Browse entries in the PDBbind-CN Database
HEADER 6ET8_COMPLEX COMPND 6ET8_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 215 HIS MSE TYR ASP ARG TRP PHE SER GLN GLN GLU LEU GLN SEQRES 2 A 215 VAL LEU PRO PHE ALA GLU GLN ASP GLU GLN ARG ASN GLN SEQRES 3 A 215 THR TRP LEU GLU LEU VAL GLY GLU ALA GLN GLN LEU MSE SEQRES 4 A 215 GLY GLU ARG CYS PRO ALA ASP GLU PRO ARG ALA ILE ALA SEQRES 5 A 215 LEU ALA THR ARG TRP MSE GLU GLN LEU GLU GLN ASP THR SEQRES 6 A 215 ALA GLY ARG PRO GLU PHE LEU THR ARG LEU ASN GLU MSE SEQRES 7 A 215 HIS ALA ALA GLU PRO GLN MSE ARG GLU GLN THR GLY VAL SEQRES 8 A 215 THR PRO GLU MSE ILE ASP PHE ILE THR ARG ALA PHE ALA SEQRES 9 A 215 GLU SER LYS LEU ALA ILE TRP ALA ARG TYR LEU ASN ALA SEQRES 10 A 215 GLU GLU LEU ALA PHE THR ARG GLN HIS TYR PHE ASP ARG SEQRES 11 A 215 LEU MSE GLU TRP PRO ALA LEU VAL ALA ASP LEU HIS ARG SEQRES 12 A 215 ALA CYS ARG GLU LYS ARG ASP PRO ALA SER PRO GLU GLY SEQRES 13 A 215 GLN GLN LEU ALA GLN ARG TRP LEU ALA LEU PHE GLN SER SEQRES 14 A 215 TYR ALA GLY LYS ASP ALA GLN THR GLN GLN LYS PHE ARG SEQRES 15 A 215 TYR ALA MSE GLU GLN GLU PRO HIS LEU MSE LYS GLY THR SEQRES 16 A 215 TRP MSE THR SER GLU VAL LEU SER TRP LEU GLN GLN ALA SEQRES 17 A 215 ILE GLY VAL MSE MSE ARG GLN HET MSE A 1 9 HET MSE A 38 9 HET MSE A 57 9 HET MSE A 77 9 HET MSE A 84 9 HET MSE A 94 9 HET MSE A 131 9 HET MSE A 184 9 HET MSE A 191 9 HET MSE A 196 9 HET MSE A 211 9 HET MSE A 212 9 HET BWH A 396 99 ATOM 1 N HIS A 0 38.672 54.202 51.723 1.00 72.39 N ATOM 2 CA HIS A 0 37.277 54.435 52.074 1.00 69.23 C ATOM 3 C HIS A 0 37.094 55.756 52.812 1.00 57.90 C ATOM 4 O HIS A 0 38.032 56.331 53.371 1.00 52.36 O ATOM 5 CB HIS A 0 36.718 53.295 52.927 1.00 78.65 C ATOM 6 CG HIS A 0 36.452 52.039 52.157 1.00 92.18 C ATOM 7 ND1 HIS A 0 37.376 51.020 52.052 1.00 97.90 N ATOM 8 CD2 HIS A 0 35.367 51.637 51.452 1.00 94.66 C ATOM 9 CE1 HIS A 0 36.872 50.044 51.318 1.00 99.22 C ATOM 10 NE2 HIS A 0 35.654 50.393 50.942 1.00 97.99 N ATOM 11 HN3 HIS A 0 39.246 54.176 52.590 1.00 0.00 H ATOM 12 HN2 HIS A 0 39.006 54.971 51.107 1.00 0.00 H ATOM 13 HN1 HIS A 0 38.755 53.294 51.223 1.00 0.00 H HETATM 14 N MSE A 1 35.860 56.221 52.826 1.00 50.55 N HETATM 15 CA MSE A 1 35.602 57.607 53.171 1.00 44.26 C HETATM 16 C MSE A 1 35.973 57.996 54.614 1.00 43.51 C HETATM 17 O MSE A 1 36.623 59.029 54.825 1.00 42.70 O HETATM 18 CB MSE A 1 34.138 57.927 52.900 1.00 42.25 C HETATM 19 CG MSE A 1 33.839 59.389 52.960 1.00 42.38 C HETATM 20 SE MSE A 1 31.946 59.695 52.641 1.00 48.28 S HETATM 21 CE MSE A 1 31.184 58.801 54.219 1.00 34.27 C HETATM 22 H MSE A 1 35.067 55.591 52.589 1.00 0.00 H ATOM 23 N TYR A 2 35.561 57.201 55.612 1.00 41.24 N ATOM 24 CA TYR A 2 35.836 57.604 56.989 1.00 42.26 C ATOM 25 C TYR A 2 37.329 57.549 57.302 1.00 36.20 C ATOM 26 O TYR A 2 37.816 58.336 58.122 1.00 36.90 O ATOM 27 CB TYR A 2 35.022 56.749 57.974 1.00 41.92 C ATOM 28 CG TYR A 2 33.523 56.948 57.835 1.00 36.55 C ATOM 29 CD1 TYR A 2 32.920 58.152 58.201 1.00 37.28 C ATOM 30 CD2 TYR A 2 32.721 55.948 57.301 1.00 39.24 C ATOM 31 CE1 TYR A 2 31.540 58.347 58.057 1.00 36.06 C ATOM 32 CE2 TYR A 2 31.348 56.126 57.161 1.00 40.87 C ATOM 33 CZ TYR A 2 30.764 57.321 57.530 1.00 37.82 C ATOM 34 OH TYR A 2 29.404 57.488 57.369 1.00 37.67 O ATOM 35 HH TYR A 2 29.171 57.386 56.412 1.00 0.00 H ATOM 36 H TYR A 2 35.056 56.315 55.410 1.00 0.00 H ATOM 37 N ASP A 3 38.076 56.682 56.622 1.00 39.17 N ATOM 38 CA ASP A 3 39.518 56.591 56.835 1.00 47.21 C ATOM 39 C ASP A 3 40.262 57.851 56.420 1.00 50.51 C ATOM 40 O ASP A 3 41.364 58.098 56.924 1.00 47.53 O ATOM 41 CB ASP A 3 40.071 55.391 56.082 1.00 54.18 C ATOM 42 CG ASP A 3 39.506 54.092 56.601 1.00 59.86 C ATOM 43 OD1 ASP A 3 38.269 53.922 56.538 1.00 62.54 O ATOM 44 OD2 ASP A 3 40.286 53.263 57.096 1.00 61.56 O ATOM 45 H ASP A 3 37.624 56.057 55.925 1.00 0.00 H ATOM 46 N ARG A 4 39.688 58.651 55.519 1.00 48.68 N ATOM 47 CA ARG A 4 40.294 59.925 55.162 1.00 46.43 C ATOM 48 C ARG A 4 40.134 60.970 56.252 1.00 43.52 C ATOM 49 O ARG A 4 40.807 62.006 56.192 1.00 43.15 O ATOM 50 CB ARG A 4 39.689 60.457 53.859 1.00 40.79 C ATOM 51 CG ARG A 4 39.960 59.569 52.656 1.00 43.47 C ATOM 52 CD ARG A 4 39.640 60.285 51.351 1.00 42.44 C ATOM 53 NE ARG A 4 38.209 60.340 51.059 1.00 44.84 N ATOM 54 CZ ARG A 4 37.534 59.375 50.441 1.00 47.58 C ATOM 55 NH1 ARG A 4 38.157 58.260 50.061 1.00 50.92 N ATOM 56 NH2 ARG A 4 36.235 59.522 50.198 1.00 40.24 N ATOM 57 HE ARG A 4 37.685 61.189 51.353 1.00 0.00 H ATOM 58 HH12 ARG A 4 37.627 57.507 49.578 1.00 0.00 H ATOM 59 HH11 ARG A 4 39.173 58.143 50.248 1.00 0.00 H ATOM 60 HH22 ARG A 4 35.708 58.767 49.715 1.00 0.00 H ATOM 61 HH21 ARG A 4 35.746 60.392 50.491 1.00 0.00 H ATOM 62 H ARG A 4 38.798 58.361 55.067 1.00 0.00 H ATOM 63 N TRP A 5 39.271 60.724 57.246 1.00 37.23 N ATOM 64 CA TRP A 5 38.913 61.752 58.201 1.00 34.26 C ATOM 65 C TRP A 5 39.098 61.372 59.663 1.00 35.40 C ATOM 66 O TRP A 5 39.085 62.270 60.507 1.00 35.27 O ATOM 67 CB TRP A 5 37.457 62.183 57.976 1.00 32.38 C ATOM 68 CG TRP A 5 37.309 62.853 56.642 1.00 32.58 C ATOM 69 CD1 TRP A 5 37.008 62.261 55.458 1.00 33.43 C ATOM 70 CD2 TRP A 5 37.470 64.251 56.371 1.00 34.82 C ATOM 71 NE1 TRP A 5 36.967 63.213 54.450 1.00 33.50 N ATOM 72 CE2 TRP A 5 37.258 64.437 54.988 1.00 34.21 C ATOM 73 CE3 TRP A 5 37.783 65.361 57.163 1.00 34.64 C ATOM 74 CZ2 TRP A 5 37.328 65.695 54.380 1.00 34.60 C ATOM 75 CZ3 TRP A 5 37.852 66.612 56.556 1.00 34.05 C ATOM 76 CH2 TRP A 5 37.628 66.761 55.177 1.00 35.32 C ATOM 77 HE1 TRP A 5 36.751 63.027 53.450 1.00 0.00 H ATOM 78 H TRP A 5 38.850 59.777 57.334 1.00 0.00 H ATOM 79 N PHE A 6 39.289 60.099 59.977 1.00 39.31 N ATOM 80 CA PHE A 6 39.388 59.596 61.342 1.00 37.94 C ATOM 81 C PHE A 6 40.661 58.773 61.468 1.00 38.56 C ATOM 82 O PHE A 6 41.047 58.077 60.527 1.00 39.81 O ATOM 83 CB PHE A 6 38.153 58.741 61.692 1.00 33.89 C ATOM 84 CG PHE A 6 36.874 59.544 61.822 1.00 32.08 C ATOM 85 CD1 PHE A 6 36.500 60.073 63.047 1.00 31.05 C ATOM 86 CD2 PHE A 6 36.047 59.766 60.724 1.00 34.22 C ATOM 87 CE1 PHE A 6 35.332 60.804 63.182 1.00 29.00 C ATOM 88 CE2 PHE A 6 34.876 60.515 60.854 1.00 30.66 C ATOM 89 CZ PHE A 6 34.515 61.031 62.083 1.00 30.12 C ATOM 90 H PHE A 6 39.374 59.414 59.199 1.00 0.00 H ATOM 91 N SER A 7 41.323 58.856 62.621 1.00 39.37 N ATOM 92 CA SER A 7 42.464 57.977 62.853 1.00 39.66 C ATOM 93 C SER A 7 41.993 56.540 63.052 1.00 42.05 C ATOM 94 O SER A 7 40.807 56.267 63.266 1.00 39.98 O ATOM 95 CB SER A 7 43.269 58.424 64.070 1.00 43.20 C ATOM 96 OG SER A 7 42.515 58.240 65.258 1.00 39.43 O ATOM 97 HG SER A 7 41.684 58.776 65.206 1.00 0.00 H ATOM 98 H SER A 7 41.030 59.540 63.348 1.00 0.00 H ATOM 99 N GLN A 8 42.945 55.608 62.963 1.00 42.31 N ATOM 100 CA GLN A 8 42.599 54.202 63.129 1.00 44.44 C ATOM 101 C GLN A 8 41.954 53.964 64.488 1.00 41.97 C ATOM 102 O GLN A 8 40.967 53.225 64.600 1.00 44.84 O ATOM 103 CB GLN A 8 43.841 53.330 62.950 1.00 53.12 C ATOM 104 CG GLN A 8 43.541 51.981 62.316 1.00 60.94 C ATOM 105 CD GLN A 8 42.659 52.103 61.076 1.00 67.67 C ATOM 106 OE1 GLN A 8 41.690 51.355 60.918 1.00 70.65 O ATOM 107 NE2 GLN A 8 42.988 53.053 60.192 1.00 68.89 N ATOM 108 HE22 GLN A 8 43.813 53.661 60.365 1.00 0.00 H ATOM 109 HE21 GLN A 8 42.418 53.183 59.332 1.00 0.00 H ATOM 110 H GLN A 8 43.930 55.884 62.776 1.00 0.00 H ATOM 111 N GLN A 9 42.480 54.613 65.522 1.00 44.41 N ATOM 112 CA GLN A 9 41.921 54.452 66.858 1.00 48.07 C ATOM 113 C GLN A 9 40.528 55.060 66.957 1.00 46.31 C ATOM 114 O GLN A 9 39.633 54.465 67.572 1.00 42.77 O ATOM 115 CB GLN A 9 42.857 55.080 67.882 1.00 54.30 C ATOM 116 CG GLN A 9 42.519 54.731 69.303 1.00 57.47 C ATOM 117 CD GLN A 9 43.213 55.635 70.283 1.00 59.65 C ATOM 118 OE1 GLN A 9 43.506 56.791 69.975 1.00 56.28 O ATOM 119 NE2 GLN A 9 43.487 55.116 71.477 1.00 62.52 N ATOM 120 HE22 GLN A 9 43.220 54.134 71.691 1.00 0.00 H ATOM 121 HE21 GLN A 9 43.968 55.692 72.196 1.00 0.00 H ATOM 122 H GLN A 9 43.297 55.240 65.376 1.00 0.00 H ATOM 123 N GLU A 10 40.325 56.249 66.367 1.00 37.86 N ATOM 124 CA GLU A 10 38.990 56.840 66.325 1.00 35.24 C ATOM 125 C GLU A 10 38.013 55.942 65.573 1.00 35.85 C ATOM 126 O GLU A 10 36.846 55.827 65.961 1.00 36.87 O ATOM 127 CB GLU A 10 39.027 58.235 65.675 1.00 34.27 C ATOM 128 CG GLU A 10 39.664 59.320 66.517 1.00 34.17 C ATOM 129 CD GLU A 10 39.744 60.641 65.782 1.00 37.55 C ATOM 130 OE1 GLU A 10 40.073 60.632 64.577 1.00 36.60 O ATOM 131 OE2 GLU A 10 39.439 61.689 66.394 1.00 41.21 O ATOM 132 H GLU A 10 41.126 56.754 65.936 1.00 0.00 H ATOM 133 N LEU A 11 38.466 55.303 64.487 1.00 36.29 N ATOM 134 CA LEU A 11 37.548 54.505 63.682 1.00 36.23 C ATOM 135 C LEU A 11 36.951 53.346 64.473 1.00 36.83 C ATOM 136 O LEU A 11 35.797 52.969 64.243 1.00 39.97 O ATOM 137 CB LEU A 11 38.262 53.979 62.439 1.00 37.97 C ATOM 138 CG LEU A 11 38.429 55.026 61.329 1.00 37.59 C ATOM 139 CD1 LEU A 11 39.351 54.459 60.263 1.00 46.45 C ATOM 140 CD2 LEU A 11 37.087 55.383 60.727 1.00 36.01 C ATOM 141 H LEU A 11 39.468 55.375 64.219 1.00 0.00 H ATOM 142 N GLN A 12 37.698 52.793 65.418 1.00 37.66 N ATOM 143 CA GLN A 12 37.178 51.650 66.166 1.00 38.78 C ATOM 144 C GLN A 12 36.095 52.041 67.171 1.00 36.49 C ATOM 145 O GLN A 12 35.363 51.160 67.638 1.00 37.45 O ATOM 146 CB GLN A 12 38.315 50.923 66.881 1.00 43.57 C ATOM 147 CG GLN A 12 39.472 50.506 65.969 1.00 45.39 C ATOM 148 CD GLN A 12 39.005 49.842 64.671 1.00 53.70 C ATOM 149 OE1 GLN A 12 38.402 48.765 64.687 1.00 56.85 O ATOM 150 NE2 GLN A 12 39.288 50.489 63.538 1.00 53.67 N ATOM 151 HE22 GLN A 12 39.798 51.395 63.570 1.00 0.00 H ATOM 152 HE21 GLN A 12 38.998 50.087 62.624 1.00 0.00 H ATOM 153 H GLN A 12 38.645 53.169 65.625 1.00 0.00 H ATOM 154 N VAL A 13 35.979 53.320 67.530 1.00 35.03 N ATOM 155 CA VAL A 13 34.922 53.759 68.435 1.00 35.21 C ATOM 156 C VAL A 13 33.907 54.658 67.732 1.00 32.56 C ATOM 157 O VAL A 13 33.085 55.294 68.398 1.00 30.57 O ATOM 158 CB VAL A 13 35.495 54.433 69.696 1.00 34.22 C ATOM 159 CG1 VAL A 13 36.333 53.420 70.511 1.00 35.33 C ATOM 160 CG2 VAL A 13 36.329 55.656 69.334 1.00 33.21 C ATOM 161 H VAL A 13 36.655 54.018 67.158 1.00 0.00 H ATOM 162 N LEU A 14 33.922 54.692 66.388 1.00 33.42 N ATOM 163 CA LEU A 14 32.953 55.450 65.602 1.00 30.53 C ATOM 164 C LEU A 14 31.888 54.508 65.061 1.00 30.70 C ATOM 165 O LEU A 14 32.199 53.691 64.181 1.00 31.95 O ATOM 166 CB LEU A 14 33.657 56.155 64.442 1.00 30.69 C ATOM 167 CG LEU A 14 32.708 56.950 63.538 1.00 31.36 C ATOM 168 CD1 LEU A 14 32.143 58.182 64.277 1.00 31.52 C ATOM 169 CD2 LEU A 14 33.377 57.348 62.206 1.00 30.04 C ATOM 170 H LEU A 14 34.657 54.154 65.886 1.00 0.00 H ATOM 171 N PRO A 15 30.644 54.561 65.538 1.00 29.70 N ATOM 172 CA PRO A 15 29.653 53.574 65.062 1.00 30.17 C ATOM 173 C PRO A 15 29.426 53.620 63.554 1.00 31.45 C ATOM 174 O PRO A 15 29.207 52.576 62.932 1.00 34.72 O ATOM 175 CB PRO A 15 28.392 53.944 65.858 1.00 28.97 C ATOM 176 CG PRO A 15 28.947 54.483 67.158 1.00 28.59 C ATOM 177 CD PRO A 15 30.174 55.281 66.740 1.00 29.18 C ATOM 178 N PHE A 16 29.463 54.814 62.946 1.00 29.34 N ATOM 179 CA PHE A 16 29.250 54.905 61.503 1.00 34.91 C ATOM 180 C PHE A 16 30.204 54.014 60.730 1.00 36.10 C ATOM 181 O PHE A 16 29.825 53.444 59.697 1.00 39.20 O ATOM 182 CB PHE A 16 29.408 56.360 61.044 1.00 30.70 C ATOM 183 CG PHE A 16 28.183 57.192 61.235 1.00 26.99 C ATOM 184 CD1 PHE A 16 26.961 56.759 60.748 1.00 29.91 C ATOM 185 CD2 PHE A 16 28.247 58.411 61.905 1.00 25.73 C ATOM 186 CE1 PHE A 16 25.827 57.534 60.903 1.00 25.77 C ATOM 187 CE2 PHE A 16 27.111 59.191 62.075 1.00 27.14 C ATOM 188 CZ PHE A 16 25.894 58.750 61.567 1.00 25.73 C ATOM 189 H PHE A 16 29.643 55.675 63.501 1.00 0.00 H ATOM 190 N ALA A 17 31.436 53.860 61.215 1.00 36.26 N ATOM 191 CA ALA A 17 32.438 53.105 60.475 1.00 39.83 C ATOM 192 C ALA A 17 32.169 51.601 60.460 1.00 36.13 C ATOM 193 O ALA A 17 32.889 50.870 59.767 1.00 39.03 O ATOM 194 CB ALA A 17 33.825 53.395 61.053 1.00 40.73 C ATOM 195 H ALA A 17 31.685 54.284 62.132 1.00 0.00 H ATOM 196 N GLU A 18 31.142 51.122 61.177 1.00 40.14 N ATOM 197 CA GLU A 18 30.805 49.700 61.183 1.00 40.18 C ATOM 198 C GLU A 18 30.114 49.233 59.908 1.00 43.20 C ATOM 199 O GLU A 18 30.168 48.041 59.603 1.00 40.59 O ATOM 200 CB GLU A 18 29.906 49.377 62.375 1.00 41.94 C ATOM 201 CG GLU A 18 30.612 49.471 63.688 1.00 43.92 C ATOM 202 CD GLU A 18 29.660 49.390 64.867 1.00 52.06 C ATOM 203 OE1 GLU A 18 28.426 49.381 64.646 1.00 47.88 O ATOM 204 OE2 GLU A 18 30.158 49.336 66.013 1.00 55.76 O ATOM 205 H GLU A 18 30.570 51.780 61.744 1.00 0.00 H ATOM 206 N GLN A 19 29.476 50.135 59.157 1.00 42.18 N ATOM 207 CA GLN A 19 28.582 49.747 58.060 1.00 44.68 C ATOM 208 C GLN A 19 27.600 48.675 58.524 1.00 40.71 C ATOM 209 O GLN A 19 27.363 47.659 57.853 1.00 43.95 O ATOM 210 CB GLN A 19 29.363 49.298 56.821 1.00 52.24 C ATOM 211 CG GLN A 19 30.302 50.371 56.255 1.00 57.96 C ATOM 212 CD GLN A 19 29.624 51.722 55.999 1.00 62.86 C ATOM 213 OE1 GLN A 19 28.463 51.795 55.583 1.00 63.21 O ATOM 214 NE2 GLN A 19 30.358 52.798 56.252 1.00 63.38 N ATOM 215 HE22 GLN A 19 31.332 52.693 56.601 1.00 0.00 H ATOM 216 HE21 GLN A 19 29.959 53.747 56.101 1.00 0.00 H ATOM 217 H GLN A 19 29.618 51.146 59.356 1.00 0.00 H ATOM 218 N ASP A 20 27.069 48.881 59.722 1.00 39.14 N ATOM 219 CA ASP A 20 25.982 48.055 60.212 1.00 43.51 C ATOM 220 C ASP A 20 24.766 48.210 59.310 1.00 41.59 C ATOM 221 O ASP A 20 24.344 49.335 59.000 1.00 40.06 O ATOM 222 CB ASP A 20 25.639 48.448 61.652 1.00 35.54 C ATOM 223 CG ASP A 20 24.511 47.615 62.227 1.00 43.62 C ATOM 224 OD1 ASP A 20 23.338 47.972 62.024 1.00 42.01 O ATOM 225 OD2 ASP A 20 24.799 46.579 62.854 1.00 45.50 O ATOM 226 H ASP A 20 27.438 49.648 60.320 1.00 0.00 H ATOM 227 N GLU A 21 24.229 47.068 58.865 1.00 45.68 N ATOM 228 CA GLU A 21 23.092 47.089 57.955 1.00 45.33 C ATOM 229 C GLU A 21 21.877 47.754 58.588 1.00 43.62 C ATOM 230 O GLU A 21 21.172 48.524 57.928 1.00 38.76 O ATOM 231 CB GLU A 21 22.741 45.674 57.522 1.00 43.37 C ATOM 232 CG GLU A 21 21.474 45.606 56.697 1.00 52.90 C ATOM 233 CD GLU A 21 21.607 46.352 55.378 1.00 63.59 C ATOM 234 OE1 GLU A 21 22.501 45.985 54.586 1.00 69.71 O ATOM 235 OE2 GLU A 21 20.836 47.312 55.144 1.00 68.81 O ATOM 236 H GLU A 21 24.627 46.157 59.172 1.00 0.00 H ATOM 237 N GLN A 22 21.596 47.451 59.861 1.00 40.86 N ATOM 238 CA GLN A 22 20.424 48.050 60.494 1.00 38.45 C ATOM 239 C GLN A 22 20.591 49.552 60.668 1.00 38.52 C ATOM 240 O GLN A 22 19.633 50.302 60.461 1.00 35.54 O ATOM 241 CB GLN A 22 20.119 47.377 61.836 1.00 36.16 C ATOM 242 CG GLN A 22 19.345 46.060 61.678 1.00 38.47 C ATOM 243 CD GLN A 22 20.146 45.002 60.974 1.00 46.44 C ATOM 244 OE1 GLN A 22 21.265 44.674 61.383 1.00 49.17 O ATOM 245 NE2 GLN A 22 19.583 44.447 59.909 1.00 50.29 N ATOM 246 HE22 GLN A 22 18.639 44.754 59.600 1.00 0.00 H ATOM 247 HE21 GLN A 22 20.086 43.704 59.383 1.00 0.00 H ATOM 248 H GLN A 22 22.205 46.797 60.393 1.00 0.00 H ATOM 249 N ARG A 23 21.795 50.016 61.036 1.00 35.33 N ATOM 250 CA ARG A 23 22.018 51.455 61.139 1.00 34.00 C ATOM 251 C ARG A 23 21.865 52.123 59.780 1.00 31.58 C ATOM 252 O ARG A 23 21.336 53.230 59.691 1.00 31.90 O ATOM 253 CB ARG A 23 23.401 51.761 61.715 1.00 30.76 C ATOM 254 CG ARG A 23 23.689 53.268 61.864 1.00 29.04 C ATOM 255 CD ARG A 23 25.001 53.498 62.595 1.00 36.45 C ATOM 256 NE ARG A 23 24.953 53.015 63.984 1.00 33.39 N ATOM 257 CZ ARG A 23 25.527 51.896 64.412 1.00 39.54 C ATOM 258 NH1 ARG A 23 25.424 51.557 65.690 1.00 36.65 N ATOM 259 NH2 ARG A 23 26.205 51.122 63.570 1.00 39.86 N ATOM 260 HE ARG A 23 24.434 53.589 64.679 1.00 0.00 H ATOM 261 HH12 ARG A 23 25.870 50.683 66.034 1.00 0.00 H ATOM 262 HH11 ARG A 23 24.897 52.165 66.349 1.00 0.00 H ATOM 263 HH22 ARG A 23 26.652 50.247 63.912 1.00 0.00 H ATOM 264 HH21 ARG A 23 26.289 51.391 62.569 1.00 0.00 H ATOM 265 H ARG A 23 22.567 49.352 61.247 1.00 0.00 H ATOM 266 N ASN A 24 22.316 51.456 58.708 1.00 32.55 N ATOM 267 CA ASN A 24 22.213 52.056 57.377 1.00 34.34 C ATOM 268 C ASN A 24 20.756 52.211 56.952 1.00 35.30 C ATOM 269 O ASN A 24 20.367 53.243 56.386 1.00 34.08 O ATOM 270 CB ASN A 24 23.000 51.216 56.361 1.00 40.90 C ATOM 271 CG ASN A 24 24.501 51.433 56.479 1.00 42.55 C ATOM 272 OD1 ASN A 24 24.942 52.406 57.100 1.00 46.83 O ATOM 273 ND2 ASN A 24 25.286 50.545 55.894 1.00 48.63 N ATOM 274 HD22 ASN A 24 24.870 49.741 55.382 1.00 0.00 H ATOM 275 HD21 ASN A 24 26.319 50.650 55.946 1.00 0.00 H ATOM 276 H ASN A 24 22.739 50.513 58.822 1.00 0.00 H ATOM 277 N GLN A 25 19.938 51.201 57.232 1.00 36.80 N ATOM 278 CA GLN A 25 18.519 51.263 56.913 1.00 38.86 C ATOM 279 C GLN A 25 17.815 52.344 57.718 1.00 36.62 C ATOM 280 O GLN A 25 16.934 53.043 57.200 1.00 32.78 O ATOM 281 CB GLN A 25 17.882 49.901 57.179 1.00 40.45 C ATOM 282 CG GLN A 25 16.401 49.870 56.892 1.00 47.96 C ATOM 283 CD GLN A 25 16.109 50.072 55.423 1.00 51.82 C ATOM 284 OE1 GLN A 25 16.879 49.640 54.562 1.00 50.01 O ATOM 285 NE2 GLN A 25 14.997 50.732 55.125 1.00 53.10 N ATOM 286 HE22 GLN A 25 14.378 51.078 55.886 1.00 0.00 H ATOM 287 HE21 GLN A 25 14.745 50.903 54.131 1.00 0.00 H ATOM 288 H GLN A 25 20.320 50.348 57.689 1.00 0.00 H ATOM 289 N THR A 26 18.186 52.497 58.992 1.00 31.03 N ATOM 290 CA THR A 26 17.620 53.575 59.800 1.00 29.45 C ATOM 291 C THR A 26 17.899 54.937 59.171 1.00 28.21 C ATOM 292 O THR A 26 16.999 55.780 59.053 1.00 30.00 O ATOM 293 CB THR A 26 18.176 53.497 61.224 1.00 28.83 C ATOM 294 OG1 THR A 26 17.727 52.279 61.839 1.00 37.48 O ATOM 295 CG2 THR A 26 17.721 54.709 62.048 1.00 27.74 C ATOM 296 HG1 THR A 26 18.085 52.225 62.761 1.00 0.00 H ATOM 297 H THR A 26 18.881 51.846 59.411 1.00 0.00 H ATOM 298 N TRP A 27 19.135 55.160 58.725 1.00 31.49 N ATOM 299 CA TRP A 27 19.445 56.440 58.088 1.00 30.72 C ATOM 300 C TRP A 27 18.796 56.556 56.718 1.00 29.76 C ATOM 301 O TRP A 27 18.416 57.663 56.322 1.00 29.03 O ATOM 302 CB TRP A 27 20.956 56.633 57.989 1.00 27.01 C ATOM 303 CG TRP A 27 21.464 57.172 59.256 1.00 27.27 C ATOM 304 CD1 TRP A 27 22.171 56.514 60.227 1.00 28.99 C ATOM 305 CD2 TRP A 27 21.252 58.501 59.733 1.00 29.08 C ATOM 306 NE1 TRP A 27 22.430 57.372 61.275 1.00 26.37 N ATOM 307 CE2 TRP A 27 21.882 58.600 60.993 1.00 28.29 C ATOM 308 CE3 TRP A 27 20.596 59.618 59.209 1.00 30.44 C ATOM 309 CZ2 TRP A 27 21.854 59.777 61.760 1.00 29.55 C ATOM 310 CZ3 TRP A 27 20.574 60.799 59.965 1.00 34.65 C ATOM 311 CH2 TRP A 27 21.200 60.864 61.231 1.00 33.02 C ATOM 312 HE1 TRP A 27 22.955 57.129 62.139 1.00 0.00 H ATOM 313 H TRP A 27 19.871 54.432 58.829 1.00 0.00 H ATOM 314 N LEU A 28 18.662 55.434 55.993 1.00 29.49 N ATOM 315 CA LEU A 28 17.935 55.450 54.726 1.00 30.48 C ATOM 316 C LEU A 28 16.530 55.992 54.921 1.00 31.94 C ATOM 317 O LEU A 28 16.049 56.798 54.117 1.00 31.06 O ATOM 318 CB LEU A 28 17.872 54.042 54.116 1.00 33.49 C ATOM 319 CG LEU A 28 18.829 53.708 52.980 1.00 39.14 C ATOM 320 CD1 LEU A 28 18.543 52.285 52.441 1.00 41.67 C ATOM 321 CD2 LEU A 28 18.734 54.760 51.890 1.00 42.56 C ATOM 322 H LEU A 28 19.079 54.546 56.336 1.00 0.00 H ATOM 323 N GLU A 29 15.873 55.582 56.009 1.00 31.15 N ATOM 324 CA GLU A 29 14.519 56.042 56.281 1.00 31.27 C ATOM 325 C GLU A 29 14.515 57.479 56.771 1.00 30.90 C ATOM 326 O GLU A 29 13.626 58.253 56.406 1.00 34.20 O ATOM 327 CB GLU A 29 13.838 55.121 57.297 1.00 36.11 C ATOM 328 CG GLU A 29 13.646 53.706 56.768 1.00 39.55 C ATOM 329 CD GLU A 29 13.190 52.736 57.844 1.00 49.83 C ATOM 330 OE1 GLU A 29 12.676 53.202 58.888 1.00 52.21 O ATOM 331 OE2 GLU A 29 13.365 51.513 57.652 1.00 49.83 O ATOM 332 H GLU A 29 16.335 54.926 56.670 1.00 0.00 H ATOM 333 N LEU A 30 15.493 57.858 57.600 1.00 26.60 N ATOM 334 CA LEU A 30 15.548 59.237 58.075 1.00 25.29 C ATOM 335 C LEU A 30 15.755 60.205 56.913 1.00 26.36 C ATOM 336 O LEU A 30 15.131 61.279 56.866 1.00 26.83 O ATOM 337 CB LEU A 30 16.666 59.393 59.107 1.00 25.07 C ATOM 338 CG LEU A 30 16.436 58.759 60.489 1.00 28.77 C ATOM 339 CD1 LEU A 30 17.692 58.873 61.341 1.00 31.49 C ATOM 340 CD2 LEU A 30 15.234 59.370 61.203 1.00 30.48 C ATOM 341 H LEU A 30 16.213 57.172 57.906 1.00 0.00 H ATOM 342 N VAL A 31 16.639 59.848 55.976 1.00 27.41 N ATOM 343 CA VAL A 31 16.899 60.705 54.825 1.00 26.19 C ATOM 344 C VAL A 31 15.680 60.757 53.911 1.00 27.36 C ATOM 345 O VAL A 31 15.302 61.827 53.414 1.00 29.96 O ATOM 346 CB VAL A 31 18.148 60.209 54.062 1.00 26.60 C ATOM 347 CG1 VAL A 31 18.173 60.762 52.641 1.00 28.21 C ATOM 348 CG2 VAL A 31 19.436 60.574 54.792 1.00 26.03 C ATOM 349 H VAL A 31 17.149 58.946 56.069 1.00 0.00 H ATOM 350 N GLY A 32 15.070 59.599 53.640 1.00 27.74 N ATOM 351 CA GLY A 32 13.902 59.570 52.771 1.00 28.85 C ATOM 352 C GLY A 32 12.746 60.383 53.325 1.00 31.59 C ATOM 353 O GLY A 32 12.047 61.078 52.579 1.00 28.43 O ATOM 354 H GLY A 32 15.431 58.715 54.052 1.00 0.00 H ATOM 355 N GLU A 33 12.530 60.313 54.642 1.00 27.30 N ATOM 356 CA GLU A 33 11.478 61.113 55.264 1.00 26.71 C ATOM 357 C GLU A 33 11.794 62.600 55.189 1.00 26.64 C ATOM 358 O GLU A 33 10.896 63.415 54.946 1.00 27.15 O ATOM 359 CB GLU A 33 11.269 60.667 56.712 1.00 26.32 C ATOM 360 CG GLU A 33 10.710 59.251 56.778 1.00 27.83 C ATOM 361 CD GLU A 33 10.387 58.790 58.184 1.00 37.90 C ATOM 362 OE1 GLU A 33 10.504 57.577 58.439 1.00 36.55 O ATOM 363 OE2 GLU A 33 10.013 59.633 59.024 1.00 38.93 O ATOM 364 H GLU A 33 13.115 59.684 55.228 1.00 0.00 H ATOM 365 N ALA A 34 13.063 62.976 55.378 1.00 25.53 N ATOM 366 CA ALA A 34 13.427 64.383 55.229 1.00 25.12 C ATOM 367 C ALA A 34 13.242 64.847 53.791 1.00 25.60 C ATOM 368 O ALA A 34 12.765 65.967 53.553 1.00 25.61 O ATOM 369 CB ALA A 34 14.867 64.628 55.676 1.00 22.52 C ATOM 370 H ALA A 34 13.786 62.272 55.629 1.00 0.00 H ATOM 371 N GLN A 35 13.640 64.018 52.821 1.00 25.28 N ATOM 372 CA GLN A 35 13.425 64.356 51.415 1.00 26.26 C ATOM 373 C GLN A 35 11.952 64.610 51.127 1.00 27.68 C ATOM 374 O GLN A 35 11.604 65.536 50.378 1.00 28.96 O ATOM 375 CB GLN A 35 13.940 63.235 50.499 1.00 27.72 C ATOM 376 CG GLN A 35 15.465 63.140 50.405 1.00 32.47 C ATOM 377 CD GLN A 35 15.933 61.874 49.698 1.00 36.35 C ATOM 378 OE1 GLN A 35 15.190 60.901 49.601 1.00 34.69 O ATOM 379 NE2 GLN A 35 17.170 61.884 49.204 1.00 36.33 N ATOM 380 HE22 GLN A 35 17.765 62.730 49.309 1.00 0.00 H ATOM 381 HE21 GLN A 35 17.541 61.045 48.713 1.00 0.00 H ATOM 382 H GLN A 35 14.108 63.123 53.069 1.00 0.00 H ATOM 383 N GLN A 36 11.074 63.768 51.671 1.00 27.63 N ATOM 384 CA GLN A 36 9.647 63.912 51.407 1.00 28.51 C ATOM 385 C GLN A 36 9.108 65.212 51.997 1.00 28.30 C ATOM 386 O GLN A 36 8.339 65.925 51.342 1.00 29.08 O ATOM 387 CB GLN A 36 8.886 62.701 51.968 1.00 33.12 C ATOM 388 CG GLN A 36 7.387 62.752 51.750 1.00 44.87 C ATOM 389 CD GLN A 36 7.010 62.590 50.287 1.00 55.80 C ATOM 390 OE1 GLN A 36 7.614 61.791 49.562 1.00 58.29 O ATOM 391 NE2 GLN A 36 6.016 63.360 49.838 1.00 58.45 N ATOM 392 HE22 GLN A 36 5.536 64.018 50.484 1.00 0.00 H ATOM 393 HE21 GLN A 36 5.722 63.301 48.842 1.00 0.00 H ATOM 394 H GLN A 36 11.409 63.002 52.289 1.00 0.00 H ATOM 395 N LEU A 37 9.497 65.541 53.229 1.00 26.74 N ATOM 396 CA LEU A 37 9.034 66.796 53.815 1.00 25.76 C ATOM 397 C LEU A 37 9.574 68.001 53.052 1.00 28.06 C ATOM 398 O LEU A 37 8.879 69.014 52.912 1.00 28.95 O ATOM 399 CB LEU A 37 9.441 66.888 55.288 1.00 24.49 C ATOM 400 CG LEU A 37 8.805 65.822 56.199 1.00 25.69 C ATOM 401 CD1 LEU A 37 9.121 66.084 57.688 1.00 25.94 C ATOM 402 CD2 LEU A 37 7.306 65.720 55.953 1.00 27.26 C ATOM 403 H LEU A 37 10.124 64.910 53.768 1.00 0.00 H HETATM 404 N MSE A 38 10.818 67.936 52.590 1.00 26.63 N HETATM 405 CA MSE A 38 11.402 69.091 51.901 1.00 25.18 C HETATM 406 C MSE A 38 10.714 69.307 50.566 1.00 25.35 C HETATM 407 O MSE A 38 10.423 70.441 50.170 1.00 26.58 O HETATM 408 CB MSE A 38 12.901 68.905 51.681 1.00 26.76 C HETATM 409 CG MSE A 38 13.722 68.883 52.987 1.00 24.32 C HETATM 410 SE MSE A 38 15.451 68.081 52.557 1.00 40.17 S HETATM 411 CE MSE A 38 16.222 69.609 51.562 1.00 31.76 C HETATM 412 H MSE A 38 11.376 67.068 52.717 1.00 0.00 H ATOM 413 N GLY A 39 10.481 68.209 49.860 1.00 26.57 N ATOM 414 CA GLY A 39 9.849 68.312 48.553 1.00 29.25 C ATOM 415 C GLY A 39 8.441 68.875 48.606 1.00 30.97 C ATOM 416 O GLY A 39 7.961 69.444 47.622 1.00 32.10 O ATOM 417 H GLY A 39 10.749 67.278 50.239 1.00 0.00 H ATOM 418 N GLU A 40 7.753 68.693 49.734 1.00 31.99 N ATOM 419 CA GLU A 40 6.427 69.237 50.005 1.00 34.01 C ATOM 420 C GLU A 40 6.476 70.647 50.570 1.00 30.71 C ATOM 421 O GLU A 40 5.423 71.245 50.797 1.00 33.62 O ATOM 422 CB GLU A 40 5.688 68.333 51.002 1.00 34.29 C ATOM 423 CG GLU A 40 5.330 66.966 50.463 1.00 44.81 C ATOM 424 CD GLU A 40 4.874 65.995 51.549 1.00 49.69 C ATOM 425 OE1 GLU A 40 4.776 66.411 52.722 1.00 48.26 O ATOM 426 OE2 GLU A 40 4.618 64.808 51.221 1.00 55.93 O ATOM 427 H GLU A 40 8.197 68.118 50.479 1.00 0.00 H ATOM 428 N ARG A 41 7.671 71.182 50.793 1.00 26.16 N ATOM 429 CA ARG A 41 7.873 72.448 51.501 1.00 25.55 C ATOM 430 C ARG A 41 7.140 72.456 52.850 1.00 31.95 C ATOM 431 O ARG A 41 6.552 73.459 53.274 1.00 29.23 O ATOM 432 CB ARG A 41 7.482 73.640 50.617 1.00 30.25 C ATOM 433 CG ARG A 41 8.442 73.802 49.433 1.00 31.41 C ATOM 434 CD ARG A 41 8.148 75.031 48.576 1.00 33.13 C ATOM 435 NE ARG A 41 7.081 74.757 47.629 1.00 45.49 N ATOM 436 CZ ARG A 41 5.875 75.311 47.681 1.00 51.75 C ATOM 437 NH1 ARG A 41 5.583 76.184 48.646 1.00 47.37 N ATOM 438 NH2 ARG A 41 4.970 74.995 46.762 1.00 50.23 N ATOM 439 HE ARG A 41 7.274 74.083 46.861 1.00 0.00 H ATOM 440 HH12 ARG A 41 4.639 76.618 48.687 1.00 0.00 H ATOM 441 HH11 ARG A 41 6.300 76.431 49.358 1.00 0.00 H ATOM 442 HH22 ARG A 41 4.023 75.424 46.795 1.00 0.00 H ATOM 443 HH21 ARG A 41 5.208 74.318 46.009 1.00 0.00 H ATOM 444 H ARG A 41 8.509 70.674 50.446 1.00 0.00 H ATOM 445 N CYS A 42 7.226 71.335 53.549 1.00 30.95 N ATOM 446 CA CYS A 42 6.662 71.220 54.887 1.00 28.77 C ATOM 447 C CYS A 42 7.253 72.266 55.830 1.00 27.23 C ATOM 448 O CYS A 42 8.481 72.371 55.946 1.00 28.73 O ATOM 449 CB CYS A 42 6.943 69.830 55.439 1.00 27.92 C ATOM 450 SG CYS A 42 6.313 69.537 57.106 1.00 30.90 S ATOM 451 H CYS A 42 7.709 70.514 53.131 1.00 0.00 H ATOM 452 N PRO A 43 6.424 73.032 56.534 1.00 26.89 N ATOM 453 CA PRO A 43 6.950 73.956 57.545 1.00 25.46 C ATOM 454 C PRO A 43 7.663 73.210 58.671 1.00 26.10 C ATOM 455 O PRO A 43 7.194 72.180 59.153 1.00 26.03 O ATOM 456 CB PRO A 43 5.694 74.677 58.057 1.00 27.13 C ATOM 457 CG PRO A 43 4.690 74.544 56.958 1.00 28.11 C ATOM 458 CD PRO A 43 4.975 73.190 56.315 1.00 28.50 C ATOM 459 N ALA A 44 8.804 73.756 59.097 1.00 23.24 N ATOM 460 CA ALA A 44 9.625 73.072 60.098 1.00 20.28 C ATOM 461 C ALA A 44 8.935 72.962 61.454 1.00 21.14 C ATOM 462 O ALA A 44 9.360 72.141 62.277 1.00 24.08 O ATOM 463 CB ALA A 44 10.978 73.793 60.256 1.00 23.01 C ATOM 464 H ALA A 44 9.112 74.673 58.715 1.00 0.00 H ATOM 465 N ASP A 45 7.887 73.759 61.716 1.00 22.79 N ATOM 466 CA ASP A 45 7.168 73.655 62.986 1.00 26.13 C ATOM 467 C ASP A 45 5.984 72.693 62.943 1.00 29.35 C ATOM 468 O ASP A 45 5.269 72.574 63.943 1.00 31.28 O ATOM 469 CB ASP A 45 6.695 75.042 63.463 1.00 26.21 C ATOM 470 CG ASP A 45 5.789 75.751 62.467 1.00 31.51 C ATOM 471 OD1 ASP A 45 5.512 75.214 61.383 1.00 30.84 O ATOM 472 OD2 ASP A 45 5.366 76.895 62.785 1.00 40.41 O ATOM 473 H ASP A 45 7.583 74.458 61.009 1.00 0.00 H ATOM 474 N GLU A 46 5.755 71.985 61.837 1.00 25.49 N ATOM 475 CA GLU A 46 4.720 70.963 61.854 1.00 30.02 C ATOM 476 C GLU A 46 5.143 69.800 62.755 1.00 30.28 C ATOM 477 O GLU A 46 6.334 69.486 62.859 1.00 28.13 O ATOM 478 CB GLU A 46 4.443 70.437 60.449 1.00 33.43 C ATOM 479 CG GLU A 46 3.866 71.468 59.511 1.00 35.00 C ATOM 480 CD GLU A 46 2.427 71.779 59.835 1.00 43.32 C ATOM 481 OE1 GLU A 46 1.690 70.821 60.143 1.00 48.10 O ATOM 482 OE2 GLU A 46 2.038 72.973 59.793 1.00 44.49 O ATOM 483 H GLU A 46 6.308 72.161 60.974 1.00 0.00 H ATOM 484 N PRO A 47 4.182 69.154 63.419 1.00 28.88 N ATOM 485 CA PRO A 47 4.523 67.984 64.249 1.00 32.48 C ATOM 486 C PRO A 47 5.384 66.941 63.551 1.00 27.29 C ATOM 487 O PRO A 47 6.363 66.469 64.141 1.00 27.92 O ATOM 488 CB PRO A 47 3.141 67.429 64.635 1.00 33.97 C ATOM 489 CG PRO A 47 2.273 68.662 64.680 1.00 33.02 C ATOM 490 CD PRO A 47 2.771 69.557 63.571 1.00 31.23 C ATOM 491 N ARG A 48 5.058 66.565 62.311 1.00 29.23 N ATOM 492 CA ARG A 48 5.839 65.520 61.659 1.00 28.70 C ATOM 493 C ARG A 48 7.287 65.951 61.420 1.00 24.81 C ATOM 494 O ARG A 48 8.193 65.104 61.473 1.00 28.23 O ATOM 495 CB ARG A 48 5.156 65.077 60.356 1.00 35.32 C ATOM 496 CG ARG A 48 4.953 66.159 59.305 1.00 39.63 C ATOM 497 CD ARG A 48 3.955 65.668 58.229 1.00 41.88 C ATOM 498 NE ARG A 48 3.796 66.601 57.111 1.00 43.93 N ATOM 499 CZ ARG A 48 3.110 67.740 57.175 1.00 47.08 C ATOM 500 NH1 ARG A 48 2.529 68.109 58.316 1.00 44.72 N ATOM 501 NH2 ARG A 48 3.018 68.520 56.103 1.00 46.23 N ATOM 502 HE ARG A 48 4.249 66.357 56.207 1.00 0.00 H ATOM 503 HH12 ARG A 48 1.994 68.999 58.363 1.00 0.00 H ATOM 504 HH11 ARG A 48 2.611 67.507 59.160 1.00 0.00 H ATOM 505 HH22 ARG A 48 2.482 69.410 56.152 1.00 0.00 H ATOM 506 HH21 ARG A 48 3.482 68.240 55.215 1.00 0.00 H ATOM 507 H ARG A 48 4.259 67.011 61.818 1.00 0.00 H ATOM 508 N ALA A 49 7.538 67.253 61.204 1.00 26.05 N ATOM 509 CA ALA A 49 8.906 67.724 61.016 1.00 21.73 C ATOM 510 C ALA A 49 9.663 67.720 62.336 1.00 27.01 C ATOM 511 O ALA A 49 10.805 67.256 62.405 1.00 20.33 O ATOM 512 CB ALA A 49 8.910 69.134 60.402 1.00 23.08 C ATOM 513 H ALA A 49 6.750 67.931 61.171 1.00 0.00 H ATOM 514 N ILE A 50 9.031 68.241 63.394 1.00 25.31 N ATOM 515 CA ILE A 50 9.628 68.231 64.729 1.00 20.49 C ATOM 516 C ILE A 50 9.957 66.806 65.160 1.00 20.87 C ATOM 517 O ILE A 50 11.035 66.540 65.708 1.00 23.74 O ATOM 518 CB ILE A 50 8.672 68.919 65.727 1.00 25.34 C ATOM 519 CG1 ILE A 50 8.688 70.444 65.530 1.00 25.26 C ATOM 520 CG2 ILE A 50 8.976 68.469 67.171 1.00 23.53 C ATOM 521 CD1 ILE A 50 7.533 71.192 66.247 1.00 28.34 C ATOM 522 H ILE A 50 8.090 68.664 63.264 1.00 0.00 H ATOM 523 N ALA A 51 9.030 65.868 64.930 1.00 22.31 N ATOM 524 CA ALA A 51 9.255 64.484 65.328 1.00 26.09 C ATOM 525 C ALA A 51 10.422 63.882 64.559 1.00 23.84 C ATOM 526 O ALA A 51 11.269 63.193 65.140 1.00 25.20 O ATOM 527 CB ALA A 51 7.979 63.659 65.105 1.00 27.24 C ATOM 528 H ALA A 51 8.139 66.130 64.462 1.00 0.00 H ATOM 529 N LEU A 52 10.492 64.154 63.251 1.00 24.60 N ATOM 530 CA LEU A 52 11.607 63.660 62.441 1.00 25.73 C ATOM 531 C LEU A 52 12.936 64.222 62.932 1.00 20.74 C ATOM 532 O LEU A 52 13.916 63.481 63.076 1.00 21.05 O ATOM 533 CB LEU A 52 11.400 64.019 60.968 1.00 22.75 C ATOM 534 CG LEU A 52 12.573 63.671 60.055 1.00 24.88 C ATOM 535 CD1 LEU A 52 12.788 62.165 60.059 1.00 23.92 C ATOM 536 CD2 LEU A 52 12.340 64.153 58.610 1.00 25.91 C ATOM 537 H LEU A 52 9.745 64.723 62.804 1.00 0.00 H ATOM 538 N ALA A 53 12.977 65.519 63.246 1.00 22.82 N ATOM 539 CA ALA A 53 14.243 66.125 63.641 1.00 20.45 C ATOM 540 C ALA A 53 14.693 65.587 64.985 1.00 22.42 C ATOM 541 O ALA A 53 15.895 65.419 65.219 1.00 18.97 O ATOM 542 CB ALA A 53 14.125 67.657 63.687 1.00 19.21 C ATOM 543 H ALA A 53 12.111 66.094 63.209 1.00 0.00 H ATOM 544 N THR A 54 13.740 65.322 65.886 1.00 23.91 N ATOM 545 CA THR A 54 14.081 64.714 67.162 1.00 20.40 C ATOM 546 C THR A 54 14.718 63.338 66.952 1.00 23.51 C ATOM 547 O THR A 54 15.745 63.016 67.573 1.00 21.74 O ATOM 548 CB THR A 54 12.825 64.644 68.043 1.00 20.59 C ATOM 549 OG1 THR A 54 12.368 65.991 68.305 1.00 24.06 O ATOM 550 CG2 THR A 54 13.106 63.945 69.374 1.00 22.13 C ATOM 551 HG1 THR A 54 11.558 65.959 68.873 1.00 0.00 H ATOM 552 H THR A 54 12.749 65.552 65.672 1.00 0.00 H ATOM 553 N ARG A 55 14.151 62.528 66.051 1.00 23.11 N ATOM 554 CA ARG A 55 14.766 61.231 65.760 1.00 24.26 C ATOM 555 C ARG A 55 16.170 61.391 65.186 1.00 25.00 C ATOM 556 O ARG A 55 17.071 60.603 65.520 1.00 25.49 O ATOM 557 CB ARG A 55 13.888 60.410 64.803 1.00 25.31 C ATOM 558 CG ARG A 55 12.693 59.734 65.472 1.00 33.77 C ATOM 559 CD ARG A 55 11.632 59.345 64.450 1.00 41.79 C ATOM 560 NE ARG A 55 12.160 58.485 63.396 1.00 49.66 N ATOM 561 CZ ARG A 55 11.705 58.470 62.143 1.00 53.48 C ATOM 562 NH1 ARG A 55 10.720 59.282 61.781 1.00 51.49 N ATOM 563 NH2 ARG A 55 12.237 57.643 61.249 1.00 56.53 N ATOM 564 HE ARG A 55 12.941 57.843 63.638 1.00 0.00 H ATOM 565 HH12 ARG A 55 10.367 59.268 60.803 1.00 0.00 H ATOM 566 HH11 ARG A 55 10.301 59.933 62.476 1.00 0.00 H ATOM 567 HH22 ARG A 55 11.880 57.634 60.272 1.00 0.00 H ATOM 568 HH21 ARG A 55 13.010 57.005 61.526 1.00 0.00 H ATOM 569 H ARG A 55 13.280 62.817 65.561 1.00 0.00 H ATOM 570 N TRP A 56 16.361 62.379 64.289 1.00 21.33 N ATOM 571 CA TRP A 56 17.675 62.636 63.690 1.00 20.21 C ATOM 572 C TRP A 56 18.721 62.901 64.759 1.00 23.61 C ATOM 573 O TRP A 56 19.828 62.360 64.705 1.00 22.50 O ATOM 574 CB TRP A 56 17.636 63.865 62.761 1.00 21.08 C ATOM 575 CG TRP A 56 17.371 63.588 61.351 1.00 27.53 C ATOM 576 CD1 TRP A 56 16.237 63.029 60.832 1.00 27.44 C ATOM 577 CD2 TRP A 56 18.238 63.859 60.229 1.00 20.22 C ATOM 578 NE1 TRP A 56 16.340 62.948 59.470 1.00 24.48 N ATOM 579 CE2 TRP A 56 17.558 63.438 59.076 1.00 21.97 C ATOM 580 CE3 TRP A 56 19.525 64.394 60.101 1.00 25.79 C ATOM 581 CZ2 TRP A 56 18.121 63.524 57.795 1.00 26.36 C ATOM 582 CZ3 TRP A 56 20.074 64.511 58.823 1.00 28.53 C ATOM 583 CH2 TRP A 56 19.374 64.070 57.691 1.00 25.65 C ATOM 584 HE1 TRP A 56 15.608 62.573 58.833 1.00 0.00 H ATOM 585 H TRP A 56 15.555 62.975 64.014 1.00 0.00 H HETATM 586 N MSE A 57 18.417 63.800 65.698 1.00 21.21 N HETATM 587 CA MSE A 57 19.404 64.158 66.708 1.00 22.76 C HETATM 588 C MSE A 57 19.709 63.003 67.668 1.00 22.75 C HETATM 589 O MSE A 57 20.859 62.818 68.044 1.00 25.84 O HETATM 590 CB MSE A 57 18.962 65.382 67.528 1.00 19.06 C HETATM 591 CG MSE A 57 19.011 66.696 66.727 1.00 20.45 C HETATM 592 SE MSE A 57 20.811 67.083 65.953 1.00 35.36 S HETATM 593 CE MSE A 57 20.440 66.573 64.198 1.00 21.23 C HETATM 594 H MSE A 57 17.477 64.244 65.708 1.00 0.00 H ATOM 595 N GLU A 58 18.668 62.260 68.072 1.00 22.87 N ATOM 596 CA GLU A 58 18.875 61.062 68.891 1.00 24.09 C ATOM 597 C GLU A 58 19.823 60.090 68.192 1.00 25.48 C ATOM 598 O GLU A 58 20.821 59.632 68.773 1.00 24.45 O ATOM 599 CB GLU A 58 17.530 60.379 69.177 1.00 25.01 C ATOM 600 CG GLU A 58 16.559 61.152 70.095 1.00 26.72 C ATOM 601 CD GLU A 58 15.138 60.558 70.110 1.00 35.10 C ATOM 602 OE1 GLU A 58 14.772 59.821 69.169 1.00 39.19 O ATOM 603 OE2 GLU A 58 14.374 60.833 71.059 1.00 36.51 O ATOM 604 H GLU A 58 17.703 62.537 67.801 1.00 0.00 H ATOM 605 N GLN A 59 19.520 59.767 66.932 1.00 24.08 N ATOM 606 CA GLN A 59 20.334 58.828 66.174 1.00 26.41 C ATOM 607 C GLN A 59 21.735 59.370 65.938 1.00 26.54 C ATOM 608 O GLN A 59 22.718 58.630 66.078 1.00 25.48 O ATOM 609 CB GLN A 59 19.651 58.495 64.850 1.00 25.55 C ATOM 610 CG GLN A 59 20.298 57.345 64.071 1.00 24.55 C ATOM 611 CD GLN A 59 20.101 55.993 64.717 1.00 32.20 C ATOM 612 OE1 GLN A 59 19.069 55.714 65.362 1.00 33.20 O ATOM 613 NE2 GLN A 59 21.115 55.145 64.586 1.00 34.78 N ATOM 614 HE22 GLN A 59 21.956 55.420 64.039 1.00 0.00 H ATOM 615 HE21 GLN A 59 21.068 54.206 65.030 1.00 0.00 H ATOM 616 H GLN A 59 18.685 60.195 66.483 1.00 0.00 H ATOM 617 N LEU A 60 21.854 60.666 65.603 1.00 21.64 N ATOM 618 CA LEU A 60 23.173 61.213 65.316 1.00 22.25 C ATOM 619 C LEU A 60 24.047 61.235 66.570 1.00 21.90 C ATOM 620 O LEU A 60 25.263 61.005 66.492 1.00 22.58 O ATOM 621 CB LEU A 60 23.033 62.613 64.713 1.00 22.86 C ATOM 622 CG LEU A 60 24.316 63.277 64.254 1.00 21.07 C ATOM 623 CD1 LEU A 60 24.933 62.492 63.089 1.00 23.84 C ATOM 624 CD2 LEU A 60 24.026 64.755 63.837 1.00 20.47 C ATOM 625 H LEU A 60 21.011 61.273 65.549 1.00 0.00 H ATOM 626 N GLU A 61 23.462 61.511 67.739 1.00 20.97 N ATOM 627 CA GLU A 61 24.279 61.458 68.950 1.00 22.55 C ATOM 628 C GLU A 61 24.791 60.048 69.208 1.00 25.48 C ATOM 629 O GLU A 61 25.955 59.859 69.587 1.00 25.88 O ATOM 630 CB GLU A 61 23.509 61.947 70.181 1.00 28.87 C ATOM 631 CG GLU A 61 24.412 61.924 71.398 1.00 31.53 C ATOM 632 CD GLU A 61 23.830 62.585 72.628 1.00 38.03 C ATOM 633 OE1 GLU A 61 22.700 63.134 72.557 1.00 35.94 O ATOM 634 OE2 GLU A 61 24.524 62.546 73.670 1.00 40.41 O ATOM 635 H GLU A 61 22.453 61.757 67.786 1.00 0.00 H ATOM 636 N GLN A 62 23.916 59.053 69.071 1.00 26.06 N ATOM 637 CA GLN A 62 24.340 57.666 69.222 1.00 24.05 C ATOM 638 C GLN A 62 25.426 57.304 68.224 1.00 24.56 C ATOM 639 O GLN A 62 26.412 56.639 68.578 1.00 25.48 O ATOM 640 CB GLN A 62 23.144 56.739 69.032 1.00 31.25 C ATOM 641 CG GLN A 62 22.181 56.730 70.190 1.00 36.89 C ATOM 642 CD GLN A 62 21.099 55.684 70.028 1.00 47.58 C ATOM 643 OE1 GLN A 62 21.376 54.533 69.670 1.00 52.05 O ATOM 644 NE2 GLN A 62 19.854 56.076 70.287 1.00 50.63 N ATOM 645 HE22 GLN A 62 19.668 57.055 70.585 1.00 0.00 H ATOM 646 HE21 GLN A 62 19.066 55.404 70.191 1.00 0.00 H ATOM 647 H GLN A 62 22.922 59.267 68.854 1.00 0.00 H ATOM 648 N ASP A 63 25.245 57.704 66.963 1.00 24.16 N ATOM 649 CA ASP A 63 26.134 57.210 65.924 1.00 24.94 C ATOM 650 C ASP A 63 27.453 57.967 65.859 1.00 25.21 C ATOM 651 O ASP A 63 28.394 57.466 65.233 1.00 26.36 O ATOM 652 CB ASP A 63 25.399 57.220 64.592 1.00 24.85 C ATOM 653 CG ASP A 63 24.281 56.179 64.538 1.00 30.31 C ATOM 654 OD1 ASP A 63 24.272 55.265 65.403 1.00 26.89 O ATOM 655 OD2 ASP A 63 23.410 56.281 63.645 1.00 29.25 O ATOM 656 H ASP A 63 24.476 58.362 66.726 1.00 0.00 H ATOM 657 N THR A 64 27.552 59.136 66.507 1.00 23.95 N ATOM 658 CA THR A 64 28.831 59.792 66.749 1.00 24.12 C ATOM 659 C THR A 64 29.428 59.410 68.095 1.00 24.74 C ATOM 660 O THR A 64 30.379 60.058 68.541 1.00 24.91 O ATOM 661 CB THR A 64 28.694 61.317 66.689 1.00 24.91 C ATOM 662 OG1 THR A 64 27.641 61.745 67.573 1.00 24.59 O ATOM 663 CG2 THR A 64 28.426 61.790 65.254 1.00 26.18 C ATOM 664 HG1 THR A 64 26.788 61.327 67.295 1.00 0.00 H ATOM 665 H THR A 64 26.683 59.593 66.850 1.00 0.00 H ATOM 666 N ALA A 65 28.885 58.378 68.747 1.00 25.23 N ATOM 667 CA ALA A 65 29.393 57.860 70.021 1.00 26.43 C ATOM 668 C ALA A 65 29.335 58.924 71.104 1.00 26.62 C ATOM 669 O ALA A 65 30.120 58.896 72.058 1.00 27.45 O ATOM 670 CB ALA A 65 30.819 57.308 69.901 1.00 27.33 C ATOM 671 H ALA A 65 28.054 57.915 68.326 1.00 0.00 H ATOM 672 N GLY A 66 28.430 59.886 70.935 1.00 24.28 N ATOM 673 CA GLY A 66 28.291 60.925 71.935 1.00 25.80 C ATOM 674 C GLY A 66 29.490 61.834 72.045 1.00 28.72 C ATOM 675 O GLY A 66 29.628 62.541 73.036 1.00 25.83 O ATOM 676 H GLY A 66 27.826 59.891 70.089 1.00 0.00 H ATOM 677 N ARG A 67 30.365 61.845 71.040 1.00 25.59 N ATOM 678 CA ARG A 67 31.586 62.630 71.109 1.00 26.29 C ATOM 679 C ARG A 67 31.426 63.882 70.266 1.00 24.69 C ATOM 680 O ARG A 67 31.303 63.775 69.038 1.00 23.49 O ATOM 681 CB ARG A 67 32.776 61.805 70.628 1.00 27.69 C ATOM 682 CG ARG A 67 33.094 60.616 71.559 1.00 29.32 C ATOM 683 CD ARG A 67 33.914 59.573 70.818 1.00 31.82 C ATOM 684 NE ARG A 67 34.164 58.373 71.608 1.00 35.38 N ATOM 685 CZ ARG A 67 35.196 58.239 72.434 1.00 38.96 C ATOM 686 NH1 ARG A 67 35.368 57.113 73.116 1.00 31.82 N ATOM 687 NH2 ARG A 67 36.049 59.251 72.579 1.00 40.51 N ATOM 688 HE ARG A 67 33.498 57.579 71.520 1.00 0.00 H ATOM 689 HH12 ARG A 67 36.178 57.014 73.761 1.00 0.00 H ATOM 690 HH11 ARG A 67 34.693 56.330 73.005 1.00 0.00 H ATOM 691 HH22 ARG A 67 36.861 59.159 73.222 1.00 0.00 H ATOM 692 HH21 ARG A 67 35.903 60.134 72.049 1.00 0.00 H ATOM 693 H ARG A 67 30.170 61.280 70.189 1.00 0.00 H ATOM 694 N PRO A 68 31.414 65.079 70.867 1.00 24.80 N ATOM 695 CA PRO A 68 31.222 66.291 70.068 1.00 24.02 C ATOM 696 C PRO A 68 32.272 66.450 68.991 1.00 25.07 C ATOM 697 O PRO A 68 31.958 66.985 67.925 1.00 25.06 O ATOM 698 CB PRO A 68 31.288 67.425 71.108 1.00 28.53 C ATOM 699 CG PRO A 68 31.970 66.842 72.289 1.00 29.89 C ATOM 700 CD PRO A 68 31.606 65.374 72.305 1.00 29.23 C ATOM 701 N GLU A 69 33.493 65.961 69.224 1.00 28.68 N ATOM 702 CA GLU A 69 34.541 66.079 68.216 1.00 33.42 C ATOM 703 C GLU A 69 34.243 65.222 66.989 1.00 31.78 C ATOM 704 O GLU A 69 34.670 65.563 65.877 1.00 28.61 O ATOM 705 CB GLU A 69 35.899 65.707 68.822 1.00 40.17 C ATOM 706 CG GLU A 69 36.044 64.254 69.246 1.00 51.01 C ATOM 707 CD GLU A 69 35.710 63.996 70.720 1.00 55.82 C ATOM 708 OE1 GLU A 69 34.999 64.825 71.334 1.00 46.42 O ATOM 709 OE2 GLU A 69 36.167 62.952 71.264 1.00 65.34 O ATOM 710 H GLU A 69 33.698 65.493 70.130 1.00 0.00 H ATOM 711 N PHE A 70 33.521 64.113 67.170 1.00 29.74 N ATOM 712 CA PHE A 70 33.093 63.319 66.024 1.00 27.41 C ATOM 713 C PHE A 70 31.996 64.040 65.248 1.00 24.48 C ATOM 714 O PHE A 70 31.971 63.989 64.013 1.00 24.71 O ATOM 715 CB PHE A 70 32.622 61.929 66.486 1.00 25.31 C ATOM 716 CG PHE A 70 33.750 60.965 66.838 1.00 27.41 C ATOM 717 CD1 PHE A 70 35.078 61.362 66.809 1.00 28.53 C ATOM 718 CD2 PHE A 70 33.464 59.646 67.205 1.00 27.44 C ATOM 719 CE1 PHE A 70 36.098 60.475 67.124 1.00 30.73 C ATOM 720 CE2 PHE A 70 34.482 58.752 67.522 1.00 31.16 C ATOM 721 CZ PHE A 70 35.801 59.164 67.493 1.00 31.39 C ATOM 722 H PHE A 70 33.263 63.814 68.132 1.00 0.00 H ATOM 723 N LEU A 71 31.075 64.718 65.950 1.00 22.71 N ATOM 724 CA LEU A 71 30.080 65.550 65.262 1.00 21.69 C ATOM 725 C LEU A 71 30.751 66.614 64.401 1.00 21.78 C ATOM 726 O LEU A 71 30.403 66.803 63.218 1.00 21.63 O ATOM 727 CB LEU A 71 29.157 66.220 66.295 1.00 20.82 C ATOM 728 CG LEU A 71 28.250 67.329 65.759 1.00 25.13 C ATOM 729 CD1 LEU A 71 27.275 66.777 64.751 1.00 21.45 C ATOM 730 CD2 LEU A 71 27.506 68.075 66.906 1.00 20.81 C ATOM 731 H LEU A 71 31.066 64.654 66.988 1.00 0.00 H ATOM 732 N THR A 72 31.732 67.324 64.961 1.00 24.05 N ATOM 733 CA THR A 72 32.366 68.375 64.171 1.00 23.86 C ATOM 734 C THR A 72 33.220 67.795 63.049 1.00 23.50 C ATOM 735 O THR A 72 33.397 68.440 62.009 1.00 25.12 O ATOM 736 CB THR A 72 33.189 69.307 65.069 1.00 26.91 C ATOM 737 OG1 THR A 72 34.227 68.574 65.725 1.00 23.94 O ATOM 738 CG2 THR A 72 32.290 69.965 66.124 1.00 21.95 C ATOM 739 HG1 THR A 72 34.823 68.169 65.046 1.00 0.00 H ATOM 740 H THR A 72 32.038 67.133 65.937 1.00 0.00 H ATOM 741 N ARG A 73 33.724 66.567 63.207 1.00 24.36 N ATOM 742 CA ARG A 73 34.392 65.922 62.078 1.00 25.48 C ATOM 743 C ARG A 73 33.423 65.668 60.922 1.00 25.17 C ATOM 744 O ARG A 73 33.769 65.877 59.747 1.00 26.24 O ATOM 745 CB ARG A 73 35.041 64.608 62.526 1.00 26.59 C ATOM 746 CG ARG A 73 36.206 64.191 61.633 1.00 28.24 C ATOM 747 CD ARG A 73 37.435 65.066 61.878 1.00 30.64 C ATOM 748 NE ARG A 73 37.776 65.068 63.292 1.00 33.04 N ATOM 749 CZ ARG A 73 38.449 64.095 63.915 1.00 31.94 C ATOM 750 NH1 ARG A 73 38.895 63.027 63.250 1.00 33.75 N ATOM 751 NH2 ARG A 73 38.679 64.196 65.217 1.00 35.66 N ATOM 752 HE ARG A 73 37.474 65.886 63.860 1.00 0.00 H ATOM 753 HH12 ARG A 73 39.416 62.281 63.754 1.00 0.00 H ATOM 754 HH11 ARG A 73 38.721 62.941 62.228 1.00 0.00 H ATOM 755 HH22 ARG A 73 39.201 63.446 65.713 1.00 0.00 H ATOM 756 HH21 ARG A 73 38.337 65.026 65.743 1.00 0.00 H ATOM 757 H ARG A 73 33.642 66.077 64.121 1.00 0.00 H ATOM 758 N LEU A 74 32.211 65.196 61.220 1.00 24.15 N ATOM 759 CA LEU A 74 31.215 65.041 60.161 1.00 25.39 C ATOM 760 C LEU A 74 30.912 66.373 59.490 1.00 25.37 C ATOM 761 O LEU A 74 30.692 66.428 58.280 1.00 23.57 O ATOM 762 CB LEU A 74 29.924 64.444 60.715 1.00 23.02 C ATOM 763 CG LEU A 74 30.042 63.034 61.287 1.00 24.39 C ATOM 764 CD1 LEU A 74 28.680 62.556 61.807 1.00 28.80 C ATOM 765 CD2 LEU A 74 30.612 62.082 60.223 1.00 26.65 C ATOM 766 H LEU A 74 31.976 64.940 62.200 1.00 0.00 H ATOM 767 N ASN A 75 30.852 67.462 60.263 1.00 22.44 N ATOM 768 CA ASN A 75 30.607 68.755 59.636 1.00 22.03 C ATOM 769 C ASN A 75 31.758 69.163 58.735 1.00 23.13 C ATOM 770 O ASN A 75 31.547 69.803 57.689 1.00 23.24 O ATOM 771 CB ASN A 75 30.354 69.813 60.712 1.00 23.47 C ATOM 772 CG ASN A 75 29.006 69.626 61.368 1.00 25.55 C ATOM 773 OD1 ASN A 75 28.061 69.201 60.700 1.00 22.80 O ATOM 774 ND2 ASN A 75 28.899 69.929 62.680 1.00 20.85 N ATOM 775 HD22 ASN A 75 29.726 70.285 63.201 1.00 0.00 H ATOM 776 HD21 ASN A 75 27.990 69.807 63.169 1.00 0.00 H ATOM 777 H ASN A 75 30.978 67.388 61.293 1.00 0.00 H ATOM 778 N GLU A 76 32.987 68.827 59.125 1.00 24.11 N ATOM 779 CA GLU A 76 34.114 69.068 58.232 1.00 25.55 C ATOM 780 C GLU A 76 33.953 68.278 56.943 1.00 26.21 C ATOM 781 O GLU A 76 34.291 68.770 55.861 1.00 26.98 O ATOM 782 CB GLU A 76 35.437 68.720 58.913 1.00 28.74 C ATOM 783 CG GLU A 76 35.779 69.607 60.086 1.00 33.20 C ATOM 784 CD GLU A 76 37.007 69.134 60.849 1.00 37.59 C ATOM 785 OE1 GLU A 76 37.902 68.517 60.240 1.00 41.56 O ATOM 786 OE2 GLU A 76 37.081 69.387 62.063 1.00 38.70 O ATOM 787 H GLU A 76 33.141 68.396 60.059 1.00 0.00 H HETATM 788 N MSE A 77 33.418 67.062 57.034 1.00 26.72 N HETATM 789 CA MSE A 77 33.200 66.252 55.832 1.00 27.03 C HETATM 790 C MSE A 77 32.094 66.831 54.944 1.00 26.39 C HETATM 791 O MSE A 77 32.214 66.822 53.723 1.00 27.37 O HETATM 792 CB MSE A 77 32.876 64.812 56.234 1.00 27.61 C HETATM 793 CG MSE A 77 34.055 64.191 56.856 1.00 28.27 C HETATM 794 SE MSE A 77 33.598 62.456 57.695 1.00 39.07 S HETATM 795 CE MSE A 77 33.477 61.414 56.062 1.00 33.96 C HETATM 796 H MSE A 77 33.153 66.684 57.966 1.00 0.00 H ATOM 797 N HIS A 78 31.019 67.343 55.551 1.00 25.29 N ATOM 798 CA HIS A 78 29.985 67.958 54.723 1.00 25.79 C ATOM 799 C HIS A 78 30.544 69.153 53.954 1.00 27.33 C ATOM 800 O HIS A 78 30.159 69.383 52.799 1.00 26.17 O ATOM 801 CB HIS A 78 28.772 68.347 55.574 1.00 23.82 C ATOM 802 CG HIS A 78 27.947 67.168 56.010 1.00 29.42 C ATOM 803 ND1 HIS A 78 27.216 66.398 55.124 1.00 26.94 N ATOM 804 CD2 HIS A 78 27.757 66.620 57.232 1.00 27.07 C ATOM 805 CE1 HIS A 78 26.613 65.423 55.787 1.00 25.65 C ATOM 806 NE2 HIS A 78 26.928 65.530 57.065 1.00 26.46 N ATOM 807 H HIS A 78 30.921 67.304 56.586 1.00 0.00 H ATOM 808 N ALA A 79 31.528 69.859 54.525 1.00 25.01 N ATOM 809 CA ALA A 79 32.116 70.998 53.822 1.00 25.64 C ATOM 810 C ALA A 79 33.139 70.593 52.763 1.00 27.43 C ATOM 811 O ALA A 79 33.321 71.326 51.783 1.00 32.03 O ATOM 812 CB ALA A 79 32.785 71.952 54.812 1.00 26.97 C ATOM 813 H ALA A 79 31.874 69.597 55.470 1.00 0.00 H ATOM 814 N ALA A 80 33.828 69.453 52.924 1.00 28.33 N ATOM 815 CA ALA A 80 34.995 69.208 52.091 1.00 30.24 C ATOM 816 C ALA A 80 35.163 67.787 51.551 1.00 31.46 C ATOM 817 O ALA A 80 36.081 67.570 50.753 1.00 34.42 O ATOM 818 CB ALA A 80 36.267 69.596 52.868 1.00 30.84 C ATOM 819 H ALA A 80 33.532 68.754 53.635 1.00 0.00 H ATOM 820 N GLU A 81 34.321 66.828 51.926 1.00 31.43 N ATOM 821 CA GLU A 81 34.449 65.459 51.420 1.00 32.04 C ATOM 822 C GLU A 81 33.552 65.301 50.199 1.00 32.43 C ATOM 823 O GLU A 81 32.319 65.334 50.344 1.00 32.58 O ATOM 824 CB GLU A 81 34.081 64.445 52.495 1.00 33.09 C ATOM 825 CG GLU A 81 33.990 62.985 52.015 1.00 33.67 C ATOM 826 CD GLU A 81 35.193 62.545 51.210 1.00 38.34 C ATOM 827 OE1 GLU A 81 35.011 62.145 50.039 1.00 41.49 O ATOM 828 OE2 GLU A 81 36.326 62.607 51.725 1.00 38.30 O ATOM 829 H GLU A 81 33.556 67.055 52.593 1.00 0.00 H ATOM 830 N PRO A 82 34.112 65.117 48.997 1.00 34.31 N ATOM 831 CA PRO A 82 33.281 65.041 47.781 1.00 40.52 C ATOM 832 C PRO A 82 32.263 63.915 47.796 1.00 39.46 C ATOM 833 O PRO A 82 31.177 64.063 47.217 1.00 38.67 O ATOM 834 CB PRO A 82 34.319 64.831 46.667 1.00 46.84 C ATOM 835 CG PRO A 82 35.607 65.325 47.232 1.00 44.27 C ATOM 836 CD PRO A 82 35.550 65.005 48.694 1.00 36.48 C ATOM 837 N GLN A 83 32.573 62.798 48.451 1.00 35.29 N ATOM 838 CA GLN A 83 31.690 61.641 48.434 1.00 40.80 C ATOM 839 C GLN A 83 30.563 61.706 49.453 1.00 37.34 C ATOM 840 O GLN A 83 29.772 60.760 49.522 1.00 34.65 O ATOM 841 CB GLN A 83 32.513 60.366 48.662 1.00 43.19 C ATOM 842 CG GLN A 83 33.462 60.084 47.508 1.00 48.10 C ATOM 843 CD GLN A 83 32.736 60.116 46.185 1.00 57.93 C ATOM 844 OE1 GLN A 83 31.928 59.235 45.893 1.00 62.88 O ATOM 845 NE2 GLN A 83 32.994 61.151 45.384 1.00 60.92 N ATOM 846 HE22 GLN A 83 33.685 61.872 45.673 1.00 0.00 H ATOM 847 HE21 GLN A 83 32.504 61.237 44.471 1.00 0.00 H ATOM 848 H GLN A 83 33.464 62.751 48.985 1.00 0.00 H HETATM 849 N MSE A 84 30.455 62.772 50.242 1.00 32.36 N HETATM 850 CA MSE A 84 29.528 62.760 51.365 1.00 32.66 C HETATM 851 C MSE A 84 28.055 62.569 50.971 1.00 30.24 C HETATM 852 O MSE A 84 27.360 61.743 51.553 1.00 32.53 O HETATM 853 CB MSE A 84 29.694 64.047 52.183 1.00 28.28 C HETATM 854 CG MSE A 84 29.179 63.965 53.587 1.00 30.87 C HETATM 855 SE MSE A 84 30.111 62.567 54.624 1.00 41.09 S HETATM 856 CE MSE A 84 29.539 63.105 56.418 1.00 29.95 C HETATM 857 H MSE A 84 31.034 63.616 50.056 1.00 0.00 H ATOM 858 N ARG A 85 27.566 63.338 49.993 1.00 31.44 N ATOM 859 CA ARG A 85 26.179 63.158 49.573 1.00 35.88 C ATOM 860 C ARG A 85 25.950 61.765 49.001 1.00 40.04 C ATOM 861 O ARG A 85 24.952 61.107 49.325 1.00 40.66 O ATOM 862 CB ARG A 85 25.784 64.216 48.543 1.00 41.50 C ATOM 863 CG ARG A 85 24.499 63.860 47.812 1.00 44.09 C ATOM 864 CD ARG A 85 23.926 65.023 47.015 1.00 47.53 C ATOM 865 NE ARG A 85 22.597 64.683 46.517 1.00 49.31 N ATOM 866 CZ ARG A 85 21.622 65.561 46.309 1.00 50.63 C ATOM 867 NH1 ARG A 85 21.816 66.856 46.558 1.00 48.38 N ATOM 868 NH2 ARG A 85 20.449 65.138 45.856 1.00 53.55 N ATOM 869 HE ARG A 85 22.399 63.683 46.310 1.00 0.00 H ATOM 870 HH12 ARG A 85 21.048 67.538 46.393 1.00 0.00 H ATOM 871 HH11 ARG A 85 22.735 67.184 46.917 1.00 0.00 H ATOM 872 HH22 ARG A 85 19.680 65.818 45.690 1.00 0.00 H ATOM 873 HH21 ARG A 85 20.299 64.126 45.667 1.00 0.00 H ATOM 874 H ARG A 85 28.166 64.055 49.537 1.00 0.00 H ATOM 875 N GLU A 86 26.860 61.301 48.140 1.00 36.41 N ATOM 876 CA GLU A 86 26.677 59.996 47.526 1.00 40.42 C ATOM 877 C GLU A 86 26.643 58.890 48.574 1.00 40.25 C ATOM 878 O GLU A 86 25.812 57.979 48.500 1.00 44.09 O ATOM 879 CB GLU A 86 27.790 59.750 46.510 1.00 52.33 C ATOM 880 CG GLU A 86 27.589 58.493 45.678 1.00 64.78 C ATOM 881 CD GLU A 86 26.282 58.529 44.910 1.00 73.80 C ATOM 882 OE1 GLU A 86 26.192 59.300 43.925 1.00 78.83 O ATOM 883 OE2 GLU A 86 25.339 57.805 45.307 1.00 75.73 O ATOM 884 H GLU A 86 27.698 61.872 47.909 1.00 0.00 H ATOM 885 N GLN A 87 27.519 58.960 49.570 1.00 34.94 N ATOM 886 CA GLN A 87 27.597 57.875 50.543 1.00 35.97 C ATOM 887 C GLN A 87 26.514 57.957 51.613 1.00 38.58 C ATOM 888 O GLN A 87 26.089 56.916 52.125 1.00 38.39 O ATOM 889 CB GLN A 87 28.977 57.858 51.203 1.00 36.49 C ATOM 890 CG GLN A 87 30.101 57.463 50.267 1.00 44.58 C ATOM 891 CD GLN A 87 30.121 55.982 49.969 1.00 48.59 C ATOM 892 OE1 GLN A 87 29.760 55.160 50.806 1.00 49.13 O ATOM 893 NE2 GLN A 87 30.543 55.635 48.769 1.00 51.88 N ATOM 894 HE22 GLN A 87 30.840 56.365 48.091 1.00 0.00 H ATOM 895 HE21 GLN A 87 30.579 54.631 48.501 1.00 0.00 H ATOM 896 H GLN A 87 28.147 59.785 49.656 1.00 0.00 H ATOM 897 N THR A 88 26.044 59.164 51.974 1.00 30.28 N ATOM 898 CA THR A 88 25.124 59.292 53.098 1.00 29.41 C ATOM 899 C THR A 88 23.708 59.711 52.721 1.00 30.47 C ATOM 900 O THR A 88 22.790 59.461 53.508 1.00 31.71 O ATOM 901 CB THR A 88 25.644 60.320 54.108 1.00 31.15 C ATOM 902 OG1 THR A 88 25.504 61.621 53.524 1.00 29.01 O ATOM 903 CG2 THR A 88 27.110 60.044 54.457 1.00 30.31 C ATOM 904 HG1 THR A 88 26.032 61.664 52.687 1.00 0.00 H ATOM 905 H THR A 88 26.339 60.012 51.448 1.00 0.00 H ATOM 906 N GLY A 89 23.513 60.338 51.557 1.00 29.59 N ATOM 907 CA GLY A 89 22.244 60.950 51.200 1.00 28.28 C ATOM 908 C GLY A 89 21.960 62.247 51.922 1.00 30.65 C ATOM 909 O GLY A 89 20.935 62.885 51.658 1.00 29.25 O ATOM 910 H GLY A 89 24.301 60.390 50.880 1.00 0.00 H ATOM 911 N VAL A 90 22.829 62.650 52.813 1.00 25.64 N ATOM 912 CA VAL A 90 22.621 63.869 53.603 1.00 24.12 C ATOM 913 C VAL A 90 23.261 65.049 52.883 1.00 24.07 C ATOM 914 O VAL A 90 24.404 64.957 52.422 1.00 26.23 O ATOM 915 CB VAL A 90 23.203 63.699 55.005 1.00 23.36 C ATOM 916 CG1 VAL A 90 23.060 65.003 55.792 1.00 22.00 C ATOM 917 CG2 VAL A 90 22.461 62.575 55.766 1.00 23.46 C ATOM 918 H VAL A 90 23.692 62.090 52.966 1.00 0.00 H ATOM 919 N THR A 91 22.522 66.160 52.768 1.00 23.33 N ATOM 920 CA THR A 91 22.965 67.339 52.034 1.00 23.39 C ATOM 921 C THR A 91 22.946 68.528 52.974 1.00 22.09 C ATOM 922 O THR A 91 22.243 68.506 53.985 1.00 21.21 O ATOM 923 CB THR A 91 22.042 67.663 50.856 1.00 24.02 C ATOM 924 OG1 THR A 91 20.740 67.967 51.382 1.00 23.21 O ATOM 925 CG2 THR A 91 21.967 66.457 49.910 1.00 25.53 C ATOM 926 HG1 THR A 91 20.125 68.180 50.636 1.00 0.00 H ATOM 927 H THR A 91 21.588 66.183 53.224 1.00 0.00 H ATOM 928 N PRO A 92 23.654 69.603 52.640 1.00 22.09 N ATOM 929 CA PRO A 92 23.572 70.801 53.505 1.00 21.02 C ATOM 930 C PRO A 92 22.180 71.400 53.574 1.00 22.24 C ATOM 931 O PRO A 92 21.798 71.926 54.632 1.00 21.12 O ATOM 932 CB PRO A 92 24.565 71.761 52.849 1.00 21.53 C ATOM 933 CG PRO A 92 25.575 70.810 52.182 1.00 23.98 C ATOM 934 CD PRO A 92 24.679 69.752 51.591 1.00 23.21 C ATOM 935 N GLU A 93 21.422 71.355 52.472 1.00 21.08 N ATOM 936 CA GLU A 93 20.040 71.829 52.481 1.00 20.76 C ATOM 937 C GLU A 93 19.178 71.006 53.426 1.00 21.65 C ATOM 938 O GLU A 93 18.338 71.556 54.152 1.00 20.72 O ATOM 939 CB GLU A 93 19.459 71.784 51.071 1.00 21.83 C ATOM 940 CG GLU A 93 20.173 72.720 50.116 1.00 22.41 C ATOM 941 CD GLU A 93 21.493 72.162 49.621 1.00 25.07 C ATOM 942 OE1 GLU A 93 22.358 72.952 49.222 1.00 23.88 O ATOM 943 OE2 GLU A 93 21.662 70.926 49.592 1.00 24.68 O ATOM 944 H GLU A 93 21.825 70.975 51.592 1.00 0.00 H HETATM 945 N MSE A 94 19.366 69.689 53.428 1.00 20.78 N HETATM 946 CA MSE A 94 18.617 68.811 54.318 1.00 20.54 C HETATM 947 C MSE A 94 18.973 69.117 55.783 1.00 19.53 C HETATM 948 O MSE A 94 18.101 69.198 56.668 1.00 19.07 O HETATM 949 CB MSE A 94 18.922 67.354 53.992 1.00 21.43 C HETATM 950 CG MSE A 94 18.098 66.369 54.799 1.00 21.45 C HETATM 951 SE MSE A 94 18.592 64.562 54.151 1.00 32.61 S HETATM 952 CE MSE A 94 18.000 64.721 52.308 1.00 24.51 C HETATM 953 H MSE A 94 20.065 69.276 52.778 1.00 0.00 H ATOM 954 N ILE A 95 20.272 69.299 56.046 1.00 19.36 N ATOM 955 CA ILE A 95 20.692 69.633 57.407 1.00 20.11 C ATOM 956 C ILE A 95 20.048 70.943 57.855 1.00 19.45 C ATOM 957 O ILE A 95 19.606 71.064 59.009 1.00 18.99 O ATOM 958 CB ILE A 95 22.232 69.683 57.513 1.00 18.75 C ATOM 959 CG1 ILE A 95 22.821 68.264 57.338 1.00 19.49 C ATOM 960 CG2 ILE A 95 22.644 70.249 58.895 1.00 20.48 C ATOM 961 CD1 ILE A 95 24.362 68.252 57.265 1.00 21.60 C ATOM 962 H ILE A 95 20.978 69.204 55.288 1.00 0.00 H ATOM 963 N ASP A 96 19.934 71.913 56.949 1.00 18.08 N ATOM 964 CA ASP A 96 19.279 73.187 57.302 1.00 17.64 C ATOM 965 C ASP A 96 17.829 72.972 57.719 1.00 19.61 C ATOM 966 O ASP A 96 17.339 73.606 58.666 1.00 19.09 O ATOM 967 CB ASP A 96 19.298 74.159 56.121 1.00 18.37 C ATOM 968 CG ASP A 96 20.664 74.806 55.894 1.00 20.65 C ATOM 969 OD1 ASP A 96 21.558 74.687 56.763 1.00 22.12 O ATOM 970 OD2 ASP A 96 20.834 75.419 54.815 1.00 21.54 O ATOM 971 H ASP A 96 20.308 71.772 55.989 1.00 0.00 H ATOM 972 N PHE A 97 17.116 72.114 56.999 1.00 18.87 N ATOM 973 CA PHE A 97 15.746 71.803 57.371 1.00 19.85 C ATOM 974 C PHE A 97 15.684 71.155 58.755 1.00 19.90 C ATOM 975 O PHE A 97 14.914 71.590 59.620 1.00 19.11 O ATOM 976 CB PHE A 97 15.124 70.893 56.323 1.00 22.67 C ATOM 977 CG PHE A 97 13.727 70.502 56.646 1.00 22.41 C ATOM 978 CD1 PHE A 97 12.701 71.419 56.501 1.00 25.10 C ATOM 979 CD2 PHE A 97 13.442 69.229 57.135 1.00 22.66 C ATOM 980 CE1 PHE A 97 11.404 71.049 56.826 1.00 29.73 C ATOM 981 CE2 PHE A 97 12.160 68.866 57.467 1.00 27.27 C ATOM 982 CZ PHE A 97 11.141 69.772 57.303 1.00 29.90 C ATOM 983 H PHE A 97 17.540 71.662 56.164 1.00 0.00 H ATOM 984 N ILE A 98 16.484 70.105 58.976 1.00 17.98 N ATOM 985 CA ILE A 98 16.503 69.433 60.280 1.00 17.80 C ATOM 986 C ILE A 98 16.878 70.413 61.394 1.00 18.66 C ATOM 987 O ILE A 98 16.298 70.377 62.489 1.00 19.61 O ATOM 988 CB ILE A 98 17.452 68.221 60.245 1.00 18.11 C ATOM 989 CG1 ILE A 98 16.955 67.171 59.235 1.00 20.55 C ATOM 990 CG2 ILE A 98 17.590 67.581 61.649 1.00 18.00 C ATOM 991 CD1 ILE A 98 15.610 66.561 59.593 1.00 19.91 C ATOM 992 H ILE A 98 17.101 69.761 58.213 1.00 0.00 H ATOM 993 N THR A 99 17.861 71.286 61.144 1.00 16.89 N ATOM 994 CA THR A 99 18.247 72.273 62.159 1.00 18.16 C ATOM 995 C THR A 99 17.050 73.111 62.603 1.00 17.58 C ATOM 996 O THR A 99 16.854 73.358 63.806 1.00 18.01 O ATOM 997 CB THR A 99 19.343 73.191 61.611 1.00 18.25 C ATOM 998 OG1 THR A 99 20.554 72.446 61.468 1.00 18.61 O ATOM 999 CG2 THR A 99 19.602 74.383 62.562 1.00 22.32 C ATOM 1000 HG1 THR A 99 21.264 73.038 61.114 1.00 0.00 H ATOM 1001 H THR A 99 18.353 71.265 60.228 1.00 0.00 H ATOM 1002 N ARG A 100 16.252 73.584 61.647 1.00 18.93 N ATOM 1003 CA ARG A 100 15.143 74.472 62.016 1.00 17.37 C ATOM 1004 C ARG A 100 14.012 73.685 62.658 1.00 20.68 C ATOM 1005 O ARG A 100 13.375 74.162 63.602 1.00 19.30 O ATOM 1006 CB ARG A 100 14.641 75.252 60.792 1.00 17.00 C ATOM 1007 CG ARG A 100 13.517 76.287 61.074 1.00 17.30 C ATOM 1008 CD ARG A 100 13.328 77.270 59.855 1.00 17.59 C ATOM 1009 NE ARG A 100 14.491 78.150 59.717 1.00 17.51 N ATOM 1010 CZ ARG A 100 14.747 79.201 60.502 1.00 20.14 C ATOM 1011 NH1 ARG A 100 13.912 79.559 61.489 1.00 20.96 N ATOM 1012 NH2 ARG A 100 15.847 79.900 60.305 1.00 18.07 N ATOM 1013 HE ARG A 100 15.166 77.942 58.953 1.00 0.00 H ATOM 1014 HH12 ARG A 100 14.134 80.381 62.086 1.00 0.00 H ATOM 1015 HH11 ARG A 100 13.042 79.014 61.657 1.00 0.00 H ATOM 1016 HH22 ARG A 100 16.057 80.720 60.909 1.00 0.00 H ATOM 1017 HH21 ARG A 100 16.505 79.632 59.545 1.00 0.00 H ATOM 1018 H ARG A 100 16.413 73.327 60.652 1.00 0.00 H ATOM 1019 N ALA A 101 13.760 72.464 62.177 1.00 18.65 N ATOM 1020 CA ALA A 101 12.757 71.628 62.830 1.00 17.89 C ATOM 1021 C ALA A 101 13.181 71.264 64.248 1.00 20.51 C ATOM 1022 O ALA A 101 12.343 71.203 65.158 1.00 19.25 O ATOM 1023 CB ALA A 101 12.504 70.375 61.986 1.00 18.40 C ATOM 1024 H ALA A 101 14.274 72.112 61.344 1.00 0.00 H ATOM 1025 N PHE A 102 14.480 71.032 64.464 1.00 18.02 N ATOM 1026 CA PHE A 102 14.932 70.726 65.822 1.00 18.94 C ATOM 1027 C PHE A 102 14.816 71.952 66.717 1.00 19.53 C ATOM 1028 O PHE A 102 14.410 71.850 67.885 1.00 19.69 O ATOM 1029 CB PHE A 102 16.371 70.196 65.806 1.00 18.48 C ATOM 1030 CG PHE A 102 16.775 69.540 67.107 1.00 19.29 C ATOM 1031 CD1 PHE A 102 16.094 68.420 67.560 1.00 22.23 C ATOM 1032 CD2 PHE A 102 17.812 70.061 67.873 1.00 21.41 C ATOM 1033 CE1 PHE A 102 16.453 67.823 68.777 1.00 23.05 C ATOM 1034 CE2 PHE A 102 18.179 69.479 69.076 1.00 19.68 C ATOM 1035 CZ PHE A 102 17.502 68.358 69.517 1.00 20.02 C ATOM 1036 H PHE A 102 15.160 71.068 63.678 1.00 0.00 H ATOM 1037 N ALA A 103 15.141 73.123 66.174 1.00 16.05 N ATOM 1038 CA ALA A 103 14.893 74.367 66.903 1.00 20.25 C ATOM 1039 C ALA A 103 13.440 74.472 67.326 1.00 18.46 C ATOM 1040 O ALA A 103 13.141 74.833 68.469 1.00 18.88 O ATOM 1041 CB ALA A 103 15.264 75.562 66.025 1.00 16.90 C ATOM 1042 H ALA A 103 15.573 73.154 65.228 1.00 0.00 H ATOM 1043 N GLU A 104 12.518 74.217 66.384 1.00 17.24 N ATOM 1044 CA GLU A 104 11.105 74.289 66.713 1.00 16.94 C ATOM 1045 C GLU A 104 10.723 73.241 67.747 1.00 17.88 C ATOM 1046 O GLU A 104 9.805 73.472 68.540 1.00 21.30 O ATOM 1047 CB GLU A 104 10.250 74.163 65.443 1.00 17.84 C ATOM 1048 CG GLU A 104 10.375 75.423 64.508 1.00 17.77 C ATOM 1049 CD GLU A 104 9.689 76.666 65.090 1.00 23.66 C ATOM 1050 OE1 GLU A 104 8.856 76.505 66.007 1.00 20.87 O ATOM 1051 OE2 GLU A 104 9.982 77.787 64.620 1.00 23.32 O ATOM 1052 H GLU A 104 12.815 73.968 65.419 1.00 0.00 H ATOM 1053 N SER A 105 11.419 72.098 67.788 1.00 18.02 N ATOM 1054 CA SER A 105 11.107 71.134 68.842 1.00 21.02 C ATOM 1055 C SER A 105 11.405 71.705 70.217 1.00 23.54 C ATOM 1056 O SER A 105 10.734 71.349 71.180 1.00 22.26 O ATOM 1057 CB SER A 105 11.865 69.809 68.662 1.00 20.52 C ATOM 1058 OG SER A 105 13.216 69.882 69.110 1.00 20.43 O ATOM 1059 HG SER A 105 13.696 70.579 68.596 1.00 0.00 H ATOM 1060 H SER A 105 12.163 71.901 67.088 1.00 0.00 H ATOM 1061 N LYS A 106 12.372 72.611 70.321 1.00 21.86 N ATOM 1062 CA LYS A 106 12.659 73.236 71.605 1.00 19.88 C ATOM 1063 C LYS A 106 11.768 74.438 71.862 1.00 20.82 C ATOM 1064 O LYS A 106 11.332 74.647 73.012 1.00 21.66 O ATOM 1065 CB LYS A 106 14.131 73.613 71.665 1.00 19.81 C ATOM 1066 CG LYS A 106 14.922 72.283 71.637 1.00 26.44 C ATOM 1067 CD LYS A 106 16.350 72.396 72.016 1.00 25.99 C ATOM 1068 CE LYS A 106 16.986 70.960 72.102 1.00 18.80 C ATOM 1069 NZ LYS A 106 18.403 71.220 72.372 1.00 19.02 N ATOM 1070 HZ1 LYS A 106 18.805 71.783 71.595 1.00 0.00 H ATOM 1071 HZ2 LYS A 106 18.494 71.745 73.265 1.00 0.00 H ATOM 1072 HZ3 LYS A 106 18.912 70.316 72.446 1.00 0.00 H ATOM 1073 H LYS A 106 12.926 72.875 69.482 1.00 0.00 H ATOM 1074 N LEU A 107 11.486 75.225 70.810 1.00 19.10 N ATOM 1075 CA LEU A 107 10.565 76.348 70.965 1.00 19.21 C ATOM 1076 C LEU A 107 9.193 75.872 71.410 1.00 22.21 C ATOM 1077 O LEU A 107 8.513 76.584 72.172 1.00 24.39 O ATOM 1078 CB LEU A 107 10.466 77.151 69.653 1.00 21.23 C ATOM 1079 CG LEU A 107 11.763 77.883 69.291 1.00 21.69 C ATOM 1080 CD1 LEU A 107 11.910 78.137 67.778 1.00 23.29 C ATOM 1081 CD2 LEU A 107 11.793 79.207 70.045 1.00 21.16 C ATOM 1082 H LEU A 107 11.923 75.035 69.886 1.00 0.00 H ATOM 1083 N ALA A 108 8.782 74.663 70.989 1.00 22.19 N ATOM 1084 CA ALA A 108 7.493 74.139 71.430 1.00 21.86 C ATOM 1085 C ALA A 108 7.471 73.911 72.934 1.00 28.03 C ATOM 1086 O ALA A 108 6.423 74.068 73.568 1.00 31.30 O ATOM 1087 CB ALA A 108 7.157 72.815 70.733 1.00 22.05 C ATOM 1088 H ALA A 108 9.381 74.102 70.350 1.00 0.00 H ATOM 1089 N ILE A 109 8.601 73.505 73.507 1.00 23.69 N ATOM 1090 CA ILE A 109 8.678 73.327 74.955 1.00 22.87 C ATOM 1091 C ILE A 109 8.803 74.673 75.656 1.00 26.19 C ATOM 1092 O ILE A 109 8.164 74.905 76.691 1.00 27.06 O ATOM 1093 CB ILE A 109 9.864 72.409 75.291 1.00 25.88 C ATOM 1094 CG1 ILE A 109 9.651 71.031 74.665 1.00 33.42 C ATOM 1095 CG2 ILE A 109 10.056 72.246 76.801 1.00 25.50 C ATOM 1096 CD1 ILE A 109 10.818 70.152 74.836 1.00 34.14 C ATOM 1097 H ILE A 109 9.437 73.313 72.919 1.00 0.00 H ATOM 1098 N TRP A 110 9.664 75.554 75.140 1.00 25.56 N ATOM 1099 CA TRP A 110 9.853 76.849 75.775 1.00 23.27 C ATOM 1100 C TRP A 110 8.567 77.668 75.767 1.00 27.20 C ATOM 1101 O TRP A 110 8.380 78.535 76.630 1.00 26.66 O ATOM 1102 CB TRP A 110 10.971 77.634 75.092 1.00 22.12 C ATOM 1103 CG TRP A 110 12.390 77.172 75.391 1.00 19.43 C ATOM 1104 CD1 TRP A 110 12.891 76.739 76.591 1.00 22.84 C ATOM 1105 CD2 TRP A 110 13.482 77.130 74.465 1.00 20.67 C ATOM 1106 NE1 TRP A 110 14.226 76.421 76.457 1.00 21.84 N ATOM 1107 CE2 TRP A 110 14.616 76.665 75.168 1.00 20.98 C ATOM 1108 CE3 TRP A 110 13.619 77.461 73.108 1.00 21.22 C ATOM 1109 CZ2 TRP A 110 15.854 76.494 74.563 1.00 21.36 C ATOM 1110 CZ3 TRP A 110 14.851 77.278 72.503 1.00 23.31 C ATOM 1111 CH2 TRP A 110 15.958 76.798 73.235 1.00 22.33 C ATOM 1112 HE1 TRP A 110 14.838 76.055 77.214 1.00 0.00 H ATOM 1113 H TRP A 110 10.201 75.314 74.282 1.00 0.00 H ATOM 1114 N ALA A 111 7.673 77.411 74.804 1.00 27.35 N ATOM 1115 CA ALA A 111 6.405 78.137 74.730 1.00 31.46 C ATOM 1116 C ALA A 111 5.577 77.975 76.000 1.00 34.84 C ATOM 1117 O ALA A 111 4.720 78.819 76.290 1.00 37.36 O ATOM 1118 CB ALA A 111 5.591 77.654 73.521 1.00 30.75 C ATOM 1119 H ALA A 111 7.884 76.681 74.094 1.00 0.00 H ATOM 1120 N ARG A 112 5.805 76.910 76.752 1.00 32.53 N ATOM 1121 CA ARG A 112 5.043 76.679 77.967 1.00 35.67 C ATOM 1122 C ARG A 112 5.625 77.405 79.170 1.00 31.64 C ATOM 1123 O ARG A 112 5.011 77.375 80.243 1.00 33.40 O ATOM 1124 CB ARG A 112 4.974 75.178 78.271 1.00 38.09 C ATOM 1125 CG ARG A 112 4.546 74.330 77.080 1.00 42.18 C ATOM 1126 CD ARG A 112 4.043 72.962 77.521 1.00 51.85 C ATOM 1127 NE ARG A 112 5.104 72.034 77.921 1.00 56.77 N ATOM 1128 CZ ARG A 112 5.700 71.167 77.101 1.00 59.60 C ATOM 1129 NH1 ARG A 112 6.642 70.349 77.567 1.00 58.78 N ATOM 1130 NH2 ARG A 112 5.360 71.116 75.814 1.00 58.60 N ATOM 1131 HE ARG A 112 5.414 72.053 78.914 1.00 0.00 H ATOM 1132 HH12 ARG A 112 7.107 69.673 76.928 1.00 0.00 H ATOM 1133 HH11 ARG A 112 6.913 70.386 78.570 1.00 0.00 H ATOM 1134 HH22 ARG A 112 5.828 70.438 75.179 1.00 0.00 H ATOM 1135 HH21 ARG A 112 4.627 71.754 75.444 1.00 0.00 H ATOM 1136 H ARG A 112 6.539 76.230 76.469 1.00 0.00 H ATOM 1137 N TYR A 113 6.808 77.995 79.027 1.00 26.79 N ATOM 1138 CA TYR A 113 7.494 78.691 80.110 1.00 27.56 C ATOM 1139 C TYR A 113 7.639 80.181 79.869 1.00 26.61 C ATOM 1140 O TYR A 113 7.652 80.953 80.835 1.00 29.77 O ATOM 1141 CB TYR A 113 8.891 78.089 80.318 1.00 27.39 C ATOM 1142 CG TYR A 113 8.855 76.654 80.785 1.00 25.81 C ATOM 1143 CD1 TYR A 113 8.791 75.603 79.872 1.00 27.36 C ATOM 1144 CD2 TYR A 113 8.920 76.352 82.134 1.00 25.97 C ATOM 1145 CE1 TYR A 113 8.751 74.300 80.302 1.00 29.36 C ATOM 1146 CE2 TYR A 113 8.889 75.042 82.578 1.00 31.07 C ATOM 1147 CZ TYR A 113 8.804 74.025 81.666 1.00 30.71 C ATOM 1148 OH TYR A 113 8.756 72.725 82.139 1.00 32.66 O ATOM 1149 HH TYR A 113 8.696 72.099 81.374 1.00 0.00 H ATOM 1150 H TYR A 113 7.268 77.958 78.095 1.00 0.00 H ATOM 1151 N LEU A 114 7.692 80.600 78.606 1.00 26.76 N ATOM 1152 CA LEU A 114 7.927 81.984 78.201 1.00 25.84 C ATOM 1153 C LEU A 114 6.631 82.681 77.806 1.00 28.56 C ATOM 1154 O LEU A 114 5.643 82.044 77.440 1.00 31.99 O ATOM 1155 CB LEU A 114 8.889 82.031 77.007 1.00 25.89 C ATOM 1156 CG LEU A 114 10.223 81.313 77.112 1.00 27.19 C ATOM 1157 CD1 LEU A 114 10.986 81.370 75.764 1.00 23.11 C ATOM 1158 CD2 LEU A 114 11.039 81.911 78.241 1.00 26.26 C ATOM 1159 H LEU A 114 7.557 79.893 77.856 1.00 0.00 H ATOM 1160 N ASN A 115 6.651 84.016 77.868 1.00 27.74 N ATOM 1161 CA ASN A 115 5.567 84.786 77.275 1.00 29.78 C ATOM 1162 C ASN A 115 5.831 84.960 75.782 1.00 31.75 C ATOM 1163 O ASN A 115 6.879 84.565 75.269 1.00 29.79 O ATOM 1164 CB ASN A 115 5.393 86.130 77.991 1.00 34.49 C ATOM 1165 CG ASN A 115 6.594 87.059 77.848 1.00 37.93 C ATOM 1166 OD1 ASN A 115 7.212 87.166 76.786 1.00 33.22 O ATOM 1167 ND2 ASN A 115 6.904 87.770 78.926 1.00 35.52 N ATOM 1168 HD22 ASN A 115 6.358 87.650 79.803 1.00 0.00 H ATOM 1169 HD21 ASN A 115 7.693 88.447 78.893 1.00 0.00 H ATOM 1170 H ASN A 115 7.440 84.504 78.339 1.00 0.00 H ATOM 1171 N ALA A 116 4.867 85.557 75.070 1.00 31.08 N ATOM 1172 CA ALA A 116 4.965 85.596 73.606 1.00 29.94 C ATOM 1173 C ALA A 116 6.160 86.416 73.138 1.00 32.83 C ATOM 1174 O ALA A 116 6.775 86.104 72.103 1.00 31.76 O ATOM 1175 CB ALA A 116 3.687 86.172 73.003 1.00 33.31 C ATOM 1176 H ALA A 116 4.053 85.991 75.551 1.00 0.00 H ATOM 1177 N GLU A 117 6.515 87.456 73.883 1.00 32.09 N ATOM 1178 CA GLU A 117 7.590 88.327 73.436 1.00 30.41 C ATOM 1179 C GLU A 117 8.954 87.679 73.641 1.00 26.82 C ATOM 1180 O GLU A 117 9.859 87.859 72.815 1.00 25.09 O ATOM 1181 CB GLU A 117 7.483 89.665 74.164 1.00 32.93 C ATOM 1182 CG GLU A 117 6.209 90.445 73.814 1.00 35.33 C ATOM 1183 CD GLU A 117 4.920 89.868 74.426 1.00 41.66 C ATOM 1184 OE1 GLU A 117 4.980 89.115 75.436 1.00 39.51 O ATOM 1185 OE2 GLU A 117 3.831 90.178 73.890 1.00 42.42 O ATOM 1186 H GLU A 117 6.027 87.647 74.781 1.00 0.00 H ATOM 1187 N GLU A 118 9.113 86.911 74.726 1.00 25.48 N ATOM 1188 CA GLU A 118 10.343 86.153 74.929 1.00 26.30 C ATOM 1189 C GLU A 118 10.479 85.057 73.885 1.00 26.23 C ATOM 1190 O GLU A 118 11.570 84.816 73.354 1.00 24.78 O ATOM 1191 CB GLU A 118 10.355 85.542 76.338 1.00 25.60 C ATOM 1192 CG GLU A 118 10.536 86.574 77.461 1.00 25.42 C ATOM 1193 CD GLU A 118 10.029 86.084 78.810 1.00 30.64 C ATOM 1194 OE1 GLU A 118 9.176 85.177 78.829 1.00 27.90 O ATOM 1195 OE2 GLU A 118 10.492 86.612 79.839 1.00 31.98 O ATOM 1196 H GLU A 118 8.351 86.854 75.432 1.00 0.00 H ATOM 1197 N LEU A 119 9.377 84.378 73.580 1.00 26.61 N ATOM 1198 CA LEU A 119 9.412 83.333 72.565 1.00 25.63 C ATOM 1199 C LEU A 119 9.786 83.900 71.191 1.00 23.32 C ATOM 1200 O LEU A 119 10.593 83.307 70.453 1.00 24.95 O ATOM 1201 CB LEU A 119 8.054 82.634 72.529 1.00 29.85 C ATOM 1202 CG LEU A 119 8.006 81.362 71.693 1.00 33.59 C ATOM 1203 CD1 LEU A 119 8.870 80.280 72.350 1.00 31.14 C ATOM 1204 CD2 LEU A 119 6.558 80.924 71.533 1.00 40.12 C ATOM 1205 H LEU A 119 8.485 84.594 74.069 1.00 0.00 H ATOM 1206 N ALA A 120 9.224 85.058 70.835 1.00 25.36 N ATOM 1207 CA ALA A 120 9.543 85.664 69.549 1.00 24.42 C ATOM 1208 C ALA A 120 11.015 86.047 69.472 1.00 25.06 C ATOM 1209 O ALA A 120 11.661 85.858 68.436 1.00 24.40 O ATOM 1210 CB ALA A 120 8.650 86.892 69.318 1.00 24.85 C ATOM 1211 H ALA A 120 8.556 85.529 71.478 1.00 0.00 H ATOM 1212 N PHE A 121 11.553 86.641 70.545 1.00 22.67 N ATOM 1213 CA PHE A 121 12.980 86.967 70.572 1.00 23.09 C ATOM 1214 C PHE A 121 13.842 85.727 70.324 1.00 22.11 C ATOM 1215 O PHE A 121 14.789 85.759 69.531 1.00 20.48 O ATOM 1216 CB PHE A 121 13.344 87.613 71.928 1.00 25.78 C ATOM 1217 CG PHE A 121 14.796 88.002 72.038 1.00 24.61 C ATOM 1218 CD1 PHE A 121 15.752 87.078 72.460 1.00 25.61 C ATOM 1219 CD2 PHE A 121 15.210 89.281 71.691 1.00 27.16 C ATOM 1220 CE1 PHE A 121 17.087 87.427 72.525 1.00 26.89 C ATOM 1221 CE2 PHE A 121 16.545 89.644 71.770 1.00 27.48 C ATOM 1222 CZ PHE A 121 17.482 88.725 72.177 1.00 25.48 C ATOM 1223 H PHE A 121 10.954 86.872 71.363 1.00 0.00 H ATOM 1224 N THR A 122 13.570 84.638 71.056 1.00 19.86 N ATOM 1225 CA THR A 122 14.393 83.443 70.940 1.00 20.77 C ATOM 1226 C THR A 122 14.177 82.738 69.599 1.00 21.86 C ATOM 1227 O THR A 122 15.130 82.191 69.025 1.00 20.02 O ATOM 1228 CB THR A 122 14.095 82.543 72.148 1.00 20.90 C ATOM 1229 OG1 THR A 122 14.489 83.272 73.327 1.00 21.93 O ATOM 1230 CG2 THR A 122 14.845 81.198 72.098 1.00 21.49 C ATOM 1231 HG1 THR A 122 15.455 83.481 73.277 1.00 0.00 H ATOM 1232 H THR A 122 12.764 84.647 71.713 1.00 0.00 H ATOM 1233 N ARG A 123 12.949 82.749 69.067 1.00 18.86 N ATOM 1234 CA ARG A 123 12.740 82.114 67.760 1.00 18.96 C ATOM 1235 C ARG A 123 13.613 82.761 66.683 1.00 22.59 C ATOM 1236 O ARG A 123 14.092 82.079 65.764 1.00 21.42 O ATOM 1237 CB ARG A 123 11.266 82.184 67.359 1.00 22.91 C ATOM 1238 CG ARG A 123 11.010 81.696 65.914 1.00 21.98 C ATOM 1239 CD ARG A 123 9.514 81.432 65.692 1.00 21.82 C ATOM 1240 NE ARG A 123 9.064 80.130 66.200 1.00 22.80 N ATOM 1241 CZ ARG A 123 8.232 79.943 67.218 1.00 26.65 C ATOM 1242 NH1 ARG A 123 7.702 80.982 67.888 1.00 27.52 N ATOM 1243 NH2 ARG A 123 7.873 78.707 67.549 1.00 21.34 N ATOM 1244 HE ARG A 123 9.428 79.281 65.722 1.00 0.00 H ATOM 1245 HH12 ARG A 123 7.053 80.812 68.682 1.00 0.00 H ATOM 1246 HH11 ARG A 123 7.942 81.956 67.612 1.00 0.00 H ATOM 1247 HH22 ARG A 123 7.222 78.550 68.345 1.00 0.00 H ATOM 1248 HH21 ARG A 123 8.243 77.897 67.012 1.00 0.00 H ATOM 1249 H ARG A 123 12.158 83.199 69.570 1.00 0.00 H ATOM 1250 N GLN A 124 13.821 84.076 66.785 1.00 21.17 N ATOM 1251 CA GLN A 124 14.782 84.777 65.933 1.00 22.07 C ATOM 1252 C GLN A 124 16.222 84.445 66.327 1.00 27.10 C ATOM 1253 O GLN A 124 17.001 83.908 65.527 1.00 29.49 O ATOM 1254 CB GLN A 124 14.532 86.290 66.017 1.00 20.03 C ATOM 1255 CG GLN A 124 15.495 87.132 65.158 1.00 23.42 C ATOM 1256 CD GLN A 124 15.142 88.601 65.194 1.00 23.95 C ATOM 1257 OE1 GLN A 124 14.205 88.993 65.876 1.00 30.51 O ATOM 1258 NE2 GLN A 124 15.894 89.422 64.469 1.00 33.46 N ATOM 1259 HE22 GLN A 124 16.681 89.044 63.904 1.00 0.00 H ATOM 1260 HE21 GLN A 124 15.696 90.443 64.467 1.00 0.00 H ATOM 1261 H GLN A 124 13.284 84.618 67.491 1.00 0.00 H ATOM 1262 N HIS A 125 16.588 84.713 67.573 1.00 22.34 N ATOM 1263 CA HIS A 125 18.004 84.763 67.888 1.00 22.03 C ATOM 1264 C HIS A 125 18.622 83.414 68.230 1.00 23.52 C ATOM 1265 O HIS A 125 19.848 83.336 68.344 1.00 21.98 O ATOM 1266 CB HIS A 125 18.213 85.780 69.007 1.00 19.02 C ATOM 1267 CG HIS A 125 17.929 87.184 68.560 1.00 20.43 C ATOM 1268 ND1 HIS A 125 18.763 87.870 67.706 1.00 23.83 N ATOM 1269 CD2 HIS A 125 16.887 88.012 68.816 1.00 24.49 C ATOM 1270 CE1 HIS A 125 18.254 89.070 67.465 1.00 26.16 C ATOM 1271 NE2 HIS A 125 17.117 89.184 68.131 1.00 24.82 N ATOM 1272 H HIS A 125 15.874 84.884 68.310 1.00 0.00 H ATOM 1273 N TYR A 126 17.809 82.358 68.393 1.00 20.63 N ATOM 1274 CA TYR A 126 18.333 81.008 68.560 1.00 20.53 C ATOM 1275 C TYR A 126 19.376 80.683 67.513 1.00 17.37 C ATOM 1276 O TYR A 126 20.343 79.968 67.798 1.00 18.87 O ATOM 1277 CB TYR A 126 17.157 80.021 68.482 1.00 18.81 C ATOM 1278 CG TYR A 126 17.475 78.526 68.501 1.00 22.41 C ATOM 1279 CD1 TYR A 126 17.835 77.862 67.334 1.00 22.29 C ATOM 1280 CD2 TYR A 126 17.360 77.784 69.676 1.00 24.57 C ATOM 1281 CE1 TYR A 126 18.106 76.506 67.328 1.00 23.20 C ATOM 1282 CE2 TYR A 126 17.612 76.403 69.676 1.00 22.37 C ATOM 1283 CZ TYR A 126 17.982 75.780 68.493 1.00 24.41 C ATOM 1284 OH TYR A 126 18.233 74.412 68.454 1.00 24.88 O ATOM 1285 HH TYR A 126 18.482 74.149 67.532 1.00 0.00 H ATOM 1286 H TYR A 126 16.780 82.507 68.400 1.00 0.00 H ATOM 1287 N PHE A 127 19.201 81.192 66.301 1.00 16.62 N ATOM 1288 CA PHE A 127 20.081 80.821 65.193 1.00 17.28 C ATOM 1289 C PHE A 127 21.321 81.700 65.086 1.00 21.12 C ATOM 1290 O PHE A 127 22.212 81.373 64.300 1.00 23.28 O ATOM 1291 CB PHE A 127 19.300 80.853 63.870 1.00 22.03 C ATOM 1292 CG PHE A 127 18.158 79.885 63.844 1.00 20.53 C ATOM 1293 CD1 PHE A 127 16.912 80.258 64.303 1.00 19.93 C ATOM 1294 CD2 PHE A 127 18.341 78.590 63.373 1.00 21.13 C ATOM 1295 CE1 PHE A 127 15.861 79.371 64.321 1.00 19.94 C ATOM 1296 CE2 PHE A 127 17.288 77.680 63.411 1.00 21.46 C ATOM 1297 CZ PHE A 127 16.045 78.073 63.855 1.00 18.38 C ATOM 1298 H PHE A 127 18.426 81.865 66.136 1.00 0.00 H ATOM 1299 N ASP A 128 21.414 82.784 65.868 1.00 19.34 N ATOM 1300 CA ASP A 128 22.496 83.752 65.682 1.00 21.68 C ATOM 1301 C ASP A 128 23.874 83.122 65.836 1.00 17.72 C ATOM 1302 O ASP A 128 24.794 83.430 65.061 1.00 20.42 O ATOM 1303 CB ASP A 128 22.370 84.908 66.682 1.00 20.75 C ATOM 1304 CG ASP A 128 21.270 85.886 66.339 1.00 22.90 C ATOM 1305 OD1 ASP A 128 20.506 85.661 65.387 1.00 22.03 O ATOM 1306 OD2 ASP A 128 21.183 86.930 67.036 1.00 23.54 O ATOM 1307 H ASP A 128 20.709 82.940 66.616 1.00 0.00 H ATOM 1308 N ARG A 129 24.055 82.283 66.865 1.00 16.09 N ATOM 1309 CA ARG A 129 25.350 81.691 67.171 1.00 15.46 C ATOM 1310 C ARG A 129 25.203 80.192 67.414 1.00 22.51 C ATOM 1311 O ARG A 129 26.089 79.573 67.999 1.00 21.36 O ATOM 1312 CB ARG A 129 25.976 82.382 68.409 1.00 15.99 C ATOM 1313 CG ARG A 129 26.142 83.916 68.160 1.00 16.73 C ATOM 1314 CD ARG A 129 26.866 84.591 69.320 1.00 23.10 C ATOM 1315 NE ARG A 129 28.240 84.117 69.435 1.00 21.85 N ATOM 1316 CZ ARG A 129 29.138 84.632 70.259 1.00 23.66 C ATOM 1317 NH1 ARG A 129 28.815 85.673 71.039 1.00 22.42 N ATOM 1318 NH2 ARG A 129 30.367 84.126 70.293 1.00 23.95 N ATOM 1319 HE ARG A 129 28.533 83.323 68.831 1.00 0.00 H ATOM 1320 HH12 ARG A 129 29.522 86.077 71.686 1.00 0.00 H ATOM 1321 HH11 ARG A 129 27.858 86.077 70.997 1.00 0.00 H ATOM 1322 HH22 ARG A 129 31.077 84.527 70.939 1.00 0.00 H ATOM 1323 HH21 ARG A 129 30.619 83.329 69.674 1.00 0.00 H ATOM 1324 H ARG A 129 23.241 82.046 67.467 1.00 0.00 H ATOM 1325 N LEU A 130 24.100 79.609 66.944 1.00 21.59 N ATOM 1326 CA LEU A 130 23.841 78.185 67.135 1.00 20.33 C ATOM 1327 C LEU A 130 25.035 77.310 66.743 1.00 18.14 C ATOM 1328 O LEU A 130 25.367 76.345 67.459 1.00 19.01 O ATOM 1329 CB LEU A 130 22.606 77.792 66.325 1.00 17.39 C ATOM 1330 CG LEU A 130 22.304 76.283 66.283 1.00 17.44 C ATOM 1331 CD1 LEU A 130 21.877 75.855 67.683 1.00 16.88 C ATOM 1332 CD2 LEU A 130 21.258 75.998 65.220 1.00 22.93 C ATOM 1333 H LEU A 130 23.405 80.185 66.427 1.00 0.00 H HETATM 1334 N MSE A 131 25.669 77.596 65.602 1.00 17.11 N HETATM 1335 CA MSE A 131 26.723 76.707 65.119 1.00 19.57 C HETATM 1336 C MSE A 131 28.039 76.826 65.882 1.00 20.74 C HETATM 1337 O MSE A 131 28.980 76.099 65.585 1.00 19.39 O HETATM 1338 CB MSE A 131 27.017 76.960 63.629 1.00 22.41 C HETATM 1339 CG MSE A 131 25.842 76.798 62.734 1.00 31.78 C HETATM 1340 SE MSE A 131 25.202 74.953 62.812 1.00 43.61 S HETATM 1341 CE MSE A 131 26.884 73.961 62.982 1.00 42.21 C HETATM 1342 H MSE A 131 25.414 78.447 65.061 1.00 0.00 H ATOM 1343 N GLU A 132 28.133 77.753 66.845 1.00 17.22 N ATOM 1344 CA GLU A 132 29.327 77.803 67.684 1.00 16.54 C ATOM 1345 C GLU A 132 29.255 76.865 68.887 1.00 16.64 C ATOM 1346 O GLU A 132 30.270 76.688 69.562 1.00 20.75 O ATOM 1347 CB GLU A 132 29.579 79.222 68.179 1.00 16.98 C ATOM 1348 CG GLU A 132 29.930 80.152 67.026 1.00 17.93 C ATOM 1349 CD GLU A 132 30.581 81.417 67.522 1.00 25.08 C ATOM 1350 OE1 GLU A 132 31.774 81.620 67.198 1.00 24.31 O ATOM 1351 OE2 GLU A 132 29.889 82.190 68.235 1.00 24.08 O ATOM 1352 H GLU A 132 27.360 78.433 66.994 1.00 0.00 H ATOM 1353 N TRP A 133 28.107 76.261 69.152 1.00 16.96 N ATOM 1354 CA TRP A 133 27.994 75.414 70.347 1.00 19.49 C ATOM 1355 C TRP A 133 28.867 74.161 70.285 1.00 19.49 C ATOM 1356 O TRP A 133 29.504 73.842 71.288 1.00 19.83 O ATOM 1357 CB TRP A 133 26.528 75.039 70.607 1.00 17.75 C ATOM 1358 CG TRP A 133 25.730 76.171 71.252 1.00 16.65 C ATOM 1359 CD1 TRP A 133 24.989 77.140 70.603 1.00 18.04 C ATOM 1360 CD2 TRP A 133 25.577 76.431 72.656 1.00 20.22 C ATOM 1361 NE1 TRP A 133 24.396 77.974 71.531 1.00 19.84 N ATOM 1362 CE2 TRP A 133 24.743 77.563 72.790 1.00 19.85 C ATOM 1363 CE3 TRP A 133 26.072 75.815 73.818 1.00 21.22 C ATOM 1364 CZ2 TRP A 133 24.394 78.096 74.033 1.00 19.55 C ATOM 1365 CZ3 TRP A 133 25.720 76.343 75.057 1.00 20.97 C ATOM 1366 CH2 TRP A 133 24.890 77.479 75.149 1.00 22.09 C ATOM 1367 HE1 TRP A 133 23.784 78.785 71.309 1.00 0.00 H ATOM 1368 H TRP A 133 27.291 76.385 68.519 1.00 0.00 H ATOM 1369 N PRO A 134 28.961 73.424 69.168 1.00 19.33 N ATOM 1370 CA PRO A 134 29.763 72.182 69.221 1.00 21.27 C ATOM 1371 C PRO A 134 31.228 72.409 69.589 1.00 22.23 C ATOM 1372 O PRO A 134 31.801 71.601 70.338 1.00 23.31 O ATOM 1373 CB PRO A 134 29.585 71.589 67.811 1.00 22.32 C ATOM 1374 CG PRO A 134 28.189 72.085 67.415 1.00 21.08 C ATOM 1375 CD PRO A 134 28.158 73.505 67.924 1.00 19.72 C ATOM 1376 N ALA A 135 31.840 73.502 69.112 1.00 22.56 N ATOM 1377 CA ALA A 135 33.210 73.820 69.500 1.00 23.02 C ATOM 1378 C ALA A 135 33.309 74.067 71.002 1.00 26.87 C ATOM 1379 O ALA A 135 34.258 73.611 71.655 1.00 25.62 O ATOM 1380 CB ALA A 135 33.702 75.048 68.727 1.00 22.60 C ATOM 1381 H ALA A 135 31.332 74.131 68.458 1.00 0.00 H ATOM 1382 N LEU A 136 32.327 74.771 71.568 1.00 20.96 N ATOM 1383 CA LEU A 136 32.336 74.989 73.019 1.00 21.36 C ATOM 1384 C LEU A 136 32.149 73.673 73.773 1.00 22.32 C ATOM 1385 O LEU A 136 32.874 73.391 74.738 1.00 24.25 O ATOM 1386 CB LEU A 136 31.263 76.022 73.394 1.00 20.88 C ATOM 1387 CG LEU A 136 31.039 76.218 74.910 1.00 23.22 C ATOM 1388 CD1 LEU A 136 32.302 76.763 75.600 1.00 25.16 C ATOM 1389 CD2 LEU A 136 29.865 77.147 75.116 1.00 24.78 C ATOM 1390 H LEU A 136 31.560 75.163 70.985 1.00 0.00 H ATOM 1391 N VAL A 137 31.202 72.843 73.332 1.00 19.92 N ATOM 1392 CA VAL A 137 30.970 71.567 74.011 1.00 18.34 C ATOM 1393 C VAL A 137 32.239 70.724 74.005 1.00 22.97 C ATOM 1394 O VAL A 137 32.611 70.135 75.028 1.00 24.10 O ATOM 1395 CB VAL A 137 29.784 70.834 73.361 1.00 20.77 C ATOM 1396 CG1 VAL A 137 29.634 69.415 73.937 1.00 19.30 C ATOM 1397 CG2 VAL A 137 28.510 71.657 73.572 1.00 19.66 C ATOM 1398 H VAL A 137 30.628 73.103 72.505 1.00 0.00 H ATOM 1399 N ALA A 138 32.947 70.683 72.867 1.00 25.35 N ATOM 1400 CA ALA A 138 34.209 69.949 72.822 1.00 28.30 C ATOM 1401 C ALA A 138 35.208 70.495 73.838 1.00 26.86 C ATOM 1402 O ALA A 138 35.882 69.724 74.537 1.00 29.71 O ATOM 1403 CB ALA A 138 34.802 70.004 71.417 1.00 27.11 C ATOM 1404 H ALA A 138 32.598 71.173 72.018 1.00 0.00 H ATOM 1405 N ASP A 139 35.309 71.826 73.942 1.00 26.50 N ATOM 1406 CA ASP A 139 36.215 72.435 74.910 1.00 27.94 C ATOM 1407 C ASP A 139 35.759 72.190 76.344 1.00 27.39 C ATOM 1408 O ASP A 139 36.596 72.076 77.247 1.00 32.60 O ATOM 1409 CB ASP A 139 36.342 73.940 74.641 1.00 31.60 C ATOM 1410 CG ASP A 139 37.100 74.247 73.347 1.00 35.44 C ATOM 1411 OD1 ASP A 139 37.783 73.331 72.829 1.00 37.98 O ATOM 1412 OD2 ASP A 139 37.022 75.401 72.858 1.00 33.22 O ATOM 1413 H ASP A 139 34.734 72.434 73.325 1.00 0.00 H ATOM 1414 N LEU A 140 34.449 72.112 76.581 1.00 25.79 N ATOM 1415 CA LEU A 140 33.975 71.733 77.912 1.00 26.76 C ATOM 1416 C LEU A 140 34.314 70.281 78.233 1.00 28.53 C ATOM 1417 O LEU A 140 34.729 69.977 79.359 1.00 27.78 O ATOM 1418 CB LEU A 140 32.471 71.976 78.028 1.00 24.18 C ATOM 1419 CG LEU A 140 32.093 73.467 78.011 1.00 23.80 C ATOM 1420 CD1 LEU A 140 30.587 73.650 77.900 1.00 21.43 C ATOM 1421 CD2 LEU A 140 32.636 74.090 79.302 1.00 24.91 C ATOM 1422 H LEU A 140 33.768 72.320 75.823 1.00 0.00 H ATOM 1423 N HIS A 141 34.142 69.367 77.264 1.00 27.16 N ATOM 1424 CA HIS A 141 34.504 67.976 77.513 1.00 30.30 C ATOM 1425 C HIS A 141 35.967 67.864 77.912 1.00 32.05 C ATOM 1426 O HIS A 141 36.299 67.157 78.866 1.00 31.26 O ATOM 1427 CB HIS A 141 34.224 67.109 76.285 1.00 27.64 C ATOM 1428 CG HIS A 141 32.803 66.652 76.160 1.00 24.44 C ATOM 1429 ND1 HIS A 141 32.457 65.318 76.151 1.00 24.50 N ATOM 1430 CD2 HIS A 141 31.645 67.340 76.008 1.00 23.01 C ATOM 1431 CE1 HIS A 141 31.148 65.201 76.022 1.00 25.87 C ATOM 1432 NE2 HIS A 141 30.632 66.410 75.913 1.00 21.67 N ATOM 1433 H HIS A 141 33.753 69.649 76.342 1.00 0.00 H ATOM 1434 N ARG A 142 36.856 68.567 77.202 1.00 34.26 N ATOM 1435 CA ARG A 142 38.274 68.505 77.540 1.00 39.53 C ATOM 1436 C ARG A 142 38.534 69.059 78.934 1.00 41.78 C ATOM 1437 O ARG A 142 39.313 68.484 79.704 1.00 43.69 O ATOM 1438 CB ARG A 142 39.101 69.255 76.497 1.00 41.20 C ATOM 1439 CG ARG A 142 39.370 68.448 75.234 1.00 43.18 C ATOM 1440 CD ARG A 142 40.492 69.045 74.383 1.00 46.07 C ATOM 1441 NE ARG A 142 40.002 70.076 73.475 1.00 48.04 N ATOM 1442 CZ ARG A 142 39.313 69.822 72.366 1.00 46.26 C ATOM 1443 NH1 ARG A 142 39.025 68.569 72.031 1.00 46.68 N ATOM 1444 NH2 ARG A 142 38.903 70.818 71.598 1.00 43.28 N ATOM 1445 HE ARG A 142 40.203 71.069 73.709 1.00 0.00 H ATOM 1446 HH12 ARG A 142 38.486 68.373 71.163 1.00 0.00 H ATOM 1447 HH11 ARG A 142 39.338 67.784 72.637 1.00 0.00 H ATOM 1448 HH22 ARG A 142 38.364 70.618 70.731 1.00 0.00 H ATOM 1449 HH21 ARG A 142 39.119 71.801 71.861 1.00 0.00 H ATOM 1450 H ARG A 142 36.536 69.158 76.408 1.00 0.00 H ATOM 1451 N ALA A 143 37.888 70.174 79.280 1.00 42.09 N ATOM 1452 CA ALA A 143 38.086 70.771 80.599 1.00 45.15 C ATOM 1453 C ALA A 143 37.582 69.849 81.708 1.00 45.93 C ATOM 1454 O ALA A 143 38.288 69.605 82.696 1.00 48.85 O ATOM 1455 CB ALA A 143 37.389 72.129 80.667 1.00 43.59 C ATOM 1456 H ALA A 143 37.237 70.623 78.604 1.00 0.00 H ATOM 1457 N CYS A 144 36.350 69.348 81.569 1.00 35.94 N ATOM 1458 CA CYS A 144 35.795 68.434 82.557 1.00 39.38 C ATOM 1459 C CYS A 144 36.642 67.180 82.672 1.00 41.07 C ATOM 1460 O CYS A 144 36.769 66.612 83.766 1.00 48.53 O ATOM 1461 CB CYS A 144 34.354 68.085 82.187 1.00 31.31 C ATOM 1462 SG CYS A 144 33.635 66.782 83.167 1.00 48.48 S ATOM 1463 H CYS A 144 35.779 69.616 80.742 1.00 0.00 H ATOM 1464 N ARG A 145 37.256 66.760 81.565 1.00 44.28 N ATOM 1465 CA ARG A 145 38.085 65.557 81.566 1.00 52.55 C ATOM 1466 C ARG A 145 39.332 65.747 82.417 1.00 52.89 C ATOM 1467 O ARG A 145 39.716 64.852 83.183 1.00 57.50 O ATOM 1468 CB ARG A 145 38.476 65.209 80.128 1.00 56.34 C ATOM 1469 CG ARG A 145 38.811 63.762 79.877 1.00 60.85 C ATOM 1470 CD ARG A 145 39.351 63.605 78.470 1.00 63.67 C ATOM 1471 NE ARG A 145 38.504 64.273 77.484 1.00 64.93 N ATOM 1472 CZ ARG A 145 38.955 64.797 76.345 1.00 65.24 C ATOM 1473 NH1 ARG A 145 40.249 64.738 76.055 1.00 68.17 N ATOM 1474 NH2 ARG A 145 38.117 65.389 75.500 1.00 59.65 N ATOM 1475 HE ARG A 145 37.486 64.344 77.684 1.00 0.00 H ATOM 1476 HH12 ARG A 145 40.602 65.147 75.166 1.00 0.00 H ATOM 1477 HH11 ARG A 145 40.910 64.283 76.717 1.00 0.00 H ATOM 1478 HH22 ARG A 145 38.475 65.796 74.612 1.00 0.00 H ATOM 1479 HH21 ARG A 145 37.103 65.445 75.726 1.00 0.00 H ATOM 1480 H ARG A 145 37.142 67.300 80.683 1.00 0.00 H ATOM 1481 N GLU A 146 39.984 66.898 82.280 1.00 49.75 N ATOM 1482 CA GLU A 146 41.221 67.200 82.982 1.00 49.27 C ATOM 1483 C GLU A 146 40.985 67.792 84.360 1.00 51.50 C ATOM 1484 O GLU A 146 41.932 68.301 84.970 1.00 53.55 O ATOM 1485 CB GLU A 146 42.069 68.156 82.148 1.00 51.22 C ATOM 1486 CG GLU A 146 42.287 67.676 80.731 1.00 52.61 C ATOM 1487 CD GLU A 146 42.776 68.782 79.820 1.00 58.28 C ATOM 1488 OE1 GLU A 146 42.595 69.974 80.173 1.00 60.02 O ATOM 1489 OE2 GLU A 146 43.334 68.462 78.746 1.00 59.80 O ATOM 1490 H GLU A 146 39.590 67.617 81.640 1.00 0.00 H ATOM 1491 N LYS A 147 39.748 67.730 84.864 1.00 50.19 N ATOM 1492 CA LYS A 147 39.399 68.288 86.169 1.00 48.77 C ATOM 1493 C LYS A 147 39.951 69.703 86.322 1.00 47.95 C ATOM 1494 O LYS A 147 40.494 70.072 87.367 1.00 53.16 O ATOM 1495 CB LYS A 147 39.886 67.391 87.314 1.00 51.01 C ATOM 1496 CG LYS A 147 39.175 66.051 87.431 1.00 53.13 C ATOM 1497 CD LYS A 147 39.623 65.305 88.693 1.00 55.60 C ATOM 1498 CE LYS A 147 39.377 63.822 88.552 1.00 61.36 C ATOM 1499 NZ LYS A 147 40.097 63.287 87.358 1.00 61.97 N ATOM 1500 HZ1 LYS A 147 39.755 63.771 86.503 1.00 0.00 H ATOM 1501 HZ2 LYS A 147 41.118 63.453 87.467 1.00 0.00 H ATOM 1502 HZ3 LYS A 147 39.918 62.266 87.275 1.00 0.00 H ATOM 1503 H LYS A 147 39.004 67.266 84.305 1.00 0.00 H ATOM 1504 N ARG A 148 39.847 70.487 85.247 1.00 42.39 N ATOM 1505 CA ARG A 148 40.173 71.899 85.329 1.00 43.09 C ATOM 1506 C ARG A 148 39.345 72.537 86.428 1.00 42.02 C ATOM 1507 O ARG A 148 38.153 72.243 86.577 1.00 38.70 O ATOM 1508 CB ARG A 148 39.887 72.602 83.997 1.00 49.22 C ATOM 1509 CG ARG A 148 40.851 72.258 82.879 1.00 59.24 C ATOM 1510 CD ARG A 148 42.150 73.039 82.989 1.00 64.64 C ATOM 1511 NE ARG A 148 43.273 72.269 82.463 1.00 69.42 N ATOM 1512 CZ ARG A 148 44.380 72.800 81.951 1.00 74.16 C ATOM 1513 NH1 ARG A 148 45.347 72.006 81.503 1.00 75.13 N ATOM 1514 NH2 ARG A 148 44.520 74.119 81.876 1.00 74.62 N ATOM 1515 HE ARG A 148 43.203 71.232 82.490 1.00 0.00 H ATOM 1516 HH12 ARG A 148 46.214 72.418 81.102 1.00 0.00 H ATOM 1517 HH11 ARG A 148 45.237 70.973 81.553 1.00 0.00 H ATOM 1518 HH22 ARG A 148 45.388 74.528 81.475 1.00 0.00 H ATOM 1519 HH21 ARG A 148 43.762 74.743 82.219 1.00 0.00 H ATOM 1520 H ARG A 148 39.530 70.083 84.343 1.00 0.00 H ATOM 1521 N ASP A 149 39.981 73.406 87.205 1.00 40.75 N ATOM 1522 CA ASP A 149 39.258 74.098 88.260 1.00 43.71 C ATOM 1523 C ASP A 149 38.198 74.986 87.615 1.00 44.71 C ATOM 1524 O ASP A 149 38.548 75.866 86.813 1.00 46.17 O ATOM 1525 CB ASP A 149 40.228 74.913 89.107 1.00 41.36 C ATOM 1526 CG ASP A 149 39.561 75.600 90.284 1.00 44.24 C ATOM 1527 OD1 ASP A 149 38.318 75.612 90.397 1.00 45.38 O ATOM 1528 OD2 ASP A 149 40.303 76.160 91.104 1.00 50.77 O ATOM 1529 H ASP A 149 40.994 73.591 87.059 1.00 0.00 H ATOM 1530 N PRO A 150 36.908 74.779 87.904 1.00 40.43 N ATOM 1531 CA PRO A 150 35.879 75.648 87.304 1.00 39.93 C ATOM 1532 C PRO A 150 36.057 77.120 87.643 1.00 41.23 C ATOM 1533 O PRO A 150 35.618 77.981 86.871 1.00 44.24 O ATOM 1534 CB PRO A 150 34.572 75.095 87.887 1.00 43.42 C ATOM 1535 CG PRO A 150 34.904 73.664 88.268 1.00 41.45 C ATOM 1536 CD PRO A 150 36.320 73.717 88.746 1.00 40.41 C ATOM 1537 N ALA A 151 36.692 77.430 88.771 1.00 44.64 N ATOM 1538 CA ALA A 151 36.887 78.800 89.230 1.00 49.87 C ATOM 1539 C ALA A 151 38.177 79.426 88.720 1.00 47.47 C ATOM 1540 O ALA A 151 38.477 80.569 89.085 1.00 47.75 O ATOM 1541 CB ALA A 151 36.885 78.847 90.765 1.00 52.29 C ATOM 1542 H ALA A 151 37.068 76.656 89.355 1.00 0.00 H ATOM 1543 N SER A 152 38.967 78.707 87.929 1.00 44.34 N ATOM 1544 CA SER A 152 40.232 79.243 87.453 1.00 46.43 C ATOM 1545 C SER A 152 39.966 80.198 86.299 1.00 46.81 C ATOM 1546 O SER A 152 38.850 80.257 85.771 1.00 42.91 O ATOM 1547 CB SER A 152 41.151 78.112 87.014 1.00 41.26 C ATOM 1548 OG SER A 152 40.673 77.514 85.828 1.00 38.79 O ATOM 1549 HG SER A 152 39.767 77.148 85.986 1.00 0.00 H ATOM 1550 H SER A 152 38.677 77.749 87.647 1.00 0.00 H ATOM 1551 N PRO A 153 40.971 80.986 85.896 1.00 51.47 N ATOM 1552 CA PRO A 153 40.778 81.834 84.704 1.00 51.17 C ATOM 1553 C PRO A 153 40.378 81.051 83.466 1.00 50.41 C ATOM 1554 O PRO A 153 39.487 81.487 82.730 1.00 50.50 O ATOM 1555 CB PRO A 153 42.139 82.517 84.545 1.00 48.35 C ATOM 1556 CG PRO A 153 42.635 82.641 85.961 1.00 50.16 C ATOM 1557 CD PRO A 153 42.180 81.369 86.656 1.00 50.46 C ATOM 1558 N GLU A 154 41.003 79.893 83.233 1.00 50.81 N ATOM 1559 CA GLU A 154 40.680 79.081 82.064 1.00 50.46 C ATOM 1560 C GLU A 154 39.267 78.509 82.148 1.00 47.32 C ATOM 1561 O GLU A 154 38.597 78.357 81.119 1.00 42.42 O ATOM 1562 CB GLU A 154 41.705 77.952 81.916 1.00 52.48 C ATOM 1563 CG GLU A 154 43.171 78.405 81.890 1.00 54.98 C ATOM 1564 CD GLU A 154 43.718 78.793 83.261 1.00 54.66 C ATOM 1565 OE1 GLU A 154 43.027 78.559 84.275 1.00 52.97 O ATOM 1566 OE2 GLU A 154 44.835 79.350 83.327 1.00 57.24 O ATOM 1567 H GLU A 154 41.733 79.564 83.897 1.00 0.00 H ATOM 1568 N GLY A 155 38.804 78.188 83.359 1.00 47.86 N ATOM 1569 CA GLY A 155 37.435 77.731 83.528 1.00 39.57 C ATOM 1570 C GLY A 155 36.436 78.867 83.382 1.00 42.59 C ATOM 1571 O GLY A 155 35.357 78.687 82.813 1.00 35.82 O ATOM 1572 H GLY A 155 39.428 78.266 84.187 1.00 0.00 H ATOM 1573 N GLN A 156 36.788 80.058 83.886 1.00 41.34 N ATOM 1574 CA GLN A 156 35.891 81.205 83.767 1.00 40.20 C ATOM 1575 C GLN A 156 35.789 81.710 82.330 1.00 35.88 C ATOM 1576 O GLN A 156 34.767 82.296 81.960 1.00 35.54 O ATOM 1577 CB GLN A 156 36.344 82.330 84.706 1.00 40.26 C ATOM 1578 CG GLN A 156 36.059 82.063 86.165 1.00 41.02 C ATOM 1579 CD GLN A 156 34.606 81.736 86.426 1.00 44.31 C ATOM 1580 OE1 GLN A 156 33.756 82.629 86.503 1.00 43.68 O ATOM 1581 NE2 GLN A 156 34.301 80.438 86.540 1.00 38.59 N ATOM 1582 HE22 GLN A 156 35.050 79.720 86.469 1.00 0.00 H ATOM 1583 HE21 GLN A 156 33.315 80.148 86.700 1.00 0.00 H ATOM 1584 H GLN A 156 37.705 80.166 84.365 1.00 0.00 H ATOM 1585 N GLN A 157 36.825 81.498 81.508 1.00 37.37 N ATOM 1586 CA GLN A 157 36.724 81.822 80.086 1.00 35.18 C ATOM 1587 C GLN A 157 35.702 80.935 79.403 1.00 34.89 C ATOM 1588 O GLN A 157 34.993 81.375 78.489 1.00 31.86 O ATOM 1589 CB GLN A 157 38.071 81.642 79.394 1.00 39.63 C ATOM 1590 CG GLN A 157 39.061 82.757 79.591 1.00 53.36 C ATOM 1591 CD GLN A 157 40.266 82.592 78.688 1.00 65.09 C ATOM 1592 OE1 GLN A 157 40.474 81.521 78.109 1.00 69.71 O ATOM 1593 NE2 GLN A 157 41.062 83.651 78.551 1.00 68.45 N ATOM 1594 HE22 GLN A 157 40.847 84.533 79.059 1.00 0.00 H ATOM 1595 HE21 GLN A 157 41.899 83.596 77.936 1.00 0.00 H ATOM 1596 H GLN A 157 37.709 81.100 81.885 1.00 0.00 H ATOM 1597 N LEU A 158 35.650 79.657 79.803 1.00 35.00 N ATOM 1598 CA LEU A 158 34.638 78.771 79.259 1.00 30.74 C ATOM 1599 C LEU A 158 33.255 79.182 79.725 1.00 27.25 C ATOM 1600 O LEU A 158 32.309 79.197 78.928 1.00 27.74 O ATOM 1601 CB LEU A 158 34.923 77.318 79.651 1.00 33.17 C ATOM 1602 CG LEU A 158 36.092 76.702 78.906 1.00 34.88 C ATOM 1603 CD1 LEU A 158 36.563 75.460 79.661 1.00 35.47 C ATOM 1604 CD2 LEU A 158 35.684 76.378 77.470 1.00 32.22 C ATOM 1605 H LEU A 158 36.333 79.301 80.502 1.00 0.00 H ATOM 1606 N ALA A 159 33.110 79.508 81.007 1.00 27.97 N ATOM 1607 CA ALA A 159 31.813 79.964 81.487 1.00 31.48 C ATOM 1608 C ALA A 159 31.392 81.242 80.772 1.00 28.24 C ATOM 1609 O ALA A 159 30.207 81.417 80.471 1.00 29.54 O ATOM 1610 CB ALA A 159 31.835 80.176 82.998 1.00 33.69 C ATOM 1611 H ALA A 159 33.916 79.438 81.660 1.00 0.00 H ATOM 1612 N GLN A 160 32.348 82.145 80.502 1.00 28.82 N ATOM 1613 CA GLN A 160 32.021 83.383 79.792 1.00 29.32 C ATOM 1614 C GLN A 160 31.582 83.100 78.359 1.00 27.07 C ATOM 1615 O GLN A 160 30.695 83.779 77.841 1.00 26.95 O ATOM 1616 CB GLN A 160 33.205 84.354 79.791 1.00 30.43 C ATOM 1617 CG GLN A 160 33.513 85.018 81.128 1.00 40.35 C ATOM 1618 CD GLN A 160 32.524 86.120 81.497 1.00 50.14 C ATOM 1619 OE1 GLN A 160 31.674 86.521 80.691 1.00 49.64 O ATOM 1620 NE2 GLN A 160 32.630 86.611 82.731 1.00 53.44 N ATOM 1621 HE22 GLN A 160 33.359 86.245 83.376 1.00 0.00 H ATOM 1622 HE21 GLN A 160 31.983 87.361 83.050 1.00 0.00 H ATOM 1623 H GLN A 160 33.328 81.964 80.799 1.00 0.00 H ATOM 1624 N ARG A 161 32.202 82.119 77.703 1.00 25.01 N ATOM 1625 CA ARG A 161 31.753 81.735 76.368 1.00 25.63 C ATOM 1626 C ARG A 161 30.355 81.133 76.422 1.00 25.31 C ATOM 1627 O ARG A 161 29.525 81.432 75.563 1.00 22.80 O ATOM 1628 CB ARG A 161 32.736 80.755 75.732 1.00 26.65 C ATOM 1629 CG ARG A 161 34.028 81.375 75.207 1.00 30.28 C ATOM 1630 CD ARG A 161 35.031 80.284 74.799 1.00 32.25 C ATOM 1631 NE ARG A 161 34.572 79.471 73.682 1.00 27.23 N ATOM 1632 CZ ARG A 161 35.135 78.320 73.334 1.00 28.34 C ATOM 1633 NH1 ARG A 161 36.166 77.855 74.025 1.00 29.72 N ATOM 1634 NH2 ARG A 161 34.663 77.635 72.303 1.00 27.89 N ATOM 1635 HE ARG A 161 33.760 79.810 73.127 1.00 0.00 H ATOM 1636 HH12 ARG A 161 36.609 76.954 73.755 1.00 0.00 H ATOM 1637 HH11 ARG A 161 36.532 78.391 74.837 1.00 0.00 H ATOM 1638 HH22 ARG A 161 35.105 76.734 72.031 1.00 0.00 H ATOM 1639 HH21 ARG A 161 33.851 77.999 71.765 1.00 0.00 H ATOM 1640 H ARG A 161 33.006 81.627 78.142 1.00 0.00 H ATOM 1641 N TRP A 162 30.051 80.334 77.458 1.00 23.93 N ATOM 1642 CA TRP A 162 28.684 79.834 77.615 1.00 23.87 C ATOM 1643 C TRP A 162 27.706 80.989 77.768 1.00 22.79 C ATOM 1644 O TRP A 162 26.652 81.017 77.117 1.00 22.63 O ATOM 1645 CB TRP A 162 28.564 78.881 78.824 1.00 28.14 C ATOM 1646 CG TRP A 162 27.109 78.481 79.111 1.00 22.89 C ATOM 1647 CD1 TRP A 162 26.426 77.416 78.584 1.00 25.02 C ATOM 1648 CD2 TRP A 162 26.179 79.159 79.991 1.00 23.35 C ATOM 1649 NE1 TRP A 162 25.132 77.401 79.065 1.00 26.31 N ATOM 1650 CE2 TRP A 162 24.956 78.452 79.928 1.00 28.93 C ATOM 1651 CE3 TRP A 162 26.261 80.297 80.800 1.00 31.26 C ATOM 1652 CZ2 TRP A 162 23.823 78.845 80.651 1.00 24.24 C ATOM 1653 CZ3 TRP A 162 25.141 80.679 81.537 1.00 30.39 C ATOM 1654 CH2 TRP A 162 23.935 79.954 81.447 1.00 30.74 C ATOM 1655 HE1 TRP A 162 24.405 76.702 78.812 1.00 0.00 H ATOM 1656 H TRP A 162 30.785 80.071 78.147 1.00 0.00 H ATOM 1657 N LEU A 163 28.028 81.953 78.643 1.00 23.49 N ATOM 1658 CA LEU A 163 27.097 83.055 78.867 1.00 25.56 C ATOM 1659 C LEU A 163 26.826 83.812 77.568 1.00 24.17 C ATOM 1660 O LEU A 163 25.681 84.188 77.283 1.00 25.78 O ATOM 1661 CB LEU A 163 27.639 84.005 79.943 1.00 27.05 C ATOM 1662 CG LEU A 163 26.725 85.182 80.299 1.00 31.44 C ATOM 1663 CD1 LEU A 163 25.444 84.705 80.957 1.00 31.95 C ATOM 1664 CD2 LEU A 163 27.422 86.252 81.158 1.00 36.00 C ATOM 1665 H LEU A 163 28.932 81.916 79.157 1.00 0.00 H ATOM 1666 N ALA A 164 27.864 84.028 76.761 1.00 25.77 N ATOM 1667 CA ALA A 164 27.668 84.771 75.515 1.00 25.47 C ATOM 1668 C ALA A 164 26.737 84.020 74.569 1.00 23.05 C ATOM 1669 O ALA A 164 25.854 84.624 73.957 1.00 24.29 O ATOM 1670 CB ALA A 164 29.012 85.056 74.835 1.00 25.10 C ATOM 1671 H ALA A 164 28.807 83.671 77.015 1.00 0.00 H ATOM 1672 N LEU A 165 26.904 82.694 74.449 1.00 22.26 N ATOM 1673 CA LEU A 165 26.017 81.924 73.569 1.00 21.66 C ATOM 1674 C LEU A 165 24.601 81.827 74.147 1.00 22.56 C ATOM 1675 O LEU A 165 23.609 81.890 73.404 1.00 21.84 O ATOM 1676 CB LEU A 165 26.596 80.518 73.338 1.00 18.41 C ATOM 1677 CG LEU A 165 27.937 80.415 72.607 1.00 21.86 C ATOM 1678 CD1 LEU A 165 28.255 78.958 72.232 1.00 23.81 C ATOM 1679 CD2 LEU A 165 27.954 81.297 71.343 1.00 19.71 C ATOM 1680 H LEU A 165 27.660 82.213 74.978 1.00 0.00 H ATOM 1681 N PHE A 166 24.498 81.681 75.472 1.00 21.55 N ATOM 1682 CA PHE A 166 23.210 81.632 76.167 1.00 21.62 C ATOM 1683 C PHE A 166 22.456 82.955 76.046 1.00 22.97 C ATOM 1684 O PHE A 166 21.277 82.986 75.654 1.00 24.55 O ATOM 1685 CB PHE A 166 23.455 81.280 77.644 1.00 24.54 C ATOM 1686 CG PHE A 166 22.211 81.291 78.500 1.00 24.29 C ATOM 1687 CD1 PHE A 166 21.229 80.329 78.325 1.00 28.65 C ATOM 1688 CD2 PHE A 166 22.039 82.254 79.483 1.00 25.47 C ATOM 1689 CE1 PHE A 166 20.094 80.327 79.107 1.00 29.54 C ATOM 1690 CE2 PHE A 166 20.907 82.268 80.268 1.00 29.66 C ATOM 1691 CZ PHE A 166 19.932 81.309 80.091 1.00 31.44 C ATOM 1692 H PHE A 166 25.370 81.599 76.033 1.00 0.00 H ATOM 1693 N GLN A 167 23.117 84.066 76.375 1.00 22.95 N ATOM 1694 CA GLN A 167 22.465 85.365 76.239 1.00 23.81 C ATOM 1695 C GLN A 167 22.135 85.678 74.782 1.00 24.89 C ATOM 1696 O GLN A 167 21.213 86.456 74.501 1.00 24.53 O ATOM 1697 CB GLN A 167 23.347 86.462 76.845 1.00 30.63 C ATOM 1698 CG GLN A 167 23.328 86.464 78.386 1.00 38.31 C ATOM 1699 CD GLN A 167 24.083 87.642 79.018 1.00 47.12 C ATOM 1700 OE1 GLN A 167 24.980 88.220 78.401 1.00 47.28 O ATOM 1701 NE2 GLN A 167 23.718 87.994 80.259 1.00 46.41 N ATOM 1702 HE22 GLN A 167 22.955 87.478 80.743 1.00 0.00 H ATOM 1703 HE21 GLN A 167 24.198 88.783 80.738 1.00 0.00 H ATOM 1704 H GLN A 167 24.094 84.007 76.727 1.00 0.00 H ATOM 1705 N SER A 168 22.879 85.106 73.837 1.00 22.74 N ATOM 1706 CA SER A 168 22.522 85.312 72.441 1.00 19.93 C ATOM 1707 C SER A 168 21.113 84.801 72.141 1.00 21.06 C ATOM 1708 O SER A 168 20.348 85.483 71.453 1.00 24.74 O ATOM 1709 CB SER A 168 23.557 84.649 71.529 1.00 24.60 C ATOM 1710 OG SER A 168 23.139 84.699 70.191 1.00 26.88 O ATOM 1711 HG SER A 168 23.027 85.644 69.917 1.00 0.00 H ATOM 1712 H SER A 168 23.701 84.522 74.092 1.00 0.00 H ATOM 1713 N TYR A 169 20.738 83.615 72.666 1.00 24.02 N ATOM 1714 CA TYR A 169 19.403 83.092 72.371 1.00 26.37 C ATOM 1715 C TYR A 169 18.354 83.504 73.399 1.00 26.67 C ATOM 1716 O TYR A 169 17.185 83.699 73.031 1.00 22.79 O ATOM 1717 CB TYR A 169 19.429 81.550 72.193 1.00 24.45 C ATOM 1718 CG TYR A 169 19.394 80.629 73.401 1.00 29.27 C ATOM 1719 CD1 TYR A 169 18.218 80.431 74.134 1.00 25.50 C ATOM 1720 CD2 TYR A 169 20.518 79.889 73.772 1.00 28.21 C ATOM 1721 CE1 TYR A 169 18.180 79.561 75.219 1.00 30.09 C ATOM 1722 CE2 TYR A 169 20.483 79.014 74.852 1.00 29.52 C ATOM 1723 CZ TYR A 169 19.315 78.844 75.565 1.00 35.73 C ATOM 1724 OH TYR A 169 19.278 77.987 76.647 1.00 43.85 O ATOM 1725 HH TYR A 169 19.510 77.072 76.350 1.00 0.00 H ATOM 1726 H TYR A 169 21.390 83.079 73.273 1.00 0.00 H ATOM 1727 N ALA A 170 18.752 83.705 74.663 1.00 21.03 N ATOM 1728 CA ALA A 170 17.801 83.990 75.739 1.00 22.16 C ATOM 1729 C ALA A 170 17.552 85.471 75.935 1.00 26.38 C ATOM 1730 O ALA A 170 16.491 85.849 76.455 1.00 26.85 O ATOM 1731 CB ALA A 170 18.305 83.395 77.063 1.00 23.38 C ATOM 1732 H ALA A 170 19.767 83.657 74.886 1.00 0.00 H ATOM 1733 N GLY A 171 18.499 86.316 75.523 1.00 23.48 N ATOM 1734 CA GLY A 171 18.462 87.720 75.863 1.00 24.38 C ATOM 1735 C GLY A 171 19.210 87.986 77.149 1.00 28.77 C ATOM 1736 O GLY A 171 19.742 87.087 77.809 1.00 27.56 O ATOM 1737 H GLY A 171 19.283 85.955 74.943 1.00 0.00 H ATOM 1738 N LYS A 172 19.237 89.275 77.500 1.00 29.63 N ATOM 1739 CA LYS A 172 19.988 89.809 78.635 1.00 30.21 C ATOM 1740 C LYS A 172 19.154 90.016 79.897 1.00 34.05 C ATOM 1741 O LYS A 172 19.684 90.550 80.881 1.00 39.16 O ATOM 1742 CB LYS A 172 20.619 91.160 78.252 1.00 34.72 C ATOM 1743 CG LYS A 172 21.561 91.137 77.052 1.00 44.38 C ATOM 1744 CD LYS A 172 22.822 90.353 77.390 1.00 51.45 C ATOM 1745 CE LYS A 172 23.794 90.251 76.212 1.00 56.81 C ATOM 1746 NZ LYS A 172 24.565 91.509 75.977 1.00 59.99 N ATOM 1747 HZ1 LYS A 172 23.904 92.286 75.775 1.00 0.00 H ATOM 1748 HZ2 LYS A 172 25.121 91.737 76.826 1.00 0.00 H ATOM 1749 HZ3 LYS A 172 25.204 91.376 75.168 1.00 0.00 H ATOM 1750 H LYS A 172 18.686 89.945 76.926 1.00 0.00 H ATOM 1751 N ASP A 173 17.862 89.688 79.886 1.00 31.27 N ATOM 1752 CA ASP A 173 16.995 89.966 81.033 1.00 31.16 C ATOM 1753 C ASP A 173 17.095 88.844 82.061 1.00 35.56 C ATOM 1754 O ASP A 173 16.961 87.662 81.715 1.00 34.10 O ATOM 1755 CB ASP A 173 15.542 90.151 80.589 1.00 34.05 C ATOM 1756 CG ASP A 173 14.626 90.544 81.735 1.00 39.55 C ATOM 1757 OD1 ASP A 173 14.194 89.662 82.502 1.00 36.02 O ATOM 1758 OD2 ASP A 173 14.354 91.756 81.904 1.00 43.31 O ATOM 1759 H ASP A 173 17.461 89.225 79.045 1.00 0.00 H ATOM 1760 N ALA A 174 17.325 89.216 83.327 1.00 36.64 N ATOM 1761 CA ALA A 174 17.622 88.199 84.331 1.00 34.93 C ATOM 1762 C ALA A 174 16.415 87.303 84.601 1.00 34.05 C ATOM 1763 O ALA A 174 16.570 86.091 84.770 1.00 32.86 O ATOM 1764 CB ALA A 174 18.115 88.855 85.622 1.00 37.64 C ATOM 1765 H ALA A 174 17.292 90.221 83.592 1.00 0.00 H ATOM 1766 N GLN A 175 15.208 87.879 84.655 1.00 34.02 N ATOM 1767 CA GLN A 175 14.015 87.074 84.906 1.00 28.73 C ATOM 1768 C GLN A 175 13.747 86.123 83.749 1.00 29.04 C ATOM 1769 O GLN A 175 13.361 84.964 83.955 1.00 28.34 O ATOM 1770 CB GLN A 175 12.802 87.993 85.143 1.00 30.37 C ATOM 1771 CG GLN A 175 11.525 87.239 85.585 1.00 35.13 C ATOM 1772 CD GLN A 175 10.304 88.138 85.670 1.00 38.49 C ATOM 1773 OE1 GLN A 175 10.424 89.363 85.604 1.00 36.62 O ATOM 1774 NE2 GLN A 175 9.123 87.537 85.840 1.00 37.12 N ATOM 1775 HE22 GLN A 175 9.070 86.500 85.890 1.00 0.00 H ATOM 1776 HE21 GLN A 175 8.257 88.107 85.922 1.00 0.00 H ATOM 1777 H GLN A 175 15.119 88.906 84.517 1.00 0.00 H ATOM 1778 N THR A 176 13.957 86.596 82.522 1.00 29.93 N ATOM 1779 CA THR A 176 13.812 85.731 81.360 1.00 26.04 C ATOM 1780 C THR A 176 14.817 84.594 81.402 1.00 24.11 C ATOM 1781 O THR A 176 14.470 83.441 81.134 1.00 25.88 O ATOM 1782 CB THR A 176 13.972 86.542 80.072 1.00 25.96 C ATOM 1783 OG1 THR A 176 12.955 87.557 80.041 1.00 28.71 O ATOM 1784 CG2 THR A 176 13.865 85.635 78.835 1.00 24.14 C ATOM 1785 HG1 THR A 176 13.047 88.090 79.212 1.00 0.00 H ATOM 1786 H THR A 176 14.227 87.592 82.393 1.00 0.00 H ATOM 1787 N GLN A 177 16.069 84.900 81.754 1.00 29.81 N ATOM 1788 CA GLN A 177 17.090 83.859 81.774 1.00 29.33 C ATOM 1789 C GLN A 177 16.729 82.784 82.773 1.00 29.38 C ATOM 1790 O GLN A 177 16.876 81.590 82.491 1.00 28.68 O ATOM 1791 CB GLN A 177 18.456 84.449 82.101 1.00 29.42 C ATOM 1792 CG GLN A 177 19.024 85.268 80.934 1.00 31.68 C ATOM 1793 CD GLN A 177 20.371 85.880 81.232 1.00 39.35 C ATOM 1794 OE1 GLN A 177 20.882 86.675 80.450 1.00 44.18 O ATOM 1795 NE2 GLN A 177 20.955 85.517 82.363 1.00 44.10 N ATOM 1796 HE22 GLN A 177 20.485 84.839 82.997 1.00 0.00 H ATOM 1797 HE21 GLN A 177 21.884 85.909 82.618 1.00 0.00 H ATOM 1798 H GLN A 177 16.314 85.877 82.013 1.00 0.00 H ATOM 1799 N GLN A 178 16.218 83.197 83.939 1.00 30.21 N ATOM 1800 CA GLN A 178 15.824 82.230 84.954 1.00 25.73 C ATOM 1801 C GLN A 178 14.714 81.308 84.448 1.00 28.89 C ATOM 1802 O GLN A 178 14.647 80.139 84.852 1.00 31.84 O ATOM 1803 CB GLN A 178 15.402 82.978 86.233 1.00 27.17 C ATOM 1804 CG GLN A 178 14.667 82.108 87.279 1.00 31.88 C ATOM 1805 CD GLN A 178 15.420 80.854 87.703 1.00 44.83 C ATOM 1806 OE1 GLN A 178 16.619 80.690 87.436 1.00 52.34 O ATOM 1807 NE2 GLN A 178 14.701 79.941 88.351 1.00 42.09 N ATOM 1808 HE22 GLN A 178 13.697 80.119 88.555 1.00 0.00 H ATOM 1809 HE21 GLN A 178 15.143 79.050 88.653 1.00 0.00 H ATOM 1810 H GLN A 178 16.102 84.214 84.121 1.00 0.00 H ATOM 1811 N LYS A 179 13.818 81.812 83.590 1.00 24.86 N ATOM 1812 CA LYS A 179 12.823 80.924 82.986 1.00 26.02 C ATOM 1813 C LYS A 179 13.493 79.839 82.169 1.00 27.35 C ATOM 1814 O LYS A 179 13.091 78.675 82.218 1.00 26.79 O ATOM 1815 CB LYS A 179 11.861 81.704 82.096 1.00 23.67 C ATOM 1816 CG LYS A 179 11.018 82.749 82.830 1.00 25.06 C ATOM 1817 CD LYS A 179 10.079 83.410 81.844 1.00 29.08 C ATOM 1818 CE LYS A 179 9.300 84.562 82.508 1.00 33.07 C ATOM 1819 NZ LYS A 179 8.394 85.203 81.528 1.00 28.66 N ATOM 1820 HZ1 LYS A 179 8.953 85.582 80.737 1.00 0.00 H ATOM 1821 HZ2 LYS A 179 7.718 84.498 81.170 1.00 0.00 H ATOM 1822 HZ3 LYS A 179 7.876 85.977 81.991 1.00 0.00 H ATOM 1823 H LYS A 179 13.829 82.825 83.355 1.00 0.00 H ATOM 1824 N PHE A 180 14.503 80.211 81.396 1.00 23.59 N ATOM 1825 CA PHE A 180 15.192 79.227 80.566 1.00 25.23 C ATOM 1826 C PHE A 180 15.923 78.217 81.428 1.00 24.24 C ATOM 1827 O PHE A 180 15.912 77.016 81.136 1.00 26.70 O ATOM 1828 CB PHE A 180 16.182 79.921 79.638 1.00 24.12 C ATOM 1829 CG PHE A 180 15.563 80.519 78.408 1.00 25.60 C ATOM 1830 CD1 PHE A 180 15.261 79.716 77.322 1.00 23.23 C ATOM 1831 CD2 PHE A 180 15.305 81.877 78.330 1.00 24.34 C ATOM 1832 CE1 PHE A 180 14.708 80.248 76.174 1.00 23.97 C ATOM 1833 CE2 PHE A 180 14.744 82.434 77.193 1.00 24.18 C ATOM 1834 CZ PHE A 180 14.447 81.628 76.104 1.00 25.04 C ATOM 1835 H PHE A 180 14.806 81.206 81.381 1.00 0.00 H ATOM 1836 N ARG A 181 16.586 78.689 82.481 1.00 27.04 N ATOM 1837 CA ARG A 181 17.335 77.766 83.319 1.00 26.92 C ATOM 1838 C ARG A 181 16.402 76.827 84.061 1.00 26.15 C ATOM 1839 O ARG A 181 16.712 75.645 84.201 1.00 27.89 O ATOM 1840 CB ARG A 181 18.245 78.548 84.265 1.00 29.97 C ATOM 1841 CG ARG A 181 19.181 79.492 83.470 1.00 31.92 C ATOM 1842 CD ARG A 181 20.475 79.806 84.228 1.00 37.05 C ATOM 1843 NE ARG A 181 21.336 78.628 84.373 1.00 35.98 N ATOM 1844 CZ ARG A 181 22.294 78.524 85.289 1.00 39.78 C ATOM 1845 NH1 ARG A 181 22.515 79.539 86.149 1.00 37.86 N ATOM 1846 NH2 ARG A 181 23.021 77.412 85.356 1.00 39.34 N ATOM 1847 HE ARG A 181 21.189 77.829 83.723 1.00 0.00 H ATOM 1848 HH12 ARG A 181 23.264 79.459 86.866 1.00 0.00 H ATOM 1849 HH11 ARG A 181 21.936 80.402 86.095 1.00 0.00 H ATOM 1850 HH22 ARG A 181 23.772 77.324 86.070 1.00 0.00 H ATOM 1851 HH21 ARG A 181 22.838 76.631 84.694 1.00 0.00 H ATOM 1852 H ARG A 181 16.569 79.705 82.702 1.00 0.00 H ATOM 1853 N TYR A 182 15.242 77.324 84.518 1.00 25.95 N ATOM 1854 CA TYR A 182 14.250 76.451 85.145 1.00 24.68 C ATOM 1855 C TYR A 182 13.715 75.426 84.150 1.00 25.84 C ATOM 1856 O TYR A 182 13.603 74.240 84.468 1.00 28.57 O ATOM 1857 CB TYR A 182 13.100 77.285 85.720 1.00 27.65 C ATOM 1858 CG TYR A 182 12.029 76.460 86.395 1.00 27.98 C ATOM 1859 CD1 TYR A 182 12.199 76.004 87.702 1.00 27.80 C ATOM 1860 CD2 TYR A 182 10.845 76.142 85.734 1.00 26.55 C ATOM 1861 CE1 TYR A 182 11.206 75.241 88.339 1.00 29.35 C ATOM 1862 CE2 TYR A 182 9.852 75.404 86.356 1.00 27.57 C ATOM 1863 CZ TYR A 182 10.043 74.938 87.649 1.00 28.97 C ATOM 1864 OH TYR A 182 9.048 74.213 88.255 1.00 31.32 O ATOM 1865 HH TYR A 182 8.227 74.764 88.310 1.00 0.00 H ATOM 1866 H TYR A 182 15.046 78.341 84.425 1.00 0.00 H ATOM 1867 N ALA A 183 13.365 75.871 82.940 1.00 24.89 N ATOM 1868 CA ALA A 183 12.836 74.940 81.951 1.00 24.73 C ATOM 1869 C ALA A 183 13.811 73.814 81.683 1.00 27.64 C ATOM 1870 O ALA A 183 13.400 72.656 81.531 1.00 27.44 O ATOM 1871 CB ALA A 183 12.521 75.652 80.642 1.00 24.08 C ATOM 1872 H ALA A 183 13.470 76.879 82.704 1.00 0.00 H HETATM 1873 N MSE A 184 15.101 74.117 81.589 1.00 23.92 N HETATM 1874 CA MSE A 184 16.025 73.027 81.296 1.00 26.46 C HETATM 1875 C MSE A 184 16.009 72.016 82.438 1.00 29.79 C HETATM 1876 O MSE A 184 16.015 70.799 82.200 1.00 29.84 O HETATM 1877 CB MSE A 184 17.449 73.523 81.044 1.00 29.01 C HETATM 1878 CG MSE A 184 18.411 72.364 80.755 1.00 38.27 C HETATM 1879 SE MSE A 184 19.270 71.723 82.383 1.00 50.67 S HETATM 1880 CE MSE A 184 18.820 69.829 82.566 1.00 53.88 C HETATM 1881 H MSE A 184 15.439 75.092 81.719 1.00 0.00 H ATOM 1882 N GLU A 185 15.949 72.511 83.681 1.00 30.70 N ATOM 1883 CA GLU A 185 15.927 71.598 84.814 1.00 29.23 C ATOM 1884 C GLU A 185 14.717 70.670 84.768 1.00 29.58 C ATOM 1885 O GLU A 185 14.769 69.549 85.283 1.00 34.26 O ATOM 1886 CB GLU A 185 15.899 72.393 86.130 1.00 35.44 C ATOM 1887 CG GLU A 185 17.194 73.084 86.521 1.00 42.03 C ATOM 1888 CD GLU A 185 17.034 73.922 87.794 1.00 60.53 C ATOM 1889 OE1 GLU A 185 15.875 74.155 88.212 1.00 64.18 O ATOM 1890 OE2 GLU A 185 18.060 74.349 88.378 1.00 64.30 O ATOM 1891 H GLU A 185 15.918 73.539 83.835 1.00 0.00 H ATOM 1892 N GLN A 186 13.626 71.124 84.157 1.00 29.21 N ATOM 1893 CA GLN A 186 12.353 70.423 84.133 1.00 27.86 C ATOM 1894 C GLN A 186 12.114 69.593 82.873 1.00 28.99 C ATOM 1895 O GLN A 186 11.213 68.746 82.872 1.00 28.81 O ATOM 1896 CB GLN A 186 11.218 71.441 84.264 1.00 27.77 C ATOM 1897 CG GLN A 186 11.242 72.229 85.587 1.00 31.20 C ATOM 1898 CD GLN A 186 11.193 71.319 86.792 1.00 38.92 C ATOM 1899 OE1 GLN A 186 12.083 71.346 87.645 1.00 49.19 O ATOM 1900 NE2 GLN A 186 10.153 70.498 86.873 1.00 37.28 N ATOM 1901 HE22 GLN A 186 9.424 70.507 86.131 1.00 0.00 H ATOM 1902 HE21 GLN A 186 10.067 69.845 87.678 1.00 0.00 H ATOM 1903 H GLN A 186 13.688 72.038 83.665 1.00 0.00 H ATOM 1904 N GLU A 187 12.864 69.821 81.800 1.00 27.87 N ATOM 1905 CA GLU A 187 12.526 69.275 80.484 1.00 23.35 C ATOM 1906 C GLU A 187 13.717 68.561 79.872 1.00 21.16 C ATOM 1907 O GLU A 187 14.575 69.205 79.240 1.00 22.57 O ATOM 1908 CB GLU A 187 12.054 70.385 79.546 1.00 24.82 C ATOM 1909 CG GLU A 187 10.849 71.143 80.082 1.00 27.15 C ATOM 1910 CD GLU A 187 9.567 70.365 79.891 1.00 32.33 C ATOM 1911 OE1 GLU A 187 9.612 69.259 79.287 1.00 28.92 O ATOM 1912 OE2 GLU A 187 8.512 70.833 80.365 1.00 32.82 O ATOM 1913 H GLU A 187 13.718 70.406 81.898 1.00 0.00 H ATOM 1914 N PRO A 188 13.766 67.227 79.976 1.00 21.60 N ATOM 1915 CA PRO A 188 14.897 66.476 79.408 1.00 22.66 C ATOM 1916 C PRO A 188 15.139 66.756 77.933 1.00 22.03 C ATOM 1917 O PRO A 188 16.295 66.741 77.478 1.00 22.95 O ATOM 1918 CB PRO A 188 14.495 65.015 79.651 1.00 24.88 C ATOM 1919 CG PRO A 188 13.540 65.050 80.798 1.00 27.55 C ATOM 1920 CD PRO A 188 12.851 66.403 80.778 1.00 23.89 C ATOM 1921 N HIS A 189 14.092 67.054 77.160 1.00 24.41 N ATOM 1922 CA HIS A 189 14.320 67.284 75.729 1.00 23.01 C ATOM 1923 C HIS A 189 15.227 68.483 75.471 1.00 24.90 C ATOM 1924 O HIS A 189 15.897 68.547 74.428 1.00 22.31 O ATOM 1925 CB HIS A 189 12.997 67.467 74.986 1.00 23.07 C ATOM 1926 CG HIS A 189 13.176 67.655 73.512 1.00 23.14 C ATOM 1927 ND1 HIS A 189 13.534 66.624 72.668 1.00 27.46 N ATOM 1928 CD2 HIS A 189 13.106 68.765 72.741 1.00 26.28 C ATOM 1929 CE1 HIS A 189 13.655 67.091 71.436 1.00 29.67 C ATOM 1930 NE2 HIS A 189 13.398 68.387 71.457 1.00 25.17 N ATOM 1931 H HIS A 189 13.136 67.122 77.563 1.00 0.00 H ATOM 1932 N LEU A 190 15.280 69.441 76.400 1.00 22.97 N ATOM 1933 CA LEU A 190 16.068 70.635 76.127 1.00 22.07 C ATOM 1934 C LEU A 190 17.557 70.367 76.139 1.00 24.88 C ATOM 1935 O LEU A 190 18.318 71.225 75.684 1.00 29.62 O ATOM 1936 CB LEU A 190 15.714 71.722 77.134 1.00 19.92 C ATOM 1937 CG LEU A 190 14.310 72.280 76.930 1.00 20.56 C ATOM 1938 CD1 LEU A 190 14.054 73.311 78.038 1.00 23.09 C ATOM 1939 CD2 LEU A 190 14.117 72.923 75.515 1.00 19.42 C ATOM 1940 H LEU A 190 14.769 69.337 77.300 1.00 0.00 H HETATM 1941 N MSE A 191 18.005 69.212 76.612 1.00 27.01 N HETATM 1942 CA MSE A 191 19.423 68.914 76.502 1.00 26.72 C HETATM 1943 C MSE A 191 19.707 67.816 75.461 1.00 23.95 C HETATM 1944 O MSE A 191 20.814 67.267 75.419 1.00 21.48 O HETATM 1945 CB MSE A 191 19.988 68.532 77.867 1.00 32.44 C HETATM 1946 CG MSE A 191 19.996 69.681 78.867 1.00 30.44 C HETATM 1947 SE MSE A 191 21.089 71.208 78.310 1.00 37.43 S HETATM 1948 CE MSE A 191 22.822 70.327 78.243 1.00 31.57 C HETATM 1949 H MSE A 191 17.354 68.532 77.053 1.00 0.00 H ATOM 1950 N LYS A 192 18.720 67.508 74.616 1.00 22.37 N ATOM 1951 CA LYS A 192 18.980 66.654 73.453 1.00 21.14 C ATOM 1952 C LYS A 192 19.644 67.482 72.353 1.00 19.79 C ATOM 1953 O LYS A 192 19.501 68.719 72.308 1.00 23.18 O ATOM 1954 CB LYS A 192 17.680 66.010 72.940 1.00 22.51 C ATOM 1955 CG LYS A 192 16.945 65.084 73.951 1.00 27.51 C ATOM 1956 CD LYS A 192 15.865 64.282 73.201 1.00 34.40 C ATOM 1957 CE LYS A 192 14.696 63.794 74.053 1.00 43.39 C ATOM 1958 NZ LYS A 192 13.298 64.016 73.454 1.00 32.95 N ATOM 1959 HZ1 LYS A 192 13.145 65.033 73.302 1.00 0.00 H ATOM 1960 HZ2 LYS A 192 13.228 63.514 72.546 1.00 0.00 H ATOM 1961 HZ3 LYS A 192 12.579 63.650 74.110 1.00 0.00 H ATOM 1962 H LYS A 192 17.762 67.876 74.784 1.00 0.00 H ATOM 1963 N GLY A 193 20.427 66.802 71.500 1.00 20.17 N ATOM 1964 CA GLY A 193 21.175 67.505 70.469 1.00 17.69 C ATOM 1965 C GLY A 193 22.254 68.424 70.999 1.00 19.86 C ATOM 1966 O GLY A 193 22.611 69.399 70.325 1.00 21.40 O ATOM 1967 H GLY A 193 20.499 65.767 71.577 1.00 0.00 H ATOM 1968 N THR A 194 22.766 68.163 72.205 1.00 20.17 N ATOM 1969 CA THR A 194 23.796 69.002 72.806 1.00 19.72 C ATOM 1970 C THR A 194 25.138 68.318 72.956 1.00 20.39 C ATOM 1971 O THR A 194 26.140 69.011 73.150 1.00 20.85 O ATOM 1972 CB THR A 194 23.380 69.491 74.211 1.00 22.86 C ATOM 1973 OG1 THR A 194 23.230 68.375 75.109 1.00 21.20 O ATOM 1974 CG2 THR A 194 22.095 70.292 74.191 1.00 19.31 C ATOM 1975 HG1 THR A 194 22.533 67.764 74.761 1.00 0.00 H ATOM 1976 H THR A 194 22.419 67.336 72.731 1.00 0.00 H ATOM 1977 N TRP A 195 25.176 66.975 72.949 1.00 19.27 N ATOM 1978 CA TRP A 195 26.390 66.226 73.261 1.00 21.75 C ATOM 1979 C TRP A 195 26.912 66.530 74.664 1.00 22.84 C ATOM 1980 O TRP A 195 28.084 66.300 74.963 1.00 26.81 O ATOM 1981 CB TRP A 195 27.483 66.439 72.201 1.00 21.58 C ATOM 1982 CG TRP A 195 27.230 65.619 70.944 1.00 21.90 C ATOM 1983 CD1 TRP A 195 27.868 64.453 70.571 1.00 20.36 C ATOM 1984 CD2 TRP A 195 26.229 65.862 69.933 1.00 22.57 C ATOM 1985 NE1 TRP A 195 27.337 63.984 69.391 1.00 24.31 N ATOM 1986 CE2 TRP A 195 26.320 64.815 68.994 1.00 24.09 C ATOM 1987 CE3 TRP A 195 25.249 66.852 69.752 1.00 24.47 C ATOM 1988 CZ2 TRP A 195 25.487 64.742 67.876 1.00 23.22 C ATOM 1989 CZ3 TRP A 195 24.419 66.778 68.635 1.00 19.41 C ATOM 1990 CH2 TRP A 195 24.537 65.724 67.721 1.00 20.95 C ATOM 1991 HE1 TRP A 195 27.656 63.135 68.882 1.00 0.00 H ATOM 1992 H TRP A 195 24.310 66.450 72.713 1.00 0.00 H HETATM 1993 N MSE A 196 26.048 66.994 75.549 1.00 20.74 N HETATM 1994 CA MSE A 196 26.458 67.291 76.908 1.00 22.47 C HETATM 1995 C MSE A 196 26.167 66.100 77.795 1.00 27.60 C HETATM 1996 O MSE A 196 25.186 65.396 77.571 1.00 37.35 O HETATM 1997 CB MSE A 196 25.746 68.529 77.430 1.00 21.88 C HETATM 1998 CG MSE A 196 26.148 69.849 76.763 1.00 23.17 C HETATM 1999 SE MSE A 196 27.912 70.342 77.431 1.00 35.80 S HETATM 2000 CE MSE A 196 27.364 70.983 79.220 1.00 26.39 C HETATM 2001 H MSE A 196 25.059 67.149 75.267 1.00 0.00 H ATOM 2002 N THR A 197 27.010 65.854 78.787 1.00 26.25 N ATOM 2003 CA THR A 197 26.769 64.767 79.738 1.00 26.76 C ATOM 2004 C THR A 197 26.520 65.354 81.116 1.00 28.66 C ATOM 2005 O THR A 197 26.824 66.515 81.372 1.00 24.89 O ATOM 2006 CB THR A 197 27.958 63.801 79.799 1.00 28.20 C ATOM 2007 OG1 THR A 197 29.099 64.488 80.329 1.00 30.18 O ATOM 2008 CG2 THR A 197 28.307 63.241 78.404 1.00 28.27 C ATOM 2009 HG1 THR A 197 29.868 63.866 80.369 1.00 0.00 H ATOM 2010 H THR A 197 27.860 66.445 78.892 1.00 0.00 H ATOM 2011 N SER A 198 26.002 64.528 82.037 1.00 31.15 N ATOM 2012 CA SER A 198 25.819 64.996 83.408 1.00 30.77 C ATOM 2013 C SER A 198 27.139 65.476 83.993 1.00 28.68 C ATOM 2014 O SER A 198 27.176 66.442 84.759 1.00 29.77 O ATOM 2015 CB SER A 198 25.227 63.883 84.278 1.00 32.13 C ATOM 2016 OG SER A 198 23.994 63.414 83.758 1.00 33.48 O ATOM 2017 HG SER A 198 24.137 63.056 82.846 1.00 0.00 H ATOM 2018 H SER A 198 25.732 63.558 81.776 1.00 0.00 H ATOM 2019 N GLU A 199 28.233 64.797 83.641 1.00 28.16 N ATOM 2020 CA GLU A 199 29.552 65.153 84.142 1.00 29.63 C ATOM 2021 C GLU A 199 30.009 66.502 83.596 1.00 29.07 C ATOM 2022 O GLU A 199 30.499 67.348 84.352 1.00 26.95 O ATOM 2023 CB GLU A 199 30.534 64.040 83.783 1.00 37.92 C ATOM 2024 CG GLU A 199 31.940 64.231 84.245 1.00 44.16 C ATOM 2025 CD GLU A 199 32.865 63.152 83.697 1.00 57.82 C ATOM 2026 OE1 GLU A 199 32.351 62.147 83.146 1.00 57.40 O ATOM 2027 OE2 GLU A 199 34.103 63.316 83.815 1.00 63.09 O ATOM 2028 H GLU A 199 28.140 63.991 82.990 1.00 0.00 H ATOM 2029 N VAL A 200 29.872 66.720 82.277 1.00 24.31 N ATOM 2030 CA VAL A 200 30.294 67.995 81.700 1.00 24.82 C ATOM 2031 C VAL A 200 29.344 69.105 82.123 1.00 23.97 C ATOM 2032 O VAL A 200 29.764 70.244 82.372 1.00 25.27 O ATOM 2033 CB VAL A 200 30.410 67.873 80.164 1.00 23.05 C ATOM 2034 CG1 VAL A 200 30.843 69.185 79.555 1.00 25.54 C ATOM 2035 CG2 VAL A 200 31.405 66.805 79.808 1.00 29.28 C ATOM 2036 H VAL A 200 29.466 65.982 81.667 1.00 0.00 H ATOM 2037 N LEU A 201 28.053 68.791 82.251 1.00 28.65 N ATOM 2038 CA LEU A 201 27.099 69.792 82.726 1.00 28.11 C ATOM 2039 C LEU A 201 27.406 70.228 84.156 1.00 30.34 C ATOM 2040 O LEU A 201 27.325 71.423 84.478 1.00 29.96 O ATOM 2041 CB LEU A 201 25.670 69.257 82.614 1.00 28.42 C ATOM 2042 CG LEU A 201 24.569 70.249 82.990 1.00 33.08 C ATOM 2043 CD1 LEU A 201 24.599 71.452 82.049 1.00 30.26 C ATOM 2044 CD2 LEU A 201 23.214 69.565 82.943 1.00 36.44 C ATOM 2045 H LEU A 201 27.725 67.833 82.013 1.00 0.00 H ATOM 2046 N SER A 202 27.780 69.274 85.023 1.00 28.90 N ATOM 2047 CA SER A 202 28.182 69.609 86.382 1.00 29.84 C ATOM 2048 C SER A 202 29.378 70.551 86.374 1.00 34.30 C ATOM 2049 O SER A 202 29.404 71.553 87.100 1.00 34.14 O ATOM 2050 CB SER A 202 28.507 68.331 87.174 1.00 26.91 C ATOM 2051 OG SER A 202 29.054 68.636 88.455 1.00 29.53 O ATOM 2052 HG SER A 202 29.889 69.156 88.341 1.00 0.00 H ATOM 2053 H SER A 202 27.783 68.279 84.719 1.00 0.00 H ATOM 2054 N TRP A 203 30.400 70.217 85.590 1.00 26.09 N ATOM 2055 CA TRP A 203 31.575 71.069 85.513 1.00 30.82 C ATOM 2056 C TRP A 203 31.177 72.462 85.049 1.00 26.68 C ATOM 2057 O TRP A 203 31.580 73.470 85.641 1.00 29.11 O ATOM 2058 CB TRP A 203 32.603 70.455 84.555 1.00 28.63 C ATOM 2059 CG TRP A 203 33.902 71.170 84.580 1.00 28.78 C ATOM 2060 CD1 TRP A 203 35.005 70.829 85.287 1.00 34.22 C ATOM 2061 CD2 TRP A 203 34.225 72.383 83.890 1.00 33.70 C ATOM 2062 NE1 TRP A 203 36.007 71.747 85.077 1.00 39.47 N ATOM 2063 CE2 TRP A 203 35.554 72.707 84.218 1.00 39.84 C ATOM 2064 CE3 TRP A 203 33.525 73.209 83.012 1.00 32.38 C ATOM 2065 CZ2 TRP A 203 36.197 73.836 83.708 1.00 42.18 C ATOM 2066 CZ3 TRP A 203 34.152 74.332 82.519 1.00 35.25 C ATOM 2067 CH2 TRP A 203 35.483 74.634 82.865 1.00 34.94 C ATOM 2068 HE1 TRP A 203 36.955 71.715 85.503 1.00 0.00 H ATOM 2069 H TRP A 203 30.358 69.342 85.030 1.00 0.00 H ATOM 2070 N LEU A 204 30.369 72.527 83.985 1.00 24.41 N ATOM 2071 CA LEU A 204 29.932 73.819 83.456 1.00 25.32 C ATOM 2072 C LEU A 204 29.116 74.591 84.488 1.00 27.77 C ATOM 2073 O LEU A 204 29.356 75.788 84.729 1.00 31.72 O ATOM 2074 CB LEU A 204 29.118 73.600 82.179 1.00 26.99 C ATOM 2075 CG LEU A 204 28.404 74.861 81.684 1.00 27.18 C ATOM 2076 CD1 LEU A 204 29.420 75.917 81.270 1.00 27.39 C ATOM 2077 CD2 LEU A 204 27.450 74.520 80.551 1.00 28.01 C ATOM 2078 H LEU A 204 30.048 71.649 83.529 1.00 0.00 H ATOM 2079 N GLN A 205 28.148 73.915 85.123 1.00 32.37 N ATOM 2080 CA GLN A 205 27.280 74.610 86.069 1.00 32.25 C ATOM 2081 C GLN A 205 28.038 75.054 87.312 1.00 34.92 C ATOM 2082 O GLN A 205 27.636 76.030 87.959 1.00 35.69 O ATOM 2083 CB GLN A 205 26.073 73.735 86.425 1.00 32.45 C ATOM 2084 CG GLN A 205 25.057 73.680 85.261 1.00 34.74 C ATOM 2085 CD GLN A 205 23.789 72.909 85.592 1.00 35.22 C ATOM 2086 OE1 GLN A 205 23.807 71.969 86.390 1.00 38.21 O ATOM 2087 NE2 GLN A 205 22.679 73.298 84.959 1.00 35.31 N ATOM 2088 HE22 GLN A 205 22.712 74.097 84.294 1.00 0.00 H ATOM 2089 HE21 GLN A 205 21.781 72.802 85.131 1.00 0.00 H ATOM 2090 H GLN A 205 28.016 72.899 84.942 1.00 0.00 H ATOM 2091 N GLN A 206 29.135 74.371 87.661 1.00 35.41 N ATOM 2092 CA GLN A 206 30.030 74.901 88.687 1.00 37.24 C ATOM 2093 C GLN A 206 30.710 76.179 88.220 1.00 36.01 C ATOM 2094 O GLN A 206 30.796 77.160 88.971 1.00 39.63 O ATOM 2095 CB GLN A 206 31.081 73.865 89.067 1.00 38.25 C ATOM 2096 CG GLN A 206 30.564 72.769 89.941 1.00 33.13 C ATOM 2097 CD GLN A 206 31.703 71.997 90.556 1.00 42.28 C ATOM 2098 OE1 GLN A 206 32.449 71.321 89.853 1.00 48.23 O ATOM 2099 NE2 GLN A 206 31.879 72.136 91.858 1.00 40.36 N ATOM 2100 HE22 GLN A 206 31.220 72.719 92.412 1.00 0.00 H ATOM 2101 HE21 GLN A 206 32.676 71.662 92.328 1.00 0.00 H ATOM 2102 H GLN A 206 29.350 73.463 87.202 1.00 0.00 H ATOM 2103 N ALA A 207 31.223 76.179 86.983 1.00 34.00 N ATOM 2104 CA ALA A 207 31.868 77.375 86.448 1.00 32.23 C ATOM 2105 C ALA A 207 30.876 78.529 86.339 1.00 32.68 C ATOM 2106 O ALA A 207 31.212 79.676 86.664 1.00 39.38 O ATOM 2107 CB ALA A 207 32.494 77.062 85.083 1.00 29.30 C ATOM 2108 H ALA A 207 31.162 75.321 86.399 1.00 0.00 H ATOM 2109 N ILE A 208 29.640 78.238 85.905 1.00 33.17 N ATOM 2110 CA ILE A 208 28.598 79.269 85.810 1.00 36.10 C ATOM 2111 C ILE A 208 28.246 79.798 87.194 1.00 43.21 C ATOM 2112 O ILE A 208 28.109 81.015 87.402 1.00 39.16 O ATOM 2113 CB ILE A 208 27.342 78.713 85.115 1.00 34.87 C ATOM 2114 CG1 ILE A 208 27.624 78.353 83.660 1.00 29.13 C ATOM 2115 CG2 ILE A 208 26.169 79.718 85.255 1.00 34.23 C ATOM 2116 CD1 ILE A 208 26.489 77.576 82.994 1.00 28.60 C ATOM 2117 H ILE A 208 29.415 77.261 85.630 1.00 0.00 H ATOM 2118 N GLY A 209 28.054 78.884 88.154 1.00 38.75 N ATOM 2119 CA GLY A 209 27.698 79.304 89.498 1.00 45.35 C ATOM 2120 C GLY A 209 28.722 80.247 90.095 1.00 47.39 C ATOM 2121 O GLY A 209 28.367 81.223 90.766 1.00 53.03 O ATOM 2122 H GLY A 209 28.160 77.872 87.937 1.00 0.00 H ATOM 2123 N VAL A 210 30.009 79.984 89.841 1.00 40.85 N ATOM 2124 CA VAL A 210 31.060 80.905 90.274 1.00 44.10 C ATOM 2125 C VAL A 210 30.874 82.263 89.617 1.00 48.92 C ATOM 2126 O VAL A 210 31.000 83.308 90.269 1.00 52.66 O ATOM 2127 CB VAL A 210 32.449 80.308 89.974 1.00 44.37 C ATOM 2128 CG1 VAL A 210 33.532 81.375 90.041 1.00 39.88 C ATOM 2129 CG2 VAL A 210 32.760 79.174 90.956 1.00 45.41 C ATOM 2130 H VAL A 210 30.265 79.115 89.330 1.00 0.00 H HETATM 2131 N MSE A 211 30.548 82.269 88.325 1.00 44.64 N HETATM 2132 CA MSE A 211 30.357 83.503 87.567 1.00 45.60 C HETATM 2133 C MSE A 211 29.125 84.285 88.049 1.00 46.36 C HETATM 2134 O MSE A 211 29.174 85.494 88.167 1.00 44.04 O HETATM 2135 CB MSE A 211 30.237 83.169 86.067 1.00 45.08 C HETATM 2136 CG MSE A 211 30.444 84.344 85.105 1.00 45.95 C HETATM 2137 SE MSE A 211 30.327 83.776 83.222 1.00 50.46 S HETATM 2138 CE MSE A 211 28.557 82.929 83.262 1.00 47.09 C HETATM 2139 H MSE A 211 30.425 81.359 87.837 1.00 0.00 H HETATM 2140 N MSE A 212 28.031 83.567 88.300 1.00 51.03 N HETATM 2141 CA MSE A 212 26.754 84.164 88.699 1.00 53.24 C HETATM 2142 C MSE A 212 26.798 84.859 90.060 1.00 52.34 C HETATM 2143 O MSE A 212 26.378 86.008 90.194 1.00 52.72 O HETATM 2144 CB MSE A 212 25.657 83.094 88.728 1.00 56.98 C HETATM 2145 CG MSE A 212 25.215 82.606 87.368 1.00 59.50 C HETATM 2146 SE MSE A 212 24.504 84.054 86.291 1.00 68.35 S HETATM 2147 CE MSE A 212 23.164 84.740 87.538 1.00 71.49 C HETATM 2148 H MSE A 212 28.086 82.533 88.208 1.00 0.00 H ATOM 2149 N ARG A 213 27.288 84.145 91.076 1.00 49.75 N ATOM 2150 CA ARG A 213 27.274 84.695 92.429 1.00 54.12 C ATOM 2151 C ARG A 213 28.186 85.912 92.551 1.00 54.69 C ATOM 2152 O ARG A 213 27.901 86.817 93.346 1.00 54.45 O ATOM 2153 CB ARG A 213 27.651 83.615 93.450 1.00 54.48 C ATOM 2154 CG ARG A 213 26.551 82.546 93.611 1.00 58.13 C ATOM 2155 CD ARG A 213 26.992 81.343 94.443 1.00 61.79 C ATOM 2156 NE ARG A 213 27.362 81.718 95.805 1.00 69.93 N ATOM 2157 CZ ARG A 213 26.550 81.641 96.859 1.00 69.04 C ATOM 2158 NH1 ARG A 213 25.305 81.202 96.716 1.00 70.38 N ATOM 2159 NH2 ARG A 213 26.986 82.005 98.059 1.00 67.49 N ATOM 2160 HE ARG A 213 28.328 82.070 95.964 1.00 0.00 H ATOM 2161 HH12 ARG A 213 24.676 81.144 97.542 1.00 0.00 H ATOM 2162 HH11 ARG A 213 24.959 80.916 95.778 1.00 0.00 H ATOM 2163 HH22 ARG A 213 26.353 81.945 98.882 1.00 0.00 H ATOM 2164 HH21 ARG A 213 27.960 82.350 98.176 1.00 0.00 H ATOM 2165 H ARG A 213 27.680 83.197 90.904 1.00 0.00 H ATOM 2166 N GLN A 214 29.249 85.973 91.751 1.00 56.77 N ATOM 2167 CA GLN A 214 30.238 87.052 91.829 1.00 63.72 C ATOM 2168 C GLN A 214 29.869 88.254 90.950 1.00 66.71 C ATOM 2169 O GLN A 214 29.152 88.116 89.957 1.00 67.60 O ATOM 2170 CB GLN A 214 31.628 86.517 91.446 1.00 67.01 C ATOM 2171 CG GLN A 214 32.419 87.383 90.467 1.00 72.75 C ATOM 2172 CD GLN A 214 33.792 86.802 90.143 1.00 78.64 C ATOM 2173 OE1 GLN A 214 33.993 85.586 90.188 1.00 80.93 O ATOM 2174 NE2 GLN A 214 34.745 87.675 89.816 1.00 81.86 N ATOM 2175 HE22 GLN A 214 34.532 88.693 89.790 1.00 0.00 H ATOM 2176 HE21 GLN A 214 35.702 87.339 89.586 1.00 0.00 H ATOM 2177 H GLN A 214 29.383 85.224 91.042 1.00 0.00 H TER 2178 GLN A 214 HETATM 2179 O HOH 1 30.775 57.514 46.758 1.00 44.69 O HETATM 2180 O HOH 2 22.339 54.910 54.805 1.00 30.04 O HETATM 2181 O HOH 3 14.115 72.773 89.009 1.00 41.84 O HETATM 2182 O HOH 4 38.205 63.880 50.930 1.00 44.71 O HETATM 2183 O HOH 5 21.003 64.033 71.084 1.00 26.27 O HETATM 2184 O HOH 6 12.257 88.380 67.278 1.00 28.30 O HETATM 2185 O HOH 7 9.237 60.735 63.163 1.00 44.71 O HETATM 2186 O HOH 8 7.937 62.511 61.286 1.00 35.00 O HETATM 2187 O HOH 9 18.620 73.414 66.179 1.00 19.64 O HETATM 2188 O HOH 10 18.973 51.524 63.922 1.00 38.76 O HETATM 2189 O HOH 11 3.125 78.046 62.440 1.00 46.40 O HETATM 2190 O HOH 12 5.236 81.508 74.977 1.00 46.45 O HETATM 2191 O HOH 13 7.496 74.991 67.575 1.00 23.56 O HETATM 2192 O HOH 14 22.652 65.517 73.523 1.00 28.10 O HETATM 2193 O HOH 15 19.277 75.424 52.759 1.00 27.13 O HETATM 2194 O HOH 16 15.719 58.370 49.600 1.00 40.82 O HETATM 2195 O HOH 17 42.798 56.617 59.287 1.00 47.73 O HETATM 2196 O HOH 18 39.380 69.463 58.324 1.00 43.94 O HETATM 2197 O HOH 19 31.211 62.962 80.363 1.00 35.27 O HETATM 2198 O HOH 20 31.835 69.111 88.606 1.00 32.84 O HETATM 2199 O HOH 21 40.203 71.146 89.729 1.00 43.22 O HETATM 2200 O HOH 22 18.708 67.794 49.746 1.00 29.51 O HETATM 2201 O HOH 23 24.554 53.688 67.492 1.00 33.15 O HETATM 2202 O HOH 24 23.078 87.092 69.094 1.00 25.92 O HETATM 2203 O HOH 25 30.801 67.441 50.803 1.00 38.67 O HETATM 2204 O HOH 26 30.149 72.009 57.309 1.00 23.76 O HETATM 2205 O HOH 27 7.660 72.205 84.488 1.00 38.37 O HETATM 2206 O HOH 28 19.701 63.247 49.334 1.00 32.91 O HETATM 2207 O HOH 29 27.844 69.540 70.355 1.00 27.60 O HETATM 2208 O HOH 30 33.427 51.331 64.428 1.00 34.94 O HETATM 2209 O HOH 31 17.098 69.323 80.146 1.00 29.67 O HETATM 2210 O HOH 32 18.017 64.837 78.231 1.00 35.69 O HETATM 2211 O HOH 33 24.920 67.130 86.024 1.00 31.61 O HETATM 2212 O HOH 34 36.726 67.104 65.124 1.00 48.71 O HETATM 2213 O HOH 35 23.066 80.501 71.173 1.00 22.94 O HETATM 2214 O HOH 36 25.655 87.264 73.479 1.00 28.94 O HETATM 2215 O HOH 37 26.697 66.486 52.484 1.00 29.85 O HETATM 2216 O HOH 38 6.172 83.106 81.499 1.00 28.22 O HETATM 2217 O HOH 39 19.422 72.896 70.521 1.00 22.19 O HETATM 2218 O HOH 40 3.954 74.666 72.651 1.00 46.03 O HETATM 2219 O HOH 41 5.780 84.834 69.931 1.00 34.67 O HETATM 2220 O HOH 42 22.674 49.007 64.435 1.00 42.28 O HETATM 2221 O HOH 43 29.474 82.709 97.243 1.00 45.00 O HETATM 2222 O HOH 44 25.020 73.459 49.324 1.00 29.68 O HETATM 2223 O HOH 45 6.844 77.568 50.608 1.00 38.17 O HETATM 2224 O HOH 46 10.253 89.971 71.150 1.00 32.55 O HETATM 2225 O HOH 47 13.248 89.338 78.005 1.00 32.93 O HETATM 2226 O HOH 48 8.404 61.827 58.824 1.00 22.94 O HETATM 2227 O HOH 49 33.188 83.832 67.947 1.00 27.98 O HETATM 2228 O HOH 50 5.220 73.558 66.490 1.00 39.80 O HETATM 2229 O HOH 51 22.219 82.306 69.241 1.00 18.43 O HETATM 2230 O HOH 52 12.316 91.342 85.506 1.00 43.81 O HETATM 2231 O HOH 53 9.118 69.134 71.173 1.00 33.02 O HETATM 2232 O HOH 54 10.258 73.226 54.037 1.00 30.83 O HETATM 2233 O HOH 55 7.320 83.695 67.697 1.00 27.89 O HETATM 2234 O HOH 56 31.266 74.992 66.630 1.00 21.83 O HETATM 2235 O HOH 57 22.580 45.161 63.750 1.00 37.05 O HETATM 2236 O HOH 58 19.409 74.745 73.009 1.00 23.33 O HETATM 2237 O HOH 59 17.525 81.945 61.096 1.00 37.31 O HETATM 2238 O HOH 60 25.463 44.670 59.461 1.00 41.90 O HETATM 2239 O HOH 61 20.931 88.062 70.630 1.00 29.56 O HETATM 2240 O HOH 62 27.120 70.777 58.626 1.00 34.46 O HETATM 2241 O HOH 63 11.865 72.641 51.046 1.00 32.11 O HETATM 2242 O HOH 64 14.280 56.723 63.697 1.00 42.93 O HETATM 2243 O HOH 65 23.729 69.897 48.055 1.00 28.54 O HETATM 2244 O HOH 66 11.102 78.651 62.231 1.00 23.49 O HETATM 2245 O HOH 67 30.063 86.425 78.400 1.00 33.82 O HETATM 2246 O HOH 68 20.439 59.607 71.525 1.00 39.93 O HETATM 2247 O HOH 69 21.950 73.858 59.522 1.00 21.69 O HETATM 2248 O HOH 70 24.490 83.104 62.316 1.00 20.70 O HETATM 2249 O HOH 71 19.394 88.024 64.431 1.00 29.70 O HETATM 2250 O HOH 72 10.472 61.632 67.300 1.00 30.70 O HETATM 2251 O HOH 73 11.273 67.540 77.864 1.00 25.66 O HETATM 2252 O HOH 74 20.663 69.610 62.251 1.00 20.88 O HETATM 2253 O HOH 75 10.253 66.393 70.074 1.00 32.59 O HETATM 2254 O HOH 76 16.096 88.171 77.947 1.00 27.44 O HETATM 2255 O HOH 77 21.372 89.058 73.512 1.00 29.16 O HETATM 2256 O HOH 78 14.330 82.084 62.980 1.00 24.16 O HETATM 2257 O HOH 79 35.215 73.127 50.775 1.00 37.01 O HETATM 2258 O HOH 80 7.278 78.718 63.724 1.00 31.84 O HETATM 2259 O HOH 81 16.730 83.441 62.775 1.00 37.67 O HETATM 2260 O HOH 82 32.463 78.258 70.332 1.00 24.84 O HETATM 2261 O HOH 83 36.809 73.078 70.210 1.00 40.17 O HETATM 2262 O HOH 84 28.381 56.184 55.102 1.00 44.38 O HETATM 2263 O HOH 85 13.899 85.687 75.350 1.00 21.45 O HETATM 2264 O HOH 86 39.168 73.241 77.298 1.00 41.22 O HETATM 2265 O HOH 87 25.203 61.982 81.074 1.00 33.74 O HETATM 2266 O HOH 88 3.965 64.784 54.901 1.00 44.15 O HETATM 2267 O HOH 89 20.979 57.275 53.486 1.00 34.06 O HETATM 2268 O HOH 90 15.452 91.468 68.399 1.00 27.50 O HETATM 2269 O HOH 91 36.800 67.185 73.655 1.00 42.64 O HETATM 2270 O HOH 92 19.459 75.052 84.613 1.00 28.12 O HETATM 2271 O HOH 93 24.025 72.422 56.325 1.00 21.36 O HETATM 2272 O HOH 94 29.272 71.145 50.754 1.00 37.10 O HETATM 2273 O HOH 95 16.356 76.343 78.408 1.00 25.95 O HETATM 2274 O HOH 96 34.143 63.398 74.899 1.00 40.23 O HETATM 2275 O HOH 97 24.838 69.515 87.413 1.00 38.04 O HETATM 2276 O HOH 98 16.308 64.264 70.076 1.00 33.19 O HETATM 2277 O HOH 99 19.776 69.382 48.107 1.00 39.38 O HETATM 2278 O HOH 100 20.856 71.941 66.146 1.00 22.15 O HETATM 2279 O HOH 101 11.835 83.718 86.028 1.00 31.82 O HETATM 2280 O HOH 102 2.428 86.212 76.413 1.00 52.22 O HETATM 2281 O HOH 103 37.872 78.985 76.026 1.00 41.34 O HETATM 2282 O HOH 104 16.951 49.385 60.879 1.00 37.65 O HETATM 2283 O HOH 105 30.802 71.631 63.995 1.00 29.48 O HETATM 2284 O HOH 106 12.730 63.987 76.270 1.00 33.39 O HETATM 2285 O HOH 107 26.118 53.940 69.519 1.00 26.35 O HETATM 2286 O HOH 108 29.531 46.919 67.474 1.00 37.56 O HETATM 2287 O HOH 109 17.161 73.948 52.992 1.00 37.17 O HETATM 2288 O HOH 110 30.921 82.253 73.141 1.00 27.18 O HETATM 2289 O HOH 111 8.003 65.447 48.486 1.00 34.88 O HETATM 2290 O HOH 112 21.402 71.742 69.073 1.00 21.74 O HETATM 2291 O HOH 113 27.093 51.588 60.820 1.00 34.41 O HETATM 2292 O HOH 114 31.172 86.758 72.390 1.00 32.05 O HETATM 2293 O HOH 115 24.852 77.035 87.608 1.00 32.06 O HETATM 2294 O HOH 116 42.957 59.906 58.598 1.00 47.50 O HETATM 2295 O HOH 117 32.539 80.554 71.859 1.00 30.74 O HETATM 2296 O HOH 118 6.547 74.011 86.727 1.00 55.44 O HETATM 2297 O HOH 119 4.935 80.381 68.720 1.00 48.11 O HETATM 2298 O HOH 120 9.144 89.686 78.758 1.00 39.52 O HETATM 2299 O HOH 121 32.648 55.987 72.806 1.00 29.37 O HETATM 2300 O HOH 122 33.286 79.195 67.987 1.00 33.46 O HETATM 2301 O HOH 123 20.992 78.569 70.336 1.00 22.43 O HETATM 2302 O HOH 124 36.481 70.789 56.155 1.00 30.78 O HETATM 2303 O HOH 125 35.845 72.015 62.794 1.00 38.79 O HETATM 2304 O HOH 126 14.516 50.624 60.282 1.00 50.16 O HETATM 2305 O HOH 127 17.702 91.167 75.739 1.00 31.04 O HETATM 2306 O HOH 128 17.665 87.900 62.570 1.00 41.49 O HETATM 2307 O HOH 129 15.947 58.035 67.030 1.00 38.66 O HETATM 2308 O HOH 130 29.151 65.747 49.025 1.00 34.68 O HETATM 2309 O HOH 131 14.593 91.098 85.159 1.00 46.51 O HETATM 2310 O HOH 132 6.131 66.273 67.186 1.00 33.33 O HETATM 2311 O HOH 133 15.369 67.462 83.122 1.00 44.52 O HETATM 2312 O HOH 134 27.480 49.897 67.515 1.00 37.33 O HETATM 2313 O HOH 135 2.203 66.911 61.220 1.00 40.27 O HETATM 2314 O HOH 136 45.267 55.938 65.515 1.00 46.17 O HETATM 2315 O HOH 137 40.850 64.799 60.314 1.00 48.30 O HETATM 2316 O HOH 138 39.050 66.672 67.066 1.00 50.55 O HETATM 2317 O HOH 139 22.018 89.944 66.278 1.00 32.69 O HETATM 2318 O HOH 140 33.500 54.382 51.556 1.00 49.71 O HETATM 2319 O HOH 141 10.283 64.535 72.190 1.00 42.18 O HETATM 2320 O HOH 142 27.829 79.670 100.255 1.00 49.42 O HETATM 2321 O HOH 143 37.804 62.066 48.203 1.00 45.66 O HETATM 2322 O HOH 144 21.238 51.716 64.669 1.00 41.43 O HETATM 2323 O HOH 145 3.849 63.549 63.445 1.00 48.75 O HETATM 2324 O HOH 146 22.748 66.530 84.643 1.00 45.42 O HETATM 2325 O HOH 147 39.467 66.850 51.265 1.00 45.97 O HETATM 2326 O HOH 148 17.960 62.651 45.389 1.00 50.67 O HETATM 2327 O HOH 149 18.159 65.316 48.666 1.00 31.30 O HETATM 2328 O HOH 150 3.901 83.316 80.356 1.00 45.65 O HETATM 2329 O HOH 151 19.711 69.977 64.753 1.00 24.30 O HETATM 2330 O HOH 152 32.472 68.735 48.900 1.00 48.76 O HETATM 2331 O HOH 153 12.750 90.434 69.041 1.00 35.24 O HETATM 2332 O HOH 154 20.101 90.548 69.999 1.00 33.77 O HETATM 2333 O HOH 155 25.594 72.918 89.664 1.00 39.09 O HETATM 2334 O HOH 156 33.975 82.550 70.638 1.00 37.61 O HETATM 2335 O HOH 157 7.956 65.327 68.704 1.00 40.39 O HETATM 2336 O HOH 158 13.563 88.339 75.448 1.00 28.08 O HETATM 2337 O HOH 159 28.548 72.467 54.969 1.00 22.50 O HETATM 2338 O HOH 160 32.574 84.630 73.645 1.00 33.04 O HETATM 2339 O HOH 161 41.866 51.056 68.286 1.00 43.95 O HETATM 2340 O HOH 162 19.775 91.236 73.896 1.00 41.88 O HETATM 2341 O HOH 163 39.115 70.389 50.437 1.00 41.88 O HETATM 2342 O HOH 164 18.617 92.519 66.139 1.00 38.84 O HETATM 2343 O HOH 165 21.647 78.740 57.875 1.00 36.09 O HETATM 2344 O HOH 166 19.403 77.333 72.316 1.00 26.78 O HETATM 2345 O HOH 167 15.732 43.044 58.590 1.00 47.93 O HETATM 2346 O HOH 168 20.547 91.798 67.599 1.00 37.68 O HETATM 2347 O HOH 169 16.748 92.991 70.268 1.00 41.77 O HETATM 2348 O HOH 170 5.394 61.757 62.254 1.00 47.13 O HETATM 2349 O HOH 171 26.392 71.065 55.853 1.00 23.71 O HETATM 2350 O HOH 172 27.727 69.676 49.051 1.00 41.17 O HETATM 2351 O HOH 173 13.976 61.957 77.379 1.00 31.46 O HETATM 2352 O HOH 174 8.173 62.646 68.553 1.00 41.55 O HETATM 2353 O HOH 175 16.518 73.939 50.602 1.00 37.20 O HETATM 2354 O HOH 176 15.354 90.483 75.071 1.00 40.65 O HETATM 2355 O HOH 177 4.999 68.883 68.103 1.00 42.56 O HETATM 2356 O HOH 178 16.085 61.815 78.351 1.00 39.33 O HETATM 2357 O HOH 179 3.458 78.594 70.596 1.00 50.78 O HETATM 2358 O HOH 180 12.737 61.675 79.602 1.00 34.00 O HETATM 2359 N BWH A 181 24.579 63.426 59.490 1.00 -0.23 N HETATM 2360 C10 BWH A 181 24.644 64.707 60.066 1.00 0.07 C HETATM 2361 C11 BWH A 181 25.801 65.427 60.337 1.00 -0.04 C HETATM 2362 C12 BWH A 181 25.715 66.698 60.879 1.00 -0.06 C HETATM 2363 C13 BWH A 181 24.475 67.270 61.156 1.00 0.03 C HETATM 2364 C14 BWH A 181 23.326 66.552 60.849 1.00 -0.06 C HETATM 2365 C15 BWH A 181 23.407 65.284 60.318 1.00 -0.04 C HETATM 2366 H9 BWH A 181 22.500 64.734 60.096 1.00 0.05 H HETATM 2367 H8 BWH A 181 22.354 66.996 61.030 1.00 0.06 H HETATM 2368 C16 BWH A 181 24.307 68.583 61.840 1.00 0.20 C HETATM 2369 N1 BWH A 181 25.269 69.495 61.614 1.00 -0.26 N HETATM 2370 C17 BWH A 181 25.255 70.832 62.178 1.00 0.16 C HETATM 2371 C18 BWH A 181 23.966 71.602 61.792 1.00 0.11 C HETATM 2372 C19 BWH A 181 23.047 72.009 62.867 1.00 0.09 C HETATM 2373 N2 BWH A 181 22.375 72.319 63.756 1.00 -0.30 N HETATM 2374 H11 BWH A 181 23.397 70.960 61.103 1.00 0.06 H HETATM 2375 H12 BWH A 181 24.278 72.517 61.267 1.00 0.06 H HETATM 2376 C20 BWH A 181 25.528 70.780 63.686 1.00 0.23 C HETATM 2377 N3 BWH A 181 24.665 71.480 64.393 1.00 -0.23 N HETATM 2378 C21 BWH A 181 24.527 71.536 65.781 1.00 0.07 C HETATM 2379 C22 BWH A 181 24.334 72.764 66.382 1.00 -0.04 C HETATM 2380 C23 BWH A 181 24.330 72.865 67.759 1.00 -0.06 C HETATM 2381 C24 BWH A 181 24.588 71.741 68.539 1.00 0.04 C HETATM 2382 C25 BWH A 181 24.638 70.494 67.929 1.00 -0.06 C HETATM 2383 C26 BWH A 181 24.635 70.391 66.555 1.00 -0.04 C HETATM 2384 H17 BWH A 181 24.717 69.419 66.082 1.00 0.05 H HETATM 2385 H16 BWH A 181 24.680 69.597 68.537 1.00 0.06 H HETATM 2386 C27 BWH A 181 24.880 71.865 69.986 1.00 0.22 C HETATM 2387 N4 BWH A 181 24.020 72.650 70.680 1.00 -0.24 N HETATM 2388 C28 BWH A 181 24.018 72.872 72.072 1.00 0.09 C HETATM 2389 C29 BWH A 181 22.923 73.578 72.587 1.00 0.14 C HETATM 2390 C30 BWH A 181 22.843 73.816 73.952 1.00 0.13 C HETATM 2391 C31 BWH A 181 23.865 73.363 74.824 1.00 0.06 C HETATM 2392 C32 BWH A 181 24.955 72.676 74.288 1.00 -0.07 C HETATM 2393 C33 BWH A 181 25.031 72.435 72.926 1.00 -0.05 C HETATM 2394 H19 BWH A 181 25.884 71.903 72.521 1.00 0.04 H HETATM 2395 H18 BWH A 181 25.747 72.329 74.942 1.00 0.05 H HETATM 2396 C34 BWH A 181 23.891 73.602 76.298 1.00 0.21 C HETATM 2397 N5 BWH A 181 22.846 74.294 76.798 1.00 -0.24 N HETATM 2398 C35 BWH A 181 22.645 74.666 78.153 1.00 0.09 C HETATM 2399 C36 BWH A 181 21.476 75.374 78.449 1.00 0.14 C HETATM 2400 C37 BWH A 181 21.210 75.744 79.761 1.00 0.12 C HETATM 2401 C38 BWH A 181 22.107 75.404 80.796 1.00 0.02 C HETATM 2402 C39 BWH A 181 23.265 74.701 80.481 1.00 -0.08 C HETATM 2403 C40 BWH A 181 23.534 74.343 79.173 1.00 -0.06 C HETATM 2404 H22 BWH A 181 24.446 73.806 78.940 1.00 0.04 H HETATM 2405 H20 BWH A 181 23.962 74.432 81.267 1.00 0.05 H HETATM 2406 C41 BWH A 181 21.824 75.800 82.214 1.00 0.05 C HETATM 2407 O6 BWH A 181 22.617 75.535 83.104 1.00 -0.57 O HETATM 2408 O7 BWH A 181 20.710 76.441 82.411 1.00 -0.57 O HETATM 2409 O8 BWH A 181 20.086 76.458 79.984 1.00 -0.34 O HETATM 2410 H37 BWH A 181 19.622 76.580 79.164 1.00 0.24 H HETATM 2411 O9 BWH A 181 20.600 75.669 77.423 1.00 -0.33 O HETATM 2412 C42 BWH A 181 19.604 74.672 77.187 1.00 0.05 C HETATM 2413 H23 BWH A 181 18.956 74.991 76.358 1.00 0.06 H HETATM 2414 H24 BWH A 181 18.998 74.537 78.095 1.00 0.06 H HETATM 2415 H25 BWH A 181 20.092 73.721 76.927 1.00 0.06 H HETATM 2416 H35 BWH A 181 22.140 74.574 76.147 1.00 0.22 H HETATM 2417 O5 BWH A 181 24.829 73.200 76.977 1.00 -0.39 O HETATM 2418 O10 BWH A 181 21.759 74.472 74.430 1.00 -0.34 O HETATM 2419 H36 BWH A 181 21.184 74.698 73.709 1.00 0.25 H HETATM 2420 O11 BWH A 181 21.953 74.000 71.696 1.00 -0.33 O HETATM 2421 C43 BWH A 181 22.043 75.386 71.326 1.00 0.05 C HETATM 2422 H26 BWH A 181 21.236 75.630 70.619 1.00 0.06 H HETATM 2423 H27 BWH A 181 23.017 75.576 70.851 1.00 0.06 H HETATM 2424 H28 BWH A 181 21.945 76.013 72.225 1.00 0.06 H HETATM 2425 H34 BWH A 181 23.314 73.120 70.150 1.00 0.22 H HETATM 2426 O4 BWH A 181 25.856 71.303 70.474 1.00 -0.38 O HETATM 2427 H15 BWH A 181 24.126 73.819 68.232 1.00 0.06 H HETATM 2428 H14 BWH A 181 24.186 73.648 65.773 1.00 0.05 H HETATM 2429 H33 BWH A 181 24.027 72.043 63.868 1.00 0.23 H HETATM 2430 O3 BWH A 181 26.446 70.134 64.177 1.00 -0.38 O HETATM 2431 H10 BWH A 181 26.093 71.383 61.726 1.00 0.08 H HETATM 2432 H32 BWH A 181 26.035 69.238 61.025 1.00 0.19 H HETATM 2433 O2 BWH A 181 23.316 68.813 62.538 1.00 -0.39 O HETATM 2434 H7 BWH A 181 26.621 67.254 61.090 1.00 0.06 H HETATM 2435 H6 BWH A 181 26.771 64.993 60.124 1.00 0.05 H HETATM 2436 C9 BWH A 181 25.552 62.703 58.955 1.00 0.23 C HETATM 2437 C1 BWH A 181 25.111 61.344 58.629 1.00 0.03 C HETATM 2438 C BWH A 181 23.717 61.086 59.095 1.00 -0.02 C HETATM 2439 H2 BWH A 181 23.427 60.058 58.831 1.00 0.04 H HETATM 2440 H3 BWH A 181 23.031 61.797 58.611 1.00 0.04 H HETATM 2441 H4 BWH A 181 23.666 61.213 60.187 1.00 0.04 H HETATM 2442 C2 BWH A 181 25.825 60.447 57.948 1.00 -0.05 C HETATM 2443 C3 BWH A 181 25.339 59.129 57.505 1.00 -0.04 C HETATM 2444 C4 BWH A 181 26.175 58.026 57.624 1.00 -0.06 C HETATM 2445 C5 BWH A 181 25.827 56.799 57.090 1.00 -0.03 C HETATM 2446 C6 BWH A 181 24.621 56.649 56.424 1.00 0.09 C HETATM 2447 O BWH A 181 24.308 55.448 55.835 1.00 -0.33 O HETATM 2448 H5 BWH A 181 23.454 55.511 55.424 1.00 0.25 H HETATM 2449 C7 BWH A 181 23.754 57.725 56.324 1.00 -0.03 C HETATM 2450 C8 BWH A 181 24.108 58.948 56.867 1.00 -0.06 C HETATM 2451 H31 BWH A 181 23.418 59.781 56.796 1.00 0.06 H HETATM 2452 H30 BWH A 181 22.800 57.609 55.822 1.00 0.05 H HETATM 2453 H29 BWH A 181 26.498 55.954 57.192 1.00 0.05 H HETATM 2454 H21 BWH A 181 27.119 58.129 58.146 1.00 0.06 H HETATM 2455 H13 BWH A 181 26.852 60.711 57.699 1.00 0.06 H HETATM 2456 O1 BWH A 181 26.692 63.115 58.715 1.00 -0.37 O HETATM 2457 H1 BWH A 181 23.673 63.002 59.483 1.00 0.23 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 14 3 15 22 CONECT 15 14 16 18 CONECT 16 15 17 23 CONECT 17 16 CONECT 18 15 19 CONECT 19 18 20 CONECT 20 19 21 CONECT 21 20 CONECT 22 14 CONECT 404 397 405 412 CONECT 405 404 406 408 CONECT 406 405 407 413 CONECT 407 406 CONECT 408 405 409 CONECT 409 408 410 CONECT 410 409 411 CONECT 411 410 CONECT 412 404 CONECT 586 572 587 594 CONECT 587 586 588 590 CONECT 588 587 589 595 CONECT 589 588 CONECT 590 587 591 CONECT 591 590 592 CONECT 592 591 593 CONECT 593 592 CONECT 594 586 CONECT 788 780 789 796 CONECT 789 788 790 792 CONECT 790 789 791 797 CONECT 791 790 CONECT 792 789 793 CONECT 793 792 794 CONECT 794 793 795 CONECT 795 794 CONECT 796 788 CONECT 849 839 850 857 CONECT 850 849 851 853 CONECT 851 850 852 858 CONECT 852 851 CONECT 853 850 854 CONECT 854 853 855 CONECT 855 854 856 CONECT 856 855 CONECT 857 849 CONECT 945 937 946 953 CONECT 946 945 947 949 CONECT 947 946 948 954 CONECT 948 947 CONECT 949 946 950 CONECT 950 949 951 CONECT 951 950 952 CONECT 952 951 CONECT 953 945 CONECT 1334 1327 1335 1342 CONECT 1335 1334 1336 1338 CONECT 1336 1335 1337 1343 CONECT 1337 1336 CONECT 1338 1335 1339 CONECT 1339 1338 1340 CONECT 1340 1339 1341 CONECT 1341 1340 CONECT 1342 1334 CONECT 1873 1869 1874 1881 CONECT 1874 1873 1875 1877 CONECT 1875 1874 1876 1882 CONECT 1876 1875 CONECT 1877 1874 1878 CONECT 1878 1877 1879 CONECT 1879 1878 1880 CONECT 1880 1879 CONECT 1881 1873 CONECT 1941 1934 1942 1949 CONECT 1942 1941 1943 1945 CONECT 1943 1942 1944 1950 CONECT 1944 1943 CONECT 1945 1942 1946 CONECT 1946 1945 1947 CONECT 1947 1946 1948 CONECT 1948 1947 CONECT 1949 1941 CONECT 1993 1979 1994 2001 CONECT 1994 1993 1995 1997 CONECT 1995 1994 1996 2002 CONECT 1996 1995 CONECT 1997 1994 1998 CONECT 1998 1997 1999 CONECT 1999 1998 2000 CONECT 2000 1999 CONECT 2001 1993 CONECT 2131 2125 2132 2139 CONECT 2132 2131 2133 2135 CONECT 2133 2132 2134 2140 CONECT 2134 2133 CONECT 2135 2132 2136 CONECT 2136 2135 2137 CONECT 2137 2136 2138 CONECT 2138 2137 CONECT 2139 2131 CONECT 2140 2133 2141 2148 CONECT 2141 2140 2142 2144 CONECT 2142 2141 2143 2149 CONECT 2143 2142 CONECT 2144 2141 2145 CONECT 2145 2144 2146 CONECT 2146 2145 2147 CONECT 2147 2146 CONECT 2148 2140 CONECT 2359 2360 2436 2457 CONECT 2360 2359 2361 2365 CONECT 2361 2360 2362 2435 CONECT 2362 2361 2363 2434 CONECT 2363 2362 2364 2368 CONECT 2364 2363 2365 2367 CONECT 2365 2360 2364 2366 CONECT 2366 2365 CONECT 2367 2364 CONECT 2368 2363 2369 2433 CONECT 2369 2368 2370 2432 CONECT 2370 2369 2371 2376 2431 CONECT 2371 2370 2372 2374 2375 CONECT 2372 2371 2373 CONECT 2373 2372 CONECT 2374 2371 CONECT 2375 2371 CONECT 2376 2370 2377 2430 CONECT 2377 2376 2378 2429 CONECT 2378 2377 2379 2383 CONECT 2379 2378 2380 2428 CONECT 2380 2379 2381 2427 CONECT 2381 2380 2382 2386 CONECT 2382 2381 2383 2385 CONECT 2383 2378 2382 2384 CONECT 2384 2383 CONECT 2385 2382 CONECT 2386 2381 2387 2426 CONECT 2387 2386 2388 2425 CONECT 2388 2387 2389 2393 CONECT 2389 2388 2390 2420 CONECT 2390 2389 2391 2418 CONECT 2391 2390 2392 2396 CONECT 2392 2391 2393 2395 CONECT 2393 2388 2392 2394 CONECT 2394 2393 CONECT 2395 2392 CONECT 2396 2391 2397 2417 CONECT 2397 2396 2398 2416 CONECT 2398 2397 2399 2403 CONECT 2399 2398 2400 2411 CONECT 2400 2399 2401 2409 CONECT 2401 2400 2402 2406 CONECT 2402 2401 2403 2405 CONECT 2403 2398 2402 2404 CONECT 2404 2403 CONECT 2405 2402 CONECT 2406 2401 2407 2408 CONECT 2407 2406 CONECT 2408 2406 CONECT 2409 2400 2410 CONECT 2410 2409 CONECT 2411 2399 2412 CONECT 2412 2411 2413 2414 2415 CONECT 2413 2412 CONECT 2414 2412 CONECT 2415 2412 CONECT 2416 2397 CONECT 2417 2396 CONECT 2418 2390 2419 CONECT 2419 2418 CONECT 2420 2389 2421 CONECT 2421 2420 2422 2423 2424 CONECT 2422 2421 CONECT 2423 2421 CONECT 2424 2421 CONECT 2425 2387 CONECT 2426 2386 CONECT 2427 2380 CONECT 2428 2379 CONECT 2429 2377 CONECT 2430 2376 CONECT 2431 2370 CONECT 2432 2369 CONECT 2433 2368 CONECT 2434 2362 CONECT 2435 2361 CONECT 2436 2359 2437 2456 CONECT 2437 2436 2438 2442 CONECT 2438 2437 2439 2440 2441 CONECT 2439 2438 CONECT 2440 2438 CONECT 2441 2438 CONECT 2442 2437 2443 2455 CONECT 2443 2442 2444 2450 CONECT 2444 2443 2445 2454 CONECT 2445 2444 2446 2453 CONECT 2446 2445 2447 2449 CONECT 2447 2446 2448 CONECT 2448 2447 CONECT 2449 2446 2450 2452 CONECT 2450 2443 2449 2451 CONECT 2451 2450 CONECT 2452 2449 CONECT 2453 2445 CONECT 2454 2444 CONECT 2455 2442 CONECT 2456 2436 CONECT 2457 2359 MASTER 0 0 0 0 0 0 0 0 2456 1 211 17 END
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Structure:
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Related entries of code: 6et8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6h96
RCSB PDB
PDBbind
226aa, >6H96_1|Chains... *
6hai
RCSB PDB
PDBbind
226aa, >6HAI_1|Chains... at 99%
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
6et8
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Albicidin resistance protein
Ligand Name
BWH
EC.Number
E.C.-.-.-.-
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Kd=5.6nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Nat Commun Vol. 9: pp. 3095-3095
Ligand Properties
Formula
C
4
4
H
3
8
N
6
O
1
2
Molecular Weight
842.806
Exact Mass
842.255
No. of atoms
100
No. of bonds
104
Polar Surface Area
285.74
LOGP Value
5.72 (
Computed with XLOGP3
)
6.40 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 22
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 5
Canonical SMILES
N#CC[C@@H](C(=O)Nc1ccc(cc1)C(=O)Nc1ccc(c(c1OC)O)C(=O)Nc1ccc(c(c1OC)O)C(=O)O)NC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccc(cc1)O)/C
InChI String
InChI=1S/C44H38N6O12/c1-23(22-24-4-14-29(51)15-5-24)39(54)46-27-10-6-26(7-11-27)41(56)50-34(20-21-45)43(58)47-28-12-8-25(9-13-28)40(55)48-32-18-16-30(35(52)37(32)61-2)42(57)49-33-19-17-31(44(59)60)36(53)38(33)62-3/h4-19,22,34,51-53H,20H2,1-3H3,(H,46,54)(H,47,58)(H,48,55)(H,49,57)(H,50,56)(H,59,60)/b23-22+/t34-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8KRS7
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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