Browse entries in the PDBbind-CN Database
HEADER 1VYG_COMPLEX COMPND 1VYG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 135 GLY SER MET SER SER PHE LEU GLY LYS TRP LYS LEU SER SEQRES 2 A 135 GLU SER HIS ASN PHE ASP ALA VAL MET SER LYS LEU GLY SEQRES 3 A 135 VAL SER TRP ALA THR ARG GLN ILE GLY ASN THR VAL THR SEQRES 4 A 135 PRO THR VAL THR PHE THR MET ASP GLY ASP LYS MET THR SEQRES 5 A 135 MET LEU THR GLU SER THR PHE LYS ASN LEU SER CYS THR SEQRES 6 A 135 PHE LYS PHE GLY GLU GLU PHE ASP GLU LYS THR SER ASP SEQRES 7 A 135 GLY ARG ASN VAL LYS SER VAL VAL GLU LYS ASN SER GLU SEQRES 8 A 135 SER LYS LEU THR GLN THR GLN VAL ASP PRO LYS ASN THR SEQRES 9 A 135 THR VAL ILE VAL ARG GLU VAL ASP GLY ASP THR MET LYS SEQRES 10 A 135 THR THR VAL THR VAL GLY ASP VAL THR ALA ILE ARG ASN SEQRES 11 A 135 TYR LYS ARG LEU SER HET ACD A 212 53 ATOM 1 N GLY A -1 37.324 38.690 10.007 1.00 72.01 N ATOM 2 CA GLY A -1 37.584 38.242 11.406 1.00 72.08 C ATOM 3 C GLY A -1 36.291 37.945 12.139 1.00 72.15 C ATOM 4 O GLY A -1 35.286 38.627 11.915 1.00 72.13 O ATOM 5 HA3 GLY A -1 38.121 39.028 11.937 1.00 0.00 H ATOM 6 HA2 GLY A -1 38.194 37.339 11.382 1.00 0.00 H ATOM 7 HN3 GLY A -1 36.746 39.555 10.023 1.00 0.00 H ATOM 8 HN2 GLY A -1 36.816 37.942 9.493 1.00 0.00 H ATOM 9 HN1 GLY A -1 38.229 38.885 9.533 1.00 0.00 H ATOM 10 N SER A 0 36.325 36.945 13.025 1.00 72.14 N ATOM 11 CA SER A 0 35.117 36.423 13.681 1.00 72.06 C ATOM 12 C SER A 0 33.918 36.503 12.729 1.00 71.73 C ATOM 13 O SER A 0 33.204 37.505 12.718 1.00 72.42 O ATOM 14 CB SER A 0 34.828 37.159 15.006 1.00 72.13 C ATOM 15 OG SER A 0 33.791 36.520 15.752 1.00 71.56 O ATOM 16 HA SER A 0 35.292 35.376 13.928 1.00 0.00 H ATOM 17 HB2 SER A 0 34.524 38.182 14.783 1.00 0.00 H ATOM 18 HB3 SER A 0 35.737 37.175 15.607 1.00 0.00 H ATOM 19 HG SER A 0 33.635 37.019 16.592 1.00 0.00 H ATOM 20 H SER A 0 37.244 36.518 13.260 1.00 0.00 H ATOM 21 N MET A 1 33.728 35.456 11.925 1.00 70.92 N ATOM 22 CA MET A 1 32.628 35.351 10.943 1.00 70.38 C ATOM 23 C MET A 1 32.910 36.133 9.675 1.00 69.06 C ATOM 24 O MET A 1 32.019 36.759 9.119 1.00 69.46 O ATOM 25 CB MET A 1 31.273 35.777 11.543 1.00 70.52 C ATOM 26 CG MET A 1 30.996 35.199 12.929 1.00 71.48 C ATOM 27 SD MET A 1 31.871 33.631 13.233 1.00 72.44 S ATOM 28 CE MET A 1 30.586 32.469 12.683 1.00 73.84 C ATOM 29 HA MET A 1 32.565 34.296 10.678 1.00 0.00 H ATOM 30 HB2 MET A 1 31.257 36.864 11.616 1.00 0.00 H ATOM 31 HB3 MET A 1 30.481 35.448 10.870 1.00 0.00 H ATOM 32 HG2 MET A 1 29.924 35.024 13.025 1.00 0.00 H ATOM 33 HG3 MET A 1 31.313 35.925 13.678 1.00 0.00 H ATOM 34 HE1 MET A 1 29.690 32.608 13.287 1.00 0.00 H ATOM 35 HE2 MET A 1 30.352 32.657 11.635 1.00 0.00 H ATOM 36 HE3 MET A 1 30.948 31.447 12.798 1.00 0.00 H ATOM 37 H MET A 1 34.397 34.662 11.993 1.00 0.00 H ATOM 38 N SER A 2 34.152 36.056 9.215 1.00 67.46 N ATOM 39 CA SER A 2 34.621 36.817 8.059 1.00 66.35 C ATOM 40 C SER A 2 33.985 36.311 6.772 1.00 64.73 C ATOM 41 O SER A 2 33.734 37.073 5.832 1.00 64.58 O ATOM 42 CB SER A 2 36.151 36.713 7.932 1.00 66.43 C ATOM 43 OG SER A 2 36.745 36.376 9.172 1.00 67.47 O ATOM 44 HA SER A 2 34.332 37.857 8.214 1.00 0.00 H ATOM 45 HB2 SER A 2 36.546 37.672 7.597 1.00 0.00 H ATOM 46 HB3 SER A 2 36.396 35.944 7.199 1.00 0.00 H ATOM 47 HG SER A 2 37.727 36.316 9.061 1.00 0.00 H ATOM 48 H SER A 2 34.822 35.425 9.699 1.00 0.00 H ATOM 49 N SER A 3 33.781 35.003 6.730 1.00 62.70 N ATOM 50 CA SER A 3 33.166 34.344 5.590 1.00 61.15 C ATOM 51 C SER A 3 31.674 34.697 5.492 1.00 59.33 C ATOM 52 O SER A 3 31.090 34.676 4.409 1.00 58.78 O ATOM 53 CB SER A 3 33.356 32.828 5.709 1.00 61.26 C ATOM 54 OG SER A 3 33.566 32.430 7.059 1.00 61.67 O ATOM 55 HA SER A 3 33.650 34.694 4.678 1.00 0.00 H ATOM 56 HB2 SER A 3 34.220 32.532 5.114 1.00 0.00 H ATOM 57 HB3 SER A 3 32.465 32.329 5.327 1.00 0.00 H ATOM 58 HG SER A 3 33.684 31.448 7.098 1.00 0.00 H ATOM 59 H SER A 3 34.072 34.425 7.544 1.00 0.00 H ATOM 60 N PHE A 4 31.067 35.012 6.632 1.00 57.15 N ATOM 61 CA PHE A 4 29.656 35.377 6.672 1.00 55.77 C ATOM 62 C PHE A 4 29.376 36.771 6.185 1.00 54.80 C ATOM 63 O PHE A 4 28.268 37.038 5.769 1.00 54.84 O ATOM 64 CB PHE A 4 29.099 35.250 8.079 1.00 55.32 C ATOM 65 CG PHE A 4 28.616 33.894 8.385 1.00 53.55 C ATOM 66 CD1 PHE A 4 29.454 32.972 8.988 1.00 52.57 C ATOM 67 CD2 PHE A 4 27.340 33.513 8.033 1.00 51.72 C ATOM 68 CE1 PHE A 4 29.017 31.713 9.247 1.00 50.04 C ATOM 69 CE2 PHE A 4 26.895 32.259 8.315 1.00 50.01 C ATOM 70 CZ PHE A 4 27.740 31.355 8.910 1.00 49.59 C ATOM 71 HA PHE A 4 29.167 34.677 5.994 1.00 0.00 H ATOM 72 HB2 PHE A 4 29.885 35.508 8.789 1.00 0.00 H ATOM 73 HB3 PHE A 4 28.269 35.948 8.189 1.00 0.00 H ATOM 74 HD2 PHE A 4 26.683 34.220 7.526 1.00 0.00 H ATOM 75 HE2 PHE A 4 25.872 31.973 8.070 1.00 0.00 H ATOM 76 HZ PHE A 4 27.391 30.343 9.116 1.00 0.00 H ATOM 77 HE1 PHE A 4 29.681 30.990 9.722 1.00 0.00 H ATOM 78 HD1 PHE A 4 30.471 33.258 9.257 1.00 0.00 H ATOM 79 H PHE A 4 31.612 34.998 7.517 1.00 0.00 H ATOM 80 N LEU A 5 30.365 37.657 6.258 1.00 53.76 N ATOM 81 CA LEU A 5 30.193 39.040 5.833 1.00 52.89 C ATOM 82 C LEU A 5 29.838 39.155 4.359 1.00 51.88 C ATOM 83 O LEU A 5 30.270 38.351 3.536 1.00 51.62 O ATOM 84 CB LEU A 5 31.455 39.849 6.114 1.00 53.07 C ATOM 85 CG LEU A 5 31.602 40.411 7.531 1.00 53.63 C ATOM 86 CD1 LEU A 5 30.667 39.794 8.581 1.00 52.33 C ATOM 87 CD2 LEU A 5 33.046 40.265 7.954 1.00 54.58 C ATOM 88 HA LEU A 5 29.360 39.441 6.410 1.00 0.00 H ATOM 89 HB2 LEU A 5 32.312 39.204 5.922 1.00 0.00 H ATOM 90 HB3 LEU A 5 31.472 40.689 5.420 1.00 0.00 H ATOM 91 HG LEU A 5 31.300 41.457 7.485 1.00 0.00 H ATOM 92 HD21 LEU A 5 33.323 39.211 7.939 1.00 0.00 H ATOM 93 HD22 LEU A 5 33.683 40.819 7.264 1.00 0.00 H ATOM 94 HD23 LEU A 5 33.170 40.661 8.962 1.00 0.00 H ATOM 95 HD11 LEU A 5 29.631 39.962 8.287 1.00 0.00 H ATOM 96 HD12 LEU A 5 30.857 38.723 8.651 1.00 0.00 H ATOM 97 HD13 LEU A 5 30.851 40.261 9.549 1.00 0.00 H ATOM 98 H LEU A 5 31.288 37.354 6.629 1.00 0.00 H ATOM 99 N GLY A 6 29.040 40.168 4.046 1.00 50.52 N ATOM 100 CA GLY A 6 28.542 40.366 2.705 1.00 49.78 C ATOM 101 C GLY A 6 27.096 39.953 2.534 1.00 48.61 C ATOM 102 O GLY A 6 26.382 39.745 3.500 1.00 47.45 O ATOM 103 HA3 GLY A 6 29.153 39.779 2.019 1.00 0.00 H ATOM 104 HA2 GLY A 6 28.632 41.423 2.455 1.00 0.00 H ATOM 105 H GLY A 6 28.765 40.841 4.790 1.00 0.00 H ATOM 106 N LYS A 7 26.681 39.850 1.275 1.00 47.99 N ATOM 107 CA LYS A 7 25.307 39.538 0.935 1.00 47.86 C ATOM 108 C LYS A 7 25.210 38.151 0.333 1.00 47.03 C ATOM 109 O LYS A 7 26.198 37.584 -0.133 1.00 46.61 O ATOM 110 CB LYS A 7 24.726 40.567 -0.037 1.00 48.27 C ATOM 111 CG LYS A 7 25.055 42.028 0.297 1.00 50.44 C ATOM 112 CD LYS A 7 23.822 42.902 0.438 1.00 52.13 C ATOM 113 CE LYS A 7 23.193 43.180 -0.875 1.00 53.09 C ATOM 114 NZ LYS A 7 22.540 41.932 -1.314 1.00 54.98 N ATOM 115 HA LYS A 7 24.725 39.570 1.856 1.00 0.00 H ATOM 116 HB2 LYS A 7 25.115 40.351 -1.032 1.00 0.00 H ATOM 117 HB3 LYS A 7 23.642 40.456 -0.040 1.00 0.00 H ATOM 118 HG2 LYS A 7 25.607 42.053 1.237 1.00 0.00 H ATOM 119 HG3 LYS A 7 25.678 42.434 -0.500 1.00 0.00 H ATOM 120 HD2 LYS A 7 23.099 42.393 1.075 1.00 0.00 H ATOM 121 HD3 LYS A 7 24.109 43.847 0.899 1.00 0.00 H ATOM 122 HE2 LYS A 7 23.952 43.480 -1.598 1.00 0.00 H ATOM 123 HE3 LYS A 7 22.454 43.975 -0.775 1.00 0.00 H ATOM 124 HZ1 LYS A 7 23.254 41.180 -1.400 1.00 0.00 H ATOM 125 HZ2 LYS A 7 21.823 41.653 -0.614 1.00 0.00 H ATOM 126 HZ3 LYS A 7 22.085 42.086 -2.236 1.00 0.00 H ATOM 127 H LYS A 7 27.366 39.999 0.507 1.00 0.00 H ATOM 128 N TRP A 8 23.987 37.637 0.341 1.00 46.37 N ATOM 129 CA TRP A 8 23.691 36.255 0.015 1.00 45.56 C ATOM 130 C TRP A 8 22.268 36.192 -0.484 1.00 45.56 C ATOM 131 O TRP A 8 21.390 36.755 0.128 1.00 45.03 O ATOM 132 CB TRP A 8 23.797 35.375 1.264 1.00 45.11 C ATOM 133 CG TRP A 8 25.131 35.360 1.955 1.00 43.98 C ATOM 134 CD1 TRP A 8 25.525 36.146 3.006 1.00 41.14 C ATOM 135 CD2 TRP A 8 26.234 34.499 1.673 1.00 42.68 C ATOM 136 NE1 TRP A 8 26.800 35.825 3.383 1.00 39.37 N ATOM 137 CE2 TRP A 8 27.263 34.825 2.579 1.00 40.85 C ATOM 138 CE3 TRP A 8 26.458 33.479 0.746 1.00 42.86 C ATOM 139 CZ2 TRP A 8 28.475 34.176 2.588 1.00 41.07 C ATOM 140 CZ3 TRP A 8 27.673 32.829 0.762 1.00 42.42 C ATOM 141 CH2 TRP A 8 28.665 33.179 1.676 1.00 42.03 C ATOM 142 HA TRP A 8 24.398 35.900 -0.734 1.00 0.00 H ATOM 143 HB2 TRP A 8 23.055 35.725 1.981 1.00 0.00 H ATOM 144 HB3 TRP A 8 23.563 34.352 0.971 1.00 0.00 H ATOM 145 HE1 TRP A 8 27.331 36.271 4.158 1.00 0.00 H ATOM 146 HD1 TRP A 8 24.911 36.916 3.474 1.00 0.00 H ATOM 147 HZ2 TRP A 8 29.256 34.448 3.298 1.00 0.00 H ATOM 148 HH2 TRP A 8 29.615 32.644 1.662 1.00 0.00 H ATOM 149 HZ3 TRP A 8 27.861 32.028 0.048 1.00 0.00 H ATOM 150 HE3 TRP A 8 25.688 33.203 0.025 1.00 0.00 H ATOM 151 H TRP A 8 23.195 38.261 0.596 1.00 0.00 H ATOM 152 N LYS A 9 22.038 35.515 -1.601 1.00 46.44 N ATOM 153 CA LYS A 9 20.687 35.339 -2.137 1.00 46.64 C ATOM 154 C LYS A 9 20.371 33.863 -2.069 1.00 46.18 C ATOM 155 O LYS A 9 21.220 33.047 -2.392 1.00 45.99 O ATOM 156 CB LYS A 9 20.601 35.826 -3.580 1.00 47.05 C ATOM 157 CG LYS A 9 19.169 35.780 -4.205 1.00 48.47 C ATOM 158 CD LYS A 9 18.684 37.180 -4.630 1.00 49.84 C ATOM 159 CE LYS A 9 17.690 37.157 -5.790 1.00 51.31 C ATOM 160 NZ LYS A 9 18.112 38.067 -6.918 1.00 51.77 N ATOM 161 HA LYS A 9 19.973 35.923 -1.556 1.00 0.00 H ATOM 162 HB2 LYS A 9 20.952 36.858 -3.611 1.00 0.00 H ATOM 163 HB3 LYS A 9 21.256 35.202 -4.188 1.00 0.00 H ATOM 164 HG2 LYS A 9 19.187 35.132 -5.081 1.00 0.00 H ATOM 165 HG3 LYS A 9 18.475 35.375 -3.469 1.00 0.00 H ATOM 166 HD2 LYS A 9 18.204 37.653 -3.774 1.00 0.00 H ATOM 167 HD3 LYS A 9 19.551 37.769 -4.930 1.00 0.00 H ATOM 168 HE2 LYS A 9 16.715 37.479 -5.424 1.00 0.00 H ATOM 169 HE3 LYS A 9 17.616 36.138 -6.169 1.00 0.00 H ATOM 170 HZ1 LYS A 9 18.179 39.044 -6.567 1.00 0.00 H ATOM 171 HZ2 LYS A 9 19.039 37.763 -7.279 1.00 0.00 H ATOM 172 HZ3 LYS A 9 17.408 38.019 -7.682 1.00 0.00 H ATOM 173 H LYS A 9 22.842 35.097 -2.112 1.00 0.00 H ATOM 174 N LEU A 10 19.158 33.526 -1.635 1.00 45.86 N ATOM 175 CA LEU A 10 18.666 32.155 -1.693 1.00 45.51 C ATOM 176 C LEU A 10 18.670 31.673 -3.133 1.00 45.78 C ATOM 177 O LEU A 10 18.301 32.418 -4.031 1.00 46.14 O ATOM 178 CB LEU A 10 17.247 32.075 -1.128 1.00 45.24 C ATOM 179 CG LEU A 10 16.567 30.711 -1.080 1.00 43.08 C ATOM 180 CD1 LEU A 10 17.091 29.870 0.035 1.00 42.04 C ATOM 181 CD2 LEU A 10 15.099 30.910 -0.920 1.00 42.44 C ATOM 182 HA LEU A 10 19.319 31.521 -1.094 1.00 0.00 H ATOM 183 HB2 LEU A 10 17.283 32.455 -0.107 1.00 0.00 H ATOM 184 HB3 LEU A 10 16.620 32.728 -1.735 1.00 0.00 H ATOM 185 HG LEU A 10 16.780 30.186 -2.011 1.00 0.00 H ATOM 186 HD21 LEU A 10 14.906 31.452 0.006 1.00 0.00 H ATOM 187 HD22 LEU A 10 14.717 31.484 -1.765 1.00 0.00 H ATOM 188 HD23 LEU A 10 14.604 29.940 -0.885 1.00 0.00 H ATOM 189 HD11 LEU A 10 18.161 29.715 -0.101 1.00 0.00 H ATOM 190 HD12 LEU A 10 16.913 30.375 0.984 1.00 0.00 H ATOM 191 HD13 LEU A 10 16.580 28.907 0.033 1.00 0.00 H ATOM 192 H LEU A 10 18.541 34.265 -1.242 1.00 0.00 H ATOM 193 N SER A 11 19.121 30.437 -3.344 1.00 45.94 N ATOM 194 CA SER A 11 19.104 29.814 -4.652 1.00 46.03 C ATOM 195 C SER A 11 18.353 28.511 -4.638 1.00 45.62 C ATOM 196 O SER A 11 17.677 28.190 -5.606 1.00 46.41 O ATOM 197 CB SER A 11 20.522 29.578 -5.171 1.00 46.51 C ATOM 198 OG SER A 11 21.307 28.881 -4.232 1.00 47.10 O ATOM 199 HA SER A 11 18.590 30.504 -5.321 1.00 0.00 H ATOM 200 HB2 SER A 11 20.989 30.541 -5.378 1.00 0.00 H ATOM 201 HB3 SER A 11 20.470 28.996 -6.091 1.00 0.00 H ATOM 202 HG SER A 11 21.363 29.407 -3.395 1.00 0.00 H ATOM 203 H SER A 11 19.500 29.899 -2.539 1.00 0.00 H ATOM 204 N GLU A 12 18.483 27.728 -3.578 1.00 45.32 N ATOM 205 CA GLU A 12 17.668 26.515 -3.455 1.00 44.91 C ATOM 206 C GLU A 12 17.179 26.258 -2.045 1.00 44.43 C ATOM 207 O GLU A 12 17.845 26.560 -1.070 1.00 43.50 O ATOM 208 CB GLU A 12 18.403 25.282 -3.948 1.00 44.61 C ATOM 209 CG GLU A 12 19.762 25.560 -4.530 1.00 46.22 C ATOM 210 CD GLU A 12 20.581 24.308 -4.640 1.00 47.66 C ATOM 211 OE1 GLU A 12 21.799 24.366 -4.327 1.00 45.46 O ATOM 212 OE2 GLU A 12 19.978 23.275 -5.048 1.00 50.85 O ATOM 213 HA GLU A 12 16.800 26.703 -4.087 1.00 0.00 H ATOM 214 HB2 GLU A 12 18.525 24.599 -3.108 1.00 0.00 H ATOM 215 HB3 GLU A 12 17.794 24.806 -4.716 1.00 0.00 H ATOM 216 HG2 GLU A 12 19.640 25.992 -5.523 1.00 0.00 H ATOM 217 HG3 GLU A 12 20.284 26.269 -3.888 1.00 0.00 H ATOM 218 H GLU A 12 19.164 27.974 -2.832 1.00 0.00 H ATOM 219 N SER A 13 15.997 25.673 -1.978 1.00 44.17 N ATOM 220 CA SER A 13 15.361 25.347 -0.728 1.00 44.63 C ATOM 221 C SER A 13 14.800 23.934 -0.851 1.00 44.35 C ATOM 222 O SER A 13 14.048 23.661 -1.763 1.00 44.73 O ATOM 223 CB SER A 13 14.244 26.347 -0.462 1.00 44.38 C ATOM 224 OG SER A 13 13.528 26.013 0.720 1.00 45.77 O ATOM 225 HA SER A 13 16.067 25.393 0.101 1.00 0.00 H ATOM 226 HB2 SER A 13 13.556 26.346 -1.307 1.00 0.00 H ATOM 227 HB3 SER A 13 14.676 27.341 -0.348 1.00 0.00 H ATOM 228 HG SER A 13 13.130 25.112 0.620 1.00 0.00 H ATOM 229 H SER A 13 15.506 25.438 -2.864 1.00 0.00 H ATOM 230 N HIS A 14 15.168 23.043 0.053 1.00 44.45 N ATOM 231 CA HIS A 14 14.660 21.681 0.021 1.00 44.96 C ATOM 232 C HIS A 14 13.978 21.351 1.343 1.00 45.12 C ATOM 233 O HIS A 14 14.545 21.544 2.419 1.00 44.90 O ATOM 234 CB HIS A 14 15.807 20.700 -0.264 1.00 45.00 C ATOM 235 CG HIS A 14 15.379 19.267 -0.409 1.00 46.40 C ATOM 236 ND1 HIS A 14 16.006 18.390 -1.265 1.00 47.24 N ATOM 237 CD2 HIS A 14 14.406 18.553 0.202 1.00 47.64 C ATOM 238 CE1 HIS A 14 15.438 17.201 -1.175 1.00 47.57 C ATOM 239 NE2 HIS A 14 14.464 17.274 -0.289 1.00 47.75 N ATOM 240 HA HIS A 14 13.924 21.589 -0.778 1.00 0.00 H ATOM 241 HB2 HIS A 14 16.295 21.005 -1.190 1.00 0.00 H ATOM 242 HB3 HIS A 14 16.520 20.761 0.558 1.00 0.00 H ATOM 243 HD2 HIS A 14 13.704 18.926 0.948 1.00 0.00 H ATOM 244 HE1 HIS A 14 15.725 16.312 -1.737 1.00 0.00 H ATOM 245 H HIS A 14 15.834 23.321 0.802 1.00 0.00 H ATOM 246 N ASN A 15 12.721 20.934 1.226 1.00 45.54 N ATOM 247 CA ASN A 15 11.901 20.423 2.322 1.00 45.94 C ATOM 248 C ASN A 15 11.456 21.515 3.281 1.00 46.30 C ATOM 249 O ASN A 15 11.248 21.248 4.457 1.00 46.84 O ATOM 250 CB ASN A 15 12.617 19.286 3.084 1.00 46.10 C ATOM 251 CG ASN A 15 11.699 18.534 4.011 1.00 46.06 C ATOM 252 OD1 ASN A 15 12.101 18.092 5.081 1.00 44.16 O ATOM 253 ND2 ASN A 15 10.450 18.390 3.606 1.00 48.68 N ATOM 254 HA ASN A 15 11.001 20.015 1.862 1.00 0.00 H ATOM 255 HB2 ASN A 15 13.029 18.585 2.358 1.00 0.00 H ATOM 256 HB3 ASN A 15 13.428 19.717 3.671 1.00 0.00 H ATOM 257 HD22 ASN A 15 10.152 18.782 2.690 1.00 0.00 H ATOM 258 HD21 ASN A 15 9.765 17.885 4.203 1.00 0.00 H ATOM 259 H ASN A 15 12.288 20.975 0.281 1.00 0.00 H ATOM 260 N PHE A 16 11.286 22.733 2.779 1.00 46.47 N ATOM 261 CA PHE A 16 11.003 23.879 3.640 1.00 47.30 C ATOM 262 C PHE A 16 9.537 23.959 4.068 1.00 48.16 C ATOM 263 O PHE A 16 9.233 24.492 5.138 1.00 48.16 O ATOM 264 CB PHE A 16 11.420 25.188 2.957 1.00 47.15 C ATOM 265 CG PHE A 16 11.408 26.403 3.866 1.00 46.99 C ATOM 266 CD1 PHE A 16 10.770 27.564 3.477 1.00 46.40 C ATOM 267 CD2 PHE A 16 12.059 26.388 5.094 1.00 48.55 C ATOM 268 CE1 PHE A 16 10.763 28.679 4.301 1.00 48.42 C ATOM 269 CE2 PHE A 16 12.046 27.507 5.925 1.00 48.57 C ATOM 270 CZ PHE A 16 11.406 28.646 5.527 1.00 48.62 C ATOM 271 HA PHE A 16 11.594 23.734 4.544 1.00 0.00 H ATOM 272 HB2 PHE A 16 12.431 25.063 2.569 1.00 0.00 H ATOM 273 HB3 PHE A 16 10.735 25.374 2.130 1.00 0.00 H ATOM 274 HD2 PHE A 16 12.587 25.489 5.412 1.00 0.00 H ATOM 275 HE2 PHE A 16 12.547 27.473 6.893 1.00 0.00 H ATOM 276 HZ PHE A 16 11.401 29.525 6.171 1.00 0.00 H ATOM 277 HE1 PHE A 16 10.249 29.586 3.982 1.00 0.00 H ATOM 278 HD1 PHE A 16 10.266 27.604 2.511 1.00 0.00 H ATOM 279 H PHE A 16 11.356 22.874 1.751 1.00 0.00 H ATOM 280 N ASP A 17 8.629 23.446 3.240 1.00 49.13 N ATOM 281 CA ASP A 17 7.220 23.421 3.612 1.00 49.43 C ATOM 282 C ASP A 17 6.967 22.499 4.799 1.00 49.68 C ATOM 283 O ASP A 17 6.054 22.741 5.587 1.00 49.48 O ATOM 284 CB ASP A 17 6.332 23.015 2.452 1.00 49.81 C ATOM 285 CG ASP A 17 4.887 23.467 2.645 1.00 50.87 C ATOM 286 OD1 ASP A 17 3.994 22.601 2.819 1.00 52.82 O ATOM 287 OD2 ASP A 17 4.551 24.666 2.632 1.00 51.76 O ATOM 288 HA ASP A 17 6.964 24.441 3.900 1.00 0.00 H ATOM 289 HB2 ASP A 17 6.721 23.464 1.538 1.00 0.00 H ATOM 290 HB3 ASP A 17 6.351 21.929 2.359 1.00 0.00 H ATOM 291 H ASP A 17 8.927 23.060 2.321 1.00 0.00 H ATOM 292 N ALA A 18 7.772 21.448 4.922 1.00 49.55 N ATOM 293 CA ALA A 18 7.672 20.556 6.061 1.00 49.93 C ATOM 294 C ALA A 18 7.965 21.278 7.373 1.00 50.47 C ATOM 295 O ALA A 18 7.206 21.111 8.338 1.00 50.25 O ATOM 296 CB ALA A 18 8.600 19.366 5.900 1.00 49.81 C ATOM 297 HA ALA A 18 6.643 20.197 6.098 1.00 0.00 H ATOM 298 HB1 ALA A 18 8.330 18.816 4.999 1.00 0.00 H ATOM 299 HB2 ALA A 18 9.629 19.717 5.819 1.00 0.00 H ATOM 300 HB3 ALA A 18 8.505 18.713 6.768 1.00 0.00 H ATOM 301 H ALA A 18 8.486 21.262 4.189 1.00 0.00 H ATOM 302 N VAL A 19 9.036 22.086 7.417 1.00 50.71 N ATOM 303 CA VAL A 19 9.487 22.615 8.705 1.00 51.21 C ATOM 304 C VAL A 19 8.509 23.635 9.204 1.00 51.59 C ATOM 305 O VAL A 19 8.278 23.742 10.409 1.00 52.07 O ATOM 306 CB VAL A 19 10.920 23.251 8.738 1.00 51.19 C ATOM 307 CG1 VAL A 19 11.942 22.377 8.053 1.00 50.48 C ATOM 308 CG2 VAL A 19 10.932 24.716 8.200 1.00 51.98 C ATOM 309 HA VAL A 19 9.544 21.734 9.344 1.00 0.00 H ATOM 310 HB VAL A 19 11.213 23.310 9.786 1.00 0.00 H ATOM 311 HG11 VAL A 19 11.986 21.410 8.555 1.00 0.00 H ATOM 312 HG12 VAL A 19 11.656 22.234 7.011 1.00 0.00 H ATOM 313 HG13 VAL A 19 12.919 22.857 8.100 1.00 0.00 H ATOM 314 HG21 VAL A 19 10.582 24.725 7.168 1.00 0.00 H ATOM 315 HG22 VAL A 19 10.275 25.332 8.813 1.00 0.00 H ATOM 316 HG23 VAL A 19 11.947 25.110 8.244 1.00 0.00 H ATOM 317 H VAL A 19 9.541 22.334 6.543 1.00 0.00 H ATOM 318 N MET A 20 7.916 24.375 8.287 1.00 51.95 N ATOM 319 CA MET A 20 7.118 25.503 8.701 1.00 52.42 C ATOM 320 C MET A 20 5.591 25.271 8.597 1.00 52.56 C ATOM 321 O MET A 20 4.815 26.104 9.010 1.00 52.64 O ATOM 322 CB MET A 20 7.545 26.746 7.953 1.00 52.50 C ATOM 323 CG MET A 20 7.182 26.740 6.518 1.00 52.44 C ATOM 324 SD MET A 20 7.952 28.133 5.750 1.00 54.01 S ATOM 325 CE MET A 20 7.359 27.870 4.012 1.00 51.71 C ATOM 326 HA MET A 20 7.307 25.641 9.766 1.00 0.00 H ATOM 327 HB2 MET A 20 7.072 27.608 8.423 1.00 0.00 H ATOM 328 HB3 MET A 20 8.628 26.839 8.032 1.00 0.00 H ATOM 329 HG2 MET A 20 6.100 26.810 6.410 1.00 0.00 H ATOM 330 HG3 MET A 20 7.534 25.820 6.052 1.00 0.00 H ATOM 331 HE1 MET A 20 7.712 26.904 3.651 1.00 0.00 H ATOM 332 HE2 MET A 20 6.269 27.890 3.994 1.00 0.00 H ATOM 333 HE3 MET A 20 7.749 28.662 3.373 1.00 0.00 H ATOM 334 H MET A 20 8.023 24.148 7.278 1.00 0.00 H ATOM 335 N SER A 21 5.180 24.115 8.086 1.00 52.93 N ATOM 336 CA SER A 21 3.855 23.576 8.372 1.00 53.39 C ATOM 337 C SER A 21 3.878 23.161 9.828 1.00 53.17 C ATOM 338 O SER A 21 2.911 23.374 10.547 1.00 53.55 O ATOM 339 CB SER A 21 3.556 22.333 7.537 1.00 53.37 C ATOM 340 OG SER A 21 3.612 22.636 6.160 1.00 56.25 O ATOM 341 HA SER A 21 3.097 24.325 8.144 1.00 0.00 H ATOM 342 HB2 SER A 21 2.560 21.966 7.783 1.00 0.00 H ATOM 343 HB3 SER A 21 4.292 21.562 7.765 1.00 0.00 H ATOM 344 HG SER A 21 4.517 22.966 5.933 1.00 0.00 H ATOM 345 H SER A 21 5.820 23.580 7.465 1.00 0.00 H ATOM 346 N LYS A 22 4.992 22.551 10.231 1.00 52.59 N ATOM 347 CA LYS A 22 5.209 22.095 11.592 1.00 52.48 C ATOM 348 C LYS A 22 5.331 23.262 12.556 1.00 52.48 C ATOM 349 O LYS A 22 5.035 23.118 13.738 1.00 53.00 O ATOM 350 CB LYS A 22 6.444 21.184 11.655 1.00 52.27 C ATOM 351 CG LYS A 22 7.098 21.074 13.007 1.00 52.26 C ATOM 352 CD LYS A 22 7.994 19.855 13.114 1.00 51.97 C ATOM 353 CE LYS A 22 7.348 18.755 13.911 1.00 51.73 C ATOM 354 NZ LYS A 22 8.320 17.687 14.254 1.00 51.84 N ATOM 355 HA LYS A 22 4.339 21.516 11.902 1.00 0.00 H ATOM 356 HB2 LYS A 22 6.140 20.184 11.346 1.00 0.00 H ATOM 357 HB3 LYS A 22 7.184 21.571 10.954 1.00 0.00 H ATOM 358 HG2 LYS A 22 7.698 21.967 13.180 1.00 0.00 H ATOM 359 HG3 LYS A 22 6.321 21.007 13.768 1.00 0.00 H ATOM 360 HD2 LYS A 22 8.209 19.485 12.111 1.00 0.00 H ATOM 361 HD3 LYS A 22 8.926 20.143 13.601 1.00 0.00 H ATOM 362 HE2 LYS A 22 6.538 18.322 13.325 1.00 0.00 H ATOM 363 HE3 LYS A 22 6.944 19.175 14.832 1.00 0.00 H ATOM 364 HZ1 LYS A 22 8.706 17.277 13.379 1.00 0.00 H ATOM 365 HZ2 LYS A 22 9.093 18.092 14.819 1.00 0.00 H ATOM 366 HZ3 LYS A 22 7.839 16.946 14.803 1.00 0.00 H ATOM 367 H LYS A 22 5.747 22.393 9.533 1.00 0.00 H ATOM 368 N LEU A 23 5.742 24.424 12.058 1.00 52.62 N ATOM 369 CA LEU A 23 5.726 25.650 12.855 1.00 52.40 C ATOM 370 C LEU A 23 4.354 26.304 12.946 1.00 52.13 C ATOM 371 O LEU A 23 4.183 27.298 13.632 1.00 52.88 O ATOM 372 CB LEU A 23 6.745 26.657 12.310 1.00 52.25 C ATOM 373 CG LEU A 23 8.177 26.159 12.501 1.00 52.07 C ATOM 374 CD1 LEU A 23 9.142 26.921 11.621 1.00 51.57 C ATOM 375 CD2 LEU A 23 8.589 26.249 13.995 1.00 51.60 C ATOM 376 HA LEU A 23 5.997 25.351 13.868 1.00 0.00 H ATOM 377 HB2 LEU A 23 6.561 26.808 11.246 1.00 0.00 H ATOM 378 HB3 LEU A 23 6.625 27.604 12.837 1.00 0.00 H ATOM 379 HG LEU A 23 8.216 25.112 12.200 1.00 0.00 H ATOM 380 HD21 LEU A 23 8.527 27.286 14.326 1.00 0.00 H ATOM 381 HD22 LEU A 23 7.917 25.634 14.594 1.00 0.00 H ATOM 382 HD23 LEU A 23 9.612 25.890 14.111 1.00 0.00 H ATOM 383 HD11 LEU A 23 8.863 26.787 10.576 1.00 0.00 H ATOM 384 HD12 LEU A 23 9.104 27.980 11.875 1.00 0.00 H ATOM 385 HD13 LEU A 23 10.152 26.544 11.780 1.00 0.00 H ATOM 386 H LEU A 23 6.084 24.462 11.076 1.00 0.00 H ATOM 387 N GLY A 24 3.375 25.761 12.254 1.00 52.08 N ATOM 388 CA GLY A 24 2.056 26.346 12.241 1.00 52.16 C ATOM 389 C GLY A 24 1.977 27.632 11.438 1.00 52.11 C ATOM 390 O GLY A 24 0.960 28.330 11.485 1.00 52.85 O ATOM 391 HA3 GLY A 24 1.762 26.561 13.268 1.00 0.00 H ATOM 392 HA2 GLY A 24 1.362 25.625 11.809 1.00 0.00 H ATOM 393 H GLY A 24 3.555 24.895 11.707 1.00 0.00 H ATOM 394 N VAL A 25 3.015 27.952 10.678 1.00 51.73 N ATOM 395 CA VAL A 25 2.937 29.092 9.773 1.00 51.88 C ATOM 396 C VAL A 25 1.648 28.936 8.986 1.00 51.65 C ATOM 397 O VAL A 25 1.313 27.824 8.580 1.00 52.38 O ATOM 398 CB VAL A 25 4.132 29.161 8.809 1.00 51.76 C ATOM 399 CG1 VAL A 25 4.004 30.346 7.853 1.00 51.81 C ATOM 400 CG2 VAL A 25 5.415 29.282 9.587 1.00 52.39 C ATOM 401 HA VAL A 25 2.957 30.016 10.350 1.00 0.00 H ATOM 402 HB VAL A 25 4.142 28.243 8.222 1.00 0.00 H ATOM 403 HG11 VAL A 25 3.090 30.242 7.268 1.00 0.00 H ATOM 404 HG12 VAL A 25 3.966 31.272 8.427 1.00 0.00 H ATOM 405 HG13 VAL A 25 4.865 30.367 7.185 1.00 0.00 H ATOM 406 HG21 VAL A 25 5.388 30.189 10.191 1.00 0.00 H ATOM 407 HG22 VAL A 25 5.528 28.414 10.237 1.00 0.00 H ATOM 408 HG23 VAL A 25 6.255 29.330 8.894 1.00 0.00 H ATOM 409 H VAL A 25 3.887 27.388 10.728 1.00 0.00 H ATOM 410 N SER A 26 0.910 30.025 8.792 1.00 51.02 N ATOM 411 CA SER A 26 -0.382 29.932 8.122 1.00 50.48 C ATOM 412 C SER A 26 -0.159 29.412 6.715 1.00 50.39 C ATOM 413 O SER A 26 0.957 29.397 6.227 1.00 49.86 O ATOM 414 CB SER A 26 -1.082 31.287 8.062 1.00 50.38 C ATOM 415 OG SER A 26 -0.445 32.142 7.132 1.00 49.28 O ATOM 416 HA SER A 26 -1.022 29.254 8.687 1.00 0.00 H ATOM 417 HB2 SER A 26 -1.053 31.748 9.049 1.00 0.00 H ATOM 418 HB3 SER A 26 -2.119 31.140 7.761 1.00 0.00 H ATOM 419 HG SER A 26 -0.915 33.013 7.110 1.00 0.00 H ATOM 420 H SER A 26 1.256 30.949 9.120 1.00 0.00 H ATOM 421 N TRP A 27 -1.228 28.994 6.060 1.00 50.25 N ATOM 422 CA TRP A 27 -1.124 28.549 4.689 1.00 50.26 C ATOM 423 C TRP A 27 -0.528 29.636 3.816 1.00 50.15 C ATOM 424 O TRP A 27 0.361 29.359 3.002 1.00 50.92 O ATOM 425 CB TRP A 27 -2.497 28.183 4.119 1.00 50.26 C ATOM 426 CG TRP A 27 -2.396 27.779 2.702 1.00 51.00 C ATOM 427 CD1 TRP A 27 -2.672 28.543 1.611 1.00 50.88 C ATOM 428 CD2 TRP A 27 -1.925 26.526 2.209 1.00 51.47 C ATOM 429 NE1 TRP A 27 -2.427 27.832 0.461 1.00 50.96 N ATOM 430 CE2 TRP A 27 -1.973 26.585 0.800 1.00 51.96 C ATOM 431 CE3 TRP A 27 -1.493 25.343 2.818 1.00 51.68 C ATOM 432 CZ2 TRP A 27 -1.596 25.509 -0.014 1.00 51.88 C ATOM 433 CZ3 TRP A 27 -1.119 24.276 2.016 1.00 52.95 C ATOM 434 CH2 TRP A 27 -1.173 24.365 0.613 1.00 52.72 C ATOM 435 HA TRP A 27 -0.480 27.670 4.688 1.00 0.00 H ATOM 436 HB2 TRP A 27 -2.913 27.357 4.696 1.00 0.00 H ATOM 437 HB3 TRP A 27 -3.157 29.047 4.197 1.00 0.00 H ATOM 438 HE1 TRP A 27 -2.564 28.183 -0.508 1.00 0.00 H ATOM 439 HD1 TRP A 27 -3.035 29.570 1.644 1.00 0.00 H ATOM 440 HZ2 TRP A 27 -1.637 25.578 -1.101 1.00 0.00 H ATOM 441 HH2 TRP A 27 -0.872 23.507 0.012 1.00 0.00 H ATOM 442 HZ3 TRP A 27 -0.777 23.351 2.481 1.00 0.00 H ATOM 443 HE3 TRP A 27 -1.451 25.262 3.904 1.00 0.00 H ATOM 444 H TRP A 27 -2.153 28.985 6.536 1.00 0.00 H ATOM 445 N ALA A 28 -1.058 30.852 3.965 1.00 49.26 N ATOM 446 CA ALA A 28 -0.705 31.967 3.111 1.00 49.04 C ATOM 447 C ALA A 28 0.746 32.404 3.264 1.00 48.53 C ATOM 448 O ALA A 28 1.399 32.726 2.282 1.00 48.19 O ATOM 449 CB ALA A 28 -1.637 33.151 3.364 1.00 49.12 C ATOM 450 HA ALA A 28 -0.824 31.617 2.085 1.00 0.00 H ATOM 451 HB1 ALA A 28 -2.665 32.854 3.153 1.00 0.00 H ATOM 452 HB2 ALA A 28 -1.553 33.462 4.405 1.00 0.00 H ATOM 453 HB3 ALA A 28 -1.356 33.979 2.713 1.00 0.00 H ATOM 454 H ALA A 28 -1.752 31.005 4.724 1.00 0.00 H ATOM 455 N THR A 29 1.250 32.423 4.488 1.00 48.09 N ATOM 456 CA THR A 29 2.621 32.853 4.715 1.00 47.79 C ATOM 457 C THR A 29 3.557 31.736 4.283 1.00 47.70 C ATOM 458 O THR A 29 4.615 32.017 3.751 1.00 48.08 O ATOM 459 CB THR A 29 2.828 33.273 6.170 1.00 47.75 C ATOM 460 OG1 THR A 29 1.991 34.400 6.451 1.00 49.51 O ATOM 461 CG2 THR A 29 4.221 33.831 6.413 1.00 48.04 C ATOM 462 HA THR A 29 2.845 33.736 4.117 1.00 0.00 H ATOM 463 HB THR A 29 2.630 32.386 6.771 1.00 0.00 H ATOM 464 HG1 THR A 29 2.119 34.678 7.392 1.00 0.00 H ATOM 465 HG23 THR A 29 4.960 33.052 6.228 1.00 0.00 H ATOM 466 HG21 THR A 29 4.398 34.669 5.739 1.00 0.00 H ATOM 467 HG22 THR A 29 4.300 34.171 7.446 1.00 0.00 H ATOM 468 H THR A 29 0.661 32.128 5.293 1.00 0.00 H ATOM 469 N ARG A 30 3.152 30.478 4.465 1.00 47.34 N ATOM 470 CA ARG A 30 3.920 29.350 3.962 1.00 47.09 C ATOM 471 C ARG A 30 4.114 29.409 2.470 1.00 47.49 C ATOM 472 O ARG A 30 5.204 29.113 1.983 1.00 46.74 O ATOM 473 CB ARG A 30 3.244 28.043 4.265 1.00 47.10 C ATOM 474 CG ARG A 30 3.380 27.649 5.693 1.00 47.27 C ATOM 475 CD ARG A 30 2.625 26.412 6.092 1.00 46.64 C ATOM 476 NE ARG A 30 2.570 25.432 5.015 1.00 47.48 N ATOM 477 CZ ARG A 30 1.637 24.504 4.897 1.00 48.41 C ATOM 478 NH1 ARG A 30 0.680 24.377 5.815 1.00 48.94 N ATOM 479 NH2 ARG A 30 1.671 23.682 3.865 1.00 49.37 N ATOM 480 HA ARG A 30 4.885 29.413 4.466 1.00 0.00 H ATOM 481 HB2 ARG A 30 2.184 28.134 4.026 1.00 0.00 H ATOM 482 HB3 ARG A 30 3.690 27.266 3.644 1.00 0.00 H ATOM 483 HG2 ARG A 30 4.437 27.479 5.897 1.00 0.00 H ATOM 484 HG3 ARG A 30 3.021 28.476 6.306 1.00 0.00 H ATOM 485 HD2 ARG A 30 1.608 26.693 6.364 1.00 0.00 H ATOM 486 HD3 ARG A 30 3.118 25.961 6.953 1.00 0.00 H ATOM 487 HE ARG A 30 3.315 25.465 4.290 1.00 0.00 H ATOM 488 HH12 ARG A 30 -0.048 23.642 5.709 1.00 0.00 H ATOM 489 HH11 ARG A 30 0.661 25.013 6.638 1.00 0.00 H ATOM 490 HH22 ARG A 30 0.942 22.947 3.761 1.00 0.00 H ATOM 491 HH21 ARG A 30 2.427 23.769 3.156 1.00 0.00 H ATOM 492 H ARG A 30 2.266 30.300 4.979 1.00 0.00 H ATOM 493 N GLN A 31 3.061 29.781 1.746 1.00 48.12 N ATOM 494 CA GLN A 31 3.121 29.819 0.289 1.00 48.52 C ATOM 495 C GLN A 31 4.150 30.839 -0.135 1.00 48.82 C ATOM 496 O GLN A 31 5.014 30.536 -0.980 1.00 49.83 O ATOM 497 CB GLN A 31 1.754 30.123 -0.341 1.00 48.28 C ATOM 498 CG GLN A 31 0.756 28.940 -0.375 1.00 50.02 C ATOM 499 CD GLN A 31 1.373 27.529 -0.164 1.00 51.07 C ATOM 500 OE1 GLN A 31 1.976 26.961 -1.076 1.00 52.82 O ATOM 501 NE2 GLN A 31 1.177 26.964 1.025 1.00 51.31 N ATOM 502 HA GLN A 31 3.412 28.832 -0.069 1.00 0.00 H ATOM 503 HB2 GLN A 31 1.295 30.933 0.226 1.00 0.00 H ATOM 504 HB3 GLN A 31 1.922 30.450 -1.367 1.00 0.00 H ATOM 505 HG2 GLN A 31 0.017 29.103 0.409 1.00 0.00 H ATOM 506 HG3 GLN A 31 0.261 28.947 -1.346 1.00 0.00 H ATOM 507 HE22 GLN A 31 0.662 27.480 1.767 1.00 0.00 H ATOM 508 HE21 GLN A 31 1.539 26.007 1.212 1.00 0.00 H ATOM 509 H GLN A 31 2.179 30.049 2.228 1.00 0.00 H ATOM 510 N ILE A 32 4.075 32.033 0.459 1.00 49.00 N ATOM 511 CA ILE A 32 5.090 33.077 0.267 1.00 48.79 C ATOM 512 C ILE A 32 6.480 32.577 0.649 1.00 48.57 C ATOM 513 O ILE A 32 7.440 32.892 -0.018 1.00 49.00 O ATOM 514 CB ILE A 32 4.776 34.341 1.097 1.00 48.79 C ATOM 515 CG1 ILE A 32 3.414 34.936 0.734 1.00 49.57 C ATOM 516 CG2 ILE A 32 5.862 35.415 0.902 1.00 48.93 C ATOM 517 CD1 ILE A 32 3.380 35.619 -0.596 1.00 51.03 C ATOM 518 HA ILE A 32 5.071 33.331 -0.793 1.00 0.00 H ATOM 519 HB ILE A 32 4.755 34.030 2.142 1.00 0.00 H ATOM 520 HG12 ILE A 32 2.680 34.130 0.724 1.00 0.00 H ATOM 521 HG13 ILE A 32 3.143 35.663 1.499 1.00 0.00 H ATOM 522 HD11 ILE A 32 4.100 36.438 -0.601 1.00 0.00 H ATOM 523 HD12 ILE A 32 3.636 34.903 -1.377 1.00 0.00 H ATOM 524 HD13 ILE A 32 2.379 36.012 -0.776 1.00 0.00 H ATOM 525 HG21 ILE A 32 6.826 35.018 1.221 1.00 0.00 H ATOM 526 HG22 ILE A 32 5.912 35.692 -0.151 1.00 0.00 H ATOM 527 HG23 ILE A 32 5.614 36.293 1.498 1.00 0.00 H ATOM 528 H ILE A 32 3.266 32.231 1.082 1.00 0.00 H ATOM 529 N GLY A 33 6.593 31.814 1.731 1.00 48.95 N ATOM 530 CA GLY A 33 7.860 31.214 2.121 1.00 49.35 C ATOM 531 C GLY A 33 8.456 30.317 1.053 1.00 49.71 C ATOM 532 O GLY A 33 9.664 30.295 0.831 1.00 49.94 O ATOM 533 HA3 GLY A 33 7.699 30.620 3.021 1.00 0.00 H ATOM 534 HA2 GLY A 33 8.569 32.013 2.337 1.00 0.00 H ATOM 535 H GLY A 33 5.751 31.641 2.316 1.00 0.00 H ATOM 536 N ASN A 34 7.586 29.588 0.373 1.00 50.34 N ATOM 537 CA ASN A 34 7.988 28.668 -0.686 1.00 51.00 C ATOM 538 C ASN A 34 8.272 29.340 -2.044 1.00 51.39 C ATOM 539 O ASN A 34 8.842 28.701 -2.919 1.00 51.65 O ATOM 540 CB ASN A 34 6.924 27.570 -0.836 1.00 50.88 C ATOM 541 CG ASN A 34 6.663 26.831 0.478 1.00 50.84 C ATOM 542 OD1 ASN A 34 7.579 26.622 1.276 1.00 50.37 O ATOM 543 ND2 ASN A 34 5.414 26.450 0.710 1.00 50.38 N ATOM 544 HA ASN A 34 8.942 28.240 -0.378 1.00 0.00 H ATOM 545 HB2 ASN A 34 5.993 28.027 -1.172 1.00 0.00 H ATOM 546 HB3 ASN A 34 7.264 26.851 -1.581 1.00 0.00 H ATOM 547 HD22 ASN A 34 4.672 26.647 0.009 1.00 0.00 H ATOM 548 HD21 ASN A 34 5.177 25.954 1.593 1.00 0.00 H ATOM 549 H ASN A 34 6.575 29.674 0.602 1.00 0.00 H ATOM 550 N THR A 35 7.882 30.606 -2.221 1.00 51.86 N ATOM 551 CA THR A 35 8.168 31.325 -3.462 1.00 52.49 C ATOM 552 C THR A 35 9.377 32.254 -3.356 1.00 52.47 C ATOM 553 O THR A 35 10.307 32.160 -4.165 1.00 52.56 O ATOM 554 CB THR A 35 6.952 32.159 -3.936 1.00 52.79 C ATOM 555 OG1 THR A 35 6.520 33.036 -2.895 1.00 52.91 O ATOM 556 CG2 THR A 35 5.745 31.275 -4.225 1.00 54.04 C ATOM 557 HA THR A 35 8.394 30.546 -4.190 1.00 0.00 H ATOM 558 HB THR A 35 7.279 32.692 -4.829 1.00 0.00 H ATOM 559 HG1 THR A 35 6.259 32.503 -2.103 1.00 0.00 H ATOM 560 HG23 THR A 35 5.995 30.569 -5.017 1.00 0.00 H ATOM 561 HG21 THR A 35 5.472 30.728 -3.322 1.00 0.00 H ATOM 562 HG22 THR A 35 4.908 31.897 -4.541 1.00 0.00 H ATOM 563 H THR A 35 7.364 31.090 -1.460 1.00 0.00 H ATOM 564 N VAL A 36 9.373 33.150 -2.371 1.00 52.27 N ATOM 565 CA VAL A 36 10.356 34.232 -2.347 1.00 52.14 C ATOM 566 C VAL A 36 11.771 33.749 -2.075 1.00 51.60 C ATOM 567 O VAL A 36 11.995 32.731 -1.422 1.00 51.16 O ATOM 568 CB VAL A 36 10.035 35.336 -1.327 1.00 52.39 C ATOM 569 CG1 VAL A 36 8.558 35.694 -1.362 1.00 53.26 C ATOM 570 CG2 VAL A 36 10.484 34.932 0.071 1.00 52.53 C ATOM 571 HA VAL A 36 10.295 34.646 -3.354 1.00 0.00 H ATOM 572 HB VAL A 36 10.594 36.230 -1.603 1.00 0.00 H ATOM 573 HG11 VAL A 36 8.295 36.049 -2.358 1.00 0.00 H ATOM 574 HG12 VAL A 36 7.966 34.811 -1.122 1.00 0.00 H ATOM 575 HG13 VAL A 36 8.358 36.477 -0.631 1.00 0.00 H ATOM 576 HG21 VAL A 36 9.967 34.019 0.368 1.00 0.00 H ATOM 577 HG22 VAL A 36 11.560 34.758 0.069 1.00 0.00 H ATOM 578 HG23 VAL A 36 10.245 35.731 0.773 1.00 0.00 H ATOM 579 H VAL A 36 8.665 33.080 -1.613 1.00 0.00 H ATOM 580 N THR A 37 12.712 34.526 -2.593 1.00 51.12 N ATOM 581 CA THR A 37 14.127 34.240 -2.500 1.00 50.84 C ATOM 582 C THR A 37 14.767 35.424 -1.779 1.00 49.81 C ATOM 583 O THR A 37 15.133 36.415 -2.393 1.00 49.93 O ATOM 584 CB THR A 37 14.726 34.023 -3.911 1.00 50.79 C ATOM 585 OG1 THR A 37 14.449 35.145 -4.750 1.00 51.83 O ATOM 586 CG2 THR A 37 14.015 32.890 -4.631 1.00 51.31 C ATOM 587 HA THR A 37 14.317 33.321 -1.945 1.00 0.00 H ATOM 588 HB THR A 37 15.790 33.840 -3.759 1.00 0.00 H ATOM 589 HG1 THR A 37 14.848 35.959 -4.352 1.00 0.00 H ATOM 590 HG23 THR A 37 14.157 31.963 -4.076 1.00 0.00 H ATOM 591 HG21 THR A 37 12.951 33.115 -4.699 1.00 0.00 H ATOM 592 HG22 THR A 37 14.429 32.782 -5.633 1.00 0.00 H ATOM 593 H THR A 37 12.417 35.388 -3.094 1.00 0.00 H ATOM 594 N PRO A 38 14.880 35.326 -0.463 1.00 48.88 N ATOM 595 CA PRO A 38 15.427 36.417 0.317 1.00 48.37 C ATOM 596 C PRO A 38 16.894 36.637 0.033 1.00 47.99 C ATOM 597 O PRO A 38 17.579 35.757 -0.493 1.00 47.57 O ATOM 598 CB PRO A 38 15.250 35.926 1.754 1.00 47.86 C ATOM 599 CG PRO A 38 14.293 34.890 1.675 1.00 47.79 C ATOM 600 CD PRO A 38 14.540 34.193 0.410 1.00 48.76 C ATOM 601 HA PRO A 38 14.938 37.367 0.099 1.00 0.00 H ATOM 602 HD3 PRO A 38 15.367 33.488 0.494 1.00 0.00 H ATOM 603 HD2 PRO A 38 13.651 33.668 0.060 1.00 0.00 H ATOM 604 HG3 PRO A 38 13.285 35.306 1.686 1.00 0.00 H ATOM 605 HG2 PRO A 38 14.411 34.203 2.513 1.00 0.00 H ATOM 606 HB2 PRO A 38 16.193 35.547 2.148 1.00 0.00 H ATOM 607 HB3 PRO A 38 14.889 36.732 2.392 1.00 0.00 H ATOM 608 N THR A 39 17.351 37.820 0.417 1.00 47.76 N ATOM 609 CA THR A 39 18.733 38.193 0.350 1.00 47.87 C ATOM 610 C THR A 39 19.118 38.560 1.751 1.00 47.82 C ATOM 611 O THR A 39 18.634 39.539 2.285 1.00 48.20 O ATOM 612 CB THR A 39 18.904 39.382 -0.607 1.00 48.04 C ATOM 613 OG1 THR A 39 18.601 38.952 -1.940 1.00 48.89 O ATOM 614 CG2 THR A 39 20.353 39.836 -0.723 1.00 47.79 C ATOM 615 HA THR A 39 19.364 37.390 -0.030 1.00 0.00 H ATOM 616 HB THR A 39 18.263 40.173 -0.217 1.00 0.00 H ATOM 617 HG1 THR A 39 17.667 38.624 -1.976 1.00 0.00 H ATOM 618 HG23 THR A 39 20.700 40.191 0.247 1.00 0.00 H ATOM 619 HG21 THR A 39 20.970 38.998 -1.047 1.00 0.00 H ATOM 620 HG22 THR A 39 20.422 40.643 -1.453 1.00 0.00 H ATOM 621 H THR A 39 16.671 38.514 0.787 1.00 0.00 H ATOM 622 N VAL A 40 19.970 37.757 2.367 1.00 47.71 N ATOM 623 CA VAL A 40 20.452 38.082 3.697 1.00 47.61 C ATOM 624 C VAL A 40 21.863 38.668 3.629 1.00 47.11 C ATOM 625 O VAL A 40 22.683 38.287 2.820 1.00 46.39 O ATOM 626 CB VAL A 40 20.318 36.903 4.705 1.00 47.47 C ATOM 627 CG1 VAL A 40 19.233 35.931 4.263 1.00 48.18 C ATOM 628 CG2 VAL A 40 21.605 36.171 4.902 1.00 48.84 C ATOM 629 HA VAL A 40 19.800 38.855 4.102 1.00 0.00 H ATOM 630 HB VAL A 40 20.039 37.344 5.662 1.00 0.00 H ATOM 631 HG11 VAL A 40 18.279 36.455 4.207 1.00 0.00 H ATOM 632 HG12 VAL A 40 19.486 35.528 3.283 1.00 0.00 H ATOM 633 HG13 VAL A 40 19.160 35.117 4.984 1.00 0.00 H ATOM 634 HG21 VAL A 40 21.939 35.762 3.948 1.00 0.00 H ATOM 635 HG22 VAL A 40 22.358 36.859 5.287 1.00 0.00 H ATOM 636 HG23 VAL A 40 21.455 35.359 5.614 1.00 0.00 H ATOM 637 H VAL A 40 20.296 36.889 1.896 1.00 0.00 H ATOM 638 N THR A 41 22.092 39.636 4.493 1.00 47.23 N ATOM 639 CA THR A 41 23.321 40.371 4.566 1.00 47.50 C ATOM 640 C THR A 41 23.807 40.167 5.973 1.00 48.10 C ATOM 641 O THR A 41 23.028 40.224 6.896 1.00 48.75 O ATOM 642 CB THR A 41 22.995 41.854 4.302 1.00 47.84 C ATOM 643 OG1 THR A 41 22.280 41.983 3.061 1.00 45.15 O ATOM 644 CG2 THR A 41 24.249 42.697 4.117 1.00 48.02 C ATOM 645 HA THR A 41 24.074 40.054 3.844 1.00 0.00 H ATOM 646 HB THR A 41 22.423 42.193 5.166 1.00 0.00 H ATOM 647 HG1 THR A 41 21.437 41.466 3.112 1.00 0.00 H ATOM 648 HG23 THR A 41 24.853 42.652 5.024 1.00 0.00 H ATOM 649 HG21 THR A 41 24.825 42.310 3.276 1.00 0.00 H ATOM 650 HG22 THR A 41 23.965 43.731 3.919 1.00 0.00 H ATOM 651 H THR A 41 21.335 39.882 5.163 1.00 0.00 H ATOM 652 N PHE A 42 25.076 39.877 6.152 1.00 49.16 N ATOM 653 CA PHE A 42 25.673 39.927 7.470 1.00 50.20 C ATOM 654 C PHE A 42 26.690 41.063 7.515 1.00 51.21 C ATOM 655 O PHE A 42 27.339 41.347 6.520 1.00 51.25 O ATOM 656 CB PHE A 42 26.374 38.618 7.812 1.00 50.15 C ATOM 657 CG PHE A 42 25.485 37.411 7.761 1.00 50.73 C ATOM 658 CD1 PHE A 42 25.302 36.723 6.586 1.00 49.92 C ATOM 659 CD2 PHE A 42 24.869 36.939 8.907 1.00 51.62 C ATOM 660 CE1 PHE A 42 24.493 35.613 6.545 1.00 51.25 C ATOM 661 CE2 PHE A 42 24.058 35.816 8.870 1.00 51.16 C ATOM 662 CZ PHE A 42 23.862 35.161 7.693 1.00 51.00 C ATOM 663 HA PHE A 42 24.880 40.092 8.199 1.00 0.00 H ATOM 664 HB2 PHE A 42 27.190 38.472 7.104 1.00 0.00 H ATOM 665 HB3 PHE A 42 26.780 38.701 8.820 1.00 0.00 H ATOM 666 HD2 PHE A 42 25.024 37.458 9.853 1.00 0.00 H ATOM 667 HE2 PHE A 42 23.578 35.458 9.781 1.00 0.00 H ATOM 668 HZ PHE A 42 23.213 34.286 7.654 1.00 0.00 H ATOM 669 HE1 PHE A 42 24.347 35.084 5.603 1.00 0.00 H ATOM 670 HD1 PHE A 42 25.803 37.060 5.679 1.00 0.00 H ATOM 671 H PHE A 42 25.660 39.608 5.335 1.00 0.00 H ATOM 672 N THR A 43 26.795 41.712 8.672 1.00 52.98 N ATOM 673 CA THR A 43 27.914 42.586 9.012 1.00 54.37 C ATOM 674 C THR A 43 28.307 42.322 10.458 1.00 56.27 C ATOM 675 O THR A 43 27.452 42.107 11.324 1.00 55.74 O ATOM 676 CB THR A 43 27.573 44.098 8.851 1.00 54.17 C ATOM 677 OG1 THR A 43 26.462 44.451 9.682 1.00 52.86 O ATOM 678 CG2 THR A 43 27.114 44.420 7.444 1.00 54.10 C ATOM 679 HA THR A 43 28.729 42.364 8.323 1.00 0.00 H ATOM 680 HB THR A 43 28.483 44.639 9.110 1.00 0.00 H ATOM 681 HG1 THR A 43 26.689 44.270 10.629 1.00 0.00 H ATOM 682 HG23 THR A 43 27.910 44.178 6.739 1.00 0.00 H ATOM 683 HG21 THR A 43 26.227 43.831 7.209 1.00 0.00 H ATOM 684 HG22 THR A 43 26.876 45.481 7.375 1.00 0.00 H ATOM 685 H THR A 43 26.037 41.590 9.374 1.00 0.00 H ATOM 686 N MET A 44 29.611 42.322 10.705 1.00 58.61 N ATOM 687 CA MET A 44 30.123 42.242 12.066 1.00 60.60 C ATOM 688 C MET A 44 30.471 43.677 12.473 1.00 61.95 C ATOM 689 O MET A 44 31.167 44.395 11.733 1.00 61.71 O ATOM 690 CB MET A 44 31.353 41.326 12.154 1.00 60.98 C ATOM 691 CG MET A 44 31.080 39.937 12.752 1.00 62.09 C ATOM 692 SD MET A 44 30.612 39.996 14.498 1.00 64.73 S ATOM 693 CE MET A 44 31.530 38.645 15.146 1.00 66.07 C ATOM 694 HA MET A 44 29.381 41.808 12.737 1.00 0.00 H ATOM 695 HB2 MET A 44 31.748 41.190 11.147 1.00 0.00 H ATOM 696 HB3 MET A 44 32.101 41.821 12.773 1.00 0.00 H ATOM 697 HG2 MET A 44 31.982 39.334 12.655 1.00 0.00 H ATOM 698 HG3 MET A 44 30.270 39.470 12.191 1.00 0.00 H ATOM 699 HE1 MET A 44 31.224 37.726 14.646 1.00 0.00 H ATOM 700 HE2 MET A 44 32.593 38.815 14.976 1.00 0.00 H ATOM 701 HE3 MET A 44 31.341 38.559 16.216 1.00 0.00 H ATOM 702 H MET A 44 30.280 42.380 9.911 1.00 0.00 H ATOM 703 N ASP A 45 29.966 44.081 13.637 1.00 63.09 N ATOM 704 CA ASP A 45 30.222 45.409 14.194 1.00 64.11 C ATOM 705 C ASP A 45 30.681 45.298 15.647 1.00 64.66 C ATOM 706 O ASP A 45 29.882 45.372 16.597 1.00 64.41 O ATOM 707 CB ASP A 45 28.971 46.251 14.072 1.00 64.41 C ATOM 708 CG ASP A 45 28.402 46.200 12.687 1.00 65.35 C ATOM 709 OD1 ASP A 45 28.996 46.873 11.809 1.00 66.27 O ATOM 710 OD2 ASP A 45 27.407 45.489 12.388 1.00 65.47 O ATOM 711 HA ASP A 45 31.023 45.893 13.635 1.00 0.00 H ATOM 712 HB2 ASP A 45 28.225 45.880 14.775 1.00 0.00 H ATOM 713 HB3 ASP A 45 29.215 47.285 14.316 1.00 0.00 H ATOM 714 H ASP A 45 29.364 43.424 14.173 1.00 0.00 H ATOM 715 N GLY A 46 31.988 45.112 15.798 1.00 65.20 N ATOM 716 CA GLY A 46 32.571 44.812 17.083 1.00 65.62 C ATOM 717 C GLY A 46 32.123 43.419 17.448 1.00 66.02 C ATOM 718 O GLY A 46 32.163 42.518 16.603 1.00 66.50 O ATOM 719 HA3 GLY A 46 32.224 45.526 17.829 1.00 0.00 H ATOM 720 HA2 GLY A 46 33.658 44.853 17.021 1.00 0.00 H ATOM 721 H GLY A 46 32.608 45.185 14.966 1.00 0.00 H ATOM 722 N ASP A 47 31.655 43.256 18.684 1.00 66.13 N ATOM 723 CA ASP A 47 31.229 41.946 19.196 1.00 66.21 C ATOM 724 C ASP A 47 29.747 41.628 18.872 1.00 65.53 C ATOM 725 O ASP A 47 29.221 40.600 19.319 1.00 65.54 O ATOM 726 CB ASP A 47 31.502 41.822 20.718 1.00 66.60 C ATOM 727 CG ASP A 47 31.529 43.173 21.439 1.00 68.08 C ATOM 728 OD1 ASP A 47 30.449 43.634 21.889 1.00 70.45 O ATOM 729 OD2 ASP A 47 32.585 43.841 21.602 1.00 68.80 O ATOM 730 HA ASP A 47 31.831 41.201 18.676 1.00 0.00 H ATOM 731 HB2 ASP A 47 30.718 41.208 21.162 1.00 0.00 H ATOM 732 HB3 ASP A 47 32.467 41.335 20.858 1.00 0.00 H ATOM 733 H ASP A 47 31.589 44.085 19.309 1.00 0.00 H ATOM 734 N LYS A 48 29.093 42.502 18.099 1.00 64.42 N ATOM 735 CA LYS A 48 27.705 42.316 17.704 1.00 63.77 C ATOM 736 C LYS A 48 27.609 42.124 16.188 1.00 62.45 C ATOM 737 O LYS A 48 28.064 42.967 15.435 1.00 62.33 O ATOM 738 CB LYS A 48 26.854 43.513 18.152 1.00 64.20 C ATOM 739 CG LYS A 48 26.371 43.426 19.612 1.00 65.60 C ATOM 740 CD LYS A 48 25.164 44.356 19.889 1.00 67.45 C ATOM 741 CE LYS A 48 23.886 43.586 20.350 1.00 67.62 C ATOM 742 NZ LYS A 48 23.630 43.660 21.823 1.00 66.01 N ATOM 743 HA LYS A 48 27.319 41.421 18.193 1.00 0.00 H ATOM 744 HB2 LYS A 48 27.450 44.419 18.041 1.00 0.00 H ATOM 745 HB3 LYS A 48 25.979 43.574 17.504 1.00 0.00 H ATOM 746 HG2 LYS A 48 26.077 42.398 19.824 1.00 0.00 H ATOM 747 HG3 LYS A 48 27.192 43.711 20.270 1.00 0.00 H ATOM 748 HD2 LYS A 48 25.443 45.063 20.670 1.00 0.00 H ATOM 749 HD3 LYS A 48 24.929 44.901 18.975 1.00 0.00 H ATOM 750 HE2 LYS A 48 23.998 42.538 20.073 1.00 0.00 H ATOM 751 HE3 LYS A 48 23.025 44.007 19.830 1.00 0.00 H ATOM 752 HZ1 LYS A 48 24.438 43.251 22.335 1.00 0.00 H ATOM 753 HZ2 LYS A 48 23.508 44.654 22.103 1.00 0.00 H ATOM 754 HZ3 LYS A 48 22.767 43.126 22.051 1.00 0.00 H ATOM 755 H LYS A 48 29.597 43.349 17.767 1.00 0.00 H ATOM 756 N MET A 49 27.036 40.998 15.761 1.00 60.88 N ATOM 757 CA MET A 49 26.731 40.733 14.350 1.00 59.66 C ATOM 758 C MET A 49 25.282 41.087 14.016 1.00 58.01 C ATOM 759 O MET A 49 24.387 40.953 14.842 1.00 57.36 O ATOM 760 CB MET A 49 26.955 39.252 14.029 1.00 59.85 C ATOM 761 CG MET A 49 26.855 38.906 12.550 1.00 60.80 C ATOM 762 SD MET A 49 26.962 37.122 12.226 1.00 62.34 S ATOM 763 CE MET A 49 28.243 37.066 11.002 1.00 60.92 C ATOM 764 HA MET A 49 27.397 41.355 13.752 1.00 0.00 H ATOM 765 HB2 MET A 49 27.950 38.974 14.378 1.00 0.00 H ATOM 766 HB3 MET A 49 26.207 38.670 14.567 1.00 0.00 H ATOM 767 HG2 MET A 49 27.668 39.404 12.021 1.00 0.00 H ATOM 768 HG3 MET A 49 25.900 39.271 12.172 1.00 0.00 H ATOM 769 HE1 MET A 49 27.938 37.646 10.131 1.00 0.00 H ATOM 770 HE2 MET A 49 29.159 37.486 11.417 1.00 0.00 H ATOM 771 HE3 MET A 49 28.417 36.031 10.707 1.00 0.00 H ATOM 772 H MET A 49 26.793 40.271 16.464 1.00 0.00 H ATOM 773 N THR A 50 25.066 41.542 12.791 1.00 56.62 N ATOM 774 CA THR A 50 23.731 41.845 12.303 1.00 55.44 C ATOM 775 C THR A 50 23.450 41.060 11.046 1.00 54.20 C ATOM 776 O THR A 50 24.274 40.991 10.144 1.00 53.37 O ATOM 777 CB THR A 50 23.563 43.352 12.059 1.00 55.29 C ATOM 778 OG1 THR A 50 23.688 44.035 13.306 1.00 55.25 O ATOM 779 CG2 THR A 50 22.147 43.685 11.666 1.00 55.76 C ATOM 780 HA THR A 50 23.008 41.552 13.065 1.00 0.00 H ATOM 781 HB THR A 50 24.294 43.629 11.299 1.00 0.00 H ATOM 782 HG1 THR A 50 23.581 45.008 13.160 1.00 0.00 H ATOM 783 HG23 THR A 50 21.917 43.215 10.710 1.00 0.00 H ATOM 784 HG21 THR A 50 21.463 43.314 12.429 1.00 0.00 H ATOM 785 HG22 THR A 50 22.041 44.766 11.576 1.00 0.00 H ATOM 786 H THR A 50 25.878 41.687 12.158 1.00 0.00 H ATOM 787 N MET A 51 22.269 40.458 11.018 1.00 53.13 N ATOM 788 CA MET A 51 21.799 39.705 9.878 1.00 52.44 C ATOM 789 C MET A 51 20.524 40.359 9.372 1.00 51.53 C ATOM 790 O MET A 51 19.501 40.341 10.050 1.00 50.98 O ATOM 791 CB MET A 51 21.515 38.250 10.266 1.00 52.51 C ATOM 792 CG MET A 51 21.042 37.420 9.076 1.00 54.13 C ATOM 793 SD MET A 51 20.489 35.755 9.452 1.00 56.34 S ATOM 794 CE MET A 51 18.917 35.788 8.688 1.00 56.08 C ATOM 795 HA MET A 51 22.564 39.703 9.102 1.00 0.00 H ATOM 796 HB2 MET A 51 22.428 37.807 10.663 1.00 0.00 H ATOM 797 HB3 MET A 51 20.742 38.235 11.034 1.00 0.00 H ATOM 798 HG2 MET A 51 21.869 37.346 8.370 1.00 0.00 H ATOM 799 HG3 MET A 51 20.213 37.950 8.607 1.00 0.00 H ATOM 800 HE1 MET A 51 18.311 36.572 9.141 1.00 0.00 H ATOM 801 HE2 MET A 51 19.036 35.989 7.623 1.00 0.00 H ATOM 802 HE3 MET A 51 18.428 34.824 8.825 1.00 0.00 H ATOM 803 H MET A 51 21.654 40.531 11.853 1.00 0.00 H ATOM 804 N LEU A 52 20.584 40.921 8.173 1.00 50.55 N ATOM 805 CA LEU A 52 19.426 41.538 7.557 1.00 50.44 C ATOM 806 C LEU A 52 18.848 40.605 6.510 1.00 49.96 C ATOM 807 O LEU A 52 19.577 40.080 5.716 1.00 49.88 O ATOM 808 CB LEU A 52 19.856 42.868 6.923 1.00 50.60 C ATOM 809 CG LEU A 52 19.001 43.519 5.837 1.00 50.89 C ATOM 810 CD1 LEU A 52 17.703 44.026 6.428 1.00 50.98 C ATOM 811 CD2 LEU A 52 19.771 44.634 5.199 1.00 51.55 C ATOM 812 HA LEU A 52 18.657 41.730 8.305 1.00 0.00 H ATOM 813 HB2 LEU A 52 19.934 43.591 7.735 1.00 0.00 H ATOM 814 HB3 LEU A 52 20.842 42.703 6.488 1.00 0.00 H ATOM 815 HG LEU A 52 18.757 42.780 5.074 1.00 0.00 H ATOM 816 HD21 LEU A 52 20.027 45.376 5.955 1.00 0.00 H ATOM 817 HD22 LEU A 52 20.683 44.236 4.755 1.00 0.00 H ATOM 818 HD23 LEU A 52 19.161 45.098 4.424 1.00 0.00 H ATOM 819 HD11 LEU A 52 17.153 43.192 6.864 1.00 0.00 H ATOM 820 HD12 LEU A 52 17.921 44.763 7.201 1.00 0.00 H ATOM 821 HD13 LEU A 52 17.104 44.487 5.643 1.00 0.00 H ATOM 822 H LEU A 52 21.488 40.919 7.659 1.00 0.00 H ATOM 823 N THR A 53 17.536 40.414 6.495 1.00 50.21 N ATOM 824 CA THR A 53 16.877 39.608 5.462 1.00 50.49 C ATOM 825 C THR A 53 15.924 40.472 4.677 1.00 51.10 C ATOM 826 O THR A 53 15.090 41.158 5.266 1.00 51.09 O ATOM 827 CB THR A 53 16.127 38.409 6.089 1.00 50.59 C ATOM 828 OG1 THR A 53 17.065 37.519 6.720 1.00 50.03 O ATOM 829 CG2 THR A 53 15.444 37.523 5.000 1.00 50.52 C ATOM 830 HA THR A 53 17.639 39.211 4.791 1.00 0.00 H ATOM 831 HB THR A 53 15.400 38.836 6.780 1.00 0.00 H ATOM 832 HG1 THR A 53 16.577 36.755 7.118 1.00 0.00 H ATOM 833 HG23 THR A 53 14.706 38.117 4.460 1.00 0.00 H ATOM 834 HG21 THR A 53 16.199 37.159 4.303 1.00 0.00 H ATOM 835 HG22 THR A 53 14.951 36.677 5.479 1.00 0.00 H ATOM 836 H THR A 53 16.955 40.850 7.240 1.00 0.00 H ATOM 837 N GLU A 54 16.061 40.457 3.354 1.00 51.87 N ATOM 838 CA GLU A 54 15.220 41.246 2.485 1.00 53.00 C ATOM 839 C GLU A 54 14.494 40.369 1.494 1.00 53.40 C ATOM 840 O GLU A 54 15.112 39.695 0.688 1.00 53.91 O ATOM 841 CB GLU A 54 16.029 42.277 1.693 1.00 53.66 C ATOM 842 CG GLU A 54 16.690 43.358 2.523 1.00 55.06 C ATOM 843 CD GLU A 54 17.665 44.161 1.698 1.00 57.19 C ATOM 844 OE1 GLU A 54 18.714 43.586 1.306 1.00 59.19 O ATOM 845 OE2 GLU A 54 17.377 45.350 1.432 1.00 56.38 O ATOM 846 HA GLU A 54 14.508 41.759 3.131 1.00 0.00 H ATOM 847 HB2 GLU A 54 16.809 41.746 1.148 1.00 0.00 H ATOM 848 HB3 GLU A 54 15.357 42.760 0.984 1.00 0.00 H ATOM 849 HG2 GLU A 54 15.922 44.025 2.915 1.00 0.00 H ATOM 850 HG3 GLU A 54 17.224 42.893 3.352 1.00 0.00 H ATOM 851 H GLU A 54 16.798 39.857 2.932 1.00 0.00 H ATOM 852 N SER A 55 13.172 40.397 1.553 1.00 54.08 N ATOM 853 CA SER A 55 12.343 39.817 0.510 1.00 54.50 C ATOM 854 C SER A 55 11.243 40.800 0.183 1.00 54.87 C ATOM 855 O SER A 55 11.146 41.883 0.766 1.00 55.13 O ATOM 856 CB SER A 55 11.747 38.481 0.969 1.00 54.34 C ATOM 857 OG SER A 55 11.088 38.617 2.219 1.00 54.54 O ATOM 858 HA SER A 55 12.947 39.620 -0.376 1.00 0.00 H ATOM 859 HB2 SER A 55 12.548 37.748 1.067 1.00 0.00 H ATOM 860 HB3 SER A 55 11.030 38.136 0.224 1.00 0.00 H ATOM 861 HG SER A 55 11.736 38.926 2.901 1.00 0.00 H ATOM 862 H SER A 55 12.713 40.848 2.370 1.00 0.00 H ATOM 863 N THR A 56 10.401 40.411 -0.753 1.00 55.52 N ATOM 864 CA THR A 56 9.189 41.167 -1.050 1.00 55.64 C ATOM 865 C THR A 56 8.211 41.073 0.132 1.00 55.77 C ATOM 866 O THR A 56 7.433 41.986 0.357 1.00 56.19 O ATOM 867 CB THR A 56 8.548 40.649 -2.358 1.00 55.50 C ATOM 868 OG1 THR A 56 8.435 39.220 -2.316 1.00 53.94 O ATOM 869 CG2 THR A 56 9.477 40.932 -3.567 1.00 55.65 C ATOM 870 HA THR A 56 9.442 42.217 -1.195 1.00 0.00 H ATOM 871 HB THR A 56 7.582 41.144 -2.457 1.00 0.00 H ATOM 872 HG1 THR A 56 8.024 38.898 -3.157 1.00 0.00 H ATOM 873 HG23 THR A 56 9.617 42.008 -3.672 1.00 0.00 H ATOM 874 HG21 THR A 56 10.442 40.453 -3.402 1.00 0.00 H ATOM 875 HG22 THR A 56 9.022 40.534 -4.474 1.00 0.00 H ATOM 876 H THR A 56 10.605 39.545 -1.292 1.00 0.00 H ATOM 877 N PHE A 57 8.274 39.985 0.895 1.00 55.59 N ATOM 878 CA PHE A 57 7.379 39.802 2.027 1.00 55.66 C ATOM 879 C PHE A 57 7.669 40.819 3.130 1.00 56.16 C ATOM 880 O PHE A 57 6.878 41.740 3.361 1.00 57.03 O ATOM 881 CB PHE A 57 7.504 38.379 2.567 1.00 55.30 C ATOM 882 CG PHE A 57 6.588 38.081 3.713 1.00 53.99 C ATOM 883 CD1 PHE A 57 7.065 37.442 4.839 1.00 52.65 C ATOM 884 CD2 PHE A 57 5.240 38.419 3.651 1.00 53.32 C ATOM 885 CE1 PHE A 57 6.239 37.159 5.886 1.00 51.81 C ATOM 886 CE2 PHE A 57 4.403 38.118 4.688 1.00 52.30 C ATOM 887 CZ PHE A 57 4.904 37.489 5.813 1.00 52.69 C ATOM 888 HA PHE A 57 6.357 39.964 1.684 1.00 0.00 H ATOM 889 HB2 PHE A 57 7.279 37.684 1.758 1.00 0.00 H ATOM 890 HB3 PHE A 57 8.531 38.227 2.900 1.00 0.00 H ATOM 891 HD2 PHE A 57 4.849 38.927 2.770 1.00 0.00 H ATOM 892 HE2 PHE A 57 3.345 38.373 4.629 1.00 0.00 H ATOM 893 HZ PHE A 57 4.240 37.254 6.645 1.00 0.00 H ATOM 894 HE1 PHE A 57 6.634 36.673 6.778 1.00 0.00 H ATOM 895 HD1 PHE A 57 8.116 37.160 4.892 1.00 0.00 H ATOM 896 H PHE A 57 8.977 39.250 0.678 1.00 0.00 H ATOM 897 N LYS A 58 8.806 40.640 3.798 1.00 56.29 N ATOM 898 CA LYS A 58 9.297 41.556 4.818 1.00 56.15 C ATOM 899 C LYS A 58 10.791 41.768 4.661 1.00 55.75 C ATOM 900 O LYS A 58 11.506 40.916 4.117 1.00 55.78 O ATOM 901 CB LYS A 58 9.045 40.978 6.200 1.00 56.31 C ATOM 902 CG LYS A 58 7.592 40.704 6.475 1.00 57.80 C ATOM 903 CD LYS A 58 7.342 40.239 7.889 1.00 58.90 C ATOM 904 CE LYS A 58 5.840 40.178 8.151 1.00 59.95 C ATOM 905 NZ LYS A 58 5.487 39.424 9.395 1.00 60.76 N ATOM 906 HA LYS A 58 8.772 42.504 4.703 1.00 0.00 H ATOM 907 HB2 LYS A 58 9.597 40.042 6.290 1.00 0.00 H ATOM 908 HB3 LYS A 58 9.410 41.686 6.943 1.00 0.00 H ATOM 909 HG2 LYS A 58 7.026 41.620 6.304 1.00 0.00 H ATOM 910 HG3 LYS A 58 7.247 39.931 5.788 1.00 0.00 H ATOM 911 HD2 LYS A 58 7.775 39.248 8.027 1.00 0.00 H ATOM 912 HD3 LYS A 58 7.804 40.937 8.587 1.00 0.00 H ATOM 913 HE2 LYS A 58 5.360 39.691 7.302 1.00 0.00 H ATOM 914 HE3 LYS A 58 5.463 41.196 8.244 1.00 0.00 H ATOM 915 HZ1 LYS A 58 5.832 38.446 9.316 1.00 0.00 H ATOM 916 HZ2 LYS A 58 5.931 39.884 10.215 1.00 0.00 H ATOM 917 HZ3 LYS A 58 4.454 39.420 9.515 1.00 0.00 H ATOM 918 H LYS A 58 9.376 39.798 3.579 1.00 0.00 H ATOM 919 N ASN A 59 11.250 42.912 5.139 1.00 55.14 N ATOM 920 CA ASN A 59 12.662 43.126 5.405 1.00 54.99 C ATOM 921 C ASN A 59 12.841 43.187 6.898 1.00 55.11 C ATOM 922 O ASN A 59 12.594 44.209 7.480 1.00 55.18 O ATOM 923 CB ASN A 59 13.173 44.425 4.776 1.00 54.49 C ATOM 924 CG ASN A 59 12.918 44.491 3.303 1.00 54.04 C ATOM 925 OD1 ASN A 59 12.337 45.444 2.818 1.00 56.02 O ATOM 926 ND2 ASN A 59 13.339 43.471 2.577 1.00 52.01 N ATOM 927 HA ASN A 59 13.234 42.309 4.966 1.00 0.00 H ATOM 928 HB2 ASN A 59 12.672 45.266 5.255 1.00 0.00 H ATOM 929 HB3 ASN A 59 14.247 44.498 4.948 1.00 0.00 H ATOM 930 HD22 ASN A 59 13.832 42.677 3.033 1.00 0.00 H ATOM 931 HD21 ASN A 59 13.178 43.462 1.550 1.00 0.00 H ATOM 932 H ASN A 59 10.579 43.683 5.331 1.00 0.00 H ATOM 933 N LEU A 60 13.228 42.084 7.525 1.00 55.81 N ATOM 934 CA LEU A 60 13.567 42.109 8.941 1.00 56.65 C ATOM 935 C LEU A 60 15.069 42.166 9.110 1.00 56.51 C ATOM 936 O LEU A 60 15.828 41.812 8.224 1.00 56.60 O ATOM 937 CB LEU A 60 13.059 40.869 9.673 1.00 57.14 C ATOM 938 CG LEU A 60 11.624 40.418 9.382 1.00 59.66 C ATOM 939 CD1 LEU A 60 11.602 38.951 8.950 1.00 61.26 C ATOM 940 CD2 LEU A 60 10.677 40.658 10.578 1.00 60.61 C ATOM 941 HA LEU A 60 13.090 42.992 9.366 1.00 0.00 H ATOM 942 HB2 LEU A 60 13.721 40.042 9.415 1.00 0.00 H ATOM 943 HB3 LEU A 60 13.129 41.068 10.742 1.00 0.00 H ATOM 944 HG LEU A 60 11.252 41.031 8.561 1.00 0.00 H ATOM 945 HD21 LEU A 60 11.037 40.100 11.442 1.00 0.00 H ATOM 946 HD22 LEU A 60 10.655 41.722 10.814 1.00 0.00 H ATOM 947 HD23 LEU A 60 9.673 40.321 10.319 1.00 0.00 H ATOM 948 HD11 LEU A 60 12.202 38.830 8.048 1.00 0.00 H ATOM 949 HD12 LEU A 60 12.014 38.333 9.747 1.00 0.00 H ATOM 950 HD13 LEU A 60 10.575 38.649 8.748 1.00 0.00 H ATOM 951 H LEU A 60 13.290 41.189 6.998 1.00 0.00 H ATOM 952 N SER A 61 15.494 42.593 10.279 1.00 56.42 N ATOM 953 CA SER A 61 16.900 42.564 10.618 1.00 56.16 C ATOM 954 C SER A 61 17.023 42.350 12.098 1.00 55.90 C ATOM 955 O SER A 61 16.152 42.744 12.865 1.00 55.62 O ATOM 956 CB SER A 61 17.587 43.864 10.206 1.00 56.20 C ATOM 957 OG SER A 61 18.153 44.499 11.325 1.00 55.45 O ATOM 958 HA SER A 61 17.390 41.752 10.081 1.00 0.00 H ATOM 959 HB2 SER A 61 16.853 44.528 9.749 1.00 0.00 H ATOM 960 HB3 SER A 61 18.373 43.641 9.484 1.00 0.00 H ATOM 961 HG SER A 61 18.593 45.338 11.039 1.00 0.00 H ATOM 962 H SER A 61 14.808 42.957 10.971 1.00 0.00 H ATOM 963 N CYS A 62 18.095 41.694 12.510 1.00 56.03 N ATOM 964 CA CYS A 62 18.359 41.603 13.925 1.00 56.40 C ATOM 965 C CYS A 62 19.824 41.511 14.238 1.00 56.10 C ATOM 966 O CYS A 62 20.645 41.104 13.412 1.00 55.99 O ATOM 967 CB CYS A 62 17.588 40.455 14.560 1.00 56.81 C ATOM 968 SG CYS A 62 18.238 38.872 14.129 1.00 57.93 S ATOM 969 HA CYS A 62 18.004 42.535 14.365 1.00 0.00 H ATOM 970 HB2 CYS A 62 16.551 40.507 14.230 1.00 0.00 H ATOM 971 HB3 CYS A 62 17.629 40.565 15.644 1.00 0.00 H ATOM 972 HG CYS A 62 17.489 37.887 14.740 1.00 0.00 H ATOM 973 H CYS A 62 18.738 41.250 11.824 1.00 0.00 H ATOM 974 N THR A 63 20.120 41.928 15.463 1.00 55.64 N ATOM 975 CA THR A 63 21.468 42.168 15.907 1.00 55.35 C ATOM 976 C THR A 63 21.679 41.426 17.204 1.00 55.01 C ATOM 977 O THR A 63 20.853 41.499 18.131 1.00 55.02 O ATOM 978 CB THR A 63 21.659 43.674 16.070 1.00 55.23 C ATOM 979 OG1 THR A 63 21.815 44.260 14.763 1.00 56.02 O ATOM 980 CG2 THR A 63 22.947 44.015 16.804 1.00 54.70 C ATOM 981 HA THR A 63 22.203 41.809 15.187 1.00 0.00 H ATOM 982 HB THR A 63 20.796 44.044 16.623 1.00 0.00 H ATOM 983 HG1 THR A 63 22.606 43.865 14.318 1.00 0.00 H ATOM 984 HG23 THR A 63 22.909 43.603 17.812 1.00 0.00 H ATOM 985 HG21 THR A 63 23.794 43.587 16.267 1.00 0.00 H ATOM 986 HG22 THR A 63 23.058 45.098 16.857 1.00 0.00 H ATOM 987 H THR A 63 19.341 42.089 16.133 1.00 0.00 H ATOM 988 N PHE A 64 22.803 40.730 17.271 1.00 54.73 N ATOM 989 CA PHE A 64 23.070 39.845 18.378 1.00 54.74 C ATOM 990 C PHE A 64 24.546 39.758 18.776 1.00 55.19 C ATOM 991 O PHE A 64 25.449 39.852 17.947 1.00 55.19 O ATOM 992 CB PHE A 64 22.519 38.453 18.049 1.00 54.47 C ATOM 993 CG PHE A 64 22.958 37.908 16.711 1.00 53.77 C ATOM 994 CD1 PHE A 64 22.134 38.005 15.605 1.00 54.22 C ATOM 995 CD2 PHE A 64 24.181 37.262 16.571 1.00 54.25 C ATOM 996 CE1 PHE A 64 22.537 37.488 14.362 1.00 54.74 C ATOM 997 CE2 PHE A 64 24.582 36.728 15.338 1.00 54.22 C ATOM 998 CZ PHE A 64 23.769 36.849 14.238 1.00 53.98 C ATOM 999 HA PHE A 64 22.566 40.268 19.247 1.00 0.00 H ATOM 1000 HB2 PHE A 64 22.851 37.763 18.824 1.00 0.00 H ATOM 1001 HB3 PHE A 64 21.430 38.507 18.055 1.00 0.00 H ATOM 1002 HD2 PHE A 64 24.840 37.169 17.435 1.00 0.00 H ATOM 1003 HE2 PHE A 64 25.541 36.216 15.253 1.00 0.00 H ATOM 1004 HZ PHE A 64 24.085 36.448 13.275 1.00 0.00 H ATOM 1005 HE1 PHE A 64 21.885 37.587 13.494 1.00 0.00 H ATOM 1006 HD1 PHE A 64 21.161 38.488 15.698 1.00 0.00 H ATOM 1007 H PHE A 64 23.507 40.823 16.511 1.00 0.00 H ATOM 1008 N LYS A 65 24.759 39.613 20.076 1.00 55.84 N ATOM 1009 CA LYS A 65 25.966 39.021 20.635 1.00 56.57 C ATOM 1010 C LYS A 65 25.813 37.489 20.591 1.00 56.95 C ATOM 1011 O LYS A 65 24.699 36.974 20.707 1.00 56.57 O ATOM 1012 CB LYS A 65 26.134 39.497 22.089 1.00 56.68 C ATOM 1013 CG LYS A 65 27.523 39.318 22.689 1.00 57.53 C ATOM 1014 CD LYS A 65 27.930 40.507 23.589 1.00 58.08 C ATOM 1015 CE LYS A 65 27.663 41.868 22.910 1.00 58.74 C ATOM 1016 NZ LYS A 65 28.496 42.992 23.428 1.00 58.12 N ATOM 1017 HA LYS A 65 26.845 39.320 20.064 1.00 0.00 H ATOM 1018 HB2 LYS A 65 25.888 40.558 22.124 1.00 0.00 H ATOM 1019 HB3 LYS A 65 25.428 38.941 22.707 1.00 0.00 H ATOM 1020 HG2 LYS A 65 27.532 38.406 23.286 1.00 0.00 H ATOM 1021 HG3 LYS A 65 28.246 39.227 21.879 1.00 0.00 H ATOM 1022 HD2 LYS A 65 27.359 40.458 24.516 1.00 0.00 H ATOM 1023 HD3 LYS A 65 28.994 40.429 23.815 1.00 0.00 H ATOM 1024 HE2 LYS A 65 26.614 42.124 23.060 1.00 0.00 H ATOM 1025 HE3 LYS A 65 27.860 41.761 21.843 1.00 0.00 H ATOM 1026 HZ1 LYS A 65 28.312 43.119 24.444 1.00 0.00 H ATOM 1027 HZ2 LYS A 65 29.502 42.772 23.282 1.00 0.00 H ATOM 1028 HZ3 LYS A 65 28.253 43.865 22.919 1.00 0.00 H ATOM 1029 H LYS A 65 24.023 39.940 20.734 1.00 0.00 H ATOM 1030 N PHE A 66 26.924 36.767 20.421 1.00 57.68 N ATOM 1031 CA PHE A 66 26.896 35.305 20.428 1.00 58.20 C ATOM 1032 C PHE A 66 26.724 34.791 21.846 1.00 58.60 C ATOM 1033 O PHE A 66 27.422 35.232 22.751 1.00 58.73 O ATOM 1034 CB PHE A 66 28.179 34.707 19.825 1.00 58.24 C ATOM 1035 CG PHE A 66 28.370 35.029 18.368 1.00 58.91 C ATOM 1036 CD1 PHE A 66 27.457 34.584 17.419 1.00 58.38 C ATOM 1037 CD2 PHE A 66 29.456 35.782 17.945 1.00 59.18 C ATOM 1038 CE1 PHE A 66 27.620 34.891 16.081 1.00 58.77 C ATOM 1039 CE2 PHE A 66 29.625 36.083 16.606 1.00 59.48 C ATOM 1040 CZ PHE A 66 28.699 35.644 15.672 1.00 59.16 C ATOM 1041 HA PHE A 66 26.051 34.994 19.814 1.00 0.00 H ATOM 1042 HB2 PHE A 66 29.034 35.096 20.379 1.00 0.00 H ATOM 1043 HB3 PHE A 66 28.139 33.623 19.936 1.00 0.00 H ATOM 1044 HD2 PHE A 66 30.182 36.139 18.675 1.00 0.00 H ATOM 1045 HE2 PHE A 66 30.488 36.666 16.284 1.00 0.00 H ATOM 1046 HZ PHE A 66 28.824 35.894 14.618 1.00 0.00 H ATOM 1047 HE1 PHE A 66 26.894 34.537 15.349 1.00 0.00 H ATOM 1048 HD1 PHE A 66 26.602 33.986 17.734 1.00 0.00 H ATOM 1049 H PHE A 66 27.831 37.257 20.280 1.00 0.00 H ATOM 1050 N GLY A 67 25.796 33.856 22.024 1.00 59.17 N ATOM 1051 CA GLY A 67 25.547 33.224 23.303 1.00 59.58 C ATOM 1052 C GLY A 67 24.457 33.951 24.064 1.00 60.07 C ATOM 1053 O GLY A 67 23.855 33.401 24.996 1.00 59.99 O ATOM 1054 HA3 GLY A 67 26.464 33.238 23.892 1.00 0.00 H ATOM 1055 HA2 GLY A 67 25.239 32.192 23.137 1.00 0.00 H ATOM 1056 H GLY A 67 25.222 33.565 21.207 1.00 0.00 H ATOM 1057 N GLU A 68 24.176 35.174 23.628 1.00 60.45 N ATOM 1058 CA GLU A 68 23.383 36.106 24.398 1.00 61.04 C ATOM 1059 C GLU A 68 21.935 36.044 23.929 1.00 60.94 C ATOM 1060 O GLU A 68 21.623 36.446 22.823 1.00 61.04 O ATOM 1061 CB GLU A 68 23.960 37.517 24.225 1.00 61.20 C ATOM 1062 CG GLU A 68 23.013 38.643 24.621 1.00 62.71 C ATOM 1063 CD GLU A 68 23.712 39.970 24.880 1.00 63.91 C ATOM 1064 OE1 GLU A 68 23.345 40.957 24.183 1.00 62.71 O ATOM 1065 OE2 GLU A 68 24.599 40.025 25.793 1.00 63.62 O ATOM 1066 HA GLU A 68 23.412 35.846 25.456 1.00 0.00 H ATOM 1067 HB2 GLU A 68 24.857 37.595 24.839 1.00 0.00 H ATOM 1068 HB3 GLU A 68 24.226 37.649 23.176 1.00 0.00 H ATOM 1069 HG2 GLU A 68 22.292 38.785 23.816 1.00 0.00 H ATOM 1070 HG3 GLU A 68 22.488 38.348 25.529 1.00 0.00 H ATOM 1071 H GLU A 68 24.539 35.472 22.700 1.00 0.00 H ATOM 1072 N GLU A 69 21.051 35.550 24.777 1.00 60.94 N ATOM 1073 CA GLU A 69 19.654 35.439 24.419 1.00 61.01 C ATOM 1074 C GLU A 69 19.090 36.823 24.083 1.00 60.96 C ATOM 1075 O GLU A 69 19.580 37.844 24.575 1.00 61.17 O ATOM 1076 CB GLU A 69 18.880 34.784 25.559 1.00 61.28 C ATOM 1077 CG GLU A 69 17.453 34.359 25.231 1.00 62.03 C ATOM 1078 CD GLU A 69 16.508 34.613 26.384 1.00 64.05 C ATOM 1079 OE1 GLU A 69 15.781 33.671 26.762 1.00 65.51 O ATOM 1080 OE2 GLU A 69 16.500 35.751 26.925 1.00 65.61 O ATOM 1081 HA GLU A 69 19.551 34.810 23.534 1.00 0.00 H ATOM 1082 HB2 GLU A 69 19.431 33.897 25.871 1.00 0.00 H ATOM 1083 HB3 GLU A 69 18.837 35.493 26.386 1.00 0.00 H ATOM 1084 HG2 GLU A 69 17.109 34.921 24.363 1.00 0.00 H ATOM 1085 HG3 GLU A 69 17.447 33.294 24.999 1.00 0.00 H ATOM 1086 H GLU A 69 21.365 35.236 25.717 1.00 0.00 H ATOM 1087 N PHE A 70 18.076 36.842 23.220 1.00 60.60 N ATOM 1088 CA PHE A 70 17.511 38.075 22.678 1.00 60.22 C ATOM 1089 C PHE A 70 16.173 37.805 21.996 1.00 60.03 C ATOM 1090 O PHE A 70 15.996 36.800 21.319 1.00 60.05 O ATOM 1091 CB PHE A 70 18.472 38.738 21.689 1.00 60.26 C ATOM 1092 CG PHE A 70 18.589 38.029 20.350 1.00 59.74 C ATOM 1093 CD1 PHE A 70 19.542 37.047 20.153 1.00 59.06 C ATOM 1094 CD2 PHE A 70 17.773 38.382 19.286 1.00 59.65 C ATOM 1095 CE1 PHE A 70 19.666 36.409 18.938 1.00 59.44 C ATOM 1096 CE2 PHE A 70 17.894 37.750 18.047 1.00 59.85 C ATOM 1097 CZ PHE A 70 18.845 36.762 17.875 1.00 59.58 C ATOM 1098 HA PHE A 70 17.351 38.756 23.514 1.00 0.00 H ATOM 1099 HB2 PHE A 70 18.125 39.755 21.507 1.00 0.00 H ATOM 1100 HB3 PHE A 70 19.462 38.770 22.145 1.00 0.00 H ATOM 1101 HD2 PHE A 70 17.026 39.165 19.419 1.00 0.00 H ATOM 1102 HE2 PHE A 70 17.243 38.034 17.221 1.00 0.00 H ATOM 1103 HZ PHE A 70 18.950 36.263 16.912 1.00 0.00 H ATOM 1104 HE1 PHE A 70 20.411 35.624 18.811 1.00 0.00 H ATOM 1105 HD1 PHE A 70 20.206 36.773 20.972 1.00 0.00 H ATOM 1106 H PHE A 70 17.667 35.935 22.917 1.00 0.00 H ATOM 1107 N ASP A 71 15.233 38.721 22.172 1.00 59.78 N ATOM 1108 CA ASP A 71 13.889 38.531 21.653 1.00 59.31 C ATOM 1109 C ASP A 71 13.914 38.899 20.198 1.00 58.50 C ATOM 1110 O ASP A 71 14.711 39.719 19.761 1.00 58.98 O ATOM 1111 CB ASP A 71 12.867 39.404 22.392 1.00 59.58 C ATOM 1112 CG ASP A 71 12.522 38.879 23.771 1.00 60.15 C ATOM 1113 OD1 ASP A 71 12.906 37.741 24.122 1.00 61.40 O ATOM 1114 OD2 ASP A 71 11.838 39.545 24.569 1.00 61.55 O ATOM 1115 HA ASP A 71 13.587 37.494 21.796 1.00 0.00 H ATOM 1116 HB2 ASP A 71 13.279 40.408 22.496 1.00 0.00 H ATOM 1117 HB3 ASP A 71 11.954 39.447 21.799 1.00 0.00 H ATOM 1118 H ASP A 71 15.461 39.593 22.691 1.00 0.00 H ATOM 1119 N GLU A 72 13.012 38.297 19.454 1.00 57.61 N ATOM 1120 CA GLU A 72 12.997 38.439 18.021 1.00 56.92 C ATOM 1121 C GLU A 72 11.587 38.180 17.557 1.00 56.01 C ATOM 1122 O GLU A 72 10.884 37.376 18.149 1.00 55.60 O ATOM 1123 CB GLU A 72 13.959 37.417 17.424 1.00 57.15 C ATOM 1124 CG GLU A 72 14.274 37.579 15.953 1.00 57.77 C ATOM 1125 CD GLU A 72 14.666 36.259 15.338 1.00 59.08 C ATOM 1126 OE1 GLU A 72 15.474 35.540 15.961 1.00 57.92 O ATOM 1127 OE2 GLU A 72 14.149 35.934 14.248 1.00 61.14 O ATOM 1128 HA GLU A 72 13.309 39.435 17.708 1.00 0.00 H ATOM 1129 HB2 GLU A 72 14.897 37.481 17.975 1.00 0.00 H ATOM 1130 HB3 GLU A 72 13.524 36.428 17.565 1.00 0.00 H ATOM 1131 HG2 GLU A 72 13.393 37.965 15.440 1.00 0.00 H ATOM 1132 HG3 GLU A 72 15.097 38.284 15.840 1.00 0.00 H ATOM 1133 H GLU A 72 12.291 37.703 19.912 1.00 0.00 H ATOM 1134 N LYS A 73 11.165 38.908 16.529 1.00 55.46 N ATOM 1135 CA LYS A 73 9.936 38.599 15.820 1.00 54.83 C ATOM 1136 C LYS A 73 10.367 37.980 14.504 1.00 53.50 C ATOM 1137 O LYS A 73 11.177 38.558 13.776 1.00 53.18 O ATOM 1138 CB LYS A 73 9.089 39.863 15.611 1.00 55.43 C ATOM 1139 CG LYS A 73 7.565 39.599 15.425 1.00 57.09 C ATOM 1140 CD LYS A 73 6.675 40.612 16.201 1.00 57.76 C ATOM 1141 CE LYS A 73 5.554 41.209 15.333 1.00 57.88 C ATOM 1142 NZ LYS A 73 4.379 40.283 15.241 1.00 57.86 N ATOM 1143 HA LYS A 73 9.303 37.913 16.383 1.00 0.00 H ATOM 1144 HB2 LYS A 73 9.219 40.507 16.480 1.00 0.00 H ATOM 1145 HB3 LYS A 73 9.456 40.376 14.722 1.00 0.00 H ATOM 1146 HG2 LYS A 73 7.327 39.668 14.364 1.00 0.00 H ATOM 1147 HG3 LYS A 73 7.340 38.594 15.782 1.00 0.00 H ATOM 1148 HD2 LYS A 73 6.223 40.099 17.050 1.00 0.00 H ATOM 1149 HD3 LYS A 73 7.306 41.424 16.563 1.00 0.00 H ATOM 1150 HE2 LYS A 73 5.941 41.392 14.330 1.00 0.00 H ATOM 1151 HE3 LYS A 73 5.229 42.152 15.773 1.00 0.00 H ATOM 1152 HZ1 LYS A 73 4.681 39.383 14.817 1.00 0.00 H ATOM 1153 HZ2 LYS A 73 4.001 40.109 16.194 1.00 0.00 H ATOM 1154 HZ3 LYS A 73 3.643 40.717 14.649 1.00 0.00 H ATOM 1155 H LYS A 73 11.732 39.724 16.223 1.00 0.00 H ATOM 1156 N THR A 74 9.852 36.783 14.232 1.00 52.16 N ATOM 1157 CA THR A 74 10.174 36.038 13.029 1.00 50.73 C ATOM 1158 C THR A 74 9.346 36.621 11.910 1.00 50.71 C ATOM 1159 O THR A 74 8.396 37.378 12.165 1.00 50.09 O ATOM 1160 CB THR A 74 9.904 34.482 13.172 1.00 50.34 C ATOM 1161 OG1 THR A 74 8.509 34.205 13.306 1.00 47.49 O ATOM 1162 CG2 THR A 74 10.499 33.916 14.430 1.00 49.34 C ATOM 1163 HA THR A 74 11.241 36.131 12.827 1.00 0.00 H ATOM 1164 HB THR A 74 10.342 34.044 12.275 1.00 0.00 H ATOM 1165 HG1 THR A 74 8.030 34.535 12.505 1.00 0.00 H ATOM 1166 HG23 THR A 74 11.577 34.078 14.426 1.00 0.00 H ATOM 1167 HG21 THR A 74 10.059 34.413 15.294 1.00 0.00 H ATOM 1168 HG22 THR A 74 10.292 32.847 14.480 1.00 0.00 H ATOM 1169 H THR A 74 9.188 36.362 14.913 1.00 0.00 H ATOM 1170 N SER A 75 9.709 36.261 10.676 1.00 50.55 N ATOM 1171 CA SER A 75 9.059 36.807 9.488 1.00 50.52 C ATOM 1172 C SER A 75 7.576 36.485 9.471 1.00 50.54 C ATOM 1173 O SER A 75 6.766 37.321 9.138 1.00 51.36 O ATOM 1174 CB SER A 75 9.722 36.290 8.217 1.00 50.46 C ATOM 1175 OG SER A 75 9.784 34.869 8.178 1.00 50.70 O ATOM 1176 HA SER A 75 9.172 37.890 9.525 1.00 0.00 H ATOM 1177 HB2 SER A 75 10.736 36.687 8.164 1.00 0.00 H ATOM 1178 HB3 SER A 75 9.151 36.640 7.357 1.00 0.00 H ATOM 1179 HG SER A 75 10.221 34.582 7.337 1.00 0.00 H ATOM 1180 H SER A 75 10.478 35.571 10.558 1.00 0.00 H ATOM 1181 N ASP A 76 7.171 35.376 9.848 1.00 50.52 N ATOM 1182 CA ASP A 76 5.888 34.744 9.948 1.00 50.40 C ATOM 1183 C ASP A 76 5.097 35.304 11.096 1.00 50.84 C ATOM 1184 O ASP A 76 3.881 35.292 11.195 1.00 50.70 O ATOM 1185 CB ASP A 76 5.917 33.242 9.992 1.00 50.05 C ATOM 1186 CG ASP A 76 6.521 32.726 11.276 1.00 49.38 C ATOM 1187 OD1 ASP A 76 5.762 32.440 12.193 1.00 48.17 O ATOM 1188 OD2 ASP A 76 7.744 32.689 11.338 1.00 47.35 O ATOM 1189 HA ASP A 76 5.386 34.985 9.011 1.00 0.00 H ATOM 1190 HB2 ASP A 76 4.897 32.867 9.907 1.00 0.00 H ATOM 1191 HB3 ASP A 76 6.508 32.876 9.153 1.00 0.00 H ATOM 1192 H ASP A 76 7.944 34.758 10.167 1.00 0.00 H ATOM 1193 N GLY A 77 5.822 35.905 12.063 1.00 51.43 N ATOM 1194 CA GLY A 77 5.151 36.535 13.149 1.00 51.89 C ATOM 1195 C GLY A 77 5.165 35.913 14.492 1.00 51.77 C ATOM 1196 O GLY A 77 4.395 36.314 15.349 1.00 52.34 O ATOM 1197 HA3 GLY A 77 4.105 36.632 12.858 1.00 0.00 H ATOM 1198 HA2 GLY A 77 5.590 37.527 13.257 1.00 0.00 H ATOM 1199 H GLY A 77 6.861 35.908 12.015 1.00 0.00 H ATOM 1200 N ARG A 78 6.006 34.920 14.721 1.00 52.03 N ATOM 1201 CA ARG A 78 6.072 34.360 16.086 1.00 52.27 C ATOM 1202 C ARG A 78 7.072 35.241 16.877 1.00 52.94 C ATOM 1203 O ARG A 78 8.037 35.777 16.394 1.00 52.69 O ATOM 1204 CB ARG A 78 6.523 32.929 15.995 1.00 52.20 C ATOM 1205 CG ARG A 78 5.592 32.033 15.246 1.00 50.36 C ATOM 1206 CD ARG A 78 6.361 30.590 14.990 1.00 49.30 C ATOM 1207 NE ARG A 78 7.350 30.657 13.959 1.00 47.10 N ATOM 1208 CZ ARG A 78 8.639 30.479 14.040 1.00 45.51 C ATOM 1209 NH1 ARG A 78 9.394 30.644 12.989 1.00 45.30 N ATOM 1210 NH2 ARG A 78 9.180 30.100 15.164 1.00 44.16 N ATOM 1211 HA ARG A 78 5.108 34.365 16.594 1.00 0.00 H ATOM 1212 HB2 ARG A 78 7.492 32.908 15.496 1.00 0.00 H ATOM 1213 HB3 ARG A 78 6.629 32.540 17.008 1.00 0.00 H ATOM 1214 HG2 ARG A 78 4.686 31.871 15.830 1.00 0.00 H ATOM 1215 HG3 ARG A 78 5.331 32.487 14.290 1.00 0.00 H ATOM 1216 HD2 ARG A 78 5.617 29.845 14.709 1.00 0.00 H ATOM 1217 HD3 ARG A 78 6.846 30.286 15.917 1.00 0.00 H ATOM 1218 HE ARG A 78 6.989 30.879 13.009 1.00 0.00 H ATOM 1219 HH12 ARG A 78 10.422 30.501 13.059 1.00 0.00 H ATOM 1220 HH11 ARG A 78 8.968 30.919 12.081 1.00 0.00 H ATOM 1221 HH22 ARG A 78 10.209 29.959 15.225 1.00 0.00 H ATOM 1222 HH21 ARG A 78 8.583 29.939 16.000 1.00 0.00 H ATOM 1223 H ARG A 78 6.606 34.543 13.960 1.00 0.00 H ATOM 1224 N ASN A 79 6.727 35.607 18.092 1.00 53.62 N ATOM 1225 CA ASN A 79 7.654 36.223 19.030 1.00 54.03 C ATOM 1226 C ASN A 79 8.454 35.085 19.634 1.00 53.86 C ATOM 1227 O ASN A 79 7.888 34.236 20.320 1.00 53.90 O ATOM 1228 CB ASN A 79 6.891 36.998 20.117 1.00 54.56 C ATOM 1229 CG ASN A 79 6.087 38.141 19.544 1.00 54.45 C ATOM 1230 OD1 ASN A 79 6.482 39.289 19.647 1.00 54.95 O ATOM 1231 ND2 ASN A 79 4.977 37.822 18.893 1.00 54.95 N ATOM 1232 HA ASN A 79 8.305 36.943 18.534 1.00 0.00 H ATOM 1233 HB2 ASN A 79 6.214 36.313 20.627 1.00 0.00 H ATOM 1234 HB3 ASN A 79 7.609 37.398 20.833 1.00 0.00 H ATOM 1235 HD22 ASN A 79 4.678 36.828 18.831 1.00 0.00 H ATOM 1236 HD21 ASN A 79 4.405 38.566 18.445 1.00 0.00 H ATOM 1237 H ASN A 79 5.745 35.449 18.397 1.00 0.00 H ATOM 1238 N VAL A 80 9.754 35.049 19.344 1.00 53.94 N ATOM 1239 CA VAL A 80 10.635 33.953 19.774 1.00 54.06 C ATOM 1240 C VAL A 80 11.797 34.448 20.640 1.00 54.29 C ATOM 1241 O VAL A 80 12.229 35.585 20.513 1.00 54.26 O ATOM 1242 CB VAL A 80 11.229 33.195 18.554 1.00 53.97 C ATOM 1243 CG1 VAL A 80 10.130 32.522 17.764 1.00 54.22 C ATOM 1244 CG2 VAL A 80 12.072 34.126 17.651 1.00 53.26 C ATOM 1245 HA VAL A 80 10.010 33.283 20.364 1.00 0.00 H ATOM 1246 HB VAL A 80 11.901 32.427 18.937 1.00 0.00 H ATOM 1247 HG11 VAL A 80 9.608 31.811 18.404 1.00 0.00 H ATOM 1248 HG12 VAL A 80 9.428 33.275 17.407 1.00 0.00 H ATOM 1249 HG13 VAL A 80 10.565 31.996 16.914 1.00 0.00 H ATOM 1250 HG21 VAL A 80 11.444 34.935 17.278 1.00 0.00 H ATOM 1251 HG22 VAL A 80 12.897 34.542 18.230 1.00 0.00 H ATOM 1252 HG23 VAL A 80 12.468 33.555 16.811 1.00 0.00 H ATOM 1253 H VAL A 80 10.163 35.829 18.790 1.00 0.00 H ATOM 1254 N LYS A 81 12.308 33.585 21.509 1.00 54.64 N ATOM 1255 CA LYS A 81 13.539 33.871 22.232 1.00 55.00 C ATOM 1256 C LYS A 81 14.644 33.167 21.490 1.00 54.59 C ATOM 1257 O LYS A 81 14.622 31.937 21.359 1.00 54.47 O ATOM 1258 CB LYS A 81 13.495 33.325 23.661 1.00 55.54 C ATOM 1259 CG LYS A 81 12.492 33.988 24.592 1.00 56.78 C ATOM 1260 CD LYS A 81 12.447 33.243 25.944 1.00 58.50 C ATOM 1261 CE LYS A 81 11.612 31.953 25.875 1.00 59.44 C ATOM 1262 NZ LYS A 81 12.395 30.748 25.440 1.00 59.67 N ATOM 1263 HA LYS A 81 13.687 34.949 22.291 1.00 0.00 H ATOM 1264 HB2 LYS A 81 13.251 32.264 23.607 1.00 0.00 H ATOM 1265 HB3 LYS A 81 14.487 33.446 24.096 1.00 0.00 H ATOM 1266 HG2 LYS A 81 12.787 35.024 24.761 1.00 0.00 H ATOM 1267 HG3 LYS A 81 11.503 33.963 24.134 1.00 0.00 H ATOM 1268 HD2 LYS A 81 13.465 32.986 26.237 1.00 0.00 H ATOM 1269 HD3 LYS A 81 12.011 33.903 26.693 1.00 0.00 H ATOM 1270 HE2 LYS A 81 10.797 32.108 25.168 1.00 0.00 H ATOM 1271 HE3 LYS A 81 11.200 31.757 26.865 1.00 0.00 H ATOM 1272 HZ1 LYS A 81 12.787 30.915 24.491 1.00 0.00 H ATOM 1273 HZ2 LYS A 81 13.171 30.579 26.112 1.00 0.00 H ATOM 1274 HZ3 LYS A 81 11.768 29.919 25.417 1.00 0.00 H ATOM 1275 H LYS A 81 11.818 32.683 21.678 1.00 0.00 H ATOM 1276 N SER A 82 15.623 33.931 21.027 1.00 53.81 N ATOM 1277 CA SER A 82 16.680 33.378 20.209 1.00 53.58 C ATOM 1278 C SER A 82 18.033 33.443 20.881 1.00 53.07 C ATOM 1279 O SER A 82 18.294 34.315 21.682 1.00 53.57 O ATOM 1280 CB SER A 82 16.714 34.115 18.878 1.00 53.67 C ATOM 1281 OG SER A 82 15.405 34.202 18.358 1.00 54.27 O ATOM 1282 HA SER A 82 16.464 32.321 20.052 1.00 0.00 H ATOM 1283 HB2 SER A 82 17.349 33.573 18.177 1.00 0.00 H ATOM 1284 HB3 SER A 82 17.114 35.118 19.027 1.00 0.00 H ATOM 1285 HG SER A 82 15.426 34.681 17.492 1.00 0.00 H ATOM 1286 H SER A 82 15.631 34.945 21.256 1.00 0.00 H ATOM 1287 N VAL A 83 18.885 32.485 20.569 1.00 52.48 N ATOM 1288 CA VAL A 83 20.303 32.599 20.850 1.00 52.10 C ATOM 1289 C VAL A 83 21.046 32.160 19.584 1.00 51.57 C ATOM 1290 O VAL A 83 20.675 31.164 18.973 1.00 51.38 O ATOM 1291 CB VAL A 83 20.712 31.755 22.091 1.00 52.07 C ATOM 1292 CG1 VAL A 83 20.523 30.237 21.862 1.00 52.37 C ATOM 1293 CG2 VAL A 83 22.126 32.039 22.466 1.00 52.50 C ATOM 1294 HA VAL A 83 20.564 33.627 21.102 1.00 0.00 H ATOM 1295 HB VAL A 83 20.050 32.047 22.906 1.00 0.00 H ATOM 1296 HG11 VAL A 83 19.475 30.031 21.646 1.00 0.00 H ATOM 1297 HG12 VAL A 83 21.138 29.918 21.021 1.00 0.00 H ATOM 1298 HG13 VAL A 83 20.823 29.695 22.759 1.00 0.00 H ATOM 1299 HG21 VAL A 83 22.780 31.786 21.631 1.00 0.00 H ATOM 1300 HG22 VAL A 83 22.232 33.097 22.704 1.00 0.00 H ATOM 1301 HG23 VAL A 83 22.397 31.441 23.336 1.00 0.00 H ATOM 1302 H VAL A 83 18.529 31.623 20.108 1.00 0.00 H ATOM 1303 N VAL A 84 22.047 32.933 19.167 1.00 51.04 N ATOM 1304 CA VAL A 84 22.996 32.501 18.142 1.00 50.99 C ATOM 1305 C VAL A 84 24.340 32.128 18.776 1.00 51.00 C ATOM 1306 O VAL A 84 25.002 32.971 19.349 1.00 50.35 O ATOM 1307 CB VAL A 84 23.257 33.578 17.034 1.00 50.83 C ATOM 1308 CG1 VAL A 84 23.977 32.944 15.851 1.00 50.02 C ATOM 1309 CG2 VAL A 84 21.956 34.252 16.574 1.00 50.87 C ATOM 1310 HA VAL A 84 22.534 31.636 17.665 1.00 0.00 H ATOM 1311 HB VAL A 84 23.889 34.354 17.465 1.00 0.00 H ATOM 1312 HG11 VAL A 84 24.930 32.534 16.185 1.00 0.00 H ATOM 1313 HG12 VAL A 84 23.361 32.145 15.438 1.00 0.00 H ATOM 1314 HG13 VAL A 84 24.154 33.701 15.087 1.00 0.00 H ATOM 1315 HG21 VAL A 84 21.282 33.498 16.167 1.00 0.00 H ATOM 1316 HG22 VAL A 84 21.483 34.743 17.424 1.00 0.00 H ATOM 1317 HG23 VAL A 84 22.183 34.991 15.806 1.00 0.00 H ATOM 1318 H VAL A 84 22.158 33.879 19.586 1.00 0.00 H ATOM 1319 N GLU A 85 24.740 30.866 18.645 1.00 51.65 N ATOM 1320 CA GLU A 85 26.055 30.411 19.085 1.00 52.59 C ATOM 1321 C GLU A 85 27.050 30.390 17.922 1.00 52.68 C ATOM 1322 O GLU A 85 26.697 30.052 16.803 1.00 51.89 O ATOM 1323 CB GLU A 85 25.957 29.015 19.723 1.00 52.91 C ATOM 1324 CG GLU A 85 24.927 28.888 20.850 1.00 54.65 C ATOM 1325 CD GLU A 85 25.378 29.477 22.186 1.00 58.69 C ATOM 1326 OE1 GLU A 85 24.638 29.288 23.203 1.00 60.31 O ATOM 1327 OE2 GLU A 85 26.450 30.143 22.228 1.00 60.30 O ATOM 1328 HA GLU A 85 26.419 31.116 19.833 1.00 0.00 H ATOM 1329 HB2 GLU A 85 25.692 28.304 18.941 1.00 0.00 H ATOM 1330 HB3 GLU A 85 26.936 28.759 20.129 1.00 0.00 H ATOM 1331 HG2 GLU A 85 24.017 29.402 20.540 1.00 0.00 H ATOM 1332 HG3 GLU A 85 24.712 27.830 20.999 1.00 0.00 H ATOM 1333 H GLU A 85 24.091 30.178 18.213 1.00 0.00 H ATOM 1334 N LYS A 86 28.292 30.771 18.194 1.00 53.02 N ATOM 1335 CA LYS A 86 29.386 30.552 17.256 1.00 53.68 C ATOM 1336 C LYS A 86 29.922 29.120 17.395 1.00 54.06 C ATOM 1337 O LYS A 86 30.475 28.744 18.432 1.00 54.03 O ATOM 1338 CB LYS A 86 30.496 31.566 17.499 1.00 54.02 C ATOM 1339 CG LYS A 86 31.517 31.649 16.391 1.00 55.61 C ATOM 1340 CD LYS A 86 32.304 32.962 16.449 1.00 57.93 C ATOM 1341 CE LYS A 86 33.481 32.912 17.421 1.00 59.79 C ATOM 1342 NZ LYS A 86 34.609 33.802 16.962 1.00 60.29 N ATOM 1343 HA LYS A 86 29.014 30.685 16.240 1.00 0.00 H ATOM 1344 HB2 LYS A 86 30.040 32.549 17.618 1.00 0.00 H ATOM 1345 HB3 LYS A 86 31.012 31.293 18.419 1.00 0.00 H ATOM 1346 HG2 LYS A 86 32.212 30.815 16.486 1.00 0.00 H ATOM 1347 HG3 LYS A 86 31.004 31.585 15.431 1.00 0.00 H ATOM 1348 HD2 LYS A 86 32.686 33.182 15.452 1.00 0.00 H ATOM 1349 HD3 LYS A 86 31.629 33.758 16.762 1.00 0.00 H ATOM 1350 HE2 LYS A 86 33.843 31.886 17.489 1.00 0.00 H ATOM 1351 HE3 LYS A 86 33.145 33.243 18.404 1.00 0.00 H ATOM 1352 HZ1 LYS A 86 34.938 33.488 16.027 1.00 0.00 H ATOM 1353 HZ2 LYS A 86 34.271 34.784 16.901 1.00 0.00 H ATOM 1354 HZ3 LYS A 86 35.393 33.746 17.643 1.00 0.00 H ATOM 1355 H LYS A 86 28.490 31.239 19.102 1.00 0.00 H ATOM 1356 N ASN A 87 29.726 28.317 16.351 1.00 54.24 N ATOM 1357 CA ASN A 87 30.262 26.960 16.295 1.00 54.50 C ATOM 1358 C ASN A 87 31.712 27.019 15.828 1.00 55.28 C ATOM 1359 O ASN A 87 32.616 26.441 16.452 1.00 56.05 O ATOM 1360 CB ASN A 87 29.424 26.068 15.366 1.00 54.11 C ATOM 1361 CG ASN A 87 27.936 26.199 15.624 1.00 53.43 C ATOM 1362 OD1 ASN A 87 27.200 26.735 14.816 1.00 52.30 O ATOM 1363 ND2 ASN A 87 27.497 25.726 16.767 1.00 54.40 N ATOM 1364 HA ASN A 87 30.218 26.518 17.290 1.00 0.00 H ATOM 1365 HB2 ASN A 87 29.626 26.351 14.333 1.00 0.00 H ATOM 1366 HB3 ASN A 87 29.716 25.029 15.521 1.00 0.00 H ATOM 1367 HD22 ASN A 87 28.158 25.275 17.431 1.00 0.00 H ATOM 1368 HD21 ASN A 87 26.488 25.803 17.008 1.00 0.00 H ATOM 1369 H ASN A 87 29.170 28.670 15.546 1.00 0.00 H ATOM 1370 N SER A 88 31.926 27.723 14.724 1.00 55.48 N ATOM 1371 CA SER A 88 33.255 27.965 14.203 1.00 55.95 C ATOM 1372 C SER A 88 33.288 29.355 13.604 1.00 56.07 C ATOM 1373 O SER A 88 32.417 30.173 13.883 1.00 56.44 O ATOM 1374 CB SER A 88 33.602 26.911 13.154 1.00 56.00 C ATOM 1375 OG SER A 88 33.009 27.223 11.907 1.00 56.58 O ATOM 1376 HA SER A 88 33.994 27.898 15.001 1.00 0.00 H ATOM 1377 HB2 SER A 88 33.238 25.940 13.490 1.00 0.00 H ATOM 1378 HB3 SER A 88 34.685 26.870 13.034 1.00 0.00 H ATOM 1379 HG SER A 88 33.248 26.526 11.246 1.00 0.00 H ATOM 1380 H SER A 88 31.109 28.115 14.214 1.00 0.00 H ATOM 1381 N GLU A 89 34.307 29.623 12.799 1.00 56.28 N ATOM 1382 CA GLU A 89 34.398 30.874 12.050 1.00 56.53 C ATOM 1383 C GLU A 89 33.525 30.853 10.782 1.00 55.28 C ATOM 1384 O GLU A 89 33.064 31.899 10.320 1.00 55.55 O ATOM 1385 CB GLU A 89 35.862 31.150 11.679 1.00 57.22 C ATOM 1386 CG GLU A 89 36.725 31.556 12.870 1.00 59.25 C ATOM 1387 CD GLU A 89 36.453 32.972 13.330 1.00 62.30 C ATOM 1388 OE1 GLU A 89 36.382 33.194 14.557 1.00 64.13 O ATOM 1389 OE2 GLU A 89 36.312 33.869 12.466 1.00 65.16 O ATOM 1390 HA GLU A 89 34.023 31.673 12.690 1.00 0.00 H ATOM 1391 HB2 GLU A 89 36.283 30.246 11.239 1.00 0.00 H ATOM 1392 HB3 GLU A 89 35.886 31.955 10.944 1.00 0.00 H ATOM 1393 HG2 GLU A 89 36.522 30.875 13.697 1.00 0.00 H ATOM 1394 HG3 GLU A 89 37.774 31.477 12.585 1.00 0.00 H ATOM 1395 H GLU A 89 35.066 28.920 12.697 1.00 0.00 H ATOM 1396 N SER A 90 33.320 29.668 10.215 1.00 53.85 N ATOM 1397 CA SER A 90 32.445 29.520 9.055 1.00 52.79 C ATOM 1398 C SER A 90 31.044 28.978 9.413 1.00 51.52 C ATOM 1399 O SER A 90 30.232 28.736 8.543 1.00 50.90 O ATOM 1400 CB SER A 90 33.126 28.655 7.994 1.00 52.45 C ATOM 1401 OG SER A 90 33.403 27.369 8.497 1.00 52.76 O ATOM 1402 HA SER A 90 32.277 30.517 8.649 1.00 0.00 H ATOM 1403 HB2 SER A 90 34.060 29.129 7.692 1.00 0.00 H ATOM 1404 HB3 SER A 90 32.468 28.566 7.129 1.00 0.00 H ATOM 1405 HG SER A 90 33.843 26.829 7.794 1.00 0.00 H ATOM 1406 H SER A 90 33.793 28.828 10.606 1.00 0.00 H ATOM 1407 N LYS A 91 30.744 28.838 10.695 1.00 50.68 N ATOM 1408 CA LYS A 91 29.468 28.249 11.110 1.00 50.07 C ATOM 1409 C LYS A 91 28.890 28.940 12.340 1.00 49.23 C ATOM 1410 O LYS A 91 29.610 29.296 13.259 1.00 49.04 O ATOM 1411 CB LYS A 91 29.643 26.748 11.378 1.00 49.94 C ATOM 1412 CG LYS A 91 28.365 26.010 11.718 1.00 50.42 C ATOM 1413 CD LYS A 91 28.310 24.611 11.120 1.00 51.27 C ATOM 1414 CE LYS A 91 28.290 23.517 12.167 1.00 51.71 C ATOM 1415 NZ LYS A 91 28.044 22.171 11.554 1.00 52.71 N ATOM 1416 HA LYS A 91 28.760 28.393 10.294 1.00 0.00 H ATOM 1417 HB2 LYS A 91 30.071 26.292 10.486 1.00 0.00 H ATOM 1418 HB3 LYS A 91 30.335 26.631 12.212 1.00 0.00 H ATOM 1419 HG2 LYS A 91 28.289 25.928 12.802 1.00 0.00 H ATOM 1420 HG3 LYS A 91 27.520 26.584 11.338 1.00 0.00 H ATOM 1421 HD2 LYS A 91 27.408 24.528 10.514 1.00 0.00 H ATOM 1422 HD3 LYS A 91 29.186 24.469 10.487 1.00 0.00 H ATOM 1423 HE2 LYS A 91 27.498 23.729 12.885 1.00 0.00 H ATOM 1424 HE3 LYS A 91 29.251 23.502 12.681 1.00 0.00 H ATOM 1425 HZ1 LYS A 91 27.126 22.176 11.066 1.00 0.00 H ATOM 1426 HZ2 LYS A 91 28.799 21.959 10.871 1.00 0.00 H ATOM 1427 HZ3 LYS A 91 28.037 21.447 12.301 1.00 0.00 H ATOM 1428 H LYS A 91 31.424 29.150 11.418 1.00 0.00 H ATOM 1429 N LEU A 92 27.579 29.144 12.332 1.00 48.69 N ATOM 1430 CA LEU A 92 26.853 29.562 13.525 1.00 47.89 C ATOM 1431 C LEU A 92 25.477 28.915 13.584 1.00 47.46 C ATOM 1432 O LEU A 92 24.997 28.366 12.593 1.00 46.24 O ATOM 1433 CB LEU A 92 26.767 31.084 13.615 1.00 48.18 C ATOM 1434 CG LEU A 92 26.451 31.910 12.383 1.00 48.90 C ATOM 1435 CD1 LEU A 92 24.968 31.803 12.097 1.00 50.27 C ATOM 1436 CD2 LEU A 92 26.861 33.375 12.563 1.00 48.06 C ATOM 1437 HA LEU A 92 27.412 29.218 14.395 1.00 0.00 H ATOM 1438 HB2 LEU A 92 25.995 31.311 14.350 1.00 0.00 H ATOM 1439 HB3 LEU A 92 27.732 31.431 13.985 1.00 0.00 H ATOM 1440 HG LEU A 92 27.023 31.522 11.540 1.00 0.00 H ATOM 1441 HD21 LEU A 92 26.322 33.800 13.410 1.00 0.00 H ATOM 1442 HD22 LEU A 92 27.934 33.431 12.748 1.00 0.00 H ATOM 1443 HD23 LEU A 92 26.618 33.933 11.659 1.00 0.00 H ATOM 1444 HD11 LEU A 92 24.707 30.759 11.922 1.00 0.00 H ATOM 1445 HD12 LEU A 92 24.406 32.180 12.952 1.00 0.00 H ATOM 1446 HD13 LEU A 92 24.726 32.393 11.213 1.00 0.00 H ATOM 1447 H LEU A 92 27.053 29.001 11.446 1.00 0.00 H ATOM 1448 N THR A 93 24.866 28.954 14.770 1.00 47.06 N ATOM 1449 CA THR A 93 23.634 28.230 15.039 1.00 46.91 C ATOM 1450 C THR A 93 22.624 29.048 15.854 1.00 46.84 C ATOM 1451 O THR A 93 22.845 29.371 17.005 1.00 46.17 O ATOM 1452 CB THR A 93 23.964 26.914 15.743 1.00 46.85 C ATOM 1453 OG1 THR A 93 24.873 26.162 14.932 1.00 47.69 O ATOM 1454 CG2 THR A 93 22.736 26.008 15.857 1.00 46.53 C ATOM 1455 HA THR A 93 23.154 28.028 14.082 1.00 0.00 H ATOM 1456 HB THR A 93 24.359 27.178 16.724 1.00 0.00 H ATOM 1457 HG1 THR A 93 25.703 26.685 14.797 1.00 0.00 H ATOM 1458 HG23 THR A 93 21.978 26.501 16.465 1.00 0.00 H ATOM 1459 HG21 THR A 93 22.336 25.814 14.862 1.00 0.00 H ATOM 1460 HG22 THR A 93 23.023 25.066 16.325 1.00 0.00 H ATOM 1461 H THR A 93 25.287 29.524 15.531 1.00 0.00 H ATOM 1462 N GLN A 94 21.494 29.347 15.227 1.00 47.20 N ATOM 1463 CA GLN A 94 20.490 30.202 15.790 1.00 47.67 C ATOM 1464 C GLN A 94 19.359 29.313 16.205 1.00 48.26 C ATOM 1465 O GLN A 94 18.662 28.768 15.349 1.00 48.82 O ATOM 1466 CB GLN A 94 20.013 31.221 14.750 1.00 47.61 C ATOM 1467 CG GLN A 94 18.645 31.807 15.031 1.00 48.61 C ATOM 1468 CD GLN A 94 18.372 33.061 14.247 1.00 50.10 C ATOM 1469 OE1 GLN A 94 18.896 33.243 13.149 1.00 52.10 O ATOM 1470 NE2 GLN A 94 17.536 33.925 14.797 1.00 49.20 N ATOM 1471 HA GLN A 94 20.882 30.763 16.639 1.00 0.00 H ATOM 1472 HB2 GLN A 94 20.734 32.038 14.717 1.00 0.00 H ATOM 1473 HB3 GLN A 94 19.980 30.727 13.779 1.00 0.00 H ATOM 1474 HG2 GLN A 94 17.889 31.065 14.774 1.00 0.00 H ATOM 1475 HG3 GLN A 94 18.578 32.040 16.094 1.00 0.00 H ATOM 1476 HE22 GLN A 94 17.119 33.724 15.728 1.00 0.00 H ATOM 1477 HE21 GLN A 94 17.295 34.805 14.298 1.00 0.00 H ATOM 1478 H GLN A 94 21.329 28.943 14.283 1.00 0.00 H ATOM 1479 N THR A 95 19.150 29.178 17.510 1.00 48.81 N ATOM 1480 CA THR A 95 18.010 28.418 18.003 1.00 49.60 C ATOM 1481 C THR A 95 16.920 29.425 18.351 1.00 50.01 C ATOM 1482 O THR A 95 17.199 30.502 18.841 1.00 50.04 O ATOM 1483 CB THR A 95 18.390 27.466 19.174 1.00 49.45 C ATOM 1484 OG1 THR A 95 18.155 28.102 20.421 1.00 51.57 O ATOM 1485 CG2 THR A 95 19.910 27.157 19.203 1.00 48.40 C ATOM 1486 HA THR A 95 17.638 27.737 17.237 1.00 0.00 H ATOM 1487 HB THR A 95 17.794 26.566 19.023 1.00 0.00 H ATOM 1488 HG1 THR A 95 18.401 27.486 21.156 1.00 0.00 H ATOM 1489 HG23 THR A 95 20.196 26.660 18.276 1.00 0.00 H ATOM 1490 HG21 THR A 95 20.467 28.088 19.305 1.00 0.00 H ATOM 1491 HG22 THR A 95 20.131 26.506 20.049 1.00 0.00 H ATOM 1492 H THR A 95 19.806 29.619 18.185 1.00 0.00 H ATOM 1493 N GLN A 96 15.685 29.075 18.039 1.00 50.65 N ATOM 1494 CA GLN A 96 14.563 29.987 18.108 1.00 51.43 C ATOM 1495 C GLN A 96 13.514 29.274 18.924 1.00 52.01 C ATOM 1496 O GLN A 96 12.982 28.240 18.496 1.00 51.04 O ATOM 1497 CB GLN A 96 14.002 30.289 16.713 1.00 51.38 C ATOM 1498 CG GLN A 96 14.657 31.464 16.041 1.00 52.21 C ATOM 1499 CD GLN A 96 14.087 31.756 14.666 1.00 51.01 C ATOM 1500 OE1 GLN A 96 13.757 30.847 13.919 1.00 52.62 O ATOM 1501 NE2 GLN A 96 13.972 33.027 14.337 1.00 51.09 N ATOM 1502 HA GLN A 96 14.864 30.939 18.545 1.00 0.00 H ATOM 1503 HB2 GLN A 96 14.146 29.409 16.086 1.00 0.00 H ATOM 1504 HB3 GLN A 96 12.936 30.496 16.808 1.00 0.00 H ATOM 1505 HG2 GLN A 96 14.519 32.344 16.668 1.00 0.00 H ATOM 1506 HG3 GLN A 96 15.722 31.256 15.938 1.00 0.00 H ATOM 1507 HE22 GLN A 96 14.266 33.766 15.007 1.00 0.00 H ATOM 1508 HE21 GLN A 96 13.587 33.291 13.408 1.00 0.00 H ATOM 1509 H GLN A 96 15.511 28.098 17.729 1.00 0.00 H ATOM 1510 N VAL A 97 13.215 29.829 20.092 1.00 52.93 N ATOM 1511 CA VAL A 97 12.285 29.190 20.999 1.00 53.97 C ATOM 1512 C VAL A 97 11.014 30.000 21.081 1.00 54.34 C ATOM 1513 O VAL A 97 11.011 31.143 21.507 1.00 54.18 O ATOM 1514 CB VAL A 97 12.884 28.966 22.392 1.00 54.30 C ATOM 1515 CG1 VAL A 97 11.867 28.273 23.296 1.00 54.65 C ATOM 1516 CG2 VAL A 97 14.142 28.112 22.286 1.00 55.17 C ATOM 1517 HA VAL A 97 12.058 28.202 20.599 1.00 0.00 H ATOM 1518 HB VAL A 97 13.142 29.934 22.823 1.00 0.00 H ATOM 1519 HG11 VAL A 97 10.977 28.897 23.385 1.00 0.00 H ATOM 1520 HG12 VAL A 97 11.596 27.310 22.864 1.00 0.00 H ATOM 1521 HG13 VAL A 97 12.305 28.120 24.282 1.00 0.00 H ATOM 1522 HG21 VAL A 97 13.889 27.148 21.844 1.00 0.00 H ATOM 1523 HG22 VAL A 97 14.873 28.621 21.658 1.00 0.00 H ATOM 1524 HG23 VAL A 97 14.560 27.958 23.281 1.00 0.00 H ATOM 1525 H VAL A 97 13.654 30.733 20.359 1.00 0.00 H ATOM 1526 N ASP A 98 9.952 29.395 20.581 1.00 55.28 N ATOM 1527 CA ASP A 98 8.598 29.798 20.892 1.00 56.20 C ATOM 1528 C ASP A 98 7.961 28.654 21.720 1.00 56.63 C ATOM 1529 O ASP A 98 8.592 27.602 21.916 1.00 56.86 O ATOM 1530 CB ASP A 98 7.850 30.138 19.592 1.00 56.55 C ATOM 1531 CG ASP A 98 7.435 28.921 18.815 1.00 56.47 C ATOM 1532 OD1 ASP A 98 7.936 28.684 17.680 1.00 55.75 O ATOM 1533 OD2 ASP A 98 6.581 28.158 19.267 1.00 57.58 O ATOM 1534 HA ASP A 98 8.554 30.707 21.492 1.00 0.00 H ATOM 1535 HB2 ASP A 98 6.957 30.710 19.845 1.00 0.00 H ATOM 1536 HB3 ASP A 98 8.503 30.745 18.964 1.00 0.00 H ATOM 1537 H ASP A 98 10.096 28.593 19.935 1.00 0.00 H ATOM 1538 N PRO A 99 6.757 28.857 22.256 1.00 56.73 N ATOM 1539 CA PRO A 99 6.191 27.876 23.194 1.00 56.52 C ATOM 1540 C PRO A 99 5.633 26.606 22.549 1.00 56.14 C ATOM 1541 O PRO A 99 5.474 25.600 23.258 1.00 56.41 O ATOM 1542 CB PRO A 99 5.089 28.673 23.925 1.00 56.97 C ATOM 1543 CG PRO A 99 5.219 30.128 23.417 1.00 57.08 C ATOM 1544 CD PRO A 99 5.866 30.020 22.076 1.00 56.75 C ATOM 1545 HA PRO A 99 6.967 27.481 23.850 1.00 0.00 H ATOM 1546 HD3 PRO A 99 5.129 29.837 21.294 1.00 0.00 H ATOM 1547 HD2 PRO A 99 6.433 30.920 21.836 1.00 0.00 H ATOM 1548 HG3 PRO A 99 5.839 30.715 24.094 1.00 0.00 H ATOM 1549 HG2 PRO A 99 4.236 30.592 23.331 1.00 0.00 H ATOM 1550 HB2 PRO A 99 4.105 28.272 23.683 1.00 0.00 H ATOM 1551 HB3 PRO A 99 5.241 28.631 25.004 1.00 0.00 H ATOM 1552 N LYS A 100 5.316 26.644 21.257 1.00 55.17 N ATOM 1553 CA LYS A 100 4.954 25.432 20.523 1.00 54.67 C ATOM 1554 C LYS A 100 6.169 24.598 20.013 1.00 53.83 C ATOM 1555 O LYS A 100 6.118 23.369 20.006 1.00 53.65 O ATOM 1556 CB LYS A 100 4.010 25.784 19.371 1.00 54.85 C ATOM 1557 CG LYS A 100 2.700 26.443 19.809 1.00 55.81 C ATOM 1558 CD LYS A 100 1.594 26.278 18.733 1.00 57.46 C ATOM 1559 CE LYS A 100 1.230 27.592 18.048 1.00 57.31 C ATOM 1560 NZ LYS A 100 0.041 27.445 17.160 1.00 57.06 N ATOM 1561 HA LYS A 100 4.447 24.784 21.238 1.00 0.00 H ATOM 1562 HB2 LYS A 100 4.529 26.469 18.701 1.00 0.00 H ATOM 1563 HB3 LYS A 100 3.768 24.866 18.835 1.00 0.00 H ATOM 1564 HG2 LYS A 100 2.364 25.981 20.737 1.00 0.00 H ATOM 1565 HG3 LYS A 100 2.876 27.506 19.977 1.00 0.00 H ATOM 1566 HD2 LYS A 100 1.947 25.577 17.976 1.00 0.00 H ATOM 1567 HD3 LYS A 100 0.701 25.876 19.211 1.00 0.00 H ATOM 1568 HE2 LYS A 100 2.078 27.925 17.450 1.00 0.00 H ATOM 1569 HE3 LYS A 100 1.010 28.339 18.811 1.00 0.00 H ATOM 1570 HZ1 LYS A 100 0.245 26.739 16.424 1.00 0.00 H ATOM 1571 HZ2 LYS A 100 -0.775 27.134 17.724 1.00 0.00 H ATOM 1572 HZ3 LYS A 100 -0.173 28.360 16.714 1.00 0.00 H ATOM 1573 H LYS A 100 5.326 27.556 20.758 1.00 0.00 H ATOM 1574 N ASN A 101 7.259 25.261 19.629 1.00 52.67 N ATOM 1575 CA ASN A 101 8.367 24.607 18.948 1.00 51.89 C ATOM 1576 C ASN A 101 9.674 25.313 19.187 1.00 51.29 C ATOM 1577 O ASN A 101 9.688 26.474 19.546 1.00 52.07 O ATOM 1578 CB ASN A 101 8.134 24.616 17.437 1.00 51.94 C ATOM 1579 CG ASN A 101 7.215 23.527 16.982 1.00 51.80 C ATOM 1580 OD1 ASN A 101 7.549 22.346 17.066 1.00 51.20 O ATOM 1581 ND2 ASN A 101 6.045 23.915 16.483 1.00 52.41 N ATOM 1582 HA ASN A 101 8.416 23.593 19.345 1.00 0.00 H ATOM 1583 HB2 ASN A 101 7.701 25.576 17.158 1.00 0.00 H ATOM 1584 HB3 ASN A 101 9.094 24.493 16.936 1.00 0.00 H ATOM 1585 HD22 ASN A 101 5.810 24.927 16.434 1.00 0.00 H ATOM 1586 HD21 ASN A 101 5.365 23.206 16.142 1.00 0.00 H ATOM 1587 H ASN A 101 7.320 26.281 19.822 1.00 0.00 H ATOM 1588 N THR A 102 10.770 24.607 18.936 1.00 50.33 N ATOM 1589 CA THR A 102 12.112 25.180 18.908 1.00 49.40 C ATOM 1590 C THR A 102 12.725 24.950 17.528 1.00 47.89 C ATOM 1591 O THR A 102 12.888 23.807 17.120 1.00 47.31 O ATOM 1592 CB THR A 102 12.985 24.498 19.994 1.00 49.65 C ATOM 1593 OG1 THR A 102 12.538 24.909 21.288 1.00 50.80 O ATOM 1594 CG2 THR A 102 14.454 24.962 19.943 1.00 50.07 C ATOM 1595 HA THR A 102 12.063 26.250 19.109 1.00 0.00 H ATOM 1596 HB THR A 102 12.904 23.426 19.814 1.00 0.00 H ATOM 1597 HG1 THR A 102 13.095 24.474 21.982 1.00 0.00 H ATOM 1598 HG23 THR A 102 14.887 24.689 18.980 1.00 0.00 H ATOM 1599 HG21 THR A 102 14.497 26.044 20.069 1.00 0.00 H ATOM 1600 HG22 THR A 102 15.014 24.480 20.744 1.00 0.00 H ATOM 1601 H THR A 102 10.667 23.589 18.749 1.00 0.00 H ATOM 1602 N THR A 103 13.040 26.032 16.813 1.00 46.43 N ATOM 1603 CA THR A 103 13.727 25.961 15.514 1.00 44.69 C ATOM 1604 C THR A 103 15.225 26.210 15.671 1.00 43.98 C ATOM 1605 O THR A 103 15.621 27.224 16.187 1.00 43.44 O ATOM 1606 CB THR A 103 13.153 26.996 14.523 1.00 44.68 C ATOM 1607 OG1 THR A 103 11.731 26.877 14.431 1.00 41.91 O ATOM 1608 CG2 THR A 103 13.629 26.728 13.085 1.00 43.90 C ATOM 1609 HA THR A 103 13.565 24.957 15.122 1.00 0.00 H ATOM 1610 HB THR A 103 13.480 27.966 14.896 1.00 0.00 H ATOM 1611 HG1 THR A 103 11.385 27.549 13.791 1.00 0.00 H ATOM 1612 HG23 THR A 103 14.716 26.796 13.045 1.00 0.00 H ATOM 1613 HG21 THR A 103 13.314 25.730 12.780 1.00 0.00 H ATOM 1614 HG22 THR A 103 13.193 27.469 12.415 1.00 0.00 H ATOM 1615 H THR A 103 12.788 26.968 17.191 1.00 0.00 H ATOM 1616 N VAL A 104 16.042 25.266 15.227 1.00 43.23 N ATOM 1617 CA VAL A 104 17.486 25.426 15.169 1.00 42.89 C ATOM 1618 C VAL A 104 17.909 25.684 13.731 1.00 42.55 C ATOM 1619 O VAL A 104 17.555 24.923 12.820 1.00 42.57 O ATOM 1620 CB VAL A 104 18.199 24.153 15.625 1.00 42.99 C ATOM 1621 CG1 VAL A 104 19.743 24.338 15.534 1.00 43.66 C ATOM 1622 CG2 VAL A 104 17.765 23.790 17.041 1.00 43.28 C ATOM 1623 HA VAL A 104 17.753 26.257 15.822 1.00 0.00 H ATOM 1624 HB VAL A 104 17.922 23.330 14.966 1.00 0.00 H ATOM 1625 HG11 VAL A 104 20.022 24.553 14.502 1.00 0.00 H ATOM 1626 HG12 VAL A 104 20.047 25.166 16.174 1.00 0.00 H ATOM 1627 HG13 VAL A 104 20.237 23.423 15.862 1.00 0.00 H ATOM 1628 HG21 VAL A 104 18.019 24.606 17.718 1.00 0.00 H ATOM 1629 HG22 VAL A 104 16.688 23.624 17.058 1.00 0.00 H ATOM 1630 HG23 VAL A 104 18.279 22.882 17.356 1.00 0.00 H ATOM 1631 H VAL A 104 15.630 24.367 14.904 1.00 0.00 H ATOM 1632 N ILE A 105 18.691 26.732 13.525 1.00 41.89 N ATOM 1633 CA ILE A 105 19.051 27.154 12.192 1.00 41.87 C ATOM 1634 C ILE A 105 20.557 27.214 12.120 1.00 42.05 C ATOM 1635 O ILE A 105 21.182 28.173 12.587 1.00 42.16 O ATOM 1636 CB ILE A 105 18.432 28.525 11.879 1.00 41.99 C ATOM 1637 CG1 ILE A 105 16.913 28.449 11.925 1.00 42.90 C ATOM 1638 CG2 ILE A 105 18.837 29.011 10.528 1.00 41.63 C ATOM 1639 CD1 ILE A 105 16.289 29.625 12.605 1.00 44.79 C ATOM 1640 HA ILE A 105 18.670 26.450 11.452 1.00 0.00 H ATOM 1641 HB ILE A 105 18.797 29.219 12.636 1.00 0.00 H ATOM 1642 HG12 ILE A 105 16.536 28.398 10.903 1.00 0.00 H ATOM 1643 HG13 ILE A 105 16.626 27.545 12.462 1.00 0.00 H ATOM 1644 HD11 ILE A 105 16.649 29.682 13.632 1.00 0.00 H ATOM 1645 HD12 ILE A 105 16.559 30.537 12.072 1.00 0.00 H ATOM 1646 HD13 ILE A 105 15.205 29.510 12.605 1.00 0.00 H ATOM 1647 HG21 ILE A 105 19.922 29.104 10.487 1.00 0.00 H ATOM 1648 HG22 ILE A 105 18.503 28.300 9.772 1.00 0.00 H ATOM 1649 HG23 ILE A 105 18.381 29.983 10.341 1.00 0.00 H ATOM 1650 H ILE A 105 19.054 27.263 14.342 1.00 0.00 H ATOM 1651 N VAL A 106 21.135 26.171 11.548 1.00 41.69 N ATOM 1652 CA VAL A 106 22.557 26.120 11.299 1.00 41.80 C ATOM 1653 C VAL A 106 22.739 26.836 9.968 1.00 42.06 C ATOM 1654 O VAL A 106 22.046 26.516 9.002 1.00 42.16 O ATOM 1655 CB VAL A 106 23.078 24.644 11.302 1.00 41.87 C ATOM 1656 CG1 VAL A 106 24.592 24.564 11.168 1.00 42.06 C ATOM 1657 CG2 VAL A 106 22.658 23.920 12.606 1.00 42.12 C ATOM 1658 HA VAL A 106 23.147 26.605 12.076 1.00 0.00 H ATOM 1659 HB VAL A 106 22.628 24.157 10.437 1.00 0.00 H ATOM 1660 HG11 VAL A 106 24.897 25.028 10.230 1.00 0.00 H ATOM 1661 HG12 VAL A 106 25.058 25.088 12.003 1.00 0.00 H ATOM 1662 HG13 VAL A 106 24.901 23.519 11.175 1.00 0.00 H ATOM 1663 HG21 VAL A 106 23.079 24.445 13.463 1.00 0.00 H ATOM 1664 HG22 VAL A 106 21.571 23.911 12.681 1.00 0.00 H ATOM 1665 HG23 VAL A 106 23.030 22.896 12.587 1.00 0.00 H ATOM 1666 H VAL A 106 20.546 25.361 11.268 1.00 0.00 H ATOM 1667 N ARG A 107 23.580 27.876 9.974 1.00 41.76 N ATOM 1668 CA ARG A 107 24.113 28.528 8.787 1.00 41.57 C ATOM 1669 C ARG A 107 25.599 28.253 8.735 1.00 41.80 C ATOM 1670 O ARG A 107 26.297 28.458 9.704 1.00 41.78 O ATOM 1671 CB ARG A 107 23.918 30.040 8.841 1.00 41.52 C ATOM 1672 CG ARG A 107 22.464 30.477 8.989 1.00 41.08 C ATOM 1673 CD ARG A 107 22.259 31.969 8.871 1.00 40.37 C ATOM 1674 NE ARG A 107 20.847 32.251 8.705 1.00 41.26 N ATOM 1675 CZ ARG A 107 19.958 32.238 9.702 1.00 42.56 C ATOM 1676 NH1 ARG A 107 20.319 32.032 10.961 1.00 41.10 N ATOM 1677 NH2 ARG A 107 18.688 32.462 9.437 1.00 44.98 N ATOM 1678 HA ARG A 107 23.590 28.141 7.913 1.00 0.00 H ATOM 1679 HB2 ARG A 107 24.480 30.428 9.691 1.00 0.00 H ATOM 1680 HB3 ARG A 107 24.312 30.469 7.920 1.00 0.00 H ATOM 1681 HG2 ARG A 107 21.877 29.987 8.212 1.00 0.00 H ATOM 1682 HG3 ARG A 107 22.107 30.157 9.968 1.00 0.00 H ATOM 1683 HD2 ARG A 107 22.809 32.344 8.008 1.00 0.00 H ATOM 1684 HD3 ARG A 107 22.624 32.459 9.774 1.00 0.00 H ATOM 1685 HE ARG A 107 20.504 32.478 7.750 1.00 0.00 H ATOM 1686 HH12 ARG A 107 19.601 32.028 11.714 1.00 0.00 H ATOM 1687 HH11 ARG A 107 21.320 31.874 11.196 1.00 0.00 H ATOM 1688 HH22 ARG A 107 17.987 32.454 10.205 1.00 0.00 H ATOM 1689 HH21 ARG A 107 18.386 32.647 8.459 1.00 0.00 H ATOM 1690 H ARG A 107 23.876 28.248 10.899 1.00 0.00 H ATOM 1691 N GLU A 108 26.081 27.818 7.584 1.00 42.04 N ATOM 1692 CA GLU A 108 27.454 27.385 7.427 1.00 42.62 C ATOM 1693 C GLU A 108 27.988 27.896 6.095 1.00 42.15 C ATOM 1694 O GLU A 108 27.448 27.578 5.061 1.00 41.09 O ATOM 1695 CB GLU A 108 27.509 25.861 7.446 1.00 43.22 C ATOM 1696 CG GLU A 108 28.911 25.313 7.597 1.00 46.85 C ATOM 1697 CD GLU A 108 28.974 23.802 7.494 1.00 51.48 C ATOM 1698 OE1 GLU A 108 27.888 23.158 7.509 1.00 53.28 O ATOM 1699 OE2 GLU A 108 30.116 23.278 7.378 1.00 53.73 O ATOM 1700 HA GLU A 108 28.061 27.779 8.242 1.00 0.00 H ATOM 1701 HB2 GLU A 108 26.906 25.503 8.281 1.00 0.00 H ATOM 1702 HB3 GLU A 108 27.091 25.488 6.511 1.00 0.00 H ATOM 1703 HG2 GLU A 108 29.537 25.741 6.814 1.00 0.00 H ATOM 1704 HG3 GLU A 108 29.297 25.611 8.572 1.00 0.00 H ATOM 1705 H GLU A 108 25.449 27.785 6.758 1.00 0.00 H ATOM 1706 N VAL A 109 29.034 28.708 6.135 1.00 42.51 N ATOM 1707 CA VAL A 109 29.679 29.197 4.929 1.00 43.09 C ATOM 1708 C VAL A 109 30.679 28.184 4.417 1.00 43.10 C ATOM 1709 O VAL A 109 31.530 27.739 5.154 1.00 43.25 O ATOM 1710 CB VAL A 109 30.412 30.522 5.170 1.00 43.16 C ATOM 1711 CG1 VAL A 109 31.192 30.925 3.916 1.00 43.00 C ATOM 1712 CG2 VAL A 109 29.412 31.613 5.584 1.00 43.47 C ATOM 1713 HA VAL A 109 28.891 29.358 4.193 1.00 0.00 H ATOM 1714 HB VAL A 109 31.125 30.396 5.984 1.00 0.00 H ATOM 1715 HG11 VAL A 109 31.920 30.150 3.678 1.00 0.00 H ATOM 1716 HG12 VAL A 109 30.500 31.044 3.082 1.00 0.00 H ATOM 1717 HG13 VAL A 109 31.709 31.867 4.098 1.00 0.00 H ATOM 1718 HG21 VAL A 109 28.677 31.750 4.791 1.00 0.00 H ATOM 1719 HG22 VAL A 109 28.907 31.312 6.502 1.00 0.00 H ATOM 1720 HG23 VAL A 109 29.946 32.548 5.752 1.00 0.00 H ATOM 1721 H VAL A 109 29.405 29.005 7.060 1.00 0.00 H ATOM 1722 N ASP A 110 30.546 27.829 3.149 1.00 43.60 N ATOM 1723 CA ASP A 110 31.508 27.006 2.442 1.00 44.02 C ATOM 1724 C ASP A 110 31.723 27.589 1.032 1.00 44.18 C ATOM 1725 O ASP A 110 31.028 27.233 0.075 1.00 44.69 O ATOM 1726 CB ASP A 110 31.017 25.559 2.371 1.00 44.15 C ATOM 1727 CG ASP A 110 32.054 24.627 1.786 1.00 45.38 C ATOM 1728 OD1 ASP A 110 31.768 23.417 1.638 1.00 47.67 O ATOM 1729 OD2 ASP A 110 33.195 25.013 1.462 1.00 45.57 O ATOM 1730 HA ASP A 110 32.459 27.006 2.975 1.00 0.00 H ATOM 1731 HB2 ASP A 110 30.772 25.222 3.378 1.00 0.00 H ATOM 1732 HB3 ASP A 110 30.123 25.523 1.749 1.00 0.00 H ATOM 1733 H ASP A 110 29.706 28.158 2.632 1.00 0.00 H ATOM 1734 N GLY A 111 32.702 28.477 0.921 1.00 44.11 N ATOM 1735 CA GLY A 111 33.025 29.118 -0.319 1.00 44.35 C ATOM 1736 C GLY A 111 31.951 30.119 -0.666 1.00 45.01 C ATOM 1737 O GLY A 111 31.742 31.091 0.064 1.00 45.92 O ATOM 1738 HA3 GLY A 111 33.092 28.369 -1.108 1.00 0.00 H ATOM 1739 HA2 GLY A 111 33.982 29.631 -0.224 1.00 0.00 H ATOM 1740 H GLY A 111 33.257 28.717 1.767 1.00 0.00 H ATOM 1741 N ASP A 112 31.273 29.871 -1.783 1.00 44.81 N ATOM 1742 CA ASP A 112 30.213 30.739 -2.267 1.00 44.76 C ATOM 1743 C ASP A 112 28.830 30.266 -1.849 1.00 43.43 C ATOM 1744 O ASP A 112 27.822 30.874 -2.182 1.00 42.72 O ATOM 1745 CB ASP A 112 30.324 30.840 -3.790 1.00 45.38 C ATOM 1746 CG ASP A 112 31.557 31.618 -4.211 1.00 47.81 C ATOM 1747 OD1 ASP A 112 32.055 32.431 -3.388 1.00 48.00 O ATOM 1748 OD2 ASP A 112 32.096 31.480 -5.336 1.00 53.31 O ATOM 1749 HA ASP A 112 30.339 31.723 -1.815 1.00 0.00 H ATOM 1750 HB2 ASP A 112 30.380 29.835 -4.208 1.00 0.00 H ATOM 1751 HB3 ASP A 112 29.438 31.344 -4.177 1.00 0.00 H ATOM 1752 H ASP A 112 31.511 29.021 -2.333 1.00 0.00 H ATOM 1753 N THR A 113 28.797 29.187 -1.100 1.00 41.89 N ATOM 1754 CA THR A 113 27.573 28.692 -0.554 1.00 41.55 C ATOM 1755 C THR A 113 27.463 28.931 0.962 1.00 41.02 C ATOM 1756 O THR A 113 28.393 28.706 1.732 1.00 39.99 O ATOM 1757 CB THR A 113 27.453 27.190 -0.879 1.00 41.63 C ATOM 1758 OG1 THR A 113 27.526 27.009 -2.302 1.00 41.51 O ATOM 1759 CG2 THR A 113 26.060 26.639 -0.475 1.00 41.47 C ATOM 1760 HA THR A 113 26.750 29.242 -1.010 1.00 0.00 H ATOM 1761 HB THR A 113 28.251 26.678 -0.340 1.00 0.00 H ATOM 1762 HG1 THR A 113 28.393 27.354 -2.633 1.00 0.00 H ATOM 1763 HG23 THR A 113 25.928 26.742 0.602 1.00 0.00 H ATOM 1764 HG21 THR A 113 25.284 27.202 -0.993 1.00 0.00 H ATOM 1765 HG22 THR A 113 25.993 25.587 -0.751 1.00 0.00 H ATOM 1766 H THR A 113 29.683 28.681 -0.900 1.00 0.00 H ATOM 1767 N MET A 114 26.306 29.416 1.382 1.00 40.85 N ATOM 1768 CA MET A 114 25.952 29.337 2.781 1.00 40.64 C ATOM 1769 C MET A 114 24.840 28.370 2.759 1.00 40.58 C ATOM 1770 O MET A 114 23.879 28.581 2.030 1.00 40.59 O ATOM 1771 CB MET A 114 25.471 30.665 3.325 1.00 40.68 C ATOM 1772 CG MET A 114 24.864 30.562 4.724 1.00 40.49 C ATOM 1773 SD MET A 114 24.715 32.173 5.391 1.00 38.58 S ATOM 1774 CE MET A 114 23.058 32.671 4.633 1.00 40.25 C ATOM 1775 HA MET A 114 26.793 29.056 3.415 1.00 0.00 H ATOM 1776 HB2 MET A 114 26.318 31.350 3.365 1.00 0.00 H ATOM 1777 HB3 MET A 114 24.715 31.063 2.648 1.00 0.00 H ATOM 1778 HG2 MET A 114 25.511 29.959 5.361 1.00 0.00 H ATOM 1779 HG3 MET A 114 23.880 30.097 4.664 1.00 0.00 H ATOM 1780 HE1 MET A 114 23.134 32.642 3.546 1.00 0.00 H ATOM 1781 HE2 MET A 114 22.285 31.977 4.963 1.00 0.00 H ATOM 1782 HE3 MET A 114 22.802 33.681 4.954 1.00 0.00 H ATOM 1783 H MET A 114 25.650 29.855 0.704 1.00 0.00 H ATOM 1784 N LYS A 115 24.990 27.291 3.512 1.00 40.76 N ATOM 1785 CA LYS A 115 23.942 26.322 3.675 1.00 41.07 C ATOM 1786 C LYS A 115 23.267 26.642 4.977 1.00 40.65 C ATOM 1787 O LYS A 115 23.902 26.724 6.008 1.00 40.87 O ATOM 1788 CB LYS A 115 24.490 24.898 3.703 1.00 41.23 C ATOM 1789 CG LYS A 115 23.378 23.833 3.804 1.00 42.79 C ATOM 1790 CD LYS A 115 23.872 22.365 3.724 1.00 44.44 C ATOM 1791 CE LYS A 115 25.018 22.063 4.674 1.00 44.67 C ATOM 1792 NZ LYS A 115 24.946 20.667 5.150 1.00 45.75 N ATOM 1793 HA LYS A 115 23.248 26.371 2.836 1.00 0.00 H ATOM 1794 HB2 LYS A 115 25.057 24.724 2.789 1.00 0.00 H ATOM 1795 HB3 LYS A 115 25.151 24.795 4.564 1.00 0.00 H ATOM 1796 HG2 LYS A 115 22.866 23.967 4.757 1.00 0.00 H ATOM 1797 HG3 LYS A 115 22.674 23.999 2.988 1.00 0.00 H ATOM 1798 HD2 LYS A 115 23.039 21.706 3.966 1.00 0.00 H ATOM 1799 HD3 LYS A 115 24.206 22.167 2.705 1.00 0.00 H ATOM 1800 HE2 LYS A 115 24.961 22.737 5.529 1.00 0.00 H ATOM 1801 HE3 LYS A 115 25.964 22.216 4.154 1.00 0.00 H ATOM 1802 HZ1 LYS A 115 24.046 20.518 5.649 1.00 0.00 H ATOM 1803 HZ2 LYS A 115 25.003 20.021 4.337 1.00 0.00 H ATOM 1804 HZ3 LYS A 115 25.738 20.482 5.798 1.00 0.00 H ATOM 1805 H LYS A 115 25.895 27.140 4.001 1.00 0.00 H ATOM 1806 N THR A 116 21.966 26.810 4.908 1.00 40.75 N ATOM 1807 CA THR A 116 21.135 27.058 6.064 1.00 40.72 C ATOM 1808 C THR A 116 20.332 25.802 6.284 1.00 40.51 C ATOM 1809 O THR A 116 19.481 25.481 5.490 1.00 40.01 O ATOM 1810 CB THR A 116 20.201 28.229 5.809 1.00 40.58 C ATOM 1811 OG1 THR A 116 20.961 29.443 5.755 1.00 40.97 O ATOM 1812 CG2 THR A 116 19.237 28.429 6.979 1.00 41.70 C ATOM 1813 HA THR A 116 21.742 27.306 6.935 1.00 0.00 H ATOM 1814 HB THR A 116 19.668 28.015 4.882 1.00 0.00 H ATOM 1815 HG1 THR A 116 20.352 30.205 5.589 1.00 0.00 H ATOM 1816 HG23 THR A 116 18.614 27.541 7.091 1.00 0.00 H ATOM 1817 HG21 THR A 116 19.807 28.592 7.894 1.00 0.00 H ATOM 1818 HG22 THR A 116 18.605 29.295 6.783 1.00 0.00 H ATOM 1819 H THR A 116 21.511 26.762 3.974 1.00 0.00 H ATOM 1820 N THR A 117 20.644 25.072 7.347 1.00 40.67 N ATOM 1821 CA THR A 117 19.876 23.918 7.741 1.00 40.47 C ATOM 1822 C THR A 117 18.866 24.382 8.766 1.00 40.90 C ATOM 1823 O THR A 117 19.228 25.050 9.696 1.00 39.57 O ATOM 1824 CB THR A 117 20.807 22.874 8.337 1.00 40.37 C ATOM 1825 OG1 THR A 117 21.912 22.649 7.447 1.00 39.68 O ATOM 1826 CG2 THR A 117 20.118 21.553 8.449 1.00 39.39 C ATOM 1827 HA THR A 117 19.366 23.468 6.889 1.00 0.00 H ATOM 1828 HB THR A 117 21.124 23.243 9.312 1.00 0.00 H ATOM 1829 HG1 THR A 117 22.407 23.496 7.317 1.00 0.00 H ATOM 1830 HG23 THR A 117 19.261 21.647 9.115 1.00 0.00 H ATOM 1831 HG21 THR A 117 19.780 21.236 7.462 1.00 0.00 H ATOM 1832 HG22 THR A 117 20.813 20.815 8.851 1.00 0.00 H ATOM 1833 H THR A 117 21.472 25.342 7.916 1.00 0.00 H ATOM 1834 N VAL A 118 17.592 24.047 8.577 1.00 42.12 N ATOM 1835 CA VAL A 118 16.569 24.424 9.544 1.00 43.10 C ATOM 1836 C VAL A 118 15.862 23.180 10.094 1.00 44.00 C ATOM 1837 O VAL A 118 15.350 22.372 9.351 1.00 43.51 O ATOM 1838 CB VAL A 118 15.563 25.422 8.960 1.00 42.79 C ATOM 1839 CG1 VAL A 118 14.724 26.006 10.065 1.00 43.00 C ATOM 1840 CG2 VAL A 118 16.293 26.540 8.221 1.00 42.55 C ATOM 1841 HA VAL A 118 17.070 24.929 10.370 1.00 0.00 H ATOM 1842 HB VAL A 118 14.918 24.898 8.255 1.00 0.00 H ATOM 1843 HG11 VAL A 118 14.185 25.206 10.572 1.00 0.00 H ATOM 1844 HG12 VAL A 118 15.370 26.519 10.777 1.00 0.00 H ATOM 1845 HG13 VAL A 118 14.011 26.714 9.643 1.00 0.00 H ATOM 1846 HG21 VAL A 118 16.952 27.063 8.915 1.00 0.00 H ATOM 1847 HG22 VAL A 118 16.883 26.113 7.410 1.00 0.00 H ATOM 1848 HG23 VAL A 118 15.564 27.240 7.812 1.00 0.00 H ATOM 1849 H VAL A 118 17.323 23.509 7.728 1.00 0.00 H ATOM 1850 N THR A 119 15.846 23.048 11.414 1.00 45.32 N ATOM 1851 CA THR A 119 15.379 21.836 12.064 1.00 46.03 C ATOM 1852 C THR A 119 14.341 22.166 13.136 1.00 46.92 C ATOM 1853 O THR A 119 14.598 22.946 14.048 1.00 46.45 O ATOM 1854 CB THR A 119 16.573 21.073 12.673 1.00 46.07 C ATOM 1855 OG1 THR A 119 17.655 21.048 11.735 1.00 45.87 O ATOM 1856 CG2 THR A 119 16.239 19.599 12.864 1.00 46.12 C ATOM 1857 HA THR A 119 14.901 21.199 11.320 1.00 0.00 H ATOM 1858 HB THR A 119 16.815 21.571 13.612 1.00 0.00 H ATOM 1859 HG1 THR A 119 17.929 21.976 11.524 1.00 0.00 H ATOM 1860 HG23 THR A 119 15.415 19.503 13.571 1.00 0.00 H ATOM 1861 HG21 THR A 119 15.950 19.166 11.906 1.00 0.00 H ATOM 1862 HG22 THR A 119 17.114 19.077 13.251 1.00 0.00 H ATOM 1863 H THR A 119 16.179 23.838 12.003 1.00 0.00 H ATOM 1864 N VAL A 120 13.151 21.606 12.975 1.00 48.09 N ATOM 1865 CA VAL A 120 12.148 21.630 14.012 1.00 49.27 C ATOM 1866 C VAL A 120 11.864 20.189 14.396 1.00 50.11 C ATOM 1867 O VAL A 120 11.210 19.449 13.663 1.00 50.26 O ATOM 1868 CB VAL A 120 10.861 22.323 13.546 1.00 49.63 C ATOM 1869 CG1 VAL A 120 9.875 22.458 14.733 1.00 49.31 C ATOM 1870 CG2 VAL A 120 11.190 23.689 12.942 1.00 49.57 C ATOM 1871 HA VAL A 120 12.515 22.200 14.865 1.00 0.00 H ATOM 1872 HB VAL A 120 10.384 21.719 12.774 1.00 0.00 H ATOM 1873 HG11 VAL A 120 9.632 21.467 15.116 1.00 0.00 H ATOM 1874 HG12 VAL A 120 10.338 23.051 15.522 1.00 0.00 H ATOM 1875 HG13 VAL A 120 8.964 22.951 14.393 1.00 0.00 H ATOM 1876 HG21 VAL A 120 11.679 24.309 13.693 1.00 0.00 H ATOM 1877 HG22 VAL A 120 11.855 23.557 12.089 1.00 0.00 H ATOM 1878 HG23 VAL A 120 10.269 24.172 12.615 1.00 0.00 H ATOM 1879 H VAL A 120 12.933 21.135 12.074 1.00 0.00 H ATOM 1880 N GLY A 121 12.385 19.797 15.549 1.00 51.09 N ATOM 1881 CA GLY A 121 12.316 18.428 15.999 1.00 51.76 C ATOM 1882 C GLY A 121 13.048 17.525 15.037 1.00 52.52 C ATOM 1883 O GLY A 121 14.251 17.673 14.820 1.00 52.76 O ATOM 1884 HA3 GLY A 121 11.272 18.120 16.058 1.00 0.00 H ATOM 1885 HA2 GLY A 121 12.773 18.350 16.985 1.00 0.00 H ATOM 1886 H GLY A 121 12.860 20.500 16.150 1.00 0.00 H ATOM 1887 N ASP A 122 12.295 16.605 14.449 1.00 53.09 N ATOM 1888 CA ASP A 122 12.832 15.607 13.528 1.00 53.58 C ATOM 1889 C ASP A 122 12.749 16.044 12.061 1.00 52.61 C ATOM 1890 O ASP A 122 13.185 15.307 11.191 1.00 52.67 O ATOM 1891 CB ASP A 122 12.046 14.307 13.695 1.00 54.17 C ATOM 1892 CG ASP A 122 10.555 14.492 13.389 1.00 56.48 C ATOM 1893 OD1 ASP A 122 9.848 13.481 13.140 1.00 58.95 O ATOM 1894 OD2 ASP A 122 10.013 15.627 13.380 1.00 57.54 O ATOM 1895 HA ASP A 122 13.886 15.474 13.772 1.00 0.00 H ATOM 1896 HB2 ASP A 122 12.455 13.559 13.016 1.00 0.00 H ATOM 1897 HB3 ASP A 122 12.154 13.960 14.723 1.00 0.00 H ATOM 1898 H ASP A 122 11.275 16.594 14.653 1.00 0.00 H ATOM 1899 N VAL A 123 12.162 17.213 11.796 1.00 51.52 N ATOM 1900 CA VAL A 123 12.038 17.739 10.436 1.00 50.56 C ATOM 1901 C VAL A 123 13.213 18.681 10.111 1.00 49.58 C ATOM 1902 O VAL A 123 13.693 19.420 10.970 1.00 48.95 O ATOM 1903 CB VAL A 123 10.689 18.485 10.226 1.00 50.86 C ATOM 1904 CG1 VAL A 123 10.467 18.814 8.764 1.00 50.77 C ATOM 1905 CG2 VAL A 123 9.512 17.650 10.745 1.00 51.55 C ATOM 1906 HA VAL A 123 12.061 16.887 9.757 1.00 0.00 H ATOM 1907 HB VAL A 123 10.743 19.415 10.793 1.00 0.00 H ATOM 1908 HG11 VAL A 123 11.277 19.452 8.409 1.00 0.00 H ATOM 1909 HG12 VAL A 123 10.449 17.891 8.184 1.00 0.00 H ATOM 1910 HG13 VAL A 123 9.516 19.335 8.650 1.00 0.00 H ATOM 1911 HG21 VAL A 123 9.475 16.703 10.207 1.00 0.00 H ATOM 1912 HG22 VAL A 123 9.645 17.460 11.810 1.00 0.00 H ATOM 1913 HG23 VAL A 123 8.582 18.196 10.585 1.00 0.00 H ATOM 1914 H VAL A 123 11.778 17.771 12.585 1.00 0.00 H ATOM 1915 N THR A 124 13.660 18.624 8.859 1.00 48.43 N ATOM 1916 CA THR A 124 14.847 19.314 8.396 1.00 47.22 C ATOM 1917 C THR A 124 14.668 19.809 6.976 1.00 46.50 C ATOM 1918 O THR A 124 14.237 19.085 6.085 1.00 46.22 O ATOM 1919 CB THR A 124 16.056 18.392 8.456 1.00 47.21 C ATOM 1920 OG1 THR A 124 16.294 18.034 9.810 1.00 48.49 O ATOM 1921 CG2 THR A 124 17.347 19.115 8.047 1.00 46.80 C ATOM 1922 HA THR A 124 15.009 20.170 9.052 1.00 0.00 H ATOM 1923 HB THR A 124 15.838 17.552 7.797 1.00 0.00 H ATOM 1924 HG1 THR A 124 15.499 17.568 10.172 1.00 0.00 H ATOM 1925 HG23 THR A 124 17.268 19.437 7.008 1.00 0.00 H ATOM 1926 HG21 THR A 124 17.494 19.984 8.688 1.00 0.00 H ATOM 1927 HG22 THR A 124 18.192 18.436 8.155 1.00 0.00 H ATOM 1928 H THR A 124 13.127 18.052 8.174 1.00 0.00 H ATOM 1929 N ALA A 125 15.008 21.071 6.786 1.00 45.70 N ATOM 1930 CA ALA A 125 15.033 21.690 5.500 1.00 45.03 C ATOM 1931 C ALA A 125 16.426 22.231 5.354 1.00 44.90 C ATOM 1932 O ALA A 125 17.121 22.477 6.330 1.00 45.30 O ATOM 1933 CB ALA A 125 14.034 22.799 5.431 1.00 44.79 C ATOM 1934 HA ALA A 125 14.779 20.988 4.705 1.00 0.00 H ATOM 1935 HB1 ALA A 125 13.036 22.399 5.612 1.00 0.00 H ATOM 1936 HB2 ALA A 125 14.270 23.547 6.188 1.00 0.00 H ATOM 1937 HB3 ALA A 125 14.069 23.257 4.443 1.00 0.00 H ATOM 1938 H ALA A 125 15.271 21.642 7.615 1.00 0.00 H ATOM 1939 N ILE A 126 16.848 22.385 4.119 1.00 44.57 N ATOM 1940 CA ILE A 126 18.158 22.918 3.829 1.00 44.21 C ATOM 1941 C ILE A 126 17.946 23.994 2.806 1.00 43.28 C ATOM 1942 O ILE A 126 17.231 23.804 1.837 1.00 42.77 O ATOM 1943 CB ILE A 126 19.098 21.819 3.295 1.00 44.43 C ATOM 1944 CG1 ILE A 126 19.413 20.830 4.434 1.00 44.64 C ATOM 1945 CG2 ILE A 126 20.371 22.452 2.711 1.00 45.10 C ATOM 1946 CD1 ILE A 126 20.193 19.633 4.034 1.00 44.73 C ATOM 1947 HA ILE A 126 18.634 23.313 4.726 1.00 0.00 H ATOM 1948 HB ILE A 126 18.615 21.267 2.489 1.00 0.00 H ATOM 1949 HG12 ILE A 126 19.981 21.363 5.197 1.00 0.00 H ATOM 1950 HG13 ILE A 126 18.468 20.491 4.857 1.00 0.00 H ATOM 1951 HD11 ILE A 126 19.637 19.074 3.281 1.00 0.00 H ATOM 1952 HD12 ILE A 126 21.152 19.947 3.621 1.00 0.00 H ATOM 1953 HD13 ILE A 126 20.361 19.002 4.907 1.00 0.00 H ATOM 1954 HG21 ILE A 126 20.101 23.121 1.894 1.00 0.00 H ATOM 1955 HG22 ILE A 126 20.885 23.016 3.489 1.00 0.00 H ATOM 1956 HG23 ILE A 126 21.027 21.666 2.337 1.00 0.00 H ATOM 1957 H ILE A 126 16.223 22.117 3.332 1.00 0.00 H ATOM 1958 N ARG A 127 18.584 25.127 3.038 1.00 42.48 N ATOM 1959 CA ARG A 127 18.456 26.268 2.170 1.00 41.88 C ATOM 1960 C ARG A 127 19.829 26.764 1.821 1.00 41.21 C ATOM 1961 O ARG A 127 20.604 27.105 2.682 1.00 40.31 O ATOM 1962 CB ARG A 127 17.621 27.338 2.855 1.00 41.70 C ATOM 1963 CG ARG A 127 16.146 27.069 2.632 1.00 41.31 C ATOM 1964 CD ARG A 127 15.247 27.575 3.700 1.00 41.04 C ATOM 1965 NE ARG A 127 15.024 29.016 3.599 1.00 40.94 N ATOM 1966 CZ ARG A 127 14.242 29.605 2.705 1.00 41.04 C ATOM 1967 NH1 ARG A 127 14.110 30.919 2.732 1.00 41.03 N ATOM 1968 NH2 ARG A 127 13.595 28.906 1.781 1.00 43.34 N ATOM 1969 HA ARG A 127 17.945 25.996 1.246 1.00 0.00 H ATOM 1970 HB2 ARG A 127 17.832 27.331 3.924 1.00 0.00 H ATOM 1971 HB3 ARG A 127 17.876 28.314 2.443 1.00 0.00 H ATOM 1972 HG2 ARG A 127 15.854 27.540 1.693 1.00 0.00 H ATOM 1973 HG3 ARG A 127 16.007 25.991 2.555 1.00 0.00 H ATOM 1974 HD2 ARG A 127 15.695 27.356 4.669 1.00 0.00 H ATOM 1975 HD3 ARG A 127 14.287 27.065 3.622 1.00 0.00 H ATOM 1976 HE ARG A 127 15.517 29.627 4.281 1.00 0.00 H ATOM 1977 HH12 ARG A 127 13.500 31.395 2.037 1.00 0.00 H ATOM 1978 HH11 ARG A 127 14.616 31.478 3.448 1.00 0.00 H ATOM 1979 HH22 ARG A 127 12.988 29.393 1.091 1.00 0.00 H ATOM 1980 HH21 ARG A 127 13.695 27.871 1.747 1.00 0.00 H ATOM 1981 H ARG A 127 19.198 25.197 3.874 1.00 0.00 H ATOM 1982 N ASN A 128 20.130 26.764 0.537 1.00 41.23 N ATOM 1983 CA ASN A 128 21.388 27.269 0.054 1.00 41.18 C ATOM 1984 C ASN A 128 21.284 28.696 -0.452 1.00 41.45 C ATOM 1985 O ASN A 128 20.338 29.058 -1.118 1.00 41.53 O ATOM 1986 CB ASN A 128 21.901 26.357 -1.015 1.00 41.25 C ATOM 1987 CG ASN A 128 22.396 25.070 -0.454 1.00 41.48 C ATOM 1988 OD1 ASN A 128 22.173 24.009 -1.021 1.00 45.30 O ATOM 1989 ND2 ASN A 128 23.078 25.146 0.671 1.00 41.67 N ATOM 1990 HA ASN A 128 22.090 27.293 0.888 1.00 0.00 H ATOM 1991 HB2 ASN A 128 21.095 26.149 -1.718 1.00 0.00 H ATOM 1992 HB3 ASN A 128 22.719 26.852 -1.538 1.00 0.00 H ATOM 1993 HD22 ASN A 128 23.243 26.071 1.118 1.00 0.00 H ATOM 1994 HD21 ASN A 128 23.451 24.281 1.112 1.00 0.00 H ATOM 1995 H ASN A 128 19.440 26.389 -0.145 1.00 0.00 H ATOM 1996 N TYR A 129 22.258 29.509 -0.069 1.00 41.74 N ATOM 1997 CA TYR A 129 22.388 30.862 -0.531 1.00 41.63 C ATOM 1998 C TYR A 129 23.683 30.973 -1.356 1.00 42.98 C ATOM 1999 O TYR A 129 24.723 30.522 -0.938 1.00 41.97 O ATOM 2000 CB TYR A 129 22.409 31.813 0.673 1.00 41.02 C ATOM 2001 CG TYR A 129 21.060 31.986 1.358 1.00 38.54 C ATOM 2002 CD1 TYR A 129 20.322 33.142 1.183 1.00 37.47 C ATOM 2003 CD2 TYR A 129 20.532 30.999 2.190 1.00 35.61 C ATOM 2004 CE1 TYR A 129 19.100 33.324 1.806 1.00 35.32 C ATOM 2005 CE2 TYR A 129 19.311 31.170 2.818 1.00 34.64 C ATOM 2006 CZ TYR A 129 18.596 32.335 2.610 1.00 34.88 C ATOM 2007 OH TYR A 129 17.387 32.541 3.199 1.00 31.59 O ATOM 2008 HA TYR A 129 21.543 31.139 -1.162 1.00 0.00 H ATOM 2009 HB3 TYR A 129 22.746 32.791 0.330 1.00 0.00 H ATOM 2010 HB2 TYR A 129 23.116 31.422 1.405 1.00 0.00 H ATOM 2011 HD2 TYR A 129 21.091 30.077 2.348 1.00 0.00 H ATOM 2012 HE2 TYR A 129 18.916 30.392 3.472 1.00 0.00 H ATOM 2013 HE1 TYR A 129 18.542 34.248 1.658 1.00 0.00 H ATOM 2014 HD1 TYR A 129 20.712 33.929 0.538 1.00 0.00 H ATOM 2015 HH TYR A 129 17.491 32.512 4.183 1.00 0.00 H ATOM 2016 H TYR A 129 22.966 29.148 0.602 1.00 0.00 H ATOM 2017 N LYS A 130 23.592 31.540 -2.556 1.00 45.71 N ATOM 2018 CA LYS A 130 24.765 31.899 -3.335 1.00 47.55 C ATOM 2019 C LYS A 130 25.198 33.305 -2.920 1.00 48.70 C ATOM 2020 O LYS A 130 24.393 34.228 -2.826 1.00 48.27 O ATOM 2021 CB LYS A 130 24.481 31.860 -4.837 1.00 47.92 C ATOM 2022 CG LYS A 130 24.271 30.463 -5.412 1.00 51.02 C ATOM 2023 CD LYS A 130 24.190 30.490 -6.971 1.00 54.51 C ATOM 2024 CE LYS A 130 25.592 30.617 -7.609 1.00 55.75 C ATOM 2025 NZ LYS A 130 25.551 30.732 -9.102 1.00 58.51 N ATOM 2026 HA LYS A 130 25.557 31.176 -3.140 1.00 0.00 H ATOM 2027 HB2 LYS A 130 23.581 32.444 -5.027 1.00 0.00 H ATOM 2028 HB3 LYS A 130 25.325 32.316 -5.354 1.00 0.00 H ATOM 2029 HG2 LYS A 130 25.104 29.827 -5.112 1.00 0.00 H ATOM 2030 HG3 LYS A 130 23.342 30.053 -5.016 1.00 0.00 H ATOM 2031 HD2 LYS A 130 23.725 29.567 -7.318 1.00 0.00 H ATOM 2032 HD3 LYS A 130 23.582 31.340 -7.280 1.00 0.00 H ATOM 2033 HE2 LYS A 130 26.175 29.735 -7.345 1.00 0.00 H ATOM 2034 HE3 LYS A 130 26.078 31.506 -7.206 1.00 0.00 H ATOM 2035 HZ1 LYS A 130 25.098 29.885 -9.501 1.00 0.00 H ATOM 2036 HZ2 LYS A 130 25.006 31.576 -9.369 1.00 0.00 H ATOM 2037 HZ3 LYS A 130 26.521 30.814 -9.469 1.00 0.00 H ATOM 2038 H LYS A 130 22.649 31.733 -2.950 1.00 0.00 H ATOM 2039 N ARG A 131 26.492 33.441 -2.693 1.00 50.29 N ATOM 2040 CA ARG A 131 27.119 34.688 -2.318 1.00 51.65 C ATOM 2041 C ARG A 131 26.922 35.704 -3.436 1.00 52.71 C ATOM 2042 O ARG A 131 27.077 35.373 -4.598 1.00 52.81 O ATOM 2043 CB ARG A 131 28.595 34.391 -2.128 1.00 51.84 C ATOM 2044 CG ARG A 131 29.418 35.465 -1.547 1.00 52.32 C ATOM 2045 CD ARG A 131 30.751 34.948 -1.072 1.00 53.20 C ATOM 2046 NE ARG A 131 31.086 35.626 0.166 1.00 54.97 N ATOM 2047 CZ ARG A 131 31.686 35.073 1.207 1.00 55.86 C ATOM 2048 NH1 ARG A 131 31.903 35.826 2.275 1.00 57.48 N ATOM 2049 NH2 ARG A 131 32.069 33.796 1.204 1.00 55.78 N ATOM 2050 HA ARG A 131 26.688 35.100 -1.405 1.00 0.00 H ATOM 2051 HB2 ARG A 131 28.676 33.523 -1.474 1.00 0.00 H ATOM 2052 HB3 ARG A 131 29.011 34.148 -3.106 1.00 0.00 H ATOM 2053 HG2 ARG A 131 29.585 36.232 -2.304 1.00 0.00 H ATOM 2054 HG3 ARG A 131 28.886 35.901 -0.701 1.00 0.00 H ATOM 2055 HD2 ARG A 131 31.515 35.152 -1.823 1.00 0.00 H ATOM 2056 HD3 ARG A 131 30.690 33.873 -0.900 1.00 0.00 H ATOM 2057 HE ARG A 131 30.833 36.632 0.241 1.00 0.00 H ATOM 2058 HH12 ARG A 131 32.373 35.421 3.110 1.00 0.00 H ATOM 2059 HH11 ARG A 131 31.604 36.822 2.279 1.00 0.00 H ATOM 2060 HH22 ARG A 131 32.539 33.392 2.039 1.00 0.00 H ATOM 2061 HH21 ARG A 131 31.898 33.204 0.366 1.00 0.00 H ATOM 2062 H ARG A 131 27.096 32.600 -2.790 1.00 0.00 H ATOM 2063 N LEU A 132 26.555 36.927 -3.090 1.00 54.36 N ATOM 2064 CA LEU A 132 26.409 37.984 -4.089 1.00 55.75 C ATOM 2065 C LEU A 132 27.710 38.774 -4.242 1.00 56.98 C ATOM 2066 O LEU A 132 28.321 39.172 -3.241 1.00 57.65 O ATOM 2067 CB LEU A 132 25.265 38.916 -3.730 1.00 55.26 C ATOM 2068 CG LEU A 132 23.909 38.220 -3.709 1.00 56.02 C ATOM 2069 CD1 LEU A 132 22.833 39.226 -3.369 1.00 56.41 C ATOM 2070 CD2 LEU A 132 23.607 37.530 -5.040 1.00 57.17 C ATOM 2071 HA LEU A 132 26.180 37.510 -5.043 1.00 0.00 H ATOM 2072 HB2 LEU A 132 25.456 39.335 -2.742 1.00 0.00 H ATOM 2073 HB3 LEU A 132 25.230 39.721 -4.464 1.00 0.00 H ATOM 2074 HG LEU A 132 23.932 37.443 -2.945 1.00 0.00 H ATOM 2075 HD21 LEU A 132 23.601 38.271 -5.839 1.00 0.00 H ATOM 2076 HD22 LEU A 132 24.374 36.782 -5.243 1.00 0.00 H ATOM 2077 HD23 LEU A 132 22.632 37.046 -4.984 1.00 0.00 H ATOM 2078 HD11 LEU A 132 23.037 39.657 -2.389 1.00 0.00 H ATOM 2079 HD12 LEU A 132 22.826 40.016 -4.120 1.00 0.00 H ATOM 2080 HD13 LEU A 132 21.863 38.728 -3.354 1.00 0.00 H ATOM 2081 H LEU A 132 26.367 37.140 -2.090 1.00 0.00 H ATOM 2082 N SER A 133 28.114 38.957 -5.505 1.00 58.08 N ATOM 2083 CA SER A 133 29.287 39.740 -5.920 1.00 59.12 C ATOM 2084 C SER A 133 30.597 39.072 -5.532 1.00 59.88 C ATOM 2085 O SER A 133 31.106 38.232 -6.281 1.00 60.57 O ATOM 2086 CB SER A 133 29.235 41.182 -5.393 1.00 59.36 C ATOM 2087 OG SER A 133 28.624 42.031 -6.347 1.00 59.20 O ATOM 2088 HA SER A 133 29.250 39.781 -7.009 1.00 0.00 H ATOM 2089 HB2 SER A 133 30.249 41.531 -5.198 1.00 0.00 H ATOM 2090 HB3 SER A 133 28.659 41.207 -4.468 1.00 0.00 H ATOM 2091 HG SER A 133 28.597 42.956 -5.995 1.00 0.00 H ATOM 2092 H SER A 133 27.551 38.508 -6.255 1.00 0.00 H TER 2093 SER A 133 HETATM 2094 O HOH 1 13.373 22.195 -5.105 1.00 52.50 O HETATM 2095 O HOH 2 -1.419 21.317 15.680 1.00 57.13 O HETATM 2096 O HOH 3 24.291 42.646 -4.246 1.00 52.39 O HETATM 2097 O HOH 4 19.287 32.734 -6.902 1.00 54.39 O HETATM 2098 O HOH 5 19.856 24.518 -7.714 1.00 60.59 O HETATM 2099 O HOH 6 -0.045 23.727 17.339 1.00 54.19 O HETATM 2100 O HOH 7 11.973 23.971 0.145 1.00 36.91 O HETATM 2101 O HOH 8 11.961 23.589 -3.469 1.00 48.86 O HETATM 2102 O HOH 9 13.106 19.917 -4.091 1.00 66.87 O HETATM 2103 O HOH 10 4.692 38.824 -0.740 1.00 53.21 O HETATM 2104 O HOH 11 9.235 19.127 16.015 1.00 83.99 O HETATM 2105 O HOH 12 4.116 19.886 14.297 1.00 55.55 O HETATM 2106 O HOH 13 1.992 32.344 10.357 1.00 40.44 O HETATM 2107 O HOH 14 0.256 33.739 0.371 1.00 35.88 O HETATM 2108 O HOH 15 11.726 31.625 0.907 1.00 47.73 O HETATM 2109 O HOH 16 1.035 23.804 20.028 1.00 46.64 O HETATM 2110 O HOH 17 2.705 34.797 -3.352 1.00 56.73 O HETATM 2111 O HOH 18 12.035 30.111 -2.236 1.00 37.11 O HETATM 2112 O HOH 19 11.367 36.842 -4.097 1.00 41.49 O HETATM 2113 O HOH 20 16.227 38.925 -2.678 1.00 48.11 O HETATM 2114 O HOH 21 23.849 43.004 6.989 1.00 76.37 O HETATM 2115 O HOH 22 19.952 41.552 2.558 1.00 29.92 O HETATM 2116 O HOH 23 17.960 13.787 8.501 1.00 56.85 O HETATM 2117 O HOH 24 30.244 49.428 13.207 1.00 50.49 O HETATM 2118 O HOH 25 34.859 45.767 19.681 1.00 52.88 O HETATM 2119 O HOH 26 29.928 38.180 20.193 1.00 63.39 O HETATM 2120 O HOH 27 21.777 45.494 21.686 1.00 41.18 O HETATM 2121 O HOH 28 25.948 44.223 14.376 1.00 61.68 O HETATM 2122 O HOH 29 23.123 43.414 8.752 1.00 69.16 O HETATM 2123 O HOH 30 17.285 38.798 9.629 1.00 43.01 O HETATM 2124 O HOH 31 15.567 41.168 -1.962 1.00 57.59 O HETATM 2125 O HOH 32 19.138 43.908 -1.066 1.00 50.05 O HETATM 2126 O HOH 33 14.811 46.504 1.710 1.00 65.60 O HETATM 2127 O HOH 34 4.489 40.847 0.089 1.00 45.05 O HETATM 2128 O HOH 35 12.149 38.800 -2.549 1.00 42.94 O HETATM 2129 O HOH 36 3.134 38.810 8.334 1.00 65.14 O HETATM 2130 O HOH 37 13.128 44.168 -0.128 1.00 39.55 O HETATM 2131 O HOH 38 16.379 44.508 15.215 1.00 32.32 O HETATM 2132 O HOH 39 19.924 45.438 9.222 1.00 65.81 O HETATM 2133 O HOH 40 19.764 44.518 19.365 1.00 75.63 O HETATM 2134 O HOH 41 22.523 35.498 20.314 1.00 37.41 O HETATM 2135 O HOH 42 22.625 38.587 21.436 1.00 54.45 O HETATM 2136 O HOH 43 25.014 35.367 27.750 1.00 68.85 O HETATM 2137 O HOH 44 25.479 43.161 25.154 1.00 57.09 O HETATM 2138 O HOH 45 20.852 37.656 27.049 1.00 66.51 O HETATM 2139 O HOH 46 22.304 35.619 28.125 1.00 69.37 O HETATM 2140 O HOH 47 13.584 40.937 15.252 1.00 43.62 O HETATM 2141 O HOH 48 13.358 37.911 12.478 1.00 57.32 O HETATM 2142 O HOH 49 7.531 39.881 11.713 1.00 69.85 O HETATM 2143 O HOH 50 3.577 31.786 12.473 1.00 39.76 O HETATM 2144 O HOH 51 9.063 39.233 19.500 1.00 52.55 O HETATM 2145 O HOH 52 3.079 33.584 18.661 1.00 45.04 O HETATM 2146 O HOH 53 4.291 41.724 22.390 1.00 49.98 O HETATM 2147 O HOH 54 7.253 41.828 23.144 1.00 57.63 O HETATM 2148 O HOH 55 26.209 25.925 18.869 1.00 53.95 O HETATM 2149 O HOH 56 37.525 28.496 13.391 1.00 56.28 O HETATM 2150 O HOH 57 22.693 28.109 19.381 1.00 49.90 O HETATM 2151 O HOH 58 11.613 29.419 13.573 1.00 38.76 O HETATM 2152 O HOH 59 10.692 28.398 17.136 1.00 44.38 O HETATM 2153 O HOH 60 12.463 32.935 11.701 1.00 44.78 O HETATM 2154 O HOH 61 3.812 22.260 20.425 1.00 47.74 O HETATM 2155 O HOH 62 22.337 30.545 12.428 1.00 48.48 O HETATM 2156 O HOH 63 25.539 23.020 8.014 1.00 46.30 O HETATM 2157 O HOH 64 34.534 32.652 -3.175 1.00 53.86 O HETATM 2158 O HOH 65 31.853 29.479 -6.349 1.00 46.75 O HETATM 2159 O HOH 66 29.763 25.839 -2.357 1.00 49.82 O HETATM 2160 O HOH 67 22.595 19.974 5.947 1.00 58.20 O HETATM 2161 O HOH 68 23.714 24.378 7.628 1.00 40.75 O HETATM 2162 O HOH 69 19.691 22.893 11.800 1.00 46.55 O HETATM 2163 O HOH 70 7.992 14.434 14.218 1.00 45.76 O HETATM 2164 O HOH 71 13.730 15.751 7.897 1.00 59.59 O HETATM 2165 O HOH 72 15.634 15.749 10.557 1.00 53.73 O HETATM 2166 O HOH 73 11.684 28.517 -0.286 1.00 36.19 O HETATM 2167 O HOH 74 29.520 38.268 -0.089 1.00 67.12 O HETATM 2168 O HOH 75 20.002 32.185 5.894 1.00 45.15 O HETATM 2169 O HOH 76 17.098 34.797 6.505 1.00 66.62 O HETATM 2170 C1 ACD A 77 17.034 31.329 6.316 1.00 0.03 C HETATM 2171 C2 ACD A 77 16.386 30.375 7.282 1.00 0.00 C HETATM 2172 C3 ACD A 77 15.291 31.127 8.034 1.00 -0.03 C HETATM 2173 C4 ACD A 77 14.126 30.176 8.323 1.00 -0.03 C HETATM 2174 C5 ACD A 77 14.014 29.879 9.814 1.00 -0.10 C HETATM 2175 C6 ACD A 77 12.863 29.363 10.274 1.00 -0.09 C HETATM 2176 C7 ACD A 77 11.708 29.065 9.339 1.00 -0.02 C HETATM 2177 C8 ACD A 77 10.519 29.630 10.019 1.00 -0.09 C HETATM 2178 C9 ACD A 77 9.566 30.373 9.463 1.00 -0.09 C HETATM 2179 C10 ACD A 77 9.481 30.802 8.032 1.00 -0.02 C HETATM 2180 C11 ACD A 77 8.020 31.121 7.852 1.00 -0.09 C HETATM 2181 C12 ACD A 77 7.512 31.600 6.732 1.00 -0.09 C HETATM 2182 C13 ACD A 77 8.370 31.886 5.543 1.00 -0.02 C HETATM 2183 C14 ACD A 77 8.138 33.324 5.107 1.00 -0.09 C HETATM 2184 C15 ACD A 77 9.019 33.995 4.356 1.00 -0.10 C HETATM 2185 C16 ACD A 77 10.306 33.372 3.836 1.00 -0.04 C HETATM 2186 C17 ACD A 77 11.524 34.066 4.423 1.00 -0.05 C HETATM 2187 C18 ACD A 77 11.507 35.555 4.090 1.00 -0.05 C HETATM 2188 C19 ACD A 77 11.427 36.344 5.389 1.00 -0.06 C HETATM 2189 C20 ACD A 77 11.333 37.855 5.165 1.00 -0.07 C HETATM 2190 H29 ACD A 77 11.278 38.367 6.137 1.00 0.02 H HETATM 2191 H30 ACD A 77 10.431 38.083 4.579 1.00 0.02 H HETATM 2192 H31 ACD A 77 12.223 38.201 4.618 1.00 0.02 H HETATM 2193 H27 ACD A 77 12.328 36.133 5.984 1.00 0.03 H HETATM 2194 H28 ACD A 77 10.536 36.016 5.944 1.00 0.03 H HETATM 2195 H25 ACD A 77 10.633 35.784 3.463 1.00 0.03 H HETATM 2196 H26 ACD A 77 12.427 35.824 3.550 1.00 0.03 H HETATM 2197 H23 ACD A 77 12.435 33.613 4.005 1.00 0.03 H HETATM 2198 H24 ACD A 77 11.520 33.940 5.516 1.00 0.03 H HETATM 2199 H21 ACD A 77 10.333 33.464 2.740 1.00 0.04 H HETATM 2200 H22 ACD A 77 10.329 32.308 4.115 1.00 0.04 H HETATM 2201 H20 ACD A 77 8.805 35.033 4.106 1.00 0.05 H HETATM 2202 H19 ACD A 77 7.222 33.826 5.417 1.00 0.05 H HETATM 2203 H17 ACD A 77 8.104 31.203 4.722 1.00 0.05 H HETATM 2204 H18 ACD A 77 9.428 31.746 5.808 1.00 0.05 H HETATM 2205 H16 ACD A 77 6.442 31.791 6.673 1.00 0.05 H HETATM 2206 H15 ACD A 77 7.347 30.947 8.691 1.00 0.05 H HETATM 2207 H13 ACD A 77 9.793 29.991 7.358 1.00 0.05 H HETATM 2208 H14 ACD A 77 10.104 31.690 7.849 1.00 0.05 H HETATM 2209 H12 ACD A 77 8.762 30.704 10.119 1.00 0.05 H HETATM 2210 H11 ACD A 77 10.415 29.415 11.082 1.00 0.05 H HETATM 2211 H9 ACD A 77 11.594 27.980 9.196 1.00 0.05 H HETATM 2212 H10 ACD A 77 11.864 29.549 8.364 1.00 0.05 H HETATM 2213 H8 ACD A 77 12.758 29.155 11.338 1.00 0.05 H HETATM 2214 H7 ACD A 77 14.845 30.080 10.488 1.00 0.05 H HETATM 2215 H5 ACD A 77 14.289 29.233 7.781 1.00 0.04 H HETATM 2216 H6 ACD A 77 13.190 30.640 7.978 1.00 0.04 H HETATM 2217 H3 ACD A 77 14.935 31.967 7.420 1.00 0.03 H HETATM 2218 H4 ACD A 77 15.695 31.511 8.982 1.00 0.03 H HETATM 2219 H1 ACD A 77 17.136 30.000 7.994 1.00 0.04 H HETATM 2220 H2 ACD A 77 15.947 29.530 6.732 1.00 0.04 H HETATM 2221 O1 ACD A 77 17.671 32.316 6.695 1.00 -0.57 O HETATM 2222 O2 ACD A 77 16.870 31.072 5.025 1.00 -0.57 O CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 2170 2171 2221 2222 CONECT 2171 2170 2172 2219 2220 CONECT 2172 2171 2173 2217 2218 CONECT 2173 2172 2174 2215 2216 CONECT 2174 2173 2175 2214 CONECT 2175 2174 2176 2213 CONECT 2176 2175 2177 2211 2212 CONECT 2177 2176 2178 2210 CONECT 2178 2177 2179 2209 CONECT 2179 2178 2180 2207 2208 CONECT 2180 2179 2181 2206 CONECT 2181 2180 2182 2205 CONECT 2182 2181 2183 2203 2204 CONECT 2183 2182 2184 2202 CONECT 2184 2183 2185 2201 CONECT 2185 2184 2186 2199 2200 CONECT 2186 2185 2187 2197 2198 CONECT 2187 2186 2188 2195 2196 CONECT 2188 2187 2189 2193 2194 CONECT 2189 2188 2190 2191 2192 CONECT 2190 2189 CONECT 2191 2189 CONECT 2192 2189 CONECT 2193 2188 CONECT 2194 2188 CONECT 2195 2187 CONECT 2196 2187 CONECT 2197 2186 CONECT 2198 2186 CONECT 2199 2185 CONECT 2200 2185 CONECT 2201 2184 CONECT 2202 2183 CONECT 2203 2182 CONECT 2204 2182 CONECT 2205 2181 CONECT 2206 2180 CONECT 2207 2179 CONECT 2208 2179 CONECT 2209 2178 CONECT 2210 2177 CONECT 2211 2176 CONECT 2212 2176 CONECT 2213 2175 CONECT 2214 2174 CONECT 2215 2173 CONECT 2216 2173 CONECT 2217 2172 CONECT 2218 2172 CONECT 2219 2171 CONECT 2220 2171 CONECT 2221 2170 CONECT 2222 2170 MASTER 0 0 0 0 0 0 0 0 2221 1 57 11 END
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Related entries of code: 1vyg
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1vyf
RCSB PDB
PDBbind
135aa, >1VYF_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1adl
RCSB PDB
PDBbind
ACD
1gnj
RCSB PDB
PDBbind
ACD
2lbv
RCSB PDB
PDBbind
ACD
5csd
RCSB PDB
PDBbind
ACD
5fb7
RCSB PDB
PDBbind
ACD
Entry Information
PDB ID
1vyg
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
fatty acid-binding protein
Ligand Name
ACD
EC.Number
E.C.-.-.-.-
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
Kd=10nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistryv43;pp.13000
Ligand Properties
Formula
C
2
0
H
3
2
O
2
Molecular Weight
304.467
Exact Mass
304.240
No. of atoms
54
No. of bonds
53
Polar Surface Area
37.3
LOGP Value
7.73 (
Computed with XLOGP3
)
6.22 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O
InChI String
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P29498
Entrez Gene ID
NCBI Entrez Gene ID:
8344852
ASD
Information of known allosteric effects of PDB entries
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