Browse entries in the PDBbind-CN Database
HEADER 6EQS_COMPLEX COMPND 6EQS_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 269 ALA ARG PRO SER SER SER MET ALA ASP PHE ARG LYS PHE SEQRES 2 A 269 PHE ALA LYS ALA LYS HIS ILE VAL ILE ILE SER GLY ALA SEQRES 3 A 269 GLY VAL SER ALA GLU SER GLY VAL PRO THR PHE ARG GLY SEQRES 4 A 269 ALA GLY GLY TYR TRP ARG LYS TRP GLN ALA GLN ASP LEU SEQRES 5 A 269 ALA THR PRO LEU ALA PHE ALA HIS ASN PRO SER ARG VAL SEQRES 6 A 269 TRP GLU PHE TYR HIS TYR ARG ARG GLU VAL MET GLY SER SEQRES 7 A 269 LYS GLU PRO ASN ALA GLY HIS ARG ALA ILE ALA GLU CYS SEQRES 8 A 269 GLU THR ARG LEU GLY LYS GLN GLY ARG ARG VAL VAL VAL SEQRES 9 A 269 ILE THR GLN ASN ILE ASP GLU LEU HIS ARG LYS ALA GLY SEQRES 10 A 269 THR LYS ASN LEU LEU GLU ILE HIS GLY SER LEU PHE LYS SEQRES 11 A 269 THR ARG CYS THR SER CYS GLY VAL VAL ALA GLU ASN TYR SEQRES 12 A 269 LYS SER PRO ILE CYS PRO ALA LEU SER GLY LYS GLY ALA SEQRES 13 A 269 PRO GLU PRO GLY THR GLN ASP ALA SER ILE PRO VAL GLU SEQRES 14 A 269 LYS LEU PRO ARG CYS GLU GLU ALA GLY CYS GLY GLY LEU SEQRES 15 A 269 LEU ARG PRO HIS VAL VAL TRP PHE GLY GLU ASN LEU ASP SEQRES 16 A 269 PRO ALA ILE LEU GLU GLU VAL ASP ARG GLU LEU ALA HIS SEQRES 17 A 269 CYS ASP LEU CYS LEU VAL VAL GLY THR SER SER VAL VAL SEQRES 18 A 269 TYR PRO ALA ALA MET PHE ALA PRO GLN VAL ALA ALA ARG SEQRES 19 A 269 GLY VAL PRO VAL ALA GLU PHE ASN THR GLU THR THR PRO SEQRES 20 A 269 ALA THR ASN ARG PHE ARG PHE HIS PHE GLN GLY PRO CYS SEQRES 21 A 269 GLY THR THR LEU PRO GLU ALA LEU ALA HET ZN A 1 1 HET BV A 8 140 ATOM 1 N ALA A 34 13.583 38.466 6.821 1.00 65.72 N ATOM 2 CA ALA A 34 14.456 37.313 6.308 1.00 58.35 C ATOM 3 C ALA A 34 14.021 36.831 4.877 1.00 39.44 C ATOM 4 O ALA A 34 13.226 35.858 4.738 1.00 62.04 O ATOM 5 CB ALA A 34 14.421 36.159 7.334 1.00 72.31 C ATOM 6 HN3 ALA A 34 12.592 38.153 6.872 1.00 0.00 H ATOM 7 HN2 ALA A 34 13.660 39.273 6.170 1.00 0.00 H ATOM 8 HN1 ALA A 34 13.907 38.750 7.767 1.00 0.00 H ATOM 9 N ARG A 35 14.442 37.565 3.826 1.00 37.06 N ATOM 10 CA ARG A 35 13.708 37.469 2.558 1.00 35.64 C ATOM 11 C ARG A 35 14.513 37.544 1.263 1.00 36.75 C ATOM 12 O ARG A 35 15.485 38.211 1.224 1.00 45.94 O ATOM 13 CB ARG A 35 12.678 38.534 2.484 1.00 47.94 C ATOM 14 CG ARG A 35 11.506 38.350 3.426 1.00 57.07 C ATOM 15 CD ARG A 35 10.571 39.531 3.274 1.00 69.67 C ATOM 16 NE ARG A 35 9.801 39.835 4.498 1.00 81.38 N ATOM 17 CZ ARG A 35 9.257 41.024 4.788 1.00 73.06 C ATOM 18 NH1 ARG A 35 9.367 42.052 3.942 1.00 94.35 N ATOM 19 NH2 ARG A 35 8.601 41.195 5.906 1.00 91.50 N ATOM 20 HE ARG A 35 9.672 39.067 5.187 1.00 0.00 H ATOM 21 HH12 ARG A 35 8.939 42.970 4.180 1.00 0.00 H ATOM 22 HH11 ARG A 35 9.880 41.935 3.045 1.00 0.00 H ATOM 23 HH22 ARG A 35 8.181 42.120 6.126 1.00 0.00 H ATOM 24 HH21 ARG A 35 8.500 40.406 6.575 1.00 0.00 H ATOM 25 H ARG A 35 15.271 38.187 3.912 1.00 0.00 H ATOM 26 N PRO A 36 14.121 36.684 0.279 1.00 22.97 N ATOM 27 CA PRO A 36 15.034 36.501 -0.797 1.00 17.89 C ATOM 28 C PRO A 36 15.166 37.607 -1.726 1.00 19.40 C ATOM 29 O PRO A 36 14.240 38.310 -1.920 1.00 24.23 O ATOM 30 CB PRO A 36 14.525 35.210 -1.448 1.00 17.76 C ATOM 31 CG PRO A 36 13.302 34.861 -0.792 1.00 30.16 C ATOM 32 CD PRO A 36 13.019 35.729 0.268 1.00 28.51 C ATOM 33 N SER A 37 16.308 37.671 -2.390 1.00 16.65 N ATOM 34 CA SER A 37 16.526 38.609 -3.455 1.00 16.30 C ATOM 35 C SER A 37 15.932 38.071 -4.783 1.00 15.02 C ATOM 36 O SER A 37 16.001 36.869 -5.011 1.00 16.01 O ATOM 37 CB SER A 37 17.994 38.813 -3.654 1.00 18.46 C ATOM 38 OG SER A 37 18.340 39.499 -4.852 1.00 17.86 O ATOM 39 HG SER A 37 17.923 40.397 -4.849 1.00 0.00 H ATOM 40 H SER A 37 17.076 37.019 -2.131 1.00 0.00 H ATOM 41 N SER A 38 15.426 39.029 -5.590 1.00 15.47 N ATOM 42 CA SER A 38 15.079 38.746 -6.990 1.00 16.95 C ATOM 43 C SER A 38 15.993 39.348 -7.988 1.00 16.02 C ATOM 44 O SER A 38 15.611 39.400 -9.175 1.00 16.81 O ATOM 45 CB SER A 38 13.691 39.211 -7.204 1.00 15.47 C ATOM 46 OG SER A 38 13.502 40.550 -7.120 1.00 17.74 O ATOM 47 HG SER A 38 12.547 40.758 -7.277 1.00 0.00 H ATOM 48 H SER A 38 15.279 39.987 -5.213 1.00 0.00 H ATOM 49 N SER A 39 17.226 39.602 -7.565 1.00 15.74 N ATOM 50 CA SER A 39 18.212 40.091 -8.498 1.00 17.23 C ATOM 51 C SER A 39 19.046 39.036 -9.216 1.00 16.35 C ATOM 52 O SER A 39 19.924 38.383 -8.638 1.00 16.18 O ATOM 53 CB SER A 39 19.147 41.091 -7.790 1.00 22.16 C ATOM 54 OG SER A 39 20.280 41.400 -8.565 1.00 21.95 O ATOM 55 HG SER A 39 19.992 41.802 -9.423 1.00 0.00 H ATOM 56 H SER A 39 17.479 39.449 -6.568 1.00 0.00 H ATOM 57 N MET A 40 18.779 38.831 -10.532 1.00 16.79 N ATOM 58 CA MET A 40 19.621 37.982 -11.352 1.00 18.79 C ATOM 59 C MET A 40 21.016 38.423 -11.452 1.00 20.15 C ATOM 60 O MET A 40 21.925 37.619 -11.472 1.00 19.72 O ATOM 61 CB MET A 40 19.016 37.789 -12.747 1.00 22.31 C ATOM 62 CG MET A 40 19.779 36.809 -13.616 1.00 24.47 C ATOM 63 SD MET A 40 19.640 35.218 -12.891 1.00 26.97 S ATOM 64 CE MET A 40 18.149 34.991 -13.962 1.00 34.33 C ATOM 65 H MET A 40 17.952 39.293 -10.961 1.00 0.00 H ATOM 66 N ALA A 41 21.233 39.678 -11.484 1.00 19.58 N ATOM 67 CA ALA A 41 22.610 40.207 -11.639 1.00 18.93 C ATOM 68 C ALA A 41 23.397 39.773 -10.407 1.00 18.07 C ATOM 69 O ALA A 41 24.537 39.397 -10.520 1.00 21.20 O ATOM 70 CB ALA A 41 22.562 41.776 -11.753 1.00 24.77 C ATOM 71 H ALA A 41 20.435 40.340 -11.400 1.00 0.00 H ATOM 72 N ASP A 42 22.779 39.824 -9.221 1.00 19.15 N ATOM 73 CA ASP A 42 23.494 39.471 -8.004 1.00 19.64 C ATOM 74 C ASP A 42 23.734 37.914 -8.003 1.00 16.15 C ATOM 75 O ASP A 42 24.842 37.486 -7.651 1.00 19.76 O ATOM 76 CB ASP A 42 22.792 39.914 -6.733 1.00 20.06 C ATOM 77 CG ASP A 42 22.924 41.435 -6.468 1.00 21.34 C ATOM 78 OD1 ASP A 42 23.746 42.121 -7.212 1.00 26.08 O ATOM 79 OD2 ASP A 42 22.086 41.890 -5.605 1.00 23.97 O ATOM 80 H ASP A 42 21.783 40.117 -9.169 1.00 0.00 H ATOM 81 N PHE A 43 22.728 37.154 -8.433 1.00 16.68 N ATOM 82 CA PHE A 43 22.966 35.729 -8.491 1.00 16.18 C ATOM 83 C PHE A 43 24.089 35.415 -9.442 1.00 14.38 C ATOM 84 O PHE A 43 24.957 34.540 -9.229 1.00 18.40 O ATOM 85 CB PHE A 43 21.684 35.083 -9.043 1.00 17.17 C ATOM 86 CG PHE A 43 21.906 33.629 -9.485 1.00 17.92 C ATOM 87 CD1 PHE A 43 21.920 32.591 -8.588 1.00 17.73 C ATOM 88 CD2 PHE A 43 22.113 33.313 -10.835 1.00 19.69 C ATOM 89 CE1 PHE A 43 22.197 31.287 -8.983 1.00 16.20 C ATOM 90 CE2 PHE A 43 22.358 32.088 -11.273 1.00 18.12 C ATOM 91 CZ PHE A 43 22.382 31.010 -10.334 1.00 16.11 C ATOM 92 H PHE A 43 21.815 37.566 -8.714 1.00 0.00 H ATOM 93 N ARG A 44 24.118 36.132 -10.575 1.00 15.95 N ATOM 94 CA ARG A 44 25.143 35.911 -11.588 1.00 16.07 C ATOM 95 C ARG A 44 26.594 36.153 -11.116 1.00 20.88 C ATOM 96 O ARG A 44 27.551 35.567 -11.604 1.00 20.65 O ATOM 97 CB ARG A 44 24.884 36.680 -12.909 1.00 20.10 C ATOM 98 CG ARG A 44 23.691 36.365 -13.642 1.00 24.32 C ATOM 99 CD ARG A 44 23.720 35.351 -14.598 1.00 28.58 C ATOM 100 NE ARG A 44 24.550 35.778 -15.761 1.00 30.97 N ATOM 101 CZ ARG A 44 25.019 34.840 -16.593 1.00 26.53 C ATOM 102 NH1 ARG A 44 24.699 33.558 -16.416 1.00 27.11 N ATOM 103 NH2 ARG A 44 25.814 35.112 -17.553 1.00 27.79 N ATOM 104 HE ARG A 44 24.760 36.784 -15.922 1.00 0.00 H ATOM 105 HH12 ARG A 44 25.068 32.835 -17.067 1.00 0.00 H ATOM 106 HH11 ARG A 44 24.081 33.280 -15.627 1.00 0.00 H ATOM 107 HH22 ARG A 44 26.155 34.353 -18.177 1.00 0.00 H ATOM 108 HH21 ARG A 44 26.121 36.093 -17.712 1.00 0.00 H ATOM 109 H ARG A 44 23.394 36.861 -10.734 1.00 0.00 H ATOM 110 N LYS A 45 26.756 37.093 -10.184 1.00 19.83 N ATOM 111 CA LYS A 45 28.033 37.328 -9.533 1.00 21.86 C ATOM 112 C LYS A 45 28.519 36.047 -8.755 1.00 19.09 C ATOM 113 O LYS A 45 29.707 35.650 -8.911 1.00 25.52 O ATOM 114 CB LYS A 45 27.937 38.498 -8.543 1.00 23.64 C ATOM 115 CG LYS A 45 27.793 39.861 -9.228 1.00 24.66 C ATOM 116 CD LYS A 45 27.394 40.973 -8.209 1.00 38.72 C ATOM 117 CE LYS A 45 26.815 42.168 -8.926 1.00 44.05 C ATOM 118 NZ LYS A 45 28.039 42.626 -9.593 1.00 57.85 N ATOM 119 HZ1 LYS A 45 28.758 42.853 -8.877 1.00 0.00 H ATOM 120 HZ2 LYS A 45 28.395 41.874 -10.217 1.00 0.00 H ATOM 121 HZ3 LYS A 45 27.829 43.474 -10.156 1.00 0.00 H ATOM 122 H LYS A 45 25.940 37.678 -9.914 1.00 0.00 H ATOM 123 N PHE A 46 27.567 35.401 -8.020 1.00 17.06 N ATOM 124 CA PHE A 46 27.931 34.096 -7.364 1.00 17.75 C ATOM 125 C PHE A 46 28.203 33.015 -8.471 1.00 18.84 C ATOM 126 O PHE A 46 29.163 32.281 -8.378 1.00 18.92 O ATOM 127 CB PHE A 46 26.836 33.644 -6.463 1.00 19.47 C ATOM 128 CG PHE A 46 26.717 34.354 -5.157 1.00 18.41 C ATOM 129 CD1 PHE A 46 27.733 34.381 -4.285 1.00 20.05 C ATOM 130 CD2 PHE A 46 25.536 35.004 -4.829 1.00 24.42 C ATOM 131 CE1 PHE A 46 27.558 35.025 -3.000 1.00 20.56 C ATOM 132 CE2 PHE A 46 25.355 35.669 -3.586 1.00 20.85 C ATOM 133 CZ PHE A 46 26.378 35.643 -2.677 1.00 23.02 C ATOM 134 H PHE A 46 26.613 35.801 -7.916 1.00 0.00 H ATOM 135 N PHE A 47 27.373 32.975 -9.483 1.00 15.06 N ATOM 136 CA PHE A 47 27.459 31.955 -10.525 1.00 16.43 C ATOM 137 C PHE A 47 28.788 31.994 -11.242 1.00 20.40 C ATOM 138 O PHE A 47 29.340 30.951 -11.548 1.00 21.17 O ATOM 139 CB PHE A 47 26.299 32.072 -11.492 1.00 17.67 C ATOM 140 CG PHE A 47 26.317 31.136 -12.643 1.00 18.83 C ATOM 141 CD1 PHE A 47 26.075 29.799 -12.441 1.00 21.83 C ATOM 142 CD2 PHE A 47 26.481 31.589 -13.999 1.00 19.89 C ATOM 143 CE1 PHE A 47 26.129 28.875 -13.496 1.00 18.79 C ATOM 144 CE2 PHE A 47 26.435 30.684 -15.023 1.00 21.41 C ATOM 145 CZ PHE A 47 26.268 29.313 -14.761 1.00 25.28 C ATOM 146 H PHE A 47 26.626 33.695 -9.547 1.00 0.00 H ATOM 147 N ALA A 48 29.341 33.192 -11.488 1.00 17.34 N ATOM 148 CA ALA A 48 30.549 33.339 -12.179 1.00 20.05 C ATOM 149 C ALA A 48 31.716 32.737 -11.475 1.00 21.35 C ATOM 150 O ALA A 48 32.685 32.342 -12.160 1.00 28.48 O ATOM 151 CB ALA A 48 30.861 34.858 -12.437 1.00 22.84 C ATOM 152 H ALA A 48 28.852 34.046 -11.151 1.00 0.00 H ATOM 153 N LYS A 49 31.670 32.649 -10.137 1.00 21.04 N ATOM 154 CA LYS A 49 32.768 32.166 -9.324 1.00 21.78 C ATOM 155 C LYS A 49 32.580 30.762 -8.790 1.00 21.90 C ATOM 156 O LYS A 49 33.515 30.199 -8.239 1.00 27.21 O ATOM 157 CB LYS A 49 32.978 33.199 -8.161 1.00 29.95 C ATOM 158 CG LYS A 49 33.323 34.637 -8.612 1.00 39.13 C ATOM 159 CD LYS A 49 34.393 35.312 -7.774 1.00 56.34 C ATOM 160 CE LYS A 49 34.748 36.742 -8.251 1.00 67.57 C ATOM 161 NZ LYS A 49 35.087 37.614 -7.081 1.00 81.54 N ATOM 162 HZ1 LYS A 49 34.270 37.664 -6.439 1.00 0.00 H ATOM 163 HZ2 LYS A 49 35.903 37.213 -6.576 1.00 0.00 H ATOM 164 HZ3 LYS A 49 35.322 38.569 -7.419 1.00 0.00 H ATOM 165 H LYS A 49 30.797 32.944 -9.656 1.00 0.00 H ATOM 166 N ALA A 50 31.351 30.225 -8.875 1.00 20.48 N ATOM 167 CA ALA A 50 31.045 28.974 -8.258 1.00 17.70 C ATOM 168 C ALA A 50 31.798 27.794 -8.925 1.00 16.27 C ATOM 169 O ALA A 50 31.799 27.619 -10.169 1.00 21.57 O ATOM 170 CB ALA A 50 29.550 28.723 -8.288 1.00 20.85 C ATOM 171 H ALA A 50 30.609 30.730 -9.400 1.00 0.00 H ATOM 172 N LYS A 51 32.364 26.981 -8.083 1.00 19.54 N ATOM 173 CA LYS A 51 33.158 25.833 -8.541 1.00 16.60 C ATOM 174 C LYS A 51 32.363 24.507 -8.479 1.00 18.34 C ATOM 175 O LYS A 51 32.756 23.517 -9.104 1.00 18.22 O ATOM 176 CB LYS A 51 34.538 25.765 -7.765 1.00 21.60 C ATOM 177 CG LYS A 51 35.475 26.951 -7.986 1.00 28.08 C ATOM 178 CD LYS A 51 36.908 26.818 -7.498 1.00 38.57 C ATOM 179 CE LYS A 51 37.962 27.868 -7.842 1.00 48.03 C ATOM 180 NZ LYS A 51 39.343 27.239 -7.810 1.00 62.91 N ATOM 181 HZ1 LYS A 51 39.529 26.863 -6.859 1.00 0.00 H ATOM 182 HZ2 LYS A 51 39.387 26.466 -8.505 1.00 0.00 H ATOM 183 HZ3 LYS A 51 40.056 27.959 -8.045 1.00 0.00 H ATOM 184 H LYS A 51 32.252 27.147 -7.062 1.00 0.00 H ATOM 185 N HIS A 52 31.313 24.472 -7.690 1.00 16.74 N ATOM 186 CA HIS A 52 30.618 23.246 -7.405 1.00 16.17 C ATOM 187 C HIS A 52 29.110 23.564 -7.201 1.00 13.13 C ATOM 188 O HIS A 52 28.704 23.885 -6.083 1.00 15.54 O ATOM 189 CB HIS A 52 31.233 22.522 -6.279 1.00 19.05 C ATOM 190 CG HIS A 52 30.673 21.139 -6.051 1.00 16.79 C ATOM 191 ND1 HIS A 52 31.406 20.150 -5.450 1.00 20.72 N ATOM 192 CD2 HIS A 52 29.490 20.574 -6.453 1.00 18.83 C ATOM 193 CE1 HIS A 52 30.638 19.043 -5.367 1.00 22.71 C ATOM 194 NE2 HIS A 52 29.467 19.276 -5.951 1.00 18.22 N ATOM 195 H HIS A 52 30.975 25.356 -7.259 1.00 0.00 H ATOM 196 N ILE A 53 28.374 23.516 -8.309 1.00 11.66 N ATOM 197 CA ILE A 53 26.975 23.863 -8.303 1.00 11.50 C ATOM 198 C ILE A 53 26.096 22.554 -8.159 1.00 11.66 C ATOM 199 O ILE A 53 26.283 21.659 -8.946 1.00 15.19 O ATOM 200 CB ILE A 53 26.588 24.644 -9.583 1.00 12.75 C ATOM 201 CG1 ILE A 53 27.540 25.848 -9.744 1.00 15.79 C ATOM 202 CG2 ILE A 53 25.143 25.014 -9.505 1.00 15.79 C ATOM 203 CD1 ILE A 53 27.249 26.620 -10.990 1.00 16.00 C ATOM 204 H ILE A 53 28.819 23.221 -9.201 1.00 0.00 H ATOM 205 N VAL A 54 25.187 22.562 -7.227 1.00 10.93 N ATOM 206 CA VAL A 54 24.173 21.525 -7.151 1.00 11.36 C ATOM 207 C VAL A 54 22.823 22.077 -7.552 1.00 9.64 C ATOM 208 O VAL A 54 22.387 23.125 -7.026 1.00 12.60 O ATOM 209 CB VAL A 54 24.130 21.041 -5.700 1.00 11.54 C ATOM 210 CG1 VAL A 54 22.919 20.132 -5.479 1.00 14.75 C ATOM 211 CG2 VAL A 54 25.355 20.304 -5.322 1.00 14.09 C ATOM 212 H VAL A 54 25.187 23.327 -6.522 1.00 0.00 H ATOM 213 N ILE A 55 22.177 21.381 -8.483 1.00 11.53 N ATOM 214 CA ILE A 55 20.895 21.797 -8.943 1.00 10.28 C ATOM 215 C ILE A 55 19.913 20.662 -8.509 1.00 9.02 C ATOM 216 O ILE A 55 20.026 19.480 -8.976 1.00 11.67 O ATOM 217 CB ILE A 55 20.901 21.897 -10.504 1.00 10.06 C ATOM 218 CG1 ILE A 55 21.943 22.950 -10.954 1.00 15.44 C ATOM 219 CG2 ILE A 55 19.482 22.178 -10.997 1.00 13.90 C ATOM 220 CD1 ILE A 55 22.076 23.204 -12.468 1.00 16.55 C ATOM 221 H ILE A 55 22.613 20.524 -8.879 1.00 0.00 H ATOM 222 N ILE A 56 18.981 20.979 -7.625 1.00 8.26 N ATOM 223 CA ILE A 56 17.914 20.108 -7.150 1.00 9.47 C ATOM 224 C ILE A 56 16.695 20.333 -8.019 1.00 9.31 C ATOM 225 O ILE A 56 16.282 21.520 -8.093 1.00 11.51 O ATOM 226 CB ILE A 56 17.676 20.351 -5.680 1.00 10.83 C ATOM 227 CG1 ILE A 56 18.888 19.997 -4.876 1.00 13.24 C ATOM 228 CG2 ILE A 56 16.438 19.508 -5.255 1.00 13.50 C ATOM 229 CD1 ILE A 56 18.895 20.665 -3.537 1.00 13.63 C ATOM 230 H ILE A 56 19.013 21.941 -7.232 1.00 0.00 H ATOM 231 N SER A 57 16.064 19.345 -8.657 1.00 8.95 N ATOM 232 CA SER A 57 14.894 19.576 -9.411 1.00 8.89 C ATOM 233 C SER A 57 13.724 18.716 -8.972 1.00 8.78 C ATOM 234 O SER A 57 13.887 17.585 -8.416 1.00 9.68 O ATOM 235 CB SER A 57 15.176 19.371 -10.956 1.00 9.26 C ATOM 236 OG SER A 57 15.423 18.010 -11.187 1.00 9.28 O ATOM 237 HG SER A 57 15.601 17.867 -12.150 1.00 0.00 H ATOM 238 H SER A 57 16.445 18.379 -8.597 1.00 0.00 H ATOM 239 N GLY A 58 12.548 19.234 -9.234 1.00 8.53 N ATOM 240 CA GLY A 58 11.362 18.566 -9.135 1.00 9.01 C ATOM 241 C GLY A 58 10.470 18.704 -10.365 1.00 8.05 C ATOM 242 O GLY A 58 10.981 19.008 -11.476 1.00 9.20 O ATOM 243 H GLY A 58 12.517 20.228 -9.540 1.00 0.00 H ATOM 244 N ALA A 59 9.193 18.288 -10.227 1.00 8.52 N ATOM 245 CA ALA A 59 8.357 18.070 -11.411 1.00 10.76 C ATOM 246 C ALA A 59 8.138 19.318 -12.250 1.00 9.87 C ATOM 247 O ALA A 59 7.841 19.272 -13.438 1.00 9.94 O ATOM 248 CB ALA A 59 7.057 17.438 -10.995 1.00 12.32 C ATOM 249 H ALA A 59 8.801 18.122 -9.278 1.00 0.00 H ATOM 250 N GLY A 60 8.295 20.441 -11.633 1.00 10.65 N ATOM 251 CA GLY A 60 8.113 21.698 -12.309 1.00 10.12 C ATOM 252 C GLY A 60 9.135 21.899 -13.429 1.00 10.83 C ATOM 253 O GLY A 60 8.835 22.668 -14.401 1.00 12.64 O ATOM 254 H GLY A 60 8.558 20.437 -10.627 1.00 0.00 H ATOM 255 N VAL A 61 10.323 21.263 -13.347 1.00 10.46 N ATOM 256 CA VAL A 61 11.283 21.359 -14.420 1.00 10.60 C ATOM 257 C VAL A 61 10.808 20.722 -15.681 1.00 8.64 C ATOM 258 O VAL A 61 11.339 21.008 -16.775 1.00 10.25 O ATOM 259 CB VAL A 61 12.732 20.974 -14.058 1.00 10.76 C ATOM 260 CG1 VAL A 61 12.869 19.483 -14.096 1.00 12.37 C ATOM 261 CG2 VAL A 61 13.791 21.666 -14.871 1.00 14.09 C ATOM 262 H VAL A 61 10.548 20.699 -12.503 1.00 0.00 H ATOM 263 N SER A 62 9.838 19.804 -15.592 1.00 10.18 N ATOM 264 CA SER A 62 9.351 19.083 -16.750 1.00 12.12 C ATOM 265 C SER A 62 7.934 19.503 -17.190 1.00 11.35 C ATOM 266 O SER A 62 7.424 19.026 -18.203 1.00 11.69 O ATOM 267 CB SER A 62 9.314 17.588 -16.492 1.00 11.10 C ATOM 268 OG SER A 62 10.639 17.135 -16.322 1.00 10.93 O ATOM 269 HG SER A 62 10.634 16.160 -16.152 1.00 0.00 H ATOM 270 H SER A 62 9.420 19.602 -14.661 1.00 0.00 H ATOM 271 N ALA A 63 7.378 20.454 -16.492 1.00 11.03 N ATOM 272 CA ALA A 63 6.034 20.899 -16.770 1.00 13.69 C ATOM 273 C ALA A 63 5.950 21.467 -18.248 1.00 12.27 C ATOM 274 O ALA A 63 4.981 21.185 -18.982 1.00 13.98 O ATOM 275 CB ALA A 63 5.534 21.919 -15.790 1.00 13.49 C ATOM 276 H ALA A 63 7.914 20.900 -15.720 1.00 0.00 H ATOM 277 N GLU A 64 7.002 22.217 -18.591 1.00 12.00 N ATOM 278 CA GLU A 64 6.998 22.773 -19.972 1.00 12.19 C ATOM 279 C GLU A 64 7.257 21.798 -21.078 1.00 14.44 C ATOM 280 O GLU A 64 7.200 22.135 -22.219 1.00 17.15 O ATOM 281 CB GLU A 64 7.988 23.922 -20.019 1.00 13.65 C ATOM 282 CG GLU A 64 7.553 25.138 -19.220 1.00 15.39 C ATOM 283 CD GLU A 64 8.619 26.151 -18.936 1.00 15.03 C ATOM 284 OE1 GLU A 64 8.971 26.867 -19.957 1.00 21.17 O ATOM 285 OE2 GLU A 64 9.142 26.179 -17.807 1.00 15.51 O ATOM 286 H GLU A 64 7.782 22.402 -17.928 1.00 0.00 H ATOM 287 N SER A 65 7.569 20.548 -20.710 1.00 12.02 N ATOM 288 CA SER A 65 7.609 19.454 -21.625 1.00 12.58 C ATOM 289 C SER A 65 6.259 18.793 -21.813 1.00 12.44 C ATOM 290 O SER A 65 6.120 17.776 -22.569 1.00 14.87 O ATOM 291 CB SER A 65 8.597 18.372 -21.212 1.00 12.91 C ATOM 292 OG SER A 65 9.890 18.929 -21.174 1.00 12.49 O ATOM 293 HG SER A 65 10.126 19.275 -22.071 1.00 0.00 H ATOM 294 H SER A 65 7.792 20.367 -19.711 1.00 0.00 H ATOM 295 N GLY A 66 5.236 19.263 -21.052 1.00 13.33 N ATOM 296 CA GLY A 66 3.947 18.587 -21.116 1.00 14.38 C ATOM 297 C GLY A 66 3.848 17.399 -20.116 1.00 15.53 C ATOM 298 O GLY A 66 2.904 16.663 -20.220 1.00 17.14 O ATOM 299 H GLY A 66 5.371 20.090 -20.436 1.00 0.00 H ATOM 300 N VAL A 67 4.739 17.301 -19.143 1.00 13.11 N ATOM 301 CA VAL A 67 4.681 16.192 -18.151 1.00 11.92 C ATOM 302 C VAL A 67 3.870 16.703 -16.986 1.00 13.29 C ATOM 303 O VAL A 67 4.179 17.761 -16.382 1.00 13.76 O ATOM 304 CB VAL A 67 6.095 15.843 -17.719 1.00 13.18 C ATOM 305 CG1 VAL A 67 6.048 14.708 -16.683 1.00 11.97 C ATOM 306 CG2 VAL A 67 6.898 15.343 -18.864 1.00 13.83 C ATOM 307 H VAL A 67 5.494 18.012 -19.070 1.00 0.00 H ATOM 308 N PRO A 68 2.822 15.948 -16.557 1.00 13.63 N ATOM 309 CA PRO A 68 2.018 16.391 -15.428 1.00 14.30 C ATOM 310 C PRO A 68 2.831 16.484 -14.192 1.00 13.26 C ATOM 311 O PRO A 68 3.687 15.702 -13.940 1.00 18.15 O ATOM 312 CB PRO A 68 0.882 15.366 -15.343 1.00 16.97 C ATOM 313 CG PRO A 68 1.491 14.155 -16.071 1.00 24.78 C ATOM 314 CD PRO A 68 2.283 14.717 -17.183 1.00 13.87 C ATOM 315 N THR A 69 2.510 17.434 -13.320 1.00 15.12 N ATOM 316 CA THR A 69 3.070 17.518 -11.976 1.00 12.63 C ATOM 317 C THR A 69 2.256 16.695 -10.960 1.00 12.89 C ATOM 318 O THR A 69 1.207 16.191 -11.299 1.00 18.68 O ATOM 319 CB THR A 69 3.287 18.954 -11.546 1.00 14.98 C ATOM 320 OG1 THR A 69 2.041 19.513 -11.418 1.00 15.21 O ATOM 321 CG2 THR A 69 4.175 19.742 -12.446 1.00 16.98 C ATOM 322 HG1 THR A 69 1.525 19.013 -10.737 1.00 0.00 H ATOM 323 H THR A 69 1.822 18.157 -13.612 1.00 0.00 H ATOM 324 N PHE A 70 2.785 16.604 -9.754 1.00 15.53 N ATOM 325 CA PHE A 70 1.979 16.011 -8.636 1.00 17.73 C ATOM 326 C PHE A 70 0.954 16.996 -8.065 1.00 17.28 C ATOM 327 O PHE A 70 -0.088 16.611 -7.585 1.00 23.92 O ATOM 328 CB PHE A 70 2.885 15.515 -7.496 1.00 19.12 C ATOM 329 CG PHE A 70 3.620 14.314 -7.800 1.00 21.04 C ATOM 330 CD1 PHE A 70 4.691 14.310 -8.672 1.00 23.20 C ATOM 331 CD2 PHE A 70 3.256 13.165 -7.175 1.00 31.76 C ATOM 332 CE1 PHE A 70 5.434 13.119 -8.872 1.00 33.88 C ATOM 333 CE2 PHE A 70 3.866 11.928 -7.446 1.00 44.28 C ATOM 334 CZ PHE A 70 4.974 11.926 -8.317 1.00 40.93 C ATOM 335 H PHE A 70 3.753 16.941 -9.580 1.00 0.00 H ATOM 336 N ARG A 71 1.281 18.276 -8.046 1.00 19.18 N ATOM 337 CA ARG A 71 0.367 19.348 -7.531 1.00 23.03 C ATOM 338 C ARG A 71 -0.627 19.675 -8.683 1.00 19.57 C ATOM 339 O ARG A 71 -0.340 19.562 -9.901 1.00 27.01 O ATOM 340 CB ARG A 71 1.284 20.547 -7.176 1.00 25.98 C ATOM 341 CG ARG A 71 0.644 21.952 -7.250 1.00 42.92 C ATOM 342 CD ARG A 71 1.755 22.916 -7.095 1.00 54.21 C ATOM 343 NE ARG A 71 2.147 22.587 -5.693 1.00 50.86 N ATOM 344 CZ ARG A 71 1.579 23.196 -4.645 1.00 38.54 C ATOM 345 NH1 ARG A 71 0.741 24.179 -4.870 1.00 53.00 N ATOM 346 NH2 ARG A 71 1.830 22.838 -3.394 1.00 51.45 N ATOM 347 HE ARG A 71 2.879 21.867 -5.526 1.00 0.00 H ATOM 348 HH12 ARG A 71 0.287 24.668 -4.072 1.00 0.00 H ATOM 349 HH11 ARG A 71 0.531 24.470 -5.846 1.00 0.00 H ATOM 350 HH22 ARG A 71 1.368 23.337 -2.608 1.00 0.00 H ATOM 351 HH21 ARG A 71 2.489 22.058 -3.199 1.00 0.00 H ATOM 352 H ARG A 71 2.217 18.553 -8.405 1.00 0.00 H ATOM 353 N GLY A 72 -1.798 19.999 -8.244 1.00 26.14 N ATOM 354 CA GLY A 72 -2.853 20.344 -9.207 1.00 24.41 C ATOM 355 C GLY A 72 -3.495 19.212 -9.941 1.00 22.43 C ATOM 356 O GLY A 72 -3.331 18.011 -9.608 1.00 32.97 O ATOM 357 H GLY A 72 -1.992 20.015 -7.222 1.00 0.00 H ATOM 358 N ALA A 73 -4.001 19.549 -11.113 1.00 26.49 N ATOM 359 CA ALA A 73 -4.920 18.653 -11.770 1.00 23.78 C ATOM 360 C ALA A 73 -4.250 17.468 -12.373 1.00 25.97 C ATOM 361 O ALA A 73 -4.860 16.417 -12.461 1.00 25.17 O ATOM 362 CB ALA A 73 -5.669 19.401 -12.862 1.00 24.40 C ATOM 363 H ALA A 73 -3.739 20.452 -11.558 1.00 0.00 H ATOM 364 N GLY A 74 -2.976 17.633 -12.772 1.00 26.82 N ATOM 365 CA GLY A 74 -2.243 16.529 -13.285 1.00 27.89 C ATOM 366 C GLY A 74 -1.926 15.451 -12.299 1.00 27.21 C ATOM 367 O GLY A 74 -1.525 14.419 -12.724 1.00 32.23 O ATOM 368 H GLY A 74 -2.527 18.569 -12.705 1.00 0.00 H ATOM 369 N GLY A 75 -2.048 15.669 -11.022 1.00 22.13 N ATOM 370 CA GLY A 75 -1.714 14.693 -9.946 1.00 22.53 C ATOM 371 C GLY A 75 -2.735 13.596 -9.568 1.00 21.55 C ATOM 372 O GLY A 75 -2.647 12.942 -8.553 1.00 29.29 O ATOM 373 H GLY A 75 -2.408 16.600 -10.728 1.00 0.00 H ATOM 374 N TYR A 76 -3.732 13.500 -10.433 1.00 17.91 N ATOM 375 CA TYR A 76 -4.890 12.556 -10.287 1.00 18.03 C ATOM 376 C TYR A 76 -4.864 11.587 -11.423 1.00 20.02 C ATOM 377 O TYR A 76 -4.503 11.899 -12.558 1.00 20.63 O ATOM 378 CB TYR A 76 -6.222 13.289 -10.254 1.00 18.39 C ATOM 379 CG TYR A 76 -6.364 14.178 -9.095 1.00 17.87 C ATOM 380 CD1 TYR A 76 -5.810 15.477 -9.073 1.00 18.59 C ATOM 381 CD2 TYR A 76 -6.959 13.759 -7.960 1.00 18.09 C ATOM 382 CE1 TYR A 76 -5.962 16.327 -8.006 1.00 24.55 C ATOM 383 CE2 TYR A 76 -7.115 14.604 -6.877 1.00 20.75 C ATOM 384 CZ TYR A 76 -6.616 15.885 -6.916 1.00 20.61 C ATOM 385 OH TYR A 76 -6.746 16.669 -5.806 1.00 32.69 O ATOM 386 HH TYR A 76 -6.343 17.556 -5.981 1.00 0.00 H ATOM 387 H TYR A 76 -3.712 14.119 -11.268 1.00 0.00 H ATOM 388 N TRP A 77 -5.217 10.347 -11.099 1.00 16.20 N ATOM 389 CA TRP A 77 -5.365 9.266 -12.060 1.00 13.45 C ATOM 390 C TRP A 77 -6.579 8.490 -11.596 1.00 15.70 C ATOM 391 O TRP A 77 -6.610 8.032 -10.454 1.00 16.74 O ATOM 392 CB TRP A 77 -4.047 8.393 -12.120 1.00 14.10 C ATOM 393 CG TRP A 77 -4.184 7.335 -13.124 1.00 13.19 C ATOM 394 CD1 TRP A 77 -3.873 7.319 -14.430 1.00 16.13 C ATOM 395 CD2 TRP A 77 -4.531 5.976 -12.806 1.00 13.37 C ATOM 396 NE1 TRP A 77 -4.033 6.096 -14.992 1.00 14.80 N ATOM 397 CE2 TRP A 77 -4.460 5.223 -13.954 1.00 15.03 C ATOM 398 CE3 TRP A 77 -4.908 5.336 -11.618 1.00 12.30 C ATOM 399 CZ2 TRP A 77 -4.682 3.836 -13.929 1.00 12.58 C ATOM 400 CZ3 TRP A 77 -5.109 3.938 -11.612 1.00 12.48 C ATOM 401 CH2 TRP A 77 -4.987 3.245 -12.781 1.00 15.62 C ATOM 402 HE1 TRP A 77 -3.874 5.845 -15.989 1.00 0.00 H ATOM 403 H TRP A 77 -5.398 10.137 -10.097 1.00 0.00 H ATOM 404 N ARG A 78 -7.550 8.425 -12.480 1.00 18.01 N ATOM 405 CA ARG A 78 -8.840 7.946 -12.102 1.00 17.74 C ATOM 406 C ARG A 78 -9.281 8.691 -10.886 1.00 18.43 C ATOM 407 O ARG A 78 -9.171 9.894 -10.896 1.00 20.95 O ATOM 408 CB ARG A 78 -8.865 6.398 -12.014 1.00 14.78 C ATOM 409 CG ARG A 78 -8.469 5.731 -13.304 1.00 14.05 C ATOM 410 CD ARG A 78 -8.544 4.221 -13.262 1.00 13.54 C ATOM 411 NE ARG A 78 -8.101 3.678 -14.531 1.00 14.16 N ATOM 412 CZ ARG A 78 -7.683 2.457 -14.782 1.00 15.51 C ATOM 413 NH1 ARG A 78 -7.839 1.501 -13.871 1.00 16.68 N ATOM 414 NH2 ARG A 78 -7.129 2.206 -15.926 1.00 19.16 N ATOM 415 HE ARG A 78 -8.116 4.332 -15.339 1.00 0.00 H ATOM 416 HH12 ARG A 78 -7.509 0.535 -14.069 1.00 0.00 H ATOM 417 HH11 ARG A 78 -8.291 1.719 -12.960 1.00 0.00 H ATOM 418 HH22 ARG A 78 -6.793 1.246 -16.141 1.00 0.00 H ATOM 419 HH21 ARG A 78 -7.021 2.965 -16.629 1.00 0.00 H ATOM 420 H ARG A 78 -7.377 8.725 -13.461 1.00 0.00 H ATOM 421 N LYS A 79 -9.761 8.073 -9.839 1.00 17.87 N ATOM 422 CA LYS A 79 -10.196 8.843 -8.682 1.00 21.72 C ATOM 423 C LYS A 79 -9.094 9.001 -7.623 1.00 27.11 C ATOM 424 O LYS A 79 -9.397 9.513 -6.548 1.00 35.46 O ATOM 425 CB LYS A 79 -11.317 8.137 -8.011 1.00 25.66 C ATOM 426 CG LYS A 79 -10.977 6.757 -7.440 1.00 29.15 C ATOM 427 CD LYS A 79 -12.102 6.327 -6.632 1.00 40.36 C ATOM 428 CE LYS A 79 -11.762 5.087 -5.847 1.00 41.16 C ATOM 429 NZ LYS A 79 -12.713 4.690 -4.751 1.00 51.40 N ATOM 430 HZ1 LYS A 79 -12.773 5.457 -4.051 1.00 0.00 H ATOM 431 HZ2 LYS A 79 -13.654 4.515 -5.157 1.00 0.00 H ATOM 432 HZ3 LYS A 79 -12.367 3.824 -4.290 1.00 0.00 H ATOM 433 H LYS A 79 -9.832 7.035 -9.832 1.00 0.00 H ATOM 434 N TRP A 80 -7.878 8.617 -7.904 1.00 22.02 N ATOM 435 CA TRP A 80 -6.823 8.625 -6.930 1.00 24.45 C ATOM 436 C TRP A 80 -5.849 9.714 -7.192 1.00 19.45 C ATOM 437 O TRP A 80 -5.629 10.194 -8.324 1.00 22.71 O ATOM 438 CB TRP A 80 -6.074 7.298 -6.894 1.00 20.18 C ATOM 439 CG TRP A 80 -6.922 6.205 -6.417 1.00 25.06 C ATOM 440 CD1 TRP A 80 -7.305 5.949 -5.143 1.00 31.76 C ATOM 441 CD2 TRP A 80 -7.647 5.297 -7.248 1.00 20.32 C ATOM 442 NE1 TRP A 80 -8.185 4.912 -5.114 1.00 35.72 N ATOM 443 CE2 TRP A 80 -8.392 4.463 -6.376 1.00 26.46 C ATOM 444 CE3 TRP A 80 -7.603 5.026 -8.617 1.00 18.09 C ATOM 445 CZ2 TRP A 80 -9.115 3.408 -6.785 1.00 23.69 C ATOM 446 CZ3 TRP A 80 -8.392 4.016 -9.072 1.00 26.88 C ATOM 447 CH2 TRP A 80 -9.188 3.224 -8.159 1.00 23.83 C ATOM 448 HE1 TRP A 80 -8.629 4.524 -4.257 1.00 0.00 H ATOM 449 H TRP A 80 -7.666 8.293 -8.869 1.00 0.00 H ATOM 450 N GLN A 81 -5.159 10.030 -6.121 1.00 22.81 N ATOM 451 CA GLN A 81 -3.979 10.813 -6.181 1.00 24.21 C ATOM 452 C GLN A 81 -2.797 9.867 -6.308 1.00 18.51 C ATOM 453 O GLN A 81 -2.728 8.737 -5.771 1.00 20.73 O ATOM 454 CB GLN A 81 -3.799 11.765 -4.974 1.00 25.28 C ATOM 455 CG GLN A 81 -4.765 12.911 -5.076 1.00 43.20 C ATOM 456 CD GLN A 81 -4.615 13.893 -3.942 1.00 53.06 C ATOM 457 OE1 GLN A 81 -4.016 14.962 -4.068 1.00 65.64 O ATOM 458 NE2 GLN A 81 -5.108 13.477 -2.830 1.00 57.94 N ATOM 459 HE22 GLN A 81 -5.603 12.563 -2.790 1.00 0.00 H ATOM 460 HE21 GLN A 81 -5.012 14.054 -1.970 1.00 0.00 H ATOM 461 H GLN A 81 -5.490 9.693 -5.194 1.00 0.00 H ATOM 462 N ALA A 82 -1.842 10.376 -6.919 1.00 21.54 N ATOM 463 CA ALA A 82 -0.615 9.718 -7.102 1.00 23.11 C ATOM 464 C ALA A 82 0.017 9.197 -5.839 1.00 23.17 C ATOM 465 O ALA A 82 0.409 8.021 -5.788 1.00 27.78 O ATOM 466 CB ALA A 82 0.315 10.568 -7.925 1.00 31.09 C ATOM 467 H ALA A 82 -1.957 11.332 -7.312 1.00 0.00 H ATOM 468 N GLN A 83 -0.091 9.906 -4.719 1.00 22.79 N ATOM 469 CA GLN A 83 0.483 9.404 -3.447 1.00 32.75 C ATOM 470 C GLN A 83 -0.355 8.304 -2.743 1.00 27.06 C ATOM 471 O GLN A 83 -0.051 7.706 -1.610 1.00 27.11 O ATOM 472 CB GLN A 83 0.760 10.534 -2.469 1.00 33.80 C ATOM 473 CG GLN A 83 -0.398 11.043 -1.677 1.00 26.20 C ATOM 474 CD GLN A 83 -0.019 12.478 -1.114 1.00 33.81 C ATOM 475 OE1 GLN A 83 0.708 12.547 -0.124 1.00 45.22 O ATOM 476 NE2 GLN A 83 -0.430 13.610 -1.813 1.00 35.12 N ATOM 477 HE22 GLN A 83 -1.045 13.512 -2.646 1.00 0.00 H ATOM 478 HE21 GLN A 83 -0.122 14.553 -1.502 1.00 0.00 H ATOM 479 H GLN A 83 -0.583 10.822 -4.735 1.00 0.00 H ATOM 480 N ASP A 84 -1.526 8.067 -3.279 1.00 19.28 N ATOM 481 CA ASP A 84 -2.319 6.947 -2.887 1.00 18.66 C ATOM 482 C ASP A 84 -1.840 5.640 -3.510 1.00 15.24 C ATOM 483 O ASP A 84 -1.950 4.548 -2.964 1.00 24.07 O ATOM 484 CB ASP A 84 -3.871 7.156 -3.348 1.00 21.11 C ATOM 485 CG ASP A 84 -4.586 8.351 -2.777 1.00 19.78 C ATOM 486 OD1 ASP A 84 -4.441 8.532 -1.564 1.00 30.35 O ATOM 487 OD2 ASP A 84 -5.273 8.999 -3.658 1.00 30.94 O ATOM 488 H ASP A 84 -1.888 8.712 -4.010 1.00 0.00 H ATOM 489 N LEU A 85 -1.376 5.730 -4.742 1.00 14.19 N ATOM 490 CA LEU A 85 -1.021 4.556 -5.540 1.00 13.91 C ATOM 491 C LEU A 85 0.443 4.159 -5.402 1.00 13.56 C ATOM 492 O LEU A 85 0.857 2.974 -5.494 1.00 16.07 O ATOM 493 CB LEU A 85 -1.363 4.765 -6.997 1.00 16.68 C ATOM 494 CG LEU A 85 -2.852 4.979 -7.204 1.00 19.34 C ATOM 495 CD1 LEU A 85 -3.133 5.739 -8.504 1.00 29.02 C ATOM 496 CD2 LEU A 85 -3.459 3.656 -7.302 1.00 36.42 C ATOM 497 H LEU A 85 -1.258 6.674 -5.163 1.00 0.00 H ATOM 498 N ALA A 86 1.291 5.174 -5.148 1.00 12.58 N ATOM 499 CA ALA A 86 2.747 4.990 -5.048 1.00 10.61 C ATOM 500 C ALA A 86 3.150 4.663 -3.591 1.00 11.15 C ATOM 501 O ALA A 86 3.869 5.319 -2.928 1.00 12.50 O ATOM 502 CB ALA A 86 3.457 6.246 -5.485 1.00 12.22 C ATOM 503 H ALA A 86 0.900 6.129 -5.017 1.00 0.00 H ATOM 504 N THR A 87 2.591 3.491 -3.181 1.00 11.21 N ATOM 505 CA THR A 87 2.843 2.998 -1.826 1.00 11.53 C ATOM 506 C THR A 87 2.985 1.461 -1.857 1.00 11.10 C ATOM 507 O THR A 87 2.338 0.819 -2.666 1.00 14.06 O ATOM 508 CB THR A 87 1.733 3.392 -0.848 1.00 15.02 C ATOM 509 OG1 THR A 87 0.507 2.605 -1.069 1.00 21.26 O ATOM 510 CG2 THR A 87 1.435 4.861 -0.738 1.00 14.91 C ATOM 511 HG1 THR A 87 -0.186 2.887 -0.420 1.00 0.00 H ATOM 512 H THR A 87 1.986 2.947 -3.829 1.00 0.00 H ATOM 513 N PRO A 88 3.758 0.942 -0.845 1.00 10.82 N ATOM 514 CA PRO A 88 3.830 -0.555 -0.830 1.00 12.07 C ATOM 515 C PRO A 88 2.482 -1.167 -0.501 1.00 13.84 C ATOM 516 O PRO A 88 2.181 -2.289 -0.982 1.00 15.58 O ATOM 517 CB PRO A 88 4.856 -0.816 0.259 1.00 18.84 C ATOM 518 CG PRO A 88 5.395 0.435 0.713 1.00 16.91 C ATOM 519 CD PRO A 88 4.642 1.568 0.101 1.00 12.86 C ATOM 520 N LEU A 89 1.615 -0.564 0.334 1.00 15.62 N ATOM 521 CA LEU A 89 0.319 -1.138 0.632 1.00 16.98 C ATOM 522 C LEU A 89 -0.547 -1.223 -0.651 1.00 14.91 C ATOM 523 O LEU A 89 -1.255 -2.211 -0.850 1.00 15.84 O ATOM 524 CB LEU A 89 -0.365 -0.369 1.754 1.00 19.77 C ATOM 525 CG LEU A 89 -1.700 -0.983 2.236 1.00 23.84 C ATOM 526 CD1 LEU A 89 -1.584 -2.460 2.721 1.00 34.49 C ATOM 527 CD2 LEU A 89 -2.201 -0.088 3.378 1.00 32.54 C ATOM 528 H LEU A 89 1.883 0.338 0.777 1.00 0.00 H ATOM 529 N ALA A 90 -0.539 -0.149 -1.415 1.00 14.18 N ATOM 530 CA ALA A 90 -1.290 -0.164 -2.652 1.00 13.02 C ATOM 531 C ALA A 90 -0.887 -1.351 -3.546 1.00 13.47 C ATOM 532 O ALA A 90 -1.738 -1.987 -4.127 1.00 15.92 O ATOM 533 CB ALA A 90 -1.253 1.183 -3.404 1.00 14.35 C ATOM 534 H ALA A 90 -0.002 0.696 -1.133 1.00 0.00 H ATOM 535 N PHE A 91 0.414 -1.483 -3.690 1.00 13.82 N ATOM 536 CA PHE A 91 0.904 -2.521 -4.510 1.00 13.75 C ATOM 537 C PHE A 91 0.588 -3.957 -4.012 1.00 13.20 C ATOM 538 O PHE A 91 0.292 -4.792 -4.767 1.00 16.93 O ATOM 539 CB PHE A 91 2.403 -2.311 -4.774 1.00 13.21 C ATOM 540 CG PHE A 91 3.035 -3.250 -5.753 1.00 13.75 C ATOM 541 CD1 PHE A 91 2.881 -3.012 -7.121 1.00 15.18 C ATOM 542 CD2 PHE A 91 3.785 -4.258 -5.398 1.00 15.22 C ATOM 543 CE1 PHE A 91 3.442 -3.836 -8.059 1.00 12.63 C ATOM 544 CE2 PHE A 91 4.342 -5.170 -6.308 1.00 17.19 C ATOM 545 CZ PHE A 91 4.200 -4.874 -7.681 1.00 15.44 C ATOM 546 H PHE A 91 1.069 -0.834 -3.208 1.00 0.00 H ATOM 547 N ALA A 92 0.683 -4.120 -2.695 1.00 16.58 N ATOM 548 CA ALA A 92 0.333 -5.383 -2.102 1.00 19.36 C ATOM 549 C ALA A 92 -1.119 -5.743 -2.286 1.00 21.80 C ATOM 550 O ALA A 92 -1.482 -6.858 -2.531 1.00 25.20 O ATOM 551 CB ALA A 92 0.701 -5.370 -0.621 1.00 19.91 C ATOM 552 H ALA A 92 1.010 -3.336 -2.095 1.00 0.00 H ATOM 553 N HIS A 93 -1.994 -4.737 -2.175 1.00 19.99 N ATOM 554 CA HIS A 93 -3.431 -4.936 -2.286 1.00 24.19 C ATOM 555 C HIS A 93 -3.924 -5.135 -3.676 1.00 20.44 C ATOM 556 O HIS A 93 -4.864 -5.866 -3.907 1.00 20.32 O ATOM 557 CB HIS A 93 -4.225 -3.828 -1.624 1.00 30.74 C ATOM 558 CG HIS A 93 -4.261 -3.911 -0.123 1.00 62.58 C ATOM 559 ND1 HIS A 93 -4.317 -5.094 0.577 1.00104.98 N ATOM 560 CD2 HIS A 93 -4.270 -2.928 0.772 1.00 86.78 C ATOM 561 CE1 HIS A 93 -4.354 -4.818 1.868 1.00118.08 C ATOM 562 NE2 HIS A 93 -4.360 -3.507 2.010 1.00139.35 N ATOM 563 H HIS A 93 -1.633 -3.777 -2.003 1.00 0.00 H ATOM 564 N ASN A 94 -3.332 -4.368 -4.593 1.00 15.79 N ATOM 565 CA ASN A 94 -3.872 -4.316 -5.963 1.00 13.71 C ATOM 566 C ASN A 94 -2.730 -4.037 -6.891 1.00 14.19 C ATOM 567 O ASN A 94 -2.632 -2.938 -7.456 1.00 14.69 O ATOM 568 CB ASN A 94 -4.957 -3.323 -6.129 1.00 20.45 C ATOM 569 CG ASN A 94 -5.861 -3.695 -7.252 1.00 23.17 C ATOM 570 OD1 ASN A 94 -5.357 -4.173 -8.327 1.00 22.47 O ATOM 571 ND2 ASN A 94 -7.189 -3.452 -7.096 1.00 33.63 N ATOM 572 HD22 ASN A 94 -7.545 -3.062 -6.200 1.00 0.00 H ATOM 573 HD21 ASN A 94 -7.850 -3.656 -7.873 1.00 0.00 H ATOM 574 H ASN A 94 -2.492 -3.809 -4.342 1.00 0.00 H ATOM 575 N PRO A 95 -1.866 -5.013 -7.119 1.00 11.04 N ATOM 576 CA PRO A 95 -0.711 -4.712 -7.957 1.00 11.56 C ATOM 577 C PRO A 95 -1.158 -4.439 -9.438 1.00 9.63 C ATOM 578 O PRO A 95 -0.399 -3.780 -10.166 1.00 12.31 O ATOM 579 CB PRO A 95 0.128 -6.033 -7.895 1.00 13.28 C ATOM 580 CG PRO A 95 -0.851 -7.085 -7.475 1.00 15.25 C ATOM 581 CD PRO A 95 -1.821 -6.406 -6.545 1.00 16.25 C ATOM 582 N SER A 96 -2.254 -4.992 -9.856 1.00 11.37 N ATOM 583 CA SER A 96 -2.728 -4.662 -11.226 1.00 13.15 C ATOM 584 C SER A 96 -3.040 -3.154 -11.359 1.00 11.81 C ATOM 585 O SER A 96 -2.676 -2.564 -12.375 1.00 12.46 O ATOM 586 CB SER A 96 -3.997 -5.496 -11.602 1.00 16.22 C ATOM 587 OG SER A 96 -4.422 -5.227 -12.870 1.00 14.73 O ATOM 588 HG SER A 96 -4.648 -4.266 -12.944 1.00 0.00 H ATOM 589 H SER A 96 -2.787 -5.648 -9.250 1.00 0.00 H ATOM 590 N ARG A 97 -3.789 -2.608 -10.400 1.00 12.64 N ATOM 591 CA ARG A 97 -4.108 -1.224 -10.427 1.00 12.09 C ATOM 592 C ARG A 97 -2.848 -0.358 -10.439 1.00 13.10 C ATOM 593 O ARG A 97 -2.749 0.640 -11.210 1.00 13.17 O ATOM 594 CB ARG A 97 -5.001 -0.816 -9.278 1.00 14.07 C ATOM 595 CG ARG A 97 -5.453 0.640 -9.343 1.00 17.07 C ATOM 596 CD ARG A 97 -6.271 0.993 -8.126 1.00 18.92 C ATOM 597 NE ARG A 97 -7.538 0.260 -8.166 1.00 20.62 N ATOM 598 CZ ARG A 97 -8.229 -0.129 -7.092 1.00 25.51 C ATOM 599 NH1 ARG A 97 -7.934 0.225 -5.883 1.00 31.21 N ATOM 600 NH2 ARG A 97 -9.345 -0.800 -7.216 1.00 32.12 N ATOM 601 HE ARG A 97 -7.929 0.025 -9.101 1.00 0.00 H ATOM 602 HH12 ARG A 97 -8.512 -0.112 -5.087 1.00 0.00 H ATOM 603 HH11 ARG A 97 -7.119 0.846 -5.707 1.00 0.00 H ATOM 604 HH22 ARG A 97 -9.871 -1.095 -6.369 1.00 0.00 H ATOM 605 HH21 ARG A 97 -9.706 -1.038 -8.162 1.00 0.00 H ATOM 606 H ARG A 97 -4.144 -3.202 -9.624 1.00 0.00 H ATOM 607 N VAL A 98 -1.920 -0.684 -9.530 1.00 10.70 N ATOM 608 CA VAL A 98 -0.674 0.113 -9.528 1.00 9.66 C ATOM 609 C VAL A 98 0.073 -0.036 -10.832 1.00 10.04 C ATOM 610 O VAL A 98 0.586 0.994 -11.301 1.00 10.30 O ATOM 611 CB VAL A 98 0.185 -0.243 -8.238 1.00 11.65 C ATOM 612 CG1 VAL A 98 1.516 0.383 -8.240 1.00 13.94 C ATOM 613 CG2 VAL A 98 -0.626 0.017 -6.978 1.00 13.07 C ATOM 614 H VAL A 98 -2.069 -1.462 -8.856 1.00 0.00 H ATOM 615 N TRP A 99 0.166 -1.218 -11.369 1.00 11.00 N ATOM 616 CA TRP A 99 0.815 -1.353 -12.679 1.00 9.59 C ATOM 617 C TRP A 99 0.052 -0.617 -13.782 1.00 9.94 C ATOM 618 O TRP A 99 0.717 -0.086 -14.704 1.00 11.74 O ATOM 619 CB TRP A 99 1.078 -2.820 -13.081 1.00 11.49 C ATOM 620 CG TRP A 99 2.412 -3.240 -12.731 1.00 11.58 C ATOM 621 CD1 TRP A 99 2.778 -4.296 -11.879 1.00 11.10 C ATOM 622 CD2 TRP A 99 3.641 -2.719 -13.181 1.00 8.81 C ATOM 623 NE1 TRP A 99 4.138 -4.398 -11.738 1.00 9.88 N ATOM 624 CE2 TRP A 99 4.699 -3.448 -12.599 1.00 10.43 C ATOM 625 CE3 TRP A 99 3.988 -1.708 -14.109 1.00 9.50 C ATOM 626 CZ2 TRP A 99 6.007 -3.191 -12.848 1.00 9.72 C ATOM 627 CZ3 TRP A 99 5.297 -1.439 -14.368 1.00 12.61 C ATOM 628 CH2 TRP A 99 6.309 -2.089 -13.689 1.00 12.50 C ATOM 629 HE1 TRP A 99 4.652 -5.053 -11.114 1.00 0.00 H ATOM 630 H TRP A 99 -0.213 -2.053 -10.878 1.00 0.00 H ATOM 631 N GLU A 100 -1.271 -0.559 -13.764 1.00 11.26 N ATOM 632 CA GLU A 100 -1.977 0.221 -14.765 1.00 12.00 C ATOM 633 C GLU A 100 -1.602 1.707 -14.682 1.00 12.86 C ATOM 634 O GLU A 100 -1.371 2.347 -15.724 1.00 11.80 O ATOM 635 CB GLU A 100 -3.480 0.185 -14.595 1.00 13.07 C ATOM 636 CG GLU A 100 -4.147 -1.112 -15.083 1.00 15.15 C ATOM 637 CD GLU A 100 -5.662 -0.834 -15.219 1.00 18.23 C ATOM 638 OE1 GLU A 100 -6.442 -1.112 -14.346 1.00 15.02 O ATOM 639 OE2 GLU A 100 -6.045 -0.434 -16.422 1.00 16.84 O ATOM 640 H GLU A 100 -1.804 -1.072 -13.033 1.00 0.00 H ATOM 641 N PHE A 101 -1.409 2.189 -13.458 1.00 10.48 N ATOM 642 CA PHE A 101 -1.029 3.584 -13.205 1.00 9.00 C ATOM 643 C PHE A 101 0.386 3.788 -13.775 1.00 10.88 C ATOM 644 O PHE A 101 0.663 4.806 -14.463 1.00 11.00 O ATOM 645 CB PHE A 101 -1.120 3.852 -11.677 1.00 9.96 C ATOM 646 CG PHE A 101 -0.527 5.153 -11.219 1.00 11.86 C ATOM 647 CD1 PHE A 101 -0.976 6.428 -11.588 1.00 15.05 C ATOM 648 CD2 PHE A 101 0.501 5.064 -10.305 1.00 13.57 C ATOM 649 CE1 PHE A 101 -0.489 7.554 -10.916 1.00 17.01 C ATOM 650 CE2 PHE A 101 0.995 6.223 -9.753 1.00 14.87 C ATOM 651 CZ PHE A 101 0.539 7.385 -10.037 1.00 15.53 C ATOM 652 H PHE A 101 -1.532 1.551 -12.646 1.00 0.00 H ATOM 653 N TYR A 102 1.360 2.970 -13.434 1.00 9.36 N ATOM 654 CA TYR A 102 2.683 3.113 -13.964 1.00 8.91 C ATOM 655 C TYR A 102 2.772 2.934 -15.493 1.00 10.39 C ATOM 656 O TYR A 102 3.574 3.638 -16.140 1.00 11.28 O ATOM 657 CB TYR A 102 3.761 2.272 -13.194 1.00 12.58 C ATOM 658 CG TYR A 102 4.072 2.914 -11.842 1.00 11.66 C ATOM 659 CD1 TYR A 102 4.998 3.896 -11.750 1.00 12.51 C ATOM 660 CD2 TYR A 102 3.443 2.512 -10.700 1.00 9.44 C ATOM 661 CE1 TYR A 102 5.272 4.530 -10.518 1.00 10.63 C ATOM 662 CE2 TYR A 102 3.689 3.115 -9.487 1.00 10.84 C ATOM 663 CZ TYR A 102 4.566 4.139 -9.378 1.00 12.64 C ATOM 664 OH TYR A 102 4.851 4.773 -8.181 1.00 13.74 O ATOM 665 HH TYR A 102 5.517 5.488 -8.338 1.00 0.00 H ATOM 666 H TYR A 102 1.164 2.200 -12.763 1.00 0.00 H ATOM 667 N HIS A 103 1.973 2.033 -15.983 1.00 10.43 N ATOM 668 CA HIS A 103 1.887 1.891 -17.445 1.00 10.87 C ATOM 669 C HIS A 103 1.474 3.155 -18.105 1.00 12.19 C ATOM 670 O HIS A 103 2.047 3.606 -19.122 1.00 12.73 O ATOM 671 CB HIS A 103 0.960 0.694 -17.781 1.00 11.95 C ATOM 672 CG HIS A 103 0.764 0.574 -19.232 1.00 11.50 C ATOM 673 ND1 HIS A 103 1.826 0.247 -20.064 1.00 13.74 N ATOM 674 CD2 HIS A 103 -0.326 0.657 -20.019 1.00 14.36 C ATOM 675 CE1 HIS A 103 1.328 0.270 -21.292 1.00 14.98 C ATOM 676 NE2 HIS A 103 0.038 0.458 -21.308 1.00 13.73 N ATOM 677 H HIS A 103 1.407 1.426 -15.356 1.00 0.00 H ATOM 678 N TYR A 104 0.425 3.751 -17.612 1.00 10.23 N ATOM 679 CA TYR A 104 -0.059 5.045 -18.142 1.00 12.42 C ATOM 680 C TYR A 104 1.068 6.043 -18.087 1.00 11.09 C ATOM 681 O TYR A 104 1.264 6.700 -19.146 1.00 10.86 O ATOM 682 CB TYR A 104 -1.199 5.549 -17.268 1.00 11.68 C ATOM 683 CG TYR A 104 -1.646 6.911 -17.614 1.00 13.63 C ATOM 684 CD1 TYR A 104 -2.318 7.152 -18.804 1.00 15.04 C ATOM 685 CD2 TYR A 104 -1.394 8.007 -16.825 1.00 15.00 C ATOM 686 CE1 TYR A 104 -2.767 8.414 -19.135 1.00 16.66 C ATOM 687 CE2 TYR A 104 -1.713 9.322 -17.171 1.00 22.22 C ATOM 688 CZ TYR A 104 -2.409 9.493 -18.344 1.00 18.96 C ATOM 689 OH TYR A 104 -2.752 10.771 -18.698 1.00 26.36 O ATOM 690 HH TYR A 104 -3.246 10.753 -19.556 1.00 0.00 H ATOM 691 H TYR A 104 -0.086 3.305 -16.824 1.00 0.00 H ATOM 692 N ARG A 105 1.792 6.184 -16.988 1.00 10.64 N ATOM 693 CA ARG A 105 2.856 7.197 -16.969 1.00 10.33 C ATOM 694 C ARG A 105 3.958 6.900 -17.983 1.00 11.46 C ATOM 695 O ARG A 105 4.502 7.810 -18.556 1.00 12.53 O ATOM 696 CB ARG A 105 3.305 7.249 -15.491 1.00 10.37 C ATOM 697 CG ARG A 105 2.276 7.733 -14.567 1.00 11.32 C ATOM 698 CD ARG A 105 2.685 7.594 -13.115 1.00 13.46 C ATOM 699 NE ARG A 105 3.641 8.545 -12.761 1.00 11.35 N ATOM 700 CZ ARG A 105 4.249 8.565 -11.568 1.00 12.35 C ATOM 701 NH1 ARG A 105 5.170 9.514 -11.279 1.00 13.77 N ATOM 702 NH2 ARG A 105 4.034 7.606 -10.650 1.00 15.05 N ATOM 703 HE ARG A 105 3.894 9.275 -13.458 1.00 0.00 H ATOM 704 HH12 ARG A 105 5.636 9.520 -10.349 1.00 0.00 H ATOM 705 HH11 ARG A 105 5.411 10.237 -11.987 1.00 0.00 H ATOM 706 HH22 ARG A 105 4.520 7.647 -9.731 1.00 0.00 H ATOM 707 HH21 ARG A 105 3.382 6.823 -10.859 1.00 0.00 H ATOM 708 H ARG A 105 1.611 5.589 -16.154 1.00 0.00 H ATOM 709 N ARG A 106 4.287 5.645 -18.134 1.00 12.30 N ATOM 710 CA ARG A 106 5.338 5.258 -19.143 1.00 12.36 C ATOM 711 C ARG A 106 4.840 5.685 -20.538 1.00 11.77 C ATOM 712 O ARG A 106 5.680 6.159 -21.376 1.00 14.43 O ATOM 713 CB ARG A 106 5.572 3.752 -19.137 1.00 13.14 C ATOM 714 CG ARG A 106 6.364 3.345 -17.904 1.00 14.79 C ATOM 715 CD ARG A 106 6.199 1.854 -17.493 1.00 15.88 C ATOM 716 NE ARG A 106 6.717 0.951 -18.614 1.00 12.52 N ATOM 717 CZ ARG A 106 7.971 0.565 -18.750 1.00 9.91 C ATOM 718 NH1 ARG A 106 8.895 0.887 -17.892 1.00 11.81 N ATOM 719 NH2 ARG A 106 8.251 -0.133 -19.911 1.00 11.17 N ATOM 720 HE ARG A 106 6.030 0.617 -19.320 1.00 0.00 H ATOM 721 HH12 ARG A 106 9.873 0.563 -18.035 1.00 0.00 H ATOM 722 HH11 ARG A 106 8.656 1.468 -17.064 1.00 0.00 H ATOM 723 HH22 ARG A 106 9.217 -0.472 -20.094 1.00 0.00 H ATOM 724 HH21 ARG A 106 7.496 -0.318 -20.601 1.00 0.00 H ATOM 725 H ARG A 106 3.824 4.913 -17.558 1.00 0.00 H ATOM 726 N GLU A 107 3.578 5.437 -20.765 1.00 14.81 N ATOM 727 CA GLU A 107 3.091 5.753 -22.103 1.00 15.56 C ATOM 728 C GLU A 107 3.015 7.254 -22.344 1.00 15.38 C ATOM 729 O GLU A 107 3.357 7.754 -23.444 1.00 15.97 O ATOM 730 CB GLU A 107 1.724 5.139 -22.353 1.00 17.38 C ATOM 731 CG GLU A 107 1.761 3.629 -22.540 1.00 20.34 C ATOM 732 CD GLU A 107 2.410 3.254 -23.839 1.00 20.90 C ATOM 733 OE1 GLU A 107 1.838 3.714 -24.856 1.00 30.94 O ATOM 734 OE2 GLU A 107 3.330 2.504 -23.889 1.00 31.74 O ATOM 735 H GLU A 107 2.956 5.037 -20.034 1.00 0.00 H ATOM 736 N VAL A 108 2.601 8.032 -21.321 1.00 13.33 N ATOM 737 CA VAL A 108 2.639 9.513 -21.375 1.00 14.75 C ATOM 738 C VAL A 108 4.039 9.954 -21.769 1.00 16.25 C ATOM 739 O VAL A 108 4.200 10.820 -22.632 1.00 16.03 O ATOM 740 CB VAL A 108 2.225 10.115 -20.002 1.00 13.90 C ATOM 741 CG1 VAL A 108 2.493 11.600 -19.942 1.00 14.60 C ATOM 742 CG2 VAL A 108 0.744 9.913 -19.750 1.00 19.39 C ATOM 743 H VAL A 108 2.241 7.573 -20.460 1.00 0.00 H ATOM 744 N MET A 109 5.052 9.384 -21.156 1.00 12.10 N ATOM 745 CA MET A 109 6.416 9.772 -21.423 1.00 13.13 C ATOM 746 C MET A 109 6.910 9.542 -22.819 1.00 14.79 C ATOM 747 O MET A 109 7.841 10.114 -23.289 1.00 15.31 O ATOM 748 CB MET A 109 7.341 9.222 -20.436 1.00 17.06 C ATOM 749 CG MET A 109 7.234 9.802 -18.994 1.00 11.96 C ATOM 750 SD MET A 109 7.352 11.563 -18.940 1.00 12.49 S ATOM 751 CE MET A 109 8.852 11.867 -19.708 1.00 12.96 C ATOM 752 H MET A 109 4.866 8.634 -20.460 1.00 0.00 H ATOM 753 N GLY A 110 6.306 8.624 -23.515 1.00 15.18 N ATOM 754 CA GLY A 110 6.743 8.251 -24.827 1.00 18.17 C ATOM 755 C GLY A 110 6.812 9.377 -25.820 1.00 24.18 C ATOM 756 O GLY A 110 7.631 9.372 -26.755 1.00 30.35 O ATOM 757 H GLY A 110 5.479 8.145 -23.105 1.00 0.00 H ATOM 758 N SER A 111 5.955 10.337 -25.687 1.00 21.73 N ATOM 759 CA SER A 111 5.981 11.448 -26.589 1.00 31.50 C ATOM 760 C SER A 111 6.742 12.701 -26.084 1.00 25.33 C ATOM 761 O SER A 111 6.755 13.729 -26.757 1.00 39.95 O ATOM 762 CB SER A 111 4.465 11.749 -26.977 1.00 31.84 C ATOM 763 OG SER A 111 3.640 11.928 -25.769 1.00 29.06 O ATOM 764 HG SER A 111 3.672 11.102 -25.224 1.00 0.00 H ATOM 765 H SER A 111 5.248 10.301 -24.925 1.00 0.00 H ATOM 766 N LYS A 112 7.364 12.672 -24.919 1.00 16.56 N ATOM 767 CA LYS A 112 7.777 13.873 -24.308 1.00 14.50 C ATOM 768 C LYS A 112 9.259 14.100 -24.561 1.00 16.26 C ATOM 769 O LYS A 112 10.116 13.164 -24.581 1.00 18.25 O ATOM 770 CB LYS A 112 7.558 13.852 -22.764 1.00 15.80 C ATOM 771 CG LYS A 112 6.110 13.579 -22.424 1.00 16.22 C ATOM 772 CD LYS A 112 5.190 14.637 -22.894 1.00 16.45 C ATOM 773 CE LYS A 112 3.779 14.380 -22.564 1.00 17.94 C ATOM 774 NZ LYS A 112 3.135 13.421 -23.364 1.00 23.66 N ATOM 775 HZ1 LYS A 112 3.153 13.731 -24.357 1.00 0.00 H ATOM 776 HZ2 LYS A 112 3.628 12.510 -23.275 1.00 0.00 H ATOM 777 HZ3 LYS A 112 2.149 13.315 -23.050 1.00 0.00 H ATOM 778 H LYS A 112 7.549 11.761 -24.452 1.00 0.00 H ATOM 779 N GLU A 113 9.622 15.372 -24.677 1.00 14.21 N ATOM 780 CA GLU A 113 10.983 15.766 -24.902 1.00 14.33 C ATOM 781 C GLU A 113 11.460 16.752 -23.882 1.00 11.62 C ATOM 782 O GLU A 113 10.687 17.481 -23.352 1.00 13.75 O ATOM 783 CB GLU A 113 11.109 16.366 -26.319 1.00 16.17 C ATOM 784 CG GLU A 113 10.729 15.459 -27.432 1.00 21.98 C ATOM 785 CD GLU A 113 11.801 14.413 -27.663 1.00 25.75 C ATOM 786 OE1 GLU A 113 12.876 14.418 -27.188 1.00 30.73 O ATOM 787 OE2 GLU A 113 11.614 13.515 -28.516 1.00 50.41 O ATOM 788 H GLU A 113 8.893 16.110 -24.602 1.00 0.00 H ATOM 789 N PRO A 114 12.826 16.819 -23.690 1.00 13.32 N ATOM 790 CA PRO A 114 13.344 17.878 -22.803 1.00 13.15 C ATOM 791 C PRO A 114 12.981 19.318 -23.263 1.00 13.26 C ATOM 792 O PRO A 114 12.818 19.542 -24.451 1.00 15.87 O ATOM 793 CB PRO A 114 14.839 17.656 -22.838 1.00 15.02 C ATOM 794 CG PRO A 114 15.067 16.369 -23.408 1.00 17.79 C ATOM 795 CD PRO A 114 13.909 15.991 -24.257 1.00 15.38 C ATOM 796 N ASN A 115 12.820 20.185 -22.329 1.00 11.24 N ATOM 797 CA ASN A 115 12.493 21.592 -22.603 1.00 12.79 C ATOM 798 C ASN A 115 13.768 22.433 -22.425 1.00 11.27 C ATOM 799 O ASN A 115 14.817 21.989 -22.115 1.00 11.98 O ATOM 800 CB ASN A 115 11.281 22.031 -21.819 1.00 13.98 C ATOM 801 CG ASN A 115 11.522 21.975 -20.322 1.00 13.60 C ATOM 802 OD1 ASN A 115 12.508 22.578 -19.910 1.00 15.45 O ATOM 803 ND2 ASN A 115 10.713 21.337 -19.560 1.00 12.69 N ATOM 804 HD22 ASN A 115 9.893 20.844 -19.968 1.00 0.00 H ATOM 805 HD21 ASN A 115 10.876 21.312 -18.533 1.00 0.00 H ATOM 806 H ASN A 115 12.925 19.880 -21.340 1.00 0.00 H ATOM 807 N ALA A 116 13.629 23.733 -22.673 1.00 11.42 N ATOM 808 CA ALA A 116 14.756 24.702 -22.571 1.00 11.50 C ATOM 809 C ALA A 116 15.307 24.726 -21.170 1.00 11.40 C ATOM 810 O ALA A 116 16.571 25.003 -21.118 1.00 14.15 O ATOM 811 CB ALA A 116 14.344 26.083 -23.030 1.00 17.06 C ATOM 812 H ALA A 116 12.692 24.088 -22.950 1.00 0.00 H ATOM 813 N GLY A 117 14.540 24.421 -20.152 1.00 12.84 N ATOM 814 CA GLY A 117 15.152 24.412 -18.851 1.00 14.79 C ATOM 815 C GLY A 117 16.085 23.166 -18.679 1.00 10.31 C ATOM 816 O GLY A 117 17.212 23.298 -18.205 1.00 12.18 O ATOM 817 H GLY A 117 13.533 24.195 -20.280 1.00 0.00 H ATOM 818 N HIS A 118 15.623 21.963 -19.087 1.00 10.39 N ATOM 819 CA HIS A 118 16.480 20.809 -19.056 1.00 11.53 C ATOM 820 C HIS A 118 17.740 21.059 -19.865 1.00 11.76 C ATOM 821 O HIS A 118 18.876 20.673 -19.525 1.00 11.89 O ATOM 822 CB HIS A 118 15.836 19.499 -19.586 1.00 11.68 C ATOM 823 CG HIS A 118 14.582 19.056 -18.936 1.00 11.31 C ATOM 824 ND1 HIS A 118 13.387 19.181 -19.589 1.00 9.31 N ATOM 825 CD2 HIS A 118 14.367 18.380 -17.737 1.00 12.24 C ATOM 826 CE1 HIS A 118 12.473 18.639 -18.811 1.00 11.05 C ATOM 827 NE2 HIS A 118 13.066 18.107 -17.705 1.00 11.28 N ATOM 828 H HIS A 118 14.644 21.872 -19.425 1.00 0.00 H ATOM 829 N ARG A 119 17.518 21.647 -21.067 1.00 11.38 N ATOM 830 CA ARG A 119 18.687 21.866 -21.934 1.00 16.97 C ATOM 831 C ARG A 119 19.706 22.836 -21.355 1.00 12.23 C ATOM 832 O ARG A 119 20.908 22.663 -21.457 1.00 13.97 O ATOM 833 CB ARG A 119 18.231 22.352 -23.317 1.00 16.37 C ATOM 834 CG ARG A 119 17.463 21.229 -24.105 1.00 20.77 C ATOM 835 CD ARG A 119 17.396 21.528 -25.630 1.00 26.45 C ATOM 836 NE ARG A 119 16.802 22.860 -25.867 1.00 33.40 N ATOM 837 CZ ARG A 119 15.471 23.109 -25.952 1.00 27.15 C ATOM 838 NH1 ARG A 119 14.589 22.070 -25.891 1.00 36.02 N ATOM 839 NH2 ARG A 119 14.992 24.304 -26.183 1.00 34.64 N ATOM 840 HE ARG A 119 17.451 23.665 -25.977 1.00 0.00 H ATOM 841 HH12 ARG A 119 13.567 22.251 -25.955 1.00 0.00 H ATOM 842 HH11 ARG A 119 14.939 21.097 -25.780 1.00 0.00 H ATOM 843 HH22 ARG A 119 13.964 24.450 -26.240 1.00 0.00 H ATOM 844 HH21 ARG A 119 15.639 25.108 -26.309 1.00 0.00 H ATOM 845 H ARG A 119 16.562 21.931 -21.363 1.00 0.00 H ATOM 846 N ALA A 120 19.215 23.921 -20.744 1.00 13.05 N ATOM 847 CA ALA A 120 20.147 24.906 -20.111 1.00 12.86 C ATOM 848 C ALA A 120 20.965 24.232 -19.008 1.00 14.19 C ATOM 849 O ALA A 120 22.165 24.488 -18.912 1.00 14.73 O ATOM 850 CB ALA A 120 19.358 26.087 -19.514 1.00 15.67 C ATOM 851 H ALA A 120 18.188 24.079 -20.709 1.00 0.00 H ATOM 852 N ILE A 121 20.303 23.341 -18.232 1.00 13.52 N ATOM 853 CA ILE A 121 21.013 22.659 -17.189 1.00 12.62 C ATOM 854 C ILE A 121 22.143 21.745 -17.747 1.00 12.27 C ATOM 855 O ILE A 121 23.259 21.682 -17.193 1.00 12.78 O ATOM 856 CB ILE A 121 19.978 21.871 -16.317 1.00 11.48 C ATOM 857 CG1 ILE A 121 19.148 22.877 -15.494 1.00 11.88 C ATOM 858 CG2 ILE A 121 20.694 20.851 -15.444 1.00 12.27 C ATOM 859 CD1 ILE A 121 17.970 22.245 -14.876 1.00 12.49 C ATOM 860 H ILE A 121 19.292 23.154 -18.390 1.00 0.00 H ATOM 861 N ALA A 122 21.752 21.004 -18.805 1.00 13.11 N ATOM 862 CA ALA A 122 22.726 20.124 -19.449 1.00 13.30 C ATOM 863 C ALA A 122 23.919 20.864 -20.090 1.00 13.66 C ATOM 864 O ALA A 122 25.113 20.486 -19.929 1.00 15.64 O ATOM 865 CB ALA A 122 22.082 19.181 -20.473 1.00 17.51 C ATOM 866 H ALA A 122 20.775 21.058 -19.156 1.00 0.00 H ATOM 867 N GLU A 123 23.580 21.958 -20.786 1.00 15.16 N ATOM 868 CA GLU A 123 24.630 22.714 -21.417 1.00 14.54 C ATOM 869 C GLU A 123 25.545 23.373 -20.364 1.00 14.42 C ATOM 870 O GLU A 123 26.756 23.507 -20.614 1.00 17.85 O ATOM 871 CB GLU A 123 24.011 23.801 -22.313 1.00 17.80 C ATOM 872 CG GLU A 123 23.335 23.121 -23.533 1.00 25.91 C ATOM 873 CD GLU A 123 22.372 24.096 -24.277 1.00 27.43 C ATOM 874 OE1 GLU A 123 22.359 25.361 -24.048 1.00 36.57 O ATOM 875 OE2 GLU A 123 21.555 23.673 -25.124 1.00 33.10 O ATOM 876 H GLU A 123 22.586 22.253 -20.868 1.00 0.00 H ATOM 877 N CYS A 124 24.966 23.847 -19.251 1.00 15.39 N ATOM 878 CA CYS A 124 25.745 24.375 -18.196 1.00 15.59 C ATOM 879 C CYS A 124 26.755 23.425 -17.669 1.00 14.21 C ATOM 880 O CYS A 124 27.940 23.774 -17.497 1.00 15.18 O ATOM 881 CB CYS A 124 24.804 24.933 -17.162 1.00 19.01 C ATOM 882 SG CYS A 124 25.680 25.598 -15.677 1.00 18.74 S ATOM 883 H CYS A 124 23.930 23.826 -19.163 1.00 0.00 H ATOM 884 N GLU A 125 26.310 22.207 -17.419 1.00 15.24 N ATOM 885 CA GLU A 125 27.254 21.205 -16.938 1.00 15.54 C ATOM 886 C GLU A 125 28.409 20.959 -17.923 1.00 13.94 C ATOM 887 O GLU A 125 29.603 20.921 -17.484 1.00 16.41 O ATOM 888 CB GLU A 125 26.541 19.855 -16.697 1.00 14.72 C ATOM 889 CG GLU A 125 27.437 18.686 -16.353 1.00 14.65 C ATOM 890 CD GLU A 125 26.675 17.403 -16.218 1.00 16.13 C ATOM 891 OE1 GLU A 125 25.435 17.329 -16.406 1.00 21.22 O ATOM 892 OE2 GLU A 125 27.372 16.369 -15.953 1.00 18.82 O ATOM 893 H GLU A 125 25.308 21.968 -17.562 1.00 0.00 H ATOM 894 N THR A 126 28.109 20.906 -19.214 1.00 17.02 N ATOM 895 CA THR A 126 29.176 20.639 -20.201 1.00 19.02 C ATOM 896 C THR A 126 30.145 21.800 -20.243 1.00 19.68 C ATOM 897 O THR A 126 31.386 21.605 -20.220 1.00 22.23 O ATOM 898 CB THR A 126 28.556 20.432 -21.576 1.00 21.39 C ATOM 899 OG1 THR A 126 27.694 19.301 -21.533 1.00 22.93 O ATOM 900 CG2 THR A 126 29.640 20.251 -22.648 1.00 22.47 C ATOM 901 HG1 THR A 126 26.980 19.457 -20.865 1.00 0.00 H ATOM 902 H THR A 126 27.129 21.051 -19.530 1.00 0.00 H ATOM 903 N ARG A 127 29.597 23.032 -20.317 1.00 20.14 N ATOM 904 CA ARG A 127 30.454 24.222 -20.414 1.00 18.98 C ATOM 905 C ARG A 127 31.341 24.383 -19.186 1.00 19.85 C ATOM 906 O ARG A 127 32.561 24.625 -19.290 1.00 23.07 O ATOM 907 CB ARG A 127 29.591 25.415 -20.650 1.00 22.53 C ATOM 908 CG ARG A 127 30.288 26.726 -20.983 1.00 28.47 C ATOM 909 CD ARG A 127 29.280 27.812 -21.322 1.00 27.82 C ATOM 910 NE ARG A 127 28.740 28.232 -20.027 1.00 34.17 N ATOM 911 CZ ARG A 127 27.484 28.079 -19.601 1.00 31.22 C ATOM 912 NH1 ARG A 127 26.570 27.532 -20.450 1.00 28.80 N ATOM 913 NH2 ARG A 127 27.162 28.504 -18.355 1.00 34.38 N ATOM 914 HE ARG A 127 29.402 28.696 -19.373 1.00 0.00 H ATOM 915 HH12 ARG A 127 25.585 27.403 -20.141 1.00 0.00 H ATOM 916 HH11 ARG A 127 26.857 27.244 -21.407 1.00 0.00 H ATOM 917 HH22 ARG A 127 26.189 28.394 -18.003 1.00 0.00 H ATOM 918 HH21 ARG A 127 27.887 28.940 -17.751 1.00 0.00 H ATOM 919 H ARG A 127 28.563 23.139 -20.305 1.00 0.00 H ATOM 920 N LEU A 128 30.757 24.301 -18.006 1.00 20.71 N ATOM 921 CA LEU A 128 31.529 24.447 -16.815 1.00 21.57 C ATOM 922 C LEU A 128 32.544 23.319 -16.611 1.00 22.58 C ATOM 923 O LEU A 128 33.665 23.543 -16.105 1.00 18.58 O ATOM 924 CB LEU A 128 30.647 24.549 -15.542 1.00 18.27 C ATOM 925 CG LEU A 128 30.340 26.005 -15.159 1.00 21.69 C ATOM 926 CD1 LEU A 128 29.710 26.786 -16.256 1.00 21.79 C ATOM 927 CD2 LEU A 128 29.446 26.144 -13.951 1.00 18.19 C ATOM 928 H LEU A 128 29.733 24.130 -17.944 1.00 0.00 H ATOM 929 N GLY A 129 32.185 22.125 -17.016 1.00 20.15 N ATOM 930 CA GLY A 129 33.074 20.992 -16.936 1.00 22.40 C ATOM 931 C GLY A 129 34.331 21.222 -17.717 1.00 20.00 C ATOM 932 O GLY A 129 35.456 20.836 -17.248 1.00 25.69 O ATOM 933 H GLY A 129 31.231 21.991 -17.407 1.00 0.00 H ATOM 934 N LYS A 130 34.231 21.859 -18.893 1.00 25.87 N ATOM 935 CA LYS A 130 35.467 22.177 -19.663 1.00 24.84 C ATOM 936 C LYS A 130 36.387 23.133 -18.937 1.00 24.63 C ATOM 937 O LYS A 130 37.584 23.180 -19.265 1.00 31.30 O ATOM 938 CB LYS A 130 35.066 22.726 -21.034 1.00 30.25 C ATOM 939 CG LYS A 130 34.464 21.606 -21.894 1.00 33.50 C ATOM 940 CD LYS A 130 33.941 22.200 -23.227 1.00 45.18 C ATOM 941 CE LYS A 130 33.210 21.192 -24.128 1.00 50.38 C ATOM 942 NZ LYS A 130 32.826 21.914 -25.380 1.00 55.43 N ATOM 943 HZ1 LYS A 130 32.202 22.711 -25.142 1.00 0.00 H ATOM 944 HZ2 LYS A 130 33.683 22.271 -25.850 1.00 0.00 H ATOM 945 HZ3 LYS A 130 32.327 21.260 -26.017 1.00 0.00 H ATOM 946 H LYS A 130 33.298 22.129 -19.265 1.00 0.00 H ATOM 947 N GLN A 131 35.822 23.919 -17.980 1.00 28.79 N ATOM 948 CA GLN A 131 36.596 24.901 -17.168 1.00 22.80 C ATOM 949 C GLN A 131 37.092 24.241 -15.813 1.00 23.93 C ATOM 950 O GLN A 131 37.527 24.988 -14.912 1.00 27.93 O ATOM 951 CB GLN A 131 35.729 26.105 -16.800 1.00 21.76 C ATOM 952 CG GLN A 131 35.175 26.823 -18.001 1.00 27.73 C ATOM 953 CD GLN A 131 34.100 27.815 -17.709 1.00 34.23 C ATOM 954 OE1 GLN A 131 33.900 28.190 -16.590 1.00 36.01 O ATOM 955 NE2 GLN A 131 33.337 28.169 -18.754 1.00 42.48 N ATOM 956 HE22 GLN A 131 33.559 27.811 -19.705 1.00 0.00 H ATOM 957 HE21 GLN A 131 32.523 28.801 -18.613 1.00 0.00 H ATOM 958 H GLN A 131 34.800 23.830 -17.807 1.00 0.00 H ATOM 959 N GLY A 132 36.743 22.967 -15.561 1.00 21.31 N ATOM 960 CA GLY A 132 37.076 22.301 -14.322 1.00 21.90 C ATOM 961 C GLY A 132 36.095 22.594 -13.189 1.00 26.90 C ATOM 962 O GLY A 132 36.415 22.318 -12.066 1.00 22.85 O ATOM 963 H GLY A 132 36.213 22.441 -16.285 1.00 0.00 H ATOM 964 N ARG A 133 34.878 23.055 -13.518 1.00 19.76 N ATOM 965 CA ARG A 133 33.895 23.436 -12.527 1.00 21.69 C ATOM 966 C ARG A 133 32.756 22.351 -12.592 1.00 18.85 C ATOM 967 O ARG A 133 32.358 21.965 -13.682 1.00 19.62 O ATOM 968 CB ARG A 133 33.318 24.811 -12.854 1.00 21.62 C ATOM 969 CG ARG A 133 34.387 25.891 -12.682 1.00 23.50 C ATOM 970 CD ARG A 133 33.981 27.110 -13.586 1.00 24.18 C ATOM 971 NE ARG A 133 32.941 27.781 -12.857 1.00 25.74 N ATOM 972 CZ ARG A 133 32.103 28.728 -13.315 1.00 18.73 C ATOM 973 NH1 ARG A 133 32.183 29.190 -14.561 1.00 24.93 N ATOM 974 NH2 ARG A 133 31.223 29.189 -12.458 1.00 24.76 N ATOM 975 HE ARG A 133 32.823 27.503 -11.862 1.00 0.00 H ATOM 976 HH12 ARG A 133 31.521 29.923 -14.887 1.00 0.00 H ATOM 977 HH11 ARG A 133 32.907 28.818 -15.208 1.00 0.00 H ATOM 978 HH22 ARG A 133 30.547 29.923 -12.751 1.00 0.00 H ATOM 979 HH21 ARG A 133 31.202 28.821 -11.486 1.00 0.00 H ATOM 980 H ARG A 133 34.632 23.142 -14.525 1.00 0.00 H ATOM 981 N ARG A 134 32.321 21.916 -11.417 1.00 15.37 N ATOM 982 CA ARG A 134 31.369 20.853 -11.309 1.00 14.63 C ATOM 983 C ARG A 134 29.921 21.304 -11.184 1.00 11.16 C ATOM 984 O ARG A 134 29.626 22.140 -10.401 1.00 15.33 O ATOM 985 CB ARG A 134 31.724 19.958 -10.143 1.00 16.83 C ATOM 986 CG ARG A 134 30.775 18.720 -9.925 1.00 17.16 C ATOM 987 CD ARG A 134 31.368 17.879 -8.801 1.00 16.64 C ATOM 988 NE ARG A 134 30.532 16.732 -8.443 1.00 18.53 N ATOM 989 CZ ARG A 134 30.472 15.566 -9.067 1.00 14.77 C ATOM 990 NH1 ARG A 134 31.079 15.378 -10.235 1.00 18.75 N ATOM 991 NH2 ARG A 134 29.780 14.629 -8.549 1.00 16.71 N ATOM 992 HE ARG A 134 29.920 16.845 -7.610 1.00 0.00 H ATOM 993 HH12 ARG A 134 31.020 14.454 -10.709 1.00 0.00 H ATOM 994 HH11 ARG A 134 31.613 16.155 -10.674 1.00 0.00 H ATOM 995 HH22 ARG A 134 29.719 13.705 -9.022 1.00 0.00 H ATOM 996 HH21 ARG A 134 29.276 14.789 -7.653 1.00 0.00 H ATOM 997 H ARG A 134 32.682 22.360 -10.549 1.00 0.00 H ATOM 998 N VAL A 135 29.058 20.705 -11.985 1.00 13.21 N ATOM 999 CA VAL A 135 27.596 20.848 -11.855 1.00 11.82 C ATOM 1000 C VAL A 135 26.971 19.443 -11.757 1.00 14.48 C ATOM 1001 O VAL A 135 27.350 18.533 -12.530 1.00 14.44 O ATOM 1002 CB VAL A 135 27.037 21.493 -13.171 1.00 14.16 C ATOM 1003 CG1 VAL A 135 25.493 21.665 -13.085 1.00 16.68 C ATOM 1004 CG2 VAL A 135 27.652 22.872 -13.432 1.00 16.15 C ATOM 1005 H VAL A 135 29.429 20.101 -12.747 1.00 0.00 H ATOM 1006 N VAL A 136 26.133 19.336 -10.746 1.00 12.36 N ATOM 1007 CA VAL A 136 25.491 18.039 -10.474 1.00 10.95 C ATOM 1008 C VAL A 136 23.996 18.289 -10.335 1.00 11.00 C ATOM 1009 O VAL A 136 23.586 19.283 -9.786 1.00 13.24 O ATOM 1010 CB VAL A 136 26.033 17.307 -9.201 1.00 14.29 C ATOM 1011 CG1 VAL A 136 25.823 18.022 -7.897 1.00 11.64 C ATOM 1012 CG2 VAL A 136 25.535 15.885 -9.070 1.00 16.65 C ATOM 1013 H VAL A 136 25.927 20.160 -10.146 1.00 0.00 H ATOM 1014 N VAL A 137 23.164 17.412 -10.920 1.00 11.11 N ATOM 1015 CA VAL A 137 21.698 17.504 -10.818 1.00 10.67 C ATOM 1016 C VAL A 137 21.175 16.373 -9.875 1.00 8.92 C ATOM 1017 O VAL A 137 21.480 15.174 -10.167 1.00 11.95 O ATOM 1018 CB VAL A 137 21.074 17.386 -12.223 1.00 10.44 C ATOM 1019 CG1 VAL A 137 19.604 17.399 -12.105 1.00 11.23 C ATOM 1020 CG2 VAL A 137 21.634 18.465 -13.103 1.00 13.57 C ATOM 1021 H VAL A 137 23.574 16.631 -11.471 1.00 0.00 H ATOM 1022 N ILE A 138 20.508 16.783 -8.842 1.00 8.90 N ATOM 1023 CA ILE A 138 19.852 15.883 -7.936 1.00 11.01 C ATOM 1024 C ILE A 138 18.411 15.979 -8.108 1.00 9.00 C ATOM 1025 O ILE A 138 17.769 16.977 -7.844 1.00 9.88 O ATOM 1026 CB ILE A 138 20.194 16.233 -6.532 1.00 10.47 C ATOM 1027 CG1 ILE A 138 21.643 16.213 -6.261 1.00 11.50 C ATOM 1028 CG2 ILE A 138 19.467 15.296 -5.501 1.00 10.32 C ATOM 1029 CD1 ILE A 138 22.105 16.537 -4.922 1.00 11.30 C ATOM 1030 H ILE A 138 20.445 17.805 -8.662 1.00 0.00 H ATOM 1031 N THR A 139 17.791 15.046 -8.871 1.00 7.60 N ATOM 1032 CA THR A 139 16.426 15.099 -9.287 1.00 6.91 C ATOM 1033 C THR A 139 15.495 14.148 -8.458 1.00 6.81 C ATOM 1034 O THR A 139 15.857 12.953 -8.284 1.00 9.37 O ATOM 1035 CB THR A 139 16.129 14.935 -10.815 1.00 9.05 C ATOM 1036 OG1 THR A 139 14.826 15.287 -11.110 1.00 10.10 O ATOM 1037 CG2 THR A 139 16.410 13.537 -11.224 1.00 8.25 C ATOM 1038 HG1 THR A 139 14.676 16.232 -10.858 1.00 0.00 H ATOM 1039 H THR A 139 18.354 14.227 -9.178 1.00 0.00 H ATOM 1040 N GLN A 140 14.309 14.623 -8.085 1.00 8.96 N ATOM 1041 CA GLN A 140 13.184 13.854 -7.582 1.00 8.80 C ATOM 1042 C GLN A 140 12.446 13.220 -8.705 1.00 8.43 C ATOM 1043 O GLN A 140 11.625 12.327 -8.440 1.00 10.20 O ATOM 1044 CB GLN A 140 12.258 14.831 -6.819 1.00 9.39 C ATOM 1045 CG GLN A 140 12.936 15.443 -5.613 1.00 11.60 C ATOM 1046 CD GLN A 140 12.087 16.533 -5.105 1.00 11.51 C ATOM 1047 OE1 GLN A 140 11.185 16.346 -4.280 1.00 12.17 O ATOM 1048 NE2 GLN A 140 12.429 17.759 -5.467 1.00 13.74 N ATOM 1049 HE22 GLN A 140 13.189 17.903 -6.162 1.00 0.00 H ATOM 1050 HE21 GLN A 140 11.937 18.579 -5.057 1.00 0.00 H ATOM 1051 H GLN A 140 14.174 15.651 -8.162 1.00 0.00 H ATOM 1052 N ASN A 141 12.659 13.615 -9.940 1.00 7.71 N ATOM 1053 CA ASN A 141 11.878 13.178 -11.034 1.00 9.10 C ATOM 1054 C ASN A 141 12.194 11.772 -11.446 1.00 9.75 C ATOM 1055 O ASN A 141 13.383 11.453 -11.467 1.00 8.13 O ATOM 1056 CB ASN A 141 11.931 14.069 -12.237 1.00 9.29 C ATOM 1057 CG ASN A 141 11.516 15.517 -11.932 1.00 9.83 C ATOM 1058 OD1 ASN A 141 10.905 15.765 -10.927 1.00 12.10 O ATOM 1059 ND2 ASN A 141 12.044 16.466 -12.771 1.00 11.78 N ATOM 1060 HD22 ASN A 141 12.562 16.175 -13.625 1.00 0.00 H ATOM 1061 HD21 ASN A 141 11.926 17.476 -12.553 1.00 0.00 H ATOM 1062 H ASN A 141 13.438 14.280 -10.121 1.00 0.00 H ATOM 1063 N ILE A 142 11.298 10.950 -11.911 1.00 10.23 N ATOM 1064 CA ILE A 142 11.491 9.641 -12.467 1.00 10.06 C ATOM 1065 C ILE A 142 11.388 9.531 -13.989 1.00 10.71 C ATOM 1066 O ILE A 142 11.341 8.497 -14.532 1.00 11.41 O ATOM 1067 CB ILE A 142 10.550 8.665 -11.769 1.00 9.99 C ATOM 1068 CG1 ILE A 142 9.104 8.808 -12.046 1.00 11.40 C ATOM 1069 CG2 ILE A 142 10.869 8.711 -10.274 1.00 8.81 C ATOM 1070 CD1 ILE A 142 8.210 7.666 -11.589 1.00 12.91 C ATOM 1071 H ILE A 142 10.314 11.286 -11.875 1.00 0.00 H ATOM 1072 N ASP A 143 11.322 10.762 -14.601 1.00 9.57 N ATOM 1073 CA ASP A 143 10.934 10.893 -16.012 1.00 10.45 C ATOM 1074 C ASP A 143 12.085 10.794 -16.989 1.00 9.07 C ATOM 1075 O ASP A 143 11.805 10.720 -18.193 1.00 10.88 O ATOM 1076 CB ASP A 143 10.147 12.169 -16.227 1.00 10.09 C ATOM 1077 CG ASP A 143 10.905 13.462 -15.997 1.00 11.09 C ATOM 1078 OD1 ASP A 143 12.132 13.495 -16.146 1.00 10.88 O ATOM 1079 OD2 ASP A 143 10.163 14.476 -15.726 1.00 13.34 O ATOM 1080 H ASP A 143 11.551 11.616 -14.054 1.00 0.00 H ATOM 1081 N GLU A 144 13.330 10.737 -16.520 1.00 9.77 N ATOM 1082 CA GLU A 144 14.476 10.617 -17.345 1.00 11.59 C ATOM 1083 C GLU A 144 14.793 11.769 -18.310 1.00 11.40 C ATOM 1084 O GLU A 144 15.666 11.700 -19.142 1.00 11.32 O ATOM 1085 CB GLU A 144 14.583 9.235 -18.014 1.00 11.04 C ATOM 1086 CG GLU A 144 14.695 8.090 -17.076 1.00 11.74 C ATOM 1087 CD GLU A 144 15.291 6.819 -17.663 1.00 11.60 C ATOM 1088 OE1 GLU A 144 15.439 5.814 -16.953 1.00 13.89 O ATOM 1089 OE2 GLU A 144 15.462 6.752 -18.928 1.00 14.91 O ATOM 1090 H GLU A 144 13.469 10.783 -15.490 1.00 0.00 H ATOM 1091 N LEU A 145 14.011 12.852 -18.257 1.00 10.57 N ATOM 1092 CA LEU A 145 14.221 13.988 -19.193 1.00 9.50 C ATOM 1093 C LEU A 145 15.576 14.644 -19.003 1.00 9.97 C ATOM 1094 O LEU A 145 16.101 15.121 -19.968 1.00 10.91 O ATOM 1095 CB LEU A 145 13.072 14.904 -19.217 1.00 10.10 C ATOM 1096 CG LEU A 145 11.767 14.423 -19.812 1.00 11.51 C ATOM 1097 CD1 LEU A 145 10.671 15.447 -19.737 1.00 12.52 C ATOM 1098 CD2 LEU A 145 11.920 14.007 -21.277 1.00 13.97 C ATOM 1099 H LEU A 145 13.247 12.900 -17.553 1.00 0.00 H ATOM 1100 N HIS A 146 16.096 14.709 -17.753 1.00 10.50 N ATOM 1101 CA HIS A 146 17.464 15.211 -17.649 1.00 10.71 C ATOM 1102 C HIS A 146 18.484 14.384 -18.444 1.00 12.37 C ATOM 1103 O HIS A 146 19.416 14.899 -18.969 1.00 13.38 O ATOM 1104 CB HIS A 146 17.912 15.349 -16.158 1.00 11.28 C ATOM 1105 CG HIS A 146 17.218 16.386 -15.371 1.00 12.48 C ATOM 1106 ND1 HIS A 146 17.465 17.730 -15.600 1.00 11.24 N ATOM 1107 CD2 HIS A 146 16.486 16.353 -14.203 1.00 10.59 C ATOM 1108 CE1 HIS A 146 16.829 18.427 -14.655 1.00 13.41 C ATOM 1109 NE2 HIS A 146 16.230 17.667 -13.800 1.00 11.31 N ATOM 1110 H HIS A 146 15.552 14.418 -16.916 1.00 0.00 H ATOM 1111 N ARG A 147 18.300 13.051 -18.394 1.00 13.43 N ATOM 1112 CA ARG A 147 19.104 12.173 -19.167 1.00 15.97 C ATOM 1113 C ARG A 147 18.997 12.468 -20.678 1.00 14.50 C ATOM 1114 O ARG A 147 19.982 12.550 -21.415 1.00 16.02 O ATOM 1115 CB ARG A 147 18.817 10.672 -18.930 1.00 19.72 C ATOM 1116 CG ARG A 147 18.873 10.023 -17.538 1.00 30.75 C ATOM 1117 CD ARG A 147 19.298 8.411 -17.443 1.00 41.29 C ATOM 1118 NE ARG A 147 20.682 8.673 -17.042 1.00 46.39 N ATOM 1119 CZ ARG A 147 21.251 8.589 -15.782 1.00 38.56 C ATOM 1120 NH1 ARG A 147 20.581 8.238 -14.723 1.00 38.99 N ATOM 1121 NH2 ARG A 147 22.479 9.021 -15.568 1.00 45.11 N ATOM 1122 HE ARG A 147 21.325 8.961 -17.807 1.00 0.00 H ATOM 1123 HH12 ARG A 147 21.056 8.191 -13.799 1.00 0.00 H ATOM 1124 HH11 ARG A 147 19.570 8.005 -14.801 1.00 0.00 H ATOM 1125 HH22 ARG A 147 22.896 8.953 -14.618 1.00 0.00 H ATOM 1126 HH21 ARG A 147 23.030 9.430 -16.350 1.00 0.00 H ATOM 1127 H ARG A 147 17.558 12.659 -17.780 1.00 0.00 H ATOM 1128 N LYS A 148 17.764 12.601 -21.137 1.00 14.89 N ATOM 1129 CA LYS A 148 17.525 12.830 -22.552 1.00 13.21 C ATOM 1130 C LYS A 148 18.139 14.178 -23.019 1.00 13.90 C ATOM 1131 O LYS A 148 18.493 14.332 -24.179 1.00 16.30 O ATOM 1132 CB LYS A 148 16.065 12.736 -22.817 1.00 15.32 C ATOM 1133 CG LYS A 148 15.465 11.405 -22.855 1.00 24.73 C ATOM 1134 CD LYS A 148 15.794 10.454 -24.053 1.00 31.74 C ATOM 1135 CE LYS A 148 14.452 9.913 -24.564 1.00 45.65 C ATOM 1136 NZ LYS A 148 13.999 10.640 -25.746 1.00 42.14 N ATOM 1137 HZ1 LYS A 148 13.881 11.646 -25.509 1.00 0.00 H ATOM 1138 HZ2 LYS A 148 14.705 10.542 -26.504 1.00 0.00 H ATOM 1139 HZ3 LYS A 148 13.090 10.249 -26.065 1.00 0.00 H ATOM 1140 H LYS A 148 16.960 12.541 -20.481 1.00 0.00 H ATOM 1141 N ALA A 149 18.204 15.146 -22.085 1.00 13.11 N ATOM 1142 CA ALA A 149 18.809 16.426 -22.405 1.00 13.51 C ATOM 1143 C ALA A 149 20.313 16.408 -22.468 1.00 13.94 C ATOM 1144 O ALA A 149 20.938 17.392 -22.920 1.00 18.35 O ATOM 1145 CB ALA A 149 18.314 17.444 -21.372 1.00 15.22 C ATOM 1146 H ALA A 149 17.820 14.976 -21.133 1.00 0.00 H ATOM 1147 N GLY A 150 20.935 15.360 -21.913 1.00 14.08 N ATOM 1148 CA GLY A 150 22.339 15.265 -21.895 1.00 14.06 C ATOM 1149 C GLY A 150 23.101 15.554 -20.581 1.00 13.88 C ATOM 1150 O GLY A 150 24.352 15.610 -20.565 1.00 19.31 O ATOM 1151 H GLY A 150 20.368 14.600 -21.486 1.00 0.00 H ATOM 1152 N THR A 151 22.355 15.653 -19.504 1.00 13.02 N ATOM 1153 CA THR A 151 23.007 15.726 -18.184 1.00 13.04 C ATOM 1154 C THR A 151 23.778 14.440 -17.911 1.00 11.77 C ATOM 1155 O THR A 151 23.189 13.397 -18.174 1.00 17.70 O ATOM 1156 CB THR A 151 21.951 15.942 -17.153 1.00 10.78 C ATOM 1157 OG1 THR A 151 21.420 17.257 -17.265 1.00 12.74 O ATOM 1158 CG2 THR A 151 22.495 15.847 -15.726 1.00 12.37 C ATOM 1159 HG1 THR A 151 22.146 17.917 -17.131 1.00 0.00 H ATOM 1160 H THR A 151 21.318 15.680 -19.582 1.00 0.00 H ATOM 1161 N LYS A 152 24.995 14.502 -17.416 1.00 13.56 N ATOM 1162 CA LYS A 152 25.792 13.362 -17.135 1.00 12.58 C ATOM 1163 C LYS A 152 25.771 13.150 -15.610 1.00 11.55 C ATOM 1164 O LYS A 152 25.618 11.950 -15.125 1.00 14.62 O ATOM 1165 CB LYS A 152 27.180 13.445 -17.685 1.00 16.39 C ATOM 1166 CG LYS A 152 27.242 13.647 -19.184 1.00 23.15 C ATOM 1167 CD LYS A 152 28.683 13.923 -19.621 1.00 30.47 C ATOM 1168 CE LYS A 152 28.654 14.769 -20.959 1.00 40.05 C ATOM 1169 NZ LYS A 152 28.620 16.333 -20.778 1.00 39.18 N ATOM 1170 HZ1 LYS A 152 27.768 16.601 -20.245 1.00 0.00 H ATOM 1171 HZ2 LYS A 152 29.467 16.639 -20.257 1.00 0.00 H ATOM 1172 HZ3 LYS A 152 28.603 16.789 -21.713 1.00 0.00 H ATOM 1173 H LYS A 152 25.396 15.441 -17.219 1.00 0.00 H ATOM 1174 N ASN A 153 26.015 14.195 -14.842 1.00 14.69 N ATOM 1175 CA ASN A 153 26.104 14.082 -13.402 1.00 12.05 C ATOM 1176 C ASN A 153 24.726 14.149 -12.777 1.00 10.30 C ATOM 1177 O ASN A 153 24.296 15.183 -12.314 1.00 14.62 O ATOM 1178 CB ASN A 153 26.957 15.229 -12.819 1.00 16.75 C ATOM 1179 CG ASN A 153 28.372 15.153 -13.205 1.00 19.77 C ATOM 1180 OD1 ASN A 153 28.912 14.093 -13.460 1.00 23.58 O ATOM 1181 ND2 ASN A 153 29.059 16.289 -13.185 1.00 18.27 N ATOM 1182 HD22 ASN A 153 28.577 17.184 -12.965 1.00 0.00 H ATOM 1183 HD21 ASN A 153 30.079 16.284 -13.390 1.00 0.00 H ATOM 1184 H ASN A 153 26.147 15.127 -15.284 1.00 0.00 H ATOM 1185 N LEU A 154 23.972 13.065 -12.896 1.00 13.59 N ATOM 1186 CA LEU A 154 22.602 12.951 -12.519 1.00 11.67 C ATOM 1187 C LEU A 154 22.395 12.025 -11.411 1.00 13.10 C ATOM 1188 O LEU A 154 22.815 10.861 -11.546 1.00 15.73 O ATOM 1189 CB LEU A 154 21.762 12.544 -13.717 1.00 12.53 C ATOM 1190 CG LEU A 154 20.220 12.533 -13.479 1.00 13.39 C ATOM 1191 CD1 LEU A 154 19.660 13.876 -13.161 1.00 12.85 C ATOM 1192 CD2 LEU A 154 19.488 11.955 -14.630 1.00 14.46 C ATOM 1193 H LEU A 154 24.422 12.220 -13.302 1.00 0.00 H ATOM 1194 N LEU A 155 21.769 12.402 -10.342 1.00 11.64 N ATOM 1195 CA LEU A 155 21.323 11.489 -9.245 1.00 10.80 C ATOM 1196 C LEU A 155 19.800 11.415 -9.238 1.00 9.65 C ATOM 1197 O LEU A 155 19.175 12.413 -8.968 1.00 11.18 O ATOM 1198 CB LEU A 155 21.873 11.955 -7.938 1.00 14.10 C ATOM 1199 CG LEU A 155 23.231 12.064 -7.374 1.00 19.25 C ATOM 1200 CD1 LEU A 155 23.986 13.130 -8.008 1.00 35.73 C ATOM 1201 CD2 LEU A 155 23.131 12.187 -5.793 1.00 23.30 C ATOM 1202 H LEU A 155 21.561 13.416 -10.239 1.00 0.00 H ATOM 1203 N GLU A 156 19.216 10.286 -9.624 1.00 9.29 N ATOM 1204 CA GLU A 156 17.803 10.046 -9.635 1.00 7.98 C ATOM 1205 C GLU A 156 17.389 9.532 -8.273 1.00 8.10 C ATOM 1206 O GLU A 156 17.357 8.253 -8.075 1.00 11.43 O ATOM 1207 CB GLU A 156 17.440 9.115 -10.783 1.00 11.49 C ATOM 1208 CG GLU A 156 17.583 9.732 -12.098 1.00 12.72 C ATOM 1209 CD GLU A 156 17.413 8.816 -13.261 1.00 15.54 C ATOM 1210 OE1 GLU A 156 18.052 7.753 -13.225 1.00 22.03 O ATOM 1211 OE2 GLU A 156 16.642 9.054 -14.148 1.00 15.93 O ATOM 1212 H GLU A 156 19.834 9.514 -9.944 1.00 0.00 H ATOM 1213 N ILE A 157 17.096 10.352 -7.310 1.00 10.68 N ATOM 1214 CA ILE A 157 17.003 9.945 -5.947 1.00 10.75 C ATOM 1215 C ILE A 157 15.759 9.100 -5.618 1.00 7.96 C ATOM 1216 O ILE A 157 15.721 8.418 -4.591 1.00 9.16 O ATOM 1217 CB ILE A 157 17.098 11.075 -4.954 1.00 9.39 C ATOM 1218 CG1 ILE A 157 15.940 12.006 -4.992 1.00 10.24 C ATOM 1219 CG2 ILE A 157 18.429 11.853 -5.170 1.00 11.60 C ATOM 1220 CD1 ILE A 157 15.908 13.134 -4.027 1.00 11.10 C ATOM 1221 H ILE A 157 16.921 11.350 -7.543 1.00 0.00 H ATOM 1222 N HIS A 158 14.799 9.156 -6.527 1.00 7.91 N ATOM 1223 CA HIS A 158 13.553 8.502 -6.375 1.00 9.70 C ATOM 1224 C HIS A 158 13.372 7.335 -7.385 1.00 10.44 C ATOM 1225 O HIS A 158 12.275 6.819 -7.500 1.00 9.82 O ATOM 1226 CB HIS A 158 12.298 9.390 -6.322 1.00 9.06 C ATOM 1227 CG HIS A 158 12.306 10.280 -5.142 1.00 8.08 C ATOM 1228 ND1 HIS A 158 11.604 11.475 -5.088 1.00 11.34 N ATOM 1229 CD2 HIS A 158 12.863 10.214 -3.915 1.00 9.19 C ATOM 1230 CE1 HIS A 158 11.741 12.023 -3.895 1.00 10.70 C ATOM 1231 NE2 HIS A 158 12.562 11.331 -3.149 1.00 11.44 N ATOM 1232 H HIS A 158 14.968 9.706 -7.393 1.00 0.00 H ATOM 1233 N GLY A 159 14.448 7.038 -8.109 1.00 9.02 N ATOM 1234 CA GLY A 159 14.408 6.047 -9.121 1.00 8.71 C ATOM 1235 C GLY A 159 14.000 6.454 -10.526 1.00 9.05 C ATOM 1236 O GLY A 159 14.065 7.636 -10.845 1.00 11.12 O ATOM 1237 H GLY A 159 15.338 7.544 -7.928 1.00 0.00 H ATOM 1238 N SER A 160 13.472 5.534 -11.311 1.00 11.42 N ATOM 1239 CA SER A 160 13.199 5.800 -12.716 1.00 12.15 C ATOM 1240 C SER A 160 11.947 4.951 -13.077 1.00 10.70 C ATOM 1241 O SER A 160 11.825 3.786 -12.776 1.00 11.04 O ATOM 1242 CB SER A 160 14.264 5.337 -13.627 1.00 11.77 C ATOM 1243 OG SER A 160 13.809 5.414 -14.977 1.00 13.09 O ATOM 1244 HG SER A 160 14.526 5.103 -15.584 1.00 0.00 H ATOM 1245 H SER A 160 13.246 4.598 -10.917 1.00 0.00 H ATOM 1246 N LEU A 161 11.046 5.564 -13.853 1.00 9.07 N ATOM 1247 CA LEU A 161 9.942 5.019 -14.465 1.00 11.20 C ATOM 1248 C LEU A 161 10.346 3.872 -15.411 1.00 11.31 C ATOM 1249 O LEU A 161 9.488 3.038 -15.747 1.00 11.22 O ATOM 1250 CB LEU A 161 9.085 6.026 -15.256 1.00 13.87 C ATOM 1251 CG LEU A 161 7.820 5.790 -15.799 1.00 16.09 C ATOM 1252 CD1 LEU A 161 6.914 5.405 -14.582 1.00 19.38 C ATOM 1253 CD2 LEU A 161 7.329 7.033 -16.509 1.00 18.36 C ATOM 1254 H LEU A 161 11.200 6.580 -14.013 1.00 0.00 H ATOM 1255 N PHE A 162 11.526 3.954 -15.934 1.00 9.37 N ATOM 1256 CA PHE A 162 12.023 3.002 -16.976 1.00 8.60 C ATOM 1257 C PHE A 162 13.016 1.961 -16.429 1.00 9.82 C ATOM 1258 O PHE A 162 13.892 1.516 -17.159 1.00 10.92 O ATOM 1259 CB PHE A 162 12.548 3.759 -18.158 1.00 9.64 C ATOM 1260 CG PHE A 162 11.461 4.666 -18.794 1.00 10.56 C ATOM 1261 CD1 PHE A 162 10.390 4.022 -19.428 1.00 14.97 C ATOM 1262 CD2 PHE A 162 11.482 6.003 -18.680 1.00 13.28 C ATOM 1263 CE1 PHE A 162 9.449 4.719 -20.090 1.00 16.43 C ATOM 1264 CE2 PHE A 162 10.424 6.725 -19.269 1.00 17.47 C ATOM 1265 CZ PHE A 162 9.424 6.112 -19.918 1.00 18.24 C ATOM 1266 H PHE A 162 12.158 4.716 -15.616 1.00 0.00 H ATOM 1267 N LYS A 163 12.880 1.681 -15.094 1.00 10.63 N ATOM 1268 CA LYS A 163 13.556 0.537 -14.528 1.00 10.19 C ATOM 1269 C LYS A 163 12.519 -0.229 -13.742 1.00 9.12 C ATOM 1270 O LYS A 163 11.565 0.281 -13.173 1.00 11.06 O ATOM 1271 CB LYS A 163 14.692 0.978 -13.573 1.00 11.72 C ATOM 1272 CG LYS A 163 15.869 1.594 -14.291 1.00 13.50 C ATOM 1273 CD LYS A 163 16.992 1.997 -13.391 1.00 16.14 C ATOM 1274 CE LYS A 163 18.270 2.377 -14.160 1.00 21.57 C ATOM 1275 NZ LYS A 163 18.148 3.293 -15.211 1.00 25.88 N ATOM 1276 HZ1 LYS A 163 17.500 2.911 -15.929 1.00 0.00 H ATOM 1277 HZ2 LYS A 163 17.771 4.191 -14.845 1.00 0.00 H ATOM 1278 HZ3 LYS A 163 19.082 3.456 -15.638 1.00 0.00 H ATOM 1279 H LYS A 163 12.292 2.290 -14.491 1.00 0.00 H ATOM 1280 N THR A 164 12.841 -1.540 -13.670 1.00 11.58 N ATOM 1281 CA THR A 164 12.088 -2.523 -12.912 1.00 11.81 C ATOM 1282 C THR A 164 12.968 -3.068 -11.796 1.00 7.67 C ATOM 1283 O THR A 164 14.179 -3.134 -12.003 1.00 10.87 O ATOM 1284 CB THR A 164 11.503 -3.679 -13.745 1.00 11.93 C ATOM 1285 OG1 THR A 164 12.532 -4.356 -14.384 1.00 12.31 O ATOM 1286 CG2 THR A 164 10.499 -3.152 -14.695 1.00 14.02 C ATOM 1287 HG1 THR A 164 13.157 -4.719 -13.707 1.00 0.00 H ATOM 1288 H THR A 164 13.681 -1.865 -14.190 1.00 0.00 H ATOM 1289 N ARG A 165 12.284 -3.564 -10.758 1.00 9.31 N ATOM 1290 CA ARG A 165 13.053 -4.388 -9.783 1.00 11.36 C ATOM 1291 C ARG A 165 12.153 -5.612 -9.457 1.00 9.73 C ATOM 1292 O ARG A 165 10.959 -5.537 -9.306 1.00 11.37 O ATOM 1293 CB ARG A 165 13.183 -3.523 -8.453 1.00 14.19 C ATOM 1294 CG ARG A 165 14.036 -4.282 -7.444 1.00 18.18 C ATOM 1295 CD ARG A 165 14.559 -3.586 -6.282 1.00 19.47 C ATOM 1296 NE ARG A 165 13.500 -3.145 -5.461 1.00 22.13 N ATOM 1297 CZ ARG A 165 13.114 -1.857 -5.114 1.00 22.12 C ATOM 1298 NH1 ARG A 165 13.417 -0.899 -5.815 1.00 28.53 N ATOM 1299 NH2 ARG A 165 12.401 -1.621 -4.034 1.00 21.69 N ATOM 1300 HE ARG A 165 12.917 -3.903 -5.052 1.00 0.00 H ATOM 1301 HH12 ARG A 165 13.121 0.060 -5.542 1.00 0.00 H ATOM 1302 HH11 ARG A 165 13.971 -1.044 -6.683 1.00 0.00 H ATOM 1303 HH22 ARG A 165 12.125 -0.647 -3.796 1.00 0.00 H ATOM 1304 HH21 ARG A 165 12.114 -2.408 -3.418 1.00 0.00 H ATOM 1305 H ARG A 165 11.267 -3.383 -10.638 1.00 0.00 H ATOM 1306 N CYS A 166 12.832 -6.745 -9.458 1.00 11.37 N ATOM 1307 CA CYS A 166 12.160 -8.021 -9.146 1.00 12.06 C ATOM 1308 C CYS A 166 11.937 -8.140 -7.623 1.00 10.74 C ATOM 1309 O CYS A 166 12.901 -8.100 -6.868 1.00 14.49 O ATOM 1310 CB CYS A 166 12.911 -9.147 -9.671 1.00 11.99 C ATOM 1311 SG CYS A 166 12.121 -10.736 -9.383 1.00 13.81 S ATOM 1312 H CYS A 166 13.848 -6.738 -9.680 1.00 0.00 H ATOM 1313 N THR A 167 10.653 -8.401 -7.286 1.00 11.54 N ATOM 1314 CA THR A 167 10.321 -8.557 -5.851 1.00 12.58 C ATOM 1315 C THR A 167 10.770 -9.913 -5.282 1.00 16.53 C ATOM 1316 O THR A 167 10.684 -10.114 -4.092 1.00 18.16 O ATOM 1317 CB THR A 167 8.830 -8.334 -5.622 1.00 14.50 C ATOM 1318 OG1 THR A 167 8.059 -9.355 -6.257 1.00 15.82 O ATOM 1319 CG2 THR A 167 8.424 -6.929 -5.996 1.00 14.98 C ATOM 1320 HG1 THR A 167 8.237 -9.344 -7.231 1.00 0.00 H ATOM 1321 H THR A 167 9.918 -8.490 -8.016 1.00 0.00 H ATOM 1322 N SER A 168 11.164 -10.831 -6.144 1.00 15.08 N ATOM 1323 CA SER A 168 11.727 -12.124 -5.733 1.00 14.56 C ATOM 1324 C SER A 168 13.243 -12.105 -5.692 1.00 15.55 C ATOM 1325 O SER A 168 13.804 -12.535 -4.657 1.00 19.65 O ATOM 1326 CB SER A 168 11.122 -13.336 -6.551 1.00 18.87 C ATOM 1327 OG SER A 168 11.755 -14.471 -6.074 1.00 27.25 O ATOM 1328 HG SER A 168 11.412 -15.265 -6.555 1.00 0.00 H ATOM 1329 H SER A 168 11.072 -10.630 -7.160 1.00 0.00 H ATOM 1330 N CYS A 169 13.905 -11.763 -6.820 1.00 16.22 N ATOM 1331 CA CYS A 169 15.346 -11.838 -6.959 1.00 15.46 C ATOM 1332 C CYS A 169 16.142 -10.551 -6.638 1.00 18.49 C ATOM 1333 O CYS A 169 17.313 -10.570 -6.461 1.00 18.07 O ATOM 1334 CB CYS A 169 15.925 -12.679 -8.116 1.00 16.41 C ATOM 1335 SG CYS A 169 15.749 -11.544 -9.574 1.00 16.61 S ATOM 1336 H CYS A 169 13.350 -11.428 -7.633 1.00 0.00 H ATOM 1337 N GLY A 170 15.444 -9.422 -6.640 1.00 13.94 N ATOM 1338 CA GLY A 170 16.007 -8.115 -6.451 1.00 15.00 C ATOM 1339 C GLY A 170 16.772 -7.539 -7.678 1.00 14.74 C ATOM 1340 O GLY A 170 17.182 -6.389 -7.560 1.00 18.41 O ATOM 1341 H GLY A 170 14.417 -9.489 -6.789 1.00 0.00 H ATOM 1342 N VAL A 171 16.704 -8.147 -8.822 1.00 14.18 N ATOM 1343 CA VAL A 171 17.459 -7.618 -9.890 1.00 13.86 C ATOM 1344 C VAL A 171 16.759 -6.311 -10.432 1.00 13.65 C ATOM 1345 O VAL A 171 15.544 -6.285 -10.530 1.00 12.48 O ATOM 1346 CB VAL A 171 17.635 -8.630 -11.058 1.00 17.92 C ATOM 1347 CG1 VAL A 171 16.456 -8.969 -11.822 1.00 24.74 C ATOM 1348 CG2 VAL A 171 18.634 -8.123 -12.089 1.00 25.68 C ATOM 1349 H VAL A 171 16.114 -8.994 -8.947 1.00 0.00 H ATOM 1350 N VAL A 172 17.641 -5.393 -10.809 1.00 14.38 N ATOM 1351 CA VAL A 172 17.216 -4.072 -11.339 1.00 12.94 C ATOM 1352 C VAL A 172 17.480 -4.122 -12.826 1.00 14.09 C ATOM 1353 O VAL A 172 18.619 -4.464 -13.194 1.00 18.71 O ATOM 1354 CB VAL A 172 17.793 -2.917 -10.626 1.00 13.19 C ATOM 1355 CG1 VAL A 172 17.445 -1.590 -11.406 1.00 19.43 C ATOM 1356 CG2 VAL A 172 17.418 -2.882 -9.140 1.00 15.43 C ATOM 1357 H VAL A 172 18.656 -5.604 -10.731 1.00 0.00 H ATOM 1358 N ALA A 173 16.533 -3.749 -13.658 1.00 12.71 N ATOM 1359 CA ALA A 173 16.751 -3.809 -15.108 1.00 15.19 C ATOM 1360 C ALA A 173 16.147 -2.526 -15.714 1.00 12.03 C ATOM 1361 O ALA A 173 15.112 -2.038 -15.281 1.00 13.27 O ATOM 1362 CB ALA A 173 16.087 -5.011 -15.715 1.00 16.10 C ATOM 1363 H ALA A 173 15.623 -3.409 -13.286 1.00 0.00 H ATOM 1364 N GLU A 174 16.808 -2.129 -16.800 1.00 12.59 N ATOM 1365 CA GLU A 174 16.176 -1.078 -17.593 1.00 13.32 C ATOM 1366 C GLU A 174 14.998 -1.714 -18.384 1.00 13.84 C ATOM 1367 O GLU A 174 15.102 -2.878 -18.854 1.00 15.43 O ATOM 1368 CB GLU A 174 17.167 -0.515 -18.651 1.00 15.92 C ATOM 1369 CG GLU A 174 18.290 0.294 -18.054 1.00 23.41 C ATOM 1370 CD GLU A 174 19.243 0.932 -19.058 1.00 32.60 C ATOM 1371 OE1 GLU A 174 19.250 0.485 -20.222 1.00 38.07 O ATOM 1372 OE2 GLU A 174 19.937 1.861 -18.663 1.00 45.47 O ATOM 1373 H GLU A 174 17.723 -2.544 -17.068 1.00 0.00 H ATOM 1374 N ASN A 175 13.939 -0.982 -18.530 1.00 13.07 N ATOM 1375 CA ASN A 175 12.817 -1.436 -19.242 1.00 12.98 C ATOM 1376 C ASN A 175 12.057 -0.228 -19.874 1.00 12.28 C ATOM 1377 O ASN A 175 11.427 0.503 -19.211 1.00 13.29 O ATOM 1378 CB ASN A 175 11.887 -2.316 -18.377 1.00 13.24 C ATOM 1379 CG ASN A 175 10.850 -2.974 -19.179 1.00 14.19 C ATOM 1380 OD1 ASN A 175 10.204 -2.401 -20.082 1.00 14.09 O ATOM 1381 ND2 ASN A 175 10.640 -4.251 -18.827 1.00 13.76 N ATOM 1382 HD22 ASN A 175 11.206 -4.681 -18.068 1.00 0.00 H ATOM 1383 HD21 ASN A 175 9.911 -4.811 -19.313 1.00 0.00 H ATOM 1384 H ASN A 175 13.919 -0.032 -18.108 1.00 0.00 H ATOM 1385 N TYR A 176 12.161 -0.169 -21.234 1.00 10.74 N ATOM 1386 CA TYR A 176 11.477 0.823 -21.968 1.00 11.46 C ATOM 1387 C TYR A 176 10.426 0.228 -22.883 1.00 14.39 C ATOM 1388 O TYR A 176 9.893 0.952 -23.746 1.00 17.44 O ATOM 1389 CB TYR A 176 12.466 1.603 -22.882 1.00 16.91 C ATOM 1390 CG TYR A 176 13.505 2.364 -22.088 1.00 16.32 C ATOM 1391 CD1 TYR A 176 13.331 3.642 -21.770 1.00 14.06 C ATOM 1392 CD2 TYR A 176 14.730 1.812 -21.780 1.00 14.43 C ATOM 1393 CE1 TYR A 176 14.238 4.353 -21.044 1.00 12.53 C ATOM 1394 CE2 TYR A 176 15.632 2.525 -21.053 1.00 13.17 C ATOM 1395 CZ TYR A 176 15.407 3.858 -20.710 1.00 14.21 C ATOM 1396 OH TYR A 176 16.357 4.520 -19.970 1.00 15.57 O ATOM 1397 HH TYR A 176 16.058 5.450 -19.807 1.00 0.00 H ATOM 1398 H TYR A 176 12.751 -0.863 -21.735 1.00 0.00 H ATOM 1399 N LYS A 177 10.054 -1.030 -22.666 1.00 16.01 N ATOM 1400 CA LYS A 177 9.083 -1.662 -23.535 1.00 16.71 C ATOM 1401 C LYS A 177 7.668 -1.042 -23.463 1.00 13.85 C ATOM 1402 O LYS A 177 7.189 -0.883 -22.402 1.00 15.28 O ATOM 1403 CB LYS A 177 9.035 -3.156 -23.371 1.00 17.70 C ATOM 1404 CG LYS A 177 8.406 -3.877 -24.511 1.00 30.08 C ATOM 1405 CD LYS A 177 8.449 -5.386 -24.270 1.00 43.48 C ATOM 1406 CE LYS A 177 8.389 -6.270 -25.566 1.00 47.50 C ATOM 1407 NZ LYS A 177 7.106 -6.721 -26.252 1.00 58.02 N ATOM 1408 HZ1 LYS A 177 6.541 -7.289 -25.589 1.00 0.00 H ATOM 1409 HZ2 LYS A 177 6.560 -5.886 -26.547 1.00 0.00 H ATOM 1410 HZ3 LYS A 177 7.344 -7.294 -27.087 1.00 0.00 H ATOM 1411 H LYS A 177 10.461 -1.561 -21.870 1.00 0.00 H ATOM 1412 N SER A 178 7.056 -0.920 -24.623 1.00 14.11 N ATOM 1413 CA SER A 178 5.711 -0.388 -24.742 1.00 18.11 C ATOM 1414 C SER A 178 4.899 -1.469 -25.448 1.00 15.95 C ATOM 1415 O SER A 178 5.124 -1.689 -26.683 1.00 18.92 O ATOM 1416 CB SER A 178 5.712 0.883 -25.583 1.00 18.12 C ATOM 1417 OG SER A 178 4.369 1.300 -25.899 1.00 21.78 O ATOM 1418 HG SER A 178 3.873 1.476 -25.060 1.00 0.00 H ATOM 1419 H SER A 178 7.555 -1.216 -25.486 1.00 0.00 H ATOM 1420 N PRO A 179 3.952 -2.089 -24.797 1.00 15.03 N ATOM 1421 CA PRO A 179 3.714 -2.133 -23.353 1.00 15.00 C ATOM 1422 C PRO A 179 4.668 -3.004 -22.572 1.00 12.89 C ATOM 1423 O PRO A 179 5.237 -3.923 -23.164 1.00 16.96 O ATOM 1424 CB PRO A 179 2.320 -2.690 -23.268 1.00 16.36 C ATOM 1425 CG PRO A 179 2.315 -3.725 -24.328 1.00 18.65 C ATOM 1426 CD PRO A 179 3.112 -3.133 -25.493 1.00 18.62 C ATOM 1427 N ILE A 180 4.827 -2.743 -21.283 1.00 13.55 N ATOM 1428 CA ILE A 180 5.764 -3.524 -20.602 1.00 14.19 C ATOM 1429 C ILE A 180 5.375 -4.978 -20.520 1.00 12.77 C ATOM 1430 O ILE A 180 6.288 -5.804 -20.368 1.00 16.28 O ATOM 1431 CB ILE A 180 5.895 -2.910 -19.192 1.00 12.40 C ATOM 1432 CG1 ILE A 180 7.029 -3.541 -18.452 1.00 12.98 C ATOM 1433 CG2 ILE A 180 4.557 -2.753 -18.425 1.00 12.76 C ATOM 1434 CD1 ILE A 180 7.479 -2.857 -17.160 1.00 12.43 C ATOM 1435 H ILE A 180 4.284 -1.997 -20.804 1.00 0.00 H ATOM 1436 N CYS A 181 4.111 -5.302 -20.514 1.00 11.75 N ATOM 1437 CA CYS A 181 3.699 -6.705 -20.711 1.00 12.18 C ATOM 1438 C CYS A 181 2.436 -6.740 -21.551 1.00 12.58 C ATOM 1439 O CYS A 181 1.739 -5.697 -21.667 1.00 13.59 O ATOM 1440 CB CYS A 181 3.497 -7.431 -19.356 1.00 15.45 C ATOM 1441 SG CYS A 181 2.073 -6.816 -18.466 1.00 15.41 S ATOM 1442 H CYS A 181 3.390 -4.567 -20.369 1.00 0.00 H ATOM 1443 N PRO A 182 2.168 -7.870 -22.235 1.00 12.92 N ATOM 1444 CA PRO A 182 1.026 -7.882 -23.178 1.00 15.88 C ATOM 1445 C PRO A 182 -0.349 -7.657 -22.525 1.00 13.07 C ATOM 1446 O PRO A 182 -1.163 -6.986 -23.127 1.00 14.65 O ATOM 1447 CB PRO A 182 1.099 -9.328 -23.740 1.00 17.07 C ATOM 1448 CG PRO A 182 2.505 -9.646 -23.610 1.00 17.52 C ATOM 1449 CD PRO A 182 3.014 -9.077 -22.358 1.00 12.25 C ATOM 1450 N ALA A 183 -0.469 -8.070 -21.243 1.00 12.89 N ATOM 1451 CA ALA A 183 -1.751 -7.844 -20.618 1.00 13.74 C ATOM 1452 C ALA A 183 -2.044 -6.374 -20.317 1.00 14.23 C ATOM 1453 O ALA A 183 -3.234 -6.018 -20.162 1.00 15.85 O ATOM 1454 CB ALA A 183 -1.824 -8.657 -19.355 1.00 14.89 C ATOM 1455 H ALA A 183 0.317 -8.524 -20.736 1.00 0.00 H ATOM 1456 N LEU A 184 -1.038 -5.502 -20.312 1.00 12.23 N ATOM 1457 CA LEU A 184 -1.255 -4.088 -20.085 1.00 14.07 C ATOM 1458 C LEU A 184 -1.529 -3.351 -21.398 1.00 11.15 C ATOM 1459 O LEU A 184 -1.798 -2.130 -21.357 1.00 14.86 O ATOM 1460 CB LEU A 184 -0.098 -3.428 -19.328 1.00 12.13 C ATOM 1461 CG LEU A 184 -0.160 -3.646 -17.818 1.00 12.98 C ATOM 1462 CD1 LEU A 184 1.250 -3.439 -17.263 1.00 12.91 C ATOM 1463 CD2 LEU A 184 -1.259 -2.929 -17.142 1.00 15.38 C ATOM 1464 H LEU A 184 -0.070 -5.845 -20.476 1.00 0.00 H ATOM 1465 N SER A 185 -1.463 -3.973 -22.555 1.00 12.34 N ATOM 1466 CA SER A 185 -1.741 -3.403 -23.861 1.00 12.77 C ATOM 1467 C SER A 185 -3.182 -2.825 -23.733 1.00 15.89 C ATOM 1468 O SER A 185 -4.174 -3.471 -23.488 1.00 19.86 O ATOM 1469 CB SER A 185 -1.691 -4.486 -24.964 1.00 18.33 C ATOM 1470 OG SER A 185 -1.892 -3.801 -26.171 1.00 22.50 O ATOM 1471 HG SER A 185 -2.771 -3.347 -26.149 1.00 0.00 H ATOM 1472 H SER A 185 -1.183 -4.974 -22.532 1.00 0.00 H ATOM 1473 N GLY A 186 -3.302 -1.508 -24.043 1.00 15.62 N ATOM 1474 CA GLY A 186 -4.516 -0.730 -24.019 1.00 20.77 C ATOM 1475 C GLY A 186 -5.136 -0.438 -22.689 1.00 20.83 C ATOM 1476 O GLY A 186 -6.257 0.061 -22.558 1.00 24.05 O ATOM 1477 H GLY A 186 -2.433 -1.012 -24.325 1.00 0.00 H ATOM 1478 N LYS A 187 -4.413 -0.715 -21.615 1.00 16.87 N ATOM 1479 CA LYS A 187 -4.824 -0.443 -20.309 1.00 13.90 C ATOM 1480 C LYS A 187 -4.254 0.869 -19.755 1.00 15.58 C ATOM 1481 O LYS A 187 -3.502 1.525 -20.402 1.00 17.19 O ATOM 1482 CB LYS A 187 -4.490 -1.577 -19.307 1.00 17.41 C ATOM 1483 CG LYS A 187 -4.942 -2.946 -19.838 1.00 18.97 C ATOM 1484 CD LYS A 187 -6.476 -3.004 -20.093 1.00 19.37 C ATOM 1485 CE LYS A 187 -6.807 -4.309 -20.644 1.00 24.35 C ATOM 1486 NZ LYS A 187 -8.255 -4.499 -20.583 1.00 31.04 N ATOM 1487 HZ1 LYS A 187 -8.569 -4.446 -19.593 1.00 0.00 H ATOM 1488 HZ2 LYS A 187 -8.725 -3.755 -21.137 1.00 0.00 H ATOM 1489 HZ3 LYS A 187 -8.498 -5.431 -20.976 1.00 0.00 H ATOM 1490 H LYS A 187 -3.484 -1.162 -21.753 1.00 0.00 H ATOM 1491 N GLY A 188 -4.614 1.166 -18.481 1.00 13.92 N ATOM 1492 CA GLY A 188 -4.090 2.413 -17.910 1.00 14.69 C ATOM 1493 C GLY A 188 -4.855 3.645 -18.168 1.00 16.69 C ATOM 1494 O GLY A 188 -4.328 4.719 -17.752 1.00 15.28 O ATOM 1495 H GLY A 188 -5.235 0.537 -17.932 1.00 0.00 H ATOM 1496 N ALA A 189 -6.024 3.608 -18.870 1.00 15.63 N ATOM 1497 CA ALA A 189 -6.681 4.894 -19.162 1.00 17.36 C ATOM 1498 C ALA A 189 -6.972 5.645 -17.841 1.00 13.33 C ATOM 1499 O ALA A 189 -7.331 5.018 -16.837 1.00 15.36 O ATOM 1500 CB ALA A 189 -8.010 4.633 -19.869 1.00 19.64 C ATOM 1501 H ALA A 189 -6.436 2.707 -19.187 1.00 0.00 H ATOM 1502 N PRO A 190 -6.824 6.953 -17.882 1.00 15.47 N ATOM 1503 CA PRO A 190 -6.856 7.759 -16.650 1.00 14.33 C ATOM 1504 C PRO A 190 -8.218 8.285 -16.196 1.00 16.47 C ATOM 1505 O PRO A 190 -8.312 8.856 -15.086 1.00 16.09 O ATOM 1506 CB PRO A 190 -5.973 8.986 -17.005 1.00 15.78 C ATOM 1507 CG PRO A 190 -6.170 9.166 -18.485 1.00 17.79 C ATOM 1508 CD PRO A 190 -6.298 7.734 -19.046 1.00 17.95 C ATOM 1509 N GLU A 191 -9.250 8.096 -16.994 1.00 21.18 N ATOM 1510 CA GLU A 191 -10.469 8.815 -16.680 1.00 18.87 C ATOM 1511 C GLU A 191 -11.159 8.106 -15.518 1.00 17.44 C ATOM 1512 O GLU A 191 -11.178 6.854 -15.400 1.00 19.13 O ATOM 1513 CB GLU A 191 -11.409 8.727 -17.875 1.00 19.51 C ATOM 1514 CG GLU A 191 -11.034 9.505 -19.086 1.00 23.82 C ATOM 1515 CD GLU A 191 -9.995 8.907 -19.957 1.00 24.24 C ATOM 1516 OE1 GLU A 191 -9.708 7.721 -19.862 1.00 21.82 O ATOM 1517 OE2 GLU A 191 -9.547 9.633 -20.824 1.00 27.60 O ATOM 1518 H GLU A 191 -9.192 7.458 -17.814 1.00 0.00 H ATOM 1519 N PRO A 192 -11.667 8.838 -14.593 1.00 16.41 N ATOM 1520 CA PRO A 192 -12.440 8.317 -13.486 1.00 19.84 C ATOM 1521 C PRO A 192 -13.583 7.399 -14.013 1.00 22.81 C ATOM 1522 O PRO A 192 -14.220 7.693 -15.073 1.00 20.27 O ATOM 1523 CB PRO A 192 -13.048 9.613 -12.835 1.00 18.36 C ATOM 1524 CG PRO A 192 -12.048 10.673 -13.061 1.00 17.46 C ATOM 1525 CD PRO A 192 -11.692 10.328 -14.496 1.00 16.87 C ATOM 1526 N GLY A 193 -13.804 6.293 -13.307 1.00 20.64 N ATOM 1527 CA GLY A 193 -14.904 5.361 -13.688 1.00 24.05 C ATOM 1528 C GLY A 193 -14.383 4.321 -14.681 1.00 29.98 C ATOM 1529 O GLY A 193 -15.120 3.452 -15.051 1.00 33.98 O ATOM 1530 H GLY A 193 -13.206 6.077 -12.484 1.00 0.00 H ATOM 1531 N THR A 194 -13.156 4.381 -15.154 1.00 21.99 N ATOM 1532 CA THR A 194 -12.539 3.274 -15.911 1.00 21.38 C ATOM 1533 C THR A 194 -12.468 2.096 -14.948 1.00 21.37 C ATOM 1534 O THR A 194 -11.988 2.213 -13.828 1.00 24.67 O ATOM 1535 CB THR A 194 -11.107 3.662 -16.469 1.00 20.94 C ATOM 1536 OG1 THR A 194 -11.158 4.870 -17.184 1.00 23.28 O ATOM 1537 CG2 THR A 194 -10.510 2.608 -17.179 1.00 22.11 C ATOM 1538 HG1 THR A 194 -11.474 5.593 -16.586 1.00 0.00 H ATOM 1539 H THR A 194 -12.599 5.243 -14.988 1.00 0.00 H ATOM 1540 N GLN A 195 -13.007 1.007 -15.397 1.00 30.74 N ATOM 1541 CA GLN A 195 -12.917 -0.329 -14.797 1.00 31.77 C ATOM 1542 C GLN A 195 -11.513 -0.746 -14.513 1.00 23.62 C ATOM 1543 O GLN A 195 -10.599 -0.546 -15.420 1.00 27.17 O ATOM 1544 CB GLN A 195 -13.688 -1.308 -15.755 1.00 40.66 C ATOM 1545 CG GLN A 195 -13.892 -2.681 -15.232 1.00 48.63 C ATOM 1546 CD GLN A 195 -14.906 -3.442 -16.093 1.00 73.67 C ATOM 1547 OE1 GLN A 195 -14.815 -3.370 -17.338 1.00 69.85 O ATOM 1548 NE2 GLN A 195 -15.874 -4.151 -15.455 1.00 87.69 N ATOM 1549 HE22 GLN A 195 -15.901 -4.175 -14.416 1.00 0.00 H ATOM 1550 HE21 GLN A 195 -16.588 -4.669 -16.006 1.00 0.00 H ATOM 1551 H GLN A 195 -13.561 1.088 -16.274 1.00 0.00 H ATOM 1552 N ASP A 196 -11.203 -1.307 -13.300 1.00 28.39 N ATOM 1553 CA ASP A 196 -9.953 -2.017 -13.054 1.00 23.88 C ATOM 1554 C ASP A 196 -9.721 -3.117 -14.088 1.00 19.35 C ATOM 1555 O ASP A 196 -10.613 -3.940 -14.373 1.00 27.35 O ATOM 1556 CB ASP A 196 -9.781 -2.708 -11.662 1.00 29.55 C ATOM 1557 CG ASP A 196 -9.466 -1.814 -10.556 1.00 34.99 C ATOM 1558 OD1 ASP A 196 -8.627 -0.874 -10.602 1.00 33.04 O ATOM 1559 OD2 ASP A 196 -10.048 -2.141 -9.471 1.00 45.71 O ATOM 1560 H ASP A 196 -11.889 -1.222 -12.523 1.00 0.00 H ATOM 1561 N ALA A 197 -8.518 -3.149 -14.641 1.00 18.28 N ATOM 1562 CA ALA A 197 -8.147 -4.222 -15.600 1.00 20.83 C ATOM 1563 C ALA A 197 -8.162 -5.611 -14.909 1.00 18.69 C ATOM 1564 O ALA A 197 -8.414 -6.599 -15.557 1.00 21.53 O ATOM 1565 CB ALA A 197 -6.784 -4.019 -16.242 1.00 16.80 C ATOM 1566 H ALA A 197 -7.823 -2.413 -14.401 1.00 0.00 H ATOM 1567 N SER A 198 -7.835 -5.596 -13.600 1.00 16.87 N ATOM 1568 CA SER A 198 -7.865 -6.831 -12.813 1.00 19.58 C ATOM 1569 C SER A 198 -7.043 -7.955 -13.417 1.00 17.71 C ATOM 1570 O SER A 198 -7.468 -9.098 -13.478 1.00 23.17 O ATOM 1571 CB SER A 198 -9.321 -7.235 -12.454 1.00 27.04 C ATOM 1572 OG SER A 198 -9.877 -6.293 -11.596 1.00 32.80 O ATOM 1573 HG SER A 198 -9.338 -6.244 -10.767 1.00 0.00 H ATOM 1574 H SER A 198 -7.560 -4.701 -13.147 1.00 0.00 H ATOM 1575 N ILE A 199 -5.858 -7.634 -13.810 1.00 15.88 N ATOM 1576 CA ILE A 199 -4.942 -8.561 -14.433 1.00 15.58 C ATOM 1577 C ILE A 199 -4.407 -9.467 -13.284 1.00 16.51 C ATOM 1578 O ILE A 199 -3.854 -8.972 -12.327 1.00 19.25 O ATOM 1579 CB ILE A 199 -3.764 -7.857 -15.132 1.00 13.60 C ATOM 1580 CG1 ILE A 199 -4.279 -6.886 -16.208 1.00 16.65 C ATOM 1581 CG2 ILE A 199 -2.785 -8.817 -15.682 1.00 13.50 C ATOM 1582 CD1 ILE A 199 -3.313 -5.799 -16.627 1.00 17.21 C ATOM 1583 H ILE A 199 -5.544 -6.652 -13.671 1.00 0.00 H ATOM 1584 N PRO A 200 -4.497 -10.821 -13.465 1.00 18.69 N ATOM 1585 CA PRO A 200 -3.932 -11.676 -12.485 1.00 20.65 C ATOM 1586 C PRO A 200 -2.429 -11.467 -12.359 1.00 18.32 C ATOM 1587 O PRO A 200 -1.739 -11.195 -13.367 1.00 17.42 O ATOM 1588 CB PRO A 200 -4.194 -13.090 -13.035 1.00 28.29 C ATOM 1589 CG PRO A 200 -5.073 -12.956 -14.139 1.00 30.85 C ATOM 1590 CD PRO A 200 -5.128 -11.517 -14.581 1.00 22.58 C ATOM 1591 N VAL A 201 -1.901 -11.694 -11.164 1.00 20.71 N ATOM 1592 CA VAL A 201 -0.498 -11.399 -10.913 1.00 25.65 C ATOM 1593 C VAL A 201 0.457 -12.176 -11.922 1.00 18.97 C ATOM 1594 O VAL A 201 1.487 -11.662 -12.341 1.00 20.34 O ATOM 1595 CB VAL A 201 -0.272 -11.602 -9.385 1.00 30.53 C ATOM 1596 CG1 VAL A 201 -0.332 -13.106 -9.051 1.00 27.00 C ATOM 1597 CG2 VAL A 201 0.938 -11.073 -8.923 1.00 38.57 C ATOM 1598 H VAL A 201 -2.492 -12.085 -10.403 1.00 0.00 H ATOM 1599 N GLU A 202 0.057 -13.391 -12.307 1.00 19.35 N ATOM 1600 CA GLU A 202 0.770 -14.155 -13.289 1.00 22.88 C ATOM 1601 C GLU A 202 0.988 -13.496 -14.658 1.00 18.88 C ATOM 1602 O GLU A 202 1.895 -13.861 -15.373 1.00 20.29 O ATOM 1603 CB GLU A 202 0.145 -15.577 -13.537 1.00 27.05 C ATOM 1604 CG GLU A 202 0.091 -16.411 -12.264 1.00 35.75 C ATOM 1605 CD GLU A 202 -1.093 -16.173 -11.301 1.00 31.96 C ATOM 1606 OE1 GLU A 202 -1.951 -15.346 -11.649 1.00 30.36 O ATOM 1607 OE2 GLU A 202 -1.167 -16.933 -10.273 1.00 53.07 O ATOM 1608 H GLU A 202 -0.800 -13.796 -11.880 1.00 0.00 H ATOM 1609 N LYS A 203 0.095 -12.570 -14.960 1.00 17.04 N ATOM 1610 CA LYS A 203 0.108 -11.856 -16.230 1.00 14.96 C ATOM 1611 C LYS A 203 0.615 -10.383 -16.132 1.00 14.69 C ATOM 1612 O LYS A 203 0.682 -9.727 -17.143 1.00 15.65 O ATOM 1613 CB LYS A 203 -1.207 -11.912 -16.961 1.00 18.91 C ATOM 1614 CG LYS A 203 -1.692 -13.311 -17.359 1.00 21.06 C ATOM 1615 CD LYS A 203 -3.102 -13.228 -17.983 1.00 25.23 C ATOM 1616 CE LYS A 203 -3.536 -14.666 -18.357 1.00 35.08 C ATOM 1617 NZ LYS A 203 -5.042 -14.811 -18.523 1.00 47.61 N ATOM 1618 HZ1 LYS A 203 -5.514 -14.561 -17.630 1.00 0.00 H ATOM 1619 HZ2 LYS A 203 -5.369 -14.176 -19.279 1.00 0.00 H ATOM 1620 HZ3 LYS A 203 -5.269 -15.795 -18.773 1.00 0.00 H ATOM 1621 H LYS A 203 -0.645 -12.342 -14.265 1.00 0.00 H ATOM 1622 N LEU A 204 0.980 -9.954 -14.908 1.00 12.57 N ATOM 1623 CA LEU A 204 1.623 -8.655 -14.733 1.00 13.56 C ATOM 1624 C LEU A 204 3.080 -8.810 -15.134 1.00 13.56 C ATOM 1625 O LEU A 204 3.589 -9.895 -15.360 1.00 14.51 O ATOM 1626 CB LEU A 204 1.405 -8.228 -13.276 1.00 14.27 C ATOM 1627 CG LEU A 204 -0.034 -7.771 -12.974 1.00 16.50 C ATOM 1628 CD1 LEU A 204 -0.207 -7.456 -11.494 1.00 17.77 C ATOM 1629 CD2 LEU A 204 -0.435 -6.640 -13.822 1.00 14.23 C ATOM 1630 H LEU A 204 0.802 -10.555 -14.078 1.00 0.00 H ATOM 1631 N PRO A 205 3.825 -7.690 -15.106 1.00 12.06 N ATOM 1632 CA PRO A 205 5.238 -7.798 -15.521 1.00 13.18 C ATOM 1633 C PRO A 205 5.989 -8.738 -14.556 1.00 11.71 C ATOM 1634 O PRO A 205 5.960 -8.583 -13.367 1.00 12.62 O ATOM 1635 CB PRO A 205 5.734 -6.337 -15.430 1.00 13.25 C ATOM 1636 CG PRO A 205 4.495 -5.546 -15.723 1.00 12.89 C ATOM 1637 CD PRO A 205 3.426 -6.269 -15.020 1.00 12.97 C ATOM 1638 N ARG A 206 6.691 -9.696 -15.204 1.00 14.49 N ATOM 1639 CA ARG A 206 7.426 -10.748 -14.492 1.00 15.03 C ATOM 1640 C ARG A 206 8.889 -10.767 -14.902 1.00 12.42 C ATOM 1641 O ARG A 206 9.222 -10.464 -16.014 1.00 15.99 O ATOM 1642 CB ARG A 206 6.867 -12.169 -14.703 1.00 15.51 C ATOM 1643 CG ARG A 206 5.406 -12.439 -14.470 1.00 15.59 C ATOM 1644 CD ARG A 206 4.817 -12.086 -13.060 1.00 13.56 C ATOM 1645 NE ARG A 206 5.276 -12.982 -12.008 1.00 12.04 N ATOM 1646 CZ ARG A 206 4.562 -13.235 -10.888 1.00 14.63 C ATOM 1647 NH1 ARG A 206 3.397 -12.700 -10.678 1.00 16.12 N ATOM 1648 NH2 ARG A 206 5.069 -13.991 -9.955 1.00 19.52 N ATOM 1649 HE ARG A 206 6.198 -13.450 -12.124 1.00 0.00 H ATOM 1650 HH12 ARG A 206 2.875 -12.917 -9.805 1.00 0.00 H ATOM 1651 HH11 ARG A 206 2.986 -12.055 -11.383 1.00 0.00 H ATOM 1652 HH22 ARG A 206 4.523 -14.188 -9.092 1.00 0.00 H ATOM 1653 HH21 ARG A 206 6.019 -14.397 -10.074 1.00 0.00 H ATOM 1654 H ARG A 206 6.710 -9.687 -16.244 1.00 0.00 H ATOM 1655 N CYS A 207 9.683 -11.186 -13.904 1.00 13.74 N ATOM 1656 CA CYS A 207 11.049 -11.316 -14.100 1.00 14.36 C ATOM 1657 C CYS A 207 11.378 -12.331 -15.218 1.00 14.36 C ATOM 1658 O CYS A 207 10.879 -13.409 -15.136 1.00 19.61 O ATOM 1659 CB CYS A 207 11.731 -11.732 -12.777 1.00 16.67 C ATOM 1660 SG CYS A 207 13.506 -11.708 -12.721 1.00 14.45 S ATOM 1661 H CYS A 207 9.270 -11.415 -12.977 1.00 0.00 H ATOM 1662 N GLU A 208 12.288 -11.988 -16.062 1.00 16.79 N ATOM 1663 CA GLU A 208 12.672 -12.969 -17.154 1.00 18.80 C ATOM 1664 C GLU A 208 13.906 -13.668 -16.842 1.00 17.44 C ATOM 1665 O GLU A 208 14.333 -14.469 -17.660 1.00 23.04 O ATOM 1666 CB GLU A 208 12.768 -12.204 -18.520 1.00 22.97 C ATOM 1667 CG GLU A 208 11.487 -11.555 -18.973 1.00 26.83 C ATOM 1668 CD GLU A 208 11.381 -10.996 -20.325 1.00 36.53 C ATOM 1669 OE1 GLU A 208 12.320 -10.687 -21.014 1.00 45.03 O ATOM 1670 OE2 GLU A 208 10.264 -10.708 -20.691 1.00 57.67 O ATOM 1671 H GLU A 208 12.750 -11.058 -15.997 1.00 0.00 H ATOM 1672 N GLU A 209 14.463 -13.517 -15.630 1.00 18.67 N ATOM 1673 CA GLU A 209 15.627 -14.310 -15.306 1.00 19.61 C ATOM 1674 C GLU A 209 15.254 -15.756 -15.194 1.00 16.82 C ATOM 1675 O GLU A 209 14.114 -16.065 -14.595 1.00 19.71 O ATOM 1676 CB GLU A 209 16.278 -13.855 -14.010 1.00 18.92 C ATOM 1677 CG GLU A 209 16.804 -12.454 -14.112 1.00 21.39 C ATOM 1678 CD GLU A 209 17.996 -12.219 -14.937 1.00 33.30 C ATOM 1679 OE1 GLU A 209 18.827 -13.111 -14.996 1.00 38.06 O ATOM 1680 OE2 GLU A 209 18.235 -11.066 -15.274 1.00 36.96 O ATOM 1681 H GLU A 209 14.067 -12.846 -14.941 1.00 0.00 H ATOM 1682 N ALA A 210 16.082 -16.706 -15.629 1.00 18.93 N ATOM 1683 CA ALA A 210 15.702 -18.134 -15.688 1.00 22.69 C ATOM 1684 C ALA A 210 15.311 -18.575 -14.267 1.00 18.20 C ATOM 1685 O ALA A 210 16.059 -18.416 -13.289 1.00 20.89 O ATOM 1686 CB ALA A 210 16.928 -18.813 -16.173 1.00 25.93 C ATOM 1687 H ALA A 210 17.036 -16.431 -15.940 1.00 0.00 H ATOM 1688 N GLY A 211 14.158 -19.269 -14.222 1.00 20.31 N ATOM 1689 CA GLY A 211 13.731 -19.850 -12.909 1.00 22.40 C ATOM 1690 C GLY A 211 13.317 -18.871 -11.828 1.00 18.55 C ATOM 1691 O GLY A 211 12.963 -19.329 -10.718 1.00 18.59 O ATOM 1692 H GLY A 211 13.579 -19.398 -15.076 1.00 0.00 H ATOM 1693 N CYS A 212 13.217 -17.561 -12.160 1.00 15.75 N ATOM 1694 CA CYS A 212 12.772 -16.622 -11.153 1.00 17.48 C ATOM 1695 C CYS A 212 11.179 -16.467 -11.356 1.00 16.25 C ATOM 1696 O CYS A 212 10.461 -17.015 -10.566 1.00 27.01 O ATOM 1697 CB CYS A 212 13.509 -15.341 -11.200 1.00 18.18 C ATOM 1698 SG CYS A 212 12.817 -14.201 -9.898 1.00 16.42 S ATOM 1699 H CYS A 212 13.455 -17.237 -13.119 1.00 0.00 H ATOM 1700 N GLY A 213 10.855 -15.667 -12.364 1.00 21.34 N ATOM 1701 CA GLY A 213 9.511 -15.316 -12.628 1.00 22.38 C ATOM 1702 C GLY A 213 8.758 -14.541 -11.535 1.00 18.91 C ATOM 1703 O GLY A 213 7.488 -14.505 -11.478 1.00 22.27 O ATOM 1704 H GLY A 213 11.608 -15.289 -12.974 1.00 0.00 H ATOM 1705 N GLY A 214 9.497 -13.888 -10.679 1.00 16.19 N ATOM 1706 CA GLY A 214 8.948 -12.966 -9.748 1.00 13.87 C ATOM 1707 C GLY A 214 8.169 -11.800 -10.279 1.00 13.65 C ATOM 1708 O GLY A 214 8.382 -11.375 -11.442 1.00 14.50 O ATOM 1709 H GLY A 214 10.525 -14.049 -10.679 1.00 0.00 H ATOM 1710 N LEU A 215 7.249 -11.308 -9.508 1.00 15.93 N ATOM 1711 CA LEU A 215 6.552 -10.096 -9.870 1.00 12.05 C ATOM 1712 C LEU A 215 7.448 -8.844 -9.860 1.00 10.81 C ATOM 1713 O LEU A 215 8.162 -8.637 -8.863 1.00 12.15 O ATOM 1714 CB LEU A 215 5.379 -9.888 -8.921 1.00 12.59 C ATOM 1715 CG LEU A 215 4.528 -8.666 -9.124 1.00 12.45 C ATOM 1716 CD1 LEU A 215 3.823 -8.654 -10.456 1.00 12.82 C ATOM 1717 CD2 LEU A 215 3.567 -8.564 -7.968 1.00 13.64 C ATOM 1718 H LEU A 215 7.011 -11.792 -8.619 1.00 0.00 H ATOM 1719 N LEU A 216 7.489 -8.164 -11.001 1.00 11.62 N ATOM 1720 CA LEU A 216 8.194 -6.885 -10.994 1.00 11.78 C ATOM 1721 C LEU A 216 7.450 -5.791 -10.325 1.00 10.78 C ATOM 1722 O LEU A 216 6.218 -5.762 -10.421 1.00 12.00 O ATOM 1723 CB LEU A 216 8.605 -6.504 -12.436 1.00 10.64 C ATOM 1724 CG LEU A 216 9.368 -7.585 -13.209 1.00 12.13 C ATOM 1725 CD1 LEU A 216 9.712 -7.099 -14.600 1.00 14.65 C ATOM 1726 CD2 LEU A 216 10.636 -7.946 -12.493 1.00 13.35 C ATOM 1727 H LEU A 216 7.037 -8.528 -11.864 1.00 0.00 H ATOM 1728 N ARG A 217 8.185 -4.786 -9.798 1.00 11.25 N ATOM 1729 CA ARG A 217 7.666 -3.467 -9.433 1.00 10.73 C ATOM 1730 C ARG A 217 8.502 -2.458 -10.178 1.00 12.32 C ATOM 1731 O ARG A 217 9.560 -2.688 -10.638 1.00 11.33 O ATOM 1732 CB ARG A 217 7.808 -3.233 -7.953 1.00 10.67 C ATOM 1733 CG ARG A 217 9.136 -3.357 -7.404 1.00 12.04 C ATOM 1734 CD ARG A 217 9.296 -2.975 -5.971 1.00 11.92 C ATOM 1735 NE ARG A 217 9.266 -1.504 -5.877 1.00 9.83 N ATOM 1736 CZ ARG A 217 9.231 -0.863 -4.714 1.00 9.54 C ATOM 1737 NH1 ARG A 217 9.325 0.439 -4.704 1.00 10.49 N ATOM 1738 NH2 ARG A 217 9.098 -1.508 -3.587 1.00 13.18 N ATOM 1739 HE ARG A 217 9.272 -0.947 -6.755 1.00 0.00 H ATOM 1740 HH12 ARG A 217 9.299 0.955 -3.802 1.00 0.00 H ATOM 1741 HH11 ARG A 217 9.426 0.960 -5.598 1.00 0.00 H ATOM 1742 HH22 ARG A 217 9.073 -0.985 -2.688 1.00 0.00 H ATOM 1743 HH21 ARG A 217 9.017 -2.545 -3.588 1.00 0.00 H ATOM 1744 H ARG A 217 9.197 -4.964 -9.640 1.00 0.00 H ATOM 1745 N PRO A 218 7.939 -1.225 -10.349 1.00 10.60 N ATOM 1746 CA PRO A 218 8.772 -0.096 -10.771 1.00 10.16 C ATOM 1747 C PRO A 218 9.892 0.182 -9.748 1.00 7.96 C ATOM 1748 O PRO A 218 9.686 0.065 -8.530 1.00 9.83 O ATOM 1749 CB PRO A 218 7.828 1.064 -10.841 1.00 10.72 C ATOM 1750 CG PRO A 218 6.738 0.741 -9.921 1.00 13.93 C ATOM 1751 CD PRO A 218 6.535 -0.775 -10.007 1.00 11.19 C ATOM 1752 N HIS A 219 11.074 0.420 -10.312 1.00 8.69 N ATOM 1753 CA HIS A 219 12.224 0.718 -9.459 1.00 10.00 C ATOM 1754 C HIS A 219 12.222 2.252 -9.149 1.00 9.84 C ATOM 1755 O HIS A 219 12.997 3.046 -9.638 1.00 10.79 O ATOM 1756 CB HIS A 219 13.533 0.345 -10.141 1.00 12.93 C ATOM 1757 CG HIS A 219 14.736 0.458 -9.326 1.00 11.54 C ATOM 1758 ND1 HIS A 219 14.912 -0.213 -8.153 1.00 13.67 N ATOM 1759 CD2 HIS A 219 15.836 1.141 -9.588 1.00 15.59 C ATOM 1760 CE1 HIS A 219 16.104 0.130 -7.695 1.00 15.08 C ATOM 1761 NE2 HIS A 219 16.684 0.997 -8.517 1.00 17.72 N ATOM 1762 H HIS A 219 11.178 0.394 -11.346 1.00 0.00 H ATOM 1763 N VAL A 220 11.233 2.522 -8.256 1.00 8.22 N ATOM 1764 CA VAL A 220 10.995 3.882 -7.802 1.00 8.44 C ATOM 1765 C VAL A 220 10.942 3.831 -6.272 1.00 8.56 C ATOM 1766 O VAL A 220 10.512 2.750 -5.742 1.00 11.70 O ATOM 1767 CB VAL A 220 9.822 4.560 -8.382 1.00 10.97 C ATOM 1768 CG1 VAL A 220 9.937 4.698 -9.903 1.00 10.74 C ATOM 1769 CG2 VAL A 220 8.493 3.879 -8.045 1.00 14.48 C ATOM 1770 H VAL A 220 10.641 1.747 -7.894 1.00 0.00 H ATOM 1771 N VAL A 221 11.181 4.922 -5.618 1.00 9.59 N ATOM 1772 CA VAL A 221 10.939 5.008 -4.169 1.00 7.37 C ATOM 1773 C VAL A 221 9.509 5.264 -3.856 1.00 8.97 C ATOM 1774 O VAL A 221 8.999 6.357 -4.343 1.00 11.98 O ATOM 1775 CB VAL A 221 11.792 5.987 -3.437 1.00 8.82 C ATOM 1776 CG1 VAL A 221 11.554 6.081 -1.951 1.00 11.05 C ATOM 1777 CG2 VAL A 221 13.282 5.691 -3.704 1.00 9.69 C ATOM 1778 H VAL A 221 11.550 5.752 -6.125 1.00 0.00 H ATOM 1779 N TRP A 222 8.742 4.423 -3.194 1.00 10.40 N ATOM 1780 CA TRP A 222 7.377 4.716 -2.878 1.00 10.38 C ATOM 1781 C TRP A 222 7.265 5.553 -1.608 1.00 9.44 C ATOM 1782 O TRP A 222 8.182 5.557 -0.790 1.00 11.01 O ATOM 1783 CB TRP A 222 6.546 3.417 -2.809 1.00 8.44 C ATOM 1784 CG TRP A 222 6.208 2.889 -4.113 1.00 10.10 C ATOM 1785 CD1 TRP A 222 6.018 3.503 -5.272 1.00 12.16 C ATOM 1786 CD2 TRP A 222 5.998 1.497 -4.402 1.00 10.51 C ATOM 1787 NE1 TRP A 222 5.634 2.657 -6.262 1.00 12.37 N ATOM 1788 CE2 TRP A 222 5.645 1.400 -5.752 1.00 12.82 C ATOM 1789 CE3 TRP A 222 6.018 0.275 -3.663 1.00 14.87 C ATOM 1790 CZ2 TRP A 222 5.387 0.145 -6.379 1.00 12.81 C ATOM 1791 CZ3 TRP A 222 5.832 -0.866 -4.270 1.00 14.31 C ATOM 1792 CH2 TRP A 222 5.508 -0.934 -5.586 1.00 15.14 C ATOM 1793 HE1 TRP A 222 5.378 2.924 -7.234 1.00 0.00 H ATOM 1794 H TRP A 222 9.143 3.513 -2.890 1.00 0.00 H ATOM 1795 N PHE A 223 6.094 6.191 -1.383 1.00 10.15 N ATOM 1796 CA PHE A 223 5.889 6.864 -0.089 1.00 12.55 C ATOM 1797 C PHE A 223 5.898 5.776 0.933 1.00 11.03 C ATOM 1798 O PHE A 223 5.304 4.668 0.837 1.00 14.88 O ATOM 1799 CB PHE A 223 4.554 7.583 -0.097 1.00 13.32 C ATOM 1800 CG PHE A 223 4.582 8.780 -1.037 1.00 14.04 C ATOM 1801 CD1 PHE A 223 5.000 10.017 -0.556 1.00 17.55 C ATOM 1802 CD2 PHE A 223 4.171 8.679 -2.375 1.00 16.33 C ATOM 1803 CE1 PHE A 223 5.042 11.144 -1.383 1.00 18.26 C ATOM 1804 CE2 PHE A 223 4.257 9.798 -3.166 1.00 18.01 C ATOM 1805 CZ PHE A 223 4.727 11.044 -2.752 1.00 16.54 C ATOM 1806 H PHE A 223 5.351 6.206 -2.111 1.00 0.00 H ATOM 1807 N GLY A 224 6.606 6.142 2.061 1.00 11.01 N ATOM 1808 CA GLY A 224 6.828 5.229 3.116 1.00 13.59 C ATOM 1809 C GLY A 224 8.053 4.323 3.007 1.00 13.98 C ATOM 1810 O GLY A 224 8.288 3.510 3.944 1.00 15.16 O ATOM 1811 H GLY A 224 6.983 7.108 2.135 1.00 0.00 H ATOM 1812 N GLU A 225 8.764 4.397 1.919 1.00 11.87 N ATOM 1813 CA GLU A 225 9.991 3.629 1.711 1.00 10.56 C ATOM 1814 C GLU A 225 11.185 4.536 1.802 1.00 10.95 C ATOM 1815 O GLU A 225 11.158 5.722 1.400 1.00 11.43 O ATOM 1816 CB GLU A 225 10.001 3.016 0.329 1.00 11.60 C ATOM 1817 CG GLU A 225 8.991 1.949 0.176 1.00 12.33 C ATOM 1818 CD GLU A 225 9.065 1.274 -1.167 1.00 14.52 C ATOM 1819 OE1 GLU A 225 8.675 0.042 -1.213 1.00 14.88 O ATOM 1820 OE2 GLU A 225 9.540 1.814 -2.164 1.00 12.16 O ATOM 1821 H GLU A 225 8.444 5.033 1.161 1.00 0.00 H ATOM 1822 N ASN A 226 12.263 4.099 2.485 1.00 12.82 N ATOM 1823 CA ASN A 226 13.478 4.975 2.513 1.00 12.56 C ATOM 1824 C ASN A 226 14.165 5.054 1.149 1.00 10.41 C ATOM 1825 O ASN A 226 13.991 4.121 0.304 1.00 12.25 O ATOM 1826 CB ASN A 226 14.419 4.539 3.644 1.00 13.72 C ATOM 1827 CG ASN A 226 15.290 5.610 4.165 1.00 14.32 C ATOM 1828 OD1 ASN A 226 15.158 6.779 3.723 1.00 16.06 O ATOM 1829 ND2 ASN A 226 16.047 5.305 5.247 1.00 18.70 N ATOM 1830 HD22 ASN A 226 16.120 4.319 5.569 1.00 0.00 H ATOM 1831 HD21 ASN A 226 16.555 6.057 5.755 1.00 0.00 H ATOM 1832 H ASN A 226 12.251 3.183 2.977 1.00 0.00 H ATOM 1833 N LEU A 227 14.906 6.129 1.008 1.00 11.22 N ATOM 1834 CA LEU A 227 15.839 6.192 -0.078 1.00 12.03 C ATOM 1835 C LEU A 227 16.956 5.113 0.069 1.00 12.45 C ATOM 1836 O LEU A 227 17.237 4.742 1.253 1.00 14.05 O ATOM 1837 CB LEU A 227 16.380 7.593 -0.288 1.00 13.00 C ATOM 1838 CG LEU A 227 15.478 8.578 -0.945 1.00 14.83 C ATOM 1839 CD1 LEU A 227 14.127 8.832 -0.229 1.00 14.30 C ATOM 1840 CD2 LEU A 227 16.164 9.943 -1.117 1.00 15.25 C ATOM 1841 H LEU A 227 14.817 6.923 1.674 1.00 0.00 H ATOM 1842 N ASP A 228 17.635 4.849 -1.022 1.00 11.16 N ATOM 1843 CA ASP A 228 18.796 4.002 -0.945 1.00 10.24 C ATOM 1844 C ASP A 228 19.913 4.617 -0.115 1.00 11.96 C ATOM 1845 O ASP A 228 20.230 5.808 -0.316 1.00 12.75 O ATOM 1846 CB ASP A 228 19.292 3.775 -2.407 1.00 14.74 C ATOM 1847 CG ASP A 228 20.510 2.883 -2.520 1.00 21.02 C ATOM 1848 OD1 ASP A 228 21.267 2.635 -1.673 1.00 24.75 O ATOM 1849 OD2 ASP A 228 20.618 2.279 -3.512 1.00 48.57 O ATOM 1850 H ASP A 228 17.337 5.248 -1.935 1.00 0.00 H ATOM 1851 N PRO A 229 20.524 3.928 0.844 1.00 15.84 N ATOM 1852 CA PRO A 229 21.593 4.497 1.573 1.00 16.55 C ATOM 1853 C PRO A 229 22.757 5.060 0.817 1.00 13.86 C ATOM 1854 O PRO A 229 23.336 6.093 1.198 1.00 15.72 O ATOM 1855 CB PRO A 229 21.999 3.442 2.612 1.00 22.80 C ATOM 1856 CG PRO A 229 21.047 2.367 2.415 1.00 27.55 C ATOM 1857 CD PRO A 229 20.197 2.529 1.264 1.00 17.57 C ATOM 1858 N ALA A 230 23.066 4.440 -0.296 1.00 14.99 N ATOM 1859 CA ALA A 230 24.160 4.894 -1.121 1.00 14.90 C ATOM 1860 C ALA A 230 23.791 6.286 -1.729 1.00 12.85 C ATOM 1861 O ALA A 230 24.649 7.095 -1.939 1.00 14.07 O ATOM 1862 CB ALA A 230 24.506 3.884 -2.186 1.00 18.87 C ATOM 1863 H ALA A 230 22.515 3.608 -0.589 1.00 0.00 H ATOM 1864 N ILE A 231 22.520 6.406 -2.133 1.00 12.72 N ATOM 1865 CA ILE A 231 22.023 7.687 -2.630 1.00 12.34 C ATOM 1866 C ILE A 231 22.078 8.730 -1.593 1.00 10.66 C ATOM 1867 O ILE A 231 22.512 9.889 -1.865 1.00 12.25 O ATOM 1868 CB ILE A 231 20.611 7.500 -3.235 1.00 14.76 C ATOM 1869 CG1 ILE A 231 20.693 6.731 -4.592 1.00 19.32 C ATOM 1870 CG2 ILE A 231 19.895 8.813 -3.429 1.00 18.56 C ATOM 1871 CD1 ILE A 231 20.890 7.663 -5.765 1.00 24.89 C ATOM 1872 H ILE A 231 21.884 5.584 -2.093 1.00 0.00 H ATOM 1873 N LEU A 232 21.642 8.394 -0.369 1.00 12.57 N ATOM 1874 CA LEU A 232 21.708 9.433 0.707 1.00 15.30 C ATOM 1875 C LEU A 232 23.171 9.871 0.856 1.00 10.86 C ATOM 1876 O LEU A 232 23.426 11.059 1.079 1.00 12.02 O ATOM 1877 CB LEU A 232 21.117 8.893 2.033 1.00 15.99 C ATOM 1878 CG LEU A 232 19.676 8.558 1.986 1.00 16.49 C ATOM 1879 CD1 LEU A 232 19.372 7.713 3.285 1.00 22.56 C ATOM 1880 CD2 LEU A 232 18.854 9.809 1.861 1.00 20.44 C ATOM 1881 H LEU A 232 21.270 7.442 -0.174 1.00 0.00 H ATOM 1882 N GLU A 233 24.110 8.925 0.862 1.00 11.66 N ATOM 1883 CA GLU A 233 25.490 9.315 1.002 1.00 12.37 C ATOM 1884 C GLU A 233 26.002 10.195 -0.097 1.00 9.74 C ATOM 1885 O GLU A 233 26.757 11.147 0.147 1.00 13.02 O ATOM 1886 CB GLU A 233 26.396 8.125 1.169 1.00 14.13 C ATOM 1887 CG GLU A 233 26.165 7.185 2.331 1.00 20.44 C ATOM 1888 CD GLU A 233 27.206 6.177 2.536 1.00 28.39 C ATOM 1889 OE1 GLU A 233 27.294 5.618 3.666 1.00 35.05 O ATOM 1890 OE2 GLU A 233 27.811 5.830 1.604 1.00 43.65 O ATOM 1891 H GLU A 233 23.851 7.922 0.767 1.00 0.00 H ATOM 1892 N GLU A 234 25.585 9.920 -1.288 1.00 10.26 N ATOM 1893 CA GLU A 234 26.023 10.735 -2.443 1.00 12.56 C ATOM 1894 C GLU A 234 25.455 12.094 -2.337 1.00 11.90 C ATOM 1895 O GLU A 234 26.215 13.106 -2.614 1.00 13.18 O ATOM 1896 CB GLU A 234 25.528 10.068 -3.746 1.00 14.19 C ATOM 1897 CG GLU A 234 26.237 8.831 -4.187 1.00 16.31 C ATOM 1898 CD GLU A 234 25.688 8.436 -5.568 1.00 28.58 C ATOM 1899 OE1 GLU A 234 26.003 8.973 -6.632 1.00 35.83 O ATOM 1900 OE2 GLU A 234 24.836 7.595 -5.487 1.00 37.30 O ATOM 1901 H GLU A 234 24.937 9.120 -1.436 1.00 0.00 H ATOM 1902 N VAL A 235 24.161 12.223 -1.999 1.00 10.55 N ATOM 1903 CA VAL A 235 23.618 13.538 -1.833 1.00 10.63 C ATOM 1904 C VAL A 235 24.404 14.305 -0.774 1.00 10.55 C ATOM 1905 O VAL A 235 24.685 15.512 -0.900 1.00 11.86 O ATOM 1906 CB VAL A 235 22.073 13.435 -1.437 1.00 10.72 C ATOM 1907 CG1 VAL A 235 21.581 14.807 -1.021 1.00 12.16 C ATOM 1908 CG2 VAL A 235 21.282 12.944 -2.616 1.00 12.80 C ATOM 1909 H VAL A 235 23.564 11.383 -1.860 1.00 0.00 H ATOM 1910 N ASP A 236 24.591 13.660 0.386 1.00 13.41 N ATOM 1911 CA ASP A 236 25.234 14.302 1.549 1.00 14.22 C ATOM 1912 C ASP A 236 26.611 14.868 1.025 1.00 11.94 C ATOM 1913 O ASP A 236 26.950 16.025 1.396 1.00 12.45 O ATOM 1914 CB ASP A 236 25.432 13.214 2.624 1.00 13.82 C ATOM 1915 CG ASP A 236 25.738 13.659 3.990 1.00 19.72 C ATOM 1916 OD1 ASP A 236 25.855 14.874 4.184 1.00 26.85 O ATOM 1917 OD2 ASP A 236 25.867 12.753 4.873 1.00 22.88 O ATOM 1918 H ASP A 236 24.272 12.674 0.469 1.00 0.00 H ATOM 1919 N ARG A 237 27.379 14.086 0.330 1.00 12.57 N ATOM 1920 CA ARG A 237 28.677 14.600 -0.131 1.00 12.50 C ATOM 1921 C ARG A 237 28.533 15.864 -1.027 1.00 12.80 C ATOM 1922 O ARG A 237 29.270 16.833 -0.849 1.00 14.28 O ATOM 1923 CB ARG A 237 29.412 13.545 -0.877 1.00 13.54 C ATOM 1924 CG ARG A 237 30.810 14.019 -1.361 1.00 18.20 C ATOM 1925 CD ARG A 237 31.429 13.033 -2.325 1.00 22.03 C ATOM 1926 NE ARG A 237 30.646 13.045 -3.641 1.00 30.53 N ATOM 1927 CZ ARG A 237 30.655 12.142 -4.582 1.00 25.56 C ATOM 1928 NH1 ARG A 237 31.507 11.206 -4.518 1.00 44.07 N ATOM 1929 NH2 ARG A 237 30.054 12.266 -5.780 1.00 34.50 N ATOM 1930 HE ARG A 237 30.035 13.871 -3.804 1.00 0.00 H ATOM 1931 HH12 ARG A 237 31.533 10.475 -5.257 1.00 0.00 H ATOM 1932 HH11 ARG A 237 32.180 11.169 -3.726 1.00 0.00 H ATOM 1933 HH22 ARG A 237 30.112 11.493 -6.473 1.00 0.00 H ATOM 1934 HH21 ARG A 237 29.531 13.135 -6.012 1.00 0.00 H ATOM 1935 H ARG A 237 27.082 13.115 0.104 1.00 0.00 H ATOM 1936 N GLU A 238 27.612 15.804 -1.959 1.00 11.09 N ATOM 1937 CA GLU A 238 27.382 16.954 -2.794 1.00 14.26 C ATOM 1938 C GLU A 238 26.953 18.174 -2.060 1.00 13.28 C ATOM 1939 O GLU A 238 27.493 19.274 -2.309 1.00 14.51 O ATOM 1940 CB GLU A 238 26.400 16.605 -3.940 1.00 13.07 C ATOM 1941 CG GLU A 238 26.891 15.533 -4.839 1.00 12.85 C ATOM 1942 CD GLU A 238 28.108 15.777 -5.667 1.00 17.80 C ATOM 1943 OE1 GLU A 238 28.419 16.792 -6.037 1.00 24.98 O ATOM 1944 OE2 GLU A 238 28.703 14.706 -5.900 1.00 33.97 O ATOM 1945 H GLU A 238 27.055 14.936 -2.093 1.00 0.00 H ATOM 1946 N LEU A 239 26.010 18.040 -1.154 1.00 12.17 N ATOM 1947 CA LEU A 239 25.538 19.251 -0.497 1.00 15.39 C ATOM 1948 C LEU A 239 26.632 19.830 0.387 1.00 17.55 C ATOM 1949 O LEU A 239 26.642 21.071 0.577 1.00 17.86 O ATOM 1950 CB LEU A 239 24.348 18.888 0.348 1.00 14.26 C ATOM 1951 CG LEU A 239 23.093 18.327 -0.348 1.00 14.19 C ATOM 1952 CD1 LEU A 239 21.982 18.068 0.717 1.00 17.42 C ATOM 1953 CD2 LEU A 239 22.564 19.188 -1.386 1.00 14.09 C ATOM 1954 H LEU A 239 25.617 17.107 -0.916 1.00 0.00 H ATOM 1955 N ALA A 240 27.442 18.986 1.004 1.00 14.44 N ATOM 1956 CA ALA A 240 28.468 19.468 1.886 1.00 18.66 C ATOM 1957 C ALA A 240 29.609 20.180 1.186 1.00 20.01 C ATOM 1958 O ALA A 240 30.288 20.953 1.834 1.00 22.33 O ATOM 1959 CB ALA A 240 29.107 18.298 2.677 1.00 17.76 C ATOM 1960 H ALA A 240 27.335 17.963 0.849 1.00 0.00 H ATOM 1961 N HIS A 241 29.809 19.896 -0.118 1.00 14.58 N ATOM 1962 CA HIS A 241 30.875 20.431 -0.866 1.00 19.90 C ATOM 1963 C HIS A 241 30.448 21.622 -1.794 1.00 16.36 C ATOM 1964 O HIS A 241 31.318 22.313 -2.313 1.00 22.07 O ATOM 1965 CB HIS A 241 31.580 19.340 -1.628 1.00 26.03 C ATOM 1966 CG HIS A 241 32.416 18.489 -0.732 1.00 40.63 C ATOM 1967 ND1 HIS A 241 31.934 17.381 -0.107 1.00 38.53 N ATOM 1968 CD2 HIS A 241 33.633 18.723 -0.178 1.00 55.32 C ATOM 1969 CE1 HIS A 241 32.863 16.850 0.667 1.00 57.16 C ATOM 1970 NE2 HIS A 241 33.886 17.675 0.678 1.00 69.82 N ATOM 1971 H HIS A 241 29.145 19.252 -0.593 1.00 0.00 H ATOM 1972 N CYS A 242 29.198 21.775 -2.057 1.00 15.05 N ATOM 1973 CA CYS A 242 28.789 22.736 -3.000 1.00 15.85 C ATOM 1974 C CYS A 242 29.031 24.174 -2.526 1.00 17.03 C ATOM 1975 O CYS A 242 29.030 24.480 -1.294 1.00 17.47 O ATOM 1976 CB CYS A 242 27.375 22.573 -3.556 1.00 11.76 C ATOM 1977 SG CYS A 242 26.141 23.055 -2.311 1.00 10.76 S ATOM 1978 H CYS A 242 28.489 21.188 -1.572 1.00 0.00 H ATOM 1979 N ASP A 243 29.186 25.059 -3.519 1.00 14.61 N ATOM 1980 CA ASP A 243 29.299 26.514 -3.185 1.00 14.43 C ATOM 1981 C ASP A 243 28.159 27.330 -3.798 1.00 14.23 C ATOM 1982 O ASP A 243 28.158 28.578 -3.573 1.00 16.60 O ATOM 1983 CB ASP A 243 30.688 27.000 -3.542 1.00 14.99 C ATOM 1984 CG ASP A 243 31.062 26.881 -4.978 1.00 17.23 C ATOM 1985 OD1 ASP A 243 30.229 26.413 -5.790 1.00 16.88 O ATOM 1986 OD2 ASP A 243 32.213 27.322 -5.296 1.00 21.38 O ATOM 1987 H ASP A 243 29.227 24.740 -4.508 1.00 0.00 H ATOM 1988 N LEU A 244 27.210 26.714 -4.452 1.00 14.57 N ATOM 1989 CA LEU A 244 26.071 27.380 -4.992 1.00 12.48 C ATOM 1990 C LEU A 244 24.991 26.302 -5.269 1.00 12.72 C ATOM 1991 O LEU A 244 25.369 25.246 -5.757 1.00 15.78 O ATOM 1992 CB LEU A 244 26.356 28.134 -6.301 1.00 16.58 C ATOM 1993 CG LEU A 244 25.222 28.935 -6.951 1.00 15.79 C ATOM 1994 CD1 LEU A 244 24.657 29.986 -6.082 1.00 17.63 C ATOM 1995 CD2 LEU A 244 25.760 29.490 -8.346 1.00 18.47 C ATOM 1996 H LEU A 244 27.290 25.686 -4.585 1.00 0.00 H ATOM 1997 N CYS A 245 23.727 26.583 -4.905 1.00 12.63 N ATOM 1998 CA CYS A 245 22.711 25.587 -5.071 1.00 12.45 C ATOM 1999 C CYS A 245 21.520 26.240 -5.766 1.00 9.47 C ATOM 2000 O CYS A 245 21.143 27.414 -5.441 1.00 12.97 O ATOM 2001 CB CYS A 245 22.393 25.005 -3.712 1.00 13.49 C ATOM 2002 SG CYS A 245 20.949 23.899 -3.694 1.00 15.13 S ATOM 2003 H CYS A 245 23.490 27.514 -4.507 1.00 0.00 H ATOM 2004 N LEU A 246 20.893 25.622 -6.736 1.00 10.10 N ATOM 2005 CA LEU A 246 19.661 25.942 -7.326 1.00 11.38 C ATOM 2006 C LEU A 246 18.611 24.934 -6.980 1.00 10.10 C ATOM 2007 O LEU A 246 18.906 23.750 -7.030 1.00 12.79 O ATOM 2008 CB LEU A 246 19.811 26.004 -8.848 1.00 11.03 C ATOM 2009 CG LEU A 246 20.614 27.093 -9.414 1.00 17.91 C ATOM 2010 CD1 LEU A 246 21.983 27.154 -9.153 1.00 19.44 C ATOM 2011 CD2 LEU A 246 20.429 27.173 -10.914 1.00 18.57 C ATOM 2012 H LEU A 246 21.372 24.783 -7.120 1.00 0.00 H ATOM 2013 N VAL A 247 17.406 25.365 -6.738 1.00 9.54 N ATOM 2014 CA VAL A 247 16.304 24.519 -6.317 1.00 9.71 C ATOM 2015 C VAL A 247 15.154 24.800 -7.294 1.00 8.52 C ATOM 2016 O VAL A 247 14.570 25.951 -7.232 1.00 11.88 O ATOM 2017 CB VAL A 247 15.970 24.576 -4.805 1.00 13.97 C ATOM 2018 CG1 VAL A 247 15.711 25.830 -4.253 1.00 16.98 C ATOM 2019 CG2 VAL A 247 14.910 23.536 -4.515 1.00 15.98 C ATOM 2020 H VAL A 247 17.221 26.382 -6.854 1.00 0.00 H ATOM 2021 N VAL A 248 14.928 23.934 -8.269 1.00 11.08 N ATOM 2022 CA VAL A 248 14.193 24.238 -9.444 1.00 9.66 C ATOM 2023 C VAL A 248 12.936 23.442 -9.579 1.00 9.44 C ATOM 2024 O VAL A 248 13.000 22.183 -9.574 1.00 10.13 O ATOM 2025 CB VAL A 248 15.033 23.910 -10.666 1.00 8.35 C ATOM 2026 CG1 VAL A 248 14.240 24.213 -11.971 1.00 6.84 C ATOM 2027 CG2 VAL A 248 16.386 24.614 -10.650 1.00 10.30 C ATOM 2028 H VAL A 248 15.312 22.973 -8.168 1.00 0.00 H ATOM 2029 N GLY A 249 11.787 24.065 -9.715 1.00 10.80 N ATOM 2030 CA GLY A 249 10.575 23.383 -9.995 1.00 10.13 C ATOM 2031 C GLY A 249 10.130 22.385 -8.948 1.00 9.41 C ATOM 2032 O GLY A 249 9.610 21.313 -9.300 1.00 11.36 O ATOM 2033 H GLY A 249 11.765 25.100 -9.613 1.00 0.00 H ATOM 2034 N THR A 250 10.354 22.668 -7.677 1.00 9.95 N ATOM 2035 CA THR A 250 9.915 21.783 -6.675 1.00 10.81 C ATOM 2036 C THR A 250 9.156 22.415 -5.555 1.00 10.83 C ATOM 2037 O THR A 250 9.329 23.597 -5.258 1.00 11.58 O ATOM 2038 CB THR A 250 11.046 20.894 -6.057 1.00 11.77 C ATOM 2039 OG1 THR A 250 10.526 19.984 -5.056 1.00 12.91 O ATOM 2040 CG2 THR A 250 12.084 21.694 -5.403 1.00 12.18 C ATOM 2041 HG1 THR A 250 9.853 19.389 -5.471 1.00 0.00 H ATOM 2042 H THR A 250 10.853 23.543 -7.418 1.00 0.00 H ATOM 2043 N SER A 251 8.115 21.776 -5.069 1.00 12.71 N ATOM 2044 CA SER A 251 7.207 22.337 -4.087 1.00 13.90 C ATOM 2045 C SER A 251 7.818 22.287 -2.670 1.00 12.74 C ATOM 2046 O SER A 251 7.282 22.936 -1.753 1.00 12.29 O ATOM 2047 CB SER A 251 5.927 21.553 -4.046 1.00 13.05 C ATOM 2048 OG SER A 251 6.104 20.135 -3.918 1.00 14.09 O ATOM 2049 HG SER A 251 6.625 19.798 -4.689 1.00 0.00 H ATOM 2050 H SER A 251 7.932 20.810 -5.409 1.00 0.00 H ATOM 2051 N SER A 252 8.946 21.547 -2.533 1.00 11.50 N ATOM 2052 CA SER A 252 9.579 21.538 -1.241 1.00 12.89 C ATOM 2053 C SER A 252 8.690 21.106 -0.087 1.00 16.07 C ATOM 2054 O SER A 252 8.854 21.594 1.033 1.00 19.09 O ATOM 2055 CB SER A 252 10.397 22.822 -0.976 1.00 16.35 C ATOM 2056 OG SER A 252 11.519 22.953 -1.876 1.00 16.34 O ATOM 2057 HG SER A 252 11.190 22.986 -2.809 1.00 0.00 H ATOM 2058 H SER A 252 9.338 21.007 -3.331 1.00 0.00 H ATOM 2059 N VAL A 253 7.873 20.068 -0.355 1.00 14.84 N ATOM 2060 CA VAL A 253 6.920 19.412 0.585 1.00 16.20 C ATOM 2061 C VAL A 253 7.397 17.976 0.873 1.00 13.94 C ATOM 2062 O VAL A 253 7.174 17.551 1.994 1.00 16.66 O ATOM 2063 CB VAL A 253 5.502 19.320 -0.169 1.00 17.87 C ATOM 2064 CG1 VAL A 253 4.588 18.423 0.420 1.00 24.77 C ATOM 2065 CG2 VAL A 253 4.939 20.777 -0.221 1.00 31.11 C ATOM 2066 H VAL A 253 7.912 19.684 -1.321 1.00 0.00 H ATOM 2067 N VAL A 254 8.032 17.235 -0.028 1.00 13.96 N ATOM 2068 CA VAL A 254 8.366 15.843 0.187 1.00 12.08 C ATOM 2069 C VAL A 254 9.712 15.671 0.767 1.00 10.81 C ATOM 2070 O VAL A 254 10.687 16.264 0.266 1.00 11.47 O ATOM 2071 CB VAL A 254 8.184 15.026 -1.131 1.00 13.34 C ATOM 2072 CG1 VAL A 254 8.680 13.594 -0.873 1.00 14.24 C ATOM 2073 CG2 VAL A 254 6.710 15.023 -1.461 1.00 13.01 C ATOM 2074 H VAL A 254 8.302 17.676 -0.931 1.00 0.00 H ATOM 2075 N TYR A 255 9.827 14.859 1.871 1.00 13.07 N ATOM 2076 CA TYR A 255 11.039 14.616 2.493 1.00 11.95 C ATOM 2077 C TYR A 255 11.612 13.250 2.202 1.00 12.44 C ATOM 2078 O TYR A 255 10.847 12.383 1.896 1.00 12.01 O ATOM 2079 CB TYR A 255 10.735 14.692 4.066 1.00 12.73 C ATOM 2080 CG TYR A 255 10.479 16.121 4.477 1.00 13.16 C ATOM 2081 CD1 TYR A 255 9.271 16.716 4.347 1.00 17.07 C ATOM 2082 CD2 TYR A 255 11.451 16.767 5.122 1.00 21.57 C ATOM 2083 CE1 TYR A 255 9.080 18.042 4.701 1.00 22.33 C ATOM 2084 CE2 TYR A 255 11.269 18.109 5.541 1.00 29.10 C ATOM 2085 CZ TYR A 255 10.103 18.746 5.323 1.00 25.17 C ATOM 2086 OH TYR A 255 9.950 20.022 5.745 1.00 44.02 O ATOM 2087 HH TYR A 255 10.068 20.060 6.727 1.00 0.00 H ATOM 2088 H TYR A 255 8.970 14.410 2.253 1.00 0.00 H ATOM 2089 N PRO A 256 12.941 13.112 2.295 1.00 11.68 N ATOM 2090 CA PRO A 256 13.942 14.089 2.758 1.00 13.55 C ATOM 2091 C PRO A 256 14.300 15.158 1.750 1.00 11.09 C ATOM 2092 O PRO A 256 15.030 16.016 2.137 1.00 12.40 O ATOM 2093 CB PRO A 256 15.161 13.190 3.127 1.00 13.16 C ATOM 2094 CG PRO A 256 15.003 12.011 2.200 1.00 12.85 C ATOM 2095 CD PRO A 256 13.524 11.755 2.113 1.00 13.67 C ATOM 2096 N ALA A 257 13.931 15.057 0.456 1.00 9.39 N ATOM 2097 CA ALA A 257 14.405 15.957 -0.503 1.00 10.74 C ATOM 2098 C ALA A 257 14.190 17.439 -0.155 1.00 10.75 C ATOM 2099 O ALA A 257 15.082 18.255 -0.421 1.00 11.64 O ATOM 2100 CB ALA A 257 13.775 15.700 -1.847 1.00 10.53 C ATOM 2101 H ALA A 257 13.283 14.297 0.167 1.00 0.00 H ATOM 2102 N ALA A 258 13.082 17.732 0.510 1.00 10.16 N ATOM 2103 CA ALA A 258 12.773 19.115 0.927 1.00 9.85 C ATOM 2104 C ALA A 258 13.827 19.676 1.910 1.00 11.32 C ATOM 2105 O ALA A 258 13.917 20.899 2.019 1.00 16.17 O ATOM 2106 CB ALA A 258 11.401 19.197 1.459 1.00 13.35 C ATOM 2107 H ALA A 258 12.414 16.970 0.744 1.00 0.00 H ATOM 2108 N MET A 259 14.600 18.810 2.575 1.00 13.11 N ATOM 2109 CA MET A 259 15.628 19.312 3.513 1.00 15.02 C ATOM 2110 C MET A 259 16.930 19.695 2.853 1.00 11.92 C ATOM 2111 O MET A 259 17.721 20.337 3.503 1.00 12.36 O ATOM 2112 CB MET A 259 16.003 18.331 4.628 1.00 12.44 C ATOM 2113 CG MET A 259 14.868 17.640 5.322 1.00 17.03 C ATOM 2114 SD MET A 259 15.580 15.981 5.735 1.00 19.87 S ATOM 2115 CE MET A 259 17.274 16.020 5.647 1.00 5.75 C ATOM 2116 H MET A 259 14.479 17.787 2.433 1.00 0.00 H ATOM 2117 N PHE A 260 17.132 19.290 1.585 1.00 11.21 N ATOM 2118 CA PHE A 260 18.459 19.381 0.981 1.00 10.10 C ATOM 2119 C PHE A 260 18.883 20.874 0.841 1.00 12.98 C ATOM 2120 O PHE A 260 19.948 21.258 1.337 1.00 13.44 O ATOM 2121 CB PHE A 260 18.512 18.681 -0.345 1.00 9.79 C ATOM 2122 CG PHE A 260 18.287 17.211 -0.306 1.00 11.08 C ATOM 2123 CD1 PHE A 260 18.315 16.421 0.828 1.00 13.31 C ATOM 2124 CD2 PHE A 260 18.088 16.563 -1.512 1.00 12.05 C ATOM 2125 CE1 PHE A 260 18.082 15.042 0.707 1.00 11.20 C ATOM 2126 CE2 PHE A 260 17.923 15.217 -1.653 1.00 13.37 C ATOM 2127 CZ PHE A 260 17.894 14.459 -0.559 1.00 14.84 C ATOM 2128 H PHE A 260 16.338 18.910 1.032 1.00 0.00 H ATOM 2129 N ALA A 261 18.092 21.643 0.083 1.00 10.76 N ATOM 2130 CA ALA A 261 18.489 23.063 -0.170 1.00 12.95 C ATOM 2131 C ALA A 261 18.556 23.852 1.129 1.00 11.91 C ATOM 2132 O ALA A 261 19.483 24.663 1.317 1.00 14.71 O ATOM 2133 CB ALA A 261 17.610 23.619 -1.258 1.00 12.54 C ATOM 2134 H ALA A 261 17.215 21.259 -0.324 1.00 0.00 H ATOM 2135 N PRO A 262 17.577 23.653 2.049 1.00 12.49 N ATOM 2136 CA PRO A 262 17.690 24.343 3.319 1.00 12.92 C ATOM 2137 C PRO A 262 19.004 24.083 4.028 1.00 14.11 C ATOM 2138 O PRO A 262 19.528 24.960 4.733 1.00 15.36 O ATOM 2139 CB PRO A 262 16.448 24.022 4.088 1.00 14.65 C ATOM 2140 CG PRO A 262 15.431 23.785 2.998 1.00 13.91 C ATOM 2141 CD PRO A 262 16.226 23.089 1.906 1.00 14.14 C ATOM 2142 N GLN A 263 19.466 22.807 3.980 1.00 13.22 N ATOM 2143 CA GLN A 263 20.732 22.537 4.643 1.00 14.26 C ATOM 2144 C GLN A 263 21.925 23.318 4.061 1.00 11.16 C ATOM 2145 O GLN A 263 22.822 23.751 4.840 1.00 17.82 O ATOM 2146 CB GLN A 263 21.014 21.016 4.583 1.00 17.97 C ATOM 2147 CG GLN A 263 20.475 20.153 5.463 1.00 26.02 C ATOM 2148 CD GLN A 263 21.153 18.818 5.537 1.00 29.95 C ATOM 2149 OE1 GLN A 263 20.609 18.073 6.288 1.00 28.61 O ATOM 2150 NE2 GLN A 263 22.331 18.545 4.901 1.00 26.03 N ATOM 2151 HE22 GLN A 263 22.749 19.246 4.257 1.00 0.00 H ATOM 2152 HE21 GLN A 263 22.810 17.636 5.061 1.00 0.00 H ATOM 2153 H GLN A 263 18.938 22.056 3.491 1.00 0.00 H ATOM 2154 N VAL A 264 21.930 23.443 2.746 1.00 12.70 N ATOM 2155 CA VAL A 264 22.978 24.179 2.090 1.00 14.42 C ATOM 2156 C VAL A 264 22.869 25.695 2.557 1.00 14.18 C ATOM 2157 O VAL A 264 23.873 26.369 2.944 1.00 16.57 O ATOM 2158 CB VAL A 264 22.759 24.014 0.488 1.00 13.42 C ATOM 2159 CG1 VAL A 264 23.722 24.944 -0.246 1.00 16.66 C ATOM 2160 CG2 VAL A 264 23.010 22.576 0.098 1.00 18.78 C ATOM 2161 H VAL A 264 21.173 23.007 2.182 1.00 0.00 H ATOM 2162 N ALA A 265 21.660 26.239 2.555 1.00 12.84 N ATOM 2163 CA ALA A 265 21.481 27.608 3.013 1.00 12.57 C ATOM 2164 C ALA A 265 21.890 27.851 4.466 1.00 15.84 C ATOM 2165 O ALA A 265 22.464 28.889 4.797 1.00 16.66 O ATOM 2166 CB ALA A 265 20.014 27.990 2.827 1.00 13.89 C ATOM 2167 H ALA A 265 20.841 25.688 2.227 1.00 0.00 H ATOM 2168 N ALA A 266 21.693 26.836 5.287 1.00 15.45 N ATOM 2169 CA ALA A 266 22.041 26.955 6.695 1.00 19.34 C ATOM 2170 C ALA A 266 23.565 27.100 6.925 1.00 20.76 C ATOM 2171 O ALA A 266 23.954 27.587 7.963 1.00 27.53 O ATOM 2172 CB ALA A 266 21.466 25.763 7.495 1.00 19.09 C ATOM 2173 H ALA A 266 21.288 25.949 4.926 1.00 0.00 H ATOM 2174 N ARG A 267 24.304 26.499 5.974 1.00 18.89 N ATOM 2175 CA ARG A 267 25.786 26.578 5.944 1.00 26.10 C ATOM 2176 C ARG A 267 26.262 27.958 5.521 1.00 21.17 C ATOM 2177 O ARG A 267 27.474 28.156 5.521 1.00 20.53 O ATOM 2178 CB ARG A 267 26.378 25.585 4.884 1.00 39.00 C ATOM 2179 CG ARG A 267 26.445 24.161 5.233 1.00 32.70 C ATOM 2180 CD ARG A 267 27.823 23.679 4.832 1.00 18.52 C ATOM 2181 NE ARG A 267 27.690 23.254 3.429 1.00 17.60 N ATOM 2182 CZ ARG A 267 28.411 23.719 2.380 1.00 15.59 C ATOM 2183 NH1 ARG A 267 29.458 24.576 2.454 1.00 20.43 N ATOM 2184 NH2 ARG A 267 28.087 23.383 1.126 1.00 13.18 N ATOM 2185 HE ARG A 267 26.975 22.528 3.223 1.00 0.00 H ATOM 2186 HH12 ARG A 267 29.948 24.874 1.587 1.00 0.00 H ATOM 2187 HH11 ARG A 267 29.772 24.935 3.378 1.00 0.00 H ATOM 2188 HH22 ARG A 267 28.648 23.746 0.329 1.00 0.00 H ATOM 2189 HH21 ARG A 267 27.274 22.759 0.948 1.00 0.00 H ATOM 2190 H ARG A 267 23.817 25.958 5.231 1.00 0.00 H ATOM 2191 N GLY A 268 25.337 28.798 5.015 1.00 18.34 N ATOM 2192 CA GLY A 268 25.775 30.099 4.541 1.00 17.59 C ATOM 2193 C GLY A 268 25.995 30.072 3.028 1.00 19.41 C ATOM 2194 O GLY A 268 26.396 31.079 2.435 1.00 20.94 O ATOM 2195 H GLY A 268 24.336 28.522 4.965 1.00 0.00 H ATOM 2196 N VAL A 269 25.647 29.030 2.327 1.00 15.21 N ATOM 2197 CA VAL A 269 25.807 28.933 0.855 1.00 15.00 C ATOM 2198 C VAL A 269 24.565 29.470 0.163 1.00 14.23 C ATOM 2199 O VAL A 269 23.439 29.289 0.583 1.00 14.92 O ATOM 2200 CB VAL A 269 26.046 27.467 0.422 1.00 17.78 C ATOM 2201 CG1 VAL A 269 25.970 27.280 -1.088 1.00 16.51 C ATOM 2202 CG2 VAL A 269 27.338 26.950 1.023 1.00 21.79 C ATOM 2203 H VAL A 269 25.233 28.219 2.829 1.00 0.00 H ATOM 2204 N PRO A 270 24.762 30.321 -0.885 1.00 13.80 N ATOM 2205 CA PRO A 270 23.591 30.902 -1.562 1.00 15.57 C ATOM 2206 C PRO A 270 22.786 29.816 -2.289 1.00 15.79 C ATOM 2207 O PRO A 270 23.364 28.985 -3.024 1.00 13.48 O ATOM 2208 CB PRO A 270 24.181 31.857 -2.595 1.00 15.77 C ATOM 2209 CG PRO A 270 25.601 31.662 -2.607 1.00 22.74 C ATOM 2210 CD PRO A 270 26.062 30.802 -1.459 1.00 18.13 C ATOM 2211 N VAL A 271 21.507 29.896 -2.064 1.00 13.27 N ATOM 2212 CA VAL A 271 20.505 28.992 -2.703 1.00 12.34 C ATOM 2213 C VAL A 271 19.568 29.884 -3.495 1.00 11.29 C ATOM 2214 O VAL A 271 19.047 30.861 -2.993 1.00 14.09 O ATOM 2215 CB VAL A 271 19.720 28.158 -1.687 1.00 13.47 C ATOM 2216 CG1 VAL A 271 18.685 27.347 -2.464 1.00 13.64 C ATOM 2217 CG2 VAL A 271 20.722 27.252 -0.896 1.00 15.31 C ATOM 2218 H VAL A 271 21.166 30.626 -1.406 1.00 0.00 H ATOM 2219 N ALA A 272 19.345 29.524 -4.769 1.00 13.13 N ATOM 2220 CA ALA A 272 18.427 30.204 -5.601 1.00 13.76 C ATOM 2221 C ALA A 272 17.278 29.337 -6.046 1.00 11.82 C ATOM 2222 O ALA A 272 17.535 28.231 -6.607 1.00 12.75 O ATOM 2223 CB ALA A 272 19.082 30.726 -6.902 1.00 12.46 C ATOM 2224 H ALA A 272 19.868 28.714 -5.159 1.00 0.00 H ATOM 2225 N GLU A 273 16.058 29.675 -5.665 1.00 12.25 N ATOM 2226 CA GLU A 273 14.866 28.966 -6.026 1.00 11.65 C ATOM 2227 C GLU A 273 14.284 29.454 -7.358 1.00 10.95 C ATOM 2228 O GLU A 273 14.064 30.680 -7.458 1.00 13.64 O ATOM 2229 CB GLU A 273 13.866 29.093 -4.897 1.00 11.68 C ATOM 2230 CG GLU A 273 12.567 28.307 -5.050 1.00 12.61 C ATOM 2231 CD GLU A 273 11.577 28.513 -3.941 1.00 14.06 C ATOM 2232 OE1 GLU A 273 11.211 29.691 -3.722 1.00 16.84 O ATOM 2233 OE2 GLU A 273 11.137 27.564 -3.337 1.00 17.21 O ATOM 2234 H GLU A 273 15.956 30.515 -5.060 1.00 0.00 H ATOM 2235 N PHE A 274 14.040 28.536 -8.270 1.00 12.09 N ATOM 2236 CA PHE A 274 13.429 28.878 -9.541 1.00 11.62 C ATOM 2237 C PHE A 274 12.061 28.180 -9.542 1.00 10.67 C ATOM 2238 O PHE A 274 12.008 26.941 -9.556 1.00 12.72 O ATOM 2239 CB PHE A 274 14.261 28.398 -10.730 1.00 12.99 C ATOM 2240 CG PHE A 274 15.508 29.055 -10.927 1.00 11.90 C ATOM 2241 CD1 PHE A 274 16.597 28.900 -10.087 1.00 11.07 C ATOM 2242 CD2 PHE A 274 15.695 29.903 -11.968 1.00 15.39 C ATOM 2243 CE1 PHE A 274 17.799 29.564 -10.239 1.00 12.84 C ATOM 2244 CE2 PHE A 274 16.896 30.564 -12.173 1.00 15.22 C ATOM 2245 CZ PHE A 274 17.913 30.369 -11.304 1.00 15.58 C ATOM 2246 H PHE A 274 14.290 27.546 -8.075 1.00 0.00 H ATOM 2247 N ASN A 275 10.957 28.905 -9.501 1.00 13.51 N ATOM 2248 CA ASN A 275 9.683 28.346 -9.388 1.00 12.32 C ATOM 2249 C ASN A 275 8.668 29.357 -9.908 1.00 14.44 C ATOM 2250 O ASN A 275 8.905 30.598 -9.893 1.00 17.12 O ATOM 2251 CB ASN A 275 9.407 27.945 -7.936 1.00 15.54 C ATOM 2252 CG ASN A 275 8.293 26.923 -7.721 1.00 13.10 C ATOM 2253 OD1 ASN A 275 7.150 27.183 -8.101 1.00 13.69 O ATOM 2254 ND2 ASN A 275 8.644 25.748 -7.137 1.00 13.23 N ATOM 2255 HD22 ASN A 275 9.627 25.589 -6.838 1.00 0.00 H ATOM 2256 HD21 ASN A 275 7.929 25.007 -6.989 1.00 0.00 H ATOM 2257 H ASN A 275 11.041 29.940 -9.555 1.00 0.00 H ATOM 2258 N THR A 276 7.527 28.924 -10.418 1.00 13.55 N ATOM 2259 CA THR A 276 6.426 29.819 -10.783 1.00 17.27 C ATOM 2260 C THR A 276 5.681 30.352 -9.593 1.00 16.85 C ATOM 2261 O THR A 276 4.930 31.346 -9.760 1.00 23.13 O ATOM 2262 CB THR A 276 5.404 29.002 -11.641 1.00 16.61 C ATOM 2263 OG1 THR A 276 5.228 27.751 -11.065 1.00 15.93 O ATOM 2264 CG2 THR A 276 5.983 28.838 -13.062 1.00 19.62 C ATOM 2265 HG1 THR A 276 4.582 27.229 -11.604 1.00 0.00 H ATOM 2266 H THR A 276 7.406 27.902 -10.567 1.00 0.00 H ATOM 2267 N GLU A 277 5.919 29.827 -8.398 1.00 18.69 N ATOM 2268 CA GLU A 277 5.412 30.342 -7.137 1.00 24.58 C ATOM 2269 C GLU A 277 6.280 30.269 -5.983 1.00 21.14 C ATOM 2270 O GLU A 277 7.382 29.716 -6.078 1.00 19.22 O ATOM 2271 CB GLU A 277 4.074 29.867 -6.874 1.00 35.38 C ATOM 2272 CG GLU A 277 3.986 28.490 -6.630 1.00 32.39 C ATOM 2273 CD GLU A 277 2.672 27.932 -7.256 1.00 42.41 C ATOM 2274 OE1 GLU A 277 2.183 28.331 -8.359 1.00 66.57 O ATOM 2275 OE2 GLU A 277 2.151 26.998 -6.675 1.00 62.08 O ATOM 2276 H GLU A 277 6.517 28.977 -8.361 1.00 0.00 H ATOM 2277 N THR A 278 5.850 30.875 -4.869 1.00 22.60 N ATOM 2278 CA THR A 278 6.536 30.709 -3.634 1.00 21.69 C ATOM 2279 C THR A 278 6.132 29.329 -3.040 1.00 23.57 C ATOM 2280 O THR A 278 5.074 28.796 -3.299 1.00 28.86 O ATOM 2281 CB THR A 278 6.286 31.847 -2.651 1.00 26.40 C ATOM 2282 OG1 THR A 278 4.922 31.880 -2.412 1.00 34.39 O ATOM 2283 CG2 THR A 278 6.738 33.174 -3.353 1.00 29.45 C ATOM 2284 HG1 THR A 278 4.443 32.040 -3.263 1.00 0.00 H ATOM 2285 H THR A 278 5.002 31.476 -4.907 1.00 0.00 H ATOM 2286 N THR A 279 6.989 28.850 -2.143 1.00 21.12 N ATOM 2287 CA THR A 279 6.842 27.528 -1.474 1.00 18.98 C ATOM 2288 C THR A 279 7.131 27.730 0.035 1.00 22.68 C ATOM 2289 O THR A 279 7.628 28.785 0.452 1.00 24.58 O ATOM 2290 CB THR A 279 7.886 26.526 -2.062 1.00 20.19 C ATOM 2291 OG1 THR A 279 9.180 26.745 -1.516 1.00 18.91 O ATOM 2292 CG2 THR A 279 7.902 26.481 -3.617 1.00 20.83 C ATOM 2293 HG1 THR A 279 9.474 27.666 -1.727 1.00 0.00 H ATOM 2294 H THR A 279 7.812 29.435 -1.894 1.00 0.00 H ATOM 2295 N PRO A 280 6.939 26.638 0.860 1.00 23.87 N ATOM 2296 CA PRO A 280 7.305 26.777 2.276 1.00 27.77 C ATOM 2297 C PRO A 280 8.759 27.084 2.540 1.00 27.61 C ATOM 2298 O PRO A 280 9.112 27.496 3.601 1.00 34.54 O ATOM 2299 CB PRO A 280 6.919 25.442 2.906 1.00 31.86 C ATOM 2300 CG PRO A 280 5.868 24.893 1.996 1.00 28.75 C ATOM 2301 CD PRO A 280 6.226 25.375 0.608 1.00 24.52 C ATOM 2302 N ALA A 281 9.585 26.741 1.525 1.00 21.39 N ATOM 2303 CA ALA A 281 11.021 26.895 1.690 1.00 21.16 C ATOM 2304 C ALA A 281 11.551 28.271 1.239 1.00 19.02 C ATOM 2305 O ALA A 281 12.678 28.548 1.519 1.00 18.62 O ATOM 2306 CB ALA A 281 11.736 25.769 0.994 1.00 27.38 C ATOM 2307 H ALA A 281 9.196 26.370 0.635 1.00 0.00 H ATOM 2308 N THR A 282 10.749 29.023 0.491 1.00 17.84 N ATOM 2309 CA THR A 282 11.257 30.227 -0.191 1.00 19.96 C ATOM 2310 C THR A 282 12.074 31.096 0.714 1.00 19.94 C ATOM 2311 O THR A 282 13.125 31.565 0.358 1.00 17.15 O ATOM 2312 CB THR A 282 10.087 30.958 -0.837 1.00 21.62 C ATOM 2313 OG1 THR A 282 9.442 30.146 -1.818 1.00 19.00 O ATOM 2314 CG2 THR A 282 10.459 32.250 -1.368 1.00 20.15 C ATOM 2315 HG1 THR A 282 10.092 29.906 -2.525 1.00 0.00 H ATOM 2316 H THR A 282 9.749 28.758 0.386 1.00 0.00 H ATOM 2317 N ASN A 283 11.545 31.374 1.889 1.00 21.13 N ATOM 2318 CA ASN A 283 12.175 32.326 2.768 1.00 19.75 C ATOM 2319 C ASN A 283 13.457 31.816 3.447 1.00 19.87 C ATOM 2320 O ASN A 283 14.127 32.645 4.132 1.00 23.58 O ATOM 2321 CB ASN A 283 11.133 32.791 3.801 1.00 23.07 C ATOM 2322 CG ASN A 283 10.186 33.896 3.130 1.00 33.63 C ATOM 2323 OD1 ASN A 283 10.401 34.366 1.967 1.00 34.18 O ATOM 2324 ND2 ASN A 283 9.155 34.220 3.812 1.00 37.05 N ATOM 2325 HD22 ASN A 283 9.011 33.817 4.760 1.00 0.00 H ATOM 2326 HD21 ASN A 283 8.460 34.887 3.419 1.00 0.00 H ATOM 2327 H ASN A 283 10.666 30.903 2.184 1.00 0.00 H ATOM 2328 N ARG A 284 13.810 30.541 3.283 1.00 20.06 N ATOM 2329 CA ARG A 284 15.086 30.045 3.704 1.00 21.00 C ATOM 2330 C ARG A 284 16.236 30.396 2.746 1.00 16.64 C ATOM 2331 O ARG A 284 17.397 30.201 3.052 1.00 21.79 O ATOM 2332 CB ARG A 284 15.004 28.484 3.880 1.00 24.61 C ATOM 2333 CG ARG A 284 13.858 28.090 4.853 1.00 30.44 C ATOM 2334 CD ARG A 284 14.205 27.485 6.314 1.00 34.15 C ATOM 2335 NE ARG A 284 14.908 28.213 7.438 1.00 23.44 N ATOM 2336 CZ ARG A 284 14.673 28.065 8.793 1.00 30.44 C ATOM 2337 NH1 ARG A 284 15.370 28.752 9.608 1.00 38.09 N ATOM 2338 NH2 ARG A 284 13.767 27.271 9.424 1.00 27.08 N ATOM 2339 HE ARG A 284 15.644 28.895 7.164 1.00 0.00 H ATOM 2340 HH12 ARG A 284 15.214 28.660 10.632 1.00 0.00 H ATOM 2341 HH11 ARG A 284 16.096 29.405 9.249 1.00 0.00 H ATOM 2342 HH22 ARG A 284 13.711 27.270 10.462 1.00 0.00 H ATOM 2343 HH21 ARG A 284 13.131 26.665 8.868 1.00 0.00 H ATOM 2344 H ARG A 284 13.138 29.886 2.835 1.00 0.00 H ATOM 2345 N PHE A 285 15.934 30.861 1.531 1.00 14.54 N ATOM 2346 CA PHE A 285 16.924 30.919 0.468 1.00 12.42 C ATOM 2347 C PHE A 285 17.389 32.345 0.200 1.00 13.09 C ATOM 2348 O PHE A 285 16.672 33.318 0.480 1.00 17.37 O ATOM 2349 CB PHE A 285 16.314 30.342 -0.811 1.00 13.23 C ATOM 2350 CG PHE A 285 15.813 28.917 -0.637 1.00 14.50 C ATOM 2351 CD1 PHE A 285 16.506 27.986 0.160 1.00 14.58 C ATOM 2352 CD2 PHE A 285 14.691 28.461 -1.287 1.00 13.75 C ATOM 2353 CE1 PHE A 285 16.110 26.678 0.281 1.00 16.92 C ATOM 2354 CE2 PHE A 285 14.300 27.109 -1.200 1.00 15.22 C ATOM 2355 CZ PHE A 285 15.014 26.275 -0.406 1.00 15.08 C ATOM 2356 H PHE A 285 14.966 31.190 1.340 1.00 0.00 H ATOM 2357 N ARG A 286 18.512 32.395 -0.531 1.00 13.15 N ATOM 2358 CA ARG A 286 19.051 33.720 -0.860 1.00 13.96 C ATOM 2359 C ARG A 286 18.365 34.375 -1.969 1.00 12.91 C ATOM 2360 O ARG A 286 18.308 35.649 -2.016 1.00 14.72 O ATOM 2361 CB ARG A 286 20.559 33.543 -1.137 1.00 15.97 C ATOM 2362 CG ARG A 286 21.377 34.765 -1.133 1.00 16.51 C ATOM 2363 CD ARG A 286 21.645 35.287 0.292 1.00 21.31 C ATOM 2364 NE ARG A 286 22.353 34.230 1.077 1.00 19.45 N ATOM 2365 CZ ARG A 286 23.634 33.934 0.991 1.00 20.92 C ATOM 2366 NH1 ARG A 286 24.479 34.699 0.221 1.00 20.99 N ATOM 2367 NH2 ARG A 286 24.095 32.855 1.603 1.00 18.58 N ATOM 2368 HE ARG A 286 21.784 33.679 1.751 1.00 0.00 H ATOM 2369 HH12 ARG A 286 25.489 34.457 0.160 1.00 0.00 H ATOM 2370 HH11 ARG A 286 24.108 35.519 -0.300 1.00 0.00 H ATOM 2371 HH22 ARG A 286 25.105 32.613 1.541 1.00 0.00 H ATOM 2372 HH21 ARG A 286 23.448 32.249 2.146 1.00 0.00 H ATOM 2373 H ARG A 286 18.984 31.526 -0.853 1.00 0.00 H ATOM 2374 N PHE A 287 17.866 33.693 -2.954 1.00 14.17 N ATOM 2375 CA PHE A 287 17.237 34.155 -4.119 1.00 12.63 C ATOM 2376 C PHE A 287 15.969 33.448 -4.484 1.00 13.37 C ATOM 2377 O PHE A 287 15.828 32.217 -4.226 1.00 12.34 O ATOM 2378 CB PHE A 287 18.078 34.106 -5.440 1.00 14.65 C ATOM 2379 CG PHE A 287 19.403 34.787 -5.374 1.00 15.91 C ATOM 2380 CD1 PHE A 287 19.499 36.170 -5.649 1.00 14.24 C ATOM 2381 CD2 PHE A 287 20.535 34.114 -4.949 1.00 13.89 C ATOM 2382 CE1 PHE A 287 20.720 36.805 -5.506 1.00 15.98 C ATOM 2383 CE2 PHE A 287 21.723 34.729 -4.848 1.00 15.41 C ATOM 2384 CZ PHE A 287 21.843 36.114 -5.116 1.00 14.79 C ATOM 2385 H PHE A 287 17.943 32.660 -2.867 1.00 0.00 H ATOM 2386 N HIS A 288 14.995 34.101 -5.061 1.00 14.47 N ATOM 2387 CA HIS A 288 13.748 33.545 -5.557 1.00 13.87 C ATOM 2388 C HIS A 288 13.522 34.144 -6.957 1.00 11.25 C ATOM 2389 O HIS A 288 13.408 35.421 -7.021 1.00 14.92 O ATOM 2390 CB HIS A 288 12.564 33.746 -4.674 1.00 17.09 C ATOM 2391 CG HIS A 288 11.280 33.223 -5.232 1.00 16.16 C ATOM 2392 ND1 HIS A 288 10.877 31.919 -5.161 1.00 17.00 N ATOM 2393 CD2 HIS A 288 10.331 33.857 -5.956 1.00 18.54 C ATOM 2394 CE1 HIS A 288 9.735 31.769 -5.817 1.00 18.34 C ATOM 2395 NE2 HIS A 288 9.360 32.958 -6.293 1.00 18.97 N ATOM 2396 H HIS A 288 15.126 35.126 -5.177 1.00 0.00 H ATOM 2397 N PHE A 289 13.513 33.354 -7.996 1.00 13.56 N ATOM 2398 CA PHE A 289 13.284 33.795 -9.357 1.00 12.09 C ATOM 2399 C PHE A 289 11.983 33.230 -9.847 1.00 10.29 C ATOM 2400 O PHE A 289 11.828 31.988 -10.003 1.00 13.87 O ATOM 2401 CB PHE A 289 14.451 33.393 -10.250 1.00 13.80 C ATOM 2402 CG PHE A 289 15.735 34.043 -9.875 1.00 15.15 C ATOM 2403 CD1 PHE A 289 15.819 35.401 -9.900 1.00 17.32 C ATOM 2404 CD2 PHE A 289 16.904 33.371 -9.477 1.00 13.66 C ATOM 2405 CE1 PHE A 289 16.944 36.051 -9.417 1.00 20.71 C ATOM 2406 CE2 PHE A 289 18.045 33.973 -9.087 1.00 15.86 C ATOM 2407 CZ PHE A 289 18.041 35.363 -9.047 1.00 18.57 C ATOM 2408 H PHE A 289 13.681 32.340 -7.836 1.00 0.00 H ATOM 2409 N GLN A 290 11.030 34.107 -10.011 1.00 16.27 N ATOM 2410 CA GLN A 290 9.702 33.738 -10.368 1.00 17.30 C ATOM 2411 C GLN A 290 9.580 33.562 -11.863 1.00 15.13 C ATOM 2412 O GLN A 290 9.987 34.385 -12.589 1.00 26.09 O ATOM 2413 CB GLN A 290 8.700 34.724 -9.735 1.00 23.16 C ATOM 2414 CG GLN A 290 7.291 34.129 -9.679 1.00 31.60 C ATOM 2415 CD GLN A 290 6.553 34.134 -8.308 1.00 35.18 C ATOM 2416 OE1 GLN A 290 7.044 33.641 -7.240 1.00 42.32 O ATOM 2417 NE2 GLN A 290 5.282 34.528 -8.404 1.00 40.91 N ATOM 2418 HE22 GLN A 290 4.927 34.925 -9.297 1.00 0.00 H ATOM 2419 HE21 GLN A 290 4.647 34.439 -7.586 1.00 0.00 H ATOM 2420 H GLN A 290 11.249 35.115 -9.876 1.00 0.00 H ATOM 2421 N GLY A 291 8.879 32.589 -12.241 1.00 17.92 N ATOM 2422 CA GLY A 291 8.445 32.423 -13.616 1.00 18.34 C ATOM 2423 C GLY A 291 8.758 30.987 -14.034 1.00 13.63 C ATOM 2424 O GLY A 291 9.338 30.185 -13.308 1.00 17.36 O ATOM 2425 H GLY A 291 8.599 31.874 -11.540 1.00 0.00 H ATOM 2426 N PRO A 292 8.392 30.683 -15.262 1.00 15.43 N ATOM 2427 CA PRO A 292 8.608 29.365 -15.784 1.00 12.53 C ATOM 2428 C PRO A 292 10.124 29.135 -15.905 1.00 13.91 C ATOM 2429 O PRO A 292 10.798 29.942 -16.544 1.00 14.12 O ATOM 2430 CB PRO A 292 7.936 29.372 -17.220 1.00 14.05 C ATOM 2431 CG PRO A 292 7.789 30.815 -17.419 1.00 26.26 C ATOM 2432 CD PRO A 292 7.624 31.522 -16.196 1.00 22.18 C ATOM 2433 N CYS A 293 10.598 27.971 -15.438 1.00 14.31 N ATOM 2434 CA CYS A 293 11.987 27.745 -15.518 1.00 13.09 C ATOM 2435 C CYS A 293 12.583 27.559 -16.891 1.00 12.10 C ATOM 2436 O CYS A 293 13.786 27.800 -17.110 1.00 14.04 O ATOM 2437 CB CYS A 293 12.455 26.682 -14.520 1.00 14.43 C ATOM 2438 SG CYS A 293 11.916 25.062 -14.947 1.00 17.96 S ATOM 2439 H CYS A 293 9.961 27.257 -15.030 1.00 0.00 H ATOM 2440 N GLY A 294 11.738 27.300 -17.869 1.00 13.38 N ATOM 2441 CA GLY A 294 12.156 27.214 -19.237 1.00 17.50 C ATOM 2442 C GLY A 294 12.570 28.557 -19.765 1.00 14.52 C ATOM 2443 O GLY A 294 13.279 28.582 -20.796 1.00 18.91 O ATOM 2444 H GLY A 294 10.734 27.153 -17.640 1.00 0.00 H ATOM 2445 N THR A 295 12.133 29.635 -19.115 1.00 14.59 N ATOM 2446 CA THR A 295 12.468 31.010 -19.416 1.00 14.93 C ATOM 2447 C THR A 295 13.625 31.471 -18.531 1.00 15.64 C ATOM 2448 O THR A 295 14.631 32.000 -19.030 1.00 23.53 O ATOM 2449 CB THR A 295 11.262 31.937 -19.322 1.00 23.43 C ATOM 2450 OG1 THR A 295 10.383 31.578 -20.433 1.00 25.61 O ATOM 2451 CG2 THR A 295 11.760 33.414 -19.507 1.00 23.90 C ATOM 2452 HG1 THR A 295 10.112 30.630 -20.344 1.00 0.00 H ATOM 2453 H THR A 295 11.489 29.472 -18.314 1.00 0.00 H ATOM 2454 N THR A 296 13.524 31.195 -17.210 1.00 15.31 N ATOM 2455 CA THR A 296 14.476 31.769 -16.347 1.00 14.61 C ATOM 2456 C THR A 296 15.866 31.043 -16.284 1.00 14.12 C ATOM 2457 O THR A 296 16.919 31.636 -16.136 1.00 17.30 O ATOM 2458 CB THR A 296 13.903 31.873 -14.954 1.00 13.74 C ATOM 2459 OG1 THR A 296 13.571 30.574 -14.539 1.00 15.03 O ATOM 2460 CG2 THR A 296 12.705 32.744 -14.832 1.00 18.93 C ATOM 2461 HG1 THR A 296 13.191 30.608 -13.625 1.00 0.00 H ATOM 2462 H THR A 296 12.769 30.580 -16.845 1.00 0.00 H ATOM 2463 N LEU A 297 15.872 29.692 -16.430 1.00 14.20 N ATOM 2464 CA LEU A 297 17.099 29.013 -16.371 1.00 14.36 C ATOM 2465 C LEU A 297 18.062 29.332 -17.537 1.00 15.32 C ATOM 2466 O LEU A 297 19.314 29.462 -17.307 1.00 15.65 O ATOM 2467 CB LEU A 297 16.906 27.469 -16.369 1.00 13.30 C ATOM 2468 CG LEU A 297 16.340 26.946 -15.033 1.00 14.03 C ATOM 2469 CD1 LEU A 297 15.950 25.546 -15.181 1.00 13.59 C ATOM 2470 CD2 LEU A 297 17.415 27.027 -13.885 1.00 19.33 C ATOM 2471 H LEU A 297 14.985 29.171 -16.582 1.00 0.00 H ATOM 2472 N PRO A 298 17.594 29.437 -18.788 1.00 14.20 N ATOM 2473 CA PRO A 298 18.561 29.839 -19.830 1.00 15.50 C ATOM 2474 C PRO A 298 19.257 31.128 -19.559 1.00 17.78 C ATOM 2475 O PRO A 298 20.438 31.276 -19.837 1.00 20.77 O ATOM 2476 CB PRO A 298 17.748 29.829 -21.115 1.00 17.05 C ATOM 2477 CG PRO A 298 16.606 28.851 -20.804 1.00 17.56 C ATOM 2478 CD PRO A 298 16.296 29.083 -19.329 1.00 14.93 C ATOM 2479 N GLU A 299 18.516 32.084 -18.962 1.00 16.92 N ATOM 2480 CA GLU A 299 19.085 33.363 -18.624 1.00 19.17 C ATOM 2481 C GLU A 299 20.074 33.227 -17.461 1.00 19.40 C ATOM 2482 O GLU A 299 21.168 33.760 -17.479 1.00 24.86 O ATOM 2483 CB GLU A 299 17.851 34.309 -18.241 1.00 24.81 C ATOM 2484 CG GLU A 299 16.866 34.639 -19.313 1.00 21.05 C ATOM 2485 CD GLU A 299 15.500 35.239 -18.931 1.00 30.40 C ATOM 2486 OE1 GLU A 299 14.949 35.957 -19.768 1.00 50.89 O ATOM 2487 OE2 GLU A 299 14.895 34.947 -17.827 1.00 35.43 O ATOM 2488 H GLU A 299 17.517 31.894 -18.742 1.00 0.00 H ATOM 2489 N ALA A 300 19.667 32.529 -16.415 1.00 16.50 N ATOM 2490 CA ALA A 300 20.529 32.372 -15.245 1.00 18.19 C ATOM 2491 C ALA A 300 21.832 31.685 -15.473 1.00 15.43 C ATOM 2492 O ALA A 300 22.845 31.959 -14.845 1.00 17.53 O ATOM 2493 CB ALA A 300 19.758 31.721 -14.126 1.00 19.77 C ATOM 2494 H ALA A 300 18.725 32.088 -16.424 1.00 0.00 H ATOM 2495 N LEU A 301 21.745 30.639 -16.331 1.00 15.66 N ATOM 2496 CA LEU A 301 22.886 29.736 -16.587 1.00 18.67 C ATOM 2497 C LEU A 301 23.687 29.971 -17.829 1.00 19.12 C ATOM 2498 O LEU A 301 24.568 29.235 -18.116 1.00 21.26 O ATOM 2499 CB LEU A 301 22.389 28.295 -16.560 1.00 17.09 C ATOM 2500 CG LEU A 301 21.663 27.807 -15.336 1.00 16.39 C ATOM 2501 CD1 LEU A 301 21.193 26.352 -15.533 1.00 18.79 C ATOM 2502 CD2 LEU A 301 22.515 27.988 -14.069 1.00 21.36 C ATOM 2503 H LEU A 301 20.846 30.467 -16.825 1.00 0.00 H ATOM 2504 N ALA A 302 23.442 31.115 -18.469 1.00 21.39 N ATOM 2505 CA ALA A 302 24.137 31.465 -19.635 1.00 19.36 C ATOM 2506 C ALA A 302 25.649 31.638 -19.452 1.00 24.63 C ATOM 2507 O ALA A 302 26.066 32.165 -18.379 1.00 27.40 O ATOM 2508 CB ALA A 302 23.576 32.725 -20.249 1.00 25.99 C ATOM 2509 OXT ALA A 302 26.379 31.323 -20.423 1.00 33.17 O ATOM 2510 H ALA A 302 22.719 31.762 -18.095 1.00 0.00 H TER 2511 ALA A 302 HETATM 2512 ZN ZN A 1 13.671 -12.126 -10.455 1.00 15.13 ZN HETATM 2513 O HOH 2 -6.819 -4.311 -9.674 1.00 36.56 O HETATM 2514 O HOH 3 15.391 22.702 7.518 1.00 57.10 O HETATM 2515 O HOH 4 28.416 32.661 -18.170 1.00 41.66 O HETATM 2516 O HOH 5 5.045 1.913 -22.284 1.00 26.71 O HETATM 2517 O HOH 6 12.035 10.361 -27.156 1.00 72.43 O HETATM 2518 O HOH 7 9.372 -8.846 -18.156 1.00 51.28 O HETATM 2519 O HOH 8 3.743 1.787 -28.225 1.00 34.17 O HETATM 2520 O HOH 9 0.978 8.113 0.586 1.00 37.10 O HETATM 2521 O HOH 10 -9.239 1.360 -11.430 1.00 34.44 O HETATM 2522 O HOH 11 26.481 13.492 7.142 1.00 40.96 O HETATM 2523 O HOH 12 9.233 22.099 3.431 1.00115.61 O HETATM 2524 O HOH 13 -8.881 -5.439 -9.468 1.00 82.49 O HETATM 2525 O HOH 14 20.759 8.149 -12.220 1.00 47.70 O HETATM 2526 O HOH 15 -7.969 -10.955 -11.830 1.00 46.55 O HETATM 2527 O HOH 16 12.823 1.430 -5.006 1.00 33.33 O HETATM 2528 O HOH 17 -3.679 11.342 -14.905 1.00 43.75 O HETATM 2529 O HOH 18 -2.002 -16.582 -7.887 1.00 65.34 O HETATM 2530 O HOH 19 11.479 -15.887 -15.019 1.00 48.08 O HETATM 2531 O HOH 20 8.201 11.113 -9.085 1.00 24.43 O HETATM 2532 O HOH 21 25.604 31.036 -22.851 1.00 34.78 O HETATM 2533 O HOH 22 20.646 3.234 -16.614 1.00 44.73 O HETATM 2534 O HOH 23 19.954 43.873 -9.180 1.00 46.28 O HETATM 2535 O HOH 24 4.482 24.955 -4.924 1.00 22.05 O HETATM 2536 O HOH 25 16.037 -15.794 -19.090 1.00 65.21 O HETATM 2537 O HOH 26 -7.238 1.931 -21.039 1.00 40.58 O HETATM 2538 O HOH 27 2.472 9.686 -25.137 1.00 43.20 O HETATM 2539 O HOH 28 8.921 29.413 -20.588 1.00 28.47 O HETATM 2540 O HOH 29 8.394 -1.667 0.749 1.00 27.44 O HETATM 2541 O HOH 30 15.792 34.520 2.643 1.00 34.16 O HETATM 2542 O HOH 31 23.364 18.935 -16.232 1.00 14.91 O HETATM 2543 O HOH 32 13.682 29.828 -23.076 1.00 35.67 O HETATM 2544 O HOH 33 18.241 5.844 -8.683 1.00 36.46 O HETATM 2545 O HOH 34 13.512 1.570 -0.190 1.00 31.72 O HETATM 2546 O HOH 35 -8.677 -0.860 -17.207 1.00 22.85 O HETATM 2547 O HOH 36 22.725 0.432 -1.568 1.00 45.61 O HETATM 2548 O HOH 37 10.789 24.346 4.176 1.00 47.78 O HETATM 2549 O HOH 38 17.259 -4.719 -5.508 1.00 50.75 O HETATM 2550 O HOH 39 29.965 16.247 -16.470 1.00 25.16 O HETATM 2551 O HOH 40 14.761 10.910 -13.946 1.00 12.24 O HETATM 2552 O HOH 41 -1.217 20.109 -12.347 1.00 25.98 O HETATM 2553 O HOH 42 -11.476 5.736 -19.745 1.00 25.64 O HETATM 2554 O HOH 43 25.821 17.479 3.628 1.00 26.60 O HETATM 2555 O HOH 44 16.326 39.752 -11.720 1.00 20.50 O HETATM 2556 O HOH 45 9.220 14.876 -9.054 1.00 14.65 O HETATM 2557 O HOH 46 16.969 2.414 2.539 1.00 36.31 O HETATM 2558 O HOH 47 17.570 14.735 -26.659 1.00 37.83 O HETATM 2559 O HOH 48 -6.142 -3.199 -12.550 1.00 23.89 O HETATM 2560 O HOH 49 16.754 -8.839 -15.445 1.00 27.48 O HETATM 2561 O HOH 50 19.575 41.850 -4.462 1.00 35.56 O HETATM 2562 O HOH 51 8.959 -6.074 -20.437 1.00 30.42 O HETATM 2563 O HOH 52 21.737 21.087 -25.840 1.00 44.56 O HETATM 2564 O HOH 53 25.382 9.749 -16.655 1.00 25.75 O HETATM 2565 O HOH 54 7.575 17.356 -24.797 1.00 18.66 O HETATM 2566 O HOH 55 4.505 0.129 -20.368 1.00 13.12 O HETATM 2567 O HOH 56 -1.611 3.156 0.511 1.00 53.66 O HETATM 2568 O HOH 57 8.415 15.022 -13.739 1.00 19.44 O HETATM 2569 O HOH 58 33.555 32.921 -14.654 1.00 38.96 O HETATM 2570 O HOH 59 7.153 5.000 -23.326 1.00 30.38 O HETATM 2571 O HOH 60 19.909 19.263 -24.581 1.00 36.92 O HETATM 2572 O HOH 61 12.123 1.224 -2.712 1.00 20.22 O HETATM 2573 O HOH 62 11.334 24.903 -3.859 1.00 14.40 O HETATM 2574 O HOH 63 4.678 -6.410 -24.117 1.00 30.04 O HETATM 2575 O HOH 64 12.479 12.738 -0.820 1.00 12.81 O HETATM 2576 O HOH 65 -5.431 -7.630 -20.101 1.00 26.41 O HETATM 2577 O HOH 66 3.354 4.050 2.641 1.00 30.11 O HETATM 2578 O HOH 67 23.858 22.851 7.199 1.00 27.27 O HETATM 2579 O HOH 68 28.085 20.328 6.091 1.00 31.02 O HETATM 2580 O HOH 69 16.110 -3.055 -21.388 1.00 75.56 O HETATM 2581 O HOH 70 18.982 18.423 -17.765 1.00 12.30 O HETATM 2582 O HOH 71 11.898 30.404 -12.366 1.00 14.88 O HETATM 2583 O HOH 72 5.472 14.156 -12.555 1.00 28.11 O HETATM 2584 O HOH 73 18.202 25.196 -25.588 1.00 59.42 O HETATM 2585 O HOH 74 9.089 23.262 -17.062 1.00 14.24 O HETATM 2586 O HOH 75 13.856 22.655 -0.473 1.00 14.86 O HETATM 2587 O HOH 76 14.985 32.531 -21.699 1.00 34.59 O HETATM 2588 O HOH 77 31.127 25.448 0.192 1.00 37.53 O HETATM 2589 O HOH 78 6.746 3.126 6.184 1.00 52.63 O HETATM 2590 O HOH 79 10.331 -8.331 -2.033 1.00 35.99 O HETATM 2591 O HOH 80 13.821 -6.199 -12.803 1.00 14.66 O HETATM 2592 O HOH 81 -6.808 11.023 -2.599 1.00 34.69 O HETATM 2593 O HOH 82 14.170 -5.469 -18.859 1.00 32.60 O HETATM 2594 O HOH 83 16.115 8.064 -21.263 1.00 36.64 O HETATM 2595 O HOH 84 -4.305 -6.714 -8.520 1.00 21.38 O HETATM 2596 O HOH 85 12.186 23.879 -17.499 1.00 30.30 O HETATM 2597 O HOH 86 16.382 3.097 -17.321 1.00 17.67 O HETATM 2598 O HOH 87 19.548 -6.048 -15.254 1.00 49.52 O HETATM 2599 O HOH 88 28.528 31.228 -4.257 1.00 46.24 O HETATM 2600 O HOH 89 1.098 -10.159 -19.839 1.00 17.72 O HETATM 2601 O HOH 90 29.351 29.674 -1.332 1.00 33.92 O HETATM 2602 O HOH 91 2.590 26.927 -11.184 1.00 37.30 O HETATM 2603 O HOH 92 27.624 33.367 3.390 1.00 49.90 O HETATM 2604 O HOH 93 30.461 20.264 -14.762 1.00 19.82 O HETATM 2605 O HOH 94 31.446 37.605 -9.820 1.00 34.16 O HETATM 2606 O HOH 95 22.682 31.357 3.457 1.00 29.53 O HETATM 2607 O HOH 96 18.066 -12.637 -4.770 1.00 30.42 O HETATM 2608 O HOH 97 19.333 1.784 -8.249 1.00 43.71 O HETATM 2609 O HOH 98 6.081 16.421 -26.916 1.00 43.84 O HETATM 2610 O HOH 99 6.469 17.076 -14.449 1.00 16.52 O HETATM 2611 O HOH 100 5.774 18.933 3.960 1.00 37.88 O HETATM 2612 O HOH 101 16.919 6.128 -3.560 1.00 14.43 O HETATM 2613 O HOH 102 22.380 28.278 10.151 1.00 40.58 O HETATM 2614 O HOH 103 10.370 32.624 -23.012 1.00 56.91 O HETATM 2615 O HOH 104 17.773 6.083 -15.436 1.00 23.92 O HETATM 2616 O HOH 105 -2.833 16.950 -7.079 1.00 41.20 O HETATM 2617 O HOH 106 38.749 21.710 -21.328 1.00 51.80 O HETATM 2618 O HOH 107 4.919 24.319 -2.283 1.00 24.61 O HETATM 2619 O HOH 108 -13.309 -1.456 -11.476 1.00 52.32 O HETATM 2620 O HOH 109 -4.301 -4.753 -27.215 1.00 33.98 O HETATM 2621 O HOH 110 4.217 -4.126 -1.516 1.00 26.67 O HETATM 2622 O HOH 111 34.811 21.866 -8.176 1.00 40.17 O HETATM 2623 O HOH 112 5.507 33.037 -11.910 1.00 51.88 O HETATM 2624 O HOH 113 10.625 17.944 -2.055 1.00 15.92 O HETATM 2625 O HOH 114 32.262 18.968 -19.906 1.00 30.61 O HETATM 2626 O HOH 115 34.921 30.679 -12.414 1.00 55.43 O HETATM 2627 O HOH 116 13.327 15.902 -15.366 1.00 13.66 O HETATM 2628 O HOH 117 6.489 -3.792 -27.928 1.00 40.97 O HETATM 2629 O HOH 118 12.246 -5.562 -16.895 1.00 18.01 O HETATM 2630 O HOH 119 10.745 0.443 -26.365 1.00 36.82 O HETATM 2631 O HOH 120 18.002 29.387 5.667 1.00 34.21 O HETATM 2632 O HOH 121 11.265 36.812 -8.181 1.00 25.88 O HETATM 2633 O HOH 122 19.169 -3.382 -17.656 1.00 37.07 O HETATM 2634 O HOH 123 26.055 17.625 -19.605 1.00 26.37 O HETATM 2635 O HOH 124 14.567 2.513 -1.934 1.00 40.94 O HETATM 2636 O HOH 125 27.615 15.919 6.120 1.00 42.59 O HETATM 2637 O HOH 126 17.940 26.285 -23.228 1.00 26.19 O HETATM 2638 O HOH 127 22.700 12.090 -20.799 1.00 26.92 O HETATM 2639 O HOH 128 28.670 11.345 2.219 1.00 34.95 O HETATM 2640 O HOH 129 2.274 21.412 -18.186 1.00 41.97 O HETATM 2641 O HOH 130 2.482 20.006 -16.063 1.00 41.65 O HETATM 2642 O HOH 131 17.854 26.668 6.251 1.00 27.64 O HETATM 2643 O HOH 132 30.540 17.184 -18.870 1.00 40.28 O HETATM 2644 O HOH 133 15.762 20.851 -1.356 1.00 13.94 O HETATM 2645 O HOH 134 8.012 18.370 -2.766 1.00 18.74 O HETATM 2646 O HOH 135 12.407 10.254 -20.934 1.00 28.02 O HETATM 2647 O HOH 136 -10.151 12.566 -10.921 1.00 23.80 O HETATM 2648 O HOH 137 -4.097 10.992 -21.197 1.00 48.37 O HETATM 2649 O HOH 138 14.708 19.019 -26.521 1.00 39.57 O HETATM 2650 O HOH 139 27.308 6.148 -2.346 1.00 43.61 O HETATM 2651 O HOH 140 14.484 9.964 -9.251 1.00 9.30 O HETATM 2652 O HOH 141 9.085 30.426 2.991 1.00 40.06 O HETATM 2653 O HOH 142 33.623 26.124 -21.484 1.00 36.61 O HETATM 2654 O HOH 143 2.855 14.806 -25.853 1.00 55.04 O HETATM 2655 O HOH 144 -7.875 8.160 -22.621 1.00 45.69 O HETATM 2656 O HOH 145 -7.938 -2.740 -4.422 1.00 64.29 O HETATM 2657 O HOH 146 29.727 30.635 -14.901 1.00 30.82 O HETATM 2658 O HOH 147 20.873 30.573 0.667 1.00 16.82 O HETATM 2659 O HOH 148 18.951 37.469 0.111 1.00 36.08 O HETATM 2660 O HOH 149 13.687 -2.031 -22.808 1.00 23.65 O HETATM 2661 O HOH 150 27.714 34.990 -14.419 1.00 31.36 O HETATM 2662 O HOH 151 8.901 0.620 -14.299 1.00 17.98 O HETATM 2663 O HOH 152 12.284 1.353 3.352 1.00 24.42 O HETATM 2664 O HOH 153 3.033 24.494 -14.765 1.00 40.57 O HETATM 2665 O HOH 154 -7.713 16.670 -12.106 1.00 24.71 O HETATM 2666 O HOH 155 9.509 0.907 4.229 1.00 42.39 O HETATM 2667 O HOH 156 -9.798 -3.079 -18.591 1.00 31.30 O HETATM 2668 O HOH 157 26.200 40.183 -12.753 1.00 33.27 O HETATM 2669 O HOH 158 7.334 -12.259 -6.776 1.00 41.14 O HETATM 2670 O HOH 159 21.405 36.131 -19.128 1.00 53.84 O HETATM 2671 O HOH 160 21.872 28.942 -20.793 1.00 29.11 O HETATM 2672 O HOH 161 16.040 -14.349 -4.285 1.00 21.76 O HETATM 2673 O HOH 162 -0.284 12.841 -4.865 1.00 34.09 O HETATM 2674 O HOH 163 -5.034 8.608 -22.325 1.00 55.62 O HETATM 2675 O HOH 164 3.257 11.121 2.676 1.00 66.07 O HETATM 2676 O HOH 165 20.978 7.986 -9.902 1.00 28.77 O HETATM 2677 O HOH 166 20.368 27.097 -22.819 1.00 42.22 O HETATM 2678 O HOH 167 9.621 19.776 -24.801 1.00 29.62 O HETATM 2679 O HOH 168 13.469 31.627 -2.539 1.00 25.72 O HETATM 2680 O HOH 169 -2.497 19.930 -5.408 1.00 45.79 O HETATM 2681 O HOH 170 4.590 25.300 -16.728 1.00 31.49 O HETATM 2682 O HOH 171 8.769 12.399 -12.424 1.00 17.72 O HETATM 2683 O HOH 172 10.664 10.799 -22.938 1.00 25.31 O HETATM 2684 O HOH 173 20.483 -5.550 -10.124 1.00 26.38 O HETATM 2685 O HOH 174 23.537 26.832 -20.011 1.00 23.14 O HETATM 2686 O HOH 175 17.426 5.360 -11.651 1.00 36.20 O HETATM 2687 O HOH 176 13.086 -9.165 -16.394 1.00 28.59 O HETATM 2688 O HOH 177 27.578 23.805 -23.434 1.00 50.10 O HETATM 2689 O HOH 178 27.302 33.920 0.608 1.00 27.70 O HETATM 2690 O HOH 179 18.685 -15.702 -16.603 1.00 39.28 O HETATM 2691 O HOH 180 8.600 -4.356 -2.890 1.00 27.57 O HETATM 2692 O HOH 181 0.453 19.331 -14.331 1.00 26.13 O HETATM 2693 O HOH 182 22.082 0.199 -21.100 1.00 55.78 O HETATM 2694 O HOH 183 20.254 32.761 2.603 1.00 27.74 O HETATM 2695 O HOH 184 30.487 31.767 -5.747 1.00 41.11 O HETATM 2696 O HOH 185 30.148 21.167 4.815 1.00 32.25 O HETATM 2697 O HOH 186 -0.101 3.048 2.936 1.00 30.89 O HETATM 2698 O HOH 187 -3.756 -9.027 -9.336 1.00 39.50 O HETATM 2699 O HOH 188 19.141 41.740 -12.062 1.00 39.02 O HETATM 2700 O HOH 189 26.002 8.360 -9.571 1.00115.92 O HETATM 2701 O HOH 190 11.687 25.169 -6.682 1.00 12.35 O HETATM 2702 O HOH 191 18.964 4.801 -21.436 1.00 49.42 O HETATM 2703 O HOH 192 11.052 24.713 -23.889 1.00 25.46 O HETATM 2704 O HOH 193 -7.012 -12.882 -17.305 1.00 53.00 O HETATM 2705 O HOH 194 3.194 32.260 -5.264 1.00 52.89 O HETATM 2706 O HOH 195 8.722 -0.919 -27.152 1.00 37.04 O HETATM 2707 O HOH 196 -12.317 5.740 -10.716 1.00 20.20 O HETATM 2708 O HOH 197 7.928 -7.190 -18.216 1.00 51.26 O HETATM 2709 O HOH 198 2.098 1.677 2.346 1.00 21.44 O HETATM 2710 O HOH 199 -7.667 1.042 -19.084 1.00 27.27 O HETATM 2711 O HOH 200 15.115 13.320 -15.208 1.00 13.88 O HETATM 2712 O HOH 201 16.576 2.313 5.680 1.00 37.19 O HETATM 2713 O HOH 202 30.945 30.085 -18.551 1.00 45.55 O HETATM 2714 O HOH 203 -3.973 -12.375 -8.996 1.00 35.13 O HETATM 2715 O HOH 204 -1.276 -1.174 -27.654 1.00 63.77 O HETATM 2716 O HOH 205 10.410 19.758 8.778 1.00 39.78 O HETATM 2717 O HOH 206 -8.388 -2.047 -23.426 1.00 46.58 O HETATM 2718 O HOH 207 1.996 -7.407 -4.791 1.00 33.22 O HETATM 2719 O HOH 208 9.524 -15.880 -7.751 1.00 41.56 O HETATM 2720 O HOH 209 7.520 2.571 -22.472 1.00 27.80 O HETATM 2721 O HOH 210 2.444 22.465 -10.412 1.00 18.14 O HETATM 2722 O HOH 211 14.154 21.226 6.329 1.00 49.82 O HETATM 2723 O HOH 212 -5.708 -8.408 -9.846 1.00 43.64 O HETATM 2724 O HOH 213 12.726 14.894 -31.146 1.00143.85 O HETATM 2725 O HOH 214 31.527 17.802 -14.519 1.00 22.20 O HETATM 2726 O HOH 215 0.327 5.651 5.624 1.00 45.55 O HETATM 2727 O HOH 216 27.705 12.181 -7.942 1.00 57.71 O HETATM 2728 O HOH 217 31.514 16.112 -4.042 1.00 38.88 O HETATM 2729 O HOH 218 30.376 23.422 -23.922 1.00 43.16 O HETATM 2730 O HOH 219 17.567 24.563 8.441 1.00 52.65 O HETATM 2731 O HOH 220 14.228 13.114 -30.407 1.00 80.68 O HETATM 2732 O HOH 221 5.008 4.781 -25.501 1.00 31.94 O HETATM 2733 O HOH 222 3.145 12.008 9.663 1.00 53.38 O HETATM 2734 O HOH 223 -5.763 2.085 -4.290 1.00 58.16 O HETATM 2735 O HOH 224 14.455 3.225 -6.661 1.00 20.98 O HETATM 2736 O HOH 225 0.335 17.996 -18.529 1.00 41.19 O HETATM 2737 O HOH 226 2.907 23.719 -0.336 1.00 42.59 O HETATM 2738 O HOH 227 18.664 9.657 -22.506 1.00 49.12 O HETATM 2739 O HOH 228 18.569 34.852 2.882 1.00 64.02 O HETATM 2740 O HOH 229 19.391 5.527 -17.490 1.00 52.45 O HETATM 2741 O HOH 230 29.284 14.760 4.248 1.00 56.22 O HETATM 2742 O HOH 231 -3.445 -16.294 -14.607 1.00 64.12 O HETATM 2743 O HOH 232 -13.769 1.337 -18.751 1.00 48.28 O HETATM 2744 O HOH 233 28.539 38.450 -13.256 1.00 40.19 O HETATM 2745 O HOH 234 3.806 28.800 -0.055 1.00 52.37 O HETATM 2746 O HOH 235 -2.033 -6.157 2.995 1.00109.62 O HETATM 2747 O HOH 236 -8.052 12.206 -13.960 1.00 44.33 O HETATM 2748 O HOH 237 11.523 37.377 -4.715 1.00102.52 O HETATM 2749 O HOH 238 22.817 3.942 -19.242 1.00 58.24 O HETATM 2750 O HOH 239 5.204 -5.853 -29.191 1.00 50.20 O HETATM 2751 O HOH 240 13.405 -4.673 -21.544 1.00 64.48 O HETATM 2752 O HOH 241 13.904 8.450 -21.786 1.00 51.31 O HETATM 2753 O HOH 242 37.721 26.878 -11.089 1.00 53.44 O HETATM 2754 O HOH 243 4.724 20.752 -24.573 1.00 58.61 O HETATM 2755 O HOH 244 4.227 8.030 -27.991 1.00 50.24 O HETATM 2756 O HOH 245 21.827 39.708 -15.140 1.00 59.05 O HETATM 2757 O HOH 246 16.041 -0.429 -3.223 1.00 72.26 O HETATM 2758 O HOH 247 27.993 37.395 -15.568 1.00 40.29 O HETATM 2759 O HOH 248 11.505 -8.004 -17.679 1.00 40.02 O HETATM 2760 O HOH 249 32.242 25.282 -23.803 1.00 52.57 O HETATM 2761 O HOH 250 17.138 42.313 -11.018 1.00 36.06 O HETATM 2762 O HOH 251 7.394 13.881 -10.637 1.00 42.52 O HETATM 2763 O HOH 252 2.808 -3.626 2.559 1.00 59.13 O HETATM 2764 O HOH 253 25.482 24.199 8.942 1.00 49.52 O HETATM 2765 O HOH 254 -8.930 12.185 -16.923 1.00 54.98 O HETATM 2766 O HOH 255 11.181 -5.571 -3.548 1.00 31.78 O HETATM 2767 O HOH 256 -3.881 1.235 -0.038 1.00 53.25 O HETATM 2768 O HOH 257 20.367 -1.160 -14.343 1.00 46.35 O HETATM 2769 O HOH 258 -0.928 8.344 -22.979 1.00 44.44 O HETATM 2770 O HOH 259 26.001 2.344 1.262 1.00 53.29 O HETATM 2771 O HOH 260 3.673 -6.661 -2.307 1.00 51.22 O HETATM 2772 O HOH 261 -6.308 17.136 -16.112 1.00 46.22 O HETATM 2773 O HOH 262 29.897 37.481 -5.337 1.00 49.97 O HETATM 2774 O HOH 263 3.032 -6.501 -26.417 1.00 45.06 O HETATM 2775 O HOH 264 2.795 -0.358 4.244 1.00 49.72 O HETATM 2776 O HOH 265 10.808 7.312 -22.813 1.00 54.78 O HETATM 2777 O HOH 266 -1.423 18.028 -16.576 1.00 51.35 O HETATM 2778 O HOH 267 21.375 8.685 -21.821 1.00 50.59 O HETATM 2779 O HOH 268 16.640 4.145 -5.844 1.00 31.48 O HETATM 2780 O HOH 269 33.413 10.926 -0.736 1.00 58.84 O HETATM 2781 O HOH 270 29.239 33.334 -15.754 1.00 37.23 O HETATM 2782 O HOH 271 6.924 -3.936 -0.845 1.00 41.90 O HETATM 2783 O HOH 272 -0.315 -12.287 -20.598 1.00 34.50 O HETATM 2784 O HOH 273 24.039 36.396 4.352 1.00 50.96 O HETATM 2785 O HOH 274 15.292 -9.412 -17.939 1.00 69.10 O HETATM 2786 O HOH 275 14.195 -8.731 -13.957 1.00 17.56 O HETATM 2787 O HOH 276 6.572 -5.101 -3.269 1.00 53.43 O HETATM 2788 O HOH 277 28.040 30.458 -24.429 1.00 51.02 O HETATM 2789 O HOH 278 2.897 27.591 -15.411 1.00 64.60 O HETATM 2790 O HOH 279 33.644 28.656 -1.287 1.00 60.10 O HETATM 2791 O HOH 280 31.267 28.163 0.040 1.00 39.38 O HETATM 2792 O HOH 281 7.950 -1.052 3.337 1.00 42.24 O HETATM 2793 O HOH 282 -7.471 13.264 -16.199 1.00 54.83 O HETATM 2794 O HOH 283 29.125 32.439 -1.066 1.00 42.11 O HETATM 2795 O HOH 284 1.180 5.872 2.746 1.00 49.44 O HETATM 2796 O HOH 285 -13.075 12.531 -10.176 1.00 32.02 O HETATM 2797 O HOH 286 22.728 2.734 -13.824 1.00 52.22 O HETATM 2798 O HOH 287 14.700 0.682 4.970 1.00 46.77 O HETATM 2799 O HOH 288 16.579 28.569 -24.476 1.00 48.42 O HETATM 2800 O HOH 289 -6.733 -14.932 -10.398 1.00 57.00 O HETATM 2801 O HOH 290 -9.825 13.532 -15.757 1.00 44.08 O HETATM 2802 O HOH 291 -10.811 9.079 -1.741 1.00 50.62 O HETATM 2803 O HOH 292 -3.108 -12.088 -6.252 1.00 45.92 O HETATM 2804 O HOH 293 25.339 5.462 -18.124 1.00 52.27 O HETATM 2805 O HOH 294 -16.404 6.897 -7.951 1.00 56.12 O HETATM 2806 O HOH 295 3.295 22.791 3.411 1.00 70.26 O HETATM 2807 C1 BV A 8 9.880 7.809 3.926 1.00 0.32 C HETATM 2808 N4 BV A 8 10.000 7.970 2.590 1.00 -0.24 N HETATM 2809 C21 BV A 8 9.696 9.163 1.844 1.00 0.13 C HETATM 2810 C20 BV A 8 8.331 9.613 2.307 1.00 0.20 C HETATM 2811 N3 BV A 8 8.149 10.895 2.600 1.00 -0.26 N HETATM 2812 C15 BV A 8 6.903 11.388 3.192 1.00 0.14 C HETATM 2813 C14 BV A 8 7.002 11.334 4.774 1.00 0.00 C HETATM 2814 C13 BV A 8 5.870 12.092 5.520 1.00 -0.04 C HETATM 2815 C10 BV A 8 5.771 13.401 5.923 1.00 -0.02 C HETATM 2816 C9 BV A 8 6.579 14.477 5.806 1.00 -0.07 C HETATM 2817 C8 BV A 8 6.147 15.729 6.395 1.00 -0.08 C HETATM 2818 C7 BV A 8 4.885 15.774 7.020 1.00 -0.08 C HETATM 2819 C6 BV A 8 4.100 14.653 7.101 1.00 -0.04 C HETATM 2820 C11 BV A 8 4.516 13.490 6.561 1.00 0.06 C HETATM 2821 N1 BV A 8 3.936 12.240 6.498 1.00 -0.29 N HETATM 2822 C12 BV A 8 4.769 11.422 5.877 1.00 0.02 C HETATM 2823 H12 BV A 8 4.587 10.366 5.686 1.00 0.08 H HETATM 2824 H11 BV A 8 3.010 11.986 6.872 1.00 0.22 H HETATM 2825 H7 BV A 8 3.140 14.702 7.602 1.00 0.05 H HETATM 2826 H8 BV A 8 4.530 16.707 7.442 1.00 0.05 H HETATM 2827 H9 BV A 8 6.779 16.609 6.356 1.00 0.05 H HETATM 2828 H10 BV A 8 7.527 14.406 5.285 1.00 0.05 H HETATM 2829 H13 BV A 8 6.970 10.279 5.084 1.00 0.04 H HETATM 2830 H14 BV A 8 7.965 11.775 5.072 1.00 0.04 H HETATM 2831 C16 BV A 8 6.650 12.833 2.779 1.00 0.20 C HETATM 2832 O1 BV A 8 7.568 13.650 2.708 1.00 -0.39 O HETATM 2833 N2 BV A 8 5.384 13.140 2.583 1.00 -0.28 N HETATM 2834 C17 BV A 8 4.983 14.481 2.177 1.00 0.04 C HETATM 2835 C18 BV A 8 4.506 15.434 3.308 1.00 -0.04 C HETATM 2836 H18 BV A 8 4.233 16.408 2.876 1.00 0.03 H HETATM 2837 H19 BV A 8 5.317 15.571 4.038 1.00 0.03 H HETATM 2838 H20 BV A 8 3.630 14.998 3.810 1.00 0.03 H HETATM 2839 C19 BV A 8 3.848 14.247 1.193 1.00 -0.04 C HETATM 2840 H21 BV A 8 3.475 15.215 0.827 1.00 0.03 H HETATM 2841 H22 BV A 8 3.033 13.706 1.696 1.00 0.03 H HETATM 2842 H23 BV A 8 4.215 13.651 0.345 1.00 0.03 H HETATM 2843 H17 BV A 8 5.831 14.964 1.669 1.00 0.06 H HETATM 2844 H16 BV A 8 4.684 12.438 2.716 1.00 0.19 H HETATM 2845 H15 BV A 8 6.068 10.758 2.852 1.00 0.08 H HETATM 2846 H24 BV A 8 8.886 11.544 2.411 1.00 0.19 H HETATM 2847 O2 BV A 8 7.375 8.868 2.282 1.00 -0.39 O HETATM 2848 C28 BV A 8 9.678 8.822 0.270 1.00 -0.01 C HETATM 2849 C29 BV A 8 9.497 10.065 -0.589 1.00 -0.05 C HETATM 2850 C30 BV A 8 9.615 9.699 -2.017 1.00 -0.05 C HETATM 2851 C31 BV A 8 8.328 9.108 -2.565 1.00 -0.02 C HETATM 2852 N5 BV A 8 8.361 8.960 -4.034 1.00 -0.37 N HETATM 2853 C5 BV A 8 8.156 9.938 -4.872 1.00 0.16 C HETATM 2854 N6 BV A 8 8.325 9.738 -6.174 1.00 -0.28 N HETATM 2855 C2 BV A 8 8.588 8.439 -6.774 1.00 0.05 C HETATM 2856 C4 BV A 8 7.377 7.563 -7.006 1.00 0.02 C HETATM 2857 C32 BV A 8 6.451 8.000 -8.191 1.00 0.04 C HETATM 2858 O5 BV A 8 6.642 9.123 -8.726 1.00 -0.57 O HETATM 2859 O6 BV A 8 5.527 7.175 -8.470 1.00 -0.57 O HETATM 2860 H5 BV A 8 6.775 7.565 -6.086 1.00 0.05 H HETATM 2861 H6 BV A 8 7.731 6.542 -7.210 1.00 0.05 H HETATM 2862 H1 BV A 8 9.073 8.609 -7.747 1.00 0.06 H HETATM 2863 H2 BV A 8 9.276 7.894 -6.111 1.00 0.06 H HETATM 2864 H40 BV A 8 8.266 10.555 -6.799 1.00 0.19 H HETATM 2865 S1 BV A 8 7.988 11.505 -4.255 1.00 0.00 S HETATM 2866 C33 BV A 8 7.353 12.422 -5.618 1.00 0.16 C HETATM 2867 O7 BV A 8 6.551 13.492 -5.061 1.00 -0.35 O HETATM 2868 C36 BV A 8 7.303 14.740 -5.047 1.00 0.12 C HETATM 2869 C35 BV A 8 8.676 14.406 -5.657 1.00 0.11 C HETATM 2870 C34 BV A 8 8.323 13.206 -6.504 1.00 0.12 C HETATM 2871 O8 BV A 8 9.459 12.394 -6.844 1.00 -0.39 O HETATM 2872 H43 BV A 8 9.908 12.131 -6.049 1.00 0.21 H HETATM 2873 H42 BV A 8 7.829 13.530 -7.432 1.00 0.07 H HETATM 2874 O9 BV A 8 9.660 14.067 -4.700 1.00 -0.39 O HETATM 2875 H45 BV A 8 9.869 14.832 -4.178 1.00 0.21 H HETATM 2876 H44 BV A 8 9.046 15.240 -6.271 1.00 0.06 H HETATM 2877 C37 BV A 8 6.559 15.803 -5.869 1.00 0.11 C HETATM 2878 O10 BV A 8 7.247 16.987 -5.612 1.00 -0.25 O HETATM 2879 P1 BV A 8 7.729 17.934 -6.809 1.00 0.30 P HETATM 2880 O11 BV A 8 8.600 17.144 -7.717 1.00 -0.61 O HETATM 2881 O12 BV A 8 8.326 19.067 -6.188 1.00 -0.61 O HETATM 2882 O13 BV A 8 6.387 18.193 -7.658 1.00 -0.13 O HETATM 2883 P2 BV A 8 5.045 19.035 -7.262 1.00 0.30 P HETATM 2884 O14 BV A 8 4.113 18.690 -8.306 1.00 -0.61 O HETATM 2885 O15 BV A 8 4.784 18.878 -5.820 1.00 -0.61 O HETATM 2886 O16 BV A 8 5.470 20.578 -7.369 1.00 -0.25 O HETATM 2887 C38 BV A 8 5.850 21.076 -8.676 1.00 0.11 C HETATM 2888 C39 BV A 8 6.452 22.482 -8.424 1.00 0.12 C HETATM 2889 O17 BV A 8 6.864 23.050 -9.717 1.00 -0.34 O HETATM 2890 C42 BV A 8 6.349 24.510 -9.728 1.00 0.20 C HETATM 2891 C41 BV A 8 5.144 24.443 -8.919 1.00 0.14 C HETATM 2892 C40 BV A 8 5.494 23.519 -7.724 1.00 0.11 C HETATM 2893 O18 BV A 8 6.224 24.207 -6.683 1.00 -0.39 O HETATM 2894 H53 BV A 8 5.651 24.834 -6.257 1.00 0.21 H HETATM 2895 H52 BV A 8 4.596 23.043 -7.303 1.00 0.06 H HETATM 2896 O19 BV A 8 4.811 25.716 -8.486 1.00 -0.38 O HETATM 2897 H55 BV A 8 5.546 26.092 -8.016 1.00 0.21 H HETATM 2898 H54 BV A 8 4.310 24.020 -9.498 1.00 0.07 H HETATM 2899 N7 BV A 8 6.204 24.793 -11.184 1.00 -0.19 N HETATM 2900 C43 BV A 8 5.234 24.400 -12.024 1.00 0.11 C HETATM 2901 N8 BV A 8 5.500 24.690 -13.283 1.00 -0.30 N HETATM 2902 C44 BV A 8 6.732 25.275 -13.251 1.00 0.10 C HETATM 2903 C45 BV A 8 7.128 25.320 -11.940 1.00 0.16 C HETATM 2904 N9 BV A 8 8.289 25.804 -11.545 1.00 -0.27 N HETATM 2905 C46 BV A 8 9.149 26.313 -12.509 1.00 0.05 C HETATM 2906 N10 BV A 8 8.751 26.260 -13.843 1.00 -0.27 N HETATM 2907 C47 BV A 8 7.556 25.827 -14.219 1.00 0.13 C HETATM 2908 N11 BV A 8 7.208 25.849 -15.549 1.00 -0.32 N HETATM 2909 H59 BV A 8 7.845 26.268 -16.241 1.00 0.18 H HETATM 2910 H60 BV A 8 6.310 25.447 -15.853 1.00 0.18 H HETATM 2911 H58 BV A 8 10.105 26.741 -12.231 1.00 0.10 H HETATM 2912 H57 BV A 8 4.325 23.896 -11.701 1.00 0.13 H HETATM 2913 H56 BV A 8 7.059 25.220 -9.279 1.00 0.10 H HETATM 2914 H51 BV A 8 7.338 22.357 -7.784 1.00 0.07 H HETATM 2915 H49 BV A 8 4.970 21.147 -9.332 1.00 0.06 H HETATM 2916 H50 BV A 8 6.598 20.414 -9.137 1.00 0.06 H HETATM 2917 H47 BV A 8 5.511 15.883 -5.543 1.00 0.06 H HETATM 2918 H48 BV A 8 6.592 15.559 -6.941 1.00 0.06 H HETATM 2919 H46 BV A 8 7.427 15.102 -4.016 1.00 0.07 H HETATM 2920 H41 BV A 8 6.756 11.743 -6.244 1.00 0.08 H HETATM 2921 H38 BV A 8 7.492 9.769 -2.295 1.00 0.03 H HETATM 2922 H39 BV A 8 8.173 8.117 -2.113 1.00 0.03 H HETATM 2923 H36 BV A 8 10.420 8.958 -2.128 1.00 0.03 H HETATM 2924 H37 BV A 8 9.865 10.601 -2.595 1.00 0.03 H HETATM 2925 H34 BV A 8 10.272 10.803 -0.334 1.00 0.03 H HETATM 2926 H35 BV A 8 8.503 10.498 -0.403 1.00 0.03 H HETATM 2927 H32 BV A 8 8.848 8.129 0.068 1.00 0.03 H HETATM 2928 H33 BV A 8 10.631 8.342 0.001 1.00 0.03 H HETATM 2929 H25 BV A 8 10.444 9.944 2.045 1.00 0.08 H HETATM 2930 H26 BV A 8 10.332 7.184 2.069 1.00 0.19 H HETATM 2931 O3 BV A 8 9.455 8.728 4.634 1.00 -0.38 O HETATM 2932 O4 BV A 8 10.185 6.609 4.378 1.00 -0.25 O HETATM 2933 C3 BV A 8 10.284 6.540 5.837 1.00 0.11 C HETATM 2934 C22 BV A 8 11.221 5.511 6.221 1.00 -0.01 C HETATM 2935 C23 BV A 8 12.466 5.876 6.623 1.00 -0.06 C HETATM 2936 C24 BV A 8 13.421 4.958 7.036 1.00 -0.07 C HETATM 2937 C25 BV A 8 13.123 3.610 7.012 1.00 -0.07 C HETATM 2938 C26 BV A 8 11.857 3.212 6.552 1.00 -0.07 C HETATM 2939 C27 BV A 8 10.917 4.157 6.154 1.00 -0.06 C HETATM 2940 H31 BV A 8 9.947 3.837 5.791 1.00 0.06 H HETATM 2941 H30 BV A 8 11.610 2.158 6.507 1.00 0.06 H HETATM 2942 H29 BV A 8 13.850 2.876 7.341 1.00 0.06 H HETATM 2943 H28 BV A 8 14.393 5.296 7.375 1.00 0.06 H HETATM 2944 H27 BV A 8 12.724 6.929 6.621 1.00 0.06 H HETATM 2945 H3 BV A 8 9.295 6.308 6.258 1.00 0.08 H HETATM 2946 H4 BV A 8 10.629 7.510 6.225 1.00 0.08 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1311 1310 2512 CONECT 1335 1334 2512 CONECT 1660 1659 2512 CONECT 1698 1697 2512 CONECT 2512 1311 1335 1660 1698 CONECT 2807 2808 2931 2932 CONECT 2808 2807 2809 2930 CONECT 2809 2808 2810 2848 2929 CONECT 2810 2809 2811 2847 CONECT 2811 2810 2812 2846 CONECT 2812 2811 2813 2831 2845 CONECT 2813 2812 2814 2829 2830 CONECT 2814 2813 2815 2822 CONECT 2815 2814 2816 2820 CONECT 2816 2815 2817 2828 CONECT 2817 2816 2818 2827 CONECT 2818 2817 2819 2826 CONECT 2819 2818 2820 2825 CONECT 2820 2815 2819 2821 CONECT 2821 2820 2822 2824 CONECT 2822 2814 2821 2823 CONECT 2823 2822 CONECT 2824 2821 CONECT 2825 2819 CONECT 2826 2818 CONECT 2827 2817 CONECT 2828 2816 CONECT 2829 2813 CONECT 2830 2813 CONECT 2831 2812 2832 2833 CONECT 2832 2831 CONECT 2833 2831 2834 2844 CONECT 2834 2833 2835 2839 2843 CONECT 2835 2834 2836 2837 2838 CONECT 2836 2835 CONECT 2837 2835 CONECT 2838 2835 CONECT 2839 2834 2840 2841 2842 CONECT 2840 2839 CONECT 2841 2839 CONECT 2842 2839 CONECT 2843 2834 CONECT 2844 2833 CONECT 2845 2812 CONECT 2846 2811 CONECT 2847 2810 CONECT 2848 2809 2849 2927 2928 CONECT 2849 2848 2850 2925 2926 CONECT 2850 2849 2851 2923 2924 CONECT 2851 2850 2852 2921 2922 CONECT 2852 2851 2853 CONECT 2853 2852 2854 2865 CONECT 2854 2853 2855 2864 CONECT 2855 2854 2856 2862 2863 CONECT 2856 2855 2857 2860 2861 CONECT 2857 2856 2858 2859 CONECT 2858 2857 CONECT 2859 2857 CONECT 2860 2856 CONECT 2861 2856 CONECT 2862 2855 CONECT 2863 2855 CONECT 2864 2854 CONECT 2865 2853 2866 CONECT 2866 2865 2867 2870 2920 CONECT 2867 2866 2868 CONECT 2868 2867 2869 2877 2919 CONECT 2869 2868 2870 2874 2876 CONECT 2870 2866 2869 2871 2873 CONECT 2871 2870 2872 CONECT 2872 2871 CONECT 2873 2870 CONECT 2874 2869 2875 CONECT 2875 2874 CONECT 2876 2869 CONECT 2877 2868 2878 2917 2918 CONECT 2878 2877 2879 CONECT 2879 2878 2880 2881 2882 CONECT 2880 2879 CONECT 2881 2879 CONECT 2882 2879 2883 CONECT 2883 2882 2884 2885 2886 CONECT 2884 2883 CONECT 2885 2883 CONECT 2886 2883 2887 CONECT 2887 2886 2888 2915 2916 CONECT 2888 2887 2889 2892 2914 CONECT 2889 2888 2890 CONECT 2890 2889 2891 2899 2913 CONECT 2891 2890 2892 2896 2898 CONECT 2892 2888 2891 2893 2895 CONECT 2893 2892 2894 CONECT 2894 2893 CONECT 2895 2892 CONECT 2896 2891 2897 CONECT 2897 2896 CONECT 2898 2891 CONECT 2899 2890 2900 2903 CONECT 2900 2899 2901 2912 CONECT 2901 2900 2902 CONECT 2902 2901 2903 2907 CONECT 2903 2899 2902 2904 CONECT 2904 2903 2905 CONECT 2905 2904 2906 2911 CONECT 2906 2905 2907 CONECT 2907 2902 2906 2908 CONECT 2908 2907 2909 2910 CONECT 2909 2908 CONECT 2910 2908 CONECT 2911 2905 CONECT 2912 2900 CONECT 2913 2890 CONECT 2914 2888 CONECT 2915 2887 CONECT 2916 2887 CONECT 2917 2877 CONECT 2918 2877 CONECT 2919 2868 CONECT 2920 2866 CONECT 2921 2851 CONECT 2922 2851 CONECT 2923 2850 CONECT 2924 2850 CONECT 2925 2849 CONECT 2926 2849 CONECT 2927 2848 CONECT 2928 2848 CONECT 2929 2809 CONECT 2930 2808 CONECT 2931 2807 CONECT 2932 2807 2933 CONECT 2933 2932 2934 2945 2946 CONECT 2934 2933 2935 2939 CONECT 2935 2934 2936 2944 CONECT 2936 2935 2937 2943 CONECT 2937 2936 2938 2942 CONECT 2938 2937 2939 2941 CONECT 2939 2934 2938 2940 CONECT 2940 2939 CONECT 2941 2938 CONECT 2942 2937 CONECT 2943 2936 CONECT 2944 2935 CONECT 2945 2933 CONECT 2946 2933 MASTER 0 0 0 0 0 0 0 0 2945 1 149 21 END
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Structure:
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Related entries of code: 6eqs
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2nyr
RCSB PDB
PDBbind
271aa, >2NYR_1|Chains... at 99%
5xhs
RCSB PDB
PDBbind
288aa, >5XHS_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6eqs
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Sirtuin 5 Deacylase
Ligand Name
BV8
EC.Number
E.C.-.-.-.-
Resolution
1.32(Å)
Affinity (Kd/Ki/IC50)
IC50=0.37uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Angew. Chem. Int. Ed. Engl. Vol. 56: pp. 14836-14841
Ligand Properties
Formula
C
4
7
H
6
5
N
1
1
O
1
9
P
2
S
Molecular Weight
1182.090
Exact Mass
1181.370
No. of atoms
145
No. of bonds
151
Polar Surface Area
504.1
LOGP Value
-0.41 (
Computed with XLOGP3
)
2.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 10
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 36
No. of Nitrogen and Oxygen Atoms: 30
No. of Rings: 7
Canonical SMILES
CC(NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)OCc1ccccc1)CCCC/N=C(\S[C@H]1O[C@@H]([C@H]([C@H]1O)O)COP(OP(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)(O)O)(O)O)/NCCC(=O)O)C
InChI String
InChI=1S/C47H67N11O19P2S/c1-25(2)55-43(66)31(18-27-19-51-29-13-7-6-12-28(27)29)56-42(65)30(57-47(67)72-20-26-10-4-3-5-11-26)14-8-9-16-49-46(50-17-15-34(59)60)80-45-39(64)37(62)33(76-45)22-74-79(70,71)77-78(68,69)73-21-32-36(61)38(63)44(75-32)58-24-54-35-40(48)52-23-53-41(35)58/h3-7,10-13,19,23-25,30-33,36-39,44-45,51,61-64,68-71,78-79H,8-9,14-18,20-22H2,1-2H3,(H,49,50)(H,55,66)(H,56,65)(H,57,67)(H,59,60)(H2,48,52,53)/t30-,31-,32+,33+,36+,37+,38+,39+,44+,45+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9NXA8
Entrez Gene ID
NCBI Entrez Gene ID:
23408
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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