Browse entries in the PDBbind-CN Database
HEADER 4MYD_COMPLEX COMPND 4MYD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 252 MET ILE LEU HIS ALA GLN ALA LYS HIS GLY LYS PRO GLY SEQRES 2 A 252 LEU PRO TRP LEU VAL PHE LEU HIS GLY PHE SER GLY ASP SEQRES 3 A 252 CYS HIS GLU TRP GLN GLU VAL GLY GLU ALA PHE ALA ASP SEQRES 4 A 252 TYR SER ARG LEU TYR VAL ASP LEU PRO GLY HIS GLY GLY SEQRES 5 A 252 SER ALA ALA ILE SER VAL ASP GLY PHE ASP ASP VAL THR SEQRES 6 A 252 ASP LEU LEU ARG LYS THR LEU VAL SER TYR ASN ILE LEU SEQRES 7 A 252 ASP PHE TRP LEU VAL GLY TYR SER LEU GLY GLY ARG VAL SEQRES 8 A 252 ALA MET MET ALA ALA CYS GLN GLY LEU ALA GLY LEU CYS SEQRES 9 A 252 GLY VAL ILE VAL GLU GLY GLY HIS PRO GLY LEU GLN ASN SEQRES 10 A 252 ALA GLU GLN ARG ALA GLU ARG GLN ARG SER ASP ARG GLN SEQRES 11 A 252 TRP VAL GLN ARG PHE LEU THR GLU PRO LEU THR ALA VAL SEQRES 12 A 252 PHE ALA ASP TRP TYR GLN GLN PRO VAL PHE ALA SER LEU SEQRES 13 A 252 ASN ASP ASP GLN ARG ARG GLU LEU VAL ALA LEU ARG SER SEQRES 14 A 252 ASN ASN ASN GLY ALA THR LEU ALA ALA MET LEU GLU ALA SEQRES 15 A 252 THR SER LEU ALA VAL GLN PRO ASP LEU ARG ALA ASN LEU SEQRES 16 A 252 SER ALA ARG THR PHE ALA PHE TYR TYR LEU CYS GLY GLU SEQRES 17 A 252 ARG ASP SER LYS PHE ARG ALA LEU ALA ALA GLU LEU ALA SEQRES 18 A 252 ALA ASP CYS HIS VAL ILE PRO ARG ALA GLY HIS ASN ALA SEQRES 19 A 252 HIS ARG GLU ASN PRO ALA GLY VAL ILE ALA SER LEU ALA SEQRES 20 A 252 GLN ILE LEU ARG PHE HET UNN A 604 27 ATOM 1 N MET A 1 11.816 76.144 -10.716 1.00 40.07 N ATOM 2 CA MET A 1 13.155 75.868 -10.104 1.00 37.84 C ATOM 3 C MET A 1 13.062 74.959 -8.894 1.00 32.13 C ATOM 4 O MET A 1 12.255 75.158 -7.981 1.00 32.29 O ATOM 5 CB MET A 1 13.859 77.167 -9.716 1.00 44.65 C ATOM 6 CG MET A 1 15.271 76.993 -9.211 1.00 52.53 C ATOM 7 SD MET A 1 16.382 76.166 -10.380 1.00 58.54 S ATOM 8 CE MET A 1 16.369 77.352 -11.719 1.00 60.38 C ATOM 9 HN3 MET A 1 11.204 76.606 -10.013 1.00 0.00 H ATOM 10 HN2 MET A 1 11.384 75.248 -11.019 1.00 0.00 H ATOM 11 HN1 MET A 1 11.934 76.769 -11.539 1.00 0.00 H ATOM 12 N ILE A 2 13.913 73.949 -8.922 1.00 25.09 N ATOM 13 CA ILE A 2 14.040 73.010 -7.838 1.00 20.57 C ATOM 14 C ILE A 2 15.498 72.944 -7.400 1.00 19.30 C ATOM 15 O ILE A 2 16.392 73.444 -8.069 1.00 20.37 O ATOM 16 CB ILE A 2 13.554 71.625 -8.249 1.00 22.05 C ATOM 17 CG1 ILE A 2 14.428 71.073 -9.362 1.00 23.40 C ATOM 18 CG2 ILE A 2 12.077 71.666 -8.665 1.00 22.84 C ATOM 19 CD1 ILE A 2 14.208 69.621 -9.617 1.00 27.12 C ATOM 20 H ILE A 2 14.516 73.827 -9.761 1.00 0.00 H ATOM 21 N LEU A 3 15.734 72.341 -6.254 1.00 15.16 N ATOM 22 CA LEU A 3 17.087 72.148 -5.772 1.00 14.10 C ATOM 23 C LEU A 3 17.789 71.031 -6.542 1.00 13.23 C ATOM 24 O LEU A 3 17.157 70.032 -6.898 1.00 15.40 O ATOM 25 CB LEU A 3 17.085 71.817 -4.287 1.00 13.04 C ATOM 26 CG LEU A 3 16.495 72.899 -3.397 1.00 14.28 C ATOM 27 CD1 LEU A 3 16.397 72.412 -1.949 1.00 15.70 C ATOM 28 CD2 LEU A 3 17.311 74.178 -3.470 1.00 15.45 C ATOM 29 H LEU A 3 14.935 71.997 -5.684 1.00 0.00 H ATOM 30 N HIS A 4 19.088 71.183 -6.794 1.00 13.41 N ATOM 31 CA HIS A 4 19.866 70.061 -7.275 1.00 13.29 C ATOM 32 C HIS A 4 19.885 68.969 -6.214 1.00 12.66 C ATOM 33 O HIS A 4 20.030 69.249 -5.013 1.00 12.67 O ATOM 34 CB HIS A 4 21.296 70.460 -7.612 1.00 14.01 C ATOM 35 CG HIS A 4 22.105 69.305 -8.094 1.00 16.07 C ATOM 36 ND1 HIS A 4 23.039 68.660 -7.319 1.00 18.98 N ATOM 37 CD2 HIS A 4 22.045 68.615 -9.256 1.00 18.36 C ATOM 38 CE1 HIS A 4 23.550 67.648 -7.998 1.00 20.60 C ATOM 39 NE2 HIS A 4 22.975 67.609 -9.180 1.00 20.78 N ATOM 40 H HIS A 4 19.543 72.106 -6.645 1.00 0.00 H ATOM 41 N ALA A 5 19.760 67.719 -6.649 1.00 13.42 N ATOM 42 CA ALA A 5 19.776 66.573 -5.763 1.00 13.42 C ATOM 43 C ALA A 5 20.231 65.335 -6.510 1.00 15.18 C ATOM 44 O ALA A 5 20.170 65.291 -7.752 1.00 16.54 O ATOM 45 CB ALA A 5 18.399 66.349 -5.153 1.00 14.11 C ATOM 46 H ALA A 5 19.646 67.557 -7.670 1.00 0.00 H ATOM 47 N GLN A 6 20.659 64.329 -5.758 1.00 14.30 N ATOM 48 CA GLN A 6 20.913 62.993 -6.298 1.00 14.70 C ATOM 49 C GLN A 6 19.924 62.029 -5.694 1.00 14.60 C ATOM 50 O GLN A 6 19.836 61.933 -4.469 1.00 14.19 O ATOM 51 CB GLN A 6 22.342 62.541 -6.006 1.00 15.72 C ATOM 52 CG GLN A 6 23.373 63.435 -6.629 1.00 18.20 C ATOM 53 CD GLN A 6 24.802 62.964 -6.450 1.00 20.86 C ATOM 54 OE1 GLN A 6 25.103 62.064 -5.666 1.00 22.81 O ATOM 55 NE2 GLN A 6 25.684 63.537 -7.237 1.00 25.86 N ATOM 56 HE22 GLN A 6 25.388 64.294 -7.885 1.00 0.00 H ATOM 57 HE21 GLN A 6 26.678 63.233 -7.212 1.00 0.00 H ATOM 58 H GLN A 6 20.820 64.497 -4.744 1.00 0.00 H ATOM 59 N ALA A 7 19.167 61.348 -6.558 1.00 16.22 N ATOM 60 CA ALA A 7 18.180 60.366 -6.114 1.00 16.08 C ATOM 61 C ALA A 7 18.684 58.947 -6.313 1.00 18.39 C ATOM 62 O ALA A 7 19.302 58.626 -7.346 1.00 20.56 O ATOM 63 CB ALA A 7 16.901 60.545 -6.855 1.00 16.76 C ATOM 64 H ALA A 7 19.283 61.522 -7.577 1.00 0.00 H ATOM 65 N LYS A 8 18.378 58.102 -5.335 1.00 17.72 N ATOM 66 CA LYS A 8 18.643 56.664 -5.422 1.00 18.94 C ATOM 67 C LYS A 8 17.327 55.958 -5.124 1.00 19.82 C ATOM 68 O LYS A 8 16.717 56.195 -4.091 1.00 19.60 O ATOM 69 CB LYS A 8 19.684 56.224 -4.399 1.00 23.29 C ATOM 70 CG LYS A 8 20.937 57.020 -4.372 1.00 28.54 C ATOM 71 CD LYS A 8 21.836 56.866 -5.549 1.00 36.09 C ATOM 72 CE LYS A 8 23.131 57.577 -5.212 1.00 42.06 C ATOM 73 NZ LYS A 8 23.989 57.834 -6.389 1.00 46.19 N ATOM 74 HZ1 LYS A 8 24.238 56.930 -6.839 1.00 0.00 H ATOM 75 HZ2 LYS A 8 23.474 58.430 -7.068 1.00 0.00 H ATOM 76 HZ3 LYS A 8 24.856 58.322 -6.085 1.00 0.00 H ATOM 77 H LYS A 8 17.932 58.476 -4.473 1.00 0.00 H ATOM 78 N HIS A 9 16.886 55.088 -6.011 1.00 21.34 N ATOM 79 CA HIS A 9 15.622 54.391 -5.820 1.00 21.95 C ATOM 80 C HIS A 9 15.812 53.072 -5.097 1.00 21.78 C ATOM 81 O HIS A 9 16.688 52.263 -5.454 1.00 26.34 O ATOM 82 CB HIS A 9 14.948 54.211 -7.182 1.00 23.43 C ATOM 83 CG HIS A 9 14.668 55.518 -7.841 1.00 28.16 C ATOM 84 ND1 HIS A 9 15.528 56.104 -8.744 1.00 34.84 N ATOM 85 CD2 HIS A 9 13.670 56.408 -7.642 1.00 29.96 C ATOM 86 CE1 HIS A 9 15.036 57.269 -9.122 1.00 33.71 C ATOM 87 NE2 HIS A 9 13.907 57.477 -8.471 1.00 32.33 N ATOM 88 H HIS A 9 17.451 54.896 -6.863 1.00 0.00 H ATOM 89 N GLY A 10 15.001 52.881 -4.062 1.00 20.02 N ATOM 90 CA GLY A 10 15.000 51.650 -3.302 1.00 21.28 C ATOM 91 C GLY A 10 13.762 50.837 -3.658 1.00 21.30 C ATOM 92 O GLY A 10 13.258 50.890 -4.795 1.00 22.86 O ATOM 93 H GLY A 10 14.346 53.641 -3.789 1.00 0.00 H ATOM 94 N LYS A 11 13.238 50.109 -2.683 1.00 21.62 N ATOM 95 CA LYS A 11 12.092 49.246 -2.928 1.00 24.64 C ATOM 96 C LYS A 11 10.861 50.099 -3.134 1.00 22.73 C ATOM 97 O LYS A 11 10.592 50.996 -2.318 1.00 21.64 O ATOM 98 CB LYS A 11 11.858 48.317 -1.753 1.00 27.67 C ATOM 99 CG LYS A 11 12.892 47.257 -1.544 1.00 32.49 C ATOM 100 CD LYS A 11 12.441 46.383 -0.397 1.00 38.77 C ATOM 101 CE LYS A 11 13.360 45.221 -0.170 1.00 42.53 C ATOM 102 NZ LYS A 11 13.028 44.567 1.140 1.00 45.09 N ATOM 103 HZ1 LYS A 11 13.144 45.257 1.910 1.00 0.00 H ATOM 104 HZ2 LYS A 11 12.044 44.232 1.119 1.00 0.00 H ATOM 105 HZ3 LYS A 11 13.667 43.761 1.295 1.00 0.00 H ATOM 106 H LYS A 11 13.651 50.155 -1.730 1.00 0.00 H ATOM 107 N PRO A 12 10.079 49.817 -4.174 1.00 23.01 N ATOM 108 CA PRO A 12 8.871 50.613 -4.345 1.00 23.36 C ATOM 109 C PRO A 12 7.963 50.517 -3.133 1.00 22.29 C ATOM 110 O PRO A 12 7.682 49.415 -2.656 1.00 23.22 O ATOM 111 CB PRO A 12 8.200 49.988 -5.575 1.00 24.45 C ATOM 112 CG PRO A 12 9.239 49.255 -6.272 1.00 27.87 C ATOM 113 CD PRO A 12 10.257 48.831 -5.246 1.00 25.94 C ATOM 114 N GLY A 13 7.468 51.662 -2.681 1.00 21.23 N ATOM 115 CA GLY A 13 6.525 51.705 -1.580 1.00 20.67 C ATOM 116 C GLY A 13 7.144 52.047 -0.242 1.00 20.07 C ATOM 117 O GLY A 13 6.440 52.478 0.656 1.00 20.66 O ATOM 118 H GLY A 13 7.764 52.553 -3.128 1.00 0.00 H ATOM 119 N LEU A 14 8.452 51.847 -0.089 1.00 20.15 N ATOM 120 CA LEU A 14 9.098 52.232 1.151 1.00 18.97 C ATOM 121 C LEU A 14 9.312 53.733 1.147 1.00 17.24 C ATOM 122 O LEU A 14 9.385 54.352 0.104 1.00 17.20 O ATOM 123 CB LEU A 14 10.413 51.493 1.342 1.00 22.52 C ATOM 124 CG LEU A 14 10.279 50.270 2.253 1.00 28.87 C ATOM 125 CD1 LEU A 14 9.199 49.351 1.793 1.00 31.16 C ATOM 126 CD2 LEU A 14 11.572 49.509 2.330 1.00 30.08 C ATOM 127 H LEU A 14 9.008 51.417 -0.856 1.00 0.00 H ATOM 128 N PRO A 15 9.405 54.322 2.328 1.00 17.91 N ATOM 129 CA PRO A 15 9.581 55.773 2.360 1.00 17.41 C ATOM 130 C PRO A 15 10.868 56.255 1.719 1.00 15.57 C ATOM 131 O PRO A 15 11.854 55.511 1.593 1.00 15.97 O ATOM 132 CB PRO A 15 9.596 56.091 3.857 1.00 17.24 C ATOM 133 CG PRO A 15 8.953 54.864 4.523 1.00 21.28 C ATOM 134 CD PRO A 15 9.340 53.716 3.668 1.00 20.29 C ATOM 135 N TRP A 16 10.871 57.522 1.336 1.00 13.86 N ATOM 136 CA TRP A 16 12.126 58.180 1.014 1.00 12.75 C ATOM 137 C TRP A 16 12.787 58.703 2.282 1.00 12.25 C ATOM 138 O TRP A 16 12.123 59.184 3.203 1.00 14.20 O ATOM 139 CB TRP A 16 11.905 59.348 0.071 1.00 13.88 C ATOM 140 CG TRP A 16 11.582 58.976 -1.331 1.00 13.55 C ATOM 141 CD1 TRP A 16 10.396 58.455 -1.812 1.00 14.73 C ATOM 142 CD2 TRP A 16 12.447 59.105 -2.451 1.00 14.12 C ATOM 143 NE1 TRP A 16 10.492 58.271 -3.148 1.00 14.98 N ATOM 144 CE2 TRP A 16 11.736 58.645 -3.581 1.00 13.95 C ATOM 145 CE3 TRP A 16 13.766 59.557 -2.603 1.00 13.65 C ATOM 146 CZ2 TRP A 16 12.286 58.648 -4.864 1.00 15.44 C ATOM 147 CZ3 TRP A 16 14.318 59.564 -3.864 1.00 14.82 C ATOM 148 CH2 TRP A 16 13.580 59.098 -4.995 1.00 15.20 C ATOM 149 HE1 TRP A 16 9.734 57.901 -3.756 1.00 0.00 H ATOM 150 H TRP A 16 9.976 58.046 1.266 1.00 0.00 H ATOM 151 N LEU A 17 14.104 58.665 2.289 1.00 12.21 N ATOM 152 CA LEU A 17 14.947 59.358 3.264 1.00 12.48 C ATOM 153 C LEU A 17 15.545 60.562 2.551 1.00 11.63 C ATOM 154 O LEU A 17 16.316 60.384 1.595 1.00 12.16 O ATOM 155 CB LEU A 17 16.043 58.443 3.786 1.00 13.06 C ATOM 156 CG LEU A 17 15.550 57.123 4.394 1.00 13.55 C ATOM 157 CD1 LEU A 17 16.722 56.250 4.833 1.00 16.82 C ATOM 158 CD2 LEU A 17 14.561 57.334 5.550 1.00 16.05 C ATOM 159 H LEU A 17 14.577 58.104 1.551 1.00 0.00 H ATOM 160 N VAL A 18 15.159 61.771 2.958 1.00 11.32 N ATOM 161 CA VAL A 18 15.581 63.008 2.312 1.00 11.04 C ATOM 162 C VAL A 18 16.616 63.645 3.242 1.00 10.64 C ATOM 163 O VAL A 18 16.289 64.040 4.353 1.00 11.95 O ATOM 164 CB VAL A 18 14.402 63.949 2.068 1.00 11.43 C ATOM 165 CG1 VAL A 18 14.878 65.235 1.452 1.00 12.39 C ATOM 166 CG2 VAL A 18 13.374 63.268 1.165 1.00 12.52 C ATOM 167 H VAL A 18 14.524 61.835 3.779 1.00 0.00 H ATOM 168 N PHE A 19 17.868 63.681 2.791 1.00 9.76 N ATOM 169 CA PHE A 19 19.021 64.084 3.596 1.00 10.29 C ATOM 170 C PHE A 19 19.439 65.497 3.286 1.00 10.43 C ATOM 171 O PHE A 19 19.662 65.831 2.109 1.00 10.19 O ATOM 172 CB PHE A 19 20.197 63.172 3.310 1.00 11.12 C ATOM 173 CG PHE A 19 20.007 61.767 3.797 1.00 11.24 C ATOM 174 CD1 PHE A 19 20.253 61.422 5.114 1.00 11.25 C ATOM 175 CD2 PHE A 19 19.584 60.782 2.911 1.00 12.70 C ATOM 176 CE1 PHE A 19 20.091 60.127 5.552 1.00 13.28 C ATOM 177 CE2 PHE A 19 19.395 59.480 3.344 1.00 14.11 C ATOM 178 CZ PHE A 19 19.649 59.145 4.655 1.00 14.17 C ATOM 179 H PHE A 19 18.037 63.405 1.803 1.00 0.00 H ATOM 180 N LEU A 20 19.632 66.305 4.328 1.00 10.17 N ATOM 181 CA LEU A 20 20.054 67.688 4.219 1.00 10.02 C ATOM 182 C LEU A 20 21.381 67.873 4.946 1.00 9.17 C ATOM 183 O LEU A 20 21.455 67.655 6.162 1.00 9.65 O ATOM 184 CB LEU A 20 19.006 68.632 4.829 1.00 9.85 C ATOM 185 CG LEU A 20 17.583 68.465 4.313 1.00 9.84 C ATOM 186 CD1 LEU A 20 16.715 69.505 4.944 1.00 12.90 C ATOM 187 CD2 LEU A 20 17.476 68.561 2.796 1.00 11.06 C ATOM 188 H LEU A 20 19.470 65.919 5.280 1.00 0.00 H ATOM 189 N HIS A 21 22.402 68.267 4.198 1.00 9.67 N ATOM 190 CA HIS A 21 23.738 68.558 4.718 1.00 9.69 C ATOM 191 C HIS A 21 23.760 69.853 5.549 1.00 9.26 C ATOM 192 O HIS A 21 22.744 70.551 5.652 1.00 9.79 O ATOM 193 CB HIS A 21 24.696 68.666 3.549 1.00 9.48 C ATOM 194 CG HIS A 21 24.392 69.803 2.630 1.00 9.55 C ATOM 195 ND1 HIS A 21 24.727 71.103 2.921 1.00 9.93 N ATOM 196 CD2 HIS A 21 23.740 69.846 1.429 1.00 9.06 C ATOM 197 CE1 HIS A 21 24.304 71.896 1.948 1.00 9.53 C ATOM 198 NE2 HIS A 21 23.672 71.160 1.036 1.00 10.02 N ATOM 199 H HIS A 21 22.243 68.376 3.176 1.00 0.00 H ATOM 200 N GLY A 22 24.926 70.170 6.116 1.00 8.73 N ATOM 201 CA GLY A 22 25.097 71.357 6.885 1.00 9.27 C ATOM 202 C GLY A 22 25.799 72.462 6.126 1.00 8.84 C ATOM 203 O GLY A 22 26.074 72.367 4.926 1.00 9.49 O ATOM 204 H GLY A 22 25.736 69.530 5.992 1.00 0.00 H ATOM 205 N PHE A 23 26.124 73.543 6.811 1.00 9.23 N ATOM 206 CA PHE A 23 26.714 74.693 6.148 1.00 8.52 C ATOM 207 C PHE A 23 28.091 74.310 5.607 1.00 7.43 C ATOM 208 O PHE A 23 28.927 73.735 6.313 1.00 8.94 O ATOM 209 CB PHE A 23 26.845 75.889 7.095 1.00 9.05 C ATOM 210 CG PHE A 23 27.448 77.073 6.417 1.00 9.14 C ATOM 211 CD1 PHE A 23 26.719 77.822 5.514 1.00 11.34 C ATOM 212 CD2 PHE A 23 28.769 77.404 6.641 1.00 11.13 C ATOM 213 CE1 PHE A 23 27.294 78.885 4.859 1.00 13.77 C ATOM 214 CE2 PHE A 23 29.365 78.440 5.979 1.00 12.62 C ATOM 215 CZ PHE A 23 28.616 79.191 5.091 1.00 13.41 C ATOM 216 H PHE A 23 25.956 73.571 7.837 1.00 0.00 H ATOM 217 N SER A 24 28.290 74.680 4.349 1.00 7.94 N ATOM 218 CA SER A 24 29.453 74.389 3.504 1.00 8.49 C ATOM 219 C SER A 24 29.484 72.963 2.976 1.00 9.11 C ATOM 220 O SER A 24 30.380 72.619 2.186 1.00 9.71 O ATOM 221 CB SER A 24 30.786 74.742 4.193 1.00 9.84 C ATOM 222 OG SER A 24 31.319 73.757 5.056 1.00 9.93 O ATOM 223 HG SER A 24 30.673 73.573 5.784 1.00 0.00 H ATOM 224 H SER A 24 27.533 75.242 3.910 1.00 0.00 H ATOM 225 N GLY A 25 28.497 72.143 3.326 1.00 9.44 N ATOM 226 CA GLY A 25 28.425 70.799 2.828 1.00 9.65 C ATOM 227 C GLY A 25 27.807 70.737 1.447 1.00 8.95 C ATOM 228 O GLY A 25 27.506 71.752 0.819 1.00 9.44 O ATOM 229 H GLY A 25 27.760 72.484 3.976 1.00 0.00 H ATOM 230 N ASP A 26 27.592 69.522 0.975 1.00 9.98 N ATOM 231 CA ASP A 26 26.842 69.293 -0.259 1.00 10.16 C ATOM 232 C ASP A 26 26.183 67.921 -0.178 1.00 9.68 C ATOM 233 O ASP A 26 26.192 67.275 0.906 1.00 9.84 O ATOM 234 CB ASP A 26 27.751 69.432 -1.509 1.00 10.83 C ATOM 235 CG ASP A 26 28.752 68.301 -1.685 1.00 12.54 C ATOM 236 OD1 ASP A 26 28.735 67.313 -0.962 1.00 11.34 O ATOM 237 OD2 ASP A 26 29.569 68.407 -2.623 1.00 19.26 O ATOM 238 H ASP A 26 27.967 68.704 1.497 1.00 0.00 H ATOM 239 N CYS A 27 25.587 67.483 -1.278 1.00 9.97 N ATOM 240 CA CYS A 27 24.784 66.269 -1.274 1.00 11.35 C ATOM 241 C CYS A 27 25.559 64.982 -0.990 1.00 11.59 C ATOM 242 O CYS A 27 24.959 63.965 -0.719 1.00 11.34 O ATOM 243 CB CYS A 27 24.037 66.135 -2.595 1.00 14.38 C ATOM 244 SG CYS A 27 25.076 65.767 -4.004 1.00 17.52 S ATOM 245 H CYS A 27 25.695 68.018 -2.163 1.00 0.00 H ATOM 246 N HIS A 28 26.879 65.048 -0.968 1.00 10.90 N ATOM 247 CA HIS A 28 27.663 63.883 -0.592 1.00 11.14 C ATOM 248 C HIS A 28 27.726 63.644 0.916 1.00 10.90 C ATOM 249 O HIS A 28 28.081 62.548 1.335 1.00 11.73 O ATOM 250 CB HIS A 28 29.092 64.030 -1.142 1.00 13.22 C ATOM 251 CG HIS A 28 29.103 64.064 -2.617 1.00 15.24 C ATOM 252 ND1 HIS A 28 28.979 62.920 -3.375 1.00 20.42 N ATOM 253 CD2 HIS A 28 29.097 65.103 -3.485 1.00 17.50 C ATOM 254 CE1 HIS A 28 28.965 63.250 -4.652 1.00 20.72 C ATOM 255 NE2 HIS A 28 29.022 64.567 -4.744 1.00 21.69 N ATOM 256 H HIS A 28 27.358 65.936 -1.220 1.00 0.00 H ATOM 257 N GLU A 29 27.384 64.654 1.706 1.00 10.38 N ATOM 258 CA GLU A 29 27.557 64.624 3.160 1.00 10.43 C ATOM 259 C GLU A 29 26.995 63.363 3.787 1.00 11.24 C ATOM 260 O GLU A 29 27.680 62.717 4.583 1.00 10.82 O ATOM 261 CB GLU A 29 26.924 65.862 3.795 1.00 10.46 C ATOM 262 CG GLU A 29 27.076 65.930 5.297 1.00 9.62 C ATOM 263 CD GLU A 29 28.524 66.126 5.690 1.00 9.87 C ATOM 264 OE1 GLU A 29 29.165 67.048 5.147 1.00 10.29 O ATOM 265 OE2 GLU A 29 29.026 65.379 6.553 1.00 10.36 O ATOM 266 H GLU A 29 26.974 65.506 1.273 1.00 0.00 H ATOM 267 N TRP A 30 25.758 63.020 3.461 1.00 10.67 N ATOM 268 CA TRP A 30 25.063 61.909 4.114 1.00 10.19 C ATOM 269 C TRP A 30 25.181 60.576 3.363 1.00 11.88 C ATOM 270 O TRP A 30 24.555 59.600 3.778 1.00 12.42 O ATOM 271 CB TRP A 30 23.570 62.260 4.283 1.00 10.88 C ATOM 272 CG TRP A 30 23.256 63.156 5.450 1.00 10.48 C ATOM 273 CD1 TRP A 30 22.983 64.509 5.429 1.00 11.38 C ATOM 274 CD2 TRP A 30 23.086 62.735 6.805 1.00 11.51 C ATOM 275 NE1 TRP A 30 22.681 64.946 6.697 1.00 10.63 N ATOM 276 CE2 TRP A 30 22.732 63.879 7.556 1.00 10.98 C ATOM 277 CE3 TRP A 30 23.201 61.501 7.456 1.00 12.94 C ATOM 278 CZ2 TRP A 30 22.484 63.822 8.924 1.00 11.04 C ATOM 279 CZ3 TRP A 30 22.961 61.447 8.821 1.00 12.50 C ATOM 280 CH2 TRP A 30 22.608 62.597 9.535 1.00 11.46 C ATOM 281 HE1 TRP A 30 22.452 65.925 6.961 1.00 0.00 H ATOM 282 H TRP A 30 25.265 63.556 2.718 1.00 0.00 H ATOM 283 N GLN A 31 25.930 60.523 2.253 1.00 11.46 N ATOM 284 CA GLN A 31 25.858 59.327 1.406 1.00 12.95 C ATOM 285 C GLN A 31 26.509 58.095 2.025 1.00 13.89 C ATOM 286 O GLN A 31 26.026 56.984 1.829 1.00 14.82 O ATOM 287 CB GLN A 31 26.447 59.601 0.023 1.00 12.38 C ATOM 288 CG GLN A 31 25.571 60.595 -0.738 1.00 13.90 C ATOM 289 CD GLN A 31 25.815 60.671 -2.221 1.00 14.71 C ATOM 290 OE1 GLN A 31 26.260 59.702 -2.843 1.00 19.11 O ATOM 291 NE2 GLN A 31 25.469 61.797 -2.813 1.00 14.82 N ATOM 292 HE22 GLN A 31 25.098 62.588 -2.249 1.00 0.00 H ATOM 293 HE21 GLN A 31 25.567 61.894 -3.844 1.00 0.00 H ATOM 294 H GLN A 31 26.552 61.316 1.996 1.00 0.00 H ATOM 295 N GLU A 32 27.550 58.269 2.828 1.00 12.54 N ATOM 296 CA GLU A 32 28.162 57.113 3.463 1.00 13.39 C ATOM 297 C GLU A 32 27.131 56.410 4.382 1.00 15.08 C ATOM 298 O GLU A 32 27.043 55.177 4.417 1.00 15.47 O ATOM 299 CB GLU A 32 29.426 57.516 4.235 1.00 14.59 C ATOM 300 CG GLU A 32 30.093 56.355 4.946 1.00 16.97 C ATOM 301 CD GLU A 32 31.384 56.726 5.612 1.00 19.87 C ATOM 302 OE1 GLU A 32 31.489 57.813 6.218 1.00 16.61 O ATOM 303 OE2 GLU A 32 32.318 55.909 5.573 1.00 25.48 O ATOM 304 H GLU A 32 27.925 59.223 3.002 1.00 0.00 H ATOM 305 N VAL A 33 26.363 57.204 5.120 1.00 14.28 N ATOM 306 CA VAL A 33 25.353 56.681 6.005 1.00 14.29 C ATOM 307 C VAL A 33 24.114 56.242 5.220 1.00 13.73 C ATOM 308 O VAL A 33 23.594 55.148 5.420 1.00 15.69 O ATOM 309 CB VAL A 33 24.972 57.734 7.058 1.00 15.45 C ATOM 310 CG1 VAL A 33 23.629 57.431 7.713 1.00 16.41 C ATOM 311 CG2 VAL A 33 26.071 57.848 8.100 1.00 15.95 C ATOM 312 H VAL A 33 26.495 58.234 5.057 1.00 0.00 H ATOM 313 N GLY A 34 23.630 57.108 4.342 1.00 14.53 N ATOM 314 CA GLY A 34 22.373 56.853 3.677 1.00 15.75 C ATOM 315 C GLY A 34 22.342 55.630 2.794 1.00 16.48 C ATOM 316 O GLY A 34 21.307 54.941 2.666 1.00 16.44 O ATOM 317 H GLY A 34 24.159 57.978 4.130 1.00 0.00 H ATOM 318 N GLU A 35 23.475 55.337 2.171 1.00 16.05 N ATOM 319 CA GLU A 35 23.524 54.215 1.251 1.00 16.29 C ATOM 320 C GLU A 35 23.453 52.888 1.991 1.00 17.84 C ATOM 321 O GLU A 35 23.181 51.866 1.365 1.00 19.21 O ATOM 322 CB GLU A 35 24.763 54.307 0.359 1.00 16.23 C ATOM 323 CG GLU A 35 24.647 55.436 -0.653 1.00 18.86 C ATOM 324 CD GLU A 35 23.375 55.326 -1.459 1.00 19.16 C ATOM 325 OE1 GLU A 35 22.383 55.999 -1.093 1.00 18.92 O ATOM 326 OE2 GLU A 35 23.339 54.565 -2.444 1.00 22.11 O ATOM 327 H GLU A 35 24.326 55.909 2.341 1.00 0.00 H ATOM 328 N ALA A 36 23.650 52.895 3.315 1.00 18.49 N ATOM 329 CA ALA A 36 23.382 51.720 4.133 1.00 20.40 C ATOM 330 C ALA A 36 21.882 51.343 4.146 1.00 19.46 C ATOM 331 O ALA A 36 21.527 50.206 4.464 1.00 23.85 O ATOM 332 CB ALA A 36 23.884 51.949 5.551 1.00 22.53 C ATOM 333 H ALA A 36 24.003 53.761 3.771 1.00 0.00 H ATOM 334 N PHE A 37 21.008 52.296 3.828 1.00 18.25 N ATOM 335 CA PHE A 37 19.564 52.066 3.820 1.00 16.47 C ATOM 336 C PHE A 37 19.080 51.804 2.399 1.00 17.55 C ATOM 337 O PHE A 37 18.181 52.463 1.883 1.00 17.46 O ATOM 338 CB PHE A 37 18.864 53.255 4.475 1.00 19.24 C ATOM 339 CG PHE A 37 19.194 53.347 5.919 1.00 20.49 C ATOM 340 CD1 PHE A 37 20.338 54.006 6.339 1.00 20.52 C ATOM 341 CD2 PHE A 37 18.408 52.685 6.851 1.00 23.92 C ATOM 342 CE1 PHE A 37 20.670 54.024 7.672 1.00 22.44 C ATOM 343 CE2 PHE A 37 18.733 52.707 8.193 1.00 25.35 C ATOM 344 CZ PHE A 37 19.860 53.379 8.600 1.00 24.25 C ATOM 345 H PHE A 37 21.366 53.239 3.576 1.00 0.00 H ATOM 346 N ALA A 38 19.687 50.794 1.788 1.00 19.78 N ATOM 347 CA ALA A 38 19.538 50.517 0.369 1.00 21.38 C ATOM 348 C ALA A 38 18.112 50.127 -0.032 1.00 20.53 C ATOM 349 O ALA A 38 17.771 50.221 -1.219 1.00 19.59 O ATOM 350 CB ALA A 38 20.510 49.427 -0.034 1.00 23.61 C ATOM 351 H ALA A 38 20.299 50.170 2.352 1.00 0.00 H ATOM 352 N ASP A 39 17.295 49.704 0.941 1.00 17.81 N ATOM 353 CA ASP A 39 15.905 49.325 0.667 1.00 15.89 C ATOM 354 C ASP A 39 14.972 50.541 0.642 1.00 17.29 C ATOM 355 O ASP A 39 13.884 50.482 0.062 1.00 17.34 O ATOM 356 CB ASP A 39 15.389 48.284 1.681 1.00 15.78 C ATOM 357 CG ASP A 39 15.494 48.730 3.140 1.00 15.25 C ATOM 358 OD1 ASP A 39 14.611 48.334 3.924 1.00 14.03 O ATOM 359 OD2 ASP A 39 16.442 49.434 3.527 1.00 14.35 O ATOM 360 H ASP A 39 17.655 49.643 1.915 1.00 0.00 H ATOM 361 N TYR A 40 15.386 51.637 1.270 1.00 18.72 N ATOM 362 CA TYR A 40 14.642 52.890 1.184 1.00 16.12 C ATOM 363 C TYR A 40 15.045 53.604 -0.098 1.00 16.22 C ATOM 364 O TYR A 40 16.089 53.311 -0.648 1.00 18.10 O ATOM 365 CB TYR A 40 14.933 53.795 2.390 1.00 16.35 C ATOM 366 CG TYR A 40 14.340 53.326 3.692 1.00 21.02 C ATOM 367 CD1 TYR A 40 14.907 52.283 4.413 1.00 25.34 C ATOM 368 CD2 TYR A 40 13.209 53.944 4.203 1.00 22.86 C ATOM 369 CE1 TYR A 40 14.334 51.858 5.605 1.00 25.75 C ATOM 370 CE2 TYR A 40 12.646 53.548 5.388 1.00 24.11 C ATOM 371 CZ TYR A 40 13.196 52.504 6.083 1.00 25.93 C ATOM 372 OH TYR A 40 12.626 52.094 7.278 1.00 28.22 O ATOM 373 HH TYR A 40 13.144 51.334 7.646 1.00 0.00 H ATOM 374 H TYR A 40 16.259 51.601 1.835 1.00 0.00 H ATOM 375 N SER A 41 14.271 54.580 -0.548 1.00 16.08 N ATOM 376 CA SER A 41 14.768 55.507 -1.559 1.00 13.67 C ATOM 377 C SER A 41 15.484 56.636 -0.818 1.00 13.74 C ATOM 378 O SER A 41 15.113 56.952 0.305 1.00 15.18 O ATOM 379 CB SER A 41 13.628 56.019 -2.439 1.00 15.16 C ATOM 380 OG SER A 41 13.073 54.956 -3.196 1.00 16.63 O ATOM 381 HG SER A 41 12.721 54.264 -2.582 1.00 0.00 H ATOM 382 H SER A 41 13.304 54.686 -0.179 1.00 0.00 H ATOM 383 N ARG A 42 16.496 57.227 -1.440 1.00 12.84 N ATOM 384 CA ARG A 42 17.320 58.275 -0.813 1.00 12.77 C ATOM 385 C ARG A 42 17.354 59.486 -1.723 1.00 13.12 C ATOM 386 O ARG A 42 17.578 59.356 -2.921 1.00 14.23 O ATOM 387 CB ARG A 42 18.753 57.779 -0.555 1.00 15.23 C ATOM 388 CG ARG A 42 18.876 56.651 0.487 1.00 14.91 C ATOM 389 CD ARG A 42 18.671 55.260 -0.110 1.00 17.02 C ATOM 390 NE ARG A 42 19.751 54.871 -0.998 1.00 18.74 N ATOM 391 CZ ARG A 42 19.668 53.897 -1.906 1.00 21.77 C ATOM 392 NH1 ARG A 42 20.715 53.602 -2.663 1.00 23.26 N ATOM 393 NH2 ARG A 42 18.530 53.242 -2.085 1.00 22.54 N ATOM 394 HE ARG A 42 20.651 55.387 -0.921 1.00 0.00 H ATOM 395 HH12 ARG A 42 20.648 52.842 -3.370 1.00 0.00 H ATOM 396 HH11 ARG A 42 21.604 54.130 -2.550 1.00 0.00 H ATOM 397 HH22 ARG A 42 18.472 52.484 -2.795 1.00 0.00 H ATOM 398 HH21 ARG A 42 17.694 53.486 -1.516 1.00 0.00 H ATOM 399 H ARG A 42 16.718 56.937 -2.414 1.00 0.00 H ATOM 400 N LEU A 43 17.128 60.665 -1.168 1.00 11.97 N ATOM 401 CA LEU A 43 17.307 61.912 -1.928 1.00 11.45 C ATOM 402 C LEU A 43 18.365 62.717 -1.194 1.00 11.29 C ATOM 403 O LEU A 43 18.155 63.117 -0.035 1.00 12.18 O ATOM 404 CB LEU A 43 16.017 62.710 -2.056 1.00 12.37 C ATOM 405 CG LEU A 43 16.139 63.872 -3.029 1.00 12.33 C ATOM 406 CD1 LEU A 43 16.253 63.375 -4.474 1.00 12.66 C ATOM 407 CD2 LEU A 43 14.991 64.861 -2.842 1.00 13.56 C ATOM 408 H LEU A 43 16.818 60.711 -0.176 1.00 0.00 H ATOM 409 N TYR A 44 19.500 62.954 -1.841 1.00 10.98 N ATOM 410 CA TYR A 44 20.586 63.732 -1.289 1.00 11.47 C ATOM 411 C TYR A 44 20.514 65.131 -1.894 1.00 11.62 C ATOM 412 O TYR A 44 20.818 65.332 -3.054 1.00 12.06 O ATOM 413 CB TYR A 44 21.912 63.067 -1.581 1.00 11.28 C ATOM 414 CG TYR A 44 22.034 61.680 -1.013 1.00 11.24 C ATOM 415 CD1 TYR A 44 22.223 61.499 0.363 1.00 11.63 C ATOM 416 CD2 TYR A 44 21.921 60.547 -1.817 1.00 13.73 C ATOM 417 CE1 TYR A 44 22.340 60.260 0.899 1.00 12.17 C ATOM 418 CE2 TYR A 44 22.029 59.279 -1.272 1.00 13.64 C ATOM 419 CZ TYR A 44 22.233 59.144 0.095 1.00 13.27 C ATOM 420 OH TYR A 44 22.365 57.901 0.673 1.00 14.91 O ATOM 421 HH TYR A 44 23.143 57.435 0.276 1.00 0.00 H ATOM 422 H TYR A 44 19.614 62.559 -2.796 1.00 0.00 H ATOM 423 N VAL A 45 20.085 66.096 -1.090 1.00 10.99 N ATOM 424 CA VAL A 45 19.771 67.436 -1.566 1.00 10.77 C ATOM 425 C VAL A 45 20.943 68.394 -1.427 1.00 10.34 C ATOM 426 O VAL A 45 21.621 68.370 -0.413 1.00 11.30 O ATOM 427 CB VAL A 45 18.552 68.012 -0.777 1.00 11.31 C ATOM 428 CG1 VAL A 45 18.285 69.483 -1.140 1.00 13.35 C ATOM 429 CG2 VAL A 45 17.318 67.158 -0.981 1.00 13.81 C ATOM 430 H VAL A 45 19.968 65.886 -0.078 1.00 0.00 H ATOM 431 N ASP A 46 21.155 69.270 -2.404 1.00 10.33 N ATOM 432 CA ASP A 46 22.046 70.431 -2.236 1.00 10.45 C ATOM 433 C ASP A 46 21.215 71.641 -1.829 1.00 10.14 C ATOM 434 O ASP A 46 20.307 72.070 -2.565 1.00 10.93 O ATOM 435 CB ASP A 46 22.791 70.759 -3.528 1.00 10.91 C ATOM 436 CG ASP A 46 23.969 69.852 -3.805 1.00 12.05 C ATOM 437 OD1 ASP A 46 24.664 69.492 -2.863 1.00 13.31 O ATOM 438 OD2 ASP A 46 24.251 69.577 -5.010 1.00 14.22 O ATOM 439 H ASP A 46 20.676 69.131 -3.317 1.00 0.00 H ATOM 440 N LEU A 47 21.480 72.174 -0.646 1.00 10.06 N ATOM 441 CA LEU A 47 20.778 73.365 -0.184 1.00 10.76 C ATOM 442 C LEU A 47 21.154 74.563 -1.031 1.00 10.26 C ATOM 443 O LEU A 47 22.228 74.571 -1.645 1.00 10.01 O ATOM 444 CB LEU A 47 21.130 73.634 1.274 1.00 11.16 C ATOM 445 CG LEU A 47 20.640 72.603 2.305 1.00 12.73 C ATOM 446 CD1 LEU A 47 21.190 72.954 3.676 1.00 13.26 C ATOM 447 CD2 LEU A 47 19.124 72.539 2.286 1.00 14.65 C ATOM 448 H LEU A 47 22.200 71.736 -0.037 1.00 0.00 H ATOM 449 N PRO A 48 20.300 75.599 -1.037 1.00 10.22 N ATOM 450 CA PRO A 48 20.681 76.846 -1.721 1.00 10.36 C ATOM 451 C PRO A 48 22.102 77.297 -1.368 1.00 9.99 C ATOM 452 O PRO A 48 22.495 77.254 -0.192 1.00 10.56 O ATOM 453 CB PRO A 48 19.639 77.837 -1.238 1.00 12.29 C ATOM 454 CG PRO A 48 18.425 76.980 -1.060 1.00 12.35 C ATOM 455 CD PRO A 48 18.953 75.719 -0.456 1.00 10.84 C ATOM 456 N GLY A 49 22.849 77.755 -2.365 1.00 11.11 N ATOM 457 CA GLY A 49 24.199 78.256 -2.153 1.00 11.26 C ATOM 458 C GLY A 49 25.265 77.187 -2.091 1.00 10.54 C ATOM 459 O GLY A 49 26.451 77.501 -1.984 1.00 10.79 O ATOM 460 H GLY A 49 22.457 77.756 -3.328 1.00 0.00 H ATOM 461 N HIS A 50 24.848 75.920 -2.128 1.00 10.45 N ATOM 462 CA HIS A 50 25.715 74.775 -1.893 1.00 9.83 C ATOM 463 C HIS A 50 25.658 73.811 -3.054 1.00 9.54 C ATOM 464 O HIS A 50 24.612 73.668 -3.706 1.00 10.91 O ATOM 465 CB HIS A 50 25.275 74.046 -0.624 1.00 9.45 C ATOM 466 CG HIS A 50 25.503 74.823 0.641 1.00 9.13 C ATOM 467 ND1 HIS A 50 24.740 75.912 1.014 1.00 9.71 N ATOM 468 CD2 HIS A 50 26.401 74.640 1.637 1.00 9.24 C ATOM 469 CE1 HIS A 50 25.175 76.370 2.180 1.00 9.57 C ATOM 470 NE2 HIS A 50 26.175 75.607 2.589 1.00 9.77 N ATOM 471 H HIS A 50 23.845 75.740 -2.337 1.00 0.00 H ATOM 472 N GLY A 51 26.772 73.133 -3.326 1.00 10.19 N ATOM 473 CA GLY A 51 26.835 72.113 -4.359 1.00 11.39 C ATOM 474 C GLY A 51 26.288 72.643 -5.681 1.00 10.77 C ATOM 475 O GLY A 51 26.535 73.782 -6.066 1.00 11.17 O ATOM 476 H GLY A 51 27.630 73.342 -2.777 1.00 0.00 H ATOM 477 N GLY A 52 25.482 71.810 -6.341 1.00 11.77 N ATOM 478 CA GLY A 52 24.843 72.175 -7.588 1.00 12.55 C ATOM 479 C GLY A 52 23.720 73.162 -7.456 1.00 11.73 C ATOM 480 O GLY A 52 23.168 73.572 -8.487 1.00 14.15 O ATOM 481 H GLY A 52 25.306 70.864 -5.946 1.00 0.00 H ATOM 482 N SER A 53 23.329 73.507 -6.232 1.00 11.29 N ATOM 483 CA SER A 53 22.325 74.541 -5.969 1.00 11.81 C ATOM 484 C SER A 53 22.958 75.888 -5.665 1.00 11.26 C ATOM 485 O SER A 53 22.287 76.790 -5.152 1.00 11.71 O ATOM 486 CB SER A 53 21.428 74.138 -4.807 1.00 12.22 C ATOM 487 OG SER A 53 20.703 72.969 -5.134 1.00 11.83 O ATOM 488 HG SER A 53 20.124 72.717 -4.372 1.00 0.00 H ATOM 489 H SER A 53 23.758 73.018 -5.421 1.00 0.00 H ATOM 490 N ALA A 54 24.235 76.053 -6.003 1.00 10.96 N ATOM 491 CA ALA A 54 24.934 77.291 -5.682 1.00 11.24 C ATOM 492 C ALA A 54 24.194 78.530 -6.155 1.00 11.57 C ATOM 493 O ALA A 54 24.146 79.522 -5.434 1.00 12.57 O ATOM 494 CB ALA A 54 26.338 77.281 -6.263 1.00 13.04 C ATOM 495 H ALA A 54 24.739 75.291 -6.501 1.00 0.00 H ATOM 496 N ALA A 55 23.642 78.480 -7.369 1.00 12.30 N ATOM 497 CA ALA A 55 23.076 79.661 -8.009 1.00 13.56 C ATOM 498 C ALA A 55 21.650 79.953 -7.554 1.00 14.62 C ATOM 499 O ALA A 55 21.064 80.940 -7.952 1.00 19.33 O ATOM 500 CB ALA A 55 23.124 79.516 -9.514 1.00 14.52 C ATOM 501 H ALA A 55 23.615 77.571 -7.874 1.00 0.00 H ATOM 502 N ILE A 56 21.103 79.099 -6.695 1.00 14.37 N ATOM 503 CA ILE A 56 19.766 79.292 -6.176 1.00 15.73 C ATOM 504 C ILE A 56 19.858 80.154 -4.947 1.00 16.03 C ATOM 505 O ILE A 56 20.388 79.726 -3.921 1.00 18.41 O ATOM 506 CB ILE A 56 19.102 77.953 -5.840 1.00 15.52 C ATOM 507 CG1 ILE A 56 19.036 77.097 -7.104 1.00 18.34 C ATOM 508 CG2 ILE A 56 17.698 78.166 -5.243 1.00 18.44 C ATOM 509 CD1 ILE A 56 18.490 75.718 -6.925 1.00 21.47 C ATOM 510 H ILE A 56 21.650 78.270 -6.388 1.00 0.00 H ATOM 511 N SER A 57 19.362 81.373 -5.039 1.00 19.85 N ATOM 512 CA SER A 57 19.425 82.229 -3.870 1.00 23.42 C ATOM 513 C SER A 57 18.077 82.287 -3.180 1.00 20.33 C ATOM 514 O SER A 57 17.016 82.085 -3.782 1.00 20.66 O ATOM 515 CB SER A 57 19.896 83.619 -4.229 1.00 28.81 C ATOM 516 OG SER A 57 18.905 84.278 -4.944 1.00 32.24 O ATOM 517 HG SER A 57 19.218 85.188 -5.177 1.00 0.00 H ATOM 518 H SER A 57 18.937 81.711 -5.926 1.00 0.00 H ATOM 519 N VAL A 58 18.153 82.520 -1.882 1.00 17.19 N ATOM 520 CA VAL A 58 16.978 82.595 -1.033 1.00 16.24 C ATOM 521 C VAL A 58 17.076 83.791 -0.127 1.00 17.15 C ATOM 522 O VAL A 58 18.169 84.244 0.183 1.00 18.00 O ATOM 523 CB VAL A 58 16.814 81.312 -0.185 1.00 15.90 C ATOM 524 CG1 VAL A 58 16.491 80.132 -1.063 1.00 16.32 C ATOM 525 CG2 VAL A 58 18.076 81.025 0.649 1.00 16.28 C ATOM 526 H VAL A 58 19.090 82.655 -1.452 1.00 0.00 H ATOM 527 N ASP A 59 15.923 84.312 0.291 1.00 17.29 N ATOM 528 CA ASP A 59 15.882 85.438 1.220 1.00 20.36 C ATOM 529 C ASP A 59 15.755 85.002 2.675 1.00 19.88 C ATOM 530 O ASP A 59 15.951 85.815 3.596 1.00 24.06 O ATOM 531 CB ASP A 59 14.721 86.372 0.896 1.00 24.78 C ATOM 532 CG ASP A 59 14.878 87.088 -0.443 1.00 32.87 C ATOM 533 OD1 ASP A 59 16.027 87.272 -0.899 1.00 35.05 O ATOM 534 OD2 ASP A 59 13.841 87.495 -1.006 1.00 38.76 O ATOM 535 H ASP A 59 15.029 83.906 -0.053 1.00 0.00 H ATOM 536 N GLY A 60 15.413 83.742 2.877 1.00 16.59 N ATOM 537 CA GLY A 60 15.165 83.209 4.205 1.00 16.28 C ATOM 538 C GLY A 60 14.581 81.806 4.159 1.00 15.32 C ATOM 539 O GLY A 60 14.547 81.130 3.105 1.00 15.17 O ATOM 540 H GLY A 60 15.318 83.110 2.057 1.00 0.00 H ATOM 541 N PHE A 61 14.103 81.344 5.305 1.00 15.42 N ATOM 542 CA PHE A 61 13.624 79.971 5.411 1.00 14.77 C ATOM 543 C PHE A 61 12.360 79.716 4.606 1.00 16.71 C ATOM 544 O PHE A 61 12.183 78.607 4.114 1.00 15.91 O ATOM 545 CB PHE A 61 13.375 79.602 6.870 1.00 14.60 C ATOM 546 CG PHE A 61 14.615 79.277 7.626 1.00 13.77 C ATOM 547 CD1 PHE A 61 15.188 78.033 7.478 1.00 14.31 C ATOM 548 CD2 PHE A 61 15.223 80.209 8.457 1.00 14.73 C ATOM 549 CE1 PHE A 61 16.353 77.685 8.158 1.00 13.90 C ATOM 550 CE2 PHE A 61 16.396 79.879 9.141 1.00 14.55 C ATOM 551 CZ PHE A 61 16.961 78.620 8.984 1.00 15.47 C ATOM 552 H PHE A 61 14.069 81.967 6.137 1.00 0.00 H ATOM 553 N ASP A 62 11.471 80.701 4.480 1.00 16.74 N ATOM 554 CA ASP A 62 10.269 80.470 3.667 1.00 17.58 C ATOM 555 C ASP A 62 10.652 80.012 2.255 1.00 16.05 C ATOM 556 O ASP A 62 10.048 79.095 1.692 1.00 16.24 O ATOM 557 CB ASP A 62 9.421 81.734 3.532 1.00 20.31 C ATOM 558 CG ASP A 62 8.754 82.170 4.830 1.00 26.81 C ATOM 559 OD1 ASP A 62 8.825 81.453 5.837 1.00 28.21 O ATOM 560 OD2 ASP A 62 8.130 83.247 4.824 1.00 33.75 O ATOM 561 H ASP A 62 11.625 81.617 4.949 1.00 0.00 H ATOM 562 N ASP A 63 11.621 80.692 1.656 1.00 15.40 N ATOM 563 CA ASP A 63 12.060 80.341 0.327 1.00 15.39 C ATOM 564 C ASP A 63 12.666 78.944 0.297 1.00 14.32 C ATOM 565 O ASP A 63 12.464 78.223 -0.658 1.00 14.85 O ATOM 566 CB ASP A 63 13.094 81.344 -0.190 1.00 15.89 C ATOM 567 CG ASP A 63 12.532 82.726 -0.494 1.00 20.36 C ATOM 568 OD1 ASP A 63 11.295 82.895 -0.639 1.00 22.08 O ATOM 569 OD2 ASP A 63 13.393 83.651 -0.625 1.00 24.90 O ATOM 570 H ASP A 63 12.070 81.489 2.151 1.00 0.00 H ATOM 571 N VAL A 64 13.430 78.566 1.313 1.00 14.03 N ATOM 572 CA VAL A 64 14.051 77.244 1.342 1.00 12.36 C ATOM 573 C VAL A 64 12.980 76.170 1.455 1.00 13.09 C ATOM 574 O VAL A 64 13.012 75.174 0.721 1.00 13.98 O ATOM 575 CB VAL A 64 15.044 77.105 2.511 1.00 13.68 C ATOM 576 CG1 VAL A 64 15.639 75.711 2.532 1.00 14.46 C ATOM 577 CG2 VAL A 64 16.160 78.165 2.450 1.00 13.51 C ATOM 578 H VAL A 64 13.590 79.223 2.103 1.00 0.00 H ATOM 579 N THR A 65 12.008 76.379 2.326 1.00 14.41 N ATOM 580 CA THR A 65 10.917 75.406 2.465 1.00 14.75 C ATOM 581 C THR A 65 10.158 75.245 1.163 1.00 16.04 C ATOM 582 O THR A 65 9.839 74.137 0.747 1.00 15.75 O ATOM 583 CB THR A 65 9.973 75.819 3.578 1.00 15.60 C ATOM 584 OG1 THR A 65 10.721 75.821 4.787 1.00 16.05 O ATOM 585 CG2 THR A 65 8.792 74.878 3.726 1.00 17.18 C ATOM 586 HG1 THR A 65 10.133 76.087 5.537 1.00 0.00 H ATOM 587 H THR A 65 12.016 77.236 2.915 1.00 0.00 H ATOM 588 N ASP A 66 9.898 76.352 0.493 1.00 14.11 N ATOM 589 CA ASP A 66 9.201 76.300 -0.795 1.00 16.56 C ATOM 590 C ASP A 66 10.000 75.513 -1.831 1.00 13.82 C ATOM 591 O ASP A 66 9.461 74.697 -2.580 1.00 14.59 O ATOM 592 CB ASP A 66 8.922 77.725 -1.282 1.00 20.74 C ATOM 593 CG ASP A 66 8.285 77.772 -2.632 1.00 37.02 C ATOM 594 OD1 ASP A 66 7.111 77.398 -2.731 1.00 42.80 O ATOM 595 OD2 ASP A 66 8.965 78.211 -3.585 1.00 44.06 O ATOM 596 H ASP A 66 10.191 77.271 0.883 1.00 0.00 H ATOM 597 N LEU A 67 11.301 75.762 -1.882 1.00 13.70 N ATOM 598 CA LEU A 67 12.164 75.011 -2.792 1.00 13.19 C ATOM 599 C LEU A 67 12.187 73.529 -2.447 1.00 13.47 C ATOM 600 O LEU A 67 12.162 72.672 -3.326 1.00 14.48 O ATOM 601 CB LEU A 67 13.563 75.580 -2.784 1.00 13.60 C ATOM 602 CG LEU A 67 13.735 76.832 -3.629 1.00 15.11 C ATOM 603 CD1 LEU A 67 14.860 77.652 -3.100 1.00 15.15 C ATOM 604 CD2 LEU A 67 13.965 76.435 -5.088 1.00 17.37 C ATOM 605 H LEU A 67 11.711 76.497 -1.270 1.00 0.00 H ATOM 606 N LEU A 68 12.246 73.219 -1.166 1.00 13.17 N ATOM 607 CA LEU A 68 12.205 71.829 -0.758 1.00 14.00 C ATOM 608 C LEU A 68 10.885 71.170 -1.177 1.00 14.25 C ATOM 609 O LEU A 68 10.888 70.077 -1.731 1.00 14.26 O ATOM 610 CB LEU A 68 12.431 71.718 0.742 1.00 16.42 C ATOM 611 CG LEU A 68 12.625 70.350 1.337 1.00 19.23 C ATOM 612 CD1 LEU A 68 13.811 69.656 0.682 1.00 21.96 C ATOM 613 CD2 LEU A 68 12.867 70.503 2.850 1.00 20.66 C ATOM 614 H LEU A 68 12.322 73.970 -0.451 1.00 0.00 H ATOM 615 N ARG A 69 9.762 71.849 -0.962 1.00 14.54 N ATOM 616 CA ARG A 69 8.472 71.312 -1.356 1.00 16.80 C ATOM 617 C ARG A 69 8.462 71.006 -2.856 1.00 17.17 C ATOM 618 O ARG A 69 8.026 69.931 -3.270 1.00 16.88 O ATOM 619 CB ARG A 69 7.357 72.307 -1.056 1.00 18.57 C ATOM 620 CG ARG A 69 6.926 72.436 0.372 1.00 25.21 C ATOM 621 CD ARG A 69 5.637 73.248 0.474 1.00 31.06 C ATOM 622 NE ARG A 69 5.333 73.510 1.870 1.00 31.13 N ATOM 623 CZ ARG A 69 5.343 74.709 2.435 1.00 35.27 C ATOM 624 NH1 ARG A 69 5.636 75.786 1.725 1.00 37.94 N ATOM 625 NH2 ARG A 69 5.045 74.829 3.724 1.00 35.13 N ATOM 626 HE ARG A 69 5.089 72.697 2.471 1.00 0.00 H ATOM 627 HH12 ARG A 69 5.641 76.722 2.178 1.00 0.00 H ATOM 628 HH11 ARG A 69 5.861 75.697 0.714 1.00 0.00 H ATOM 629 HH22 ARG A 69 5.051 75.767 4.174 1.00 0.00 H ATOM 630 HH21 ARG A 69 4.806 73.985 4.283 1.00 0.00 H ATOM 631 H ARG A 69 9.809 72.781 -0.503 1.00 0.00 H ATOM 632 N LYS A 70 8.903 71.972 -3.675 1.00 15.35 N ATOM 633 CA LYS A 70 8.903 71.793 -5.128 1.00 16.33 C ATOM 634 C LYS A 70 9.817 70.642 -5.553 1.00 14.97 C ATOM 635 O LYS A 70 9.504 69.910 -6.480 1.00 16.48 O ATOM 636 CB LYS A 70 9.337 73.078 -5.813 1.00 17.98 C ATOM 637 CG LYS A 70 8.307 74.153 -5.718 1.00 22.92 C ATOM 638 CD LYS A 70 8.771 75.434 -6.374 1.00 30.09 C ATOM 639 CE LYS A 70 7.748 76.540 -6.119 1.00 37.04 C ATOM 640 NZ LYS A 70 8.205 77.917 -6.470 1.00 44.12 N ATOM 641 HZ1 LYS A 70 9.047 78.155 -5.909 1.00 0.00 H ATOM 642 HZ2 LYS A 70 8.439 77.956 -7.482 1.00 0.00 H ATOM 643 HZ3 LYS A 70 7.445 78.596 -6.263 1.00 0.00 H ATOM 644 H LYS A 70 9.251 72.865 -3.271 1.00 0.00 H ATOM 645 N THR A 71 10.947 70.496 -4.872 1.00 13.76 N ATOM 646 CA THR A 71 11.890 69.438 -5.192 1.00 14.34 C ATOM 647 C THR A 71 11.260 68.078 -4.900 1.00 14.61 C ATOM 648 O THR A 71 11.348 67.169 -5.723 1.00 15.45 O ATOM 649 CB THR A 71 13.190 69.616 -4.397 1.00 14.79 C ATOM 650 OG1 THR A 71 13.750 70.913 -4.683 1.00 14.18 O ATOM 651 CG2 THR A 71 14.204 68.561 -4.749 1.00 15.52 C ATOM 652 HG1 THR A 71 13.103 71.615 -4.422 1.00 0.00 H ATOM 653 H THR A 71 11.162 71.152 -4.094 1.00 0.00 H ATOM 654 N LEU A 72 10.614 67.939 -3.749 1.00 15.20 N ATOM 655 CA LEU A 72 9.961 66.688 -3.406 1.00 16.13 C ATOM 656 C LEU A 72 8.897 66.312 -4.441 1.00 16.65 C ATOM 657 O LEU A 72 8.810 65.161 -4.861 1.00 16.41 O ATOM 658 CB LEU A 72 9.328 66.785 -2.021 1.00 17.19 C ATOM 659 CG LEU A 72 10.275 66.974 -0.847 1.00 19.34 C ATOM 660 CD1 LEU A 72 9.492 67.408 0.401 1.00 21.84 C ATOM 661 CD2 LEU A 72 11.008 65.693 -0.603 1.00 22.79 C ATOM 662 H LEU A 72 10.575 68.737 -3.083 1.00 0.00 H ATOM 663 N VAL A 73 8.109 67.288 -4.876 1.00 16.35 N ATOM 664 CA VAL A 73 7.075 67.028 -5.869 1.00 18.18 C ATOM 665 C VAL A 73 7.715 66.569 -7.176 1.00 19.29 C ATOM 666 O VAL A 73 7.235 65.645 -7.830 1.00 20.77 O ATOM 667 CB VAL A 73 6.205 68.298 -6.122 1.00 20.16 C ATOM 668 CG1 VAL A 73 5.277 68.130 -7.358 1.00 21.50 C ATOM 669 CG2 VAL A 73 5.373 68.618 -4.893 1.00 21.54 C ATOM 670 H VAL A 73 8.231 68.251 -4.503 1.00 0.00 H ATOM 671 N SER A 74 8.784 67.248 -7.584 1.00 19.19 N ATOM 672 CA SER A 74 9.457 66.920 -8.826 1.00 21.40 C ATOM 673 C SER A 74 9.970 65.467 -8.856 1.00 20.25 C ATOM 674 O SER A 74 9.964 64.800 -9.909 1.00 22.59 O ATOM 675 CB SER A 74 10.593 67.907 -9.061 1.00 23.73 C ATOM 676 OG SER A 74 11.213 67.663 -10.296 1.00 28.01 O ATOM 677 HG SER A 74 11.580 66.744 -10.304 1.00 0.00 H ATOM 678 H SER A 74 9.144 68.030 -7.000 1.00 0.00 H ATOM 679 N TYR A 75 10.376 64.958 -7.699 1.00 18.62 N ATOM 680 CA TYR A 75 10.857 63.584 -7.598 1.00 18.63 C ATOM 681 C TYR A 75 9.731 62.573 -7.250 1.00 18.72 C ATOM 682 O TYR A 75 9.977 61.390 -7.027 1.00 20.60 O ATOM 683 CB TYR A 75 12.001 63.508 -6.562 1.00 17.54 C ATOM 684 CG TYR A 75 13.320 64.010 -7.111 1.00 16.79 C ATOM 685 CD1 TYR A 75 14.140 63.160 -7.842 1.00 17.62 C ATOM 686 CD2 TYR A 75 13.738 65.318 -6.908 1.00 17.98 C ATOM 687 CE1 TYR A 75 15.324 63.597 -8.362 1.00 18.70 C ATOM 688 CE2 TYR A 75 14.927 65.772 -7.432 1.00 17.60 C ATOM 689 CZ TYR A 75 15.728 64.905 -8.168 1.00 19.57 C ATOM 690 OH TYR A 75 16.942 65.327 -8.686 1.00 20.32 O ATOM 691 HH TYR A 75 16.790 66.085 -9.305 1.00 0.00 H ATOM 692 H TYR A 75 10.351 65.552 -6.846 1.00 0.00 H ATOM 693 N ASN A 76 8.491 63.045 -7.243 1.00 20.33 N ATOM 694 CA ASN A 76 7.322 62.219 -6.952 1.00 21.86 C ATOM 695 C ASN A 76 7.409 61.558 -5.571 1.00 20.69 C ATOM 696 O ASN A 76 7.011 60.411 -5.367 1.00 20.28 O ATOM 697 CB ASN A 76 7.133 61.172 -8.053 1.00 29.46 C ATOM 698 CG ASN A 76 6.112 61.590 -9.052 1.00 40.42 C ATOM 699 OD1 ASN A 76 5.184 62.342 -8.748 1.00 45.08 O ATOM 700 ND2 ASN A 76 6.275 61.112 -10.278 1.00 46.97 N ATOM 701 HD22 ASN A 76 7.074 60.480 -10.488 1.00 0.00 H ATOM 702 HD21 ASN A 76 5.604 61.369 -11.030 1.00 0.00 H ATOM 703 H ASN A 76 8.344 64.052 -7.455 1.00 0.00 H ATOM 704 N ILE A 77 7.924 62.304 -4.608 1.00 16.00 N ATOM 705 CA ILE A 77 8.084 61.811 -3.250 1.00 15.64 C ATOM 706 C ILE A 77 6.832 62.097 -2.423 1.00 18.05 C ATOM 707 O ILE A 77 6.498 63.264 -2.202 1.00 22.72 O ATOM 708 CB ILE A 77 9.317 62.461 -2.597 1.00 13.72 C ATOM 709 CG1 ILE A 77 10.566 61.949 -3.316 1.00 14.02 C ATOM 710 CG2 ILE A 77 9.420 62.111 -1.119 1.00 14.39 C ATOM 711 CD1 ILE A 77 11.844 62.694 -2.972 1.00 15.19 C ATOM 712 H ILE A 77 8.224 63.275 -4.830 1.00 0.00 H ATOM 713 N LEU A 78 6.160 61.037 -1.966 1.00 14.54 N ATOM 714 CA LEU A 78 4.875 61.140 -1.266 1.00 13.77 C ATOM 715 C LEU A 78 4.846 60.807 0.240 1.00 17.43 C ATOM 716 O LEU A 78 3.881 61.142 0.951 1.00 20.28 O ATOM 717 CB LEU A 78 3.868 60.213 -1.924 1.00 15.61 C ATOM 718 CG LEU A 78 3.715 60.345 -3.430 1.00 17.65 C ATOM 719 CD1 LEU A 78 2.744 59.269 -3.952 1.00 20.24 C ATOM 720 CD2 LEU A 78 3.302 61.777 -3.800 1.00 23.44 C ATOM 721 H LEU A 78 6.568 60.092 -2.114 1.00 0.00 H ATOM 722 N ASP A 79 5.884 60.142 0.700 1.00 17.36 N ATOM 723 CA ASP A 79 5.975 59.525 2.023 1.00 15.96 C ATOM 724 C ASP A 79 7.469 59.610 2.334 1.00 14.21 C ATOM 725 O ASP A 79 8.244 58.980 1.629 1.00 17.84 O ATOM 726 CB ASP A 79 5.421 58.074 1.900 1.00 22.18 C ATOM 727 CG ASP A 79 5.667 57.207 3.085 1.00 25.22 C ATOM 728 OD1 ASP A 79 5.915 57.676 4.205 1.00 26.15 O ATOM 729 OD2 ASP A 79 5.524 55.991 2.894 1.00 27.43 O ATOM 730 H ASP A 79 6.707 60.047 0.071 1.00 0.00 H ATOM 731 N PHE A 80 7.894 60.420 3.311 1.00 13.71 N ATOM 732 CA PHE A 80 9.343 60.600 3.516 1.00 14.05 C ATOM 733 C PHE A 80 9.704 61.055 4.910 1.00 13.96 C ATOM 734 O PHE A 80 8.877 61.602 5.647 1.00 15.49 O ATOM 735 CB PHE A 80 9.926 61.603 2.507 1.00 14.37 C ATOM 736 CG PHE A 80 9.453 63.003 2.724 1.00 13.83 C ATOM 737 CD1 PHE A 80 8.198 63.410 2.285 1.00 17.02 C ATOM 738 CD2 PHE A 80 10.242 63.909 3.402 1.00 14.78 C ATOM 739 CE1 PHE A 80 7.745 64.712 2.533 1.00 17.04 C ATOM 740 CE2 PHE A 80 9.792 65.198 3.637 1.00 16.16 C ATOM 741 CZ PHE A 80 8.552 65.598 3.217 1.00 17.37 C ATOM 742 H PHE A 80 7.211 60.916 3.918 1.00 0.00 H ATOM 743 N TRP A 81 10.944 60.770 5.265 1.00 13.66 N ATOM 744 CA TRP A 81 11.609 61.299 6.436 1.00 14.10 C ATOM 745 C TRP A 81 12.567 62.382 5.994 1.00 12.79 C ATOM 746 O TRP A 81 13.191 62.266 4.936 1.00 14.42 O ATOM 747 CB TRP A 81 12.406 60.226 7.163 1.00 15.36 C ATOM 748 CG TRP A 81 11.593 59.195 7.843 1.00 17.47 C ATOM 749 CD1 TRP A 81 10.897 58.176 7.252 1.00 19.51 C ATOM 750 CD2 TRP A 81 11.381 59.068 9.248 1.00 18.97 C ATOM 751 NE1 TRP A 81 10.281 57.402 8.227 1.00 21.78 N ATOM 752 CE2 TRP A 81 10.565 57.942 9.454 1.00 20.24 C ATOM 753 CE3 TRP A 81 11.827 59.787 10.362 1.00 19.30 C ATOM 754 CZ2 TRP A 81 10.166 57.533 10.733 1.00 21.83 C ATOM 755 CZ3 TRP A 81 11.444 59.378 11.620 1.00 19.99 C ATOM 756 CH2 TRP A 81 10.635 58.260 11.799 1.00 20.71 C ATOM 757 HE1 TRP A 81 9.702 56.555 8.055 1.00 0.00 H ATOM 758 H TRP A 81 11.481 60.118 4.659 1.00 0.00 H ATOM 759 N LEU A 82 12.730 63.404 6.824 1.00 12.81 N ATOM 760 CA LEU A 82 13.701 64.459 6.593 1.00 13.09 C ATOM 761 C LEU A 82 14.816 64.246 7.628 1.00 12.60 C ATOM 762 O LEU A 82 14.517 64.177 8.821 1.00 15.25 O ATOM 763 CB LEU A 82 13.015 65.801 6.744 1.00 18.46 C ATOM 764 CG LEU A 82 13.516 67.010 6.020 1.00 21.09 C ATOM 765 CD1 LEU A 82 13.743 66.739 4.548 1.00 20.93 C ATOM 766 CD2 LEU A 82 12.485 68.109 6.218 1.00 18.66 C ATOM 767 H LEU A 82 12.137 63.452 7.677 1.00 0.00 H ATOM 768 N VAL A 83 16.061 64.118 7.173 1.00 10.73 N ATOM 769 CA VAL A 83 17.192 63.856 8.023 1.00 11.37 C ATOM 770 C VAL A 83 18.180 64.993 7.791 1.00 11.37 C ATOM 771 O VAL A 83 18.667 65.160 6.658 1.00 12.30 O ATOM 772 CB VAL A 83 17.852 62.505 7.709 1.00 11.11 C ATOM 773 CG1 VAL A 83 19.034 62.244 8.629 1.00 13.75 C ATOM 774 CG2 VAL A 83 16.866 61.343 7.768 1.00 14.29 C ATOM 775 H VAL A 83 16.224 64.212 6.150 1.00 0.00 H ATOM 776 N GLY A 84 18.463 65.805 8.802 1.00 10.64 N ATOM 777 CA GLY A 84 19.276 66.995 8.603 1.00 9.15 C ATOM 778 C GLY A 84 20.385 67.125 9.629 1.00 8.85 C ATOM 779 O GLY A 84 20.165 66.884 10.815 1.00 10.74 O ATOM 780 H GLY A 84 18.098 65.587 9.751 1.00 0.00 H ATOM 781 N TYR A 85 21.566 67.514 9.173 1.00 9.76 N ATOM 782 CA TYR A 85 22.744 67.796 10.002 1.00 9.50 C ATOM 783 C TYR A 85 22.954 69.305 10.098 1.00 9.27 C ATOM 784 O TYR A 85 23.093 69.990 9.072 1.00 10.32 O ATOM 785 CB TYR A 85 24.005 67.113 9.409 1.00 10.55 C ATOM 786 CG TYR A 85 25.291 67.721 9.894 1.00 9.05 C ATOM 787 CD1 TYR A 85 25.695 67.610 11.216 1.00 9.99 C ATOM 788 CD2 TYR A 85 26.117 68.432 9.017 1.00 9.87 C ATOM 789 CE1 TYR A 85 26.854 68.221 11.681 1.00 11.03 C ATOM 790 CE2 TYR A 85 27.291 69.028 9.460 1.00 9.93 C ATOM 791 CZ TYR A 85 27.658 68.904 10.801 1.00 9.63 C ATOM 792 OH TYR A 85 28.781 69.512 11.296 1.00 9.91 O ATOM 793 HH TYR A 85 28.706 70.491 11.172 1.00 0.00 H ATOM 794 H TYR A 85 21.667 67.629 8.144 1.00 0.00 H ATOM 795 N SER A 86 22.974 69.809 11.329 1.00 9.59 N ATOM 796 CA SER A 86 23.381 71.162 11.664 1.00 9.56 C ATOM 797 C SER A 86 22.484 72.163 10.910 1.00 10.05 C ATOM 798 O SER A 86 21.285 72.145 11.144 1.00 10.42 O ATOM 799 CB SER A 86 24.874 71.280 11.420 1.00 10.62 C ATOM 800 OG SER A 86 25.515 72.146 12.356 1.00 11.08 O ATOM 801 HG SER A 86 25.122 73.052 12.288 1.00 0.00 H ATOM 802 H SER A 86 22.676 69.188 12.109 1.00 0.00 H ATOM 803 N LEU A 87 23.006 73.026 10.043 1.00 8.93 N ATOM 804 CA LEU A 87 22.132 73.896 9.257 1.00 10.13 C ATOM 805 C LEU A 87 20.999 73.102 8.577 1.00 9.23 C ATOM 806 O LEU A 87 19.863 73.556 8.545 1.00 10.31 O ATOM 807 CB LEU A 87 22.927 74.674 8.194 1.00 10.55 C ATOM 808 CG LEU A 87 22.080 75.440 7.167 1.00 11.05 C ATOM 809 CD1 LEU A 87 21.206 76.509 7.814 1.00 12.46 C ATOM 810 CD2 LEU A 87 22.982 76.083 6.117 1.00 11.64 C ATOM 811 H LEU A 87 24.038 73.082 9.924 1.00 0.00 H ATOM 812 N GLY A 88 21.308 71.929 8.035 1.00 9.83 N ATOM 813 CA GLY A 88 20.314 71.074 7.421 1.00 9.87 C ATOM 814 C GLY A 88 19.261 70.612 8.418 1.00 9.04 C ATOM 815 O GLY A 88 18.096 70.409 8.053 1.00 10.33 O ATOM 816 H GLY A 88 22.299 71.614 8.052 1.00 0.00 H ATOM 817 N GLY A 89 19.666 70.407 9.674 1.00 9.73 N ATOM 818 CA GLY A 89 18.697 70.117 10.736 1.00 11.06 C ATOM 819 C GLY A 89 17.787 71.291 11.012 1.00 10.16 C ATOM 820 O GLY A 89 16.579 71.117 11.264 1.00 10.85 O ATOM 821 H GLY A 89 20.680 70.454 9.902 1.00 0.00 H ATOM 822 N ARG A 90 18.330 72.508 10.983 1.00 10.53 N ATOM 823 CA ARG A 90 17.509 73.690 11.194 1.00 10.55 C ATOM 824 C ARG A 90 16.557 73.877 10.017 1.00 11.46 C ATOM 825 O ARG A 90 15.394 74.162 10.239 1.00 11.62 O ATOM 826 CB ARG A 90 18.357 74.923 11.409 1.00 9.96 C ATOM 827 CG ARG A 90 19.246 74.791 12.605 1.00 11.39 C ATOM 828 CD ARG A 90 19.878 76.074 13.097 1.00 11.46 C ATOM 829 NE ARG A 90 20.824 76.700 12.160 1.00 10.92 N ATOM 830 CZ ARG A 90 20.622 77.837 11.466 1.00 11.81 C ATOM 831 NH1 ARG A 90 19.458 78.473 11.486 1.00 11.40 N ATOM 832 NH2 ARG A 90 21.604 78.353 10.740 1.00 12.47 N ATOM 833 HE ARG A 90 21.735 76.219 12.020 1.00 0.00 H ATOM 834 HH12 ARG A 90 19.335 79.349 10.939 1.00 0.00 H ATOM 835 HH11 ARG A 90 18.669 78.096 12.049 1.00 0.00 H ATOM 836 HH22 ARG A 90 21.449 79.231 10.204 1.00 0.00 H ATOM 837 HH21 ARG A 90 22.530 77.880 10.706 1.00 0.00 H ATOM 838 H ARG A 90 19.350 72.613 10.808 1.00 0.00 H ATOM 839 N VAL A 91 17.029 73.699 8.782 1.00 10.14 N ATOM 840 CA VAL A 91 16.154 73.725 7.620 1.00 10.59 C ATOM 841 C VAL A 91 15.040 72.682 7.782 1.00 10.96 C ATOM 842 O VAL A 91 13.886 72.977 7.500 1.00 11.35 O ATOM 843 CB VAL A 91 16.941 73.470 6.313 1.00 10.60 C ATOM 844 CG1 VAL A 91 16.003 73.220 5.144 1.00 10.23 C ATOM 845 CG2 VAL A 91 17.854 74.663 6.006 1.00 12.05 C ATOM 846 H VAL A 91 18.047 73.538 8.647 1.00 0.00 H ATOM 847 N ALA A 92 15.385 71.476 8.223 1.00 10.57 N ATOM 848 CA ALA A 92 14.417 70.396 8.389 1.00 10.68 C ATOM 849 C ALA A 92 13.360 70.778 9.411 1.00 11.02 C ATOM 850 O ALA A 92 12.175 70.554 9.188 1.00 12.30 O ATOM 851 CB ALA A 92 15.098 69.123 8.804 1.00 11.05 C ATOM 852 H ALA A 92 16.382 71.295 8.458 1.00 0.00 H ATOM 853 N MET A 93 13.777 71.312 10.567 1.00 11.32 N ATOM 854 CA MET A 93 12.814 71.685 11.600 1.00 11.57 C ATOM 855 C MET A 93 11.912 72.814 11.115 1.00 12.09 C ATOM 856 O MET A 93 10.703 72.783 11.341 1.00 13.05 O ATOM 857 CB MET A 93 13.531 72.102 12.885 1.00 12.15 C ATOM 858 CG MET A 93 14.182 70.915 13.579 1.00 13.10 C ATOM 859 SD MET A 93 14.941 71.269 15.168 1.00 14.25 S ATOM 860 CE MET A 93 16.352 72.243 14.629 1.00 13.52 C ATOM 861 H MET A 93 14.793 71.462 10.730 1.00 0.00 H ATOM 862 N MET A 94 12.483 73.809 10.446 1.00 11.78 N ATOM 863 CA MET A 94 11.672 74.887 9.909 1.00 12.34 C ATOM 864 C MET A 94 10.654 74.395 8.878 1.00 12.16 C ATOM 865 O MET A 94 9.484 74.788 8.923 1.00 14.24 O ATOM 866 CB MET A 94 12.553 75.974 9.286 1.00 11.80 C ATOM 867 CG MET A 94 13.230 76.871 10.337 1.00 13.15 C ATOM 868 SD MET A 94 12.096 77.901 11.290 1.00 14.56 S ATOM 869 CE MET A 94 11.663 79.140 10.061 1.00 15.93 C ATOM 870 H MET A 94 13.514 73.816 10.306 1.00 0.00 H ATOM 871 N ALA A 95 11.091 73.568 7.937 1.00 11.73 N ATOM 872 CA ALA A 95 10.190 73.063 6.912 1.00 11.01 C ATOM 873 C ALA A 95 9.101 72.195 7.532 1.00 13.13 C ATOM 874 O ALA A 95 7.925 72.300 7.167 1.00 14.96 O ATOM 875 CB ALA A 95 10.959 72.298 5.894 1.00 13.09 C ATOM 876 H ALA A 95 12.089 73.277 7.932 1.00 0.00 H ATOM 877 N ALA A 96 9.476 71.339 8.468 1.00 12.04 N ATOM 878 CA ALA A 96 8.505 70.438 9.080 1.00 13.82 C ATOM 879 C ALA A 96 7.456 71.231 9.851 1.00 13.21 C ATOM 880 O ALA A 96 6.273 70.891 9.825 1.00 16.50 O ATOM 881 CB ALA A 96 9.194 69.454 10.007 1.00 14.86 C ATOM 882 H ALA A 96 10.471 71.308 8.770 1.00 0.00 H ATOM 883 N CYS A 97 7.884 72.260 10.580 1.00 14.76 N ATOM 884 CA CYS A 97 6.975 73.062 11.365 1.00 15.91 C ATOM 885 C CYS A 97 6.068 73.921 10.479 1.00 17.01 C ATOM 886 O CYS A 97 4.896 74.177 10.817 1.00 19.50 O ATOM 887 CB CYS A 97 7.746 73.937 12.345 1.00 16.78 C ATOM 888 SG CYS A 97 8.440 72.994 13.732 1.00 18.41 S ATOM 889 H CYS A 97 8.898 72.492 10.584 1.00 0.00 H ATOM 890 N GLN A 98 6.598 74.360 9.332 1.00 17.01 N ATOM 891 CA GLN A 98 5.785 75.138 8.403 1.00 18.40 C ATOM 892 C GLN A 98 4.792 74.221 7.670 1.00 20.54 C ATOM 893 O GLN A 98 3.718 74.668 7.260 1.00 24.36 O ATOM 894 CB GLN A 98 6.664 75.901 7.383 1.00 19.81 C ATOM 895 CG GLN A 98 7.427 77.116 7.981 1.00 20.78 C ATOM 896 CD GLN A 98 8.319 77.879 6.982 1.00 25.30 C ATOM 897 OE1 GLN A 98 8.786 77.333 6.000 1.00 29.35 O ATOM 898 NE2 GLN A 98 8.575 79.150 7.267 1.00 25.87 N ATOM 899 HE22 GLN A 98 8.160 79.587 8.115 1.00 0.00 H ATOM 900 HE21 GLN A 98 9.191 79.709 6.643 1.00 0.00 H ATOM 901 H GLN A 98 7.590 74.147 9.102 1.00 0.00 H ATOM 902 N GLY A 99 5.161 72.956 7.475 1.00 20.81 N ATOM 903 CA GLY A 99 4.295 71.948 6.893 1.00 20.41 C ATOM 904 C GLY A 99 4.790 71.433 5.559 1.00 20.58 C ATOM 905 O GLY A 99 4.906 72.209 4.603 1.00 22.10 O ATOM 906 H GLY A 99 6.122 72.676 7.755 1.00 0.00 H ATOM 907 N LEU A 100 5.055 70.131 5.485 1.00 20.24 N ATOM 908 CA LEU A 100 5.430 69.463 4.244 1.00 19.63 C ATOM 909 C LEU A 100 4.539 68.260 4.045 1.00 20.55 C ATOM 910 O LEU A 100 4.615 67.315 4.820 1.00 23.65 O ATOM 911 CB LEU A 100 6.872 68.964 4.270 1.00 22.91 C ATOM 912 CG LEU A 100 7.974 70.000 4.298 1.00 26.51 C ATOM 913 CD1 LEU A 100 9.302 69.277 4.494 1.00 29.79 C ATOM 914 CD2 LEU A 100 7.968 70.842 3.028 1.00 28.01 C ATOM 915 H LEU A 100 4.992 69.563 6.354 1.00 0.00 H ATOM 916 N ALA A 101 3.824 68.213 2.938 1.00 18.40 N ATOM 917 CA ALA A 101 2.908 67.117 2.690 1.00 17.74 C ATOM 918 C ALA A 101 3.685 65.800 2.540 1.00 17.45 C ATOM 919 O ALA A 101 4.590 65.706 1.731 1.00 18.83 O ATOM 920 CB ALA A 101 2.116 67.398 1.455 1.00 20.26 C ATOM 921 H ALA A 101 3.918 68.972 2.234 1.00 0.00 H ATOM 922 N GLY A 102 3.273 64.790 3.309 1.00 17.27 N ATOM 923 CA GLY A 102 3.864 63.460 3.266 1.00 15.98 C ATOM 924 C GLY A 102 5.003 63.235 4.242 1.00 14.73 C ATOM 925 O GLY A 102 5.542 62.125 4.309 1.00 15.23 O ATOM 926 H GLY A 102 2.491 64.962 3.972 1.00 0.00 H ATOM 927 N LEU A 103 5.336 64.233 5.050 1.00 15.67 N ATOM 928 CA LEU A 103 6.376 64.068 6.053 1.00 16.34 C ATOM 929 C LEU A 103 5.959 63.121 7.157 1.00 18.25 C ATOM 930 O LEU A 103 4.981 63.394 7.861 1.00 19.88 O ATOM 931 CB LEU A 103 6.727 65.418 6.689 1.00 18.72 C ATOM 932 CG LEU A 103 7.748 65.351 7.833 1.00 20.51 C ATOM 933 CD1 LEU A 103 9.076 65.041 7.308 1.00 19.51 C ATOM 934 CD2 LEU A 103 7.695 66.642 8.613 1.00 23.44 C ATOM 935 H LEU A 103 4.846 65.147 4.965 1.00 0.00 H ATOM 936 N CYS A 104 6.688 62.024 7.355 1.00 16.31 N ATOM 937 CA CYS A 104 6.319 61.147 8.477 1.00 19.56 C ATOM 938 C CYS A 104 7.182 61.350 9.703 1.00 19.31 C ATOM 939 O CYS A 104 6.772 61.013 10.793 1.00 22.24 O ATOM 940 CB CYS A 104 6.321 59.684 8.093 1.00 27.47 C ATOM 941 SG CYS A 104 7.752 59.064 7.450 1.00 36.77 S ATOM 942 H CYS A 104 7.492 61.795 6.736 1.00 0.00 H ATOM 943 N GLY A 105 8.370 61.897 9.550 1.00 15.96 N ATOM 944 CA GLY A 105 9.217 62.153 10.690 1.00 18.05 C ATOM 945 C GLY A 105 10.453 62.965 10.314 1.00 15.48 C ATOM 946 O GLY A 105 10.825 63.076 9.121 1.00 15.81 O ATOM 947 H GLY A 105 8.702 62.147 8.597 1.00 0.00 H ATOM 948 N VAL A 106 11.048 63.551 11.341 1.00 15.27 N ATOM 949 CA VAL A 106 12.220 64.387 11.226 1.00 14.87 C ATOM 950 C VAL A 106 13.299 63.860 12.142 1.00 13.75 C ATOM 951 O VAL A 106 13.021 63.567 13.307 1.00 16.49 O ATOM 952 CB VAL A 106 11.882 65.831 11.601 1.00 18.84 C ATOM 953 CG1 VAL A 106 13.096 66.723 11.564 1.00 19.64 C ATOM 954 CG2 VAL A 106 10.833 66.342 10.678 1.00 20.14 C ATOM 955 H VAL A 106 10.647 63.400 12.289 1.00 0.00 H ATOM 956 N ILE A 107 14.511 63.721 11.620 1.00 13.59 N ATOM 957 CA ILE A 107 15.659 63.332 12.438 1.00 14.26 C ATOM 958 C ILE A 107 16.706 64.421 12.295 1.00 12.40 C ATOM 959 O ILE A 107 17.127 64.710 11.186 1.00 12.41 O ATOM 960 CB ILE A 107 16.236 61.962 12.003 1.00 14.17 C ATOM 961 CG1 ILE A 107 15.160 60.864 12.042 1.00 16.76 C ATOM 962 CG2 ILE A 107 17.437 61.591 12.879 1.00 16.17 C ATOM 963 CD1 ILE A 107 15.595 59.547 11.444 1.00 17.56 C ATOM 964 H ILE A 107 14.648 63.893 10.604 1.00 0.00 H ATOM 965 N VAL A 108 17.083 65.026 13.417 1.00 12.31 N ATOM 966 CA VAL A 108 17.960 66.185 13.437 1.00 12.62 C ATOM 967 C VAL A 108 19.224 65.841 14.177 1.00 11.69 C ATOM 968 O VAL A 108 19.181 65.366 15.316 1.00 13.50 O ATOM 969 CB VAL A 108 17.246 67.393 14.101 1.00 14.17 C ATOM 970 CG1 VAL A 108 18.229 68.515 14.418 1.00 15.28 C ATOM 971 CG2 VAL A 108 16.126 67.887 13.225 1.00 16.50 C ATOM 972 H VAL A 108 16.734 64.653 14.323 1.00 0.00 H ATOM 973 N GLU A 109 20.360 66.085 13.552 1.00 11.82 N ATOM 974 CA GLU A 109 21.680 65.883 14.150 1.00 11.60 C ATOM 975 C GLU A 109 22.324 67.241 14.397 1.00 10.88 C ATOM 976 O GLU A 109 22.743 67.914 13.468 1.00 11.49 O ATOM 977 CB GLU A 109 22.557 65.026 13.209 1.00 11.75 C ATOM 978 CG GLU A 109 23.956 64.772 13.719 1.00 11.42 C ATOM 979 CD GLU A 109 24.844 64.165 12.687 1.00 12.03 C ATOM 980 OE1 GLU A 109 24.555 64.286 11.478 1.00 13.22 O ATOM 981 OE2 GLU A 109 25.829 63.519 13.073 1.00 14.39 O ATOM 982 H GLU A 109 20.315 66.442 12.576 1.00 0.00 H ATOM 983 N GLY A 110 22.387 67.648 15.652 1.00 12.02 N ATOM 984 CA GLY A 110 23.079 68.863 16.007 1.00 13.75 C ATOM 985 C GLY A 110 22.456 70.111 15.401 1.00 12.62 C ATOM 986 O GLY A 110 23.173 71.057 15.087 1.00 12.90 O ATOM 987 H GLY A 110 21.930 67.083 16.396 1.00 0.00 H ATOM 988 N GLY A 111 21.131 70.138 15.264 1.00 13.04 N ATOM 989 CA GLY A 111 20.419 71.304 14.774 1.00 12.64 C ATOM 990 C GLY A 111 19.903 72.142 15.909 1.00 11.92 C ATOM 991 O GLY A 111 19.274 71.620 16.822 1.00 14.46 O ATOM 992 H GLY A 111 20.585 69.290 15.518 1.00 0.00 H ATOM 993 N HIS A 112 20.169 73.434 15.850 1.00 12.52 N ATOM 994 CA HIS A 112 19.767 74.343 16.931 1.00 12.40 C ATOM 995 C HIS A 112 18.275 74.700 16.812 1.00 12.37 C ATOM 996 O HIS A 112 17.847 75.144 15.762 1.00 13.22 O ATOM 997 CB HIS A 112 20.600 75.617 16.879 1.00 12.92 C ATOM 998 CG HIS A 112 20.649 76.344 18.166 1.00 14.62 C ATOM 999 ND1 HIS A 112 19.513 76.829 18.784 1.00 15.51 N ATOM 1000 CD2 HIS A 112 21.694 76.683 18.950 1.00 15.59 C ATOM 1001 CE1 HIS A 112 19.870 77.443 19.899 1.00 16.65 C ATOM 1002 NE2 HIS A 112 21.185 77.363 20.025 1.00 17.24 N ATOM 1003 H HIS A 112 20.672 73.815 15.023 1.00 0.00 H ATOM 1004 N PRO A 113 17.467 74.485 17.871 1.00 13.29 N ATOM 1005 CA PRO A 113 16.030 74.760 17.797 1.00 14.04 C ATOM 1006 C PRO A 113 15.676 76.233 17.835 1.00 14.20 C ATOM 1007 O PRO A 113 14.529 76.564 17.535 1.00 15.28 O ATOM 1008 CB PRO A 113 15.482 74.026 19.011 1.00 16.80 C ATOM 1009 CG PRO A 113 16.607 74.049 19.999 1.00 16.83 C ATOM 1010 CD PRO A 113 17.832 73.867 19.163 1.00 14.82 C ATOM 1011 N GLY A 114 16.624 77.096 18.185 1.00 14.54 N ATOM 1012 CA GLY A 114 16.412 78.532 18.117 1.00 15.53 C ATOM 1013 C GLY A 114 16.928 79.246 19.355 1.00 15.05 C ATOM 1014 O GLY A 114 16.945 78.700 20.463 1.00 16.40 O ATOM 1015 H GLY A 114 17.541 76.734 18.516 1.00 0.00 H ATOM 1016 N LEU A 115 17.357 80.483 19.149 1.00 16.45 N ATOM 1017 CA LEU A 115 17.760 81.378 20.231 1.00 16.97 C ATOM 1018 C LEU A 115 16.530 81.921 20.944 1.00 19.32 C ATOM 1019 O LEU A 115 15.423 81.863 20.431 1.00 19.49 O ATOM 1020 CB LEU A 115 18.634 82.509 19.678 1.00 17.70 C ATOM 1021 CG LEU A 115 19.899 81.983 19.001 1.00 17.54 C ATOM 1022 CD1 LEU A 115 20.602 83.092 18.243 1.00 17.41 C ATOM 1023 CD2 LEU A 115 20.817 81.349 20.047 1.00 17.96 C ATOM 1024 H LEU A 115 17.409 80.833 18.171 1.00 0.00 H ATOM 1025 N GLN A 116 16.737 82.454 22.144 1.00 23.16 N ATOM 1026 CA GLN A 116 15.618 82.796 23.005 1.00 25.43 C ATOM 1027 C GLN A 116 15.593 84.216 23.490 1.00 28.17 C ATOM 1028 O GLN A 116 14.707 84.544 24.299 1.00 31.60 O ATOM 1029 CB GLN A 116 15.597 81.846 24.181 1.00 29.57 C ATOM 1030 CG GLN A 116 15.447 80.402 23.738 1.00 31.61 C ATOM 1031 CD GLN A 116 15.151 79.475 24.892 1.00 35.59 C ATOM 1032 OE1 GLN A 116 16.005 79.224 25.733 1.00 38.51 O ATOM 1033 NE2 GLN A 116 13.927 78.955 24.934 1.00 35.64 N ATOM 1034 HE22 GLN A 116 13.234 79.197 24.197 1.00 0.00 H ATOM 1035 HE21 GLN A 116 13.664 78.307 25.703 1.00 0.00 H ATOM 1036 H GLN A 116 17.709 82.628 22.470 1.00 0.00 H ATOM 1037 N ASN A 117 16.499 85.074 23.051 1.00 33.44 N ATOM 1038 CA ASN A 117 16.341 86.506 23.320 1.00 36.38 C ATOM 1039 C ASN A 117 17.053 87.374 22.305 1.00 38.98 C ATOM 1040 O ASN A 117 17.802 86.874 21.446 1.00 37.67 O ATOM 1041 CB ASN A 117 16.827 86.880 24.734 1.00 38.03 C ATOM 1042 CG ASN A 117 18.301 86.630 24.916 1.00 41.14 C ATOM 1043 OD1 ASN A 117 19.125 87.202 24.200 1.00 39.30 O ATOM 1044 ND2 ASN A 117 18.649 85.759 25.854 1.00 43.88 N ATOM 1045 HD22 ASN A 117 17.918 85.300 26.435 1.00 0.00 H ATOM 1046 HD21 ASN A 117 19.653 85.535 26.009 1.00 0.00 H ATOM 1047 H ASN A 117 17.323 84.733 22.515 1.00 0.00 H ATOM 1048 N ALA A 118 16.827 88.676 22.390 1.00 41.67 N ATOM 1049 CA ALA A 118 17.340 89.622 21.412 1.00 43.61 C ATOM 1050 C ALA A 118 18.852 89.764 21.488 1.00 40.38 C ATOM 1051 O ALA A 118 19.511 89.958 20.444 1.00 41.31 O ATOM 1052 CB ALA A 118 16.667 90.988 21.618 1.00 44.12 C ATOM 1053 H ALA A 118 16.262 89.035 23.186 1.00 0.00 H ATOM 1054 N GLU A 119 19.431 89.547 22.670 1.00 40.53 N ATOM 1055 CA GLU A 119 20.882 89.700 22.846 1.00 40.98 C ATOM 1056 C GLU A 119 21.634 88.623 22.075 1.00 35.98 C ATOM 1057 O GLU A 119 22.609 88.888 21.360 1.00 34.69 O ATOM 1058 CB GLU A 119 21.274 89.626 24.334 1.00 47.84 C ATOM 1059 CG GLU A 119 22.578 88.846 24.613 1.00 53.87 C ATOM 1060 CD GLU A 119 22.945 88.766 26.091 1.00 60.17 C ATOM 1061 OE1 GLU A 119 23.423 87.687 26.516 1.00 62.72 O ATOM 1062 OE2 GLU A 119 22.769 89.769 26.824 1.00 61.13 O ATOM 1063 H GLU A 119 18.845 89.264 23.481 1.00 0.00 H ATOM 1064 N GLN A 120 21.171 87.400 22.241 1.00 32.13 N ATOM 1065 CA GLN A 120 21.740 86.268 21.536 1.00 28.87 C ATOM 1066 C GLN A 120 21.593 86.405 20.040 1.00 26.07 C ATOM 1067 O GLN A 120 22.543 86.147 19.315 1.00 24.91 O ATOM 1068 CB GLN A 120 21.067 85.000 22.005 1.00 29.21 C ATOM 1069 CG GLN A 120 21.463 84.570 23.397 1.00 32.96 C ATOM 1070 CD GLN A 120 20.563 83.475 23.895 1.00 37.82 C ATOM 1071 OE1 GLN A 120 19.506 83.213 23.307 1.00 35.78 O ATOM 1072 NE2 GLN A 120 20.985 82.792 24.947 1.00 42.92 N ATOM 1073 HE22 GLN A 120 21.881 83.049 25.409 1.00 0.00 H ATOM 1074 HE21 GLN A 120 20.421 81.998 25.312 1.00 0.00 H ATOM 1075 H GLN A 120 20.377 87.243 22.894 1.00 0.00 H ATOM 1076 N ARG A 121 20.441 86.865 19.579 1.00 25.62 N ATOM 1077 CA ARG A 121 20.218 87.021 18.148 1.00 24.49 C ATOM 1078 C ARG A 121 21.136 88.088 17.580 1.00 25.76 C ATOM 1079 O ARG A 121 21.724 87.888 16.528 1.00 24.55 O ATOM 1080 CB ARG A 121 18.758 87.347 17.862 1.00 27.18 C ATOM 1081 CG ARG A 121 17.861 86.189 18.184 1.00 28.33 C ATOM 1082 CD ARG A 121 16.402 86.590 18.224 1.00 31.27 C ATOM 1083 NE ARG A 121 15.598 85.419 18.533 1.00 31.89 N ATOM 1084 CZ ARG A 121 15.273 84.502 17.642 1.00 23.18 C ATOM 1085 NH1 ARG A 121 15.659 84.636 16.366 1.00 23.90 N ATOM 1086 NH2 ARG A 121 14.591 83.434 18.016 1.00 22.03 N ATOM 1087 HE ARG A 121 15.261 85.298 19.509 1.00 0.00 H ATOM 1088 HH12 ARG A 121 15.401 83.911 15.666 1.00 0.00 H ATOM 1089 HH11 ARG A 121 16.216 85.465 16.076 1.00 0.00 H ATOM 1090 HH22 ARG A 121 14.334 82.710 17.315 1.00 0.00 H ATOM 1091 HH21 ARG A 121 14.312 83.318 19.011 1.00 0.00 H ATOM 1092 H ARG A 121 19.685 87.118 20.247 1.00 0.00 H ATOM 1093 N ALA A 122 21.308 89.202 18.295 1.00 28.04 N ATOM 1094 CA ALA A 122 22.227 90.249 17.855 1.00 30.25 C ATOM 1095 C ALA A 122 23.662 89.753 17.763 1.00 28.32 C ATOM 1096 O ALA A 122 24.377 90.046 16.782 1.00 28.65 O ATOM 1097 CB ALA A 122 22.155 91.454 18.814 1.00 31.21 C ATOM 1098 H ALA A 122 20.778 89.327 19.181 1.00 0.00 H ATOM 1099 N GLU A 123 24.096 89.000 18.770 1.00 27.70 N ATOM 1100 CA GLU A 123 25.443 88.433 18.783 1.00 26.90 C ATOM 1101 C GLU A 123 25.652 87.525 17.569 1.00 22.84 C ATOM 1102 O GLU A 123 26.659 87.613 16.862 1.00 23.13 O ATOM 1103 CB GLU A 123 25.682 87.645 20.082 1.00 30.74 C ATOM 1104 CG GLU A 123 26.999 86.855 20.161 1.00 40.44 C ATOM 1105 CD GLU A 123 26.962 85.742 21.215 1.00 52.09 C ATOM 1106 OE1 GLU A 123 25.878 85.484 21.787 1.00 56.39 O ATOM 1107 OE2 GLU A 123 28.010 85.110 21.462 1.00 56.88 O ATOM 1108 H GLU A 123 23.459 88.810 19.570 1.00 0.00 H ATOM 1109 N ARG A 124 24.691 86.663 17.291 1.00 19.57 N ATOM 1110 CA ARG A 124 24.825 85.750 16.168 1.00 17.17 C ATOM 1111 C ARG A 124 24.767 86.513 14.851 1.00 16.55 C ATOM 1112 O ARG A 124 25.487 86.190 13.923 1.00 15.99 O ATOM 1113 CB ARG A 124 23.738 84.692 16.253 1.00 18.56 C ATOM 1114 CG ARG A 124 23.796 83.660 15.146 1.00 19.54 C ATOM 1115 CD ARG A 124 25.151 82.918 15.179 1.00 23.81 C ATOM 1116 NE ARG A 124 25.004 81.678 14.500 1.00 29.73 N ATOM 1117 CZ ARG A 124 24.943 80.470 15.064 1.00 23.79 C ATOM 1118 NH1 ARG A 124 25.127 80.226 16.361 1.00 22.72 N ATOM 1119 NH2 ARG A 124 24.724 79.488 14.265 1.00 23.60 N ATOM 1120 HE ARG A 124 24.938 81.716 13.463 1.00 0.00 H ATOM 1121 HH12 ARG A 124 25.062 79.253 16.721 1.00 0.00 H ATOM 1122 HH11 ARG A 124 25.335 81.009 17.013 1.00 0.00 H ATOM 1123 HH22 ARG A 124 24.664 78.519 14.637 1.00 0.00 H ATOM 1124 HH21 ARG A 124 24.607 79.663 13.246 1.00 0.00 H ATOM 1125 H ARG A 124 23.833 86.637 17.879 1.00 0.00 H ATOM 1126 N GLN A 125 23.924 87.543 14.778 1.00 17.40 N ATOM 1127 CA GLN A 125 23.846 88.340 13.567 1.00 19.21 C ATOM 1128 C GLN A 125 25.195 88.962 13.279 1.00 17.44 C ATOM 1129 O GLN A 125 25.672 88.920 12.165 1.00 17.60 O ATOM 1130 CB GLN A 125 22.796 89.440 13.728 1.00 26.46 C ATOM 1131 CG GLN A 125 22.698 90.413 12.570 1.00 38.98 C ATOM 1132 CD GLN A 125 22.059 91.737 12.986 1.00 51.26 C ATOM 1133 OE1 GLN A 125 21.692 91.937 14.148 1.00 57.11 O ATOM 1134 NE2 GLN A 125 21.961 92.658 12.043 1.00 54.90 N ATOM 1135 HE22 GLN A 125 22.282 92.449 11.076 1.00 0.00 H ATOM 1136 HE21 GLN A 125 21.563 93.592 12.268 1.00 0.00 H ATOM 1137 H GLN A 125 23.320 87.777 15.592 1.00 0.00 H ATOM 1138 N ARG A 126 25.815 89.526 14.308 1.00 17.19 N ATOM 1139 CA ARG A 126 27.115 90.142 14.135 1.00 18.06 C ATOM 1140 C ARG A 126 28.189 89.129 13.766 1.00 17.10 C ATOM 1141 O ARG A 126 29.004 89.371 12.868 1.00 15.38 O ATOM 1142 CB ARG A 126 27.492 90.911 15.398 1.00 19.42 C ATOM 1143 CG ARG A 126 26.706 92.227 15.488 1.00 23.57 C ATOM 1144 CD ARG A 126 27.225 93.111 16.590 1.00 30.92 C ATOM 1145 NE ARG A 126 26.553 92.897 17.860 1.00 41.81 N ATOM 1146 CZ ARG A 126 25.577 93.682 18.321 1.00 46.72 C ATOM 1147 NH1 ARG A 126 25.157 94.736 17.629 1.00 49.36 N ATOM 1148 NH2 ARG A 126 25.020 93.418 19.490 1.00 49.23 N ATOM 1149 HE ARG A 126 26.849 92.087 18.442 1.00 0.00 H ATOM 1150 HH12 ARG A 126 24.395 95.335 18.006 1.00 0.00 H ATOM 1151 HH11 ARG A 126 25.590 94.961 16.711 1.00 0.00 H ATOM 1152 HH22 ARG A 126 24.259 94.027 19.853 1.00 0.00 H ATOM 1153 HH21 ARG A 126 25.342 92.601 20.047 1.00 0.00 H ATOM 1154 H ARG A 126 25.364 89.526 15.245 1.00 0.00 H ATOM 1155 N SER A 127 28.187 87.986 14.434 1.00 15.69 N ATOM 1156 CA SER A 127 29.183 86.951 14.148 1.00 14.29 C ATOM 1157 C SER A 127 29.018 86.403 12.722 1.00 13.69 C ATOM 1158 O SER A 127 30.002 86.295 11.943 1.00 13.10 O ATOM 1159 CB SER A 127 29.049 85.818 15.145 1.00 19.02 C ATOM 1160 OG SER A 127 30.073 84.895 14.960 1.00 23.36 O ATOM 1161 HG SER A 127 30.023 84.528 14.042 1.00 0.00 H ATOM 1162 H SER A 127 27.471 87.821 15.170 1.00 0.00 H ATOM 1163 N ASP A 128 27.777 86.129 12.328 1.00 12.85 N ATOM 1164 CA ASP A 128 27.561 85.664 10.969 1.00 12.47 C ATOM 1165 C ASP A 128 27.933 86.727 9.918 1.00 13.25 C ATOM 1166 O ASP A 128 28.460 86.383 8.866 1.00 13.90 O ATOM 1167 CB ASP A 128 26.118 85.190 10.799 1.00 14.31 C ATOM 1168 CG ASP A 128 25.885 83.789 11.351 1.00 15.19 C ATOM 1169 OD1 ASP A 128 26.869 83.106 11.691 1.00 16.50 O ATOM 1170 OD2 ASP A 128 24.707 83.353 11.431 1.00 16.21 O ATOM 1171 H ASP A 128 26.976 86.246 12.981 1.00 0.00 H ATOM 1172 N ARG A 129 27.683 87.997 10.214 1.00 13.79 N ATOM 1173 CA ARG A 129 28.101 89.082 9.331 1.00 15.26 C ATOM 1174 C ARG A 129 29.611 89.072 9.141 1.00 14.42 C ATOM 1175 O ARG A 129 30.092 89.317 8.027 1.00 13.97 O ATOM 1176 CB ARG A 129 27.634 90.434 9.878 1.00 20.80 C ATOM 1177 H ARG A 129 27.178 88.224 11.094 1.00 0.00 H ATOM 1178 N GLN A 130 30.370 88.821 10.209 1.00 13.48 N ATOM 1179 CA GLN A 130 31.830 88.733 10.072 1.00 13.17 C ATOM 1180 C GLN A 130 32.249 87.541 9.211 1.00 11.37 C ATOM 1181 O GLN A 130 33.123 87.687 8.358 1.00 12.98 O ATOM 1182 CB GLN A 130 32.505 88.647 11.438 1.00 17.02 C ATOM 1183 CG GLN A 130 32.483 89.958 12.176 1.00 27.05 C ATOM 1184 CD GLN A 130 33.123 89.873 13.548 1.00 46.15 C ATOM 1185 OE1 GLN A 130 33.868 88.937 13.846 1.00 54.47 O ATOM 1186 NE2 GLN A 130 32.856 90.870 14.384 1.00 55.34 N ATOM 1187 HE22 GLN A 130 32.221 91.639 14.090 1.00 0.00 H ATOM 1188 HE21 GLN A 130 33.282 90.881 15.333 1.00 0.00 H ATOM 1189 H GLN A 130 29.927 88.687 11.140 1.00 0.00 H ATOM 1190 N TRP A 131 31.646 86.369 9.398 1.00 12.28 N ATOM 1191 CA TRP A 131 31.961 85.233 8.532 1.00 11.52 C ATOM 1192 C TRP A 131 31.588 85.528 7.084 1.00 11.19 C ATOM 1193 O TRP A 131 32.339 85.189 6.170 1.00 11.01 O ATOM 1194 CB TRP A 131 31.235 83.971 9.012 1.00 11.28 C ATOM 1195 CG TRP A 131 31.806 83.331 10.232 1.00 11.05 C ATOM 1196 CD1 TRP A 131 31.225 83.254 11.444 1.00 13.13 C ATOM 1197 CD2 TRP A 131 33.082 82.690 10.359 1.00 10.43 C ATOM 1198 NE1 TRP A 131 32.050 82.593 12.323 1.00 14.66 N ATOM 1199 CE2 TRP A 131 33.196 82.236 11.679 1.00 11.53 C ATOM 1200 CE3 TRP A 131 34.134 82.432 9.474 1.00 9.86 C ATOM 1201 CZ2 TRP A 131 34.314 81.560 12.148 1.00 12.60 C ATOM 1202 CZ3 TRP A 131 35.263 81.750 9.949 1.00 11.30 C ATOM 1203 CH2 TRP A 131 35.332 81.324 11.276 1.00 11.51 C ATOM 1204 HE1 TRP A 131 31.833 82.397 13.321 1.00 0.00 H ATOM 1205 H TRP A 131 30.949 86.261 10.162 1.00 0.00 H ATOM 1206 N VAL A 132 30.445 86.182 6.867 1.00 12.34 N ATOM 1207 CA VAL A 132 30.034 86.555 5.510 1.00 12.68 C ATOM 1208 C VAL A 132 31.127 87.368 4.824 1.00 11.67 C ATOM 1209 O VAL A 132 31.503 87.087 3.688 1.00 12.66 O ATOM 1210 CB VAL A 132 28.718 87.359 5.537 1.00 12.73 C ATOM 1211 CG1 VAL A 132 28.510 88.187 4.251 1.00 15.36 C ATOM 1212 CG2 VAL A 132 27.554 86.430 5.795 1.00 14.44 C ATOM 1213 H VAL A 132 29.837 86.431 7.673 1.00 0.00 H ATOM 1214 N GLN A 133 31.684 88.348 5.524 1.00 12.76 N ATOM 1215 CA GLN A 133 32.736 89.156 4.923 1.00 14.56 C ATOM 1216 C GLN A 133 33.977 88.323 4.618 1.00 12.86 C ATOM 1217 O GLN A 133 34.600 88.533 3.590 1.00 13.70 O ATOM 1218 CB GLN A 133 33.067 90.333 5.821 1.00 17.31 C ATOM 1219 CG GLN A 133 32.002 91.398 5.757 1.00 24.96 C ATOM 1220 CD GLN A 133 31.705 91.835 4.313 1.00 30.87 C ATOM 1221 OE1 GLN A 133 32.619 92.123 3.528 1.00 33.89 O ATOM 1222 NE2 GLN A 133 30.433 91.773 3.936 1.00 31.88 N ATOM 1223 HE22 GLN A 133 29.697 91.527 4.628 1.00 0.00 H ATOM 1224 HE21 GLN A 133 30.173 91.970 2.949 1.00 0.00 H ATOM 1225 H GLN A 133 31.371 88.538 6.497 1.00 0.00 H ATOM 1226 N ARG A 134 34.320 87.362 5.476 1.00 11.72 N ATOM 1227 CA ARG A 134 35.462 86.492 5.244 1.00 11.37 C ATOM 1228 C ARG A 134 35.208 85.613 4.002 1.00 11.26 C ATOM 1229 O ARG A 134 36.086 85.479 3.135 1.00 11.20 O ATOM 1230 CB ARG A 134 35.753 85.649 6.477 1.00 10.87 C ATOM 1231 CG ARG A 134 36.175 86.468 7.687 1.00 12.25 C ATOM 1232 CD ARG A 134 36.805 85.647 8.756 1.00 13.22 C ATOM 1233 NE ARG A 134 38.072 85.102 8.311 1.00 13.40 N ATOM 1234 CZ ARG A 134 38.805 84.261 9.026 1.00 14.37 C ATOM 1235 NH1 ARG A 134 38.378 83.859 10.231 1.00 14.85 N ATOM 1236 NH2 ARG A 134 39.957 83.823 8.528 1.00 16.55 N ATOM 1237 HE ARG A 134 38.427 85.388 7.376 1.00 0.00 H ATOM 1238 HH12 ARG A 134 38.953 83.199 10.793 1.00 0.00 H ATOM 1239 HH11 ARG A 134 37.472 84.207 10.604 1.00 0.00 H ATOM 1240 HH22 ARG A 134 40.543 83.163 9.077 1.00 0.00 H ATOM 1241 HH21 ARG A 134 40.272 84.141 7.589 1.00 0.00 H ATOM 1242 H ARG A 134 33.753 87.230 6.338 1.00 0.00 H ATOM 1243 N PHE A 135 34.011 85.041 3.881 1.00 10.54 N ATOM 1244 CA PHE A 135 33.707 84.195 2.727 1.00 10.74 C ATOM 1245 C PHE A 135 33.699 84.984 1.414 1.00 11.15 C ATOM 1246 O PHE A 135 33.981 84.425 0.351 1.00 11.34 O ATOM 1247 CB PHE A 135 32.374 83.464 2.924 1.00 11.02 C ATOM 1248 CG PHE A 135 32.485 82.262 3.823 1.00 11.10 C ATOM 1249 CD1 PHE A 135 33.200 81.139 3.420 1.00 12.69 C ATOM 1250 CD2 PHE A 135 31.890 82.251 5.060 1.00 11.26 C ATOM 1251 CE1 PHE A 135 33.308 80.045 4.239 1.00 13.52 C ATOM 1252 CE2 PHE A 135 32.002 81.156 5.880 1.00 12.33 C ATOM 1253 CZ PHE A 135 32.726 80.071 5.496 1.00 12.15 C ATOM 1254 H PHE A 135 33.288 85.197 4.612 1.00 0.00 H ATOM 1255 N LEU A 136 33.447 86.287 1.494 1.00 11.38 N ATOM 1256 CA LEU A 136 33.477 87.146 0.313 1.00 12.55 C ATOM 1257 C LEU A 136 34.867 87.646 -0.073 1.00 12.24 C ATOM 1258 O LEU A 136 35.022 88.176 -1.159 1.00 13.76 O ATOM 1259 CB LEU A 136 32.566 88.351 0.524 1.00 12.76 C ATOM 1260 CG LEU A 136 31.078 88.043 0.461 1.00 14.67 C ATOM 1261 CD1 LEU A 136 30.272 89.227 0.907 1.00 17.61 C ATOM 1262 CD2 LEU A 136 30.658 87.689 -0.924 1.00 15.57 C ATOM 1263 H LEU A 136 33.223 86.705 2.420 1.00 0.00 H ATOM 1264 N THR A 137 35.855 87.514 0.806 1.00 12.00 N ATOM 1265 CA THR A 137 37.124 88.213 0.587 1.00 12.55 C ATOM 1266 C THR A 137 38.400 87.406 0.784 1.00 11.18 C ATOM 1267 O THR A 137 39.450 87.850 0.371 1.00 13.03 O ATOM 1268 CB THR A 137 37.237 89.460 1.487 1.00 13.96 C ATOM 1269 OG1 THR A 137 37.201 89.092 2.864 1.00 14.92 O ATOM 1270 CG2 THR A 137 36.143 90.478 1.198 1.00 15.77 C ATOM 1271 HG1 THR A 137 36.346 88.632 3.059 1.00 0.00 H ATOM 1272 H THR A 137 35.728 86.916 1.647 1.00 0.00 H ATOM 1273 N GLU A 138 38.335 86.219 1.372 1.00 12.19 N ATOM 1274 CA GLU A 138 39.540 85.488 1.755 1.00 11.35 C ATOM 1275 C GLU A 138 39.683 84.139 1.085 1.00 10.90 C ATOM 1276 O GLU A 138 38.711 83.568 0.615 1.00 11.35 O ATOM 1277 CB GLU A 138 39.557 85.296 3.264 1.00 13.03 C ATOM 1278 CG GLU A 138 39.739 86.568 4.040 1.00 15.65 C ATOM 1279 CD GLU A 138 39.752 86.311 5.531 1.00 20.62 C ATOM 1280 OE1 GLU A 138 40.355 85.299 5.985 1.00 26.13 O ATOM 1281 OE2 GLU A 138 39.201 87.135 6.225 1.00 22.53 O ATOM 1282 H GLU A 138 37.404 85.799 1.565 1.00 0.00 H ATOM 1283 N PRO A 139 40.922 83.612 1.054 1.00 11.93 N ATOM 1284 CA PRO A 139 41.096 82.251 0.528 1.00 11.54 C ATOM 1285 C PRO A 139 40.252 81.288 1.391 1.00 10.81 C ATOM 1286 O PRO A 139 40.316 81.358 2.634 1.00 10.48 O ATOM 1287 CB PRO A 139 42.588 81.981 0.714 1.00 12.12 C ATOM 1288 CG PRO A 139 43.203 83.312 1.094 1.00 15.03 C ATOM 1289 CD PRO A 139 42.149 84.153 1.651 1.00 13.55 C ATOM 1290 N LEU A 140 39.481 80.388 0.790 1.00 10.47 N ATOM 1291 CA LEU A 140 38.612 79.533 1.590 1.00 10.08 C ATOM 1292 C LEU A 140 39.410 78.578 2.438 1.00 9.75 C ATOM 1293 O LEU A 140 38.957 78.219 3.525 1.00 10.07 O ATOM 1294 CB LEU A 140 37.606 78.792 0.718 1.00 10.50 C ATOM 1295 CG LEU A 140 36.632 79.700 -0.026 1.00 12.71 C ATOM 1296 CD1 LEU A 140 35.574 78.799 -0.726 1.00 14.17 C ATOM 1297 CD2 LEU A 140 35.983 80.734 0.848 1.00 15.01 C ATOM 1298 H LEU A 140 39.497 80.294 -0.246 1.00 0.00 H ATOM 1299 N THR A 141 40.618 78.203 2.037 1.00 10.44 N ATOM 1300 CA THR A 141 41.423 77.340 2.916 1.00 10.79 C ATOM 1301 C THR A 141 41.766 78.095 4.229 1.00 10.89 C ATOM 1302 O THR A 141 41.879 77.476 5.284 1.00 12.43 O ATOM 1303 CB THR A 141 42.716 76.822 2.249 1.00 11.67 C ATOM 1304 OG1 THR A 141 43.458 77.931 1.741 1.00 12.98 O ATOM 1305 CG2 THR A 141 42.427 75.799 1.160 1.00 13.21 C ATOM 1306 HG1 THR A 141 42.910 78.415 1.074 1.00 0.00 H ATOM 1307 H THR A 141 40.990 78.514 1.117 1.00 0.00 H ATOM 1308 N ALA A 142 41.947 79.406 4.175 1.00 10.85 N ATOM 1309 CA ALA A 142 42.189 80.189 5.394 1.00 10.98 C ATOM 1310 C ALA A 142 40.898 80.333 6.218 1.00 9.37 C ATOM 1311 O ALA A 142 40.912 80.179 7.440 1.00 10.54 O ATOM 1312 CB ALA A 142 42.752 81.538 5.043 1.00 12.44 C ATOM 1313 H ALA A 142 41.917 79.889 3.254 1.00 0.00 H ATOM 1314 N VAL A 143 39.772 80.615 5.561 1.00 9.52 N ATOM 1315 CA VAL A 143 38.523 80.793 6.279 1.00 10.03 C ATOM 1316 C VAL A 143 38.151 79.482 6.967 1.00 9.66 C ATOM 1317 O VAL A 143 37.790 79.474 8.147 1.00 9.32 O ATOM 1318 CB VAL A 143 37.385 81.241 5.370 1.00 10.44 C ATOM 1319 CG1 VAL A 143 36.096 81.478 6.173 1.00 11.49 C ATOM 1320 CG2 VAL A 143 37.762 82.514 4.645 1.00 11.34 C ATOM 1321 H VAL A 143 39.789 80.708 4.525 1.00 0.00 H ATOM 1322 N PHE A 144 38.246 78.360 6.252 1.00 8.54 N ATOM 1323 CA PHE A 144 37.834 77.077 6.840 1.00 8.80 C ATOM 1324 C PHE A 144 38.815 76.608 7.915 1.00 8.96 C ATOM 1325 O PHE A 144 38.399 75.897 8.846 1.00 9.46 O ATOM 1326 CB PHE A 144 37.598 75.989 5.762 1.00 8.93 C ATOM 1327 CG PHE A 144 36.273 76.158 5.054 1.00 8.91 C ATOM 1328 CD1 PHE A 144 35.100 76.037 5.770 1.00 10.25 C ATOM 1329 CD2 PHE A 144 36.205 76.512 3.728 1.00 9.99 C ATOM 1330 CE1 PHE A 144 33.866 76.206 5.166 1.00 10.19 C ATOM 1331 CE2 PHE A 144 34.956 76.705 3.117 1.00 10.05 C ATOM 1332 CZ PHE A 144 33.810 76.570 3.836 1.00 9.80 C ATOM 1333 H PHE A 144 38.611 78.393 5.279 1.00 0.00 H ATOM 1334 N ALA A 145 40.094 76.988 7.837 1.00 9.90 N ATOM 1335 CA ALA A 145 41.013 76.662 8.929 1.00 9.71 C ATOM 1336 C ALA A 145 40.543 77.272 10.257 1.00 9.99 C ATOM 1337 O ALA A 145 40.675 76.654 11.316 1.00 12.19 O ATOM 1338 CB ALA A 145 42.416 77.102 8.616 1.00 11.07 C ATOM 1339 H ALA A 145 40.434 77.512 7.006 1.00 0.00 H ATOM 1340 N ASP A 146 39.963 78.460 10.200 1.00 10.19 N ATOM 1341 CA ASP A 146 39.362 79.074 11.385 1.00 8.94 C ATOM 1342 C ASP A 146 37.962 78.523 11.654 1.00 9.01 C ATOM 1343 O ASP A 146 37.595 78.296 12.817 1.00 9.82 O ATOM 1344 CB ASP A 146 39.313 80.578 11.257 1.00 10.72 C ATOM 1345 CG ASP A 146 40.657 81.236 11.458 1.00 11.55 C ATOM 1346 OD1 ASP A 146 41.502 80.653 12.177 1.00 14.37 O ATOM 1347 OD2 ASP A 146 40.842 82.335 10.906 1.00 13.53 O ATOM 1348 H ASP A 146 39.934 78.969 9.293 1.00 0.00 H ATOM 1349 N TRP A 147 37.187 78.265 10.615 1.00 8.60 N ATOM 1350 CA TRP A 147 35.850 77.698 10.800 1.00 9.36 C ATOM 1351 C TRP A 147 35.894 76.450 11.681 1.00 7.91 C ATOM 1352 O TRP A 147 35.068 76.281 12.600 1.00 9.09 O ATOM 1353 CB TRP A 147 35.231 77.355 9.428 1.00 8.42 C ATOM 1354 CG TRP A 147 33.853 76.863 9.488 1.00 8.26 C ATOM 1355 CD1 TRP A 147 33.440 75.570 9.421 1.00 8.69 C ATOM 1356 CD2 TRP A 147 32.668 77.649 9.613 1.00 8.57 C ATOM 1357 NE1 TRP A 147 32.092 75.499 9.504 1.00 9.95 N ATOM 1358 CE2 TRP A 147 31.585 76.764 9.630 1.00 9.40 C ATOM 1359 CE3 TRP A 147 32.417 79.023 9.732 1.00 9.88 C ATOM 1360 CZ2 TRP A 147 30.264 77.198 9.801 1.00 10.36 C ATOM 1361 CZ3 TRP A 147 31.111 79.456 9.863 1.00 10.86 C ATOM 1362 CH2 TRP A 147 30.044 78.547 9.888 1.00 11.32 C ATOM 1363 HE1 TRP A 147 31.531 74.624 9.477 1.00 0.00 H ATOM 1364 H TRP A 147 37.531 78.467 9.655 1.00 0.00 H ATOM 1365 N TYR A 148 36.838 75.551 11.399 1.00 8.40 N ATOM 1366 CA TYR A 148 36.915 74.266 12.104 1.00 8.90 C ATOM 1367 C TYR A 148 37.664 74.366 13.445 1.00 9.08 C ATOM 1368 O TYR A 148 37.903 73.338 14.087 1.00 10.09 O ATOM 1369 CB TYR A 148 37.500 73.164 11.167 1.00 9.39 C ATOM 1370 CG TYR A 148 36.418 72.717 10.213 1.00 9.00 C ATOM 1371 CD1 TYR A 148 35.284 72.051 10.695 1.00 9.35 C ATOM 1372 CD2 TYR A 148 36.459 73.032 8.859 1.00 8.90 C ATOM 1373 CE1 TYR A 148 34.247 71.711 9.870 1.00 9.37 C ATOM 1374 CE2 TYR A 148 35.424 72.678 8.033 1.00 9.86 C ATOM 1375 CZ TYR A 148 34.319 72.015 8.542 1.00 9.15 C ATOM 1376 OH TYR A 148 33.244 71.682 7.736 1.00 9.85 O ATOM 1377 HH TYR A 148 32.559 71.217 8.278 1.00 0.00 H ATOM 1378 H TYR A 148 37.538 75.766 10.660 1.00 0.00 H ATOM 1379 N GLN A 149 37.955 75.599 13.894 1.00 9.39 N ATOM 1380 CA GLN A 149 38.447 75.870 15.253 1.00 9.37 C ATOM 1381 C GLN A 149 37.379 76.547 16.109 1.00 9.84 C ATOM 1382 O GLN A 149 37.651 76.876 17.261 1.00 10.09 O ATOM 1383 CB GLN A 149 39.733 76.697 15.232 1.00 10.30 C ATOM 1384 CG GLN A 149 40.863 75.948 14.611 1.00 12.24 C ATOM 1385 CD GLN A 149 42.188 76.700 14.706 1.00 15.33 C ATOM 1386 OE1 GLN A 149 42.893 76.585 15.708 1.00 19.04 O ATOM 1387 NE2 GLN A 149 42.525 77.451 13.690 1.00 17.38 N ATOM 1388 HE22 GLN A 149 41.898 77.519 12.863 1.00 0.00 H ATOM 1389 HE21 GLN A 149 43.420 77.980 13.709 1.00 0.00 H ATOM 1390 H GLN A 149 37.826 76.403 13.247 1.00 0.00 H ATOM 1391 N GLN A 150 36.165 76.748 15.583 1.00 9.98 N ATOM 1392 CA GLN A 150 35.065 77.243 16.402 1.00 9.95 C ATOM 1393 C GLN A 150 34.780 76.245 17.525 1.00 9.88 C ATOM 1394 O GLN A 150 35.082 75.051 17.387 1.00 9.68 O ATOM 1395 CB GLN A 150 33.807 77.449 15.573 1.00 11.20 C ATOM 1396 CG GLN A 150 33.844 78.560 14.583 1.00 13.24 C ATOM 1397 CD GLN A 150 32.567 78.620 13.790 1.00 15.21 C ATOM 1398 OE1 GLN A 150 31.680 79.440 14.102 1.00 18.81 O ATOM 1399 NE2 GLN A 150 32.409 77.703 12.797 1.00 14.13 N ATOM 1400 HE22 GLN A 150 33.179 77.040 12.574 1.00 0.00 H ATOM 1401 HE21 GLN A 150 31.519 77.665 12.261 1.00 0.00 H ATOM 1402 H GLN A 150 36.004 76.548 14.575 1.00 0.00 H ATOM 1403 N PRO A 151 34.170 76.707 18.625 1.00 9.84 N ATOM 1404 CA PRO A 151 33.948 75.806 19.765 1.00 10.62 C ATOM 1405 C PRO A 151 33.223 74.507 19.421 1.00 10.93 C ATOM 1406 O PRO A 151 33.548 73.470 19.981 1.00 11.65 O ATOM 1407 CB PRO A 151 33.145 76.686 20.724 1.00 11.62 C ATOM 1408 CG PRO A 151 33.680 78.058 20.480 1.00 11.05 C ATOM 1409 CD PRO A 151 33.908 78.119 18.997 1.00 11.29 C ATOM 1410 N VAL A 152 32.267 74.552 18.492 1.00 10.77 N ATOM 1411 CA VAL A 152 31.502 73.373 18.178 1.00 11.63 C ATOM 1412 C VAL A 152 32.392 72.305 17.520 1.00 11.33 C ATOM 1413 O VAL A 152 32.040 71.121 17.508 1.00 11.99 O ATOM 1414 CB VAL A 152 30.284 73.753 17.311 1.00 12.68 C ATOM 1415 CG1 VAL A 152 30.662 74.138 15.896 1.00 14.47 C ATOM 1416 CG2 VAL A 152 29.283 72.661 17.291 1.00 15.22 C ATOM 1417 H VAL A 152 32.073 75.443 17.992 1.00 0.00 H ATOM 1418 N PHE A 153 33.564 72.734 17.049 1.00 10.09 N ATOM 1419 CA PHE A 153 34.554 71.863 16.410 1.00 9.62 C ATOM 1420 C PHE A 153 35.846 71.700 17.214 1.00 9.48 C ATOM 1421 O PHE A 153 36.817 71.122 16.713 1.00 11.05 O ATOM 1422 CB PHE A 153 34.857 72.397 14.983 1.00 9.87 C ATOM 1423 CG PHE A 153 33.634 72.345 14.072 1.00 9.87 C ATOM 1424 CD1 PHE A 153 32.949 71.146 13.891 1.00 9.55 C ATOM 1425 CD2 PHE A 153 33.161 73.484 13.434 1.00 11.25 C ATOM 1426 CE1 PHE A 153 31.843 71.108 13.084 1.00 11.23 C ATOM 1427 CE2 PHE A 153 32.044 73.432 12.648 1.00 11.30 C ATOM 1428 CZ PHE A 153 31.395 72.270 12.465 1.00 12.22 C ATOM 1429 H PHE A 153 33.788 73.745 17.141 1.00 0.00 H ATOM 1430 N ALA A 154 35.832 72.116 18.479 1.00 10.57 N ATOM 1431 CA ALA A 154 36.981 71.982 19.349 1.00 11.20 C ATOM 1432 C ALA A 154 37.433 70.520 19.467 1.00 11.87 C ATOM 1433 O ALA A 154 38.614 70.242 19.642 1.00 12.57 O ATOM 1434 CB ALA A 154 36.660 72.515 20.739 1.00 12.85 C ATOM 1435 H ALA A 154 34.966 72.552 18.855 1.00 0.00 H ATOM 1436 N SER A 155 36.479 69.604 19.387 1.00 12.72 N ATOM 1437 CA SER A 155 36.782 68.210 19.627 1.00 13.30 C ATOM 1438 C SER A 155 37.615 67.575 18.531 1.00 12.82 C ATOM 1439 O SER A 155 38.188 66.516 18.740 1.00 13.52 O ATOM 1440 CB SER A 155 35.484 67.400 19.797 1.00 14.49 C ATOM 1441 OG SER A 155 34.775 67.313 18.566 1.00 15.87 O ATOM 1442 HG SER A 155 35.344 66.866 17.890 1.00 0.00 H ATOM 1443 H SER A 155 35.507 69.889 19.150 1.00 0.00 H ATOM 1444 N LEU A 156 37.640 68.169 17.348 1.00 10.68 N ATOM 1445 CA LEU A 156 38.391 67.611 16.218 1.00 11.61 C ATOM 1446 C LEU A 156 39.886 67.599 16.508 1.00 12.10 C ATOM 1447 O LEU A 156 40.400 68.443 17.246 1.00 13.97 O ATOM 1448 CB LEU A 156 38.125 68.405 14.952 1.00 11.29 C ATOM 1449 CG LEU A 156 36.682 68.391 14.434 1.00 10.57 C ATOM 1450 CD1 LEU A 156 36.589 69.330 13.231 1.00 12.41 C ATOM 1451 CD2 LEU A 156 36.183 67.024 14.094 1.00 12.68 C ATOM 1452 H LEU A 156 37.113 69.056 17.216 1.00 0.00 H ATOM 1453 N ASN A 157 40.583 66.652 15.877 1.00 12.01 N ATOM 1454 CA ASN A 157 42.038 66.663 15.914 1.00 11.97 C ATOM 1455 C ASN A 157 42.580 67.315 14.645 1.00 12.74 C ATOM 1456 O ASN A 157 41.811 67.633 13.722 1.00 12.63 O ATOM 1457 CB ASN A 157 42.600 65.248 16.154 1.00 13.26 C ATOM 1458 CG ASN A 157 42.317 64.271 15.028 1.00 13.74 C ATOM 1459 OD1 ASN A 157 42.469 64.594 13.854 1.00 14.55 O ATOM 1460 ND2 ASN A 157 41.956 63.046 15.383 1.00 17.17 N ATOM 1461 HD22 ASN A 157 41.837 62.810 16.389 1.00 0.00 H ATOM 1462 HD21 ASN A 157 41.792 62.321 14.656 1.00 0.00 H ATOM 1463 H ASN A 157 40.084 65.903 15.356 1.00 0.00 H ATOM 1464 N ASP A 158 43.900 67.527 14.584 1.00 14.60 N ATOM 1465 CA ASP A 158 44.485 68.280 13.487 1.00 15.33 C ATOM 1466 C ASP A 158 44.313 67.586 12.139 1.00 13.64 C ATOM 1467 O ASP A 158 44.087 68.228 11.112 1.00 14.32 O ATOM 1468 CB ASP A 158 45.994 68.463 13.690 1.00 22.20 C ATOM 1469 CG ASP A 158 46.361 69.337 14.869 1.00 41.93 C ATOM 1470 OD1 ASP A 158 45.537 70.136 15.355 1.00 42.49 O ATOM 1471 OD2 ASP A 158 47.539 69.218 15.304 1.00 51.56 O ATOM 1472 H ASP A 158 44.516 67.148 15.332 1.00 0.00 H ATOM 1473 N ASP A 159 44.414 66.262 12.118 1.00 15.16 N ATOM 1474 CA ASP A 159 44.220 65.503 10.877 1.00 16.26 C ATOM 1475 C ASP A 159 42.819 65.663 10.337 1.00 13.80 C ATOM 1476 O ASP A 159 42.605 65.875 9.146 1.00 14.43 O ATOM 1477 CB ASP A 159 44.511 64.006 11.102 1.00 18.55 C ATOM 1478 CG ASP A 159 45.996 63.682 11.215 1.00 30.12 C ATOM 1479 OD1 ASP A 159 46.858 64.510 10.840 1.00 32.22 O ATOM 1480 OD2 ASP A 159 46.295 62.564 11.676 1.00 37.52 O ATOM 1481 H ASP A 159 44.635 65.753 12.998 1.00 0.00 H ATOM 1482 N GLN A 160 41.844 65.584 11.237 1.00 12.10 N ATOM 1483 CA GLN A 160 40.447 65.750 10.865 1.00 11.52 C ATOM 1484 C GLN A 160 40.173 67.126 10.296 1.00 11.54 C ATOM 1485 O GLN A 160 39.477 67.277 9.294 1.00 11.45 O ATOM 1486 CB GLN A 160 39.544 65.483 12.067 1.00 11.93 C ATOM 1487 CG GLN A 160 39.464 64.010 12.463 1.00 12.84 C ATOM 1488 CD GLN A 160 38.772 63.781 13.769 1.00 13.54 C ATOM 1489 OE1 GLN A 160 38.913 64.569 14.711 1.00 13.08 O ATOM 1490 NE2 GLN A 160 38.009 62.715 13.859 1.00 15.08 N ATOM 1491 HE22 GLN A 160 37.914 62.074 13.046 1.00 0.00 H ATOM 1492 HE21 GLN A 160 37.500 62.513 14.743 1.00 0.00 H ATOM 1493 H GLN A 160 42.086 65.399 12.232 1.00 0.00 H ATOM 1494 N ARG A 161 40.737 68.140 10.938 1.00 11.34 N ATOM 1495 CA ARG A 161 40.578 69.516 10.484 1.00 10.33 C ATOM 1496 C ARG A 161 41.208 69.696 9.113 1.00 11.45 C ATOM 1497 O ARG A 161 40.581 70.300 8.245 1.00 12.09 O ATOM 1498 CB ARG A 161 41.171 70.514 11.465 1.00 11.07 C ATOM 1499 CG ARG A 161 40.424 70.634 12.770 1.00 11.09 C ATOM 1500 CD ARG A 161 40.868 71.866 13.572 1.00 12.91 C ATOM 1501 NE ARG A 161 40.135 71.912 14.823 1.00 12.22 N ATOM 1502 CZ ARG A 161 40.573 71.521 15.995 1.00 12.86 C ATOM 1503 NH1 ARG A 161 41.841 71.173 16.159 1.00 16.52 N ATOM 1504 NH2 ARG A 161 39.738 71.542 17.014 1.00 13.74 N ATOM 1505 HE ARG A 161 39.168 72.292 14.786 1.00 0.00 H ATOM 1506 HH12 ARG A 161 42.179 70.864 17.093 1.00 0.00 H ATOM 1507 HH11 ARG A 161 42.498 71.209 15.354 1.00 0.00 H ATOM 1508 HH22 ARG A 161 40.058 71.237 17.955 1.00 0.00 H ATOM 1509 HH21 ARG A 161 38.758 71.863 16.877 1.00 0.00 H ATOM 1510 H ARG A 161 41.307 67.949 11.787 1.00 0.00 H ATOM 1511 N ARG A 162 42.418 69.174 8.896 1.00 13.33 N ATOM 1512 CA ARG A 162 43.062 69.335 7.600 1.00 13.63 C ATOM 1513 C ARG A 162 42.208 68.733 6.494 1.00 13.12 C ATOM 1514 O ARG A 162 42.044 69.328 5.427 1.00 12.30 O ATOM 1515 CB ARG A 162 44.458 68.714 7.616 1.00 15.95 C ATOM 1516 CG ARG A 162 45.450 69.709 8.262 1.00 23.05 C ATOM 1517 CD ARG A 162 46.948 69.332 8.201 1.00 33.46 C ATOM 1518 NE ARG A 162 47.384 68.630 9.404 1.00 44.99 N ATOM 1519 CZ ARG A 162 47.370 67.315 9.569 1.00 50.56 C ATOM 1520 NH1 ARG A 162 46.940 66.524 8.593 1.00 52.88 N ATOM 1521 NH2 ARG A 162 47.794 66.794 10.716 1.00 50.29 N ATOM 1522 HE ARG A 162 47.734 69.208 10.195 1.00 0.00 H ATOM 1523 HH12 ARG A 162 46.930 65.493 8.726 1.00 0.00 H ATOM 1524 HH11 ARG A 162 46.613 66.936 7.696 1.00 0.00 H ATOM 1525 HH22 ARG A 162 47.786 65.763 10.853 1.00 0.00 H ATOM 1526 HH21 ARG A 162 48.134 67.417 11.476 1.00 0.00 H ATOM 1527 H ARG A 162 42.901 68.651 9.654 1.00 0.00 H ATOM 1528 N GLU A 163 41.652 67.562 6.736 1.00 13.02 N ATOM 1529 CA GLU A 163 40.820 66.894 5.754 1.00 12.52 C ATOM 1530 C GLU A 163 39.568 67.717 5.481 1.00 11.63 C ATOM 1531 O GLU A 163 39.155 67.857 4.342 1.00 11.86 O ATOM 1532 CB GLU A 163 40.454 65.526 6.288 1.00 16.83 C ATOM 1533 CG GLU A 163 39.708 64.607 5.390 1.00 25.67 C ATOM 1534 CD GLU A 163 39.500 63.221 6.044 1.00 35.64 C ATOM 1535 OE1 GLU A 163 39.139 63.128 7.250 1.00 33.96 O ATOM 1536 OE2 GLU A 163 39.749 62.212 5.358 1.00 39.93 O ATOM 1537 H GLU A 163 41.815 67.105 7.656 1.00 0.00 H ATOM 1538 N LEU A 164 38.945 68.235 6.543 1.00 10.92 N ATOM 1539 CA LEU A 164 37.734 69.043 6.361 1.00 9.67 C ATOM 1540 C LEU A 164 38.001 70.347 5.614 1.00 9.24 C ATOM 1541 O LEU A 164 37.210 70.748 4.753 1.00 10.31 O ATOM 1542 CB LEU A 164 37.095 69.313 7.705 1.00 10.14 C ATOM 1543 CG LEU A 164 36.208 68.149 8.189 1.00 11.23 C ATOM 1544 CD1 LEU A 164 36.128 68.121 9.701 1.00 11.13 C ATOM 1545 CD2 LEU A 164 34.820 68.169 7.534 1.00 12.14 C ATOM 1546 H LEU A 164 39.318 68.066 7.499 1.00 0.00 H ATOM 1547 N VAL A 165 39.092 71.027 5.938 1.00 9.86 N ATOM 1548 CA VAL A 165 39.450 72.258 5.228 1.00 10.90 C ATOM 1549 C VAL A 165 39.586 71.984 3.727 1.00 11.63 C ATOM 1550 O VAL A 165 39.065 72.728 2.883 1.00 11.57 O ATOM 1551 CB VAL A 165 40.727 72.870 5.778 1.00 11.68 C ATOM 1552 CG1 VAL A 165 41.266 73.968 4.889 1.00 13.10 C ATOM 1553 CG2 VAL A 165 40.469 73.396 7.174 1.00 12.55 C ATOM 1554 H VAL A 165 39.702 70.682 6.706 1.00 0.00 H ATOM 1555 N ALA A 166 40.279 70.913 3.385 1.00 11.66 N ATOM 1556 CA ALA A 166 40.476 70.560 1.981 1.00 12.49 C ATOM 1557 C ALA A 166 39.134 70.280 1.310 1.00 12.51 C ATOM 1558 O ALA A 166 38.885 70.718 0.184 1.00 13.67 O ATOM 1559 CB ALA A 166 41.409 69.358 1.859 1.00 14.34 C ATOM 1560 H ALA A 166 40.691 70.311 4.127 1.00 0.00 H ATOM 1561 N LEU A 167 38.256 69.561 1.986 1.00 11.57 N ATOM 1562 CA LEU A 167 36.939 69.241 1.440 1.00 10.70 C ATOM 1563 C LEU A 167 36.078 70.496 1.232 1.00 10.72 C ATOM 1564 O LEU A 167 35.558 70.730 0.142 1.00 11.19 O ATOM 1565 CB LEU A 167 36.217 68.265 2.363 1.00 11.78 C ATOM 1566 CG LEU A 167 34.805 67.840 1.986 1.00 12.43 C ATOM 1567 CD1 LEU A 167 34.798 67.057 0.687 1.00 15.30 C ATOM 1568 CD2 LEU A 167 34.244 66.997 3.112 1.00 13.83 C ATOM 1569 H LEU A 167 38.509 69.213 2.933 1.00 0.00 H ATOM 1570 N ARG A 168 35.886 71.277 2.291 1.00 9.72 N ATOM 1571 CA ARG A 168 34.982 72.416 2.213 1.00 9.69 C ATOM 1572 C ARG A 168 35.489 73.549 1.327 1.00 9.87 C ATOM 1573 O ARG A 168 34.736 74.404 0.902 1.00 10.25 O ATOM 1574 CB ARG A 168 34.647 72.980 3.609 1.00 9.59 C ATOM 1575 CG ARG A 168 34.141 71.971 4.625 1.00 9.30 C ATOM 1576 CD ARG A 168 33.047 71.091 4.158 1.00 9.15 C ATOM 1577 NE ARG A 168 32.617 70.259 5.277 1.00 9.92 N ATOM 1578 CZ ARG A 168 31.772 69.227 5.194 1.00 10.04 C ATOM 1579 NH1 ARG A 168 31.270 68.842 4.034 1.00 10.76 N ATOM 1580 NH2 ARG A 168 31.421 68.537 6.264 1.00 10.42 N ATOM 1581 HE ARG A 168 33.000 70.488 6.217 1.00 0.00 H ATOM 1582 HH12 ARG A 168 30.614 68.036 3.993 1.00 0.00 H ATOM 1583 HH11 ARG A 168 31.531 69.345 3.162 1.00 0.00 H ATOM 1584 HH22 ARG A 168 30.762 67.738 6.174 1.00 0.00 H ATOM 1585 HH21 ARG A 168 31.804 68.793 7.196 1.00 0.00 H ATOM 1586 H ARG A 168 36.385 71.073 3.181 1.00 0.00 H ATOM 1587 N SER A 169 36.776 73.583 1.068 1.00 10.20 N ATOM 1588 CA SER A 169 37.300 74.636 0.215 1.00 10.66 C ATOM 1589 C SER A 169 36.870 74.488 -1.249 1.00 8.99 C ATOM 1590 O SER A 169 37.107 75.398 -2.042 1.00 9.42 O ATOM 1591 CB SER A 169 38.803 74.725 0.362 1.00 10.86 C ATOM 1592 OG SER A 169 39.137 75.201 1.669 1.00 11.01 O ATOM 1593 HG SER A 169 38.778 74.576 2.348 1.00 0.00 H ATOM 1594 H SER A 169 37.413 72.865 1.469 1.00 0.00 H ATOM 1595 N ASN A 170 36.233 73.371 -1.601 1.00 10.76 N ATOM 1596 CA ASN A 170 35.503 73.287 -2.856 1.00 11.38 C ATOM 1597 C ASN A 170 34.092 73.848 -2.640 1.00 10.78 C ATOM 1598 O ASN A 170 33.171 73.147 -2.190 1.00 11.18 O ATOM 1599 CB ASN A 170 35.472 71.851 -3.371 1.00 12.06 C ATOM 1600 CG ASN A 170 34.751 71.726 -4.688 1.00 13.72 C ATOM 1601 OD1 ASN A 170 34.841 72.599 -5.524 1.00 14.27 O ATOM 1602 ND2 ASN A 170 34.048 70.639 -4.881 1.00 16.02 N ATOM 1603 HD22 ASN A 170 33.997 69.914 -4.137 1.00 0.00 H ATOM 1604 HD21 ASN A 170 33.541 70.500 -5.778 1.00 0.00 H ATOM 1605 H ASN A 170 36.259 72.546 -0.968 1.00 0.00 H ATOM 1606 N ASN A 171 33.919 75.141 -2.927 1.00 10.57 N ATOM 1607 CA ASN A 171 32.704 75.876 -2.596 1.00 9.61 C ATOM 1608 C ASN A 171 32.805 77.240 -3.212 1.00 9.67 C ATOM 1609 O ASN A 171 33.918 77.710 -3.503 1.00 10.49 O ATOM 1610 CB ASN A 171 32.525 76.030 -1.089 1.00 9.31 C ATOM 1611 CG ASN A 171 31.530 75.076 -0.486 1.00 9.80 C ATOM 1612 OD1 ASN A 171 30.400 74.990 -0.925 1.00 10.61 O ATOM 1613 ND2 ASN A 171 31.941 74.385 0.562 1.00 10.74 N ATOM 1614 HD22 ASN A 171 32.918 74.490 0.904 1.00 0.00 H ATOM 1615 HD21 ASN A 171 31.288 73.736 1.046 1.00 0.00 H ATOM 1616 H ASN A 171 34.688 75.648 -3.410 1.00 0.00 H ATOM 1617 N ASN A 172 31.671 77.909 -3.388 1.00 9.64 N ATOM 1618 CA ASN A 172 31.641 79.268 -3.899 1.00 9.70 C ATOM 1619 C ASN A 172 31.471 80.197 -2.695 1.00 9.86 C ATOM 1620 O ASN A 172 30.435 80.179 -2.027 1.00 10.52 O ATOM 1621 CB ASN A 172 30.532 79.442 -4.932 1.00 11.17 C ATOM 1622 CG ASN A 172 30.529 80.827 -5.516 1.00 12.02 C ATOM 1623 OD1 ASN A 172 30.539 81.811 -4.769 1.00 13.59 O ATOM 1624 ND2 ASN A 172 30.602 80.921 -6.837 1.00 11.76 N ATOM 1625 HD22 ASN A 172 30.590 80.061 -7.421 1.00 0.00 H ATOM 1626 HD21 ASN A 172 30.672 81.855 -7.289 1.00 0.00 H ATOM 1627 H ASN A 172 30.772 77.443 -3.151 1.00 0.00 H ATOM 1628 N GLY A 173 32.494 80.982 -2.380 1.00 10.38 N ATOM 1629 CA GLY A 173 32.429 81.828 -1.195 1.00 10.93 C ATOM 1630 C GLY A 173 31.278 82.799 -1.235 1.00 10.76 C ATOM 1631 O GLY A 173 30.688 83.090 -0.185 1.00 11.32 O ATOM 1632 H GLY A 173 33.343 80.993 -2.980 1.00 0.00 H ATOM 1633 N ALA A 174 30.950 83.335 -2.416 1.00 11.68 N ATOM 1634 CA ALA A 174 29.853 84.298 -2.497 1.00 12.17 C ATOM 1635 C ALA A 174 28.511 83.643 -2.177 1.00 11.48 C ATOM 1636 O ALA A 174 27.660 84.256 -1.509 1.00 12.38 O ATOM 1637 CB ALA A 174 29.807 84.946 -3.873 1.00 12.58 C ATOM 1638 H ALA A 174 31.474 83.067 -3.274 1.00 0.00 H ATOM 1639 N THR A 175 28.263 82.432 -2.699 1.00 10.89 N ATOM 1640 CA THR A 175 26.947 81.835 -2.508 1.00 10.36 C ATOM 1641 C THR A 175 26.862 81.255 -1.113 1.00 10.31 C ATOM 1642 O THR A 175 25.785 81.271 -0.502 1.00 11.50 O ATOM 1643 CB THR A 175 26.616 80.789 -3.587 1.00 10.80 C ATOM 1644 OG1 THR A 175 27.489 79.673 -3.524 1.00 11.08 O ATOM 1645 CG2 THR A 175 26.756 81.403 -4.971 1.00 12.13 C ATOM 1646 HG1 THR A 175 27.408 79.242 -2.637 1.00 0.00 H ATOM 1647 H THR A 175 28.999 81.927 -3.232 1.00 0.00 H ATOM 1648 N LEU A 176 27.986 80.792 -0.556 1.00 10.28 N ATOM 1649 CA LEU A 176 27.983 80.400 0.867 1.00 10.48 C ATOM 1650 C LEU A 176 27.621 81.602 1.720 1.00 9.67 C ATOM 1651 O LEU A 176 26.826 81.499 2.653 1.00 12.03 O ATOM 1652 CB LEU A 176 29.331 79.870 1.326 1.00 10.51 C ATOM 1653 CG LEU A 176 29.730 78.471 0.867 1.00 9.71 C ATOM 1654 CD1 LEU A 176 31.036 78.051 1.564 1.00 11.64 C ATOM 1655 CD2 LEU A 176 28.661 77.410 1.083 1.00 11.51 C ATOM 1656 H LEU A 176 28.855 80.709 -1.121 1.00 0.00 H ATOM 1657 N ALA A 177 28.239 82.749 1.433 1.00 11.02 N ATOM 1658 CA ALA A 177 27.973 83.953 2.208 1.00 12.08 C ATOM 1659 C ALA A 177 26.511 84.329 2.154 1.00 11.57 C ATOM 1660 O ALA A 177 25.908 84.673 3.166 1.00 12.47 O ATOM 1661 CB ALA A 177 28.817 85.093 1.698 1.00 12.59 C ATOM 1662 H ALA A 177 28.919 82.784 0.647 1.00 0.00 H ATOM 1663 N ALA A 178 25.928 84.256 0.965 1.00 11.70 N ATOM 1664 CA ALA A 178 24.505 84.613 0.805 1.00 13.23 C ATOM 1665 C ALA A 178 23.625 83.677 1.621 1.00 12.55 C ATOM 1666 O ALA A 178 22.705 84.133 2.306 1.00 13.47 O ATOM 1667 CB ALA A 178 24.092 84.584 -0.652 1.00 15.05 C ATOM 1668 H ALA A 178 26.478 83.945 0.139 1.00 0.00 H ATOM 1669 N MET A 179 23.896 82.379 1.568 1.00 11.66 N ATOM 1670 CA MET A 179 23.076 81.438 2.323 1.00 11.55 C ATOM 1671 C MET A 179 23.285 81.560 3.825 1.00 10.56 C ATOM 1672 O MET A 179 22.333 81.447 4.593 1.00 11.33 O ATOM 1673 CB MET A 179 23.347 80.009 1.847 1.00 11.41 C ATOM 1674 CG MET A 179 22.545 78.916 2.586 1.00 10.95 C ATOM 1675 SD MET A 179 20.776 79.176 2.466 1.00 11.58 S ATOM 1676 CE MET A 179 20.257 77.541 2.846 1.00 12.37 C ATOM 1677 H MET A 179 24.689 82.034 0.991 1.00 0.00 H ATOM 1678 N LEU A 180 24.514 81.820 4.250 1.00 10.13 N ATOM 1679 CA LEU A 180 24.824 81.947 5.680 1.00 10.47 C ATOM 1680 C LEU A 180 23.955 83.045 6.289 1.00 11.71 C ATOM 1681 O LEU A 180 23.301 82.864 7.320 1.00 12.55 O ATOM 1682 CB LEU A 180 26.299 82.269 5.888 1.00 10.67 C ATOM 1683 CG LEU A 180 26.763 82.387 7.344 1.00 12.12 C ATOM 1684 CD1 LEU A 180 26.428 81.158 8.118 1.00 13.98 C ATOM 1685 CD2 LEU A 180 28.262 82.673 7.437 1.00 13.47 C ATOM 1686 H LEU A 180 25.277 81.937 3.553 1.00 0.00 H ATOM 1687 N GLU A 181 23.897 84.190 5.619 1.00 12.33 N ATOM 1688 CA GLU A 181 23.074 85.293 6.091 1.00 13.38 C ATOM 1689 C GLU A 181 21.583 84.928 6.032 1.00 13.73 C ATOM 1690 O GLU A 181 20.813 85.204 6.966 1.00 15.64 O ATOM 1691 CB GLU A 181 23.366 86.549 5.255 1.00 20.13 C ATOM 1692 CG GLU A 181 22.549 87.793 5.625 1.00 28.55 C ATOM 1693 CD GLU A 181 23.340 89.080 5.546 1.00 39.88 C ATOM 1694 OE1 GLU A 181 24.296 89.152 4.747 1.00 39.57 O ATOM 1695 OE2 GLU A 181 22.933 90.067 6.213 1.00 48.62 O ATOM 1696 H GLU A 181 24.448 84.300 4.744 1.00 0.00 H ATOM 1697 N ALA A 182 21.154 84.368 4.907 1.00 12.43 N ATOM 1698 CA ALA A 182 19.722 84.143 4.678 1.00 14.07 C ATOM 1699 C ALA A 182 19.102 83.204 5.700 1.00 12.11 C ATOM 1700 O ALA A 182 17.946 83.402 6.103 1.00 14.07 O ATOM 1701 CB ALA A 182 19.486 83.606 3.284 1.00 16.18 C ATOM 1702 H ALA A 182 21.841 84.085 4.179 1.00 0.00 H ATOM 1703 N THR A 183 19.854 82.195 6.156 1.00 12.80 N ATOM 1704 CA THR A 183 19.317 81.199 7.086 1.00 11.87 C ATOM 1705 C THR A 183 20.049 81.227 8.410 1.00 12.40 C ATOM 1706 O THR A 183 20.000 80.273 9.180 1.00 12.47 O ATOM 1707 CB THR A 183 19.353 79.768 6.498 1.00 11.84 C ATOM 1708 OG1 THR A 183 20.658 79.469 5.976 1.00 11.53 O ATOM 1709 CG2 THR A 183 18.325 79.625 5.404 1.00 12.85 C ATOM 1710 HG1 THR A 183 21.326 79.535 6.704 1.00 0.00 H ATOM 1711 H THR A 183 20.843 82.116 5.843 1.00 0.00 H ATOM 1712 N SER A 184 20.670 82.356 8.715 1.00 12.22 N ATOM 1713 CA SER A 184 21.353 82.549 9.979 1.00 12.50 C ATOM 1714 C SER A 184 20.474 82.167 11.158 1.00 12.54 C ATOM 1715 O SER A 184 19.276 82.490 11.184 1.00 13.50 O ATOM 1716 CB SER A 184 21.757 84.015 10.114 1.00 13.94 C ATOM 1717 OG SER A 184 22.263 84.302 11.394 1.00 15.39 O ATOM 1718 HG SER A 184 23.061 83.742 11.565 1.00 0.00 H ATOM 1719 H SER A 184 20.668 83.132 8.023 1.00 0.00 H ATOM 1720 N LEU A 185 21.064 81.543 12.164 1.00 11.88 N ATOM 1721 CA LEU A 185 20.319 81.277 13.389 1.00 12.61 C ATOM 1722 C LEU A 185 19.728 82.573 13.947 1.00 12.59 C ATOM 1723 O LEU A 185 18.701 82.553 14.619 1.00 14.36 O ATOM 1724 CB LEU A 185 21.203 80.595 14.411 1.00 12.18 C ATOM 1725 CG LEU A 185 20.536 80.146 15.712 1.00 13.12 C ATOM 1726 CD1 LEU A 185 19.502 79.080 15.479 1.00 14.09 C ATOM 1727 CD2 LEU A 185 21.576 79.690 16.721 1.00 14.06 C ATOM 1728 H LEU A 185 22.056 81.243 12.082 1.00 0.00 H ATOM 1729 N ALA A 186 20.315 83.711 13.665 1.00 14.46 N ATOM 1730 CA ALA A 186 19.760 84.977 14.165 1.00 15.67 C ATOM 1731 C ALA A 186 18.345 85.288 13.692 1.00 16.76 C ATOM 1732 O ALA A 186 17.635 86.038 14.370 1.00 18.18 O ATOM 1733 CB ALA A 186 20.664 86.133 13.779 1.00 16.48 C ATOM 1734 H ALA A 186 21.178 83.718 13.084 1.00 0.00 H ATOM 1735 N VAL A 187 17.937 84.756 12.545 1.00 14.87 N ATOM 1736 CA VAL A 187 16.618 85.030 11.985 1.00 15.21 C ATOM 1737 C VAL A 187 15.636 83.884 12.206 1.00 13.22 C ATOM 1738 O VAL A 187 14.494 83.965 11.789 1.00 15.10 O ATOM 1739 CB VAL A 187 16.657 85.366 10.469 1.00 17.99 C ATOM 1740 CG1 VAL A 187 17.565 86.550 10.237 1.00 22.00 C ATOM 1741 CG2 VAL A 187 17.011 84.166 9.580 1.00 19.02 C ATOM 1742 H VAL A 187 18.580 84.122 12.029 1.00 0.00 H ATOM 1743 N GLN A 188 16.069 82.820 12.879 1.00 14.00 N ATOM 1744 CA GLN A 188 15.217 81.653 13.076 1.00 13.15 C ATOM 1745 C GLN A 188 14.328 81.822 14.310 1.00 13.01 C ATOM 1746 O GLN A 188 14.801 82.219 15.365 1.00 14.61 O ATOM 1747 CB GLN A 188 16.064 80.389 13.241 1.00 12.17 C ATOM 1748 CG GLN A 188 15.257 79.120 13.342 1.00 13.08 C ATOM 1749 CD GLN A 188 16.158 77.947 13.649 1.00 12.36 C ATOM 1750 OE1 GLN A 188 17.092 77.682 12.904 1.00 12.48 O ATOM 1751 NE2 GLN A 188 15.903 77.254 14.748 1.00 14.09 N ATOM 1752 HE22 GLN A 188 15.098 77.515 15.352 1.00 0.00 H ATOM 1753 HE21 GLN A 188 16.508 76.449 15.007 1.00 0.00 H ATOM 1754 H GLN A 188 17.032 82.821 13.271 1.00 0.00 H ATOM 1755 N PRO A 189 13.037 81.482 14.193 1.00 14.18 N ATOM 1756 CA PRO A 189 12.196 81.460 15.395 1.00 15.11 C ATOM 1757 C PRO A 189 12.674 80.438 16.427 1.00 14.51 C ATOM 1758 O PRO A 189 13.366 79.469 16.065 1.00 15.52 O ATOM 1759 CB PRO A 189 10.814 81.044 14.855 1.00 17.76 C ATOM 1760 CG PRO A 189 10.876 81.165 13.407 1.00 19.61 C ATOM 1761 CD PRO A 189 12.299 81.110 12.980 1.00 15.78 C ATOM 1762 N ASP A 190 12.252 80.610 17.671 1.00 15.61 N ATOM 1763 CA ASP A 190 12.406 79.578 18.704 1.00 15.96 C ATOM 1764 C ASP A 190 11.358 78.504 18.463 1.00 14.95 C ATOM 1765 O ASP A 190 10.168 78.739 18.704 1.00 16.09 O ATOM 1766 CB ASP A 190 12.242 80.178 20.098 1.00 16.97 C ATOM 1767 CG ASP A 190 12.408 79.161 21.223 1.00 19.57 C ATOM 1768 OD1 ASP A 190 12.472 77.956 20.967 1.00 18.94 O ATOM 1769 OD2 ASP A 190 12.430 79.582 22.409 1.00 22.87 O ATOM 1770 H ASP A 190 11.795 81.509 17.925 1.00 0.00 H ATOM 1771 N LEU A 191 11.785 77.336 17.983 1.00 14.93 N ATOM 1772 CA LEU A 191 10.868 76.260 17.589 1.00 14.78 C ATOM 1773 C LEU A 191 10.503 75.283 18.720 1.00 15.47 C ATOM 1774 O LEU A 191 9.787 74.306 18.493 1.00 16.63 O ATOM 1775 CB LEU A 191 11.481 75.475 16.421 1.00 14.34 C ATOM 1776 CG LEU A 191 11.656 76.252 15.128 1.00 14.46 C ATOM 1777 CD1 LEU A 191 12.403 75.389 14.135 1.00 15.33 C ATOM 1778 CD2 LEU A 191 10.320 76.699 14.536 1.00 15.08 C ATOM 1779 H LEU A 191 12.809 77.181 17.884 1.00 0.00 H ATOM 1780 N ARG A 192 10.957 75.539 19.935 1.00 17.07 N ATOM 1781 CA ARG A 192 10.730 74.561 21.007 1.00 17.54 C ATOM 1782 C ARG A 192 9.248 74.271 21.233 1.00 18.88 C ATOM 1783 O ARG A 192 8.853 73.105 21.331 1.00 21.29 O ATOM 1784 CB ARG A 192 11.366 75.061 22.301 1.00 18.72 C ATOM 1785 CG ARG A 192 12.898 74.959 22.308 1.00 20.02 C ATOM 1786 CD ARG A 192 13.414 75.699 23.516 1.00 21.22 C ATOM 1787 NE ARG A 192 14.871 75.742 23.588 1.00 23.16 N ATOM 1788 CZ ARG A 192 15.632 76.517 22.825 1.00 22.25 C ATOM 1789 NH1 ARG A 192 15.069 77.304 21.910 1.00 21.68 N ATOM 1790 NH2 ARG A 192 16.947 76.517 22.993 1.00 24.94 N ATOM 1791 HE ARG A 192 15.343 75.127 24.281 1.00 0.00 H ATOM 1792 HH12 ARG A 192 15.663 77.912 21.311 1.00 0.00 H ATOM 1793 HH11 ARG A 192 14.035 77.310 21.795 1.00 0.00 H ATOM 1794 HH22 ARG A 192 17.547 77.123 22.398 1.00 0.00 H ATOM 1795 HH21 ARG A 192 17.378 75.911 23.720 1.00 0.00 H ATOM 1796 H ARG A 192 11.469 76.423 20.130 1.00 0.00 H ATOM 1797 N ALA A 193 8.411 75.303 21.233 1.00 17.96 N ATOM 1798 CA ALA A 193 6.990 75.063 21.503 1.00 20.53 C ATOM 1799 C ALA A 193 6.366 74.315 20.343 1.00 19.05 C ATOM 1800 O ALA A 193 5.569 73.386 20.532 1.00 21.88 O ATOM 1801 CB ALA A 193 6.258 76.369 21.756 1.00 20.46 C ATOM 1802 H ALA A 193 8.758 76.265 21.045 1.00 0.00 H ATOM 1803 N ASN A 194 6.725 74.707 19.128 1.00 16.33 N ATOM 1804 CA ASN A 194 6.170 74.043 17.974 1.00 18.10 C ATOM 1805 C ASN A 194 6.583 72.566 17.918 1.00 18.94 C ATOM 1806 O ASN A 194 5.745 71.683 17.670 1.00 20.40 O ATOM 1807 CB ASN A 194 6.576 74.762 16.701 1.00 18.03 C ATOM 1808 CG ASN A 194 5.545 74.632 15.645 1.00 22.33 C ATOM 1809 OD1 ASN A 194 5.355 73.543 15.093 1.00 27.19 O ATOM 1810 ND2 ASN A 194 4.848 75.713 15.360 1.00 22.95 N ATOM 1811 HD22 ASN A 194 5.048 76.606 15.854 1.00 0.00 H ATOM 1812 HD21 ASN A 194 4.098 75.673 14.641 1.00 0.00 H ATOM 1813 H ASN A 194 7.402 75.488 19.008 1.00 0.00 H ATOM 1814 N LEU A 195 7.860 72.284 18.166 1.00 19.93 N ATOM 1815 CA LEU A 195 8.331 70.910 18.201 1.00 21.36 C ATOM 1816 C LEU A 195 7.640 70.081 19.279 1.00 25.75 C ATOM 1817 O LEU A 195 7.386 68.898 19.070 1.00 29.13 O ATOM 1818 CB LEU A 195 9.852 70.892 18.418 1.00 22.41 C ATOM 1819 CG LEU A 195 10.649 71.437 17.238 1.00 21.95 C ATOM 1820 CD1 LEU A 195 12.089 71.713 17.641 1.00 22.17 C ATOM 1821 CD2 LEU A 195 10.607 70.461 16.046 1.00 23.78 C ATOM 1822 H LEU A 195 8.531 73.060 18.337 1.00 0.00 H ATOM 1823 N SER A 196 7.330 70.682 20.420 1.00 26.67 N ATOM 1824 CA SER A 196 6.599 69.966 21.466 1.00 32.09 C ATOM 1825 C SER A 196 5.230 69.493 21.000 1.00 32.41 C ATOM 1826 O SER A 196 4.739 68.449 21.449 1.00 36.75 O ATOM 1827 CB SER A 196 6.422 70.853 22.696 1.00 37.28 C ATOM 1828 OG SER A 196 7.675 71.137 23.281 1.00 43.22 O ATOM 1829 HG SER A 196 8.246 71.607 22.623 1.00 0.00 H ATOM 1830 H SER A 196 7.609 71.672 20.573 1.00 0.00 H ATOM 1831 N ALA A 197 4.593 70.273 20.138 1.00 29.76 N ATOM 1832 CA ALA A 197 3.217 69.995 19.719 1.00 31.63 C ATOM 1833 C ALA A 197 3.133 69.266 18.388 1.00 38.94 C ATOM 1834 O ALA A 197 2.073 69.171 17.770 1.00 44.42 O ATOM 1835 CB ALA A 197 2.453 71.275 19.636 1.00 33.51 C ATOM 1836 H ALA A 197 5.083 71.104 19.749 1.00 0.00 H ATOM 1837 N ARG A 198 4.257 68.731 17.962 1.00 40.21 N ATOM 1838 CA ARG A 198 4.387 68.200 16.622 1.00 42.75 C ATOM 1839 C ARG A 198 3.442 67.055 16.314 1.00 39.96 C ATOM 1840 O ARG A 198 3.180 66.200 17.170 1.00 37.72 O ATOM 1841 CB ARG A 198 5.817 67.729 16.426 1.00 44.80 C ATOM 1842 CG ARG A 198 6.143 66.544 17.308 1.00 47.32 C ATOM 1843 CD ARG A 198 7.589 66.195 17.254 1.00 48.99 C ATOM 1844 NE ARG A 198 7.884 65.038 18.098 1.00 51.39 N ATOM 1845 CZ ARG A 198 8.321 65.098 19.352 1.00 53.26 C ATOM 1846 NH1 ARG A 198 8.513 66.270 19.954 1.00 52.36 N ATOM 1847 NH2 ARG A 198 8.569 63.973 20.011 1.00 56.28 N ATOM 1848 HE ARG A 198 7.741 64.094 17.685 1.00 0.00 H ATOM 1849 HH12 ARG A 198 8.855 66.300 20.936 1.00 0.00 H ATOM 1850 HH11 ARG A 198 8.321 67.155 19.443 1.00 0.00 H ATOM 1851 HH22 ARG A 198 8.911 64.010 20.992 1.00 0.00 H ATOM 1852 HH21 ARG A 198 8.421 63.055 19.546 1.00 0.00 H ATOM 1853 H ARG A 198 5.073 68.689 18.605 1.00 0.00 H ATOM 1854 N THR A 199 2.992 67.024 15.061 1.00 43.53 N ATOM 1855 CA THR A 199 2.221 65.916 14.521 1.00 47.88 C ATOM 1856 C THR A 199 3.165 64.841 13.995 1.00 47.57 C ATOM 1857 O THR A 199 2.809 63.662 13.900 1.00 52.21 O ATOM 1858 CB THR A 199 1.308 66.375 13.360 1.00 51.31 C ATOM 1859 OG1 THR A 199 2.096 67.025 12.353 1.00 53.23 O ATOM 1860 CG2 THR A 199 0.221 67.323 13.855 1.00 52.16 C ATOM 1861 HG1 THR A 199 2.548 67.813 12.747 1.00 0.00 H ATOM 1862 H THR A 199 3.202 67.831 14.439 1.00 0.00 H ATOM 1863 N PHE A 200 4.391 65.256 13.684 1.00 39.57 N ATOM 1864 CA PHE A 200 5.345 64.378 13.054 1.00 34.77 C ATOM 1865 C PHE A 200 6.252 63.778 14.118 1.00 30.39 C ATOM 1866 O PHE A 200 6.432 64.353 15.182 1.00 30.37 O ATOM 1867 CB PHE A 200 6.155 65.140 11.994 1.00 34.11 C ATOM 1868 CG PHE A 200 6.781 66.428 12.495 1.00 34.52 C ATOM 1869 CD1 PHE A 200 8.018 66.418 13.124 1.00 33.50 C ATOM 1870 CD2 PHE A 200 6.140 67.648 12.321 1.00 35.69 C ATOM 1871 CE1 PHE A 200 8.600 67.597 13.581 1.00 33.54 C ATOM 1872 CE2 PHE A 200 6.718 68.832 12.784 1.00 35.34 C ATOM 1873 CZ PHE A 200 7.956 68.800 13.407 1.00 33.58 C ATOM 1874 H PHE A 200 4.667 66.235 13.900 1.00 0.00 H ATOM 1875 N ALA A 201 6.792 62.605 13.831 1.00 27.81 N ATOM 1876 CA ALA A 201 7.774 61.996 14.694 1.00 24.89 C ATOM 1877 C ALA A 201 9.054 62.867 14.663 1.00 21.08 C ATOM 1878 O ALA A 201 9.402 63.431 13.628 1.00 21.19 O ATOM 1879 CB ALA A 201 8.067 60.579 14.248 1.00 27.09 C ATOM 1880 H ALA A 201 6.502 62.111 12.963 1.00 0.00 H ATOM 1881 N PHE A 202 9.726 63.014 15.800 1.00 22.21 N ATOM 1882 CA PHE A 202 10.897 63.877 15.912 1.00 20.81 C ATOM 1883 C PHE A 202 11.921 63.198 16.778 1.00 20.40 C ATOM 1884 O PHE A 202 11.627 62.813 17.911 1.00 22.55 O ATOM 1885 CB PHE A 202 10.516 65.246 16.487 1.00 21.59 C ATOM 1886 CG PHE A 202 11.670 66.200 16.673 1.00 21.76 C ATOM 1887 CD1 PHE A 202 12.582 66.471 15.679 1.00 22.13 C ATOM 1888 CD2 PHE A 202 11.802 66.875 17.851 1.00 21.99 C ATOM 1889 CE1 PHE A 202 13.598 67.376 15.882 1.00 22.39 C ATOM 1890 CE2 PHE A 202 12.844 67.768 18.061 1.00 22.71 C ATOM 1891 CZ PHE A 202 13.735 68.011 17.081 1.00 22.78 C ATOM 1892 H PHE A 202 9.405 62.494 16.642 1.00 0.00 H ATOM 1893 N TYR A 203 13.113 63.037 16.204 1.00 19.26 N ATOM 1894 CA TYR A 203 14.250 62.413 16.871 1.00 18.45 C ATOM 1895 C TYR A 203 15.476 63.273 16.754 1.00 16.64 C ATOM 1896 O TYR A 203 15.681 63.946 15.751 1.00 16.39 O ATOM 1897 CB TYR A 203 14.533 61.038 16.276 1.00 20.29 C ATOM 1898 CG TYR A 203 13.340 60.113 16.334 1.00 22.18 C ATOM 1899 CD1 TYR A 203 12.364 60.173 15.353 1.00 24.53 C ATOM 1900 CD2 TYR A 203 13.179 59.186 17.366 1.00 24.19 C ATOM 1901 CE1 TYR A 203 11.270 59.345 15.377 1.00 26.74 C ATOM 1902 CE2 TYR A 203 12.084 58.341 17.391 1.00 28.75 C ATOM 1903 CZ TYR A 203 11.127 58.432 16.389 1.00 29.00 C ATOM 1904 OH TYR A 203 10.013 57.611 16.389 1.00 32.42 O ATOM 1905 HH TYR A 203 9.450 57.821 15.602 1.00 0.00 H ATOM 1906 H TYR A 203 13.239 63.374 15.228 1.00 0.00 H ATOM 1907 N TYR A 204 16.313 63.214 17.773 1.00 17.12 N ATOM 1908 CA TYR A 204 17.519 64.028 17.835 1.00 17.43 C ATOM 1909 C TYR A 204 18.741 63.126 17.962 1.00 18.59 C ATOM 1910 O TYR A 204 18.727 62.142 18.724 1.00 21.60 O ATOM 1911 CB TYR A 204 17.432 65.019 19.008 1.00 17.41 C ATOM 1912 CG TYR A 204 18.259 66.255 18.804 1.00 17.39 C ATOM 1913 CD1 TYR A 204 19.613 66.279 19.135 1.00 19.77 C ATOM 1914 CD2 TYR A 204 17.688 67.407 18.279 1.00 17.61 C ATOM 1915 CE1 TYR A 204 20.358 67.405 18.943 1.00 20.31 C ATOM 1916 CE2 TYR A 204 18.420 68.534 18.094 1.00 17.53 C ATOM 1917 CZ TYR A 204 19.755 68.522 18.428 1.00 17.26 C ATOM 1918 OH TYR A 204 20.484 69.659 18.258 1.00 18.52 O ATOM 1919 HH TYR A 204 20.467 69.921 17.303 1.00 0.00 H ATOM 1920 H TYR A 204 16.104 62.564 18.558 1.00 0.00 H ATOM 1921 N LEU A 205 19.774 63.443 17.191 1.00 16.85 N ATOM 1922 CA LEU A 205 21.069 62.778 17.280 1.00 16.39 C ATOM 1923 C LEU A 205 22.102 63.780 17.718 1.00 16.24 C ATOM 1924 O LEU A 205 22.098 64.904 17.244 1.00 16.14 O ATOM 1925 CB LEU A 205 21.515 62.215 15.938 1.00 18.02 C ATOM 1926 CG LEU A 205 20.543 61.353 15.115 1.00 21.35 C ATOM 1927 CD1 LEU A 205 21.199 60.859 13.846 1.00 24.65 C ATOM 1928 CD2 LEU A 205 19.985 60.200 15.927 1.00 24.55 C ATOM 1929 H LEU A 205 19.654 64.202 16.490 1.00 0.00 H ATOM 1930 N CYS A 206 23.025 63.359 18.567 1.00 15.74 N ATOM 1931 CA CYS A 206 24.054 64.249 19.031 1.00 18.07 C ATOM 1932 C CYS A 206 25.326 63.460 19.294 1.00 15.30 C ATOM 1933 O CYS A 206 25.261 62.412 19.907 1.00 16.55 O ATOM 1934 CB CYS A 206 23.611 64.967 20.317 1.00 27.04 C ATOM 1935 SG CYS A 206 24.700 66.301 20.755 1.00 30.67 S ATOM 1936 H CYS A 206 23.006 62.375 18.902 1.00 0.00 H ATOM 1937 N GLY A 207 26.479 63.972 18.859 1.00 14.15 N ATOM 1938 CA GLY A 207 27.731 63.343 19.231 1.00 14.34 C ATOM 1939 C GLY A 207 28.000 63.400 20.730 1.00 15.80 C ATOM 1940 O GLY A 207 27.721 64.398 21.380 1.00 15.17 O ATOM 1941 H GLY A 207 26.479 64.819 18.255 1.00 0.00 H ATOM 1942 N GLU A 208 28.574 62.328 21.272 1.00 16.05 N ATOM 1943 CA GLU A 208 28.925 62.279 22.679 1.00 17.13 C ATOM 1944 C GLU A 208 29.769 63.477 23.107 1.00 17.04 C ATOM 1945 O GLU A 208 29.611 64.009 24.226 1.00 20.52 O ATOM 1946 CB GLU A 208 29.682 60.984 22.986 1.00 17.87 C ATOM 1947 CG GLU A 208 30.007 60.795 24.450 1.00 23.90 C ATOM 1948 CD GLU A 208 30.828 59.553 24.713 1.00 27.83 C ATOM 1949 OE1 GLU A 208 31.344 58.897 23.771 1.00 28.27 O ATOM 1950 OE2 GLU A 208 30.982 59.216 25.904 1.00 34.45 O ATOM 1951 H GLU A 208 28.776 61.504 20.671 1.00 0.00 H ATOM 1952 N ARG A 209 30.668 63.896 22.225 1.00 15.53 N ATOM 1953 CA ARG A 209 31.625 64.956 22.532 1.00 18.47 C ATOM 1954 C ARG A 209 31.142 66.355 22.155 1.00 21.27 C ATOM 1955 O ARG A 209 31.934 67.304 22.174 1.00 28.50 O ATOM 1956 CB ARG A 209 32.967 64.706 21.843 1.00 20.95 C ATOM 1957 CG ARG A 209 33.578 63.375 22.177 1.00 26.06 C ATOM 1958 CD ARG A 209 35.042 63.281 21.745 1.00 35.72 C ATOM 1959 NE ARG A 209 35.276 62.930 20.348 1.00 41.79 N ATOM 1960 CZ ARG A 209 35.837 61.790 19.923 1.00 42.02 C ATOM 1961 NH1 ARG A 209 36.009 61.597 18.625 1.00 37.57 N ATOM 1962 NH2 ARG A 209 36.231 60.840 20.767 1.00 41.82 N ATOM 1963 HE ARG A 209 34.984 63.619 19.626 1.00 0.00 H ATOM 1964 HH12 ARG A 209 36.443 60.716 18.283 1.00 0.00 H ATOM 1965 HH11 ARG A 209 35.710 62.326 17.947 1.00 0.00 H ATOM 1966 HH22 ARG A 209 36.663 59.967 20.402 1.00 0.00 H ATOM 1967 HH21 ARG A 209 36.107 60.970 21.791 1.00 0.00 H ATOM 1968 H ARG A 209 30.692 63.455 21.284 1.00 0.00 H ATOM 1969 N ASP A 210 29.867 66.491 21.794 1.00 17.39 N ATOM 1970 CA ASP A 210 29.287 67.765 21.392 1.00 18.08 C ATOM 1971 C ASP A 210 28.535 68.347 22.561 1.00 20.83 C ATOM 1972 O ASP A 210 27.324 68.139 22.681 1.00 18.76 O ATOM 1973 CB ASP A 210 28.364 67.546 20.185 1.00 15.64 C ATOM 1974 CG ASP A 210 27.797 68.822 19.634 1.00 13.72 C ATOM 1975 OD1 ASP A 210 28.016 69.910 20.223 1.00 16.30 O ATOM 1976 OD2 ASP A 210 27.075 68.731 18.614 1.00 13.09 O ATOM 1977 H ASP A 210 29.257 65.648 21.799 1.00 0.00 H ATOM 1978 N SER A 211 29.242 69.049 23.452 1.00 19.99 N ATOM 1979 CA SER A 211 28.614 69.481 24.691 1.00 20.82 C ATOM 1980 C SER A 211 27.466 70.460 24.473 1.00 20.84 C ATOM 1981 O SER A 211 26.452 70.378 25.168 1.00 23.47 O ATOM 1982 CB SER A 211 29.657 70.102 25.652 1.00 22.74 C ATOM 1983 OG SER A 211 30.412 71.134 25.006 1.00 23.08 O ATOM 1984 HG SER A 211 30.889 70.754 24.226 1.00 0.00 H ATOM 1985 H SER A 211 30.237 69.285 23.260 1.00 0.00 H ATOM 1986 N LYS A 212 27.620 71.385 23.534 1.00 20.24 N ATOM 1987 CA LYS A 212 26.599 72.387 23.294 1.00 20.42 C ATOM 1988 C LYS A 212 25.278 71.707 22.916 1.00 21.52 C ATOM 1989 O LYS A 212 24.198 72.035 23.437 1.00 21.79 O ATOM 1990 CB LYS A 212 27.054 73.344 22.193 1.00 23.72 C ATOM 1991 H LYS A 212 28.488 71.392 22.960 1.00 0.00 H ATOM 1992 N PHE A 213 25.343 70.744 22.009 1.00 17.86 N ATOM 1993 CA PHE A 213 24.096 70.211 21.472 1.00 16.06 C ATOM 1994 C PHE A 213 23.550 69.080 22.314 1.00 20.24 C ATOM 1995 O PHE A 213 22.338 68.836 22.292 1.00 20.79 O ATOM 1996 CB PHE A 213 24.270 69.846 20.005 1.00 15.44 C ATOM 1997 CG PHE A 213 24.271 71.067 19.159 1.00 13.66 C ATOM 1998 CD1 PHE A 213 25.452 71.761 18.948 1.00 14.86 C ATOM 1999 CD2 PHE A 213 23.072 71.590 18.651 1.00 14.60 C ATOM 2000 CE1 PHE A 213 25.456 72.954 18.246 1.00 15.43 C ATOM 2001 CE2 PHE A 213 23.088 72.755 17.933 1.00 14.89 C ATOM 2002 CZ PHE A 213 24.285 73.458 17.764 1.00 13.96 C ATOM 2003 H PHE A 213 26.261 70.377 21.687 1.00 0.00 H ATOM 2004 N ARG A 214 24.374 68.488 23.172 1.00 21.18 N ATOM 2005 CA ARG A 214 23.811 67.583 24.151 1.00 24.99 C ATOM 2006 C ARG A 214 22.925 68.349 25.110 1.00 26.60 C ATOM 2007 O ARG A 214 21.851 67.886 25.446 1.00 28.28 O ATOM 2008 CB ARG A 214 24.904 66.832 24.886 1.00 28.19 C ATOM 2009 CG ARG A 214 25.447 65.698 24.016 1.00 30.62 C ATOM 2010 CD ARG A 214 26.382 64.851 24.741 1.00 31.06 C ATOM 2011 NE ARG A 214 25.713 64.048 25.767 1.00 32.25 N ATOM 2012 CZ ARG A 214 26.359 63.151 26.490 1.00 32.12 C ATOM 2013 NH1 ARG A 214 27.659 62.977 26.280 1.00 32.28 N ATOM 2014 NH2 ARG A 214 25.715 62.435 27.407 1.00 34.60 N ATOM 2015 HE ARG A 214 24.696 64.189 25.932 1.00 0.00 H ATOM 2016 HH12 ARG A 214 28.187 62.276 26.838 1.00 0.00 H ATOM 2017 HH11 ARG A 214 28.149 63.542 25.557 1.00 0.00 H ATOM 2018 HH22 ARG A 214 26.230 61.730 27.973 1.00 0.00 H ATOM 2019 HH21 ARG A 214 24.696 62.580 27.559 1.00 0.00 H ATOM 2020 H ARG A 214 25.397 68.670 23.141 1.00 0.00 H ATOM 2021 N ALA A 215 23.348 69.541 25.514 1.00 26.71 N ATOM 2022 CA ALA A 215 22.533 70.340 26.418 1.00 29.14 C ATOM 2023 C ALA A 215 21.228 70.763 25.722 1.00 30.32 C ATOM 2024 O ALA A 215 20.153 70.704 26.322 1.00 32.77 O ATOM 2025 CB ALA A 215 23.317 71.549 26.903 1.00 29.42 C ATOM 2026 H ALA A 215 24.264 69.905 25.184 1.00 0.00 H ATOM 2027 N LEU A 216 21.312 71.187 24.460 1.00 29.02 N ATOM 2028 CA LEU A 216 20.121 71.609 23.732 1.00 29.58 C ATOM 2029 C LEU A 216 19.108 70.482 23.557 1.00 31.50 C ATOM 2030 O LEU A 216 17.910 70.695 23.703 1.00 33.44 O ATOM 2031 CB LEU A 216 20.513 72.169 22.371 1.00 26.88 C ATOM 2032 CG LEU A 216 21.113 73.564 22.481 1.00 25.17 C ATOM 2033 CD1 LEU A 216 21.806 73.922 21.184 1.00 22.91 C ATOM 2034 CD2 LEU A 216 20.050 74.585 22.826 1.00 26.69 C ATOM 2035 H LEU A 216 22.239 71.217 23.989 1.00 0.00 H ATOM 2036 N ALA A 217 19.587 69.290 23.227 1.00 32.28 N ATOM 2037 CA ALA A 217 18.703 68.150 23.012 1.00 36.01 C ATOM 2038 C ALA A 217 17.876 67.859 24.259 1.00 38.98 C ATOM 2039 O ALA A 217 16.725 67.429 24.169 1.00 38.56 O ATOM 2040 CB ALA A 217 19.519 66.920 22.603 1.00 35.22 C ATOM 2041 H ALA A 217 20.614 69.166 23.119 1.00 0.00 H ATOM 2042 N ALA A 218 18.473 68.106 25.422 1.00 39.62 N ATOM 2043 CA ALA A 218 17.810 67.877 26.700 1.00 40.78 C ATOM 2044 C ALA A 218 16.619 68.819 26.887 1.00 42.39 C ATOM 2045 O ALA A 218 15.693 68.503 27.624 1.00 44.98 O ATOM 2046 CB ALA A 218 18.806 68.044 27.836 1.00 41.52 C ATOM 2047 H ALA A 218 19.445 68.475 25.419 1.00 0.00 H ATOM 2048 N GLU A 219 16.663 69.987 26.257 1.00 41.73 N ATOM 2049 CA GLU A 219 15.566 70.953 26.328 1.00 41.67 C ATOM 2050 C GLU A 219 14.369 70.555 25.465 1.00 42.76 C ATOM 2051 O GLU A 219 13.287 71.134 25.590 1.00 44.81 O ATOM 2052 CB GLU A 219 16.042 72.339 25.869 1.00 40.58 C ATOM 2053 CG GLU A 219 17.215 72.908 26.637 1.00 40.78 C ATOM 2054 CD GLU A 219 17.654 74.278 26.122 1.00 43.03 C ATOM 2055 OE1 GLU A 219 16.905 74.905 25.362 1.00 47.42 O ATOM 2056 OE2 GLU A 219 18.751 74.742 26.492 1.00 44.94 O ATOM 2057 H GLU A 219 17.505 70.223 25.694 1.00 0.00 H ATOM 2058 N LEU A 220 14.566 69.569 24.596 1.00 40.58 N ATOM 2059 CA LEU A 220 13.576 69.214 23.585 1.00 41.22 C ATOM 2060 C LEU A 220 12.742 67.996 23.938 1.00 47.81 C ATOM 2061 O LEU A 220 13.165 67.132 24.702 1.00 47.03 O ATOM 2062 CB LEU A 220 14.268 68.972 22.240 1.00 37.46 C ATOM 2063 CG LEU A 220 14.901 70.197 21.565 1.00 35.42 C ATOM 2064 CD1 LEU A 220 15.604 69.821 20.257 1.00 33.35 C ATOM 2065 CD2 LEU A 220 13.856 71.272 21.314 1.00 35.55 C ATOM 2066 H LEU A 220 15.456 69.032 24.638 1.00 0.00 H ATOM 2067 N ALA A 221 11.564 67.934 23.325 1.00 54.31 N ATOM 2068 CA ALA A 221 10.622 66.843 23.523 1.00 60.30 C ATOM 2069 C ALA A 221 10.873 65.713 22.529 1.00 62.69 C ATOM 2070 O ALA A 221 9.934 65.156 21.957 1.00 65.07 O ATOM 2071 CB ALA A 221 9.192 67.368 23.377 1.00 61.27 C ATOM 2072 H ALA A 221 11.304 68.701 22.673 1.00 0.00 H ATOM 2073 N ALA A 222 12.140 65.384 22.320 1.00 59.40 N ATOM 2074 CA ALA A 222 12.506 64.285 21.440 1.00 54.85 C ATOM 2075 C ALA A 222 13.331 63.224 22.135 1.00 52.13 C ATOM 2076 O ALA A 222 14.057 63.521 23.080 1.00 50.50 O ATOM 2077 CB ALA A 222 13.287 64.823 20.256 1.00 52.38 C ATOM 2078 H ALA A 222 12.890 65.924 22.796 1.00 0.00 H ATOM 2079 N ASP A 223 13.217 61.995 21.636 1.00 50.35 N ATOM 2080 CA ASP A 223 14.171 60.934 21.928 1.00 48.35 C ATOM 2081 C ASP A 223 15.530 61.378 21.392 1.00 41.22 C ATOM 2082 O ASP A 223 15.626 61.670 20.191 1.00 36.65 O ATOM 2083 CB ASP A 223 13.774 59.610 21.276 1.00 53.45 C ATOM 2084 CG ASP A 223 12.722 58.862 22.051 1.00 61.81 C ATOM 2085 OD1 ASP A 223 12.050 59.467 22.914 1.00 64.26 O ATOM 2086 OD2 ASP A 223 12.570 57.652 21.783 1.00 65.02 O ATOM 2087 H ASP A 223 12.413 61.784 21.011 1.00 0.00 H ATOM 2088 N CYS A 224 16.540 61.458 22.265 1.00 39.58 N ATOM 2089 CA CYS A 224 17.909 61.781 21.842 1.00 34.49 C ATOM 2090 C CYS A 224 18.818 60.562 21.853 1.00 31.37 C ATOM 2091 O CYS A 224 18.935 59.848 22.870 1.00 35.99 O ATOM 2092 CB CYS A 224 18.561 62.854 22.717 1.00 34.23 C ATOM 2093 SG CYS A 224 20.244 63.305 22.083 1.00 36.16 S ATOM 2094 H CYS A 224 16.350 61.286 23.273 1.00 0.00 H ATOM 2095 N HIS A 225 19.452 60.345 20.706 1.00 27.78 N ATOM 2096 CA HIS A 225 20.431 59.293 20.540 1.00 24.65 C ATOM 2097 C HIS A 225 21.827 59.904 20.586 1.00 21.78 C ATOM 2098 O HIS A 225 22.195 60.697 19.708 1.00 20.82 O ATOM 2099 CB HIS A 225 20.200 58.575 19.223 1.00 26.60 C ATOM 2100 CG HIS A 225 18.879 57.882 19.163 1.00 30.61 C ATOM 2101 ND1 HIS A 225 18.762 56.516 19.034 1.00 34.47 N ATOM 2102 CD2 HIS A 225 17.616 58.365 19.225 1.00 32.21 C ATOM 2103 CE1 HIS A 225 17.484 56.185 19.026 1.00 35.17 C ATOM 2104 NE2 HIS A 225 16.767 57.288 19.149 1.00 32.92 N ATOM 2105 H HIS A 225 19.235 60.957 19.893 1.00 0.00 H ATOM 2106 N VAL A 226 22.597 59.558 21.619 1.00 21.35 N ATOM 2107 CA VAL A 226 23.968 60.034 21.755 1.00 20.97 C ATOM 2108 C VAL A 226 24.916 59.076 21.050 1.00 20.10 C ATOM 2109 O VAL A 226 24.970 57.879 21.348 1.00 24.62 O ATOM 2110 CB VAL A 226 24.376 60.196 23.235 1.00 21.75 C ATOM 2111 CG1 VAL A 226 25.843 60.627 23.351 1.00 22.33 C ATOM 2112 CG2 VAL A 226 23.478 61.208 23.895 1.00 24.05 C ATOM 2113 H VAL A 226 22.207 58.929 22.350 1.00 0.00 H ATOM 2114 N ILE A 227 25.643 59.607 20.088 1.00 18.47 N ATOM 2115 CA ILE A 227 26.538 58.815 19.250 1.00 17.64 C ATOM 2116 C ILE A 227 27.931 58.720 19.881 1.00 17.65 C ATOM 2117 O ILE A 227 28.613 59.720 20.044 1.00 16.70 O ATOM 2118 CB ILE A 227 26.668 59.406 17.840 1.00 16.31 C ATOM 2119 CG1 ILE A 227 25.285 59.717 17.234 1.00 17.19 C ATOM 2120 CG2 ILE A 227 27.487 58.443 16.963 1.00 17.16 C ATOM 2121 CD1 ILE A 227 24.383 58.513 17.055 1.00 18.31 C ATOM 2122 H ILE A 227 25.577 60.631 19.919 1.00 0.00 H ATOM 2123 N PRO A 228 28.369 57.509 20.242 1.00 18.46 N ATOM 2124 CA PRO A 228 29.649 57.390 20.955 1.00 19.05 C ATOM 2125 C PRO A 228 30.841 57.936 20.195 1.00 17.12 C ATOM 2126 O PRO A 228 30.901 57.835 18.968 1.00 18.53 O ATOM 2127 CB PRO A 228 29.802 55.875 21.125 1.00 21.01 C ATOM 2128 CG PRO A 228 28.442 55.313 21.016 1.00 22.44 C ATOM 2129 CD PRO A 228 27.721 56.201 20.067 1.00 19.13 C ATOM 2130 N ARG A 229 31.774 58.527 20.921 1.00 20.06 N ATOM 2131 CA ARG A 229 33.093 58.850 20.380 1.00 26.37 C ATOM 2132 C ARG A 229 32.998 59.728 19.154 1.00 27.44 C ATOM 2133 O ARG A 229 33.763 59.568 18.188 1.00 35.50 O ATOM 2134 CB ARG A 229 33.841 57.579 19.976 1.00 32.07 C ATOM 2135 CG ARG A 229 34.082 56.561 21.077 1.00 37.16 C ATOM 2136 CD ARG A 229 34.715 55.290 20.477 1.00 43.00 C ATOM 2137 NE ARG A 229 33.710 54.311 20.046 1.00 50.77 N ATOM 2138 CZ ARG A 229 33.351 54.090 18.781 1.00 57.47 C ATOM 2139 NH1 ARG A 229 33.888 54.788 17.782 1.00 60.57 N ATOM 2140 NH2 ARG A 229 32.418 53.184 18.512 1.00 59.47 N ATOM 2141 HE ARG A 229 33.242 53.747 20.784 1.00 0.00 H ATOM 2142 HH12 ARG A 229 33.596 54.602 16.801 1.00 0.00 H ATOM 2143 HH11 ARG A 229 34.600 55.519 17.982 1.00 0.00 H ATOM 2144 HH22 ARG A 229 32.134 53.007 17.527 1.00 0.00 H ATOM 2145 HH21 ARG A 229 31.972 52.652 19.286 1.00 0.00 H ATOM 2146 H ARG A 229 31.563 58.770 21.910 1.00 0.00 H ATOM 2147 N ALA A 230 32.066 60.660 19.186 1.00 17.41 N ATOM 2148 CA ALA A 230 31.885 61.544 18.062 1.00 13.95 C ATOM 2149 C ALA A 230 31.618 62.958 18.481 1.00 13.95 C ATOM 2150 O ALA A 230 30.962 63.199 19.489 1.00 14.36 O ATOM 2151 CB ALA A 230 30.756 61.045 17.223 1.00 15.09 C ATOM 2152 H ALA A 230 31.459 60.758 20.025 1.00 0.00 H ATOM 2153 N GLY A 231 32.115 63.891 17.689 1.00 13.35 N ATOM 2154 CA GLY A 231 31.834 65.306 17.865 1.00 14.44 C ATOM 2155 C GLY A 231 30.532 65.739 17.191 1.00 12.43 C ATOM 2156 O GLY A 231 29.594 64.946 16.977 1.00 12.97 O ATOM 2157 H GLY A 231 32.734 63.600 16.906 1.00 0.00 H ATOM 2158 N HIS A 232 30.470 67.010 16.825 1.00 11.65 N ATOM 2159 CA HIS A 232 29.255 67.626 16.309 1.00 10.44 C ATOM 2160 C HIS A 232 28.778 66.927 15.040 1.00 10.68 C ATOM 2161 O HIS A 232 27.584 66.603 14.893 1.00 10.81 O ATOM 2162 CB HIS A 232 29.502 69.109 16.038 1.00 11.28 C ATOM 2163 CG HIS A 232 28.293 69.857 15.558 1.00 11.04 C ATOM 2164 ND1 HIS A 232 27.199 70.109 16.356 1.00 11.15 N ATOM 2165 CD2 HIS A 232 28.021 70.441 14.370 1.00 10.84 C ATOM 2166 CE1 HIS A 232 26.303 70.804 15.682 1.00 10.48 C ATOM 2167 NE2 HIS A 232 26.774 71.018 14.463 1.00 11.31 N ATOM 2168 H HIS A 232 31.326 67.594 16.910 1.00 0.00 H ATOM 2169 N ASN A 233 29.685 66.724 14.087 1.00 10.49 N ATOM 2170 CA ASN A 233 29.362 65.952 12.895 1.00 10.56 C ATOM 2171 C ASN A 233 29.550 64.468 13.242 1.00 11.36 C ATOM 2172 O ASN A 233 30.597 63.859 12.980 1.00 12.09 O ATOM 2173 CB ASN A 233 30.212 66.371 11.697 1.00 9.87 C ATOM 2174 CG ASN A 233 29.713 65.747 10.424 1.00 11.17 C ATOM 2175 OD1 ASN A 233 29.080 64.672 10.456 1.00 11.57 O ATOM 2176 ND2 ASN A 233 29.983 66.386 9.286 1.00 10.30 N ATOM 2177 HD22 ASN A 233 30.514 67.280 9.305 1.00 0.00 H ATOM 2178 HD21 ASN A 233 29.663 65.991 8.379 1.00 0.00 H ATOM 2179 H ASN A 233 30.639 67.123 14.195 1.00 0.00 H ATOM 2180 N ALA A 234 28.543 63.895 13.893 1.00 11.78 N ATOM 2181 CA ALA A 234 28.690 62.533 14.407 1.00 12.15 C ATOM 2182 C ALA A 234 28.632 61.524 13.265 1.00 13.06 C ATOM 2183 O ALA A 234 29.310 60.487 13.327 1.00 13.89 O ATOM 2184 CB ALA A 234 27.616 62.228 15.452 1.00 13.28 C ATOM 2185 H ALA A 234 27.653 64.413 14.037 1.00 0.00 H ATOM 2186 N HIS A 235 27.826 61.781 12.237 1.00 12.76 N ATOM 2187 CA HIS A 235 27.723 60.811 11.150 1.00 12.34 C ATOM 2188 C HIS A 235 29.032 60.710 10.355 1.00 12.37 C ATOM 2189 O HIS A 235 29.347 59.659 9.794 1.00 14.44 O ATOM 2190 CB HIS A 235 26.532 61.124 10.222 1.00 13.01 C ATOM 2191 CG HIS A 235 26.731 62.336 9.383 1.00 11.47 C ATOM 2192 ND1 HIS A 235 26.195 63.568 9.705 1.00 11.57 N ATOM 2193 CD2 HIS A 235 27.451 62.512 8.249 1.00 11.44 C ATOM 2194 CE1 HIS A 235 26.593 64.451 8.812 1.00 11.04 C ATOM 2195 NE2 HIS A 235 27.357 63.837 7.919 1.00 11.45 N ATOM 2196 H HIS A 235 27.276 62.663 12.208 1.00 0.00 H ATOM 2197 N ARG A 236 29.802 61.792 10.310 1.00 12.32 N ATOM 2198 CA ARG A 236 31.086 61.748 9.628 1.00 12.66 C ATOM 2199 C ARG A 236 32.105 60.966 10.465 1.00 13.41 C ATOM 2200 O ARG A 236 32.899 60.197 9.928 1.00 14.90 O ATOM 2201 CB ARG A 236 31.596 63.173 9.338 1.00 15.31 C ATOM 2202 CG ARG A 236 32.871 63.226 8.593 1.00 15.68 C ATOM 2203 CD ARG A 236 33.183 64.626 8.152 1.00 14.33 C ATOM 2204 NE ARG A 236 34.532 64.679 7.671 1.00 14.20 N ATOM 2205 CZ ARG A 236 34.902 64.484 6.413 1.00 13.91 C ATOM 2206 NH1 ARG A 236 34.009 64.276 5.457 1.00 12.77 N ATOM 2207 NH2 ARG A 236 36.183 64.516 6.132 1.00 15.96 N ATOM 2208 HE ARG A 236 35.280 64.887 8.363 1.00 0.00 H ATOM 2209 HH12 ARG A 236 34.322 64.125 4.477 1.00 0.00 H ATOM 2210 HH11 ARG A 236 32.995 64.263 5.687 1.00 0.00 H ATOM 2211 HH22 ARG A 236 36.505 64.367 5.154 1.00 0.00 H ATOM 2212 HH21 ARG A 236 36.877 64.691 6.887 1.00 0.00 H ATOM 2213 H ARG A 236 29.486 62.673 10.764 1.00 0.00 H ATOM 2214 N GLU A 237 32.090 61.151 11.784 1.00 12.94 N ATOM 2215 CA GLU A 237 33.097 60.592 12.632 1.00 14.18 C ATOM 2216 C GLU A 237 32.787 59.143 13.052 1.00 14.57 C ATOM 2217 O GLU A 237 33.710 58.320 13.203 1.00 18.09 O ATOM 2218 CB GLU A 237 33.261 61.502 13.841 1.00 15.78 C ATOM 2219 CG GLU A 237 34.549 61.268 14.491 1.00 21.46 C ATOM 2220 CD GLU A 237 34.931 62.280 15.541 1.00 19.12 C ATOM 2221 OE1 GLU A 237 34.181 63.308 15.789 1.00 16.56 O ATOM 2222 OE2 GLU A 237 36.015 61.992 16.098 1.00 17.70 O ATOM 2223 H GLU A 237 31.327 61.716 12.208 1.00 0.00 H ATOM 2224 N ASN A 238 31.505 58.822 13.195 1.00 14.53 N ATOM 2225 CA ASN A 238 31.048 57.494 13.593 1.00 15.08 C ATOM 2226 C ASN A 238 29.828 57.101 12.744 1.00 15.14 C ATOM 2227 O ASN A 238 28.695 57.024 13.238 1.00 16.10 O ATOM 2228 CB ASN A 238 30.694 57.465 15.081 1.00 15.67 C ATOM 2229 CG ASN A 238 30.417 56.060 15.577 1.00 17.25 C ATOM 2230 OD1 ASN A 238 30.378 55.111 14.793 1.00 18.73 O ATOM 2231 ND2 ASN A 238 30.238 55.912 16.872 1.00 18.08 N ATOM 2232 HD22 ASN A 238 30.279 56.740 17.501 1.00 0.00 H ATOM 2233 HD21 ASN A 238 30.056 54.967 17.267 1.00 0.00 H ATOM 2234 H ASN A 238 30.790 59.555 13.014 1.00 0.00 H ATOM 2235 N PRO A 239 30.065 56.857 11.445 1.00 14.74 N ATOM 2236 CA PRO A 239 28.947 56.507 10.577 1.00 15.23 C ATOM 2237 C PRO A 239 28.241 55.216 11.012 1.00 15.80 C ATOM 2238 O PRO A 239 27.009 55.149 10.921 1.00 17.76 O ATOM 2239 CB PRO A 239 29.609 56.371 9.192 1.00 16.42 C ATOM 2240 CG PRO A 239 31.061 56.209 9.453 1.00 17.12 C ATOM 2241 CD PRO A 239 31.337 56.974 10.704 1.00 15.14 C ATOM 2242 N ALA A 240 28.984 54.221 11.489 1.00 17.36 N ATOM 2243 CA ALA A 240 28.339 52.971 11.874 1.00 18.46 C ATOM 2244 C ALA A 240 27.377 53.198 13.059 1.00 18.18 C ATOM 2245 O ALA A 240 26.291 52.637 13.115 1.00 19.84 O ATOM 2246 CB ALA A 240 29.375 51.910 12.209 1.00 20.41 C ATOM 2247 H ALA A 240 30.013 54.333 11.586 1.00 0.00 H ATOM 2248 N GLY A 241 27.769 54.063 13.992 1.00 18.10 N ATOM 2249 CA GLY A 241 26.910 54.385 15.123 1.00 18.77 C ATOM 2250 C GLY A 241 25.658 55.130 14.698 1.00 17.18 C ATOM 2251 O GLY A 241 24.563 54.874 15.223 1.00 18.35 O ATOM 2252 H GLY A 241 28.702 54.515 13.912 1.00 0.00 H ATOM 2253 N VAL A 242 25.802 56.076 13.767 1.00 16.67 N ATOM 2254 CA VAL A 242 24.633 56.785 13.270 1.00 15.31 C ATOM 2255 C VAL A 242 23.725 55.866 12.455 1.00 17.20 C ATOM 2256 O VAL A 242 22.505 55.946 12.599 1.00 18.24 O ATOM 2257 CB VAL A 242 25.039 58.040 12.462 1.00 14.15 C ATOM 2258 CG1 VAL A 242 23.845 58.613 11.750 1.00 14.48 C ATOM 2259 CG2 VAL A 242 25.643 59.080 13.422 1.00 13.89 C ATOM 2260 H VAL A 242 26.747 56.305 13.398 1.00 0.00 H ATOM 2261 N ILE A 243 24.296 54.975 11.657 1.00 17.46 N ATOM 2262 CA ILE A 243 23.473 54.004 10.932 1.00 18.96 C ATOM 2263 C ILE A 243 22.651 53.165 11.915 1.00 19.62 C ATOM 2264 O ILE A 243 21.450 52.956 11.702 1.00 20.52 O ATOM 2265 CB ILE A 243 24.320 53.100 10.040 1.00 19.02 C ATOM 2266 CG1 ILE A 243 24.921 53.919 8.895 1.00 18.41 C ATOM 2267 CG2 ILE A 243 23.461 51.926 9.455 1.00 21.46 C ATOM 2268 CD1 ILE A 243 26.087 53.248 8.213 1.00 19.13 C ATOM 2269 H ILE A 243 25.330 54.965 11.545 1.00 0.00 H ATOM 2270 N ALA A 244 23.268 52.731 13.016 1.00 20.00 N ATOM 2271 CA ALA A 244 22.551 51.929 14.003 1.00 21.15 C ATOM 2272 C ALA A 244 21.394 52.720 14.626 1.00 21.95 C ATOM 2273 O ALA A 244 20.278 52.196 14.772 1.00 22.85 O ATOM 2274 CB ALA A 244 23.499 51.432 15.077 1.00 21.62 C ATOM 2275 H ALA A 244 24.269 52.966 13.172 1.00 0.00 H ATOM 2276 N SER A 245 21.646 53.970 14.978 1.00 22.03 N ATOM 2277 CA SER A 245 20.598 54.799 15.561 1.00 21.33 C ATOM 2278 C SER A 245 19.470 55.018 14.553 1.00 21.77 C ATOM 2279 O SER A 245 18.294 54.937 14.919 1.00 22.12 O ATOM 2280 CB SER A 245 21.159 56.142 16.030 1.00 22.76 C ATOM 2281 OG SER A 245 22.054 55.936 17.101 1.00 26.07 O ATOM 2282 HG SER A 245 21.576 55.500 17.850 1.00 0.00 H ATOM 2283 H SER A 245 22.598 54.364 14.838 1.00 0.00 H ATOM 2284 N LEU A 246 19.807 55.314 13.298 1.00 20.04 N ATOM 2285 CA LEU A 246 18.778 55.504 12.290 1.00 19.82 C ATOM 2286 C LEU A 246 17.959 54.223 12.111 1.00 20.30 C ATOM 2287 O LEU A 246 16.745 54.270 11.937 1.00 21.40 O ATOM 2288 CB LEU A 246 19.400 55.947 10.966 1.00 20.33 C ATOM 2289 CG LEU A 246 20.034 57.340 10.905 1.00 24.03 C ATOM 2290 CD1 LEU A 246 20.483 57.632 9.502 1.00 24.15 C ATOM 2291 CD2 LEU A 246 19.095 58.429 11.374 1.00 26.62 C ATOM 2292 H LEU A 246 20.810 55.409 13.039 1.00 0.00 H ATOM 2293 N ALA A 247 18.607 53.068 12.172 1.00 20.75 N ATOM 2294 CA ALA A 247 17.889 51.811 12.002 1.00 22.42 C ATOM 2295 C ALA A 247 16.897 51.607 13.140 1.00 22.98 C ATOM 2296 O ALA A 247 15.778 51.147 12.911 1.00 25.71 O ATOM 2297 CB ALA A 247 18.863 50.659 11.932 1.00 23.31 C ATOM 2298 H ALA A 247 19.633 53.059 12.342 1.00 0.00 H ATOM 2299 N GLN A 248 17.292 51.941 14.363 1.00 22.44 N ATOM 2300 CA GLN A 248 16.396 51.794 15.515 1.00 23.01 C ATOM 2301 C GLN A 248 15.170 52.690 15.347 1.00 24.04 C ATOM 2302 O GLN A 248 14.050 52.299 15.634 1.00 28.05 O ATOM 2303 CB GLN A 248 17.117 52.146 16.824 1.00 26.55 C ATOM 2304 CG GLN A 248 18.262 51.241 17.185 1.00 32.95 C ATOM 2305 CD GLN A 248 19.173 51.859 18.245 1.00 38.92 C ATOM 2306 OE1 GLN A 248 18.762 52.755 18.988 1.00 41.24 O ATOM 2307 NE2 GLN A 248 20.419 51.392 18.306 1.00 40.17 N ATOM 2308 HE22 GLN A 248 20.723 50.636 17.660 1.00 0.00 H ATOM 2309 HE21 GLN A 248 21.088 51.784 18.999 1.00 0.00 H ATOM 2310 H GLN A 248 18.253 52.313 14.506 1.00 0.00 H ATOM 2311 N ILE A 249 15.407 53.905 14.879 1.00 23.73 N ATOM 2312 CA ILE A 249 14.343 54.887 14.694 1.00 24.06 C ATOM 2313 C ILE A 249 13.391 54.460 13.588 1.00 23.76 C ATOM 2314 O ILE A 249 12.171 54.479 13.753 1.00 25.62 O ATOM 2315 CB ILE A 249 14.922 56.281 14.364 1.00 23.02 C ATOM 2316 CG1 ILE A 249 15.684 56.836 15.575 1.00 23.27 C ATOM 2317 CG2 ILE A 249 13.819 57.246 13.942 1.00 25.45 C ATOM 2318 CD1 ILE A 249 16.584 58.003 15.257 1.00 23.04 C ATOM 2319 H ILE A 249 16.383 54.169 14.635 1.00 0.00 H ATOM 2320 N LEU A 250 13.957 54.073 12.454 1.00 23.84 N ATOM 2321 CA LEU A 250 13.156 53.878 11.249 1.00 25.63 C ATOM 2322 C LEU A 250 12.416 52.550 11.200 1.00 30.17 C ATOM 2323 O LEU A 250 11.320 52.465 10.647 1.00 30.72 O ATOM 2324 CB LEU A 250 14.039 53.989 10.009 1.00 26.19 C ATOM 2325 CG LEU A 250 14.645 55.355 9.697 1.00 27.45 C ATOM 2326 CD1 LEU A 250 15.634 55.228 8.533 1.00 27.57 C ATOM 2327 CD2 LEU A 250 13.552 56.360 9.372 1.00 28.01 C ATOM 2328 H LEU A 250 14.983 53.906 12.422 1.00 0.00 H ATOM 2329 N ARG A 251 13.004 51.512 11.774 1.00 33.46 N ATOM 2330 CA ARG A 251 12.498 50.176 11.538 1.00 38.88 C ATOM 2331 C ARG A 251 11.580 49.761 12.686 1.00 45.20 C ATOM 2332 O ARG A 251 11.056 48.648 12.696 1.00 48.41 O ATOM 2333 CB ARG A 251 13.677 49.223 11.314 1.00 38.71 C ATOM 2334 CG ARG A 251 14.603 49.734 10.174 1.00 39.15 C ATOM 2335 CD ARG A 251 15.672 48.727 9.754 1.00 40.72 C ATOM 2336 NE ARG A 251 16.547 49.184 8.657 1.00 42.81 N ATOM 2337 CZ ARG A 251 16.220 49.185 7.362 1.00 48.66 C ATOM 2338 NH1 ARG A 251 15.006 48.814 6.959 1.00 50.58 N ATOM 2339 NH2 ARG A 251 17.101 49.587 6.455 1.00 50.63 N ATOM 2340 HE ARG A 251 17.493 49.533 8.912 1.00 0.00 H ATOM 2341 HH12 ARG A 251 14.769 48.821 5.946 1.00 0.00 H ATOM 2342 HH11 ARG A 251 14.295 48.517 7.657 1.00 0.00 H ATOM 2343 HH22 ARG A 251 16.846 49.588 5.447 1.00 0.00 H ATOM 2344 HH21 ARG A 251 18.047 49.902 6.752 1.00 0.00 H ATOM 2345 H ARG A 251 13.827 51.656 12.393 1.00 0.00 H ATOM 2346 N PHE A 252 11.363 50.685 13.622 1.00 48.72 N ATOM 2347 CA PHE A 252 10.404 50.505 14.706 1.00 55.06 C ATOM 2348 C PHE A 252 9.306 51.560 14.583 1.00 61.23 C ATOM 2349 O PHE A 252 8.979 51.994 13.476 1.00 62.92 O ATOM 2350 CB PHE A 252 11.091 50.607 16.070 1.00 56.07 C ATOM 2351 OXT PHE A 252 8.727 52.015 15.572 1.00 63.57 O ATOM 2352 H PHE A 252 11.901 51.574 13.577 1.00 0.00 H TER 2353 PHE A 252 HETATM 2354 O HOH 1 33.192 68.306 11.467 1.00 10.97 O HETATM 2355 O HOH 2 34.949 80.166 -3.937 1.00 10.52 O HETATM 2356 O HOH 3 28.806 72.911 -1.316 1.00 10.97 O HETATM 2357 O HOH 4 31.161 64.169 5.265 1.00 13.68 O HETATM 2358 O HOH 5 29.911 67.520 1.574 1.00 13.40 O HETATM 2359 O HOH 6 30.865 61.357 5.154 1.00 15.00 O HETATM 2360 O HOH 7 33.872 65.566 11.437 1.00 12.87 O HETATM 2361 O HOH 8 32.489 67.655 14.271 1.00 11.40 O HETATM 2362 O HOH 9 17.144 81.471 16.548 1.00 16.47 O HETATM 2363 O HOH 10 29.398 60.695 2.874 1.00 13.52 O HETATM 2364 O HOH 11 22.897 80.054 7.729 1.00 12.46 O HETATM 2365 O HOH 12 31.613 68.895 9.213 1.00 10.17 O HETATM 2366 O HOH 13 30.857 65.090 2.585 1.00 13.36 O HETATM 2367 O HOH 14 23.844 64.455 1.790 1.00 12.17 O HETATM 2368 O HOH 15 38.914 77.364 -2.250 1.00 13.53 O HETATM 2369 O HOH 16 32.918 68.605 16.903 1.00 13.14 O HETATM 2370 O HOH 17 29.749 59.605 7.101 1.00 14.37 O HETATM 2371 O HOH 18 29.051 71.057 6.695 1.00 14.86 O HETATM 2372 O HOH 19 30.868 77.190 17.751 1.00 15.74 O HETATM 2373 O HOH 20 26.091 66.381 17.359 1.00 13.67 O HETATM 2374 O HOH 21 29.062 76.525 -2.732 1.00 10.40 O HETATM 2375 O HOH 22 22.218 66.688 1.613 1.00 10.14 O HETATM 2376 O HOH 23 32.373 63.585 0.803 1.00 19.72 O HETATM 2377 O HOH 24 27.441 80.476 11.820 1.00 16.61 O HETATM 2378 O HOH 25 42.175 78.600 -0.622 1.00 15.10 O HETATM 2379 O HOH 26 43.907 71.149 4.571 1.00 22.60 O HETATM 2380 O HOH 27 13.404 75.479 5.714 1.00 15.40 O HETATM 2381 O HOH 28 17.470 67.958 -8.762 1.00 20.76 O HETATM 2382 O HOH 29 28.643 82.828 13.739 1.00 21.87 O HETATM 2383 O HOH 30 34.324 63.123 2.722 1.00 20.34 O HETATM 2384 O HOH 31 32.856 70.625 -0.910 1.00 20.23 O HETATM 2385 O HOH 32 23.861 80.851 11.807 1.00 15.58 O HETATM 2386 O HOH 33 28.942 75.018 -5.141 1.00 13.51 O HETATM 2387 O HOH 34 23.509 77.101 14.851 1.00 23.38 O HETATM 2388 O HOH 35 35.564 64.932 17.566 1.00 17.70 O HETATM 2389 O HOH 36 31.432 70.038 1.350 1.00 15.36 O HETATM 2390 O HOH 37 38.314 64.043 17.346 1.00 18.67 O HETATM 2391 O HOH 38 32.768 64.665 -1.617 1.00 23.76 O HETATM 2392 O HOH 39 43.366 72.783 9.421 1.00 20.56 O HETATM 2393 O HOH 40 22.566 73.860 14.380 1.00 13.02 O HETATM 2394 O HOH 41 11.758 83.548 5.453 1.00 24.85 O HETATM 2395 O HOH 42 43.311 80.702 8.713 1.00 22.08 O HETATM 2396 O HOH 43 11.003 53.689 -2.029 1.00 23.25 O HETATM 2397 O HOH 44 42.016 74.212 11.353 1.00 22.92 O HETATM 2398 O HOH 45 30.956 73.363 -5.265 1.00 24.29 O HETATM 2399 O HOH 46 36.060 64.163 10.405 1.00 17.54 O HETATM 2400 O HOH 47 26.562 68.393 -5.750 1.00 31.27 O HETATM 2401 O HOH 48 29.059 79.889 14.163 1.00 29.83 O HETATM 2402 O HOH 49 41.587 60.933 13.306 1.00 34.18 O HETATM 2403 O HOH 50 31.807 73.473 22.166 1.00 28.52 O HETATM 2404 O HOH 51 44.301 75.981 5.691 1.00 23.66 O HETATM 2405 O HOH 52 5.255 68.906 8.003 1.00 26.43 O HETATM 2406 O HOH 53 12.520 84.085 20.859 1.00 32.05 O HETATM 2407 O HOH 54 6.821 58.273 -2.161 1.00 21.94 O HETATM 2408 O HOH 55 21.483 86.544 1.674 1.00 25.61 O HETATM 2409 O HOH 56 35.110 89.735 8.797 1.00 22.98 O HETATM 2410 O HOH 57 4.633 64.846 -8.416 1.00 27.38 O HETATM 2411 O HOH 58 9.146 78.104 21.437 1.00 28.36 O HETATM 2412 O HOH 59 27.043 76.037 16.751 1.00 25.66 O HETATM 2413 O HOH 60 20.794 82.844 -0.636 1.00 23.79 O HETATM 2414 O HOH 61 17.730 81.986 -7.513 1.00 40.20 O HETATM 2415 O HOH 62 35.925 68.074 -3.023 1.00 28.43 O HETATM 2416 O HOH 63 16.515 85.866 6.109 1.00 28.67 O HETATM 2417 O HOH 64 5.709 53.814 3.006 1.00 35.94 O HETATM 2418 O HOH 65 44.320 73.295 6.837 1.00 25.46 O HETATM 2419 O HOH 66 40.576 80.295 14.877 1.00 19.31 O HETATM 2420 O HOH 67 29.213 53.392 18.095 1.00 27.50 O HETATM 2421 O HOH 68 39.383 66.024 2.273 1.00 24.97 O HETATM 2422 O HOH 69 37.223 64.002 3.433 1.00 28.33 O HETATM 2423 O HOH 70 33.560 58.763 7.658 1.00 17.13 O HETATM 2424 O HOH 71 7.370 55.957 -0.935 1.00 31.94 O HETATM 2425 O HOH 72 33.578 68.788 -2.683 1.00 25.53 O HETATM 2426 O HOH 73 41.580 62.332 18.227 1.00 37.23 O HETATM 2427 O HOH 74 11.863 82.244 22.732 1.00 25.23 O HETATM 2428 O HOH 75 29.804 71.629 21.443 1.00 21.84 O HETATM 2429 O HOH 76 12.907 83.113 9.809 1.00 30.27 O HETATM 2430 O HOH 77 32.139 69.850 22.618 1.00 31.08 O HETATM 2431 O HOH 78 11.496 52.465 -6.085 1.00 29.07 O HETATM 2432 O HOH 79 27.050 86.913 -1.748 1.00 29.30 O HETATM 2433 O HOH 80 43.604 79.227 11.027 1.00 26.09 O HETATM 2434 O HOH 81 45.293 74.588 3.202 1.00 38.72 O HETATM 2435 O HOH 82 38.483 89.346 5.288 1.00 28.97 O HETATM 2436 O HOH 83 29.539 70.850 -6.713 1.00 33.85 O HETATM 2437 O HOH 84 40.142 87.909 8.627 1.00 36.91 O HETATM 2438 O HOH 85 12.336 83.457 2.598 1.00 25.39 O HETATM 2439 O HOH 86 26.339 91.441 19.797 1.00 33.49 O HETATM 2440 O HOH 87 34.544 90.426 -2.534 1.00 28.40 O HETATM 2441 O HOH 88 43.678 81.901 13.195 1.00 27.24 O HETATM 2442 O HOH 89 39.986 67.450 21.005 1.00 28.16 O HETATM 2443 O HOH 90 24.170 76.748 -11.803 1.00 32.88 O HETATM 2444 O HOH 91 32.340 69.628 -7.107 1.00 33.10 O HETATM 2445 O HOH 92 13.795 83.520 7.255 1.00 21.89 O HETATM 2446 O HOH 93 43.328 69.401 18.097 1.00 33.46 O HETATM 2447 O HOH 94 28.609 78.030 16.309 1.00 25.48 O HETATM 2448 O HOH 95 7.811 70.845 -8.532 1.00 30.27 O HETATM 2449 O HOH 96 26.517 69.036 27.616 1.00 45.83 O HETATM 2450 O HOH 97 19.341 78.412 23.156 1.00 31.47 O HETATM 2451 O HOH 98 6.095 56.072 6.427 1.00 30.00 O HETATM 2452 O HOH 99 23.807 74.321 24.943 1.00 43.49 O HETATM 2453 O HOH 100 24.814 77.182 17.122 1.00 31.11 O HETATM 2454 O HOH 101 35.172 60.449 6.296 1.00 35.14 O HETATM 2455 O HOH 102 22.175 87.237 10.724 1.00 40.30 O HETATM 2456 O HOH 103 43.374 83.504 8.750 1.00 38.29 O HETATM 2457 O HOH 104 24.349 84.041 20.056 1.00 30.93 O HETATM 2458 O HOH 105 24.694 54.780 18.139 1.00 37.64 O HETATM 2459 O HOH 106 23.986 76.245 -9.231 1.00 28.52 O HETATM 2460 O HOH 107 45.397 79.496 2.965 1.00 33.88 O HETATM 2461 O HOH 108 7.262 78.649 2.426 1.00 47.16 O HETATM 2462 O HOH 109 22.755 81.261 -1.617 1.00 25.66 O HETATM 2463 O HOH 110 22.378 78.469 22.347 1.00 40.04 O HETATM 2464 O HOH 111 36.850 90.674 6.892 1.00 36.43 O HETATM 2465 O HOH 112 41.986 84.614 11.645 1.00 48.49 O HETATM 2466 O HOH 113 2.965 74.425 21.394 1.00 29.47 O HETATM 2467 O HOH 114 34.793 56.445 5.287 1.00 54.26 O HETATM 2468 O HOH 115 21.892 59.412 -8.046 1.00 47.55 O HETATM 2469 O HOH 116 3.512 71.318 10.731 1.00 36.33 O HETATM 2470 O HOH 117 33.654 58.535 3.048 1.00 46.45 O HETATM 2471 O HOH 118 33.668 70.287 20.047 1.00 19.94 O HETATM 2472 O HOH 119 19.402 61.804 -9.390 1.00 31.60 O HETATM 2473 O HOH 120 29.451 85.679 19.036 1.00 55.24 O HETATM 2474 O HOH 121 31.851 66.886 -2.839 1.00 34.77 O HETATM 2475 O HOH 122 43.541 72.586 2.239 1.00 26.11 O HETATM 2476 O HOH 123 33.514 60.901 4.280 1.00 22.24 O HETATM 2477 O HOH 124 46.444 73.036 15.668 1.00 45.35 O HETATM 2478 O HOH 125 24.302 88.407 9.793 1.00 35.96 O HETATM 2479 O HOH 126 45.542 79.722 6.884 1.00 51.94 O HETATM 2480 O HOH 127 13.071 46.252 3.837 1.00 44.44 O HETATM 2481 O HOH 128 33.132 92.254 -0.789 1.00 47.73 O HETATM 2482 O HOH 129 46.211 81.421 1.213 1.00 37.23 O HETATM 2483 O HOH 130 8.285 54.402 -3.811 1.00 44.05 O HETATM 2484 O HOH 131 4.581 59.587 5.457 1.00 26.52 O HETATM 2485 O HOH 132 12.278 83.127 25.250 1.00 43.11 O HETATM 2486 O HOH 133 11.582 55.198 -5.546 1.00 35.03 O HETATM 2487 O HOH 134 8.640 83.367 7.742 1.00 53.15 O HETATM 2488 O HOH 135 3.732 70.717 1.351 1.00 35.00 O HETATM 2489 O HOH 136 3.422 69.567 13.673 1.00 59.15 O HETATM 2490 O HOH 137 22.017 83.344 -8.434 1.00 42.79 O HETATM 2491 O HOH 138 21.691 57.540 23.488 1.00 37.30 O HETATM 2492 O HOH 139 23.325 88.325 0.556 1.00 42.99 O HETATM 2493 O HOH 140 27.609 84.105 17.694 1.00 53.42 O HETATM 2494 O HOH 141 41.018 64.488 21.934 1.00 27.35 O HETATM 2495 O HOH 142 29.560 60.512 -1.725 1.00 26.51 O HETATM 2496 O HOH 143 20.151 66.350 -11.372 1.00 57.80 O HETATM 2497 O HOH 144 8.459 61.567 18.050 1.00 46.40 O HETATM 2498 O HOH 145 31.875 54.059 11.985 1.00 22.88 O HETATM 2499 O HOH 146 19.263 64.555 -10.172 1.00 37.69 O HETATM 2500 O HOH 147 8.469 56.755 14.192 1.00 51.60 O HETATM 2501 O HOH 148 29.802 92.041 12.374 1.00 39.12 O HETATM 2502 O HOH 149 28.566 92.285 1.912 1.00 54.00 O HETATM 2503 O HOH 150 38.898 58.697 8.095 1.00 56.75 O HETATM 2504 O HOH 151 18.568 73.055 -9.888 1.00 51.25 O HETATM 2505 O HOH 152 10.511 82.804 9.939 1.00 46.87 O HETATM 2506 O HOH 153 28.705 91.096 6.223 1.00 35.86 O HETATM 2507 O HOH 154 14.351 85.928 20.785 1.00 51.26 O HETATM 2508 O HOH 155 30.798 52.157 20.435 1.00 66.76 O HETATM 2509 O HOH 156 42.743 66.667 19.481 1.00 30.71 O HETATM 2510 O HOH 157 36.075 61.357 10.266 1.00 39.12 O HETATM 2511 O HOH 158 23.362 51.270 -1.379 1.00 36.28 O HETATM 2512 O HOH 159 9.461 54.788 13.144 1.00 50.09 O HETATM 2513 O HOH 160 2.262 75.303 13.415 1.00 45.85 O HETATM 2514 O HOH 161 3.845 72.152 13.735 1.00 51.12 O HETATM 2515 O HOH 162 43.177 85.058 5.344 1.00 42.69 O HETATM 2516 O HOH 163 37.300 59.448 15.757 1.00 44.16 O HETATM 2517 O HOH 164 3.417 62.957 9.843 1.00 48.52 O HETATM 2518 O HOH 165 44.486 74.047 15.999 1.00 43.42 O HETATM 2519 O HOH 166 38.060 69.533 -2.240 1.00 34.41 O HETATM 2520 O HOH 167 30.710 69.870 19.538 1.00 42.36 O HETATM 2521 O HOH 168 8.585 57.541 -5.108 1.00 41.27 O HETATM 2522 O HOH 169 24.808 90.605 22.017 1.00 45.71 O HETATM 2523 O HOH 170 5.449 71.816 -7.715 1.00 53.92 O HETATM 2524 O HOH 171 28.678 68.859 -5.216 1.00 34.90 O HETATM 2525 O HOH 172 29.375 88.550 17.645 1.00 36.99 O HETATM 2526 O HOH 173 45.498 83.873 3.829 1.00 51.54 O HETATM 2527 O HOH 174 15.677 76.905 27.310 1.00 61.53 O HETATM 2528 O HOH 175 31.240 61.020 0.400 1.00 39.98 O HETATM 2529 O HOH 176 7.077 68.982 -10.546 1.00 55.01 O HETATM 2530 O HOH 177 36.925 56.660 7.350 1.00 64.45 O HETATM 2531 O HOH 178 37.914 65.008 8.659 1.00 13.66 O HETATM 2532 O HOH 179 33.074 65.027 14.077 1.00 16.51 O HETATM 2533 O HOH 180 27.509 69.192 5.541 1.00 10.50 O HETATM 2534 O HOH 181 27.364 60.041 5.614 1.00 11.91 O HETATM 2535 O HOH 182 36.261 85.074 12.107 1.00 29.18 O HETATM 2536 O HOH 183 39.720 80.037 -2.018 1.00 13.32 O HETATM 2537 O HOH 184 32.825 85.615 13.682 1.00 43.78 O HETATM 2538 O HOH 185 13.393 65.705 -10.764 1.00 43.57 O HETATM 2539 O HOH 186 11.847 59.932 -8.462 1.00 34.61 O HETATM 2540 O HOH 187 44.390 64.999 7.150 1.00 31.52 O HETATM 2541 O HOH 188 7.507 84.354 2.115 1.00 52.01 O HETATM 2542 O HOH 189 7.786 80.841 9.554 1.00 38.96 O HETATM 2543 O HOH 190 7.775 77.343 18.620 1.00 18.77 O HETATM 2544 O HOH 191 1.473 71.268 3.104 1.00 46.63 O HETATM 2545 O HOH 192 4.536 84.417 4.673 1.00 73.28 O HETATM 2546 O HOH 193 42.197 64.111 20.235 1.00 45.51 O HETATM 2547 O HOH 194 29.729 74.508 20.819 1.00 50.42 O HETATM 2548 O HOH 195 9.825 84.503 25.985 1.00 55.84 O HETATM 2549 O HOH 196 40.594 70.638 -3.912 1.00 54.28 O HETATM 2550 O HOH 197 23.149 81.723 -4.186 1.00 25.25 O HETATM 2551 O HOH 198 43.966 66.089 4.574 1.00 50.23 O HETATM 2552 O HOH 199 44.251 71.506 14.533 1.00 29.49 O HETATM 2553 O HOH 200 1.126 70.815 5.342 1.00 48.92 O HETATM 2554 O HOH 201 45.864 77.371 7.354 1.00 66.11 O HETATM 2555 O HOH 202 37.545 80.129 14.908 1.00 28.53 O HETATM 2556 O HOH 203 35.676 81.928 15.776 1.00 39.35 O HETATM 2557 O HOH 204 35.131 92.917 4.054 1.00 57.70 O HETATM 2558 O HOH 205 30.560 71.602 -3.087 1.00 20.68 O HETATM 2559 O HOH 206 40.663 72.058 -1.490 1.00 48.56 O HETATM 2560 O HOH 207 25.306 53.696 -3.641 1.00 63.20 O HETATM 2561 O HOH 208 8.383 81.780 -0.024 1.00 53.32 O HETATM 2562 O HOH 209 29.034 93.732 6.561 1.00 59.41 O HETATM 2563 O HOH 210 37.659 66.411 -1.897 1.00 63.44 O HETATM 2564 O HOH 211 2.563 75.456 10.583 1.00 32.49 O HETATM 2565 O HOH 212 11.572 79.667 -3.132 1.00 33.33 O HETATM 2566 O HOH 213 22.380 85.267 -7.227 1.00 53.56 O HETATM 2567 O HOH 214 24.662 87.078 23.630 1.00 43.94 O HETATM 2568 O HOH 215 24.040 67.865 28.538 1.00 57.92 O HETATM 2569 O HOH 216 37.650 64.261 20.942 1.00 39.90 O HETATM 2570 O HOH 217 14.422 86.031 7.180 1.00 62.37 O HETATM 2571 O HOH 218 45.830 64.739 14.319 1.00 23.75 O HETATM 2572 O HOH 219 2.052 69.966 15.235 1.00 68.77 O HETATM 2573 O HOH 220 28.164 66.832 27.642 1.00 54.18 O HETATM 2574 O HOH 221 4.098 70.059 -10.478 1.00 55.78 O HETATM 2575 O HOH 222 35.590 64.872 -2.062 1.00 46.13 O HETATM 2576 O HOH 223 27.429 57.218 -2.709 1.00 45.68 O HETATM 2577 O HOH 224 45.346 61.575 14.340 1.00 60.32 O HETATM 2578 O HOH 225 31.952 81.940 15.150 1.00 37.41 O HETATM 2579 O HOH 226 12.211 47.845 8.288 1.00 61.73 O HETATM 2580 O HOH 227 26.226 74.108 14.963 1.00 22.25 O HETATM 2581 O HOH 228 12.340 80.094 -5.367 1.00 70.11 O HETATM 2582 O HOH 229 10.515 71.082 22.357 1.00 35.93 O HETATM 2583 O HOH 230 35.288 85.378 14.116 1.00 54.56 O HETATM 2584 O HOH 231 38.241 83.181 13.291 1.00 24.43 O HETATM 2585 O HOH 232 23.204 72.212 -11.016 1.00 52.14 O HETATM 2586 O HOH 233 9.425 58.476 -7.092 1.00 66.27 O HETATM 2587 O HOH 234 40.406 86.780 10.969 1.00 42.02 O HETATM 2588 O HOH 235 37.286 64.313 -0.509 1.00 74.83 O HETATM 2589 O HOH 236 5.228 72.747 -4.365 1.00 50.05 O HETATM 2590 O HOH 237 26.439 88.419 0.720 1.00 36.20 O HETATM 2591 O HOH 238 20.092 89.049 10.333 1.00 61.50 O HETATM 2592 O HOH 239 9.624 48.305 8.205 1.00 49.44 O HETATM 2593 O HOH 240 21.984 50.507 -3.543 1.00 39.82 O HETATM 2594 O HOH 241 0.726 73.022 7.099 1.00 42.68 O HETATM 2595 O HOH 242 23.724 91.490 28.475 1.00 57.65 O HETATM 2596 O HOH 243 2.296 68.445 6.764 1.00 52.67 O HETATM 2597 O HOH 244 8.876 84.919 23.622 1.00 35.62 O HETATM 2598 O HOH 245 34.350 57.078 16.206 1.00 57.74 O HETATM 2599 O HOH 246 39.304 67.016 -0.475 1.00 49.20 O HETATM 2600 O HOH 247 5.905 83.184 5.847 1.00 64.11 O HETATM 2601 O HOH 248 22.077 64.041 -10.220 1.00 57.71 O HETATM 2602 O HOH 249 1.503 73.132 9.647 1.00 34.54 O HETATM 2603 O HOH 250 20.439 85.648 -0.838 1.00 43.63 O HETATM 2604 O HOH 251 1.512 72.819 13.515 1.00 57.45 O HETATM 2605 O HOH 252 9.401 81.343 -2.167 1.00 53.38 O HETATM 2606 O HOH 253 32.626 53.550 7.262 1.00 37.12 O HETATM 2607 O HOH 254 45.664 80.222 -1.105 1.00 35.23 O HETATM 2608 O HOH 255 34.233 81.120 17.185 1.00 47.08 O HETATM 2609 O HOH 256 23.118 63.929 26.445 1.00 53.02 O HETATM 2610 O HOH 257 49.427 68.428 13.497 1.00 58.04 O HETATM 2611 O HOH 258 19.682 52.846 -6.093 1.00 58.62 O HETATM 2612 O HOH 259 49.420 63.673 10.428 1.00 74.36 O HETATM 2613 O HOH 260 19.149 50.791 -3.622 1.00 39.00 O HETATM 2614 O HOH 261 49.153 67.246 15.625 1.00 61.95 O HETATM 2615 O HOH 262 20.009 87.381 8.062 1.00 52.47 O HETATM 2616 O HOH 263 14.256 81.331 -4.031 1.00 46.33 O HETATM 2617 O HOH 264 44.690 71.158 11.222 1.00 34.28 O HETATM 2618 O HOH 265 15.425 73.767 -11.630 1.00 69.47 O HETATM 2619 O HOH 266 33.052 54.108 23.064 1.00 65.55 O HETATM 2620 O HOH 267 27.065 59.823 -5.491 1.00 47.65 O HETATM 2621 O HOH 268 28.562 62.256 -7.540 1.00 47.22 O HETATM 2622 O HOH 269 34.083 81.576 19.498 1.00 44.51 O HETATM 2623 O HOH 270 19.086 87.258 2.985 1.00 49.85 O HETATM 2624 O HOH 271 20.379 59.498 25.578 1.00 58.11 O HETATM 2625 O HOH 272 19.698 70.973 -10.666 1.00 58.51 O HETATM 2626 O HOH 273 24.484 65.312 28.980 1.00 61.06 O HETATM 2627 O HOH 274 44.646 60.563 11.519 1.00 75.05 O HETATM 2628 O HOH 275 41.329 69.095 19.506 1.00 9.73 O HETATM 2629 O HOH 276 25.240 87.559 2.769 1.00 26.63 O HETATM 2630 O HOH 277 23.761 84.324 -4.919 1.00 29.32 O HETATM 2631 O HOH 278 26.406 53.051 18.618 1.00 31.19 O HETATM 2632 O HOH 279 29.084 90.411 19.470 1.00 44.74 O HETATM 2633 O HOH 280 30.801 89.655 15.990 1.00 38.68 O HETATM 2634 O HOH 281 30.186 66.382 25.609 1.00 37.23 O HETATM 2635 O HOH 282 37.257 61.159 7.831 1.00 40.27 O HETATM 2636 O HOH 283 28.075 56.034 -0.182 1.00 32.31 O HETATM 2637 O HOH 284 -1.022 73.837 14.061 1.00 45.90 O HETATM 2638 O HOH 285 20.696 55.033 19.317 1.00 41.46 O HETATM 2639 O HOH 286 22.147 85.956 -3.379 1.00 46.37 O HETATM 2640 O HOH 287 26.518 75.379 -13.062 1.00 43.38 O HETATM 2641 O HOH 288 6.110 65.473 -10.474 1.00 45.18 O HETATM 2642 O HOH 289 6.565 77.857 4.349 1.00 45.11 O HETATM 2643 O HOH 290 16.907 88.162 7.168 1.00 47.67 O HETATM 2644 O HOH 291 23.602 50.069 18.790 1.00 48.14 O HETATM 2645 O HOH 292 29.244 51.433 16.525 1.00 54.31 O HETATM 2646 O HOH 293 9.436 87.660 23.648 1.00 50.37 O HETATM 2647 O HOH 294 1.668 77.303 12.368 1.00 42.68 O HETATM 2648 O HOH 295 31.439 92.232 10.054 1.00 47.84 O HETATM 2649 O HOH 296 41.046 62.219 9.630 1.00 48.03 O HETATM 2650 O HOH 297 27.841 57.788 24.094 1.00 49.94 O HETATM 2651 O HOH 298 43.249 71.855 -0.267 1.00 51.89 O HETATM 2652 O HOH 299 46.806 64.567 7.391 1.00 69.48 O HETATM 2653 O HOH 300 26.218 52.484 21.433 1.00 49.14 O HETATM 2654 O HOH 301 24.743 70.175 -10.887 1.00 47.43 O HETATM 2655 O HOH 302 28.067 79.919 18.369 1.00 45.07 O HETATM 2656 O HOH 303 12.100 86.920 4.002 1.00 57.73 O HETATM 2657 O HOH 304 2.711 75.570 23.794 1.00 53.58 O HETATM 2658 O HOH 305 30.177 56.949 0.269 1.00 43.49 O HETATM 2659 O HOH 306 36.134 62.954 1.362 1.00 60.15 O HETATM 2660 O HOH 307 26.100 50.620 17.455 1.00 53.78 O HETATM 2661 O HOH 308 45.166 62.601 0.548 1.00 55.27 O HETATM 2662 O HOH 309 48.513 65.524 13.707 1.00 50.60 O HETATM 2663 O HOH 310 19.560 76.992 25.652 1.00 48.50 O HETATM 2664 O HOH 311 31.596 81.703 19.015 1.00 68.33 O HETATM 2665 O HOH 312 13.849 84.281 -3.342 1.00 52.41 O HETATM 2666 O HOH 313 22.770 52.518 19.241 1.00 54.62 O HETATM 2667 O HOH 314 25.588 56.511 23.606 1.00 42.77 O HETATM 2668 O HOH 315 10.618 77.950 -5.269 1.00 69.71 O HETATM 2669 O HOH 316 3.560 71.449 -3.141 1.00 48.40 O HETATM 2670 O HOH 317 16.940 60.896 -10.865 1.00 50.56 O HETATM 2671 O HOH 318 39.439 61.748 18.447 1.00 49.87 O HETATM 2672 O HOH 319 23.385 55.716 20.381 1.00 52.02 O HETATM 2673 O HOH 320 26.329 58.831 26.455 1.00 58.84 O HETATM 2674 O HOH 321 12.764 87.538 6.141 1.00 49.46 O HETATM 2675 O HOH 322 17.381 69.152 -11.430 1.00 62.84 O HETATM 2676 O HOH 323 35.892 57.980 11.909 1.00 53.88 O HETATM 2677 O HOH 324 15.731 71.445 -12.468 1.00 66.90 O HETATM 2678 O HOH 325 15.142 64.727 -11.674 1.00 58.44 O HETATM 2679 O HOH 326 45.584 66.955 17.102 1.00 28.23 O HETATM 2680 O HOH 327 8.371 46.965 -2.723 1.00 47.66 O HETATM 2681 O HOH 328 30.592 79.338 19.355 1.00 43.88 O HETATM 2682 O HOH 329 24.398 64.896 -10.583 1.00 42.91 O HETATM 2683 O HOH 330 18.877 81.085 23.637 1.00 51.37 O HETATM 2684 O HOH 331 42.356 65.416 2.475 1.00 48.42 O HETATM 2685 O HOH 332 12.804 63.532 -11.458 1.00 45.70 O HETATM 2686 O HOH 333 1.070 77.575 14.729 1.00 59.20 O HETATM 2687 O HOH 334 3.475 65.978 19.754 1.00 47.53 O HETATM 2688 O HOH 335 45.138 65.824 18.922 1.00 42.06 O HETATM 2689 O HOH 336 26.413 72.947 -11.695 1.00 52.71 O HETATM 2690 O HOH 337 21.390 67.532 -12.698 1.00 62.85 O HETATM 2691 O HOH 338 33.557 92.031 8.986 1.00 52.61 O HETATM 2692 O HOH 339 37.480 60.645 11.904 1.00 43.81 O HETATM 2693 O HOH 340 5.723 76.496 -0.797 1.00 55.62 O HETATM 2694 O HOH 341 -0.553 72.183 10.841 1.00 61.04 O HETATM 2695 O HOH 342 16.898 89.938 8.998 1.00 51.79 O HETATM 2696 O HOH 343 11.028 51.861 -8.401 1.00 56.59 O HETATM 2697 O HOH 344 32.187 92.975 1.047 1.00 59.74 O HETATM 2698 O HOH 345 20.487 86.910 -6.057 1.00 65.21 O HETATM 2699 O HOH 346 20.742 61.917 25.588 1.00 69.29 O HETATM 2700 O HOH 347 15.429 52.581 -10.563 1.00 53.74 O HETATM 2701 O HOH 348 12.694 53.187 -9.934 1.00 57.76 O HETATM 2702 O HOH 349 45.215 77.001 11.238 1.00 40.39 O HETATM 2703 O HOH 350 46.833 75.830 13.534 1.00 46.36 O HETATM 2704 O HOH 351 18.506 54.635 -8.444 1.00 36.69 O HETATM 2705 O1 UNN A 352 23.422 76.248 11.776 1.00 -0.57 O HETATM 2706 C7 UNN A 352 24.410 75.530 11.973 1.00 0.05 C HETATM 2707 O2 UNN A 352 24.512 74.481 12.624 1.00 -0.57 O HETATM 2708 C2 UNN A 352 25.672 75.973 11.230 1.00 0.08 C HETATM 2709 C3 UNN A 352 26.144 77.336 11.749 1.00 0.11 C HETATM 2710 C4 UNN A 352 27.082 77.243 12.906 1.00 -0.04 C HETATM 2711 C5 UNN A 352 27.872 76.177 13.062 1.00 -0.07 C HETATM 2712 C6 UNN A 352 27.803 75.068 12.137 1.00 -0.06 C HETATM 2713 C1 UNN A 352 26.779 74.943 11.261 1.00 0.02 C HETATM 2714 C8 UNN A 352 26.767 73.821 10.306 1.00 0.12 C HETATM 2715 O3 UNN A 352 25.786 73.752 9.523 1.00 -0.39 O HETATM 2716 C9 UNN A 352 27.887 72.800 10.293 1.00 0.03 C HETATM 2717 C10 UNN A 352 29.136 73.313 9.646 1.00 0.01 C HETATM 2718 C11 UNN A 352 30.204 72.296 9.284 1.00 0.04 C HETATM 2719 O5 UNN A 352 29.931 71.085 9.412 1.00 -0.57 O HETATM 2720 O4 UNN A 352 31.242 72.880 8.878 1.00 -0.57 O HETATM 2721 H UNN A 352 29.591 74.038 10.336 1.00 0.05 H HETATM 2722 H UNN A 352 28.841 73.826 8.719 1.00 0.05 H HETATM 2723 H UNN A 352 27.546 71.912 9.742 1.00 0.05 H HETATM 2724 H UNN A 352 28.119 72.520 11.331 1.00 0.05 H HETATM 2725 H UNN A 352 28.592 74.317 12.145 1.00 0.06 H HETATM 2726 H UNN A 352 28.574 76.143 13.893 1.00 0.04 H HETATM 2727 H UNN A 352 27.123 78.054 13.632 1.00 0.08 H HETATM 2728 O9 UNN A 352 26.712 78.078 10.715 1.00 -0.37 O HETATM 2729 H UNN A 352 26.906 78.954 11.025 1.00 0.21 H HETATM 2730 H UNN A 352 25.252 77.876 12.099 1.00 0.08 H HETATM 2731 H UNN A 352 25.393 76.105 10.174 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2705 2706 CONECT 2706 2705 2707 2708 CONECT 2707 2706 CONECT 2708 2706 2709 2713 2731 CONECT 2709 2708 2710 2728 2730 CONECT 2710 2709 2711 2727 CONECT 2711 2710 2712 2726 CONECT 2712 2711 2713 2725 CONECT 2713 2708 2712 2714 CONECT 2714 2713 2715 2716 CONECT 2715 2714 CONECT 2716 2714 2717 2723 2724 CONECT 2717 2716 2718 2721 2722 CONECT 2718 2717 2719 2720 CONECT 2719 2718 CONECT 2720 2718 CONECT 2721 2717 CONECT 2722 2717 CONECT 2723 2716 CONECT 2724 2716 CONECT 2725 2712 CONECT 2726 2711 CONECT 2727 2710 CONECT 2728 2709 2729 CONECT 2729 2728 CONECT 2730 2709 CONECT 2731 2708 MASTER 0 0 0 0 0 0 0 0 2730 1 31 20 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4myd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
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
4myd
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
E. Coli 2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate synthase (MenH)
Ligand Name
164
EC.Number
E.C.4.2.99.20
Resolution
1.37(Å)
Affinity (Kd/Ki/IC50)
Kd=28uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Biol.Chem. 2014, 289:15867-15879.
Ligand Properties
Formula
C
1
1
H
1
2
O
6
Molecular Weight
240.209
Exact Mass
240.063
No. of atoms
29
No. of bonds
29
Polar Surface Area
111.9
LOGP Value
2.32 (
Computed with XLOGP3
)
-0.02 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 1
Canonical SMILES
OC(=O)CCC(=O)C1=CC=C[C@H]([C@@H]1C(=O)O)O
InChI String
InChI=1S/C11H12O6/c12-7(4-5-9(14)15)6-2-1-3-8(13)10(6)11(16)17/h1-3,8,10,13H,4-5H2,(H,14,15)(H,16,17)/t8-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P37355
Entrez Gene ID
NCBI Entrez Gene ID:
946736
ASD
Information of known allosteric effects of PDB entries
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