Browse entries in the PDBbind-CN Database
HEADER 6D1G_COMPLEX COMPND 6D1G_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 229 GLY ASP GLN ARG PHE GLY ASP LEU VAL PHE ARG GLN LEU SEQRES 2 A 229 ALA PRO ASN VAL TRP GLN HIS THR SER TYR LEU ASP MET SEQRES 3 A 229 PRO GLY PHE GLY ALA VAL ALA SER ASN GLY LEU ILE VAL SEQRES 4 A 229 ARG ASP GLY GLY ARG VAL LEU VAL VAL ASP THR ALA TRP SEQRES 5 A 229 THR ASP ASP GLN THR ALA GLN ILE LEU ASN TRP ILE LYS SEQRES 6 A 229 GLN GLU ILE ASN LEU PRO VAL ALA LEU ALA VAL VAL THR SEQRES 7 A 229 HIS ALA HIS GLN ASP LYS MET GLY GLY MET ASP ALA LEU SEQRES 8 A 229 HIS ALA ALA GLY ILE ALA THR TYR ALA ASN ALA LEU SER SEQRES 9 A 229 ASN GLN LEU ALA PRO GLN GLU GLY MET VAL ALA ALA GLN SEQRES 10 A 229 HIS SER LEU THR PHE ALA ALA ASN GLY TRP VAL GLU PRO SEQRES 11 A 229 ALA THR ALA PRO ASN PHE GLY PRO LEU LYS VAL PHE TYR SEQRES 12 A 229 PRO GLY PRO GLY HIS THR SER ASP ASN ILE THR VAL GLY SEQRES 13 A 229 ILE ASP GLY THR ASP ILE ALA PHE GLY GLY CYS LEU ILE SEQRES 14 A 229 LYS ASP SER LYS ALA LYS SER LEU GLY ASN LEU GLY ASP SEQRES 15 A 229 ALA ASP THR GLU HIS TYR ALA ALA SER ALA ARG ALA PHE SEQRES 16 A 229 GLY ALA ALA PHE PRO LYS ALA SER MET ILE VAL MET SER SEQRES 17 A 229 HIS SER ALA PRO ASP SER ARG ALA ALA ILE THR HIS THR SEQRES 18 A 229 ALA ARG MET ALA ASP LYS LEU ARG HET ZN A 1 1 HET ZN A 2 1 HET YKG A 570 26 ATOM 1 N GLY A 42 43.484 0.258 69.529 1.00 31.73 N ATOM 2 CA GLY A 42 44.786 0.087 70.149 1.00 31.15 C ATOM 3 C GLY A 42 45.949 0.429 69.236 1.00 29.73 C ATOM 4 O GLY A 42 46.720 -0.444 68.841 1.00 30.90 O ATOM 5 HN3 GLY A 42 43.415 -0.360 68.695 1.00 0.00 H ATOM 6 HN2 GLY A 42 43.368 1.250 69.238 1.00 0.00 H ATOM 7 HN1 GLY A 42 42.741 0.006 70.211 1.00 0.00 H ATOM 8 N ASP A 43 46.072 1.707 68.893 1.00 26.76 N ATOM 9 CA ASP A 43 47.181 2.155 68.065 1.00 24.24 C ATOM 10 C ASP A 43 48.468 2.189 68.879 1.00 22.23 C ATOM 11 O ASP A 43 48.475 2.574 70.051 1.00 22.65 O ATOM 12 CB ASP A 43 46.892 3.544 67.502 1.00 24.34 C ATOM 13 CG ASP A 43 45.880 3.516 66.376 1.00 25.36 C ATOM 14 OD1 ASP A 43 45.570 2.411 65.884 1.00 25.79 O ATOM 15 OD2 ASP A 43 45.394 4.596 65.984 1.00 26.22 O ATOM 16 H ASP A 43 45.366 2.396 69.221 1.00 0.00 H ATOM 17 N GLN A 44 49.562 1.788 68.246 1.00 19.79 N ATOM 18 CA GLN A 44 50.882 1.781 68.864 1.00 19.06 C ATOM 19 C GLN A 44 51.762 2.752 68.089 1.00 17.08 C ATOM 20 O GLN A 44 52.061 2.520 66.914 1.00 15.82 O ATOM 21 CB GLN A 44 51.477 0.373 68.853 1.00 20.97 C ATOM 22 CG GLN A 44 52.803 0.259 69.587 1.00 23.39 C ATOM 23 CD GLN A 44 53.502 -1.070 69.352 1.00 24.99 C ATOM 24 OE1 GLN A 44 52.974 -1.954 68.680 1.00 24.82 O ATOM 25 NE2 GLN A 44 54.704 -1.210 69.900 1.00 26.16 N ATOM 26 HE22 GLN A 44 55.113 -0.436 70.461 1.00 0.00 H ATOM 27 HE21 GLN A 44 55.236 -2.094 69.768 1.00 0.00 H ATOM 28 H GLN A 44 49.474 1.463 67.262 1.00 0.00 H ATOM 29 N ARG A 45 52.149 3.847 68.735 1.00 16.31 N ATOM 30 CA ARG A 45 53.104 4.775 68.149 1.00 15.74 C ATOM 31 C ARG A 45 54.502 4.189 68.296 1.00 15.81 C ATOM 32 O ARG A 45 54.902 3.779 69.389 1.00 17.91 O ATOM 33 CB ARG A 45 53.015 6.143 68.837 1.00 16.39 C ATOM 34 CG ARG A 45 51.655 6.845 68.692 1.00 16.79 C ATOM 35 CD ARG A 45 51.705 8.329 69.071 1.00 16.82 C ATOM 36 NE ARG A 45 52.059 8.530 70.473 1.00 16.07 N ATOM 37 CZ ARG A 45 51.193 8.507 71.482 1.00 15.80 C ATOM 38 NH1 ARG A 45 51.617 8.704 72.715 1.00 14.67 N ATOM 39 NH2 ARG A 45 49.905 8.298 71.266 1.00 16.93 N ATOM 40 HE ARG A 45 53.059 8.703 70.699 1.00 0.00 H ATOM 41 HH12 ARG A 45 50.942 8.687 73.506 1.00 0.00 H ATOM 42 HH11 ARG A 45 52.626 8.877 72.896 1.00 0.00 H ATOM 43 HH22 ARG A 45 49.239 8.283 72.065 1.00 0.00 H ATOM 44 HH21 ARG A 45 49.558 8.149 70.297 1.00 0.00 H ATOM 45 H ARG A 45 51.761 4.045 69.679 1.00 0.00 H ATOM 46 N PHE A 46 55.235 4.130 67.190 1.00 14.21 N ATOM 47 CA PHE A 46 56.578 3.554 67.170 1.00 13.77 C ATOM 48 C PHE A 46 57.398 4.513 66.317 1.00 13.88 C ATOM 49 O PHE A 46 57.284 4.506 65.088 1.00 13.07 O ATOM 50 CB PHE A 46 56.534 2.149 66.576 1.00 13.98 C ATOM 51 CG PHE A 46 57.860 1.432 66.565 1.00 14.20 C ATOM 52 CD1 PHE A 46 58.289 0.716 67.670 1.00 15.32 C ATOM 53 CD2 PHE A 46 58.653 1.440 65.430 1.00 14.02 C ATOM 54 CE1 PHE A 46 59.502 0.036 67.647 1.00 15.60 C ATOM 55 CE2 PHE A 46 59.863 0.769 65.402 1.00 14.06 C ATOM 56 CZ PHE A 46 60.289 0.066 66.511 1.00 15.17 C ATOM 57 H PHE A 46 54.839 4.508 66.306 1.00 0.00 H ATOM 58 N GLY A 47 58.189 5.358 66.974 1.00 15.26 N ATOM 59 CA GLY A 47 58.812 6.457 66.260 1.00 16.03 C ATOM 60 C GLY A 47 57.748 7.296 65.581 1.00 15.07 C ATOM 61 O GLY A 47 56.737 7.675 66.185 1.00 15.73 O ATOM 62 H GLY A 47 58.359 5.232 67.992 1.00 0.00 H ATOM 63 N ASP A 48 57.953 7.557 64.293 1.00 13.47 N ATOM 64 CA ASP A 48 57.042 8.368 63.501 1.00 12.52 C ATOM 65 C ASP A 48 55.964 7.545 62.800 1.00 11.25 C ATOM 66 O ASP A 48 55.226 8.095 61.977 1.00 11.98 O ATOM 67 CB ASP A 48 57.831 9.192 62.480 1.00 13.20 C ATOM 68 CG ASP A 48 57.151 10.497 62.124 1.00 14.17 C ATOM 69 OD1 ASP A 48 56.680 11.202 63.040 1.00 14.20 O ATOM 70 OD2 ASP A 48 57.102 10.825 60.919 1.00 15.06 O ATOM 71 H ASP A 48 58.800 7.165 63.833 1.00 0.00 H ATOM 72 N LEU A 49 55.856 6.255 63.109 1.00 10.54 N ATOM 73 CA LEU A 49 54.903 5.355 62.481 1.00 10.37 C ATOM 74 C LEU A 49 53.865 4.908 63.504 1.00 9.81 C ATOM 75 O LEU A 49 54.023 5.098 64.712 1.00 9.96 O ATOM 76 CB LEU A 49 55.626 4.148 61.865 1.00 11.75 C ATOM 77 CG LEU A 49 56.362 4.413 60.535 1.00 13.29 C ATOM 78 CD1 LEU A 49 57.714 5.080 60.760 1.00 14.44 C ATOM 79 CD2 LEU A 49 56.527 3.129 59.741 1.00 14.26 C ATOM 80 H LEU A 49 56.488 5.870 63.840 1.00 0.00 H ATOM 81 N VAL A 50 52.767 4.345 63.004 1.00 9.65 N ATOM 82 CA VAL A 50 51.696 3.822 63.840 1.00 10.46 C ATOM 83 C VAL A 50 51.380 2.403 63.392 1.00 10.24 C ATOM 84 O VAL A 50 51.316 2.121 62.190 1.00 10.74 O ATOM 85 CB VAL A 50 50.436 4.715 63.792 1.00 11.97 C ATOM 86 CG1 VAL A 50 49.303 4.087 64.587 1.00 13.39 C ATOM 87 CG2 VAL A 50 50.749 6.116 64.314 1.00 12.85 C ATOM 88 H VAL A 50 52.670 4.276 61.971 1.00 0.00 H ATOM 89 N PHE A 51 51.214 1.505 64.359 1.00 10.64 N ATOM 90 CA PHE A 51 50.881 0.111 64.099 1.00 11.21 C ATOM 91 C PHE A 51 49.611 -0.247 64.853 1.00 11.82 C ATOM 92 O PHE A 51 49.409 0.192 65.987 1.00 13.23 O ATOM 93 CB PHE A 51 52.027 -0.819 64.513 1.00 11.47 C ATOM 94 CG PHE A 51 53.289 -0.564 63.760 1.00 10.54 C ATOM 95 CD1 PHE A 51 54.155 0.446 64.150 1.00 10.42 C ATOM 96 CD2 PHE A 51 53.586 -1.290 62.622 1.00 10.27 C ATOM 97 CE1 PHE A 51 55.309 0.705 63.428 1.00 11.03 C ATOM 98 CE2 PHE A 51 54.735 -1.035 61.901 1.00 9.94 C ATOM 99 CZ PHE A 51 55.595 -0.037 62.305 1.00 10.31 C ATOM 100 H PHE A 51 51.327 1.812 65.346 1.00 0.00 H ATOM 101 N ARG A 52 48.747 -1.034 64.218 1.00 11.94 N ATOM 102 CA ARG A 52 47.462 -1.398 64.805 1.00 12.99 C ATOM 103 C ARG A 52 47.169 -2.851 64.476 1.00 12.40 C ATOM 104 O ARG A 52 47.139 -3.232 63.301 1.00 12.25 O ATOM 105 CB ARG A 52 46.337 -0.494 64.282 1.00 15.12 C ATOM 106 CG ARG A 52 44.964 -0.827 64.851 1.00 17.45 C ATOM 107 CD ARG A 52 43.842 -0.121 64.094 1.00 19.81 C ATOM 108 NE ARG A 52 43.720 1.291 64.444 1.00 22.40 N ATOM 109 CZ ARG A 52 42.672 2.052 64.139 1.00 24.78 C ATOM 110 NH1 ARG A 52 41.642 1.537 63.479 1.00 25.42 N ATOM 111 NH2 ARG A 52 42.650 3.330 64.496 1.00 25.92 N ATOM 112 HE ARG A 52 44.504 1.731 64.966 1.00 0.00 H ATOM 113 HH12 ARG A 52 40.825 2.135 63.242 1.00 0.00 H ATOM 114 HH11 ARG A 52 41.652 0.536 63.199 1.00 0.00 H ATOM 115 HH22 ARG A 52 41.830 3.923 64.256 1.00 0.00 H ATOM 116 HH21 ARG A 52 43.453 3.739 65.015 1.00 0.00 H ATOM 117 H ARG A 52 48.994 -1.400 63.277 1.00 0.00 H ATOM 118 N GLN A 53 46.952 -3.663 65.507 1.00 12.98 N ATOM 119 CA GLN A 53 46.592 -5.052 65.282 1.00 12.90 C ATOM 120 C GLN A 53 45.149 -5.133 64.807 1.00 12.02 C ATOM 121 O GLN A 53 44.252 -4.525 65.399 1.00 13.47 O ATOM 122 CB GLN A 53 46.770 -5.865 66.559 1.00 14.43 C ATOM 123 CG GLN A 53 46.553 -7.348 66.323 1.00 16.22 C ATOM 124 CD GLN A 53 47.185 -8.205 67.387 1.00 18.46 C ATOM 125 OE1 GLN A 53 47.364 -7.767 68.521 1.00 20.39 O ATOM 126 NE2 GLN A 53 47.525 -9.436 67.032 1.00 19.04 N ATOM 127 HE22 GLN A 53 47.354 -9.763 66.060 1.00 0.00 H ATOM 128 HE21 GLN A 53 47.963 -10.075 67.726 1.00 0.00 H ATOM 129 H GLN A 53 47.040 -3.302 66.478 1.00 0.00 H ATOM 130 N LEU A 54 44.931 -5.882 63.728 1.00 11.16 N ATOM 131 CA LEU A 54 43.612 -6.055 63.138 1.00 11.13 C ATOM 132 C LEU A 54 43.046 -7.446 63.341 1.00 12.01 C ATOM 133 O LEU A 54 41.827 -7.616 63.327 1.00 13.65 O ATOM 134 CB LEU A 54 43.674 -5.797 61.630 1.00 11.06 C ATOM 135 CG LEU A 54 44.252 -4.454 61.190 1.00 11.54 C ATOM 136 CD1 LEU A 54 44.149 -4.340 59.683 1.00 11.44 C ATOM 137 CD2 LEU A 54 43.542 -3.286 61.861 1.00 12.72 C ATOM 138 H LEU A 54 45.740 -6.365 63.287 1.00 0.00 H ATOM 139 N ALA A 55 43.911 -8.433 63.510 1.00 12.63 N ATOM 140 CA ALA A 55 43.534 -9.825 63.702 1.00 13.57 C ATOM 141 C ALA A 55 44.696 -10.499 64.411 1.00 13.30 C ATOM 142 O ALA A 55 45.774 -9.905 64.530 1.00 12.55 O ATOM 143 CB ALA A 55 43.239 -10.503 62.351 1.00 14.51 C ATOM 144 H ALA A 55 44.924 -8.199 63.505 1.00 0.00 H ATOM 145 N PRO A 56 44.514 -11.727 64.909 1.00 14.24 N ATOM 146 CA PRO A 56 45.619 -12.382 65.637 1.00 14.85 C ATOM 147 C PRO A 56 46.959 -12.384 64.911 1.00 14.21 C ATOM 148 O PRO A 56 48.010 -12.287 65.563 1.00 15.47 O ATOM 149 CB PRO A 56 45.084 -13.800 65.858 1.00 15.78 C ATOM 150 CG PRO A 56 43.608 -13.597 66.006 1.00 16.07 C ATOM 151 CD PRO A 56 43.248 -12.474 65.063 1.00 15.29 C ATOM 152 N ASN A 57 46.956 -12.481 63.581 1.00 12.39 N ATOM 153 CA ASN A 57 48.177 -12.563 62.787 1.00 11.19 C ATOM 154 C ASN A 57 48.325 -11.393 61.813 1.00 9.41 C ATOM 155 O ASN A 57 49.113 -11.493 60.867 1.00 9.42 O ATOM 156 CB ASN A 57 48.217 -13.871 61.989 1.00 12.40 C ATOM 157 CG ASN A 57 48.439 -15.107 62.855 1.00 15.67 C ATOM 158 OD1 ASN A 57 48.057 -15.154 64.021 1.00 17.06 O ATOM 159 ND2 ASN A 57 49.063 -16.125 62.266 1.00 17.13 N ATOM 160 HD22 ASN A 57 49.370 -16.044 61.276 1.00 0.00 H ATOM 161 HD21 ASN A 57 49.243 -17.001 62.796 1.00 0.00 H ATOM 162 H ASN A 57 46.041 -12.499 63.087 1.00 0.00 H ATOM 163 N VAL A 58 47.566 -10.305 61.987 1.00 8.80 N ATOM 164 CA VAL A 58 47.539 -9.214 61.013 1.00 8.77 C ATOM 165 C VAL A 58 47.651 -7.869 61.717 1.00 7.97 C ATOM 166 O VAL A 58 46.876 -7.574 62.634 1.00 8.75 O ATOM 167 CB VAL A 58 46.271 -9.229 60.138 1.00 9.57 C ATOM 168 CG1 VAL A 58 46.365 -8.144 59.077 1.00 9.94 C ATOM 169 CG2 VAL A 58 46.081 -10.586 59.481 1.00 10.46 C ATOM 170 H VAL A 58 46.977 -10.233 62.841 1.00 0.00 H ATOM 171 N TRP A 59 48.568 -7.030 61.238 1.00 8.26 N ATOM 172 CA TRP A 59 48.717 -5.670 61.733 1.00 8.75 C ATOM 173 C TRP A 59 48.730 -4.706 60.556 1.00 8.15 C ATOM 174 O TRP A 59 49.163 -5.055 59.456 1.00 8.64 O ATOM 175 CB TRP A 59 50.029 -5.498 62.508 1.00 9.45 C ATOM 176 CG TRP A 59 50.163 -6.358 63.729 1.00 10.16 C ATOM 177 CD1 TRP A 59 50.008 -5.954 65.023 1.00 11.15 C ATOM 178 CD2 TRP A 59 50.527 -7.749 63.785 1.00 10.94 C ATOM 179 NE1 TRP A 59 50.229 -7.003 65.875 1.00 12.24 N ATOM 180 CE2 TRP A 59 50.552 -8.115 65.144 1.00 12.00 C ATOM 181 CE3 TRP A 59 50.827 -8.720 62.820 1.00 11.67 C ATOM 182 CZ2 TRP A 59 50.863 -9.405 65.565 1.00 13.41 C ATOM 183 CZ3 TRP A 59 51.136 -10.006 63.244 1.00 12.69 C ATOM 184 CH2 TRP A 59 51.148 -10.334 64.603 1.00 13.60 C ATOM 185 HE1 TRP A 59 50.162 -6.962 66.912 1.00 0.00 H ATOM 186 H TRP A 59 49.201 -7.359 60.482 1.00 0.00 H ATOM 187 N GLN A 60 48.252 -3.489 60.799 1.00 7.95 N ATOM 188 CA GLN A 60 48.322 -2.407 59.828 1.00 7.77 C ATOM 189 C GLN A 60 49.487 -1.487 60.184 1.00 7.96 C ATOM 190 O GLN A 60 49.616 -1.073 61.342 1.00 8.51 O ATOM 191 CB GLN A 60 47.013 -1.617 59.849 1.00 8.14 C ATOM 192 CG GLN A 60 46.960 -0.481 58.852 1.00 8.63 C ATOM 193 CD GLN A 60 45.664 0.304 58.943 1.00 9.53 C ATOM 194 OE1 GLN A 60 44.762 0.135 58.126 1.00 10.78 O ATOM 195 NE2 GLN A 60 45.558 1.156 59.953 1.00 9.94 N ATOM 196 HE22 GLN A 60 46.346 1.269 60.623 1.00 0.00 H ATOM 197 HE21 GLN A 60 44.687 1.711 60.076 1.00 0.00 H ATOM 198 H GLN A 60 47.810 -3.303 61.722 1.00 0.00 H ATOM 199 N HIS A 61 50.328 -1.170 59.199 1.00 7.19 N ATOM 200 CA HIS A 61 51.378 -0.174 59.357 1.00 7.50 C ATOM 201 C HIS A 61 50.949 1.139 58.723 1.00 7.07 C ATOM 202 O HIS A 61 50.297 1.141 57.676 1.00 7.03 O ATOM 203 CB HIS A 61 52.742 -0.653 58.832 1.00 6.90 C ATOM 204 CG HIS A 61 52.850 -0.870 57.345 1.00 6.15 C ATOM 205 ND1 HIS A 61 53.011 0.163 56.443 1.00 6.57 N ATOM 206 CD2 HIS A 61 52.974 -2.019 56.630 1.00 6.50 C ATOM 207 CE1 HIS A 61 53.195 -0.342 55.236 1.00 5.97 C ATOM 208 NE2 HIS A 61 53.171 -1.663 55.319 1.00 6.65 N ATOM 209 H HIS A 61 50.230 -1.653 58.283 1.00 0.00 H ATOM 210 N THR A 62 51.292 2.253 59.376 1.00 7.47 N ATOM 211 CA THR A 62 50.933 3.581 58.897 1.00 7.50 C ATOM 212 C THR A 62 52.150 4.482 58.963 1.00 7.32 C ATOM 213 O THR A 62 52.826 4.547 59.994 1.00 8.46 O ATOM 214 CB THR A 62 49.810 4.205 59.727 1.00 8.29 C ATOM 215 OG1 THR A 62 48.686 3.321 59.733 1.00 8.58 O ATOM 216 CG2 THR A 62 49.389 5.548 59.144 1.00 8.66 C ATOM 217 HG1 THR A 62 48.375 3.179 58.804 1.00 0.00 H ATOM 218 H THR A 62 51.835 2.169 60.259 1.00 0.00 H ATOM 219 N SER A 63 52.406 5.192 57.873 1.00 7.28 N ATOM 220 CA SER A 63 53.501 6.144 57.786 1.00 7.28 C ATOM 221 C SER A 63 52.981 7.427 57.153 1.00 7.46 C ATOM 222 O SER A 63 51.927 7.438 56.511 1.00 7.57 O ATOM 223 CB SER A 63 54.664 5.563 56.973 1.00 7.95 C ATOM 224 OG SER A 63 54.267 5.239 55.650 1.00 7.53 O ATOM 225 HG SER A 63 53.540 4.568 55.680 1.00 0.00 H ATOM 226 H SER A 63 51.795 5.062 57.042 1.00 0.00 H ATOM 227 N TYR A 64 53.747 8.511 57.318 1.00 7.77 N ATOM 228 CA TYR A 64 53.290 9.849 56.967 1.00 8.59 C ATOM 229 C TYR A 64 54.328 10.566 56.121 1.00 8.75 C ATOM 230 O TYR A 64 55.531 10.478 56.383 1.00 9.35 O ATOM 231 CB TYR A 64 53.026 10.689 58.235 1.00 9.38 C ATOM 232 CG TYR A 64 52.101 9.991 59.199 1.00 9.76 C ATOM 233 CD1 TYR A 64 52.594 9.094 60.139 1.00 9.95 C ATOM 234 CD2 TYR A 64 50.731 10.198 59.146 1.00 10.32 C ATOM 235 CE1 TYR A 64 51.750 8.427 60.998 1.00 10.40 C ATOM 236 CE2 TYR A 64 49.879 9.538 60.005 1.00 10.41 C ATOM 237 CZ TYR A 64 50.394 8.652 60.928 1.00 10.89 C ATOM 238 OH TYR A 64 49.553 7.991 61.792 1.00 11.93 O ATOM 239 HH TYR A 64 50.085 7.400 62.381 1.00 0.00 H ATOM 240 H TYR A 64 54.703 8.395 57.711 1.00 0.00 H ATOM 241 N LEU A 65 53.853 11.299 55.120 1.00 8.81 N ATOM 242 CA LEU A 65 54.719 12.139 54.311 1.00 9.89 C ATOM 243 C LEU A 65 54.078 13.509 54.210 1.00 11.54 C ATOM 244 O LEU A 65 52.931 13.637 53.766 1.00 12.25 O ATOM 245 CB LEU A 65 54.969 11.554 52.920 1.00 10.38 C ATOM 246 CG LEU A 65 55.990 12.363 52.109 1.00 11.82 C ATOM 247 CD1 LEU A 65 57.371 12.270 52.751 1.00 13.64 C ATOM 248 CD2 LEU A 65 56.043 11.905 50.663 1.00 13.42 C ATOM 249 H LEU A 65 52.835 11.271 54.910 1.00 0.00 H ATOM 250 N ASP A 66 54.817 14.521 54.651 1.00 14.54 N ATOM 251 CA ASP A 66 54.423 15.916 54.514 1.00 18.40 C ATOM 252 C ASP A 66 54.556 16.252 53.039 1.00 19.90 C ATOM 253 O ASP A 66 55.650 16.535 52.551 1.00 21.04 O ATOM 254 CB ASP A 66 55.349 16.799 55.350 1.00 22.20 C ATOM 255 CG ASP A 66 55.254 16.516 56.833 1.00 26.20 C ATOM 256 OD1 ASP A 66 54.221 16.866 57.446 1.00 27.75 O ATOM 257 OD2 ASP A 66 56.218 15.946 57.404 1.00 27.79 O ATOM 258 H ASP A 66 55.722 14.306 55.117 1.00 0.00 H ATOM 259 N MET A 67 53.442 16.203 52.316 1.00 21.19 N ATOM 260 CA MET A 67 53.426 16.522 50.901 1.00 23.67 C ATOM 261 C MET A 67 53.001 17.968 50.727 1.00 23.52 C ATOM 262 O MET A 67 51.853 18.303 51.058 1.00 24.30 O ATOM 263 CB MET A 67 52.440 15.610 50.192 1.00 25.64 C ATOM 264 CG MET A 67 52.589 15.589 48.693 1.00 27.30 C ATOM 265 SD MET A 67 51.583 14.273 48.014 1.00 28.15 S ATOM 266 CE MET A 67 52.176 12.905 48.997 1.00 28.42 C ATOM 267 H MET A 67 52.553 15.927 52.780 1.00 0.00 H ATOM 268 N PRO A 68 53.863 18.849 50.215 1.00 22.98 N ATOM 269 CA PRO A 68 53.480 20.261 50.062 1.00 23.68 C ATOM 270 C PRO A 68 52.231 20.386 49.204 1.00 25.20 C ATOM 271 O PRO A 68 52.173 19.876 48.082 1.00 26.31 O ATOM 272 CB PRO A 68 54.705 20.888 49.384 1.00 23.29 C ATOM 273 CG PRO A 68 55.836 19.964 49.711 1.00 23.11 C ATOM 274 CD PRO A 68 55.236 18.593 49.752 1.00 22.91 C ATOM 275 N GLY A 69 51.219 21.055 49.755 1.00 25.46 N ATOM 276 CA GLY A 69 49.934 21.195 49.105 1.00 25.63 C ATOM 277 C GLY A 69 48.901 20.163 49.502 1.00 25.60 C ATOM 278 O GLY A 69 47.735 20.296 49.107 1.00 26.26 O ATOM 279 H GLY A 69 51.358 21.493 50.688 1.00 0.00 H ATOM 280 N PHE A 70 49.286 19.139 50.271 1.00 24.54 N ATOM 281 CA PHE A 70 48.358 18.079 50.646 1.00 24.37 C ATOM 282 C PHE A 70 48.445 17.685 52.117 1.00 21.96 C ATOM 283 O PHE A 70 47.798 16.707 52.512 1.00 22.44 O ATOM 284 CB PHE A 70 48.559 16.835 49.769 1.00 26.39 C ATOM 285 CG PHE A 70 48.421 17.104 48.301 1.00 28.34 C ATOM 286 CD1 PHE A 70 47.176 17.084 47.697 1.00 29.26 C ATOM 287 CD2 PHE A 70 49.535 17.383 47.525 1.00 29.18 C ATOM 288 CE1 PHE A 70 47.043 17.334 46.344 1.00 29.80 C ATOM 289 CE2 PHE A 70 49.409 17.635 46.171 1.00 29.86 C ATOM 290 CZ PHE A 70 48.162 17.610 45.580 1.00 30.11 C ATOM 291 H PHE A 70 50.269 19.098 50.609 1.00 0.00 H ATOM 292 N GLY A 71 49.220 18.401 52.937 1.00 19.06 N ATOM 293 CA GLY A 71 49.352 18.064 54.340 1.00 16.62 C ATOM 294 C GLY A 71 50.230 16.839 54.532 1.00 13.77 C ATOM 295 O GLY A 71 50.880 16.350 53.613 1.00 13.24 O ATOM 296 H GLY A 71 49.740 19.219 52.560 1.00 0.00 H ATOM 297 N ALA A 72 50.230 16.338 55.765 1.00 12.17 N ATOM 298 CA ALA A 72 50.980 15.132 56.116 1.00 11.93 C ATOM 299 C ALA A 72 50.061 13.934 55.916 1.00 12.11 C ATOM 300 O ALA A 72 49.211 13.646 56.759 1.00 14.77 O ATOM 301 CB ALA A 72 51.462 15.214 57.558 1.00 12.62 C ATOM 302 H ALA A 72 49.679 16.820 56.503 1.00 0.00 H ATOM 303 N VAL A 73 50.258 13.213 54.814 1.00 10.19 N ATOM 304 CA VAL A 73 49.320 12.190 54.359 1.00 9.85 C ATOM 305 C VAL A 73 49.703 10.840 54.952 1.00 9.32 C ATOM 306 O VAL A 73 50.838 10.380 54.788 1.00 8.49 O ATOM 307 CB VAL A 73 49.297 12.125 52.825 1.00 10.93 C ATOM 308 CG1 VAL A 73 48.357 11.032 52.344 1.00 11.76 C ATOM 309 CG2 VAL A 73 48.911 13.476 52.233 1.00 12.45 C ATOM 310 H VAL A 73 51.117 13.386 54.253 1.00 0.00 H ATOM 311 N ALA A 74 48.754 10.209 55.640 1.00 9.43 N ATOM 312 CA ALA A 74 48.933 8.854 56.147 1.00 9.26 C ATOM 313 C ALA A 74 48.774 7.850 55.017 1.00 8.53 C ATOM 314 O ALA A 74 47.887 7.985 54.173 1.00 10.38 O ATOM 315 CB ALA A 74 47.849 8.546 57.181 1.00 10.31 C ATOM 316 H ALA A 74 47.855 10.699 55.822 1.00 0.00 H ATOM 317 N SER A 75 49.615 6.816 55.022 1.00 7.85 N ATOM 318 CA SER A 75 49.462 5.678 54.129 1.00 7.59 C ATOM 319 C SER A 75 49.581 4.392 54.931 1.00 6.82 C ATOM 320 O SER A 75 50.478 4.255 55.773 1.00 7.17 O ATOM 321 CB SER A 75 50.512 5.691 53.025 1.00 7.99 C ATOM 322 OG SER A 75 50.304 4.608 52.146 1.00 8.28 O ATOM 323 HG SER A 75 50.371 3.758 52.649 1.00 0.00 H ATOM 324 H SER A 75 50.412 6.823 55.690 1.00 0.00 H ATOM 325 N ASN A 76 48.680 3.450 54.653 1.00 6.55 N ATOM 326 CA ASN A 76 48.609 2.179 55.360 1.00 6.26 C ATOM 327 C ASN A 76 49.031 1.021 54.473 1.00 6.28 C ATOM 328 O ASN A 76 48.683 0.972 53.290 1.00 6.56 O ATOM 329 CB ASN A 76 47.172 1.869 55.790 1.00 7.17 C ATOM 330 CG ASN A 76 46.550 2.956 56.640 1.00 8.10 C ATOM 331 OD1 ASN A 76 47.204 3.582 57.473 1.00 8.49 O ATOM 332 ND2 ASN A 76 45.255 3.166 56.446 1.00 9.09 N ATOM 333 HD22 ASN A 76 44.740 2.614 55.731 1.00 0.00 H ATOM 334 HD21 ASN A 76 44.754 3.883 57.009 1.00 0.00 H ATOM 335 H ASN A 76 47.993 3.632 53.893 1.00 0.00 H ATOM 336 N GLY A 77 49.722 0.063 55.084 1.00 6.28 N ATOM 337 CA GLY A 77 49.915 -1.263 54.532 1.00 6.06 C ATOM 338 C GLY A 77 49.673 -2.321 55.582 1.00 6.21 C ATOM 339 O GLY A 77 49.119 -2.019 56.649 1.00 6.74 O ATOM 340 H GLY A 77 50.147 0.277 56.009 1.00 0.00 H ATOM 341 N LEU A 78 50.082 -3.558 55.298 1.00 5.86 N ATOM 342 CA LEU A 78 49.784 -4.679 56.178 1.00 6.05 C ATOM 343 C LEU A 78 51.029 -5.493 56.496 1.00 5.78 C ATOM 344 O LEU A 78 51.994 -5.527 55.727 1.00 5.89 O ATOM 345 CB LEU A 78 48.720 -5.616 55.593 1.00 7.46 C ATOM 346 CG LEU A 78 47.316 -5.012 55.541 1.00 9.24 C ATOM 347 CD1 LEU A 78 46.371 -5.902 54.754 1.00 10.89 C ATOM 348 CD2 LEU A 78 46.785 -4.778 56.943 1.00 10.08 C ATOM 349 H LEU A 78 50.626 -3.726 54.428 1.00 0.00 H ATOM 350 N ILE A 79 50.981 -6.143 57.657 1.00 6.54 N ATOM 351 CA ILE A 79 51.984 -7.093 58.118 1.00 6.84 C ATOM 352 C ILE A 79 51.228 -8.342 58.546 1.00 7.29 C ATOM 353 O ILE A 79 50.288 -8.254 59.346 1.00 7.81 O ATOM 354 CB ILE A 79 52.771 -6.519 59.311 1.00 7.56 C ATOM 355 CG1 ILE A 79 53.416 -5.181 58.935 1.00 7.98 C ATOM 356 CG2 ILE A 79 53.792 -7.535 59.810 1.00 8.21 C ATOM 357 CD1 ILE A 79 53.983 -4.432 60.129 1.00 8.39 C ATOM 358 H ILE A 79 50.169 -5.959 58.280 1.00 0.00 H ATOM 359 N VAL A 80 51.621 -9.496 58.010 1.00 7.16 N ATOM 360 CA VAL A 80 50.905 -10.744 58.257 1.00 7.26 C ATOM 361 C VAL A 80 51.897 -11.790 58.735 1.00 7.53 C ATOM 362 O VAL A 80 52.891 -12.062 58.054 1.00 8.05 O ATOM 363 CB VAL A 80 50.204 -11.243 56.980 1.00 7.94 C ATOM 364 CG1 VAL A 80 49.485 -12.560 57.247 1.00 9.21 C ATOM 365 CG2 VAL A 80 49.234 -10.192 56.465 1.00 8.62 C ATOM 366 H VAL A 80 52.462 -9.508 57.398 1.00 0.00 H ATOM 367 N ARG A 81 51.619 -12.402 59.883 1.00 7.91 N ATOM 368 CA ARG A 81 52.405 -13.552 60.300 1.00 9.16 C ATOM 369 C ARG A 81 51.753 -14.809 59.746 1.00 9.24 C ATOM 370 O ARG A 81 50.563 -15.055 59.976 1.00 10.29 O ATOM 371 CB ARG A 81 52.560 -13.661 61.817 1.00 10.60 C ATOM 372 CG ARG A 81 53.462 -14.845 62.197 1.00 10.60 C ATOM 373 CD ARG A 81 53.618 -15.050 63.696 1.00 11.96 C ATOM 374 NE ARG A 81 52.367 -15.398 64.363 1.00 12.74 N ATOM 375 CZ ARG A 81 51.755 -16.574 64.267 1.00 12.89 C ATOM 376 NH1 ARG A 81 52.276 -17.550 63.537 1.00 12.31 N ATOM 377 NH2 ARG A 81 50.613 -16.777 64.911 1.00 14.75 N ATOM 378 HE ARG A 81 51.921 -14.671 64.958 1.00 0.00 H ATOM 379 HH12 ARG A 81 51.788 -18.466 63.469 1.00 0.00 H ATOM 380 HH11 ARG A 81 53.173 -17.400 63.032 1.00 0.00 H ATOM 381 HH22 ARG A 81 50.131 -17.696 64.838 1.00 0.00 H ATOM 382 HH21 ARG A 81 50.200 -16.017 65.489 1.00 0.00 H ATOM 383 H ARG A 81 50.841 -12.058 60.481 1.00 0.00 H ATOM 384 N ASP A 82 52.541 -15.609 59.034 1.00 8.90 N ATOM 385 CA ASP A 82 52.113 -16.892 58.485 1.00 9.34 C ATOM 386 C ASP A 82 53.054 -17.942 59.065 1.00 9.51 C ATOM 387 O ASP A 82 54.143 -18.170 58.533 1.00 9.63 O ATOM 388 CB ASP A 82 52.209 -16.851 56.967 1.00 10.19 C ATOM 389 CG ASP A 82 51.888 -18.186 56.332 1.00 11.77 C ATOM 390 OD1 ASP A 82 51.043 -18.912 56.888 1.00 12.10 O ATOM 391 OD2 ASP A 82 52.484 -18.515 55.287 1.00 13.41 O ATOM 392 H ASP A 82 53.519 -15.303 58.858 1.00 0.00 H ATOM 393 N GLY A 83 52.640 -18.567 60.161 1.00 10.60 N ATOM 394 CA GLY A 83 53.497 -19.551 60.809 1.00 11.26 C ATOM 395 C GLY A 83 54.770 -18.891 61.302 1.00 10.92 C ATOM 396 O GLY A 83 54.738 -17.931 62.081 1.00 11.47 O ATOM 397 H GLY A 83 51.702 -18.354 60.557 1.00 0.00 H ATOM 398 N GLY A 84 55.910 -19.393 60.835 1.00 10.96 N ATOM 399 CA GLY A 84 57.193 -18.880 61.271 1.00 10.94 C ATOM 400 C GLY A 84 57.783 -17.788 60.409 1.00 10.95 C ATOM 401 O GLY A 84 58.989 -17.536 60.462 1.00 11.54 O ATOM 402 H GLY A 84 55.880 -20.169 60.143 1.00 0.00 H ATOM 403 N ARG A 85 56.962 -17.114 59.614 1.00 10.95 N ATOM 404 CA ARG A 85 57.490 -16.045 58.789 1.00 10.96 C ATOM 405 C ARG A 85 56.476 -14.915 58.702 1.00 9.25 C ATOM 406 O ARG A 85 55.300 -15.073 59.042 1.00 9.90 O ATOM 407 CB ARG A 85 57.879 -16.557 57.410 1.00 12.77 C ATOM 408 CG ARG A 85 56.688 -16.820 56.566 1.00 12.66 C ATOM 409 CD ARG A 85 56.805 -18.082 55.715 1.00 14.47 C ATOM 410 NE ARG A 85 55.559 -18.186 54.981 1.00 13.51 N ATOM 411 CZ ARG A 85 55.409 -17.925 53.689 1.00 11.98 C ATOM 412 NH1 ARG A 85 56.444 -17.608 52.916 1.00 12.10 N ATOM 413 NH2 ARG A 85 54.201 -17.972 53.182 1.00 12.18 N ATOM 414 HE ARG A 85 54.716 -18.489 55.509 1.00 0.00 H ATOM 415 HH12 ARG A 85 56.297 -17.408 51.906 1.00 0.00 H ATOM 416 HH11 ARG A 85 57.400 -17.560 53.322 1.00 0.00 H ATOM 417 HH22 ARG A 85 54.053 -17.772 52.172 1.00 0.00 H ATOM 418 HH21 ARG A 85 53.391 -18.209 53.790 1.00 0.00 H ATOM 419 H ARG A 85 55.950 -17.350 59.583 1.00 0.00 H ATOM 420 N VAL A 86 56.965 -13.767 58.251 1.00 7.97 N ATOM 421 CA VAL A 86 56.170 -12.553 58.137 1.00 7.33 C ATOM 422 C VAL A 86 56.114 -12.135 56.674 1.00 7.03 C ATOM 423 O VAL A 86 57.104 -12.250 55.942 1.00 7.38 O ATOM 424 CB VAL A 86 56.766 -11.442 59.027 1.00 7.97 C ATOM 425 CG1 VAL A 86 56.027 -10.140 58.852 1.00 8.14 C ATOM 426 CG2 VAL A 86 56.736 -11.882 60.482 1.00 9.34 C ATOM 427 H VAL A 86 57.964 -13.733 57.965 1.00 0.00 H ATOM 428 N LEU A 87 54.946 -11.654 56.254 1.00 6.53 N ATOM 429 CA LEU A 87 54.706 -11.169 54.905 1.00 6.56 C ATOM 430 C LEU A 87 54.247 -9.718 55.000 1.00 6.56 C ATOM 431 O LEU A 87 53.451 -9.363 55.878 1.00 7.86 O ATOM 432 CB LEU A 87 53.607 -11.996 54.238 1.00 7.23 C ATOM 433 CG LEU A 87 53.667 -13.512 54.455 1.00 8.80 C ATOM 434 CD1 LEU A 87 52.428 -14.198 53.880 1.00 8.90 C ATOM 435 CD2 LEU A 87 54.933 -14.106 53.879 1.00 9.54 C ATOM 436 H LEU A 87 54.158 -11.623 56.932 1.00 0.00 H ATOM 437 N VAL A 88 54.756 -8.861 54.119 1.00 5.62 N ATOM 438 CA VAL A 88 54.435 -7.438 54.163 1.00 6.09 C ATOM 439 C VAL A 88 53.699 -7.044 52.893 1.00 5.68 C ATOM 440 O VAL A 88 54.056 -7.482 51.796 1.00 5.87 O ATOM 441 CB VAL A 88 55.705 -6.580 54.363 1.00 7.43 C ATOM 442 CG1 VAL A 88 55.421 -5.082 54.209 1.00 8.28 C ATOM 443 CG2 VAL A 88 56.325 -6.856 55.736 1.00 8.23 C ATOM 444 H VAL A 88 55.398 -9.214 53.381 1.00 0.00 H ATOM 445 N VAL A 89 52.670 -6.218 53.048 1.00 4.91 N ATOM 446 CA VAL A 89 51.973 -5.596 51.931 1.00 5.54 C ATOM 447 C VAL A 89 52.242 -4.101 51.989 1.00 4.79 C ATOM 448 O VAL A 89 51.840 -3.430 52.952 1.00 5.33 O ATOM 449 CB VAL A 89 50.464 -5.873 51.965 1.00 6.09 C ATOM 450 CG1 VAL A 89 49.794 -5.228 50.753 1.00 7.41 C ATOM 451 CG2 VAL A 89 50.196 -7.372 51.993 1.00 6.97 C ATOM 452 H VAL A 89 52.347 -6.005 54.013 1.00 0.00 H ATOM 453 N ASP A 90 52.923 -3.593 50.955 1.00 5.00 N ATOM 454 CA ASP A 90 53.285 -2.187 50.736 1.00 5.29 C ATOM 455 C ASP A 90 54.440 -1.731 51.616 1.00 5.47 C ATOM 456 O ASP A 90 54.556 -2.141 52.776 1.00 5.51 O ATOM 457 CB ASP A 90 52.081 -1.243 50.869 1.00 5.73 C ATOM 458 CG ASP A 90 51.115 -1.386 49.720 1.00 7.15 C ATOM 459 OD1 ASP A 90 51.535 -1.871 48.654 1.00 7.75 O ATOM 460 OD2 ASP A 90 49.944 -1.013 49.889 1.00 8.21 O ATOM 461 H ASP A 90 53.230 -4.269 50.226 1.00 0.00 H ATOM 462 N THR A 91 55.311 -0.893 51.059 1.00 5.12 N ATOM 463 CA THR A 91 56.306 -0.210 51.871 1.00 5.81 C ATOM 464 C THR A 91 55.648 0.970 52.584 1.00 5.83 C ATOM 465 O THR A 91 54.456 1.258 52.409 1.00 6.17 O ATOM 466 CB THR A 91 57.509 0.246 51.031 1.00 5.57 C ATOM 467 OG1 THR A 91 57.163 1.362 50.203 1.00 5.82 O ATOM 468 CG2 THR A 91 58.031 -0.860 50.156 1.00 6.61 C ATOM 469 HG1 THR A 91 56.869 2.116 50.773 1.00 0.00 H ATOM 470 H THR A 91 55.280 -0.725 50.033 1.00 0.00 H ATOM 471 N ALA A 92 56.439 1.657 53.405 1.00 6.07 N ATOM 472 CA ALA A 92 56.116 3.007 53.833 1.00 6.59 C ATOM 473 C ALA A 92 56.515 3.990 52.733 1.00 6.67 C ATOM 474 O ALA A 92 57.039 3.605 51.683 1.00 6.75 O ATOM 475 CB ALA A 92 56.814 3.318 55.152 1.00 6.98 C ATOM 476 H ALA A 92 57.314 1.214 53.750 1.00 0.00 H ATOM 477 N TRP A 93 56.295 5.286 52.978 1.00 6.73 N ATOM 478 CA TRP A 93 56.664 6.273 51.972 1.00 6.83 C ATOM 479 C TRP A 93 58.160 6.284 51.672 1.00 6.84 C ATOM 480 O TRP A 93 58.552 6.583 50.539 1.00 7.61 O ATOM 481 CB TRP A 93 56.283 7.667 52.433 1.00 7.30 C ATOM 482 CG TRP A 93 54.834 7.981 52.592 1.00 7.40 C ATOM 483 CD1 TRP A 93 54.107 7.899 53.743 1.00 7.94 C ATOM 484 CD2 TRP A 93 53.967 8.554 51.610 1.00 6.84 C ATOM 485 NE1 TRP A 93 52.831 8.354 53.529 1.00 8.10 N ATOM 486 CE2 TRP A 93 52.723 8.771 52.229 1.00 7.36 C ATOM 487 CE3 TRP A 93 54.123 8.906 50.268 1.00 7.81 C ATOM 488 CZ2 TRP A 93 51.638 9.320 51.549 1.00 8.19 C ATOM 489 CZ3 TRP A 93 53.046 9.461 49.593 1.00 8.82 C ATOM 490 CH2 TRP A 93 51.818 9.653 50.235 1.00 9.39 C ATOM 491 HE1 TRP A 93 52.070 8.378 54.238 1.00 0.00 H ATOM 492 H TRP A 93 55.865 5.586 53.876 1.00 0.00 H ATOM 493 N THR A 94 59.012 6.024 52.666 1.00 6.74 N ATOM 494 CA THR A 94 60.448 6.208 52.492 1.00 7.29 C ATOM 495 C THR A 94 61.213 4.969 52.932 1.00 6.80 C ATOM 496 O THR A 94 60.704 4.102 53.650 1.00 6.59 O ATOM 497 CB THR A 94 60.991 7.410 53.280 1.00 8.53 C ATOM 498 OG1 THR A 94 60.964 7.096 54.677 1.00 8.58 O ATOM 499 CG2 THR A 94 60.183 8.671 52.990 1.00 9.40 C ATOM 500 HG1 THR A 94 61.312 7.865 55.194 1.00 0.00 H ATOM 501 H THR A 94 58.646 5.685 53.579 1.00 0.00 H ATOM 502 N ASP A 95 62.475 4.920 52.506 1.00 7.26 N ATOM 503 CA ASP A 95 63.365 3.850 52.938 1.00 7.63 C ATOM 504 C ASP A 95 63.526 3.843 54.455 1.00 7.46 C ATOM 505 O ASP A 95 63.445 2.787 55.092 1.00 7.46 O ATOM 506 CB ASP A 95 64.732 4.010 52.277 1.00 8.38 C ATOM 507 CG ASP A 95 64.707 3.733 50.785 1.00 9.34 C ATOM 508 OD1 ASP A 95 63.949 2.846 50.346 1.00 9.65 O ATOM 509 OD2 ASP A 95 65.496 4.392 50.059 1.00 12.31 O ATOM 510 H ASP A 95 62.828 5.653 51.858 1.00 0.00 H ATOM 511 N ASP A 96 63.766 5.017 55.057 1.00 8.26 N ATOM 512 CA ASP A 96 63.960 5.062 56.504 1.00 9.18 C ATOM 513 C ASP A 96 62.720 4.567 57.244 1.00 8.14 C ATOM 514 O ASP A 96 62.824 3.820 58.224 1.00 8.22 O ATOM 515 CB ASP A 96 64.299 6.486 56.952 1.00 12.13 C ATOM 516 CG ASP A 96 65.720 6.911 56.594 1.00 15.61 C ATOM 517 OD1 ASP A 96 66.530 6.064 56.161 1.00 16.45 O ATOM 518 OD2 ASP A 96 66.023 8.110 56.765 1.00 17.67 O ATOM 519 H ASP A 96 63.814 5.891 54.496 1.00 0.00 H ATOM 520 N GLN A 97 61.537 4.990 56.799 1.00 7.79 N ATOM 521 CA GLN A 97 60.314 4.525 57.444 1.00 7.72 C ATOM 522 C GLN A 97 60.143 3.024 57.271 1.00 6.93 C ATOM 523 O GLN A 97 59.662 2.329 58.179 1.00 7.38 O ATOM 524 CB GLN A 97 59.110 5.252 56.856 1.00 7.81 C ATOM 525 CG GLN A 97 59.022 6.722 57.196 1.00 8.74 C ATOM 526 CD GLN A 97 58.029 7.433 56.305 1.00 8.89 C ATOM 527 OE1 GLN A 97 57.490 6.839 55.377 1.00 8.80 O ATOM 528 NE2 GLN A 97 57.783 8.709 56.578 1.00 10.24 N ATOM 529 HE22 GLN A 97 58.264 9.172 57.376 1.00 0.00 H ATOM 530 HE21 GLN A 97 57.110 9.245 55.994 1.00 0.00 H ATOM 531 H GLN A 97 61.486 5.649 55.996 1.00 0.00 H ATOM 532 N THR A 98 60.488 2.513 56.091 1.00 6.94 N ATOM 533 CA THR A 98 60.343 1.090 55.827 1.00 6.54 C ATOM 534 C THR A 98 61.302 0.283 56.689 1.00 6.69 C ATOM 535 O THR A 98 60.923 -0.762 57.231 1.00 7.30 O ATOM 536 CB THR A 98 60.518 0.824 54.332 1.00 6.43 C ATOM 537 OG1 THR A 98 59.517 1.564 53.618 1.00 6.42 O ATOM 538 CG2 THR A 98 60.381 -0.646 54.002 1.00 6.90 C ATOM 539 HG1 THR A 98 59.626 2.530 53.805 1.00 0.00 H ATOM 540 H THR A 98 60.865 3.138 55.350 1.00 0.00 H ATOM 541 N ALA A 99 62.532 0.775 56.873 1.00 7.35 N ATOM 542 CA ALA A 99 63.429 0.130 57.824 1.00 8.05 C ATOM 543 C ALA A 99 62.840 0.132 59.230 1.00 8.31 C ATOM 544 O ALA A 99 63.031 -0.829 59.985 1.00 8.79 O ATOM 545 CB ALA A 99 64.804 0.799 57.801 1.00 9.61 C ATOM 546 H ALA A 99 62.846 1.612 56.341 1.00 0.00 H ATOM 547 N GLN A 100 62.096 1.183 59.589 1.00 8.72 N ATOM 548 CA GLN A 100 61.434 1.211 60.892 1.00 9.50 C ATOM 549 C GLN A 100 60.321 0.171 60.991 1.00 8.32 C ATOM 550 O GLN A 100 60.117 -0.419 62.060 1.00 8.71 O ATOM 551 CB GLN A 100 60.917 2.615 61.195 1.00 12.32 C ATOM 552 CG GLN A 100 61.995 3.543 61.719 1.00 16.36 C ATOM 553 CD GLN A 100 62.287 3.304 63.186 1.00 19.50 C ATOM 554 OE1 GLN A 100 62.767 2.239 63.575 1.00 19.56 O ATOM 555 NE2 GLN A 100 61.980 4.292 64.012 1.00 21.37 N ATOM 556 HE22 GLN A 100 61.576 5.175 63.639 1.00 0.00 H ATOM 557 HE21 GLN A 100 62.143 4.185 65.034 1.00 0.00 H ATOM 558 H GLN A 100 61.987 1.986 58.937 1.00 0.00 H ATOM 559 N ILE A 101 59.587 -0.072 59.899 1.00 7.66 N ATOM 560 CA ILE A 101 58.632 -1.182 59.896 1.00 7.88 C ATOM 561 C ILE A 101 59.349 -2.482 60.223 1.00 7.72 C ATOM 562 O ILE A 101 58.878 -3.283 61.041 1.00 7.62 O ATOM 563 CB ILE A 101 57.896 -1.287 58.547 1.00 7.93 C ATOM 564 CG1 ILE A 101 56.974 -0.097 58.318 1.00 8.89 C ATOM 565 CG2 ILE A 101 57.105 -2.604 58.486 1.00 8.37 C ATOM 566 CD1 ILE A 101 56.402 -0.045 56.914 1.00 9.20 C ATOM 567 H ILE A 101 59.694 0.526 59.055 1.00 0.00 H ATOM 568 N LEU A 102 60.504 -2.709 59.584 1.00 7.55 N ATOM 569 CA LEU A 102 61.234 -3.945 59.833 1.00 7.59 C ATOM 570 C LEU A 102 61.728 -4.012 61.273 1.00 7.99 C ATOM 571 O LEU A 102 61.759 -5.095 61.877 1.00 8.50 O ATOM 572 CB LEU A 102 62.366 -4.105 58.813 1.00 7.84 C ATOM 573 CG LEU A 102 61.930 -4.067 57.343 1.00 8.21 C ATOM 574 CD1 LEU A 102 63.127 -4.192 56.413 1.00 8.98 C ATOM 575 CD2 LEU A 102 60.903 -5.159 57.064 1.00 8.20 C ATOM 576 H LEU A 102 60.878 -2.007 58.914 1.00 0.00 H ATOM 577 N ASN A 103 62.110 -2.866 61.843 1.00 8.41 N ATOM 578 CA ASN A 103 62.501 -2.827 63.248 1.00 9.58 C ATOM 579 C ASN A 103 61.329 -3.199 64.144 1.00 9.65 C ATOM 580 O ASN A 103 61.475 -3.999 65.074 1.00 9.80 O ATOM 581 CB ASN A 103 63.022 -1.435 63.609 1.00 10.71 C ATOM 582 CG ASN A 103 64.320 -1.093 62.908 1.00 11.99 C ATOM 583 OD1 ASN A 103 65.055 -1.975 62.470 1.00 12.77 O ATOM 584 ND2 ASN A 103 64.613 0.198 62.807 1.00 12.27 N ATOM 585 HD22 ASN A 103 63.961 0.911 63.192 1.00 0.00 H ATOM 586 HD21 ASN A 103 65.494 0.496 62.343 1.00 0.00 H ATOM 587 H ASN A 103 62.129 -1.992 61.279 1.00 0.00 H ATOM 588 N TRP A 104 60.154 -2.622 63.880 1.00 9.31 N ATOM 589 CA TRP A 104 58.969 -2.983 64.655 1.00 9.54 C ATOM 590 C TRP A 104 58.685 -4.476 64.554 1.00 9.06 C ATOM 591 O TRP A 104 58.379 -5.126 65.560 1.00 9.19 O ATOM 592 CB TRP A 104 57.758 -2.166 64.185 1.00 9.73 C ATOM 593 CG TRP A 104 56.487 -2.475 64.942 1.00 10.21 C ATOM 594 CD1 TRP A 104 56.009 -1.825 66.045 1.00 11.12 C ATOM 595 CD2 TRP A 104 55.551 -3.521 64.661 1.00 10.43 C ATOM 596 NE1 TRP A 104 54.829 -2.399 66.463 1.00 12.16 N ATOM 597 CE2 TRP A 104 54.528 -3.444 65.630 1.00 11.38 C ATOM 598 CE3 TRP A 104 55.476 -4.517 63.683 1.00 10.81 C ATOM 599 CZ2 TRP A 104 53.446 -4.325 65.647 1.00 11.96 C ATOM 600 CZ3 TRP A 104 54.404 -5.391 63.704 1.00 11.78 C ATOM 601 CH2 TRP A 104 53.404 -5.287 64.677 1.00 12.66 C ATOM 602 HE1 TRP A 104 54.260 -2.090 67.277 1.00 0.00 H ATOM 603 H TRP A 104 60.082 -1.914 63.121 1.00 0.00 H ATOM 604 N ILE A 105 58.792 -5.041 63.349 1.00 8.60 N ATOM 605 CA ILE A 105 58.574 -6.476 63.179 1.00 8.60 C ATOM 606 C ILE A 105 59.556 -7.271 64.029 1.00 9.39 C ATOM 607 O ILE A 105 59.182 -8.244 64.695 1.00 9.48 O ATOM 608 CB ILE A 105 58.652 -6.867 61.693 1.00 7.97 C ATOM 609 CG1 ILE A 105 57.462 -6.279 60.935 1.00 7.96 C ATOM 610 CG2 ILE A 105 58.709 -8.380 61.544 1.00 8.17 C ATOM 611 CD1 ILE A 105 57.576 -6.369 59.433 1.00 8.01 C ATOM 612 H ILE A 105 59.033 -4.455 62.524 1.00 0.00 H ATOM 613 N LYS A 106 60.832 -6.878 64.002 1.00 9.62 N ATOM 614 CA LYS A 106 61.844 -7.579 64.784 1.00 10.44 C ATOM 615 C LYS A 106 61.493 -7.571 66.266 1.00 11.42 C ATOM 616 O LYS A 106 61.568 -8.608 66.936 1.00 11.28 O ATOM 617 CB LYS A 106 63.215 -6.940 64.550 1.00 10.85 C ATOM 618 CG LYS A 106 64.300 -7.405 65.511 1.00 12.05 C ATOM 619 CD LYS A 106 64.577 -8.890 65.360 1.00 13.40 C ATOM 620 CE LYS A 106 65.702 -9.333 66.283 1.00 14.66 C ATOM 621 NZ LYS A 106 65.954 -10.798 66.205 1.00 15.37 N ATOM 622 HZ1 LYS A 106 65.092 -11.312 66.478 1.00 0.00 H ATOM 623 HZ2 LYS A 106 66.217 -11.052 65.231 1.00 0.00 H ATOM 624 HZ3 LYS A 106 66.729 -11.050 66.852 1.00 0.00 H ATOM 625 H LYS A 106 61.107 -6.063 63.417 1.00 0.00 H ATOM 626 N GLN A 107 61.078 -6.416 66.788 1.00 12.48 N ATOM 627 CA GLN A 107 60.770 -6.304 68.210 1.00 14.06 C ATOM 628 C GLN A 107 59.485 -7.045 68.563 1.00 13.62 C ATOM 629 O GLN A 107 59.443 -7.807 69.536 1.00 13.60 O ATOM 630 CB GLN A 107 60.671 -4.827 68.593 1.00 15.95 C ATOM 631 CG GLN A 107 60.002 -4.551 69.930 1.00 17.79 C ATOM 632 CD GLN A 107 59.862 -3.065 70.206 1.00 19.45 C ATOM 633 OE1 GLN A 107 60.854 -2.338 70.264 1.00 20.24 O ATOM 634 NE2 GLN A 107 58.627 -2.606 70.372 1.00 20.03 N ATOM 635 HE22 GLN A 107 57.818 -3.257 70.315 1.00 0.00 H ATOM 636 HE21 GLN A 107 58.469 -1.595 70.559 1.00 0.00 H ATOM 637 H GLN A 107 60.972 -5.584 66.173 1.00 0.00 H ATOM 638 N GLU A 108 58.429 -6.849 67.776 1.00 13.39 N ATOM 639 CA GLU A 108 57.102 -7.304 68.170 1.00 14.41 C ATOM 640 C GLU A 108 56.752 -8.705 67.690 1.00 13.78 C ATOM 641 O GLU A 108 55.877 -9.346 68.285 1.00 15.60 O ATOM 642 CB GLU A 108 56.035 -6.306 67.700 1.00 16.61 C ATOM 643 CG GLU A 108 56.230 -4.894 68.257 1.00 20.21 C ATOM 644 CD GLU A 108 55.869 -4.768 69.735 1.00 23.78 C ATOM 645 OE1 GLU A 108 55.391 -5.754 70.335 1.00 25.60 O ATOM 646 OE2 GLU A 108 56.059 -3.671 70.300 1.00 24.85 O ATOM 647 H GLU A 108 58.553 -6.363 66.865 1.00 0.00 H ATOM 648 N ILE A 109 57.395 -9.197 66.638 1.00 11.57 N ATOM 649 CA ILE A 109 57.129 -10.525 66.100 1.00 10.97 C ATOM 650 C ILE A 109 58.368 -11.410 66.153 1.00 11.02 C ATOM 651 O ILE A 109 58.300 -12.571 66.575 1.00 11.98 O ATOM 652 CB ILE A 109 56.547 -10.459 64.670 1.00 10.67 C ATOM 653 CG1 ILE A 109 55.276 -9.605 64.647 1.00 11.45 C ATOM 654 CG2 ILE A 109 56.253 -11.857 64.158 1.00 11.05 C ATOM 655 CD1 ILE A 109 54.723 -9.378 63.248 1.00 11.88 C ATOM 656 H ILE A 109 58.120 -8.610 66.178 1.00 0.00 H ATOM 657 N ASN A 110 59.514 -10.876 65.727 1.00 10.58 N ATOM 658 CA ASN A 110 60.793 -11.574 65.827 1.00 11.14 C ATOM 659 C ASN A 110 60.811 -12.856 64.993 1.00 10.69 C ATOM 660 O ASN A 110 61.246 -13.917 65.446 1.00 11.42 O ATOM 661 CB ASN A 110 61.188 -11.833 67.282 1.00 12.74 C ATOM 662 CG ASN A 110 62.624 -12.250 67.418 1.00 14.33 C ATOM 663 OD1 ASN A 110 63.466 -11.860 66.609 1.00 14.10 O ATOM 664 ND2 ASN A 110 62.918 -13.059 68.431 1.00 15.14 N ATOM 665 HD22 ASN A 110 62.171 -13.361 69.089 1.00 0.00 H ATOM 666 HD21 ASN A 110 63.895 -13.390 68.566 1.00 0.00 H ATOM 667 H ASN A 110 59.496 -9.925 65.307 1.00 0.00 H ATOM 668 N LEU A 111 60.333 -12.746 63.759 1.00 10.78 N ATOM 669 CA LEU A 111 60.423 -13.790 62.755 1.00 10.86 C ATOM 670 C LEU A 111 60.872 -13.166 61.443 1.00 10.97 C ATOM 671 O LEU A 111 60.655 -11.972 61.215 1.00 10.99 O ATOM 672 CB LEU A 111 59.069 -14.484 62.558 1.00 11.29 C ATOM 673 CG LEU A 111 58.565 -15.299 63.752 1.00 11.79 C ATOM 674 CD1 LEU A 111 57.108 -15.680 63.545 1.00 12.37 C ATOM 675 CD2 LEU A 111 59.430 -16.537 63.977 1.00 12.72 C ATOM 676 H LEU A 111 59.865 -11.856 63.495 1.00 0.00 H ATOM 677 N PRO A 112 61.511 -13.943 60.569 1.00 10.86 N ATOM 678 CA PRO A 112 62.003 -13.375 59.308 1.00 10.71 C ATOM 679 C PRO A 112 60.865 -12.911 58.414 1.00 9.40 C ATOM 680 O PRO A 112 59.789 -13.513 58.378 1.00 9.83 O ATOM 681 CB PRO A 112 62.746 -14.546 58.657 1.00 12.23 C ATOM 682 CG PRO A 112 62.174 -15.770 59.308 1.00 14.02 C ATOM 683 CD PRO A 112 61.855 -15.368 60.710 1.00 12.51 C ATOM 684 N VAL A 113 61.121 -11.840 57.670 1.00 8.53 N ATOM 685 CA VAL A 113 60.182 -11.354 56.665 1.00 8.40 C ATOM 686 C VAL A 113 60.487 -12.066 55.351 1.00 8.28 C ATOM 687 O VAL A 113 61.511 -11.805 54.711 1.00 9.46 O ATOM 688 CB VAL A 113 60.254 -9.832 56.516 1.00 9.03 C ATOM 689 CG1 VAL A 113 59.272 -9.367 55.456 1.00 9.41 C ATOM 690 CG2 VAL A 113 59.982 -9.150 57.852 1.00 9.86 C ATOM 691 H VAL A 113 62.018 -11.333 57.809 1.00 0.00 H ATOM 692 N ALA A 114 59.598 -12.980 54.958 1.00 7.95 N ATOM 693 CA ALA A 114 59.852 -13.828 53.802 1.00 8.27 C ATOM 694 C ALA A 114 59.677 -13.095 52.483 1.00 8.42 C ATOM 695 O ALA A 114 60.354 -13.427 51.507 1.00 9.84 O ATOM 696 CB ALA A 114 58.940 -15.054 53.834 1.00 9.53 C ATOM 697 H ALA A 114 58.709 -13.089 55.486 1.00 0.00 H ATOM 698 N LEU A 115 58.762 -12.134 52.420 1.00 6.82 N ATOM 699 CA LEU A 115 58.515 -11.432 51.169 1.00 6.56 C ATOM 700 C LEU A 115 57.675 -10.203 51.446 1.00 5.70 C ATOM 701 O LEU A 115 57.021 -10.086 52.490 1.00 6.35 O ATOM 702 CB LEU A 115 57.798 -12.322 50.148 1.00 8.01 C ATOM 703 CG LEU A 115 56.413 -12.841 50.536 1.00 9.55 C ATOM 704 CD1 LEU A 115 55.315 -11.918 50.028 1.00 9.78 C ATOM 705 CD2 LEU A 115 56.220 -14.234 49.961 1.00 11.70 C ATOM 706 H LEU A 115 58.219 -11.882 53.270 1.00 0.00 H ATOM 707 N ALA A 116 57.683 -9.300 50.471 1.00 5.79 N ATOM 708 CA ALA A 116 56.778 -8.170 50.433 1.00 5.78 C ATOM 709 C ALA A 116 56.165 -8.083 49.051 1.00 5.31 C ATOM 710 O ALA A 116 56.832 -8.348 48.044 1.00 6.37 O ATOM 711 CB ALA A 116 57.518 -6.872 50.725 1.00 7.07 C ATOM 712 H ALA A 116 58.371 -9.410 49.699 1.00 0.00 H ATOM 713 N VAL A 117 54.897 -7.695 49.014 1.00 5.55 N ATOM 714 CA VAL A 117 54.210 -7.383 47.772 1.00 5.92 C ATOM 715 C VAL A 117 53.730 -5.940 47.859 1.00 5.27 C ATOM 716 O VAL A 117 53.224 -5.503 48.900 1.00 6.01 O ATOM 717 CB VAL A 117 53.053 -8.367 47.483 1.00 7.16 C ATOM 718 CG1 VAL A 117 52.031 -8.387 48.625 1.00 7.60 C ATOM 719 CG2 VAL A 117 52.404 -8.050 46.149 1.00 8.29 C ATOM 720 H VAL A 117 54.374 -7.611 49.909 1.00 0.00 H ATOM 721 N VAL A 118 53.922 -5.186 46.781 1.00 5.18 N ATOM 722 CA VAL A 118 53.579 -3.768 46.747 1.00 5.66 C ATOM 723 C VAL A 118 52.510 -3.559 45.685 1.00 5.59 C ATOM 724 O VAL A 118 52.501 -4.244 44.658 1.00 6.19 O ATOM 725 CB VAL A 118 54.827 -2.889 46.511 1.00 7.53 C ATOM 726 CG1 VAL A 118 55.817 -3.101 47.634 1.00 9.04 C ATOM 727 CG2 VAL A 118 55.454 -3.220 45.181 1.00 9.05 C ATOM 728 H VAL A 118 54.332 -5.623 45.931 1.00 0.00 H ATOM 729 N THR A 119 51.593 -2.621 45.944 1.00 5.29 N ATOM 730 CA THR A 119 50.309 -2.655 45.246 1.00 5.87 C ATOM 731 C THR A 119 50.145 -1.649 44.108 1.00 5.31 C ATOM 732 O THR A 119 49.149 -1.747 43.390 1.00 6.58 O ATOM 733 CB THR A 119 49.113 -2.627 46.225 1.00 6.24 C ATOM 734 OG1 THR A 119 49.121 -1.416 46.986 1.00 6.08 O ATOM 735 CG2 THR A 119 49.136 -3.845 47.151 1.00 7.54 C ATOM 736 HG1 THR A 119 49.963 -1.358 47.503 1.00 0.00 H ATOM 737 H THR A 119 51.792 -1.872 46.638 1.00 0.00 H ATOM 738 N HIS A 120 51.085 -0.718 43.907 1.00 5.60 N ATOM 739 CA HIS A 120 51.213 0.030 42.655 1.00 6.28 C ATOM 740 C HIS A 120 52.442 0.927 42.753 1.00 6.11 C ATOM 741 O HIS A 120 53.014 1.111 43.828 1.00 6.26 O ATOM 742 CB HIS A 120 49.971 0.824 42.209 1.00 6.85 C ATOM 743 CG HIS A 120 49.584 1.954 43.112 1.00 6.97 C ATOM 744 ND1 HIS A 120 48.811 1.779 44.240 1.00 7.68 N ATOM 745 CD2 HIS A 120 49.820 3.286 43.022 1.00 7.16 C ATOM 746 CE1 HIS A 120 48.597 2.951 44.812 1.00 7.47 C ATOM 747 NE2 HIS A 120 49.197 3.882 44.091 1.00 7.36 N ATOM 748 H HIS A 120 51.756 -0.516 44.676 1.00 0.00 H ATOM 749 N ALA A 121 52.800 1.536 41.620 1.00 6.43 N ATOM 750 CA ALA A 121 54.045 2.301 41.489 1.00 7.72 C ATOM 751 C ALA A 121 53.873 3.783 41.848 1.00 7.25 C ATOM 752 O ALA A 121 54.173 4.677 41.056 1.00 8.28 O ATOM 753 CB ALA A 121 54.612 2.134 40.083 1.00 8.72 C ATOM 754 H ALA A 121 52.170 1.465 40.796 1.00 0.00 H ATOM 755 N HIS A 122 53.417 4.035 43.077 1.00 6.82 N ATOM 756 CA HIS A 122 53.473 5.357 43.688 1.00 6.66 C ATOM 757 C HIS A 122 54.261 5.268 44.992 1.00 6.05 C ATOM 758 O HIS A 122 54.411 4.187 45.573 1.00 6.21 O ATOM 759 CB HIS A 122 52.073 5.928 43.987 1.00 7.64 C ATOM 760 CG HIS A 122 51.353 6.483 42.791 1.00 8.97 C ATOM 761 ND1 HIS A 122 49.977 6.594 42.739 1.00 8.78 N ATOM 762 CD2 HIS A 122 51.814 6.991 41.623 1.00 10.20 C ATOM 763 CE1 HIS A 122 49.625 7.142 41.590 1.00 10.00 C ATOM 764 NE2 HIS A 122 50.718 7.386 40.892 1.00 10.87 N ATOM 765 H HIS A 122 53.003 3.253 43.623 1.00 0.00 H ATOM 766 N GLN A 123 54.741 6.429 45.460 1.00 6.10 N ATOM 767 CA GLN A 123 55.684 6.467 46.576 1.00 6.44 C ATOM 768 C GLN A 123 55.114 5.876 47.859 1.00 6.20 C ATOM 769 O GLN A 123 55.861 5.275 48.643 1.00 6.63 O ATOM 770 CB GLN A 123 56.155 7.899 46.828 1.00 7.57 C ATOM 771 CG GLN A 123 57.283 7.940 47.853 1.00 9.33 C ATOM 772 CD GLN A 123 57.683 9.319 48.271 1.00 12.35 C ATOM 773 OE1 GLN A 123 57.254 10.309 47.686 1.00 14.38 O ATOM 774 NE2 GLN A 123 58.525 9.397 49.297 1.00 13.71 N ATOM 775 HE22 GLN A 123 58.861 8.529 49.761 1.00 0.00 H ATOM 776 HE21 GLN A 123 58.847 10.326 49.636 1.00 0.00 H ATOM 777 H GLN A 123 54.436 7.321 45.020 1.00 0.00 H ATOM 778 N ASP A 124 53.816 6.086 48.131 1.00 6.17 N ATOM 779 CA ASP A 124 53.240 5.555 49.366 1.00 7.01 C ATOM 780 C ASP A 124 53.309 4.036 49.440 1.00 6.09 C ATOM 781 O ASP A 124 53.297 3.485 50.542 1.00 6.55 O ATOM 782 CB ASP A 124 51.801 6.087 49.689 1.00 7.57 C ATOM 783 CG ASP A 124 50.769 5.980 48.499 1.00 9.16 C ATOM 784 OD1 ASP A 124 51.238 5.839 47.366 1.00 9.21 O ATOM 785 OD2 ASP A 124 49.485 6.104 48.667 1.00 11.19 O ATOM 786 H ASP A 124 53.223 6.624 47.467 1.00 0.00 H ATOM 787 N LYS A 125 53.369 3.351 48.296 1.00 6.00 N ATOM 788 CA LYS A 125 53.357 1.892 48.241 1.00 6.52 C ATOM 789 C LYS A 125 54.709 1.284 47.905 1.00 5.74 C ATOM 790 O LYS A 125 54.960 0.132 48.277 1.00 6.10 O ATOM 791 CB LYS A 125 52.339 1.389 47.195 1.00 7.46 C ATOM 792 CG LYS A 125 51.018 2.151 47.160 1.00 8.00 C ATOM 793 CD LYS A 125 50.022 1.697 48.222 1.00 8.18 C ATOM 794 CE LYS A 125 50.275 2.285 49.608 1.00 7.71 C ATOM 795 NZ LYS A 125 49.430 1.609 50.641 1.00 8.13 N ATOM 796 HZ1 LYS A 125 48.426 1.736 50.403 1.00 0.00 H ATOM 797 HZ2 LYS A 125 49.657 0.594 50.663 1.00 0.00 H ATOM 798 HZ3 LYS A 125 49.622 2.028 51.573 1.00 0.00 H ATOM 799 H LYS A 125 53.427 3.881 47.403 1.00 0.00 H ATOM 800 N MET A 126 55.583 2.009 47.195 1.00 5.76 N ATOM 801 CA MET A 126 56.858 1.462 46.752 1.00 5.83 C ATOM 802 C MET A 126 58.061 2.301 47.145 1.00 5.53 C ATOM 803 O MET A 126 59.189 1.924 46.808 1.00 5.88 O ATOM 804 CB MET A 126 56.879 1.254 45.229 1.00 6.30 C ATOM 805 CG MET A 126 56.001 0.127 44.773 1.00 6.24 C ATOM 806 SD MET A 126 56.007 -0.188 42.998 1.00 6.99 S ATOM 807 CE MET A 126 57.589 -1.002 42.742 1.00 6.81 C ATOM 808 H MET A 126 55.344 2.992 46.953 1.00 0.00 H ATOM 809 N GLY A 127 57.860 3.415 47.849 1.00 6.28 N ATOM 810 CA GLY A 127 58.957 4.316 48.142 1.00 6.87 C ATOM 811 C GLY A 127 60.075 3.704 48.962 1.00 6.85 C ATOM 812 O GLY A 127 61.194 4.227 48.941 1.00 8.18 O ATOM 813 H GLY A 127 56.904 3.640 48.192 1.00 0.00 H ATOM 814 N GLY A 128 59.797 2.624 49.688 1.00 6.33 N ATOM 815 CA GLY A 128 60.791 1.998 50.535 1.00 6.27 C ATOM 816 C GLY A 128 61.394 0.717 49.993 1.00 6.75 C ATOM 817 O GLY A 128 61.954 -0.066 50.766 1.00 7.00 O ATOM 818 H GLY A 128 58.840 2.219 49.646 1.00 0.00 H ATOM 819 N MET A 129 61.309 0.498 48.676 1.00 6.71 N ATOM 820 CA MET A 129 61.811 -0.740 48.087 1.00 6.94 C ATOM 821 C MET A 129 63.273 -0.998 48.447 1.00 6.89 C ATOM 822 O MET A 129 63.652 -2.135 48.761 1.00 7.79 O ATOM 823 CB MET A 129 61.640 -0.679 46.573 1.00 7.35 C ATOM 824 CG MET A 129 61.885 -1.988 45.879 1.00 7.43 C ATOM 825 SD MET A 129 60.720 -3.279 46.338 1.00 7.50 S ATOM 826 CE MET A 129 59.217 -2.619 45.610 1.00 8.35 C ATOM 827 H MET A 129 60.879 1.220 48.063 1.00 0.00 H ATOM 828 N ASP A 130 64.119 0.037 48.385 1.00 7.40 N ATOM 829 CA ASP A 130 65.539 -0.179 48.663 1.00 7.83 C ATOM 830 C ASP A 130 65.754 -0.712 50.077 1.00 7.57 C ATOM 831 O ASP A 130 66.660 -1.516 50.308 1.00 7.94 O ATOM 832 CB ASP A 130 66.339 1.116 48.470 1.00 8.07 C ATOM 833 CG ASP A 130 66.850 1.331 47.033 1.00 9.26 C ATOM 834 OD1 ASP A 130 66.870 0.390 46.220 1.00 10.36 O ATOM 835 OD2 ASP A 130 67.279 2.464 46.726 1.00 11.02 O ATOM 836 H ASP A 130 63.770 0.986 48.141 1.00 0.00 H ATOM 837 N ALA A 131 64.942 -0.272 51.039 1.00 7.76 N ATOM 838 CA ALA A 131 65.089 -0.772 52.403 1.00 8.01 C ATOM 839 C ALA A 131 64.763 -2.255 52.489 1.00 7.48 C ATOM 840 O ALA A 131 65.417 -3.000 53.224 1.00 7.65 O ATOM 841 CB ALA A 131 64.211 0.017 53.367 1.00 8.44 C ATOM 842 H ALA A 131 64.204 0.427 50.818 1.00 0.00 H ATOM 843 N LEU A 132 63.751 -2.704 51.752 1.00 6.83 N ATOM 844 CA LEU A 132 63.460 -4.134 51.721 1.00 7.20 C ATOM 845 C LEU A 132 64.614 -4.910 51.104 1.00 7.13 C ATOM 846 O LEU A 132 65.000 -5.972 51.609 1.00 7.67 O ATOM 847 CB LEU A 132 62.178 -4.390 50.926 1.00 7.38 C ATOM 848 CG LEU A 132 60.910 -3.740 51.470 1.00 8.00 C ATOM 849 CD1 LEU A 132 59.737 -4.057 50.556 1.00 7.66 C ATOM 850 CD2 LEU A 132 60.631 -4.195 52.896 1.00 8.78 C ATOM 851 H LEU A 132 63.170 -2.040 51.201 1.00 0.00 H ATOM 852 N HIS A 133 65.173 -4.394 50.012 1.00 7.21 N ATOM 853 CA HIS A 133 66.275 -5.084 49.362 1.00 7.47 C ATOM 854 C HIS A 133 67.509 -5.109 50.246 1.00 7.59 C ATOM 855 O HIS A 133 68.188 -6.138 50.336 1.00 8.54 O ATOM 856 CB HIS A 133 66.556 -4.431 48.019 1.00 8.05 C ATOM 857 CG HIS A 133 65.428 -4.601 47.060 1.00 9.34 C ATOM 858 ND1 HIS A 133 65.311 -3.870 45.900 1.00 10.06 N ATOM 859 CD2 HIS A 133 64.349 -5.417 47.103 1.00 9.95 C ATOM 860 CE1 HIS A 133 64.217 -4.240 45.259 1.00 10.38 C ATOM 861 NE2 HIS A 133 63.611 -5.173 45.972 1.00 10.23 N ATOM 862 H HIS A 133 64.821 -3.496 49.623 1.00 0.00 H ATOM 863 N ALA A 134 67.798 -3.998 50.927 1.00 7.99 N ATOM 864 CA ALA A 134 68.933 -3.975 51.843 1.00 8.68 C ATOM 865 C ALA A 134 68.778 -5.005 52.952 1.00 8.40 C ATOM 866 O ALA A 134 69.776 -5.545 53.439 1.00 9.86 O ATOM 867 CB ALA A 134 69.089 -2.579 52.437 1.00 9.21 C ATOM 868 H ALA A 134 67.213 -3.147 50.804 1.00 0.00 H ATOM 869 N ALA A 135 67.540 -5.299 53.345 1.00 8.38 N ATOM 870 CA ALA A 135 67.241 -6.270 54.382 1.00 9.02 C ATOM 871 C ALA A 135 67.204 -7.699 53.863 1.00 9.13 C ATOM 872 O ALA A 135 66.982 -8.618 54.658 1.00 9.95 O ATOM 873 CB ALA A 135 65.899 -5.931 55.033 1.00 9.48 C ATOM 874 H ALA A 135 66.747 -4.808 52.885 1.00 0.00 H ATOM 875 N GLY A 136 67.397 -7.911 52.561 1.00 8.83 N ATOM 876 CA GLY A 136 67.388 -9.252 52.004 1.00 9.35 C ATOM 877 C GLY A 136 66.013 -9.846 51.776 1.00 8.90 C ATOM 878 O GLY A 136 65.885 -11.074 51.684 1.00 10.68 O ATOM 879 H GLY A 136 67.557 -7.099 51.931 1.00 0.00 H ATOM 880 N ILE A 137 64.980 -9.020 51.664 1.00 8.12 N ATOM 881 CA ILE A 137 63.608 -9.492 51.536 1.00 7.71 C ATOM 882 C ILE A 137 63.241 -9.587 50.058 1.00 7.71 C ATOM 883 O ILE A 137 63.470 -8.646 49.290 1.00 8.85 O ATOM 884 CB ILE A 137 62.656 -8.551 52.293 1.00 8.03 C ATOM 885 CG1 ILE A 137 62.962 -8.567 53.796 1.00 8.79 C ATOM 886 CG2 ILE A 137 61.188 -8.892 52.023 1.00 8.21 C ATOM 887 CD1 ILE A 137 62.380 -7.388 54.552 1.00 8.95 C ATOM 888 H ILE A 137 65.157 -7.995 51.668 1.00 0.00 H ATOM 889 N ALA A 138 62.659 -10.718 49.659 1.00 7.43 N ATOM 890 CA ALA A 138 62.189 -10.890 48.289 1.00 7.86 C ATOM 891 C ALA A 138 60.970 -10.012 48.040 1.00 7.15 C ATOM 892 O ALA A 138 60.033 -10.006 48.840 1.00 7.72 O ATOM 893 CB ALA A 138 61.796 -12.347 48.071 1.00 8.59 C ATOM 894 H ALA A 138 62.537 -11.495 50.340 1.00 0.00 H ATOM 895 N THR A 139 60.961 -9.290 46.920 1.00 6.24 N ATOM 896 CA THR A 139 59.911 -8.317 46.660 1.00 6.78 C ATOM 897 C THR A 139 59.184 -8.623 45.358 1.00 6.79 C ATOM 898 O THR A 139 59.780 -9.094 44.383 1.00 6.55 O ATOM 899 CB THR A 139 60.481 -6.909 46.604 1.00 7.55 C ATOM 900 OG1 THR A 139 61.523 -6.863 45.621 1.00 8.20 O ATOM 901 CG2 THR A 139 61.025 -6.504 47.971 1.00 8.19 C ATOM 902 HG1 THR A 139 61.897 -5.947 45.581 1.00 0.00 H ATOM 903 H THR A 139 61.718 -9.424 46.219 1.00 0.00 H ATOM 904 N TYR A 140 57.882 -8.329 45.356 1.00 5.85 N ATOM 905 CA TYR A 140 56.970 -8.671 44.275 1.00 5.90 C ATOM 906 C TYR A 140 56.080 -7.476 43.979 1.00 5.82 C ATOM 907 O TYR A 140 55.645 -6.773 44.898 1.00 6.39 O ATOM 908 CB TYR A 140 56.057 -9.839 44.686 1.00 6.11 C ATOM 909 CG TYR A 140 56.842 -11.104 44.917 1.00 6.34 C ATOM 910 CD1 TYR A 140 57.492 -11.323 46.114 1.00 6.68 C ATOM 911 CD2 TYR A 140 56.965 -12.064 43.920 1.00 7.30 C ATOM 912 CE1 TYR A 140 58.263 -12.454 46.329 1.00 7.35 C ATOM 913 CE2 TYR A 140 57.733 -13.212 44.118 1.00 8.00 C ATOM 914 CZ TYR A 140 58.375 -13.400 45.325 1.00 8.19 C ATOM 915 OH TYR A 140 59.141 -14.528 45.532 1.00 10.31 O ATOM 916 HH TYR A 140 59.872 -14.556 44.865 1.00 0.00 H ATOM 917 H TYR A 140 57.495 -7.824 46.179 1.00 0.00 H ATOM 918 N ALA A 141 55.796 -7.266 42.696 1.00 5.90 N ATOM 919 CA ALA A 141 54.841 -6.252 42.271 1.00 6.46 C ATOM 920 C ALA A 141 54.242 -6.716 40.956 1.00 6.09 C ATOM 921 O ALA A 141 54.825 -7.541 40.255 1.00 6.82 O ATOM 922 CB ALA A 141 55.521 -4.896 42.040 1.00 6.58 C ATOM 923 H ALA A 141 56.271 -7.844 41.974 1.00 0.00 H ATOM 924 N ASN A 142 53.071 -6.178 40.618 1.00 6.33 N ATOM 925 CA ASN A 142 52.532 -6.335 39.269 1.00 6.73 C ATOM 926 C ASN A 142 53.633 -6.018 38.261 1.00 6.91 C ATOM 927 O ASN A 142 54.371 -5.043 38.419 1.00 6.90 O ATOM 928 CB ASN A 142 51.384 -5.324 39.138 1.00 7.70 C ATOM 929 CG ASN A 142 50.626 -5.408 37.821 1.00 8.32 C ATOM 930 OD1 ASN A 142 51.016 -6.090 36.885 1.00 9.18 O ATOM 931 ND2 ASN A 142 49.524 -4.670 37.754 1.00 8.81 N ATOM 932 HD22 ASN A 142 49.227 -4.104 38.574 1.00 0.00 H ATOM 933 HD21 ASN A 142 48.958 -4.659 36.882 1.00 0.00 H ATOM 934 H ASN A 142 52.532 -5.638 41.325 1.00 0.00 H ATOM 935 N ALA A 143 53.767 -6.865 37.238 1.00 7.30 N ATOM 936 CA ALA A 143 54.706 -6.585 36.153 1.00 8.48 C ATOM 937 C ALA A 143 54.601 -5.144 35.666 1.00 7.82 C ATOM 938 O ALA A 143 55.620 -4.499 35.394 1.00 7.99 O ATOM 939 CB ALA A 143 54.456 -7.546 34.988 1.00 9.49 C ATOM 940 H ALA A 143 53.197 -7.734 37.213 1.00 0.00 H ATOM 941 N LEU A 144 53.375 -4.623 35.540 1.00 7.78 N ATOM 942 CA LEU A 144 53.212 -3.254 35.062 1.00 8.36 C ATOM 943 C LEU A 144 53.788 -2.250 36.053 1.00 7.87 C ATOM 944 O LEU A 144 54.361 -1.229 35.648 1.00 7.99 O ATOM 945 CB LEU A 144 51.738 -2.965 34.773 1.00 8.92 C ATOM 946 CG LEU A 144 51.429 -1.559 34.246 1.00 9.88 C ATOM 947 CD1 LEU A 144 52.253 -1.204 32.994 1.00 10.78 C ATOM 948 CD2 LEU A 144 49.939 -1.414 33.984 1.00 11.14 C ATOM 949 H LEU A 144 52.540 -5.193 35.782 1.00 0.00 H ATOM 950 N SER A 145 53.628 -2.508 37.356 1.00 7.07 N ATOM 951 CA SER A 145 54.252 -1.649 38.360 1.00 6.79 C ATOM 952 C SER A 145 55.767 -1.614 38.203 1.00 6.94 C ATOM 953 O SER A 145 56.388 -0.549 38.316 1.00 7.45 O ATOM 954 CB SER A 145 53.909 -2.130 39.767 1.00 6.79 C ATOM 955 OG SER A 145 52.513 -2.198 40.000 1.00 6.79 O ATOM 956 HG SER A 145 52.116 -1.299 39.882 1.00 0.00 H ATOM 957 H SER A 145 53.057 -3.324 37.656 1.00 0.00 H ATOM 958 N ASN A 146 56.388 -2.777 37.969 1.00 6.80 N ATOM 959 CA ASN A 146 57.835 -2.809 37.795 1.00 7.59 C ATOM 960 C ASN A 146 58.256 -2.077 36.531 1.00 7.48 C ATOM 961 O ASN A 146 59.278 -1.381 36.523 1.00 8.04 O ATOM 962 CB ASN A 146 58.332 -4.251 37.802 1.00 8.04 C ATOM 963 CG ASN A 146 58.265 -4.858 39.172 1.00 7.29 C ATOM 964 OD1 ASN A 146 58.328 -4.140 40.172 1.00 7.55 O ATOM 965 ND2 ASN A 146 58.131 -6.176 39.239 1.00 7.66 N ATOM 966 HD22 ASN A 146 58.082 -6.739 38.366 1.00 0.00 H ATOM 967 HD21 ASN A 146 58.074 -6.647 40.165 1.00 0.00 H ATOM 968 H ASN A 146 55.838 -3.658 37.911 1.00 0.00 H ATOM 969 N GLN A 147 57.465 -2.193 35.466 1.00 8.66 N ATOM 970 CA GLN A 147 57.758 -1.459 34.240 1.00 9.87 C ATOM 971 C GLN A 147 57.664 0.051 34.457 1.00 9.34 C ATOM 972 O GLN A 147 58.497 0.813 33.948 1.00 9.82 O ATOM 973 CB GLN A 147 56.792 -1.913 33.148 1.00 11.41 C ATOM 974 CG GLN A 147 56.976 -1.222 31.815 1.00 15.11 C ATOM 975 CD GLN A 147 55.824 -1.496 30.863 1.00 18.91 C ATOM 976 OE1 GLN A 147 55.493 -2.647 30.593 1.00 21.20 O ATOM 977 NE2 GLN A 147 55.204 -0.436 30.360 1.00 20.35 N ATOM 978 HE22 GLN A 147 55.519 0.521 30.617 1.00 0.00 H ATOM 979 HE21 GLN A 147 54.403 -0.562 29.709 1.00 0.00 H ATOM 980 H GLN A 147 56.631 -2.813 35.509 1.00 0.00 H ATOM 981 N LEU A 148 56.660 0.498 35.215 1.00 8.20 N ATOM 982 CA LEU A 148 56.437 1.919 35.459 1.00 8.44 C ATOM 983 C LEU A 148 57.367 2.494 36.513 1.00 8.39 C ATOM 984 O LEU A 148 57.538 3.717 36.566 1.00 8.54 O ATOM 985 CB LEU A 148 54.999 2.141 35.932 1.00 8.81 C ATOM 986 CG LEU A 148 53.877 1.910 34.919 1.00 9.90 C ATOM 987 CD1 LEU A 148 52.527 1.958 35.609 1.00 11.25 C ATOM 988 CD2 LEU A 148 53.952 2.927 33.783 1.00 11.79 C ATOM 989 H LEU A 148 56.013 -0.192 35.647 1.00 0.00 H ATOM 990 N ALA A 149 57.956 1.649 37.353 1.00 8.17 N ATOM 991 CA ALA A 149 58.679 2.145 38.520 1.00 8.54 C ATOM 992 C ALA A 149 59.725 3.195 38.177 1.00 8.36 C ATOM 993 O ALA A 149 59.689 4.285 38.772 1.00 7.87 O ATOM 994 CB ALA A 149 59.237 0.972 39.339 1.00 9.50 C ATOM 995 H ALA A 149 57.901 0.625 37.177 1.00 0.00 H ATOM 996 N PRO A 150 60.661 2.958 37.251 1.00 8.64 N ATOM 997 CA PRO A 150 61.687 3.987 37.011 1.00 9.95 C ATOM 998 C PRO A 150 61.127 5.355 36.661 1.00 10.01 C ATOM 999 O PRO A 150 61.579 6.359 37.225 1.00 10.42 O ATOM 1000 CB PRO A 150 62.529 3.381 35.885 1.00 11.22 C ATOM 1001 CG PRO A 150 62.369 1.916 36.060 1.00 11.59 C ATOM 1002 CD PRO A 150 60.943 1.727 36.486 1.00 10.04 C ATOM 1003 N GLN A 151 60.144 5.432 35.759 1.00 9.26 N ATOM 1004 CA GLN A 151 59.617 6.740 35.377 1.00 10.32 C ATOM 1005 C GLN A 151 58.857 7.403 36.516 1.00 9.65 C ATOM 1006 O GLN A 151 58.750 8.637 36.553 1.00 10.35 O ATOM 1007 CB GLN A 151 58.747 6.637 34.119 1.00 11.03 C ATOM 1008 CG GLN A 151 57.360 6.018 34.330 1.00 12.60 C ATOM 1009 CD GLN A 151 56.752 5.478 33.046 1.00 14.43 C ATOM 1010 OE1 GLN A 151 57.289 4.558 32.437 1.00 15.81 O ATOM 1011 NE2 GLN A 151 55.621 6.040 32.638 1.00 15.00 N ATOM 1012 HE22 GLN A 151 55.200 6.818 33.185 1.00 0.00 H ATOM 1013 HE21 GLN A 151 55.156 5.702 31.771 1.00 0.00 H ATOM 1014 H GLN A 151 59.757 4.567 35.332 1.00 0.00 H ATOM 1015 N GLU A 152 58.322 6.615 37.445 1.00 8.12 N ATOM 1016 CA GLU A 152 57.647 7.163 38.612 1.00 8.27 C ATOM 1017 C GLU A 152 58.607 7.526 39.733 1.00 8.57 C ATOM 1018 O GLU A 152 58.156 7.991 40.786 1.00 9.80 O ATOM 1019 CB GLU A 152 56.607 6.171 39.140 1.00 8.55 C ATOM 1020 CG GLU A 152 55.548 5.784 38.131 1.00 9.93 C ATOM 1021 CD GLU A 152 54.734 6.978 37.681 1.00 11.71 C ATOM 1022 OE1 GLU A 152 54.524 7.901 38.501 1.00 12.63 O ATOM 1023 OE2 GLU A 152 54.302 6.989 36.509 1.00 13.75 O ATOM 1024 H GLU A 152 58.388 5.583 37.335 1.00 0.00 H ATOM 1025 N GLY A 153 59.909 7.331 39.536 1.00 8.15 N ATOM 1026 CA GLY A 153 60.872 7.606 40.579 1.00 8.68 C ATOM 1027 C GLY A 153 61.003 6.503 41.597 1.00 8.20 C ATOM 1028 O GLY A 153 61.580 6.736 42.663 1.00 9.45 O ATOM 1029 H GLY A 153 60.239 6.975 38.616 1.00 0.00 H ATOM 1030 N MET A 154 60.472 5.318 41.304 1.00 8.00 N ATOM 1031 CA MET A 154 60.501 4.172 42.199 1.00 8.35 C ATOM 1032 C MET A 154 61.596 3.201 41.771 1.00 7.91 C ATOM 1033 O MET A 154 62.017 3.163 40.611 1.00 9.16 O ATOM 1034 CB MET A 154 59.158 3.431 42.167 1.00 8.83 C ATOM 1035 CG MET A 154 57.956 4.246 42.602 1.00 8.88 C ATOM 1036 SD MET A 154 58.029 4.788 44.317 1.00 8.92 S ATOM 1037 CE MET A 154 58.332 6.524 44.104 1.00 9.32 C ATOM 1038 H MET A 154 60.009 5.205 40.380 1.00 0.00 H ATOM 1039 N VAL A 155 62.026 2.385 42.722 1.00 7.19 N ATOM 1040 CA VAL A 155 62.845 1.212 42.440 1.00 7.84 C ATOM 1041 C VAL A 155 61.906 0.026 42.228 1.00 7.79 C ATOM 1042 O VAL A 155 60.980 -0.191 43.016 1.00 8.66 O ATOM 1043 CB VAL A 155 63.819 0.950 43.602 1.00 9.19 C ATOM 1044 CG1 VAL A 155 64.573 -0.368 43.395 1.00 10.54 C ATOM 1045 CG2 VAL A 155 64.778 2.132 43.764 1.00 10.36 C ATOM 1046 H VAL A 155 61.769 2.589 43.709 1.00 0.00 H ATOM 1047 N ALA A 156 62.127 -0.733 41.156 1.00 7.25 N ATOM 1048 CA ALA A 156 61.279 -1.883 40.872 1.00 7.67 C ATOM 1049 C ALA A 156 61.459 -2.978 41.917 1.00 7.38 C ATOM 1050 O ALA A 156 62.532 -3.140 42.515 1.00 7.72 O ATOM 1051 CB ALA A 156 61.609 -2.460 39.495 1.00 8.85 C ATOM 1052 H ALA A 156 62.913 -0.502 40.515 1.00 0.00 H ATOM 1053 N ALA A 157 60.388 -3.740 42.131 1.00 7.36 N ATOM 1054 CA ALA A 157 60.518 -4.986 42.870 1.00 7.23 C ATOM 1055 C ALA A 157 61.353 -5.989 42.076 1.00 7.59 C ATOM 1056 O ALA A 157 61.558 -5.859 40.867 1.00 8.99 O ATOM 1057 CB ALA A 157 59.146 -5.583 43.160 1.00 7.45 C ATOM 1058 H ALA A 157 59.459 -3.444 41.770 1.00 0.00 H ATOM 1059 N GLN A 158 61.845 -7.003 42.783 1.00 7.34 N ATOM 1060 CA GLN A 158 62.702 -8.002 42.159 1.00 8.75 C ATOM 1061 C GLN A 158 61.926 -8.951 41.258 1.00 9.13 C ATOM 1062 O GLN A 158 62.492 -9.504 40.306 1.00 11.30 O ATOM 1063 CB GLN A 158 63.380 -8.813 43.248 1.00 9.88 C ATOM 1064 CG GLN A 158 64.377 -8.022 44.041 1.00 12.91 C ATOM 1065 CD GLN A 158 64.728 -8.698 45.342 1.00 14.58 C ATOM 1066 OE1 GLN A 158 63.978 -9.547 45.833 1.00 15.48 O ATOM 1067 NE2 GLN A 158 65.857 -8.315 45.921 1.00 16.32 N ATOM 1068 HE22 GLN A 158 66.456 -7.596 45.468 1.00 0.00 H ATOM 1069 HE21 GLN A 158 66.144 -8.734 46.829 1.00 0.00 H ATOM 1070 H GLN A 158 61.615 -7.083 43.794 1.00 0.00 H ATOM 1071 N HIS A 159 60.657 -9.185 41.562 1.00 8.02 N ATOM 1072 CA HIS A 159 59.862 -10.185 40.875 1.00 7.98 C ATOM 1073 C HIS A 159 58.562 -9.561 40.396 1.00 7.51 C ATOM 1074 O HIS A 159 57.987 -8.689 41.058 1.00 7.47 O ATOM 1075 CB HIS A 159 59.536 -11.317 41.835 1.00 8.54 C ATOM 1076 CG HIS A 159 60.747 -11.954 42.441 1.00 9.54 C ATOM 1077 ND1 HIS A 159 61.602 -12.762 41.724 1.00 12.00 N ATOM 1078 CD2 HIS A 159 61.252 -11.894 43.695 1.00 9.85 C ATOM 1079 CE1 HIS A 159 62.581 -13.172 42.511 1.00 11.86 C ATOM 1080 NE2 HIS A 159 62.388 -12.666 43.714 1.00 10.92 N ATOM 1081 H HIS A 159 60.214 -8.630 42.322 1.00 0.00 H ATOM 1082 N SER A 160 58.083 -10.045 39.257 1.00 7.91 N ATOM 1083 CA SER A 160 56.874 -9.534 38.630 1.00 7.99 C ATOM 1084 C SER A 160 55.737 -10.536 38.741 1.00 7.39 C ATOM 1085 O SER A 160 55.894 -11.714 38.386 1.00 9.04 O ATOM 1086 CB SER A 160 57.122 -9.219 37.157 1.00 8.67 C ATOM 1087 OG SER A 160 57.947 -8.081 37.029 1.00 9.49 O ATOM 1088 HG SER A 160 58.815 -8.252 37.473 1.00 0.00 H ATOM 1089 H SER A 160 58.594 -10.823 38.793 1.00 0.00 H ATOM 1090 N LEU A 161 54.592 -10.052 39.190 1.00 7.22 N ATOM 1091 CA LEU A 161 53.362 -10.816 39.179 1.00 7.33 C ATOM 1092 C LEU A 161 52.665 -10.610 37.846 1.00 7.84 C ATOM 1093 O LEU A 161 52.634 -9.501 37.310 1.00 8.67 O ATOM 1094 CB LEU A 161 52.449 -10.330 40.302 1.00 7.45 C ATOM 1095 CG LEU A 161 53.035 -10.372 41.711 1.00 8.39 C ATOM 1096 CD1 LEU A 161 52.022 -9.835 42.700 1.00 9.98 C ATOM 1097 CD2 LEU A 161 53.429 -11.795 42.069 1.00 9.06 C ATOM 1098 H LEU A 161 54.574 -9.083 39.567 1.00 0.00 H ATOM 1099 N THR A 162 52.118 -11.687 37.303 1.00 8.00 N ATOM 1100 CA THR A 162 51.250 -11.583 36.144 1.00 9.16 C ATOM 1101 C THR A 162 49.883 -12.135 36.514 1.00 8.55 C ATOM 1102 O THR A 162 49.731 -12.862 37.503 1.00 9.14 O ATOM 1103 CB THR A 162 51.840 -12.280 34.911 1.00 11.02 C ATOM 1104 OG1 THR A 162 51.993 -13.675 35.177 1.00 11.55 O ATOM 1105 CG2 THR A 162 53.191 -11.690 34.555 1.00 12.13 C ATOM 1106 HG1 THR A 162 52.374 -14.122 34.380 1.00 0.00 H ATOM 1107 H THR A 162 52.313 -12.622 37.714 1.00 0.00 H ATOM 1108 N PHE A 163 48.882 -11.785 35.710 1.00 9.64 N ATOM 1109 CA PHE A 163 47.497 -12.022 36.082 1.00 10.65 C ATOM 1110 C PHE A 163 46.729 -12.660 34.942 1.00 12.15 C ATOM 1111 O PHE A 163 46.922 -12.317 33.774 1.00 13.41 O ATOM 1112 CB PHE A 163 46.817 -10.713 36.516 1.00 10.83 C ATOM 1113 CG PHE A 163 47.441 -10.126 37.738 1.00 9.74 C ATOM 1114 CD1 PHE A 163 48.544 -9.296 37.633 1.00 10.21 C ATOM 1115 CD2 PHE A 163 46.986 -10.478 38.997 1.00 10.00 C ATOM 1116 CE1 PHE A 163 49.167 -8.804 38.764 1.00 10.07 C ATOM 1117 CE2 PHE A 163 47.602 -9.985 40.131 1.00 9.71 C ATOM 1118 CZ PHE A 163 48.699 -9.152 40.014 1.00 9.40 C ATOM 1119 H PHE A 163 49.095 -11.333 34.798 1.00 0.00 H ATOM 1120 N ALA A 164 45.847 -13.582 35.302 1.00 12.20 N ATOM 1121 CA ALA A 164 44.933 -14.162 34.341 1.00 13.42 C ATOM 1122 C ALA A 164 43.925 -13.111 33.887 1.00 14.15 C ATOM 1123 O ALA A 164 43.770 -12.053 34.498 1.00 14.00 O ATOM 1124 CB ALA A 164 44.194 -15.330 34.980 1.00 14.16 C ATOM 1125 H ALA A 164 45.811 -13.894 36.293 1.00 0.00 H ATOM 1126 N ALA A 165 43.215 -13.428 32.803 1.00 15.82 N ATOM 1127 CA ALA A 165 42.223 -12.498 32.276 1.00 17.23 C ATOM 1128 C ALA A 165 41.145 -12.175 33.303 1.00 16.94 C ATOM 1129 O ALA A 165 40.603 -11.063 33.300 1.00 18.07 O ATOM 1130 CB ALA A 165 41.602 -13.065 30.998 1.00 18.29 C ATOM 1131 H ALA A 165 43.370 -14.342 32.332 1.00 0.00 H ATOM 1132 N ASN A 166 40.826 -13.118 34.190 1.00 16.19 N ATOM 1133 CA ASN A 166 39.813 -12.883 35.214 1.00 15.48 C ATOM 1134 C ASN A 166 40.339 -12.120 36.428 1.00 14.67 C ATOM 1135 O ASN A 166 39.574 -11.892 37.371 1.00 15.22 O ATOM 1136 CB ASN A 166 39.132 -14.193 35.638 1.00 16.01 C ATOM 1137 CG ASN A 166 40.074 -15.157 36.350 1.00 16.55 C ATOM 1138 OD1 ASN A 166 41.195 -14.802 36.731 1.00 16.06 O ATOM 1139 ND2 ASN A 166 39.615 -16.390 36.539 1.00 17.83 N ATOM 1140 HD22 ASN A 166 38.665 -16.649 36.203 1.00 0.00 H ATOM 1141 HD21 ASN A 166 40.205 -17.096 37.023 1.00 0.00 H ATOM 1142 H ASN A 166 41.308 -14.039 34.151 1.00 0.00 H ATOM 1143 N GLY A 167 41.614 -11.727 36.439 1.00 13.58 N ATOM 1144 CA GLY A 167 42.158 -10.888 37.484 1.00 12.48 C ATOM 1145 C GLY A 167 42.984 -11.610 38.531 1.00 11.30 C ATOM 1146 O GLY A 167 43.782 -10.961 39.216 1.00 10.30 O ATOM 1147 H GLY A 167 42.240 -12.035 35.668 1.00 0.00 H ATOM 1148 N TRP A 168 42.817 -12.918 38.692 1.00 11.33 N ATOM 1149 CA TRP A 168 43.582 -13.609 39.721 1.00 10.97 C ATOM 1150 C TRP A 168 45.040 -13.753 39.299 1.00 10.34 C ATOM 1151 O TRP A 168 45.346 -13.999 38.130 1.00 10.61 O ATOM 1152 CB TRP A 168 42.966 -14.976 40.030 1.00 12.07 C ATOM 1153 CG TRP A 168 41.699 -14.859 40.822 1.00 13.19 C ATOM 1154 CD1 TRP A 168 40.432 -15.135 40.397 1.00 15.07 C ATOM 1155 CD2 TRP A 168 41.576 -14.405 42.176 1.00 14.01 C ATOM 1156 NE1 TRP A 168 39.533 -14.888 41.402 1.00 15.31 N ATOM 1157 CE2 TRP A 168 40.208 -14.438 42.505 1.00 15.02 C ATOM 1158 CE3 TRP A 168 42.490 -13.973 43.142 1.00 15.04 C ATOM 1159 CZ2 TRP A 168 39.729 -14.061 43.760 1.00 15.78 C ATOM 1160 CZ3 TRP A 168 42.013 -13.595 44.386 1.00 15.77 C ATOM 1161 CH2 TRP A 168 40.644 -13.636 44.682 1.00 15.92 C ATOM 1162 HE1 TRP A 168 38.504 -15.021 41.337 1.00 0.00 H ATOM 1163 H TRP A 168 42.149 -13.442 38.091 1.00 0.00 H ATOM 1164 N VAL A 169 45.945 -13.596 40.267 1.00 9.54 N ATOM 1165 CA VAL A 169 47.366 -13.749 39.983 1.00 8.76 C ATOM 1166 C VAL A 169 47.633 -15.134 39.399 1.00 9.32 C ATOM 1167 O VAL A 169 46.985 -16.129 39.765 1.00 10.49 O ATOM 1168 CB VAL A 169 48.201 -13.474 41.248 1.00 9.13 C ATOM 1169 CG1 VAL A 169 48.018 -14.568 42.300 1.00 10.28 C ATOM 1170 CG2 VAL A 169 49.675 -13.283 40.896 1.00 9.13 C ATOM 1171 H VAL A 169 45.634 -13.363 41.232 1.00 0.00 H ATOM 1172 N GLU A 170 48.564 -15.197 38.452 1.00 9.03 N ATOM 1173 CA GLU A 170 49.060 -16.476 37.965 1.00 10.82 C ATOM 1174 C GLU A 170 49.874 -17.091 39.092 1.00 9.97 C ATOM 1175 O GLU A 170 50.882 -16.501 39.509 1.00 9.22 O ATOM 1176 CB GLU A 170 49.924 -16.258 36.726 1.00 14.40 C ATOM 1177 CG GLU A 170 49.178 -15.660 35.531 1.00 19.38 C ATOM 1178 CD GLU A 170 48.311 -16.656 34.798 1.00 23.83 C ATOM 1179 OE1 GLU A 170 47.655 -16.249 33.811 1.00 25.41 O ATOM 1180 OE2 GLU A 170 48.277 -17.840 35.199 1.00 25.41 O ATOM 1181 H GLU A 170 48.945 -14.316 38.052 1.00 0.00 H ATOM 1182 N PRO A 171 49.468 -18.244 39.630 1.00 10.89 N ATOM 1183 CA PRO A 171 50.064 -18.720 40.890 1.00 11.39 C ATOM 1184 C PRO A 171 51.567 -18.933 40.839 1.00 9.99 C ATOM 1185 O PRO A 171 52.238 -18.753 41.861 1.00 9.87 O ATOM 1186 CB PRO A 171 49.306 -20.029 41.170 1.00 13.66 C ATOM 1187 CG PRO A 171 48.624 -20.374 39.901 1.00 15.45 C ATOM 1188 CD PRO A 171 48.348 -19.093 39.194 1.00 12.82 C ATOM 1189 N ALA A 172 52.122 -19.314 39.691 1.00 9.14 N ATOM 1190 CA ALA A 172 53.564 -19.524 39.622 1.00 9.30 C ATOM 1191 C ALA A 172 54.347 -18.246 39.881 1.00 8.27 C ATOM 1192 O ALA A 172 55.521 -18.321 40.265 1.00 8.80 O ATOM 1193 CB ALA A 172 53.970 -20.074 38.257 1.00 10.67 C ATOM 1194 H ALA A 172 51.531 -19.461 38.848 1.00 0.00 H ATOM 1195 N THR A 173 53.739 -17.077 39.655 1.00 7.78 N ATOM 1196 CA THR A 173 54.437 -15.813 39.869 1.00 7.43 C ATOM 1197 C THR A 173 54.371 -15.325 41.305 1.00 7.70 C ATOM 1198 O THR A 173 55.093 -14.384 41.653 1.00 8.40 O ATOM 1199 CB THR A 173 53.955 -14.714 38.899 1.00 7.81 C ATOM 1200 OG1 THR A 173 52.639 -14.253 39.239 1.00 8.08 O ATOM 1201 CG2 THR A 173 53.993 -15.209 37.454 1.00 8.78 C ATOM 1202 HG1 THR A 173 52.004 -15.011 39.196 1.00 0.00 H ATOM 1203 H THR A 173 52.754 -17.068 39.322 1.00 0.00 H ATOM 1204 N ALA A 174 53.563 -15.962 42.148 1.00 7.36 N ATOM 1205 CA ALA A 174 53.418 -15.578 43.550 1.00 7.39 C ATOM 1206 C ALA A 174 53.737 -16.770 44.449 1.00 7.21 C ATOM 1207 O ALA A 174 52.899 -17.201 45.248 1.00 8.00 O ATOM 1208 CB ALA A 174 52.016 -15.035 43.821 1.00 8.19 C ATOM 1209 H ALA A 174 53.010 -16.769 41.794 1.00 0.00 H ATOM 1210 N PRO A 175 54.940 -17.342 44.334 1.00 7.70 N ATOM 1211 CA PRO A 175 55.267 -18.519 45.145 1.00 8.40 C ATOM 1212 C PRO A 175 55.359 -18.151 46.616 1.00 7.36 C ATOM 1213 O PRO A 175 55.840 -17.075 46.982 1.00 7.38 O ATOM 1214 CB PRO A 175 56.638 -18.938 44.605 1.00 9.24 C ATOM 1215 CG PRO A 175 57.238 -17.656 44.136 1.00 9.24 C ATOM 1216 CD PRO A 175 56.099 -16.906 43.533 1.00 8.52 C ATOM 1217 N ASN A 176 54.912 -19.077 47.463 1.00 7.75 N ATOM 1218 CA ASN A 176 55.080 -18.968 48.912 1.00 8.66 C ATOM 1219 C ASN A 176 54.355 -17.765 49.502 1.00 8.10 C ATOM 1220 O ASN A 176 54.772 -17.220 50.524 1.00 8.82 O ATOM 1221 CB ASN A 176 56.558 -19.001 49.304 1.00 10.92 C ATOM 1222 CG ASN A 176 57.201 -20.310 48.924 1.00 13.47 C ATOM 1223 OD1 ASN A 176 56.729 -21.363 49.337 1.00 14.73 O ATOM 1224 ND2 ASN A 176 58.228 -20.261 48.085 1.00 16.29 N ATOM 1225 HD22 ASN A 176 58.593 -19.342 47.763 1.00 0.00 H ATOM 1226 HD21 ASN A 176 58.668 -21.142 47.750 1.00 0.00 H ATOM 1227 H ASN A 176 54.424 -19.911 47.079 1.00 0.00 H ATOM 1228 N PHE A 177 53.253 -17.358 48.878 1.00 7.71 N ATOM 1229 CA PHE A 177 52.470 -16.239 49.384 1.00 7.79 C ATOM 1230 C PHE A 177 51.568 -16.617 50.556 1.00 8.36 C ATOM 1231 O PHE A 177 50.912 -15.735 51.115 1.00 8.19 O ATOM 1232 CB PHE A 177 51.671 -15.587 48.253 1.00 7.71 C ATOM 1233 CG PHE A 177 52.382 -14.428 47.575 1.00 6.92 C ATOM 1234 CD1 PHE A 177 53.704 -14.529 47.153 1.00 7.45 C ATOM 1235 CD2 PHE A 177 51.717 -13.231 47.351 1.00 7.38 C ATOM 1236 CE1 PHE A 177 54.337 -13.461 46.521 1.00 7.78 C ATOM 1237 CE2 PHE A 177 52.355 -12.165 46.726 1.00 7.87 C ATOM 1238 CZ PHE A 177 53.659 -12.283 46.313 1.00 7.81 C ATOM 1239 H PHE A 177 52.945 -17.847 48.014 1.00 0.00 H ATOM 1240 N GLY A 178 51.522 -17.889 50.957 1.00 9.91 N ATOM 1241 CA GLY A 178 50.734 -18.287 52.099 1.00 10.73 C ATOM 1242 C GLY A 178 49.283 -17.878 51.956 1.00 11.05 C ATOM 1243 O GLY A 178 48.621 -18.185 50.962 1.00 12.51 O ATOM 1244 H GLY A 178 52.065 -18.608 50.437 1.00 0.00 H ATOM 1245 N PRO A 179 48.759 -17.151 52.944 1.00 10.15 N ATOM 1246 CA PRO A 179 47.346 -16.763 52.901 1.00 10.77 C ATOM 1247 C PRO A 179 47.059 -15.557 52.020 1.00 9.90 C ATOM 1248 O PRO A 179 45.889 -15.189 51.884 1.00 10.99 O ATOM 1249 CB PRO A 179 47.048 -16.443 54.370 1.00 12.26 C ATOM 1250 CG PRO A 179 48.334 -15.889 54.867 1.00 11.91 C ATOM 1251 CD PRO A 179 49.413 -16.704 54.186 1.00 11.12 C ATOM 1252 N LEU A 180 48.066 -14.915 51.429 1.00 8.98 N ATOM 1253 CA LEU A 180 47.819 -13.728 50.618 1.00 9.42 C ATOM 1254 C LEU A 180 47.273 -14.138 49.258 1.00 9.43 C ATOM 1255 O LEU A 180 47.908 -14.913 48.535 1.00 11.08 O ATOM 1256 CB LEU A 180 49.104 -12.937 50.422 1.00 9.25 C ATOM 1257 CG LEU A 180 49.792 -12.450 51.689 1.00 10.31 C ATOM 1258 CD1 LEU A 180 50.940 -11.546 51.300 1.00 10.82 C ATOM 1259 CD2 LEU A 180 48.829 -11.734 52.614 1.00 11.30 C ATOM 1260 H LEU A 180 49.039 -15.264 51.547 1.00 0.00 H ATOM 1261 N LYS A 181 46.110 -13.608 48.906 1.00 8.48 N ATOM 1262 CA LYS A 181 45.442 -13.898 47.642 1.00 8.94 C ATOM 1263 C LYS A 181 45.424 -12.606 46.839 1.00 8.33 C ATOM 1264 O LYS A 181 44.722 -11.655 47.202 1.00 9.48 O ATOM 1265 CB LYS A 181 44.023 -14.392 47.901 1.00 11.63 C ATOM 1266 CG LYS A 181 43.958 -15.691 48.682 1.00 15.05 C ATOM 1267 CD LYS A 181 42.530 -16.094 48.984 1.00 19.02 C ATOM 1268 CE LYS A 181 41.777 -16.543 47.736 1.00 21.30 C ATOM 1269 NZ LYS A 181 40.429 -17.102 48.056 1.00 22.75 N ATOM 1270 HZ1 LYS A 181 40.536 -17.926 48.681 1.00 0.00 H ATOM 1271 HZ2 LYS A 181 39.858 -16.375 48.533 1.00 0.00 H ATOM 1272 HZ3 LYS A 181 39.958 -17.393 47.176 1.00 0.00 H ATOM 1273 H LYS A 181 45.649 -12.950 49.567 1.00 0.00 H ATOM 1274 N VAL A 182 46.181 -12.568 45.747 1.00 8.19 N ATOM 1275 CA VAL A 182 46.421 -11.326 45.017 1.00 7.51 C ATOM 1276 C VAL A 182 45.511 -11.258 43.804 1.00 7.45 C ATOM 1277 O VAL A 182 45.453 -12.204 43.003 1.00 8.00 O ATOM 1278 CB VAL A 182 47.894 -11.192 44.605 1.00 8.25 C ATOM 1279 CG1 VAL A 182 48.134 -9.829 43.978 1.00 8.57 C ATOM 1280 CG2 VAL A 182 48.799 -11.409 45.802 1.00 9.48 C ATOM 1281 H VAL A 182 46.615 -13.448 45.402 1.00 0.00 H ATOM 1282 N PHE A 183 44.832 -10.124 43.650 1.00 7.42 N ATOM 1283 CA PHE A 183 43.820 -9.954 42.622 1.00 7.83 C ATOM 1284 C PHE A 183 44.012 -8.602 41.949 1.00 7.44 C ATOM 1285 O PHE A 183 44.137 -7.572 42.624 1.00 7.96 O ATOM 1286 CB PHE A 183 42.435 -10.017 43.269 1.00 9.33 C ATOM 1287 CG PHE A 183 41.300 -9.856 42.303 1.00 10.05 C ATOM 1288 CD1 PHE A 183 40.978 -10.873 41.416 1.00 10.90 C ATOM 1289 CD2 PHE A 183 40.541 -8.698 42.287 1.00 10.28 C ATOM 1290 CE1 PHE A 183 39.926 -10.731 40.527 1.00 12.10 C ATOM 1291 CE2 PHE A 183 39.488 -8.556 41.406 1.00 11.36 C ATOM 1292 CZ PHE A 183 39.181 -9.568 40.526 1.00 12.53 C ATOM 1293 H PHE A 183 45.034 -9.329 44.290 1.00 0.00 H ATOM 1294 N TYR A 184 44.029 -8.610 40.619 1.00 8.06 N ATOM 1295 CA TYR A 184 44.049 -7.386 39.836 1.00 8.45 C ATOM 1296 C TYR A 184 42.614 -7.078 39.448 1.00 9.26 C ATOM 1297 O TYR A 184 42.031 -7.823 38.652 1.00 9.66 O ATOM 1298 CB TYR A 184 44.908 -7.558 38.583 1.00 9.03 C ATOM 1299 CG TYR A 184 44.792 -6.377 37.644 1.00 9.70 C ATOM 1300 CD1 TYR A 184 45.208 -5.116 38.045 1.00 9.91 C ATOM 1301 CD2 TYR A 184 44.247 -6.514 36.373 1.00 10.97 C ATOM 1302 CE1 TYR A 184 45.102 -4.017 37.210 1.00 11.16 C ATOM 1303 CE2 TYR A 184 44.136 -5.418 35.522 1.00 11.78 C ATOM 1304 CZ TYR A 184 44.568 -4.170 35.949 1.00 11.79 C ATOM 1305 OH TYR A 184 44.462 -3.078 35.112 1.00 12.54 O ATOM 1306 HH TYR A 184 44.814 -2.275 35.572 1.00 0.00 H ATOM 1307 H TYR A 184 44.028 -9.524 40.122 1.00 0.00 H ATOM 1308 N PRO A 185 42.003 -6.022 39.982 1.00 9.43 N ATOM 1309 CA PRO A 185 40.571 -5.781 39.768 1.00 10.07 C ATOM 1310 C PRO A 185 40.248 -5.003 38.507 1.00 10.62 C ATOM 1311 O PRO A 185 39.061 -4.796 38.225 1.00 11.83 O ATOM 1312 CB PRO A 185 40.210 -4.941 41.001 1.00 10.17 C ATOM 1313 CG PRO A 185 41.440 -4.109 41.230 1.00 9.95 C ATOM 1314 CD PRO A 185 42.595 -5.035 40.905 1.00 9.54 C ATOM 1315 N GLY A 186 41.262 -4.570 37.761 1.00 10.32 N ATOM 1316 CA GLY A 186 41.073 -3.652 36.667 1.00 11.06 C ATOM 1317 C GLY A 186 41.630 -2.289 37.019 1.00 10.97 C ATOM 1318 O GLY A 186 41.927 -1.990 38.179 1.00 10.25 O ATOM 1319 H GLY A 186 42.223 -4.906 37.975 1.00 0.00 H ATOM 1320 N PRO A 187 41.769 -1.431 36.018 1.00 11.87 N ATOM 1321 CA PRO A 187 42.331 -0.100 36.265 1.00 11.99 C ATOM 1322 C PRO A 187 41.376 0.764 37.080 1.00 11.22 C ATOM 1323 O PRO A 187 40.159 0.733 36.888 1.00 11.35 O ATOM 1324 CB PRO A 187 42.545 0.462 34.857 1.00 13.75 C ATOM 1325 CG PRO A 187 41.614 -0.318 33.982 1.00 15.00 C ATOM 1326 CD PRO A 187 41.440 -1.664 34.601 1.00 13.35 C ATOM 1327 N GLY A 188 41.939 1.539 38.001 1.00 10.91 N ATOM 1328 CA GLY A 188 41.133 2.383 38.856 1.00 10.16 C ATOM 1329 C GLY A 188 41.915 3.575 39.354 1.00 9.82 C ATOM 1330 O GLY A 188 42.118 4.539 38.611 1.00 11.04 O ATOM 1331 H GLY A 188 42.973 1.539 38.109 1.00 0.00 H ATOM 1332 N HIS A 189 42.364 3.526 40.610 1.00 9.22 N ATOM 1333 CA HIS A 189 43.266 4.558 41.111 1.00 9.11 C ATOM 1334 C HIS A 189 44.486 4.694 40.206 1.00 8.52 C ATOM 1335 O HIS A 189 44.945 5.809 39.917 1.00 9.15 O ATOM 1336 CB HIS A 189 43.688 4.214 42.537 1.00 8.76 C ATOM 1337 CG HIS A 189 44.845 5.025 43.038 1.00 8.26 C ATOM 1338 ND1 HIS A 189 44.718 6.342 43.421 1.00 8.62 N ATOM 1339 CD2 HIS A 189 46.154 4.714 43.196 1.00 8.12 C ATOM 1340 CE1 HIS A 189 45.894 6.803 43.809 1.00 8.52 C ATOM 1341 NE2 HIS A 189 46.785 5.837 43.682 1.00 8.12 N ATOM 1342 H HIS A 189 42.070 2.748 41.235 1.00 0.00 H ATOM 1343 N THR A 190 45.030 3.565 39.755 1.00 8.77 N ATOM 1344 CA THR A 190 46.019 3.532 38.687 1.00 9.07 C ATOM 1345 C THR A 190 45.715 2.327 37.809 1.00 9.51 C ATOM 1346 O THR A 190 44.888 1.478 38.148 1.00 10.66 O ATOM 1347 CB THR A 190 47.451 3.378 39.210 1.00 8.94 C ATOM 1348 OG1 THR A 190 47.534 2.168 39.967 1.00 9.09 O ATOM 1349 CG2 THR A 190 47.878 4.555 40.073 1.00 9.27 C ATOM 1350 HG1 THR A 190 48.456 2.058 40.311 1.00 0.00 H ATOM 1351 H THR A 190 44.735 2.666 40.186 1.00 0.00 H ATOM 1352 N SER A 191 46.406 2.248 36.670 1.00 9.94 N ATOM 1353 CA SER A 191 46.207 1.106 35.784 1.00 10.96 C ATOM 1354 C SER A 191 46.823 -0.168 36.337 1.00 10.03 C ATOM 1355 O SER A 191 46.407 -1.264 35.941 1.00 10.80 O ATOM 1356 CB SER A 191 46.808 1.390 34.414 1.00 13.49 C ATOM 1357 OG SER A 191 46.007 2.314 33.706 1.00 16.49 O ATOM 1358 HG SER A 191 45.952 3.161 34.216 1.00 0.00 H ATOM 1359 H SER A 191 47.082 2.996 36.415 1.00 0.00 H ATOM 1360 N ASP A 192 47.800 -0.049 37.232 1.00 8.80 N ATOM 1361 CA ASP A 192 48.520 -1.193 37.765 1.00 8.18 C ATOM 1362 C ASP A 192 48.055 -1.614 39.151 1.00 7.58 C ATOM 1363 O ASP A 192 48.601 -2.578 39.694 1.00 7.88 O ATOM 1364 CB ASP A 192 50.041 -0.945 37.762 1.00 8.40 C ATOM 1365 CG ASP A 192 50.457 0.227 38.647 1.00 8.27 C ATOM 1366 OD1 ASP A 192 49.734 1.241 38.667 1.00 8.60 O ATOM 1367 OD2 ASP A 192 51.519 0.135 39.301 1.00 7.36 O ATOM 1368 H ASP A 192 48.059 0.902 37.564 1.00 0.00 H ATOM 1369 N ASN A 193 47.062 -0.936 39.734 1.00 7.10 N ATOM 1370 CA ASN A 193 46.690 -1.219 41.114 1.00 7.23 C ATOM 1371 C ASN A 193 46.265 -2.665 41.320 1.00 7.26 C ATOM 1372 O ASN A 193 45.483 -3.216 40.542 1.00 7.80 O ATOM 1373 CB ASN A 193 45.661 -0.215 41.687 1.00 7.51 C ATOM 1374 CG ASN A 193 44.361 -0.031 40.866 1.00 8.36 C ATOM 1375 OD1 ASN A 193 43.725 1.018 41.016 1.00 9.12 O ATOM 1376 ND2 ASN A 193 43.939 -1.020 40.081 1.00 8.66 N ATOM 1377 HD22 ASN A 193 44.507 -1.886 39.984 1.00 0.00 H ATOM 1378 HD21 ASN A 193 43.041 -0.927 39.564 1.00 0.00 H ATOM 1379 H ASN A 193 46.552 -0.203 39.200 1.00 0.00 H ATOM 1380 N ILE A 194 46.802 -3.286 42.370 1.00 6.35 N ATOM 1381 CA ILE A 194 46.416 -4.637 42.743 1.00 6.80 C ATOM 1382 C ILE A 194 45.915 -4.644 44.185 1.00 6.28 C ATOM 1383 O ILE A 194 46.078 -3.680 44.934 1.00 6.34 O ATOM 1384 CB ILE A 194 47.531 -5.675 42.506 1.00 6.87 C ATOM 1385 CG1 ILE A 194 48.788 -5.350 43.322 1.00 6.70 C ATOM 1386 CG2 ILE A 194 47.859 -5.758 41.015 1.00 7.55 C ATOM 1387 CD1 ILE A 194 49.839 -6.453 43.301 1.00 7.16 C ATOM 1388 H ILE A 194 47.518 -2.790 42.939 1.00 0.00 H ATOM 1389 N THR A 195 45.254 -5.739 44.553 1.00 6.62 N ATOM 1390 CA THR A 195 44.576 -5.874 45.835 1.00 6.76 C ATOM 1391 C THR A 195 44.919 -7.228 46.434 1.00 6.32 C ATOM 1392 O THR A 195 45.369 -8.139 45.730 1.00 6.76 O ATOM 1393 CB THR A 195 43.055 -5.720 45.682 1.00 7.30 C ATOM 1394 OG1 THR A 195 42.525 -6.793 44.890 1.00 8.00 O ATOM 1395 CG2 THR A 195 42.709 -4.383 45.022 1.00 7.82 C ATOM 1396 HG1 THR A 195 42.944 -6.778 43.993 1.00 0.00 H ATOM 1397 H THR A 195 45.220 -6.540 43.891 1.00 0.00 H ATOM 1398 N VAL A 196 44.722 -7.361 47.746 1.00 6.55 N ATOM 1399 CA VAL A 196 45.190 -8.550 48.462 1.00 7.11 C ATOM 1400 C VAL A 196 44.163 -8.961 49.512 1.00 7.93 C ATOM 1401 O VAL A 196 43.843 -8.173 50.404 1.00 8.89 O ATOM 1402 CB VAL A 196 46.561 -8.326 49.133 1.00 7.78 C ATOM 1403 CG1 VAL A 196 47.063 -9.621 49.769 1.00 8.96 C ATOM 1404 CG2 VAL A 196 47.596 -7.767 48.151 1.00 8.36 C ATOM 1405 H VAL A 196 44.229 -6.609 48.269 1.00 0.00 H ATOM 1406 N GLY A 197 43.682 -10.200 49.441 1.00 8.38 N ATOM 1407 CA GLY A 197 42.879 -10.775 50.502 1.00 8.92 C ATOM 1408 C GLY A 197 43.743 -11.647 51.394 1.00 9.31 C ATOM 1409 O GLY A 197 44.762 -12.172 50.962 1.00 9.12 O ATOM 1410 H GLY A 197 43.889 -10.773 48.598 1.00 0.00 H ATOM 1411 N ILE A 198 43.346 -11.787 52.653 1.00 9.51 N ATOM 1412 CA ILE A 198 44.075 -12.623 53.602 1.00 11.06 C ATOM 1413 C ILE A 198 43.194 -13.819 53.939 1.00 11.92 C ATOM 1414 O ILE A 198 42.242 -13.717 54.726 1.00 12.58 O ATOM 1415 CB ILE A 198 44.498 -11.856 54.856 1.00 12.16 C ATOM 1416 CG1 ILE A 198 45.246 -10.582 54.464 1.00 13.44 C ATOM 1417 CG2 ILE A 198 45.353 -12.743 55.738 1.00 12.62 C ATOM 1418 CD1 ILE A 198 45.645 -9.739 55.636 1.00 14.36 C ATOM 1419 H ILE A 198 42.492 -11.287 52.972 1.00 0.00 H ATOM 1420 N ASP A 199 43.512 -14.957 53.330 1.00 12.82 N ATOM 1421 CA ASP A 199 42.757 -16.180 53.565 1.00 16.03 C ATOM 1422 C ASP A 199 42.776 -16.522 55.049 1.00 17.39 C ATOM 1423 O ASP A 199 43.779 -16.314 55.739 1.00 18.06 O ATOM 1424 CB ASP A 199 43.385 -17.319 52.757 1.00 18.96 C ATOM 1425 CG ASP A 199 42.370 -18.350 52.285 1.00 22.43 C ATOM 1426 OD1 ASP A 199 41.149 -18.090 52.349 1.00 24.07 O ATOM 1427 OD2 ASP A 199 42.804 -19.428 51.835 1.00 23.77 O ATOM 1428 H ASP A 199 44.317 -14.974 52.672 1.00 0.00 H ATOM 1429 N GLY A 200 41.651 -17.030 55.547 1.00 18.75 N ATOM 1430 CA GLY A 200 41.537 -17.384 56.946 1.00 19.60 C ATOM 1431 C GLY A 200 41.194 -16.236 57.866 1.00 19.60 C ATOM 1432 O GLY A 200 41.080 -16.444 59.081 1.00 21.31 O ATOM 1433 H GLY A 200 40.836 -17.176 54.917 1.00 0.00 H ATOM 1434 N THR A 201 41.043 -15.033 57.330 1.00 16.95 N ATOM 1435 CA THR A 201 40.621 -13.865 58.080 1.00 15.21 C ATOM 1436 C THR A 201 39.450 -13.235 57.349 1.00 14.57 C ATOM 1437 O THR A 201 39.079 -13.647 56.248 1.00 15.60 O ATOM 1438 CB THR A 201 41.738 -12.821 58.167 1.00 14.88 C ATOM 1439 OG1 THR A 201 41.793 -12.087 56.935 1.00 13.73 O ATOM 1440 CG2 THR A 201 43.078 -13.477 58.447 1.00 15.84 C ATOM 1441 HG1 THR A 201 41.977 -12.711 56.189 1.00 0.00 H ATOM 1442 H THR A 201 41.238 -14.920 56.315 1.00 0.00 H ATOM 1443 N ASP A 202 38.874 -12.209 57.966 1.00 13.68 N ATOM 1444 CA ASP A 202 37.818 -11.443 57.323 1.00 13.58 C ATOM 1445 C ASP A 202 38.339 -10.185 56.632 1.00 11.42 C ATOM 1446 O ASP A 202 37.561 -9.262 56.375 1.00 10.88 O ATOM 1447 CB ASP A 202 36.681 -11.136 58.307 1.00 16.05 C ATOM 1448 CG ASP A 202 37.112 -10.249 59.471 1.00 18.50 C ATOM 1449 OD1 ASP A 202 38.283 -9.818 59.525 1.00 19.14 O ATOM 1450 OD2 ASP A 202 36.258 -9.984 60.350 1.00 20.48 O ATOM 1451 H ASP A 202 39.183 -11.949 58.924 1.00 0.00 H ATOM 1452 N ILE A 203 39.627 -10.145 56.298 1.00 10.45 N ATOM 1453 CA ILE A 203 40.291 -8.925 55.849 1.00 9.84 C ATOM 1454 C ILE A 203 40.596 -8.994 54.358 1.00 9.31 C ATOM 1455 O ILE A 203 41.122 -9.995 53.863 1.00 9.39 O ATOM 1456 CB ILE A 203 41.588 -8.693 56.647 1.00 10.62 C ATOM 1457 CG1 ILE A 203 41.269 -8.465 58.126 1.00 12.16 C ATOM 1458 CG2 ILE A 203 42.390 -7.535 56.057 1.00 10.86 C ATOM 1459 CD1 ILE A 203 42.481 -8.515 59.029 1.00 13.38 C ATOM 1460 H ILE A 203 40.184 -11.021 56.360 1.00 0.00 H ATOM 1461 N ALA A 204 40.313 -7.899 53.651 1.00 8.81 N ATOM 1462 CA ALA A 204 40.846 -7.668 52.314 1.00 9.51 C ATOM 1463 C ALA A 204 41.364 -6.239 52.208 1.00 8.27 C ATOM 1464 O ALA A 204 40.824 -5.316 52.825 1.00 9.43 O ATOM 1465 CB ALA A 204 39.817 -7.947 51.215 1.00 10.87 C ATOM 1466 H ALA A 204 39.687 -7.182 54.070 1.00 0.00 H ATOM 1467 N PHE A 205 42.416 -6.071 51.404 1.00 7.57 N ATOM 1468 CA PHE A 205 43.154 -4.818 51.285 1.00 7.26 C ATOM 1469 C PHE A 205 42.967 -4.249 49.884 1.00 6.73 C ATOM 1470 O PHE A 205 43.386 -4.867 48.894 1.00 7.32 O ATOM 1471 CB PHE A 205 44.639 -5.055 51.537 1.00 7.51 C ATOM 1472 CG PHE A 205 45.476 -3.805 51.469 1.00 7.71 C ATOM 1473 CD1 PHE A 205 45.380 -2.836 52.453 1.00 9.14 C ATOM 1474 CD2 PHE A 205 46.388 -3.609 50.441 1.00 8.02 C ATOM 1475 CE1 PHE A 205 46.167 -1.693 52.404 1.00 9.03 C ATOM 1476 CE2 PHE A 205 47.187 -2.470 50.391 1.00 7.76 C ATOM 1477 CZ PHE A 205 47.076 -1.512 51.376 1.00 7.73 C ATOM 1478 H PHE A 205 42.728 -6.880 50.829 1.00 0.00 H ATOM 1479 N GLY A 206 42.366 -3.064 49.806 1.00 7.54 N ATOM 1480 CA GLY A 206 42.163 -2.413 48.534 1.00 7.78 C ATOM 1481 C GLY A 206 43.204 -1.385 48.142 1.00 7.83 C ATOM 1482 O GLY A 206 43.155 -0.853 47.031 1.00 8.19 O ATOM 1483 H GLY A 206 42.037 -2.599 50.676 1.00 0.00 H ATOM 1484 N GLY A 207 44.151 -1.090 49.030 1.00 7.67 N ATOM 1485 CA GLY A 207 45.167 -0.104 48.704 1.00 7.93 C ATOM 1486 C GLY A 207 44.543 1.230 48.371 1.00 7.98 C ATOM 1487 O GLY A 207 43.585 1.677 49.013 1.00 8.94 O ATOM 1488 H GLY A 207 44.163 -1.565 49.955 1.00 0.00 H ATOM 1489 N CYS A 208 45.078 1.883 47.346 1.00 7.16 N ATOM 1490 CA CYS A 208 44.511 3.188 47.026 1.00 8.79 C ATOM 1491 C CYS A 208 43.272 3.126 46.148 1.00 8.75 C ATOM 1492 O CYS A 208 42.690 4.176 45.852 1.00 9.92 O ATOM 1493 CB CYS A 208 45.528 4.148 46.429 1.00 9.21 C ATOM 1494 SG CYS A 208 46.965 4.458 47.426 1.00 8.44 S ATOM 1495 H CYS A 208 45.865 1.482 46.797 1.00 0.00 H ATOM 1496 N LEU A 209 42.833 1.937 45.754 1.00 8.23 N ATOM 1497 CA LEU A 209 41.611 1.844 44.970 1.00 8.40 C ATOM 1498 C LEU A 209 40.393 2.231 45.801 1.00 8.39 C ATOM 1499 O LEU A 209 39.460 2.872 45.291 1.00 8.80 O ATOM 1500 CB LEU A 209 41.466 0.418 44.450 1.00 8.51 C ATOM 1501 CG LEU A 209 40.216 0.108 43.637 1.00 9.42 C ATOM 1502 CD1 LEU A 209 40.262 0.814 42.299 1.00 10.27 C ATOM 1503 CD2 LEU A 209 40.092 -1.393 43.468 1.00 10.01 C ATOM 1504 H LEU A 209 43.360 1.076 46.004 1.00 0.00 H ATOM 1505 N ILE A 210 40.370 1.827 47.073 1.00 8.63 N ATOM 1506 CA ILE A 210 39.184 1.941 47.918 1.00 9.12 C ATOM 1507 C ILE A 210 39.356 3.099 48.893 1.00 9.18 C ATOM 1508 O ILE A 210 40.427 3.261 49.495 1.00 9.31 O ATOM 1509 CB ILE A 210 38.917 0.618 48.662 1.00 10.21 C ATOM 1510 CG1 ILE A 210 38.726 -0.529 47.661 1.00 10.23 C ATOM 1511 CG2 ILE A 210 37.724 0.755 49.597 1.00 11.52 C ATOM 1512 CD1 ILE A 210 37.562 -0.351 46.718 1.00 11.17 C ATOM 1513 H ILE A 210 41.233 1.413 47.480 1.00 0.00 H ATOM 1514 N LYS A 211 38.304 3.907 49.039 1.00 9.32 N ATOM 1515 CA LYS A 211 38.204 4.961 50.039 1.00 10.31 C ATOM 1516 C LYS A 211 37.127 4.593 51.051 1.00 10.26 C ATOM 1517 O LYS A 211 36.270 3.746 50.795 1.00 10.64 O ATOM 1518 CB LYS A 211 37.824 6.300 49.401 1.00 11.87 C ATOM 1519 CG LYS A 211 38.501 6.570 48.078 1.00 13.42 C ATOM 1520 CD LYS A 211 40.008 6.585 48.222 1.00 14.55 C ATOM 1521 CE LYS A 211 40.671 6.783 46.878 1.00 16.47 C ATOM 1522 NZ LYS A 211 42.146 6.773 46.958 1.00 17.17 N ATOM 1523 HZ1 LYS A 211 42.463 7.540 47.585 1.00 0.00 H ATOM 1524 HZ2 LYS A 211 42.465 5.859 47.338 1.00 0.00 H ATOM 1525 HZ3 LYS A 211 42.544 6.913 46.008 1.00 0.00 H ATOM 1526 H LYS A 211 37.499 3.775 48.394 1.00 0.00 H ATOM 1527 N ASP A 212 37.156 5.252 52.206 1.00 11.23 N ATOM 1528 CA ASP A 212 36.245 4.845 53.266 1.00 12.60 C ATOM 1529 C ASP A 212 34.808 5.261 52.943 1.00 11.58 C ATOM 1530 O ASP A 212 34.547 6.046 52.032 1.00 11.12 O ATOM 1531 CB ASP A 212 36.702 5.384 54.618 1.00 15.24 C ATOM 1532 CG ASP A 212 36.549 6.886 54.724 1.00 17.03 C ATOM 1533 OD1 ASP A 212 35.415 7.359 54.937 1.00 18.29 O ATOM 1534 OD2 ASP A 212 37.565 7.600 54.598 1.00 19.50 O ATOM 1535 H ASP A 212 37.817 6.042 52.349 1.00 0.00 H ATOM 1536 N SER A 213 33.875 4.692 53.692 1.00 11.49 N ATOM 1537 CA SER A 213 32.406 4.839 53.441 1.00 13.12 C ATOM 1538 C SER A 213 31.909 6.279 53.591 1.00 14.20 C ATOM 1539 O SER A 213 30.807 6.522 53.130 1.00 14.72 O ATOM 1540 CB SER A 213 31.608 3.910 54.326 1.00 14.37 C ATOM 1541 OG SER A 213 31.836 4.150 55.672 1.00 16.23 O ATOM 1542 HG SER A 213 32.797 4.018 55.871 1.00 0.00 H ATOM 1543 H SER A 213 34.180 4.111 54.499 1.00 0.00 H ATOM 1544 N LYS A 214 32.680 7.143 54.206 1.00 14.92 N ATOM 1545 CA LYS A 214 32.255 8.567 54.339 1.00 17.54 C ATOM 1546 C LYS A 214 33.218 9.463 53.556 1.00 15.78 C ATOM 1547 O LYS A 214 33.109 10.676 53.699 1.00 16.46 O ATOM 1548 CB LYS A 214 32.194 8.977 55.813 1.00 21.70 C ATOM 1549 CG LYS A 214 31.221 8.206 56.699 1.00 26.06 C ATOM 1550 CD LYS A 214 31.271 8.724 58.141 1.00 29.88 C ATOM 1551 CE LYS A 214 29.955 9.118 58.778 1.00 32.30 C ATOM 1552 NZ LYS A 214 30.143 10.020 59.949 1.00 33.66 N ATOM 1553 HZ1 LYS A 214 30.718 9.537 60.668 1.00 0.00 H ATOM 1554 HZ2 LYS A 214 30.626 10.888 59.642 1.00 0.00 H ATOM 1555 HZ3 LYS A 214 29.215 10.262 60.351 1.00 0.00 H ATOM 1556 H LYS A 214 33.591 6.835 54.602 1.00 0.00 H ATOM 1557 N ALA A 215 34.062 8.934 52.677 1.00 14.28 N ATOM 1558 CA ALA A 215 35.023 9.769 51.967 1.00 13.71 C ATOM 1559 C ALA A 215 34.316 10.755 51.048 1.00 14.05 C ATOM 1560 O ALA A 215 33.303 10.434 50.420 1.00 13.88 O ATOM 1561 CB ALA A 215 35.975 8.898 51.147 1.00 14.65 C ATOM 1562 H ALA A 215 34.037 7.911 52.493 1.00 0.00 H ATOM 1563 N LYS A 216 34.871 11.961 50.955 1.00 15.34 N ATOM 1564 CA LYS A 216 34.288 13.000 50.120 1.00 17.60 C ATOM 1565 C LYS A 216 34.785 12.958 48.685 1.00 17.37 C ATOM 1566 O LYS A 216 34.157 13.557 47.807 1.00 18.56 O ATOM 1567 CB LYS A 216 34.581 14.381 50.709 1.00 21.31 C ATOM 1568 CG LYS A 216 33.631 14.794 51.810 1.00 24.47 C ATOM 1569 CD LYS A 216 34.161 16.017 52.540 1.00 26.99 C ATOM 1570 CE LYS A 216 34.674 17.061 51.560 1.00 28.87 C ATOM 1571 NZ LYS A 216 33.578 17.926 51.040 1.00 30.22 N ATOM 1572 HZ1 LYS A 216 32.876 17.336 50.549 1.00 0.00 H ATOM 1573 HZ2 LYS A 216 33.123 18.421 51.833 1.00 0.00 H ATOM 1574 HZ3 LYS A 216 33.973 18.622 50.376 1.00 0.00 H ATOM 1575 H LYS A 216 35.739 12.165 51.490 1.00 0.00 H ATOM 1576 N SER A 217 35.887 12.267 48.418 1.00 16.35 N ATOM 1577 CA SER A 217 36.428 12.223 47.070 1.00 16.35 C ATOM 1578 C SER A 217 37.191 10.923 46.864 1.00 15.34 C ATOM 1579 O SER A 217 37.431 10.151 47.799 1.00 14.96 O ATOM 1580 CB SER A 217 37.337 13.416 46.784 1.00 17.40 C ATOM 1581 OG SER A 217 38.646 13.155 47.251 1.00 18.18 O ATOM 1582 HG SER A 217 39.225 13.935 47.060 1.00 0.00 H ATOM 1583 H SER A 217 36.368 11.751 49.182 1.00 0.00 H ATOM 1584 N LEU A 218 37.573 10.693 45.610 1.00 14.65 N ATOM 1585 CA LEU A 218 38.417 9.572 45.236 1.00 14.02 C ATOM 1586 C LEU A 218 39.903 9.915 45.272 1.00 13.50 C ATOM 1587 O LEU A 218 40.721 9.145 44.758 1.00 14.13 O ATOM 1588 CB LEU A 218 37.995 9.033 43.866 1.00 14.49 C ATOM 1589 CG LEU A 218 36.605 8.393 43.840 1.00 15.33 C ATOM 1590 CD1 LEU A 218 36.136 8.177 42.413 1.00 16.65 C ATOM 1591 CD2 LEU A 218 36.602 7.085 44.615 1.00 15.53 C ATOM 1592 H LEU A 218 37.253 11.345 44.865 1.00 0.00 H ATOM 1593 N GLY A 219 40.268 11.049 45.865 1.00 13.84 N ATOM 1594 CA GLY A 219 41.676 11.323 46.119 1.00 13.89 C ATOM 1595 C GLY A 219 42.438 11.703 44.861 1.00 13.25 C ATOM 1596 O GLY A 219 41.955 12.458 44.010 1.00 14.62 O ATOM 1597 H GLY A 219 39.546 11.742 46.148 1.00 0.00 H ATOM 1598 N ASN A 220 43.653 11.172 44.740 1.00 12.71 N ATOM 1599 CA ASN A 220 44.539 11.520 43.633 1.00 11.99 C ATOM 1600 C ASN A 220 44.151 10.715 42.402 1.00 12.27 C ATOM 1601 O ASN A 220 44.429 9.511 42.321 1.00 12.54 O ATOM 1602 CB ASN A 220 45.991 11.233 43.998 1.00 12.10 C ATOM 1603 CG ASN A 220 46.919 11.329 42.794 1.00 12.51 C ATOM 1604 OD1 ASN A 220 46.708 12.161 41.907 1.00 13.04 O ATOM 1605 ND2 ASN A 220 47.941 10.479 42.751 1.00 12.83 N ATOM 1606 HD22 ASN A 220 48.081 9.794 43.521 1.00 0.00 H ATOM 1607 HD21 ASN A 220 48.601 10.499 41.947 1.00 0.00 H ATOM 1608 H ASN A 220 43.980 10.490 45.454 1.00 0.00 H ATOM 1609 N LEU A 221 43.543 11.387 41.429 1.00 12.92 N ATOM 1610 CA LEU A 221 43.145 10.768 40.174 1.00 13.66 C ATOM 1611 C LEU A 221 44.143 11.034 39.051 1.00 13.07 C ATOM 1612 O LEU A 221 43.834 10.778 37.885 1.00 13.43 O ATOM 1613 CB LEU A 221 41.735 11.225 39.779 1.00 15.13 C ATOM 1614 CG LEU A 221 40.606 10.797 40.725 1.00 16.11 C ATOM 1615 CD1 LEU A 221 39.271 11.365 40.268 1.00 16.73 C ATOM 1616 CD2 LEU A 221 40.538 9.282 40.817 1.00 16.59 C ATOM 1617 H LEU A 221 43.344 12.398 41.571 1.00 0.00 H ATOM 1618 N GLY A 222 45.341 11.526 39.378 1.00 13.01 N ATOM 1619 CA GLY A 222 46.278 11.920 38.335 1.00 12.84 C ATOM 1620 C GLY A 222 46.650 10.791 37.389 1.00 13.00 C ATOM 1621 O GLY A 222 46.869 11.017 36.194 1.00 14.55 O ATOM 1622 H GLY A 222 45.605 11.628 40.379 1.00 0.00 H ATOM 1623 N ASP A 223 46.748 9.569 37.909 1.00 11.49 N ATOM 1624 CA ASP A 223 47.077 8.401 37.100 1.00 11.39 C ATOM 1625 C ASP A 223 45.905 7.433 36.991 1.00 11.32 C ATOM 1626 O ASP A 223 46.090 6.267 36.628 1.00 11.23 O ATOM 1627 CB ASP A 223 48.332 7.707 37.641 1.00 12.08 C ATOM 1628 CG ASP A 223 49.576 8.569 37.491 1.00 13.11 C ATOM 1629 OD1 ASP A 223 49.791 9.114 36.387 1.00 15.31 O ATOM 1630 OD2 ASP A 223 50.334 8.724 38.473 1.00 12.88 O ATOM 1631 H ASP A 223 46.584 9.443 38.928 1.00 0.00 H ATOM 1632 N ALA A 224 44.697 7.907 37.272 1.00 11.57 N ATOM 1633 CA ALA A 224 43.542 7.036 37.360 1.00 12.52 C ATOM 1634 C ALA A 224 42.927 6.772 35.991 1.00 13.24 C ATOM 1635 O ALA A 224 43.122 7.520 35.026 1.00 13.99 O ATOM 1636 CB ALA A 224 42.485 7.650 38.275 1.00 12.78 C ATOM 1637 H ALA A 224 44.577 8.927 37.433 1.00 0.00 H ATOM 1638 N ASP A 225 42.170 5.682 35.932 1.00 13.79 N ATOM 1639 CA ASP A 225 41.324 5.330 34.796 1.00 14.54 C ATOM 1640 C ASP A 225 39.891 5.600 35.248 1.00 13.99 C ATOM 1641 O ASP A 225 39.265 4.765 35.908 1.00 14.23 O ATOM 1642 CB ASP A 225 41.547 3.867 34.428 1.00 15.61 C ATOM 1643 CG ASP A 225 40.769 3.440 33.198 1.00 16.92 C ATOM 1644 OD1 ASP A 225 39.651 3.949 32.978 1.00 17.02 O ATOM 1645 OD2 ASP A 225 41.268 2.572 32.452 1.00 18.09 O ATOM 1646 H ASP A 225 42.181 5.038 36.748 1.00 0.00 H ATOM 1647 N THR A 226 39.382 6.788 34.912 1.00 15.28 N ATOM 1648 CA THR A 226 38.091 7.215 35.444 1.00 17.16 C ATOM 1649 C THR A 226 36.926 6.441 34.836 1.00 17.00 C ATOM 1650 O THR A 226 35.892 6.266 35.492 1.00 18.19 O ATOM 1651 CB THR A 226 37.914 8.719 35.251 1.00 19.33 C ATOM 1652 OG1 THR A 226 37.994 9.034 33.855 1.00 20.23 O ATOM 1653 CG2 THR A 226 39.005 9.477 36.005 1.00 19.95 C ATOM 1654 HG1 THR A 226 37.280 8.552 33.368 1.00 0.00 H ATOM 1655 H THR A 226 39.908 7.412 34.268 1.00 0.00 H ATOM 1656 N GLU A 227 37.071 5.971 33.595 1.00 16.47 N ATOM 1657 CA GLU A 227 35.999 5.202 32.969 1.00 16.74 C ATOM 1658 C GLU A 227 35.790 3.865 33.670 1.00 15.22 C ATOM 1659 O GLU A 227 34.649 3.429 33.861 1.00 15.11 O ATOM 1660 CB GLU A 227 36.305 4.982 31.486 1.00 18.63 C ATOM 1661 CG GLU A 227 35.399 3.959 30.815 1.00 20.28 C ATOM 1662 CD GLU A 227 35.849 3.595 29.412 1.00 21.72 C ATOM 1663 OE1 GLU A 227 36.948 4.025 29.005 1.00 22.26 O ATOM 1664 OE2 GLU A 227 35.099 2.879 28.715 1.00 22.32 O ATOM 1665 H GLU A 227 37.951 6.153 33.072 1.00 0.00 H ATOM 1666 N HIS A 228 36.877 3.204 34.066 1.00 14.13 N ATOM 1667 CA HIS A 228 36.814 1.843 34.585 1.00 14.45 C ATOM 1668 C HIS A 228 36.830 1.752 36.104 1.00 12.27 C ATOM 1669 O HIS A 228 36.670 0.648 36.638 1.00 11.61 O ATOM 1670 CB HIS A 228 37.950 0.994 34.004 1.00 17.04 C ATOM 1671 CG HIS A 228 37.884 0.845 32.517 1.00 19.23 C ATOM 1672 ND1 HIS A 228 38.772 1.467 31.667 1.00 19.91 N ATOM 1673 CD2 HIS A 228 37.023 0.161 31.728 1.00 20.72 C ATOM 1674 CE1 HIS A 228 38.467 1.165 30.418 1.00 21.00 C ATOM 1675 NE2 HIS A 228 37.411 0.373 30.428 1.00 21.44 N ATOM 1676 H HIS A 228 37.802 3.675 34.003 1.00 0.00 H ATOM 1677 N TYR A 229 36.997 2.878 36.801 1.00 11.60 N ATOM 1678 CA TYR A 229 37.173 2.869 38.248 1.00 10.55 C ATOM 1679 C TYR A 229 36.034 2.145 38.960 1.00 9.74 C ATOM 1680 O TYR A 229 36.278 1.273 39.802 1.00 9.53 O ATOM 1681 CB TYR A 229 37.317 4.307 38.754 1.00 10.59 C ATOM 1682 CG TYR A 229 38.025 4.470 40.083 1.00 10.05 C ATOM 1683 CD1 TYR A 229 37.612 3.773 41.214 1.00 10.21 C ATOM 1684 CD2 TYR A 229 39.076 5.370 40.214 1.00 9.95 C ATOM 1685 CE1 TYR A 229 38.260 3.932 42.433 1.00 10.14 C ATOM 1686 CE2 TYR A 229 39.729 5.536 41.425 1.00 9.42 C ATOM 1687 CZ TYR A 229 39.317 4.818 42.533 1.00 9.90 C ATOM 1688 OH TYR A 229 39.977 4.996 43.731 1.00 9.80 O ATOM 1689 HH TYR A 229 39.567 4.417 44.421 1.00 0.00 H ATOM 1690 H TYR A 229 37.002 3.788 36.297 1.00 0.00 H ATOM 1691 N ALA A 230 34.782 2.504 38.655 1.00 9.89 N ATOM 1692 CA ALA A 230 33.666 1.919 39.391 1.00 10.33 C ATOM 1693 C ALA A 230 33.645 0.402 39.246 1.00 9.32 C ATOM 1694 O ALA A 230 33.437 -0.326 40.225 1.00 9.93 O ATOM 1695 CB ALA A 230 32.347 2.527 38.917 1.00 10.88 C ATOM 1696 H ALA A 230 34.605 3.195 37.898 1.00 0.00 H ATOM 1697 N ALA A 231 33.809 -0.092 38.016 1.00 10.07 N ATOM 1698 CA ALA A 231 33.796 -1.533 37.786 1.00 10.70 C ATOM 1699 C ALA A 231 34.944 -2.216 38.517 1.00 10.38 C ATOM 1700 O ALA A 231 34.777 -3.308 39.070 1.00 10.69 O ATOM 1701 CB ALA A 231 33.875 -1.823 36.289 1.00 12.43 C ATOM 1702 H ALA A 231 33.947 0.556 37.215 1.00 0.00 H ATOM 1703 N SER A 232 36.110 -1.568 38.563 1.00 9.82 N ATOM 1704 CA SER A 232 37.255 -2.153 39.250 1.00 9.88 C ATOM 1705 C SER A 232 37.022 -2.220 40.753 1.00 9.21 C ATOM 1706 O SER A 232 37.333 -3.237 41.386 1.00 9.40 O ATOM 1707 CB SER A 232 38.522 -1.384 38.899 1.00 10.89 C ATOM 1708 OG SER A 232 38.730 -1.437 37.497 1.00 11.26 O ATOM 1709 HG SER A 232 39.553 -0.937 37.268 1.00 0.00 H ATOM 1710 H SER A 232 36.202 -0.639 38.105 1.00 0.00 H ATOM 1711 N ALA A 233 36.451 -1.160 41.340 1.00 8.93 N ATOM 1712 CA ALA A 233 36.099 -1.208 42.755 1.00 9.32 C ATOM 1713 C ALA A 233 35.129 -2.352 43.043 1.00 8.56 C ATOM 1714 O ALA A 233 35.296 -3.094 44.017 1.00 9.74 O ATOM 1715 CB ALA A 233 35.513 0.131 43.203 1.00 9.53 C ATOM 1716 H ALA A 233 36.258 -0.301 40.786 1.00 0.00 H ATOM 1717 N ARG A 234 34.089 -2.500 42.210 1.00 9.61 N ATOM 1718 CA ARG A 234 33.131 -3.585 42.409 1.00 10.05 C ATOM 1719 C ARG A 234 33.765 -4.954 42.200 1.00 9.52 C ATOM 1720 O ARG A 234 33.427 -5.908 42.916 1.00 10.45 O ATOM 1721 CB ARG A 234 31.919 -3.380 41.502 1.00 10.38 C ATOM 1722 CG ARG A 234 31.110 -2.171 41.924 1.00 11.33 C ATOM 1723 CD ARG A 234 29.820 -1.977 41.147 1.00 11.65 C ATOM 1724 NE ARG A 234 29.064 -0.887 41.762 1.00 11.48 N ATOM 1725 CZ ARG A 234 28.876 0.311 41.213 1.00 11.39 C ATOM 1726 NH1 ARG A 234 29.330 0.573 39.991 1.00 11.73 N ATOM 1727 NH2 ARG A 234 28.213 1.246 41.879 1.00 11.79 N ATOM 1728 HE ARG A 234 28.642 -1.060 42.697 1.00 0.00 H ATOM 1729 HH12 ARG A 234 29.178 1.512 39.570 1.00 0.00 H ATOM 1730 HH11 ARG A 234 29.837 -0.161 39.456 1.00 0.00 H ATOM 1731 HH22 ARG A 234 28.065 2.183 41.452 1.00 0.00 H ATOM 1732 HH21 ARG A 234 27.841 1.043 42.829 1.00 0.00 H ATOM 1733 H ARG A 234 33.963 -1.838 41.417 1.00 0.00 H ATOM 1734 N ALA A 235 34.720 -5.060 41.273 1.00 10.22 N ATOM 1735 CA ALA A 235 35.383 -6.342 41.055 1.00 10.64 C ATOM 1736 C ALA A 235 36.214 -6.751 42.265 1.00 9.57 C ATOM 1737 O ALA A 235 36.285 -7.935 42.607 1.00 9.92 O ATOM 1738 CB ALA A 235 36.231 -6.286 39.786 1.00 11.09 C ATOM 1739 H ALA A 235 34.991 -4.231 40.707 1.00 0.00 H ATOM 1740 N PHE A 236 36.851 -5.783 42.930 1.00 9.50 N ATOM 1741 CA PHE A 236 37.536 -6.071 44.185 1.00 9.35 C ATOM 1742 C PHE A 236 36.572 -6.680 45.204 1.00 8.71 C ATOM 1743 O PHE A 236 36.868 -7.704 45.828 1.00 9.57 O ATOM 1744 CB PHE A 236 38.200 -4.795 44.717 1.00 9.15 C ATOM 1745 CG PHE A 236 38.600 -4.869 46.163 1.00 8.77 C ATOM 1746 CD1 PHE A 236 39.689 -5.629 46.559 1.00 8.68 C ATOM 1747 CD2 PHE A 236 37.889 -4.164 47.124 1.00 9.52 C ATOM 1748 CE1 PHE A 236 40.062 -5.691 47.896 1.00 8.56 C ATOM 1749 CE2 PHE A 236 38.249 -4.218 48.462 1.00 9.82 C ATOM 1750 CZ PHE A 236 39.338 -4.977 48.849 1.00 8.93 C ATOM 1751 H PHE A 236 36.858 -4.815 42.549 1.00 0.00 H ATOM 1752 N GLY A 237 35.402 -6.059 45.380 1.00 9.38 N ATOM 1753 CA GLY A 237 34.432 -6.599 46.320 1.00 10.01 C ATOM 1754 C GLY A 237 33.989 -8.003 45.958 1.00 9.59 C ATOM 1755 O GLY A 237 33.871 -8.873 46.827 1.00 10.99 O ATOM 1756 H GLY A 237 35.186 -5.193 44.847 1.00 0.00 H ATOM 1757 N ALA A 238 33.778 -8.255 44.669 1.00 10.44 N ATOM 1758 CA ALA A 238 33.310 -9.566 44.230 1.00 11.37 C ATOM 1759 C ALA A 238 34.386 -10.634 44.368 1.00 11.95 C ATOM 1760 O ALA A 238 34.060 -11.822 44.506 1.00 12.96 O ATOM 1761 CB ALA A 238 32.829 -9.491 42.782 1.00 12.96 C ATOM 1762 H ALA A 238 33.949 -7.509 43.965 1.00 0.00 H ATOM 1763 N ALA A 239 35.663 -10.238 44.300 1.00 11.11 N ATOM 1764 CA ALA A 239 36.760 -11.185 44.450 1.00 11.14 C ATOM 1765 C ALA A 239 36.893 -11.676 45.883 1.00 10.80 C ATOM 1766 O ALA A 239 37.362 -12.801 46.112 1.00 11.60 O ATOM 1767 CB ALA A 239 38.070 -10.538 44.002 1.00 11.81 C ATOM 1768 H ALA A 239 35.876 -9.233 44.137 1.00 0.00 H ATOM 1769 N PHE A 240 36.491 -10.853 46.855 1.00 9.85 N ATOM 1770 CA PHE A 240 36.663 -11.157 48.277 1.00 10.52 C ATOM 1771 C PHE A 240 35.328 -11.020 48.999 1.00 11.04 C ATOM 1772 O PHE A 240 35.164 -10.180 49.887 1.00 10.70 O ATOM 1773 CB PHE A 240 37.729 -10.249 48.888 1.00 10.33 C ATOM 1774 CG PHE A 240 39.053 -10.328 48.181 1.00 10.27 C ATOM 1775 CD1 PHE A 240 39.830 -11.466 48.276 1.00 11.22 C ATOM 1776 CD2 PHE A 240 39.511 -9.267 47.415 1.00 10.47 C ATOM 1777 CE1 PHE A 240 41.044 -11.551 47.618 1.00 10.81 C ATOM 1778 CE2 PHE A 240 40.736 -9.341 46.757 1.00 10.60 C ATOM 1779 CZ PHE A 240 41.501 -10.487 46.861 1.00 10.97 C ATOM 1780 H PHE A 240 36.036 -9.956 46.590 1.00 0.00 H ATOM 1781 N PRO A 241 34.340 -11.846 48.641 1.00 12.98 N ATOM 1782 CA PRO A 241 32.993 -11.656 49.209 1.00 15.46 C ATOM 1783 C PRO A 241 32.911 -11.881 50.709 1.00 18.55 C ATOM 1784 O PRO A 241 31.998 -11.337 51.343 1.00 20.83 O ATOM 1785 CB PRO A 241 32.129 -12.666 48.437 1.00 16.22 C ATOM 1786 CG PRO A 241 33.094 -13.706 47.971 1.00 15.50 C ATOM 1787 CD PRO A 241 34.384 -12.973 47.692 1.00 14.24 C ATOM 1788 N LYS A 242 33.815 -12.658 51.309 1.00 20.94 N ATOM 1789 CA LYS A 242 33.701 -12.880 52.748 1.00 23.85 C ATOM 1790 C LYS A 242 34.349 -11.774 53.562 1.00 22.14 C ATOM 1791 O LYS A 242 34.157 -11.739 54.782 1.00 24.37 O ATOM 1792 CB LYS A 242 34.342 -14.203 53.170 1.00 28.49 C ATOM 1793 CG LYS A 242 35.704 -14.417 52.542 1.00 32.30 C ATOM 1794 CD LYS A 242 36.357 -15.735 52.934 1.00 35.28 C ATOM 1795 CE LYS A 242 37.854 -15.699 52.638 1.00 37.27 C ATOM 1796 NZ LYS A 242 38.690 -16.215 53.756 1.00 38.33 N ATOM 1797 HZ1 LYS A 242 38.525 -15.638 54.606 1.00 0.00 H ATOM 1798 HZ2 LYS A 242 38.433 -17.204 53.952 1.00 0.00 H ATOM 1799 HZ3 LYS A 242 39.694 -16.162 53.489 1.00 0.00 H ATOM 1800 H LYS A 242 34.584 -13.096 50.763 1.00 0.00 H ATOM 1801 N ALA A 243 35.114 -10.887 52.927 1.00 17.81 N ATOM 1802 CA ALA A 243 35.879 -9.877 53.653 1.00 15.37 C ATOM 1803 C ALA A 243 34.934 -8.830 54.223 1.00 14.38 C ATOM 1804 O ALA A 243 34.360 -8.027 53.482 1.00 15.78 O ATOM 1805 CB ALA A 243 36.897 -9.232 52.721 1.00 14.86 C ATOM 1806 H ALA A 243 35.168 -10.915 51.889 1.00 0.00 H ATOM 1807 N SER A 244 34.770 -8.835 55.542 1.00 12.53 N ATOM 1808 CA SER A 244 33.955 -7.838 56.214 1.00 12.97 C ATOM 1809 C SER A 244 34.771 -6.658 56.717 1.00 11.90 C ATOM 1810 O SER A 244 34.192 -5.609 57.023 1.00 13.69 O ATOM 1811 CB SER A 244 33.205 -8.471 57.386 1.00 14.09 C ATOM 1812 OG SER A 244 34.112 -9.057 58.302 1.00 15.23 O ATOM 1813 HG SER A 244 33.607 -9.461 59.052 1.00 0.00 H ATOM 1814 H SER A 244 35.237 -9.572 56.108 1.00 0.00 H ATOM 1815 N MET A 245 36.093 -6.796 56.800 1.00 10.59 N ATOM 1816 CA MET A 245 36.977 -5.704 57.187 1.00 10.75 C ATOM 1817 C MET A 245 37.792 -5.307 55.965 1.00 9.73 C ATOM 1818 O MET A 245 38.637 -6.075 55.492 1.00 10.17 O ATOM 1819 CB MET A 245 37.896 -6.096 58.336 1.00 12.01 C ATOM 1820 CG MET A 245 38.726 -4.919 58.798 1.00 13.63 C ATOM 1821 SD MET A 245 40.043 -5.339 59.928 1.00 15.82 S ATOM 1822 CE MET A 245 39.262 -6.553 60.974 1.00 17.45 C ATOM 1823 H MET A 245 36.512 -7.722 56.579 1.00 0.00 H ATOM 1824 N ILE A 246 37.543 -4.107 55.466 1.00 9.05 N ATOM 1825 CA ILE A 246 38.213 -3.594 54.283 1.00 8.50 C ATOM 1826 C ILE A 246 39.284 -2.612 54.727 1.00 8.33 C ATOM 1827 O ILE A 246 38.984 -1.581 55.341 1.00 9.41 O ATOM 1828 CB ILE A 246 37.211 -2.945 53.318 1.00 9.48 C ATOM 1829 CG1 ILE A 246 36.076 -3.925 52.979 1.00 10.13 C ATOM 1830 CG2 ILE A 246 37.915 -2.438 52.063 1.00 10.18 C ATOM 1831 CD1 ILE A 246 36.551 -5.247 52.398 1.00 10.94 C ATOM 1832 H ILE A 246 36.839 -3.506 55.940 1.00 0.00 H ATOM 1833 N VAL A 247 40.527 -2.942 54.428 1.00 8.14 N ATOM 1834 CA VAL A 247 41.679 -2.113 54.749 1.00 8.12 C ATOM 1835 C VAL A 247 42.058 -1.347 53.489 1.00 7.68 C ATOM 1836 O VAL A 247 41.943 -1.870 52.371 1.00 8.61 O ATOM 1837 CB VAL A 247 42.833 -2.999 55.259 1.00 8.60 C ATOM 1838 CG1 VAL A 247 44.030 -2.152 55.655 1.00 9.30 C ATOM 1839 CG2 VAL A 247 42.362 -3.846 56.432 1.00 9.69 C ATOM 1840 H VAL A 247 40.692 -3.844 53.936 1.00 0.00 H ATOM 1841 N MET A 248 42.516 -0.108 53.658 1.00 8.17 N ATOM 1842 CA MET A 248 42.793 0.748 52.512 1.00 8.28 C ATOM 1843 C MET A 248 43.931 1.700 52.865 1.00 8.23 C ATOM 1844 O MET A 248 44.357 1.790 54.018 1.00 8.46 O ATOM 1845 CB MET A 248 41.534 1.502 52.074 1.00 9.93 C ATOM 1846 CG MET A 248 41.045 2.500 53.101 1.00 11.35 C ATOM 1847 SD MET A 248 39.263 2.786 53.048 1.00 13.10 S ATOM 1848 CE MET A 248 38.660 1.437 54.047 1.00 13.39 C ATOM 1849 H MET A 248 42.678 0.253 54.620 1.00 0.00 H ATOM 1850 N SER A 249 44.409 2.434 51.857 1.00 8.10 N ATOM 1851 CA SER A 249 45.648 3.194 52.036 1.00 8.12 C ATOM 1852 C SER A 249 45.502 4.384 52.983 1.00 8.53 C ATOM 1853 O SER A 249 46.449 4.704 53.707 1.00 9.24 O ATOM 1854 CB SER A 249 46.216 3.662 50.700 1.00 8.26 C ATOM 1855 OG SER A 249 46.760 2.577 49.978 1.00 8.12 O ATOM 1856 HG SER A 249 47.122 2.904 49.116 1.00 0.00 H ATOM 1857 H SER A 249 43.904 2.466 50.949 1.00 0.00 H ATOM 1858 N HIS A 250 44.362 5.088 52.981 1.00 10.02 N ATOM 1859 CA HIS A 250 44.334 6.397 53.630 1.00 12.06 C ATOM 1860 C HIS A 250 43.242 6.582 54.677 1.00 13.30 C ATOM 1861 O HIS A 250 43.006 7.717 55.114 1.00 15.33 O ATOM 1862 CB HIS A 250 44.276 7.512 52.588 1.00 12.31 C ATOM 1863 CG HIS A 250 45.350 7.401 51.558 1.00 11.01 C ATOM 1864 ND1 HIS A 250 46.690 7.477 51.872 1.00 10.47 N ATOM 1865 CD2 HIS A 250 45.286 7.180 50.226 1.00 11.46 C ATOM 1866 CE1 HIS A 250 47.404 7.329 50.772 1.00 10.04 C ATOM 1867 NE2 HIS A 250 46.576 7.134 49.763 1.00 10.78 N ATOM 1868 H HIS A 250 43.509 4.708 52.524 1.00 0.00 H ATOM 1869 N SER A 251 42.586 5.515 55.103 1.00 13.28 N ATOM 1870 CA SER A 251 41.604 5.603 56.169 1.00 13.45 C ATOM 1871 C SER A 251 41.706 4.354 57.016 1.00 12.49 C ATOM 1872 O SER A 251 42.291 3.353 56.599 1.00 11.82 O ATOM 1873 CB SER A 251 40.182 5.725 55.626 1.00 13.88 C ATOM 1874 OG SER A 251 40.053 6.894 54.845 1.00 15.04 O ATOM 1875 HG SER A 251 39.127 6.959 54.501 1.00 0.00 H ATOM 1876 H SER A 251 42.778 4.592 54.664 1.00 0.00 H ATOM 1877 N ALA A 252 41.125 4.419 58.211 1.00 12.74 N ATOM 1878 CA ALA A 252 41.087 3.263 59.082 1.00 12.75 C ATOM 1879 C ALA A 252 40.257 2.162 58.430 1.00 11.85 C ATOM 1880 O ALA A 252 39.427 2.433 57.558 1.00 12.38 O ATOM 1881 CB ALA A 252 40.473 3.643 60.426 1.00 14.44 C ATOM 1882 H ALA A 252 40.693 5.312 58.524 1.00 0.00 H ATOM 1883 N PRO A 253 40.473 0.911 58.832 1.00 11.52 N ATOM 1884 CA PRO A 253 39.673 -0.187 58.286 1.00 11.15 C ATOM 1885 C PRO A 253 38.188 0.085 58.466 1.00 10.89 C ATOM 1886 O PRO A 253 37.753 0.660 59.467 1.00 11.76 O ATOM 1887 CB PRO A 253 40.136 -1.396 59.104 1.00 11.71 C ATOM 1888 CG PRO A 253 41.538 -1.052 59.482 1.00 12.13 C ATOM 1889 CD PRO A 253 41.525 0.425 59.738 1.00 12.30 C ATOM 1890 N ASP A 254 37.411 -0.312 57.469 1.00 10.10 N ATOM 1891 CA ASP A 254 35.996 0.001 57.411 1.00 10.00 C ATOM 1892 C ASP A 254 35.223 -1.250 57.025 1.00 9.72 C ATOM 1893 O ASP A 254 35.795 -2.290 56.692 1.00 10.79 O ATOM 1894 CB ASP A 254 35.772 1.096 56.365 1.00 11.07 C ATOM 1895 CG ASP A 254 34.479 1.879 56.569 1.00 12.97 C ATOM 1896 OD1 ASP A 254 33.705 1.603 57.512 1.00 12.96 O ATOM 1897 OD2 ASP A 254 34.236 2.789 55.757 1.00 14.42 O ATOM 1898 H ASP A 254 37.832 -0.869 56.698 1.00 0.00 H ATOM 1899 N SER A 255 33.900 -1.134 57.071 1.00 9.72 N ATOM 1900 CA SER A 255 33.035 -2.183 56.561 1.00 9.54 C ATOM 1901 C SER A 255 33.029 -2.166 55.033 1.00 8.65 C ATOM 1902 O SER A 255 33.665 -1.330 54.382 1.00 9.65 O ATOM 1903 CB SER A 255 31.609 -1.965 57.054 1.00 10.66 C ATOM 1904 OG SER A 255 30.982 -0.966 56.263 1.00 11.30 O ATOM 1905 HG SER A 255 31.491 -0.120 56.338 1.00 0.00 H ATOM 1906 H SER A 255 33.476 -0.277 57.480 1.00 0.00 H ATOM 1907 N ARG A 256 32.272 -3.099 54.446 1.00 9.18 N ATOM 1908 CA ARG A 256 32.156 -3.161 52.993 1.00 8.78 C ATOM 1909 C ARG A 256 31.454 -1.951 52.396 1.00 8.99 C ATOM 1910 O ARG A 256 31.476 -1.783 51.168 1.00 8.85 O ATOM 1911 CB ARG A 256 31.458 -4.454 52.561 1.00 9.97 C ATOM 1912 CG ARG A 256 32.266 -5.706 52.864 1.00 10.86 C ATOM 1913 CD ARG A 256 31.538 -6.972 52.448 1.00 11.81 C ATOM 1914 NE ARG A 256 31.472 -7.134 51.000 1.00 11.23 N ATOM 1915 CZ ARG A 256 32.448 -7.643 50.255 1.00 11.38 C ATOM 1916 NH1 ARG A 256 33.594 -8.022 50.816 1.00 11.86 N ATOM 1917 NH2 ARG A 256 32.273 -7.773 48.946 1.00 12.46 N ATOM 1918 HE ARG A 256 30.602 -6.831 50.518 1.00 0.00 H ATOM 1919 HH12 ARG A 256 34.354 -8.420 50.228 1.00 0.00 H ATOM 1920 HH11 ARG A 256 33.729 -7.921 51.842 1.00 0.00 H ATOM 1921 HH22 ARG A 256 33.032 -8.170 48.357 1.00 0.00 H ATOM 1922 HH21 ARG A 256 31.377 -7.477 48.509 1.00 0.00 H ATOM 1923 H ARG A 256 31.760 -3.789 55.032 1.00 0.00 H ATOM 1924 N ALA A 257 30.852 -1.096 53.225 1.00 9.20 N ATOM 1925 CA ALA A 257 30.332 0.167 52.717 1.00 9.39 C ATOM 1926 C ALA A 257 31.432 1.012 52.087 1.00 9.04 C ATOM 1927 O ALA A 257 31.141 1.869 51.249 1.00 9.17 O ATOM 1928 CB ALA A 257 29.600 0.942 53.820 1.00 10.12 C ATOM 1929 H ALA A 257 30.754 -1.331 54.233 1.00 0.00 H ATOM 1930 N ALA A 258 32.694 0.779 52.452 1.00 8.78 N ATOM 1931 CA ALA A 258 33.780 1.447 51.747 1.00 9.47 C ATOM 1932 C ALA A 258 33.760 1.099 50.260 1.00 8.68 C ATOM 1933 O ALA A 258 33.989 1.968 49.408 1.00 8.63 O ATOM 1934 CB ALA A 258 35.121 1.084 52.383 1.00 9.59 C ATOM 1935 H ALA A 258 32.901 0.125 53.234 1.00 0.00 H ATOM 1936 N ILE A 259 33.490 -0.168 49.931 1.00 8.61 N ATOM 1937 CA ILE A 259 33.482 -0.598 48.535 1.00 8.83 C ATOM 1938 C ILE A 259 32.297 0.005 47.797 1.00 8.48 C ATOM 1939 O ILE A 259 32.442 0.582 46.710 1.00 8.61 O ATOM 1940 CB ILE A 259 33.466 -2.134 48.439 1.00 9.67 C ATOM 1941 CG1 ILE A 259 34.651 -2.746 49.184 1.00 9.95 C ATOM 1942 CG2 ILE A 259 33.458 -2.574 46.984 1.00 10.89 C ATOM 1943 CD1 ILE A 259 34.495 -4.235 49.417 1.00 10.93 C ATOM 1944 H ILE A 259 33.282 -0.858 50.681 1.00 0.00 H ATOM 1945 N THR A 260 31.096 -0.138 48.364 1.00 8.82 N ATOM 1946 CA THR A 260 29.915 0.397 47.696 1.00 9.17 C ATOM 1947 C THR A 260 30.009 1.910 47.537 1.00 8.95 C ATOM 1948 O THR A 260 29.660 2.455 46.482 1.00 9.54 O ATOM 1949 CB THR A 260 28.632 0.011 48.447 1.00 9.68 C ATOM 1950 OG1 THR A 260 28.752 0.330 49.842 1.00 10.38 O ATOM 1951 CG2 THR A 260 28.312 -1.473 48.288 1.00 10.70 C ATOM 1952 HG1 THR A 260 28.906 1.303 49.945 1.00 0.00 H ATOM 1953 H THR A 260 31.004 -0.628 49.277 1.00 0.00 H ATOM 1954 N HIS A 261 30.485 2.605 48.572 1.00 9.52 N ATOM 1955 CA HIS A 261 30.568 4.059 48.498 1.00 10.11 C ATOM 1956 C HIS A 261 31.617 4.499 47.490 1.00 10.15 C ATOM 1957 O HIS A 261 31.399 5.451 46.735 1.00 10.66 O ATOM 1958 CB HIS A 261 30.868 4.646 49.878 1.00 11.23 C ATOM 1959 CG HIS A 261 31.048 6.134 49.879 1.00 12.15 C ATOM 1960 ND1 HIS A 261 30.046 7.010 49.520 1.00 13.49 N ATOM 1961 CD2 HIS A 261 32.119 6.900 50.200 1.00 13.13 C ATOM 1962 CE1 HIS A 261 30.490 8.249 49.625 1.00 13.87 C ATOM 1963 NE2 HIS A 261 31.746 8.210 50.032 1.00 13.76 N ATOM 1964 H HIS A 261 30.797 2.110 49.432 1.00 0.00 H ATOM 1965 N THR A 262 32.769 3.826 47.471 1.00 9.36 N ATOM 1966 CA THR A 262 33.792 4.156 46.485 1.00 9.54 C ATOM 1967 C THR A 262 33.264 3.965 45.069 1.00 9.24 C ATOM 1968 O THR A 262 33.459 4.815 44.191 1.00 9.43 O ATOM 1969 CB THR A 262 35.033 3.286 46.701 1.00 9.51 C ATOM 1970 OG1 THR A 262 35.675 3.634 47.934 1.00 9.24 O ATOM 1971 CG2 THR A 262 36.017 3.490 45.570 1.00 10.15 C ATOM 1972 HG1 THR A 262 35.045 3.492 48.684 1.00 0.00 H ATOM 1973 H THR A 262 32.938 3.065 48.160 1.00 0.00 H ATOM 1974 N ALA A 263 32.604 2.834 44.824 1.00 9.44 N ATOM 1975 CA ALA A 263 32.076 2.562 43.494 1.00 9.63 C ATOM 1976 C ALA A 263 31.009 3.578 43.114 1.00 9.52 C ATOM 1977 O ALA A 263 30.961 4.043 41.968 1.00 10.06 O ATOM 1978 CB ALA A 263 31.521 1.139 43.446 1.00 9.80 C ATOM 1979 H ALA A 263 32.465 2.141 45.587 1.00 0.00 H ATOM 1980 N ARG A 264 30.149 3.944 44.069 1.00 10.48 N ATOM 1981 CA ARG A 264 29.095 4.908 43.778 1.00 11.09 C ATOM 1982 C ARG A 264 29.678 6.272 43.427 1.00 11.28 C ATOM 1983 O ARG A 264 29.165 6.963 42.539 1.00 11.98 O ATOM 1984 CB ARG A 264 28.125 5.004 44.956 1.00 11.72 C ATOM 1985 CG ARG A 264 26.801 5.662 44.615 1.00 12.02 C ATOM 1986 CD ARG A 264 25.978 4.789 43.679 1.00 12.67 C ATOM 1987 NE ARG A 264 24.703 5.411 43.332 1.00 12.84 N ATOM 1988 CZ ARG A 264 24.283 5.628 42.089 1.00 14.72 C ATOM 1989 NH1 ARG A 264 25.038 5.278 41.053 1.00 15.75 N ATOM 1990 NH2 ARG A 264 23.103 6.199 41.883 1.00 15.18 N ATOM 1991 HE ARG A 264 24.080 5.705 44.111 1.00 0.00 H ATOM 1992 HH12 ARG A 264 24.703 5.451 40.084 1.00 0.00 H ATOM 1993 HH11 ARG A 264 25.964 4.831 41.212 1.00 0.00 H ATOM 1994 HH22 ARG A 264 22.771 6.371 40.913 1.00 0.00 H ATOM 1995 HH21 ARG A 264 22.511 6.475 42.692 1.00 0.00 H ATOM 1996 H ARG A 264 30.232 3.540 45.024 1.00 0.00 H ATOM 1997 N MET A 265 30.737 6.691 44.129 1.00 11.82 N ATOM 1998 CA MET A 265 31.424 7.923 43.750 1.00 12.64 C ATOM 1999 C MET A 265 32.020 7.796 42.358 1.00 11.87 C ATOM 2000 O MET A 265 31.939 8.728 41.548 1.00 12.56 O ATOM 2001 CB MET A 265 32.524 8.262 44.760 1.00 14.51 C ATOM 2002 CG MET A 265 32.042 8.927 46.041 1.00 16.47 C ATOM 2003 SD MET A 265 33.383 9.714 46.964 1.00 18.72 S ATOM 2004 CE MET A 265 34.354 8.290 47.439 1.00 18.54 C ATOM 2005 H MET A 265 31.071 6.139 44.945 1.00 0.00 H ATOM 2006 N ALA A 266 32.628 6.642 42.064 1.00 11.76 N ATOM 2007 CA ALA A 266 33.267 6.447 40.769 1.00 12.22 C ATOM 2008 C ALA A 266 32.247 6.398 39.639 1.00 12.65 C ATOM 2009 O ALA A 266 32.588 6.719 38.496 1.00 13.52 O ATOM 2010 CB ALA A 266 34.119 5.176 40.796 1.00 12.39 C ATOM 2011 H ALA A 266 32.645 5.876 42.767 1.00 0.00 H ATOM 2012 N ASP A 267 31.004 6.009 39.919 1.00 13.26 N ATOM 2013 CA ASP A 267 29.954 6.037 38.863 1.00 15.52 C ATOM 2014 C ASP A 267 29.861 7.491 38.330 1.00 19.06 C ATOM 2015 O ASP A 267 29.600 7.636 37.196 1.00 19.11 O ATOM 2016 CB ASP A 267 28.589 5.619 39.424 1.00 14.25 C ATOM 2017 CG ASP A 267 28.450 4.148 39.759 1.00 13.21 C ATOM 2018 OD1 ASP A 267 29.120 3.374 39.127 1.00 13.54 O ATOM 2019 OD2 ASP A 267 27.609 3.817 40.614 1.00 12.65 O ATOM 2020 H ASP A 267 30.766 5.685 40.878 1.00 0.00 H ATOM 2021 N LYS A 268 30.112 8.475 39.163 1.00 22.66 N ATOM 2022 CA LYS A 268 29.983 9.921 38.767 1.00 26.91 C ATOM 2023 C LYS A 268 31.118 10.323 37.812 1.00 29.20 C ATOM 2024 O LYS A 268 30.944 11.308 37.073 1.00 29.83 O ATOM 2025 CB LYS A 268 29.928 10.800 40.023 1.00 29.32 C ATOM 2026 CG LYS A 268 28.890 10.357 41.044 1.00 31.73 C ATOM 2027 CD LYS A 268 28.678 11.198 42.227 1.00 33.03 C ATOM 2028 CE LYS A 268 27.195 11.208 42.583 1.00 33.92 C ATOM 2029 NZ LYS A 268 26.614 9.984 43.192 1.00 34.47 N ATOM 2030 HZ1 LYS A 268 26.729 9.184 42.537 1.00 0.00 H ATOM 2031 HZ2 LYS A 268 27.105 9.776 44.085 1.00 0.00 H ATOM 2032 HZ3 LYS A 268 25.603 10.138 43.379 1.00 0.00 H ATOM 2033 H LYS A 268 30.411 8.246 40.132 1.00 0.00 H ATOM 2034 N LEU A 269 32.218 9.589 37.773 1.00 30.98 N ATOM 2035 CA LEU A 269 33.340 9.928 36.903 1.00 33.46 C ATOM 2036 C LEU A 269 33.059 9.616 35.443 1.00 35.60 C ATOM 2037 O LEU A 269 33.776 10.113 34.567 1.00 35.96 O ATOM 2038 CB LEU A 269 34.588 9.149 37.321 1.00 33.71 C ATOM 2039 CG LEU A 269 35.417 9.620 38.515 1.00 34.26 C ATOM 2040 CD1 LEU A 269 36.532 8.625 38.793 1.00 34.42 C ATOM 2041 CD2 LEU A 269 35.982 11.008 38.265 1.00 34.59 C ATOM 2042 H LEU A 269 32.285 8.747 38.379 1.00 0.00 H ATOM 2043 N ARG A 270 32.049 8.803 35.162 1.00 37.48 N ATOM 2044 CA ARG A 270 31.786 8.350 33.805 1.00 39.44 C ATOM 2045 C ARG A 270 30.827 9.287 33.082 1.00 40.36 C ATOM 2046 O ARG A 270 30.602 9.147 31.881 1.00 41.06 O ATOM 2047 CB ARG A 270 31.232 6.926 33.836 1.00 40.35 C ATOM 2048 CG ARG A 270 31.897 6.054 34.890 1.00 41.18 C ATOM 2049 CD ARG A 270 31.359 4.637 34.876 1.00 42.07 C ATOM 2050 NE ARG A 270 31.503 4.013 33.565 1.00 43.02 N ATOM 2051 CZ ARG A 270 30.484 3.575 32.835 1.00 43.77 C ATOM 2052 NH1 ARG A 270 29.244 3.693 33.291 1.00 44.12 N ATOM 2053 NH2 ARG A 270 30.703 3.020 31.651 1.00 44.04 N ATOM 2054 OXT ARG A 270 30.263 10.204 33.680 1.00 40.33 O ATOM 2055 HE ARG A 270 32.462 3.905 33.179 1.00 0.00 H ATOM 2056 HH12 ARG A 270 28.445 3.350 32.720 1.00 0.00 H ATOM 2057 HH11 ARG A 270 29.071 4.128 34.219 1.00 0.00 H ATOM 2058 HH22 ARG A 270 29.903 2.678 31.081 1.00 0.00 H ATOM 2059 HH21 ARG A 270 31.675 2.927 31.292 1.00 0.00 H ATOM 2060 H ARG A 270 31.429 8.481 35.932 1.00 0.00 H TER 2061 ARG A 270 HETATM 2062 ZN ZN A 1 48.745 5.889 44.171 1.00 7.82 ZN HETATM 2063 ZN ZN A 2 46.769 6.676 47.920 1.00 9.02 ZN HETATM 2064 O HOH 3 64.908 2.276 62.090 1.00 42.18 O HETATM 2065 O HOH 4 46.497 9.386 60.895 1.00 33.74 O HETATM 2066 O HOH 5 26.701 8.118 41.889 1.00 38.38 O HETATM 2067 O HOH 6 57.764 4.652 30.204 1.00 38.33 O HETATM 2068 O HOH 7 59.698 4.449 63.788 1.00 57.01 O HETATM 2069 O HOH 8 65.475 -2.237 60.189 1.00 14.28 O HETATM 2070 O HOH 9 65.528 -4.287 62.313 1.00 19.32 O HETATM 2071 O HOH 10 52.949 18.573 56.327 1.00 27.80 O HETATM 2072 O HOH 11 47.181 -2.696 68.111 1.00 29.58 O HETATM 2073 O HOH 12 50.549 -21.021 55.651 1.00 47.14 O HETATM 2074 O HOH 13 57.413 14.494 55.732 1.00 19.16 O HETATM 2075 O HOH 14 52.106 22.790 51.389 1.00 36.18 O HETATM 2076 O HOH 15 36.606 9.864 55.250 1.00 39.09 O HETATM 2077 O HOH 16 55.827 1.780 70.701 1.00 41.06 O HETATM 2078 O HOH 17 40.065 6.686 52.281 1.00 19.34 O HETATM 2079 O HOH 18 67.047 3.887 54.872 1.00 36.23 O HETATM 2080 O HOH 19 58.572 9.632 59.136 1.00 21.81 O HETATM 2081 O HOH 20 39.641 10.373 49.160 1.00 40.36 O HETATM 2082 O HOH 21 35.640 9.478 32.803 1.00 36.54 O HETATM 2083 O HOH 22 44.188 9.486 56.655 1.00 49.47 O HETATM 2084 O HOH 23 48.114 4.322 35.781 1.00 17.59 O HETATM 2085 O HOH 24 59.683 -18.428 46.879 1.00 24.78 O HETATM 2086 O HOH 25 49.112 -18.763 58.682 1.00 14.39 O HETATM 2087 O HOH 26 61.879 -6.128 38.260 1.00 28.92 O HETATM 2088 O HOH 27 52.803 9.883 38.140 1.00 12.77 O HETATM 2089 O HOH 28 31.013 1.358 57.540 1.00 23.12 O HETATM 2090 O HOH 29 46.202 15.666 54.359 1.00 20.86 O HETATM 2091 O HOH 30 42.038 7.146 43.610 1.00 18.44 O HETATM 2092 O HOH 31 44.943 9.294 34.260 1.00 36.83 O HETATM 2093 O HOH 32 65.482 4.324 47.339 1.00 13.86 O HETATM 2094 O HOH 33 63.917 -12.662 53.955 1.00 13.13 O HETATM 2095 O HOH 34 34.073 -13.339 56.916 1.00 46.17 O HETATM 2096 O HOH 35 61.718 -1.743 35.504 1.00 16.21 O HETATM 2097 O HOH 36 61.404 3.080 45.480 1.00 8.55 O HETATM 2098 O HOH 37 42.357 11.725 35.860 1.00 32.71 O HETATM 2099 O HOH 38 57.196 -13.398 40.309 1.00 12.17 O HETATM 2100 O HOH 39 58.062 16.061 51.473 1.00 28.24 O HETATM 2101 O HOH 40 42.540 0.686 56.421 1.00 9.50 O HETATM 2102 O HOH 41 67.255 -2.040 45.139 1.00 13.53 O HETATM 2103 O HOH 42 31.531 -12.729 44.447 1.00 34.39 O HETATM 2104 O HOH 43 27.639 6.557 48.412 1.00 20.07 O HETATM 2105 O HOH 44 45.301 4.852 34.259 1.00 28.73 O HETATM 2106 O HOH 45 60.267 -15.594 43.329 1.00 20.08 O HETATM 2107 O HOH 46 27.588 2.587 50.750 1.00 17.80 O HETATM 2108 O HOH 47 60.570 -8.641 37.313 1.00 30.94 O HETATM 2109 O HOH 48 43.997 1.802 31.982 1.00 34.27 O HETATM 2110 O HOH 49 61.887 5.803 45.179 1.00 11.78 O HETATM 2111 O HOH 50 37.014 -8.494 62.476 1.00 38.41 O HETATM 2112 O HOH 51 29.569 -10.223 50.920 1.00 32.47 O HETATM 2113 O HOH 52 61.039 -19.036 61.395 1.00 29.41 O HETATM 2114 O HOH 53 51.815 2.444 52.764 1.00 7.96 O HETATM 2115 O HOH 54 44.063 -9.361 34.344 1.00 23.76 O HETATM 2116 O HOH 55 33.043 -11.366 59.243 1.00 36.51 O HETATM 2117 O HOH 56 46.613 14.420 56.897 1.00 18.52 O HETATM 2118 O HOH 57 34.163 4.813 36.998 1.00 15.83 O HETATM 2119 O HOH 58 25.762 2.082 39.638 1.00 22.86 O HETATM 2120 O HOH 59 64.996 -3.622 41.480 1.00 18.81 O HETATM 2121 O HOH 60 37.309 -5.005 36.160 1.00 22.93 O HETATM 2122 O HOH 61 29.020 2.755 36.484 1.00 22.34 O HETATM 2123 O HOH 62 61.649 9.261 56.171 1.00 13.37 O HETATM 2124 O HOH 63 48.066 1.488 61.645 1.00 10.71 O HETATM 2125 O HOH 64 71.043 -6.963 55.385 1.00 24.06 O HETATM 2126 O HOH 65 58.349 -16.118 47.599 1.00 11.71 O HETATM 2127 O HOH 66 51.866 -4.043 42.015 1.00 6.56 O HETATM 2128 O HOH 67 50.373 -7.107 34.439 1.00 21.45 O HETATM 2129 O HOH 68 39.658 13.797 43.408 1.00 27.11 O HETATM 2130 O HOH 69 64.412 -12.221 45.515 1.00 30.38 O HETATM 2131 O HOH 70 68.775 3.926 48.478 1.00 18.51 O HETATM 2132 O HOH 71 48.342 4.821 71.597 1.00 32.71 O HETATM 2133 O HOH 72 44.092 -2.752 67.472 1.00 43.17 O HETATM 2134 O HOH 73 63.359 -9.063 69.095 1.00 31.86 O HETATM 2135 O HOH 74 62.020 -9.876 62.321 1.00 12.35 O HETATM 2136 O HOH 75 59.404 3.392 33.722 1.00 11.91 O HETATM 2137 O HOH 76 45.887 -11.756 31.301 1.00 39.00 O HETATM 2138 O HOH 77 47.235 0.293 45.961 1.00 7.68 O HETATM 2139 O HOH 78 32.888 -5.083 38.168 1.00 14.35 O HETATM 2140 O HOH 79 45.094 -1.117 44.959 1.00 8.54 O HETATM 2141 O HOH 80 52.801 2.813 55.507 1.00 7.46 O HETATM 2142 O HOH 81 47.321 -17.339 65.516 1.00 24.08 O HETATM 2143 O HOH 82 54.518 8.660 43.868 1.00 11.57 O HETATM 2144 O HOH 83 55.972 9.430 41.637 1.00 10.65 O HETATM 2145 O HOH 84 60.411 -21.901 47.736 1.00 49.59 O HETATM 2146 O HOH 85 48.103 -14.896 45.787 1.00 16.30 O HETATM 2147 O HOH 86 67.822 -6.809 44.711 1.00 43.38 O HETATM 2148 O HOH 87 63.079 -13.044 51.354 1.00 15.05 O HETATM 2149 O HOH 88 46.190 -19.141 36.444 1.00 39.57 O HETATM 2150 O HOH 89 34.628 -7.223 60.305 1.00 45.92 O HETATM 2151 O HOH 90 37.474 4.374 57.812 1.00 19.77 O HETATM 2152 O HOH 91 23.154 6.189 45.490 1.00 20.12 O HETATM 2153 O HOH 92 30.884 6.103 30.205 1.00 47.54 O HETATM 2154 O HOH 93 64.722 9.150 58.983 1.00 41.64 O HETATM 2155 O HOH 94 66.703 -10.703 63.533 1.00 30.40 O HETATM 2156 O HOH 95 45.605 -17.132 41.956 1.00 30.37 O HETATM 2157 O HOH 96 53.862 -15.156 33.748 1.00 24.63 O HETATM 2158 O HOH 97 48.961 -17.846 48.222 1.00 31.23 O HETATM 2159 O HOH 98 69.079 7.179 56.186 1.00 43.07 O HETATM 2160 O HOH 99 66.328 -8.886 48.612 1.00 19.90 O HETATM 2161 O HOH 100 31.519 -5.201 56.323 1.00 14.64 O HETATM 2162 O HOH 101 42.591 -17.190 37.150 1.00 20.42 O HETATM 2163 O HOH 102 55.877 8.089 59.255 1.00 11.23 O HETATM 2164 O HOH 103 65.548 -10.908 55.396 1.00 13.29 O HETATM 2165 O HOH 104 64.399 2.567 39.261 1.00 13.99 O HETATM 2166 O HOH 105 43.870 -15.692 31.287 1.00 27.63 O HETATM 2167 O HOH 106 28.404 7.889 53.589 1.00 53.36 O HETATM 2168 O HOH 107 67.643 -13.046 52.630 1.00 26.35 O HETATM 2169 O HOH 108 62.588 -7.577 60.861 1.00 10.99 O HETATM 2170 O HOH 109 68.623 -7.719 48.057 1.00 39.28 O HETATM 2171 O HOH 110 63.859 -11.139 63.924 1.00 35.66 O HETATM 2172 O HOH 111 38.174 -14.846 47.865 1.00 38.13 O HETATM 2173 O HOH 112 57.849 12.048 56.685 1.00 13.98 O HETATM 2174 O HOH 113 65.124 3.983 59.842 1.00 17.25 O HETATM 2175 O HOH 114 38.590 0.578 62.157 1.00 28.14 O HETATM 2176 O HOH 115 63.340 6.891 50.684 1.00 21.14 O HETATM 2177 O HOH 116 28.627 -1.503 44.483 1.00 19.20 O HETATM 2178 O HOH 117 27.858 1.084 44.793 1.00 12.12 O HETATM 2179 O HOH 118 28.381 -1.964 55.794 1.00 15.48 O HETATM 2180 O HOH 119 48.356 7.170 69.190 1.00 48.70 O HETATM 2181 O HOH 120 46.259 8.259 40.427 1.00 11.28 O HETATM 2182 O HOH 121 30.976 -5.946 44.327 1.00 32.55 O HETATM 2183 O HOH 122 45.834 14.794 42.475 1.00 45.59 O HETATM 2184 O HOH 123 65.950 -1.985 55.817 1.00 11.21 O HETATM 2185 O HOH 124 67.448 -8.162 57.418 1.00 14.12 O HETATM 2186 O HOH 125 50.535 -2.847 67.540 1.00 40.96 O HETATM 2187 O HOH 126 48.247 -11.890 68.362 1.00 38.17 O HETATM 2188 O HOH 127 33.429 1.449 35.486 1.00 13.40 O HETATM 2189 O HOH 128 56.013 12.783 47.053 1.00 31.04 O HETATM 2190 O HOH 129 40.525 -1.024 62.948 1.00 35.12 O HETATM 2191 O HOH 130 37.593 12.418 51.641 1.00 41.34 O HETATM 2192 O HOH 131 48.006 -4.253 35.383 1.00 24.83 O HETATM 2193 O HOH 132 53.809 7.773 65.674 1.00 16.16 O HETATM 2194 O HOH 133 55.364 5.544 71.587 1.00 34.24 O HETATM 2195 O HOH 134 30.100 -1.068 37.783 1.00 16.35 O HETATM 2196 O HOH 135 50.879 -19.817 37.167 1.00 19.16 O HETATM 2197 O HOH 136 37.497 -2.519 35.155 1.00 25.69 O HETATM 2198 O HOH 137 44.994 -13.577 61.812 1.00 33.47 O HETATM 2199 O HOH 138 48.406 -16.059 58.377 1.00 26.03 O HETATM 2200 O HOH 139 55.329 -20.782 58.394 1.00 15.08 O HETATM 2201 O HOH 140 36.267 -15.285 45.170 1.00 43.45 O HETATM 2202 O HOH 141 52.456 -20.450 50.041 1.00 18.82 O HETATM 2203 O HOH 142 49.401 -9.701 33.796 1.00 17.28 O HETATM 2204 O HOH 143 30.913 11.541 49.263 1.00 26.03 O HETATM 2205 O HOH 144 35.757 -9.967 40.634 1.00 20.29 O HETATM 2206 O HOH 145 40.926 -15.877 33.349 1.00 22.64 O HETATM 2207 O HOH 146 64.547 7.407 53.638 1.00 14.07 O HETATM 2208 O HOH 147 37.175 -13.129 38.401 1.00 42.31 O HETATM 2209 O HOH 148 37.076 12.466 43.381 1.00 33.67 O HETATM 2210 O HOH 149 39.741 4.554 30.150 1.00 52.13 O HETATM 2211 O HOH 150 54.122 -4.759 32.031 1.00 43.63 O HETATM 2212 O HOH 151 28.734 -8.081 51.122 1.00 39.91 O HETATM 2213 O HOH 152 57.940 -5.566 34.016 1.00 25.92 O HETATM 2214 O HOH 153 43.362 14.265 41.090 1.00 23.48 O HETATM 2215 O HOH 154 60.764 -13.309 38.989 1.00 29.48 O HETATM 2216 O HOH 155 39.805 -9.627 62.724 1.00 37.82 O HETATM 2217 O HOH 156 40.114 -5.591 64.544 1.00 41.95 O HETATM 2218 O HOH 157 63.320 2.670 47.411 1.00 7.73 O HETATM 2219 O HOH 158 59.592 -11.816 37.493 1.00 18.05 O HETATM 2220 O HOH 159 57.366 -13.119 36.285 1.00 27.94 O HETATM 2221 O HOH 160 46.231 11.561 56.242 1.00 22.70 O HETATM 2222 O HOH 161 52.697 -6.148 69.262 1.00 49.17 O HETATM 2223 O HOH 162 42.082 5.035 51.134 1.00 16.46 O HETATM 2224 O HOH 163 45.655 -19.990 52.197 1.00 41.30 O HETATM 2225 O HOH 164 59.152 -18.577 53.487 1.00 29.12 O HETATM 2226 O HOH 165 45.156 -17.464 37.898 1.00 18.43 O HETATM 2227 O HOH 166 42.917 4.952 49.129 1.00 30.80 O HETATM 2228 O HOH 167 39.039 6.894 31.620 1.00 43.54 O HETATM 2229 O HOH 168 40.065 7.066 58.915 1.00 22.86 O HETATM 2230 O HOH 169 49.798 10.843 40.437 1.00 20.94 O HETATM 2231 O HOH 170 61.333 7.163 49.056 1.00 34.73 O HETATM 2232 O HOH 171 63.792 -10.584 57.623 1.00 11.58 O HETATM 2233 O HOH 172 60.454 11.331 50.417 1.00 25.20 O HETATM 2234 O HOH 173 36.388 -13.736 50.336 1.00 29.24 O HETATM 2235 O HOH 174 39.787 -11.914 60.967 1.00 25.09 O HETATM 2236 O HOH 175 45.141 5.371 58.609 1.00 28.85 O HETATM 2237 O HOH 176 43.870 3.217 61.245 1.00 24.44 O HETATM 2238 O HOH 177 39.356 -12.356 53.530 1.00 37.30 O HETATM 2239 O HOH 178 49.931 -17.151 45.171 1.00 32.12 O HETATM 2240 O HOH 179 36.033 3.062 59.769 1.00 36.58 O HETATM 2241 O HOH 180 64.385 -0.203 39.296 1.00 11.12 O HETATM 2242 O HOH 181 64.833 -8.235 38.982 1.00 48.11 O HETATM 2243 O HOH 182 52.020 -21.071 53.829 1.00 31.37 O HETATM 2244 O HOH 183 60.426 6.761 62.834 1.00 22.36 O HETATM 2245 O HOH 184 29.467 -6.091 49.045 1.00 25.42 O HETATM 2246 O HOH 185 58.138 5.487 69.962 1.00 31.97 O HETATM 2247 O HOH 186 43.648 -3.718 32.304 1.00 45.68 O HETATM 2248 O HOH 187 51.506 -19.295 47.409 1.00 25.21 O HETATM 2249 O HOH 188 42.453 8.871 49.078 1.00 31.73 O HETATM 2250 O HOH 189 28.532 4.706 52.405 1.00 27.04 O HETATM 2251 O HOH 190 34.385 -4.112 59.626 1.00 36.98 O HETATM 2252 O HOH 191 36.521 -14.787 41.542 1.00 41.03 O HETATM 2253 O HOH 192 50.889 -5.904 68.617 1.00 37.27 O HETATM 2254 O HOH 193 59.772 -15.979 49.971 1.00 26.71 O HETATM 2255 O HOH 194 46.131 3.018 62.950 1.00 21.11 O HETATM 2256 O HOH 195 22.304 6.668 38.958 1.00 31.13 O HETATM 2257 O HOH 196 65.930 -13.490 69.005 1.00 49.49 O HETATM 2258 O HOH 197 59.242 -18.208 51.730 1.00 40.67 O HETATM 2259 O HOH 198 39.066 -13.959 51.646 1.00 46.06 O HETATM 2260 O HOH 199 64.123 -13.084 62.035 1.00 40.86 O HETATM 2261 O HOH 200 53.616 18.928 53.819 1.00 33.66 O HETATM 2262 O HOH 201 29.061 3.071 56.608 1.00 38.57 O HETATM 2263 O HOH 202 41.141 8.038 32.655 1.00 28.50 O HETATM 2264 O HOH 203 42.917 -6.761 67.135 1.00 33.24 O HETATM 2265 O HOH 204 41.501 -3.099 64.795 1.00 43.77 O HETATM 2266 O HOH 205 58.659 0.408 71.368 1.00 58.39 O HETATM 2267 O HOH 206 51.258 -19.895 44.792 1.00 34.58 O HETATM 2268 O HOH 207 29.734 5.428 57.700 1.00 56.76 O HETATM 2269 O HOH 208 54.433 -3.315 73.035 1.00 41.22 O HETATM 2270 O HOH 209 24.112 4.872 38.015 1.00 39.09 O HETATM 2271 O HOH 210 41.998 10.256 53.440 1.00 42.52 O HETATM 2272 O HOH 211 54.650 10.706 45.844 1.00 48.18 O HETATM 2273 O HOH 212 67.310 6.890 53.130 1.00 48.09 O HETATM 2274 O HOH 213 63.936 9.923 55.030 1.00 30.19 O HETATM 2275 O HOH 214 43.748 5.807 32.312 1.00 51.37 O HETATM 2276 O HOH 215 59.220 -20.888 51.477 1.00 46.43 O HETATM 2277 O HOH 216 67.422 3.633 58.289 1.00 35.59 O HETATM 2278 O HOH 217 38.293 -17.984 39.246 1.00 47.34 O HETATM 2279 O HOH 218 43.105 -9.432 67.010 1.00 33.43 O HETATM 2280 O HOH 219 36.805 -16.043 38.521 1.00 49.88 O HETATM 2281 O HOH 220 42.155 4.539 67.710 1.00 50.19 O HETATM 2282 O HOH 221 41.203 12.606 49.615 1.00 49.45 O HETATM 2283 O HOH 222 53.347 10.317 40.802 1.00 17.92 O HETATM 2284 O HOH 223 67.783 -0.988 64.574 1.00 44.10 O HETATM 2285 O HOH 224 59.181 -15.103 40.467 1.00 45.67 O HETATM 2286 O HOH 225 46.489 5.245 61.834 1.00 49.35 O HETATM 2287 O HOH 226 32.075 -7.128 39.806 1.00 23.08 O HETATM 2288 O HOH 227 60.345 -6.100 35.188 1.00 32.67 O HETATM 2289 O HOH 228 65.223 -14.879 43.354 1.00 41.38 O HETATM 2290 O HOH 229 25.862 8.273 39.189 1.00 38.21 O HETATM 2291 O HOH 230 25.591 -0.552 40.138 1.00 14.35 O HETATM 2292 O HOH 231 67.461 -0.188 60.427 1.00 40.50 O HETATM 2293 O HOH 232 63.009 6.315 33.708 1.00 38.82 O HETATM 2294 O HOH 233 33.819 -0.128 33.228 1.00 22.96 O HETATM 2295 O HOH 234 28.077 8.477 46.198 1.00 27.07 O HETATM 2296 O HOH 235 40.888 -13.831 50.816 1.00 38.68 O HETATM 2297 O HOH 236 70.677 -9.230 53.658 1.00 31.94 O HETATM 2298 O HOH 237 37.478 -13.469 61.170 1.00 45.63 O HETATM 2299 O HOH 238 27.615 -4.331 41.830 1.00 31.68 O HETATM 2300 O HOH 239 30.102 -8.479 45.309 1.00 39.39 O HETATM 2301 O HOH 240 60.596 7.759 46.627 1.00 16.97 O HETATM 2302 O HOH 241 27.051 -1.653 37.978 1.00 36.64 O HETATM 2303 O HOH 242 61.225 6.647 60.177 1.00 33.04 O HETATM 2304 O HOH 243 58.784 18.600 52.025 1.00 36.53 O HETATM 2305 O HOH 244 41.745 -13.854 61.769 1.00 33.68 O HETATM 2306 O HOH 245 30.811 0.782 35.807 1.00 17.23 O HETATM 2307 O HOH 246 64.948 -14.037 49.448 1.00 40.07 O HETATM 2308 O HOH 247 57.880 -21.102 58.015 1.00 31.08 O HETATM 2309 O HOH 248 51.803 -5.905 32.265 1.00 44.16 O HETATM 2310 O HOH 249 61.634 8.693 64.227 1.00 39.48 O HETATM 2311 O HOH 250 66.456 -6.145 42.780 1.00 47.92 O HETATM 2312 O HOH 251 65.210 -6.767 61.171 1.00 13.56 O HETATM 2313 O HOH 252 49.881 -13.252 31.405 1.00 49.18 O HETATM 2314 O HOH 253 46.577 -8.426 33.349 1.00 34.91 O HETATM 2315 O HOH 254 60.237 11.523 55.339 1.00 15.48 O HETATM 2316 O HOH 255 35.822 -12.617 41.055 1.00 40.69 O HETATM 2317 O HOH 256 34.695 -6.017 36.185 1.00 23.04 O HETATM 2318 O HOH 257 69.156 -7.021 62.254 1.00 52.17 O HETATM 2319 O HOH 258 65.132 -5.021 39.320 1.00 43.26 O HETATM 2320 O HOH 259 30.290 -3.229 45.981 1.00 38.67 O HETATM 2321 O HOH 260 61.688 3.963 32.382 1.00 29.40 O HETATM 2322 O HOH 261 63.044 -16.614 43.747 1.00 32.76 O HETATM 2323 O HOH 262 61.585 -18.431 57.550 1.00 43.92 O HETATM 2324 O HOH 263 45.983 -1.216 31.784 1.00 43.54 O HETATM 2325 O HOH 264 26.374 1.489 36.792 1.00 52.72 O HETATM 2326 O HOH 265 61.184 9.099 58.820 1.00 26.32 O HETATM 2327 O HOH 266 64.484 -6.368 69.068 1.00 49.14 O HETATM 2328 O HOH 267 67.800 -12.431 55.913 1.00 33.50 O HETATM 2329 O HOH 268 64.224 6.403 61.095 1.00 47.25 O HETATM 2330 O HOH 269 53.313 -17.532 34.668 1.00 32.23 O HETATM 2331 O HOH 270 40.362 9.259 51.480 1.00 31.11 O HETATM 2332 O HOH 271 61.624 -16.573 55.567 1.00 42.05 O HETATM 2333 O HOH 272 61.859 -4.634 36.062 1.00 30.00 O HETATM 2334 O HOH 273 30.076 -0.677 33.620 1.00 48.28 O HETATM 2335 O HOH 274 30.409 0.414 60.229 1.00 42.08 O HETATM 2336 O HOH 275 41.071 -5.611 33.640 1.00 50.13 O HETATM 2337 O HOH 276 44.508 11.311 53.316 1.00 49.68 O HETATM 2338 O HOH 277 59.536 14.999 53.607 1.00 38.66 O HETATM 2339 O HOH 278 69.576 -5.562 46.283 1.00 36.18 O HETATM 2340 O HOH 279 35.498 -13.332 36.954 1.00 41.18 O HETATM 2341 O HOH 280 39.944 -11.280 64.766 1.00 41.99 O HETATM 2342 O HOH 281 68.642 -4.450 62.153 1.00 49.34 O HETATM 2343 O HOH 282 69.720 -6.694 57.696 1.00 23.67 O HETATM 2344 O HOH 283 44.721 7.585 59.177 1.00 36.83 O HETATM 2345 O HOH 284 46.811 -19.899 57.774 1.00 37.93 O HETATM 2346 O HOH 285 64.379 -15.165 55.134 1.00 33.25 O HETATM 2347 O HOH 286 67.259 -2.272 42.242 1.00 15.06 O HETATM 2348 O HOH 287 25.989 6.071 51.076 1.00 40.77 O HETATM 2349 O HOH 288 40.727 -10.121 66.835 1.00 48.20 O HETATM 2350 O HOH 289 25.961 1.720 53.071 1.00 22.19 O HETATM 2351 O HOH 290 35.335 -2.457 33.239 1.00 32.90 O HETATM 2352 O HOH 291 59.717 -17.028 41.236 1.00 40.31 O HETATM 2353 O HOH 292 30.632 -3.676 37.360 1.00 20.07 O HETATM 2354 O HOH 293 45.278 10.569 58.789 1.00 36.46 O HETATM 2355 O HOH 294 29.022 10.977 47.579 1.00 29.49 O HETATM 2356 O HOH 295 65.377 -11.842 59.476 1.00 18.54 O HETATM 2357 O HOH 296 44.285 13.891 53.105 1.00 45.80 O HETATM 2358 O HOH 297 63.336 -7.894 58.188 1.00 11.33 O HETATM 2359 O HOH 298 66.515 -15.569 52.474 1.00 44.81 O HETATM 2360 O HOH 299 27.631 -3.863 57.671 1.00 23.17 O HETATM 2361 O HOH 300 33.714 -9.367 38.984 1.00 26.05 O HETATM 2362 O HOH 301 56.445 -14.962 34.518 1.00 22.97 O HETATM 2363 O HOH 302 50.812 -10.793 31.562 1.00 41.12 O HETATM 2364 O HOH 303 65.670 -6.325 58.526 1.00 12.78 O HETATM 2365 O HOH 304 64.069 -1.329 36.869 1.00 14.85 O HETATM 2366 O HOH 305 47.773 -6.025 33.386 1.00 54.39 O HETATM 2367 O HOH 306 28.259 -4.515 38.720 1.00 35.92 O HETATM 2368 O HOH 307 67.099 -8.592 61.752 1.00 24.47 O HETATM 2369 O HOH 308 26.339 -0.101 55.301 1.00 15.27 O HETATM 2370 O HOH 309 45.174 -16.653 67.605 1.00 27.91 O HETATM 2371 O HOH 310 62.915 -18.183 63.218 1.00 39.53 O HETATM 2372 O HOH 311 66.411 -3.699 57.945 1.00 11.81 O HETATM 2373 O HOH 312 62.587 -17.873 46.460 1.00 39.57 O HETATM 2374 O HOH 313 65.079 -8.501 36.264 1.00 38.61 O HETATM 2375 O HOH 314 40.315 -14.306 64.870 1.00 38.12 O HETATM 2376 O HOH 315 67.001 -7.510 40.451 1.00 41.21 O HETATM 2377 O HOH 316 28.825 -5.920 41.056 1.00 54.72 O HETATM 2378 O HOH 317 67.499 -10.076 59.398 1.00 22.11 O HETATM 2379 O HOH 318 31.738 -16.829 49.502 1.00 42.21 O HETATM 2380 O HOH 319 26.831 1.597 57.398 1.00 31.76 O HETATM 2381 O HOH 320 30.005 -14.535 45.882 1.00 45.29 O HETATM 2382 O HOH 321 45.063 -14.414 69.277 1.00 54.62 O HETATM 2383 O HOH 322 60.801 12.455 52.819 1.00 18.96 O HETATM 2384 O HOH 323 26.419 10.757 49.046 1.00 44.66 O HETATM 2385 O HOH 324 63.433 -20.883 49.133 1.00 45.89 O HETATM 2386 O HOH 325 66.482 -14.012 58.436 1.00 39.51 O HETATM 2387 O HOH 326 33.790 -4.685 33.709 1.00 34.52 O HETATM 2388 O HOH 327 27.786 4.522 59.659 1.00 44.52 O HETATM 2389 O HOH 328 31.804 -11.402 39.267 1.00 41.17 O HETATM 2390 O HOH 329 63.938 2.509 32.543 1.00 45.32 O HETATM 2391 O HOH 330 65.440 -16.153 56.801 1.00 52.56 O HETATM 2392 O HOH 331 34.610 -17.856 48.525 1.00 52.22 O HETATM 2393 O HOH 332 30.661 -3.763 34.553 1.00 38.01 O HETATM 2394 O HOH 333 58.236 22.627 51.829 1.00 55.16 O HETATM 2395 O HOH 334 59.426 20.990 51.012 1.00 37.63 O HETATM 2396 O HOH 335 31.180 -16.731 46.814 1.00 32.76 O HETATM 2397 O HOH 336 69.746 -11.666 59.184 1.00 45.41 O HETATM 2398 O HOH 337 50.314 -7.766 30.317 1.00 49.66 O HETATM 2399 O HOH 338 64.082 -5.653 34.687 1.00 39.36 O HETATM 2400 O HOH 339 71.371 -7.548 59.876 1.00 45.25 O HETATM 2401 O HOH 340 25.455 12.399 50.323 1.00 52.19 O HETATM 2402 C01 YKG A 341 49.596 14.852 42.967 1.00 -0.03 C HETATM 2403 C02 YKG A 341 49.633 13.694 43.959 1.00 -0.04 C HETATM 2404 C03 YKG A 341 50.353 12.551 43.667 1.00 -0.05 C HETATM 2405 C04 YKG A 341 50.375 11.520 44.588 1.00 0.02 C HETATM 2406 C06 YKG A 341 49.675 11.625 45.823 1.00 0.04 C HETATM 2407 C07 YKG A 341 49.598 10.618 46.864 1.00 -0.01 C HETATM 2408 C08 YKG A 341 50.099 9.175 46.647 1.00 0.06 C HETATM 2409 P09 YKG A 341 48.737 8.114 46.106 1.00 0.07 P HETATM 2410 O10 YKG A 341 48.097 8.667 44.841 1.00 -0.56 O HETATM 2411 O11 YKG A 341 47.780 8.018 47.307 1.00 -0.56 O HETATM 2412 O12 YKG A 341 49.352 6.681 45.791 1.00 -0.56 O HETATM 2413 H5 YKG A 341 50.509 8.787 47.591 1.00 0.07 H HETATM 2414 H6 YKG A 341 50.886 9.175 45.879 1.00 0.07 H HETATM 2415 C13 YKG A 341 48.853 10.856 47.986 1.00 0.01 C HETATM 2416 C14 YKG A 341 48.224 12.070 48.174 1.00 0.25 C HETATM 2417 O15 YKG A 341 47.671 12.337 49.137 1.00 -0.39 O HETATM 2418 O16 YKG A 341 48.269 12.983 47.227 1.00 -0.21 O HETATM 2419 C17 YKG A 341 48.974 12.805 46.090 1.00 0.14 C HETATM 2420 C18 YKG A 341 48.933 13.828 45.129 1.00 -0.02 C HETATM 2421 H8 YKG A 341 48.349 14.722 45.313 1.00 0.05 H HETATM 2422 H7 YKG A 341 48.755 10.077 48.741 1.00 0.04 H HETATM 2423 BR05 YKG A 341 51.421 10.033 43.945 1.00 -0.05 BR HETATM 2424 H4 YKG A 341 50.892 12.464 42.730 1.00 0.05 H HETATM 2425 H1 YKG A 341 50.200 14.598 42.084 1.00 0.04 H HETATM 2426 H2 YKG A 341 50.005 15.756 43.443 1.00 0.04 H HETATM 2427 H3 YKG A 341 48.556 15.038 42.659 1.00 0.04 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 747 745 746 2062 CONECT 761 760 763 2062 CONECT 1341 1339 1340 2062 CONECT 1494 1493 2063 CONECT 1867 1865 1866 2063 CONECT 2062 747 761 1341 CONECT 2063 1494 1867 CONECT 2402 2403 2425 2426 2427 CONECT 2403 2402 2404 2420 CONECT 2404 2403 2405 2424 CONECT 2405 2404 2406 2423 CONECT 2406 2405 2407 2419 CONECT 2407 2406 2408 2415 CONECT 2408 2407 2409 2413 2414 CONECT 2409 2408 2410 2411 2412 CONECT 2410 2409 CONECT 2411 2409 CONECT 2412 2409 CONECT 2413 2408 CONECT 2414 2408 CONECT 2415 2407 2416 2422 CONECT 2416 2415 2417 2418 CONECT 2417 2416 CONECT 2418 2416 2419 CONECT 2419 2406 2418 2420 CONECT 2420 2403 2419 2421 CONECT 2421 2420 CONECT 2422 2415 CONECT 2423 2405 CONECT 2424 2404 CONECT 2425 2402 CONECT 2426 2402 CONECT 2427 2402 MASTER 0 0 0 0 0 0 0 0 2426 1 37 18 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6d1g
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4exs
RCSB PDB
PDBbind
272aa, >4EXS_1|Chains... *
5a5z
RCSB PDB
PDBbind
251aa, >5A5Z_1|Chains... at 96%
6rmf
RCSB PDB
PDBbind
244aa, >6RMF_1|Chains... at 99%
6q2y
RCSB PDB
PDBbind
244aa, >6Q2Y_1|Chains... at 100%
6q30
RCSB PDB
PDBbind
244aa, >6Q30_1|Chains... at 100%
6ovz
RCSB PDB
PDBbind
235aa, >6OVZ_1|Chains... at 100%
6mdu
RCSB PDB
PDBbind
233aa, >6MDU_1|Chain... at 98%
6ibv
RCSB PDB
PDBbind
244aa, >6IBV_1|Chains... at 100%
6ibs
RCSB PDB
PDBbind
244aa, >6IBS_1|Chains... at 100%
6efj
RCSB PDB
PDBbind
233aa, >6EFJ_1|Chain... at 98%
6d1k
RCSB PDB
PDBbind
233aa, >6D1K_1|Chain... at 98%
6d1i
RCSB PDB
PDBbind
233aa, >6D1I_1|Chain... at 98%
6d1j
RCSB PDB
PDBbind
233aa, >6D1J_1|Chain... at 98%
6d1h
RCSB PDB
PDBbind
233aa, >6D1H_1|Chain... at 98%
6d1d
RCSB PDB
PDBbind
233aa, >6D1D_1|Chain... at 98%
6d1b
RCSB PDB
PDBbind
233aa, >6D1B_1|Chain... at 98%
6d1a
RCSB PDB
PDBbind
233aa, >6D1A_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6d19
RCSB PDB
PDBbind
YKG
Entry Information
PDB ID
6d1g
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Metallo-beta-lactamase type 2
Ligand Name
YKG
EC.Number
E.C.3.5.2.6
Resolution
1.15(Å)
Affinity (Kd/Ki/IC50)
Ki=34.2uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 8480-8496
Ligand Properties
Formula
C
1
1
H
1
1
BrO
5
P
Molecular Weight
334.080
Exact Mass
332.953
No. of atoms
29
No. of bonds
30
Polar Surface Area
104.49
LOGP Value
0.33 (
Computed with XLOGP3
)
2.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
Cc1cc(Br)c2c(c1)oc(=O)cc2CP(O)(O)O
InChI String
InChI=1S/C11H12BrO5P/c1-6-2-8(12)11-7(5-18(14,15)16)4-10(13)17-9(11)3-6/h2-4,14-16,18H,5H2,1H3
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):
C7C422
Entrez Gene ID
NCBI Entrez Gene ID:
61419528
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓