Browse entries in the PDBbind-CN Database
HEADER 4C1C_COMPLEX COMPND 4C1C_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 29 LYS THR VAL ILE LYS ASN GLU THR GLY THR ILE SER ILE SEQRES 2 A 29 SER GLN LEU ASN LYS ASN VAL TRP VAL HIS THR GLU LEU SEQRES 3 A 29 GLY SER PHE SEQRES 1 A 191 GLU ALA VAL PRO SER ASN GLY LEU VAL LEU ASN THR SER SEQRES 2 A 191 LYS GLY LEU VAL LEU VAL ASP SER SER TRP ASP ASP LYS SEQRES 3 A 191 LEU THR LYS GLU LEU ILE GLU MET VAL GLU LYS LYS PHE SEQRES 4 A 191 GLN LYS ARG VAL THR ASP VAL ILE ILE THR HIS ALA HIS SEQRES 5 A 191 ALA ASP ARG ILE GLY GLY ILE LYS THR LEU LYS GLU ARG SEQRES 6 A 191 GLY ILE LYS ALA HIS SER THR ALA LEU THR ALA GLU LEU SEQRES 7 A 191 ALA LYS LYS ASN GLY TYR GLU GLU PRO LEU GLY ASP LEU SEQRES 8 A 191 GLN THR VAL THR ASN LEU LYS PHE GLY ASN MET LYS VAL SEQRES 9 A 191 GLU THR PHE TYR PRO GLY LYS GLY HIS THR GLU ASP ASN SEQRES 10 A 191 ILE VAL VAL TRP LEU PRO GLN TYR ASN ILE LEU VAL GLY SEQRES 11 A 191 GLY CYS LEU VAL LYS SER THR SER ALA LYS ASP LEU GLY SEQRES 12 A 191 ASN VAL ALA ASP ALA TYR VAL ASN GLU TRP SER THR SER SEQRES 13 A 191 ILE GLU ASN VAL LEU LYS ARG TYR ARG ASN ILE ASN ALA SEQRES 14 A 191 VAL VAL PRO GLY HIS GLY GLU VAL GLY ASP LYS GLY LEU SEQRES 15 A 191 LEU LEU HIS THR LEU ASP LEU LEU LYS HET ZN A 1 1 HET ZN A 2 1 HET MCO A 489 28 ATOM 1 CA LYS A 36 -3.031 3.580 62.146 1.00 34.05 C ATOM 2 C LYS A 36 -2.451 4.752 62.926 1.00 34.98 C ATOM 3 O LYS A 36 -2.757 5.914 62.651 1.00 35.68 O ATOM 4 N THR A 37 -1.607 4.440 63.903 1.00 37.35 N ATOM 5 CA THR A 37 -0.983 5.464 64.723 1.00 38.79 C ATOM 6 C THR A 37 -0.003 6.303 63.905 1.00 38.23 C ATOM 7 O THR A 37 0.871 5.774 63.223 1.00 37.38 O ATOM 8 CB THR A 37 -0.270 4.841 65.936 1.00 42.84 C ATOM 9 OG1 THR A 37 -1.239 4.177 66.759 1.00 45.35 O ATOM 10 CG2 THR A 37 0.439 5.916 66.761 1.00 43.91 C ATOM 11 HG1 THR A 37 -1.686 3.467 66.233 1.00 0.00 H ATOM 12 H THR A 37 -1.388 3.440 64.085 1.00 0.00 H ATOM 13 N VAL A 38 -0.187 7.618 63.981 1.00 38.18 N ATOM 14 CA VAL A 38 0.684 8.585 63.339 1.00 38.77 C ATOM 15 C VAL A 38 1.178 9.540 64.402 1.00 37.58 C ATOM 16 O VAL A 38 0.399 10.018 65.233 1.00 38.65 O ATOM 17 CB VAL A 38 -0.042 9.384 62.246 1.00 40.02 C ATOM 18 CG1 VAL A 38 0.865 10.476 61.696 1.00 40.45 C ATOM 19 CG2 VAL A 38 -0.521 8.456 61.136 1.00 40.18 C ATOM 20 H VAL A 38 -0.997 7.972 64.529 1.00 0.00 H ATOM 21 N ILE A 39 2.473 9.819 64.360 1.00 35.64 N ATOM 22 CA ILE A 39 3.131 10.638 65.362 1.00 35.14 C ATOM 23 C ILE A 39 4.074 11.597 64.668 1.00 32.95 C ATOM 24 O ILE A 39 4.843 11.188 63.805 1.00 29.56 O ATOM 25 CB ILE A 39 3.917 9.760 66.341 1.00 37.65 C ATOM 26 CG1 ILE A 39 2.955 8.798 67.040 1.00 38.96 C ATOM 27 CG2 ILE A 39 4.628 10.620 67.366 1.00 39.11 C ATOM 28 CD1 ILE A 39 3.633 7.695 67.797 1.00 40.35 C ATOM 29 H ILE A 39 3.041 9.436 63.578 1.00 0.00 H ATOM 30 N LYS A 40 3.994 12.869 65.042 1.00 33.88 N ATOM 31 CA LYS A 40 4.790 13.904 64.406 1.00 35.57 C ATOM 32 C LYS A 40 5.739 14.585 65.374 1.00 36.09 C ATOM 33 O LYS A 40 5.520 14.614 66.607 1.00 36.16 O ATOM 34 CB LYS A 40 3.890 14.985 63.783 1.00 38.02 C ATOM 35 CG LYS A 40 2.743 14.456 62.938 1.00 39.89 C ATOM 36 CD LYS A 40 2.242 15.509 61.946 1.00 40.21 C ATOM 37 H LYS A 40 3.344 13.131 65.811 1.00 0.00 H ATOM 38 N ASN A 41 6.706 15.251 64.784 1.00 38.93 N ATOM 39 CA ASN A 41 7.616 16.115 65.480 1.00 42.73 C ATOM 40 C ASN A 41 6.911 17.446 65.730 1.00 47.24 C ATOM 41 O ASN A 41 5.855 17.685 65.229 1.00 45.91 O ATOM 42 CB ASN A 41 8.958 16.247 64.702 1.00 41.51 C ATOM 43 CG ASN A 41 8.865 17.129 63.467 1.00 41.07 C ATOM 44 OD1 ASN A 41 7.837 17.271 62.868 1.00 39.93 O ATOM 45 ND2 ASN A 41 9.973 17.702 63.078 1.00 41.46 N ATOM 46 HD22 ASN A 41 10.850 17.560 63.619 1.00 0.00 H ATOM 47 HD21 ASN A 41 9.978 18.300 62.227 1.00 0.00 H ATOM 48 H ASN A 41 6.818 15.146 63.755 1.00 0.00 H ATOM 49 N GLU A 42 7.503 18.333 66.507 1.00 50.96 N ATOM 50 CA GLU A 42 6.756 19.528 66.873 1.00 54.49 C ATOM 51 C GLU A 42 6.399 20.322 65.625 1.00 56.88 C ATOM 52 O GLU A 42 5.288 20.837 65.504 1.00 58.10 O ATOM 53 CB GLU A 42 7.545 20.383 67.856 1.00 54.65 C ATOM 54 H GLU A 42 8.474 18.183 66.848 1.00 0.00 H ATOM 55 N THR A 43 7.350 20.419 64.706 1.00 57.35 N ATOM 56 CA THR A 43 7.154 21.098 63.430 1.00 57.44 C ATOM 57 C THR A 43 6.165 20.496 62.431 1.00 56.56 C ATOM 58 O THR A 43 5.555 21.223 61.670 1.00 57.38 O ATOM 59 CB THR A 43 8.473 21.328 62.705 1.00 58.89 C ATOM 60 OG1 THR A 43 9.369 22.004 63.586 1.00 59.98 O ATOM 61 CG2 THR A 43 8.225 22.182 61.485 1.00 59.44 C ATOM 62 HG1 THR A 43 10.231 22.159 63.124 1.00 0.00 H ATOM 63 H THR A 43 8.277 19.992 64.904 1.00 0.00 H ATOM 64 N GLY A 44 6.078 19.173 62.375 1.00 53.39 N ATOM 65 CA GLY A 44 5.301 18.470 61.361 1.00 51.13 C ATOM 66 C GLY A 44 6.089 18.076 60.116 1.00 47.92 C ATOM 67 O GLY A 44 5.583 17.400 59.221 1.00 48.72 O ATOM 68 H GLY A 44 6.587 18.612 63.087 1.00 0.00 H ATOM 69 N THR A 45 7.346 18.474 60.073 1.00 43.89 N ATOM 70 CA THR A 45 8.236 18.050 59.029 1.00 39.76 C ATOM 71 C THR A 45 8.700 16.584 59.120 1.00 35.28 C ATOM 72 O THR A 45 9.258 16.111 58.170 1.00 33.95 O ATOM 73 CB THR A 45 9.469 18.937 58.943 1.00 40.67 C ATOM 74 OG1 THR A 45 10.183 18.867 60.174 1.00 41.02 O ATOM 75 CG2 THR A 45 9.071 20.368 58.644 1.00 41.23 C ATOM 76 HG1 THR A 45 10.986 19.443 60.121 1.00 0.00 H ATOM 77 H THR A 45 7.701 19.111 60.814 1.00 0.00 H ATOM 78 N ILE A 46 8.470 15.904 60.232 1.00 31.41 N ATOM 79 CA ILE A 46 8.785 14.468 60.341 1.00 28.48 C ATOM 80 C ILE A 46 7.616 13.769 60.993 1.00 26.86 C ATOM 81 O ILE A 46 7.106 14.216 62.037 1.00 27.68 O ATOM 82 CB ILE A 46 9.992 14.198 61.220 1.00 28.50 C ATOM 83 CG1 ILE A 46 11.185 14.995 60.710 1.00 29.47 C ATOM 84 CG2 ILE A 46 10.284 12.682 61.302 1.00 28.95 C ATOM 85 CD1 ILE A 46 12.364 14.928 61.623 1.00 30.25 C ATOM 86 H ILE A 46 8.056 16.395 61.050 1.00 0.00 H ATOM 87 N SER A 47 7.194 12.676 60.378 1.00 26.16 N ATOM 88 CA SER A 47 6.046 11.938 60.842 1.00 26.51 C ATOM 89 C SER A 47 6.397 10.467 60.745 1.00 26.27 C ATOM 90 O SER A 47 7.096 10.061 59.829 1.00 28.13 O ATOM 91 CB SER A 47 4.840 12.262 59.957 1.00 30.85 C ATOM 92 OG SER A 47 3.655 11.639 60.421 1.00 33.44 O ATOM 93 HG SER A 47 2.903 11.875 59.822 1.00 0.00 H ATOM 94 H SER A 47 7.705 12.340 59.537 1.00 0.00 H ATOM 95 N ILE A 48 5.920 9.676 61.697 1.00 24.20 N ATOM 96 CA ILE A 48 6.028 8.235 61.613 1.00 24.81 C ATOM 97 C ILE A 48 4.644 7.647 61.703 1.00 26.13 C ATOM 98 O ILE A 48 3.824 8.080 62.509 1.00 27.72 O ATOM 99 CB ILE A 48 6.958 7.623 62.680 1.00 25.17 C ATOM 100 CG1 ILE A 48 6.471 7.882 64.111 1.00 26.51 C ATOM 101 CG2 ILE A 48 8.360 8.137 62.463 1.00 26.50 C ATOM 102 CD1 ILE A 48 7.289 7.126 65.159 1.00 28.31 C ATOM 103 H ILE A 48 5.457 10.102 62.525 1.00 0.00 H ATOM 104 N SER A 49 4.402 6.646 60.868 1.00 25.73 N ATOM 105 CA SER A 49 3.094 6.029 60.744 1.00 26.93 C ATOM 106 C SER A 49 3.248 4.526 60.882 1.00 26.10 C ATOM 107 O SER A 49 4.050 3.925 60.187 1.00 25.25 O ATOM 108 CB SER A 49 2.498 6.368 59.380 1.00 28.74 C ATOM 109 OG SER A 49 2.473 7.772 59.176 1.00 31.41 O ATOM 110 HG SER A 49 2.083 7.968 58.287 1.00 0.00 H ATOM 111 H SER A 49 5.180 6.289 60.278 1.00 0.00 H ATOM 112 N GLN A 50 2.478 3.918 61.775 1.00 25.73 N ATOM 113 CA GLN A 50 2.649 2.506 62.081 1.00 25.11 C ATOM 114 C GLN A 50 1.983 1.598 61.054 1.00 24.83 C ATOM 115 O GLN A 50 0.800 1.754 60.784 1.00 28.30 O ATOM 116 CB GLN A 50 2.093 2.202 63.466 1.00 27.47 C ATOM 117 CG GLN A 50 2.444 0.811 63.944 1.00 28.22 C ATOM 118 CD GLN A 50 2.212 0.642 65.425 1.00 30.22 C ATOM 119 OE1 GLN A 50 1.372 1.321 66.014 1.00 32.69 O ATOM 120 NE2 GLN A 50 2.975 -0.254 66.042 1.00 31.42 N ATOM 121 HE22 GLN A 50 3.672 -0.805 65.501 1.00 0.00 H ATOM 122 HE21 GLN A 50 2.875 -0.405 67.066 1.00 0.00 H ATOM 123 H GLN A 50 1.739 4.461 62.265 1.00 0.00 H ATOM 124 N LEU A 51 2.739 0.651 60.487 1.00 24.49 N ATOM 125 CA LEU A 51 2.149 -0.380 59.609 1.00 25.79 C ATOM 126 C LEU A 51 1.795 -1.641 60.399 1.00 28.30 C ATOM 127 O LEU A 51 0.763 -2.274 60.150 1.00 31.03 O ATOM 128 CB LEU A 51 3.116 -0.753 58.496 1.00 26.37 C ATOM 129 CG LEU A 51 3.450 0.318 57.468 1.00 27.65 C ATOM 130 CD1 LEU A 51 4.316 -0.295 56.371 1.00 27.37 C ATOM 131 CD2 LEU A 51 2.192 0.909 56.864 1.00 29.22 C ATOM 132 H LEU A 51 3.763 0.641 60.668 1.00 0.00 H ATOM 133 N ASN A 52 2.646 -1.992 61.358 1.00 29.27 N ATOM 134 CA ASN A 52 2.379 -3.082 62.302 1.00 30.81 C ATOM 135 C ASN A 52 3.230 -2.909 63.565 1.00 31.37 C ATOM 136 O ASN A 52 3.916 -1.901 63.696 1.00 30.67 O ATOM 137 CB ASN A 52 2.630 -4.442 61.652 1.00 31.01 C ATOM 138 CG ASN A 52 4.078 -4.653 61.272 1.00 30.48 C ATOM 139 OD1 ASN A 52 4.981 -4.410 62.063 1.00 30.18 O ATOM 140 ND2 ASN A 52 4.310 -5.105 60.043 1.00 30.98 N ATOM 141 HD22 ASN A 52 3.515 -5.299 59.402 1.00 0.00 H ATOM 142 HD21 ASN A 52 5.287 -5.264 59.723 1.00 0.00 H ATOM 143 H ASN A 52 3.542 -1.470 61.443 1.00 0.00 H ATOM 144 N LYS A 53 3.216 -3.903 64.458 1.00 31.46 N ATOM 145 CA LYS A 53 3.836 -3.794 65.785 1.00 31.41 C ATOM 146 C LYS A 53 5.290 -3.337 65.745 1.00 30.52 C ATOM 147 O LYS A 53 5.760 -2.671 66.671 1.00 32.38 O ATOM 148 CB LYS A 53 3.735 -5.136 66.533 1.00 31.40 C ATOM 149 H LYS A 53 2.745 -4.794 64.202 1.00 0.00 H ATOM 150 N ASN A 54 6.001 -3.680 64.677 1.00 27.33 N ATOM 151 CA ASN A 54 7.430 -3.390 64.601 1.00 25.52 C ATOM 152 C ASN A 54 7.877 -2.650 63.354 1.00 22.15 C ATOM 153 O ASN A 54 9.065 -2.480 63.144 1.00 21.36 O ATOM 154 CB ASN A 54 8.212 -4.689 64.714 1.00 27.44 C ATOM 155 CG ASN A 54 8.265 -5.213 66.133 1.00 31.72 C ATOM 156 OD1 ASN A 54 8.077 -4.469 67.097 1.00 33.54 O ATOM 157 ND2 ASN A 54 8.547 -6.492 66.267 1.00 34.48 N ATOM 158 HD22 ASN A 54 8.698 -7.082 65.424 1.00 0.00 H ATOM 159 HD21 ASN A 54 8.619 -6.912 67.216 1.00 0.00 H ATOM 160 H ASN A 54 5.533 -4.162 63.883 1.00 0.00 H ATOM 161 N VAL A 55 6.936 -2.218 62.527 1.00 20.09 N ATOM 162 CA VAL A 55 7.269 -1.568 61.261 1.00 19.47 C ATOM 163 C VAL A 55 6.510 -0.260 61.131 1.00 19.09 C ATOM 164 O VAL A 55 5.267 -0.238 61.176 1.00 21.17 O ATOM 165 CB VAL A 55 6.926 -2.463 60.056 1.00 20.60 C ATOM 166 CG1 VAL A 55 7.308 -1.768 58.751 1.00 20.62 C ATOM 167 CG2 VAL A 55 7.618 -3.819 60.193 1.00 21.23 C ATOM 168 H VAL A 55 5.936 -2.345 62.785 1.00 0.00 H ATOM 169 N TRP A 56 7.253 0.825 60.957 1.00 18.24 N ATOM 170 CA TRP A 56 6.681 2.138 60.762 1.00 18.74 C ATOM 171 C TRP A 56 7.261 2.757 59.488 1.00 17.69 C ATOM 172 O TRP A 56 8.375 2.413 59.077 1.00 17.13 O ATOM 173 CB TRP A 56 7.013 3.043 61.962 1.00 20.45 C ATOM 174 CG TRP A 56 6.512 2.576 63.290 1.00 21.53 C ATOM 175 CD1 TRP A 56 6.858 1.439 63.960 1.00 21.64 C ATOM 176 CD2 TRP A 56 5.604 3.282 64.141 1.00 22.22 C ATOM 177 NE1 TRP A 56 6.196 1.387 65.181 1.00 22.21 N ATOM 178 CE2 TRP A 56 5.416 2.503 65.304 1.00 22.75 C ATOM 179 CE3 TRP A 56 4.928 4.495 64.029 1.00 23.67 C ATOM 180 CZ2 TRP A 56 4.584 2.912 66.356 1.00 24.24 C ATOM 181 CZ3 TRP A 56 4.093 4.885 65.048 1.00 25.20 C ATOM 182 CH2 TRP A 56 3.928 4.097 66.201 1.00 24.79 C ATOM 183 HE1 TRP A 56 6.280 0.626 65.884 1.00 0.00 H ATOM 184 H TRP A 56 8.288 0.727 60.961 1.00 0.00 H ATOM 185 N VAL A 57 6.496 3.644 58.856 1.00 18.11 N ATOM 186 CA VAL A 57 6.986 4.458 57.755 1.00 17.99 C ATOM 187 C VAL A 57 7.400 5.812 58.317 1.00 17.97 C ATOM 188 O VAL A 57 6.617 6.441 59.029 1.00 21.65 O ATOM 189 CB VAL A 57 5.885 4.659 56.684 1.00 19.07 C ATOM 190 CG1 VAL A 57 6.388 5.587 55.579 1.00 19.75 C ATOM 191 CG2 VAL A 57 5.456 3.310 56.119 1.00 21.38 C ATOM 192 H VAL A 57 5.509 3.760 59.162 1.00 0.00 H ATOM 193 N HIS A 58 8.591 6.275 57.973 1.00 17.08 N ATOM 194 CA HIS A 58 8.977 7.631 58.281 1.00 17.52 C ATOM 195 C HIS A 58 8.850 8.521 57.083 1.00 17.72 C ATOM 196 O HIS A 58 9.214 8.120 55.965 1.00 18.11 O ATOM 197 CB HIS A 58 10.371 7.715 58.942 1.00 16.81 C ATOM 198 CG HIS A 58 11.566 7.431 58.029 1.00 15.35 C ATOM 199 ND1 HIS A 58 12.118 8.361 57.251 1.00 16.77 N ATOM 200 CD2 HIS A 58 12.371 6.306 57.914 1.00 15.26 C ATOM 201 CE1 HIS A 58 13.187 7.848 56.639 1.00 16.70 C ATOM 202 NE2 HIS A 58 13.341 6.597 57.049 1.00 16.03 N ATOM 203 H HIS A 58 9.258 5.653 57.474 1.00 0.00 H ATOM 204 N THR A 59 8.325 9.724 57.294 1.00 18.47 N ATOM 205 CA THR A 59 8.134 10.655 56.192 1.00 18.72 C ATOM 206 C THR A 59 8.665 12.036 56.587 1.00 18.85 C ATOM 207 O THR A 59 8.325 12.553 57.671 1.00 20.61 O ATOM 208 CB THR A 59 6.647 10.760 55.824 1.00 20.40 C ATOM 209 OG1 THR A 59 6.130 9.461 55.493 1.00 20.99 O ATOM 210 CG2 THR A 59 6.432 11.733 54.643 1.00 21.36 C ATOM 211 HG1 THR A 59 6.632 9.094 54.723 1.00 0.00 H ATOM 212 H THR A 59 8.048 10.003 58.257 1.00 0.00 H ATOM 213 N GLU A 60 9.511 12.632 55.745 1.00 20.28 N ATOM 214 CA GLU A 60 10.029 13.982 55.985 1.00 20.85 C ATOM 215 C GLU A 60 9.818 14.905 54.800 1.00 22.74 C ATOM 216 O GLU A 60 9.954 14.487 53.639 1.00 22.58 O ATOM 217 CB GLU A 60 11.523 13.989 56.303 1.00 21.60 C ATOM 218 CG GLU A 60 11.936 13.059 57.411 1.00 20.83 C ATOM 219 CD GLU A 60 12.029 11.641 56.919 1.00 20.73 C ATOM 220 OE1 GLU A 60 12.682 11.403 55.872 1.00 20.68 O ATOM 221 OE2 GLU A 60 11.473 10.748 57.587 1.00 20.84 O ATOM 222 H GLU A 60 9.813 12.122 54.890 1.00 0.00 H ATOM 223 N LEU A 61 9.534 16.165 55.116 1.00 25.66 N ATOM 224 CA LEU A 61 9.391 17.203 54.114 1.00 29.75 C ATOM 225 C LEU A 61 10.727 17.890 53.875 1.00 33.98 C ATOM 226 O LEU A 61 11.348 18.381 54.819 1.00 36.07 O ATOM 227 CB LEU A 61 8.377 18.256 54.590 1.00 31.58 C ATOM 228 CG LEU A 61 6.949 17.756 54.759 1.00 33.67 C ATOM 229 CD1 LEU A 61 6.071 18.802 55.423 1.00 34.48 C ATOM 230 CD2 LEU A 61 6.392 17.386 53.403 1.00 35.04 C ATOM 231 H LEU A 61 9.410 16.415 56.118 1.00 0.00 H ATOM 232 N GLY A 62 11.158 17.930 52.620 1.00 36.14 N ATOM 233 CA GLY A 62 12.286 18.755 52.217 1.00 40.23 C ATOM 234 C GLY A 62 11.811 19.922 51.366 1.00 43.28 C ATOM 235 O GLY A 62 10.888 19.767 50.556 1.00 44.56 O ATOM 236 H GLY A 62 10.674 17.353 51.903 1.00 0.00 H ATOM 237 N SER A 63 12.450 21.081 51.531 1.00 44.46 N ATOM 238 CA SER A 63 11.953 22.341 50.965 1.00 45.71 C ATOM 239 C SER A 63 12.727 22.811 49.732 1.00 46.33 C ATOM 240 O SER A 63 13.911 23.146 49.821 1.00 47.23 O ATOM 241 CB SER A 63 11.997 23.439 52.029 1.00 45.97 C ATOM 242 H SER A 63 13.333 21.093 52.081 1.00 0.00 H ATOM 243 N PHE A 64 12.049 22.841 48.587 1.00 45.78 N ATOM 244 HN3 PHE A 64 12.510 22.216 47.896 1.00 0.00 H ATOM 245 HN2 PHE A 64 12.034 23.814 48.220 1.00 0.00 H ATOM 246 HN1 PHE A 64 11.075 22.517 48.754 1.00 0.00 H TER 247 PHE A 64 ATOM 248 C GLU A 67 8.104 22.399 48.582 1.00 40.32 C ATOM 249 O GLU A 67 9.327 22.336 48.736 1.00 40.67 O ATOM 250 N ALA A 68 7.240 22.147 49.562 1.00 39.62 N ATOM 251 CA ALA A 68 7.442 21.040 50.483 1.00 39.68 C ATOM 252 C ALA A 68 7.323 19.733 49.705 1.00 38.52 C ATOM 253 O ALA A 68 6.342 19.520 48.996 1.00 40.32 O ATOM 254 CB ALA A 68 6.419 21.097 51.609 1.00 40.30 C ATOM 255 H ALA A 68 6.403 22.754 49.672 1.00 0.00 H ATOM 256 N VAL A 69 8.325 18.867 49.829 1.00 35.78 N ATOM 257 CA VAL A 69 8.344 17.618 49.083 1.00 33.40 C ATOM 258 C VAL A 69 8.556 16.481 50.063 1.00 28.92 C ATOM 259 O VAL A 69 9.625 16.387 50.669 1.00 29.09 O ATOM 260 CB VAL A 69 9.482 17.631 48.051 1.00 34.07 C ATOM 261 CG1 VAL A 69 9.430 16.383 47.177 1.00 33.84 C ATOM 262 CG2 VAL A 69 9.407 18.915 47.211 1.00 35.38 C ATOM 263 H VAL A 69 9.111 19.087 50.473 1.00 0.00 H ATOM 264 N PRO A 70 7.537 15.613 50.243 1.00 26.61 N ATOM 265 CA PRO A 70 7.685 14.516 51.204 1.00 25.18 C ATOM 266 C PRO A 70 8.461 13.327 50.650 1.00 23.16 C ATOM 267 O PRO A 70 8.414 13.048 49.449 1.00 24.61 O ATOM 268 CB PRO A 70 6.242 14.085 51.444 1.00 25.78 C ATOM 269 CG PRO A 70 5.607 14.273 50.131 1.00 26.50 C ATOM 270 CD PRO A 70 6.236 15.539 49.562 1.00 27.52 C ATOM 271 N SER A 71 9.133 12.620 51.550 1.00 21.06 N ATOM 272 CA SER A 71 9.943 11.465 51.229 1.00 19.98 C ATOM 273 C SER A 71 9.705 10.410 52.311 1.00 17.77 C ATOM 274 O SER A 71 9.671 10.768 53.500 1.00 20.21 O ATOM 275 CB SER A 71 11.421 11.887 51.268 1.00 23.23 C ATOM 276 OG SER A 71 12.285 10.798 51.051 1.00 24.69 O ATOM 277 HG SER A 71 12.138 10.117 51.754 1.00 0.00 H ATOM 278 H SER A 71 9.074 12.914 52.546 1.00 0.00 H ATOM 279 N ASN A 72 9.586 9.138 51.910 1.00 16.30 N ATOM 280 CA ASN A 72 9.357 8.030 52.852 1.00 15.12 C ATOM 281 C ASN A 72 10.529 7.063 52.994 1.00 14.25 C ATOM 282 O ASN A 72 11.203 6.739 52.019 1.00 14.38 O ATOM 283 CB ASN A 72 8.229 7.103 52.380 1.00 16.22 C ATOM 284 CG ASN A 72 6.935 7.825 52.112 1.00 17.07 C ATOM 285 OD1 ASN A 72 6.518 8.731 52.851 1.00 18.45 O ATOM 286 ND2 ASN A 72 6.253 7.413 51.035 1.00 17.54 N ATOM 287 HD22 ASN A 72 6.634 6.651 50.439 1.00 0.00 H ATOM 288 HD21 ASN A 72 5.343 7.855 50.795 1.00 0.00 H ATOM 289 H ASN A 72 9.658 8.925 50.895 1.00 0.00 H ATOM 290 N GLY A 73 10.692 6.524 54.196 1.00 15.20 N ATOM 291 CA GLY A 73 11.510 5.352 54.465 1.00 15.65 C ATOM 292 C GLY A 73 10.810 4.488 55.496 1.00 14.98 C ATOM 293 O GLY A 73 9.628 4.696 55.828 1.00 16.58 O ATOM 294 H GLY A 73 10.202 6.969 54.998 1.00 0.00 H ATOM 295 N LEU A 74 11.543 3.529 56.057 1.00 14.56 N ATOM 296 CA LEU A 74 10.996 2.636 57.065 1.00 14.35 C ATOM 297 C LEU A 74 11.791 2.723 58.373 1.00 13.99 C ATOM 298 O LEU A 74 12.997 3.008 58.362 1.00 13.22 O ATOM 299 CB LEU A 74 11.038 1.179 56.668 1.00 18.78 C ATOM 300 CG LEU A 74 9.998 0.575 55.748 1.00 20.17 C ATOM 301 CD1 LEU A 74 10.091 -0.944 55.913 1.00 20.06 C ATOM 302 CD2 LEU A 74 8.595 1.046 56.002 1.00 19.30 C ATOM 303 H LEU A 74 12.535 3.415 55.766 1.00 0.00 H ATOM 304 N VAL A 75 11.093 2.461 59.477 1.00 14.16 N ATOM 305 CA VAL A 75 11.701 2.252 60.784 1.00 14.41 C ATOM 306 C VAL A 75 11.330 0.845 61.222 1.00 14.66 C ATOM 307 O VAL A 75 10.133 0.505 61.294 1.00 16.39 O ATOM 308 CB VAL A 75 11.156 3.240 61.846 1.00 16.17 C ATOM 309 CG1 VAL A 75 11.889 3.025 63.168 1.00 17.50 C ATOM 310 CG2 VAL A 75 11.260 4.700 61.397 1.00 18.03 C ATOM 311 H VAL A 75 10.057 2.402 59.402 1.00 0.00 H ATOM 312 N LEU A 76 12.337 0.023 61.502 1.00 13.98 N ATOM 313 CA LEU A 76 12.139 -1.352 61.950 1.00 13.74 C ATOM 314 C LEU A 76 12.546 -1.431 63.415 1.00 14.99 C ATOM 315 O LEU A 76 13.690 -1.138 63.773 1.00 14.30 O ATOM 316 CB LEU A 76 13.003 -2.313 61.139 1.00 14.82 C ATOM 317 CG LEU A 76 12.807 -2.234 59.627 1.00 15.51 C ATOM 318 CD1 LEU A 76 13.775 -3.143 58.916 1.00 16.64 C ATOM 319 CD2 LEU A 76 11.394 -2.582 59.263 1.00 17.91 C ATOM 320 H LEU A 76 13.310 0.376 61.397 1.00 0.00 H ATOM 321 N ASN A 77 11.601 -1.789 64.269 1.00 16.78 N ATOM 322 CA ASN A 77 11.845 -1.867 65.689 1.00 19.56 C ATOM 323 C ASN A 77 12.193 -3.297 66.001 1.00 20.08 C ATOM 324 O ASN A 77 11.318 -4.146 66.003 1.00 24.96 O ATOM 325 CB ASN A 77 10.587 -1.423 66.427 1.00 20.75 C ATOM 326 CG ASN A 77 10.776 -1.368 67.923 1.00 21.64 C ATOM 327 OD1 ASN A 77 11.889 -1.502 68.435 1.00 23.31 O ATOM 328 ND2 ASN A 77 9.686 -1.151 68.635 1.00 23.96 N ATOM 329 HD22 ASN A 77 8.767 -1.044 68.160 1.00 0.00 H ATOM 330 HD21 ASN A 77 9.746 -1.087 69.671 1.00 0.00 H ATOM 331 H ASN A 77 10.654 -2.021 63.906 1.00 0.00 H ATOM 332 N THR A 78 13.469 -3.581 66.226 1.00 20.51 N ATOM 333 CA THR A 78 13.937 -4.944 66.433 1.00 20.81 C ATOM 334 C THR A 78 14.442 -5.139 67.853 1.00 22.57 C ATOM 335 O THR A 78 14.723 -4.169 68.579 1.00 23.71 O ATOM 336 CB THR A 78 15.073 -5.360 65.425 1.00 20.51 C ATOM 337 OG1 THR A 78 16.367 -5.041 65.961 1.00 19.44 O ATOM 338 CG2 THR A 78 14.853 -4.719 64.017 1.00 19.43 C ATOM 339 HG1 THR A 78 16.424 -4.066 66.125 1.00 0.00 H ATOM 340 H THR A 78 14.159 -2.803 66.256 1.00 0.00 H ATOM 341 N SER A 79 14.603 -6.395 68.231 1.00 24.05 N ATOM 342 CA SER A 79 15.074 -6.707 69.564 1.00 26.01 C ATOM 343 C SER A 79 16.513 -6.277 69.815 1.00 26.02 C ATOM 344 O SER A 79 16.968 -6.321 70.953 1.00 28.04 O ATOM 345 CB SER A 79 14.951 -8.209 69.821 1.00 27.96 C ATOM 346 OG SER A 79 15.782 -8.934 68.933 1.00 28.73 O ATOM 347 HG SER A 79 15.511 -8.744 68.000 1.00 0.00 H ATOM 348 H SER A 79 14.390 -7.165 67.566 1.00 0.00 H ATOM 349 N LYS A 80 17.229 -5.864 68.773 1.00 23.87 N ATOM 350 CA LYS A 80 18.642 -5.524 68.890 1.00 23.11 C ATOM 351 C LYS A 80 18.930 -4.083 68.505 1.00 20.19 C ATOM 352 O LYS A 80 20.080 -3.658 68.406 1.00 20.47 O ATOM 353 CB LYS A 80 19.477 -6.468 68.041 1.00 26.42 C ATOM 354 CG LYS A 80 19.389 -7.923 68.506 1.00 29.15 C ATOM 355 CD LYS A 80 20.033 -8.144 69.874 1.00 31.79 C ATOM 356 CE LYS A 80 19.898 -9.590 70.330 1.00 33.52 C ATOM 357 H LYS A 80 16.766 -5.781 67.845 1.00 0.00 H ATOM 358 N GLY A 81 17.870 -3.322 68.291 1.00 18.39 N ATOM 359 CA GLY A 81 18.002 -1.924 67.953 1.00 16.12 C ATOM 360 C GLY A 81 17.045 -1.556 66.828 1.00 14.78 C ATOM 361 O GLY A 81 16.265 -2.371 66.308 1.00 17.37 O ATOM 362 H GLY A 81 16.920 -3.739 68.368 1.00 0.00 H ATOM 363 N LEU A 82 17.088 -0.296 66.453 1.00 12.75 N ATOM 364 CA LEU A 82 16.288 0.203 65.337 1.00 12.70 C ATOM 365 C LEU A 82 17.104 0.151 64.061 1.00 12.39 C ATOM 366 O LEU A 82 18.283 0.516 64.023 1.00 12.65 O ATOM 367 CB LEU A 82 15.894 1.654 65.629 1.00 13.92 C ATOM 368 CG LEU A 82 14.977 1.837 66.827 1.00 15.93 C ATOM 369 CD1 LEU A 82 14.915 3.251 67.320 1.00 16.14 C ATOM 370 CD2 LEU A 82 13.580 1.384 66.477 1.00 22.04 C ATOM 371 H LEU A 82 17.709 0.363 66.965 1.00 0.00 H ATOM 372 N VAL A 83 16.428 -0.229 62.983 1.00 11.46 N ATOM 373 CA VAL A 83 17.042 -0.253 61.657 1.00 11.73 C ATOM 374 C VAL A 83 16.172 0.627 60.771 1.00 11.94 C ATOM 375 O VAL A 83 14.942 0.472 60.750 1.00 14.39 O ATOM 376 CB VAL A 83 17.120 -1.689 61.105 1.00 13.75 C ATOM 377 CG1 VAL A 83 17.628 -1.688 59.661 1.00 14.10 C ATOM 378 CG2 VAL A 83 17.996 -2.523 62.022 1.00 15.42 C ATOM 379 H VAL A 83 15.434 -0.518 63.085 1.00 0.00 H ATOM 380 N LEU A 84 16.787 1.553 60.047 1.00 11.47 N ATOM 381 CA LEU A 84 16.037 2.362 59.090 1.00 12.08 C ATOM 382 C LEU A 84 16.258 1.891 57.676 1.00 11.37 C ATOM 383 O LEU A 84 17.340 1.451 57.317 1.00 11.71 O ATOM 384 CB LEU A 84 16.468 3.831 59.159 1.00 12.65 C ATOM 385 CG LEU A 84 16.522 4.480 60.540 1.00 15.43 C ATOM 386 CD1 LEU A 84 16.954 5.908 60.439 1.00 16.80 C ATOM 387 CD2 LEU A 84 15.201 4.334 61.245 1.00 18.33 C ATOM 388 H LEU A 84 17.810 1.704 60.162 1.00 0.00 H ATOM 389 N VAL A 85 15.222 2.007 56.862 1.00 11.56 N ATOM 390 CA VAL A 85 15.394 1.986 55.419 1.00 12.03 C ATOM 391 C VAL A 85 15.336 3.453 54.974 1.00 12.26 C ATOM 392 O VAL A 85 14.321 4.140 55.147 1.00 14.65 O ATOM 393 CB VAL A 85 14.354 1.148 54.687 1.00 13.43 C ATOM 394 CG1 VAL A 85 14.628 1.183 53.176 1.00 15.12 C ATOM 395 CG2 VAL A 85 14.391 -0.260 55.208 1.00 14.60 C ATOM 396 H VAL A 85 14.268 2.115 57.261 1.00 0.00 H ATOM 397 N ASP A 86 16.481 3.923 54.517 1.00 12.24 N ATOM 398 CA ASP A 86 16.760 5.291 54.053 1.00 13.62 C ATOM 399 C ASP A 86 16.905 6.317 55.175 1.00 14.45 C ATOM 400 O ASP A 86 16.338 6.144 56.230 1.00 14.98 O ATOM 401 CB ASP A 86 15.837 5.680 52.916 1.00 14.49 C ATOM 402 CG ASP A 86 16.211 4.925 51.671 1.00 13.56 C ATOM 403 OD1 ASP A 86 17.428 4.819 51.373 1.00 14.19 O ATOM 404 OD2 ASP A 86 15.324 4.394 50.964 1.00 15.08 O ATOM 405 H ASP A 86 17.275 3.252 54.481 1.00 0.00 H ATOM 406 N SER A 87 17.707 7.343 54.903 1.00 14.25 N ATOM 407 CA SER A 87 17.852 8.471 55.795 1.00 15.47 C ATOM 408 C SER A 87 16.855 9.534 55.369 1.00 15.97 C ATOM 409 O SER A 87 15.678 9.234 55.133 1.00 17.22 O ATOM 410 CB SER A 87 19.335 8.927 55.913 1.00 16.11 C ATOM 411 OG SER A 87 19.885 9.616 54.768 1.00 15.87 O ATOM 412 HG SER A 87 19.844 9.023 53.976 1.00 0.00 H ATOM 413 H SER A 87 18.250 7.333 54.016 1.00 0.00 H ATOM 414 N SER A 88 17.329 10.764 55.232 1.00 17.32 N ATOM 415 CA SER A 88 16.478 11.855 54.810 1.00 16.64 C ATOM 416 C SER A 88 17.281 12.882 54.015 1.00 17.17 C ATOM 417 O SER A 88 18.477 12.682 53.747 1.00 16.90 O ATOM 418 CB SER A 88 15.789 12.500 56.018 1.00 18.52 C ATOM 419 OG SER A 88 14.661 13.254 55.618 1.00 19.50 O ATOM 420 HG SER A 88 14.013 12.660 55.163 1.00 0.00 H ATOM 421 H SER A 88 18.333 10.949 55.432 1.00 0.00 H ATOM 422 N TRP A 89 16.596 13.951 53.621 1.00 17.32 N ATOM 423 CA TRP A 89 17.104 14.942 52.681 1.00 17.90 C ATOM 424 C TRP A 89 18.419 15.566 53.096 1.00 16.92 C ATOM 425 O TRP A 89 19.207 15.977 52.216 1.00 18.42 O ATOM 426 CB TRP A 89 16.086 16.065 52.542 1.00 18.77 C ATOM 427 CG TRP A 89 14.766 15.678 52.020 1.00 19.12 C ATOM 428 CD1 TRP A 89 13.635 15.377 52.732 1.00 19.76 C ATOM 429 CD2 TRP A 89 14.413 15.586 50.643 1.00 19.46 C ATOM 430 NE1 TRP A 89 12.593 15.091 51.860 1.00 20.44 N ATOM 431 CE2 TRP A 89 13.055 15.201 50.574 1.00 20.61 C ATOM 432 CE3 TRP A 89 15.125 15.784 49.460 1.00 20.89 C ATOM 433 CZ2 TRP A 89 12.382 15.051 49.356 1.00 20.47 C ATOM 434 CZ3 TRP A 89 14.462 15.635 48.261 1.00 21.85 C ATOM 435 CH2 TRP A 89 13.110 15.247 48.216 1.00 22.28 C ATOM 436 HE1 TRP A 89 11.623 14.836 52.136 1.00 0.00 H ATOM 437 H TRP A 89 15.640 14.088 54.007 1.00 0.00 H ATOM 438 N ASP A 90 18.652 15.673 54.408 1.00 16.63 N ATOM 439 CA ASP A 90 19.858 16.323 54.887 1.00 16.43 C ATOM 440 C ASP A 90 20.193 15.839 56.284 1.00 16.20 C ATOM 441 O ASP A 90 19.481 15.012 56.873 1.00 16.64 O ATOM 442 CB ASP A 90 19.752 17.851 54.808 1.00 18.90 C ATOM 443 CG ASP A 90 18.627 18.427 55.658 1.00 21.29 C ATOM 444 OD1 ASP A 90 18.187 17.762 56.601 1.00 21.17 O ATOM 445 OD2 ASP A 90 18.197 19.576 55.380 1.00 25.77 O ATOM 446 H ASP A 90 17.966 15.289 55.089 1.00 0.00 H ATOM 447 N ASP A 91 21.282 16.360 56.811 1.00 15.70 N ATOM 448 CA ASP A 91 21.721 15.950 58.123 1.00 16.06 C ATOM 449 C ASP A 91 20.796 16.439 59.228 1.00 16.57 C ATOM 450 O ASP A 91 20.558 15.712 60.178 1.00 17.52 O ATOM 451 CB ASP A 91 23.177 16.368 58.336 1.00 17.49 C ATOM 452 CG ASP A 91 24.123 15.474 57.553 1.00 17.75 C ATOM 453 OD1 ASP A 91 24.099 14.248 57.804 1.00 17.34 O ATOM 454 OD2 ASP A 91 24.828 15.981 56.649 1.00 19.58 O ATOM 455 H ASP A 91 21.827 17.069 56.280 1.00 0.00 H ATOM 456 N LYS A 92 20.285 17.659 59.128 1.00 17.42 N ATOM 457 CA LYS A 92 19.394 18.184 60.168 1.00 18.81 C ATOM 458 C LYS A 92 18.164 17.291 60.366 1.00 17.96 C ATOM 459 O LYS A 92 17.802 16.923 61.507 1.00 17.83 O ATOM 460 CB LYS A 92 18.951 19.617 59.832 1.00 22.67 C ATOM 461 CG LYS A 92 17.938 20.172 60.816 1.00 27.13 C ATOM 462 H LYS A 92 20.518 18.249 58.304 1.00 0.00 H ATOM 463 N LEU A 93 17.530 16.906 59.257 1.00 17.17 N ATOM 464 CA LEU A 93 16.351 16.060 59.343 1.00 15.93 C ATOM 465 C LEU A 93 16.722 14.648 59.811 1.00 15.21 C ATOM 466 O LEU A 93 15.974 14.008 60.543 1.00 15.72 O ATOM 467 CB LEU A 93 15.642 15.976 57.991 1.00 16.99 C ATOM 468 CG LEU A 93 14.839 17.204 57.584 1.00 19.31 C ATOM 469 CD1 LEU A 93 14.501 17.182 56.101 1.00 19.99 C ATOM 470 CD2 LEU A 93 13.583 17.232 58.404 1.00 20.28 C ATOM 471 H LEU A 93 17.881 17.212 58.327 1.00 0.00 H ATOM 472 N THR A 94 17.855 14.134 59.356 1.00 13.72 N ATOM 473 CA THR A 94 18.273 12.797 59.754 1.00 13.26 C ATOM 474 C THR A 94 18.523 12.746 61.264 1.00 13.47 C ATOM 475 O THR A 94 18.102 11.810 61.943 1.00 13.49 O ATOM 476 CB THR A 94 19.504 12.359 58.956 1.00 13.62 C ATOM 477 OG1 THR A 94 19.140 12.262 57.569 1.00 14.34 O ATOM 478 CG2 THR A 94 19.995 11.002 59.398 1.00 14.10 C ATOM 479 HG1 THR A 94 18.826 13.145 57.249 1.00 0.00 H ATOM 480 H THR A 94 18.451 14.690 58.709 1.00 0.00 H ATOM 481 N LYS A 95 19.199 13.752 61.805 1.00 14.74 N ATOM 482 CA LYS A 95 19.435 13.825 63.244 1.00 14.94 C ATOM 483 C LYS A 95 18.097 13.826 63.986 1.00 14.89 C ATOM 484 O LYS A 95 17.905 13.091 64.975 1.00 15.74 O ATOM 485 CB LYS A 95 20.226 15.076 63.590 1.00 16.80 C ATOM 486 CG LYS A 95 21.670 15.049 63.182 1.00 17.69 C ATOM 487 CD LYS A 95 22.379 16.344 63.547 1.00 20.63 C ATOM 488 CE LYS A 95 23.848 16.235 63.223 1.00 24.11 C ATOM 489 NZ LYS A 95 24.543 17.523 63.421 1.00 27.71 N ATOM 490 HZ1 LYS A 95 24.121 18.242 62.800 1.00 0.00 H ATOM 491 HZ2 LYS A 95 24.445 17.819 64.413 1.00 0.00 H ATOM 492 HZ3 LYS A 95 25.551 17.411 63.189 1.00 0.00 H ATOM 493 H LYS A 95 19.569 14.505 61.190 1.00 0.00 H ATOM 494 N GLU A 96 17.157 14.652 63.535 1.00 16.09 N ATOM 495 CA GLU A 96 15.875 14.732 64.210 1.00 17.98 C ATOM 496 C GLU A 96 15.104 13.423 64.141 1.00 16.09 C ATOM 497 O GLU A 96 14.465 13.011 65.114 1.00 16.75 O ATOM 498 CB GLU A 96 15.022 15.839 63.629 1.00 22.38 C ATOM 499 CG GLU A 96 13.924 16.239 64.573 1.00 27.17 C ATOM 500 CD GLU A 96 13.125 17.426 64.110 1.00 31.59 C ATOM 501 OE1 GLU A 96 13.562 18.132 63.168 1.00 33.44 O ATOM 502 OE2 GLU A 96 12.047 17.640 64.701 1.00 33.32 O ATOM 503 H GLU A 96 17.341 15.241 62.698 1.00 0.00 H ATOM 504 N LEU A 97 15.136 12.765 62.988 1.00 14.72 N ATOM 505 CA LEU A 97 14.478 11.476 62.845 1.00 15.02 C ATOM 506 C LEU A 97 15.059 10.459 63.823 1.00 14.20 C ATOM 507 O LEU A 97 14.312 9.767 64.511 1.00 14.39 O ATOM 508 CB LEU A 97 14.647 10.991 61.417 1.00 15.57 C ATOM 509 CG LEU A 97 14.193 9.569 61.094 1.00 16.62 C ATOM 510 CD1 LEU A 97 12.706 9.357 61.382 1.00 18.42 C ATOM 511 CD2 LEU A 97 14.551 9.215 59.655 1.00 17.31 C ATOM 512 H LEU A 97 15.639 13.177 62.176 1.00 0.00 H ATOM 513 N ILE A 98 16.381 10.338 63.840 1.00 13.49 N ATOM 514 CA ILE A 98 17.023 9.406 64.747 1.00 12.89 C ATOM 515 C ILE A 98 16.632 9.692 66.199 1.00 13.31 C ATOM 516 O ILE A 98 16.292 8.789 66.963 1.00 13.77 O ATOM 517 CB ILE A 98 18.545 9.469 64.578 1.00 13.18 C ATOM 518 CG1 ILE A 98 18.960 8.886 63.222 1.00 13.79 C ATOM 519 CG2 ILE A 98 19.239 8.721 65.724 1.00 12.72 C ATOM 520 CD1 ILE A 98 20.375 9.273 62.817 1.00 14.49 C ATOM 521 H ILE A 98 16.960 10.916 63.198 1.00 0.00 H ATOM 522 N GLU A 99 16.689 10.947 66.575 1.00 13.55 N ATOM 523 CA GLU A 99 16.403 11.317 67.959 1.00 14.65 C ATOM 524 C GLU A 99 14.949 10.992 68.331 1.00 14.50 C ATOM 525 O GLU A 99 14.662 10.509 69.434 1.00 15.84 O ATOM 526 CB GLU A 99 16.787 12.784 68.167 1.00 17.38 C ATOM 527 CG GLU A 99 18.312 12.923 68.085 1.00 18.22 C ATOM 528 CD GLU A 99 18.820 14.302 67.722 1.00 20.95 C ATOM 529 OE1 GLU A 99 18.004 15.241 67.550 1.00 23.87 O ATOM 530 OE2 GLU A 99 20.065 14.426 67.593 1.00 22.08 O ATOM 531 H GLU A 99 16.939 11.683 65.884 1.00 0.00 H ATOM 532 N MET A 100 14.025 11.205 67.400 1.00 13.56 N ATOM 533 CA MET A 100 12.632 10.907 67.662 1.00 15.18 C ATOM 534 C MET A 100 12.424 9.419 67.901 1.00 14.47 C ATOM 535 O MET A 100 11.719 9.025 68.833 1.00 16.08 O ATOM 536 CB MET A 100 11.772 11.361 66.474 1.00 16.26 C ATOM 537 CG MET A 100 10.290 11.088 66.641 1.00 18.18 C ATOM 538 SD MET A 100 9.361 11.375 65.144 1.00 21.34 S ATOM 539 CE MET A 100 7.689 11.099 65.712 1.00 23.06 C ATOM 540 H MET A 100 14.305 11.589 66.475 1.00 0.00 H ATOM 541 N VAL A 101 12.988 8.581 67.039 1.00 14.19 N ATOM 542 CA VAL A 101 12.724 7.160 67.152 1.00 14.44 C ATOM 543 C VAL A 101 13.491 6.515 68.310 1.00 14.02 C ATOM 544 O VAL A 101 12.954 5.622 68.976 1.00 14.40 O ATOM 545 CB VAL A 101 12.930 6.400 65.808 1.00 13.98 C ATOM 546 CG1 VAL A 101 11.975 6.967 64.755 1.00 16.14 C ATOM 547 CG2 VAL A 101 14.366 6.460 65.298 1.00 14.63 C ATOM 548 H VAL A 101 13.613 8.941 66.290 1.00 0.00 H ATOM 549 N GLU A 102 14.707 6.979 68.596 1.00 13.22 N ATOM 550 CA GLU A 102 15.438 6.455 69.750 1.00 12.87 C ATOM 551 C GLU A 102 14.690 6.753 71.041 1.00 14.68 C ATOM 552 O GLU A 102 14.598 5.898 71.923 1.00 15.36 O ATOM 553 CB GLU A 102 16.868 7.012 69.770 1.00 13.26 C ATOM 554 CG GLU A 102 17.703 6.417 68.644 1.00 12.78 C ATOM 555 CD GLU A 102 19.169 6.806 68.647 1.00 12.44 C ATOM 556 OE1 GLU A 102 19.549 7.806 69.285 1.00 13.13 O ATOM 557 OE2 GLU A 102 19.950 6.101 67.987 1.00 12.37 O ATOM 558 H GLU A 102 15.137 7.714 67.999 1.00 0.00 H ATOM 559 N LYS A 103 14.144 7.953 71.154 1.00 15.14 N ATOM 560 CA LYS A 103 13.390 8.320 72.343 1.00 16.69 C ATOM 561 C LYS A 103 12.123 7.494 72.454 1.00 17.50 C ATOM 562 O LYS A 103 11.809 6.962 73.517 1.00 18.98 O ATOM 563 CB LYS A 103 13.047 9.804 72.368 1.00 19.10 C ATOM 564 CG LYS A 103 12.421 10.190 73.698 1.00 23.01 C ATOM 565 CD LYS A 103 12.204 11.666 73.799 1.00 27.61 C ATOM 566 CE LYS A 103 11.386 12.005 75.046 1.00 31.37 C ATOM 567 NZ LYS A 103 12.210 12.578 76.144 1.00 33.85 N ATOM 568 HZ1 LYS A 103 12.941 11.892 76.422 1.00 0.00 H ATOM 569 HZ2 LYS A 103 12.663 13.454 75.815 1.00 0.00 H ATOM 570 HZ3 LYS A 103 11.601 12.787 76.960 1.00 0.00 H ATOM 571 H LYS A 103 14.255 8.642 70.383 1.00 0.00 H ATOM 572 N LYS A 104 11.404 7.346 71.347 1.00 17.19 N ATOM 573 CA LYS A 104 10.126 6.661 71.404 1.00 18.85 C ATOM 574 C LYS A 104 10.278 5.181 71.692 1.00 18.46 C ATOM 575 O LYS A 104 9.606 4.637 72.564 1.00 20.23 O ATOM 576 CB LYS A 104 9.367 6.840 70.105 1.00 20.41 C ATOM 577 CG LYS A 104 8.066 6.052 70.095 1.00 24.55 C ATOM 578 CD LYS A 104 7.271 6.278 68.835 1.00 26.92 C ATOM 579 CE LYS A 104 5.975 5.471 68.837 1.00 29.86 C ATOM 580 NZ LYS A 104 5.096 5.796 70.000 1.00 32.03 N ATOM 581 HZ1 LYS A 104 5.603 5.589 70.884 1.00 0.00 H ATOM 582 HZ2 LYS A 104 4.844 6.805 69.971 1.00 0.00 H ATOM 583 HZ3 LYS A 104 4.231 5.220 69.951 1.00 0.00 H ATOM 584 H LYS A 104 11.756 7.720 70.442 1.00 0.00 H ATOM 585 N PHE A 105 11.169 4.522 70.961 1.00 16.83 N ATOM 586 CA PHE A 105 11.304 3.074 71.053 1.00 17.45 C ATOM 587 C PHE A 105 12.330 2.625 72.102 1.00 17.73 C ATOM 588 O PHE A 105 12.434 1.426 72.401 1.00 18.41 O ATOM 589 CB PHE A 105 11.628 2.497 69.687 1.00 17.78 C ATOM 590 CG PHE A 105 10.553 2.753 68.664 1.00 18.40 C ATOM 591 CD1 PHE A 105 9.307 2.153 68.781 1.00 22.06 C ATOM 592 CD2 PHE A 105 10.761 3.642 67.633 1.00 18.20 C ATOM 593 CE1 PHE A 105 8.303 2.402 67.838 1.00 23.42 C ATOM 594 CE2 PHE A 105 9.757 3.888 66.689 1.00 19.14 C ATOM 595 CZ PHE A 105 8.540 3.274 66.800 1.00 22.13 C ATOM 596 H PHE A 105 11.783 5.050 70.309 1.00 0.00 H ATOM 597 N GLN A 106 13.053 3.583 72.675 1.00 16.69 N ATOM 598 CA GLN A 106 13.965 3.313 73.781 1.00 17.52 C ATOM 599 C GLN A 106 15.046 2.312 73.404 1.00 16.88 C ATOM 600 O GLN A 106 15.379 1.412 74.162 1.00 19.10 O ATOM 601 CB GLN A 106 13.192 2.883 75.033 1.00 18.93 C ATOM 602 CG GLN A 106 12.487 4.037 75.641 1.00 21.64 C ATOM 603 CD GLN A 106 13.463 4.982 76.310 1.00 24.75 C ATOM 604 OE1 GLN A 106 14.114 4.642 77.325 1.00 29.66 O ATOM 605 NE2 GLN A 106 13.584 6.174 75.752 1.00 23.92 N ATOM 606 HE22 GLN A 106 13.023 6.413 74.909 1.00 0.00 H ATOM 607 HE21 GLN A 106 14.240 6.873 76.155 1.00 0.00 H ATOM 608 H GLN A 106 12.965 4.558 72.323 1.00 0.00 H ATOM 609 N LYS A 107 15.643 2.526 72.242 1.00 15.55 N ATOM 610 CA LYS A 107 16.795 1.772 71.809 1.00 15.30 C ATOM 611 C LYS A 107 17.503 2.579 70.748 1.00 13.20 C ATOM 612 O LYS A 107 16.991 3.607 70.301 1.00 15.10 O ATOM 613 CB LYS A 107 16.408 0.411 71.303 1.00 19.12 C ATOM 614 CG LYS A 107 15.484 0.419 70.183 1.00 19.33 C ATOM 615 CD LYS A 107 14.928 -1.001 69.904 1.00 21.97 C ATOM 616 CE LYS A 107 13.902 -1.433 70.923 1.00 24.42 C ATOM 617 NZ LYS A 107 13.063 -2.593 70.473 1.00 26.19 N ATOM 618 HZ1 LYS A 107 12.551 -2.333 69.606 1.00 0.00 H ATOM 619 HZ2 LYS A 107 13.677 -3.410 70.283 1.00 0.00 H ATOM 620 HZ3 LYS A 107 12.381 -2.836 71.220 1.00 0.00 H ATOM 621 H LYS A 107 15.267 3.267 71.616 1.00 0.00 H ATOM 622 N ARG A 108 18.695 2.140 70.354 1.00 11.70 N ATOM 623 CA ARG A 108 19.502 2.927 69.438 1.00 11.34 C ATOM 624 C ARG A 108 19.242 2.528 67.987 1.00 10.98 C ATOM 625 O ARG A 108 18.987 1.362 67.709 1.00 12.28 O ATOM 626 CB ARG A 108 21.005 2.729 69.685 1.00 11.19 C ATOM 627 CG ARG A 108 21.491 2.752 71.126 1.00 11.94 C ATOM 628 CD ARG A 108 20.954 3.869 72.002 1.00 11.40 C ATOM 629 NE ARG A 108 21.010 5.212 71.456 1.00 11.37 N ATOM 630 CZ ARG A 108 22.104 5.929 71.254 1.00 11.20 C ATOM 631 NH1 ARG A 108 23.309 5.448 71.553 1.00 11.75 N ATOM 632 NH2 ARG A 108 21.986 7.155 70.777 1.00 11.93 N ATOM 633 HE ARG A 108 20.104 5.653 71.199 1.00 0.00 H ATOM 634 HH12 ARG A 108 24.156 6.028 71.387 1.00 0.00 H ATOM 635 HH11 ARG A 108 23.403 4.493 71.953 1.00 0.00 H ATOM 636 HH22 ARG A 108 22.835 7.733 70.612 1.00 0.00 H ATOM 637 HH21 ARG A 108 21.044 7.543 70.566 1.00 0.00 H ATOM 638 H ARG A 108 19.051 1.228 70.704 1.00 0.00 H ATOM 639 N VAL A 109 19.392 3.494 67.084 1.00 11.28 N ATOM 640 CA VAL A 109 19.490 3.178 65.660 1.00 11.29 C ATOM 641 C VAL A 109 20.875 2.593 65.392 1.00 11.28 C ATOM 642 O VAL A 109 21.887 3.234 65.666 1.00 11.77 O ATOM 643 CB VAL A 109 19.280 4.438 64.777 1.00 11.53 C ATOM 644 CG1 VAL A 109 19.530 4.097 63.325 1.00 12.10 C ATOM 645 CG2 VAL A 109 17.865 5.007 64.968 1.00 12.86 C ATOM 646 H VAL A 109 19.440 4.485 67.395 1.00 0.00 H ATOM 647 N THR A 110 20.906 1.378 64.864 1.00 11.33 N ATOM 648 CA THR A 110 22.164 0.685 64.644 1.00 11.61 C ATOM 649 C THR A 110 22.585 0.612 63.180 1.00 10.76 C ATOM 650 O THR A 110 23.783 0.526 62.886 1.00 11.20 O ATOM 651 CB THR A 110 22.121 -0.741 65.216 1.00 13.19 C ATOM 652 OG1 THR A 110 21.074 -1.489 64.590 1.00 14.24 O ATOM 653 CG2 THR A 110 21.900 -0.725 66.741 1.00 15.17 C ATOM 654 HG1 THR A 110 21.240 -1.534 63.615 1.00 0.00 H ATOM 655 H THR A 110 20.014 0.912 64.602 1.00 0.00 H ATOM 656 N ASP A 111 21.613 0.587 62.274 1.00 10.53 N ATOM 657 CA ASP A 111 21.852 0.308 60.854 1.00 10.68 C ATOM 658 C ASP A 111 20.841 1.071 60.020 1.00 10.55 C ATOM 659 O ASP A 111 19.698 1.251 60.455 1.00 11.34 O ATOM 660 CB ASP A 111 21.652 -1.192 60.537 1.00 12.40 C ATOM 661 CG ASP A 111 22.621 -2.110 61.247 1.00 13.69 C ATOM 662 OD1 ASP A 111 22.437 -2.380 62.450 1.00 15.20 O ATOM 663 OD2 ASP A 111 23.558 -2.606 60.585 1.00 14.55 O ATOM 664 H ASP A 111 20.639 0.774 62.586 1.00 0.00 H ATOM 665 N VAL A 112 21.267 1.474 58.826 1.00 10.58 N ATOM 666 CA VAL A 112 20.395 2.071 57.821 1.00 10.04 C ATOM 667 C VAL A 112 20.720 1.394 56.500 1.00 10.08 C ATOM 668 O VAL A 112 21.872 1.180 56.179 1.00 12.99 O ATOM 669 CB VAL A 112 20.628 3.569 57.703 1.00 10.94 C ATOM 670 CG1 VAL A 112 19.758 4.203 56.605 1.00 11.98 C ATOM 671 CG2 VAL A 112 20.369 4.255 59.021 1.00 12.48 C ATOM 672 H VAL A 112 22.275 1.357 58.597 1.00 0.00 H ATOM 673 N ILE A 113 19.689 1.111 55.705 1.00 9.72 N ATOM 674 CA ILE A 113 19.827 0.624 54.333 1.00 9.80 C ATOM 675 C ILE A 113 19.540 1.796 53.392 1.00 9.89 C ATOM 676 O ILE A 113 18.469 2.370 53.456 1.00 10.91 O ATOM 677 CB ILE A 113 18.878 -0.536 54.048 1.00 10.67 C ATOM 678 CG1 ILE A 113 19.246 -1.733 54.965 1.00 13.23 C ATOM 679 CG2 ILE A 113 18.905 -0.938 52.580 1.00 11.94 C ATOM 680 CD1 ILE A 113 18.195 -2.781 55.078 1.00 15.21 C ATOM 681 H ILE A 113 18.729 1.244 56.083 1.00 0.00 H ATOM 682 N ILE A 114 20.520 2.130 52.547 1.00 9.74 N ATOM 683 CA ILE A 114 20.415 3.244 51.602 1.00 10.66 C ATOM 684 C ILE A 114 20.037 2.655 50.245 1.00 10.19 C ATOM 685 O ILE A 114 20.789 1.855 49.698 1.00 11.60 O ATOM 686 CB ILE A 114 21.777 4.006 51.483 1.00 11.05 C ATOM 687 CG1 ILE A 114 22.258 4.513 52.842 1.00 13.73 C ATOM 688 CG2 ILE A 114 21.674 5.124 50.476 1.00 11.99 C ATOM 689 CD1 ILE A 114 21.377 5.499 53.477 1.00 15.06 C ATOM 690 H ILE A 114 21.398 1.573 52.561 1.00 0.00 H ATOM 691 N THR A 115 18.913 3.083 49.672 1.00 10.46 N ATOM 692 CA THR A 115 18.365 2.402 48.505 1.00 10.17 C ATOM 693 C THR A 115 18.734 3.023 47.162 1.00 10.00 C ATOM 694 O THR A 115 18.530 2.373 46.137 1.00 10.67 O ATOM 695 CB THR A 115 16.868 2.193 48.627 1.00 11.90 C ATOM 696 OG1 THR A 115 16.217 3.462 48.635 1.00 12.17 O ATOM 697 CG2 THR A 115 16.508 1.386 49.860 1.00 13.49 C ATOM 698 HG1 THR A 115 16.543 3.994 49.404 1.00 0.00 H ATOM 699 H THR A 115 18.421 3.912 50.062 1.00 0.00 H ATOM 700 N HIS A 116 19.258 4.241 47.141 1.00 9.48 N ATOM 701 CA HIS A 116 19.980 4.780 45.998 1.00 9.40 C ATOM 702 C HIS A 116 20.678 6.053 46.450 1.00 10.05 C ATOM 703 O HIS A 116 20.512 6.512 47.563 1.00 12.23 O ATOM 704 CB HIS A 116 19.134 4.960 44.712 1.00 9.64 C ATOM 705 CG HIS A 116 18.062 5.999 44.776 1.00 10.07 C ATOM 706 ND1 HIS A 116 16.830 5.765 45.350 1.00 10.69 N ATOM 707 CD2 HIS A 116 17.994 7.240 44.241 1.00 10.89 C ATOM 708 CE1 HIS A 116 16.059 6.829 45.185 1.00 11.45 C ATOM 709 NE2 HIS A 116 16.745 7.749 44.528 1.00 11.97 N ATOM 710 H HIS A 116 19.148 4.841 47.983 1.00 0.00 H ATOM 711 N ALA A 117 21.494 6.590 45.554 1.00 10.85 N ATOM 712 CA ALA A 117 22.345 7.744 45.819 1.00 12.17 C ATOM 713 C ALA A 117 21.742 9.081 45.333 1.00 12.22 C ATOM 714 O ALA A 117 22.350 9.842 44.604 1.00 13.40 O ATOM 715 CB ALA A 117 23.710 7.515 45.196 1.00 12.85 C ATOM 716 H ALA A 117 21.529 6.163 44.606 1.00 0.00 H ATOM 717 N HIS A 118 20.520 9.351 45.729 1.00 13.72 N ATOM 718 CA HIS A 118 19.919 10.690 45.657 1.00 14.33 C ATOM 719 C HIS A 118 19.792 11.256 47.095 1.00 14.94 C ATOM 720 O HIS A 118 19.719 10.504 48.054 1.00 14.79 O ATOM 721 CB HIS A 118 18.531 10.654 44.988 1.00 13.94 C ATOM 722 CG HIS A 118 18.558 10.623 43.486 1.00 12.89 C ATOM 723 ND1 HIS A 118 17.463 10.240 42.732 1.00 13.21 N ATOM 724 CD2 HIS A 118 19.519 10.997 42.599 1.00 13.25 C ATOM 725 CE1 HIS A 118 17.754 10.400 41.451 1.00 12.60 C ATOM 726 NE2 HIS A 118 18.990 10.843 41.341 1.00 13.77 N ATOM 727 H HIS A 118 19.946 8.575 46.115 1.00 0.00 H ATOM 728 N ALA A 119 19.672 12.574 47.201 1.00 16.41 N ATOM 729 CA ALA A 119 19.705 13.279 48.485 1.00 15.56 C ATOM 730 C ALA A 119 18.616 12.842 49.466 1.00 15.35 C ATOM 731 O ALA A 119 18.853 12.823 50.667 1.00 16.59 O ATOM 732 CB ALA A 119 19.613 14.770 48.274 1.00 18.40 C ATOM 733 H ALA A 119 19.549 13.132 46.332 1.00 0.00 H ATOM 734 N ASP A 120 17.419 12.565 48.978 1.00 14.54 N ATOM 735 CA ASP A 120 16.345 12.121 49.862 1.00 15.51 C ATOM 736 C ASP A 120 16.672 10.830 50.578 1.00 14.55 C ATOM 737 O ASP A 120 16.186 10.576 51.682 1.00 17.55 O ATOM 738 CB ASP A 120 14.991 12.010 49.133 1.00 15.38 C ATOM 739 CG ASP A 120 14.973 11.022 47.978 1.00 14.59 C ATOM 740 OD1 ASP A 120 15.983 10.902 47.269 1.00 17.61 O ATOM 741 OD2 ASP A 120 13.876 10.423 47.738 1.00 17.32 O ATOM 742 H ASP A 120 17.241 12.664 47.958 1.00 0.00 H ATOM 743 N ARG A 121 17.469 9.973 49.931 1.00 15.02 N ATOM 744 CA ARG A 121 17.863 8.699 50.503 1.00 13.73 C ATOM 745 C ARG A 121 19.121 8.788 51.389 1.00 14.24 C ATOM 746 O ARG A 121 19.183 8.195 52.475 1.00 14.96 O ATOM 747 CB ARG A 121 18.176 7.716 49.379 1.00 12.59 C ATOM 748 CG ARG A 121 17.094 7.491 48.299 1.00 12.88 C ATOM 749 CD ARG A 121 15.841 6.851 48.797 1.00 13.66 C ATOM 750 NE ARG A 121 14.781 7.821 49.043 1.00 14.39 N ATOM 751 CZ ARG A 121 13.671 7.552 49.701 1.00 14.56 C ATOM 752 NH1 ARG A 121 13.493 6.367 50.285 1.00 16.34 N ATOM 753 NH2 ARG A 121 12.745 8.471 49.788 1.00 17.88 N ATOM 754 HE ARG A 121 14.909 8.786 48.676 1.00 0.00 H ATOM 755 HH12 ARG A 121 12.612 6.169 50.801 1.00 0.00 H ATOM 756 HH11 ARG A 121 14.235 5.641 50.225 1.00 0.00 H ATOM 757 HH22 ARG A 121 11.864 8.274 50.304 1.00 0.00 H ATOM 758 HH21 ARG A 121 12.890 9.399 49.341 1.00 0.00 H ATOM 759 H ARG A 121 17.818 10.228 48.985 1.00 0.00 H ATOM 760 N ILE A 122 20.120 9.502 50.863 1.00 13.32 N ATOM 761 CA ILE A 122 21.482 9.478 51.425 1.00 13.85 C ATOM 762 C ILE A 122 21.959 10.777 52.048 1.00 14.51 C ATOM 763 O ILE A 122 23.092 10.869 52.556 1.00 13.49 O ATOM 764 CB ILE A 122 22.460 9.079 50.315 1.00 14.39 C ATOM 765 CG1 ILE A 122 23.701 8.408 50.884 1.00 14.81 C ATOM 766 CG2 ILE A 122 22.801 10.226 49.421 1.00 14.60 C ATOM 767 CD1 ILE A 122 24.624 7.827 49.825 1.00 16.09 C ATOM 768 H ILE A 122 19.930 10.094 50.029 1.00 0.00 H ATOM 769 N GLY A 123 21.091 11.776 52.076 1.00 14.16 N ATOM 770 CA GLY A 123 21.494 13.110 52.500 1.00 14.63 C ATOM 771 C GLY A 123 21.990 13.169 53.929 1.00 14.34 C ATOM 772 O GLY A 123 22.696 14.107 54.279 1.00 15.76 O ATOM 773 H GLY A 123 20.106 11.606 51.791 1.00 0.00 H ATOM 774 N GLY A 124 21.601 12.207 54.770 1.00 13.51 N ATOM 775 CA GLY A 124 22.067 12.168 56.145 1.00 13.33 C ATOM 776 C GLY A 124 23.258 11.269 56.415 1.00 12.38 C ATOM 777 O GLY A 124 23.556 10.965 57.578 1.00 13.23 O ATOM 778 H GLY A 124 20.950 11.469 54.433 1.00 0.00 H ATOM 779 N ILE A 125 23.985 10.864 55.375 1.00 12.03 N ATOM 780 CA ILE A 125 25.065 9.908 55.583 1.00 12.89 C ATOM 781 C ILE A 125 26.161 10.415 56.522 1.00 12.55 C ATOM 782 O ILE A 125 26.729 9.627 57.273 1.00 13.24 O ATOM 783 CB ILE A 125 25.630 9.408 54.207 1.00 14.23 C ATOM 784 CG1 ILE A 125 26.706 8.361 54.396 1.00 17.19 C ATOM 785 CG2 ILE A 125 26.229 10.517 53.378 1.00 15.04 C ATOM 786 CD1 ILE A 125 26.218 7.090 54.916 1.00 19.59 C ATOM 787 H ILE A 125 23.783 11.227 54.422 1.00 0.00 H ATOM 788 N LYS A 126 26.466 11.702 56.499 1.00 13.39 N ATOM 789 CA LYS A 126 27.491 12.214 57.396 1.00 13.69 C ATOM 790 C LYS A 126 27.101 11.962 58.857 1.00 13.89 C ATOM 791 O LYS A 126 27.932 11.561 59.688 1.00 14.70 O ATOM 792 CB LYS A 126 27.670 13.700 57.165 1.00 15.77 C ATOM 793 CG LYS A 126 28.599 14.352 58.153 1.00 18.70 C ATOM 794 CD LYS A 126 28.757 15.827 57.853 1.00 22.11 C ATOM 795 CE LYS A 126 29.521 16.528 58.946 1.00 26.60 C ATOM 796 NZ LYS A 126 30.956 16.610 58.610 1.00 29.32 N ATOM 797 HZ1 LYS A 126 31.339 15.650 58.494 1.00 0.00 H ATOM 798 HZ2 LYS A 126 31.073 17.141 57.723 1.00 0.00 H ATOM 799 HZ3 LYS A 126 31.463 17.097 59.377 1.00 0.00 H ATOM 800 H LYS A 126 25.976 12.344 55.844 1.00 0.00 H ATOM 801 N THR A 127 25.844 12.215 59.180 1.00 13.34 N ATOM 802 CA THR A 127 25.318 11.946 60.511 1.00 13.60 C ATOM 803 C THR A 127 25.435 10.481 60.885 1.00 12.74 C ATOM 804 O THR A 127 25.850 10.133 61.993 1.00 13.29 O ATOM 805 CB THR A 127 23.843 12.371 60.600 1.00 14.62 C ATOM 806 OG1 THR A 127 23.719 13.779 60.399 1.00 15.61 O ATOM 807 CG2 THR A 127 23.234 12.029 61.940 1.00 15.27 C ATOM 808 HG1 THR A 127 24.070 14.016 59.504 1.00 0.00 H ATOM 809 H THR A 127 25.211 12.619 58.461 1.00 0.00 H ATOM 810 N LEU A 128 25.066 9.603 59.960 1.00 12.40 N ATOM 811 CA LEU A 128 25.131 8.172 60.241 1.00 12.50 C ATOM 812 C LEU A 128 26.564 7.787 60.565 1.00 13.15 C ATOM 813 O LEU A 128 26.833 7.105 61.562 1.00 14.08 O ATOM 814 CB LEU A 128 24.641 7.364 59.049 1.00 12.30 C ATOM 815 CG LEU A 128 23.252 7.674 58.539 1.00 12.11 C ATOM 816 CD1 LEU A 128 22.915 6.717 57.415 1.00 12.90 C ATOM 817 CD2 LEU A 128 22.216 7.623 59.655 1.00 13.15 C ATOM 818 H LEU A 128 24.730 9.935 59.034 1.00 0.00 H ATOM 819 N LYS A 129 27.512 8.197 59.731 1.00 13.69 N ATOM 820 CA LYS A 129 28.876 7.739 59.926 1.00 15.57 C ATOM 821 C LYS A 129 29.453 8.284 61.222 1.00 15.18 C ATOM 822 O LYS A 129 30.136 7.551 61.954 1.00 16.81 O ATOM 823 CB LYS A 129 29.725 8.065 58.712 1.00 19.82 C ATOM 824 CG LYS A 129 29.201 7.296 57.490 1.00 23.27 C ATOM 825 CD LYS A 129 30.196 6.307 56.897 1.00 29.47 C ATOM 826 CE LYS A 129 31.342 7.042 56.260 1.00 30.22 C ATOM 827 NZ LYS A 129 32.125 6.304 55.254 1.00 29.16 N ATOM 828 HZ1 LYS A 129 32.541 5.458 55.693 1.00 0.00 H ATOM 829 HZ2 LYS A 129 31.502 6.020 54.472 1.00 0.00 H ATOM 830 HZ3 LYS A 129 32.883 6.915 54.890 1.00 0.00 H ATOM 831 H LYS A 129 27.280 8.839 58.947 1.00 0.00 H ATOM 832 N GLU A 130 29.198 9.545 61.552 1.00 13.81 N ATOM 833 CA GLU A 130 29.812 10.108 62.748 1.00 14.70 C ATOM 834 C GLU A 130 29.201 9.558 64.036 1.00 14.28 C ATOM 835 O GLU A 130 29.861 9.598 65.085 1.00 15.16 O ATOM 836 CB GLU A 130 29.772 11.621 62.715 1.00 17.85 C ATOM 837 CG GLU A 130 28.436 12.190 62.963 1.00 17.12 C ATOM 838 CD GLU A 130 28.364 13.669 62.643 1.00 20.26 C ATOM 839 OE1 GLU A 130 29.391 14.242 62.214 1.00 24.59 O ATOM 840 OE2 GLU A 130 27.276 14.264 62.838 1.00 19.98 O ATOM 841 H GLU A 130 28.567 10.125 60.963 1.00 0.00 H ATOM 842 N ARG A 131 27.980 9.044 63.988 1.00 13.24 N ATOM 843 CA ARG A 131 27.328 8.383 65.118 1.00 13.35 C ATOM 844 C ARG A 131 27.615 6.888 65.212 1.00 12.97 C ATOM 845 O ARG A 131 27.182 6.224 66.150 1.00 13.48 O ATOM 846 CB ARG A 131 25.815 8.631 65.088 1.00 14.15 C ATOM 847 CG ARG A 131 25.483 10.071 65.275 1.00 14.83 C ATOM 848 CD ARG A 131 24.016 10.324 65.478 1.00 15.46 C ATOM 849 NE ARG A 131 23.775 11.746 65.614 1.00 15.75 N ATOM 850 CZ ARG A 131 22.664 12.290 66.092 1.00 16.35 C ATOM 851 NH1 ARG A 131 21.644 11.536 66.458 1.00 16.77 N ATOM 852 NH2 ARG A 131 22.576 13.606 66.178 1.00 17.79 N ATOM 853 HE ARG A 131 24.533 12.391 65.313 1.00 0.00 H ATOM 854 HH12 ARG A 131 20.779 11.977 66.831 1.00 0.00 H ATOM 855 HH11 ARG A 131 21.705 10.501 66.373 1.00 0.00 H ATOM 856 HH22 ARG A 131 21.711 14.046 66.551 1.00 0.00 H ATOM 857 HH21 ARG A 131 23.372 14.201 65.873 1.00 0.00 H ATOM 858 H ARG A 131 27.454 9.115 63.093 1.00 0.00 H ATOM 859 N GLY A 132 28.349 6.338 64.255 1.00 13.19 N ATOM 860 CA GLY A 132 28.632 4.920 64.273 1.00 12.94 C ATOM 861 C GLY A 132 27.447 4.048 63.904 1.00 12.21 C ATOM 862 O GLY A 132 27.349 2.906 64.335 1.00 13.36 O ATOM 863 H GLY A 132 28.724 6.930 63.486 1.00 0.00 H ATOM 864 N ILE A 133 26.551 4.597 63.088 1.00 11.71 N ATOM 865 CA ILE A 133 25.422 3.870 62.524 1.00 11.65 C ATOM 866 C ILE A 133 25.874 3.265 61.202 1.00 12.00 C ATOM 867 O ILE A 133 26.364 3.982 60.335 1.00 13.90 O ATOM 868 CB ILE A 133 24.233 4.818 62.298 1.00 11.63 C ATOM 869 CG1 ILE A 133 23.743 5.376 63.644 1.00 12.32 C ATOM 870 CG2 ILE A 133 23.093 4.115 61.581 1.00 11.85 C ATOM 871 CD1 ILE A 133 22.792 6.554 63.527 1.00 12.53 C ATOM 872 H ILE A 133 26.663 5.601 62.839 1.00 0.00 H ATOM 873 N LYS A 134 25.725 1.957 61.039 1.00 12.25 N ATOM 874 CA LYS A 134 26.175 1.273 59.814 1.00 12.34 C ATOM 875 C LYS A 134 25.265 1.641 58.647 1.00 12.51 C ATOM 876 O LYS A 134 24.069 1.504 58.760 1.00 15.15 O ATOM 877 CB LYS A 134 26.168 -0.237 60.022 1.00 15.47 C ATOM 878 CG LYS A 134 27.108 -0.677 61.109 1.00 19.25 C ATOM 879 CD LYS A 134 26.926 -2.144 61.485 1.00 24.24 C ATOM 880 CE LYS A 134 27.641 -2.503 62.809 1.00 26.58 C ATOM 881 H LYS A 134 25.279 1.400 61.795 1.00 0.00 H ATOM 882 N ALA A 135 25.849 2.090 57.552 1.00 12.05 N ATOM 883 CA ALA A 135 25.091 2.507 56.371 1.00 11.33 C ATOM 884 C ALA A 135 25.318 1.512 55.237 1.00 11.48 C ATOM 885 O ALA A 135 26.351 1.540 54.570 1.00 13.99 O ATOM 886 CB ALA A 135 25.518 3.890 55.948 1.00 13.34 C ATOM 887 H ALA A 135 26.887 2.150 57.527 1.00 0.00 H ATOM 888 N HIS A 136 24.375 0.607 55.053 1.00 10.64 N ATOM 889 CA HIS A 136 24.490 -0.444 54.050 1.00 10.12 C ATOM 890 C HIS A 136 24.050 0.078 52.686 1.00 9.84 C ATOM 891 O HIS A 136 23.125 0.887 52.589 1.00 11.08 O ATOM 892 CB HIS A 136 23.584 -1.623 54.433 1.00 11.00 C ATOM 893 CG HIS A 136 23.867 -2.163 55.794 1.00 12.77 C ATOM 894 ND1 HIS A 136 24.873 -3.067 56.052 1.00 16.74 N ATOM 895 CD2 HIS A 136 23.327 -1.857 57.000 1.00 14.36 C ATOM 896 CE1 HIS A 136 24.911 -3.328 57.349 1.00 15.70 C ATOM 897 NE2 HIS A 136 23.986 -2.606 57.948 1.00 14.81 N ATOM 898 H HIS A 136 23.520 0.645 55.644 1.00 0.00 H ATOM 899 N SER A 137 24.694 -0.429 51.642 1.00 9.74 N ATOM 900 CA SER A 137 24.319 -0.067 50.275 1.00 9.56 C ATOM 901 C SER A 137 24.956 -1.061 49.351 1.00 9.28 C ATOM 902 O SER A 137 25.866 -1.786 49.740 1.00 10.46 O ATOM 903 CB SER A 137 24.856 1.332 49.909 1.00 10.87 C ATOM 904 OG SER A 137 26.255 1.311 49.644 1.00 10.85 O ATOM 905 HG SER A 137 26.437 0.700 48.886 1.00 0.00 H ATOM 906 H SER A 137 25.478 -1.094 51.798 1.00 0.00 H ATOM 907 N THR A 138 24.532 -1.057 48.100 1.00 9.13 N ATOM 908 CA THR A 138 25.288 -1.772 47.081 1.00 9.45 C ATOM 909 C THR A 138 26.601 -1.034 46.800 1.00 9.72 C ATOM 910 O THR A 138 26.771 0.148 47.116 1.00 10.01 O ATOM 911 CB THR A 138 24.524 -1.894 45.753 1.00 9.59 C ATOM 912 OG1 THR A 138 24.354 -0.575 45.263 1.00 9.82 O ATOM 913 CG2 THR A 138 23.181 -2.598 45.939 1.00 10.32 C ATOM 914 HG1 THR A 138 23.864 -0.604 44.403 1.00 0.00 H ATOM 915 H THR A 138 23.663 -0.546 47.844 1.00 0.00 H ATOM 916 N ALA A 139 27.536 -1.734 46.175 1.00 10.34 N ATOM 917 CA ALA A 139 28.781 -1.118 45.715 1.00 11.18 C ATOM 918 C ALA A 139 28.516 0.014 44.734 1.00 10.79 C ATOM 919 O ALA A 139 29.174 1.052 44.786 1.00 11.59 O ATOM 920 CB ALA A 139 29.713 -2.161 45.095 1.00 12.65 C ATOM 921 H ALA A 139 27.381 -2.749 46.007 1.00 0.00 H ATOM 922 N LEU A 140 27.556 -0.167 43.839 1.00 10.24 N ATOM 923 CA LEU A 140 27.270 0.865 42.837 1.00 10.55 C ATOM 924 C LEU A 140 26.723 2.114 43.533 1.00 9.43 C ATOM 925 O LEU A 140 27.126 3.229 43.206 1.00 10.54 O ATOM 926 CB LEU A 140 26.274 0.328 41.819 1.00 10.46 C ATOM 927 CG LEU A 140 25.845 1.293 40.721 1.00 11.24 C ATOM 928 CD1 LEU A 140 27.040 1.830 39.929 1.00 12.59 C ATOM 929 CD2 LEU A 140 24.816 0.595 39.824 1.00 12.05 C ATOM 930 H LEU A 140 27.002 -1.047 43.847 1.00 0.00 H ATOM 931 N THR A 141 25.806 1.960 44.476 1.00 9.29 N ATOM 932 CA THR A 141 25.332 3.117 45.247 1.00 9.43 C ATOM 933 C THR A 141 26.472 3.837 45.931 1.00 9.99 C ATOM 934 O THR A 141 26.524 5.070 45.926 1.00 10.64 O ATOM 935 CB THR A 141 24.229 2.700 46.245 1.00 9.06 C ATOM 936 OG1 THR A 141 23.111 2.208 45.517 1.00 9.44 O ATOM 937 CG2 THR A 141 23.828 3.815 47.169 1.00 9.39 C ATOM 938 HG1 THR A 141 22.770 2.919 44.918 1.00 0.00 H ATOM 939 H THR A 141 25.419 1.015 44.672 1.00 0.00 H ATOM 940 N ALA A 142 27.423 3.093 46.507 1.00 10.23 N ATOM 941 CA ALA A 142 28.559 3.720 47.179 1.00 11.80 C ATOM 942 C ALA A 142 29.431 4.489 46.182 1.00 12.48 C ATOM 943 O ALA A 142 29.897 5.567 46.491 1.00 13.87 O ATOM 944 CB ALA A 142 29.377 2.688 47.943 1.00 12.99 C ATOM 945 H ALA A 142 27.353 2.056 46.476 1.00 0.00 H ATOM 946 N GLU A 143 29.624 3.910 44.985 1.00 11.96 N ATOM 947 CA GLU A 143 30.460 4.484 43.925 1.00 12.79 C ATOM 948 C GLU A 143 29.833 5.802 43.437 1.00 13.16 C ATOM 949 O GLU A 143 30.547 6.787 43.197 1.00 13.29 O ATOM 950 CB GLU A 143 30.623 3.465 42.761 1.00 12.19 C ATOM 951 CG GLU A 143 31.597 3.870 41.622 1.00 12.83 C ATOM 952 CD GLU A 143 31.693 2.805 40.526 1.00 12.65 C ATOM 953 OE1 GLU A 143 30.646 2.127 40.320 1.00 14.41 O ATOM 954 OE2 GLU A 143 32.758 2.653 39.882 1.00 13.49 O ATOM 955 H GLU A 143 29.153 3.002 44.799 1.00 0.00 H ATOM 956 N LEU A 144 28.508 5.819 43.278 1.00 12.75 N ATOM 957 CA LEU A 144 27.791 7.008 42.867 1.00 13.13 C ATOM 958 C LEU A 144 27.780 8.050 43.987 1.00 13.82 C ATOM 959 O LEU A 144 27.906 9.235 43.727 1.00 15.30 O ATOM 960 CB LEU A 144 26.365 6.625 42.440 1.00 12.93 C ATOM 961 CG LEU A 144 26.264 5.777 41.182 1.00 12.61 C ATOM 962 CD1 LEU A 144 24.893 5.242 40.979 1.00 14.65 C ATOM 963 CD2 LEU A 144 26.682 6.554 39.964 1.00 14.35 C ATOM 964 H LEU A 144 27.971 4.946 43.456 1.00 0.00 H ATOM 965 N ALA A 145 27.618 7.620 45.232 1.00 13.09 N ATOM 966 CA ALA A 145 27.671 8.565 46.350 1.00 13.41 C ATOM 967 C ALA A 145 29.023 9.300 46.329 1.00 13.97 C ATOM 968 O ALA A 145 29.060 10.524 46.431 1.00 15.78 O ATOM 969 CB ALA A 145 27.495 7.843 47.681 1.00 14.06 C ATOM 970 H ALA A 145 27.453 6.610 45.414 1.00 0.00 H ATOM 971 N LYS A 146 30.116 8.546 46.184 1.00 14.89 N ATOM 972 CA LYS A 146 31.473 9.121 46.184 1.00 16.62 C ATOM 973 C LYS A 146 31.640 10.091 45.030 1.00 16.72 C ATOM 974 O LYS A 146 32.178 11.196 45.180 1.00 18.78 O ATOM 975 CB LYS A 146 32.526 8.008 46.096 1.00 18.32 C ATOM 976 CG LYS A 146 33.977 8.513 46.250 1.00 21.53 C ATOM 977 CD LYS A 146 34.998 7.388 46.199 1.00 24.38 C ATOM 978 CE LYS A 146 36.401 7.846 46.569 1.00 27.39 C ATOM 979 NZ LYS A 146 37.353 6.705 46.495 1.00 29.61 N ATOM 980 HZ1 LYS A 146 37.053 5.961 47.157 1.00 0.00 H ATOM 981 HZ2 LYS A 146 37.363 6.326 45.527 1.00 0.00 H ATOM 982 HZ3 LYS A 146 38.306 7.033 46.750 1.00 0.00 H ATOM 983 H LYS A 146 30.006 7.518 46.067 1.00 0.00 H ATOM 984 N LYS A 147 31.190 9.674 43.850 1.00 17.19 N ATOM 985 CA LYS A 147 31.290 10.504 42.673 1.00 18.89 C ATOM 986 C LYS A 147 30.600 11.836 42.883 1.00 18.26 C ATOM 987 O LYS A 147 31.093 12.859 42.394 1.00 20.95 O ATOM 988 CB LYS A 147 30.638 9.798 41.487 1.00 21.54 C ATOM 989 CG LYS A 147 30.790 10.569 40.203 1.00 24.29 C ATOM 990 CD LYS A 147 30.822 9.662 39.002 1.00 27.24 C ATOM 991 CE LYS A 147 29.475 9.344 38.439 1.00 29.72 C ATOM 992 NZ LYS A 147 29.732 8.857 37.036 1.00 27.60 N ATOM 993 HZ1 LYS A 147 30.205 9.606 36.492 1.00 0.00 H ATOM 994 HZ2 LYS A 147 30.340 8.014 37.069 1.00 0.00 H ATOM 995 HZ3 LYS A 147 28.827 8.616 36.583 1.00 0.00 H ATOM 996 H LYS A 147 30.757 8.731 43.774 1.00 0.00 H ATOM 997 N ASN A 148 29.488 11.829 43.620 1.00 17.13 N ATOM 998 CA ASN A 148 28.687 13.019 43.843 1.00 17.74 C ATOM 999 C ASN A 148 28.994 13.778 45.126 1.00 17.61 C ATOM 1000 O ASN A 148 28.305 14.745 45.474 1.00 17.90 O ATOM 1001 CB ASN A 148 27.223 12.662 43.767 1.00 19.34 C ATOM 1002 CG ASN A 148 26.837 12.157 42.387 1.00 22.84 C ATOM 1003 OD1 ASN A 148 27.438 12.529 41.381 1.00 27.45 O ATOM 1004 ND2 ASN A 148 25.877 11.291 42.341 1.00 23.40 N ATOM 1005 HD22 ASN A 148 25.394 11.003 43.216 1.00 0.00 H ATOM 1006 HD21 ASN A 148 25.588 10.883 41.429 1.00 0.00 H ATOM 1007 H ASN A 148 29.182 10.934 44.053 1.00 0.00 H ATOM 1008 N GLY A 149 30.081 13.404 45.775 1.00 17.70 N ATOM 1009 CA GLY A 149 30.593 14.169 46.901 1.00 18.52 C ATOM 1010 C GLY A 149 29.998 13.826 48.250 1.00 19.35 C ATOM 1011 O GLY A 149 30.235 14.551 49.217 1.00 21.48 O ATOM 1012 H GLY A 149 30.582 12.544 45.475 1.00 0.00 H ATOM 1013 N TYR A 150 29.246 12.733 48.341 1.00 18.20 N ATOM 1014 CA TYR A 150 28.743 12.272 49.635 1.00 18.00 C ATOM 1015 C TYR A 150 29.727 11.323 50.278 1.00 17.01 C ATOM 1016 O TYR A 150 30.479 10.623 49.584 1.00 18.67 O ATOM 1017 CB TYR A 150 27.413 11.550 49.455 1.00 18.80 C ATOM 1018 CG TYR A 150 26.235 12.435 49.179 1.00 20.62 C ATOM 1019 CD1 TYR A 150 25.746 13.294 50.144 1.00 22.13 C ATOM 1020 CD2 TYR A 150 25.566 12.366 47.963 1.00 24.41 C ATOM 1021 CE1 TYR A 150 24.661 14.099 49.904 1.00 24.97 C ATOM 1022 CE2 TYR A 150 24.462 13.165 47.711 1.00 27.61 C ATOM 1023 CZ TYR A 150 24.012 14.033 48.687 1.00 28.10 C ATOM 1024 OH TYR A 150 22.912 14.844 48.451 1.00 31.84 O ATOM 1025 HH TYR A 150 22.733 15.396 49.253 1.00 0.00 H ATOM 1026 H TYR A 150 29.012 12.198 47.480 1.00 0.00 H ATOM 1027 N GLU A 151 29.672 11.231 51.605 1.00 17.75 N ATOM 1028 CA GLU A 151 30.423 10.193 52.293 1.00 17.73 C ATOM 1029 C GLU A 151 29.873 8.840 51.859 1.00 16.30 C ATOM 1030 O GLU A 151 28.725 8.717 51.437 1.00 15.86 O ATOM 1031 CB GLU A 151 30.348 10.381 53.793 1.00 19.34 C ATOM 1032 CG GLU A 151 31.110 11.627 54.200 1.00 22.20 C ATOM 1033 CD GLU A 151 31.051 11.925 55.681 1.00 24.53 C ATOM 1034 OE1 GLU A 151 31.077 10.990 56.488 1.00 25.00 O ATOM 1035 OE2 GLU A 151 30.995 13.114 56.033 1.00 27.96 O ATOM 1036 H GLU A 151 29.092 11.901 52.149 1.00 0.00 H ATOM 1037 N GLU A 152 30.718 7.828 51.928 1.00 16.75 N ATOM 1038 CA GLU A 152 30.369 6.557 51.319 1.00 17.20 C ATOM 1039 C GLU A 152 29.721 5.584 52.289 1.00 15.39 C ATOM 1040 O GLU A 152 30.242 5.350 53.390 1.00 15.70 O ATOM 1041 CB GLU A 152 31.592 5.854 50.769 1.00 22.34 C ATOM 1042 CG GLU A 152 32.023 6.215 49.386 1.00 26.12 C ATOM 1043 CD GLU A 152 33.216 5.364 48.982 1.00 29.61 C ATOM 1044 OE1 GLU A 152 33.036 4.167 48.643 1.00 31.13 O ATOM 1045 OE2 GLU A 152 34.343 5.873 49.060 1.00 31.11 O ATOM 1046 H GLU A 152 31.629 7.941 52.416 1.00 0.00 H ATOM 1047 N PRO A 153 28.620 4.970 51.865 1.00 14.89 N ATOM 1048 CA PRO A 153 28.105 3.818 52.608 1.00 13.37 C ATOM 1049 C PRO A 153 28.968 2.588 52.343 1.00 12.63 C ATOM 1050 O PRO A 153 29.971 2.682 51.614 1.00 13.97 O ATOM 1051 CB PRO A 153 26.694 3.662 52.062 1.00 15.75 C ATOM 1052 CG PRO A 153 26.746 4.369 50.721 1.00 19.07 C ATOM 1053 CD PRO A 153 27.793 5.331 50.706 1.00 17.05 C ATOM 1054 N LEU A 154 28.580 1.459 52.918 1.00 12.34 N ATOM 1055 CA LEU A 154 29.477 0.307 53.004 1.00 12.82 C ATOM 1056 C LEU A 154 29.700 -0.429 51.699 1.00 12.51 C ATOM 1057 O LEU A 154 30.721 -1.089 51.521 1.00 14.46 O ATOM 1058 CB LEU A 154 28.931 -0.672 54.025 1.00 13.68 C ATOM 1059 CG LEU A 154 29.080 -0.205 55.473 1.00 16.29 C ATOM 1060 CD1 LEU A 154 28.146 -1.042 56.362 1.00 16.95 C ATOM 1061 CD2 LEU A 154 30.535 -0.279 55.937 1.00 18.08 C ATOM 1062 H LEU A 154 27.621 1.391 53.315 1.00 0.00 H ATOM 1063 N GLY A 155 28.759 -0.382 50.771 1.00 11.60 N ATOM 1064 CA GLY A 155 28.943 -1.128 49.533 1.00 12.58 C ATOM 1065 C GLY A 155 28.928 -2.641 49.726 1.00 12.44 C ATOM 1066 O GLY A 155 29.538 -3.365 48.945 1.00 15.38 O ATOM 1067 H GLY A 155 27.898 0.181 50.923 1.00 0.00 H ATOM 1068 N ASP A 156 28.215 -3.100 50.747 1.00 12.09 N ATOM 1069 CA ASP A 156 28.167 -4.491 51.170 1.00 13.10 C ATOM 1070 C ASP A 156 27.035 -5.318 50.564 1.00 13.59 C ATOM 1071 O ASP A 156 27.077 -6.544 50.609 1.00 16.74 O ATOM 1072 CB ASP A 156 28.092 -4.562 52.716 1.00 14.58 C ATOM 1073 CG ASP A 156 26.902 -3.832 53.322 1.00 15.43 C ATOM 1074 OD1 ASP A 156 26.422 -2.816 52.790 1.00 12.98 O ATOM 1075 OD2 ASP A 156 26.498 -4.297 54.409 1.00 21.06 O ATOM 1076 H ASP A 156 27.648 -2.414 51.285 1.00 0.00 H ATOM 1077 N LEU A 157 26.009 -4.685 50.031 1.00 12.24 N ATOM 1078 CA LEU A 157 24.849 -5.402 49.516 1.00 12.21 C ATOM 1079 C LEU A 157 25.099 -5.895 48.104 1.00 12.96 C ATOM 1080 O LEU A 157 25.657 -5.177 47.289 1.00 14.11 O ATOM 1081 CB LEU A 157 23.630 -4.487 49.530 1.00 10.80 C ATOM 1082 CG LEU A 157 23.259 -3.868 50.875 1.00 10.84 C ATOM 1083 CD1 LEU A 157 22.058 -2.948 50.690 1.00 11.58 C ATOM 1084 CD2 LEU A 157 22.974 -4.942 51.941 1.00 12.39 C ATOM 1085 H LEU A 157 26.028 -3.647 49.976 1.00 0.00 H ATOM 1086 N GLN A 158 24.695 -7.130 47.854 1.00 14.12 N ATOM 1087 CA GLN A 158 24.833 -7.778 46.566 1.00 14.17 C ATOM 1088 C GLN A 158 23.522 -7.664 45.784 1.00 14.33 C ATOM 1089 O GLN A 158 22.686 -6.852 46.108 1.00 18.97 O ATOM 1090 CB GLN A 158 25.243 -9.243 46.756 1.00 17.02 C ATOM 1091 CG GLN A 158 26.460 -9.368 47.635 1.00 21.36 C ATOM 1092 CD GLN A 158 27.576 -8.477 47.165 1.00 25.32 C ATOM 1093 OE1 GLN A 158 28.085 -7.628 47.915 1.00 28.51 O ATOM 1094 NE2 GLN A 158 27.973 -8.655 45.913 1.00 27.16 N ATOM 1095 HE22 GLN A 158 27.517 -9.379 45.321 1.00 0.00 H ATOM 1096 HE21 GLN A 158 28.740 -8.071 45.523 1.00 0.00 H ATOM 1097 H GLN A 158 24.253 -7.667 48.627 1.00 0.00 H ATOM 1098 N THR A 159 23.331 -8.441 44.743 1.00 13.56 N ATOM 1099 CA THR A 159 22.062 -8.374 44.029 1.00 13.65 C ATOM 1100 C THR A 159 20.925 -8.853 44.919 1.00 12.16 C ATOM 1101 O THR A 159 19.853 -8.231 44.928 1.00 13.21 O ATOM 1102 CB THR A 159 22.129 -9.179 42.731 1.00 16.50 C ATOM 1103 OG1 THR A 159 23.073 -8.538 41.869 1.00 21.76 O ATOM 1104 CG2 THR A 159 20.776 -9.235 42.024 1.00 16.72 C ATOM 1105 HG1 THR A 159 23.960 -8.519 42.309 1.00 0.00 H ATOM 1106 H THR A 159 24.076 -9.096 44.432 1.00 0.00 H ATOM 1107 N VAL A 160 21.162 -9.931 45.659 1.00 12.80 N ATOM 1108 CA VAL A 160 20.242 -10.365 46.707 1.00 13.95 C ATOM 1109 C VAL A 160 21.058 -10.455 47.979 1.00 14.08 C ATOM 1110 O VAL A 160 22.058 -11.175 48.005 1.00 15.99 O ATOM 1111 CB VAL A 160 19.599 -11.749 46.404 1.00 15.84 C ATOM 1112 CG1 VAL A 160 18.817 -12.231 47.603 1.00 17.79 C ATOM 1113 CG2 VAL A 160 18.683 -11.654 45.180 1.00 17.61 C ATOM 1114 H VAL A 160 22.027 -10.481 45.487 1.00 0.00 H ATOM 1115 N THR A 161 20.621 -9.783 49.044 1.00 13.18 N ATOM 1116 CA THR A 161 21.277 -9.926 50.346 1.00 13.06 C ATOM 1117 C THR A 161 20.213 -10.164 51.395 1.00 13.20 C ATOM 1118 O THR A 161 19.203 -9.488 51.418 1.00 14.48 O ATOM 1119 CB THR A 161 22.140 -8.694 50.673 1.00 14.40 C ATOM 1120 OG1 THR A 161 23.241 -8.659 49.748 1.00 16.86 O ATOM 1121 CG2 THR A 161 22.726 -8.778 52.060 1.00 15.10 C ATOM 1122 HG1 THR A 161 23.777 -9.486 49.843 1.00 0.00 H ATOM 1123 H THR A 161 19.803 -9.148 48.949 1.00 0.00 H ATOM 1124 N ASN A 162 20.456 -11.138 52.265 1.00 15.04 N ATOM 1125 CA ASN A 162 19.562 -11.423 53.375 1.00 16.54 C ATOM 1126 C ASN A 162 20.237 -11.048 54.674 1.00 17.48 C ATOM 1127 O ASN A 162 21.312 -11.549 54.993 1.00 20.23 O ATOM 1128 CB ASN A 162 19.102 -12.870 53.359 1.00 19.61 C ATOM 1129 CG ASN A 162 17.939 -13.045 52.417 1.00 24.13 C ATOM 1130 OD1 ASN A 162 16.799 -12.745 52.776 1.00 27.19 O ATOM 1131 ND2 ASN A 162 18.228 -13.395 51.183 1.00 26.85 N ATOM 1132 HD22 ASN A 162 19.206 -13.640 50.927 1.00 0.00 H ATOM 1133 HD21 ASN A 162 17.479 -13.427 50.463 1.00 0.00 H ATOM 1134 H ASN A 162 21.313 -11.715 52.148 1.00 0.00 H ATOM 1135 N LEU A 163 19.574 -10.168 55.419 1.00 17.78 N ATOM 1136 CA LEU A 163 20.056 -9.659 56.688 1.00 18.46 C ATOM 1137 C LEU A 163 19.086 -10.056 57.788 1.00 19.24 C ATOM 1138 O LEU A 163 17.912 -10.286 57.530 1.00 19.20 O ATOM 1139 CB LEU A 163 20.142 -8.132 56.629 1.00 20.32 C ATOM 1140 CG LEU A 163 20.974 -7.543 55.493 1.00 23.03 C ATOM 1141 CD1 LEU A 163 20.763 -6.029 55.380 1.00 24.89 C ATOM 1142 CD2 LEU A 163 22.414 -7.881 55.737 1.00 25.82 C ATOM 1143 H LEU A 163 18.656 -9.825 55.071 1.00 0.00 H ATOM 1144 N LYS A 164 19.577 -10.109 59.021 1.00 19.69 N ATOM 1145 CA LYS A 164 18.700 -10.351 60.156 1.00 20.86 C ATOM 1146 C LYS A 164 19.166 -9.468 61.288 1.00 21.31 C ATOM 1147 O LYS A 164 20.346 -9.443 61.623 1.00 24.50 O ATOM 1148 CB LYS A 164 18.706 -11.829 60.561 1.00 24.38 C ATOM 1149 CG LYS A 164 17.572 -12.211 61.507 1.00 27.42 C ATOM 1150 CD LYS A 164 17.526 -13.708 61.756 1.00 30.33 C ATOM 1151 CE LYS A 164 16.366 -14.067 62.654 1.00 32.36 C ATOM 1152 H LYS A 164 20.597 -9.976 59.176 1.00 0.00 H ATOM 1153 N PHE A 165 18.223 -8.743 61.865 1.00 21.30 N ATOM 1154 CA PHE A 165 18.476 -7.840 62.974 1.00 21.59 C ATOM 1155 C PHE A 165 17.572 -8.257 64.108 1.00 22.69 C ATOM 1156 O PHE A 165 16.364 -8.021 64.052 1.00 22.69 O ATOM 1157 CB PHE A 165 18.135 -6.409 62.555 1.00 21.58 C ATOM 1158 CG PHE A 165 18.902 -5.934 61.357 1.00 20.61 C ATOM 1159 CD1 PHE A 165 20.189 -5.465 61.479 1.00 21.05 C ATOM 1160 CD2 PHE A 165 18.318 -5.951 60.102 1.00 19.81 C ATOM 1161 CE1 PHE A 165 20.876 -5.017 60.373 1.00 21.72 C ATOM 1162 CE2 PHE A 165 19.005 -5.506 58.993 1.00 20.74 C ATOM 1163 CZ PHE A 165 20.284 -5.045 59.122 1.00 21.49 C ATOM 1164 H PHE A 165 17.250 -8.823 61.506 1.00 0.00 H ATOM 1165 N GLY A 166 18.138 -8.860 65.147 1.00 25.66 N ATOM 1166 CA GLY A 166 17.306 -9.465 66.161 1.00 26.33 C ATOM 1167 C GLY A 166 16.487 -10.531 65.467 1.00 26.81 C ATOM 1168 O GLY A 166 17.054 -11.387 64.800 1.00 28.84 O ATOM 1169 H GLY A 166 19.174 -8.896 65.230 1.00 0.00 H ATOM 1170 N ASN A 167 15.169 -10.470 65.595 1.00 25.11 N ATOM 1171 CA ASN A 167 14.327 -11.430 64.892 1.00 25.72 C ATOM 1172 C ASN A 167 13.773 -10.887 63.573 1.00 24.03 C ATOM 1173 O ASN A 167 12.984 -11.573 62.917 1.00 26.63 O ATOM 1174 CB ASN A 167 13.162 -11.898 65.756 1.00 29.51 C ATOM 1175 CG ASN A 167 12.491 -13.155 65.195 1.00 34.37 C ATOM 1176 OD1 ASN A 167 11.272 -13.197 65.004 1.00 37.22 O ATOM 1177 ND2 ASN A 167 13.297 -14.163 64.882 1.00 36.03 N ATOM 1178 HD22 ASN A 167 14.319 -14.086 65.060 1.00 0.00 H ATOM 1179 HD21 ASN A 167 12.906 -15.029 64.459 1.00 0.00 H ATOM 1180 H ASN A 167 14.737 -9.739 66.195 1.00 0.00 H ATOM 1181 N MET A 168 14.161 -9.672 63.191 1.00 22.04 N ATOM 1182 CA MET A 168 13.634 -9.031 61.977 1.00 19.96 C ATOM 1183 C MET A 168 14.440 -9.435 60.753 1.00 19.48 C ATOM 1184 O MET A 168 15.610 -9.109 60.637 1.00 20.33 O ATOM 1185 CB MET A 168 13.667 -7.512 62.172 1.00 20.55 C ATOM 1186 CG MET A 168 13.277 -6.696 60.956 1.00 21.96 C ATOM 1187 SD MET A 168 11.533 -6.819 60.560 1.00 22.97 S ATOM 1188 CE MET A 168 10.837 -5.909 61.945 1.00 22.53 C ATOM 1189 H MET A 168 14.858 -9.161 63.769 1.00 0.00 H ATOM 1190 N LYS A 169 13.791 -10.107 59.805 1.00 17.82 N ATOM 1191 CA LYS A 169 14.443 -10.508 58.561 1.00 17.42 C ATOM 1192 C LYS A 169 14.260 -9.422 57.520 1.00 15.37 C ATOM 1193 O LYS A 169 13.163 -8.913 57.335 1.00 15.99 O ATOM 1194 CB LYS A 169 13.843 -11.813 58.052 1.00 19.27 C ATOM 1195 CG LYS A 169 14.120 -12.982 58.978 1.00 22.55 C ATOM 1196 CD LYS A 169 13.438 -14.236 58.502 1.00 24.99 C ATOM 1197 CE LYS A 169 13.872 -15.413 59.350 1.00 29.14 C ATOM 1198 NZ LYS A 169 13.149 -16.662 58.991 1.00 32.00 N ATOM 1199 HZ1 LYS A 169 12.128 -16.522 59.130 1.00 0.00 H ATOM 1200 HZ2 LYS A 169 13.336 -16.895 57.995 1.00 0.00 H ATOM 1201 HZ3 LYS A 169 13.480 -17.439 59.598 1.00 0.00 H ATOM 1202 H LYS A 169 12.792 -10.353 59.954 1.00 0.00 H ATOM 1203 N VAL A 170 15.331 -9.115 56.801 1.00 14.74 N ATOM 1204 CA VAL A 170 15.297 -8.102 55.745 1.00 13.88 C ATOM 1205 C VAL A 170 16.024 -8.632 54.529 1.00 14.48 C ATOM 1206 O VAL A 170 17.165 -9.097 54.629 1.00 17.15 O ATOM 1207 CB VAL A 170 15.990 -6.826 56.222 1.00 15.10 C ATOM 1208 CG1 VAL A 170 15.922 -5.760 55.144 1.00 16.38 C ATOM 1209 CG2 VAL A 170 15.364 -6.315 57.498 1.00 16.09 C ATOM 1210 H VAL A 170 16.225 -9.610 56.994 1.00 0.00 H ATOM 1211 N GLU A 171 15.377 -8.566 53.365 1.00 12.86 N ATOM 1212 CA GLU A 171 16.042 -8.936 52.128 1.00 13.15 C ATOM 1213 C GLU A 171 16.192 -7.668 51.286 1.00 11.69 C ATOM 1214 O GLU A 171 15.241 -6.895 51.160 1.00 14.06 O ATOM 1215 CB GLU A 171 15.246 -9.996 51.348 1.00 14.97 C ATOM 1216 CG GLU A 171 15.891 -10.380 50.030 1.00 16.77 C ATOM 1217 CD GLU A 171 15.214 -11.530 49.324 1.00 19.85 C ATOM 1218 OE1 GLU A 171 14.257 -11.315 48.552 1.00 20.63 O ATOM 1219 OE2 GLU A 171 15.676 -12.668 49.523 1.00 23.76 O ATOM 1220 H GLU A 171 14.387 -8.247 53.343 1.00 0.00 H ATOM 1221 N THR A 172 17.356 -7.458 50.679 1.00 10.98 N ATOM 1222 CA THR A 172 17.528 -6.384 49.704 1.00 11.00 C ATOM 1223 C THR A 172 17.667 -7.023 48.327 1.00 10.36 C ATOM 1224 O THR A 172 18.270 -8.087 48.174 1.00 12.14 O ATOM 1225 CB THR A 172 18.725 -5.465 50.060 1.00 11.65 C ATOM 1226 OG1 THR A 172 19.963 -6.168 49.941 1.00 12.75 O ATOM 1227 CG2 THR A 172 18.605 -4.941 51.484 1.00 12.85 C ATOM 1228 HG1 THR A 172 20.072 -6.486 49.010 1.00 0.00 H ATOM 1229 H THR A 172 18.164 -8.073 50.904 1.00 0.00 H ATOM 1230 N PHE A 173 17.130 -6.332 47.312 1.00 10.46 N ATOM 1231 CA PHE A 173 17.125 -6.871 45.951 1.00 10.45 C ATOM 1232 C PHE A 173 17.370 -5.749 44.966 1.00 9.57 C ATOM 1233 O PHE A 173 16.655 -4.738 44.991 1.00 9.96 O ATOM 1234 CB PHE A 173 15.767 -7.531 45.672 1.00 11.18 C ATOM 1235 CG PHE A 173 15.591 -8.059 44.287 1.00 11.17 C ATOM 1236 CD1 PHE A 173 16.549 -8.865 43.710 1.00 13.18 C ATOM 1237 CD2 PHE A 173 14.436 -7.766 43.559 1.00 12.79 C ATOM 1238 CE1 PHE A 173 16.328 -9.370 42.409 1.00 13.94 C ATOM 1239 CE2 PHE A 173 14.242 -8.262 42.277 1.00 14.21 C ATOM 1240 CZ PHE A 173 15.185 -9.068 41.714 1.00 13.88 C ATOM 1241 H PHE A 173 16.710 -5.398 47.494 1.00 0.00 H ATOM 1242 N TYR A 174 18.375 -5.936 44.119 1.00 9.79 N ATOM 1243 CA TYR A 174 18.610 -5.048 42.988 1.00 9.82 C ATOM 1244 C TYR A 174 17.905 -5.616 41.758 1.00 10.46 C ATOM 1245 O TYR A 174 18.331 -6.647 41.226 1.00 11.47 O ATOM 1246 CB TYR A 174 20.113 -4.934 42.697 1.00 10.73 C ATOM 1247 CG TYR A 174 20.404 -4.102 41.475 1.00 10.30 C ATOM 1248 CD1 TYR A 174 20.052 -2.754 41.413 1.00 10.18 C ATOM 1249 CD2 TYR A 174 21.014 -4.658 40.374 1.00 12.11 C ATOM 1250 CE1 TYR A 174 20.271 -1.997 40.281 1.00 10.37 C ATOM 1251 CE2 TYR A 174 21.260 -3.898 39.238 1.00 12.25 C ATOM 1252 CZ TYR A 174 20.901 -2.570 39.210 1.00 10.86 C ATOM 1253 OH TYR A 174 21.153 -1.826 38.079 1.00 12.90 O ATOM 1254 HH TYR A 174 20.837 -0.898 38.219 1.00 0.00 H ATOM 1255 H TYR A 174 19.015 -6.742 44.268 1.00 0.00 H ATOM 1256 N PRO A 175 16.824 -4.965 41.294 1.00 10.04 N ATOM 1257 CA PRO A 175 16.021 -5.540 40.209 1.00 10.69 C ATOM 1258 C PRO A 175 16.469 -5.087 38.833 1.00 11.03 C ATOM 1259 O PRO A 175 15.903 -5.546 37.828 1.00 12.75 O ATOM 1260 CB PRO A 175 14.638 -5.005 40.515 1.00 11.21 C ATOM 1261 CG PRO A 175 14.910 -3.618 41.023 1.00 11.09 C ATOM 1262 CD PRO A 175 16.145 -3.804 41.915 1.00 10.05 C ATOM 1263 N GLY A 176 17.432 -4.191 38.765 1.00 10.83 N ATOM 1264 CA GLY A 176 17.841 -3.544 37.524 1.00 10.91 C ATOM 1265 C GLY A 176 17.613 -2.042 37.573 1.00 10.51 C ATOM 1266 O GLY A 176 17.136 -1.461 38.548 1.00 10.46 O ATOM 1267 H GLY A 176 17.926 -3.931 39.642 1.00 0.00 H ATOM 1268 N LYS A 177 17.997 -1.382 36.486 1.00 10.29 N ATOM 1269 CA LYS A 177 17.946 0.062 36.393 1.00 10.06 C ATOM 1270 C LYS A 177 16.512 0.532 36.234 1.00 10.30 C ATOM 1271 O LYS A 177 15.658 -0.134 35.610 1.00 11.44 O ATOM 1272 CB LYS A 177 18.779 0.512 35.178 1.00 11.13 C ATOM 1273 CG LYS A 177 20.228 0.015 35.251 1.00 12.07 C ATOM 1274 CD LYS A 177 21.109 0.458 34.057 1.00 15.19 C ATOM 1275 CE LYS A 177 22.411 -0.382 34.015 1.00 19.44 C ATOM 1276 NZ LYS A 177 23.233 -0.219 32.783 1.00 22.47 N ATOM 1277 HZ1 LYS A 177 22.672 -0.500 31.954 1.00 0.00 H ATOM 1278 HZ2 LYS A 177 23.519 0.776 32.688 1.00 0.00 H ATOM 1279 HZ3 LYS A 177 24.079 -0.820 32.850 1.00 0.00 H ATOM 1280 H LYS A 177 18.348 -1.923 35.670 1.00 0.00 H ATOM 1281 N GLY A 178 16.224 1.717 36.745 1.00 9.95 N ATOM 1282 CA GLY A 178 14.882 2.259 36.614 1.00 10.75 C ATOM 1283 C GLY A 178 14.856 3.733 36.896 1.00 10.01 C ATOM 1284 O GLY A 178 15.269 4.549 36.082 1.00 10.73 O ATOM 1285 H GLY A 178 16.958 2.261 37.241 1.00 0.00 H ATOM 1286 N HIS A 179 14.361 4.093 38.076 1.00 9.75 N ATOM 1287 CA HIS A 179 14.413 5.470 38.530 1.00 10.20 C ATOM 1288 C HIS A 179 15.853 6.001 38.539 1.00 10.05 C ATOM 1289 O HIS A 179 16.101 7.141 38.152 1.00 10.46 O ATOM 1290 CB HIS A 179 13.765 5.560 39.914 1.00 10.97 C ATOM 1291 CG HIS A 179 14.097 6.807 40.663 1.00 10.47 C ATOM 1292 ND1 HIS A 179 13.504 8.013 40.408 1.00 11.65 N ATOM 1293 CD2 HIS A 179 14.970 7.029 41.674 1.00 10.70 C ATOM 1294 CE1 HIS A 179 14.009 8.926 41.219 1.00 11.74 C ATOM 1295 NE2 HIS A 179 14.911 8.364 42.003 1.00 11.68 N ATOM 1296 H HIS A 179 13.927 3.372 38.687 1.00 0.00 H ATOM 1297 N THR A 180 16.777 5.168 39.003 1.00 9.18 N ATOM 1298 CA THR A 180 18.199 5.404 38.848 1.00 9.35 C ATOM 1299 C THR A 180 18.856 4.081 38.431 1.00 9.54 C ATOM 1300 O THR A 180 18.238 3.022 38.411 1.00 10.35 O ATOM 1301 CB THR A 180 18.845 5.880 40.150 1.00 9.54 C ATOM 1302 OG1 THR A 180 18.603 4.900 41.159 1.00 10.25 O ATOM 1303 CG2 THR A 180 18.356 7.257 40.553 1.00 10.39 C ATOM 1304 HG1 THR A 180 19.016 5.195 42.009 1.00 0.00 H ATOM 1305 H THR A 180 16.467 4.308 39.500 1.00 0.00 H ATOM 1306 N GLU A 181 20.137 4.130 38.104 1.00 9.72 N ATOM 1307 CA GLU A 181 20.859 2.919 37.732 1.00 10.00 C ATOM 1308 C GLU A 181 20.993 1.941 38.907 1.00 9.90 C ATOM 1309 O GLU A 181 21.081 0.744 38.705 1.00 11.69 O ATOM 1310 CB GLU A 181 22.241 3.265 37.149 1.00 10.91 C ATOM 1311 CG GLU A 181 23.174 3.977 38.137 1.00 11.70 C ATOM 1312 CD GLU A 181 24.187 4.914 37.488 1.00 15.38 C ATOM 1313 OE1 GLU A 181 25.273 4.451 37.127 1.00 15.13 O ATOM 1314 OE2 GLU A 181 23.918 6.133 37.343 1.00 16.75 O ATOM 1315 H GLU A 181 20.635 5.043 38.112 1.00 0.00 H ATOM 1316 N ASP A 182 21.003 2.464 40.127 1.00 8.89 N ATOM 1317 CA ASP A 182 21.365 1.726 41.320 1.00 9.61 C ATOM 1318 C ASP A 182 20.223 1.339 42.238 1.00 8.81 C ATOM 1319 O ASP A 182 20.455 0.608 43.200 1.00 10.31 O ATOM 1320 CB ASP A 182 22.431 2.518 42.123 1.00 9.31 C ATOM 1321 CG ASP A 182 21.939 3.861 42.643 1.00 9.49 C ATOM 1322 OD1 ASP A 182 21.253 4.586 41.895 1.00 10.05 O ATOM 1323 OD2 ASP A 182 22.317 4.170 43.805 1.00 10.17 O ATOM 1324 H ASP A 182 20.735 3.463 40.233 1.00 0.00 H ATOM 1325 N ASN A 183 18.996 1.780 41.962 1.00 8.79 N ATOM 1326 CA ASN A 183 17.916 1.579 42.897 1.00 8.12 C ATOM 1327 C ASN A 183 17.734 0.129 43.321 1.00 8.61 C ATOM 1328 O ASN A 183 17.695 -0.788 42.497 1.00 9.18 O ATOM 1329 CB ASN A 183 16.609 2.224 42.350 1.00 8.72 C ATOM 1330 CG ASN A 183 16.212 1.863 40.925 1.00 8.66 C ATOM 1331 OD1 ASN A 183 15.522 2.659 40.285 1.00 10.21 O ATOM 1332 ND2 ASN A 183 16.583 0.705 40.440 1.00 9.29 N ATOM 1333 HD22 ASN A 183 17.166 0.063 41.015 1.00 0.00 H ATOM 1334 HD21 ASN A 183 16.295 0.427 39.480 1.00 0.00 H ATOM 1335 H ASN A 183 18.815 2.273 41.065 1.00 0.00 H ATOM 1336 N ILE A 184 17.555 -0.077 44.633 1.00 8.91 N ATOM 1337 CA ILE A 184 17.199 -1.372 45.183 1.00 8.63 C ATOM 1338 C ILE A 184 15.859 -1.301 45.884 1.00 8.81 C ATOM 1339 O ILE A 184 15.388 -0.221 46.259 1.00 9.34 O ATOM 1340 CB ILE A 184 18.274 -1.921 46.152 1.00 8.91 C ATOM 1341 CG1 ILE A 184 18.465 -1.017 47.374 1.00 9.84 C ATOM 1342 CG2 ILE A 184 19.570 -2.111 45.421 1.00 10.01 C ATOM 1343 CD1 ILE A 184 19.267 -1.627 48.509 1.00 10.76 C ATOM 1344 H ILE A 184 17.676 0.725 45.284 1.00 0.00 H ATOM 1345 N VAL A 185 15.242 -2.457 46.083 1.00 8.91 N ATOM 1346 CA VAL A 185 14.050 -2.584 46.901 1.00 8.89 C ATOM 1347 C VAL A 185 14.404 -3.386 48.151 1.00 9.50 C ATOM 1348 O VAL A 185 15.416 -4.103 48.201 1.00 10.07 O ATOM 1349 CB VAL A 185 12.874 -3.198 46.132 1.00 9.59 C ATOM 1350 CG1 VAL A 185 12.536 -2.366 44.898 1.00 10.00 C ATOM 1351 CG2 VAL A 185 13.153 -4.651 45.726 1.00 10.38 C ATOM 1352 H VAL A 185 15.629 -3.311 45.633 1.00 0.00 H ATOM 1353 N VAL A 186 13.546 -3.284 49.150 1.00 9.71 N ATOM 1354 CA VAL A 186 13.741 -3.958 50.421 1.00 9.85 C ATOM 1355 C VAL A 186 12.458 -4.726 50.734 1.00 10.46 C ATOM 1356 O VAL A 186 11.363 -4.193 50.594 1.00 12.32 O ATOM 1357 CB VAL A 186 14.098 -2.969 51.549 1.00 11.19 C ATOM 1358 CG1 VAL A 186 14.316 -3.721 52.862 1.00 12.36 C ATOM 1359 CG2 VAL A 186 15.352 -2.194 51.145 1.00 12.57 C ATOM 1360 H VAL A 186 12.697 -2.697 49.021 1.00 0.00 H ATOM 1361 N TRP A 187 12.613 -5.972 51.122 1.00 11.05 N ATOM 1362 CA TRP A 187 11.505 -6.881 51.369 1.00 11.40 C ATOM 1363 C TRP A 187 11.576 -7.382 52.801 1.00 11.71 C ATOM 1364 O TRP A 187 12.640 -7.790 53.272 1.00 12.73 O ATOM 1365 CB TRP A 187 11.627 -8.069 50.423 1.00 12.60 C ATOM 1366 CG TRP A 187 10.660 -9.174 50.567 1.00 13.29 C ATOM 1367 CD1 TRP A 187 10.952 -10.466 50.900 1.00 15.06 C ATOM 1368 CD2 TRP A 187 9.258 -9.152 50.251 1.00 13.34 C ATOM 1369 NE1 TRP A 187 9.814 -11.240 50.834 1.00 15.51 N ATOM 1370 CE2 TRP A 187 8.770 -10.452 50.423 1.00 14.92 C ATOM 1371 CE3 TRP A 187 8.372 -8.158 49.837 1.00 14.43 C ATOM 1372 CZ2 TRP A 187 7.436 -10.788 50.192 1.00 16.25 C ATOM 1373 CZ3 TRP A 187 7.056 -8.501 49.594 1.00 14.91 C ATOM 1374 CH2 TRP A 187 6.604 -9.801 49.783 1.00 16.47 C ATOM 1375 HE1 TRP A 187 9.756 -12.254 51.059 1.00 0.00 H ATOM 1376 H TRP A 187 13.581 -6.327 51.260 1.00 0.00 H ATOM 1377 N LEU A 188 10.433 -7.382 53.473 1.00 12.28 N ATOM 1378 CA LEU A 188 10.320 -7.940 54.825 1.00 13.71 C ATOM 1379 C LEU A 188 9.486 -9.213 54.713 1.00 15.03 C ATOM 1380 O LEU A 188 8.252 -9.156 54.654 1.00 15.81 O ATOM 1381 CB LEU A 188 9.606 -6.959 55.728 1.00 14.78 C ATOM 1382 CG LEU A 188 10.201 -5.555 55.784 1.00 15.61 C ATOM 1383 CD1 LEU A 188 9.436 -4.696 56.790 1.00 17.99 C ATOM 1384 CD2 LEU A 188 11.717 -5.551 56.118 1.00 16.11 C ATOM 1385 H LEU A 188 9.588 -6.972 53.026 1.00 0.00 H ATOM 1386 N PRO A 189 10.142 -10.377 54.649 1.00 15.92 N ATOM 1387 CA PRO A 189 9.407 -11.617 54.372 1.00 17.49 C ATOM 1388 C PRO A 189 8.475 -12.061 55.491 1.00 18.72 C ATOM 1389 O PRO A 189 7.607 -12.882 55.213 1.00 20.50 O ATOM 1390 CB PRO A 189 10.528 -12.630 54.155 1.00 18.87 C ATOM 1391 CG PRO A 189 11.678 -12.098 54.920 1.00 18.35 C ATOM 1392 CD PRO A 189 11.596 -10.616 54.713 1.00 16.22 C ATOM 1393 N GLN A 190 8.629 -11.541 56.708 1.00 18.50 N ATOM 1394 CA GLN A 190 7.725 -11.933 57.793 1.00 19.59 C ATOM 1395 C GLN A 190 6.399 -11.189 57.715 1.00 20.08 C ATOM 1396 O GLN A 190 5.456 -11.546 58.422 1.00 22.55 O ATOM 1397 CB GLN A 190 8.396 -11.670 59.138 1.00 19.58 C ATOM 1398 CG GLN A 190 9.629 -12.522 59.348 1.00 20.23 C ATOM 1399 CD GLN A 190 10.600 -11.937 60.351 1.00 20.88 C ATOM 1400 OE1 GLN A 190 10.935 -10.750 60.309 1.00 20.67 O ATOM 1401 NE2 GLN A 190 11.064 -12.768 61.262 1.00 22.95 N ATOM 1402 HE22 GLN A 190 10.757 -13.762 61.264 1.00 0.00 H ATOM 1403 HE21 GLN A 190 11.737 -12.430 61.979 1.00 0.00 H ATOM 1404 H GLN A 190 9.391 -10.857 56.888 1.00 0.00 H ATOM 1405 N TYR A 191 6.320 -10.195 56.838 1.00 19.54 N ATOM 1406 CA TYR A 191 5.150 -9.335 56.715 1.00 20.16 C ATOM 1407 C TYR A 191 4.690 -9.165 55.251 1.00 18.93 C ATOM 1408 O TYR A 191 3.637 -8.578 54.997 1.00 20.01 O ATOM 1409 CB TYR A 191 5.471 -7.948 57.251 1.00 20.60 C ATOM 1410 CG TYR A 191 6.028 -7.927 58.653 1.00 22.14 C ATOM 1411 CD1 TYR A 191 5.184 -7.923 59.735 1.00 24.97 C ATOM 1412 CD2 TYR A 191 7.392 -7.905 58.889 1.00 22.85 C ATOM 1413 CE1 TYR A 191 5.688 -7.881 61.019 1.00 26.08 C ATOM 1414 CE2 TYR A 191 7.900 -7.872 60.154 1.00 24.63 C ATOM 1415 CZ TYR A 191 7.057 -7.851 61.214 1.00 24.60 C ATOM 1416 OH TYR A 191 7.609 -7.824 62.474 1.00 27.50 O ATOM 1417 HH TYR A 191 8.170 -8.629 62.605 1.00 0.00 H ATOM 1418 H TYR A 191 7.131 -10.022 56.210 1.00 0.00 H ATOM 1419 N ASN A 192 5.507 -9.646 54.307 1.00 18.26 N ATOM 1420 CA ASN A 192 5.292 -9.438 52.861 1.00 17.11 C ATOM 1421 C ASN A 192 5.077 -7.961 52.554 1.00 15.53 C ATOM 1422 O ASN A 192 4.176 -7.562 51.814 1.00 16.76 O ATOM 1423 CB ASN A 192 4.171 -10.340 52.334 1.00 19.03 C ATOM 1424 CG ASN A 192 4.602 -11.806 52.274 1.00 20.86 C ATOM 1425 OD1 ASN A 192 5.601 -12.200 52.871 1.00 22.24 O ATOM 1426 ND2 ASN A 192 3.885 -12.598 51.519 1.00 23.78 N ATOM 1427 HD22 ASN A 192 3.045 -12.229 51.029 1.00 0.00 H ATOM 1428 HD21 ASN A 192 4.155 -13.596 51.409 1.00 0.00 H ATOM 1429 H ASN A 192 6.337 -10.195 54.607 1.00 0.00 H ATOM 1430 N ILE A 193 5.935 -7.141 53.174 1.00 14.68 N ATOM 1431 CA ILE A 193 5.974 -5.708 52.910 1.00 14.04 C ATOM 1432 C ILE A 193 7.153 -5.397 52.002 1.00 13.33 C ATOM 1433 O ILE A 193 8.291 -5.816 52.274 1.00 13.15 O ATOM 1434 CB ILE A 193 6.091 -4.900 54.219 1.00 15.34 C ATOM 1435 CG1 ILE A 193 4.791 -5.048 55.021 1.00 17.72 C ATOM 1436 CG2 ILE A 193 6.401 -3.431 53.922 1.00 16.42 C ATOM 1437 CD1 ILE A 193 4.874 -4.514 56.436 1.00 20.12 C ATOM 1438 H ILE A 193 6.597 -7.541 53.869 1.00 0.00 H ATOM 1439 N LEU A 194 6.873 -4.685 50.911 1.00 12.85 N ATOM 1440 CA LEU A 194 7.904 -4.237 49.986 1.00 11.54 C ATOM 1441 C LEU A 194 8.120 -2.746 50.139 1.00 11.67 C ATOM 1442 O LEU A 194 7.179 -1.961 50.045 1.00 12.73 O ATOM 1443 CB LEU A 194 7.450 -4.533 48.557 1.00 12.40 C ATOM 1444 CG LEU A 194 8.414 -4.110 47.463 1.00 13.23 C ATOM 1445 CD1 LEU A 194 9.622 -4.991 47.497 1.00 14.03 C ATOM 1446 CD2 LEU A 194 7.721 -4.176 46.113 1.00 15.72 C ATOM 1447 H LEU A 194 5.882 -4.440 50.713 1.00 0.00 H ATOM 1448 N VAL A 195 9.382 -2.360 50.331 1.00 11.25 N ATOM 1449 CA VAL A 195 9.784 -0.976 50.213 1.00 11.58 C ATOM 1450 C VAL A 195 10.253 -0.759 48.792 1.00 11.02 C ATOM 1451 O VAL A 195 11.324 -1.203 48.393 1.00 11.54 O ATOM 1452 CB VAL A 195 10.896 -0.584 51.215 1.00 12.94 C ATOM 1453 CG1 VAL A 195 11.098 0.921 51.171 1.00 14.50 C ATOM 1454 CG2 VAL A 195 10.533 -1.029 52.618 1.00 14.95 C ATOM 1455 H VAL A 195 10.098 -3.075 50.573 1.00 0.00 H ATOM 1456 N GLY A 196 9.398 -0.153 47.991 1.00 11.91 N ATOM 1457 CA GLY A 196 9.713 0.071 46.593 1.00 12.55 C ATOM 1458 C GLY A 196 10.708 1.187 46.369 1.00 11.20 C ATOM 1459 O GLY A 196 11.420 1.211 45.372 1.00 11.38 O ATOM 1460 H GLY A 196 8.484 0.169 48.368 1.00 0.00 H ATOM 1461 N GLY A 197 10.756 2.133 47.309 1.00 11.74 N ATOM 1462 CA GLY A 197 11.570 3.311 47.121 1.00 11.39 C ATOM 1463 C GLY A 197 11.144 4.058 45.875 1.00 10.45 C ATOM 1464 O GLY A 197 10.024 3.962 45.401 1.00 11.28 O ATOM 1465 H GLY A 197 10.203 2.021 48.183 1.00 0.00 H ATOM 1466 N CYS A 198 12.069 4.812 45.303 1.00 10.61 N ATOM 1467 CA CYS A 198 11.707 5.734 44.267 1.00 11.07 C ATOM 1468 C CYS A 198 11.555 5.090 42.890 1.00 11.00 C ATOM 1469 O CYS A 198 11.103 5.724 41.954 1.00 12.03 O ATOM 1470 CB CYS A 198 12.625 6.946 44.315 1.00 12.00 C ATOM 1471 SG CYS A 198 12.778 7.589 46.053 1.00 13.19 S ATOM 1472 H CYS A 198 13.061 4.735 45.606 1.00 0.00 H ATOM 1473 N LEU A 199 11.874 3.798 42.808 1.00 10.86 N ATOM 1474 CA LEU A 199 11.512 2.934 41.689 1.00 10.67 C ATOM 1475 C LEU A 199 9.999 2.832 41.502 1.00 11.38 C ATOM 1476 O LEU A 199 9.534 2.572 40.386 1.00 11.87 O ATOM 1477 CB LEU A 199 12.100 1.532 41.952 1.00 10.84 C ATOM 1478 CG LEU A 199 11.870 0.480 40.878 1.00 11.25 C ATOM 1479 CD1 LEU A 199 12.753 0.741 39.652 1.00 11.95 C ATOM 1480 CD2 LEU A 199 12.161 -0.895 41.460 1.00 14.10 C ATOM 1481 H LEU A 199 12.415 3.379 43.591 1.00 0.00 H ATOM 1482 N VAL A 200 9.232 3.007 42.574 1.00 11.29 N ATOM 1483 CA VAL A 200 7.813 2.762 42.564 1.00 12.13 C ATOM 1484 C VAL A 200 7.087 4.064 42.825 1.00 13.08 C ATOM 1485 O VAL A 200 7.355 4.750 43.814 1.00 14.13 O ATOM 1486 CB VAL A 200 7.422 1.698 43.611 1.00 13.13 C ATOM 1487 CG1 VAL A 200 5.914 1.528 43.658 1.00 14.64 C ATOM 1488 CG2 VAL A 200 8.146 0.383 43.336 1.00 13.53 C ATOM 1489 H VAL A 200 9.675 3.334 43.456 1.00 0.00 H ATOM 1490 N LYS A 201 6.184 4.402 41.899 1.00 13.79 N ATOM 1491 CA LYS A 201 5.394 5.599 42.003 1.00 15.33 C ATOM 1492 C LYS A 201 4.112 5.397 42.801 1.00 15.54 C ATOM 1493 O LYS A 201 3.430 4.379 42.686 1.00 17.12 O ATOM 1494 CB LYS A 201 5.031 6.076 40.593 1.00 17.14 C ATOM 1495 CG LYS A 201 6.226 6.375 39.697 1.00 20.99 C ATOM 1496 CD LYS A 201 7.050 7.491 40.277 1.00 24.97 C ATOM 1497 CE LYS A 201 8.032 8.100 39.309 1.00 26.87 C ATOM 1498 NZ LYS A 201 8.647 9.309 39.919 1.00 27.01 N ATOM 1499 HZ1 LYS A 201 7.903 10.001 40.140 1.00 0.00 H ATOM 1500 HZ2 LYS A 201 9.143 9.041 40.793 1.00 0.00 H ATOM 1501 HZ3 LYS A 201 9.324 9.727 39.250 1.00 0.00 H ATOM 1502 H LYS A 201 6.049 3.779 41.077 1.00 0.00 H ATOM 1503 N SER A 202 3.758 6.409 43.586 1.00 16.20 N ATOM 1504 CA SER A 202 2.499 6.396 44.307 1.00 17.42 C ATOM 1505 C SER A 202 1.324 6.703 43.343 1.00 18.01 C ATOM 1506 O SER A 202 1.495 7.226 42.240 1.00 17.12 O ATOM 1507 CB SER A 202 2.512 7.442 45.409 1.00 19.94 C ATOM 1508 OG SER A 202 2.562 8.748 44.869 1.00 22.05 O ATOM 1509 HG SER A 202 3.384 8.848 44.326 1.00 0.00 H ATOM 1510 H SER A 202 4.395 7.225 43.685 1.00 0.00 H ATOM 1511 N THR A 203 0.116 6.409 43.801 1.00 19.01 N ATOM 1512 CA THR A 203 -1.080 6.672 43.008 1.00 20.90 C ATOM 1513 C THR A 203 -1.172 8.149 42.638 1.00 22.92 C ATOM 1514 O THR A 203 -1.663 8.494 41.561 1.00 24.00 O ATOM 1515 CB THR A 203 -2.353 6.226 43.762 1.00 23.16 C ATOM 1516 OG1 THR A 203 -2.240 4.837 44.092 1.00 24.39 O ATOM 1517 CG2 THR A 203 -3.610 6.440 42.911 1.00 24.95 C ATOM 1518 HG1 THR A 203 -2.142 4.308 43.261 1.00 0.00 H ATOM 1519 H THR A 203 0.018 5.982 44.744 1.00 0.00 H ATOM 1520 N SER A 204 -0.719 9.025 43.527 1.00 23.76 N ATOM 1521 CA SER A 204 -0.806 10.468 43.301 1.00 26.01 C ATOM 1522 C SER A 204 0.163 10.974 42.237 1.00 25.32 C ATOM 1523 O SER A 204 -0.023 12.076 41.711 1.00 27.79 O ATOM 1524 CB SER A 204 -0.563 11.234 44.601 1.00 27.88 C ATOM 1525 OG SER A 204 0.725 10.937 45.120 1.00 29.21 O ATOM 1526 HG SER A 204 0.791 9.966 45.301 1.00 0.00 H ATOM 1527 H SER A 204 -0.291 8.676 44.408 1.00 0.00 H ATOM 1528 N ALA A 205 1.187 10.185 41.927 1.00 22.95 N ATOM 1529 CA ALA A 205 2.122 10.543 40.868 1.00 22.55 C ATOM 1530 C ALA A 205 1.460 10.272 39.536 1.00 22.15 C ATOM 1531 O ALA A 205 1.078 9.135 39.251 1.00 22.41 O ATOM 1532 CB ALA A 205 3.398 9.731 40.984 1.00 22.83 C ATOM 1533 H ALA A 205 1.323 9.296 42.450 1.00 0.00 H ATOM 1534 N LYS A 206 1.355 11.315 38.716 1.00 22.62 N ATOM 1535 CA LYS A 206 0.687 11.214 37.415 1.00 24.19 C ATOM 1536 C LYS A 206 1.655 11.216 36.235 1.00 24.68 C ATOM 1537 O LYS A 206 1.225 11.187 35.084 1.00 26.90 O ATOM 1538 CB LYS A 206 -0.324 12.353 37.246 1.00 26.44 C ATOM 1539 CG LYS A 206 -1.276 12.482 38.400 1.00 27.53 C ATOM 1540 CD LYS A 206 -1.993 11.182 38.684 1.00 29.30 C ATOM 1541 CE LYS A 206 -2.982 11.338 39.818 1.00 30.86 C ATOM 1542 NZ LYS A 206 -3.632 10.043 40.147 1.00 31.62 N ATOM 1543 HZ1 LYS A 206 -4.139 9.689 39.311 1.00 0.00 H ATOM 1544 HZ2 LYS A 206 -2.906 9.355 40.432 1.00 0.00 H ATOM 1545 HZ3 LYS A 206 -4.304 10.183 40.928 1.00 0.00 H ATOM 1546 H LYS A 206 1.759 12.228 39.007 1.00 0.00 H ATOM 1547 N ASP A 207 2.951 11.254 36.511 1.00 25.01 N ATOM 1548 CA ASP A 207 3.973 11.164 35.475 1.00 25.48 C ATOM 1549 C ASP A 207 5.229 10.609 36.124 1.00 24.99 C ATOM 1550 O ASP A 207 5.234 10.367 37.334 1.00 24.35 O ATOM 1551 CB ASP A 207 4.243 12.524 34.830 1.00 27.99 C ATOM 1552 CG ASP A 207 4.612 13.594 35.843 1.00 30.67 C ATOM 1553 OD1 ASP A 207 5.580 13.400 36.601 1.00 30.56 O ATOM 1554 OD2 ASP A 207 3.952 14.654 35.865 1.00 33.57 O ATOM 1555 H ASP A 207 3.250 11.352 37.502 1.00 0.00 H ATOM 1556 N LEU A 208 6.291 10.416 35.345 1.00 25.06 N ATOM 1557 CA LEU A 208 7.486 9.752 35.857 1.00 25.17 C ATOM 1558 C LEU A 208 8.359 10.636 36.731 1.00 24.70 C ATOM 1559 O LEU A 208 9.275 10.151 37.386 1.00 26.01 O ATOM 1560 CB LEU A 208 8.343 9.214 34.716 1.00 25.11 C ATOM 1561 CG LEU A 208 7.737 8.037 33.963 1.00 24.58 C ATOM 1562 CD1 LEU A 208 8.575 7.737 32.741 1.00 26.26 C ATOM 1563 CD2 LEU A 208 7.632 6.826 34.878 1.00 24.68 C ATOM 1564 H LEU A 208 6.269 10.743 34.358 1.00 0.00 H ATOM 1565 N GLY A 209 8.121 11.935 36.718 1.00 24.21 N ATOM 1566 CA GLY A 209 8.868 12.822 37.576 1.00 23.98 C ATOM 1567 C GLY A 209 10.283 13.017 37.081 1.00 22.57 C ATOM 1568 O GLY A 209 10.529 13.226 35.897 1.00 22.86 O ATOM 1569 H GLY A 209 7.391 12.321 36.086 1.00 0.00 H ATOM 1570 N ASN A 210 11.229 12.913 37.999 1.00 22.27 N ATOM 1571 CA ASN A 210 12.620 13.152 37.685 1.00 22.09 C ATOM 1572 C ASN A 210 13.232 12.002 36.897 1.00 19.82 C ATOM 1573 O ASN A 210 13.458 10.925 37.455 1.00 21.65 O ATOM 1574 CB ASN A 210 13.361 13.337 39.002 1.00 23.31 C ATOM 1575 CG ASN A 210 14.845 13.506 38.821 1.00 24.43 C ATOM 1576 OD1 ASN A 210 15.341 13.722 37.713 1.00 24.97 O ATOM 1577 ND2 ASN A 210 15.576 13.407 39.925 1.00 24.30 N ATOM 1578 HD22 ASN A 210 15.115 13.224 40.839 1.00 0.00 H ATOM 1579 HD21 ASN A 210 16.609 13.513 39.876 1.00 0.00 H ATOM 1580 H ASN A 210 10.966 12.653 38.971 1.00 0.00 H ATOM 1581 N VAL A 211 13.466 12.212 35.597 1.00 19.71 N ATOM 1582 CA VAL A 211 14.059 11.162 34.772 1.00 18.81 C ATOM 1583 C VAL A 211 15.478 11.465 34.344 1.00 17.94 C ATOM 1584 O VAL A 211 16.046 10.731 33.538 1.00 18.34 O ATOM 1585 CB VAL A 211 13.209 10.805 33.529 1.00 18.87 C ATOM 1586 CG1 VAL A 211 11.873 10.272 33.958 1.00 19.61 C ATOM 1587 CG2 VAL A 211 13.049 12.009 32.572 1.00 20.00 C ATOM 1588 H VAL A 211 13.224 13.129 35.170 1.00 0.00 H ATOM 1589 N ALA A 212 16.076 12.485 34.959 1.00 19.96 N ATOM 1590 CA ALA A 212 17.444 12.861 34.624 1.00 20.10 C ATOM 1591 C ALA A 212 18.415 11.703 34.795 1.00 17.21 C ATOM 1592 O ALA A 212 19.350 11.543 34.006 1.00 20.79 O ATOM 1593 CB ALA A 212 17.896 14.011 35.492 1.00 22.38 C ATOM 1594 H ALA A 212 15.560 13.019 35.687 1.00 0.00 H ATOM 1595 N ASP A 213 18.209 10.916 35.840 1.00 14.55 N ATOM 1596 CA ASP A 213 19.102 9.825 36.142 1.00 13.29 C ATOM 1597 C ASP A 213 18.480 8.468 35.850 1.00 11.92 C ATOM 1598 O ASP A 213 19.005 7.446 36.300 1.00 11.86 O ATOM 1599 CB ASP A 213 19.532 9.925 37.610 1.00 13.93 C ATOM 1600 CG ASP A 213 20.323 11.187 37.898 1.00 16.15 C ATOM 1601 OD1 ASP A 213 21.109 11.621 37.035 1.00 19.07 O ATOM 1602 OD2 ASP A 213 20.188 11.730 39.016 1.00 17.82 O ATOM 1603 H ASP A 213 17.388 11.088 36.454 1.00 0.00 H ATOM 1604 N ALA A 214 17.364 8.459 35.112 1.00 13.02 N ATOM 1605 CA ALA A 214 16.551 7.271 34.939 1.00 12.43 C ATOM 1606 C ALA A 214 16.857 6.544 33.636 1.00 13.27 C ATOM 1607 O ALA A 214 17.520 7.078 32.726 1.00 15.56 O ATOM 1608 CB ALA A 214 15.094 7.649 34.983 1.00 13.68 C ATOM 1609 H ALA A 214 17.068 9.339 34.644 1.00 0.00 H ATOM 1610 N TYR A 215 16.368 5.317 33.576 1.00 11.94 N ATOM 1611 CA TYR A 215 16.544 4.401 32.456 1.00 12.96 C ATOM 1612 C TYR A 215 15.166 3.946 32.057 1.00 14.26 C ATOM 1613 O TYR A 215 14.698 2.905 32.495 1.00 13.55 O ATOM 1614 CB TYR A 215 17.439 3.238 32.875 1.00 12.58 C ATOM 1615 CG TYR A 215 18.842 3.710 33.163 1.00 11.60 C ATOM 1616 CD1 TYR A 215 19.143 4.356 34.347 1.00 11.02 C ATOM 1617 CD2 TYR A 215 19.851 3.575 32.235 1.00 12.51 C ATOM 1618 CE1 TYR A 215 20.385 4.868 34.611 1.00 11.52 C ATOM 1619 CE2 TYR A 215 21.119 4.075 32.477 1.00 13.17 C ATOM 1620 CZ TYR A 215 21.386 4.723 33.678 1.00 12.80 C ATOM 1621 OH TYR A 215 22.623 5.240 33.977 1.00 15.40 O ATOM 1622 HH TYR A 215 22.597 5.656 34.875 1.00 0.00 H ATOM 1623 H TYR A 215 15.816 4.980 34.390 1.00 0.00 H ATOM 1624 N VAL A 216 14.499 4.756 31.253 1.00 15.66 N ATOM 1625 CA VAL A 216 13.090 4.561 31.056 1.00 16.70 C ATOM 1626 C VAL A 216 12.738 3.383 30.181 1.00 17.53 C ATOM 1627 O VAL A 216 11.590 3.025 30.143 1.00 20.48 O ATOM 1628 CB VAL A 216 12.397 5.831 30.514 1.00 18.48 C ATOM 1629 CG1 VAL A 216 12.563 6.969 31.517 1.00 19.47 C ATOM 1630 CG2 VAL A 216 12.919 6.244 29.145 1.00 20.52 C ATOM 1631 H VAL A 216 14.992 5.531 30.765 1.00 0.00 H ATOM 1632 N ASN A 217 13.717 2.881 29.415 1.00 15.35 N ATOM 1633 CA ASN A 217 13.529 1.689 28.587 1.00 14.70 C ATOM 1634 C ASN A 217 13.811 0.386 29.349 1.00 13.03 C ATOM 1635 O ASN A 217 13.457 -0.675 28.842 1.00 13.18 O ATOM 1636 CB ASN A 217 14.339 1.719 27.286 1.00 16.69 C ATOM 1637 CG ASN A 217 13.766 0.772 26.238 1.00 18.68 C ATOM 1638 OD1 ASN A 217 12.566 0.803 25.979 1.00 21.28 O ATOM 1639 ND2 ASN A 217 14.590 -0.107 25.693 1.00 20.01 N ATOM 1640 HD22 ASN A 217 15.600 -0.097 25.942 1.00 0.00 H ATOM 1641 HD21 ASN A 217 14.228 -0.809 25.016 1.00 0.00 H ATOM 1642 H ASN A 217 14.643 3.355 29.409 1.00 0.00 H ATOM 1643 N GLU A 218 14.391 0.491 30.562 1.00 12.35 N ATOM 1644 CA GLU A 218 14.733 -0.651 31.417 1.00 12.56 C ATOM 1645 C GLU A 218 13.887 -0.722 32.698 1.00 12.16 C ATOM 1646 O GLU A 218 13.833 -1.748 33.361 1.00 13.69 O ATOM 1647 CB GLU A 218 16.212 -0.590 31.830 1.00 12.54 C ATOM 1648 CG GLU A 218 17.208 -0.687 30.665 1.00 12.96 C ATOM 1649 CD GLU A 218 18.679 -0.686 31.123 1.00 12.45 C ATOM 1650 OE1 GLU A 218 19.151 -1.661 31.739 1.00 13.81 O ATOM 1651 OE2 GLU A 218 19.364 0.311 30.868 1.00 13.16 O ATOM 1652 H GLU A 218 14.610 1.445 30.915 1.00 0.00 H ATOM 1653 N TRP A 219 13.263 0.387 33.071 1.00 11.85 N ATOM 1654 CA TRP A 219 12.468 0.525 34.285 1.00 11.55 C ATOM 1655 C TRP A 219 11.304 -0.469 34.335 1.00 10.95 C ATOM 1656 O TRP A 219 11.034 -1.074 35.370 1.00 11.53 O ATOM 1657 CB TRP A 219 12.032 1.980 34.394 1.00 11.12 C ATOM 1658 CG TRP A 219 11.485 2.504 35.685 1.00 10.99 C ATOM 1659 CD1 TRP A 219 10.967 1.793 36.733 1.00 11.42 C ATOM 1660 CD2 TRP A 219 11.400 3.882 36.042 1.00 11.54 C ATOM 1661 NE1 TRP A 219 10.564 2.672 37.735 1.00 12.14 N ATOM 1662 CE2 TRP A 219 10.804 3.954 37.315 1.00 11.88 C ATOM 1663 CE3 TRP A 219 11.761 5.062 35.394 1.00 12.40 C ATOM 1664 CZ2 TRP A 219 10.570 5.165 37.952 1.00 12.59 C ATOM 1665 CZ3 TRP A 219 11.546 6.256 36.027 1.00 13.43 C ATOM 1666 CH2 TRP A 219 10.949 6.308 37.299 1.00 13.63 C ATOM 1667 HE1 TRP A 219 10.150 2.401 38.650 1.00 0.00 H ATOM 1668 H TRP A 219 13.347 1.219 32.452 1.00 0.00 H ATOM 1669 N SER A 220 10.640 -0.708 33.205 1.00 10.65 N ATOM 1670 CA SER A 220 9.535 -1.664 33.193 1.00 10.43 C ATOM 1671 C SER A 220 10.010 -3.081 33.484 1.00 10.63 C ATOM 1672 O SER A 220 9.362 -3.810 34.236 1.00 11.89 O ATOM 1673 CB SER A 220 8.782 -1.630 31.857 1.00 10.88 C ATOM 1674 OG SER A 220 8.156 -0.374 31.673 1.00 12.06 O ATOM 1675 HG SER A 220 8.843 0.339 31.674 1.00 0.00 H ATOM 1676 H SER A 220 10.908 -0.214 32.330 1.00 0.00 H ATOM 1677 N THR A 221 11.129 -3.483 32.889 1.00 11.64 N ATOM 1678 CA THR A 221 11.703 -4.809 33.139 1.00 12.37 C ATOM 1679 C THR A 221 12.085 -4.953 34.607 1.00 11.48 C ATOM 1680 O THR A 221 11.857 -5.991 35.210 1.00 11.94 O ATOM 1681 CB THR A 221 12.903 -5.048 32.220 1.00 14.05 C ATOM 1682 OG1 THR A 221 12.454 -5.038 30.856 1.00 17.90 O ATOM 1683 CG2 THR A 221 13.593 -6.370 32.476 1.00 16.07 C ATOM 1684 HG1 THR A 221 12.045 -4.160 30.651 1.00 0.00 H ATOM 1685 H THR A 221 11.610 -2.840 32.229 1.00 0.00 H ATOM 1686 N SER A 222 12.622 -3.896 35.189 1.00 10.77 N ATOM 1687 CA SER A 222 13.006 -3.924 36.589 1.00 10.39 C ATOM 1688 C SER A 222 11.793 -4.096 37.505 1.00 10.01 C ATOM 1689 O SER A 222 11.814 -4.884 38.443 1.00 10.86 O ATOM 1690 CB SER A 222 13.808 -2.676 36.928 1.00 10.89 C ATOM 1691 OG SER A 222 14.985 -2.690 36.135 1.00 11.42 O ATOM 1692 HG SER A 222 15.527 -1.886 36.336 1.00 0.00 H ATOM 1693 H SER A 222 12.772 -3.029 34.635 1.00 0.00 H ATOM 1694 N ILE A 223 10.714 -3.372 37.210 1.00 9.76 N ATOM 1695 CA ILE A 223 9.453 -3.571 37.936 1.00 10.30 C ATOM 1696 C ILE A 223 8.953 -5.007 37.764 1.00 11.40 C ATOM 1697 O ILE A 223 8.527 -5.636 38.721 1.00 12.00 O ATOM 1698 CB ILE A 223 8.368 -2.545 37.482 1.00 10.40 C ATOM 1699 CG1 ILE A 223 8.724 -1.127 37.933 1.00 9.73 C ATOM 1700 CG2 ILE A 223 6.982 -2.940 37.965 1.00 10.26 C ATOM 1701 CD1 ILE A 223 8.543 -0.865 39.436 1.00 9.92 C ATOM 1702 H ILE A 223 10.765 -2.657 36.456 1.00 0.00 H ATOM 1703 N GLU A 224 8.965 -5.520 36.536 1.00 12.43 N ATOM 1704 CA GLU A 224 8.580 -6.913 36.307 1.00 13.34 C ATOM 1705 C GLU A 224 9.427 -7.890 37.103 1.00 12.92 C ATOM 1706 O GLU A 224 8.911 -8.874 37.628 1.00 13.71 O ATOM 1707 CB GLU A 224 8.640 -7.264 34.816 1.00 15.42 C ATOM 1708 CG GLU A 224 7.588 -6.532 33.998 1.00 18.49 C ATOM 1709 CD GLU A 224 6.190 -7.072 34.147 1.00 23.31 C ATOM 1710 OE1 GLU A 224 5.977 -8.045 34.905 1.00 26.92 O ATOM 1711 OE2 GLU A 224 5.305 -6.525 33.454 1.00 26.44 O ATOM 1712 H GLU A 224 9.251 -4.925 35.732 1.00 0.00 H ATOM 1713 N ASN A 225 10.715 -7.594 37.256 1.00 12.44 N ATOM 1714 CA ASN A 225 11.563 -8.447 38.075 1.00 12.37 C ATOM 1715 C ASN A 225 11.124 -8.456 39.548 1.00 12.18 C ATOM 1716 O ASN A 225 11.194 -9.481 40.206 1.00 13.28 O ATOM 1717 CB ASN A 225 13.022 -8.020 37.969 1.00 12.12 C ATOM 1718 CG ASN A 225 13.627 -8.332 36.629 1.00 14.34 C ATOM 1719 OD1 ASN A 225 13.122 -9.176 35.884 1.00 16.46 O ATOM 1720 ND2 ASN A 225 14.718 -7.655 36.302 1.00 14.03 N ATOM 1721 HD22 ASN A 225 15.111 -6.952 36.960 1.00 0.00 H ATOM 1722 HD21 ASN A 225 15.182 -7.827 35.387 1.00 0.00 H ATOM 1723 H ASN A 225 11.115 -6.754 36.791 1.00 0.00 H ATOM 1724 N VAL A 226 10.679 -7.325 40.063 1.00 11.58 N ATOM 1725 CA VAL A 226 10.126 -7.253 41.409 1.00 11.28 C ATOM 1726 C VAL A 226 8.836 -8.066 41.507 1.00 12.23 C ATOM 1727 O VAL A 226 8.669 -8.867 42.434 1.00 14.04 O ATOM 1728 CB VAL A 226 9.891 -5.791 41.815 1.00 11.51 C ATOM 1729 CG1 VAL A 226 9.218 -5.713 43.182 1.00 12.94 C ATOM 1730 CG2 VAL A 226 11.218 -5.036 41.807 1.00 11.44 C ATOM 1731 H VAL A 226 10.725 -6.458 39.490 1.00 0.00 H ATOM 1732 N LEU A 227 7.928 -7.907 40.531 1.00 12.78 N ATOM 1733 CA LEU A 227 6.666 -8.646 40.507 1.00 13.94 C ATOM 1734 C LEU A 227 6.899 -10.155 40.409 1.00 14.12 C ATOM 1735 O LEU A 227 6.127 -10.939 40.958 1.00 17.24 O ATOM 1736 CB LEU A 227 5.794 -8.178 39.344 1.00 14.92 C ATOM 1737 CG LEU A 227 5.135 -6.817 39.509 1.00 16.17 C ATOM 1738 CD1 LEU A 227 4.699 -6.249 38.155 1.00 18.00 C ATOM 1739 CD2 LEU A 227 3.928 -6.892 40.444 1.00 18.74 C ATOM 1740 H LEU A 227 8.129 -7.234 39.764 1.00 0.00 H ATOM 1741 N LYS A 228 7.938 -10.574 39.695 1.00 14.14 N ATOM 1742 CA LYS A 228 8.248 -11.998 39.571 1.00 16.15 C ATOM 1743 C LYS A 228 8.853 -12.551 40.853 1.00 15.24 C ATOM 1744 O LYS A 228 8.632 -13.715 41.188 1.00 17.59 O ATOM 1745 CB LYS A 228 9.231 -12.220 38.422 1.00 18.21 C ATOM 1746 CG LYS A 228 8.588 -12.080 37.053 1.00 21.89 C ATOM 1747 CD LYS A 228 9.625 -12.187 35.956 1.00 26.40 C ATOM 1748 CE LYS A 228 9.051 -11.828 34.596 1.00 29.75 C ATOM 1749 NZ LYS A 228 10.140 -11.737 33.585 1.00 31.22 N ATOM 1750 HZ1 LYS A 228 10.818 -11.003 33.873 1.00 0.00 H ATOM 1751 HZ2 LYS A 228 10.627 -12.654 33.518 1.00 0.00 H ATOM 1752 HZ3 LYS A 228 9.733 -11.491 32.660 1.00 0.00 H ATOM 1753 H LYS A 228 8.542 -9.877 39.215 1.00 0.00 H ATOM 1754 N ARG A 229 9.613 -11.750 41.586 1.00 14.81 N ATOM 1755 CA ARG A 229 10.268 -12.247 42.785 1.00 14.30 C ATOM 1756 C ARG A 229 9.303 -12.332 43.948 1.00 15.03 C ATOM 1757 O ARG A 229 9.384 -13.254 44.765 1.00 16.44 O ATOM 1758 CB ARG A 229 11.478 -11.365 43.154 1.00 14.53 C ATOM 1759 CG ARG A 229 12.300 -11.955 44.287 1.00 14.81 C ATOM 1760 CD ARG A 229 13.595 -11.212 44.548 1.00 15.51 C ATOM 1761 NE ARG A 229 14.335 -11.854 45.626 1.00 16.41 N ATOM 1762 CZ ARG A 229 15.094 -12.930 45.470 1.00 18.49 C ATOM 1763 NH1 ARG A 229 15.291 -13.454 44.270 1.00 19.39 N ATOM 1764 NH2 ARG A 229 15.675 -13.485 46.524 1.00 19.59 N ATOM 1765 HE ARG A 229 14.263 -11.442 46.578 1.00 0.00 H ATOM 1766 HH12 ARG A 229 15.889 -14.298 44.163 1.00 0.00 H ATOM 1767 HH11 ARG A 229 14.848 -13.021 43.435 1.00 0.00 H ATOM 1768 HH22 ARG A 229 16.271 -14.329 46.405 1.00 0.00 H ATOM 1769 HH21 ARG A 229 15.535 -13.077 47.470 1.00 0.00 H ATOM 1770 H ARG A 229 9.742 -10.758 41.301 1.00 0.00 H ATOM 1771 N TYR A 230 8.430 -11.341 44.052 1.00 14.30 N ATOM 1772 CA TYR A 230 7.507 -11.223 45.179 1.00 15.11 C ATOM 1773 C TYR A 230 6.077 -11.311 44.673 1.00 16.57 C ATOM 1774 O TYR A 230 5.475 -10.318 44.342 1.00 16.79 O ATOM 1775 CB TYR A 230 7.765 -9.899 45.908 1.00 15.57 C ATOM 1776 CG TYR A 230 9.212 -9.702 46.323 1.00 15.00 C ATOM 1777 CD1 TYR A 230 9.845 -10.594 47.177 1.00 15.38 C ATOM 1778 CD2 TYR A 230 9.954 -8.647 45.823 1.00 16.33 C ATOM 1779 CE1 TYR A 230 11.168 -10.423 47.544 1.00 15.78 C ATOM 1780 CE2 TYR A 230 11.283 -8.454 46.199 1.00 15.94 C ATOM 1781 CZ TYR A 230 11.879 -9.355 47.039 1.00 16.13 C ATOM 1782 OH TYR A 230 13.201 -9.140 47.395 1.00 18.35 O ATOM 1783 HH TYR A 230 13.500 -9.863 48.001 1.00 0.00 H ATOM 1784 H TYR A 230 8.400 -10.620 43.303 1.00 0.00 H ATOM 1785 N ARG A 231 5.558 -12.538 44.628 1.00 17.75 N ATOM 1786 CA ARG A 231 4.275 -12.836 43.988 1.00 18.55 C ATOM 1787 C ARG A 231 3.072 -12.665 44.915 1.00 18.28 C ATOM 1788 O ARG A 231 1.924 -12.739 44.476 1.00 18.71 O ATOM 1789 CB ARG A 231 4.280 -14.267 43.444 1.00 19.50 C ATOM 1790 CG ARG A 231 5.075 -14.425 42.166 1.00 21.01 C ATOM 1791 CD ARG A 231 4.365 -13.783 40.980 1.00 22.86 C ATOM 1792 NE ARG A 231 3.090 -14.434 40.690 1.00 26.23 N ATOM 1793 CZ ARG A 231 2.960 -15.518 39.936 1.00 28.59 C ATOM 1794 NH1 ARG A 231 4.028 -16.084 39.387 1.00 29.61 N ATOM 1795 NH2 ARG A 231 1.760 -16.044 39.735 1.00 29.32 N ATOM 1796 HE ARG A 231 2.228 -14.021 41.101 1.00 0.00 H ATOM 1797 HH12 ARG A 231 3.921 -16.934 38.797 1.00 0.00 H ATOM 1798 HH11 ARG A 231 4.972 -15.678 39.547 1.00 0.00 H ATOM 1799 HH22 ARG A 231 1.657 -16.894 39.144 1.00 0.00 H ATOM 1800 HH21 ARG A 231 0.922 -15.607 40.168 1.00 0.00 H ATOM 1801 H ARG A 231 6.088 -13.318 45.067 1.00 0.00 H ATOM 1802 N ASN A 232 3.345 -12.441 46.195 1.00 17.98 N ATOM 1803 CA ASN A 232 2.300 -12.229 47.191 1.00 18.41 C ATOM 1804 C ASN A 232 2.713 -11.070 48.109 1.00 19.14 C ATOM 1805 O ASN A 232 3.495 -11.255 49.041 1.00 22.12 O ATOM 1806 CB ASN A 232 2.128 -13.527 48.008 1.00 20.03 C ATOM 1807 CG ASN A 232 1.111 -13.406 49.121 1.00 24.20 C ATOM 1808 OD1 ASN A 232 0.234 -12.546 49.086 1.00 29.22 O ATOM 1809 ND2 ASN A 232 1.216 -14.296 50.119 1.00 26.08 N ATOM 1810 HD22 ASN A 232 1.976 -15.006 50.105 1.00 0.00 H ATOM 1811 HD21 ASN A 232 0.538 -14.276 50.907 1.00 0.00 H ATOM 1812 H ASN A 232 4.339 -12.416 46.499 1.00 0.00 H ATOM 1813 N ILE A 233 2.197 -9.872 47.831 1.00 17.65 N ATOM 1814 CA ILE A 233 2.610 -8.657 48.521 1.00 17.45 C ATOM 1815 C ILE A 233 1.456 -8.054 49.299 1.00 18.71 C ATOM 1816 O ILE A 233 0.371 -7.887 48.773 1.00 20.51 O ATOM 1817 CB ILE A 233 3.100 -7.593 47.519 1.00 18.14 C ATOM 1818 CG1 ILE A 233 4.283 -8.118 46.697 1.00 17.15 C ATOM 1819 CG2 ILE A 233 3.489 -6.321 48.248 1.00 20.25 C ATOM 1820 CD1 ILE A 233 4.710 -7.208 45.590 1.00 19.15 C ATOM 1821 H ILE A 233 1.470 -9.802 47.091 1.00 0.00 H ATOM 1822 N ASN A 234 1.708 -7.716 50.569 1.00 19.66 N ATOM 1823 CA ASN A 234 0.691 -7.140 51.456 1.00 20.91 C ATOM 1824 C ASN A 234 0.661 -5.613 51.434 1.00 19.84 C ATOM 1825 O ASN A 234 -0.394 -5.003 51.533 1.00 20.92 O ATOM 1826 CB ASN A 234 0.898 -7.609 52.895 1.00 23.88 C ATOM 1827 CG ASN A 234 0.406 -9.020 53.128 1.00 27.33 C ATOM 1828 OD1 ASN A 234 -0.612 -9.441 52.570 1.00 28.88 O ATOM 1829 ND2 ASN A 234 1.121 -9.762 53.963 1.00 29.46 N ATOM 1830 HD22 ASN A 234 1.972 -9.367 54.411 1.00 0.00 H ATOM 1831 HD21 ASN A 234 0.830 -10.739 54.170 1.00 0.00 H ATOM 1832 H ASN A 234 2.666 -7.868 50.944 1.00 0.00 H ATOM 1833 N ALA A 235 1.825 -4.991 51.312 1.00 16.99 N ATOM 1834 CA ALA A 235 1.895 -3.535 51.256 1.00 17.04 C ATOM 1835 C ALA A 235 3.119 -3.112 50.477 1.00 15.37 C ATOM 1836 O ALA A 235 4.166 -3.771 50.560 1.00 16.25 O ATOM 1837 CB ALA A 235 1.950 -2.954 52.651 1.00 18.23 C ATOM 1838 H ALA A 235 2.701 -5.549 51.255 1.00 0.00 H ATOM 1839 N VAL A 236 3.010 -1.989 49.766 1.00 15.71 N ATOM 1840 CA VAL A 236 4.136 -1.445 49.025 1.00 14.86 C ATOM 1841 C VAL A 236 4.313 0.013 49.449 1.00 14.34 C ATOM 1842 O VAL A 236 3.372 0.824 49.361 1.00 16.09 O ATOM 1843 CB VAL A 236 3.891 -1.488 47.510 1.00 14.61 C ATOM 1844 CG1 VAL A 236 5.040 -0.793 46.778 1.00 15.01 C ATOM 1845 CG2 VAL A 236 3.745 -2.911 47.041 1.00 15.40 C ATOM 1846 H VAL A 236 2.098 -1.491 49.741 1.00 0.00 H ATOM 1847 N VAL A 237 5.526 0.328 49.911 1.00 13.61 N ATOM 1848 CA VAL A 237 5.862 1.684 50.318 1.00 13.92 C ATOM 1849 C VAL A 237 6.639 2.377 49.198 1.00 13.84 C ATOM 1850 O VAL A 237 7.743 1.953 48.861 1.00 13.69 O ATOM 1851 CB VAL A 237 6.728 1.676 51.586 1.00 14.09 C ATOM 1852 CG1 VAL A 237 6.949 3.092 52.060 1.00 16.32 C ATOM 1853 CG2 VAL A 237 6.064 0.830 52.694 1.00 16.12 C ATOM 1854 H VAL A 237 6.250 -0.416 49.982 1.00 0.00 H ATOM 1855 N PRO A 238 6.045 3.403 48.557 1.00 13.91 N ATOM 1856 CA PRO A 238 6.774 4.127 47.510 1.00 14.56 C ATOM 1857 C PRO A 238 7.728 5.132 48.160 1.00 13.86 C ATOM 1858 O PRO A 238 7.584 5.472 49.347 1.00 14.28 O ATOM 1859 CB PRO A 238 5.660 4.858 46.761 1.00 14.94 C ATOM 1860 CG PRO A 238 4.656 5.177 47.823 1.00 15.25 C ATOM 1861 CD PRO A 238 4.737 4.038 48.835 1.00 14.58 C ATOM 1862 N GLY A 239 8.673 5.658 47.392 1.00 14.35 N ATOM 1863 CA GLY A 239 9.605 6.633 47.904 1.00 14.65 C ATOM 1864 C GLY A 239 8.957 7.961 48.256 1.00 14.11 C ATOM 1865 O GLY A 239 9.427 8.662 49.156 1.00 15.65 O ATOM 1866 H GLY A 239 8.744 5.361 46.398 1.00 0.00 H ATOM 1867 N HIS A 240 7.871 8.298 47.560 1.00 14.20 N ATOM 1868 CA HIS A 240 7.144 9.556 47.754 1.00 16.18 C ATOM 1869 C HIS A 240 5.668 9.210 47.629 1.00 17.88 C ATOM 1870 O HIS A 240 5.263 8.548 46.683 1.00 19.86 O ATOM 1871 CB HIS A 240 7.609 10.612 46.711 1.00 17.60 C ATOM 1872 CG HIS A 240 9.103 10.803 46.692 1.00 15.96 C ATOM 1873 ND1 HIS A 240 9.767 11.655 47.545 1.00 15.67 N ATOM 1874 CD2 HIS A 240 10.071 10.195 45.959 1.00 16.29 C ATOM 1875 CE1 HIS A 240 11.071 11.557 47.346 1.00 15.91 C ATOM 1876 NE2 HIS A 240 11.285 10.667 46.401 1.00 15.96 N ATOM 1877 H HIS A 240 7.521 7.633 46.841 1.00 0.00 H ATOM 1878 N GLY A 241 4.853 9.631 48.582 1.00 18.79 N ATOM 1879 CA GLY A 241 3.423 9.427 48.497 1.00 20.19 C ATOM 1880 C GLY A 241 2.889 8.366 49.435 1.00 20.35 C ATOM 1881 O GLY A 241 3.606 7.850 50.286 1.00 21.31 O ATOM 1882 H GLY A 241 5.249 10.119 49.411 1.00 0.00 H ATOM 1883 N GLU A 242 1.614 8.032 49.266 1.00 21.81 N ATOM 1884 CA GLU A 242 0.922 7.139 50.186 1.00 22.18 C ATOM 1885 C GLU A 242 1.286 5.673 49.976 1.00 21.53 C ATOM 1886 O GLU A 242 1.532 5.235 48.856 1.00 21.58 O ATOM 1887 CB GLU A 242 -0.592 7.309 50.034 1.00 24.10 C ATOM 1888 CG GLU A 242 -1.407 6.331 50.864 1.00 25.23 C ATOM 1889 H GLU A 242 1.095 8.420 48.453 1.00 0.00 H ATOM 1890 N VAL A 243 1.328 4.922 51.073 1.00 20.63 N ATOM 1891 CA VAL A 243 1.484 3.489 51.014 1.00 21.58 C ATOM 1892 C VAL A 243 0.327 2.878 50.209 1.00 22.03 C ATOM 1893 O VAL A 243 -0.823 3.316 50.311 1.00 23.68 O ATOM 1894 CB VAL A 243 1.547 2.887 52.439 1.00 22.58 C ATOM 1895 CG1 VAL A 243 1.576 1.380 52.373 1.00 23.19 C ATOM 1896 CG2 VAL A 243 2.764 3.413 53.173 1.00 23.94 C ATOM 1897 H VAL A 243 1.246 5.382 52.002 1.00 0.00 H ATOM 1898 N GLY A 244 0.630 1.841 49.449 1.00 21.16 N ATOM 1899 CA GLY A 244 -0.374 1.159 48.656 1.00 21.10 C ATOM 1900 C GLY A 244 -0.104 -0.329 48.658 1.00 20.87 C ATOM 1901 O GLY A 244 0.385 -0.874 49.648 1.00 21.69 O ATOM 1902 H GLY A 244 1.614 1.505 49.419 1.00 0.00 H ATOM 1903 N ASP A 245 -0.394 -0.986 47.548 1.00 22.20 N ATOM 1904 CA ASP A 245 -0.169 -2.417 47.419 1.00 22.08 C ATOM 1905 C ASP A 245 0.448 -2.699 46.047 1.00 18.99 C ATOM 1906 O ASP A 245 1.038 -1.815 45.444 1.00 18.45 O ATOM 1907 CB ASP A 245 -1.456 -3.240 47.684 1.00 25.15 C ATOM 1908 CG ASP A 245 -2.615 -2.894 46.748 1.00 26.79 C ATOM 1909 OD1 ASP A 245 -2.411 -2.272 45.688 1.00 25.46 O ATOM 1910 OD2 ASP A 245 -3.764 -3.284 47.076 1.00 31.32 O ATOM 1911 H ASP A 245 -0.795 -0.464 46.743 1.00 0.00 H ATOM 1912 N LYS A 246 0.312 -3.924 45.557 1.00 19.28 N ATOM 1913 CA LYS A 246 0.899 -4.297 44.272 1.00 20.05 C ATOM 1914 C LYS A 246 0.421 -3.369 43.154 1.00 16.77 C ATOM 1915 O LYS A 246 1.107 -3.196 42.141 1.00 16.35 O ATOM 1916 CB LYS A 246 0.551 -5.760 43.961 1.00 23.66 C ATOM 1917 CG LYS A 246 0.825 -6.231 42.543 1.00 26.83 C ATOM 1918 CD LYS A 246 0.205 -7.619 42.282 1.00 28.06 C ATOM 1919 H LYS A 246 -0.223 -4.633 46.098 1.00 0.00 H ATOM 1920 N GLY A 247 -0.757 -2.783 43.333 1.00 16.77 N ATOM 1921 CA GLY A 247 -1.239 -1.829 42.354 1.00 16.19 C ATOM 1922 C GLY A 247 -0.284 -0.684 42.047 1.00 15.18 C ATOM 1923 O GLY A 247 -0.321 -0.142 40.957 1.00 15.88 O ATOM 1924 H GLY A 247 -1.331 -3.007 44.171 1.00 0.00 H ATOM 1925 N LEU A 248 0.576 -0.306 42.992 1.00 14.67 N ATOM 1926 CA LEU A 248 1.565 0.747 42.730 1.00 13.96 C ATOM 1927 C LEU A 248 2.576 0.294 41.688 1.00 12.86 C ATOM 1928 O LEU A 248 3.081 1.112 40.912 1.00 13.58 O ATOM 1929 CB LEU A 248 2.298 1.158 44.002 1.00 14.51 C ATOM 1930 CG LEU A 248 1.417 1.799 45.062 1.00 16.58 C ATOM 1931 CD1 LEU A 248 2.313 2.387 46.164 1.00 17.01 C ATOM 1932 CD2 LEU A 248 0.509 2.876 44.490 1.00 18.04 C ATOM 1933 H LEU A 248 0.546 -0.762 43.926 1.00 0.00 H ATOM 1934 N LEU A 249 2.906 -0.995 41.681 1.00 12.37 N ATOM 1935 CA LEU A 249 3.833 -1.527 40.675 1.00 12.85 C ATOM 1936 C LEU A 249 3.156 -1.452 39.303 1.00 13.08 C ATOM 1937 O LEU A 249 3.792 -1.074 38.321 1.00 12.80 O ATOM 1938 CB LEU A 249 4.266 -2.963 41.019 1.00 14.09 C ATOM 1939 CG LEU A 249 4.996 -3.123 42.360 1.00 16.46 C ATOM 1940 CD1 LEU A 249 5.096 -4.587 42.790 1.00 18.23 C ATOM 1941 CD2 LEU A 249 6.327 -2.533 42.235 1.00 19.85 C ATOM 1942 H LEU A 249 2.502 -1.633 42.397 1.00 0.00 H ATOM 1943 N LEU A 250 1.874 -1.823 39.230 1.00 13.54 N ATOM 1944 CA LEU A 250 1.150 -1.737 37.970 1.00 14.04 C ATOM 1945 C LEU A 250 0.978 -0.297 37.526 1.00 14.24 C ATOM 1946 O LEU A 250 0.990 -0.012 36.333 1.00 14.59 O ATOM 1947 CB LEU A 250 -0.204 -2.417 38.115 1.00 16.58 C ATOM 1948 CG LEU A 250 -0.177 -3.872 38.587 1.00 19.73 C ATOM 1949 CD1 LEU A 250 -1.589 -4.482 38.606 1.00 20.61 C ATOM 1950 CD2 LEU A 250 0.774 -4.726 37.771 1.00 21.61 C ATOM 1951 H LEU A 250 1.390 -2.176 40.080 1.00 0.00 H ATOM 1952 N HIS A 251 0.764 0.605 38.476 1.00 13.94 N ATOM 1953 CA HIS A 251 0.674 2.021 38.155 1.00 14.53 C ATOM 1954 C HIS A 251 1.970 2.517 37.526 1.00 13.88 C ATOM 1955 O HIS A 251 1.956 3.272 36.571 1.00 14.87 O ATOM 1956 CB HIS A 251 0.359 2.786 39.439 1.00 15.52 C ATOM 1957 CG HIS A 251 0.360 4.273 39.307 1.00 16.00 C ATOM 1958 ND1 HIS A 251 -0.440 4.960 38.422 1.00 17.25 N ATOM 1959 CD2 HIS A 251 1.038 5.213 40.004 1.00 17.55 C ATOM 1960 CE1 HIS A 251 -0.245 6.256 38.563 1.00 18.23 C ATOM 1961 NE2 HIS A 251 0.652 6.437 39.520 1.00 17.73 N ATOM 1962 H HIS A 251 0.659 0.295 39.463 1.00 0.00 H ATOM 1963 N THR A 252 3.108 2.094 38.083 1.00 13.00 N ATOM 1964 CA THR A 252 4.398 2.508 37.565 1.00 12.80 C ATOM 1965 C THR A 252 4.566 1.990 36.136 1.00 13.20 C ATOM 1966 O THR A 252 5.025 2.725 35.266 1.00 13.59 O ATOM 1967 CB THR A 252 5.522 2.040 38.518 1.00 12.71 C ATOM 1968 OG1 THR A 252 5.282 2.569 39.838 1.00 14.54 O ATOM 1969 CG2 THR A 252 6.848 2.551 38.055 1.00 14.93 C ATOM 1970 HG1 THR A 252 4.409 2.241 40.170 1.00 0.00 H ATOM 1971 H THR A 252 3.068 1.456 38.903 1.00 0.00 H ATOM 1972 N LEU A 253 4.211 0.740 35.897 1.00 13.19 N ATOM 1973 CA LEU A 253 4.228 0.199 34.536 1.00 13.47 C ATOM 1974 C LEU A 253 3.383 1.040 33.575 1.00 13.73 C ATOM 1975 O LEU A 253 3.798 1.302 32.461 1.00 14.86 O ATOM 1976 CB LEU A 253 3.731 -1.235 34.525 1.00 14.15 C ATOM 1977 CG LEU A 253 4.663 -2.269 35.142 1.00 13.89 C ATOM 1978 CD1 LEU A 253 4.015 -3.640 35.112 1.00 16.14 C ATOM 1979 CD2 LEU A 253 6.038 -2.301 34.473 1.00 14.44 C ATOM 1980 H LEU A 253 3.915 0.131 36.687 1.00 0.00 H ATOM 1981 N ASP A 254 2.220 1.484 34.028 1.00 14.26 N ATOM 1982 CA ASP A 254 1.380 2.284 33.153 1.00 15.40 C ATOM 1983 C ASP A 254 2.021 3.644 32.855 1.00 15.97 C ATOM 1984 O ASP A 254 1.952 4.129 31.726 1.00 17.70 O ATOM 1985 CB ASP A 254 -0.002 2.466 33.741 1.00 18.20 C ATOM 1986 CG ASP A 254 -0.964 3.038 32.721 1.00 21.33 C ATOM 1987 OD1 ASP A 254 -1.076 2.478 31.608 1.00 21.74 O ATOM 1988 OD2 ASP A 254 -1.576 4.068 33.012 1.00 24.27 O ATOM 1989 H ASP A 254 1.912 1.263 34.997 1.00 0.00 H ATOM 1990 N LEU A 255 2.678 4.255 33.843 1.00 16.34 N ATOM 1991 CA LEU A 255 3.322 5.548 33.626 1.00 16.68 C ATOM 1992 C LEU A 255 4.490 5.463 32.664 1.00 16.31 C ATOM 1993 O LEU A 255 4.860 6.465 32.066 1.00 18.18 O ATOM 1994 CB LEU A 255 3.788 6.153 34.943 1.00 17.29 C ATOM 1995 CG LEU A 255 2.700 6.595 35.909 1.00 18.32 C ATOM 1996 CD1 LEU A 255 3.350 6.988 37.225 1.00 18.68 C ATOM 1997 CD2 LEU A 255 1.868 7.731 35.334 1.00 20.96 C ATOM 1998 H LEU A 255 2.732 3.805 34.779 1.00 0.00 H ATOM 1999 N LEU A 256 5.051 4.265 32.508 1.00 15.08 N ATOM 2000 CA LEU A 256 6.205 4.043 31.629 1.00 14.86 C ATOM 2001 C LEU A 256 5.812 3.814 30.163 1.00 17.34 C ATOM 2002 O LEU A 256 6.679 3.679 29.304 1.00 19.75 O ATOM 2003 CB LEU A 256 7.007 2.853 32.135 1.00 13.72 C ATOM 2004 CG LEU A 256 7.823 3.201 33.384 1.00 13.56 C ATOM 2005 CD1 LEU A 256 8.181 1.950 34.165 1.00 14.04 C ATOM 2006 CD2 LEU A 256 9.078 3.970 32.990 1.00 14.76 C ATOM 2007 H LEU A 256 4.656 3.456 33.029 1.00 0.00 H ATOM 2008 N LYS A 257 4.520 3.773 29.891 1.00 18.87 N ATOM 2009 CA LYS A 257 4.042 3.572 28.518 1.00 22.56 C ATOM 2010 C LYS A 257 4.070 4.868 27.704 1.00 27.41 C ATOM 2011 O LYS A 257 3.916 5.918 28.223 1.00 29.46 O ATOM 2012 CB LYS A 257 2.678 2.906 28.540 1.00 24.61 C ATOM 2013 CG LYS A 257 2.851 1.447 28.839 1.00 27.55 C ATOM 2014 CD LYS A 257 1.662 0.771 29.368 1.00 32.80 C ATOM 2015 CE LYS A 257 1.964 -0.674 29.406 1.00 34.92 C ATOM 2016 NZ LYS A 257 0.953 -1.296 28.550 1.00 35.91 N ATOM 2017 OXT LYS A 257 4.072 4.835 26.478 1.00 31.54 O ATOM 2018 HZ1 LYS A 257 0.006 -1.091 28.929 1.00 0.00 H ATOM 2019 HZ2 LYS A 257 1.033 -0.912 27.587 1.00 0.00 H ATOM 2020 HZ3 LYS A 257 1.104 -2.325 28.528 1.00 0.00 H ATOM 2021 H LYS A 257 3.831 3.885 30.662 1.00 0.00 H TER 2022 LYS A 257 HETATM 2023 ZN ZN A 1 13.139 9.810 46.063 1.00 11.87 ZN HETATM 2024 ZN ZN A 2 15.886 9.277 43.498 1.00 12.63 ZN HETATM 2025 O HOH 3 -1.170 1.527 64.701 1.00 38.50 O HETATM 2026 O HOH 4 6.368 14.692 57.262 1.00 32.80 O HETATM 2027 O HOH 5 4.825 8.328 57.558 1.00 28.55 O HETATM 2028 O HOH 6 0.551 9.091 57.420 1.00 40.54 O HETATM 2029 O HOH 7 1.877 -5.972 58.615 1.00 36.05 O HETATM 2030 O HOH 8 4.122 14.255 55.892 1.00 36.38 O HETATM 2031 O HOH 9 2.876 6.644 55.405 1.00 39.13 O HETATM 2032 O HOH 10 3.204 14.369 53.423 1.00 34.88 O HETATM 2033 O HOH 11 6.964 -0.627 67.312 1.00 33.14 O HETATM 2034 O HOH 12 11.541 -7.274 65.027 1.00 32.92 O HETATM 2035 O HOH 13 5.977 0.595 69.723 1.00 39.73 O HETATM 2036 O HOH 14 13.010 9.807 53.552 1.00 26.01 O HETATM 2037 O HOH 15 11.748 20.272 56.225 1.00 37.79 O HETATM 2038 O HOH 16 3.241 11.967 51.853 1.00 33.38 O HETATM 2039 O HOH 17 13.582 20.400 48.486 1.00 39.89 O HETATM 2040 O HOH 18 21.786 -3.718 72.208 1.00 37.94 O HETATM 2041 O HOH 19 16.406 -3.304 73.569 1.00 40.12 O HETATM 2042 O HOH 20 3.122 16.403 51.869 1.00 39.73 O HETATM 2043 O HOH 21 10.464 4.052 50.153 1.00 23.35 O HETATM 2044 O HOH 22 3.292 7.997 53.674 1.00 42.36 O HETATM 2045 O HOH 23 5.653 10.766 51.073 1.00 23.62 O HETATM 2046 O HOH 24 26.323 17.903 60.053 1.00 39.21 O HETATM 2047 O HOH 25 20.850 19.880 63.561 1.00 38.52 O HETATM 2048 O HOH 26 10.863 13.229 70.397 1.00 31.50 O HETATM 2049 O HOH 27 8.846 9.870 72.757 1.00 35.46 O HETATM 2050 O HOH 28 7.303 10.305 69.433 1.00 34.74 O HETATM 2051 O HOH 29 10.418 -0.466 71.511 1.00 30.39 O HETATM 2052 O HOH 30 7.126 8.217 73.497 1.00 40.29 O HETATM 2053 O HOH 31 15.901 0.892 79.428 1.00 25.94 O HETATM 2054 O HOH 32 15.596 -1.999 79.500 1.00 34.44 O HETATM 2055 O HOH 33 13.452 -8.513 66.515 1.00 29.44 O HETATM 2056 O HOH 34 19.833 -4.767 72.449 1.00 36.60 O HETATM 2057 O HOH 35 20.007 -3.874 65.484 1.00 36.30 O HETATM 2058 O HOH 36 21.627 -1.768 69.904 1.00 20.15 O HETATM 2059 O HOH 37 18.350 -2.822 71.644 1.00 26.12 O HETATM 2060 O HOH 38 13.207 3.079 50.155 1.00 30.00 O HETATM 2061 O HOH 39 32.887 2.284 54.918 1.00 36.59 O HETATM 2062 O HOH 40 21.672 16.724 51.041 1.00 36.07 O HETATM 2063 O HOH 41 18.364 17.715 50.053 1.00 34.55 O HETATM 2064 O HOH 42 16.265 20.679 56.912 1.00 35.50 O HETATM 2065 O HOH 43 23.997 -3.010 41.847 1.00 14.94 O HETATM 2066 O HOH 44 28.505 -2.841 41.108 1.00 26.53 O HETATM 2067 O HOH 45 31.999 0.053 48.027 1.00 27.63 O HETATM 2068 O HOH 46 21.504 19.681 57.309 1.00 27.52 O HETATM 2069 O HOH 47 23.222 17.880 55.201 1.00 26.46 O HETATM 2070 O HOH 48 25.473 13.952 54.792 1.00 17.29 O HETATM 2071 O HOH 49 26.057 15.459 60.629 1.00 26.63 O HETATM 2072 O HOH 50 34.811 9.090 42.645 1.00 20.82 O HETATM 2073 O HOH 51 22.770 18.922 61.136 1.00 37.20 O HETATM 2074 O HOH 52 15.099 18.646 61.659 1.00 39.67 O HETATM 2075 O HOH 53 18.582 18.420 63.731 1.00 26.05 O HETATM 2076 O HOH 54 39.417 8.810 41.495 1.00 38.75 O HETATM 2077 O HOH 55 39.226 9.799 38.948 1.00 35.04 O HETATM 2078 O HOH 56 33.870 12.616 51.405 1.00 42.11 O HETATM 2079 O HOH 57 27.489 17.000 63.249 1.00 41.87 O HETATM 2080 O HOH 58 13.633 14.837 67.161 1.00 34.34 O HETATM 2081 O HOH 59 31.143 -4.269 55.136 1.00 39.51 O HETATM 2082 O HOH 60 25.987 -7.275 57.537 1.00 41.93 O HETATM 2083 O HOH 61 28.065 -3.886 58.769 1.00 34.05 O HETATM 2084 O HOH 62 21.904 -13.703 43.745 1.00 40.58 O HETATM 2085 O HOH 63 27.145 -10.967 50.937 1.00 38.61 O HETATM 2086 O HOH 64 13.241 13.654 70.065 1.00 35.91 O HETATM 2087 O HOH 65 15.660 16.113 68.083 1.00 36.96 O HETATM 2088 O HOH 66 18.670 17.436 66.200 1.00 36.53 O HETATM 2089 O HOH 67 21.721 13.747 69.731 1.00 23.11 O HETATM 2090 O HOH 68 21.472 16.756 67.386 1.00 44.64 O HETATM 2091 O HOH 69 9.946 10.591 70.318 1.00 24.57 O HETATM 2092 O HOH 70 22.439 -9.361 67.392 1.00 44.29 O HETATM 2093 O HOH 71 21.771 9.066 68.067 1.00 13.92 O HETATM 2094 O HOH 72 18.937 10.205 70.335 1.00 16.51 O HETATM 2095 O HOH 73 24.819 -3.425 39.195 1.00 22.20 O HETATM 2096 O HOH 74 20.515 -4.788 35.111 1.00 33.03 O HETATM 2097 O HOH 75 9.589 6.829 75.350 1.00 39.63 O HETATM 2098 O HOH 76 13.405 10.177 78.156 1.00 32.19 O HETATM 2099 O HOH 77 7.656 5.648 74.174 1.00 39.30 O HETATM 2100 O HOH 78 2.539 4.659 69.561 1.00 34.31 O HETATM 2101 O HOH 79 5.536 8.679 70.803 1.00 37.16 O HETATM 2102 O HOH 80 14.098 -1.150 74.701 1.00 44.18 O HETATM 2103 O HOH 81 16.624 2.112 77.044 1.00 27.40 O HETATM 2104 O HOH 82 19.782 -0.387 71.506 1.00 14.98 O HETATM 2105 O HOH 83 25.885 0.623 64.766 1.00 15.69 O HETATM 2106 O HOH 84 6.393 11.075 42.652 1.00 37.56 O HETATM 2107 O HOH 85 24.506 -3.353 64.005 1.00 35.88 O HETATM 2108 O HOH 86 24.740 -5.076 61.008 1.00 32.14 O HETATM 2109 O HOH 87 -2.209 7.802 36.600 1.00 33.13 O HETATM 2110 O HOH 88 8.792 11.519 31.558 1.00 35.23 O HETATM 2111 O HOH 89 11.281 15.219 32.386 1.00 32.04 O HETATM 2112 O HOH 90 22.176 0.507 47.593 1.00 10.21 O HETATM 2113 O HOH 91 14.519 10.519 29.107 1.00 27.78 O HETATM 2114 O HOH 92 14.893 4.043 46.303 1.00 12.23 O HETATM 2115 O HOH 93 14.996 10.746 44.946 1.00 21.53 O HETATM 2116 O HOH 94 8.949 7.193 29.218 1.00 34.32 O HETATM 2117 O HOH 95 16.189 -4.240 31.164 1.00 28.69 O HETATM 2118 O HOH 96 21.471 7.181 42.515 1.00 28.03 O HETATM 2119 O HOH 97 24.518 11.277 44.672 1.00 34.50 O HETATM 2120 O HOH 98 4.465 -3.000 30.764 1.00 25.44 O HETATM 2121 O HOH 99 9.941 -7.928 31.634 1.00 32.97 O HETATM 2122 O HOH 100 18.419 13.863 39.797 1.00 28.61 O HETATM 2123 O HOH 101 1.228 -5.562 32.679 1.00 38.81 O HETATM 2124 O HOH 102 12.889 -13.167 37.384 1.00 35.25 O HETATM 2125 O HOH 103 5.134 -13.974 36.354 1.00 36.18 O HETATM 2126 O HOH 104 -1.807 -5.936 34.713 1.00 33.46 O HETATM 2127 O HOH 105 19.801 14.043 44.751 1.00 28.03 O HETATM 2128 O HOH 106 12.672 -15.362 41.866 1.00 34.10 O HETATM 2129 O HOH 107 23.385 16.290 52.845 1.00 28.34 O HETATM 2130 O HOH 108 -1.244 8.299 52.988 1.00 42.44 O HETATM 2131 O HOH 109 -1.163 -0.406 54.457 1.00 45.11 O HETATM 2132 O HOH 110 30.702 11.656 59.141 1.00 24.03 O HETATM 2133 O HOH 111 31.502 13.992 60.550 1.00 35.17 O HETATM 2134 O HOH 112 31.925 17.812 61.021 1.00 39.30 O HETATM 2135 O HOH 113 0.212 -4.099 34.180 1.00 31.59 O HETATM 2136 O HOH 114 30.322 3.210 55.238 1.00 18.87 O HETATM 2137 O HOH 115 33.378 8.306 52.786 1.00 31.83 O HETATM 2138 O HOH 116 32.906 9.268 55.889 1.00 34.12 O HETATM 2139 O HOH 117 1.870 -3.575 31.387 1.00 27.72 O HETATM 2140 O HOH 118 29.410 10.943 67.399 1.00 15.46 O HETATM 2141 O HOH 119 31.423 14.350 64.492 1.00 36.25 O HETATM 2142 O HOH 120 24.384 10.971 68.749 1.00 19.05 O HETATM 2143 O HOH 121 28.966 4.405 59.604 1.00 26.99 O HETATM 2144 O HOH 122 28.747 2.628 57.560 1.00 18.11 O HETATM 2145 O HOH 123 22.886 -0.723 43.010 1.00 11.14 O HETATM 2146 O HOH 124 27.167 -4.484 45.225 1.00 17.21 O HETATM 2147 O HOH 125 26.544 -2.842 43.035 1.00 12.99 O HETATM 2148 O HOH 126 30.006 -0.623 41.655 1.00 28.49 O HETATM 2149 O HOH 127 31.851 0.949 45.416 1.00 21.22 O HETATM 2150 O HOH 128 33.160 6.885 42.487 1.00 17.82 O HETATM 2151 O HOH 129 32.684 6.062 40.495 1.00 23.53 O HETATM 2152 O HOH 130 33.444 3.556 40.131 1.00 21.93 O HETATM 2153 O HOH 131 32.200 -0.472 42.782 1.00 28.62 O HETATM 2154 O HOH 132 33.730 12.054 47.353 1.00 30.88 O HETATM 2155 O HOH 133 33.856 13.442 43.765 1.00 37.48 O HETATM 2156 O HOH 134 35.426 11.331 44.161 1.00 33.74 O HETATM 2157 O HOH 135 37.411 8.019 43.350 1.00 31.20 O HETATM 2158 O HOH 136 37.177 5.444 43.982 1.00 27.42 O HETATM 2159 O HOH 137 26.093 16.138 44.766 1.00 35.20 O HETATM 2160 O HOH 138 31.316 14.975 51.641 1.00 34.13 O HETATM 2161 O HOH 139 32.711 15.887 49.292 1.00 39.56 O HETATM 2162 O HOH 140 33.158 10.477 49.520 1.00 27.90 O HETATM 2163 O HOH 141 27.967 13.332 52.986 1.00 24.66 O HETATM 2164 O HOH 142 30.497 15.221 54.419 1.00 36.69 O HETATM 2165 O HOH 143 32.164 1.801 50.156 1.00 27.64 O HETATM 2166 O HOH 144 33.244 3.351 45.597 1.00 26.15 O HETATM 2167 O HOH 145 34.747 8.350 50.228 1.00 33.50 O HETATM 2168 O HOH 146 31.647 -3.466 52.661 1.00 41.86 O HETATM 2169 O HOH 147 30.169 -5.728 47.829 1.00 35.98 O HETATM 2170 O HOH 148 32.134 -2.579 48.154 1.00 30.81 O HETATM 2171 O HOH 149 26.684 -6.873 55.234 1.00 36.35 O HETATM 2172 O HOH 150 28.787 -5.013 56.151 1.00 37.86 O HETATM 2173 O HOH 151 20.524 -5.896 47.221 1.00 18.14 O HETATM 2174 O HOH 152 23.672 -5.454 42.945 1.00 31.20 O HETATM 2175 O HOH 153 29.446 -5.957 45.060 1.00 33.36 O HETATM 2176 O HOH 154 25.586 -9.685 43.244 1.00 37.16 O HETATM 2177 O HOH 155 23.419 -11.783 44.974 1.00 24.62 O HETATM 2178 O HOH 156 24.365 -6.190 38.948 1.00 38.89 O HETATM 2179 O HOH 157 22.138 -13.938 48.215 1.00 36.61 O HETATM 2180 O HOH 158 24.903 -12.611 47.430 1.00 34.31 O HETATM 2181 O HOH 159 24.729 -11.103 50.055 1.00 28.73 O HETATM 2182 O HOH 160 22.949 -12.626 51.794 1.00 24.71 O HETATM 2183 O HOH 161 20.808 -14.360 50.593 1.00 43.04 O HETATM 2184 O HOH 162 13.741 -13.296 52.288 1.00 36.62 O HETATM 2185 O HOH 163 16.780 -12.400 56.036 1.00 31.73 O HETATM 2186 O HOH 164 22.420 -9.767 59.175 1.00 35.58 O HETATM 2187 O HOH 165 19.634 -12.032 64.857 1.00 43.75 O HETATM 2188 O HOH 166 21.097 -9.002 65.198 1.00 40.82 O HETATM 2189 O HOH 167 10.518 -9.612 57.799 1.00 16.80 O HETATM 2190 O HOH 168 12.758 -13.892 48.759 1.00 33.98 O HETATM 2191 O HOH 169 18.800 -7.974 38.957 1.00 33.07 O HETATM 2192 O HOH 170 23.859 -2.130 36.996 1.00 24.92 O HETATM 2193 O HOH 171 18.965 -6.878 36.372 1.00 36.73 O HETATM 2194 O HOH 172 18.612 -3.040 34.113 1.00 15.84 O HETATM 2195 O HOH 173 21.776 -1.721 30.891 1.00 34.39 O HETATM 2196 O HOH 174 16.107 10.000 38.011 1.00 17.62 O HETATM 2197 O HOH 175 11.627 9.306 38.867 1.00 22.72 O HETATM 2198 O HOH 176 21.245 6.785 37.772 1.00 12.48 O HETATM 2199 O HOH 177 25.068 2.119 36.085 1.00 30.00 O HETATM 2200 O HOH 178 23.878 6.600 36.968 1.00 27.90 O HETATM 2201 O HOH 179 25.251 8.835 37.282 1.00 38.18 O HETATM 2202 O HOH 180 14.131 1.807 44.864 1.00 11.54 O HETATM 2203 O HOH 181 13.589 0.783 48.393 1.00 11.62 O HETATM 2204 O HOH 182 9.434 -14.112 51.135 1.00 26.88 O HETATM 2205 O HOH 183 4.898 -13.590 55.765 1.00 28.89 O HETATM 2206 O HOH 184 7.983 -15.945 54.836 1.00 46.09 O HETATM 2207 O HOH 185 9.968 -15.074 56.868 1.00 36.48 O HETATM 2208 O HOH 186 7.197 -14.453 52.720 1.00 32.60 O HETATM 2209 O HOH 187 2.982 -11.794 55.741 1.00 34.80 O HETATM 2210 O HOH 188 9.967 -9.321 62.852 1.00 34.79 O HETATM 2211 O HOH 189 1.708 -6.931 56.325 1.00 32.70 O HETATM 2212 O HOH 190 9.870 8.207 42.428 1.00 19.98 O HETATM 2213 O HOH 191 8.034 7.289 44.572 1.00 18.89 O HETATM 2214 O HOH 192 6.644 11.279 39.891 1.00 35.04 O HETATM 2215 O HOH 193 5.711 8.678 43.864 1.00 19.50 O HETATM 2216 O HOH 194 -0.319 8.608 46.574 1.00 34.39 O HETATM 2217 O HOH 195 -0.157 5.618 46.732 1.00 22.09 O HETATM 2218 O HOH 196 -2.244 2.775 41.868 1.00 33.08 O HETATM 2219 O HOH 197 -1.864 14.015 42.033 1.00 39.94 O HETATM 2220 O HOH 198 1.779 12.582 49.550 1.00 42.85 O HETATM 2221 O HOH 199 2.279 13.978 39.229 1.00 33.79 O HETATM 2222 O HOH 200 -1.807 9.774 34.713 1.00 33.44 O HETATM 2223 O HOH 201 2.028 10.498 32.415 1.00 34.65 O HETATM 2224 O HOH 202 -4.392 8.354 38.067 1.00 37.44 O HETATM 2225 O HOH 203 6.149 11.007 32.585 1.00 34.95 O HETATM 2226 O HOH 204 9.259 13.376 33.488 1.00 31.09 O HETATM 2227 O HOH 205 13.403 14.887 34.415 1.00 27.00 O HETATM 2228 O HOH 206 14.963 16.366 36.899 1.00 39.81 O HETATM 2229 O HOH 207 17.731 14.120 42.795 1.00 38.64 O HETATM 2230 O HOH 208 15.576 7.310 30.565 1.00 18.84 O HETATM 2231 O HOH 209 15.664 9.171 31.104 1.00 15.27 O HETATM 2232 O HOH 210 22.130 7.989 34.562 1.00 36.55 O HETATM 2233 O HOH 211 22.769 10.235 35.386 1.00 39.78 O HETATM 2234 O HOH 212 22.358 12.461 40.686 1.00 38.13 O HETATM 2235 O HOH 213 16.477 6.745 29.915 1.00 11.45 O HETATM 2236 O HOH 214 19.324 6.099 30.182 1.00 16.47 O HETATM 2237 O HOH 215 9.582 0.861 29.899 1.00 21.97 O HETATM 2238 O HOH 216 9.367 4.326 29.034 1.00 25.97 O HETATM 2239 O HOH 217 10.018 -0.234 28.006 1.00 38.30 O HETATM 2240 O HOH 218 11.842 -2.607 30.128 1.00 23.08 O HETATM 2241 O HOH 219 10.636 3.515 26.520 1.00 40.07 O HETATM 2242 O HOH 220 14.980 4.897 25.890 1.00 21.48 O HETATM 2243 O HOH 221 16.055 -4.257 34.065 1.00 17.17 O HETATM 2244 O HOH 222 18.652 -4.291 30.517 1.00 35.50 O HETATM 2245 O HOH 223 5.481 -0.441 31.054 1.00 17.84 O HETATM 2246 O HOH 224 8.545 -4.803 30.663 1.00 38.98 O HETATM 2247 O HOH 225 11.388 -9.170 33.680 1.00 31.77 O HETATM 2248 O HOH 226 6.564 -9.868 36.236 1.00 35.83 O HETATM 2249 O HOH 227 2.525 -7.234 34.805 1.00 46.51 O HETATM 2250 O HOH 228 6.067 -5.004 31.600 1.00 36.74 O HETATM 2251 O HOH 229 13.095 -11.486 39.630 1.00 19.84 O HETATM 2252 O HOH 230 15.521 -10.559 38.352 1.00 33.85 O HETATM 2253 O HOH 231 16.888 -6.869 34.407 1.00 28.46 O HETATM 2254 O HOH 232 3.400 -10.367 41.255 1.00 34.99 O HETATM 2255 O HOH 233 4.839 -11.655 37.803 1.00 37.94 O HETATM 2256 O HOH 234 8.269 -10.147 31.694 1.00 41.69 O HETATM 2257 O HOH 235 7.111 -14.926 45.355 1.00 26.27 O HETATM 2258 O HOH 236 10.545 -14.241 47.236 1.00 37.43 O HETATM 2259 O HOH 237 11.074 -15.412 44.411 1.00 35.61 O HETATM 2260 O HOH 238 14.278 -13.006 41.545 1.00 23.02 O HETATM 2261 O HOH 239 17.279 -15.679 43.444 1.00 45.06 O HETATM 2262 O HOH 240 17.432 -15.681 45.956 1.00 43.12 O HETATM 2263 O HOH 241 3.040 -9.307 43.413 1.00 27.29 O HETATM 2264 O HOH 242 5.817 -12.758 47.780 1.00 26.58 O HETATM 2265 O HOH 243 -1.005 -11.398 44.974 1.00 40.81 O HETATM 2266 O HOH 244 1.143 -12.588 41.814 1.00 36.37 O HETATM 2267 O HOH 245 0.921 -9.467 45.316 1.00 28.08 O HETATM 2268 O HOH 246 7.355 -15.654 36.748 1.00 30.05 O HETATM 2269 O HOH 247 11.008 -16.366 39.522 1.00 38.84 O HETATM 2270 O HOH 248 -0.217 -14.419 52.710 1.00 38.73 O HETATM 2271 O HOH 249 -2.112 -9.460 48.925 1.00 48.87 O HETATM 2272 O HOH 250 -0.685 -6.469 46.731 1.00 31.51 O HETATM 2273 O HOH 251 0.963 -4.854 54.840 1.00 39.01 O HETATM 2274 O HOH 252 0.852 -12.642 54.114 1.00 43.40 O HETATM 2275 O HOH 253 0.238 6.031 53.558 1.00 35.57 O HETATM 2276 O HOH 254 -2.125 4.305 47.806 1.00 33.21 O HETATM 2277 O HOH 255 -1.383 -1.023 51.949 1.00 34.75 O HETATM 2278 O HOH 256 -1.917 0.499 45.523 1.00 32.54 O HETATM 2279 O HOH 257 -4.467 -1.370 44.023 1.00 35.60 O HETATM 2280 O HOH 258 -0.472 -1.411 34.365 1.00 17.85 O HETATM 2281 O HOH 259 -0.600 3.987 29.340 1.00 30.24 O HETATM 2282 O HOH 260 1.648 6.365 30.136 1.00 35.35 O HETATM 2283 O HOH 261 -0.912 0.158 30.077 1.00 19.62 O HETATM 2284 O HOH 262 4.185 9.091 32.289 1.00 33.66 O HETATM 2285 O HOH 263 6.125 7.128 29.701 1.00 29.68 O HETATM 2286 O HOH 264 0.454 -3.471 28.064 1.00 37.27 O HETATM 2287 O HOH 265 -0.494 0.950 26.310 1.00 34.87 O HETATM 2288 O HOH 266 0.534 -1.186 32.001 1.00 30.00 O HETATM 2289 O HOH 267 30.402 13.510 66.914 1.00 28.95 O HETATM 2290 O HOH 268 21.731 8.386 40.061 1.00 19.95 O HETATM 2291 O2 MCO A 269 11.016 10.779 42.450 1.00 -0.57 O HETATM 2292 C9 MCO A 269 10.800 11.710 41.601 1.00 0.06 C HETATM 2293 O3 MCO A 269 10.625 11.445 40.415 1.00 -0.57 O HETATM 2294 C8 MCO A 269 10.764 13.115 42.026 1.00 0.10 C HETATM 2295 C7 MCO A 269 9.370 13.473 42.467 1.00 -0.02 C HETATM 2296 C6 MCO A 269 9.393 13.599 43.945 1.00 -0.03 C HETATM 2297 C5 MCO A 269 10.823 13.471 44.372 1.00 0.04 C HETATM 2298 N MCO A 269 11.600 13.279 43.175 1.00 -0.26 N HETATM 2299 C4 MCO A 269 13.041 13.227 43.131 1.00 0.18 C HETATM 2300 O1 MCO A 269 13.602 13.054 42.094 1.00 -0.40 O HETATM 2301 C2 MCO A 269 13.833 13.349 44.395 1.00 0.05 C HETATM 2302 C3 MCO A 269 14.486 14.710 44.533 1.00 -0.04 C HETATM 2303 H9 MCO A 269 15.054 14.750 45.474 1.00 0.03 H HETATM 2304 H10 MCO A 269 13.710 15.490 44.539 1.00 0.03 H HETATM 2305 H11 MCO A 269 15.167 14.877 43.686 1.00 0.03 H HETATM 2306 C1 MCO A 269 14.890 12.278 44.412 1.00 0.01 C HETATM 2307 S MCO A 269 14.175 10.620 44.206 1.00 -0.18 S HETATM 2308 H14 MCO A 269 14.912 9.933 44.223 1.00 0.10 H HETATM 2309 H12 MCO A 269 15.423 12.319 45.373 1.00 0.04 H HETATM 2310 H13 MCO A 269 15.599 12.464 43.592 1.00 0.04 H HETATM 2311 H8 MCO A 269 13.156 13.200 45.249 1.00 0.05 H HETATM 2312 H6 MCO A 269 10.942 12.607 45.043 1.00 0.05 H HETATM 2313 H7 MCO A 269 11.146 14.386 44.891 1.00 0.05 H HETATM 2314 H4 MCO A 269 8.789 12.801 44.402 1.00 0.03 H HETATM 2315 H5 MCO A 269 8.995 14.579 44.247 1.00 0.03 H HETATM 2316 H2 MCO A 269 8.666 12.683 42.168 1.00 0.03 H HETATM 2317 H3 MCO A 269 9.065 14.427 42.013 1.00 0.03 H HETATM 2318 H1 MCO A 269 11.094 13.769 41.205 1.00 0.07 H CONECT 243 239 244 245 246 CONECT 244 243 CONECT 245 243 CONECT 246 243 CONECT 709 707 708 2024 CONECT 723 722 725 2024 CONECT 741 739 2023 CONECT 1295 1293 1294 2024 CONECT 1471 1470 2023 CONECT 1876 1874 1875 2023 CONECT 2023 741 1471 1876 CONECT 2024 709 723 1295 CONECT 2291 2292 CONECT 2292 2291 2293 2294 CONECT 2293 2292 CONECT 2294 2292 2295 2298 2318 CONECT 2295 2294 2296 2316 2317 CONECT 2296 2295 2297 2314 2315 CONECT 2297 2296 2298 2312 2313 CONECT 2298 2294 2297 2299 CONECT 2299 2298 2300 2301 CONECT 2300 2299 CONECT 2301 2299 2302 2306 2311 CONECT 2302 2301 2303 2304 2305 CONECT 2303 2302 CONECT 2304 2302 CONECT 2305 2302 CONECT 2306 2301 2307 2309 2310 CONECT 2307 2306 2308 CONECT 2308 2307 CONECT 2309 2306 CONECT 2310 2306 CONECT 2311 2301 CONECT 2312 2297 CONECT 2313 2297 CONECT 2314 2296 CONECT 2315 2296 CONECT 2316 2295 CONECT 2317 2295 CONECT 2318 2294 MASTER 0 0 0 0 0 0 0 0 2316 2 40 18 END
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Structure:
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Related entries of code: 4c1c
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1jt1
RCSB PDB
PDBbind
MCO
1m2x
RCSB PDB
PDBbind
MCO
2fu8
RCSB PDB
PDBbind
MCO
4c1e
RCSB PDB
PDBbind
MCO
4c1g
RCSB PDB
PDBbind
MCO
Entry Information
PDB ID
4c1c
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
metallo-beta-lactamase BCII
Ligand Name
MCO
EC.Number
E.C.3.5.2.6
Resolution
1.18(Å)
Affinity (Kd/Ki/IC50)
IC50=10.7uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Antimicrob.Agents Chemother. Vol. 60: pp. 142-150
Ligand Properties
Formula
C
9
H
1
5
NO
3
S
Molecular Weight
217.285
Exact Mass
217.077
No. of atoms
29
No. of bonds
29
Polar Surface Area
96.41
LOGP Value
1.52 (
Computed with XLOGP3
)
0.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
Canonical SMILES
SC[C@H](C(=O)N1CCC[C@@H]1C(=O)O)C
InChI String
InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P04190
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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