Browse entries in the PDBbind-CN Database
HEADER 5LE1_COMPLEX COMPND 5LE1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 96 GLY GLU TYR PRO THR VAL SER GLU ILE PRO VAL GLY GLU SEQRES 2 A 96 VAL ARG LEU TYR GLN ILE ALA ASP GLY VAL TRP SER HIS SEQRES 3 A 96 ILE ALA THR GLN SER PHE ASP GLY ALA VAL TYR PRO SER SEQRES 4 A 96 ASN GLY LEU ILE VAL ARG ASP GLY ASP GLU LEU LEU LEU SEQRES 5 A 96 ILE ASP THR ALA TRP GLY ALA LYS ASN THR ALA ALA LEU SEQRES 6 A 96 LEU ALA GLU ILE GLU LYS GLN ILE GLY LEU PRO VAL THR SEQRES 7 A 96 ARG ALA VAL SER THR HIS PHE HIS ASP ASP ARG VAL GLY SEQRES 8 A 96 GLY VAL ASP VAL LEU SEQRES 1 A 134 ALA ALA GLY VAL ALA THR TYR ALA SER PRO SER THR ARG SEQRES 2 A 134 ARG LEU ALA GLU VAL GLU GLY ASN GLU ILE PRO THR HIS SEQRES 3 A 134 SER LEU GLU GLY LEU SER SER SER GLY ASP ALA VAL ARG SEQRES 4 A 134 PHE GLY PRO VAL GLU LEU PHE TYR PRO GLY ALA ALA HIS SEQRES 5 A 134 SER THR ASP ASN LEU VAL VAL TYR VAL PRO SER ALA SER SEQRES 6 A 134 VAL LEU TYR GLY GLY CYS ALA ILE TYR GLU LEU SER ARG SEQRES 7 A 134 THR SER ALA GLY ASN VAL ALA ASP ALA ASP LEU ALA GLU SEQRES 8 A 134 TRP PRO THR SER ILE GLU ARG ILE GLN GLN HIS TYR PRO SEQRES 9 A 134 GLU ALA GLN PHE VAL ILE PRO GLY HIS GLY LEU PRO GLY SEQRES 10 A 134 GLY LEU ASP LEU LEU LYS HIS THR THR ASN VAL VAL LYS SEQRES 11 A 134 ALA HIS THR ASN HET ZN A 1 1 HET ZN A 2 1 HET UNN A 571 32 ATOM 1 C GLY A 31 94.068 87.981 3.869 1.00 27.72 C ATOM 2 O GLY A 31 93.505 86.989 4.356 1.00 35.16 O ATOM 3 N GLU A 32 94.769 87.931 2.740 1.00 33.81 N ATOM 4 CA GLU A 32 95.337 86.676 2.286 1.00 25.49 C ATOM 5 C GLU A 32 96.460 86.292 3.247 1.00 17.49 C ATOM 6 O GLU A 32 97.175 87.150 3.775 1.00 23.30 O ATOM 7 CB GLU A 32 95.835 86.781 0.840 1.00 23.42 C ATOM 8 CG GLU A 32 94.721 86.945 -0.185 1.00 31.51 C ATOM 9 CD GLU A 32 93.772 85.759 -0.210 1.00 28.91 C ATOM 10 OE1 GLU A 32 94.250 84.613 -0.350 1.00 23.93 O ATOM 11 OE2 GLU A 32 92.547 85.972 -0.085 1.00 29.99 O ATOM 12 H GLU A 32 94.911 88.796 2.180 1.00 0.00 H ATOM 13 N TYR A 33 96.589 85.001 3.506 1.00 18.05 N ATOM 14 CA TYR A 33 97.660 84.528 4.361 1.00 15.41 C ATOM 15 C TYR A 33 98.987 84.768 3.656 1.00 13.71 C ATOM 16 O TYR A 33 99.107 84.473 2.465 1.00 17.90 O ATOM 17 CB TYR A 33 97.485 83.034 4.629 1.00 15.08 C ATOM 18 CG TYR A 33 98.165 82.576 5.885 1.00 14.81 C ATOM 19 CD1 TYR A 33 99.418 81.962 5.849 1.00 12.43 C ATOM 20 CD2 TYR A 33 97.578 82.794 7.116 1.00 13.51 C ATOM 21 CE1 TYR A 33 100.052 81.572 7.015 1.00 11.33 C ATOM 22 CE2 TYR A 33 98.192 82.416 8.280 1.00 11.90 C ATOM 23 CZ TYR A 33 99.421 81.786 8.238 1.00 12.28 C ATOM 24 OH TYR A 33 100.003 81.403 9.418 1.00 12.10 O ATOM 25 HH TYR A 33 100.872 80.968 9.230 1.00 0.00 H ATOM 26 H TYR A 33 95.918 84.322 3.094 1.00 0.00 H ATOM 27 N PRO A 34 99.999 85.291 4.341 1.00 15.03 N ATOM 28 CA PRO A 34 101.257 85.579 3.640 1.00 16.49 C ATOM 29 C PRO A 34 101.996 84.307 3.284 1.00 18.64 C ATOM 30 O PRO A 34 102.012 83.338 4.053 1.00 17.37 O ATOM 31 CB PRO A 34 102.042 86.428 4.644 1.00 18.57 C ATOM 32 CG PRO A 34 101.516 86.051 5.953 1.00 17.99 C ATOM 33 CD PRO A 34 100.048 85.697 5.753 1.00 15.26 C ATOM 34 N THR A 35 102.613 84.325 2.112 1.00 17.25 N ATOM 35 CA THR A 35 103.377 83.199 1.595 1.00 16.22 C ATOM 36 C THR A 35 104.875 83.436 1.746 1.00 14.62 C ATOM 37 O THR A 35 105.350 84.545 1.995 1.00 15.61 O ATOM 38 CB THR A 35 103.042 82.948 0.128 1.00 20.61 C ATOM 39 OG1 THR A 35 103.530 84.036 -0.670 1.00 23.42 O ATOM 40 CG2 THR A 35 101.546 82.807 -0.067 1.00 26.87 C ATOM 41 HG1 THR A 35 103.311 83.870 -1.621 1.00 0.00 H ATOM 42 H THR A 35 102.548 85.186 1.533 1.00 0.00 H ATOM 43 N VAL A 36 105.624 82.348 1.560 1.00 15.23 N ATOM 44 CA VAL A 36 107.066 82.384 1.787 1.00 15.36 C ATOM 45 C VAL A 36 107.745 83.472 0.949 1.00 15.40 C ATOM 46 O VAL A 36 108.640 84.170 1.442 1.00 15.46 O ATOM 47 CB VAL A 36 107.685 80.985 1.567 1.00 14.23 C ATOM 48 CG1 VAL A 36 107.377 80.425 0.182 1.00 16.50 C ATOM 49 CG2 VAL A 36 109.185 81.036 1.823 1.00 15.73 C ATOM 50 H VAL A 36 105.175 81.463 1.249 1.00 0.00 H ATOM 51 N SER A 37 107.358 83.635 -0.318 1.00 14.43 N ATOM 52 CA SER A 37 108.063 84.601 -1.161 1.00 15.57 C ATOM 53 C SER A 37 107.759 86.046 -0.781 1.00 14.45 C ATOM 54 O SER A 37 108.450 86.956 -1.258 1.00 18.02 O ATOM 55 CB SER A 37 107.744 84.343 -2.626 1.00 17.90 C ATOM 56 OG SER A 37 106.411 84.700 -2.931 1.00 20.58 O ATOM 57 HG SER A 37 105.792 84.165 -2.374 1.00 0.00 H ATOM 58 H SER A 37 106.565 83.082 -0.701 1.00 0.00 H ATOM 59 N GLU A 38 106.763 86.273 0.065 1.00 14.20 N ATOM 60 CA GLU A 38 106.352 87.620 0.444 1.00 17.90 C ATOM 61 C GLU A 38 107.020 88.117 1.718 1.00 15.53 C ATOM 62 O GLU A 38 106.814 89.282 2.083 1.00 19.81 O ATOM 63 CB GLU A 38 104.827 87.657 0.616 1.00 17.70 C ATOM 64 CG GLU A 38 104.112 87.303 -0.683 1.00 19.15 C ATOM 65 CD GLU A 38 102.589 87.187 -0.600 1.00 25.62 C ATOM 66 OE1 GLU A 38 102.039 86.797 0.443 1.00 24.14 O ATOM 67 OE2 GLU A 38 101.942 87.451 -1.641 1.00 34.76 O ATOM 68 H GLU A 38 106.257 85.461 0.473 1.00 0.00 H ATOM 69 N ILE A 39 107.794 87.283 2.404 1.00 14.14 N ATOM 70 CA ILE A 39 108.379 87.648 3.692 1.00 14.50 C ATOM 71 C ILE A 39 109.896 87.505 3.614 1.00 13.16 C ATOM 72 O ILE A 39 110.413 86.378 3.664 1.00 12.69 O ATOM 73 CB ILE A 39 107.835 86.776 4.827 1.00 12.88 C ATOM 74 CG1 ILE A 39 106.302 86.763 4.835 1.00 13.38 C ATOM 75 CG2 ILE A 39 108.379 87.271 6.159 1.00 13.71 C ATOM 76 CD1 ILE A 39 105.732 85.806 5.875 1.00 13.93 C ATOM 77 H ILE A 39 107.990 86.340 2.011 1.00 0.00 H ATOM 78 N PRO A 40 110.650 88.596 3.527 1.00 14.49 N ATOM 79 CA PRO A 40 112.119 88.482 3.586 1.00 14.48 C ATOM 80 C PRO A 40 112.568 87.854 4.895 1.00 13.70 C ATOM 81 O PRO A 40 111.961 88.071 5.948 1.00 13.49 O ATOM 82 CB PRO A 40 112.586 89.933 3.509 1.00 16.84 C ATOM 83 CG PRO A 40 111.449 90.673 2.852 1.00 18.14 C ATOM 84 CD PRO A 40 110.209 89.987 3.347 1.00 17.16 C ATOM 85 N VAL A 41 113.652 87.070 4.832 1.00 14.73 N ATOM 86 CA VAL A 41 114.236 86.520 6.052 1.00 13.44 C ATOM 87 C VAL A 41 114.615 87.668 6.969 1.00 12.48 C ATOM 88 O VAL A 41 115.316 88.600 6.565 1.00 15.52 O ATOM 89 CB VAL A 41 115.441 85.620 5.729 1.00 14.16 C ATOM 90 CG1 VAL A 41 116.124 85.157 7.004 1.00 14.23 C ATOM 91 CG2 VAL A 41 114.983 84.406 4.930 1.00 14.07 C ATOM 92 H VAL A 41 114.080 86.852 3.910 1.00 0.00 H ATOM 93 N GLY A 42 114.134 87.610 8.212 1.00 12.77 N ATOM 94 CA GLY A 42 114.334 88.671 9.180 1.00 13.07 C ATOM 95 C GLY A 42 113.104 89.503 9.439 1.00 14.92 C ATOM 96 O GLY A 42 113.109 90.299 10.383 1.00 16.89 O ATOM 97 H GLY A 42 113.593 86.769 8.499 1.00 0.00 H ATOM 98 N GLU A 43 112.052 89.344 8.647 1.00 12.91 N ATOM 99 CA GLU A 43 110.786 90.032 8.861 1.00 14.05 C ATOM 100 C GLU A 43 109.741 89.041 9.353 1.00 12.17 C ATOM 101 O GLU A 43 109.831 87.841 9.114 1.00 12.73 O ATOM 102 CB GLU A 43 110.282 90.720 7.584 1.00 14.64 C ATOM 103 CG GLU A 43 111.202 91.837 7.137 1.00 16.33 C ATOM 104 CD GLU A 43 110.663 92.687 6.001 1.00 20.53 C ATOM 105 OE1 GLU A 43 109.461 92.604 5.677 1.00 23.31 O ATOM 106 OE2 GLU A 43 111.459 93.474 5.431 1.00 26.36 O ATOM 107 H GLU A 43 112.135 88.698 7.836 1.00 0.00 H ATOM 108 N VAL A 44 108.743 89.543 10.064 1.00 12.53 N ATOM 109 CA VAL A 44 107.684 88.708 10.615 1.00 12.52 C ATOM 110 C VAL A 44 106.344 89.363 10.317 1.00 12.41 C ATOM 111 O VAL A 44 106.175 90.564 10.523 1.00 15.63 O ATOM 112 CB VAL A 44 107.874 88.503 12.132 1.00 11.37 C ATOM 113 CG1 VAL A 44 106.706 87.727 12.711 1.00 13.93 C ATOM 114 CG2 VAL A 44 109.157 87.755 12.406 1.00 14.58 C ATOM 115 H VAL A 44 108.714 90.568 10.235 1.00 0.00 H ATOM 116 N ARG A 45 105.370 88.558 9.898 1.00 11.02 N ATOM 117 CA ARG A 45 104.003 89.013 9.693 1.00 10.94 C ATOM 118 C ARG A 45 103.109 88.444 10.784 1.00 11.69 C ATOM 119 O ARG A 45 103.356 87.346 11.295 1.00 11.45 O ATOM 120 CB ARG A 45 103.452 88.512 8.357 1.00 12.90 C ATOM 121 CG ARG A 45 104.275 88.898 7.143 1.00 15.70 C ATOM 122 CD ARG A 45 104.304 90.377 6.878 1.00 22.98 C ATOM 123 NE ARG A 45 105.015 90.587 5.614 1.00 23.28 N ATOM 124 CZ ARG A 45 106.211 91.147 5.473 1.00 25.15 C ATOM 125 NH1 ARG A 45 106.870 91.648 6.507 1.00 25.21 N ATOM 126 NH2 ARG A 45 106.739 91.225 4.261 1.00 25.24 N ATOM 127 HE ARG A 45 104.539 90.268 4.746 1.00 0.00 H ATOM 128 HH12 ARG A 45 107.805 92.081 6.367 1.00 0.00 H ATOM 129 HH11 ARG A 45 106.452 91.609 7.459 1.00 0.00 H ATOM 130 HH22 ARG A 45 107.674 91.660 4.128 1.00 0.00 H ATOM 131 HH21 ARG A 45 106.218 90.852 3.442 1.00 0.00 H ATOM 132 H ARG A 45 105.596 87.561 9.709 1.00 0.00 H ATOM 133 N LEU A 46 102.069 89.193 11.139 1.00 12.52 N ATOM 134 CA LEU A 46 101.016 88.692 12.009 1.00 11.74 C ATOM 135 C LEU A 46 99.750 88.553 11.182 1.00 13.36 C ATOM 136 O LEU A 46 99.460 89.394 10.319 1.00 16.01 O ATOM 137 CB LEU A 46 100.745 89.665 13.152 1.00 13.22 C ATOM 138 CG LEU A 46 101.975 90.051 13.969 1.00 13.84 C ATOM 139 CD1 LEU A 46 101.549 90.878 15.172 1.00 17.25 C ATOM 140 CD2 LEU A 46 102.763 88.835 14.424 1.00 14.14 C ATOM 141 H LEU A 46 102.006 90.168 10.783 1.00 0.00 H ATOM 142 N TYR A 47 98.987 87.509 11.462 1.00 12.33 N ATOM 143 CA TYR A 47 97.737 87.238 10.758 1.00 12.14 C ATOM 144 C TYR A 47 96.630 86.981 11.774 1.00 12.79 C ATOM 145 O TYR A 47 96.773 86.105 12.637 1.00 13.08 O ATOM 146 CB TYR A 47 97.909 86.025 9.834 1.00 13.21 C ATOM 147 CG TYR A 47 96.681 85.687 9.044 1.00 16.03 C ATOM 148 CD1 TYR A 47 96.456 86.256 7.806 1.00 16.70 C ATOM 149 CD2 TYR A 47 95.746 84.780 9.531 1.00 15.90 C ATOM 150 CE1 TYR A 47 95.324 85.954 7.068 1.00 17.44 C ATOM 151 CE2 TYR A 47 94.609 84.470 8.803 1.00 19.23 C ATOM 152 CZ TYR A 47 94.413 85.060 7.574 1.00 19.00 C ATOM 153 OH TYR A 47 93.291 84.757 6.824 1.00 25.00 O ATOM 154 HH TYR A 47 93.280 83.787 6.625 1.00 0.00 H ATOM 155 H TYR A 47 99.289 86.856 12.213 1.00 0.00 H ATOM 156 N GLN A 48 95.538 87.731 11.684 1.00 13.86 N ATOM 157 CA GLN A 48 94.430 87.576 12.619 1.00 13.23 C ATOM 158 C GLN A 48 93.611 86.342 12.249 1.00 13.47 C ATOM 159 O GLN A 48 93.020 86.278 11.167 1.00 16.41 O ATOM 160 CB GLN A 48 93.563 88.831 12.593 1.00 15.29 C ATOM 161 CG GLN A 48 92.501 88.850 13.680 1.00 23.79 C ATOM 162 CD GLN A 48 92.997 89.443 14.984 1.00 29.77 C ATOM 163 OE1 GLN A 48 93.240 88.732 15.966 1.00 26.32 O ATOM 164 NE2 GLN A 48 93.151 90.761 15.000 1.00 31.50 N ATOM 165 HE22 GLN A 48 92.934 91.320 14.150 1.00 0.00 H ATOM 166 HE21 GLN A 48 93.488 91.235 15.862 1.00 0.00 H ATOM 167 H GLN A 48 95.472 88.444 10.930 1.00 0.00 H ATOM 168 N ILE A 49 93.564 85.363 13.148 1.00 13.83 N ATOM 169 CA ILE A 49 92.741 84.174 12.925 1.00 12.00 C ATOM 170 C ILE A 49 91.343 84.355 13.486 1.00 14.82 C ATOM 171 O ILE A 49 90.358 83.974 12.848 1.00 20.50 O ATOM 172 CB ILE A 49 93.429 82.948 13.547 1.00 13.38 C ATOM 173 CG1 ILE A 49 94.766 82.683 12.871 1.00 14.25 C ATOM 174 CG2 ILE A 49 92.518 81.708 13.459 1.00 16.26 C ATOM 175 CD1 ILE A 49 95.645 81.750 13.646 1.00 14.81 C ATOM 176 H ILE A 49 94.121 85.444 14.023 1.00 0.00 H ATOM 177 N ALA A 50 91.253 84.916 14.688 1.00 14.89 N ATOM 178 CA ALA A 50 89.995 85.099 15.394 1.00 14.63 C ATOM 179 C ALA A 50 90.263 86.189 16.421 1.00 15.54 C ATOM 180 O ALA A 50 91.395 86.626 16.593 1.00 15.36 O ATOM 181 CB ALA A 50 89.550 83.804 16.085 1.00 17.87 C ATOM 182 H ALA A 50 92.128 85.241 15.147 1.00 0.00 H ATOM 183 N ASP A 51 89.214 86.637 17.098 1.00 16.21 N ATOM 184 CA ASP A 51 89.411 87.667 18.112 1.00 17.20 C ATOM 185 C ASP A 51 90.412 87.176 19.149 1.00 16.42 C ATOM 186 O ASP A 51 90.247 86.101 19.725 1.00 16.07 O ATOM 187 CB ASP A 51 88.084 88.023 18.779 1.00 18.48 C ATOM 188 CG ASP A 51 87.145 88.840 17.880 1.00 20.57 C ATOM 189 OD1 ASP A 51 87.587 89.444 16.884 1.00 23.56 O ATOM 190 OD2 ASP A 51 85.946 88.873 18.218 1.00 28.04 O ATOM 191 H ASP A 51 88.264 86.259 16.908 1.00 0.00 H ATOM 192 N GLY A 52 91.472 87.952 19.363 1.00 13.82 N ATOM 193 CA GLY A 52 92.461 87.597 20.355 1.00 12.45 C ATOM 194 C GLY A 52 93.368 86.443 19.993 1.00 10.62 C ATOM 195 O GLY A 52 94.067 85.931 20.872 1.00 12.37 O ATOM 196 H GLY A 52 91.590 88.825 18.809 1.00 0.00 H ATOM 197 N VAL A 53 93.382 86.018 18.728 1.00 11.95 N ATOM 198 CA VAL A 53 94.243 84.927 18.271 1.00 11.63 C ATOM 199 C VAL A 53 94.870 85.316 16.945 1.00 11.78 C ATOM 200 O VAL A 53 94.155 85.609 15.970 1.00 12.32 O ATOM 201 CB VAL A 53 93.478 83.601 18.096 1.00 11.35 C ATOM 202 CG1 VAL A 53 94.466 82.494 17.723 1.00 12.13 C ATOM 203 CG2 VAL A 53 92.703 83.252 19.351 1.00 14.76 C ATOM 204 H VAL A 53 92.755 86.481 18.039 1.00 0.00 H ATOM 205 N TRP A 54 96.189 85.253 16.894 1.00 10.26 N ATOM 206 CA TRP A 54 96.950 85.515 15.684 1.00 10.52 C ATOM 207 C TRP A 54 97.895 84.356 15.421 1.00 11.53 C ATOM 208 O TRP A 54 98.334 83.666 16.348 1.00 11.27 O ATOM 209 CB TRP A 54 97.837 86.760 15.832 1.00 11.33 C ATOM 210 CG TRP A 54 97.136 88.049 16.174 1.00 11.22 C ATOM 211 CD1 TRP A 54 96.874 89.069 15.323 1.00 13.99 C ATOM 212 CD2 TRP A 54 96.658 88.479 17.469 1.00 12.21 C ATOM 213 NE1 TRP A 54 96.262 90.111 15.988 1.00 15.99 N ATOM 214 CE2 TRP A 54 96.116 89.766 17.304 1.00 13.89 C ATOM 215 CE3 TRP A 54 96.649 87.907 18.739 1.00 12.01 C ATOM 216 CZ2 TRP A 54 95.547 90.483 18.363 1.00 15.32 C ATOM 217 CZ3 TRP A 54 96.091 88.617 19.784 1.00 12.91 C ATOM 218 CH2 TRP A 54 95.550 89.893 19.590 1.00 15.44 C ATOM 219 HE1 TRP A 54 95.961 91.010 15.560 1.00 0.00 H ATOM 220 H TRP A 54 96.707 85.004 17.761 1.00 0.00 H ATOM 221 N SER A 55 98.261 84.169 14.163 1.00 10.09 N ATOM 222 CA SER A 55 99.480 83.439 13.863 1.00 9.91 C ATOM 223 C SER A 55 100.584 84.442 13.566 1.00 9.55 C ATOM 224 O SER A 55 100.327 85.599 13.206 1.00 10.91 O ATOM 225 CB SER A 55 99.325 82.448 12.710 1.00 12.18 C ATOM 226 OG SER A 55 99.028 83.121 11.512 1.00 12.57 O ATOM 227 HG SER A 55 98.932 82.462 10.780 1.00 0.00 H ATOM 228 H SER A 55 97.676 84.545 13.390 1.00 0.00 H ATOM 229 N HIS A 56 101.821 84.009 13.786 1.00 10.02 N ATOM 230 CA HIS A 56 102.988 84.748 13.336 1.00 9.28 C ATOM 231 C HIS A 56 103.670 83.919 12.269 1.00 9.35 C ATOM 232 O HIS A 56 103.726 82.694 12.374 1.00 9.86 O ATOM 233 CB HIS A 56 103.919 85.178 14.499 1.00 9.71 C ATOM 234 CG HIS A 56 104.520 84.079 15.320 1.00 8.90 C ATOM 235 ND1 HIS A 56 105.650 83.390 14.926 1.00 10.02 N ATOM 236 CD2 HIS A 56 104.212 83.628 16.559 1.00 9.41 C ATOM 237 CE1 HIS A 56 106.001 82.554 15.886 1.00 10.58 C ATOM 238 NE2 HIS A 56 105.150 82.683 16.891 1.00 9.77 N ATOM 239 H HIS A 56 101.958 83.113 14.296 1.00 0.00 H ATOM 240 N ILE A 57 104.142 84.588 11.223 1.00 9.48 N ATOM 241 CA ILE A 57 104.755 83.936 10.075 1.00 9.85 C ATOM 242 C ILE A 57 106.123 84.547 9.835 1.00 10.08 C ATOM 243 O ILE A 57 106.256 85.770 9.708 1.00 11.20 O ATOM 244 CB ILE A 57 103.892 84.049 8.808 1.00 10.68 C ATOM 245 CG1 ILE A 57 102.421 83.685 9.097 1.00 11.49 C ATOM 246 CG2 ILE A 57 104.489 83.132 7.742 1.00 12.17 C ATOM 247 CD1 ILE A 57 101.522 84.855 9.477 1.00 14.59 C ATOM 248 H ILE A 57 104.070 85.626 11.224 1.00 0.00 H ATOM 249 N ALA A 58 107.131 83.688 9.753 1.00 9.10 N ATOM 250 CA ALA A 58 108.506 84.089 9.492 1.00 10.01 C ATOM 251 C ALA A 58 109.097 83.156 8.458 1.00 10.19 C ATOM 252 O ALA A 58 108.473 82.181 8.047 1.00 10.75 O ATOM 253 CB ALA A 58 109.330 84.036 10.785 1.00 11.56 C ATOM 254 H ALA A 58 106.928 82.676 9.882 1.00 0.00 H ATOM 255 N THR A 59 110.322 83.445 8.045 1.00 10.81 N ATOM 256 CA THR A 59 110.999 82.672 7.013 1.00 9.43 C ATOM 257 C THR A 59 112.447 82.464 7.425 1.00 11.24 C ATOM 258 O THR A 59 113.035 83.283 8.150 1.00 11.46 O ATOM 259 CB THR A 59 110.914 83.365 5.646 1.00 11.44 C ATOM 260 OG1 THR A 59 111.372 84.721 5.746 1.00 11.75 O ATOM 261 CG2 THR A 59 109.494 83.362 5.086 1.00 13.06 C ATOM 262 HG1 THR A 59 111.312 85.155 4.858 1.00 0.00 H ATOM 263 H THR A 59 110.818 84.253 8.473 1.00 0.00 H ATOM 264 N GLN A 60 113.035 81.382 6.933 1.00 10.38 N ATOM 265 CA GLN A 60 114.402 81.082 7.310 1.00 10.27 C ATOM 266 C GLN A 60 115.079 80.262 6.229 1.00 11.37 C ATOM 267 O GLN A 60 114.433 79.473 5.535 1.00 12.67 O ATOM 268 CB GLN A 60 114.429 80.308 8.640 1.00 11.52 C ATOM 269 CG GLN A 60 115.795 80.181 9.279 1.00 11.52 C ATOM 270 CD GLN A 60 116.486 81.514 9.367 1.00 11.90 C ATOM 271 OE1 GLN A 60 117.269 81.874 8.495 1.00 13.10 O ATOM 272 NE2 GLN A 60 116.147 82.282 10.390 1.00 13.13 N ATOM 273 HE22 GLN A 60 115.478 81.931 11.105 1.00 0.00 H ATOM 274 HE21 GLN A 60 116.550 83.237 10.479 1.00 0.00 H ATOM 275 H GLN A 60 112.520 80.755 6.283 1.00 0.00 H ATOM 276 N SER A 61 116.386 80.453 6.100 1.00 12.29 N ATOM 277 CA SER A 61 117.233 79.607 5.266 1.00 13.39 C ATOM 278 C SER A 61 117.346 78.216 5.879 1.00 17.73 C ATOM 279 O SER A 61 117.716 78.068 7.052 1.00 18.55 O ATOM 280 CB SER A 61 118.620 80.231 5.155 1.00 18.11 C ATOM 281 OG SER A 61 118.546 81.486 4.513 1.00 23.76 O ATOM 282 HG SER A 61 119.453 81.877 4.449 1.00 0.00 H ATOM 283 H SER A 61 116.826 81.241 6.617 1.00 0.00 H ATOM 284 N PHE A 62 117.049 77.195 5.075 1.00 16.49 N ATOM 285 CA PHE A 62 116.948 75.819 5.538 1.00 17.70 C ATOM 286 C PHE A 62 117.039 74.902 4.326 1.00 20.80 C ATOM 287 O PHE A 62 116.309 75.084 3.346 1.00 20.13 O ATOM 288 CB PHE A 62 115.621 75.609 6.286 1.00 20.33 C ATOM 289 CG PHE A 62 115.377 74.186 6.707 1.00 22.08 C ATOM 290 CD1 PHE A 62 116.210 73.568 7.627 1.00 27.23 C ATOM 291 CD2 PHE A 62 114.310 73.474 6.186 1.00 21.53 C ATOM 292 CE1 PHE A 62 115.985 72.249 8.011 1.00 26.09 C ATOM 293 CE2 PHE A 62 114.077 72.155 6.567 1.00 24.98 C ATOM 294 CZ PHE A 62 114.916 71.546 7.478 1.00 29.88 C ATOM 295 H PHE A 62 116.881 77.391 4.068 1.00 0.00 H ATOM 296 N ASP A 63 117.921 73.914 4.401 1.00 20.94 N ATOM 297 CA ASP A 63 118.006 72.889 3.366 1.00 22.49 C ATOM 298 C ASP A 63 118.206 73.499 1.972 1.00 22.19 C ATOM 299 O ASP A 63 117.647 73.014 0.988 1.00 27.45 O ATOM 300 CB ASP A 63 116.754 72.001 3.406 1.00 30.09 C ATOM 301 CG ASP A 63 117.001 70.603 2.860 1.00 41.21 C ATOM 302 OD1 ASP A 63 116.011 69.915 2.523 1.00 47.24 O ATOM 303 OD2 ASP A 63 118.176 70.195 2.771 1.00 38.34 O ATOM 304 H ASP A 63 118.566 73.869 5.215 1.00 0.00 H ATOM 305 N GLY A 64 119.043 74.542 1.873 1.00 21.60 N ATOM 306 CA GLY A 64 119.359 75.166 0.588 1.00 19.51 C ATOM 307 C GLY A 64 118.286 76.086 0.037 1.00 18.34 C ATOM 308 O GLY A 64 118.426 76.578 -1.093 1.00 19.29 O ATOM 309 H GLY A 64 119.481 74.919 2.737 1.00 0.00 H ATOM 310 N ALA A 65 117.220 76.306 0.788 1.00 17.53 N ATOM 311 CA ALA A 65 116.091 77.105 0.348 1.00 16.10 C ATOM 312 C ALA A 65 115.678 78.058 1.455 1.00 15.27 C ATOM 313 O ALA A 65 116.338 78.126 2.500 1.00 18.84 O ATOM 314 CB ALA A 65 114.928 76.189 -0.035 1.00 18.13 C ATOM 315 H ALA A 65 117.189 75.887 1.739 1.00 0.00 H ATOM 316 N VAL A 66 114.586 78.783 1.254 1.00 13.89 N ATOM 317 CA VAL A 66 113.936 79.564 2.298 1.00 12.42 C ATOM 318 C VAL A 66 112.561 78.962 2.529 1.00 11.52 C ATOM 319 O VAL A 66 111.796 78.772 1.580 1.00 13.23 O ATOM 320 CB VAL A 66 113.841 81.062 1.938 1.00 12.21 C ATOM 321 CG1 VAL A 66 112.988 81.804 2.944 1.00 12.89 C ATOM 322 CG2 VAL A 66 115.234 81.683 1.849 1.00 16.10 C ATOM 323 H VAL A 66 114.172 78.795 0.300 1.00 0.00 H ATOM 324 N TYR A 67 112.239 78.681 3.782 1.00 11.71 N ATOM 325 CA TYR A 67 110.967 78.085 4.153 1.00 12.37 C ATOM 326 C TYR A 67 110.201 79.019 5.075 1.00 11.43 C ATOM 327 O TYR A 67 110.808 79.725 5.888 1.00 12.05 O ATOM 328 CB TYR A 67 111.172 76.762 4.904 1.00 13.33 C ATOM 329 CG TYR A 67 111.493 75.591 4.019 1.00 15.41 C ATOM 330 CD1 TYR A 67 112.787 75.334 3.621 1.00 18.70 C ATOM 331 CD2 TYR A 67 110.484 74.749 3.569 1.00 17.59 C ATOM 332 CE1 TYR A 67 113.079 74.255 2.816 1.00 20.68 C ATOM 333 CE2 TYR A 67 110.749 73.675 2.757 1.00 22.64 C ATOM 334 CZ TYR A 67 112.043 73.436 2.372 1.00 19.49 C ATOM 335 OH TYR A 67 112.311 72.348 1.561 1.00 27.44 O ATOM 336 HH TYR A 67 111.811 72.440 0.711 1.00 0.00 H ATOM 337 H TYR A 67 112.926 78.896 4.533 1.00 0.00 H ATOM 338 N PRO A 68 108.871 78.983 5.029 1.00 10.58 N ATOM 339 CA PRO A 68 108.058 79.718 5.995 1.00 10.84 C ATOM 340 C PRO A 68 107.819 78.874 7.236 1.00 11.46 C ATOM 341 O PRO A 68 107.957 77.649 7.222 1.00 12.40 O ATOM 342 CB PRO A 68 106.750 79.896 5.226 1.00 11.54 C ATOM 343 CG PRO A 68 106.617 78.598 4.460 1.00 13.05 C ATOM 344 CD PRO A 68 108.039 78.222 4.081 1.00 12.23 C ATOM 345 N SER A 69 107.412 79.553 8.306 1.00 9.95 N ATOM 346 CA SER A 69 107.118 78.882 9.557 1.00 9.86 C ATOM 347 C SER A 69 106.117 79.709 10.349 1.00 9.68 C ATOM 348 O SER A 69 106.201 80.940 10.364 1.00 10.07 O ATOM 349 CB SER A 69 108.417 78.685 10.333 1.00 11.09 C ATOM 350 OG SER A 69 108.203 77.880 11.468 1.00 12.54 O ATOM 351 HG SER A 69 107.540 78.316 12.060 1.00 0.00 H ATOM 352 H SER A 69 107.303 80.585 8.243 1.00 0.00 H ATOM 353 N ASN A 70 105.185 79.016 11.006 1.00 10.02 N ATOM 354 CA ASN A 70 104.121 79.624 11.797 1.00 10.01 C ATOM 355 C ASN A 70 104.314 79.389 13.287 1.00 9.95 C ATOM 356 O ASN A 70 104.751 78.315 13.701 1.00 10.60 O ATOM 357 CB ASN A 70 102.757 79.005 11.459 1.00 10.43 C ATOM 358 CG ASN A 70 102.361 79.166 10.029 1.00 11.36 C ATOM 359 OD1 ASN A 70 102.517 80.248 9.445 1.00 12.24 O ATOM 360 ND2 ASN A 70 101.809 78.105 9.464 1.00 13.39 N ATOM 361 HD22 ASN A 70 101.705 77.223 10.005 1.00 0.00 H ATOM 362 HD21 ASN A 70 101.479 78.153 8.479 1.00 0.00 H ATOM 363 H ASN A 70 105.219 77.978 10.951 1.00 0.00 H ATOM 364 N GLY A 71 103.849 80.352 14.069 1.00 9.32 N ATOM 365 CA GLY A 71 103.546 80.176 15.480 1.00 10.07 C ATOM 366 C GLY A 71 102.219 80.828 15.805 1.00 10.05 C ATOM 367 O GLY A 71 101.496 81.251 14.897 1.00 10.09 O ATOM 368 H GLY A 71 103.691 81.290 13.648 1.00 0.00 H ATOM 369 N LEU A 72 101.900 80.944 17.088 1.00 9.52 N ATOM 370 CA LEU A 72 100.613 81.475 17.528 1.00 8.87 C ATOM 371 C LEU A 72 100.821 82.546 18.589 1.00 9.70 C ATOM 372 O LEU A 72 101.803 82.523 19.335 1.00 10.11 O ATOM 373 CB LEU A 72 99.714 80.377 18.097 1.00 11.39 C ATOM 374 CG LEU A 72 98.202 80.562 17.962 1.00 12.04 C ATOM 375 CD1 LEU A 72 97.753 80.414 16.510 1.00 12.90 C ATOM 376 CD2 LEU A 72 97.460 79.534 18.837 1.00 13.86 C ATOM 377 H LEU A 72 102.591 80.646 17.806 1.00 0.00 H ATOM 378 N ILE A 73 99.869 83.473 18.670 1.00 9.60 N ATOM 379 CA ILE A 73 99.795 84.478 19.731 1.00 9.81 C ATOM 380 C ILE A 73 98.366 84.459 20.236 1.00 10.40 C ATOM 381 O ILE A 73 97.425 84.546 19.442 1.00 10.62 O ATOM 382 CB ILE A 73 100.121 85.889 19.219 1.00 10.01 C ATOM 383 CG1 ILE A 73 101.495 85.911 18.547 1.00 11.75 C ATOM 384 CG2 ILE A 73 100.036 86.902 20.366 1.00 12.22 C ATOM 385 CD1 ILE A 73 101.675 87.104 17.600 1.00 13.15 C ATOM 386 H ILE A 73 99.133 83.484 17.935 1.00 0.00 H ATOM 387 N VAL A 74 98.191 84.367 21.551 1.00 9.58 N ATOM 388 CA VAL A 74 96.858 84.319 22.144 1.00 11.16 C ATOM 389 C VAL A 74 96.770 85.374 23.242 1.00 9.88 C ATOM 390 O VAL A 74 97.621 85.417 24.133 1.00 10.55 O ATOM 391 CB VAL A 74 96.543 82.921 22.720 1.00 10.32 C ATOM 392 CG1 VAL A 74 95.113 82.862 23.237 1.00 12.75 C ATOM 393 CG2 VAL A 74 96.790 81.841 21.681 1.00 11.87 C ATOM 394 H VAL A 74 99.024 84.328 22.172 1.00 0.00 H ATOM 395 N ARG A 75 95.722 86.199 23.210 1.00 10.49 N ATOM 396 CA ARG A 75 95.511 87.134 24.307 1.00 10.76 C ATOM 397 C ARG A 75 95.271 86.367 25.595 1.00 11.10 C ATOM 398 O ARG A 75 94.459 85.439 25.643 1.00 12.50 O ATOM 399 CB ARG A 75 94.336 88.071 24.014 1.00 11.35 C ATOM 400 CG ARG A 75 94.188 89.187 25.024 1.00 11.59 C ATOM 401 CD ARG A 75 92.956 90.042 24.772 1.00 12.25 C ATOM 402 NE ARG A 75 91.683 89.358 24.973 1.00 12.17 N ATOM 403 CZ ARG A 75 91.053 89.254 26.136 1.00 13.25 C ATOM 404 NH1 ARG A 75 91.589 89.752 27.237 1.00 14.96 N ATOM 405 NH2 ARG A 75 89.871 88.650 26.203 1.00 15.69 N ATOM 406 HE ARG A 75 91.236 88.919 24.143 1.00 0.00 H ATOM 407 HH12 ARG A 75 91.088 89.666 28.144 1.00 0.00 H ATOM 408 HH11 ARG A 75 92.512 90.230 27.196 1.00 0.00 H ATOM 409 HH22 ARG A 75 89.379 88.570 27.116 1.00 0.00 H ATOM 410 HH21 ARG A 75 89.438 88.258 25.343 1.00 0.00 H ATOM 411 H ARG A 75 95.061 86.175 22.408 1.00 0.00 H ATOM 412 N ASP A 76 95.984 86.782 26.637 1.00 10.66 N ATOM 413 CA ASP A 76 95.920 86.172 27.966 1.00 11.21 C ATOM 414 C ASP A 76 95.586 87.281 28.953 1.00 11.50 C ATOM 415 O ASP A 76 96.462 87.823 29.632 1.00 11.68 O ATOM 416 CB ASP A 76 97.272 85.519 28.254 1.00 10.93 C ATOM 417 CG ASP A 76 97.329 84.850 29.597 1.00 14.15 C ATOM 418 OD1 ASP A 76 96.269 84.601 30.209 1.00 14.40 O ATOM 419 OD2 ASP A 76 98.481 84.569 30.038 1.00 16.72 O ATOM 420 H ASP A 76 96.626 87.589 26.500 1.00 0.00 H ATOM 421 N GLY A 77 94.313 87.664 28.992 1.00 12.68 N ATOM 422 CA GLY A 77 93.927 88.799 29.800 1.00 11.77 C ATOM 423 C GLY A 77 94.509 90.096 29.272 1.00 13.35 C ATOM 424 O GLY A 77 94.211 90.497 28.140 1.00 12.76 O ATOM 425 H GLY A 77 93.597 87.148 28.442 1.00 0.00 H ATOM 426 N ASP A 78 95.346 90.744 30.079 1.00 12.35 N ATOM 427 CA ASP A 78 96.043 91.964 29.698 1.00 13.85 C ATOM 428 C ASP A 78 97.436 91.680 29.140 1.00 13.12 C ATOM 429 O ASP A 78 98.189 92.625 28.863 1.00 14.99 O ATOM 430 CB ASP A 78 96.129 92.940 30.869 1.00 15.06 C ATOM 431 CG ASP A 78 96.813 92.364 32.101 1.00 16.09 C ATOM 432 OD1 ASP A 78 96.791 91.139 32.299 1.00 19.22 O ATOM 433 OD2 ASP A 78 97.317 93.187 32.908 1.00 23.01 O ATOM 434 H ASP A 78 95.511 90.359 31.031 1.00 0.00 H ATOM 435 N GLU A 79 97.778 90.416 28.946 1.00 11.49 N ATOM 436 CA GLU A 79 99.082 89.969 28.487 1.00 12.19 C ATOM 437 C GLU A 79 98.897 89.093 27.255 1.00 11.52 C ATOM 438 O GLU A 79 97.780 88.811 26.835 1.00 11.72 O ATOM 439 CB GLU A 79 99.811 89.188 29.589 1.00 13.68 C ATOM 440 CG GLU A 79 99.949 89.975 30.886 1.00 14.13 C ATOM 441 CD GLU A 79 100.583 89.215 32.037 1.00 18.86 C ATOM 442 OE1 GLU A 79 100.795 87.987 31.935 1.00 17.67 O ATOM 443 OE2 GLU A 79 100.838 89.888 33.070 1.00 23.83 O ATOM 444 H GLU A 79 97.060 89.689 29.136 1.00 0.00 H ATOM 445 N LEU A 80 100.002 88.667 26.659 1.00 11.30 N ATOM 446 CA LEU A 80 99.979 87.752 25.524 1.00 10.48 C ATOM 447 C LEU A 80 100.768 86.495 25.846 1.00 9.47 C ATOM 448 O LEU A 80 101.842 86.559 26.471 1.00 10.73 O ATOM 449 CB LEU A 80 100.584 88.379 24.257 1.00 10.79 C ATOM 450 CG LEU A 80 99.918 89.681 23.802 1.00 10.85 C ATOM 451 CD1 LEU A 80 100.732 90.270 22.654 1.00 11.75 C ATOM 452 CD2 LEU A 80 98.451 89.455 23.433 1.00 11.97 C ATOM 453 H LEU A 80 100.921 88.998 27.015 1.00 0.00 H ATOM 454 N LEU A 81 100.222 85.368 25.399 1.00 9.59 N ATOM 455 CA LEU A 81 100.897 84.082 25.403 1.00 9.11 C ATOM 456 C LEU A 81 101.387 83.806 23.997 1.00 10.09 C ATOM 457 O LEU A 81 100.609 83.869 23.038 1.00 11.04 O ATOM 458 CB LEU A 81 99.935 82.983 25.841 1.00 10.54 C ATOM 459 CG LEU A 81 100.434 81.553 25.719 1.00 9.71 C ATOM 460 CD1 LEU A 81 101.609 81.295 26.624 1.00 11.43 C ATOM 461 CD2 LEU A 81 99.300 80.581 26.004 1.00 11.70 C ATOM 462 H LEU A 81 99.253 85.410 25.024 1.00 0.00 H ATOM 463 N LEU A 82 102.661 83.476 23.877 1.00 9.40 N ATOM 464 CA LEU A 82 103.272 83.139 22.599 1.00 8.49 C ATOM 465 C LEU A 82 103.433 81.626 22.490 1.00 8.36 C ATOM 466 O LEU A 82 103.896 80.974 23.430 1.00 9.91 O ATOM 467 CB LEU A 82 104.639 83.809 22.510 1.00 10.40 C ATOM 468 CG LEU A 82 105.430 83.583 21.239 1.00 10.81 C ATOM 469 CD1 LEU A 82 104.775 84.200 20.023 1.00 12.25 C ATOM 470 CD2 LEU A 82 106.815 84.148 21.408 1.00 11.87 C ATOM 471 H LEU A 82 103.253 83.456 24.732 1.00 0.00 H ATOM 472 N ILE A 83 103.070 81.073 21.341 1.00 8.55 N ATOM 473 CA ILE A 83 103.338 79.677 21.022 1.00 9.92 C ATOM 474 C ILE A 83 104.389 79.667 19.920 1.00 9.38 C ATOM 475 O ILE A 83 104.114 80.078 18.786 1.00 10.00 O ATOM 476 CB ILE A 83 102.090 78.897 20.575 1.00 9.36 C ATOM 477 CG1 ILE A 83 100.924 79.083 21.553 1.00 9.96 C ATOM 478 CG2 ILE A 83 102.445 77.443 20.413 1.00 12.44 C ATOM 479 CD1 ILE A 83 101.151 78.661 23.005 1.00 10.97 C ATOM 480 H ILE A 83 102.574 81.659 20.639 1.00 0.00 H ATOM 481 N ASP A 84 105.575 79.160 20.266 1.00 9.26 N ATOM 482 CA ASP A 84 106.734 78.988 19.392 1.00 9.25 C ATOM 483 C ASP A 84 107.439 80.292 19.035 1.00 9.19 C ATOM 484 O ASP A 84 106.827 81.357 18.928 1.00 9.25 O ATOM 485 CB ASP A 84 106.370 78.133 18.178 1.00 9.88 C ATOM 486 CG ASP A 84 106.087 76.717 18.581 1.00 10.88 C ATOM 487 OD1 ASP A 84 106.764 76.224 19.507 1.00 10.77 O ATOM 488 OD2 ASP A 84 105.191 76.052 18.007 1.00 11.19 O ATOM 489 H ASP A 84 105.685 78.858 21.255 1.00 0.00 H ATOM 490 N THR A 85 108.754 80.194 18.856 1.00 9.49 N ATOM 491 CA THR A 85 109.526 81.327 18.386 1.00 9.47 C ATOM 492 C THR A 85 109.319 81.502 16.889 1.00 10.07 C ATOM 493 O THR A 85 108.602 80.744 16.233 1.00 9.65 O ATOM 494 CB THR A 85 111.002 81.103 18.645 1.00 9.46 C ATOM 495 OG1 THR A 85 111.431 80.009 17.821 1.00 10.49 O ATOM 496 CG2 THR A 85 111.301 80.808 20.125 1.00 11.15 C ATOM 497 HG1 THR A 85 112.395 79.842 17.972 1.00 0.00 H ATOM 498 H THR A 85 109.234 79.293 19.056 1.00 0.00 H ATOM 499 N ALA A 86 109.985 82.511 16.327 1.00 10.08 N ATOM 500 CA ALA A 86 109.917 82.793 14.898 1.00 8.96 C ATOM 501 C ALA A 86 111.144 82.265 14.157 1.00 9.81 C ATOM 502 O ALA A 86 111.535 82.814 13.115 1.00 11.30 O ATOM 503 CB ALA A 86 109.704 84.290 14.658 1.00 10.67 C ATOM 504 H ALA A 86 110.575 83.119 16.930 1.00 0.00 H ATOM 505 N TRP A 87 111.760 81.191 14.669 1.00 9.36 N ATOM 506 CA TRP A 87 112.851 80.486 14.002 1.00 10.55 C ATOM 507 C TRP A 87 114.101 81.346 13.967 1.00 10.33 C ATOM 508 O TRP A 87 114.581 81.762 12.903 1.00 13.76 O ATOM 509 CB TRP A 87 112.446 79.991 12.618 1.00 10.09 C ATOM 510 CG TRP A 87 113.326 78.934 12.031 1.00 9.30 C ATOM 511 CD1 TRP A 87 114.527 78.469 12.488 1.00 9.89 C ATOM 512 CD2 TRP A 87 113.052 78.199 10.840 1.00 10.57 C ATOM 513 NE1 TRP A 87 115.026 77.485 11.653 1.00 11.78 N ATOM 514 CE2 TRP A 87 114.121 77.308 10.636 1.00 10.46 C ATOM 515 CE3 TRP A 87 111.990 78.211 9.936 1.00 11.36 C ATOM 516 CZ2 TRP A 87 114.170 76.451 9.537 1.00 12.60 C ATOM 517 CZ3 TRP A 87 112.036 77.359 8.852 1.00 11.99 C ATOM 518 CH2 TRP A 87 113.112 76.488 8.670 1.00 13.61 C ATOM 519 HE1 TRP A 87 115.923 76.973 11.774 1.00 0.00 H ATOM 520 H TRP A 87 111.443 80.839 15.595 1.00 0.00 H ATOM 521 N GLY A 88 114.648 81.564 15.146 1.00 11.04 N ATOM 522 CA GLY A 88 115.931 82.201 15.332 1.00 12.31 C ATOM 523 C GLY A 88 115.855 83.517 16.066 1.00 11.58 C ATOM 524 O GLY A 88 114.812 84.150 16.146 1.00 10.97 O ATOM 525 H GLY A 88 114.125 81.260 15.992 1.00 0.00 H ATOM 526 N ALA A 89 117.000 83.936 16.589 1.00 11.81 N ATOM 527 CA ALA A 89 117.081 85.150 17.397 1.00 11.36 C ATOM 528 C ALA A 89 116.642 86.395 16.621 1.00 10.78 C ATOM 529 O ALA A 89 115.868 87.209 17.126 1.00 11.25 O ATOM 530 CB ALA A 89 118.512 85.315 17.899 1.00 13.68 C ATOM 531 H ALA A 89 117.865 83.384 16.419 1.00 0.00 H ATOM 532 N LYS A 90 117.171 86.598 15.411 1.00 11.50 N ATOM 533 CA LYS A 90 116.856 87.819 14.671 1.00 12.67 C ATOM 534 C LYS A 90 115.369 87.883 14.341 1.00 11.44 C ATOM 535 O LYS A 90 114.703 88.914 14.530 1.00 11.53 O ATOM 536 CB LYS A 90 117.691 87.869 13.394 1.00 15.32 C ATOM 537 CG LYS A 90 117.539 89.165 12.625 1.00 24.01 C ATOM 538 CD LYS A 90 118.462 89.210 11.402 1.00 22.02 C ATOM 539 CE LYS A 90 118.335 90.529 10.659 1.00 27.20 C ATOM 540 NZ LYS A 90 118.932 91.660 11.421 1.00 28.95 N ATOM 541 HZ1 LYS A 90 118.447 91.755 12.336 1.00 0.00 H ATOM 542 HZ2 LYS A 90 119.943 91.473 11.581 1.00 0.00 H ATOM 543 HZ3 LYS A 90 118.823 92.539 10.877 1.00 0.00 H ATOM 544 H LYS A 90 117.807 85.888 14.996 1.00 0.00 H ATOM 545 N ASN A 91 114.810 86.775 13.871 1.00 10.25 N ATOM 546 CA ASN A 91 113.388 86.750 13.565 1.00 9.91 C ATOM 547 C ASN A 91 112.556 86.939 14.814 1.00 9.51 C ATOM 548 O ASN A 91 111.511 87.603 14.776 1.00 10.14 O ATOM 549 CB ASN A 91 112.985 85.426 12.933 1.00 10.73 C ATOM 550 CG ASN A 91 113.419 85.277 11.496 1.00 11.06 C ATOM 551 OD1 ASN A 91 113.990 86.177 10.868 1.00 12.26 O ATOM 552 ND2 ASN A 91 113.132 84.103 10.938 1.00 12.57 N ATOM 553 HD22 ASN A 91 112.651 83.367 11.493 1.00 0.00 H ATOM 554 HD21 ASN A 91 113.389 83.922 9.947 1.00 0.00 H ATOM 555 H ASN A 91 115.389 85.924 13.721 1.00 0.00 H ATOM 556 N THR A 92 112.976 86.347 15.930 1.00 9.51 N ATOM 557 CA THR A 92 112.181 86.469 17.143 1.00 9.72 C ATOM 558 C THR A 92 112.217 87.903 17.685 1.00 9.57 C ATOM 559 O THR A 92 111.206 88.397 18.209 1.00 9.63 O ATOM 560 CB THR A 92 112.639 85.412 18.158 1.00 9.71 C ATOM 561 OG1 THR A 92 112.402 84.113 17.596 1.00 10.93 O ATOM 562 CG2 THR A 92 111.903 85.531 19.465 1.00 11.31 C ATOM 563 HG1 THR A 92 112.915 84.020 16.754 1.00 0.00 H ATOM 564 H THR A 92 113.863 85.803 15.935 1.00 0.00 H ATOM 565 N ALA A 93 113.342 88.594 17.540 1.00 9.49 N ATOM 566 CA ALA A 93 113.364 90.024 17.849 1.00 10.65 C ATOM 567 C ALA A 93 112.370 90.771 16.962 1.00 10.71 C ATOM 568 O ALA A 93 111.631 91.648 17.436 1.00 11.48 O ATOM 569 CB ALA A 93 114.777 90.587 17.705 1.00 12.38 C ATOM 570 H ALA A 93 114.206 88.120 17.207 1.00 0.00 H ATOM 571 N ALA A 94 112.324 90.445 15.668 1.00 9.81 N ATOM 572 CA ALA A 94 111.365 91.110 14.786 1.00 9.65 C ATOM 573 C ALA A 94 109.924 90.796 15.182 1.00 9.79 C ATOM 574 O ALA A 94 109.053 91.665 15.104 1.00 11.07 O ATOM 575 CB ALA A 94 111.648 90.717 13.336 1.00 11.07 C ATOM 576 H ALA A 94 112.967 89.721 15.289 1.00 0.00 H ATOM 577 N LEU A 95 109.667 89.571 15.631 1.00 9.84 N ATOM 578 CA LEU A 95 108.356 89.189 16.136 1.00 9.30 C ATOM 579 C LEU A 95 107.940 90.074 17.302 1.00 9.13 C ATOM 580 O LEU A 95 106.826 90.606 17.332 1.00 10.55 O ATOM 581 CB LEU A 95 108.413 87.713 16.535 1.00 10.65 C ATOM 582 CG LEU A 95 107.223 87.191 17.321 1.00 10.26 C ATOM 583 CD1 LEU A 95 105.957 87.229 16.483 1.00 11.86 C ATOM 584 CD2 LEU A 95 107.531 85.774 17.780 1.00 12.17 C ATOM 585 H LEU A 95 110.428 88.862 15.621 1.00 0.00 H ATOM 586 N LEU A 96 108.821 90.238 18.284 1.00 9.86 N ATOM 587 CA LEU A 96 108.483 91.077 19.426 1.00 10.20 C ATOM 588 C LEU A 96 108.206 92.505 18.990 1.00 9.97 C ATOM 589 O LEU A 96 107.293 93.152 19.514 1.00 11.04 O ATOM 590 CB LEU A 96 109.594 91.039 20.476 1.00 12.00 C ATOM 591 CG LEU A 96 109.783 89.711 21.192 1.00 10.48 C ATOM 592 CD1 LEU A 96 110.960 89.843 22.148 1.00 14.43 C ATOM 593 CD2 LEU A 96 108.535 89.284 21.940 1.00 14.46 C ATOM 594 H LEU A 96 109.748 89.769 18.237 1.00 0.00 H ATOM 595 N ALA A 97 108.978 93.024 18.040 1.00 10.54 N ATOM 596 CA ALA A 97 108.748 94.387 17.574 1.00 10.90 C ATOM 597 C ALA A 97 107.405 94.513 16.859 1.00 11.38 C ATOM 598 O ALA A 97 106.690 95.511 17.034 1.00 13.30 O ATOM 599 CB ALA A 97 109.886 94.830 16.659 1.00 12.82 C ATOM 600 H ALA A 97 109.747 92.457 17.629 1.00 0.00 H ATOM 601 N GLU A 98 107.035 93.507 16.058 1.00 10.74 N ATOM 602 CA GLU A 98 105.771 93.570 15.343 1.00 11.27 C ATOM 603 C GLU A 98 104.594 93.433 16.296 1.00 12.28 C ATOM 604 O GLU A 98 103.572 94.103 16.130 1.00 13.82 O ATOM 605 CB GLU A 98 105.733 92.521 14.233 1.00 14.53 C ATOM 606 CG GLU A 98 104.688 92.801 13.168 1.00 23.71 C ATOM 607 CD GLU A 98 104.930 94.137 12.418 1.00 16.72 C ATOM 608 OE1 GLU A 98 103.941 94.709 11.928 1.00 38.44 O ATOM 609 OE2 GLU A 98 106.097 94.549 12.307 1.00 38.75 O ATOM 610 H GLU A 98 107.653 92.678 15.947 1.00 0.00 H ATOM 611 N ILE A 99 104.721 92.579 17.309 1.00 11.14 N ATOM 612 CA ILE A 99 103.687 92.481 18.339 1.00 12.01 C ATOM 613 C ILE A 99 103.486 93.827 19.024 1.00 12.42 C ATOM 614 O ILE A 99 102.354 94.265 19.253 1.00 13.74 O ATOM 615 CB ILE A 99 104.030 91.372 19.347 1.00 11.76 C ATOM 616 CG1 ILE A 99 103.898 90.005 18.680 1.00 11.69 C ATOM 617 CG2 ILE A 99 103.159 91.476 20.575 1.00 13.96 C ATOM 618 CD1 ILE A 99 104.393 88.840 19.539 1.00 11.64 C ATOM 619 H ILE A 99 105.565 91.974 17.369 1.00 0.00 H ATOM 620 N GLU A 100 104.577 94.493 19.400 1.00 12.35 N ATOM 621 CA GLU A 100 104.438 95.779 20.076 1.00 14.88 C ATOM 622 C GLU A 100 103.768 96.798 19.169 1.00 15.74 C ATOM 623 O GLU A 100 102.918 97.574 19.622 1.00 18.67 O ATOM 624 CB GLU A 100 105.805 96.269 20.572 1.00 17.31 C ATOM 625 CG GLU A 100 105.777 97.626 21.325 1.00 18.76 C ATOM 626 CD GLU A 100 104.793 97.714 22.514 1.00 28.61 C ATOM 627 OE1 GLU A 100 104.365 96.687 23.091 1.00 29.08 O ATOM 628 OE2 GLU A 100 104.452 98.859 22.896 1.00 32.91 O ATOM 629 H GLU A 100 105.521 94.099 19.213 1.00 0.00 H ATOM 630 N LYS A 101 104.133 96.803 17.881 1.00 14.46 N ATOM 631 CA LYS A 101 103.581 97.763 16.931 1.00 16.91 C ATOM 632 C LYS A 101 102.093 97.535 16.692 1.00 18.61 C ATOM 633 O LYS A 101 101.314 98.486 16.656 1.00 20.84 O ATOM 634 CB LYS A 101 104.357 97.669 15.612 1.00 19.05 C ATOM 635 CG LYS A 101 103.801 98.521 14.475 1.00 25.96 C ATOM 636 CD LYS A 101 104.617 98.300 13.198 1.00 27.67 C ATOM 637 CE LYS A 101 104.114 99.209 12.069 1.00 35.75 C ATOM 638 NZ LYS A 101 104.974 99.134 10.850 1.00 42.95 N ATOM 639 HZ1 LYS A 101 105.942 99.427 11.092 1.00 0.00 H ATOM 640 HZ2 LYS A 101 104.985 98.157 10.495 1.00 0.00 H ATOM 641 HZ3 LYS A 101 104.591 99.766 10.118 1.00 0.00 H ATOM 642 H LYS A 101 104.828 96.104 17.549 1.00 0.00 H ATOM 643 N GLN A 102 101.684 96.282 16.525 1.00 15.80 N ATOM 644 CA GLN A 102 100.340 95.959 16.073 1.00 17.10 C ATOM 645 C GLN A 102 99.373 95.653 17.205 1.00 17.75 C ATOM 646 O GLN A 102 98.184 95.937 17.069 1.00 21.32 O ATOM 647 CB GLN A 102 100.379 94.753 15.136 1.00 18.68 C ATOM 648 CG GLN A 102 101.215 94.934 13.893 1.00 21.13 C ATOM 649 CD GLN A 102 100.842 93.930 12.828 1.00 26.06 C ATOM 650 OE1 GLN A 102 99.686 93.536 12.716 1.00 30.13 O ATOM 651 NE2 GLN A 102 101.820 93.510 12.045 1.00 32.45 N ATOM 652 HE22 GLN A 102 102.785 93.873 12.178 1.00 0.00 H ATOM 653 HE21 GLN A 102 101.624 92.816 11.295 1.00 0.00 H ATOM 654 H GLN A 102 102.347 95.506 16.724 1.00 0.00 H ATOM 655 N ILE A 103 99.857 95.085 18.305 1.00 16.32 N ATOM 656 CA ILE A 103 99.009 94.648 19.412 1.00 17.07 C ATOM 657 C ILE A 103 99.249 95.488 20.650 1.00 17.65 C ATOM 658 O ILE A 103 98.307 96.008 21.248 1.00 19.64 O ATOM 659 CB ILE A 103 99.180 93.141 19.708 1.00 16.06 C ATOM 660 CG1 ILE A 103 98.952 92.311 18.441 1.00 15.66 C ATOM 661 CG2 ILE A 103 98.178 92.697 20.798 1.00 17.81 C ATOM 662 CD1 ILE A 103 99.236 90.830 18.596 1.00 16.57 C ATOM 663 H ILE A 103 100.885 94.945 18.381 1.00 0.00 H ATOM 664 N GLY A 104 100.503 95.623 21.061 1.00 16.25 N ATOM 665 CA GLY A 104 100.829 96.565 22.107 1.00 16.45 C ATOM 666 C GLY A 104 100.593 96.073 23.511 1.00 15.69 C ATOM 667 O GLY A 104 100.570 96.890 24.440 1.00 18.97 O ATOM 668 H GLY A 104 101.254 95.049 20.629 1.00 0.00 H ATOM 669 N LEU A 105 100.381 94.789 23.693 1.00 13.69 N ATOM 670 CA LEU A 105 100.328 94.151 24.997 1.00 13.12 C ATOM 671 C LEU A 105 101.600 93.341 25.204 1.00 13.37 C ATOM 672 O LEU A 105 102.195 92.876 24.235 1.00 14.82 O ATOM 673 CB LEU A 105 99.124 93.206 25.097 1.00 12.89 C ATOM 674 CG LEU A 105 97.727 93.843 25.026 1.00 16.69 C ATOM 675 CD1 LEU A 105 96.698 92.742 25.322 1.00 16.20 C ATOM 676 CD2 LEU A 105 97.544 95.028 25.945 1.00 19.21 C ATOM 677 H LEU A 105 100.243 94.193 22.852 1.00 0.00 H ATOM 678 N PRO A 106 102.055 93.171 26.437 1.00 12.63 N ATOM 679 CA PRO A 106 103.330 92.470 26.647 1.00 13.85 C ATOM 680 C PRO A 106 103.198 90.963 26.513 1.00 12.50 C ATOM 681 O PRO A 106 102.252 90.347 27.013 1.00 13.51 O ATOM 682 CB PRO A 106 103.681 92.835 28.089 1.00 17.08 C ATOM 683 CG PRO A 106 102.340 93.029 28.739 1.00 17.44 C ATOM 684 CD PRO A 106 101.492 93.695 27.683 1.00 15.00 C ATOM 685 N VAL A 107 104.183 90.362 25.853 1.00 12.57 N ATOM 686 CA VAL A 107 104.332 88.909 25.847 1.00 11.28 C ATOM 687 C VAL A 107 104.978 88.539 27.167 1.00 12.70 C ATOM 688 O VAL A 107 106.092 88.985 27.459 1.00 14.30 O ATOM 689 CB VAL A 107 105.218 88.439 24.689 1.00 12.94 C ATOM 690 CG1 VAL A 107 105.375 86.929 24.734 1.00 12.78 C ATOM 691 CG2 VAL A 107 104.667 88.914 23.325 1.00 13.08 C ATOM 692 H VAL A 107 104.867 90.942 25.326 1.00 0.00 H ATOM 693 N THR A 108 104.288 87.728 27.964 1.00 10.14 N ATOM 694 CA THR A 108 104.796 87.367 29.282 1.00 10.69 C ATOM 695 C THR A 108 105.180 85.898 29.410 1.00 10.53 C ATOM 696 O THR A 108 106.014 85.570 30.266 1.00 12.25 O ATOM 697 CB THR A 108 103.776 87.746 30.353 1.00 12.27 C ATOM 698 OG1 THR A 108 102.565 87.039 30.067 1.00 12.27 O ATOM 699 CG2 THR A 108 103.577 89.269 30.382 1.00 13.23 C ATOM 700 HG1 THR A 108 101.883 87.266 30.748 1.00 0.00 H ATOM 701 H THR A 108 103.375 87.347 27.643 1.00 0.00 H ATOM 702 N ARG A 109 104.629 85.017 28.575 1.00 9.39 N ATOM 703 CA ARG A 109 104.986 83.607 28.582 1.00 9.68 C ATOM 704 C ARG A 109 105.045 83.096 27.151 1.00 9.73 C ATOM 705 O ARG A 109 104.354 83.603 26.261 1.00 10.19 O ATOM 706 CB ARG A 109 103.971 82.765 29.365 1.00 10.49 C ATOM 707 CG ARG A 109 103.864 83.163 30.807 1.00 10.93 C ATOM 708 CD ARG A 109 102.933 82.278 31.571 1.00 13.82 C ATOM 709 NE ARG A 109 101.546 82.509 31.217 1.00 13.47 N ATOM 710 CZ ARG A 109 100.534 81.846 31.752 1.00 16.61 C ATOM 711 NH1 ARG A 109 100.754 80.912 32.664 1.00 18.11 N ATOM 712 NH2 ARG A 109 99.286 82.119 31.390 1.00 16.63 N ATOM 713 HE ARG A 109 101.335 83.236 30.503 1.00 0.00 H ATOM 714 HH12 ARG A 109 99.954 80.394 33.081 1.00 0.00 H ATOM 715 HH11 ARG A 109 101.726 80.696 32.963 1.00 0.00 H ATOM 716 HH22 ARG A 109 98.495 81.594 31.814 1.00 0.00 H ATOM 717 HH21 ARG A 109 99.100 82.858 30.682 1.00 0.00 H ATOM 718 H ARG A 109 103.918 85.350 27.893 1.00 0.00 H ATOM 719 N ALA A 110 105.884 82.092 26.943 1.00 9.86 N ATOM 720 CA ALA A 110 105.974 81.396 25.668 1.00 9.35 C ATOM 721 C ALA A 110 106.068 79.904 25.920 1.00 10.19 C ATOM 722 O ALA A 110 106.692 79.473 26.889 1.00 10.79 O ATOM 723 CB ALA A 110 107.191 81.845 24.855 1.00 10.12 C ATOM 724 H ALA A 110 106.503 81.789 27.722 1.00 0.00 H ATOM 725 N VAL A 111 105.466 79.129 25.034 1.00 9.09 N ATOM 726 CA VAL A 111 105.536 77.672 25.045 1.00 8.71 C ATOM 727 C VAL A 111 106.121 77.244 23.710 1.00 10.10 C ATOM 728 O VAL A 111 105.629 77.670 22.661 1.00 10.37 O ATOM 729 CB VAL A 111 104.149 77.034 25.237 1.00 9.89 C ATOM 730 CG1 VAL A 111 104.194 75.521 25.027 1.00 10.86 C ATOM 731 CG2 VAL A 111 103.581 77.381 26.600 1.00 11.29 C ATOM 732 H VAL A 111 104.909 79.586 24.284 1.00 0.00 H ATOM 733 N SER A 112 107.134 76.377 23.740 1.00 9.38 N ATOM 734 CA SER A 112 107.672 75.766 22.522 1.00 9.60 C ATOM 735 C SER A 112 107.127 74.354 22.382 1.00 9.72 C ATOM 736 O SER A 112 107.157 73.573 23.342 1.00 11.12 O ATOM 737 CB SER A 112 109.194 75.727 22.540 1.00 10.86 C ATOM 738 OG SER A 112 109.759 77.027 22.475 1.00 11.14 O ATOM 739 HG SER A 112 109.453 77.558 23.253 1.00 0.00 H ATOM 740 H SER A 112 107.555 76.127 24.657 1.00 0.00 H ATOM 741 N THR A 113 106.628 74.033 21.184 1.00 8.90 N ATOM 742 CA THR A 113 105.866 72.816 20.979 1.00 10.35 C ATOM 743 C THR A 113 106.711 71.623 20.540 1.00 11.36 C ATOM 744 O THR A 113 106.193 70.511 20.550 1.00 12.08 O ATOM 745 CB THR A 113 104.703 73.036 20.007 1.00 10.87 C ATOM 746 OG1 THR A 113 105.188 73.470 18.722 1.00 10.75 O ATOM 747 CG2 THR A 113 103.718 74.047 20.543 1.00 12.54 C ATOM 748 HG1 THR A 113 105.683 74.321 18.828 1.00 0.00 H ATOM 749 H THR A 113 106.790 74.672 20.379 1.00 0.00 H ATOM 750 N HIS A 114 107.982 71.815 20.171 1.00 10.24 N ATOM 751 CA HIS A 114 108.959 70.724 20.127 1.00 10.02 C ATOM 752 C HIS A 114 110.345 71.352 20.067 1.00 9.91 C ATOM 753 O HIS A 114 110.495 72.572 20.134 1.00 10.49 O ATOM 754 CB HIS A 114 108.668 69.670 19.037 1.00 10.54 C ATOM 755 CG HIS A 114 108.842 70.130 17.619 1.00 10.67 C ATOM 756 ND1 HIS A 114 107.871 70.834 16.942 1.00 11.27 N ATOM 757 CD2 HIS A 114 109.828 69.893 16.713 1.00 10.93 C ATOM 758 CE1 HIS A 114 108.271 71.056 15.699 1.00 10.94 C ATOM 759 NE2 HIS A 114 109.463 70.500 15.531 1.00 11.40 N ATOM 760 H HIS A 114 108.288 72.773 19.906 1.00 0.00 H ATOM 761 N PHE A 115 111.375 70.498 19.989 1.00 10.96 N ATOM 762 CA PHE A 115 112.747 70.918 20.224 1.00 10.72 C ATOM 763 C PHE A 115 113.454 71.498 19.020 1.00 10.48 C ATOM 764 O PHE A 115 114.587 71.973 19.172 1.00 11.90 O ATOM 765 CB PHE A 115 113.573 69.752 20.781 1.00 12.14 C ATOM 766 CG PHE A 115 113.945 68.683 19.771 1.00 12.51 C ATOM 767 CD1 PHE A 115 113.057 67.666 19.430 1.00 13.60 C ATOM 768 CD2 PHE A 115 115.210 68.651 19.215 1.00 13.13 C ATOM 769 CE1 PHE A 115 113.428 66.672 18.548 1.00 15.07 C ATOM 770 CE2 PHE A 115 115.582 67.640 18.338 1.00 14.44 C ATOM 771 CZ PHE A 115 114.682 66.670 17.997 1.00 14.02 C ATOM 772 H PHE A 115 111.187 69.503 19.753 1.00 0.00 H ATOM 773 N HIS A 116 112.855 71.469 17.833 1.00 10.53 N ATOM 774 CA HIS A 116 113.564 71.964 16.658 1.00 11.39 C ATOM 775 C HIS A 116 113.707 73.487 16.694 1.00 10.78 C ATOM 776 O HIS A 116 112.987 74.195 17.401 1.00 10.45 O ATOM 777 CB HIS A 116 112.842 71.543 15.381 1.00 12.52 C ATOM 778 CG HIS A 116 112.946 70.082 15.085 1.00 12.36 C ATOM 779 ND1 HIS A 116 112.080 69.428 14.232 1.00 13.09 N ATOM 780 CD2 HIS A 116 113.826 69.149 15.521 1.00 13.73 C ATOM 781 CE1 HIS A 116 112.428 68.156 14.153 1.00 14.99 C ATOM 782 NE2 HIS A 116 113.483 67.959 14.926 1.00 15.68 N ATOM 783 H HIS A 116 111.888 71.096 17.743 1.00 0.00 H ATOM 784 N ASP A 117 114.645 73.995 15.904 1.00 11.83 N ATOM 785 CA ASP A 117 115.025 75.401 16.011 1.00 12.12 C ATOM 786 C ASP A 117 113.943 76.361 15.525 1.00 12.27 C ATOM 787 O ASP A 117 113.968 77.541 15.900 1.00 11.41 O ATOM 788 CB ASP A 117 116.349 75.660 15.301 1.00 13.01 C ATOM 789 CG ASP A 117 117.169 76.709 15.995 1.00 21.69 C ATOM 790 OD1 ASP A 117 117.137 76.753 17.251 1.00 19.75 O ATOM 791 OD2 ASP A 117 117.841 77.473 15.278 1.00 31.52 O ATOM 792 H ASP A 117 115.113 73.386 15.203 1.00 0.00 H ATOM 793 N ASP A 118 112.988 75.887 14.712 1.00 10.88 N ATOM 794 CA ASP A 118 111.866 76.737 14.330 1.00 10.95 C ATOM 795 C ASP A 118 110.896 76.949 15.476 1.00 10.32 C ATOM 796 O ASP A 118 110.011 77.801 15.360 1.00 11.96 O ATOM 797 CB ASP A 118 111.139 76.220 13.062 1.00 11.30 C ATOM 798 CG ASP A 118 110.646 74.771 13.164 1.00 12.30 C ATOM 799 OD1 ASP A 118 111.364 73.914 13.737 1.00 14.01 O ATOM 800 OD2 ASP A 118 109.591 74.427 12.544 1.00 14.41 O ATOM 801 H ASP A 118 113.047 74.913 14.354 1.00 0.00 H ATOM 802 N ARG A 119 111.058 76.206 16.573 1.00 10.83 N ATOM 803 CA ARG A 119 110.206 76.290 17.745 1.00 10.00 C ATOM 804 C ARG A 119 110.902 76.913 18.941 1.00 10.09 C ATOM 805 O ARG A 119 110.230 77.562 19.747 1.00 10.24 O ATOM 806 CB ARG A 119 109.723 74.882 18.159 1.00 10.37 C ATOM 807 CG ARG A 119 109.114 74.012 17.052 1.00 11.17 C ATOM 808 CD ARG A 119 107.819 74.603 16.525 1.00 10.71 C ATOM 809 NE ARG A 119 107.893 74.921 15.113 1.00 11.58 N ATOM 810 CZ ARG A 119 107.020 75.688 14.482 1.00 13.30 C ATOM 811 NH1 ARG A 119 106.009 76.215 15.151 1.00 15.15 N ATOM 812 NH2 ARG A 119 107.141 75.910 13.180 1.00 14.98 N ATOM 813 HE ARG A 119 108.680 74.522 14.563 1.00 0.00 H ATOM 814 HH12 ARG A 119 105.319 76.819 14.660 1.00 0.00 H ATOM 815 HH11 ARG A 119 105.903 76.026 16.168 1.00 0.00 H ATOM 816 HH22 ARG A 119 106.451 76.514 12.689 1.00 0.00 H ATOM 817 HH21 ARG A 119 107.926 75.480 12.650 1.00 0.00 H ATOM 818 H ARG A 119 111.844 75.525 16.589 1.00 0.00 H ATOM 819 N VAL A 120 112.214 76.689 19.097 1.00 10.23 N ATOM 820 CA VAL A 120 112.975 77.189 20.241 1.00 10.42 C ATOM 821 C VAL A 120 114.014 78.238 19.872 1.00 11.60 C ATOM 822 O VAL A 120 114.555 78.887 20.776 1.00 11.61 O ATOM 823 CB VAL A 120 113.649 76.059 21.057 1.00 11.01 C ATOM 824 CG1 VAL A 120 112.644 75.093 21.606 1.00 11.05 C ATOM 825 CG2 VAL A 120 114.699 75.290 20.237 1.00 11.00 C ATOM 826 H VAL A 120 112.713 76.135 18.372 1.00 0.00 H ATOM 827 N GLY A 121 114.379 78.382 18.601 1.00 9.96 N ATOM 828 CA GLY A 121 115.423 79.316 18.240 1.00 11.16 C ATOM 829 C GLY A 121 114.905 80.712 18.446 1.00 10.77 C ATOM 830 O GLY A 121 113.903 81.104 17.823 1.00 11.57 O ATOM 831 H GLY A 121 113.911 77.820 17.862 1.00 0.00 H ATOM 832 N GLY A 122 115.520 81.465 19.359 1.00 10.34 N ATOM 833 CA GLY A 122 114.998 82.744 19.782 1.00 11.23 C ATOM 834 C GLY A 122 114.531 82.789 21.220 1.00 10.69 C ATOM 835 O GLY A 122 114.184 83.870 21.698 1.00 10.76 O ATOM 836 H GLY A 122 116.406 81.120 19.781 1.00 0.00 H ATOM 837 N VAL A 123 114.508 81.661 21.945 1.00 10.34 N ATOM 838 CA VAL A 123 114.080 81.738 23.347 1.00 11.73 C ATOM 839 C VAL A 123 115.011 82.600 24.192 1.00 12.28 C ATOM 840 O VAL A 123 114.560 83.223 25.158 1.00 11.72 O ATOM 841 CB VAL A 123 113.807 80.367 24.001 1.00 17.60 C ATOM 842 CG1 VAL A 123 112.635 79.681 23.371 1.00 14.16 C ATOM 843 CG2 VAL A 123 114.996 79.494 23.948 1.00 18.98 C ATOM 844 H VAL A 123 114.787 80.752 21.523 1.00 0.00 H ATOM 845 N ASP A 124 116.303 82.692 23.858 1.00 11.28 N ATOM 846 CA ASP A 124 117.180 83.569 24.635 1.00 11.88 C ATOM 847 C ASP A 124 116.769 85.041 24.476 1.00 12.36 C ATOM 848 O ASP A 124 116.780 85.812 25.442 1.00 13.37 O ATOM 849 CB ASP A 124 118.654 83.364 24.257 1.00 12.73 C ATOM 850 CG ASP A 124 119.214 81.970 24.638 1.00 15.06 C ATOM 851 OD1 ASP A 124 118.485 81.142 25.255 1.00 17.11 O ATOM 852 OD2 ASP A 124 120.394 81.728 24.297 1.00 17.79 O ATOM 853 H ASP A 124 116.680 82.147 23.056 1.00 0.00 H ATOM 854 N VAL A 125 116.397 85.446 23.255 1.00 11.79 N ATOM 855 CA VAL A 125 115.857 86.791 23.026 1.00 11.26 C ATOM 856 C VAL A 125 114.584 87.003 23.838 1.00 10.21 C ATOM 857 O VAL A 125 114.396 88.048 24.469 1.00 10.94 O ATOM 858 CB VAL A 125 115.632 87.028 21.518 1.00 10.96 C ATOM 859 CG1 VAL A 125 114.787 88.276 21.270 1.00 12.63 C ATOM 860 CG2 VAL A 125 116.963 87.175 20.795 1.00 12.77 C ATOM 861 H VAL A 125 116.493 84.793 22.451 1.00 0.00 H ATOM 862 N LEU A 126 113.673 86.027 23.813 1.00 10.34 N ATOM 863 CA LEU A 126 112.438 86.147 24.594 1.00 9.13 C ATOM 864 C LEU A 126 112.748 86.377 26.063 1.00 10.16 C ATOM 865 O LEU A 126 112.175 87.266 26.702 1.00 11.30 O ATOM 866 CB LEU A 126 111.562 84.901 24.415 1.00 9.62 C ATOM 867 CG LEU A 126 110.990 84.652 23.012 1.00 9.18 C ATOM 868 CD1 LEU A 126 110.200 83.358 23.022 1.00 10.56 C ATOM 869 CD2 LEU A 126 110.126 85.823 22.572 1.00 11.78 C ATOM 870 H LEU A 126 113.840 85.178 23.237 1.00 0.00 H TER 871 LEU A 126 ATOM 872 N ALA A 128 115.458 87.611 27.416 1.00 12.35 N ATOM 873 CA ALA A 128 116.034 88.939 27.599 1.00 12.95 C ATOM 874 C ALA A 128 114.981 90.036 27.560 1.00 14.06 C ATOM 875 O ALA A 128 115.189 91.114 28.137 1.00 14.44 O ATOM 876 CB ALA A 128 117.108 89.194 26.541 1.00 13.93 C ATOM 877 HN3 ALA A 128 114.980 87.566 26.494 1.00 0.00 H ATOM 878 HN2 ALA A 128 114.771 87.425 28.174 1.00 0.00 H ATOM 879 HN1 ALA A 128 116.215 86.898 27.450 1.00 0.00 H ATOM 880 N ALA A 129 113.867 89.795 26.881 1.00 12.86 N ATOM 881 CA ALA A 129 112.754 90.722 26.794 1.00 12.21 C ATOM 882 C ALA A 129 111.790 90.579 27.951 1.00 17.16 C ATOM 883 O ALA A 129 110.806 91.326 27.999 1.00 18.95 O ATOM 884 CB ALA A 129 111.992 90.523 25.478 1.00 13.02 C ATOM 885 H ALA A 129 113.787 88.887 26.381 1.00 0.00 H ATOM 886 N GLY A 130 112.038 89.658 28.877 1.00 12.98 N ATOM 887 CA GLY A 130 111.173 89.479 30.027 1.00 13.76 C ATOM 888 C GLY A 130 110.186 88.344 29.926 1.00 13.63 C ATOM 889 O GLY A 130 109.325 88.222 30.797 1.00 15.72 O ATOM 890 H GLY A 130 112.875 89.049 28.774 1.00 0.00 H ATOM 891 N VAL A 131 110.270 87.517 28.902 1.00 11.95 N ATOM 892 CA VAL A 131 109.313 86.443 28.682 1.00 11.24 C ATOM 893 C VAL A 131 109.775 85.210 29.437 1.00 11.61 C ATOM 894 O VAL A 131 110.932 84.791 29.306 1.00 13.77 O ATOM 895 CB VAL A 131 109.191 86.131 27.182 1.00 10.75 C ATOM 896 CG1 VAL A 131 108.134 85.041 26.946 1.00 11.35 C ATOM 897 CG2 VAL A 131 108.849 87.381 26.380 1.00 12.43 C ATOM 898 H VAL A 131 111.051 87.637 28.225 1.00 0.00 H ATOM 899 N ALA A 132 108.858 84.594 30.180 1.00 11.11 N ATOM 900 CA ALA A 132 109.102 83.297 30.797 1.00 10.79 C ATOM 901 C ALA A 132 108.820 82.211 29.768 1.00 10.76 C ATOM 902 O ALA A 132 107.699 82.116 29.255 1.00 11.65 O ATOM 903 CB ALA A 132 108.188 83.106 31.997 1.00 12.72 C ATOM 904 H ALA A 132 107.937 85.054 30.325 1.00 0.00 H ATOM 905 N THR A 133 109.827 81.411 29.441 1.00 10.88 N ATOM 906 CA THR A 133 109.739 80.424 28.374 1.00 9.90 C ATOM 907 C THR A 133 109.592 79.027 28.966 1.00 9.37 C ATOM 908 O THR A 133 110.210 78.702 29.989 1.00 10.35 O ATOM 909 CB THR A 133 110.979 80.486 27.466 1.00 11.20 C ATOM 910 OG1 THR A 133 112.158 80.263 28.237 1.00 12.68 O ATOM 911 CG2 THR A 133 111.054 81.827 26.742 1.00 11.02 C ATOM 912 HG1 THR A 133 112.951 80.305 27.645 1.00 0.00 H ATOM 913 H THR A 133 110.719 81.493 29.970 1.00 0.00 H ATOM 914 N TYR A 134 108.757 78.221 28.314 1.00 9.74 N ATOM 915 CA TYR A 134 108.342 76.915 28.800 1.00 9.69 C ATOM 916 C TYR A 134 108.428 75.868 27.698 1.00 8.94 C ATOM 917 O TYR A 134 108.193 76.151 26.518 1.00 10.05 O ATOM 918 CB TYR A 134 106.863 76.933 29.267 1.00 10.32 C ATOM 919 CG TYR A 134 106.588 77.798 30.475 1.00 11.48 C ATOM 920 CD1 TYR A 134 106.481 79.175 30.339 1.00 10.66 C ATOM 921 CD2 TYR A 134 106.410 77.253 31.733 1.00 13.00 C ATOM 922 CE1 TYR A 134 106.231 79.982 31.413 1.00 12.54 C ATOM 923 CE2 TYR A 134 106.163 78.052 32.822 1.00 13.63 C ATOM 924 CZ TYR A 134 106.079 79.413 32.657 1.00 14.30 C ATOM 925 OH TYR A 134 105.811 80.200 33.780 1.00 18.93 O ATOM 926 HH TYR A 134 106.525 80.068 34.452 1.00 0.00 H ATOM 927 H TYR A 134 108.378 78.545 27.401 1.00 0.00 H ATOM 928 N ALA A 135 108.676 74.622 28.103 1.00 10.20 N ATOM 929 CA ALA A 135 108.539 73.462 27.234 1.00 10.74 C ATOM 930 C ALA A 135 108.493 72.240 28.132 1.00 11.13 C ATOM 931 O ALA A 135 108.800 72.321 29.321 1.00 12.07 O ATOM 932 CB ALA A 135 109.691 73.381 26.227 1.00 11.82 C ATOM 933 H ALA A 135 108.982 74.472 29.086 1.00 0.00 H ATOM 934 N SER A 136 108.097 71.102 27.568 1.00 11.45 N ATOM 935 CA SER A 136 108.125 69.880 28.352 1.00 11.66 C ATOM 936 C SER A 136 109.564 69.512 28.715 1.00 12.81 C ATOM 937 O SER A 136 110.514 69.918 28.033 1.00 11.96 O ATOM 938 CB SER A 136 107.507 68.717 27.583 1.00 12.04 C ATOM 939 OG SER A 136 108.392 68.307 26.553 1.00 12.67 O ATOM 940 HG SER A 136 107.990 67.552 26.055 1.00 0.00 H ATOM 941 H SER A 136 107.772 71.088 26.580 1.00 0.00 H ATOM 942 N PRO A 137 109.741 68.704 29.759 1.00 12.76 N ATOM 943 CA PRO A 137 111.100 68.243 30.099 1.00 13.02 C ATOM 944 C PRO A 137 111.786 67.541 28.944 1.00 13.61 C ATOM 945 O PRO A 137 112.996 67.702 28.740 1.00 15.49 O ATOM 946 CB PRO A 137 110.869 67.317 31.302 1.00 15.80 C ATOM 947 CG PRO A 137 109.569 67.769 31.890 1.00 18.37 C ATOM 948 CD PRO A 137 108.746 68.290 30.758 1.00 13.12 C ATOM 949 N SER A 138 111.030 66.744 28.187 1.00 13.20 N ATOM 950 CA SER A 138 111.579 66.072 27.023 1.00 13.49 C ATOM 951 C SER A 138 112.065 67.071 25.983 1.00 13.10 C ATOM 952 O SER A 138 113.183 66.960 25.473 1.00 13.39 O ATOM 953 CB SER A 138 110.517 65.153 26.435 1.00 16.22 C ATOM 954 OG SER A 138 111.049 64.456 25.340 1.00 21.33 O ATOM 955 HG SER A 138 110.355 63.860 24.961 1.00 0.00 H ATOM 956 H SER A 138 110.030 66.602 28.435 1.00 0.00 H ATOM 957 N THR A 139 111.233 68.055 25.647 1.00 11.26 N ATOM 958 CA THR A 139 111.657 69.048 24.671 1.00 10.61 C ATOM 959 C THR A 139 112.926 69.755 25.123 1.00 11.24 C ATOM 960 O THR A 139 113.845 69.989 24.322 1.00 12.30 O ATOM 961 CB THR A 139 110.533 70.059 24.467 1.00 11.50 C ATOM 962 OG1 THR A 139 109.411 69.409 23.851 1.00 11.93 O ATOM 963 CG2 THR A 139 110.997 71.247 23.610 1.00 12.57 C ATOM 964 HG1 THR A 139 109.686 69.039 22.975 1.00 0.00 H ATOM 965 H THR A 139 110.288 68.113 26.078 1.00 0.00 H ATOM 966 N ARG A 140 113.002 70.108 26.405 1.00 11.92 N ATOM 967 CA ARG A 140 114.184 70.801 26.909 1.00 13.20 C ATOM 968 C ARG A 140 115.440 69.946 26.767 1.00 14.12 C ATOM 969 O ARG A 140 116.498 70.445 26.350 1.00 14.74 O ATOM 970 CB ARG A 140 113.982 71.224 28.371 1.00 12.81 C ATOM 971 CG ARG A 140 112.859 72.252 28.554 1.00 12.88 C ATOM 972 CD ARG A 140 112.610 72.654 29.998 1.00 14.08 C ATOM 973 NE ARG A 140 113.714 73.461 30.507 1.00 14.29 N ATOM 974 CZ ARG A 140 114.661 73.055 31.326 1.00 17.99 C ATOM 975 NH1 ARG A 140 114.684 71.803 31.771 1.00 24.04 N ATOM 976 NH2 ARG A 140 115.616 73.899 31.698 1.00 22.43 N ATOM 977 HE ARG A 140 113.757 74.451 30.193 1.00 0.00 H ATOM 978 HH12 ARG A 140 115.438 71.495 32.418 1.00 0.00 H ATOM 979 HH11 ARG A 140 113.948 71.131 31.472 1.00 0.00 H ATOM 980 HH22 ARG A 140 116.366 73.583 32.345 1.00 0.00 H ATOM 981 HH21 ARG A 140 115.614 74.876 31.342 1.00 0.00 H ATOM 982 H ARG A 140 112.216 69.889 27.050 1.00 0.00 H ATOM 983 N ARG A 141 115.359 68.668 27.125 1.00 13.05 N ATOM 984 CA ARG A 141 116.511 67.784 26.974 1.00 13.85 C ATOM 985 C ARG A 141 116.886 67.604 25.511 1.00 12.88 C ATOM 986 O ARG A 141 118.077 67.625 25.168 1.00 15.29 O ATOM 987 CB ARG A 141 116.244 66.429 27.625 1.00 14.04 C ATOM 988 CG ARG A 141 116.336 66.420 29.146 1.00 17.32 C ATOM 989 CD ARG A 141 116.323 64.988 29.700 1.00 17.54 C ATOM 990 NE ARG A 141 115.129 64.288 29.238 1.00 17.72 N ATOM 991 CZ ARG A 141 113.964 64.269 29.881 1.00 19.43 C ATOM 992 NH1 ARG A 141 113.834 64.843 31.072 1.00 18.28 N ATOM 993 NH2 ARG A 141 112.925 63.657 29.333 1.00 19.30 N ATOM 994 HE ARG A 141 115.193 63.766 28.341 1.00 0.00 H ATOM 995 HH12 ARG A 141 112.917 64.820 31.563 1.00 0.00 H ATOM 996 HH11 ARG A 141 114.649 65.315 31.513 1.00 0.00 H ATOM 997 HH22 ARG A 141 112.011 63.638 29.830 1.00 0.00 H ATOM 998 HH21 ARG A 141 113.023 63.195 28.406 1.00 0.00 H ATOM 999 H ARG A 141 114.470 68.296 27.515 1.00 0.00 H ATOM 1000 N LEU A 142 115.895 67.374 24.646 1.00 13.07 N ATOM 1001 CA LEU A 142 116.174 67.150 23.231 1.00 13.58 C ATOM 1002 C LEU A 142 116.812 68.372 22.600 1.00 12.76 C ATOM 1003 O LEU A 142 117.735 68.248 21.788 1.00 14.61 O ATOM 1004 CB LEU A 142 114.882 66.801 22.507 1.00 13.54 C ATOM 1005 CG LEU A 142 114.320 65.418 22.848 1.00 14.73 C ATOM 1006 CD1 LEU A 142 112.891 65.314 22.353 1.00 16.30 C ATOM 1007 CD2 LEU A 142 115.186 64.322 22.266 1.00 17.47 C ATOM 1008 H LEU A 142 114.912 67.354 24.985 1.00 0.00 H ATOM 1009 N ALA A 143 116.325 69.557 22.958 1.00 12.50 N ATOM 1010 CA ALA A 143 116.904 70.791 22.428 1.00 12.84 C ATOM 1011 C ALA A 143 118.362 70.912 22.829 1.00 13.54 C ATOM 1012 O ALA A 143 119.215 71.263 22.006 1.00 14.35 O ATOM 1013 CB ALA A 143 116.123 72.001 22.937 1.00 13.42 C ATOM 1014 H ALA A 143 115.525 69.606 23.621 1.00 0.00 H ATOM 1015 N GLU A 144 118.678 70.607 24.086 1.00 14.41 N ATOM 1016 CA GLU A 144 120.054 70.724 24.545 1.00 15.96 C ATOM 1017 C GLU A 144 120.980 69.819 23.742 1.00 17.79 C ATOM 1018 O GLU A 144 122.059 70.245 23.304 1.00 20.54 O ATOM 1019 CB GLU A 144 120.127 70.407 26.039 1.00 17.81 C ATOM 1020 CG GLU A 144 121.532 70.475 26.613 1.00 21.29 C ATOM 1021 CD GLU A 144 121.567 70.188 28.103 1.00 29.22 C ATOM 1022 OE1 GLU A 144 122.398 70.808 28.799 1.00 38.79 O ATOM 1023 OE2 GLU A 144 120.774 69.344 28.580 1.00 28.86 O ATOM 1024 H GLU A 144 117.939 70.284 24.742 1.00 0.00 H ATOM 1025 N VAL A 145 120.580 68.560 23.538 1.00 17.36 N ATOM 1026 CA VAL A 145 121.432 67.626 22.809 1.00 17.47 C ATOM 1027 C VAL A 145 121.619 68.087 21.370 1.00 17.87 C ATOM 1028 O VAL A 145 122.701 67.934 20.790 1.00 18.39 O ATOM 1029 CB VAL A 145 120.864 66.197 22.889 1.00 18.28 C ATOM 1030 CG1 VAL A 145 121.671 65.244 22.018 1.00 19.73 C ATOM 1031 CG2 VAL A 145 120.900 65.706 24.321 1.00 20.02 C ATOM 1032 H VAL A 145 119.658 68.245 23.900 1.00 0.00 H ATOM 1033 N GLU A 146 120.572 68.653 20.773 1.00 16.52 N ATOM 1034 CA GLU A 146 120.629 69.133 19.392 1.00 16.25 C ATOM 1035 C GLU A 146 121.480 70.378 19.243 1.00 20.18 C ATOM 1036 O GLU A 146 121.847 70.727 18.112 1.00 24.97 O ATOM 1037 CB GLU A 146 119.202 69.428 18.912 1.00 17.74 C ATOM 1038 CG GLU A 146 119.051 69.688 17.412 1.00 19.63 C ATOM 1039 CD GLU A 146 119.140 68.429 16.576 1.00 27.62 C ATOM 1040 OE1 GLU A 146 119.024 67.311 17.136 1.00 25.10 O ATOM 1041 OE2 GLU A 146 119.337 68.558 15.347 1.00 32.13 O ATOM 1042 H GLU A 146 119.685 68.757 21.306 1.00 0.00 H ATOM 1043 N GLY A 147 121.800 71.049 20.340 1.00 17.32 N ATOM 1044 CA GLY A 147 122.543 72.288 20.301 1.00 17.88 C ATOM 1045 C GLY A 147 121.681 73.513 20.142 1.00 18.92 C ATOM 1046 O GLY A 147 122.213 74.591 19.831 1.00 19.82 O ATOM 1047 H GLY A 147 121.506 70.670 21.263 1.00 0.00 H ATOM 1048 N ASN A 148 120.376 73.390 20.348 1.00 14.40 N ATOM 1049 CA ASN A 148 119.459 74.511 20.250 1.00 13.36 C ATOM 1050 C ASN A 148 119.287 75.174 21.610 1.00 14.05 C ATOM 1051 O ASN A 148 119.666 74.637 22.663 1.00 15.93 O ATOM 1052 CB ASN A 148 118.100 74.042 19.740 1.00 13.94 C ATOM 1053 CG ASN A 148 118.156 73.466 18.335 1.00 13.65 C ATOM 1054 OD1 ASN A 148 119.103 73.706 17.584 1.00 16.41 O ATOM 1055 ND2 ASN A 148 117.123 72.704 17.971 1.00 14.86 N ATOM 1056 HD22 ASN A 148 116.345 72.529 18.639 1.00 0.00 H ATOM 1057 HD21 ASN A 148 117.095 72.285 17.019 1.00 0.00 H ATOM 1058 H ASN A 148 119.995 72.453 20.589 1.00 0.00 H ATOM 1059 N GLU A 149 118.682 76.355 21.578 1.00 13.12 N ATOM 1060 CA GLU A 149 118.345 77.063 22.806 1.00 13.03 C ATOM 1061 C GLU A 149 117.303 76.296 23.618 1.00 13.86 C ATOM 1062 O GLU A 149 116.520 75.495 23.094 1.00 14.66 O ATOM 1063 CB GLU A 149 117.846 78.458 22.476 1.00 12.54 C ATOM 1064 CG GLU A 149 118.914 79.359 21.893 1.00 13.69 C ATOM 1065 CD GLU A 149 118.283 80.448 21.090 1.00 15.75 C ATOM 1066 OE1 GLU A 149 117.680 81.361 21.681 1.00 17.09 O ATOM 1067 OE2 GLU A 149 118.314 80.374 19.841 1.00 21.02 O ATOM 1068 H GLU A 149 118.444 76.783 20.660 1.00 0.00 H ATOM 1069 N ILE A 150 117.318 76.527 24.926 1.00 13.89 N ATOM 1070 CA ILE A 150 116.585 75.707 25.879 1.00 13.30 C ATOM 1071 C ILE A 150 115.586 76.588 26.622 1.00 13.77 C ATOM 1072 O ILE A 150 115.984 77.465 27.400 1.00 14.12 O ATOM 1073 CB ILE A 150 117.523 75.018 26.879 1.00 13.79 C ATOM 1074 CG1 ILE A 150 118.602 74.232 26.131 1.00 14.70 C ATOM 1075 CG2 ILE A 150 116.715 74.131 27.816 1.00 15.80 C ATOM 1076 CD1 ILE A 150 119.754 73.840 27.019 1.00 21.54 C ATOM 1077 H ILE A 150 117.877 77.328 25.284 1.00 0.00 H ATOM 1078 N PRO A 151 114.281 76.375 26.454 1.00 12.44 N ATOM 1079 CA PRO A 151 113.301 77.076 27.280 1.00 12.17 C ATOM 1080 C PRO A 151 113.589 76.898 28.760 1.00 12.39 C ATOM 1081 O PRO A 151 114.082 75.857 29.202 1.00 12.87 O ATOM 1082 CB PRO A 151 111.978 76.408 26.880 1.00 12.65 C ATOM 1083 CG PRO A 151 112.221 75.978 25.458 1.00 13.81 C ATOM 1084 CD PRO A 151 113.636 75.477 25.477 1.00 13.35 C ATOM 1085 N THR A 152 113.271 77.935 29.526 1.00 12.42 N ATOM 1086 CA THR A 152 113.700 77.997 30.920 1.00 13.75 C ATOM 1087 C THR A 152 112.964 77.002 31.809 1.00 13.56 C ATOM 1088 O THR A 152 113.581 76.344 32.660 1.00 15.61 O ATOM 1089 CB THR A 152 113.470 79.421 31.426 1.00 16.08 C ATOM 1090 OG1 THR A 152 114.227 80.333 30.609 1.00 19.88 O ATOM 1091 CG2 THR A 152 113.854 79.560 32.881 1.00 19.05 C ATOM 1092 HG1 THR A 152 115.189 80.107 30.669 1.00 0.00 H ATOM 1093 H THR A 152 112.709 78.714 29.127 1.00 0.00 H ATOM 1094 N HIS A 153 111.645 76.934 31.688 1.00 12.02 N ATOM 1095 CA HIS A 153 110.783 76.258 32.645 1.00 12.55 C ATOM 1096 C HIS A 153 110.214 74.979 32.046 1.00 13.13 C ATOM 1097 O HIS A 153 109.908 74.936 30.853 1.00 12.67 O ATOM 1098 CB HIS A 153 109.630 77.171 33.061 1.00 13.64 C ATOM 1099 CG HIS A 153 110.079 78.476 33.630 1.00 15.59 C ATOM 1100 ND1 HIS A 153 110.668 78.576 34.872 1.00 19.32 N ATOM 1101 CD2 HIS A 153 110.036 79.737 33.131 1.00 17.16 C ATOM 1102 CE1 HIS A 153 110.967 79.840 35.114 1.00 20.46 C ATOM 1103 NE2 HIS A 153 110.586 80.567 34.077 1.00 20.11 N ATOM 1104 H HIS A 153 111.203 77.389 30.864 1.00 0.00 H ATOM 1105 N SER A 154 110.036 73.952 32.880 1.00 15.22 N ATOM 1106 CA SER A 154 109.452 72.677 32.464 1.00 13.53 C ATOM 1107 C SER A 154 107.948 72.673 32.692 1.00 15.69 C ATOM 1108 O SER A 154 107.472 73.042 33.775 1.00 18.63 O ATOM 1109 CB SER A 154 110.062 71.530 33.263 1.00 15.57 C ATOM 1110 OG SER A 154 111.406 71.309 32.898 1.00 22.48 O ATOM 1111 HG SER A 154 111.773 70.561 33.432 1.00 0.00 H ATOM 1112 H SER A 154 110.326 74.064 33.872 1.00 0.00 H ATOM 1113 N LEU A 155 107.210 72.217 31.689 1.00 14.31 N ATOM 1114 CA LEU A 155 105.784 71.982 31.808 1.00 14.16 C ATOM 1115 C LEU A 155 105.562 70.596 32.383 1.00 18.41 C ATOM 1116 O LEU A 155 106.000 69.601 31.797 1.00 23.49 O ATOM 1117 CB LEU A 155 105.117 72.055 30.440 1.00 13.31 C ATOM 1118 CG LEU A 155 105.171 73.403 29.743 1.00 14.42 C ATOM 1119 CD1 LEU A 155 104.866 73.229 28.260 1.00 18.38 C ATOM 1120 CD2 LEU A 155 104.185 74.345 30.412 1.00 18.95 C ATOM 1121 H LEU A 155 107.673 72.020 30.779 1.00 0.00 H ATOM 1122 N GLU A 156 104.800 70.541 33.462 1.00 21.56 N ATOM 1123 CA GLU A 156 104.396 69.286 34.072 1.00 22.85 C ATOM 1124 C GLU A 156 103.087 68.793 33.459 1.00 20.43 C ATOM 1125 O GLU A 156 102.287 69.565 32.924 1.00 21.96 O ATOM 1126 CB GLU A 156 104.191 69.462 35.578 1.00 31.23 C ATOM 1127 CG GLU A 156 105.287 70.223 36.291 1.00 31.17 C ATOM 1128 H GLU A 156 104.477 71.432 33.891 1.00 0.00 H ATOM 1129 N GLY A 157 102.868 67.484 33.566 1.00 21.31 N ATOM 1130 CA GLY A 157 101.596 66.895 33.199 1.00 19.86 C ATOM 1131 C GLY A 157 101.408 66.524 31.747 1.00 19.48 C ATOM 1132 O GLY A 157 100.263 66.293 31.334 1.00 20.11 O ATOM 1133 H GLY A 157 103.628 66.870 33.922 1.00 0.00 H ATOM 1134 N LEU A 158 102.485 66.445 30.961 1.00 18.58 N ATOM 1135 CA LEU A 158 102.383 66.194 29.529 1.00 16.46 C ATOM 1136 C LEU A 158 103.218 64.994 29.074 1.00 23.32 C ATOM 1137 O LEU A 158 103.607 64.918 27.905 1.00 26.41 O ATOM 1138 CB LEU A 158 102.765 67.449 28.742 1.00 16.44 C ATOM 1139 CG LEU A 158 101.749 68.574 28.845 1.00 14.82 C ATOM 1140 CD1 LEU A 158 102.359 69.840 28.271 1.00 15.96 C ATOM 1141 CD2 LEU A 158 100.432 68.228 28.140 1.00 18.53 C ATOM 1142 H LEU A 158 103.427 66.567 31.385 1.00 0.00 H ATOM 1143 N SER A 159 103.482 64.028 29.943 1.00 23.85 N ATOM 1144 CA SER A 159 104.477 63.017 29.606 1.00 22.16 C ATOM 1145 C SER A 159 103.910 61.796 28.881 1.00 24.40 C ATOM 1146 O SER A 159 104.687 61.049 28.268 1.00 26.04 O ATOM 1147 CB SER A 159 105.216 62.564 30.864 1.00 31.00 C ATOM 1148 OG SER A 159 104.299 62.064 31.800 1.00 36.80 O ATOM 1149 HG SER A 159 103.652 62.774 32.038 1.00 0.00 H ATOM 1150 H SER A 159 102.984 63.992 30.856 1.00 0.00 H ATOM 1151 N SER A 160 102.597 61.557 28.942 1.00 20.04 N ATOM 1152 CA SER A 160 101.984 60.381 28.333 1.00 21.03 C ATOM 1153 C SER A 160 101.034 60.795 27.215 1.00 17.38 C ATOM 1154 O SER A 160 100.323 61.797 27.326 1.00 17.38 O ATOM 1155 CB SER A 160 101.184 59.582 29.351 1.00 26.08 C ATOM 1156 OG SER A 160 102.030 59.070 30.358 1.00 29.77 O ATOM 1157 HG SER A 160 101.491 58.554 31.009 1.00 0.00 H ATOM 1158 H SER A 160 101.988 62.235 29.443 1.00 0.00 H ATOM 1159 N SER A 161 100.973 59.984 26.160 1.00 17.83 N ATOM 1160 CA SER A 161 100.111 60.335 25.041 1.00 16.73 C ATOM 1161 C SER A 161 98.675 60.510 25.516 1.00 16.69 C ATOM 1162 O SER A 161 98.146 59.679 26.270 1.00 18.12 O ATOM 1163 CB SER A 161 100.165 59.252 23.965 1.00 18.36 C ATOM 1164 OG SER A 161 101.491 59.019 23.561 1.00 21.39 O ATOM 1165 HG SER A 161 101.504 58.315 22.865 1.00 0.00 H ATOM 1166 H SER A 161 101.535 59.109 26.136 1.00 0.00 H ATOM 1167 N GLY A 162 98.042 61.580 25.054 1.00 16.88 N ATOM 1168 CA GLY A 162 96.712 61.960 25.465 1.00 18.74 C ATOM 1169 C GLY A 162 96.634 62.865 26.683 1.00 18.31 C ATOM 1170 O GLY A 162 95.526 63.258 27.069 1.00 19.59 O ATOM 1171 H GLY A 162 98.531 62.178 24.357 1.00 0.00 H ATOM 1172 N ASP A 163 97.760 63.225 27.292 1.00 15.94 N ATOM 1173 CA ASP A 163 97.739 64.135 28.424 1.00 17.46 C ATOM 1174 C ASP A 163 97.412 65.544 27.938 1.00 15.32 C ATOM 1175 O ASP A 163 97.861 65.965 26.867 1.00 15.18 O ATOM 1176 CB ASP A 163 99.115 64.171 29.099 1.00 18.63 C ATOM 1177 CG ASP A 163 99.382 62.983 30.032 1.00 20.00 C ATOM 1178 OD1 ASP A 163 98.452 62.209 30.333 1.00 21.63 O ATOM 1179 OD2 ASP A 163 100.551 62.869 30.483 1.00 24.54 O ATOM 1180 H ASP A 163 98.669 62.850 26.953 1.00 0.00 H ATOM 1181 N ALA A 164 96.652 66.275 28.747 1.00 16.48 N ATOM 1182 CA ALA A 164 96.310 67.662 28.473 1.00 16.41 C ATOM 1183 C ALA A 164 96.411 68.471 29.755 1.00 17.50 C ATOM 1184 O ALA A 164 96.097 67.977 30.841 1.00 19.02 O ATOM 1185 CB ALA A 164 94.880 67.798 27.952 1.00 19.91 C ATOM 1186 H ALA A 164 96.285 65.835 29.615 1.00 0.00 H ATOM 1187 N VAL A 165 96.834 69.729 29.618 1.00 16.25 N ATOM 1188 CA VAL A 165 96.887 70.652 30.746 1.00 16.47 C ATOM 1189 C VAL A 165 96.431 72.025 30.278 1.00 15.91 C ATOM 1190 O VAL A 165 96.661 72.415 29.134 1.00 16.35 O ATOM 1191 CB VAL A 165 98.292 70.759 31.401 1.00 18.81 C ATOM 1192 CG1 VAL A 165 98.775 69.422 31.896 1.00 22.21 C ATOM 1193 CG2 VAL A 165 99.311 71.309 30.456 1.00 18.21 C ATOM 1194 H VAL A 165 97.135 70.061 28.679 1.00 0.00 H ATOM 1195 N ARG A 166 95.805 72.776 31.176 1.00 16.75 N ATOM 1196 CA ARG A 166 95.460 74.160 30.883 1.00 15.44 C ATOM 1197 C ARG A 166 96.681 75.043 31.111 1.00 16.00 C ATOM 1198 O ARG A 166 97.450 74.845 32.061 1.00 18.10 O ATOM 1199 CB ARG A 166 94.318 74.629 31.780 1.00 18.24 C ATOM 1200 CG ARG A 166 93.682 75.915 31.315 1.00 26.13 C ATOM 1201 H ARG A 166 95.558 72.370 32.101 1.00 0.00 H ATOM 1202 N PHE A 167 96.854 76.032 30.240 1.00 14.23 N ATOM 1203 CA PHE A 167 97.934 77.012 30.348 1.00 13.31 C ATOM 1204 C PHE A 167 97.335 78.356 29.951 1.00 15.45 C ATOM 1205 O PHE A 167 97.299 78.731 28.780 1.00 13.60 O ATOM 1206 CB PHE A 167 99.117 76.601 29.480 1.00 12.20 C ATOM 1207 CG PHE A 167 100.407 77.277 29.865 1.00 12.70 C ATOM 1208 CD1 PHE A 167 101.207 76.738 30.850 1.00 16.23 C ATOM 1209 CD2 PHE A 167 100.820 78.437 29.252 1.00 14.01 C ATOM 1210 CE1 PHE A 167 102.394 77.359 31.219 1.00 16.96 C ATOM 1211 CE2 PHE A 167 102.004 79.041 29.600 1.00 13.71 C ATOM 1212 CZ PHE A 167 102.790 78.508 30.582 1.00 15.16 C ATOM 1213 H PHE A 167 96.190 76.113 29.444 1.00 0.00 H ATOM 1214 N GLY A 168 96.797 79.064 30.930 1.00 15.46 N ATOM 1215 CA GLY A 168 96.121 80.307 30.654 1.00 16.43 C ATOM 1216 C GLY A 168 94.960 80.092 29.699 1.00 16.09 C ATOM 1217 O GLY A 168 94.053 79.296 29.965 1.00 19.34 O ATOM 1218 H GLY A 168 96.862 78.720 31.909 1.00 0.00 H ATOM 1219 N PRO A 169 94.954 80.806 28.571 1.00 14.27 N ATOM 1220 CA PRO A 169 93.814 80.759 27.651 1.00 13.25 C ATOM 1221 C PRO A 169 93.858 79.609 26.663 1.00 14.35 C ATOM 1222 O PRO A 169 93.017 79.557 25.765 1.00 15.43 O ATOM 1223 CB PRO A 169 93.943 82.105 26.923 1.00 14.96 C ATOM 1224 CG PRO A 169 95.432 82.298 26.837 1.00 15.99 C ATOM 1225 CD PRO A 169 95.958 81.795 28.141 1.00 15.98 C ATOM 1226 N VAL A 170 94.801 78.688 26.812 1.00 12.31 N ATOM 1227 CA VAL A 170 94.884 77.541 25.928 1.00 12.24 C ATOM 1228 C VAL A 170 94.917 76.252 26.728 1.00 13.33 C ATOM 1229 O VAL A 170 95.146 76.228 27.945 1.00 13.79 O ATOM 1230 CB VAL A 170 96.103 77.595 24.991 1.00 12.27 C ATOM 1231 CG1 VAL A 170 96.145 78.912 24.241 1.00 14.59 C ATOM 1232 CG2 VAL A 170 97.402 77.356 25.757 1.00 11.56 C ATOM 1233 H VAL A 170 95.496 78.791 27.579 1.00 0.00 H ATOM 1234 N GLU A 171 94.666 75.163 26.009 1.00 12.81 N ATOM 1235 CA GLU A 171 94.965 73.817 26.471 1.00 12.98 C ATOM 1236 C GLU A 171 96.150 73.280 25.676 1.00 12.10 C ATOM 1237 O GLU A 171 96.207 73.425 24.451 1.00 13.27 O ATOM 1238 CB GLU A 171 93.758 72.903 26.314 1.00 13.49 C ATOM 1239 CG GLU A 171 93.991 71.508 26.853 1.00 15.16 C ATOM 1240 CD GLU A 171 92.722 70.701 26.910 1.00 20.94 C ATOM 1241 OE1 GLU A 171 92.240 70.276 25.836 1.00 20.68 O ATOM 1242 OE2 GLU A 171 92.199 70.513 28.027 1.00 24.39 O ATOM 1243 H GLU A 171 94.235 75.279 25.070 1.00 0.00 H ATOM 1244 N LEU A 172 97.133 72.750 26.386 1.00 12.96 N ATOM 1245 CA LEU A 172 98.274 72.066 25.797 1.00 11.78 C ATOM 1246 C LEU A 172 97.966 70.577 25.805 1.00 12.39 C ATOM 1247 O LEU A 172 97.501 70.034 26.809 1.00 12.93 O ATOM 1248 CB LEU A 172 99.545 72.323 26.615 1.00 11.92 C ATOM 1249 CG LEU A 172 99.867 73.786 26.883 1.00 10.11 C ATOM 1250 CD1 LEU A 172 101.090 73.885 27.731 1.00 12.81 C ATOM 1251 CD2 LEU A 172 100.057 74.549 25.598 1.00 12.62 C ATOM 1252 H LEU A 172 97.087 72.827 27.422 1.00 0.00 H ATOM 1253 N PHE A 173 98.252 69.909 24.698 1.00 12.40 N ATOM 1254 CA PHE A 173 97.906 68.503 24.526 1.00 13.64 C ATOM 1255 C PHE A 173 99.108 67.781 23.947 1.00 12.91 C ATOM 1256 O PHE A 173 99.683 68.234 22.952 1.00 12.67 O ATOM 1257 CB PHE A 173 96.721 68.389 23.550 1.00 12.93 C ATOM 1258 CG PHE A 173 96.202 66.975 23.335 1.00 13.73 C ATOM 1259 CD1 PHE A 173 95.617 66.261 24.367 1.00 14.83 C ATOM 1260 CD2 PHE A 173 96.262 66.388 22.082 1.00 14.83 C ATOM 1261 CE1 PHE A 173 95.101 64.990 24.153 1.00 17.23 C ATOM 1262 CE2 PHE A 173 95.763 65.106 21.875 1.00 16.65 C ATOM 1263 CZ PHE A 173 95.179 64.414 22.907 1.00 17.61 C ATOM 1264 H PHE A 173 98.740 70.404 23.925 1.00 0.00 H ATOM 1265 N TYR A 174 99.477 66.644 24.549 1.00 12.21 N ATOM 1266 CA TYR A 174 100.520 65.809 23.982 1.00 12.94 C ATOM 1267 C TYR A 174 99.842 64.652 23.266 1.00 12.96 C ATOM 1268 O TYR A 174 99.283 63.766 23.928 1.00 14.23 O ATOM 1269 CB TYR A 174 101.472 65.291 25.053 1.00 13.03 C ATOM 1270 CG TYR A 174 102.467 64.289 24.484 1.00 12.93 C ATOM 1271 CD1 TYR A 174 103.220 64.606 23.350 1.00 13.10 C ATOM 1272 CD2 TYR A 174 102.629 63.036 25.047 1.00 13.26 C ATOM 1273 CE1 TYR A 174 104.111 63.691 22.808 1.00 15.21 C ATOM 1274 CE2 TYR A 174 103.512 62.116 24.520 1.00 14.47 C ATOM 1275 CZ TYR A 174 104.247 62.446 23.394 1.00 13.97 C ATOM 1276 OH TYR A 174 105.135 61.533 22.877 1.00 16.74 O ATOM 1277 HH TYR A 174 105.577 61.919 22.080 1.00 0.00 H ATOM 1278 H TYR A 174 99.011 66.356 25.433 1.00 0.00 H ATOM 1279 N PRO A 175 99.826 64.635 21.928 1.00 12.29 N ATOM 1280 CA PRO A 175 99.053 63.609 21.209 1.00 13.99 C ATOM 1281 C PRO A 175 99.772 62.297 21.046 1.00 13.80 C ATOM 1282 O PRO A 175 99.150 61.331 20.574 1.00 16.07 O ATOM 1283 CB PRO A 175 98.863 64.249 19.834 1.00 15.58 C ATOM 1284 CG PRO A 175 100.115 65.044 19.643 1.00 13.86 C ATOM 1285 CD PRO A 175 100.430 65.618 21.006 1.00 14.22 C ATOM 1286 N GLY A 176 101.045 62.235 21.417 1.00 15.10 N ATOM 1287 CA GLY A 176 101.913 61.133 21.066 1.00 14.89 C ATOM 1288 C GLY A 176 102.912 61.542 19.999 1.00 13.47 C ATOM 1289 O GLY A 176 102.847 62.625 19.412 1.00 14.33 O ATOM 1290 H GLY A 176 101.435 63.014 21.985 1.00 0.00 H ATOM 1291 N ALA A 177 103.852 60.643 19.757 1.00 15.65 N ATOM 1292 CA ALA A 177 104.911 60.919 18.808 1.00 15.53 C ATOM 1293 C ALA A 177 104.341 61.061 17.402 1.00 14.96 C ATOM 1294 O ALA A 177 103.414 60.343 17.003 1.00 16.06 O ATOM 1295 CB ALA A 177 105.936 59.792 18.853 1.00 17.23 C ATOM 1296 H ALA A 177 103.830 59.729 20.253 1.00 0.00 H ATOM 1297 N ALA A 178 104.918 61.983 16.648 1.00 14.83 N ATOM 1298 CA ALA A 178 104.474 62.214 15.282 1.00 14.96 C ATOM 1299 C ALA A 178 105.643 62.753 14.472 1.00 14.32 C ATOM 1300 O ALA A 178 106.565 62.002 14.158 1.00 15.91 O ATOM 1301 CB ALA A 178 103.243 63.119 15.274 1.00 14.40 C ATOM 1302 H ALA A 178 105.699 62.550 17.037 1.00 0.00 H ATOM 1303 N HIS A 179 105.633 64.053 14.163 1.00 14.32 N ATOM 1304 CA HIS A 179 106.774 64.696 13.514 1.00 13.80 C ATOM 1305 C HIS A 179 108.017 64.578 14.388 1.00 12.64 C ATOM 1306 O HIS A 179 109.140 64.419 13.884 1.00 14.93 O ATOM 1307 CB HIS A 179 106.408 66.163 13.265 1.00 12.50 C ATOM 1308 CG HIS A 179 107.568 67.073 12.982 1.00 11.96 C ATOM 1309 ND1 HIS A 179 108.130 67.196 11.732 1.00 14.86 N ATOM 1310 CD2 HIS A 179 108.238 67.937 13.781 1.00 12.31 C ATOM 1311 CE1 HIS A 179 109.107 68.088 11.775 1.00 12.99 C ATOM 1312 NE2 HIS A 179 109.197 68.551 13.012 1.00 13.27 N ATOM 1313 H HIS A 179 104.792 64.622 14.390 1.00 0.00 H ATOM 1314 N SER A 180 107.834 64.674 15.707 1.00 13.61 N ATOM 1315 CA SER A 180 108.880 64.428 16.683 1.00 13.66 C ATOM 1316 C SER A 180 108.254 63.680 17.851 1.00 14.30 C ATOM 1317 O SER A 180 107.026 63.584 17.971 1.00 14.76 O ATOM 1318 CB SER A 180 109.529 65.732 17.152 1.00 13.95 C ATOM 1319 OG SER A 180 108.593 66.551 17.826 1.00 13.32 O ATOM 1320 HG SER A 180 108.243 66.068 18.616 1.00 0.00 H ATOM 1321 H SER A 180 106.890 64.940 16.054 1.00 0.00 H ATOM 1322 N THR A 181 109.099 63.125 18.716 1.00 13.98 N ATOM 1323 CA THR A 181 108.541 62.374 19.840 1.00 14.05 C ATOM 1324 C THR A 181 107.892 63.288 20.868 1.00 14.85 C ATOM 1325 O THR A 181 106.994 62.841 21.592 1.00 16.21 O ATOM 1326 CB THR A 181 109.592 61.492 20.514 1.00 18.52 C ATOM 1327 OG1 THR A 181 110.610 62.317 21.073 1.00 20.56 O ATOM 1328 CG2 THR A 181 110.197 60.515 19.526 1.00 18.51 C ATOM 1329 HG1 THR A 181 110.209 62.926 21.742 1.00 0.00 H ATOM 1330 H THR A 181 110.127 63.223 18.596 1.00 0.00 H ATOM 1331 N ASP A 182 108.307 64.555 20.925 1.00 12.66 N ATOM 1332 CA ASP A 182 107.902 65.505 21.947 1.00 12.11 C ATOM 1333 C ASP A 182 106.812 66.464 21.500 1.00 11.17 C ATOM 1334 O ASP A 182 106.409 67.330 22.288 1.00 13.10 O ATOM 1335 CB ASP A 182 109.129 66.304 22.439 1.00 12.19 C ATOM 1336 CG ASP A 182 109.815 67.113 21.332 1.00 11.97 C ATOM 1337 OD1 ASP A 182 109.897 66.618 20.193 1.00 13.28 O ATOM 1338 OD2 ASP A 182 110.310 68.235 21.623 1.00 11.66 O ATOM 1339 H ASP A 182 108.964 64.884 20.189 1.00 0.00 H ATOM 1340 N ASN A 183 106.331 66.374 20.263 1.00 12.19 N ATOM 1341 CA ASN A 183 105.487 67.431 19.733 1.00 10.89 C ATOM 1342 C ASN A 183 104.188 67.599 20.515 1.00 10.45 C ATOM 1343 O ASN A 183 103.507 66.628 20.851 1.00 12.27 O ATOM 1344 CB ASN A 183 105.249 67.311 18.214 1.00 11.19 C ATOM 1345 CG ASN A 183 104.800 65.926 17.719 1.00 13.09 C ATOM 1346 OD1 ASN A 183 105.047 65.614 16.540 1.00 13.28 O ATOM 1347 ND2 ASN A 183 104.133 65.131 18.550 1.00 12.06 N ATOM 1348 HD22 ASN A 183 103.951 65.436 19.527 1.00 0.00 H ATOM 1349 HD21 ASN A 183 103.793 64.204 18.223 1.00 0.00 H ATOM 1350 H ASN A 183 106.559 65.547 19.675 1.00 0.00 H ATOM 1351 N LEU A 184 103.865 68.861 20.796 1.00 11.53 N ATOM 1352 CA LEU A 184 102.626 69.254 21.443 1.00 11.46 C ATOM 1353 C LEU A 184 101.720 69.954 20.445 1.00 12.22 C ATOM 1354 O LEU A 184 102.182 70.574 19.482 1.00 12.68 O ATOM 1355 CB LEU A 184 102.903 70.251 22.573 1.00 11.91 C ATOM 1356 CG LEU A 184 103.843 69.829 23.695 1.00 11.51 C ATOM 1357 CD1 LEU A 184 103.963 70.962 24.705 1.00 13.63 C ATOM 1358 CD2 LEU A 184 103.360 68.589 24.364 1.00 13.66 C ATOM 1359 H LEU A 184 104.540 69.608 20.537 1.00 0.00 H ATOM 1360 N VAL A 185 100.418 69.902 20.724 1.00 11.77 N ATOM 1361 CA VAL A 185 99.452 70.745 20.033 1.00 12.08 C ATOM 1362 C VAL A 185 98.790 71.659 21.062 1.00 11.82 C ATOM 1363 O VAL A 185 98.843 71.428 22.273 1.00 11.63 O ATOM 1364 CB VAL A 185 98.418 69.984 19.165 1.00 16.99 C ATOM 1365 CG1 VAL A 185 99.123 69.022 18.199 1.00 15.14 C ATOM 1366 CG2 VAL A 185 97.430 69.262 19.979 1.00 17.43 C ATOM 1367 H VAL A 185 100.083 69.242 21.454 1.00 0.00 H ATOM 1368 N VAL A 186 98.187 72.733 20.561 1.00 11.64 N ATOM 1369 CA VAL A 186 97.618 73.780 21.399 1.00 12.13 C ATOM 1370 C VAL A 186 96.219 74.089 20.901 1.00 13.51 C ATOM 1371 O VAL A 186 96.015 74.285 19.703 1.00 14.08 O ATOM 1372 CB VAL A 186 98.490 75.041 21.345 1.00 11.15 C ATOM 1373 CG1 VAL A 186 97.916 76.109 22.279 1.00 12.44 C ATOM 1374 CG2 VAL A 186 99.910 74.702 21.739 1.00 11.95 C ATOM 1375 H VAL A 186 98.119 72.830 19.528 1.00 0.00 H ATOM 1376 N TYR A 187 95.253 74.142 21.812 1.00 12.24 N ATOM 1377 CA TYR A 187 93.879 74.477 21.467 1.00 12.04 C ATOM 1378 C TYR A 187 93.464 75.742 22.203 1.00 12.53 C ATOM 1379 O TYR A 187 93.728 75.874 23.402 1.00 13.25 O ATOM 1380 CB TYR A 187 92.920 73.348 21.838 1.00 12.58 C ATOM 1381 CG TYR A 187 91.525 73.495 21.283 1.00 14.15 C ATOM 1382 CD1 TYR A 187 91.304 73.448 19.918 1.00 16.55 C ATOM 1383 CD2 TYR A 187 90.425 73.637 22.120 1.00 15.69 C ATOM 1384 CE1 TYR A 187 90.040 73.557 19.396 1.00 16.77 C ATOM 1385 CE2 TYR A 187 89.144 73.745 21.605 1.00 17.77 C ATOM 1386 CZ TYR A 187 88.960 73.707 20.238 1.00 15.74 C ATOM 1387 OH TYR A 187 87.697 73.798 19.682 1.00 20.92 O ATOM 1388 HH TYR A 187 87.283 74.658 19.945 1.00 0.00 H ATOM 1389 H TYR A 187 95.486 73.937 22.805 1.00 0.00 H ATOM 1390 N VAL A 188 92.791 76.649 21.498 1.00 12.91 N ATOM 1391 CA VAL A 188 92.243 77.861 22.105 1.00 12.70 C ATOM 1392 C VAL A 188 90.735 77.680 22.199 1.00 14.56 C ATOM 1393 O VAL A 188 90.032 77.870 21.203 1.00 15.13 O ATOM 1394 CB VAL A 188 92.575 79.108 21.281 1.00 12.63 C ATOM 1395 CG1 VAL A 188 92.193 80.356 22.067 1.00 13.06 C ATOM 1396 CG2 VAL A 188 94.039 79.112 20.886 1.00 13.55 C ATOM 1397 H VAL A 188 92.650 76.490 20.480 1.00 0.00 H ATOM 1398 N PRO A 189 90.190 77.323 23.362 1.00 14.87 N ATOM 1399 CA PRO A 189 88.771 76.948 23.392 1.00 17.51 C ATOM 1400 C PRO A 189 87.842 78.088 23.035 1.00 18.49 C ATOM 1401 O PRO A 189 86.811 77.873 22.385 1.00 20.90 O ATOM 1402 CB PRO A 189 88.556 76.465 24.832 1.00 21.69 C ATOM 1403 CG PRO A 189 89.883 76.276 25.421 1.00 26.07 C ATOM 1404 CD PRO A 189 90.894 77.016 24.616 1.00 18.36 C ATOM 1405 N SER A 190 88.170 79.304 23.449 1.00 18.06 N ATOM 1406 CA SER A 190 87.256 80.408 23.208 1.00 21.13 C ATOM 1407 C SER A 190 87.098 80.717 21.724 1.00 18.92 C ATOM 1408 O SER A 190 86.097 81.325 21.333 1.00 23.52 O ATOM 1409 CB SER A 190 87.732 81.661 23.940 1.00 25.54 C ATOM 1410 OG SER A 190 88.990 82.081 23.436 1.00 32.08 O ATOM 1411 HG SER A 190 89.654 81.359 23.567 1.00 0.00 H ATOM 1412 H SER A 190 89.072 79.466 23.941 1.00 0.00 H ATOM 1413 N ALA A 191 88.049 80.292 20.889 1.00 18.75 N ATOM 1414 CA ALA A 191 88.040 80.624 19.473 1.00 17.71 C ATOM 1415 C ALA A 191 87.955 79.401 18.576 1.00 18.46 C ATOM 1416 O ALA A 191 87.881 79.549 17.350 1.00 18.86 O ATOM 1417 CB ALA A 191 89.326 81.390 19.127 1.00 20.24 C ATOM 1418 H ALA A 191 88.821 79.704 21.263 1.00 0.00 H ATOM 1419 N SER A 192 87.963 78.200 19.152 1.00 18.01 N ATOM 1420 CA SER A 192 87.948 76.957 18.379 1.00 16.10 C ATOM 1421 C SER A 192 89.120 76.882 17.404 1.00 17.56 C ATOM 1422 O SER A 192 88.971 76.410 16.275 1.00 18.36 O ATOM 1423 CB SER A 192 86.613 76.746 17.658 1.00 22.23 C ATOM 1424 OG SER A 192 85.530 76.748 18.580 1.00 26.29 O ATOM 1425 HG SER A 192 85.502 77.617 19.053 1.00 0.00 H ATOM 1426 H SER A 192 87.981 78.143 20.190 1.00 0.00 H ATOM 1427 N VAL A 193 90.290 77.328 17.850 1.00 14.90 N ATOM 1428 CA VAL A 193 91.508 77.305 17.043 1.00 13.78 C ATOM 1429 C VAL A 193 92.396 76.177 17.539 1.00 13.15 C ATOM 1430 O VAL A 193 92.800 76.153 18.711 1.00 13.80 O ATOM 1431 CB VAL A 193 92.247 78.651 17.110 1.00 13.37 C ATOM 1432 CG1 VAL A 193 93.619 78.554 16.422 1.00 14.06 C ATOM 1433 CG2 VAL A 193 91.420 79.761 16.489 1.00 16.59 C ATOM 1434 H VAL A 193 90.341 77.710 18.816 1.00 0.00 H ATOM 1435 N LEU A 194 92.717 75.255 16.638 1.00 13.79 N ATOM 1436 CA LEU A 194 93.653 74.175 16.906 1.00 13.88 C ATOM 1437 C LEU A 194 94.975 74.485 16.217 1.00 12.85 C ATOM 1438 O LEU A 194 95.046 74.545 14.983 1.00 14.33 O ATOM 1439 CB LEU A 194 93.079 72.844 16.418 1.00 15.13 C ATOM 1440 CG LEU A 194 94.002 71.639 16.560 1.00 14.50 C ATOM 1441 CD1 LEU A 194 94.349 71.357 18.002 1.00 17.10 C ATOM 1442 CD2 LEU A 194 93.363 70.428 15.917 1.00 18.82 C ATOM 1443 H LEU A 194 92.278 75.308 15.697 1.00 0.00 H ATOM 1444 N TYR A 195 96.012 74.686 17.000 1.00 13.33 N ATOM 1445 CA TYR A 195 97.363 74.845 16.478 1.00 11.25 C ATOM 1446 C TYR A 195 98.022 73.475 16.495 1.00 12.90 C ATOM 1447 O TYR A 195 98.356 72.940 17.559 1.00 13.02 O ATOM 1448 CB TYR A 195 98.109 75.840 17.335 1.00 14.43 C ATOM 1449 CG TYR A 195 99.526 76.070 16.976 1.00 12.38 C ATOM 1450 CD1 TYR A 195 99.878 76.952 15.964 1.00 12.08 C ATOM 1451 CD2 TYR A 195 100.532 75.445 17.697 1.00 13.62 C ATOM 1452 CE1 TYR A 195 101.180 77.203 15.679 1.00 13.11 C ATOM 1453 CE2 TYR A 195 101.829 75.691 17.423 1.00 13.46 C ATOM 1454 CZ TYR A 195 102.158 76.570 16.421 1.00 13.82 C ATOM 1455 OH TYR A 195 103.472 76.869 16.184 1.00 14.01 O ATOM 1456 HH TYR A 195 103.870 77.269 16.997 1.00 0.00 H ATOM 1457 H TYR A 195 95.863 74.733 18.028 1.00 0.00 H ATOM 1458 N GLY A 196 98.176 72.894 15.309 1.00 13.38 N ATOM 1459 CA GLY A 196 98.747 71.570 15.182 1.00 13.46 C ATOM 1460 C GLY A 196 100.248 71.544 15.233 1.00 12.38 C ATOM 1461 O GLY A 196 100.820 70.475 15.474 1.00 13.39 O ATOM 1462 H GLY A 196 97.879 73.403 14.452 1.00 0.00 H ATOM 1463 N GLY A 197 100.901 72.683 14.993 1.00 12.48 N ATOM 1464 CA GLY A 197 102.333 72.679 14.891 1.00 12.61 C ATOM 1465 C GLY A 197 102.788 71.714 13.814 1.00 12.91 C ATOM 1466 O GLY A 197 102.072 71.403 12.853 1.00 13.23 O ATOM 1467 H GLY A 197 100.373 73.572 14.880 1.00 0.00 H ATOM 1468 N CYS A 198 104.017 71.232 13.969 1.00 11.59 N ATOM 1469 CA CYS A 198 104.656 70.513 12.878 1.00 12.26 C ATOM 1470 C CYS A 198 104.178 69.075 12.740 1.00 12.10 C ATOM 1471 O CYS A 198 104.530 68.419 11.760 1.00 14.03 O ATOM 1472 CB CYS A 198 106.170 70.644 13.025 1.00 12.85 C ATOM 1473 SG CYS A 198 106.642 72.401 13.007 1.00 12.47 S ATOM 1474 H CYS A 198 104.521 71.369 14.869 1.00 0.00 H ATOM 1475 N ALA A 199 103.356 68.592 13.671 1.00 12.21 N ATOM 1476 CA ALA A 199 102.669 67.321 13.485 1.00 12.26 C ATOM 1477 C ALA A 199 101.581 67.377 12.417 1.00 14.30 C ATOM 1478 O ALA A 199 101.085 66.323 12.008 1.00 14.80 O ATOM 1479 CB ALA A 199 102.052 66.908 14.821 1.00 14.23 C ATOM 1480 H ALA A 199 103.202 69.132 14.546 1.00 0.00 H ATOM 1481 N ILE A 200 101.193 68.570 11.960 1.00 13.33 N ATOM 1482 CA ILE A 200 100.136 68.730 10.968 1.00 14.29 C ATOM 1483 C ILE A 200 100.731 69.437 9.762 1.00 14.55 C ATOM 1484 O ILE A 200 101.353 70.502 9.900 1.00 14.12 O ATOM 1485 CB ILE A 200 98.936 69.516 11.532 1.00 14.09 C ATOM 1486 CG1 ILE A 200 98.327 68.804 12.745 1.00 15.29 C ATOM 1487 CG2 ILE A 200 97.893 69.722 10.453 1.00 15.95 C ATOM 1488 CD1 ILE A 200 97.824 67.403 12.459 1.00 17.94 C ATOM 1489 H ILE A 200 101.665 69.421 12.327 1.00 0.00 H ATOM 1490 N TYR A 201 100.539 68.846 8.583 1.00 14.62 N ATOM 1491 CA TYR A 201 100.997 69.419 7.329 1.00 15.99 C ATOM 1492 C TYR A 201 99.896 70.244 6.673 1.00 15.93 C ATOM 1493 O TYR A 201 98.704 69.927 6.772 1.00 17.60 O ATOM 1494 CB TYR A 201 101.350 68.282 6.381 1.00 17.66 C ATOM 1495 CG TYR A 201 102.651 67.542 6.637 1.00 17.29 C ATOM 1496 CD1 TYR A 201 103.691 68.114 7.350 1.00 19.65 C ATOM 1497 CD2 TYR A 201 102.843 66.267 6.132 1.00 20.30 C ATOM 1498 CE1 TYR A 201 104.892 67.440 7.534 1.00 20.53 C ATOM 1499 CE2 TYR A 201 104.028 65.590 6.324 1.00 22.38 C ATOM 1500 CZ TYR A 201 105.051 66.183 7.016 1.00 18.34 C ATOM 1501 OH TYR A 201 106.242 65.521 7.171 1.00 18.64 O ATOM 1502 HH TYR A 201 106.867 66.086 7.691 1.00 0.00 H ATOM 1503 H TYR A 201 100.039 67.934 8.560 1.00 0.00 H ATOM 1504 N GLU A 202 100.310 71.301 5.973 1.00 16.18 N ATOM 1505 CA GLU A 202 99.389 72.027 5.114 1.00 16.86 C ATOM 1506 C GLU A 202 98.972 71.158 3.926 1.00 19.49 C ATOM 1507 O GLU A 202 99.672 70.226 3.518 1.00 18.69 O ATOM 1508 CB GLU A 202 100.016 73.336 4.614 1.00 16.22 C ATOM 1509 CG GLU A 202 101.158 73.169 3.603 1.00 18.37 C ATOM 1510 CD GLU A 202 101.575 74.466 2.954 1.00 19.98 C ATOM 1511 OE1 GLU A 202 100.716 75.368 2.724 1.00 19.65 O ATOM 1512 OE2 GLU A 202 102.769 74.573 2.594 1.00 23.87 O ATOM 1513 H GLU A 202 101.301 71.609 6.042 1.00 0.00 H ATOM 1514 N LEU A 203 97.825 71.512 3.348 1.00 18.76 N ATOM 1515 CA LEU A 203 97.249 70.732 2.253 1.00 19.02 C ATOM 1516 C LEU A 203 98.199 70.593 1.068 1.00 23.64 C ATOM 1517 O LEU A 203 98.232 69.544 0.411 1.00 24.70 O ATOM 1518 CB LEU A 203 95.970 71.402 1.775 1.00 23.01 C ATOM 1519 CG LEU A 203 94.668 71.223 2.544 1.00 35.40 C ATOM 1520 CD1 LEU A 203 93.534 71.689 1.637 1.00 37.71 C ATOM 1521 CD2 LEU A 203 94.453 69.766 2.982 1.00 37.51 C ATOM 1522 H LEU A 203 97.328 72.362 3.683 1.00 0.00 H ATOM 1523 N SER A 204 98.937 71.649 0.737 1.00 20.29 N ATOM 1524 CA SER A 204 99.747 71.607 -0.472 1.00 23.64 C ATOM 1525 C SER A 204 101.007 70.769 -0.308 1.00 22.41 C ATOM 1526 O SER A 204 101.689 70.512 -1.307 1.00 26.68 O ATOM 1527 CB SER A 204 100.119 73.020 -0.916 1.00 27.09 C ATOM 1528 OG SER A 204 100.962 73.615 0.042 1.00 26.96 O ATOM 1529 HG SER A 204 101.199 74.530 -0.252 1.00 0.00 H ATOM 1530 H SER A 204 98.935 72.498 1.337 1.00 0.00 H ATOM 1531 N ARG A 205 101.324 70.331 0.909 1.00 20.73 N ATOM 1532 CA ARG A 205 102.445 69.422 1.160 1.00 22.09 C ATOM 1533 C ARG A 205 101.931 68.001 0.959 1.00 26.22 C ATOM 1534 O ARG A 205 101.251 67.449 1.830 1.00 27.22 O ATOM 1535 CB ARG A 205 102.975 69.626 2.575 1.00 21.76 C ATOM 1536 CG ARG A 205 104.073 68.641 3.011 1.00 26.75 C ATOM 1537 CD ARG A 205 105.333 68.793 2.181 1.00 22.75 C ATOM 1538 NE ARG A 205 105.747 70.189 2.094 1.00 19.91 N ATOM 1539 CZ ARG A 205 106.572 70.665 1.170 1.00 23.22 C ATOM 1540 NH1 ARG A 205 107.074 69.858 0.239 1.00 26.37 N ATOM 1541 NH2 ARG A 205 106.892 71.956 1.181 1.00 25.92 N ATOM 1542 HE ARG A 205 105.372 70.853 2.801 1.00 0.00 H ATOM 1543 HH12 ARG A 205 107.720 70.236 -0.483 1.00 0.00 H ATOM 1544 HH11 ARG A 205 106.820 68.849 0.233 1.00 0.00 H ATOM 1545 HH22 ARG A 205 107.538 72.338 0.461 1.00 0.00 H ATOM 1546 HH21 ARG A 205 106.496 72.584 1.910 1.00 0.00 H ATOM 1547 H ARG A 205 100.751 70.648 1.717 1.00 0.00 H ATOM 1548 N THR A 206 102.286 67.396 -0.173 1.00 25.48 N ATOM 1549 CA THR A 206 101.739 66.103 -0.567 1.00 23.36 C ATOM 1550 C THR A 206 102.710 64.943 -0.408 1.00 29.63 C ATOM 1551 O THR A 206 102.341 63.802 -0.720 1.00 31.31 O ATOM 1552 CB THR A 206 101.248 66.160 -2.016 1.00 28.32 C ATOM 1553 OG1 THR A 206 102.338 66.495 -2.883 1.00 29.23 O ATOM 1554 CG2 THR A 206 100.142 67.194 -2.162 1.00 32.51 C ATOM 1555 HG1 THR A 206 102.704 67.378 -2.625 1.00 0.00 H ATOM 1556 H THR A 206 102.976 67.861 -0.797 1.00 0.00 H ATOM 1557 N SER A 207 103.934 65.193 0.046 1.00 27.01 N ATOM 1558 CA SER A 207 104.863 64.126 0.379 1.00 27.08 C ATOM 1559 C SER A 207 105.519 64.471 1.705 1.00 24.22 C ATOM 1560 O SER A 207 105.619 65.644 2.085 1.00 23.55 O ATOM 1561 CB SER A 207 105.932 63.923 -0.702 1.00 29.47 C ATOM 1562 OG SER A 207 106.682 65.104 -0.890 1.00 43.84 O ATOM 1563 HG SER A 207 107.365 64.952 -1.590 1.00 0.00 H ATOM 1564 H SER A 207 104.236 66.181 0.166 1.00 0.00 H ATOM 1565 N ALA A 208 105.929 63.434 2.430 1.00 24.77 N ATOM 1566 CA ALA A 208 106.470 63.644 3.764 1.00 23.92 C ATOM 1567 C ALA A 208 107.726 64.492 3.669 1.00 22.58 C ATOM 1568 O ALA A 208 108.510 64.365 2.724 1.00 26.84 O ATOM 1569 CB ALA A 208 106.807 62.299 4.409 1.00 28.11 C ATOM 1570 H ALA A 208 105.863 62.471 2.042 1.00 0.00 H ATOM 1571 N GLY A 209 107.912 65.362 4.652 1.00 22.68 N ATOM 1572 CA GLY A 209 109.119 66.156 4.742 1.00 24.40 C ATOM 1573 C GLY A 209 110.176 65.501 5.604 1.00 22.21 C ATOM 1574 O GLY A 209 110.522 64.326 5.417 1.00 26.47 O ATOM 1575 H GLY A 209 107.174 65.477 5.375 1.00 0.00 H ATOM 1576 N ASN A 210 110.688 66.257 6.570 1.00 21.24 N ATOM 1577 CA ASN A 210 111.724 65.753 7.461 1.00 21.31 C ATOM 1578 C ASN A 210 111.119 64.705 8.389 1.00 20.27 C ATOM 1579 O ASN A 210 110.271 65.020 9.231 1.00 21.17 O ATOM 1580 CB ASN A 210 112.294 66.925 8.256 1.00 19.82 C ATOM 1581 CG ASN A 210 113.282 66.483 9.328 1.00 22.94 C ATOM 1582 OD1 ASN A 210 113.912 65.429 9.206 1.00 24.67 O ATOM 1583 ND2 ASN A 210 113.413 67.282 10.386 1.00 24.36 N ATOM 1584 HD22 ASN A 210 112.861 68.161 10.445 1.00 0.00 H ATOM 1585 HD21 ASN A 210 114.068 67.027 11.153 1.00 0.00 H ATOM 1586 H ASN A 210 110.341 67.230 6.692 1.00 0.00 H ATOM 1587 N VAL A 211 111.551 63.458 8.238 1.00 22.70 N ATOM 1588 CA VAL A 211 111.106 62.375 9.103 1.00 23.20 C ATOM 1589 C VAL A 211 112.238 61.862 9.975 1.00 21.07 C ATOM 1590 O VAL A 211 112.092 60.825 10.634 1.00 23.17 O ATOM 1591 CB VAL A 211 110.443 61.240 8.301 1.00 25.31 C ATOM 1592 CG1 VAL A 211 109.227 61.779 7.543 1.00 30.98 C ATOM 1593 CG2 VAL A 211 111.436 60.617 7.342 1.00 28.47 C ATOM 1594 H VAL A 211 112.229 63.249 7.477 1.00 0.00 H ATOM 1595 N ALA A 212 113.372 62.572 10.007 1.00 22.98 N ATOM 1596 CA ALA A 212 114.531 62.054 10.723 1.00 23.05 C ATOM 1597 C ALA A 212 114.226 61.871 12.201 1.00 19.93 C ATOM 1598 O ALA A 212 114.748 60.936 12.826 1.00 25.04 O ATOM 1599 CB ALA A 212 115.733 62.977 10.543 1.00 25.96 C ATOM 1600 H ALA A 212 113.426 63.491 9.522 1.00 0.00 H ATOM 1601 N ASP A 213 113.369 62.721 12.764 1.00 18.09 N ATOM 1602 CA ASP A 213 113.016 62.659 14.174 1.00 16.87 C ATOM 1603 C ASP A 213 111.598 62.138 14.388 1.00 16.63 C ATOM 1604 O ASP A 213 111.108 62.133 15.521 1.00 17.14 O ATOM 1605 CB ASP A 213 113.218 64.030 14.827 1.00 18.03 C ATOM 1606 CG ASP A 213 114.674 64.452 14.813 1.00 21.85 C ATOM 1607 OD1 ASP A 213 115.544 63.562 14.837 1.00 24.52 O ATOM 1608 OD2 ASP A 213 114.979 65.660 14.737 1.00 17.94 O ATOM 1609 H ASP A 213 112.935 63.458 12.172 1.00 0.00 H ATOM 1610 N ALA A 214 110.944 61.667 13.335 1.00 18.09 N ATOM 1611 CA ALA A 214 109.545 61.280 13.417 1.00 18.46 C ATOM 1612 C ALA A 214 109.383 59.822 13.830 1.00 18.78 C ATOM 1613 O ALA A 214 110.301 59.006 13.733 1.00 21.44 O ATOM 1614 CB ALA A 214 108.859 61.487 12.068 1.00 19.92 C ATOM 1615 H ALA A 214 111.444 61.572 12.428 1.00 0.00 H ATOM 1616 N ASP A 215 108.178 59.513 14.292 1.00 18.47 N ATOM 1617 CA ASP A 215 107.721 58.150 14.521 1.00 19.55 C ATOM 1618 C ASP A 215 106.592 57.907 13.519 1.00 20.43 C ATOM 1619 O ASP A 215 105.425 58.214 13.780 1.00 19.45 O ATOM 1620 CB ASP A 215 107.243 57.994 15.954 1.00 19.85 C ATOM 1621 CG ASP A 215 106.967 56.539 16.311 1.00 23.33 C ATOM 1622 OD1 ASP A 215 106.628 55.747 15.402 1.00 25.98 O ATOM 1623 OD2 ASP A 215 107.095 56.196 17.508 1.00 31.22 O ATOM 1624 H ASP A 215 107.521 60.291 14.503 1.00 0.00 H ATOM 1625 N LEU A 216 106.952 57.379 12.353 1.00 19.98 N ATOM 1626 CA LEU A 216 105.971 57.208 11.289 1.00 23.05 C ATOM 1627 C LEU A 216 104.878 56.220 11.669 1.00 21.02 C ATOM 1628 O LEU A 216 103.726 56.390 11.253 1.00 23.94 O ATOM 1629 CB LEU A 216 106.671 56.747 10.013 1.00 23.75 C ATOM 1630 CG LEU A 216 107.609 57.790 9.405 1.00 25.94 C ATOM 1631 CD1 LEU A 216 108.478 57.135 8.363 1.00 33.53 C ATOM 1632 CD2 LEU A 216 106.816 58.921 8.794 1.00 26.28 C ATOM 1633 H LEU A 216 107.938 57.087 12.200 1.00 0.00 H ATOM 1634 N ALA A 217 105.207 55.180 12.440 1.00 22.17 N ATOM 1635 CA ALA A 217 104.188 54.209 12.817 1.00 23.72 C ATOM 1636 C ALA A 217 103.161 54.810 13.765 1.00 25.64 C ATOM 1637 O ALA A 217 101.973 54.478 13.691 1.00 24.65 O ATOM 1638 CB ALA A 217 104.838 52.976 13.433 1.00 25.61 C ATOM 1639 H ALA A 217 106.186 55.064 12.770 1.00 0.00 H ATOM 1640 N GLU A 218 103.594 55.696 14.666 1.00 18.62 N ATOM 1641 CA GLU A 218 102.696 56.276 15.660 1.00 17.68 C ATOM 1642 C GLU A 218 101.947 57.498 15.142 1.00 15.91 C ATOM 1643 O GLU A 218 100.874 57.814 15.659 1.00 17.94 O ATOM 1644 CB GLU A 218 103.500 56.690 16.899 1.00 20.58 C ATOM 1645 CG GLU A 218 102.684 57.132 18.086 1.00 25.57 C ATOM 1646 CD GLU A 218 101.841 56.024 18.661 1.00 32.73 C ATOM 1647 OE1 GLU A 218 100.910 56.335 19.430 1.00 41.62 O ATOM 1648 OE2 GLU A 218 102.121 54.857 18.339 1.00 25.53 O ATOM 1649 H GLU A 218 104.595 55.979 14.659 1.00 0.00 H ATOM 1650 N TRP A 219 102.496 58.204 14.152 1.00 16.15 N ATOM 1651 CA TRP A 219 101.944 59.495 13.743 1.00 15.89 C ATOM 1652 C TRP A 219 100.465 59.411 13.407 1.00 17.57 C ATOM 1653 O TRP A 219 99.697 60.256 13.887 1.00 16.09 O ATOM 1654 CB TRP A 219 102.815 60.005 12.586 1.00 15.83 C ATOM 1655 CG TRP A 219 102.711 61.442 12.201 1.00 15.34 C ATOM 1656 CD1 TRP A 219 101.666 62.300 12.401 1.00 15.73 C ATOM 1657 CD2 TRP A 219 103.724 62.194 11.528 1.00 14.66 C ATOM 1658 NE1 TRP A 219 101.975 63.550 11.886 1.00 15.55 N ATOM 1659 CE2 TRP A 219 103.235 63.498 11.350 1.00 14.15 C ATOM 1660 CE3 TRP A 219 105.003 61.883 11.056 1.00 15.27 C ATOM 1661 CZ2 TRP A 219 103.983 64.495 10.725 1.00 15.75 C ATOM 1662 CZ3 TRP A 219 105.740 62.871 10.429 1.00 16.83 C ATOM 1663 CH2 TRP A 219 105.227 64.150 10.257 1.00 16.16 C ATOM 1664 HE1 TRP A 219 101.356 64.385 11.904 1.00 0.00 H ATOM 1665 H TRP A 219 103.333 57.829 13.662 1.00 0.00 H ATOM 1666 N PRO A 220 99.985 58.423 12.647 1.00 17.83 N ATOM 1667 CA PRO A 220 98.536 58.374 12.396 1.00 17.74 C ATOM 1668 C PRO A 220 97.711 58.236 13.659 1.00 18.94 C ATOM 1669 O PRO A 220 96.646 58.859 13.771 1.00 19.00 O ATOM 1670 CB PRO A 220 98.383 57.154 11.478 1.00 19.41 C ATOM 1671 CG PRO A 220 99.714 56.984 10.845 1.00 25.05 C ATOM 1672 CD PRO A 220 100.709 57.386 11.892 1.00 18.94 C ATOM 1673 N THR A 221 98.180 57.432 14.621 1.00 18.29 N ATOM 1674 CA THR A 221 97.446 57.263 15.871 1.00 17.28 C ATOM 1675 C THR A 221 97.449 58.549 16.679 1.00 16.66 C ATOM 1676 O THR A 221 96.437 58.908 17.289 1.00 16.71 O ATOM 1677 CB THR A 221 98.049 56.113 16.667 1.00 18.86 C ATOM 1678 OG1 THR A 221 98.026 54.933 15.863 1.00 21.26 O ATOM 1679 CG2 THR A 221 97.238 55.866 17.934 1.00 20.41 C ATOM 1680 HG1 THR A 221 98.417 54.180 16.373 1.00 0.00 H ATOM 1681 H THR A 221 99.075 56.923 14.476 1.00 0.00 H ATOM 1682 N SER A 222 98.572 59.259 16.692 1.00 14.75 N ATOM 1683 CA SER A 222 98.617 60.546 17.377 1.00 14.98 C ATOM 1684 C SER A 222 97.610 61.526 16.776 1.00 15.00 C ATOM 1685 O SER A 222 96.938 62.265 17.510 1.00 14.93 O ATOM 1686 CB SER A 222 100.045 61.087 17.350 1.00 14.81 C ATOM 1687 OG SER A 222 100.910 60.162 17.982 1.00 15.42 O ATOM 1688 HG SER A 222 101.836 60.513 17.965 1.00 0.00 H ATOM 1689 H SER A 222 99.421 58.896 16.213 1.00 0.00 H ATOM 1690 N ILE A 223 97.482 61.544 15.448 1.00 15.74 N ATOM 1691 CA ILE A 223 96.470 62.388 14.814 1.00 15.57 C ATOM 1692 C ILE A 223 95.065 61.941 15.215 1.00 15.35 C ATOM 1693 O ILE A 223 94.185 62.778 15.453 1.00 16.63 O ATOM 1694 CB ILE A 223 96.674 62.431 13.288 1.00 15.61 C ATOM 1695 CG1 ILE A 223 97.928 63.252 12.976 1.00 17.34 C ATOM 1696 CG2 ILE A 223 95.451 63.033 12.578 1.00 16.03 C ATOM 1697 CD1 ILE A 223 98.359 63.211 11.531 1.00 20.90 C ATOM 1698 H ILE A 223 98.106 60.954 14.860 1.00 0.00 H ATOM 1699 N GLU A 224 94.816 60.622 15.295 1.00 15.97 N ATOM 1700 CA GLU A 224 93.522 60.156 15.797 1.00 17.18 C ATOM 1701 C GLU A 224 93.220 60.721 17.176 1.00 17.12 C ATOM 1702 O GLU A 224 92.075 61.062 17.476 1.00 18.10 O ATOM 1703 CB GLU A 224 93.479 58.629 15.871 1.00 19.44 C ATOM 1704 CG GLU A 224 93.519 57.917 14.544 1.00 21.90 C ATOM 1705 CD GLU A 224 93.513 56.418 14.702 1.00 25.72 C ATOM 1706 OE1 GLU A 224 93.240 55.926 15.828 1.00 27.59 O ATOM 1707 OE2 GLU A 224 93.755 55.722 13.691 1.00 31.92 O ATOM 1708 H GLU A 224 95.540 59.935 15.001 1.00 0.00 H ATOM 1709 N ARG A 225 94.233 60.819 18.038 1.00 17.29 N ATOM 1710 CA ARG A 225 94.003 61.391 19.361 1.00 16.17 C ATOM 1711 C ARG A 225 93.618 62.862 19.271 1.00 17.46 C ATOM 1712 O ARG A 225 92.743 63.321 20.016 1.00 18.54 O ATOM 1713 CB ARG A 225 95.246 61.222 20.249 1.00 17.95 C ATOM 1714 CG ARG A 225 95.607 59.767 20.568 1.00 19.76 C ATOM 1715 CD ARG A 225 96.590 59.602 21.760 1.00 22.72 C ATOM 1716 NE ARG A 225 97.089 58.222 21.815 1.00 23.73 N ATOM 1717 CZ ARG A 225 98.154 57.773 21.147 1.00 22.33 C ATOM 1718 NH1 ARG A 225 98.890 58.572 20.405 1.00 22.70 N ATOM 1719 NH2 ARG A 225 98.503 56.490 21.230 1.00 28.22 N ATOM 1720 HE ARG A 225 96.576 57.547 22.417 1.00 0.00 H ATOM 1721 HH12 ARG A 225 99.714 58.195 19.895 1.00 0.00 H ATOM 1722 HH11 ARG A 225 98.647 59.580 20.328 1.00 0.00 H ATOM 1723 HH22 ARG A 225 99.333 56.142 20.709 1.00 0.00 H ATOM 1724 HH21 ARG A 225 97.945 55.836 21.816 1.00 0.00 H ATOM 1725 H ARG A 225 95.182 60.490 17.769 1.00 0.00 H ATOM 1726 N ILE A 226 94.264 63.613 18.376 1.00 15.58 N ATOM 1727 CA ILE A 226 93.929 65.025 18.186 1.00 15.69 C ATOM 1728 C ILE A 226 92.484 65.165 17.731 1.00 16.06 C ATOM 1729 O ILE A 226 91.714 65.949 18.290 1.00 17.65 O ATOM 1730 CB ILE A 226 94.887 65.676 17.175 1.00 15.02 C ATOM 1731 CG1 ILE A 226 96.327 65.596 17.670 1.00 15.33 C ATOM 1732 CG2 ILE A 226 94.481 67.149 16.930 1.00 15.61 C ATOM 1733 CD1 ILE A 226 97.347 65.999 16.629 1.00 15.84 C ATOM 1734 H ILE A 226 95.020 63.187 17.803 1.00 0.00 H ATOM 1735 N GLN A 227 92.087 64.386 16.712 1.00 15.71 N ATOM 1736 CA GLN A 227 90.713 64.434 16.229 1.00 16.67 C ATOM 1737 C GLN A 227 89.731 64.108 17.347 1.00 19.31 C ATOM 1738 O GLN A 227 88.700 64.771 17.496 1.00 20.95 O ATOM 1739 CB GLN A 227 90.538 63.461 15.059 1.00 19.96 C ATOM 1740 CG GLN A 227 89.095 63.228 14.619 1.00 24.90 C ATOM 1741 CD GLN A 227 88.412 64.451 14.031 1.00 40.04 C ATOM 1742 OE1 GLN A 227 87.311 64.826 14.452 1.00 41.20 O ATOM 1743 NE2 GLN A 227 89.034 65.049 13.022 1.00 34.75 N ATOM 1744 HE22 GLN A 227 89.959 64.699 12.701 1.00 0.00 H ATOM 1745 HE21 GLN A 227 88.596 65.867 12.553 1.00 0.00 H ATOM 1746 H GLN A 227 92.768 63.741 16.262 1.00 0.00 H ATOM 1747 N GLN A 228 90.033 63.084 18.150 1.00 18.37 N ATOM 1748 CA GLN A 228 89.118 62.687 19.212 1.00 20.73 C ATOM 1749 C GLN A 228 88.958 63.798 20.246 1.00 20.09 C ATOM 1750 O GLN A 228 87.874 63.976 20.819 1.00 21.83 O ATOM 1751 CB GLN A 228 89.655 61.415 19.863 1.00 22.21 C ATOM 1752 CG GLN A 228 88.925 60.952 21.113 1.00 24.69 C ATOM 1753 CD GLN A 228 87.552 60.435 20.812 1.00 32.34 C ATOM 1754 OE1 GLN A 228 87.265 60.009 19.693 1.00 42.94 O ATOM 1755 NE2 GLN A 228 86.681 60.460 21.816 1.00 42.77 N ATOM 1756 HE22 GLN A 228 86.969 60.829 22.745 1.00 0.00 H ATOM 1757 HE21 GLN A 228 85.712 60.110 21.673 1.00 0.00 H ATOM 1758 H GLN A 228 90.926 62.568 18.016 1.00 0.00 H ATOM 1759 N HIS A 229 90.037 64.522 20.527 1.00 18.46 N ATOM 1760 CA HIS A 229 90.026 65.515 21.597 1.00 18.45 C ATOM 1761 C HIS A 229 89.435 66.847 21.158 1.00 18.25 C ATOM 1762 O HIS A 229 88.814 67.537 21.980 1.00 20.06 O ATOM 1763 CB HIS A 229 91.447 65.735 22.120 1.00 23.04 C ATOM 1764 CG HIS A 229 91.509 65.994 23.593 1.00 25.85 C ATOM 1765 ND1 HIS A 229 91.550 64.983 24.528 1.00 28.93 N ATOM 1766 CD2 HIS A 229 91.541 67.155 24.292 1.00 32.07 C ATOM 1767 CE1 HIS A 229 91.593 65.510 25.740 1.00 43.53 C ATOM 1768 NE2 HIS A 229 91.584 66.827 25.625 1.00 35.38 N ATOM 1769 H HIS A 229 90.906 64.378 19.974 1.00 0.00 H ATOM 1770 N TYR A 230 89.605 67.211 19.883 1.00 17.83 N ATOM 1771 CA TYR A 230 89.243 68.544 19.386 1.00 17.18 C ATOM 1772 C TYR A 230 88.334 68.459 18.159 1.00 19.17 C ATOM 1773 O TYR A 230 88.611 69.068 17.124 1.00 20.67 O ATOM 1774 CB TYR A 230 90.500 69.359 19.088 1.00 18.18 C ATOM 1775 CG TYR A 230 91.367 69.504 20.310 1.00 17.08 C ATOM 1776 CD1 TYR A 230 90.904 70.167 21.427 1.00 15.79 C ATOM 1777 CD2 TYR A 230 92.640 68.964 20.347 1.00 18.36 C ATOM 1778 CE1 TYR A 230 91.673 70.294 22.551 1.00 18.35 C ATOM 1779 CE2 TYR A 230 93.424 69.077 21.478 1.00 18.49 C ATOM 1780 CZ TYR A 230 92.942 69.741 22.570 1.00 19.35 C ATOM 1781 OH TYR A 230 93.709 69.866 23.702 1.00 21.82 O ATOM 1782 HH TYR A 230 93.204 70.372 24.387 1.00 0.00 H ATOM 1783 H TYR A 230 90.010 66.523 19.217 1.00 0.00 H ATOM 1784 N PRO A 231 87.218 67.727 18.253 1.00 20.55 N ATOM 1785 CA PRO A 231 86.331 67.567 17.087 1.00 23.28 C ATOM 1786 C PRO A 231 85.608 68.837 16.673 1.00 26.44 C ATOM 1787 O PRO A 231 85.038 68.866 15.572 1.00 27.04 O ATOM 1788 CB PRO A 231 85.336 66.503 17.557 1.00 26.88 C ATOM 1789 CG PRO A 231 85.277 66.697 19.036 1.00 24.33 C ATOM 1790 CD PRO A 231 86.691 67.023 19.436 1.00 21.77 C ATOM 1791 N GLU A 232 85.581 69.867 17.517 1.00 24.68 N ATOM 1792 CA GLU A 232 84.876 71.106 17.215 1.00 23.95 C ATOM 1793 C GLU A 232 85.803 72.188 16.673 1.00 23.03 C ATOM 1794 O GLU A 232 85.362 73.327 16.488 1.00 24.69 O ATOM 1795 CB GLU A 232 84.150 71.625 18.459 1.00 27.29 C ATOM 1796 CG GLU A 232 83.014 70.752 18.938 1.00 40.19 C ATOM 1797 CD GLU A 232 82.283 71.360 20.132 1.00 49.17 C ATOM 1798 OE1 GLU A 232 82.963 71.883 21.047 1.00 55.90 O ATOM 1799 OE2 GLU A 232 81.032 71.323 20.150 1.00 55.43 O ATOM 1800 H GLU A 232 86.081 69.784 18.425 1.00 0.00 H ATOM 1801 N ALA A 233 87.060 71.862 16.401 1.00 19.55 N ATOM 1802 CA ALA A 233 87.994 72.866 15.902 1.00 18.04 C ATOM 1803 C ALA A 233 87.488 73.434 14.581 1.00 22.51 C ATOM 1804 O ALA A 233 87.088 72.690 13.680 1.00 23.03 O ATOM 1805 CB ALA A 233 89.370 72.246 15.701 1.00 19.03 C ATOM 1806 H ALA A 233 87.382 70.884 16.544 1.00 0.00 H ATOM 1807 N GLN A 234 87.494 74.762 14.474 1.00 19.23 N ATOM 1808 CA GLN A 234 87.093 75.449 13.251 1.00 20.27 C ATOM 1809 C GLN A 234 88.268 75.914 12.405 1.00 20.76 C ATOM 1810 O GLN A 234 88.109 76.118 11.201 1.00 24.87 O ATOM 1811 CB GLN A 234 86.226 76.663 13.592 1.00 22.67 C ATOM 1812 CG GLN A 234 84.913 76.307 14.254 1.00 27.96 C ATOM 1813 CD GLN A 234 84.114 77.537 14.638 1.00 35.70 C ATOM 1814 OE1 GLN A 234 84.392 78.645 14.168 1.00 43.27 O ATOM 1815 NE2 GLN A 234 83.115 77.350 15.496 1.00 42.60 N ATOM 1816 HE22 GLN A 234 82.918 76.398 15.865 1.00 0.00 H ATOM 1817 HE21 GLN A 234 82.531 78.156 15.797 1.00 0.00 H ATOM 1818 H GLN A 234 87.795 75.329 15.292 1.00 0.00 H ATOM 1819 N PHE A 235 89.424 76.127 13.008 1.00 17.35 N ATOM 1820 CA PHE A 235 90.622 76.547 12.315 1.00 16.69 C ATOM 1821 C PHE A 235 91.743 75.632 12.767 1.00 17.20 C ATOM 1822 O PHE A 235 91.854 75.327 13.960 1.00 18.75 O ATOM 1823 CB PHE A 235 90.998 77.978 12.712 1.00 17.68 C ATOM 1824 CG PHE A 235 89.868 78.961 12.613 1.00 19.56 C ATOM 1825 CD1 PHE A 235 89.017 79.182 13.684 1.00 22.91 C ATOM 1826 CD2 PHE A 235 89.659 79.674 11.448 1.00 27.15 C ATOM 1827 CE1 PHE A 235 87.977 80.089 13.593 1.00 27.51 C ATOM 1828 CE2 PHE A 235 88.622 80.586 11.353 1.00 28.28 C ATOM 1829 CZ PHE A 235 87.781 80.792 12.425 1.00 25.83 C ATOM 1830 H PHE A 235 89.475 75.985 14.037 1.00 0.00 H ATOM 1831 N VAL A 236 92.553 75.165 11.824 1.00 15.20 N ATOM 1832 CA VAL A 236 93.687 74.304 12.126 1.00 13.54 C ATOM 1833 C VAL A 236 94.932 74.923 11.512 1.00 14.36 C ATOM 1834 O VAL A 236 94.982 75.155 10.295 1.00 15.59 O ATOM 1835 CB VAL A 236 93.486 72.861 11.639 1.00 15.27 C ATOM 1836 CG1 VAL A 236 94.703 72.028 11.966 1.00 16.71 C ATOM 1837 CG2 VAL A 236 92.244 72.257 12.279 1.00 16.95 C ATOM 1838 H VAL A 236 92.370 75.424 10.833 1.00 0.00 H ATOM 1839 N ILE A 237 95.915 75.219 12.353 1.00 13.40 N ATOM 1840 CA ILE A 237 97.142 75.884 11.930 1.00 14.18 C ATOM 1841 C ILE A 237 98.236 74.823 11.845 1.00 11.84 C ATOM 1842 O ILE A 237 98.480 74.122 12.841 1.00 14.91 O ATOM 1843 CB ILE A 237 97.541 77.001 12.903 1.00 15.43 C ATOM 1844 CG1 ILE A 237 96.337 77.890 13.259 1.00 13.03 C ATOM 1845 CG2 ILE A 237 98.673 77.824 12.310 1.00 15.35 C ATOM 1846 CD1 ILE A 237 95.587 78.500 12.073 1.00 14.37 C ATOM 1847 H ILE A 237 95.806 74.966 13.356 1.00 0.00 H ATOM 1848 N PRO A 238 98.909 74.671 10.713 1.00 12.60 N ATOM 1849 CA PRO A 238 100.072 73.782 10.646 1.00 12.69 C ATOM 1850 C PRO A 238 101.334 74.546 11.058 1.00 12.73 C ATOM 1851 O PRO A 238 101.366 75.771 11.106 1.00 14.35 O ATOM 1852 CB PRO A 238 100.106 73.407 9.155 1.00 13.58 C ATOM 1853 CG PRO A 238 99.652 74.686 8.469 1.00 15.16 C ATOM 1854 CD PRO A 238 98.591 75.258 9.393 1.00 13.53 C ATOM 1855 N GLY A 239 102.406 73.791 11.323 1.00 12.32 N ATOM 1856 CA GLY A 239 103.673 74.421 11.669 1.00 12.02 C ATOM 1857 C GLY A 239 104.276 75.236 10.536 1.00 10.86 C ATOM 1858 O GLY A 239 105.008 76.204 10.769 1.00 11.81 O ATOM 1859 H GLY A 239 102.335 72.754 11.282 1.00 0.00 H ATOM 1860 N HIS A 240 103.997 74.844 9.298 1.00 11.94 N ATOM 1861 CA HIS A 240 104.509 75.515 8.113 1.00 12.48 C ATOM 1862 C HIS A 240 103.407 75.580 7.068 1.00 13.33 C ATOM 1863 O HIS A 240 102.836 74.541 6.716 1.00 15.19 O ATOM 1864 CB HIS A 240 105.715 74.747 7.549 1.00 13.27 C ATOM 1865 CG HIS A 240 106.779 74.491 8.566 1.00 11.61 C ATOM 1866 ND1 HIS A 240 107.781 75.393 8.833 1.00 11.06 N ATOM 1867 CD2 HIS A 240 106.975 73.447 9.409 1.00 11.25 C ATOM 1868 CE1 HIS A 240 108.564 74.912 9.785 1.00 11.22 C ATOM 1869 NE2 HIS A 240 108.086 73.745 10.174 1.00 11.50 N ATOM 1870 H HIS A 240 103.382 74.016 9.169 1.00 0.00 H ATOM 1871 N GLY A 241 103.105 76.774 6.562 1.00 13.23 N ATOM 1872 CA GLY A 241 102.157 76.903 5.472 1.00 15.16 C ATOM 1873 C GLY A 241 100.768 77.358 5.883 1.00 14.92 C ATOM 1874 O GLY A 241 100.538 77.925 6.951 1.00 14.85 O ATOM 1875 H GLY A 241 103.555 77.626 6.954 1.00 0.00 H ATOM 1876 N LEU A 242 99.816 77.081 4.999 1.00 16.57 N ATOM 1877 CA LEU A 242 98.521 77.760 5.028 1.00 16.34 C ATOM 1878 C LEU A 242 97.561 77.076 6.001 1.00 19.06 C ATOM 1879 O LEU A 242 97.414 75.848 5.965 1.00 15.80 O ATOM 1880 CB LEU A 242 97.903 77.773 3.634 1.00 18.17 C ATOM 1881 CG LEU A 242 98.675 78.536 2.550 1.00 20.20 C ATOM 1882 CD1 LEU A 242 98.088 78.303 1.172 1.00 21.63 C ATOM 1883 CD2 LEU A 242 98.705 80.020 2.849 1.00 22.13 C ATOM 1884 H LEU A 242 99.996 76.363 4.268 1.00 0.00 H ATOM 1885 N PRO A 243 96.860 77.832 6.844 1.00 16.67 N ATOM 1886 CA PRO A 243 95.846 77.227 7.709 1.00 16.12 C ATOM 1887 C PRO A 243 94.712 76.601 6.914 1.00 16.81 C ATOM 1888 O PRO A 243 94.463 76.900 5.739 1.00 19.46 O ATOM 1889 CB PRO A 243 95.335 78.406 8.537 1.00 21.40 C ATOM 1890 CG PRO A 243 96.486 79.367 8.560 1.00 22.56 C ATOM 1891 CD PRO A 243 97.029 79.269 7.145 1.00 18.51 C ATOM 1892 N GLY A 244 94.022 75.706 7.590 1.00 16.20 N ATOM 1893 CA GLY A 244 92.858 75.042 7.036 1.00 18.65 C ATOM 1894 C GLY A 244 91.900 74.672 8.135 1.00 20.09 C ATOM 1895 O GLY A 244 91.780 75.384 9.137 1.00 18.36 O ATOM 1896 H GLY A 244 94.323 75.467 8.556 1.00 0.00 H ATOM 1897 N GLY A 245 91.204 73.562 7.939 1.00 20.27 N ATOM 1898 CA GLY A 245 90.298 73.037 8.942 1.00 22.16 C ATOM 1899 C GLY A 245 90.717 71.649 9.367 1.00 18.02 C ATOM 1900 O GLY A 245 91.874 71.263 9.184 1.00 17.59 O ATOM 1901 H GLY A 245 91.311 73.052 7.039 1.00 0.00 H ATOM 1902 N LEU A 246 89.784 70.890 9.941 1.00 19.46 N ATOM 1903 CA LEU A 246 90.118 69.544 10.398 1.00 20.02 C ATOM 1904 C LEU A 246 90.505 68.634 9.238 1.00 19.56 C ATOM 1905 O LEU A 246 91.109 67.578 9.463 1.00 21.47 O ATOM 1906 CB LEU A 246 88.971 68.949 11.229 1.00 20.01 C ATOM 1907 CG LEU A 246 88.903 69.476 12.670 1.00 21.70 C ATOM 1908 CD1 LEU A 246 87.555 69.124 13.272 1.00 26.68 C ATOM 1909 CD2 LEU A 246 90.047 68.936 13.522 1.00 21.89 C ATOM 1910 H LEU A 246 88.818 71.256 10.063 1.00 0.00 H ATOM 1911 N ASP A 247 90.205 69.038 7.998 1.00 19.65 N ATOM 1912 CA ASP A 247 90.693 68.307 6.835 1.00 21.25 C ATOM 1913 C ASP A 247 92.213 68.142 6.842 1.00 19.31 C ATOM 1914 O ASP A 247 92.727 67.199 6.227 1.00 21.58 O ATOM 1915 CB ASP A 247 90.227 68.978 5.534 1.00 22.72 C ATOM 1916 CG ASP A 247 90.641 70.444 5.432 1.00 26.18 C ATOM 1917 OD1 ASP A 247 90.422 71.215 6.393 1.00 27.28 O ATOM 1918 OD2 ASP A 247 91.173 70.834 4.371 1.00 28.84 O ATOM 1919 H ASP A 247 89.616 69.884 7.862 1.00 0.00 H ATOM 1920 N LEU A 248 92.954 69.031 7.515 1.00 17.11 N ATOM 1921 CA LEU A 248 94.407 68.886 7.530 1.00 18.46 C ATOM 1922 C LEU A 248 94.846 67.639 8.285 1.00 18.56 C ATOM 1923 O LEU A 248 95.935 67.122 8.015 1.00 19.68 O ATOM 1924 CB LEU A 248 95.096 70.123 8.108 1.00 16.98 C ATOM 1925 CG LEU A 248 94.955 71.452 7.353 1.00 19.62 C ATOM 1926 CD1 LEU A 248 95.978 72.466 7.872 1.00 18.50 C ATOM 1927 CD2 LEU A 248 95.095 71.321 5.881 1.00 23.10 C ATOM 1928 H LEU A 248 92.499 69.817 8.022 1.00 0.00 H ATOM 1929 N LEU A 249 94.025 67.143 9.209 1.00 17.60 N ATOM 1930 CA LEU A 249 94.407 65.961 9.979 1.00 18.34 C ATOM 1931 C LEU A 249 94.408 64.724 9.095 1.00 21.51 C ATOM 1932 O LEU A 249 95.404 63.993 9.029 1.00 21.01 O ATOM 1933 CB LEU A 249 93.479 65.769 11.184 1.00 18.62 C ATOM 1934 CG LEU A 249 93.926 66.501 12.452 1.00 22.20 C ATOM 1935 CD1 LEU A 249 93.983 67.998 12.262 1.00 22.74 C ATOM 1936 CD2 LEU A 249 92.994 66.170 13.595 1.00 20.82 C ATOM 1937 H LEU A 249 93.107 67.599 9.384 1.00 0.00 H ATOM 1938 N LYS A 250 93.301 64.484 8.386 1.00 23.66 N ATOM 1939 CA LYS A 250 93.236 63.346 7.479 1.00 25.32 C ATOM 1940 C LYS A 250 94.266 63.485 6.365 1.00 22.13 C ATOM 1941 O LYS A 250 94.906 62.501 5.973 1.00 23.50 O ATOM 1942 CB LYS A 250 91.828 63.226 6.898 1.00 32.03 C ATOM 1943 CG LYS A 250 91.710 62.194 5.784 1.00 39.32 C ATOM 1944 H LYS A 250 92.480 65.115 8.483 1.00 0.00 H ATOM 1945 N HIS A 251 94.463 64.710 5.871 1.00 21.66 N ATOM 1946 CA HIS A 251 95.475 64.935 4.846 1.00 19.72 C ATOM 1947 C HIS A 251 96.849 64.500 5.336 1.00 18.54 C ATOM 1948 O HIS A 251 97.593 63.820 4.619 1.00 20.52 O ATOM 1949 CB HIS A 251 95.519 66.410 4.461 1.00 21.55 C ATOM 1950 CG HIS A 251 96.721 66.765 3.650 1.00 20.71 C ATOM 1951 ND1 HIS A 251 96.915 66.326 2.358 1.00 23.31 N ATOM 1952 CD2 HIS A 251 97.829 67.468 3.981 1.00 21.57 C ATOM 1953 CE1 HIS A 251 98.076 66.776 1.915 1.00 28.41 C ATOM 1954 NE2 HIS A 251 98.650 67.470 2.884 1.00 21.20 N ATOM 1955 H HIS A 251 93.892 65.507 6.219 1.00 0.00 H ATOM 1956 N THR A 252 97.219 64.917 6.551 1.00 18.34 N ATOM 1957 CA THR A 252 98.537 64.566 7.070 1.00 17.73 C ATOM 1958 C THR A 252 98.676 63.058 7.233 1.00 17.81 C ATOM 1959 O THR A 252 99.698 62.473 6.844 1.00 19.76 O ATOM 1960 CB THR A 252 98.809 65.302 8.381 1.00 17.39 C ATOM 1961 OG1 THR A 252 98.742 66.726 8.165 1.00 15.95 O ATOM 1962 CG2 THR A 252 100.182 64.945 8.908 1.00 17.77 C ATOM 1963 HG1 THR A 252 97.840 66.966 7.835 1.00 0.00 H ATOM 1964 H THR A 252 96.569 65.491 7.125 1.00 0.00 H ATOM 1965 N THR A 253 97.648 62.409 7.789 1.00 18.86 N ATOM 1966 CA THR A 253 97.649 60.954 7.905 1.00 20.84 C ATOM 1967 C THR A 253 97.911 60.301 6.558 1.00 23.36 C ATOM 1968 O THR A 253 98.719 59.370 6.449 1.00 24.12 O ATOM 1969 CB THR A 253 96.314 60.473 8.481 1.00 22.51 C ATOM 1970 OG1 THR A 253 96.152 61.018 9.797 1.00 26.21 O ATOM 1971 CG2 THR A 253 96.267 58.954 8.566 1.00 26.30 C ATOM 1972 HG1 THR A 253 95.290 60.711 10.176 1.00 0.00 H ATOM 1973 H THR A 253 96.834 62.950 8.145 1.00 0.00 H ATOM 1974 N ASN A 254 97.237 60.793 5.514 1.00 22.71 N ATOM 1975 CA ASN A 254 97.398 60.219 4.179 1.00 26.48 C ATOM 1976 C ASN A 254 98.824 60.402 3.674 1.00 24.22 C ATOM 1977 O ASN A 254 99.401 59.489 3.071 1.00 26.90 O ATOM 1978 CB ASN A 254 96.403 60.862 3.209 1.00 29.60 C ATOM 1979 CG ASN A 254 94.972 60.409 3.444 1.00 35.38 C ATOM 1980 OD1 ASN A 254 94.731 59.351 4.017 1.00 37.73 O ATOM 1981 ND2 ASN A 254 94.015 61.215 2.997 1.00 45.13 N ATOM 1982 HD22 ASN A 254 94.265 62.103 2.517 1.00 0.00 H ATOM 1983 HD21 ASN A 254 93.016 60.958 3.128 1.00 0.00 H ATOM 1984 H ASN A 254 96.589 61.595 5.653 1.00 0.00 H ATOM 1985 N VAL A 255 99.408 61.581 3.901 1.00 22.48 N ATOM 1986 CA VAL A 255 100.778 61.811 3.452 1.00 23.52 C ATOM 1987 C VAL A 255 101.735 60.882 4.188 1.00 22.29 C ATOM 1988 O VAL A 255 102.615 60.262 3.585 1.00 24.33 O ATOM 1989 CB VAL A 255 101.157 63.292 3.629 1.00 22.46 C ATOM 1990 CG1 VAL A 255 102.634 63.508 3.335 1.00 26.03 C ATOM 1991 CG2 VAL A 255 100.308 64.142 2.710 1.00 24.13 C ATOM 1992 H VAL A 255 98.888 62.333 4.396 1.00 0.00 H ATOM 1993 N VAL A 256 101.596 60.798 5.512 1.00 23.31 N ATOM 1994 CA VAL A 256 102.512 59.974 6.293 1.00 24.21 C ATOM 1995 C VAL A 256 102.414 58.514 5.872 1.00 29.44 C ATOM 1996 O VAL A 256 103.434 57.832 5.694 1.00 31.57 O ATOM 1997 CB VAL A 256 102.239 60.174 7.795 1.00 23.18 C ATOM 1998 CG1 VAL A 256 102.984 59.150 8.633 1.00 31.18 C ATOM 1999 CG2 VAL A 256 102.636 61.581 8.188 1.00 29.80 C ATOM 2000 H VAL A 256 100.833 61.321 5.988 1.00 0.00 H ATOM 2001 N LYS A 257 101.192 58.006 5.710 1.00 25.92 N ATOM 2002 CA LYS A 257 101.029 56.602 5.349 1.00 29.25 C ATOM 2003 C LYS A 257 101.568 56.328 3.953 1.00 31.13 C ATOM 2004 O LYS A 257 102.124 55.253 3.699 1.00 35.40 O ATOM 2005 CB LYS A 257 99.560 56.198 5.448 1.00 31.32 C ATOM 2006 CG LYS A 257 99.049 56.109 6.882 1.00 34.33 C ATOM 2007 CD LYS A 257 97.620 55.618 6.927 1.00 41.22 C ATOM 2008 CE LYS A 257 97.244 55.128 8.303 1.00 37.65 C ATOM 2009 NZ LYS A 257 95.865 54.578 8.299 1.00 43.29 N ATOM 2010 HZ1 LYS A 257 95.197 55.321 8.010 1.00 0.00 H ATOM 2011 HZ2 LYS A 257 95.812 53.783 7.630 1.00 0.00 H ATOM 2012 HZ3 LYS A 257 95.623 54.245 9.254 1.00 0.00 H ATOM 2013 H LYS A 257 100.356 58.610 5.841 1.00 0.00 H ATOM 2014 N ALA A 258 101.417 57.286 3.034 1.00 30.02 N ATOM 2015 CA ALA A 258 101.945 57.098 1.688 1.00 35.75 C ATOM 2016 C ALA A 258 103.459 56.975 1.715 1.00 35.30 C ATOM 2017 O ALA A 258 104.045 56.198 0.952 1.00 37.66 O ATOM 2018 CB ALA A 258 101.520 58.253 0.786 1.00 34.32 C ATOM 2019 H ALA A 258 100.922 58.167 3.279 1.00 0.00 H ATOM 2020 N HIS A 259 104.110 57.737 2.589 1.00 31.40 N ATOM 2021 CA HIS A 259 105.548 57.613 2.753 1.00 31.70 C ATOM 2022 C HIS A 259 105.915 56.218 3.234 1.00 37.91 C ATOM 2023 O HIS A 259 106.862 55.607 2.731 1.00 41.49 O ATOM 2024 CB HIS A 259 106.023 58.661 3.757 1.00 30.64 C ATOM 2025 CG HIS A 259 107.509 58.713 3.916 1.00 38.11 C ATOM 2026 ND1 HIS A 259 108.330 59.377 3.029 1.00 41.19 N ATOM 2027 CD2 HIS A 259 108.325 58.172 4.851 1.00 34.16 C ATOM 2028 CE1 HIS A 259 109.586 59.249 3.417 1.00 44.09 C ATOM 2029 NE2 HIS A 259 109.611 58.520 4.518 1.00 39.35 N ATOM 2030 H HIS A 259 103.584 58.429 3.161 1.00 0.00 H ATOM 2031 N THR A 260 105.170 55.699 4.213 1.00 42.95 N ATOM 2032 CA THR A 260 105.445 54.374 4.762 1.00 47.53 C ATOM 2033 C THR A 260 105.086 53.262 3.788 1.00 45.08 C ATOM 2034 O THR A 260 105.652 52.170 3.882 1.00 49.80 O ATOM 2035 CB THR A 260 104.658 54.176 6.061 1.00 41.12 C ATOM 2036 OG1 THR A 260 104.874 55.293 6.937 1.00 44.34 O ATOM 2037 HG1 THR A 260 104.363 55.158 7.774 1.00 0.00 H ATOM 2038 H THR A 260 104.375 56.251 4.594 1.00 0.00 H ATOM 2039 N ASN A 261 104.170 53.517 2.858 1.00 46.81 N ATOM 2040 CA ASN A 261 103.724 52.506 1.908 1.00 51.86 C ATOM 2041 C ASN A 261 104.410 52.709 0.562 1.00 52.35 C ATOM 2042 CB ASN A 261 102.204 52.585 1.741 1.00 46.87 C ATOM 2043 H ASN A 261 103.758 54.471 2.807 1.00 0.00 H TER 2044 ASN A 261 HETATM 2045 ZN ZN A 1 108.598 72.503 11.770 1.00 15.52 ZN HETATM 2046 ZN ZN A 2 110.260 70.154 13.652 1.00 12.57 ZN HETATM 2047 O HOH 3 104.258 96.242 10.284 1.00 40.83 O HETATM 2048 O HOH 4 117.728 63.165 14.004 1.00 56.17 O HETATM 2049 O HOH 5 124.185 67.236 26.778 1.00 53.94 O HETATM 2050 O HOH 6 108.405 57.202 19.308 1.00 43.63 O HETATM 2051 O HOH 7 118.776 79.684 15.740 1.00 30.03 O HETATM 2052 O HOH 8 107.894 95.838 13.405 1.00 29.44 O HETATM 2053 O HOH 9 119.837 67.308 27.544 1.00 23.10 O HETATM 2054 O HOH 10 117.349 63.483 16.542 1.00 37.43 O HETATM 2055 O HOH 11 101.108 62.770 32.911 1.00 51.02 O HETATM 2056 O HOH 12 87.252 57.682 18.791 1.00 39.87 O HETATM 2057 O HOH 13 85.012 88.361 20.485 1.00 48.13 O HETATM 2058 O HOH 14 118.682 77.725 18.977 1.00 17.33 O HETATM 2059 O HOH 15 88.264 88.154 22.365 1.00 29.10 O HETATM 2060 O HOH 16 93.184 92.107 12.861 1.00 40.52 O HETATM 2061 O HOH 17 118.326 85.773 27.803 1.00 22.97 O HETATM 2062 O HOH 18 111.095 71.713 -0.578 1.00 46.46 O HETATM 2063 O HOH 19 120.179 65.785 18.816 1.00 27.14 O HETATM 2064 O HOH 20 121.845 79.668 24.714 1.00 45.82 O HETATM 2065 O HOH 21 114.227 81.522 27.420 1.00 20.21 O HETATM 2066 O HOH 22 98.596 60.781 32.455 1.00 40.18 O HETATM 2067 O HOH 23 108.159 70.662 10.489 1.00 16.46 O HETATM 2068 O HOH 24 112.759 69.268 33.678 1.00 41.82 O HETATM 2069 O HOH 25 104.234 94.106 22.921 1.00 18.25 O HETATM 2070 O HOH 26 109.838 62.886 23.669 1.00 24.33 O HETATM 2071 O HOH 27 101.638 88.893 1.928 1.00 39.79 O HETATM 2072 O HOH 28 114.033 93.067 5.193 1.00 35.68 O HETATM 2073 O HOH 29 99.019 95.104 32.334 1.00 31.58 O HETATM 2074 O HOH 30 95.003 90.526 3.108 1.00 54.99 O HETATM 2075 O HOH 31 101.776 56.901 21.852 1.00 30.71 O HETATM 2076 O HOH 32 90.534 65.038 9.052 1.00 30.28 O HETATM 2077 O HOH 33 90.515 63.517 11.449 1.00 36.88 O HETATM 2078 O HOH 34 118.765 81.744 17.615 1.00 24.15 O HETATM 2079 O HOH 35 111.642 86.036 8.388 1.00 11.56 O HETATM 2080 O HOH 36 106.780 66.921 24.956 1.00 18.06 O HETATM 2081 O HOH 37 96.251 83.493 32.629 1.00 29.81 O HETATM 2082 O HOH 38 88.572 67.410 24.628 1.00 41.30 O HETATM 2083 O HOH 39 109.148 89.322 33.217 1.00 53.96 O HETATM 2084 O HOH 40 83.422 75.030 17.148 1.00 43.68 O HETATM 2085 O HOH 41 112.955 58.822 13.884 1.00 37.51 O HETATM 2086 O HOH 42 121.978 74.894 23.963 1.00 23.61 O HETATM 2087 O HOH 43 115.985 76.642 33.774 1.00 35.69 O HETATM 2088 O HOH 44 117.636 83.941 20.986 1.00 13.94 O HETATM 2089 O HOH 45 101.010 70.659 -3.892 1.00 37.38 O HETATM 2090 O HOH 46 108.739 79.628 13.428 1.00 14.13 O HETATM 2091 O HOH 47 115.162 91.663 11.439 1.00 23.12 O HETATM 2092 O HOH 48 102.196 99.195 24.307 1.00 45.40 O HETATM 2093 O HOH 49 106.689 79.328 36.160 1.00 34.45 O HETATM 2094 O HOH 50 117.580 65.299 16.103 1.00 28.91 O HETATM 2095 O HOH 51 108.029 66.570 8.915 1.00 16.40 O HETATM 2096 O HOH 52 98.553 92.012 10.817 1.00 34.80 O HETATM 2097 O HOH 53 97.912 66.066 32.615 1.00 31.60 O HETATM 2098 O HOH 54 96.621 68.005 -1.093 1.00 35.75 O HETATM 2099 O HOH 55 99.227 98.530 26.094 1.00 19.40 O HETATM 2100 O HOH 56 115.686 67.001 12.516 1.00 25.88 O HETATM 2101 O HOH 57 111.331 76.703 36.685 1.00 37.51 O HETATM 2102 O HOH 58 87.697 84.288 12.598 1.00 26.07 O HETATM 2103 O HOH 59 103.638 96.199 25.636 1.00 40.72 O HETATM 2104 O HOH 60 119.528 83.486 6.024 1.00 44.25 O HETATM 2105 O HOH 61 94.950 59.443 11.625 1.00 25.15 O HETATM 2106 O HOH 62 96.652 74.132 4.028 1.00 18.01 O HETATM 2107 O HOH 63 99.153 88.876 3.145 1.00 42.96 O HETATM 2108 O HOH 64 91.550 73.509 4.363 1.00 26.42 O HETATM 2109 O HOH 65 88.110 84.507 20.172 1.00 24.08 O HETATM 2110 O HOH 66 106.234 92.735 8.913 1.00 33.65 O HETATM 2111 O HOH 67 119.329 83.627 8.463 1.00 24.48 O HETATM 2112 O HOH 68 111.301 62.443 3.637 1.00 49.58 O HETATM 2113 O HOH 69 103.074 69.780 17.054 1.00 13.34 O HETATM 2114 O HOH 70 115.407 83.256 33.745 1.00 45.94 O HETATM 2115 O HOH 71 93.591 84.267 29.990 1.00 27.32 O HETATM 2116 O HOH 72 102.608 55.436 8.978 1.00 34.18 O HETATM 2117 O HOH 73 97.566 60.063 28.936 1.00 23.19 O HETATM 2118 O HOH 74 99.401 86.190 0.314 1.00 26.26 O HETATM 2119 O HOH 75 111.438 83.126 33.812 1.00 33.58 O HETATM 2120 O HOH 76 110.985 86.783 -2.207 1.00 20.49 O HETATM 2121 O HOH 77 111.276 84.780 1.638 1.00 20.54 O HETATM 2122 O HOH 78 103.289 64.058 33.338 1.00 45.64 O HETATM 2123 O HOH 79 107.501 91.303 27.365 1.00 45.31 O HETATM 2124 O HOH 80 90.590 69.621 2.011 1.00 32.52 O HETATM 2125 O HOH 81 98.170 90.387 34.518 1.00 40.25 O HETATM 2126 O HOH 82 103.625 71.743 9.069 1.00 14.19 O HETATM 2127 O HOH 83 96.901 89.000 5.751 1.00 46.22 O HETATM 2128 O HOH 84 107.032 87.000 32.350 1.00 27.97 O HETATM 2129 O HOH 85 103.109 90.159 3.714 1.00 38.70 O HETATM 2130 O HOH 86 97.748 82.815 0.774 1.00 30.45 O HETATM 2131 O HOH 87 103.289 71.837 6.232 1.00 16.24 O HETATM 2132 O HOH 88 122.649 72.618 16.312 1.00 50.05 O HETATM 2133 O HOH 89 98.757 95.233 29.450 1.00 17.71 O HETATM 2134 O HOH 90 101.087 84.586 29.213 1.00 13.83 O HETATM 2135 O HOH 91 87.191 65.637 11.090 1.00 35.69 O HETATM 2136 O HOH 92 111.847 63.228 17.915 1.00 18.30 O HETATM 2137 O HOH 93 105.129 71.519 16.806 1.00 11.38 O HETATM 2138 O HOH 94 102.013 91.843 9.885 1.00 19.33 O HETATM 2139 O HOH 95 101.102 77.480 1.027 1.00 43.10 O HETATM 2140 O HOH 96 105.354 66.987 31.308 1.00 23.18 O HETATM 2141 O HOH 97 94.036 56.984 11.278 1.00 34.38 O HETATM 2142 O HOH 98 125.119 68.010 22.073 1.00 54.14 O HETATM 2143 O HOH 99 119.793 78.870 8.655 1.00 50.86 O HETATM 2144 O HOH 100 90.354 84.267 27.134 1.00 44.01 O HETATM 2145 O HOH 101 90.436 80.369 25.284 1.00 19.78 O HETATM 2146 O HOH 102 107.852 97.916 17.700 1.00 22.58 O HETATM 2147 O HOH 103 86.410 81.622 16.290 1.00 31.67 O HETATM 2148 O HOH 104 85.517 63.232 19.604 1.00 39.54 O HETATM 2149 O HOH 105 120.443 70.806 14.198 1.00 28.70 O HETATM 2150 O HOH 106 122.144 68.491 30.816 1.00 48.68 O HETATM 2151 O HOH 107 111.136 94.501 2.891 1.00 50.10 O HETATM 2152 O HOH 108 86.050 75.059 21.501 1.00 36.70 O HETATM 2153 O HOH 109 94.933 89.500 33.529 1.00 26.48 O HETATM 2154 O HOH 110 119.322 78.547 25.736 1.00 18.51 O HETATM 2155 O HOH 111 112.674 93.298 19.401 1.00 15.37 O HETATM 2156 O HOH 112 95.282 57.118 23.603 1.00 20.80 O HETATM 2157 O HOH 113 98.981 85.751 32.497 1.00 24.36 O HETATM 2158 O HOH 114 105.580 82.933 34.197 1.00 27.88 O HETATM 2159 O HOH 115 107.397 71.091 24.763 1.00 12.53 O HETATM 2160 O HOH 116 99.319 89.008 7.570 1.00 28.45 O HETATM 2161 O HOH 117 117.367 77.339 29.808 1.00 27.42 O HETATM 2162 O HOH 118 84.943 66.694 13.837 1.00 30.57 O HETATM 2163 O HOH 119 118.257 76.466 9.262 1.00 42.41 O HETATM 2164 O HOH 120 84.779 71.137 13.709 1.00 36.10 O HETATM 2165 O HOH 121 91.171 67.921 28.152 1.00 31.98 O HETATM 2166 O HOH 122 95.950 57.961 26.260 1.00 19.85 O HETATM 2167 O HOH 123 111.208 69.610 4.377 1.00 40.93 O HETATM 2168 O HOH 124 91.645 78.161 8.865 1.00 27.30 O HETATM 2169 O HOH 125 91.505 87.676 6.182 1.00 57.59 O HETATM 2170 O HOH 126 116.851 79.553 31.169 1.00 26.62 O HETATM 2171 O HOH 127 89.879 59.996 16.112 1.00 20.45 O HETATM 2172 O HOH 128 97.995 57.317 2.009 1.00 40.16 O HETATM 2173 O HOH 129 109.563 93.642 13.185 1.00 21.00 O HETATM 2174 O HOH 130 87.937 87.835 24.343 1.00 53.58 O HETATM 2175 O HOH 131 115.470 91.588 14.173 1.00 17.24 O HETATM 2176 O HOH 132 110.179 71.685 12.502 1.00 12.15 O HETATM 2177 O HOH 133 106.486 92.788 22.176 1.00 19.94 O HETATM 2178 O HOH 134 116.351 89.265 4.043 1.00 33.93 O HETATM 2179 O HOH 135 102.043 101.196 16.771 1.00 40.92 O HETATM 2180 O HOH 136 118.099 87.441 30.206 1.00 37.13 O HETATM 2181 O HOH 137 111.220 64.665 12.007 1.00 18.86 O HETATM 2182 O HOH 138 99.936 74.034 33.102 1.00 35.89 O HETATM 2183 O HOH 139 108.577 93.232 3.079 1.00 36.87 O HETATM 2184 O HOH 140 98.248 74.419 1.754 1.00 20.01 O HETATM 2185 O HOH 141 92.869 78.456 32.379 1.00 53.27 O HETATM 2186 O HOH 142 116.628 85.265 10.486 1.00 16.52 O HETATM 2187 O HOH 143 108.886 62.165 1.003 1.00 42.89 O HETATM 2188 O HOH 144 87.447 72.213 10.815 1.00 33.02 O HETATM 2189 O HOH 145 112.886 86.769 31.590 1.00 32.61 O HETATM 2190 O HOH 146 103.811 79.465 7.056 1.00 13.28 O HETATM 2191 O HOH 147 105.307 58.809 23.608 1.00 34.12 O HETATM 2192 O HOH 148 121.121 77.189 -1.714 1.00 31.35 O HETATM 2193 O HOH 149 89.419 70.069 25.688 1.00 43.33 O HETATM 2194 O HOH 150 87.058 70.822 19.739 1.00 24.47 O HETATM 2195 O HOH 151 102.554 57.650 26.466 1.00 21.20 O HETATM 2196 O HOH 152 102.952 83.953 -3.446 1.00 47.04 O HETATM 2197 O HOH 153 119.009 73.046 14.825 1.00 19.80 O HETATM 2198 O HOH 154 103.011 80.022 34.225 1.00 20.50 O HETATM 2199 O HOH 155 105.682 69.972 9.675 1.00 14.28 O HETATM 2200 O HOH 156 114.527 91.653 30.854 1.00 19.24 O HETATM 2201 O HOH 157 118.269 65.710 20.606 1.00 20.05 O HETATM 2202 O HOH 158 87.436 69.974 22.515 1.00 42.77 O HETATM 2203 O HOH 159 92.699 87.946 8.874 1.00 32.64 O HETATM 2204 O HOH 160 104.569 65.796 35.117 1.00 40.50 O HETATM 2205 O HOH 161 105.558 82.070 -2.221 1.00 21.67 O HETATM 2206 O HOH 162 111.334 58.071 10.556 1.00 38.35 O HETATM 2207 O HOH 163 112.462 82.560 30.307 1.00 14.70 O HETATM 2208 O HOH 164 84.537 79.377 19.099 1.00 39.16 O HETATM 2209 O HOH 165 105.641 56.080 19.966 1.00 45.37 O HETATM 2210 O HOH 166 108.161 54.152 13.592 1.00 50.25 O HETATM 2211 O HOH 167 102.927 80.695 4.648 1.00 16.67 O HETATM 2212 O HOH 168 90.902 82.822 10.254 1.00 27.68 O HETATM 2213 O HOH 169 95.513 64.093 1.237 1.00 26.17 O HETATM 2214 O HOH 170 103.659 72.898 34.625 1.00 31.51 O HETATM 2215 O HOH 171 116.254 84.424 13.082 1.00 15.75 O HETATM 2216 O HOH 172 86.587 74.296 9.586 1.00 44.69 O HETATM 2217 O HOH 173 106.409 91.524 0.335 1.00 42.52 O HETATM 2218 O HOH 174 111.408 64.032 32.377 1.00 25.54 O HETATM 2219 O HOH 175 107.250 90.120 31.382 1.00 49.98 O HETATM 2220 O HOH 176 106.405 87.168 -4.407 1.00 46.44 O HETATM 2221 O HOH 177 95.373 89.706 9.598 1.00 26.10 O HETATM 2222 O HOH 178 92.280 86.165 27.613 1.00 22.59 O HETATM 2223 O HOH 179 91.691 65.863 3.897 1.00 33.86 O HETATM 2224 O HOH 180 107.142 81.975 12.911 1.00 11.01 O HETATM 2225 O HOH 181 94.483 83.214 2.687 1.00 27.23 O HETATM 2226 O HOH 182 115.137 91.471 6.775 1.00 37.79 O HETATM 2227 O HOH 183 116.644 65.911 8.416 1.00 46.72 O HETATM 2228 O HOH 184 103.251 88.836 34.250 1.00 51.37 O HETATM 2229 O HOH 185 96.550 78.197 33.673 1.00 29.67 O HETATM 2230 O HOH 186 104.580 60.896 1.557 1.00 32.08 O HETATM 2231 O HOH 187 120.314 76.019 4.027 1.00 32.30 O HETATM 2232 O HOH 188 96.715 87.416 32.500 1.00 29.15 O HETATM 2233 O HOH 189 105.328 74.894 34.433 1.00 41.92 O HETATM 2234 O HOH 190 113.809 62.969 6.468 1.00 27.32 O HETATM 2235 O HOH 191 95.497 71.675 33.854 1.00 28.14 O HETATM 2236 O HOH 192 113.258 61.241 20.517 1.00 37.96 O HETATM 2237 O HOH 193 86.487 85.829 16.468 1.00 25.77 O HETATM 2238 O HOH 194 101.664 72.410 33.014 1.00 44.68 O HETATM 2239 O HOH 195 101.777 92.618 32.658 1.00 44.55 O HETATM 2240 O HOH 196 116.773 69.224 14.119 1.00 24.13 O HETATM 2241 O HOH 197 116.403 60.717 25.221 1.00 27.45 O HETATM 2242 O HOH 198 120.917 75.846 16.740 1.00 41.62 O HETATM 2243 O HOH 199 117.839 76.716 11.952 1.00 25.94 O HETATM 2244 O HOH 200 104.727 68.403 -1.450 1.00 36.45 O HETATM 2245 O HOH 201 104.139 58.100 21.191 1.00 26.41 O HETATM 2246 O HOH 202 93.987 74.840 3.705 1.00 20.17 O HETATM 2247 O HOH 203 93.403 64.179 28.876 1.00 50.54 O HETATM 2248 O HOH 204 112.981 73.787 33.981 1.00 29.40 O HETATM 2249 O HOH 205 119.501 72.708 6.570 1.00 43.56 O HETATM 2250 O HOH 206 114.216 68.964 31.154 1.00 22.55 O HETATM 2251 O HOH 207 106.503 91.759 24.676 1.00 19.59 O HETATM 2252 O HOH 208 112.121 93.081 10.500 1.00 29.99 O HETATM 2253 O HOH 209 116.542 71.891 15.033 1.00 15.34 O HETATM 2254 O HOH 210 109.548 78.422 25.083 1.00 12.86 O HETATM 2255 O HOH 211 109.744 56.421 12.005 1.00 27.12 O HETATM 2256 O HOH 212 119.258 84.869 14.188 1.00 19.90 O HETATM 2257 O HOH 213 109.096 92.452 10.578 1.00 16.73 O HETATM 2258 O HOH 214 119.311 78.152 2.390 1.00 25.57 O HETATM 2259 O HOH 215 95.701 92.863 15.001 1.00 38.45 O HETATM 2260 O HOH 216 110.809 74.311 35.736 1.00 31.21 O HETATM 2261 O HOH 217 104.007 79.855 1.854 1.00 23.78 O HETATM 2262 O HOH 218 97.436 81.459 33.646 1.00 25.88 O HETATM 2263 O HOH 219 106.100 64.757 26.245 1.00 30.49 O HETATM 2264 O HOH 220 91.916 62.496 22.779 1.00 47.52 O HETATM 2265 O HOH 221 87.230 60.717 16.776 1.00 37.50 O HETATM 2266 O HOH 222 95.397 64.753 31.048 1.00 44.36 O HETATM 2267 O HOH 223 102.597 86.574 33.928 1.00 44.83 O HETATM 2268 O HOH 224 87.848 72.727 5.699 1.00 50.19 O HETATM 2269 O HOH 225 108.359 65.470 28.991 1.00 23.70 O HETATM 2270 O HOH 226 102.822 76.050 -0.096 1.00 43.09 O HETATM 2271 O HOH 227 93.177 81.687 6.836 1.00 41.54 O HETATM 2272 O HOH 228 114.922 61.239 16.751 1.00 44.89 O HETATM 2273 O HOH 229 98.977 78.681 33.820 1.00 34.00 O HETATM 2274 O HOH 230 106.631 65.579 27.868 1.00 46.48 O HETATM 2275 O HOH 231 87.957 87.342 28.261 1.00 26.73 O HETATM 2276 O HOH 232 83.859 83.312 22.179 1.00 52.05 O HETATM 2277 O HOH 233 119.569 82.371 15.793 1.00 44.16 O HETATM 2278 O HOH 234 103.960 72.922 -0.444 1.00 50.69 O HETATM 2279 O HOH 235 91.820 77.396 28.891 1.00 41.77 O HETATM 2280 O HOH 236 118.123 88.754 7.961 1.00 32.35 O HETATM 2281 O HOH 237 85.910 63.014 16.608 1.00 35.44 O HETATM 2282 O HOH 238 121.382 77.531 19.074 1.00 36.64 O HETATM 2283 O HOH 239 105.511 85.456 33.372 1.00 51.04 O HETATM 2284 O HOH 240 105.805 58.137 28.708 1.00 53.66 O HETATM 2285 O HOH 241 93.689 60.760 26.469 1.00 38.25 O HETATM 2286 O HOH 242 103.955 93.588 8.967 1.00 43.75 O HETATM 2287 O HOH 243 125.227 70.225 23.164 1.00 53.12 O HETATM 2288 O HOH 244 118.001 70.709 29.280 1.00 43.56 O HETATM 2289 O HOH 245 90.451 85.023 9.686 1.00 45.41 O HETATM 2290 O HOH 246 80.285 73.323 17.697 1.00 58.90 O HETATM 2291 O HOH 247 88.097 61.824 24.499 1.00 48.30 O HETATM 2292 O HOH 248 123.048 65.978 18.053 1.00 47.99 O HETATM 2293 O HOH 249 97.057 91.460 12.191 1.00 33.16 O HETATM 2294 O HOH 250 110.922 57.457 16.703 1.00 44.20 O HETATM 2295 O HOH 251 107.368 63.001 25.020 1.00 43.35 O HETATM 2296 O HOH 252 119.553 75.265 13.269 1.00 34.03 O HETATM 2297 O HOH 253 110.673 55.736 14.770 1.00 49.65 O HETATM 2298 O HOH 254 119.763 93.972 13.857 1.00 45.82 O HETATM 2299 O HOH 255 122.410 77.468 21.781 1.00 48.60 O HETATM 2300 O HOH 256 113.899 93.555 15.341 1.00 24.51 O HETATM 2301 O HOH 257 123.261 69.756 32.073 1.00 54.39 O HETATM 2302 O HOH 258 117.902 80.233 12.989 1.00 44.40 O HETATM 2303 O HOH 259 108.796 94.553 22.492 1.00 34.02 O HETATM 2304 O HOH 260 101.613 84.636 34.152 1.00 51.58 O HETATM 2305 O HOH 261 110.864 85.735 32.982 1.00 46.82 O HETATM 2306 O HOH 262 119.997 78.208 28.425 1.00 34.25 O HETATM 2307 O HOH 263 91.610 82.093 30.133 1.00 53.80 O HETATM 2308 O HOH 264 116.596 87.923 32.215 1.00 48.98 O HETATM 2309 O HOH 265 107.948 92.245 25.778 1.00 44.83 O HETATM 2310 O HOH 266 106.682 65.472 33.130 1.00 25.69 O HETATM 2311 O HOH 267 107.345 97.399 25.288 1.00 35.12 O HETATM 2312 O HOH 268 84.785 91.244 15.063 1.00 59.24 O HETATM 2313 O HOH 269 121.071 82.729 18.610 1.00 34.56 O HETATM 2314 O HOH 270 115.289 60.711 7.246 1.00 49.25 O HETATM 2315 O HOH 271 119.127 72.643 30.759 1.00 41.69 O HETATM 2316 O HOH 272 106.324 94.683 25.740 1.00 48.03 O HETATM 2317 O HOH 273 92.207 61.221 12.517 1.00 32.31 O HETATM 2318 O HOH 274 108.105 82.076 36.645 1.00 57.42 O HETATM 2319 O HOH 275 87.542 83.584 26.852 1.00 47.68 O HETATM 2320 O HOH 276 91.195 86.827 31.159 1.00 25.83 O HETATM 2321 O HOH 277 89.903 79.381 28.098 1.00 34.61 O HETATM 2322 O HOH 278 86.178 83.751 18.277 1.00 32.21 O HETATM 2323 O HOH 279 119.156 62.699 16.063 1.00 47.44 O HETATM 2324 O HOH 280 93.552 86.617 32.683 1.00 41.64 O HETATM 2325 O HOH 281 94.884 59.786 28.764 1.00 34.74 O HETATM 2326 O HOH 282 108.549 98.008 14.649 1.00 40.42 O HETATM 2327 O HOH 283 111.715 65.450 34.319 1.00 50.43 O HETATM 2328 O HOH 284 113.113 83.486 32.670 1.00 39.80 O HETATM 2329 O HOH 285 96.231 72.497 -2.001 1.00 40.82 O HETATM 2330 O HOH 286 87.101 85.303 24.750 1.00 52.23 O HETATM 2331 O HOH 287 93.550 81.952 32.863 1.00 53.35 O HETATM 2332 O HOH 288 101.565 79.653 2.519 1.00 28.54 O HETATM 2333 O HOH 289 121.951 77.460 24.320 1.00 44.02 O HETATM 2334 O HOH 290 101.056 89.976 5.730 1.00 43.72 O HETATM 2335 O HOH 291 102.496 55.214 24.483 1.00 48.30 O HETATM 2336 O HOH 292 98.038 84.708 -1.770 1.00 46.35 O HETATM 2337 O HOH 293 107.506 76.260 36.230 1.00 51.66 O HETATM 2338 O HOH 294 100.277 76.349 34.563 1.00 45.36 O HETATM 2339 O HOH 295 98.119 58.003 30.683 1.00 45.36 O HETATM 2340 O HOH 296 97.248 86.154 33.857 1.00 24.67 O HETATM 2341 O HOH 297 82.073 89.484 17.062 1.00 44.31 O HETATM 2342 O HOH 298 101.315 53.447 9.575 1.00 48.33 O HETATM 2343 O HOH 299 96.722 75.005 -0.322 1.00 31.67 O HETATM 2344 O HOH 300 89.736 73.865 28.030 1.00 51.60 O HETATM 2345 O HOH 301 119.089 79.211 11.144 1.00 38.25 O HETATM 2346 O HOH 302 112.927 88.717 0.000 1.00 42.53 O HETATM 2347 O HOH 303 98.407 62.198 -0.150 1.00 52.56 O HETATM 2348 O HOH 304 98.144 53.467 11.674 1.00 50.02 O HETATM 2349 O HOH 305 116.849 63.972 18.841 1.00 24.26 O HETATM 2350 O HOH 306 98.585 58.863 32.928 1.00 51.38 O HETATM 2351 O HOH 307 114.217 62.692 18.801 1.00 31.33 O HETATM 2352 O HOH 308 95.486 87.514 34.146 1.00 25.68 O HETATM 2353 O HOH 309 117.769 66.254 10.953 1.00 48.13 O HETATM 2354 O HOH 310 120.411 84.558 20.638 1.00 17.11 O HETATM 2355 O HOH 311 88.591 64.863 7.186 1.00 48.41 O HETATM 2356 O HOH 312 119.302 81.717 13.335 1.00 48.65 O HETATM 2357 O HOH 313 102.682 77.377 35.021 1.00 42.48 O HETATM 2358 O HOH 314 86.423 85.929 21.894 1.00 55.64 O HETATM 2359 O HOH 315 104.163 79.794 -1.832 1.00 32.65 O HETATM 2360 O HOH 316 105.864 89.212 33.422 1.00 50.61 O HETATM 2361 O HOH 317 85.886 73.574 23.963 1.00 48.24 O HETATM 2362 O HOH 318 112.927 85.792 0.000 1.00 42.89 O HETATM 2363 O HOH 319 90.342 71.506 0.000 1.00 36.76 O HETATM 2364 O HOH 320 112.048 94.455 13.159 1.00 28.59 O HETATM 2365 O HOH 321 88.807 65.852 4.366 1.00 52.17 O HETATM 2366 O HOH 322 121.491 84.280 15.736 1.00 53.21 O HETATM 2367 O HOH 323 120.400 86.146 12.165 1.00 55.56 O HETATM 2368 O HOH 324 110.182 97.223 19.579 1.00 38.93 O HETATM 2369 O HOH 325 90.187 59.796 13.429 1.00 28.34 O HETATM 2370 O HOH 326 92.069 67.230 1.553 1.00 42.97 O HETATM 2371 O HOH 327 84.881 67.452 11.089 1.00 43.59 O HETATM 2372 O HOH 328 86.048 83.459 14.703 1.00 35.19 O HETATM 2373 O HOH 329 118.911 86.240 9.480 1.00 26.74 O HETATM 2374 O HOH 330 101.402 96.667 29.658 1.00 37.97 O HETATM 2375 O HOH 331 92.766 80.685 9.360 1.00 26.28 O HETATM 2376 O HOH 332 86.310 83.835 10.219 1.00 52.45 O HETATM 2377 O HOH 333 117.269 68.336 7.184 1.00 54.34 O HETATM 2378 O HOH 334 93.791 75.498 1.006 1.00 42.51 O HETATM 2379 O HOH 335 97.535 76.821 -1.830 1.00 47.34 O HETATM 2380 O HOH 336 88.874 88.656 6.682 1.00 60.55 O HETATM 2381 O HOH 337 87.488 77.105 28.551 1.00 51.10 O HETATM 2382 O HOH 338 112.393 97.531 17.047 1.00 42.92 O HETATM 2383 O HOH 339 120.828 73.482 11.339 1.00 59.60 O HETATM 2384 O HOH 340 90.342 66.016 0.000 1.00 51.00 O HETATM 2385 C10 UNN A 341 111.808 70.867 9.839 1.00 0.21 C HETATM 2386 O11 UNN A 341 111.725 69.694 10.169 1.00 -0.39 O HETATM 2387 C04 UNN A 341 111.025 71.443 8.747 1.00 0.07 C HETATM 2388 C03 UNN A 341 111.395 72.810 8.721 1.00 0.00 C HETATM 2389 C13 UNN A 341 112.472 73.037 9.901 1.00 0.07 C HETATM 2390 N12 UNN A 341 112.651 71.711 10.495 1.00 -0.25 N HETATM 2391 C14 UNN A 341 113.479 71.415 11.637 1.00 0.07 C HETATM 2392 C15 UNN A 341 114.990 71.649 11.489 1.00 0.03 C HETATM 2393 C16 UNN A 341 115.584 72.852 11.803 1.00 0.04 C HETATM 2394 C17 UNN A 341 116.954 73.058 11.705 1.00 -0.06 C HETATM 2395 C18 UNN A 341 117.760 72.020 11.301 1.00 -0.07 C HETATM 2396 C19 UNN A 341 117.191 70.800 10.992 1.00 -0.03 C HETATM 2397 C20 UNN A 341 115.820 70.622 11.093 1.00 0.14 C HETATM 2398 F21 UNN A 341 115.269 69.432 10.776 1.00 -0.19 F HETATM 2399 H10 UNN A 341 117.819 69.978 10.669 1.00 0.06 H HETATM 2400 H9 UNN A 341 118.833 72.158 11.226 1.00 0.05 H HETATM 2401 H5 UNN A 341 117.382 74.025 11.944 1.00 0.06 H HETATM 2402 CL UNN A 341 114.592 74.171 12.337 1.00 -0.08 CL HETATM 2403 H3 UNN A 341 113.128 72.040 12.471 1.00 0.07 H HETATM 2404 H4 UNN A 341 113.331 70.354 11.886 1.00 0.07 H HETATM 2405 H1 UNN A 341 112.087 73.748 10.647 1.00 0.07 H HETATM 2406 H2 UNN A 341 113.422 73.412 9.493 1.00 0.07 H HETATM 2407 C02 UNN A 341 110.857 73.678 7.798 1.00 -0.05 C HETATM 2408 C01 UNN A 341 109.935 73.220 6.884 1.00 -0.06 C HETATM 2409 C06 UNN A 341 109.571 71.854 6.879 1.00 -0.05 C HETATM 2410 C05 UNN A 341 110.102 70.986 7.817 1.00 0.02 C HETATM 2411 C07 UNN A 341 109.673 69.535 7.773 1.00 0.07 C HETATM 2412 O08 UNN A 341 109.124 69.017 8.767 1.00 -0.56 O HETATM 2413 O09 UNN A 341 109.847 68.876 6.698 1.00 -0.56 O HETATM 2414 H8 UNN A 341 108.873 71.485 6.137 1.00 0.06 H HETATM 2415 H6 UNN A 341 109.490 73.904 6.171 1.00 0.06 H HETATM 2416 H7 UNN A 341 111.159 74.719 7.791 1.00 0.06 H HETATM 2417 OE1 UNK 342 107.346 68.364 35.434 1.00 47.69 O CONECT 759 757 758 2046 CONECT 779 778 781 2046 CONECT 800 798 2045 CONECT 872 873 877 878 879 CONECT 877 872 CONECT 878 872 CONECT 879 872 CONECT 1312 1310 1311 2046 CONECT 1473 1472 2045 CONECT 1869 1867 1868 2045 CONECT 2045 800 1473 1869 CONECT 2046 759 779 1312 CONECT 2385 2386 2387 2390 CONECT 2386 2385 CONECT 2387 2385 2388 2410 CONECT 2388 2387 2389 2407 CONECT 2389 2388 2390 2405 2406 CONECT 2390 2385 2389 2391 CONECT 2391 2390 2392 2403 2404 CONECT 2392 2391 2393 2397 CONECT 2393 2392 2394 2402 CONECT 2394 2393 2395 2401 CONECT 2395 2394 2396 2400 CONECT 2396 2395 2397 2399 CONECT 2397 2392 2396 2398 CONECT 2398 2397 CONECT 2399 2396 CONECT 2400 2395 CONECT 2401 2394 CONECT 2402 2393 CONECT 2403 2391 CONECT 2404 2391 CONECT 2405 2389 CONECT 2406 2389 CONECT 2407 2388 2408 2416 CONECT 2408 2407 2409 2415 CONECT 2409 2408 2410 2414 CONECT 2410 2387 2409 2411 CONECT 2411 2410 2412 2413 CONECT 2412 2411 CONECT 2413 2411 CONECT 2414 2409 CONECT 2415 2408 CONECT 2416 2407 MASTER 0 0 0 0 0 0 0 0 2415 2 44 19 END
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Structure:
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Related entries of code: 5le1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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PDBbind
266aa, >2YZ3_1|Chains... *
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5acw
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5acx
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5fqc
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PDBbind
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PDBbind
242aa, >5K48_1|Chains... at 99%
5lca
RCSB PDB
PDBbind
266aa, >5LCA_1|Chain... at 100%
5lcf
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PDBbind
266aa, >5LCF_1|Chain... at 100%
5lch
RCSB PDB
PDBbind
266aa, >5LCH_1|Chain... at 100%
5lm6
RCSB PDB
PDBbind
266aa, >5LM6_1|Chains... at 100%
5lsc
RCSB PDB
PDBbind
240aa, >5LSC_1|Chains... at 100%
5mm9
RCSB PDB
PDBbind
241aa, >5MM9_1|Chains... at 99%
5mxq
RCSB PDB
PDBbind
231aa, >5MXQ_1|Chain... at 100%
5mxr
RCSB PDB
PDBbind
232aa, >5MXR_1|Chain... at 100%
5n4s
RCSB PDB
PDBbind
232aa, >5N4S_1|Chains... at 99%
5n4t
RCSB PDB
PDBbind
234aa, >5N4T_1|Chains... at 100%
5nhz
RCSB PDB
PDBbind
266aa, >5NHZ_1|Chains... at 100%
5ni0
RCSB PDB
PDBbind
266aa, >5NI0_1|Chains... at 100%
5y6d
RCSB PDB
PDBbind
231aa, >5Y6D_1|Chains... at 100%
5y6e
RCSB PDB
PDBbind
231aa, >5Y6E_1|Chains... at 100%
6ew3
RCSB PDB
PDBbind
232aa, >6EW3_1|Chains... at 100%
6hf5
RCSB PDB
PDBbind
231aa, >6HF5_1|Chain... at 100%
6o5t
RCSB PDB
PDBbind
242aa, >6O5T_1|Chains... at 99%
6jn6
RCSB PDB
PDBbind
231aa, >6JN6_1|Chains... at 100%
6j8r
RCSB PDB
PDBbind
231aa, >6J8R_1|Chain... at 100%
6dd1
RCSB PDB
PDBbind
242aa, >6DD1_1|Chains... at 99%
5o7n
RCSB PDB
PDBbind
254aa, >5O7N_1|Chains... at 94%
6dd0
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PDBbind
242aa, >6DD0_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5le1
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Verona Integron-encoded MBL (VIM)-2
Ligand Name
6UW
EC.Number
E.C.-.-.-.-
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
IC50=10.6uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Chem Sci Vol. 8: pp. 928-937
Ligand Properties
Formula
C
1
6
H
1
1
ClFNO
3
Molecular Weight
319.715
Exact Mass
319.041
No. of atoms
33
No. of bonds
35
Polar Surface Area
57.61
LOGP Value
3.79 (
Computed with XLOGP3
)
3.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
OC(=O)c1cccc2c1C(=O)N(C2)Cc1c(F)cccc1Cl
InChI String
InChI=1S/C16H11ClFNO3/c17-12-5-2-6-13(18)11(12)8-19-7-9-3-1-4-10(16(21)22)14(9)15(19)20/h1-6H,7-8H2,(H,21,22)
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):
Q9K2N0
Entrez Gene ID
NCBI Entrez Gene ID:
61723701
ASD
Information of known allosteric effects of PDB entries
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