Browse entries in the PDBbind-CN Database
HEADER 4C1E_COMPLEX COMPND 4C1E_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 149 GLU TYR PRO THR VAL SER GLU ILE PRO VAL GLY GLU VAL SEQRES 2 A 149 ARG LEU TYR GLN ILE ALA ASP GLY VAL TRP SER HIS ILE SEQRES 3 A 149 ALA THR GLN SER PHE ASP GLY ALA VAL TYR PRO SER ASN SEQRES 4 A 149 GLY LEU ILE VAL ARG ASP GLY ASP GLU LEU LEU LEU ILE SEQRES 5 A 149 ASP THR ALA TRP GLY ALA LYS ASN THR ALA ALA LEU LEU SEQRES 6 A 149 ALA GLU ILE GLU LYS GLN ILE GLY LEU PRO VAL THR ARG SEQRES 7 A 149 ALA VAL SER THR HIS PHE HIS ASP ASP ARG VAL GLY GLY SEQRES 8 A 149 VAL ASP VAL LEU ARG ALA ALA GLY VAL ALA THR TYR ALA SEQRES 9 A 149 SER PRO SER THR ARG ARG LEU ALA GLU VAL GLU GLY ASN SEQRES 10 A 149 GLU ILE PRO THR HIS SER LEU GLU GLY LEU SER SER SER SEQRES 11 A 149 GLY ASP ALA VAL ARG PHE GLY PRO VAL GLU LEU PHE TYR SEQRES 12 A 149 PRO GLY ALA ALA HIS SER SEQRES 1 A 82 ASP ASN LEU VAL VAL TYR VAL PRO SER ALA SER VAL LEU SEQRES 2 A 82 TYR GLY GLY CYS ALA ILE TYR GLU LEU SER ARG THR SER SEQRES 3 A 82 ALA GLY ASN VAL ALA ASP ALA ASP LEU ALA GLU TRP PRO SEQRES 4 A 82 THR SER ILE GLU ARG ILE GLN GLN HIS TYR PRO GLU ALA SEQRES 5 A 82 GLN PHE VAL ILE PRO GLY HIS GLY LEU PRO GLY GLY LEU SEQRES 6 A 82 ASP LEU LEU LYS HIS THR THR ASN VAL VAL LYS ALA HIS SEQRES 7 A 82 THR ASN ARG SER HET NA A 1 1 HET ZN A 2 1 HET ZN A 3 1 HET ZN A 4 1 HET MCO A 528 28 ATOM 1 N GLU A 32 95.869 -4.920 60.771 1.00 36.34 N ATOM 2 CA GLU A 32 96.627 -3.674 60.819 1.00 35.80 C ATOM 3 C GLU A 32 95.750 -2.410 60.754 1.00 31.92 C ATOM 4 O GLU A 32 95.931 -1.520 61.540 1.00 31.79 O ATOM 5 CB GLU A 32 97.710 -3.601 59.753 1.00 38.88 C ATOM 6 CG GLU A 32 98.605 -2.388 59.929 1.00 41.79 C ATOM 7 CD GLU A 32 99.891 -2.448 59.123 1.00 44.54 C ATOM 8 OE1 GLU A 32 100.227 -3.519 58.614 1.00 45.45 O ATOM 9 OE2 GLU A 32 100.589 -1.421 59.002 1.00 45.73 O ATOM 10 HN3 GLU A 32 95.330 -4.963 59.882 1.00 0.00 H ATOM 11 HN2 GLU A 32 95.213 -4.957 61.577 1.00 0.00 H ATOM 12 HN1 GLU A 32 96.525 -5.726 60.819 1.00 0.00 H ATOM 13 N TYR A 33 94.802 -2.355 59.833 1.00 28.61 N ATOM 14 CA TYR A 33 93.934 -1.172 59.726 1.00 25.54 C ATOM 15 C TYR A 33 93.097 -1.015 60.972 1.00 26.04 C ATOM 16 O TYR A 33 92.495 -1.954 61.418 1.00 27.44 O ATOM 17 CB TYR A 33 93.041 -1.244 58.500 1.00 23.15 C ATOM 18 CG TYR A 33 92.455 0.098 58.115 1.00 20.78 C ATOM 19 CD1 TYR A 33 93.160 0.960 57.301 1.00 20.50 C ATOM 20 CD2 TYR A 33 91.212 0.480 58.561 1.00 19.76 C ATOM 21 CE1 TYR A 33 92.640 2.178 56.932 1.00 19.21 C ATOM 22 CE2 TYR A 33 90.686 1.700 58.205 1.00 18.10 C ATOM 23 CZ TYR A 33 91.415 2.540 57.398 1.00 18.43 C ATOM 24 OH TYR A 33 90.923 3.757 57.028 1.00 17.31 O ATOM 25 HH TYR A 33 91.583 4.217 56.451 1.00 0.00 H ATOM 26 H TYR A 33 94.669 -3.154 59.180 1.00 0.00 H ATOM 27 N PRO A 34 93.061 0.179 61.534 1.00 26.18 N ATOM 28 CA PRO A 34 92.341 0.412 62.781 1.00 26.16 C ATOM 29 C PRO A 34 90.876 0.058 62.646 1.00 25.81 C ATOM 30 O PRO A 34 90.261 0.439 61.678 1.00 25.19 O ATOM 31 CB PRO A 34 92.512 1.910 63.000 1.00 26.72 C ATOM 32 CG PRO A 34 93.765 2.243 62.315 1.00 26.75 C ATOM 33 CD PRO A 34 93.826 1.357 61.120 1.00 26.18 C ATOM 34 N THR A 35 90.324 -0.672 63.596 1.00 26.95 N ATOM 35 CA THR A 35 88.935 -1.083 63.468 1.00 28.26 C ATOM 36 C THR A 35 88.060 -0.408 64.485 1.00 28.19 C ATOM 37 O THR A 35 88.501 0.117 65.455 1.00 28.18 O ATOM 38 CB THR A 35 88.716 -2.616 63.603 1.00 29.42 C ATOM 39 OG1 THR A 35 89.026 -3.022 64.925 1.00 29.40 O ATOM 40 CG2 THR A 35 89.555 -3.397 62.647 1.00 30.70 C ATOM 41 HG1 THR A 35 89.971 -2.804 65.123 1.00 0.00 H ATOM 42 H THR A 35 90.878 -0.952 64.430 1.00 0.00 H ATOM 43 N VAL A 36 86.777 -0.468 64.246 1.00 27.72 N ATOM 44 CA VAL A 36 85.831 0.218 65.083 1.00 28.58 C ATOM 45 C VAL A 36 86.004 -0.211 66.533 1.00 29.45 C ATOM 46 O VAL A 36 85.928 0.618 67.427 1.00 30.05 O ATOM 47 CB VAL A 36 84.391 0.009 64.549 1.00 28.21 C ATOM 48 CG1 VAL A 36 84.081 -1.470 64.313 1.00 27.96 C ATOM 49 CG2 VAL A 36 83.384 0.667 65.460 1.00 27.53 C ATOM 50 H VAL A 36 86.434 -1.022 63.436 1.00 0.00 H ATOM 51 N SER A 37 86.295 -1.495 66.757 1.00 30.14 N ATOM 52 CA SER A 37 86.488 -2.007 68.116 1.00 31.70 C ATOM 53 C SER A 37 87.664 -1.358 68.849 1.00 32.99 C ATOM 54 O SER A 37 87.688 -1.340 70.076 1.00 33.50 O ATOM 55 CB SER A 37 86.671 -3.537 68.110 1.00 31.85 C ATOM 56 H SER A 37 86.386 -2.145 65.950 1.00 0.00 H ATOM 57 N GLU A 38 88.628 -0.814 68.108 1.00 32.62 N ATOM 58 CA GLU A 38 89.871 -0.329 68.713 1.00 32.96 C ATOM 59 C GLU A 38 89.896 1.173 69.048 1.00 30.92 C ATOM 60 O GLU A 38 90.848 1.647 69.671 1.00 30.55 O ATOM 61 CB GLU A 38 91.064 -0.659 67.798 1.00 35.75 C ATOM 62 CG GLU A 38 91.242 -2.142 67.494 1.00 38.41 C ATOM 63 CD GLU A 38 92.429 -2.425 66.588 1.00 40.77 C ATOM 64 OE1 GLU A 38 92.366 -2.074 65.392 1.00 41.34 O ATOM 65 OE2 GLU A 38 93.437 -2.995 67.071 1.00 42.06 O ATOM 66 H GLU A 38 88.496 -0.732 67.080 1.00 0.00 H ATOM 67 N ILE A 39 88.876 1.921 68.637 1.00 29.39 N ATOM 68 CA ILE A 39 88.915 3.384 68.732 1.00 27.87 C ATOM 69 C ILE A 39 87.772 3.968 69.562 1.00 26.49 C ATOM 70 O ILE A 39 86.621 4.031 69.093 1.00 26.32 O ATOM 71 CB ILE A 39 88.803 4.031 67.334 1.00 26.75 C ATOM 72 CG1 ILE A 39 89.864 3.451 66.392 1.00 27.06 C ATOM 73 CG2 ILE A 39 88.902 5.559 67.426 1.00 25.98 C ATOM 74 CD1 ILE A 39 89.623 3.784 64.920 1.00 26.95 C ATOM 75 H ILE A 39 88.033 1.459 68.240 1.00 0.00 H ATOM 76 N PRO A 40 88.080 4.452 70.768 1.00 25.99 N ATOM 77 CA PRO A 40 87.029 5.081 71.570 1.00 25.46 C ATOM 78 C PRO A 40 86.485 6.337 70.901 1.00 23.52 C ATOM 79 O PRO A 40 87.240 7.030 70.232 1.00 22.48 O ATOM 80 CB PRO A 40 87.750 5.422 72.881 1.00 25.42 C ATOM 81 CG PRO A 40 88.943 4.497 72.915 1.00 26.46 C ATOM 82 CD PRO A 40 89.371 4.431 71.486 1.00 25.83 C ATOM 83 N VAL A 41 85.192 6.609 71.072 1.00 21.85 N ATOM 84 CA VAL A 41 84.580 7.813 70.501 1.00 22.06 C ATOM 85 C VAL A 41 85.302 9.020 71.097 1.00 21.98 C ATOM 86 O VAL A 41 85.450 9.117 72.304 1.00 21.83 O ATOM 87 CB VAL A 41 83.069 7.868 70.795 1.00 21.18 C ATOM 88 CG1 VAL A 41 82.461 9.202 70.300 1.00 19.79 C ATOM 89 CG2 VAL A 41 82.392 6.709 70.124 1.00 20.55 C ATOM 90 H VAL A 41 84.603 5.952 71.623 1.00 0.00 H ATOM 91 N GLY A 42 85.779 9.928 70.248 1.00 21.04 N ATOM 92 CA GLY A 42 86.560 11.056 70.722 1.00 21.01 C ATOM 93 C GLY A 42 88.023 10.981 70.331 1.00 21.63 C ATOM 94 O GLY A 42 88.706 11.993 70.370 1.00 22.15 O ATOM 95 H GLY A 42 85.589 9.828 69.230 1.00 0.00 H ATOM 96 N GLU A 43 88.487 9.787 69.973 1.00 20.92 N ATOM 97 CA GLU A 43 89.870 9.573 69.572 1.00 22.10 C ATOM 98 C GLU A 43 89.952 9.308 68.067 1.00 20.24 C ATOM 99 O GLU A 43 88.979 8.894 67.421 1.00 19.85 O ATOM 100 CB GLU A 43 90.497 8.408 70.363 1.00 24.46 C ATOM 101 CG GLU A 43 90.508 8.592 71.896 1.00 27.40 C ATOM 102 CD GLU A 43 91.255 7.483 72.619 1.00 29.99 C ATOM 103 OE1 GLU A 43 92.109 6.824 71.988 1.00 30.58 O ATOM 104 OE2 GLU A 43 90.979 7.261 73.825 1.00 31.12 O ATOM 105 H GLU A 43 87.837 8.975 69.980 1.00 0.00 H ATOM 106 N VAL A 44 91.119 9.580 67.505 1.00 19.02 N ATOM 107 CA VAL A 44 91.347 9.451 66.074 1.00 18.39 C ATOM 108 C VAL A 44 92.650 8.683 65.846 1.00 17.98 C ATOM 109 O VAL A 44 93.653 8.942 66.513 1.00 19.15 O ATOM 110 CB VAL A 44 91.410 10.831 65.396 1.00 18.70 C ATOM 111 CG1 VAL A 44 91.790 10.691 63.936 1.00 19.30 C ATOM 112 CG2 VAL A 44 90.055 11.523 65.527 1.00 17.70 C ATOM 113 H VAL A 44 91.903 9.898 68.110 1.00 0.00 H ATOM 114 N ARG A 45 92.635 7.763 64.888 1.00 17.72 N ATOM 115 CA ARG A 45 93.830 7.044 64.458 1.00 19.12 C ATOM 116 C ARG A 45 94.186 7.470 63.035 1.00 17.54 C ATOM 117 O ARG A 45 93.318 7.826 62.233 1.00 16.69 O ATOM 118 CB ARG A 45 93.619 5.530 64.485 1.00 21.94 C ATOM 119 CG ARG A 45 93.138 4.973 65.800 1.00 25.44 C ATOM 120 CD ARG A 45 94.246 4.855 66.809 1.00 27.72 C ATOM 121 NE ARG A 45 93.782 3.985 67.888 1.00 29.84 N ATOM 122 CZ ARG A 45 93.369 4.408 69.081 1.00 31.59 C ATOM 123 NH1 ARG A 45 93.411 5.696 69.398 1.00 31.73 N ATOM 124 NH2 ARG A 45 92.936 3.535 69.978 1.00 31.89 N ATOM 125 HE ARG A 45 93.774 2.960 67.711 1.00 0.00 H ATOM 126 HH12 ARG A 45 93.085 6.012 70.334 1.00 0.00 H ATOM 127 HH11 ARG A 45 93.770 6.389 68.711 1.00 0.00 H ATOM 128 HH22 ARG A 45 92.613 3.864 70.910 1.00 0.00 H ATOM 129 HH21 ARG A 45 92.919 2.520 69.750 1.00 0.00 H ATOM 130 H ARG A 45 91.731 7.545 64.423 1.00 0.00 H ATOM 131 N LEU A 46 95.473 7.403 62.718 1.00 18.19 N ATOM 132 CA LEU A 46 95.927 7.612 61.357 1.00 17.46 C ATOM 133 C LEU A 46 96.500 6.297 60.879 1.00 18.15 C ATOM 134 O LEU A 46 97.015 5.504 61.687 1.00 18.53 O ATOM 135 CB LEU A 46 97.001 8.684 61.312 1.00 17.41 C ATOM 136 CG LEU A 46 96.623 10.016 61.964 1.00 16.10 C ATOM 137 CD1 LEU A 46 97.759 10.984 61.781 1.00 17.66 C ATOM 138 CD2 LEU A 46 95.334 10.511 61.337 1.00 16.11 C ATOM 139 H LEU A 46 96.170 7.196 63.461 1.00 0.00 H ATOM 140 N TYR A 47 96.397 6.063 59.580 1.00 17.55 N ATOM 141 CA TYR A 47 96.910 4.834 58.973 1.00 17.47 C ATOM 142 C TYR A 47 97.671 5.258 57.724 1.00 18.63 C ATOM 143 O TYR A 47 97.078 5.814 56.797 1.00 19.23 O ATOM 144 CB TYR A 47 95.762 3.911 58.581 1.00 18.32 C ATOM 145 CG TYR A 47 96.235 2.629 57.924 1.00 20.27 C ATOM 146 CD1 TYR A 47 96.655 1.559 58.696 1.00 22.06 C ATOM 147 CD2 TYR A 47 96.299 2.491 56.535 1.00 20.77 C ATOM 148 CE1 TYR A 47 97.089 0.394 58.123 1.00 23.44 C ATOM 149 CE2 TYR A 47 96.735 1.307 55.951 1.00 22.54 C ATOM 150 CZ TYR A 47 97.139 0.265 56.757 1.00 23.61 C ATOM 151 OH TYR A 47 97.586 -0.952 56.241 1.00 25.53 O ATOM 152 HH TYR A 47 97.825 -1.557 56.987 1.00 0.00 H ATOM 153 H TYR A 47 95.938 6.773 58.974 1.00 0.00 H ATOM 154 N GLN A 48 98.979 5.018 57.703 1.00 19.02 N ATOM 155 CA GLN A 48 99.762 5.450 56.557 1.00 21.14 C ATOM 156 C GLN A 48 99.664 4.430 55.433 1.00 21.83 C ATOM 157 O GLN A 48 100.055 3.283 55.585 1.00 21.99 O ATOM 158 CB GLN A 48 101.226 5.721 56.915 1.00 23.36 C ATOM 159 CG GLN A 48 101.988 6.401 55.747 1.00 26.65 C ATOM 160 CD GLN A 48 103.334 7.004 56.146 1.00 29.87 C ATOM 161 OE1 GLN A 48 103.847 6.755 57.232 1.00 31.43 O ATOM 162 NE2 GLN A 48 103.907 7.806 55.256 1.00 31.57 N ATOM 163 HE22 GLN A 48 103.439 7.992 54.346 1.00 0.00 H ATOM 164 HE21 GLN A 48 104.824 8.248 55.469 1.00 0.00 H ATOM 165 H GLN A 48 99.436 4.527 58.497 1.00 0.00 H ATOM 166 N ILE A 49 99.133 4.887 54.305 1.00 21.43 N ATOM 167 CA ILE A 49 98.957 4.052 53.115 1.00 23.57 C ATOM 168 C ILE A 49 100.212 4.060 52.229 1.00 25.55 C ATOM 169 O ILE A 49 100.645 3.015 51.731 1.00 26.88 O ATOM 170 CB ILE A 49 97.742 4.530 52.273 1.00 24.04 C ATOM 171 CG1 ILE A 49 96.458 4.536 53.111 1.00 23.90 C ATOM 172 CG2 ILE A 49 97.591 3.653 51.023 1.00 23.89 C ATOM 173 CD1 ILE A 49 95.401 5.519 52.634 1.00 23.21 C ATOM 174 H ILE A 49 98.829 5.881 54.265 1.00 0.00 H ATOM 175 N ALA A 50 100.794 5.236 52.038 1.00 26.32 N ATOM 176 CA ALA A 50 101.962 5.384 51.186 1.00 26.71 C ATOM 177 C ALA A 50 102.715 6.617 51.627 1.00 27.24 C ATOM 178 O ALA A 50 102.286 7.321 52.550 1.00 26.57 O ATOM 179 CB ALA A 50 101.550 5.523 49.735 1.00 27.43 C ATOM 180 H ALA A 50 100.404 6.076 52.511 1.00 0.00 H ATOM 181 N ASP A 51 103.843 6.866 50.978 1.00 28.36 N ATOM 182 CA ASP A 51 104.599 8.067 51.225 1.00 29.94 C ATOM 183 C ASP A 51 103.632 9.234 51.083 1.00 27.77 C ATOM 184 O ASP A 51 103.030 9.452 50.029 1.00 27.66 O ATOM 185 CB ASP A 51 105.772 8.183 50.240 1.00 33.31 C ATOM 186 CG ASP A 51 106.689 9.354 50.543 1.00 36.91 C ATOM 187 OD1 ASP A 51 106.447 10.066 51.540 1.00 38.40 O ATOM 188 OD2 ASP A 51 107.668 9.567 49.778 1.00 38.71 O ATOM 189 H ASP A 51 104.189 6.181 50.276 1.00 0.00 H ATOM 190 N GLY A 52 103.460 9.957 52.173 1.00 25.59 N ATOM 191 CA GLY A 52 102.593 11.118 52.173 1.00 22.72 C ATOM 192 C GLY A 52 101.089 10.921 51.928 1.00 19.72 C ATOM 193 O GLY A 52 100.416 11.856 51.509 1.00 18.22 O ATOM 194 H GLY A 52 103.955 9.689 53.047 1.00 0.00 H ATOM 195 N VAL A 53 100.570 9.729 52.180 1.00 18.03 N ATOM 196 CA VAL A 53 99.132 9.495 52.117 1.00 17.95 C ATOM 197 C VAL A 53 98.719 8.671 53.321 1.00 17.89 C ATOM 198 O VAL A 53 99.257 7.576 53.556 1.00 18.34 O ATOM 199 CB VAL A 53 98.699 8.762 50.835 1.00 18.49 C ATOM 200 CG1 VAL A 53 97.194 8.675 50.774 1.00 18.53 C ATOM 201 CG2 VAL A 53 99.258 9.453 49.589 1.00 19.15 C ATOM 202 H VAL A 53 101.202 8.942 52.429 1.00 0.00 H ATOM 203 N TRP A 54 97.737 9.165 54.060 1.00 15.51 N ATOM 204 CA TRP A 54 97.179 8.487 55.209 1.00 15.44 C ATOM 205 C TRP A 54 95.681 8.489 55.132 1.00 15.08 C ATOM 206 O TRP A 54 95.106 9.396 54.548 1.00 15.76 O ATOM 207 CB TRP A 54 97.526 9.219 56.488 1.00 15.99 C ATOM 208 CG TRP A 54 98.978 9.464 56.790 1.00 16.69 C ATOM 209 CD1 TRP A 54 99.760 8.803 57.710 1.00 18.28 C ATOM 210 CD2 TRP A 54 99.841 10.503 56.240 1.00 16.89 C ATOM 211 NE1 TRP A 54 101.007 9.328 57.740 1.00 18.05 N ATOM 212 CE2 TRP A 54 101.127 10.336 56.889 1.00 17.14 C ATOM 213 CE3 TRP A 54 99.688 11.497 55.307 1.00 17.33 C ATOM 214 CZ2 TRP A 54 102.195 11.142 56.604 1.00 16.79 C ATOM 215 CZ3 TRP A 54 100.774 12.305 55.024 1.00 17.26 C ATOM 216 CH2 TRP A 54 101.999 12.122 55.650 1.00 16.85 C ATOM 217 HE1 TRP A 54 101.773 8.984 58.353 1.00 0.00 H ATOM 218 H TRP A 54 97.345 10.092 53.799 1.00 0.00 H ATOM 219 N SER A 55 95.016 7.539 55.770 1.00 14.98 N ATOM 220 CA SER A 55 93.614 7.752 56.108 1.00 14.84 C ATOM 221 C SER A 55 93.539 8.168 57.576 1.00 13.91 C ATOM 222 O SER A 55 94.464 7.932 58.359 1.00 14.53 O ATOM 223 CB SER A 55 92.752 6.495 55.849 1.00 15.74 C ATOM 224 OG SER A 55 93.248 5.411 56.607 1.00 15.80 O ATOM 225 HG SER A 55 92.692 4.609 56.437 1.00 0.00 H ATOM 226 H SER A 55 95.489 6.649 56.028 1.00 0.00 H ATOM 227 N HIS A 56 92.441 8.839 57.934 1.00 13.53 N ATOM 228 CA HIS A 56 92.137 9.094 59.343 1.00 13.45 C ATOM 229 C HIS A 56 90.889 8.319 59.665 1.00 12.43 C ATOM 230 O HIS A 56 90.004 8.182 58.826 1.00 12.94 O ATOM 231 CB HIS A 56 92.041 10.599 59.687 1.00 12.71 C ATOM 232 CG HIS A 56 90.990 11.405 58.964 1.00 12.02 C ATOM 233 ND1 HIS A 56 89.669 11.481 59.374 1.00 13.00 N ATOM 234 CD2 HIS A 56 91.109 12.289 57.938 1.00 10.99 C ATOM 235 CE1 HIS A 56 89.026 12.358 58.622 1.00 12.62 C ATOM 236 NE2 HIS A 56 89.871 12.857 57.735 1.00 11.43 N ATOM 237 H HIS A 56 91.791 9.186 57.200 1.00 0.00 H ATOM 238 N ILE A 57 90.830 7.788 60.867 1.00 13.06 N ATOM 239 CA ILE A 57 89.726 6.916 61.275 1.00 13.91 C ATOM 240 C ILE A 57 89.231 7.407 62.633 1.00 14.19 C ATOM 241 O ILE A 57 90.009 7.572 63.578 1.00 14.31 O ATOM 242 CB ILE A 57 90.121 5.419 61.386 1.00 16.54 C ATOM 243 CG1 ILE A 57 90.867 4.923 60.141 1.00 17.18 C ATOM 244 CG2 ILE A 57 88.859 4.600 61.626 1.00 17.66 C ATOM 245 CD1 ILE A 57 92.360 5.181 60.127 1.00 18.56 C ATOM 246 H ILE A 57 91.589 7.993 61.547 1.00 0.00 H ATOM 247 N ALA A 58 87.934 7.644 62.720 1.00 13.63 N ATOM 248 CA ALA A 58 87.289 8.079 63.934 1.00 13.83 C ATOM 249 C ALA A 58 86.042 7.231 64.113 1.00 14.55 C ATOM 250 O ALA A 58 85.695 6.444 63.234 1.00 15.56 O ATOM 251 CB ALA A 58 86.919 9.511 63.799 1.00 14.54 C ATOM 252 H ALA A 58 87.349 7.510 61.870 1.00 0.00 H ATOM 253 N THR A 59 85.384 7.372 65.256 1.00 14.43 N ATOM 254 CA THR A 59 84.177 6.620 65.544 1.00 14.90 C ATOM 255 C THR A 59 83.135 7.540 66.126 1.00 14.73 C ATOM 256 O THR A 59 83.437 8.608 66.647 1.00 14.43 O ATOM 257 CB THR A 59 84.461 5.485 66.554 1.00 16.62 C ATOM 258 OG1 THR A 59 85.207 6.028 67.653 1.00 17.90 O ATOM 259 CG2 THR A 59 85.267 4.391 65.930 1.00 16.94 C ATOM 260 HG1 THR A 59 85.396 5.311 68.309 1.00 0.00 H ATOM 261 H THR A 59 85.744 8.041 65.966 1.00 0.00 H ATOM 262 N GLN A 60 81.878 7.102 66.056 1.00 14.40 N ATOM 263 CA GLN A 60 80.782 7.917 66.546 1.00 14.82 C ATOM 264 C GLN A 60 79.614 6.996 66.915 1.00 14.58 C ATOM 265 O GLN A 60 79.458 5.910 66.346 1.00 14.08 O ATOM 266 CB GLN A 60 80.388 8.877 65.439 1.00 15.65 C ATOM 267 CG GLN A 60 79.542 10.033 65.865 1.00 16.10 C ATOM 268 CD GLN A 60 80.060 10.686 67.112 1.00 16.72 C ATOM 269 OE1 GLN A 60 79.643 10.336 68.210 1.00 17.19 O ATOM 270 NE2 GLN A 60 80.994 11.580 66.967 1.00 17.43 N ATOM 271 HE22 GLN A 60 81.316 11.846 66.015 1.00 0.00 H ATOM 272 HE21 GLN A 60 81.418 12.029 67.804 1.00 0.00 H ATOM 273 H GLN A 60 81.681 6.167 65.646 1.00 0.00 H ATOM 274 N SER A 61 78.839 7.416 67.913 1.00 16.11 N ATOM 275 CA SER A 61 77.589 6.724 68.258 1.00 16.01 C ATOM 276 C SER A 61 76.534 7.010 67.204 1.00 16.22 C ATOM 277 O SER A 61 76.323 8.142 66.790 1.00 16.82 O ATOM 278 CB SER A 61 77.056 7.140 69.637 1.00 16.74 C ATOM 279 OG SER A 61 77.992 6.844 70.658 1.00 16.90 O ATOM 280 HG SER A 61 77.623 7.122 71.533 1.00 0.00 H ATOM 281 H SER A 61 79.125 8.253 68.461 1.00 0.00 H ATOM 282 N PHE A 62 75.875 5.959 66.743 1.00 14.34 N ATOM 283 CA PHE A 62 74.855 6.114 65.714 1.00 14.02 C ATOM 284 C PHE A 62 73.920 4.910 65.838 1.00 14.26 C ATOM 285 O PHE A 62 74.391 3.760 65.868 1.00 13.48 O ATOM 286 CB PHE A 62 75.505 6.140 64.313 1.00 14.89 C ATOM 287 CG PHE A 62 74.546 6.446 63.212 1.00 15.57 C ATOM 288 CD1 PHE A 62 73.843 5.430 62.567 1.00 15.35 C ATOM 289 CD2 PHE A 62 74.337 7.742 62.818 1.00 16.01 C ATOM 290 CE1 PHE A 62 72.948 5.730 61.563 1.00 16.33 C ATOM 291 CE2 PHE A 62 73.422 8.042 61.823 1.00 16.35 C ATOM 292 CZ PHE A 62 72.759 7.041 61.181 1.00 16.16 C ATOM 293 H PHE A 62 76.087 5.013 67.119 1.00 0.00 H ATOM 294 N ASP A 63 72.610 5.168 65.930 1.00 13.70 N ATOM 295 CA ASP A 63 71.589 4.102 66.047 1.00 14.31 C ATOM 296 C ASP A 63 71.816 3.192 67.250 1.00 14.23 C ATOM 297 O ASP A 63 71.404 2.035 67.235 1.00 15.02 O ATOM 298 CB ASP A 63 71.519 3.260 64.755 1.00 14.54 C ATOM 299 CG ASP A 63 70.320 2.287 64.718 1.00 14.98 C ATOM 300 OD1 ASP A 63 69.186 2.728 65.046 1.00 14.12 O ATOM 301 OD2 ASP A 63 70.520 1.087 64.329 1.00 14.20 O ATOM 302 H ASP A 63 72.296 6.159 65.919 1.00 0.00 H ATOM 303 N GLY A 64 72.467 3.703 68.293 1.00 13.82 N ATOM 304 CA GLY A 64 72.731 2.914 69.481 1.00 15.25 C ATOM 305 C GLY A 64 73.925 1.986 69.292 1.00 15.29 C ATOM 306 O GLY A 64 74.242 1.174 70.162 1.00 17.65 O ATOM 307 H GLY A 64 72.793 4.690 68.255 1.00 0.00 H ATOM 308 N ALA A 65 74.606 2.114 68.157 1.00 13.46 N ATOM 309 CA ALA A 65 75.832 1.368 67.873 1.00 13.80 C ATOM 310 C ALA A 65 77.017 2.328 67.875 1.00 14.10 C ATOM 311 O ALA A 65 76.860 3.496 68.092 1.00 13.80 O ATOM 312 CB ALA A 65 75.715 0.744 66.519 1.00 13.85 C ATOM 313 H ALA A 65 74.250 2.775 67.438 1.00 0.00 H ATOM 314 N VAL A 66 78.209 1.806 67.631 1.00 13.26 N ATOM 315 CA VAL A 66 79.351 2.634 67.290 1.00 14.97 C ATOM 316 C VAL A 66 79.821 2.251 65.910 1.00 13.75 C ATOM 317 O VAL A 66 80.020 1.067 65.621 1.00 14.39 O ATOM 318 CB VAL A 66 80.498 2.509 68.302 1.00 15.83 C ATOM 319 CG1 VAL A 66 81.747 3.339 67.862 1.00 16.09 C ATOM 320 CG2 VAL A 66 80.038 2.982 69.666 1.00 16.82 C ATOM 321 H VAL A 66 78.330 0.775 67.685 1.00 0.00 H ATOM 322 N TYR A 67 79.977 3.259 65.058 1.00 11.98 N ATOM 323 CA TYR A 67 80.417 3.091 63.678 1.00 12.57 C ATOM 324 C TYR A 67 81.755 3.810 63.474 1.00 12.65 C ATOM 325 O TYR A 67 81.962 4.840 64.054 1.00 12.91 O ATOM 326 CB TYR A 67 79.377 3.692 62.718 1.00 13.11 C ATOM 327 CG TYR A 67 78.217 2.795 62.332 1.00 12.70 C ATOM 328 CD1 TYR A 67 77.078 2.731 63.096 1.00 12.67 C ATOM 329 CD2 TYR A 67 78.259 2.053 61.187 1.00 13.50 C ATOM 330 CE1 TYR A 67 76.017 1.943 62.731 1.00 12.52 C ATOM 331 CE2 TYR A 67 77.203 1.256 60.817 1.00 12.99 C ATOM 332 CZ TYR A 67 76.095 1.195 61.601 1.00 12.28 C ATOM 333 OH TYR A 67 75.074 0.384 61.195 1.00 12.79 O ATOM 334 HH TYR A 67 74.335 0.432 61.852 1.00 0.00 H ATOM 335 H TYR A 67 79.774 4.222 65.394 1.00 0.00 H ATOM 336 N PRO A 68 82.626 3.260 62.636 1.00 13.02 N ATOM 337 CA PRO A 68 83.868 3.935 62.284 1.00 13.28 C ATOM 338 C PRO A 68 83.600 4.822 61.084 1.00 13.02 C ATOM 339 O PRO A 68 82.575 4.635 60.422 1.00 12.23 O ATOM 340 CB PRO A 68 84.780 2.744 61.907 1.00 13.68 C ATOM 341 CG PRO A 68 83.834 1.815 61.202 1.00 14.58 C ATOM 342 CD PRO A 68 82.509 1.963 61.940 1.00 14.44 C ATOM 343 N SER A 69 84.518 5.743 60.781 1.00 12.72 N ATOM 344 CA SER A 69 84.396 6.601 59.619 1.00 11.54 C ATOM 345 C SER A 69 85.801 7.017 59.181 1.00 11.12 C ATOM 346 O SER A 69 86.657 7.330 60.013 1.00 11.69 O ATOM 347 CB SER A 69 83.561 7.850 59.987 1.00 11.53 C ATOM 348 OG SER A 69 83.304 8.644 58.864 1.00 11.01 O ATOM 349 HG SER A 69 84.161 8.944 58.470 1.00 0.00 H ATOM 350 H SER A 69 85.348 5.848 61.399 1.00 0.00 H ATOM 351 N ASN A 70 86.024 6.978 57.872 1.00 10.71 N ATOM 352 CA ASN A 70 87.313 7.326 57.277 1.00 10.89 C ATOM 353 C ASN A 70 87.341 8.652 56.561 1.00 11.02 C ATOM 354 O ASN A 70 86.376 9.010 55.894 1.00 12.30 O ATOM 355 CB ASN A 70 87.717 6.317 56.197 1.00 11.54 C ATOM 356 CG ASN A 70 87.789 4.915 56.704 1.00 11.59 C ATOM 357 OD1 ASN A 70 88.443 4.666 57.697 1.00 12.56 O ATOM 358 ND2 ASN A 70 87.150 3.976 56.016 1.00 11.64 N ATOM 359 HD22 ASN A 70 86.601 4.233 55.171 1.00 0.00 H ATOM 360 HD21 ASN A 70 87.198 2.983 56.322 1.00 0.00 H ATOM 361 H ASN A 70 85.248 6.687 57.243 1.00 0.00 H ATOM 362 N GLY A 71 88.495 9.317 56.647 1.00 10.42 N ATOM 363 CA GLY A 71 88.871 10.449 55.805 1.00 10.64 C ATOM 364 C GLY A 71 90.259 10.183 55.231 1.00 11.03 C ATOM 365 O GLY A 71 90.821 9.093 55.415 1.00 11.51 O ATOM 366 H GLY A 71 89.177 9.006 57.368 1.00 0.00 H ATOM 367 N LEU A 72 90.818 11.191 54.548 1.00 11.10 N ATOM 368 CA LEU A 72 92.148 11.093 53.933 1.00 11.62 C ATOM 369 C LEU A 72 93.003 12.296 54.281 1.00 11.66 C ATOM 370 O LEU A 72 92.481 13.394 54.528 1.00 11.24 O ATOM 371 CB LEU A 72 91.998 11.021 52.424 1.00 12.10 C ATOM 372 CG LEU A 72 93.075 10.199 51.715 1.00 13.63 C ATOM 373 CD1 LEU A 72 92.943 8.690 52.050 1.00 13.80 C ATOM 374 CD2 LEU A 72 93.005 10.440 50.235 1.00 14.26 C ATOM 375 H LEU A 72 90.288 12.080 54.449 1.00 0.00 H ATOM 376 N ILE A 73 94.322 12.085 54.307 1.00 11.38 N ATOM 377 CA ILE A 73 95.297 13.167 54.426 1.00 11.21 C ATOM 378 C ILE A 73 96.337 12.931 53.341 1.00 11.57 C ATOM 379 O ILE A 73 96.870 11.817 53.211 1.00 12.85 O ATOM 380 CB ILE A 73 96.000 13.127 55.781 1.00 12.44 C ATOM 381 CG1 ILE A 73 94.982 13.153 56.910 1.00 12.77 C ATOM 382 CG2 ILE A 73 96.998 14.284 55.923 1.00 14.31 C ATOM 383 CD1 ILE A 73 95.536 12.677 58.249 1.00 12.75 C ATOM 384 H ILE A 73 94.670 11.107 54.240 1.00 0.00 H ATOM 385 N VAL A 74 96.641 13.978 52.574 1.00 11.35 N ATOM 386 CA VAL A 74 97.623 13.891 51.511 1.00 12.16 C ATOM 387 C VAL A 74 98.630 15.022 51.646 1.00 14.21 C ATOM 388 O VAL A 74 98.279 16.200 51.675 1.00 14.03 O ATOM 389 CB VAL A 74 96.931 13.974 50.137 1.00 12.49 C ATOM 390 CG1 VAL A 74 97.965 13.742 49.037 1.00 13.57 C ATOM 391 CG2 VAL A 74 95.814 12.971 50.019 1.00 13.29 C ATOM 392 H VAL A 74 96.159 14.884 52.743 1.00 0.00 H ATOM 393 N ARG A 75 99.896 14.651 51.716 1.00 16.37 N ATOM 394 CA ARG A 75 100.941 15.637 51.799 1.00 18.41 C ATOM 395 C ARG A 75 101.071 16.404 50.477 1.00 19.50 C ATOM 396 O ARG A 75 101.012 15.821 49.398 1.00 19.66 O ATOM 397 CB ARG A 75 102.262 14.961 52.168 1.00 21.46 C ATOM 398 CG ARG A 75 103.437 15.945 52.286 1.00 23.79 C ATOM 399 CD ARG A 75 104.691 15.341 52.925 1.00 26.44 C ATOM 400 NE ARG A 75 105.698 16.384 53.117 1.00 27.92 N ATOM 401 CZ ARG A 75 106.749 16.297 53.936 1.00 29.61 C ATOM 402 NH1 ARG A 75 106.930 15.219 54.692 1.00 30.05 N ATOM 403 NH2 ARG A 75 107.600 17.312 54.025 1.00 30.17 N ATOM 404 HE ARG A 75 105.587 17.263 52.573 1.00 0.00 H ATOM 405 HH12 ARG A 75 107.752 15.161 55.327 1.00 0.00 H ATOM 406 HH11 ARG A 75 106.250 14.433 54.649 1.00 0.00 H ATOM 407 HH22 ARG A 75 108.420 17.249 54.662 1.00 0.00 H ATOM 408 HH21 ARG A 75 107.447 18.170 53.458 1.00 0.00 H ATOM 409 H ARG A 75 100.139 13.640 51.711 1.00 0.00 H ATOM 410 N ASP A 76 101.226 17.718 50.576 1.00 20.91 N ATOM 411 CA ASP A 76 101.484 18.518 49.397 1.00 24.21 C ATOM 412 C ASP A 76 102.576 19.491 49.718 1.00 24.77 C ATOM 413 O ASP A 76 102.329 20.575 50.256 1.00 24.40 O ATOM 414 CB ASP A 76 100.269 19.280 48.943 1.00 27.36 C ATOM 415 CG ASP A 76 100.509 20.023 47.626 1.00 29.06 C ATOM 416 OD1 ASP A 76 101.519 19.771 46.899 1.00 30.40 O ATOM 417 OD2 ASP A 76 99.656 20.868 47.326 1.00 29.08 O ATOM 418 H ASP A 76 101.162 18.177 51.507 1.00 0.00 H ATOM 419 N GLY A 77 103.783 19.077 49.381 1.00 26.48 N ATOM 420 CA GLY A 77 104.962 19.826 49.743 1.00 27.00 C ATOM 421 C GLY A 77 105.177 19.713 51.225 1.00 27.84 C ATOM 422 O GLY A 77 105.277 18.614 51.759 1.00 29.31 O ATOM 423 H GLY A 77 103.886 18.193 48.843 1.00 0.00 H ATOM 424 N ASP A 78 105.225 20.855 51.894 1.00 27.22 N ATOM 425 CA ASP A 78 105.395 20.894 53.330 1.00 27.69 C ATOM 426 C ASP A 78 104.095 21.274 53.996 1.00 24.92 C ATOM 427 O ASP A 78 104.102 21.724 55.121 1.00 24.93 O ATOM 428 CB ASP A 78 106.474 21.897 53.705 1.00 31.24 C ATOM 429 CG ASP A 78 107.851 21.405 53.346 1.00 34.98 C ATOM 430 OD1 ASP A 78 108.068 20.178 53.435 1.00 36.52 O ATOM 431 OD2 ASP A 78 108.699 22.230 52.976 1.00 36.58 O ATOM 432 H ASP A 78 105.138 21.750 51.372 1.00 0.00 H ATOM 433 N GLU A 79 102.986 21.088 53.284 1.00 22.47 N ATOM 434 CA GLU A 79 101.640 21.290 53.837 1.00 21.17 C ATOM 435 C GLU A 79 100.802 20.026 53.646 1.00 17.90 C ATOM 436 O GLU A 79 101.210 19.096 52.957 1.00 17.49 O ATOM 437 CB GLU A 79 100.926 22.456 53.141 1.00 23.77 C ATOM 438 CG GLU A 79 101.652 23.777 53.116 1.00 27.16 C ATOM 439 CD GLU A 79 100.908 24.819 52.282 1.00 29.67 C ATOM 440 OE1 GLU A 79 99.755 24.580 51.844 1.00 30.22 O ATOM 441 OE2 GLU A 79 101.469 25.893 52.080 1.00 32.10 O ATOM 442 H GLU A 79 103.076 20.786 52.293 1.00 0.00 H ATOM 443 N LEU A 80 99.617 20.004 54.239 1.00 14.83 N ATOM 444 CA LEU A 80 98.725 18.859 54.128 1.00 14.00 C ATOM 445 C LEU A 80 97.378 19.293 53.580 1.00 13.31 C ATOM 446 O LEU A 80 96.858 20.363 53.949 1.00 13.74 O ATOM 447 CB LEU A 80 98.494 18.170 55.473 1.00 14.09 C ATOM 448 CG LEU A 80 99.727 17.673 56.205 1.00 15.57 C ATOM 449 CD1 LEU A 80 99.361 17.200 57.586 1.00 17.01 C ATOM 450 CD2 LEU A 80 100.422 16.594 55.421 1.00 16.51 C ATOM 451 H LEU A 80 99.316 20.827 54.799 1.00 0.00 H ATOM 452 N LEU A 81 96.824 18.433 52.718 1.00 11.99 N ATOM 453 CA LEU A 81 95.442 18.486 52.267 1.00 11.24 C ATOM 454 C LEU A 81 94.623 17.466 53.035 1.00 11.86 C ATOM 455 O LEU A 81 94.957 16.307 53.045 1.00 11.88 O ATOM 456 CB LEU A 81 95.378 18.187 50.769 1.00 11.18 C ATOM 457 CG LEU A 81 93.968 18.075 50.177 1.00 12.13 C ATOM 458 CD1 LEU A 81 93.171 19.376 50.298 1.00 13.25 C ATOM 459 CD2 LEU A 81 94.075 17.609 48.737 1.00 13.51 C ATOM 460 H LEU A 81 97.425 17.671 52.343 1.00 0.00 H ATOM 461 N LEU A 82 93.543 17.915 53.661 1.00 11.15 N ATOM 462 CA LEU A 82 92.643 17.027 54.377 1.00 10.34 C ATOM 463 C LEU A 82 91.404 16.732 53.570 1.00 10.44 C ATOM 464 O LEU A 82 90.826 17.623 52.958 1.00 10.36 O ATOM 465 CB LEU A 82 92.230 17.703 55.655 1.00 10.64 C ATOM 466 CG LEU A 82 91.273 16.963 56.578 1.00 11.10 C ATOM 467 CD1 LEU A 82 91.908 15.687 57.137 1.00 11.56 C ATOM 468 CD2 LEU A 82 90.817 17.887 57.671 1.00 11.17 C ATOM 469 H LEU A 82 93.334 18.934 53.639 1.00 0.00 H ATOM 470 N ILE A 83 91.013 15.464 53.548 1.00 9.65 N ATOM 471 CA ILE A 83 89.743 15.072 52.937 1.00 9.51 C ATOM 472 C ILE A 83 88.839 14.608 54.044 1.00 10.19 C ATOM 473 O ILE A 83 89.114 13.587 54.697 1.00 10.40 O ATOM 474 CB ILE A 83 89.901 13.941 51.895 1.00 10.57 C ATOM 475 CG1 ILE A 83 90.994 14.279 50.862 1.00 10.67 C ATOM 476 CG2 ILE A 83 88.589 13.619 51.253 1.00 9.99 C ATOM 477 CD1 ILE A 83 90.738 15.493 49.951 1.00 10.44 C ATOM 478 H ILE A 83 91.621 14.735 53.973 1.00 0.00 H ATOM 479 N ASP A 84 87.789 15.402 54.251 1.00 9.68 N ATOM 480 CA ASP A 84 86.715 15.168 55.222 1.00 10.24 C ATOM 481 C ASP A 84 87.078 15.419 56.672 1.00 10.31 C ATOM 482 O ASP A 84 88.203 15.207 57.090 1.00 10.01 O ATOM 483 CB ASP A 84 86.024 13.796 55.008 1.00 8.94 C ATOM 484 CG ASP A 84 85.259 13.737 53.682 1.00 8.32 C ATOM 485 OD1 ASP A 84 84.662 14.780 53.325 1.00 9.60 O ATOM 486 OD2 ASP A 84 85.266 12.651 53.001 1.00 9.42 O ATOM 487 H ASP A 84 87.725 16.264 53.673 1.00 0.00 H ATOM 488 N THR A 85 86.081 15.867 57.436 1.00 10.67 N ATOM 489 CA THR A 85 86.222 15.950 58.880 1.00 10.68 C ATOM 490 C THR A 85 86.190 14.564 59.512 1.00 10.85 C ATOM 491 O THR A 85 86.022 13.565 58.813 1.00 9.99 O ATOM 492 CB THR A 85 85.100 16.782 59.502 1.00 10.42 C ATOM 493 OG1 THR A 85 83.879 16.053 59.306 1.00 11.16 O ATOM 494 CG2 THR A 85 85.011 18.162 58.887 1.00 11.50 C ATOM 495 HG1 THR A 85 83.126 16.562 59.697 1.00 0.00 H ATOM 496 H THR A 85 85.188 16.162 56.991 1.00 0.00 H ATOM 497 N ALA A 86 86.387 14.512 60.835 1.00 10.22 N ATOM 498 CA ALA A 86 86.354 13.246 61.575 1.00 10.40 C ATOM 499 C ALA A 86 85.038 13.018 62.296 1.00 11.58 C ATOM 500 O ALA A 86 84.993 12.342 63.318 1.00 12.43 O ATOM 501 CB ALA A 86 87.505 13.189 62.526 1.00 11.14 C ATOM 502 H ALA A 86 86.569 15.395 61.353 1.00 0.00 H ATOM 503 N TRP A 87 83.957 13.567 61.732 1.00 11.74 N ATOM 504 CA TRP A 87 82.592 13.287 62.187 1.00 12.02 C ATOM 505 C TRP A 87 82.353 13.941 63.554 1.00 12.74 C ATOM 506 O TRP A 87 82.149 13.292 64.583 1.00 13.38 O ATOM 507 CB TRP A 87 82.280 11.792 62.130 1.00 12.80 C ATOM 508 CG TRP A 87 80.832 11.404 62.244 1.00 13.06 C ATOM 509 CD1 TRP A 87 79.753 12.210 62.381 1.00 13.06 C ATOM 510 CD2 TRP A 87 80.331 10.057 62.251 1.00 12.67 C ATOM 511 NE1 TRP A 87 78.587 11.429 62.472 1.00 12.63 N ATOM 512 CE2 TRP A 87 78.932 10.114 62.375 1.00 13.32 C ATOM 513 CE3 TRP A 87 80.941 8.800 62.140 1.00 13.52 C ATOM 514 CZ2 TRP A 87 78.158 8.979 62.448 1.00 13.56 C ATOM 515 CZ3 TRP A 87 80.161 7.693 62.169 1.00 13.71 C ATOM 516 CH2 TRP A 87 78.788 7.782 62.321 1.00 13.42 C ATOM 517 HE1 TRP A 87 77.621 11.795 62.593 1.00 0.00 H ATOM 518 H TRP A 87 84.091 14.222 60.935 1.00 0.00 H ATOM 519 N GLY A 88 82.337 15.261 63.504 1.00 12.42 N ATOM 520 CA GLY A 88 82.014 16.102 64.636 1.00 11.89 C ATOM 521 C GLY A 88 83.166 16.973 65.090 1.00 13.38 C ATOM 522 O GLY A 88 84.342 16.696 64.813 1.00 12.93 O ATOM 523 H GLY A 88 82.569 15.721 62.601 1.00 0.00 H ATOM 524 N ALA A 89 82.831 17.990 65.874 1.00 14.70 N ATOM 525 CA ALA A 89 83.821 18.929 66.360 1.00 15.24 C ATOM 526 C ALA A 89 84.862 18.311 67.294 1.00 15.25 C ATOM 527 O ALA A 89 86.046 18.541 67.123 1.00 15.59 O ATOM 528 CB ALA A 89 83.129 20.104 67.013 1.00 15.67 C ATOM 529 H ALA A 89 81.835 18.116 66.146 1.00 0.00 H ATOM 530 N LYS A 90 84.434 17.515 68.262 1.00 15.35 N ATOM 531 CA LYS A 90 85.371 16.941 69.214 1.00 16.39 C ATOM 532 C LYS A 90 86.343 16.057 68.454 1.00 14.35 C ATOM 533 O LYS A 90 87.566 16.145 68.643 1.00 14.89 O ATOM 534 CB LYS A 90 84.603 16.135 70.278 1.00 19.93 C ATOM 535 CG LYS A 90 85.453 15.479 71.355 1.00 23.15 C ATOM 536 CD LYS A 90 84.591 14.784 72.421 1.00 25.53 C ATOM 537 CE LYS A 90 85.441 14.153 73.530 1.00 27.91 C ATOM 538 NZ LYS A 90 84.589 13.871 74.729 1.00 29.55 N ATOM 539 HZ1 LYS A 90 84.177 14.760 75.077 1.00 0.00 H ATOM 540 HZ2 LYS A 90 83.827 13.214 74.465 1.00 0.00 H ATOM 541 HZ3 LYS A 90 85.174 13.443 75.475 1.00 0.00 H ATOM 542 H LYS A 90 83.420 17.299 68.342 1.00 0.00 H ATOM 543 N ASN A 91 85.816 15.223 67.565 1.00 13.89 N ATOM 544 CA ASN A 91 86.673 14.294 66.862 1.00 13.39 C ATOM 545 C ASN A 91 87.617 15.046 65.950 1.00 13.29 C ATOM 546 O ASN A 91 88.766 14.644 65.736 1.00 14.01 O ATOM 547 CB ASN A 91 85.845 13.336 66.005 1.00 13.91 C ATOM 548 CG ASN A 91 85.217 12.196 66.805 1.00 14.70 C ATOM 549 OD1 ASN A 91 85.406 12.069 68.017 1.00 15.40 O ATOM 550 ND2 ASN A 91 84.457 11.374 66.122 1.00 14.40 N ATOM 551 HD22 ASN A 91 84.324 11.516 65.100 1.00 0.00 H ATOM 552 HD21 ASN A 91 83.988 10.580 66.602 1.00 0.00 H ATOM 553 H ASN A 91 84.794 15.238 67.376 1.00 0.00 H ATOM 554 N THR A 92 87.126 16.115 65.354 1.00 13.73 N ATOM 555 CA THR A 92 87.944 16.883 64.411 1.00 13.26 C ATOM 556 C THR A 92 89.075 17.638 65.135 1.00 13.84 C ATOM 557 O THR A 92 90.196 17.750 64.617 1.00 13.93 O ATOM 558 CB THR A 92 87.052 17.801 63.512 1.00 12.28 C ATOM 559 OG1 THR A 92 86.136 16.986 62.757 1.00 11.33 O ATOM 560 CG2 THR A 92 87.887 18.609 62.530 1.00 11.80 C ATOM 561 HG1 THR A 92 85.562 16.473 63.380 1.00 0.00 H ATOM 562 H THR A 92 86.151 16.415 65.555 1.00 0.00 H ATOM 563 N ALA A 93 88.801 18.120 66.334 1.00 14.24 N ATOM 564 CA ALA A 93 89.889 18.641 67.172 1.00 15.25 C ATOM 565 C ALA A 93 90.929 17.541 67.460 1.00 15.64 C ATOM 566 O ALA A 93 92.138 17.776 67.362 1.00 16.12 O ATOM 567 CB ALA A 93 89.349 19.235 68.473 1.00 16.17 C ATOM 568 H ALA A 93 87.821 18.131 66.682 1.00 0.00 H ATOM 569 N ALA A 94 90.461 16.353 67.824 1.00 15.91 N ATOM 570 CA ALA A 94 91.347 15.224 68.037 1.00 15.50 C ATOM 571 C ALA A 94 92.152 14.929 66.763 1.00 14.94 C ATOM 572 O ALA A 94 93.325 14.566 66.830 1.00 15.69 O ATOM 573 CB ALA A 94 90.570 13.998 68.482 1.00 15.96 C ATOM 574 H ALA A 94 89.437 16.229 67.959 1.00 0.00 H ATOM 575 N LEU A 95 91.511 15.067 65.606 1.00 14.38 N ATOM 576 CA LEU A 95 92.146 14.802 64.325 1.00 13.87 C ATOM 577 C LEU A 95 93.321 15.749 64.119 1.00 14.61 C ATOM 578 O LEU A 95 94.419 15.315 63.811 1.00 14.54 O ATOM 579 CB LEU A 95 91.126 14.919 63.192 1.00 14.43 C ATOM 580 CG LEU A 95 91.713 14.937 61.776 1.00 14.36 C ATOM 581 CD1 LEU A 95 92.373 13.616 61.427 1.00 14.75 C ATOM 582 CD2 LEU A 95 90.628 15.251 60.771 1.00 14.26 C ATOM 583 H LEU A 95 90.518 15.376 65.618 1.00 0.00 H ATOM 584 N LEU A 96 93.084 17.042 64.319 1.00 13.79 N ATOM 585 CA LEU A 96 94.162 18.007 64.168 1.00 14.60 C ATOM 586 C LEU A 96 95.304 17.704 65.133 1.00 15.57 C ATOM 587 O LEU A 96 96.474 17.813 64.766 1.00 16.77 O ATOM 588 CB LEU A 96 93.650 19.432 64.330 1.00 14.91 C ATOM 589 CG LEU A 96 92.675 19.856 63.230 1.00 15.21 C ATOM 590 CD1 LEU A 96 92.144 21.262 63.512 1.00 17.47 C ATOM 591 CD2 LEU A 96 93.316 19.792 61.837 1.00 15.51 C ATOM 592 H LEU A 96 92.130 17.363 64.583 1.00 0.00 H ATOM 593 N ALA A 97 94.970 17.268 66.352 1.00 15.25 N ATOM 594 CA ALA A 97 96.005 17.015 67.338 1.00 16.44 C ATOM 595 C ALA A 97 96.805 15.787 66.929 1.00 16.96 C ATOM 596 O ALA A 97 98.009 15.749 67.114 1.00 17.45 O ATOM 597 CB ALA A 97 95.419 16.807 68.716 1.00 17.09 C ATOM 598 H ALA A 97 93.971 17.110 66.593 1.00 0.00 H ATOM 599 N GLU A 98 96.132 14.775 66.399 1.00 17.03 N ATOM 600 CA GLU A 98 96.810 13.557 65.994 1.00 18.45 C ATOM 601 C GLU A 98 97.706 13.814 64.773 1.00 17.88 C ATOM 602 O GLU A 98 98.802 13.258 64.660 1.00 19.09 O ATOM 603 CB GLU A 98 95.765 12.500 65.673 1.00 21.64 C ATOM 604 CG GLU A 98 96.275 11.121 65.683 1.00 24.84 C ATOM 605 CD GLU A 98 96.809 10.727 67.045 1.00 27.17 C ATOM 606 OE1 GLU A 98 96.222 11.131 68.070 1.00 28.50 O ATOM 607 OE2 GLU A 98 97.806 10.009 67.079 1.00 28.43 O ATOM 608 H GLU A 98 95.103 14.855 66.272 1.00 0.00 H ATOM 609 N ILE A 99 97.245 14.661 63.866 1.00 16.84 N ATOM 610 CA ILE A 99 98.064 15.077 62.725 1.00 16.66 C ATOM 611 C ILE A 99 99.334 15.815 63.180 1.00 18.11 C ATOM 612 O ILE A 99 100.446 15.576 62.687 1.00 18.74 O ATOM 613 CB ILE A 99 97.221 15.944 61.750 1.00 15.39 C ATOM 614 CG1 ILE A 99 96.182 15.074 61.016 1.00 14.73 C ATOM 615 CG2 ILE A 99 98.095 16.634 60.734 1.00 16.60 C ATOM 616 CD1 ILE A 99 95.218 15.856 60.172 1.00 14.55 C ATOM 617 H ILE A 99 96.281 15.039 63.966 1.00 0.00 H ATOM 618 N GLU A 100 99.177 16.712 64.134 1.00 17.50 N ATOM 619 CA GLU A 100 100.335 17.462 64.618 1.00 18.34 C ATOM 620 C GLU A 100 101.325 16.506 65.289 1.00 19.92 C ATOM 621 O GLU A 100 102.533 16.604 65.103 1.00 21.27 O ATOM 622 CB GLU A 100 99.873 18.554 65.565 1.00 19.24 C ATOM 623 CG GLU A 100 101.008 19.248 66.306 1.00 20.74 C ATOM 624 CD GLU A 100 101.931 20.002 65.404 1.00 24.29 C ATOM 625 OE1 GLU A 100 101.525 20.371 64.281 1.00 24.08 O ATOM 626 OE2 GLU A 100 103.078 20.248 65.853 1.00 27.27 O ATOM 627 H GLU A 100 98.235 16.885 64.540 1.00 0.00 H ATOM 628 N LYS A 101 100.805 15.567 66.061 1.00 20.19 N ATOM 629 CA LYS A 101 101.645 14.596 66.735 1.00 21.07 C ATOM 630 C LYS A 101 102.407 13.683 65.761 1.00 21.14 C ATOM 631 O LYS A 101 103.623 13.477 65.923 1.00 22.50 O ATOM 632 CB LYS A 101 100.794 13.733 67.669 1.00 23.51 C ATOM 633 CG LYS A 101 101.597 12.711 68.473 1.00 25.82 C ATOM 634 CD LYS A 101 100.730 12.066 69.535 1.00 27.65 C ATOM 635 CE LYS A 101 101.429 10.880 70.178 1.00 29.10 C ATOM 636 NZ LYS A 101 100.659 10.369 71.341 1.00 30.15 N ATOM 637 HZ1 LYS A 101 100.564 11.123 72.051 1.00 0.00 H ATOM 638 HZ2 LYS A 101 99.715 10.067 71.025 1.00 0.00 H ATOM 639 HZ3 LYS A 101 101.161 9.560 71.759 1.00 0.00 H ATOM 640 H LYS A 101 99.774 15.524 66.187 1.00 0.00 H ATOM 641 N GLN A 102 101.705 13.113 64.776 1.00 20.90 N ATOM 642 CA GLN A 102 102.284 12.044 63.953 1.00 20.91 C ATOM 643 C GLN A 102 102.939 12.539 62.677 1.00 20.17 C ATOM 644 O GLN A 102 103.823 11.879 62.133 1.00 21.05 O ATOM 645 CB GLN A 102 101.223 10.996 63.579 1.00 22.81 C ATOM 646 CG GLN A 102 100.601 10.272 64.742 1.00 24.17 C ATOM 647 CD GLN A 102 99.849 9.017 64.312 1.00 26.10 C ATOM 648 OE1 GLN A 102 100.336 8.226 63.496 1.00 27.16 O ATOM 649 NE2 GLN A 102 98.658 8.843 64.841 1.00 27.07 N ATOM 650 HE22 GLN A 102 98.286 9.534 65.524 1.00 0.00 H ATOM 651 HE21 GLN A 102 98.087 8.015 64.576 1.00 0.00 H ATOM 652 H GLN A 102 100.733 13.432 64.590 1.00 0.00 H ATOM 653 N ILE A 103 102.505 13.693 62.188 1.00 19.12 N ATOM 654 CA ILE A 103 103.015 14.204 60.931 1.00 18.18 C ATOM 655 C ILE A 103 103.685 15.553 61.144 1.00 18.57 C ATOM 656 O ILE A 103 104.801 15.759 60.691 1.00 18.86 O ATOM 657 CB ILE A 103 101.906 14.302 59.877 1.00 17.48 C ATOM 658 CG1 ILE A 103 101.197 12.939 59.711 1.00 17.26 C ATOM 659 CG2 ILE A 103 102.476 14.829 58.535 1.00 17.76 C ATOM 660 CD1 ILE A 103 99.952 13.013 58.818 1.00 17.38 C ATOM 661 H ILE A 103 101.791 14.237 62.712 1.00 0.00 H ATOM 662 N GLY A 104 103.019 16.469 61.841 1.00 18.49 N ATOM 663 CA GLY A 104 103.687 17.701 62.233 1.00 19.81 C ATOM 664 C GLY A 104 103.802 18.759 61.137 1.00 20.41 C ATOM 665 O GLY A 104 104.679 19.640 61.205 1.00 21.53 O ATOM 666 H GLY A 104 102.026 16.306 62.104 1.00 0.00 H ATOM 667 N LEU A 105 102.930 18.684 60.130 1.00 19.04 N ATOM 668 CA LEU A 105 102.871 19.683 59.065 1.00 18.73 C ATOM 669 C LEU A 105 101.497 20.317 59.108 1.00 17.94 C ATOM 670 O LEU A 105 100.536 19.667 59.488 1.00 17.65 O ATOM 671 CB LEU A 105 103.110 19.024 57.702 1.00 19.15 C ATOM 672 CG LEU A 105 104.506 18.406 57.492 1.00 21.58 C ATOM 673 CD1 LEU A 105 104.541 17.688 56.163 1.00 22.56 C ATOM 674 CD2 LEU A 105 105.602 19.443 57.559 1.00 21.89 C ATOM 675 H LEU A 105 102.267 17.884 60.102 1.00 0.00 H ATOM 676 N PRO A 106 101.382 21.587 58.709 1.00 17.78 N ATOM 677 CA PRO A 106 100.082 22.267 58.778 1.00 17.18 C ATOM 678 C PRO A 106 99.056 21.809 57.737 1.00 16.36 C ATOM 679 O PRO A 106 99.380 21.671 56.550 1.00 16.55 O ATOM 680 CB PRO A 106 100.441 23.736 58.561 1.00 17.73 C ATOM 681 CG PRO A 106 101.662 23.693 57.731 1.00 18.76 C ATOM 682 CD PRO A 106 102.436 22.464 58.185 1.00 18.42 C ATOM 683 N VAL A 107 97.814 21.601 58.173 1.00 15.59 N ATOM 684 CA VAL A 107 96.693 21.411 57.253 1.00 14.93 C ATOM 685 C VAL A 107 96.279 22.770 56.747 1.00 15.05 C ATOM 686 O VAL A 107 95.843 23.607 57.525 1.00 15.66 O ATOM 687 CB VAL A 107 95.489 20.774 57.964 1.00 14.66 C ATOM 688 CG1 VAL A 107 94.345 20.639 57.014 1.00 14.22 C ATOM 689 CG2 VAL A 107 95.883 19.412 58.550 1.00 15.50 C ATOM 690 H VAL A 107 97.637 21.573 59.197 1.00 0.00 H ATOM 691 N THR A 108 96.436 23.004 55.459 1.00 14.41 N ATOM 692 CA THR A 108 96.129 24.308 54.889 1.00 13.83 C ATOM 693 C THR A 108 94.805 24.325 54.123 1.00 12.48 C ATOM 694 O THR A 108 94.193 25.391 53.995 1.00 12.91 O ATOM 695 CB THR A 108 97.246 24.779 53.965 1.00 14.94 C ATOM 696 OG1 THR A 108 97.507 23.773 53.002 1.00 16.47 O ATOM 697 CG2 THR A 108 98.509 25.061 54.745 1.00 16.66 C ATOM 698 HG1 THR A 108 98.232 24.075 52.399 1.00 0.00 H ATOM 699 H THR A 108 96.785 22.245 54.840 1.00 0.00 H ATOM 700 N ARG A 109 94.373 23.162 53.599 1.00 11.03 N ATOM 701 CA ARG A 109 93.105 23.090 52.888 1.00 11.26 C ATOM 702 C ARG A 109 92.403 21.809 53.266 1.00 11.37 C ATOM 703 O ARG A 109 93.062 20.823 53.620 1.00 12.19 O ATOM 704 CB ARG A 109 93.331 23.112 51.377 1.00 12.05 C ATOM 705 CG ARG A 109 94.052 24.358 50.889 1.00 13.00 C ATOM 706 CD ARG A 109 94.066 24.419 49.360 1.00 15.18 C ATOM 707 NE ARG A 109 95.006 23.454 48.824 1.00 16.28 N ATOM 708 CZ ARG A 109 95.266 23.288 47.533 1.00 18.05 C ATOM 709 NH1 ARG A 109 94.632 24.013 46.620 1.00 18.87 N ATOM 710 NH2 ARG A 109 96.165 22.391 47.160 1.00 19.66 N ATOM 711 HE ARG A 109 95.513 22.848 49.500 1.00 0.00 H ATOM 712 HH12 ARG A 109 94.842 23.877 45.610 1.00 0.00 H ATOM 713 HH11 ARG A 109 93.926 24.717 46.914 1.00 0.00 H ATOM 714 HH22 ARG A 109 96.375 22.254 46.151 1.00 0.00 H ATOM 715 HH21 ARG A 109 96.661 21.823 47.876 1.00 0.00 H ATOM 716 H ARG A 109 94.953 22.305 53.704 1.00 0.00 H ATOM 717 N ALA A 110 91.078 21.815 53.122 1.00 11.16 N ATOM 718 CA ALA A 110 90.260 20.605 53.314 1.00 10.72 C ATOM 719 C ALA A 110 89.132 20.611 52.294 1.00 10.54 C ATOM 720 O ALA A 110 88.598 21.673 51.931 1.00 11.93 O ATOM 721 CB ALA A 110 89.666 20.555 54.713 1.00 11.44 C ATOM 722 H ALA A 110 90.605 22.705 52.865 1.00 0.00 H ATOM 723 N VAL A 111 88.767 19.410 51.877 1.00 10.10 N ATOM 724 CA VAL A 111 87.662 19.168 50.981 1.00 9.62 C ATOM 725 C VAL A 111 86.703 18.207 51.675 1.00 10.79 C ATOM 726 O VAL A 111 87.118 17.190 52.158 1.00 10.19 O ATOM 727 CB VAL A 111 88.174 18.524 49.664 1.00 10.26 C ATOM 728 CG1 VAL A 111 87.001 18.080 48.816 1.00 10.84 C ATOM 729 CG2 VAL A 111 89.082 19.495 48.913 1.00 12.47 C ATOM 730 H VAL A 111 89.310 18.590 52.216 1.00 0.00 H ATOM 731 N SER A 112 85.428 18.573 51.708 1.00 10.12 N ATOM 732 CA SER A 112 84.366 17.676 52.188 1.00 9.75 C ATOM 733 C SER A 112 83.703 17.025 50.974 1.00 9.48 C ATOM 734 O SER A 112 83.353 17.728 49.996 1.00 9.76 O ATOM 735 CB SER A 112 83.340 18.457 53.018 1.00 11.26 C ATOM 736 OG SER A 112 83.910 18.975 54.205 1.00 11.07 O ATOM 737 HG SER A 112 84.653 19.586 53.973 1.00 0.00 H ATOM 738 H SER A 112 85.171 19.527 51.383 1.00 0.00 H ATOM 739 N THR A 113 83.527 15.704 51.040 1.00 9.09 N ATOM 740 CA THR A 113 83.094 14.944 49.881 1.00 9.50 C ATOM 741 C THR A 113 81.581 14.740 49.752 1.00 9.72 C ATOM 742 O THR A 113 81.119 14.252 48.742 1.00 10.53 O ATOM 743 CB THR A 113 83.826 13.589 49.780 1.00 10.20 C ATOM 744 OG1 THR A 113 83.543 12.807 50.929 1.00 9.92 O ATOM 745 CG2 THR A 113 85.328 13.793 49.646 1.00 10.70 C ATOM 746 HG1 THR A 113 83.851 13.288 51.738 1.00 0.00 H ATOM 747 H THR A 113 83.703 15.210 51.938 1.00 0.00 H ATOM 748 N HIS A 114 80.835 15.070 50.791 1.00 9.80 N ATOM 749 CA HIS A 114 79.396 15.289 50.669 1.00 9.39 C ATOM 750 C HIS A 114 78.906 16.045 51.893 1.00 8.75 C ATOM 751 O HIS A 114 79.713 16.386 52.762 1.00 9.47 O ATOM 752 CB HIS A 114 78.545 14.029 50.347 1.00 9.72 C ATOM 753 CG HIS A 114 78.467 12.987 51.414 1.00 9.81 C ATOM 754 ND1 HIS A 114 79.474 12.077 51.606 1.00 9.11 N ATOM 755 CD2 HIS A 114 77.457 12.620 52.244 1.00 8.98 C ATOM 756 CE1 HIS A 114 79.115 11.221 52.555 1.00 9.39 C ATOM 757 NE2 HIS A 114 77.891 11.524 52.962 1.00 9.09 N ATOM 758 H HIS A 114 81.285 15.177 51.722 1.00 0.00 H ATOM 759 N PHE A 115 77.604 16.333 51.958 1.00 9.10 N ATOM 760 CA PHE A 115 77.070 17.281 52.962 1.00 9.37 C ATOM 761 C PHE A 115 76.751 16.694 54.324 1.00 9.44 C ATOM 762 O PHE A 115 76.382 17.446 55.230 1.00 9.96 O ATOM 763 CB PHE A 115 75.828 18.001 52.419 1.00 9.34 C ATOM 764 CG PHE A 115 74.571 17.160 52.366 1.00 9.74 C ATOM 765 CD1 PHE A 115 74.337 16.274 51.328 1.00 10.78 C ATOM 766 CD2 PHE A 115 73.600 17.305 53.345 1.00 10.41 C ATOM 767 CE1 PHE A 115 73.157 15.547 51.272 1.00 10.96 C ATOM 768 CE2 PHE A 115 72.445 16.559 53.288 1.00 11.82 C ATOM 769 CZ PHE A 115 72.220 15.697 52.264 1.00 11.47 C ATOM 770 H PHE A 115 76.950 15.881 51.288 1.00 0.00 H ATOM 771 N HIS A 116 76.886 15.380 54.496 1.00 9.55 N ATOM 772 CA HIS A 116 76.551 14.773 55.764 1.00 9.34 C ATOM 773 C HIS A 116 77.533 15.130 56.877 1.00 9.73 C ATOM 774 O HIS A 116 78.671 15.517 56.625 1.00 10.07 O ATOM 775 CB HIS A 116 76.403 13.251 55.614 1.00 9.48 C ATOM 776 CG HIS A 116 75.186 12.834 54.836 1.00 9.79 C ATOM 777 ND1 HIS A 116 75.042 11.564 54.301 1.00 10.63 N ATOM 778 CD2 HIS A 116 74.023 13.486 54.565 1.00 9.69 C ATOM 779 CE1 HIS A 116 73.875 11.483 53.675 1.00 10.66 C ATOM 780 NE2 HIS A 116 73.242 12.631 53.824 1.00 10.53 N ATOM 781 H HIS A 116 77.234 14.788 53.715 1.00 0.00 H ATOM 782 N ASP A 117 77.103 14.926 58.116 1.00 11.38 N ATOM 783 CA ASP A 117 77.879 15.366 59.278 1.00 12.43 C ATOM 784 C ASP A 117 79.191 14.624 59.480 1.00 11.74 C ATOM 785 O ASP A 117 80.075 15.131 60.163 1.00 11.42 O ATOM 786 CB ASP A 117 77.083 15.217 60.581 1.00 14.99 C ATOM 787 CG ASP A 117 75.933 16.182 60.687 1.00 17.82 C ATOM 788 OD1 ASP A 117 76.072 17.329 60.234 1.00 19.21 O ATOM 789 OD2 ASP A 117 74.899 15.782 61.254 1.00 18.97 O ATOM 790 H ASP A 117 76.194 14.443 58.265 1.00 0.00 H ATOM 791 N ASP A 118 79.342 13.431 58.893 1.00 11.28 N ATOM 792 CA ASP A 118 80.642 12.728 58.974 1.00 10.80 C ATOM 793 C ASP A 118 81.686 13.298 57.986 1.00 10.37 C ATOM 794 O ASP A 118 82.860 12.901 57.982 1.00 12.12 O ATOM 795 CB ASP A 118 80.461 11.216 58.769 1.00 10.71 C ATOM 796 CG ASP A 118 79.859 10.829 57.414 1.00 10.93 C ATOM 797 OD1 ASP A 118 79.162 11.643 56.765 1.00 10.26 O ATOM 798 OD2 ASP A 118 80.087 9.643 57.010 1.00 10.04 O ATOM 799 H ASP A 118 78.547 12.998 58.381 1.00 0.00 H ATOM 800 N ARG A 119 81.260 14.266 57.190 1.00 10.49 N ATOM 801 CA ARG A 119 82.122 14.920 56.201 1.00 10.01 C ATOM 802 C ARG A 119 82.344 16.428 56.469 1.00 10.05 C ATOM 803 O ARG A 119 83.426 16.951 56.169 1.00 9.27 O ATOM 804 CB ARG A 119 81.529 14.798 54.799 1.00 9.64 C ATOM 805 CG ARG A 119 81.076 13.390 54.427 1.00 9.44 C ATOM 806 CD ARG A 119 82.250 12.422 54.230 1.00 9.19 C ATOM 807 NE ARG A 119 82.071 11.178 54.995 1.00 10.08 N ATOM 808 CZ ARG A 119 83.070 10.410 55.384 1.00 11.58 C ATOM 809 NH1 ARG A 119 84.289 10.753 55.046 1.00 14.20 N ATOM 810 NH2 ARG A 119 82.859 9.339 56.126 1.00 11.84 N ATOM 811 HE ARG A 119 81.103 10.888 55.243 1.00 0.00 H ATOM 812 HH12 ARG A 119 85.095 10.165 55.340 1.00 0.00 H ATOM 813 HH11 ARG A 119 84.450 11.613 54.484 1.00 0.00 H ATOM 814 HH22 ARG A 119 83.660 8.746 56.423 1.00 0.00 H ATOM 815 HH21 ARG A 119 81.892 9.088 56.414 1.00 0.00 H ATOM 816 H ARG A 119 80.271 14.576 57.270 1.00 0.00 H ATOM 817 N VAL A 120 81.306 17.105 56.980 1.00 9.81 N ATOM 818 CA VAL A 120 81.369 18.537 57.271 1.00 9.97 C ATOM 819 C VAL A 120 81.275 18.874 58.757 1.00 10.11 C ATOM 820 O VAL A 120 81.497 20.018 59.132 1.00 11.28 O ATOM 821 CB VAL A 120 80.270 19.380 56.515 1.00 10.06 C ATOM 822 CG1 VAL A 120 80.410 19.262 54.993 1.00 10.60 C ATOM 823 CG2 VAL A 120 78.873 18.982 56.960 1.00 10.88 C ATOM 824 H VAL A 120 80.423 16.593 57.177 1.00 0.00 H ATOM 825 N GLY A 121 80.924 17.905 59.602 1.00 10.40 N ATOM 826 CA GLY A 121 80.799 18.144 61.039 1.00 10.72 C ATOM 827 C GLY A 121 82.216 18.292 61.582 1.00 10.66 C ATOM 828 O GLY A 121 82.960 17.302 61.614 1.00 11.54 O ATOM 829 H GLY A 121 80.734 16.953 59.229 1.00 0.00 H ATOM 830 N GLY A 122 82.586 19.513 61.996 1.00 11.33 N ATOM 831 CA GLY A 122 83.966 19.811 62.348 1.00 11.92 C ATOM 832 C GLY A 122 84.576 20.885 61.454 1.00 11.91 C ATOM 833 O GLY A 122 85.692 21.323 61.694 1.00 11.94 O ATOM 834 H GLY A 122 81.870 20.264 62.067 1.00 0.00 H ATOM 835 N VAL A 123 83.856 21.312 60.425 1.00 11.69 N ATOM 836 CA VAL A 123 84.341 22.366 59.530 1.00 11.67 C ATOM 837 C VAL A 123 84.668 23.646 60.274 1.00 12.48 C ATOM 838 O VAL A 123 85.658 24.282 59.955 1.00 12.67 O ATOM 839 CB VAL A 123 83.376 22.563 58.336 1.00 11.71 C ATOM 840 CG1 VAL A 123 83.441 23.984 57.777 1.00 12.34 C ATOM 841 CG2 VAL A 123 83.704 21.485 57.264 1.00 11.48 C ATOM 842 H VAL A 123 82.923 20.888 60.249 1.00 0.00 H ATOM 843 N ASP A 124 83.878 23.999 61.284 1.00 13.06 N ATOM 844 CA ASP A 124 84.128 25.236 62.008 1.00 15.03 C ATOM 845 C ASP A 124 85.436 25.098 62.804 1.00 15.08 C ATOM 846 O ASP A 124 86.198 26.061 62.928 1.00 15.40 O ATOM 847 CB ASP A 124 82.942 25.608 62.932 1.00 17.93 C ATOM 848 CG ASP A 124 81.610 25.949 62.166 1.00 21.34 C ATOM 849 OD1 ASP A 124 81.582 26.140 60.920 1.00 24.09 O ATOM 850 OD2 ASP A 124 80.569 26.073 62.845 1.00 23.04 O ATOM 851 H ASP A 124 83.080 23.390 61.557 1.00 0.00 H ATOM 852 N VAL A 125 85.691 23.921 63.368 1.00 14.27 N ATOM 853 CA VAL A 125 86.969 23.672 64.006 1.00 14.67 C ATOM 854 C VAL A 125 88.130 23.891 63.046 1.00 14.76 C ATOM 855 O VAL A 125 89.140 24.522 63.403 1.00 14.98 O ATOM 856 CB VAL A 125 87.036 22.255 64.616 1.00 15.45 C ATOM 857 CG1 VAL A 125 88.483 21.874 64.993 1.00 16.34 C ATOM 858 CG2 VAL A 125 86.174 22.176 65.854 1.00 16.64 C ATOM 859 H VAL A 125 84.968 23.173 63.351 1.00 0.00 H ATOM 860 N LEU A 126 88.026 23.321 61.854 1.00 13.99 N ATOM 861 CA LEU A 126 89.069 23.497 60.840 1.00 12.88 C ATOM 862 C LEU A 126 89.242 24.973 60.501 1.00 13.12 C ATOM 863 O LEU A 126 90.358 25.505 60.444 1.00 13.66 O ATOM 864 CB LEU A 126 88.681 22.724 59.584 1.00 12.75 C ATOM 865 CG LEU A 126 88.579 21.209 59.706 1.00 12.99 C ATOM 866 CD1 LEU A 126 88.211 20.621 58.370 1.00 12.74 C ATOM 867 CD2 LEU A 126 89.866 20.643 60.209 1.00 13.83 C ATOM 868 H LEU A 126 87.192 22.740 61.635 1.00 0.00 H ATOM 869 N ARG A 127 88.135 25.662 60.293 1.00 12.94 N ATOM 870 CA ARG A 127 88.205 27.075 59.910 1.00 13.30 C ATOM 871 C ARG A 127 88.879 27.909 61.002 1.00 15.11 C ATOM 872 O ARG A 127 89.709 28.770 60.723 1.00 15.28 O ATOM 873 CB ARG A 127 86.798 27.602 59.623 1.00 14.23 C ATOM 874 CG ARG A 127 86.781 29.087 59.255 1.00 16.32 C ATOM 875 CD ARG A 127 85.374 29.576 59.090 1.00 18.46 C ATOM 876 NE ARG A 127 84.686 28.859 58.044 1.00 18.48 N ATOM 877 CZ ARG A 127 83.674 28.014 58.194 1.00 18.99 C ATOM 878 NH1 ARG A 127 83.154 27.728 59.374 1.00 21.13 N ATOM 879 NH2 ARG A 127 83.180 27.440 57.110 1.00 17.50 N ATOM 880 HE ARG A 127 85.018 29.021 57.072 1.00 0.00 H ATOM 881 HH12 ARG A 127 82.361 27.059 59.444 1.00 0.00 H ATOM 882 HH11 ARG A 127 83.538 28.172 60.233 1.00 0.00 H ATOM 883 HH22 ARG A 127 82.387 26.772 57.191 1.00 0.00 H ATOM 884 HH21 ARG A 127 83.585 27.656 56.177 1.00 0.00 H ATOM 885 H ARG A 127 87.210 25.200 60.401 1.00 0.00 H ATOM 886 N ALA A 128 88.545 27.644 62.265 1.00 16.35 N ATOM 887 CA ALA A 128 89.124 28.414 63.361 1.00 17.13 C ATOM 888 C ALA A 128 90.629 28.168 63.438 1.00 17.52 C ATOM 889 O ALA A 128 91.386 29.008 63.899 1.00 18.40 O ATOM 890 CB ALA A 128 88.466 28.015 64.642 1.00 17.13 C ATOM 891 H ALA A 128 87.867 26.883 62.471 1.00 0.00 H ATOM 892 N ALA A 129 91.056 27.001 62.975 1.00 17.79 N ATOM 893 CA ALA A 129 92.469 26.629 62.983 1.00 17.91 C ATOM 894 C ALA A 129 93.232 27.128 61.763 1.00 17.81 C ATOM 895 O ALA A 129 94.397 26.784 61.581 1.00 19.38 O ATOM 896 CB ALA A 129 92.594 25.109 63.076 1.00 18.28 C ATOM 897 H ALA A 129 90.361 26.328 62.593 1.00 0.00 H ATOM 898 N GLY A 130 92.575 27.901 60.906 1.00 15.00 N ATOM 899 CA GLY A 130 93.237 28.482 59.759 1.00 14.90 C ATOM 900 C GLY A 130 93.183 27.632 58.501 1.00 14.32 C ATOM 901 O GLY A 130 93.848 27.968 57.508 1.00 14.35 O ATOM 902 H GLY A 130 91.565 28.092 61.063 1.00 0.00 H ATOM 903 N VAL A 131 92.388 26.553 58.515 1.00 13.63 N ATOM 904 CA VAL A 131 92.279 25.696 57.349 1.00 12.85 C ATOM 905 C VAL A 131 91.273 26.311 56.382 1.00 12.21 C ATOM 906 O VAL A 131 90.241 26.785 56.804 1.00 12.11 O ATOM 907 CB VAL A 131 91.778 24.301 57.741 1.00 12.51 C ATOM 908 CG1 VAL A 131 91.660 23.432 56.518 1.00 12.95 C ATOM 909 CG2 VAL A 131 92.700 23.685 58.793 1.00 13.41 C ATOM 910 H VAL A 131 91.843 26.327 59.371 1.00 0.00 H ATOM 911 N ALA A 132 91.613 26.346 55.093 1.00 11.71 N ATOM 912 CA ALA A 132 90.681 26.799 54.071 1.00 11.86 C ATOM 913 C ALA A 132 89.814 25.611 53.680 1.00 11.21 C ATOM 914 O ALA A 132 90.306 24.653 53.087 1.00 12.14 O ATOM 915 CB ALA A 132 91.435 27.315 52.877 1.00 12.50 C ATOM 916 H ALA A 132 92.567 26.042 54.811 1.00 0.00 H ATOM 917 N THR A 133 88.529 25.664 54.041 1.00 10.41 N ATOM 918 CA THR A 133 87.624 24.555 53.774 1.00 10.90 C ATOM 919 C THR A 133 86.901 24.747 52.462 1.00 11.41 C ATOM 920 O THR A 133 86.493 25.866 52.132 1.00 11.72 O ATOM 921 CB THR A 133 86.608 24.401 54.919 1.00 10.73 C ATOM 922 OG1 THR A 133 85.873 25.609 55.103 1.00 11.16 O ATOM 923 CG2 THR A 133 87.305 24.043 56.199 1.00 10.89 C ATOM 924 HG1 THR A 133 86.498 26.344 55.325 1.00 0.00 H ATOM 925 H THR A 133 88.168 26.513 54.522 1.00 0.00 H ATOM 926 N TYR A 134 86.780 23.648 51.711 1.00 10.81 N ATOM 927 CA TYR A 134 86.196 23.633 50.354 1.00 10.61 C ATOM 928 C TYR A 134 85.112 22.573 50.230 1.00 10.36 C ATOM 929 O TYR A 134 85.214 21.511 50.859 1.00 10.92 O ATOM 930 CB TYR A 134 87.259 23.264 49.315 1.00 11.56 C ATOM 931 CG TYR A 134 88.302 24.345 49.022 1.00 11.73 C ATOM 932 CD1 TYR A 134 89.312 24.660 49.938 1.00 11.66 C ATOM 933 CD2 TYR A 134 88.280 25.024 47.815 1.00 12.30 C ATOM 934 CE1 TYR A 134 90.246 25.676 49.647 1.00 13.23 C ATOM 935 CE2 TYR A 134 89.181 26.029 47.523 1.00 12.92 C ATOM 936 CZ TYR A 134 90.172 26.329 48.433 1.00 14.29 C ATOM 937 OH TYR A 134 91.071 27.320 48.135 1.00 15.86 O ATOM 938 HH TYR A 134 91.715 27.415 48.881 1.00 0.00 H ATOM 939 H TYR A 134 87.118 22.747 52.106 1.00 0.00 H ATOM 940 N ALA A 135 84.122 22.834 49.362 1.00 10.85 N ATOM 941 CA ALA A 135 83.166 21.817 48.927 1.00 10.87 C ATOM 942 C ALA A 135 82.545 22.315 47.643 1.00 11.21 C ATOM 943 O ALA A 135 82.676 23.489 47.326 1.00 11.25 O ATOM 944 CB ALA A 135 82.093 21.593 49.974 1.00 10.66 C ATOM 945 H ALA A 135 84.031 23.798 48.984 1.00 0.00 H ATOM 946 N SER A 136 81.897 21.425 46.904 1.00 11.15 N ATOM 947 CA SER A 136 81.162 21.854 45.734 1.00 11.99 C ATOM 948 C SER A 136 80.007 22.731 46.140 1.00 11.69 C ATOM 949 O SER A 136 79.510 22.666 47.288 1.00 11.39 O ATOM 950 CB SER A 136 80.640 20.658 44.967 1.00 11.44 C ATOM 951 OG SER A 136 79.572 20.066 45.702 1.00 11.20 O ATOM 952 HG SER A 136 79.226 19.283 45.206 1.00 0.00 H ATOM 953 H SER A 136 81.917 20.419 47.165 1.00 0.00 H ATOM 954 N PRO A 137 79.540 23.557 45.199 1.00 12.07 N ATOM 955 CA PRO A 137 78.303 24.304 45.465 1.00 13.40 C ATOM 956 C PRO A 137 77.113 23.402 45.767 1.00 13.61 C ATOM 957 O PRO A 137 76.275 23.786 46.564 1.00 15.02 O ATOM 958 CB PRO A 137 78.100 25.108 44.193 1.00 13.89 C ATOM 959 CG PRO A 137 79.472 25.265 43.615 1.00 14.08 C ATOM 960 CD PRO A 137 80.187 23.981 43.951 1.00 12.58 C ATOM 961 N SER A 138 77.050 22.226 45.152 1.00 13.16 N ATOM 962 CA SER A 138 76.012 21.237 45.461 1.00 12.84 C ATOM 963 C SER A 138 76.061 20.890 46.956 1.00 12.98 C ATOM 964 O SER A 138 75.055 20.977 47.658 1.00 13.84 O ATOM 965 CB SER A 138 76.206 19.976 44.608 1.00 12.71 C ATOM 966 OG SER A 138 75.192 19.004 44.846 1.00 13.01 O ATOM 967 HG SER A 138 74.308 19.391 44.627 1.00 0.00 H ATOM 968 H SER A 138 77.761 21.999 44.427 1.00 0.00 H ATOM 969 N THR A 139 77.239 20.506 47.434 1.00 12.10 N ATOM 970 CA THR A 139 77.413 20.145 48.848 1.00 11.65 C ATOM 971 C THR A 139 77.067 21.335 49.753 1.00 11.58 C ATOM 972 O THR A 139 76.428 21.159 50.791 1.00 10.83 O ATOM 973 CB THR A 139 78.854 19.645 49.102 1.00 10.80 C ATOM 974 OG1 THR A 139 79.067 18.436 48.360 1.00 10.02 O ATOM 975 CG2 THR A 139 79.156 19.441 50.588 1.00 11.35 C ATOM 976 HG1 THR A 139 78.418 17.750 48.656 1.00 0.00 H ATOM 977 H THR A 139 78.057 20.460 46.793 1.00 0.00 H ATOM 978 N ARG A 140 77.532 22.531 49.409 1.00 11.54 N ATOM 979 CA ARG A 140 77.290 23.704 50.235 1.00 12.82 C ATOM 980 C ARG A 140 75.796 23.984 50.324 1.00 13.55 C ATOM 981 O ARG A 140 75.287 24.275 51.398 1.00 14.15 O ATOM 982 CB ARG A 140 78.074 24.920 49.721 1.00 12.88 C ATOM 983 CG ARG A 140 79.599 24.751 49.850 1.00 12.70 C ATOM 984 CD ARG A 140 80.349 25.931 49.257 1.00 14.19 C ATOM 985 NE ARG A 140 80.381 27.011 50.240 1.00 16.67 N ATOM 986 CZ ARG A 140 79.629 28.090 50.233 1.00 18.56 C ATOM 987 NH1 ARG A 140 78.775 28.320 49.255 1.00 18.62 N ATOM 988 NH2 ARG A 140 79.769 28.965 51.217 1.00 20.12 N ATOM 989 HE ARG A 140 81.063 26.918 51.019 1.00 0.00 H ATOM 990 HH12 ARG A 140 78.189 29.179 49.268 1.00 0.00 H ATOM 991 HH11 ARG A 140 78.687 27.642 48.471 1.00 0.00 H ATOM 992 HH22 ARG A 140 79.186 29.826 51.234 1.00 0.00 H ATOM 993 HH21 ARG A 140 80.462 28.791 51.973 1.00 0.00 H ATOM 994 H ARG A 140 78.080 22.631 48.531 1.00 0.00 H ATOM 995 N ARG A 141 75.089 23.873 49.207 1.00 14.43 N ATOM 996 CA ARG A 141 73.637 24.084 49.161 1.00 15.39 C ATOM 997 C ARG A 141 72.900 23.061 50.035 1.00 14.83 C ATOM 998 O ARG A 141 72.020 23.415 50.811 1.00 15.47 O ATOM 999 CB ARG A 141 73.206 23.975 47.692 1.00 18.98 C ATOM 1000 CG ARG A 141 71.720 23.938 47.371 1.00 22.83 C ATOM 1001 CD ARG A 141 71.539 23.458 45.884 1.00 24.17 C ATOM 1002 NE ARG A 141 72.312 24.294 44.957 1.00 24.97 N ATOM 1003 CZ ARG A 141 73.024 23.874 43.905 1.00 25.08 C ATOM 1004 NH1 ARG A 141 73.096 22.591 43.562 1.00 24.87 N ATOM 1005 NH2 ARG A 141 73.676 24.770 43.174 1.00 25.23 N ATOM 1006 HE ARG A 141 72.305 25.318 45.137 1.00 0.00 H ATOM 1007 HH12 ARG A 141 73.660 22.304 42.737 1.00 0.00 H ATOM 1008 HH11 ARG A 141 72.588 21.875 44.119 1.00 0.00 H ATOM 1009 HH22 ARG A 141 74.235 24.463 42.352 1.00 0.00 H ATOM 1010 HH21 ARG A 141 73.628 25.779 43.423 1.00 0.00 H ATOM 1011 H ARG A 141 75.584 23.626 48.327 1.00 0.00 H ATOM 1012 N LEU A 142 73.256 21.793 49.904 1.00 14.17 N ATOM 1013 CA LEU A 142 72.598 20.759 50.673 1.00 13.69 C ATOM 1014 C LEU A 142 72.916 20.874 52.165 1.00 14.01 C ATOM 1015 O LEU A 142 72.050 20.611 52.993 1.00 14.37 O ATOM 1016 CB LEU A 142 73.011 19.384 50.126 1.00 13.23 C ATOM 1017 CG LEU A 142 72.400 19.087 48.759 1.00 14.84 C ATOM 1018 CD1 LEU A 142 73.114 17.929 48.090 1.00 15.50 C ATOM 1019 CD2 LEU A 142 70.954 18.772 48.854 1.00 16.29 C ATOM 1020 H LEU A 142 74.016 21.537 49.242 1.00 0.00 H ATOM 1021 N ALA A 143 74.163 21.223 52.514 1.00 12.76 N ATOM 1022 CA ALA A 143 74.535 21.404 53.917 1.00 13.13 C ATOM 1023 C ALA A 143 73.728 22.528 54.524 1.00 14.59 C ATOM 1024 O ALA A 143 73.274 22.440 55.656 1.00 15.82 O ATOM 1025 CB ALA A 143 76.026 21.690 54.069 1.00 12.37 C ATOM 1026 H ALA A 143 74.879 21.368 51.773 1.00 0.00 H ATOM 1027 N GLU A 144 73.491 23.574 53.749 1.00 16.06 N ATOM 1028 CA GLU A 144 72.728 24.687 54.287 1.00 18.47 C ATOM 1029 C GLU A 144 71.263 24.288 54.539 1.00 19.70 C ATOM 1030 O GLU A 144 70.681 24.587 55.594 1.00 21.18 O ATOM 1031 CB GLU A 144 72.788 25.887 53.336 1.00 21.65 C ATOM 1032 CG GLU A 144 72.108 27.114 53.932 1.00 25.44 C ATOM 1033 CD GLU A 144 72.178 28.309 53.029 1.00 29.78 C ATOM 1034 OE1 GLU A 144 71.968 28.134 51.811 1.00 31.39 O ATOM 1035 OE2 GLU A 144 72.431 29.419 53.543 1.00 32.08 O ATOM 1036 H GLU A 144 73.845 23.599 52.771 1.00 0.00 H ATOM 1037 N VAL A 145 70.662 23.604 53.573 1.00 20.01 N ATOM 1038 CA VAL A 145 69.283 23.120 53.728 1.00 21.24 C ATOM 1039 C VAL A 145 69.130 22.247 54.974 1.00 20.98 C ATOM 1040 O VAL A 145 68.126 22.340 55.702 1.00 21.73 O ATOM 1041 CB VAL A 145 68.842 22.314 52.478 1.00 22.68 C ATOM 1042 CG1 VAL A 145 67.505 21.606 52.727 1.00 23.48 C ATOM 1043 CG2 VAL A 145 68.767 23.211 51.252 1.00 23.11 C ATOM 1044 H VAL A 145 71.176 23.407 52.691 1.00 0.00 H ATOM 1045 N GLU A 146 70.156 21.422 55.207 1.00 20.59 N ATOM 1046 CA GLU A 146 70.173 20.391 56.245 1.00 21.20 C ATOM 1047 C GLU A 146 70.521 20.906 57.634 1.00 20.27 C ATOM 1048 O GLU A 146 70.324 20.214 58.627 1.00 20.73 O ATOM 1049 CB GLU A 146 71.212 19.326 55.887 1.00 22.39 C ATOM 1050 CG GLU A 146 71.030 18.046 56.679 1.00 23.87 C ATOM 1051 CD GLU A 146 69.683 17.455 56.405 1.00 25.58 C ATOM 1052 OE1 GLU A 146 69.430 17.131 55.221 1.00 25.65 O ATOM 1053 OE2 GLU A 146 68.875 17.359 57.353 1.00 27.29 O ATOM 1054 H GLU A 146 71.001 21.520 54.609 1.00 0.00 H ATOM 1055 N GLY A 147 71.092 22.097 57.689 1.00 19.42 N ATOM 1056 CA GLY A 147 71.591 22.667 58.918 1.00 19.14 C ATOM 1057 C GLY A 147 72.952 22.143 59.338 1.00 18.80 C ATOM 1058 O GLY A 147 73.294 22.189 60.529 1.00 19.72 O ATOM 1059 H GLY A 147 71.186 22.646 56.811 1.00 0.00 H ATOM 1060 N ASN A 148 73.735 21.641 58.391 1.00 17.45 N ATOM 1061 CA ASN A 148 75.084 21.197 58.695 1.00 16.60 C ATOM 1062 C ASN A 148 76.084 22.295 58.397 1.00 15.46 C ATOM 1063 O ASN A 148 75.766 23.277 57.752 1.00 16.25 O ATOM 1064 CB ASN A 148 75.392 19.973 57.859 1.00 17.49 C ATOM 1065 CG ASN A 148 74.484 18.828 58.194 1.00 19.52 C ATOM 1066 OD1 ASN A 148 73.772 18.865 59.206 1.00 21.87 O ATOM 1067 ND2 ASN A 148 74.492 17.814 57.374 1.00 20.51 N ATOM 1068 HD22 ASN A 148 75.107 17.828 56.536 1.00 0.00 H ATOM 1069 HD21 ASN A 148 73.883 16.991 57.558 1.00 0.00 H ATOM 1070 H ASN A 148 73.377 21.565 57.417 1.00 0.00 H ATOM 1071 N GLU A 149 77.284 22.142 58.921 1.00 15.19 N ATOM 1072 CA GLU A 149 78.310 23.127 58.685 1.00 14.29 C ATOM 1073 C GLU A 149 78.632 23.253 57.185 1.00 13.75 C ATOM 1074 O GLU A 149 78.509 22.289 56.437 1.00 14.25 O ATOM 1075 CB GLU A 149 79.548 22.788 59.504 1.00 14.89 C ATOM 1076 CG GLU A 149 79.271 22.879 61.031 1.00 16.11 C ATOM 1077 CD GLU A 149 80.250 22.103 61.885 1.00 19.96 C ATOM 1078 OE1 GLU A 149 81.400 22.476 61.977 1.00 21.13 O ATOM 1079 OE2 GLU A 149 79.856 21.084 62.464 1.00 23.94 O ATOM 1080 H GLU A 149 77.491 21.308 59.507 1.00 0.00 H ATOM 1081 N ILE A 150 79.034 24.455 56.762 1.00 13.58 N ATOM 1082 CA ILE A 150 79.173 24.798 55.354 1.00 14.56 C ATOM 1083 C ILE A 150 80.621 25.209 55.107 1.00 13.36 C ATOM 1084 O ILE A 150 81.086 26.264 55.574 1.00 13.71 O ATOM 1085 CB ILE A 150 78.224 25.963 54.947 1.00 15.50 C ATOM 1086 CG1 ILE A 150 76.772 25.679 55.340 1.00 15.91 C ATOM 1087 CG2 ILE A 150 78.348 26.232 53.463 1.00 15.62 C ATOM 1088 CD1 ILE A 150 75.872 26.875 55.153 1.00 17.37 C ATOM 1089 H ILE A 150 79.258 25.180 57.473 1.00 0.00 H ATOM 1090 N PRO A 151 81.349 24.404 54.335 1.00 12.14 N ATOM 1091 CA PRO A 151 82.713 24.795 53.932 1.00 11.45 C ATOM 1092 C PRO A 151 82.705 26.151 53.229 1.00 12.71 C ATOM 1093 O PRO A 151 81.746 26.483 52.527 1.00 14.22 O ATOM 1094 CB PRO A 151 83.134 23.664 52.983 1.00 11.69 C ATOM 1095 CG PRO A 151 82.379 22.456 53.513 1.00 11.43 C ATOM 1096 CD PRO A 151 81.024 23.026 53.919 1.00 11.27 C ATOM 1097 N THR A 152 83.761 26.912 53.400 1.00 12.31 N ATOM 1098 CA THR A 152 83.799 28.304 52.965 1.00 11.79 C ATOM 1099 C THR A 152 83.934 28.474 51.453 1.00 11.58 C ATOM 1100 O THR A 152 83.174 29.188 50.843 1.00 12.07 O ATOM 1101 CB THR A 152 84.924 29.053 53.692 1.00 11.83 C ATOM 1102 OG1 THR A 152 84.590 29.183 55.074 1.00 13.25 O ATOM 1103 CG2 THR A 152 85.091 30.432 53.100 1.00 13.19 C ATOM 1104 HG1 THR A 152 85.315 29.666 55.544 1.00 0.00 H ATOM 1105 H THR A 152 84.601 26.508 53.862 1.00 0.00 H ATOM 1106 N HIS A 153 84.899 27.783 50.871 1.00 11.15 N ATOM 1107 CA HIS A 153 85.250 27.935 49.468 1.00 11.10 C ATOM 1108 C HIS A 153 84.476 26.971 48.612 1.00 11.76 C ATOM 1109 O HIS A 153 84.136 25.898 49.071 1.00 12.38 O ATOM 1110 CB HIS A 153 86.739 27.649 49.281 1.00 11.21 C ATOM 1111 CG HIS A 153 87.670 28.719 49.798 1.00 10.85 C ATOM 1112 ND1 HIS A 153 88.319 29.553 48.981 1.00 12.22 N ATOM 1113 CD2 HIS A 153 88.084 29.023 51.064 1.00 12.43 C ATOM 1114 CE1 HIS A 153 89.090 30.357 49.682 1.00 10.99 C ATOM 1115 NE2 HIS A 153 88.957 30.044 50.961 1.00 12.24 N ATOM 1116 H HIS A 153 85.433 27.098 51.444 1.00 0.00 H ATOM 1117 N SER A 154 84.237 27.345 47.369 1.00 11.77 N ATOM 1118 CA SER A 154 83.474 26.562 46.408 1.00 12.36 C ATOM 1119 C SER A 154 84.376 25.899 45.393 1.00 12.91 C ATOM 1120 O SER A 154 85.232 26.519 44.854 1.00 15.01 O ATOM 1121 CB SER A 154 82.460 27.443 45.666 1.00 13.30 C ATOM 1122 OG SER A 154 81.383 27.800 46.502 1.00 14.55 O ATOM 1123 HG SER A 154 80.748 28.366 45.996 1.00 0.00 H ATOM 1124 H SER A 154 84.619 28.260 47.055 1.00 0.00 H ATOM 1125 N LEU A 155 84.165 24.617 45.157 1.00 12.20 N ATOM 1126 CA LEU A 155 84.817 23.886 44.094 1.00 13.77 C ATOM 1127 C LEU A 155 83.976 23.899 42.835 1.00 13.59 C ATOM 1128 O LEU A 155 82.959 23.200 42.764 1.00 14.35 O ATOM 1129 CB LEU A 155 85.047 22.428 44.511 1.00 14.04 C ATOM 1130 CG LEU A 155 85.930 22.222 45.755 1.00 15.20 C ATOM 1131 CD1 LEU A 155 85.754 20.819 46.353 1.00 16.45 C ATOM 1132 CD2 LEU A 155 87.391 22.538 45.434 1.00 15.72 C ATOM 1133 H LEU A 155 83.495 24.107 45.767 1.00 0.00 H ATOM 1134 N GLU A 156 84.387 24.685 41.845 1.00 14.93 N ATOM 1135 CA GLU A 156 83.718 24.703 40.564 1.00 15.93 C ATOM 1136 C GLU A 156 84.183 23.555 39.677 1.00 14.58 C ATOM 1137 O GLU A 156 85.196 22.904 39.937 1.00 15.69 O ATOM 1138 CB GLU A 156 83.940 26.057 39.895 1.00 20.38 C ATOM 1139 CG GLU A 156 83.290 27.256 40.640 1.00 25.44 C ATOM 1140 CD GLU A 156 81.762 27.151 40.776 1.00 30.05 C ATOM 1141 OE1 GLU A 156 81.094 26.492 39.942 1.00 31.49 O ATOM 1142 OE2 GLU A 156 81.198 27.723 41.734 1.00 32.92 O ATOM 1143 H GLU A 156 85.210 25.302 41.996 1.00 0.00 H ATOM 1144 N GLY A 157 83.398 23.283 38.647 1.00 12.87 N ATOM 1145 CA GLY A 157 83.768 22.305 37.655 1.00 12.48 C ATOM 1146 C GLY A 157 83.411 20.872 37.983 1.00 12.50 C ATOM 1147 O GLY A 157 83.934 19.956 37.361 1.00 13.43 O ATOM 1148 H GLY A 157 82.493 23.787 38.551 1.00 0.00 H ATOM 1149 N LEU A 158 82.489 20.668 38.915 1.00 11.88 N ATOM 1150 CA LEU A 158 82.146 19.325 39.360 1.00 12.12 C ATOM 1151 C LEU A 158 80.656 19.052 39.357 1.00 13.24 C ATOM 1152 O LEU A 158 80.230 18.077 39.955 1.00 12.95 O ATOM 1153 CB LEU A 158 82.675 19.043 40.786 1.00 11.75 C ATOM 1154 CG LEU A 158 84.190 18.948 40.886 1.00 12.12 C ATOM 1155 CD1 LEU A 158 84.669 19.069 42.324 1.00 13.66 C ATOM 1156 CD2 LEU A 158 84.675 17.618 40.297 1.00 13.18 C ATOM 1157 H LEU A 158 82.001 21.484 39.336 1.00 0.00 H ATOM 1158 N SER A 159 79.862 19.878 38.676 1.00 13.66 N ATOM 1159 CA SER A 159 78.406 19.721 38.763 1.00 14.71 C ATOM 1160 C SER A 159 77.776 18.697 37.805 1.00 14.53 C ATOM 1161 O SER A 159 76.635 18.325 38.011 1.00 15.79 O ATOM 1162 CB SER A 159 77.698 21.062 38.614 1.00 16.73 C ATOM 1163 OG SER A 159 77.958 21.619 37.358 1.00 18.19 O ATOM 1164 HG SER A 159 78.933 21.757 37.255 1.00 0.00 H ATOM 1165 H SER A 159 80.272 20.630 38.086 1.00 0.00 H ATOM 1166 N SER A 160 78.502 18.262 36.778 1.00 14.36 N ATOM 1167 CA SER A 160 78.005 17.262 35.848 1.00 14.81 C ATOM 1168 C SER A 160 78.692 15.911 36.035 1.00 14.00 C ATOM 1169 O SER A 160 79.916 15.843 36.210 1.00 13.19 O ATOM 1170 CB SER A 160 78.198 17.729 34.412 1.00 16.72 C ATOM 1171 OG SER A 160 77.683 16.776 33.512 1.00 18.33 O ATOM 1172 HG SER A 160 77.816 17.094 32.584 1.00 0.00 H ATOM 1173 H SER A 160 79.456 18.650 36.636 1.00 0.00 H ATOM 1174 N SER A 161 77.916 14.834 35.956 1.00 13.72 N ATOM 1175 CA SER A 161 78.482 13.503 36.131 1.00 13.80 C ATOM 1176 C SER A 161 79.659 13.307 35.194 1.00 14.17 C ATOM 1177 O SER A 161 79.594 13.692 34.024 1.00 14.35 O ATOM 1178 CB SER A 161 77.414 12.444 35.879 1.00 13.73 C ATOM 1179 OG SER A 161 76.302 12.684 36.719 1.00 13.89 O ATOM 1180 HG SER A 161 75.610 11.995 36.554 1.00 0.00 H ATOM 1181 H SER A 161 76.899 14.942 35.768 1.00 0.00 H ATOM 1182 N GLY A 162 80.755 12.772 35.717 1.00 14.76 N ATOM 1183 CA GLY A 162 81.939 12.538 34.921 1.00 15.77 C ATOM 1184 C GLY A 162 82.964 13.664 34.975 1.00 14.85 C ATOM 1185 O GLY A 162 84.071 13.547 34.431 1.00 14.80 O ATOM 1186 H GLY A 162 80.762 12.515 36.725 1.00 0.00 H ATOM 1187 N ASP A 163 82.595 14.765 35.620 1.00 13.44 N ATOM 1188 CA ASP A 163 83.499 15.888 35.800 1.00 13.19 C ATOM 1189 C ASP A 163 84.659 15.572 36.749 1.00 11.15 C ATOM 1190 O ASP A 163 84.462 15.022 37.817 1.00 11.33 O ATOM 1191 CB ASP A 163 82.746 17.080 36.371 1.00 13.68 C ATOM 1192 CG ASP A 163 81.961 17.872 35.318 1.00 15.78 C ATOM 1193 OD1 ASP A 163 82.127 17.637 34.089 1.00 16.93 O ATOM 1194 OD2 ASP A 163 81.218 18.799 35.751 1.00 15.70 O ATOM 1195 H ASP A 163 81.632 14.825 36.007 1.00 0.00 H ATOM 1196 N ALA A 164 85.880 15.936 36.349 1.00 13.06 N ATOM 1197 CA ALA A 164 87.047 15.853 37.203 1.00 13.79 C ATOM 1198 C ALA A 164 87.764 17.190 37.253 1.00 14.25 C ATOM 1199 O ALA A 164 87.819 17.906 36.239 1.00 14.61 O ATOM 1200 CB ALA A 164 87.992 14.747 36.697 1.00 14.51 C ATOM 1201 H ALA A 164 85.998 16.295 35.380 1.00 0.00 H ATOM 1202 N VAL A 165 88.329 17.515 38.413 1.00 14.65 N ATOM 1203 CA VAL A 165 89.222 18.664 38.542 1.00 14.06 C ATOM 1204 C VAL A 165 90.438 18.301 39.397 1.00 13.46 C ATOM 1205 O VAL A 165 90.360 17.486 40.322 1.00 14.72 O ATOM 1206 CB VAL A 165 88.517 19.897 39.156 1.00 16.60 C ATOM 1207 CG1 VAL A 165 87.285 20.328 38.335 1.00 16.82 C ATOM 1208 CG2 VAL A 165 88.163 19.639 40.609 1.00 18.22 C ATOM 1209 H VAL A 165 88.129 16.934 39.252 1.00 0.00 H ATOM 1210 N ARG A 166 91.562 18.913 39.082 1.00 13.52 N ATOM 1211 CA ARG A 166 92.712 18.761 39.917 1.00 14.47 C ATOM 1212 C ARG A 166 92.603 19.660 41.135 1.00 14.44 C ATOM 1213 O ARG A 166 92.096 20.802 41.040 1.00 14.64 O ATOM 1214 CB ARG A 166 93.964 19.111 39.145 1.00 16.01 C ATOM 1215 CG ARG A 166 95.126 18.811 39.984 1.00 17.49 C ATOM 1216 CD ARG A 166 96.316 19.345 39.416 1.00 17.93 C ATOM 1217 NE ARG A 166 97.453 19.218 40.308 1.00 18.22 N ATOM 1218 CZ ARG A 166 98.686 19.517 39.917 1.00 19.63 C ATOM 1219 NH1 ARG A 166 98.911 19.890 38.665 1.00 20.89 N ATOM 1220 NH2 ARG A 166 99.685 19.399 40.758 1.00 19.14 N ATOM 1221 HE ARG A 166 97.298 18.884 41.280 1.00 0.00 H ATOM 1222 HH12 ARG A 166 99.877 20.124 38.358 1.00 0.00 H ATOM 1223 HH11 ARG A 166 98.122 19.948 37.990 1.00 0.00 H ATOM 1224 HH22 ARG A 166 100.652 19.633 40.453 1.00 0.00 H ATOM 1225 HH21 ARG A 166 99.511 19.072 41.730 1.00 0.00 H ATOM 1226 H ARG A 166 91.612 19.505 38.228 1.00 0.00 H ATOM 1227 N PHE A 167 93.085 19.148 42.266 1.00 13.78 N ATOM 1228 CA PHE A 167 93.175 19.947 43.477 1.00 12.91 C ATOM 1229 C PHE A 167 94.488 19.577 44.158 1.00 12.32 C ATOM 1230 O PHE A 167 94.549 18.673 44.999 1.00 12.40 O ATOM 1231 CB PHE A 167 91.960 19.693 44.377 1.00 12.35 C ATOM 1232 CG PHE A 167 91.718 20.776 45.381 1.00 13.14 C ATOM 1233 CD1 PHE A 167 91.159 21.972 44.987 1.00 13.97 C ATOM 1234 CD2 PHE A 167 92.052 20.603 46.714 1.00 14.56 C ATOM 1235 CE1 PHE A 167 90.904 22.959 45.899 1.00 13.99 C ATOM 1236 CE2 PHE A 167 91.815 21.613 47.630 1.00 14.47 C ATOM 1237 CZ PHE A 167 91.234 22.789 47.213 1.00 14.23 C ATOM 1238 H PHE A 167 93.403 18.158 42.283 1.00 0.00 H ATOM 1239 N GLY A 168 95.548 20.284 43.812 1.00 13.34 N ATOM 1240 CA GLY A 168 96.848 19.959 44.360 1.00 13.18 C ATOM 1241 C GLY A 168 97.216 18.502 44.059 1.00 13.83 C ATOM 1242 O GLY A 168 97.168 18.069 42.901 1.00 14.33 O ATOM 1243 H GLY A 168 95.449 21.076 43.145 1.00 0.00 H ATOM 1244 N PRO A 169 97.546 17.716 45.102 1.00 13.46 N ATOM 1245 CA PRO A 169 98.031 16.332 44.933 1.00 13.14 C ATOM 1246 C PRO A 169 96.936 15.284 44.697 1.00 12.67 C ATOM 1247 O PRO A 169 97.218 14.081 44.623 1.00 13.36 O ATOM 1248 CB PRO A 169 98.744 16.075 46.255 1.00 12.95 C ATOM 1249 CG PRO A 169 97.892 16.811 47.247 1.00 13.89 C ATOM 1250 CD PRO A 169 97.491 18.098 46.527 1.00 14.13 C ATOM 1251 N VAL A 170 95.706 15.731 44.524 1.00 11.84 N ATOM 1252 CA VAL A 170 94.613 14.816 44.226 1.00 11.68 C ATOM 1253 C VAL A 170 93.834 15.294 43.017 1.00 11.23 C ATOM 1254 O VAL A 170 93.960 16.467 42.579 1.00 11.91 O ATOM 1255 CB VAL A 170 93.635 14.641 45.426 1.00 11.51 C ATOM 1256 CG1 VAL A 170 94.389 14.268 46.689 1.00 12.31 C ATOM 1257 CG2 VAL A 170 92.810 15.882 45.674 1.00 10.96 C ATOM 1258 H VAL A 170 95.515 16.750 44.602 1.00 0.00 H ATOM 1259 N GLU A 171 93.041 14.375 42.467 1.00 10.73 N ATOM 1260 CA GLU A 171 91.990 14.678 41.517 1.00 10.49 C ATOM 1261 C GLU A 171 90.637 14.445 42.195 1.00 11.02 C ATOM 1262 O GLU A 171 90.436 13.435 42.909 1.00 11.22 O ATOM 1263 CB GLU A 171 92.099 13.788 40.281 1.00 12.39 C ATOM 1264 CG GLU A 171 91.104 14.172 39.192 1.00 14.12 C ATOM 1265 CD GLU A 171 91.381 13.458 37.868 1.00 17.10 C ATOM 1266 OE1 GLU A 171 90.960 12.311 37.734 1.00 18.00 O ATOM 1267 OE2 GLU A 171 92.008 14.054 36.970 1.00 19.28 O ATOM 1268 H GLU A 171 93.185 13.381 42.736 1.00 0.00 H ATOM 1269 N LEU A 172 89.737 15.392 42.005 1.00 11.33 N ATOM 1270 CA LEU A 172 88.383 15.288 42.524 1.00 10.44 C ATOM 1271 C LEU A 172 87.491 14.879 41.377 1.00 10.11 C ATOM 1272 O LEU A 172 87.643 15.384 40.271 1.00 10.93 O ATOM 1273 CB LEU A 172 87.920 16.647 43.085 1.00 10.42 C ATOM 1274 CG LEU A 172 88.840 17.292 44.129 1.00 11.50 C ATOM 1275 CD1 LEU A 172 88.281 18.654 44.533 1.00 12.50 C ATOM 1276 CD2 LEU A 172 88.986 16.385 45.360 1.00 11.75 C ATOM 1277 H LEU A 172 90.005 16.240 41.466 1.00 0.00 H ATOM 1278 N PHE A 173 86.554 13.983 41.629 1.00 10.10 N ATOM 1279 CA PHE A 173 85.713 13.419 40.574 1.00 10.75 C ATOM 1280 C PHE A 173 84.278 13.352 41.061 1.00 10.77 C ATOM 1281 O PHE A 173 84.027 12.841 42.148 1.00 10.06 O ATOM 1282 CB PHE A 173 86.206 12.010 40.236 1.00 11.59 C ATOM 1283 CG PHE A 173 85.451 11.315 39.111 1.00 11.81 C ATOM 1284 CD1 PHE A 173 85.579 11.751 37.797 1.00 11.89 C ATOM 1285 CD2 PHE A 173 84.669 10.195 39.355 1.00 11.99 C ATOM 1286 CE1 PHE A 173 84.915 11.089 36.748 1.00 12.34 C ATOM 1287 CE2 PHE A 173 84.044 9.490 38.305 1.00 12.29 C ATOM 1288 CZ PHE A 173 84.163 9.944 37.014 1.00 12.31 C ATOM 1289 H PHE A 173 86.410 13.668 42.610 1.00 0.00 H ATOM 1290 N TYR A 174 83.340 13.836 40.255 1.00 10.00 N ATOM 1291 CA TYR A 174 81.917 13.718 40.574 1.00 10.91 C ATOM 1292 C TYR A 174 81.359 12.609 39.690 1.00 10.82 C ATOM 1293 O TYR A 174 81.203 12.784 38.492 1.00 11.77 O ATOM 1294 CB TYR A 174 81.192 15.032 40.337 1.00 11.54 C ATOM 1295 CG TYR A 174 79.704 14.867 40.511 1.00 10.88 C ATOM 1296 CD1 TYR A 174 79.191 14.306 41.665 1.00 11.60 C ATOM 1297 CD2 TYR A 174 78.821 15.206 39.509 1.00 11.34 C ATOM 1298 CE1 TYR A 174 77.815 14.149 41.838 1.00 11.14 C ATOM 1299 CE2 TYR A 174 77.454 15.038 39.665 1.00 11.56 C ATOM 1300 CZ TYR A 174 76.958 14.485 40.818 1.00 11.62 C ATOM 1301 OH TYR A 174 75.582 14.363 40.957 1.00 12.56 O ATOM 1302 HH TYR A 174 75.227 13.792 40.230 1.00 0.00 H ATOM 1303 H TYR A 174 83.624 14.311 39.375 1.00 0.00 H ATOM 1304 N PRO A 175 81.042 11.450 40.275 1.00 10.60 N ATOM 1305 CA PRO A 175 80.640 10.307 39.451 1.00 10.60 C ATOM 1306 C PRO A 175 79.180 10.325 39.095 1.00 11.09 C ATOM 1307 O PRO A 175 78.784 9.474 38.311 1.00 11.40 O ATOM 1308 CB PRO A 175 80.963 9.121 40.366 1.00 11.66 C ATOM 1309 CG PRO A 175 80.703 9.636 41.758 1.00 11.64 C ATOM 1310 CD PRO A 175 81.211 11.063 41.693 1.00 11.08 C ATOM 1311 N GLY A 176 78.408 11.274 39.629 1.00 10.70 N ATOM 1312 CA GLY A 176 76.955 11.238 39.514 1.00 10.04 C ATOM 1313 C GLY A 176 76.364 10.869 40.887 1.00 10.11 C ATOM 1314 O GLY A 176 77.078 10.515 41.851 1.00 10.14 O ATOM 1315 H GLY A 176 78.855 12.061 40.141 1.00 0.00 H ATOM 1316 N ALA A 177 75.062 10.976 41.011 1.00 10.37 N ATOM 1317 CA ALA A 177 74.399 10.743 42.291 1.00 9.66 C ATOM 1318 C ALA A 177 74.521 9.293 42.680 1.00 10.42 C ATOM 1319 O ALA A 177 74.463 8.413 41.829 1.00 11.04 O ATOM 1320 CB ALA A 177 72.957 11.132 42.191 1.00 10.71 C ATOM 1321 H ALA A 177 74.491 11.232 40.181 1.00 0.00 H ATOM 1322 N ALA A 178 74.716 9.042 43.976 1.00 9.81 N ATOM 1323 CA ALA A 178 74.861 7.665 44.438 1.00 10.06 C ATOM 1324 C ALA A 178 74.368 7.614 45.887 1.00 9.47 C ATOM 1325 O ALA A 178 73.166 7.632 46.111 1.00 10.09 O ATOM 1326 CB ALA A 178 76.285 7.194 44.274 1.00 10.80 C ATOM 1327 H ALA A 178 74.765 9.827 44.656 1.00 0.00 H ATOM 1328 N HIS A 179 75.264 7.557 46.857 1.00 9.21 N ATOM 1329 CA HIS A 179 74.899 7.687 48.272 1.00 9.36 C ATOM 1330 C HIS A 179 74.182 9.013 48.554 1.00 10.24 C ATOM 1331 O HIS A 179 73.274 9.101 49.369 1.00 9.67 O ATOM 1332 CB HIS A 179 76.159 7.548 49.113 1.00 10.03 C ATOM 1333 CG HIS A 179 75.997 7.947 50.535 1.00 9.77 C ATOM 1334 ND1 HIS A 179 75.555 7.095 51.527 1.00 9.01 N ATOM 1335 CD2 HIS A 179 76.298 9.108 51.151 1.00 9.35 C ATOM 1336 CE1 HIS A 179 75.514 7.752 52.678 1.00 9.27 C ATOM 1337 NE2 HIS A 179 75.962 8.974 52.476 1.00 9.62 N ATOM 1338 H HIS A 179 76.264 7.415 46.608 1.00 0.00 H ATOM 1339 N SER A 180 74.656 10.044 47.885 1.00 9.33 N ATOM 1340 CA SER A 180 74.004 11.338 47.908 1.00 9.90 C ATOM 1341 C SER A 180 74.141 11.983 46.519 1.00 9.51 C ATOM 1342 O SER A 180 74.919 11.512 45.670 1.00 9.81 O ATOM 1343 CB SER A 180 74.641 12.215 49.005 1.00 10.99 C ATOM 1344 OG SER A 180 76.016 12.489 48.727 1.00 10.47 O ATOM 1345 HG SER A 180 76.088 12.967 47.863 1.00 0.00 H ATOM 1346 H SER A 180 75.524 9.926 47.324 1.00 0.00 H TER 1347 SER A 180 ATOM 1348 N ASP A 182 75.482 14.799 45.792 1.00 9.90 N ATOM 1349 CA ASP A 182 76.704 15.579 45.731 1.00 10.06 C ATOM 1350 C ASP A 182 77.988 14.796 45.941 1.00 9.60 C ATOM 1351 O ASP A 182 79.067 15.387 45.996 1.00 10.80 O ATOM 1352 CB ASP A 182 76.662 16.704 46.794 1.00 10.06 C ATOM 1353 CG ASP A 182 76.484 16.197 48.223 1.00 9.91 C ATOM 1354 OD1 ASP A 182 75.847 15.136 48.410 1.00 10.81 O ATOM 1355 OD2 ASP A 182 77.056 16.836 49.150 1.00 9.59 O ATOM 1356 HN3 ASP A 182 75.404 14.351 46.727 1.00 0.00 H ATOM 1357 HN2 ASP A 182 75.504 14.065 45.055 1.00 0.00 H ATOM 1358 HN1 ASP A 182 74.665 15.424 45.637 1.00 0.00 H ATOM 1359 N ASN A 183 77.894 13.491 46.166 1.00 8.78 N ATOM 1360 CA ASN A 183 79.082 12.734 46.536 1.00 8.46 C ATOM 1361 C ASN A 183 80.257 12.845 45.560 1.00 8.06 C ATOM 1362 O ASN A 183 80.093 12.675 44.365 1.00 8.76 O ATOM 1363 CB ASN A 183 78.790 11.261 46.991 1.00 8.42 C ATOM 1364 CG ASN A 183 77.953 10.451 46.011 1.00 9.31 C ATOM 1365 OD1 ASN A 183 77.287 9.541 46.424 1.00 9.82 O ATOM 1366 ND2 ASN A 183 78.011 10.764 44.738 1.00 9.95 N ATOM 1367 HD22 ASN A 183 78.601 11.561 44.425 1.00 0.00 H ATOM 1368 HD21 ASN A 183 77.467 10.215 44.042 1.00 0.00 H ATOM 1369 H ASN A 183 76.976 13.011 46.078 1.00 0.00 H ATOM 1370 N LEU A 184 81.419 13.173 46.111 1.00 8.51 N ATOM 1371 CA LEU A 184 82.668 13.230 45.370 1.00 9.26 C ATOM 1372 C LEU A 184 83.539 12.036 45.718 1.00 9.17 C ATOM 1373 O LEU A 184 83.457 11.506 46.816 1.00 9.71 O ATOM 1374 CB LEU A 184 83.453 14.495 45.702 1.00 10.59 C ATOM 1375 CG LEU A 184 82.741 15.812 45.383 1.00 11.01 C ATOM 1376 CD1 LEU A 184 83.643 16.967 45.774 1.00 12.21 C ATOM 1377 CD2 LEU A 184 82.392 15.872 43.896 1.00 11.21 C ATOM 1378 H LEU A 184 81.437 13.401 47.126 1.00 0.00 H ATOM 1379 N VAL A 185 84.370 11.628 44.770 1.00 9.46 N ATOM 1380 CA VAL A 185 85.465 10.736 45.088 1.00 10.17 C ATOM 1381 C VAL A 185 86.773 11.464 44.833 1.00 9.92 C ATOM 1382 O VAL A 185 86.837 12.479 44.121 1.00 10.14 O ATOM 1383 CB VAL A 185 85.385 9.357 44.371 1.00 11.24 C ATOM 1384 CG1 VAL A 185 84.027 8.705 44.641 1.00 12.81 C ATOM 1385 CG2 VAL A 185 85.674 9.458 42.920 1.00 12.61 C ATOM 1386 H VAL A 185 84.235 11.951 43.791 1.00 0.00 H ATOM 1387 N VAL A 186 87.818 10.958 45.466 1.00 9.79 N ATOM 1388 CA VAL A 186 89.115 11.588 45.454 1.00 10.42 C ATOM 1389 C VAL A 186 90.176 10.566 45.085 1.00 9.87 C ATOM 1390 O VAL A 186 90.265 9.490 45.695 1.00 11.59 O ATOM 1391 CB VAL A 186 89.429 12.213 46.836 1.00 10.57 C ATOM 1392 CG1 VAL A 186 90.800 12.878 46.820 1.00 11.11 C ATOM 1393 CG2 VAL A 186 88.304 13.182 47.269 1.00 10.72 C ATOM 1394 H VAL A 186 87.700 10.070 45.994 1.00 0.00 H ATOM 1395 N TYR A 187 90.984 10.894 44.093 1.00 9.96 N ATOM 1396 CA TYR A 187 92.055 9.998 43.668 1.00 10.91 C ATOM 1397 C TYR A 187 93.424 10.633 43.891 1.00 11.29 C ATOM 1398 O TYR A 187 93.624 11.811 43.570 1.00 11.25 O ATOM 1399 CB TYR A 187 91.894 9.619 42.183 1.00 11.42 C ATOM 1400 CG TYR A 187 92.865 8.550 41.732 1.00 12.13 C ATOM 1401 CD1 TYR A 187 92.740 7.248 42.176 1.00 11.94 C ATOM 1402 CD2 TYR A 187 93.911 8.865 40.866 1.00 12.48 C ATOM 1403 CE1 TYR A 187 93.634 6.272 41.775 1.00 12.90 C ATOM 1404 CE2 TYR A 187 94.789 7.903 40.457 1.00 12.30 C ATOM 1405 CZ TYR A 187 94.662 6.609 40.933 1.00 13.14 C ATOM 1406 OH TYR A 187 95.572 5.649 40.530 1.00 13.53 O ATOM 1407 HH TYR A 187 96.483 5.924 40.803 1.00 0.00 H ATOM 1408 H TYR A 187 90.855 11.805 43.607 1.00 0.00 H ATOM 1409 N VAL A 188 94.358 9.843 44.442 1.00 11.24 N ATOM 1410 CA VAL A 188 95.723 10.305 44.683 1.00 12.79 C ATOM 1411 C VAL A 188 96.624 9.607 43.682 1.00 13.42 C ATOM 1412 O VAL A 188 96.989 8.454 43.877 1.00 13.52 O ATOM 1413 CB VAL A 188 96.205 9.971 46.105 1.00 12.38 C ATOM 1414 CG1 VAL A 188 97.506 10.695 46.382 1.00 13.26 C ATOM 1415 CG2 VAL A 188 95.137 10.268 47.179 1.00 12.74 C ATOM 1416 H VAL A 188 94.102 8.870 44.706 1.00 0.00 H ATOM 1417 N PRO A 189 96.951 10.285 42.575 1.00 14.06 N ATOM 1418 CA PRO A 189 97.656 9.566 41.499 1.00 15.07 C ATOM 1419 C PRO A 189 99.038 9.055 41.893 1.00 17.01 C ATOM 1420 O PRO A 189 99.458 8.015 41.382 1.00 17.89 O ATOM 1421 CB PRO A 189 97.749 10.593 40.370 1.00 16.03 C ATOM 1422 CG PRO A 189 97.394 11.862 40.934 1.00 16.10 C ATOM 1423 CD PRO A 189 96.558 11.636 42.162 1.00 14.72 C ATOM 1424 N SER A 190 99.721 9.745 42.799 1.00 17.51 N ATOM 1425 CA SER A 190 101.066 9.323 43.185 1.00 18.27 C ATOM 1426 C SER A 190 101.061 7.986 43.927 1.00 18.30 C ATOM 1427 O SER A 190 102.091 7.325 44.006 1.00 19.41 O ATOM 1428 CB SER A 190 101.723 10.366 44.075 1.00 19.60 C ATOM 1429 OG SER A 190 101.071 10.427 45.333 1.00 21.27 O ATOM 1430 HG SER A 190 101.511 11.110 45.899 1.00 0.00 H ATOM 1431 H SER A 190 99.297 10.589 43.235 1.00 0.00 H ATOM 1432 N ALA A 191 99.914 7.591 44.471 1.00 17.01 N ATOM 1433 CA ALA A 191 99.852 6.441 45.348 1.00 16.09 C ATOM 1434 C ALA A 191 98.825 5.408 44.880 1.00 15.18 C ATOM 1435 O ALA A 191 98.654 4.389 45.508 1.00 16.09 O ATOM 1436 CB ALA A 191 99.522 6.894 46.768 1.00 16.69 C ATOM 1437 H ALA A 191 99.043 8.119 44.262 1.00 0.00 H ATOM 1438 N SER A 192 98.085 5.737 43.824 1.00 14.17 N ATOM 1439 CA SER A 192 97.000 4.880 43.306 1.00 14.41 C ATOM 1440 C SER A 192 95.956 4.580 44.375 1.00 13.80 C ATOM 1441 O SER A 192 95.430 3.463 44.468 1.00 14.53 O ATOM 1442 CB SER A 192 97.546 3.572 42.713 1.00 16.41 C ATOM 1443 OG SER A 192 98.524 3.839 41.693 1.00 17.87 O ATOM 1444 HG SER A 192 99.276 4.350 42.084 1.00 0.00 H ATOM 1445 H SER A 192 98.280 6.638 43.342 1.00 0.00 H ATOM 1446 N VAL A 193 95.618 5.609 45.142 1.00 12.73 N ATOM 1447 CA VAL A 193 94.635 5.504 46.206 1.00 12.52 C ATOM 1448 C VAL A 193 93.369 6.194 45.745 1.00 12.27 C ATOM 1449 O VAL A 193 93.365 7.377 45.379 1.00 12.47 O ATOM 1450 CB VAL A 193 95.152 6.145 47.499 1.00 13.55 C ATOM 1451 CG1 VAL A 193 94.056 6.207 48.579 1.00 13.53 C ATOM 1452 CG2 VAL A 193 96.364 5.396 48.010 1.00 14.33 C ATOM 1453 H VAL A 193 96.076 6.528 44.974 1.00 0.00 H ATOM 1454 N LEU A 194 92.284 5.438 45.810 1.00 11.42 N ATOM 1455 CA LEU A 194 90.976 5.956 45.473 1.00 11.79 C ATOM 1456 C LEU A 194 90.171 5.994 46.749 1.00 11.54 C ATOM 1457 O LEU A 194 89.876 4.962 47.347 1.00 12.82 O ATOM 1458 CB LEU A 194 90.279 5.042 44.487 1.00 12.48 C ATOM 1459 CG LEU A 194 88.871 5.409 44.071 1.00 14.77 C ATOM 1460 CD1 LEU A 194 88.832 6.765 43.391 1.00 15.56 C ATOM 1461 CD2 LEU A 194 88.309 4.320 43.177 1.00 16.05 C ATOM 1462 H LEU A 194 92.374 4.447 46.111 1.00 0.00 H ATOM 1463 N TYR A 195 89.823 7.203 47.157 1.00 11.99 N ATOM 1464 CA TYR A 195 88.952 7.450 48.318 1.00 11.34 C ATOM 1465 C TYR A 195 87.534 7.565 47.780 1.00 11.16 C ATOM 1466 O TYR A 195 87.190 8.518 47.135 1.00 11.41 O ATOM 1467 CB TYR A 195 89.353 8.705 49.143 1.00 11.36 C ATOM 1468 CG TYR A 195 88.376 8.937 50.276 1.00 10.65 C ATOM 1469 CD1 TYR A 195 88.487 8.259 51.475 1.00 9.41 C ATOM 1470 CD2 TYR A 195 87.291 9.770 50.114 1.00 10.07 C ATOM 1471 CE1 TYR A 195 87.557 8.427 52.490 1.00 9.30 C ATOM 1472 CE2 TYR A 195 86.350 9.950 51.130 1.00 9.94 C ATOM 1473 CZ TYR A 195 86.478 9.256 52.299 1.00 10.06 C ATOM 1474 OH TYR A 195 85.524 9.429 53.279 1.00 11.56 O ATOM 1475 HH TYR A 195 85.750 8.865 54.061 1.00 0.00 H ATOM 1476 H TYR A 195 90.184 8.023 46.629 1.00 0.00 H ATOM 1477 N GLY A 196 86.725 6.555 48.030 1.00 10.48 N ATOM 1478 CA GLY A 196 85.380 6.509 47.477 1.00 10.78 C ATOM 1479 C GLY A 196 84.347 7.187 48.353 1.00 10.06 C ATOM 1480 O GLY A 196 83.259 7.474 47.871 1.00 10.94 O ATOM 1481 H GLY A 196 87.055 5.776 48.634 1.00 0.00 H ATOM 1482 N GLY A 197 84.675 7.463 49.624 1.00 10.38 N ATOM 1483 CA GLY A 197 83.701 8.038 50.545 1.00 10.03 C ATOM 1484 C GLY A 197 82.460 7.186 50.632 1.00 9.89 C ATOM 1485 O GLY A 197 82.508 6.009 50.359 1.00 9.31 O ATOM 1486 H GLY A 197 85.639 7.264 49.958 1.00 0.00 H ATOM 1487 N CYS A 198 81.323 7.788 50.985 1.00 9.04 N ATOM 1488 CA CYS A 198 80.198 6.987 51.426 1.00 8.51 C ATOM 1489 C CYS A 198 79.404 6.389 50.250 1.00 9.16 C ATOM 1490 O CYS A 198 78.508 5.615 50.451 1.00 9.18 O ATOM 1491 CB CYS A 198 79.377 7.809 52.417 1.00 9.46 C ATOM 1492 SG CYS A 198 80.397 8.326 53.815 1.00 9.61 S ATOM 1493 H CYS A 198 81.244 8.824 50.944 1.00 0.00 H ATOM 1494 N ALA A 199 79.819 6.723 49.028 1.00 9.02 N ATOM 1495 CA ALA A 199 79.298 6.065 47.831 1.00 8.77 C ATOM 1496 C ALA A 199 79.815 4.627 47.712 1.00 7.98 C ATOM 1497 O ALA A 199 79.280 3.846 46.918 1.00 9.11 O ATOM 1498 CB ALA A 199 79.704 6.817 46.558 1.00 9.72 C ATOM 1499 H ALA A 199 80.533 7.472 48.923 1.00 0.00 H ATOM 1500 N ILE A 200 80.842 4.265 48.490 1.00 8.26 N ATOM 1501 CA ILE A 200 81.440 2.931 48.457 1.00 10.52 C ATOM 1502 C ILE A 200 81.331 2.312 49.848 1.00 9.72 C ATOM 1503 O ILE A 200 81.688 2.927 50.861 1.00 9.89 O ATOM 1504 CB ILE A 200 82.923 3.000 48.012 1.00 10.74 C ATOM 1505 CG1 ILE A 200 83.062 3.617 46.617 1.00 10.59 C ATOM 1506 CG2 ILE A 200 83.591 1.627 48.087 1.00 10.57 C ATOM 1507 CD1 ILE A 200 82.317 2.885 45.543 1.00 11.75 C ATOM 1508 H ILE A 200 81.234 4.967 49.150 1.00 0.00 H ATOM 1509 N TYR A 201 80.856 1.080 49.896 1.00 9.38 N ATOM 1510 CA TYR A 201 80.655 0.292 51.106 1.00 9.08 C ATOM 1511 C TYR A 201 81.820 -0.665 51.318 1.00 9.70 C ATOM 1512 O TYR A 201 82.352 -1.192 50.367 1.00 10.17 O ATOM 1513 CB TYR A 201 79.406 -0.563 50.901 1.00 10.10 C ATOM 1514 CG TYR A 201 78.067 0.125 51.038 1.00 10.22 C ATOM 1515 CD1 TYR A 201 77.962 1.433 51.502 1.00 10.65 C ATOM 1516 CD2 TYR A 201 76.917 -0.523 50.692 1.00 10.95 C ATOM 1517 CE1 TYR A 201 76.739 2.038 51.653 1.00 10.82 C ATOM 1518 CE2 TYR A 201 75.689 0.077 50.828 1.00 11.32 C ATOM 1519 CZ TYR A 201 75.608 1.364 51.311 1.00 11.71 C ATOM 1520 OH TYR A 201 74.376 1.932 51.464 1.00 10.96 O ATOM 1521 HH TYR A 201 74.479 2.851 51.817 1.00 0.00 H ATOM 1522 H TYR A 201 80.603 0.633 48.991 1.00 0.00 H ATOM 1523 N GLU A 202 82.181 -0.907 52.573 1.00 10.08 N ATOM 1524 CA GLU A 202 83.134 -1.972 52.870 1.00 10.74 C ATOM 1525 C GLU A 202 82.502 -3.351 52.702 1.00 10.06 C ATOM 1526 O GLU A 202 81.285 -3.513 52.727 1.00 9.93 O ATOM 1527 CB GLU A 202 83.709 -1.816 54.276 1.00 9.98 C ATOM 1528 CG GLU A 202 82.749 -2.256 55.373 1.00 10.43 C ATOM 1529 CD GLU A 202 83.369 -2.338 56.760 1.00 11.19 C ATOM 1530 OE1 GLU A 202 84.511 -2.847 56.875 1.00 12.18 O ATOM 1531 OE2 GLU A 202 82.734 -1.836 57.741 1.00 12.41 O ATOM 1532 H GLU A 202 81.784 -0.336 53.346 1.00 0.00 H ATOM 1533 N LEU A 203 83.360 -4.337 52.494 1.00 10.64 N ATOM 1534 CA LEU A 203 82.919 -5.715 52.270 1.00 10.46 C ATOM 1535 C LEU A 203 82.052 -6.265 53.414 1.00 11.34 C ATOM 1536 O LEU A 203 81.130 -7.018 53.181 1.00 11.94 O ATOM 1537 CB LEU A 203 84.138 -6.622 52.086 1.00 12.07 C ATOM 1538 CG LEU A 203 84.998 -6.336 50.843 1.00 11.36 C ATOM 1539 CD1 LEU A 203 86.101 -7.365 50.724 1.00 12.61 C ATOM 1540 CD2 LEU A 203 84.105 -6.355 49.576 1.00 11.53 C ATOM 1541 H LEU A 203 84.378 -4.127 52.490 1.00 0.00 H ATOM 1542 N SER A 204 82.372 -5.900 54.648 1.00 11.30 N ATOM 1543 CA SER A 204 81.579 -6.343 55.790 1.00 12.55 C ATOM 1544 C SER A 204 80.150 -5.850 55.799 1.00 12.55 C ATOM 1545 O SER A 204 79.333 -6.399 56.525 1.00 14.70 O ATOM 1546 CB SER A 204 82.219 -5.943 57.114 1.00 14.05 C ATOM 1547 OG SER A 204 83.487 -6.535 57.248 1.00 15.73 O ATOM 1548 HG SER A 204 83.395 -7.520 57.220 1.00 0.00 H ATOM 1549 H SER A 204 83.199 -5.290 54.804 1.00 0.00 H ATOM 1550 N ARG A 205 79.854 -4.771 55.077 1.00 11.89 N ATOM 1551 CA ARG A 205 78.483 -4.286 54.961 1.00 11.34 C ATOM 1552 C ARG A 205 77.801 -5.056 53.817 1.00 11.98 C ATOM 1553 O ARG A 205 78.180 -4.930 52.644 1.00 12.56 O ATOM 1554 CB ARG A 205 78.424 -2.781 54.716 1.00 11.41 C ATOM 1555 CG ARG A 205 77.040 -2.370 54.255 1.00 12.04 C ATOM 1556 CD ARG A 205 76.904 -0.886 54.250 1.00 12.84 C ATOM 1557 NE ARG A 205 76.506 -0.395 55.557 1.00 11.83 N ATOM 1558 CZ ARG A 205 76.235 0.886 55.812 1.00 11.90 C ATOM 1559 NH1 ARG A 205 76.348 1.790 54.851 1.00 12.74 N ATOM 1560 NH2 ARG A 205 75.833 1.250 57.007 1.00 13.30 N ATOM 1561 HE ARG A 205 76.428 -1.079 56.337 1.00 0.00 H ATOM 1562 HH12 ARG A 205 76.137 2.789 55.049 1.00 0.00 H ATOM 1563 HH11 ARG A 205 76.648 1.501 53.898 1.00 0.00 H ATOM 1564 HH22 ARG A 205 75.622 2.249 57.203 1.00 0.00 H ATOM 1565 HH21 ARG A 205 75.725 0.539 57.758 1.00 0.00 H ATOM 1566 H ARG A 205 80.617 -4.263 54.585 1.00 0.00 H ATOM 1567 N THR A 206 76.840 -5.903 54.171 1.00 12.32 N ATOM 1568 CA THR A 206 76.119 -6.689 53.168 1.00 13.03 C ATOM 1569 C THR A 206 74.688 -6.224 52.903 1.00 13.49 C ATOM 1570 O THR A 206 74.010 -6.770 52.021 1.00 15.99 O ATOM 1571 CB THR A 206 76.125 -8.181 53.533 1.00 15.06 C ATOM 1572 OG1 THR A 206 75.565 -8.336 54.846 1.00 15.15 O ATOM 1573 CG2 THR A 206 77.557 -8.699 53.476 1.00 16.13 C ATOM 1574 HG1 THR A 206 74.637 -7.992 54.850 1.00 0.00 H ATOM 1575 H THR A 206 76.596 -6.009 55.176 1.00 0.00 H ATOM 1576 N SER A 207 74.236 -5.231 53.670 1.00 12.55 N ATOM 1577 CA SER A 207 72.923 -4.631 53.479 1.00 12.58 C ATOM 1578 C SER A 207 73.088 -3.129 53.398 1.00 11.93 C ATOM 1579 O SER A 207 73.949 -2.575 54.060 1.00 11.94 O ATOM 1580 CB SER A 207 71.965 -4.962 54.626 1.00 13.27 C ATOM 1581 OG SER A 207 71.415 -6.258 54.488 1.00 14.29 O ATOM 1582 HG SER A 207 72.145 -6.927 54.487 1.00 0.00 H ATOM 1583 H SER A 207 74.844 -4.872 54.433 1.00 0.00 H ATOM 1584 N ALA A 208 72.265 -2.473 52.583 1.00 11.98 N ATOM 1585 CA ALA A 208 72.355 -1.017 52.438 1.00 12.04 C ATOM 1586 C ALA A 208 72.205 -0.312 53.785 1.00 12.72 C ATOM 1587 O ALA A 208 71.457 -0.775 54.661 1.00 13.88 O ATOM 1588 CB ALA A 208 71.309 -0.532 51.489 1.00 13.03 C ATOM 1589 H ALA A 208 71.549 -3.000 52.043 1.00 0.00 H ATOM 1590 N GLY A 209 72.917 0.804 53.946 1.00 12.41 N ATOM 1591 CA GLY A 209 72.775 1.633 55.144 1.00 12.37 C ATOM 1592 C GLY A 209 71.868 2.833 54.900 1.00 12.80 C ATOM 1593 O GLY A 209 70.747 2.705 54.426 1.00 12.98 O ATOM 1594 H GLY A 209 73.587 1.091 53.205 1.00 0.00 H ATOM 1595 N ASN A 210 72.361 4.011 55.239 1.00 13.28 N ATOM 1596 CA ASN A 210 71.598 5.233 55.114 1.00 13.44 C ATOM 1597 C ASN A 210 71.435 5.592 53.671 1.00 11.60 C ATOM 1598 O ASN A 210 72.403 6.077 53.018 1.00 12.05 O ATOM 1599 CB ASN A 210 72.303 6.361 55.852 1.00 14.11 C ATOM 1600 CG ASN A 210 71.681 7.716 55.590 1.00 15.29 C ATOM 1601 OD1 ASN A 210 70.568 7.808 55.084 1.00 15.69 O ATOM 1602 ND2 ASN A 210 72.408 8.777 55.935 1.00 15.55 N ATOM 1603 HD22 ASN A 210 73.348 8.647 56.361 1.00 0.00 H ATOM 1604 HD21 ASN A 210 72.036 9.735 55.778 1.00 0.00 H ATOM 1605 H ASN A 210 73.332 4.061 55.609 1.00 0.00 H ATOM 1606 N VAL A 211 70.212 5.437 53.182 1.00 11.58 N ATOM 1607 CA VAL A 211 69.915 5.773 51.794 1.00 13.29 C ATOM 1608 C VAL A 211 68.889 6.889 51.673 1.00 12.36 C ATOM 1609 O VAL A 211 68.318 7.141 50.599 1.00 12.77 O ATOM 1610 CB VAL A 211 69.497 4.526 50.982 1.00 14.44 C ATOM 1611 CG1 VAL A 211 70.616 3.475 50.990 1.00 16.09 C ATOM 1612 CG2 VAL A 211 68.175 3.946 51.510 1.00 14.79 C ATOM 1613 H VAL A 211 69.456 5.072 53.795 1.00 0.00 H ATOM 1614 N ALA A 212 68.678 7.590 52.775 1.00 12.10 N ATOM 1615 CA ALA A 212 67.685 8.656 52.785 1.00 13.28 C ATOM 1616 C ALA A 212 67.947 9.696 51.697 1.00 12.93 C ATOM 1617 O ALA A 212 67.018 10.253 51.116 1.00 14.08 O ATOM 1618 CB ALA A 212 67.637 9.303 54.139 1.00 13.69 C ATOM 1619 H ALA A 212 69.222 7.380 53.636 1.00 0.00 H ATOM 1620 N ASP A 213 69.212 9.992 51.456 1.00 11.66 N ATOM 1621 CA ASP A 213 69.583 11.007 50.472 1.00 11.90 C ATOM 1622 C ASP A 213 70.142 10.424 49.181 1.00 11.50 C ATOM 1623 O ASP A 213 70.652 11.159 48.344 1.00 12.15 O ATOM 1624 CB ASP A 213 70.554 11.990 51.117 1.00 12.67 C ATOM 1625 CG ASP A 213 69.922 12.702 52.312 1.00 13.98 C ATOM 1626 OD1 ASP A 213 68.752 13.083 52.202 1.00 16.99 O ATOM 1627 OD2 ASP A 213 70.573 12.854 53.370 1.00 14.01 O ATOM 1628 H ASP A 213 69.960 9.492 51.978 1.00 0.00 H ATOM 1629 N ALA A 214 70.002 9.118 48.996 1.00 10.94 N ATOM 1630 CA ALA A 214 70.584 8.429 47.857 1.00 11.21 C ATOM 1631 C ALA A 214 69.735 8.531 46.610 1.00 11.15 C ATOM 1632 O ALA A 214 68.536 8.809 46.638 1.00 12.00 O ATOM 1633 CB ALA A 214 70.805 6.948 48.213 1.00 11.13 C ATOM 1634 H ALA A 214 69.457 8.568 49.690 1.00 0.00 H ATOM 1635 N ASP A 215 70.389 8.235 45.506 1.00 10.72 N ATOM 1636 CA ASP A 215 69.738 7.982 44.239 1.00 11.26 C ATOM 1637 C ASP A 215 70.002 6.529 43.875 1.00 11.44 C ATOM 1638 O ASP A 215 70.993 6.204 43.209 1.00 11.81 O ATOM 1639 CB ASP A 215 70.294 8.902 43.175 1.00 11.03 C ATOM 1640 CG ASP A 215 69.501 8.874 41.886 1.00 13.35 C ATOM 1641 OD1 ASP A 215 68.982 7.804 41.512 1.00 13.02 O ATOM 1642 OD2 ASP A 215 69.474 9.941 41.225 1.00 15.58 O ATOM 1643 H ASP A 215 71.427 8.180 45.547 1.00 0.00 H ATOM 1644 N LEU A 216 69.094 5.643 44.279 1.00 11.04 N ATOM 1645 CA LEU A 216 69.324 4.217 44.060 1.00 12.30 C ATOM 1646 C LEU A 216 69.377 3.885 42.576 1.00 11.78 C ATOM 1647 O LEU A 216 70.167 3.057 42.129 1.00 11.75 O ATOM 1648 CB LEU A 216 68.230 3.367 44.712 1.00 12.53 C ATOM 1649 CG LEU A 216 68.162 3.341 46.237 1.00 13.60 C ATOM 1650 CD1 LEU A 216 66.879 2.587 46.646 1.00 14.55 C ATOM 1651 CD2 LEU A 216 69.409 2.719 46.847 1.00 13.52 C ATOM 1652 H LEU A 216 68.224 5.965 44.749 1.00 0.00 H ATOM 1653 N ALA A 217 68.494 4.514 41.807 1.00 11.57 N ATOM 1654 CA ALA A 217 68.427 4.270 40.374 1.00 11.94 C ATOM 1655 C ALA A 217 69.747 4.574 39.664 1.00 11.55 C ATOM 1656 O ALA A 217 70.094 3.918 38.691 1.00 12.39 O ATOM 1657 CB ALA A 217 67.286 5.096 39.732 1.00 12.40 C ATOM 1658 H ALA A 217 67.837 5.195 42.239 1.00 0.00 H ATOM 1659 N GLU A 218 70.478 5.582 40.122 1.00 11.93 N ATOM 1660 CA GLU A 218 71.717 6.007 39.456 1.00 11.89 C ATOM 1661 C GLU A 218 72.980 5.476 40.090 1.00 11.13 C ATOM 1662 O GLU A 218 74.049 5.517 39.491 1.00 11.54 O ATOM 1663 CB GLU A 218 71.779 7.541 39.449 1.00 13.11 C ATOM 1664 CG GLU A 218 70.769 8.177 38.509 1.00 16.46 C ATOM 1665 CD GLU A 218 70.893 7.652 37.082 1.00 17.37 C ATOM 1666 OE1 GLU A 218 72.046 7.460 36.631 1.00 16.59 O ATOM 1667 OE2 GLU A 218 69.821 7.387 36.449 1.00 18.93 O ATOM 1668 H GLU A 218 70.165 6.086 40.977 1.00 0.00 H ATOM 1669 N TRP A 219 72.863 4.972 41.304 1.00 9.83 N ATOM 1670 CA TRP A 219 74.064 4.609 42.067 1.00 9.36 C ATOM 1671 C TRP A 219 74.991 3.617 41.290 1.00 10.55 C ATOM 1672 O TRP A 219 76.189 3.855 41.167 1.00 9.81 O ATOM 1673 CB TRP A 219 73.628 4.139 43.478 1.00 8.95 C ATOM 1674 CG TRP A 219 74.680 4.019 44.530 1.00 8.88 C ATOM 1675 CD1 TRP A 219 76.034 3.814 44.385 1.00 9.70 C ATOM 1676 CD2 TRP A 219 74.429 4.049 45.930 1.00 9.04 C ATOM 1677 NE1 TRP A 219 76.628 3.734 45.622 1.00 9.90 N ATOM 1678 CE2 TRP A 219 75.658 3.900 46.585 1.00 9.05 C ATOM 1679 CE3 TRP A 219 73.269 4.206 46.703 1.00 10.14 C ATOM 1680 CZ2 TRP A 219 75.745 3.870 47.971 1.00 9.35 C ATOM 1681 CZ3 TRP A 219 73.368 4.238 48.044 1.00 9.82 C ATOM 1682 CH2 TRP A 219 74.593 4.050 48.687 1.00 9.10 C ATOM 1683 HE1 TRP A 219 77.640 3.575 45.801 1.00 0.00 H ATOM 1684 H TRP A 219 71.920 4.832 41.720 1.00 0.00 H ATOM 1685 N PRO A 220 74.454 2.528 40.760 1.00 11.36 N ATOM 1686 CA PRO A 220 75.369 1.646 40.037 1.00 11.11 C ATOM 1687 C PRO A 220 76.005 2.268 38.796 1.00 11.22 C ATOM 1688 O PRO A 220 77.186 1.998 38.505 1.00 11.31 O ATOM 1689 CB PRO A 220 74.477 0.452 39.645 1.00 11.50 C ATOM 1690 CG PRO A 220 73.369 0.449 40.679 1.00 12.53 C ATOM 1691 CD PRO A 220 73.109 1.948 40.877 1.00 12.39 C ATOM 1692 N THR A 221 75.278 3.136 38.108 1.00 12.19 N ATOM 1693 CA THR A 221 75.839 3.857 36.965 1.00 10.99 C ATOM 1694 C THR A 221 76.986 4.757 37.406 1.00 11.39 C ATOM 1695 O THR A 221 78.054 4.801 36.770 1.00 11.85 O ATOM 1696 CB THR A 221 74.763 4.659 36.212 1.00 11.48 C ATOM 1697 OG1 THR A 221 73.748 3.764 35.709 1.00 13.28 O ATOM 1698 CG2 THR A 221 75.380 5.424 35.055 1.00 10.80 C ATOM 1699 HG1 THR A 221 73.059 4.286 35.226 1.00 0.00 H ATOM 1700 H THR A 221 74.291 3.308 38.385 1.00 0.00 H ATOM 1701 N SER A 222 76.761 5.444 38.516 1.00 10.34 N ATOM 1702 CA SER A 222 77.804 6.298 39.077 1.00 9.14 C ATOM 1703 C SER A 222 79.059 5.501 39.474 1.00 9.87 C ATOM 1704 O SER A 222 80.175 5.908 39.197 1.00 10.91 O ATOM 1705 CB SER A 222 77.249 7.085 40.254 1.00 10.41 C ATOM 1706 OG SER A 222 76.183 7.899 39.771 1.00 11.15 O ATOM 1707 HG SER A 222 75.804 8.423 40.521 1.00 0.00 H ATOM 1708 H SER A 222 75.838 5.375 38.990 1.00 0.00 H ATOM 1709 N ILE A 223 78.863 4.349 40.099 1.00 9.33 N ATOM 1710 CA ILE A 223 79.982 3.468 40.414 1.00 9.66 C ATOM 1711 C ILE A 223 80.736 3.079 39.130 1.00 10.45 C ATOM 1712 O ILE A 223 81.961 3.052 39.091 1.00 10.92 O ATOM 1713 CB ILE A 223 79.531 2.250 41.242 1.00 10.80 C ATOM 1714 CG1 ILE A 223 79.195 2.708 42.665 1.00 11.89 C ATOM 1715 CG2 ILE A 223 80.614 1.185 41.280 1.00 10.86 C ATOM 1716 CD1 ILE A 223 78.604 1.615 43.501 1.00 14.04 C ATOM 1717 H ILE A 223 77.898 4.069 40.369 1.00 0.00 H ATOM 1718 N GLU A 224 80.010 2.754 38.080 1.00 11.28 N ATOM 1719 CA GLU A 224 80.666 2.347 36.847 1.00 13.15 C ATOM 1720 C GLU A 224 81.499 3.501 36.266 1.00 12.46 C ATOM 1721 O GLU A 224 82.597 3.296 35.701 1.00 11.08 O ATOM 1722 CB GLU A 224 79.645 1.792 35.833 1.00 15.13 C ATOM 1723 CG GLU A 224 80.271 1.303 34.514 1.00 19.51 C ATOM 1724 CD GLU A 224 81.321 0.155 34.674 1.00 24.41 C ATOM 1725 OE1 GLU A 224 81.319 -0.606 35.689 1.00 26.03 O ATOM 1726 OE2 GLU A 224 82.151 0.004 33.752 1.00 27.66 O ATOM 1727 H GLU A 224 78.972 2.788 38.132 1.00 0.00 H ATOM 1728 N ARG A 225 81.039 4.725 36.450 1.00 12.14 N ATOM 1729 CA ARG A 225 81.875 5.838 36.020 1.00 11.48 C ATOM 1730 C ARG A 225 83.189 5.886 36.812 1.00 11.56 C ATOM 1731 O ARG A 225 84.242 6.249 36.246 1.00 12.61 O ATOM 1732 CB ARG A 225 81.144 7.166 36.141 1.00 11.62 C ATOM 1733 CG ARG A 225 79.991 7.350 35.221 1.00 12.81 C ATOM 1734 CD ARG A 225 79.583 8.807 35.114 1.00 12.73 C ATOM 1735 NE ARG A 225 78.350 8.971 34.363 1.00 14.52 N ATOM 1736 CZ ARG A 225 77.122 8.859 34.878 1.00 15.33 C ATOM 1737 NH1 ARG A 225 76.918 8.634 36.176 1.00 14.77 N ATOM 1738 NH2 ARG A 225 76.076 8.972 34.083 1.00 16.50 N ATOM 1739 HE ARG A 225 78.429 9.192 33.350 1.00 0.00 H ATOM 1740 HH12 ARG A 225 75.949 8.552 36.544 1.00 0.00 H ATOM 1741 HH11 ARG A 225 77.728 8.540 36.821 1.00 0.00 H ATOM 1742 HH22 ARG A 225 75.115 8.887 34.472 1.00 0.00 H ATOM 1743 HH21 ARG A 225 76.212 9.146 33.067 1.00 0.00 H ATOM 1744 H ARG A 225 80.110 4.889 36.888 1.00 0.00 H ATOM 1745 N ILE A 226 83.151 5.592 38.124 1.00 11.01 N ATOM 1746 CA ILE A 226 84.377 5.544 38.908 1.00 11.99 C ATOM 1747 C ILE A 226 85.306 4.474 38.347 1.00 12.11 C ATOM 1748 O ILE A 226 86.482 4.742 38.141 1.00 12.32 O ATOM 1749 CB ILE A 226 84.096 5.267 40.386 1.00 11.14 C ATOM 1750 CG1 ILE A 226 83.169 6.331 40.988 1.00 11.06 C ATOM 1751 CG2 ILE A 226 85.398 5.175 41.188 1.00 11.68 C ATOM 1752 CD1 ILE A 226 82.594 5.935 42.339 1.00 11.40 C ATOM 1753 H ILE A 226 82.238 5.397 38.582 1.00 0.00 H ATOM 1754 N GLN A 227 84.785 3.270 38.110 1.00 12.64 N ATOM 1755 CA GLN A 227 85.572 2.172 37.545 1.00 13.64 C ATOM 1756 C GLN A 227 86.212 2.576 36.223 1.00 14.33 C ATOM 1757 O GLN A 227 87.400 2.358 36.002 1.00 15.23 O ATOM 1758 CB GLN A 227 84.684 0.954 37.329 1.00 15.25 C ATOM 1759 CG GLN A 227 85.332 -0.157 36.528 1.00 17.69 C ATOM 1760 CD GLN A 227 86.567 -0.768 37.205 1.00 19.98 C ATOM 1761 OE1 GLN A 227 86.521 -1.167 38.373 1.00 21.08 O ATOM 1762 NE2 GLN A 227 87.660 -0.880 36.447 1.00 20.32 N ATOM 1763 HE22 GLN A 227 87.652 -0.529 35.468 1.00 0.00 H ATOM 1764 HE21 GLN A 227 88.520 -1.318 36.835 1.00 0.00 H ATOM 1765 H GLN A 227 83.783 3.105 38.335 1.00 0.00 H ATOM 1766 N GLN A 228 85.433 3.182 35.343 1.00 14.18 N ATOM 1767 CA GLN A 228 85.945 3.571 34.027 1.00 16.37 C ATOM 1768 C GLN A 228 86.984 4.678 34.082 1.00 15.69 C ATOM 1769 O GLN A 228 87.878 4.722 33.221 1.00 15.75 O ATOM 1770 CB GLN A 228 84.799 3.972 33.109 1.00 19.97 C ATOM 1771 CG GLN A 228 83.907 2.800 32.728 1.00 23.75 C ATOM 1772 CD GLN A 228 84.684 1.700 32.024 1.00 27.41 C ATOM 1773 OE1 GLN A 228 85.379 1.956 31.037 1.00 29.42 O ATOM 1774 NE2 GLN A 228 84.584 0.474 32.534 1.00 28.65 N ATOM 1775 HE22 GLN A 228 83.986 0.305 33.368 1.00 0.00 H ATOM 1776 HE21 GLN A 228 85.104 -0.314 32.099 1.00 0.00 H ATOM 1777 H GLN A 228 84.443 3.385 35.589 1.00 0.00 H ATOM 1778 N HIS A 229 86.862 5.584 35.056 1.00 14.77 N ATOM 1779 CA HIS A 229 87.806 6.690 35.191 1.00 14.74 C ATOM 1780 C HIS A 229 89.089 6.319 35.924 1.00 14.46 C ATOM 1781 O HIS A 229 90.128 6.873 35.609 1.00 16.05 O ATOM 1782 CB HIS A 229 87.152 7.885 35.875 1.00 16.39 C ATOM 1783 CG HIS A 229 87.816 9.180 35.560 1.00 18.57 C ATOM 1784 ND1 HIS A 229 87.447 9.969 34.492 1.00 20.49 N ATOM 1785 CD2 HIS A 229 88.842 9.818 36.165 1.00 19.38 C ATOM 1786 CE1 HIS A 229 88.212 11.046 34.463 1.00 20.19 C ATOM 1787 NE2 HIS A 229 89.081 10.970 35.457 1.00 20.02 N ATOM 1788 H HIS A 229 86.077 5.500 35.733 1.00 0.00 H ATOM 1789 N TYR A 230 89.013 5.400 36.892 1.00 13.54 N ATOM 1790 CA TYR A 230 90.159 5.052 37.730 1.00 13.18 C ATOM 1791 C TYR A 230 90.471 3.559 37.752 1.00 13.19 C ATOM 1792 O TYR A 230 90.655 2.969 38.815 1.00 12.48 O ATOM 1793 CB TYR A 230 89.960 5.575 39.171 1.00 13.08 C ATOM 1794 CG TYR A 230 89.788 7.067 39.250 1.00 14.02 C ATOM 1795 CD1 TYR A 230 90.835 7.906 38.972 1.00 13.80 C ATOM 1796 CD2 TYR A 230 88.578 7.640 39.609 1.00 14.96 C ATOM 1797 CE1 TYR A 230 90.706 9.280 39.045 1.00 14.23 C ATOM 1798 CE2 TYR A 230 88.421 9.006 39.662 1.00 15.18 C ATOM 1799 CZ TYR A 230 89.500 9.829 39.389 1.00 14.97 C ATOM 1800 OH TYR A 230 89.381 11.186 39.433 1.00 17.18 O ATOM 1801 HH TYR A 230 90.252 11.600 39.210 1.00 0.00 H ATOM 1802 H TYR A 230 88.107 4.916 37.054 1.00 0.00 H ATOM 1803 N PRO A 231 90.612 2.941 36.576 1.00 13.75 N ATOM 1804 CA PRO A 231 90.752 1.488 36.573 1.00 14.43 C ATOM 1805 C PRO A 231 92.127 1.036 37.085 1.00 14.58 C ATOM 1806 O PRO A 231 92.316 -0.140 37.407 1.00 15.56 O ATOM 1807 CB PRO A 231 90.578 1.138 35.092 1.00 13.66 C ATOM 1808 CG PRO A 231 91.021 2.352 34.374 1.00 13.76 C ATOM 1809 CD PRO A 231 90.483 3.471 35.206 1.00 13.06 C ATOM 1810 N GLU A 232 93.053 1.979 37.211 1.00 14.27 N ATOM 1811 CA GLU A 232 94.380 1.716 37.740 1.00 14.28 C ATOM 1812 C GLU A 232 94.439 1.746 39.282 1.00 14.83 C ATOM 1813 O GLU A 232 95.481 1.436 39.880 1.00 15.20 O ATOM 1814 CB GLU A 232 95.371 2.743 37.146 1.00 15.09 C ATOM 1815 CG GLU A 232 95.251 4.163 37.746 1.00 15.78 C ATOM 1816 CD GLU A 232 94.283 5.074 36.988 1.00 17.38 C ATOM 1817 OE1 GLU A 232 93.277 4.583 36.455 1.00 17.92 O ATOM 1818 OE2 GLU A 232 94.496 6.303 36.966 1.00 19.20 O ATOM 1819 H GLU A 232 92.818 2.949 36.918 1.00 0.00 H ATOM 1820 N ALA A 233 93.333 2.094 39.939 1.00 14.98 N ATOM 1821 CA ALA A 233 93.369 2.241 41.391 1.00 14.42 C ATOM 1822 C ALA A 233 93.764 0.952 42.098 1.00 15.38 C ATOM 1823 O ALA A 233 93.285 -0.114 41.743 1.00 15.48 O ATOM 1824 CB ALA A 233 92.023 2.710 41.906 1.00 14.65 C ATOM 1825 H ALA A 233 92.448 2.260 39.419 1.00 0.00 H ATOM 1826 N GLN A 234 94.603 1.075 43.110 1.00 15.58 N ATOM 1827 CA GLN A 234 95.098 -0.073 43.864 1.00 17.55 C ATOM 1828 C GLN A 234 94.556 -0.197 45.281 1.00 17.69 C ATOM 1829 O GLN A 234 94.485 -1.320 45.805 1.00 20.21 O ATOM 1830 CB GLN A 234 96.621 -0.098 43.910 1.00 19.96 C ATOM 1831 CG GLN A 234 97.270 -0.356 42.568 1.00 21.78 C ATOM 1832 CD GLN A 234 96.941 -1.714 42.012 1.00 24.53 C ATOM 1833 OE1 GLN A 234 97.324 -2.711 42.565 1.00 25.78 O ATOM 1834 NE2 GLN A 234 96.216 -1.749 40.936 1.00 25.31 N ATOM 1835 HE22 GLN A 234 95.906 -0.863 40.489 1.00 0.00 H ATOM 1836 HE21 GLN A 234 95.945 -2.663 40.521 1.00 0.00 H ATOM 1837 H GLN A 234 94.924 2.027 43.381 1.00 0.00 H ATOM 1838 N PHE A 235 94.259 0.900 45.897 1.00 15.04 N ATOM 1839 CA PHE A 235 93.813 0.938 47.290 1.00 15.56 C ATOM 1840 C PHE A 235 92.546 1.785 47.307 1.00 15.19 C ATOM 1841 O PHE A 235 92.597 2.964 46.975 1.00 17.73 O ATOM 1842 CB PHE A 235 94.959 1.554 48.129 1.00 17.04 C ATOM 1843 CG PHE A 235 94.829 1.396 49.631 1.00 20.18 C ATOM 1844 CD1 PHE A 235 94.129 2.325 50.390 1.00 20.49 C ATOM 1845 CD2 PHE A 235 95.496 0.366 50.296 1.00 21.33 C ATOM 1846 CE1 PHE A 235 94.042 2.183 51.780 1.00 21.58 C ATOM 1847 CE2 PHE A 235 95.401 0.221 51.682 1.00 22.08 C ATOM 1848 CZ PHE A 235 94.680 1.122 52.417 1.00 21.78 C ATOM 1849 H PHE A 235 94.341 1.798 45.378 1.00 0.00 H ATOM 1850 N VAL A 236 91.427 1.147 47.715 1.00 12.81 N ATOM 1851 CA VAL A 236 90.128 1.755 47.679 1.00 12.53 C ATOM 1852 C VAL A 236 89.573 1.899 49.085 1.00 12.05 C ATOM 1853 O VAL A 236 89.525 0.961 49.831 1.00 11.84 O ATOM 1854 CB VAL A 236 89.154 0.984 46.785 1.00 13.37 C ATOM 1855 CG1 VAL A 236 87.801 1.655 46.821 1.00 14.36 C ATOM 1856 CG2 VAL A 236 89.677 0.895 45.352 1.00 13.70 C ATOM 1857 H VAL A 236 91.511 0.173 48.070 1.00 0.00 H ATOM 1858 N ILE A 237 89.187 3.116 49.447 1.00 11.58 N ATOM 1859 CA ILE A 237 88.788 3.411 50.816 1.00 12.25 C ATOM 1860 C ILE A 237 87.306 3.752 50.825 1.00 11.91 C ATOM 1861 O ILE A 237 86.888 4.714 50.150 1.00 12.30 O ATOM 1862 CB ILE A 237 89.593 4.593 51.395 1.00 13.45 C ATOM 1863 CG1 ILE A 237 91.092 4.299 51.312 1.00 15.80 C ATOM 1864 CG2 ILE A 237 89.189 4.841 52.858 1.00 13.34 C ATOM 1865 CD1 ILE A 237 91.917 5.469 51.623 1.00 16.75 C ATOM 1866 H ILE A 237 89.169 3.876 48.737 1.00 0.00 H ATOM 1867 N PRO A 238 86.517 2.972 51.588 1.00 10.73 N ATOM 1868 CA PRO A 238 85.096 3.276 51.753 1.00 10.09 C ATOM 1869 C PRO A 238 84.906 4.389 52.779 1.00 11.19 C ATOM 1870 O PRO A 238 85.802 4.674 53.542 1.00 11.53 O ATOM 1871 CB PRO A 238 84.519 1.953 52.293 1.00 10.90 C ATOM 1872 CG PRO A 238 85.628 1.410 53.131 1.00 11.60 C ATOM 1873 CD PRO A 238 86.917 1.814 52.428 1.00 11.47 C ATOM 1874 N GLY A 239 83.738 5.014 52.801 1.00 10.70 N ATOM 1875 CA GLY A 239 83.473 6.043 53.797 1.00 10.73 C ATOM 1876 C GLY A 239 83.526 5.484 55.222 1.00 10.91 C ATOM 1877 O GLY A 239 83.924 6.195 56.160 1.00 11.55 O ATOM 1878 H GLY A 239 83.007 4.769 52.103 1.00 0.00 H ATOM 1879 N HIS A 240 83.136 4.210 55.378 1.00 10.01 N ATOM 1880 CA HIS A 240 83.068 3.567 56.672 1.00 10.64 C ATOM 1881 C HIS A 240 83.645 2.156 56.545 1.00 10.94 C ATOM 1882 O HIS A 240 83.141 1.330 55.771 1.00 11.04 O ATOM 1883 CB HIS A 240 81.600 3.524 57.150 1.00 9.88 C ATOM 1884 CG HIS A 240 80.956 4.875 57.183 1.00 9.51 C ATOM 1885 ND1 HIS A 240 81.149 5.748 58.218 1.00 10.31 N ATOM 1886 CD2 HIS A 240 80.206 5.535 56.256 1.00 10.22 C ATOM 1887 CE1 HIS A 240 80.521 6.882 57.958 1.00 9.65 C ATOM 1888 NE2 HIS A 240 79.949 6.785 56.767 1.00 8.99 N ATOM 1889 H HIS A 240 82.872 3.662 54.534 1.00 0.00 H ATOM 1890 N GLY A 241 84.735 1.891 57.267 1.00 11.54 N ATOM 1891 CA GLY A 241 85.248 0.536 57.369 1.00 12.71 C ATOM 1892 C GLY A 241 86.550 0.266 56.623 1.00 12.69 C ATOM 1893 O GLY A 241 87.313 1.175 56.235 1.00 11.79 O ATOM 1894 H GLY A 241 85.223 2.664 57.763 1.00 0.00 H ATOM 1895 N LEU A 242 86.785 -1.006 56.378 1.00 12.42 N ATOM 1896 CA LEU A 242 88.085 -1.452 55.902 1.00 12.68 C ATOM 1897 C LEU A 242 88.338 -1.174 54.436 1.00 11.77 C ATOM 1898 O LEU A 242 87.469 -1.386 53.605 1.00 11.58 O ATOM 1899 CB LEU A 242 88.233 -2.954 56.083 1.00 14.50 C ATOM 1900 CG LEU A 242 88.047 -3.515 57.488 1.00 16.17 C ATOM 1901 CD1 LEU A 242 88.232 -5.032 57.474 1.00 16.49 C ATOM 1902 CD2 LEU A 242 89.027 -2.873 58.444 1.00 17.28 C ATOM 1903 H LEU A 242 86.028 -1.704 56.527 1.00 0.00 H ATOM 1904 N PRO A 243 89.552 -0.753 54.108 1.00 12.93 N ATOM 1905 CA PRO A 243 89.870 -0.548 52.700 1.00 13.37 C ATOM 1906 C PRO A 243 89.935 -1.864 51.961 1.00 13.09 C ATOM 1907 O PRO A 243 89.941 -2.941 52.573 1.00 13.06 O ATOM 1908 CB PRO A 243 91.238 0.110 52.751 1.00 14.19 C ATOM 1909 CG PRO A 243 91.853 -0.407 53.990 1.00 14.70 C ATOM 1910 CD PRO A 243 90.738 -0.604 54.969 1.00 13.79 C ATOM 1911 N GLY A 244 89.987 -1.776 50.643 1.00 13.53 N ATOM 1912 CA GLY A 244 90.139 -2.948 49.798 1.00 14.37 C ATOM 1913 C GLY A 244 90.699 -2.505 48.458 1.00 14.89 C ATOM 1914 O GLY A 244 91.472 -1.546 48.376 1.00 15.40 O ATOM 1915 H GLY A 244 89.917 -0.839 50.197 1.00 0.00 H ATOM 1916 N GLY A 245 90.321 -3.216 47.408 1.00 15.18 N ATOM 1917 CA GLY A 245 90.697 -2.844 46.059 1.00 14.38 C ATOM 1918 C GLY A 245 89.464 -2.426 45.291 1.00 15.56 C ATOM 1919 O GLY A 245 88.441 -2.134 45.876 1.00 15.28 O ATOM 1920 H GLY A 245 89.738 -4.065 47.555 1.00 0.00 H ATOM 1921 N LEU A 246 89.564 -2.420 43.967 1.00 15.37 N ATOM 1922 CA LEU A 246 88.444 -2.052 43.129 1.00 15.30 C ATOM 1923 C LEU A 246 87.272 -3.016 43.280 1.00 14.48 C ATOM 1924 O LEU A 246 86.153 -2.660 42.895 1.00 14.21 O ATOM 1925 CB LEU A 246 88.880 -1.929 41.680 1.00 15.89 C ATOM 1926 CG LEU A 246 89.580 -0.618 41.321 1.00 15.88 C ATOM 1927 CD1 LEU A 246 90.269 -0.701 39.976 1.00 16.59 C ATOM 1928 CD2 LEU A 246 88.612 0.595 41.345 1.00 16.61 C ATOM 1929 H LEU A 246 90.466 -2.685 43.523 1.00 0.00 H ATOM 1930 N ASP A 247 87.493 -4.203 43.845 1.00 14.68 N ATOM 1931 CA ASP A 247 86.370 -5.082 44.168 1.00 15.06 C ATOM 1932 C ASP A 247 85.309 -4.441 45.072 1.00 13.81 C ATOM 1933 O ASP A 247 84.163 -4.872 45.072 1.00 12.63 O ATOM 1934 CB ASP A 247 86.852 -6.408 44.790 1.00 16.43 C ATOM 1935 CG ASP A 247 87.830 -6.198 45.945 1.00 17.53 C ATOM 1936 OD1 ASP A 247 87.927 -5.068 46.480 1.00 18.63 O ATOM 1937 OD2 ASP A 247 88.544 -7.161 46.280 1.00 17.42 O ATOM 1938 H ASP A 247 88.466 -4.504 44.056 1.00 0.00 H ATOM 1939 N LEU A 248 85.670 -3.403 45.809 1.00 12.54 N ATOM 1940 CA LEU A 248 84.678 -2.720 46.645 1.00 11.86 C ATOM 1941 C LEU A 248 83.617 -2.057 45.799 1.00 11.31 C ATOM 1942 O LEU A 248 82.497 -1.894 46.249 1.00 11.28 O ATOM 1943 CB LEU A 248 85.300 -1.674 47.545 1.00 13.17 C ATOM 1944 CG LEU A 248 86.203 -2.079 48.690 1.00 15.15 C ATOM 1945 CD1 LEU A 248 86.408 -0.986 49.719 1.00 14.03 C ATOM 1946 CD2 LEU A 248 85.693 -3.269 49.354 1.00 17.18 C ATOM 1947 H LEU A 248 86.656 -3.072 45.795 1.00 0.00 H ATOM 1948 N LEU A 249 83.952 -1.687 44.564 1.00 10.97 N ATOM 1949 CA LEU A 249 82.943 -1.117 43.652 1.00 10.54 C ATOM 1950 C LEU A 249 81.850 -2.121 43.299 1.00 11.73 C ATOM 1951 O LEU A 249 80.679 -1.810 43.401 1.00 11.84 O ATOM 1952 CB LEU A 249 83.601 -0.504 42.398 1.00 12.06 C ATOM 1953 CG LEU A 249 84.162 0.928 42.559 1.00 12.99 C ATOM 1954 CD1 LEU A 249 85.174 1.039 43.691 1.00 12.94 C ATOM 1955 CD2 LEU A 249 84.761 1.388 41.190 1.00 13.50 C ATOM 1956 H LEU A 249 84.934 -1.801 44.240 1.00 0.00 H ATOM 1957 N LYS A 250 82.253 -3.284 42.803 1.00 11.25 N ATOM 1958 CA LYS A 250 81.304 -4.352 42.513 1.00 11.85 C ATOM 1959 C LYS A 250 80.515 -4.739 43.751 1.00 10.58 C ATOM 1960 O LYS A 250 79.319 -4.979 43.694 1.00 10.95 O ATOM 1961 CB LYS A 250 82.037 -5.573 41.961 1.00 15.19 C ATOM 1962 CG LYS A 250 81.111 -6.712 41.531 1.00 19.70 C ATOM 1963 CD LYS A 250 79.871 -6.210 40.812 1.00 23.02 C ATOM 1964 CE LYS A 250 79.189 -7.328 40.017 1.00 25.54 C ATOM 1965 NZ LYS A 250 79.877 -7.469 38.723 1.00 27.22 N ATOM 1966 HZ1 LYS A 250 79.815 -6.572 38.200 1.00 0.00 H ATOM 1967 HZ2 LYS A 250 80.876 -7.708 38.887 1.00 0.00 H ATOM 1968 HZ3 LYS A 250 79.424 -8.226 38.172 1.00 0.00 H ATOM 1969 H LYS A 250 83.265 -3.436 42.618 1.00 0.00 H ATOM 1970 N HIS A 251 81.201 -4.840 44.871 1.00 9.97 N ATOM 1971 CA HIS A 251 80.542 -5.188 46.122 1.00 9.64 C ATOM 1972 C HIS A 251 79.413 -4.194 46.428 1.00 9.56 C ATOM 1973 O HIS A 251 78.272 -4.587 46.770 1.00 9.45 O ATOM 1974 CB HIS A 251 81.552 -5.178 47.279 1.00 10.50 C ATOM 1975 CG HIS A 251 80.890 -5.284 48.612 1.00 9.49 C ATOM 1976 ND1 HIS A 251 80.299 -6.444 49.069 1.00 9.63 N ATOM 1977 CD2 HIS A 251 80.655 -4.342 49.560 1.00 8.96 C ATOM 1978 CE1 HIS A 251 79.747 -6.217 50.245 1.00 9.91 C ATOM 1979 NE2 HIS A 251 79.941 -4.947 50.562 1.00 10.15 N ATOM 1980 H HIS A 251 82.227 -4.669 44.862 1.00 0.00 H ATOM 1981 N THR A 252 79.714 -2.907 46.322 1.00 9.92 N ATOM 1982 CA THR A 252 78.724 -1.909 46.613 1.00 9.51 C ATOM 1983 C THR A 252 77.556 -2.031 45.638 1.00 9.29 C ATOM 1984 O THR A 252 76.409 -1.954 46.062 1.00 10.00 O ATOM 1985 CB THR A 252 79.352 -0.509 46.562 1.00 9.23 C ATOM 1986 OG1 THR A 252 80.430 -0.433 47.502 1.00 8.74 O ATOM 1987 CG2 THR A 252 78.333 0.537 46.927 1.00 9.72 C ATOM 1988 HG1 THR A 252 81.115 -1.110 47.273 1.00 0.00 H ATOM 1989 H THR A 252 80.669 -2.620 46.027 1.00 0.00 H ATOM 1990 N THR A 253 77.833 -2.237 44.346 1.00 9.91 N ATOM 1991 CA THR A 253 76.781 -2.415 43.380 1.00 10.65 C ATOM 1992 C THR A 253 75.902 -3.595 43.752 1.00 9.69 C ATOM 1993 O THR A 253 74.676 -3.519 43.642 1.00 10.81 O ATOM 1994 CB THR A 253 77.387 -2.582 41.977 1.00 12.20 C ATOM 1995 OG1 THR A 253 77.961 -1.320 41.607 1.00 14.58 O ATOM 1996 CG2 THR A 253 76.357 -3.009 40.954 1.00 14.46 C ATOM 1997 HG1 THR A 253 78.362 -1.393 40.705 1.00 0.00 H ATOM 1998 H THR A 253 78.825 -2.269 44.034 1.00 0.00 H ATOM 1999 N ASN A 254 76.499 -4.700 44.170 1.00 10.41 N ATOM 2000 CA ASN A 254 75.737 -5.868 44.561 1.00 11.03 C ATOM 2001 C ASN A 254 74.754 -5.519 45.673 1.00 10.39 C ATOM 2002 O ASN A 254 73.566 -5.858 45.615 1.00 11.00 O ATOM 2003 CB ASN A 254 76.665 -7.006 45.041 1.00 11.71 C ATOM 2004 CG ASN A 254 77.472 -7.651 43.927 1.00 12.06 C ATOM 2005 OD1 ASN A 254 77.196 -7.483 42.736 1.00 13.75 O ATOM 2006 ND2 ASN A 254 78.483 -8.413 44.322 1.00 12.03 N ATOM 2007 HD22 ASN A 254 78.682 -8.528 45.336 1.00 0.00 H ATOM 2008 HD21 ASN A 254 79.077 -8.895 43.617 1.00 0.00 H ATOM 2009 H ASN A 254 77.537 -4.730 44.219 1.00 0.00 H ATOM 2010 N VAL A 255 75.245 -4.820 46.696 1.00 9.99 N ATOM 2011 CA VAL A 255 74.419 -4.481 47.867 1.00 10.27 C ATOM 2012 C VAL A 255 73.326 -3.487 47.502 1.00 10.19 C ATOM 2013 O VAL A 255 72.164 -3.639 47.899 1.00 10.64 O ATOM 2014 CB VAL A 255 75.295 -3.936 49.012 1.00 10.43 C ATOM 2015 CG1 VAL A 255 74.455 -3.395 50.164 1.00 11.07 C ATOM 2016 CG2 VAL A 255 76.236 -5.016 49.526 1.00 11.88 C ATOM 2017 H VAL A 255 76.236 -4.506 46.667 1.00 0.00 H ATOM 2018 N VAL A 256 73.684 -2.468 46.721 1.00 9.69 N ATOM 2019 CA VAL A 256 72.703 -1.490 46.298 1.00 10.76 C ATOM 2020 C VAL A 256 71.620 -2.116 45.442 1.00 11.09 C ATOM 2021 O VAL A 256 70.454 -1.771 45.586 1.00 12.04 O ATOM 2022 CB VAL A 256 73.381 -0.335 45.553 1.00 11.50 C ATOM 2023 CG1 VAL A 256 72.362 0.553 44.858 1.00 12.99 C ATOM 2024 CG2 VAL A 256 74.217 0.463 46.530 1.00 12.04 C ATOM 2025 H VAL A 256 74.673 -2.375 46.414 1.00 0.00 H ATOM 2026 N LYS A 257 71.981 -2.984 44.506 1.00 10.22 N ATOM 2027 CA LYS A 257 70.958 -3.654 43.691 1.00 11.19 C ATOM 2028 C LYS A 257 70.053 -4.553 44.520 1.00 11.39 C ATOM 2029 O LYS A 257 68.848 -4.618 44.274 1.00 12.57 O ATOM 2030 CB LYS A 257 71.618 -4.442 42.571 1.00 12.32 C ATOM 2031 CG LYS A 257 72.216 -3.524 41.465 1.00 13.04 C ATOM 2032 CD LYS A 257 72.748 -4.319 40.258 1.00 14.76 C ATOM 2033 CE LYS A 257 73.057 -3.414 39.070 1.00 15.35 C ATOM 2034 NZ LYS A 257 73.497 -4.173 37.865 1.00 16.08 N ATOM 2035 HZ1 LYS A 257 74.360 -4.709 38.090 1.00 0.00 H ATOM 2036 HZ2 LYS A 257 72.744 -4.831 37.577 1.00 0.00 H ATOM 2037 HZ3 LYS A 257 73.693 -3.508 37.090 1.00 0.00 H ATOM 2038 H LYS A 257 72.988 -3.190 44.349 1.00 0.00 H ATOM 2039 N ALA A 258 70.608 -5.203 45.526 1.00 11.47 N ATOM 2040 CA ALA A 258 69.777 -6.025 46.410 1.00 11.18 C ATOM 2041 C ALA A 258 68.766 -5.154 47.149 1.00 11.81 C ATOM 2042 O ALA A 258 67.601 -5.518 47.279 1.00 13.23 O ATOM 2043 CB ALA A 258 70.630 -6.798 47.385 1.00 12.29 C ATOM 2044 H ALA A 258 71.632 -5.132 45.691 1.00 0.00 H ATOM 2045 N HIS A 259 69.198 -3.992 47.621 1.00 10.95 N ATOM 2046 CA HIS A 259 68.279 -3.100 48.318 1.00 11.11 C ATOM 2047 C HIS A 259 67.208 -2.596 47.350 1.00 11.31 C ATOM 2048 O HIS A 259 66.043 -2.493 47.678 1.00 11.60 O ATOM 2049 CB HIS A 259 69.041 -1.913 48.910 1.00 12.58 C ATOM 2050 CG HIS A 259 68.150 -0.990 49.674 1.00 15.88 C ATOM 2051 ND1 HIS A 259 67.634 -1.317 50.908 1.00 17.17 N ATOM 2052 CD2 HIS A 259 67.604 0.205 49.341 1.00 17.46 C ATOM 2053 CE1 HIS A 259 66.838 -0.348 51.318 1.00 17.96 C ATOM 2054 NE2 HIS A 259 66.812 0.591 50.392 1.00 18.56 N ATOM 2055 H HIS A 259 70.193 -3.717 47.494 1.00 0.00 H ATOM 2056 N THR A 260 67.629 -2.234 46.149 1.00 10.74 N ATOM 2057 CA THR A 260 66.726 -1.769 45.109 1.00 11.20 C ATOM 2058 C THR A 260 65.602 -2.767 44.887 1.00 11.74 C ATOM 2059 O THR A 260 64.468 -2.374 44.582 1.00 13.02 O ATOM 2060 CB THR A 260 67.503 -1.579 43.790 1.00 11.50 C ATOM 2061 OG1 THR A 260 68.431 -0.490 43.941 1.00 13.74 O ATOM 2062 CG2 THR A 260 66.573 -1.317 42.638 1.00 11.62 C ATOM 2063 HG1 THR A 260 68.932 -0.365 43.096 1.00 0.00 H ATOM 2064 H THR A 260 68.647 -2.284 45.941 1.00 0.00 H ATOM 2065 N ASN A 261 65.920 -4.058 45.034 1.00 11.26 N ATOM 2066 CA ASN A 261 64.947 -5.136 44.784 1.00 12.36 C ATOM 2067 C ASN A 261 64.234 -5.651 46.026 1.00 14.00 C ATOM 2068 O ASN A 261 63.591 -6.706 45.983 1.00 15.45 O ATOM 2069 CB ASN A 261 65.623 -6.319 44.066 1.00 12.91 C ATOM 2070 CG ASN A 261 66.027 -5.989 42.654 1.00 13.94 C ATOM 2071 OD1 ASN A 261 65.690 -4.937 42.129 1.00 14.75 O ATOM 2072 ND2 ASN A 261 66.770 -6.895 42.027 1.00 15.99 N ATOM 2073 HD22 ASN A 261 67.034 -7.777 42.511 1.00 0.00 H ATOM 2074 HD21 ASN A 261 67.088 -6.722 41.052 1.00 0.00 H ATOM 2075 H ASN A 261 66.884 -4.309 45.334 1.00 0.00 H ATOM 2076 N ARG A 262 64.306 -4.890 47.110 1.00 13.58 N ATOM 2077 CA ARG A 262 63.719 -5.302 48.373 1.00 14.17 C ATOM 2078 C ARG A 262 62.208 -5.536 48.246 1.00 15.65 C ATOM 2079 O ARG A 262 61.535 -4.960 47.374 1.00 16.03 O ATOM 2080 CB ARG A 262 64.038 -4.258 49.462 1.00 14.55 C ATOM 2081 CG ARG A 262 63.325 -2.916 49.279 1.00 15.62 C ATOM 2082 CD ARG A 262 63.926 -1.823 50.161 1.00 15.10 C ATOM 2083 NE ARG A 262 63.189 -0.552 49.993 1.00 13.92 N ATOM 2084 CZ ARG A 262 63.354 0.253 48.954 1.00 13.83 C ATOM 2085 NH1 ARG A 262 64.245 -0.050 47.993 1.00 12.70 N ATOM 2086 NH2 ARG A 262 62.612 1.336 48.829 1.00 13.86 N ATOM 2087 HE ARG A 262 62.507 -0.276 50.728 1.00 0.00 H ATOM 2088 HH12 ARG A 262 64.370 0.586 47.180 1.00 0.00 H ATOM 2089 HH11 ARG A 262 64.809 -0.921 48.063 1.00 0.00 H ATOM 2090 HH22 ARG A 262 62.744 1.966 48.012 1.00 0.00 H ATOM 2091 HH21 ARG A 262 61.894 1.560 49.548 1.00 0.00 H ATOM 2092 H ARG A 262 64.796 -3.974 47.054 1.00 0.00 H ATOM 2093 N SER A 263 61.654 -6.346 49.008 1.00 19.23 N ATOM 2094 HN3 SER A 263 61.241 -7.119 48.449 1.00 0.00 H ATOM 2095 HN2 SER A 263 60.903 -5.862 49.540 1.00 0.00 H ATOM 2096 HN1 SER A 263 62.356 -6.733 49.671 1.00 0.00 H TER 2097 SER A 263 HETATM 2098 NA NA A 1 91.020 11.818 35.783 1.00 20.21 NA HETATM 2099 ZN ZN A 2 76.579 10.301 53.956 1.00 10.85 ZN HETATM 2100 ZN ZN A 3 79.210 8.409 55.762 1.00 11.30 ZN HETATM 2101 ZN ZN A 4 89.949 31.217 52.313 1.00 13.03 ZN HETATM 2102 O HOH 5 93.486 -3.328 63.547 1.00 38.95 O HETATM 2103 O HOH 6 87.681 0.771 60.386 1.00 20.07 O HETATM 2104 O HOH 7 86.261 -1.552 61.216 1.00 18.18 O HETATM 2105 O HOH 8 85.208 1.523 69.480 1.00 30.60 O HETATM 2106 O HOH 9 86.324 8.786 67.584 1.00 15.49 O HETATM 2107 O HOH 10 87.613 10.318 74.080 1.00 34.06 O HETATM 2108 O HOH 11 88.553 13.885 72.030 1.00 31.71 O HETATM 2109 O HOH 12 92.968 7.749 76.017 1.00 35.68 O HETATM 2110 O HOH 13 93.082 10.920 69.430 1.00 25.45 O HETATM 2111 O HOH 14 86.639 -4.462 60.977 1.00 23.72 O HETATM 2112 O HOH 15 97.177 6.599 64.979 1.00 27.75 O HETATM 2113 O HOH 16 100.122 6.457 61.418 1.00 37.10 O HETATM 2114 O HOH 17 100.125 3.604 59.863 1.00 27.26 O HETATM 2115 O HOH 18 102.977 8.470 59.731 1.00 38.06 O HETATM 2116 O HOH 19 105.383 10.132 54.380 1.00 36.01 O HETATM 2117 O HOH 20 104.884 5.052 48.830 1.00 31.74 O HETATM 2118 O HOH 21 102.783 8.423 47.376 1.00 28.88 O HETATM 2119 O HOH 22 105.796 12.797 50.347 1.00 30.42 O HETATM 2120 O HOH 23 101.574 12.998 48.998 1.00 32.03 O HETATM 2121 O HOH 24 81.661 12.904 71.589 1.00 28.29 O HETATM 2122 O HOH 25 72.622 10.182 64.841 1.00 28.95 O HETATM 2123 O HOH 26 69.815 6.571 62.877 1.00 18.71 O HETATM 2124 O HOH 27 69.987 4.083 61.508 1.00 22.15 O HETATM 2125 O HOH 28 69.541 0.202 58.802 1.00 21.07 O HETATM 2126 O HOH 29 70.814 10.813 63.214 1.00 36.65 O HETATM 2127 O HOH 30 87.255 10.107 60.191 1.00 13.81 O HETATM 2128 O HOH 31 72.184 -3.821 58.635 1.00 21.96 O HETATM 2129 O HOH 32 79.520 11.303 70.742 1.00 32.59 O HETATM 2130 O HOH 33 82.861 12.552 69.276 1.00 23.17 O HETATM 2131 O HOH 34 82.975 14.505 67.283 1.00 17.52 O HETATM 2132 O HOH 35 75.289 10.112 65.150 1.00 30.46 O HETATM 2133 O HOH 36 76.507 4.304 70.949 1.00 32.56 O HETATM 2134 O HOH 37 78.813 8.935 72.291 1.00 38.17 O HETATM 2135 O HOH 38 73.299 6.413 69.025 1.00 24.94 O HETATM 2136 O HOH 39 74.481 7.900 72.827 1.00 36.29 O HETATM 2137 O HOH 40 74.023 5.530 71.580 1.00 35.19 O HETATM 2138 O HOH 41 73.091 8.772 68.779 1.00 42.49 O HETATM 2139 O HOH 42 71.351 7.618 65.126 1.00 20.33 O HETATM 2140 O HOH 43 69.604 0.333 69.038 1.00 23.84 O HETATM 2141 O HOH 44 68.191 2.108 62.395 1.00 17.17 O HETATM 2142 O HOH 45 68.364 5.169 64.873 1.00 14.83 O HETATM 2143 O HOH 46 70.017 0.017 61.450 1.00 21.67 O HETATM 2144 O HOH 47 73.232 1.622 72.565 1.00 22.30 O HETATM 2145 O HOH 48 71.492 -0.364 70.460 1.00 24.91 O HETATM 2146 O HOH 49 91.334 22.235 67.386 1.00 33.78 O HETATM 2147 O HOH 50 92.598 19.534 71.014 1.00 38.86 O HETATM 2148 O HOH 51 93.061 14.830 71.477 1.00 33.28 O HETATM 2149 O HOH 52 96.969 21.647 65.138 1.00 30.13 O HETATM 2150 O HOH 53 102.126 16.794 69.453 1.00 20.98 O HETATM 2151 O HOH 54 98.218 15.201 71.063 1.00 31.52 O HETATM 2152 O HOH 55 72.565 0.122 61.417 1.00 16.48 O HETATM 2153 O HOH 56 72.669 -2.079 61.176 1.00 18.25 O HETATM 2154 O HOH 57 72.495 2.394 61.418 1.00 15.78 O HETATM 2155 O HOH 58 84.691 10.876 59.144 1.00 18.76 O HETATM 2156 O HOH 59 105.883 12.624 57.753 1.00 33.31 O HETATM 2157 O HOH 60 108.715 16.163 58.649 1.00 30.89 O HETATM 2158 O HOH 61 108.904 18.585 59.859 1.00 27.62 O HETATM 2159 O HOH 62 86.588 3.038 59.088 1.00 13.46 O HETATM 2160 O HOH 63 68.602 11.120 57.181 1.00 33.55 O HETATM 2161 O HOH 64 109.874 16.552 56.223 1.00 35.97 O HETATM 2162 O HOH 65 82.491 23.859 66.315 1.00 28.16 O HETATM 2163 O HOH 66 100.404 18.957 43.886 1.00 35.05 O HETATM 2164 O HOH 67 99.771 22.451 45.693 1.00 37.62 O HETATM 2165 O HOH 68 98.420 21.562 49.090 1.00 24.13 O HETATM 2166 O HOH 69 88.010 25.321 67.616 1.00 34.52 O HETATM 2167 O HOH 70 79.095 28.971 58.005 1.00 32.20 O HETATM 2168 O HOH 71 104.812 23.580 50.836 1.00 35.13 O HETATM 2169 O HOH 72 105.357 23.539 56.667 1.00 39.07 O HETATM 2170 O HOH 73 109.883 20.585 58.160 1.00 31.47 O HETATM 2171 O HOH 74 95.370 28.103 49.441 1.00 30.55 O HETATM 2172 O HOH 75 96.484 21.807 50.887 1.00 17.66 O HETATM 2173 O HOH 76 74.824 27.891 48.945 1.00 31.70 O HETATM 2174 O HOH 77 76.338 29.641 52.439 1.00 33.35 O HETATM 2175 O HOH 78 78.058 30.003 54.577 1.00 36.79 O HETATM 2176 O HOH 79 82.078 32.143 46.843 1.00 18.00 O HETATM 2177 O HOH 80 75.915 12.459 62.956 1.00 25.35 O HETATM 2178 O HOH 81 83.764 30.792 42.745 1.00 33.71 O HETATM 2179 O HOH 82 79.965 18.591 66.141 1.00 29.42 O HETATM 2180 O HOH 83 81.549 17.118 68.803 1.00 26.20 O HETATM 2181 O HOH 84 88.795 16.521 71.022 1.00 22.44 O HETATM 2182 O HOH 85 93.802 22.287 36.857 1.00 31.87 O HETATM 2183 O HOH 86 95.815 15.071 38.654 1.00 32.18 O HETATM 2184 O HOH 87 100.745 14.196 42.287 1.00 25.37 O HETATM 2185 O HOH 88 93.348 20.177 68.098 1.00 24.33 O HETATM 2186 O HOH 89 96.421 10.379 36.813 1.00 36.47 O HETATM 2187 O HOH 90 91.640 17.117 71.025 1.00 25.81 O HETATM 2188 O HOH 91 94.143 13.559 69.291 1.00 24.97 O HETATM 2189 O HOH 92 97.226 19.740 62.902 1.00 20.83 O HETATM 2190 O HOH 93 96.041 20.503 67.499 1.00 31.48 O HETATM 2191 O HOH 94 99.278 17.156 69.155 1.00 19.51 O HETATM 2192 O HOH 95 96.660 13.283 69.769 1.00 28.52 O HETATM 2193 O HOH 96 99.810 19.486 62.193 1.00 23.18 O HETATM 2194 O HOH 97 105.421 18.372 65.108 1.00 29.55 O HETATM 2195 O HOH 98 101.915 22.131 61.883 1.00 34.46 O HETATM 2196 O HOH 99 104.932 20.848 64.160 1.00 33.58 O HETATM 2197 O HOH 100 103.827 18.817 68.625 1.00 20.72 O HETATM 2198 O HOH 101 106.250 14.799 58.865 1.00 33.53 O HETATM 2199 O HOH 102 107.271 19.883 61.484 1.00 24.64 O HETATM 2200 O HOH 103 97.075 21.777 60.943 1.00 25.39 O HETATM 2201 O HOH 104 96.522 25.127 59.810 1.00 39.22 O HETATM 2202 O HOH 105 73.649 -6.253 58.201 1.00 21.46 O HETATM 2203 O HOH 106 73.639 -8.374 48.282 1.00 36.36 O HETATM 2204 O HOH 107 72.196 -8.383 57.978 1.00 31.36 O HETATM 2205 O HOH 108 68.246 -2.029 57.649 1.00 31.82 O HETATM 2206 O HOH 109 94.601 28.319 54.741 1.00 35.57 O HETATM 2207 O HOH 110 68.306 2.385 57.729 1.00 30.69 O HETATM 2208 O HOH 111 70.293 4.230 58.723 1.00 22.82 O HETATM 2209 O HOH 112 97.521 23.306 44.697 1.00 28.75 O HETATM 2210 O HOH 113 94.307 23.815 43.490 1.00 32.48 O HETATM 2211 O HOH 114 92.973 26.410 46.448 1.00 21.67 O HETATM 2212 O HOH 115 66.485 12.618 39.363 1.00 38.51 O HETATM 2213 O HOH 116 85.702 21.237 53.898 1.00 12.09 O HETATM 2214 O HOH 117 70.008 1.008 35.685 1.00 17.97 O HETATM 2215 O HOH 118 71.952 0.322 37.278 1.00 15.25 O HETATM 2216 O HOH 119 81.751 18.739 47.881 1.00 11.43 O HETATM 2217 O HOH 120 77.090 1.974 33.607 1.00 35.83 O HETATM 2218 O HOH 121 77.518 6.073 31.933 1.00 32.00 O HETATM 2219 O HOH 122 81.714 10.833 50.536 1.00 9.36 O HETATM 2220 O HOH 123 90.206 -4.178 38.649 1.00 35.73 O HETATM 2221 O HOH 124 73.030 11.711 57.161 1.00 19.20 O HETATM 2222 O HOH 125 70.854 11.314 55.722 1.00 23.24 O HETATM 2223 O HOH 126 92.102 4.405 31.672 1.00 28.17 O HETATM 2224 O HOH 127 74.408 13.765 58.489 1.00 23.04 O HETATM 2225 O HOH 128 74.188 19.051 61.898 1.00 32.61 O HETATM 2226 O HOH 129 77.433 19.714 60.582 1.00 25.66 O HETATM 2227 O HOH 130 74.067 12.967 61.196 1.00 29.04 O HETATM 2228 O HOH 131 72.400 16.928 60.418 1.00 33.22 O HETATM 2229 O HOH 132 78.606 14.616 65.092 1.00 39.93 O HETATM 2230 O HOH 133 73.487 -8.053 41.393 1.00 31.98 O HETATM 2231 O HOH 134 83.243 22.369 64.061 1.00 15.52 O HETATM 2232 O HOH 135 68.240 -9.162 44.699 1.00 34.95 O HETATM 2233 O HOH 136 84.975 26.092 66.365 1.00 33.36 O HETATM 2234 O HOH 137 84.530 28.604 62.489 1.00 37.95 O HETATM 2235 O HOH 138 79.234 26.389 58.900 1.00 32.34 O HETATM 2236 O HOH 139 63.059 1.579 52.977 1.00 39.88 O HETATM 2237 O HOH 140 90.118 24.830 65.894 1.00 26.46 O HETATM 2238 O HOH 141 90.335 29.431 57.918 1.00 14.68 O HETATM 2239 O HOH 142 87.546 27.551 56.202 1.00 12.27 O HETATM 2240 O HOH 143 91.763 27.015 66.714 1.00 37.27 O HETATM 2241 O HOH 144 92.824 28.146 49.853 1.00 17.74 O HETATM 2242 O HOH 145 79.519 17.698 44.622 1.00 13.69 O HETATM 2243 O HOH 146 75.951 26.615 46.557 1.00 32.07 O HETATM 2244 O HOH 147 77.059 22.623 41.785 1.00 38.73 O HETATM 2245 O HOH 148 72.669 20.139 45.057 1.00 30.26 O HETATM 2246 O HOH 149 75.935 17.259 42.543 1.00 16.33 O HETATM 2247 O HOH 150 78.516 18.135 42.101 1.00 15.28 O HETATM 2248 O HOH 151 78.833 20.974 42.190 1.00 16.33 O HETATM 2249 O HOH 152 75.148 27.338 51.169 1.00 29.17 O HETATM 2250 O HOH 153 78.313 27.613 46.702 1.00 33.88 O HETATM 2251 O HOH 154 70.680 25.793 50.288 1.00 26.28 O HETATM 2252 O HOH 155 69.822 18.992 52.191 1.00 32.21 O HETATM 2253 O HOH 156 71.619 26.056 57.822 1.00 28.59 O HETATM 2254 O HOH 157 67.453 22.495 58.610 1.00 28.37 O HETATM 2255 O HOH 158 66.931 20.103 59.341 1.00 37.65 O HETATM 2256 O HOH 159 69.696 20.147 61.273 1.00 28.77 O HETATM 2257 O HOH 160 69.996 14.708 55.368 1.00 33.19 O HETATM 2258 O HOH 161 75.618 21.146 62.374 1.00 40.01 O HETATM 2259 O HOH 162 74.113 25.376 58.118 1.00 30.86 O HETATM 2260 O HOH 163 72.790 15.398 57.597 1.00 28.68 O HETATM 2261 O HOH 164 80.370 28.876 55.033 1.00 27.86 O HETATM 2262 O HOH 165 82.015 29.818 48.333 1.00 14.83 O HETATM 2263 O HOH 166 85.525 29.818 46.557 1.00 18.63 O HETATM 2264 O HOH 167 85.247 28.857 43.119 1.00 35.52 O HETATM 2265 O HOH 168 87.218 25.845 41.860 1.00 26.60 O HETATM 2266 O HOH 169 88.087 26.460 43.889 1.00 28.59 O HETATM 2267 O HOH 170 79.432 28.874 44.836 1.00 29.46 O HETATM 2268 O HOH 171 81.077 22.275 40.980 1.00 14.29 O HETATM 2269 O HOH 172 87.879 23.661 40.450 1.00 33.69 O HETATM 2270 O HOH 173 79.635 24.391 39.997 1.00 27.41 O HETATM 2271 O HOH 174 81.238 25.153 37.900 1.00 34.72 O HETATM 2272 O HOH 175 80.259 22.622 37.261 1.00 27.98 O HETATM 2273 O HOH 176 85.474 20.145 35.200 1.00 27.68 O HETATM 2274 O HOH 177 76.398 20.966 35.263 1.00 26.03 O HETATM 2275 O HOH 178 80.974 15.620 32.653 1.00 22.91 O HETATM 2276 O HOH 179 78.726 21.416 33.496 1.00 33.73 O HETATM 2277 O HOH 180 74.244 11.129 36.472 1.00 33.65 O HETATM 2278 O HOH 181 73.511 11.660 38.730 1.00 28.60 O HETATM 2279 O HOH 182 84.505 11.507 32.725 1.00 33.54 O HETATM 2280 O HOH 183 81.296 19.223 32.059 1.00 30.36 O HETATM 2281 O HOH 184 80.965 21.213 35.104 1.00 28.66 O HETATM 2282 O HOH 185 86.330 16.507 33.396 1.00 32.07 O HETATM 2283 O HOH 186 91.439 20.895 36.885 1.00 25.30 O HETATM 2284 O HOH 187 93.589 16.214 37.696 1.00 27.71 O HETATM 2285 O HOH 188 89.900 22.490 41.732 1.00 28.67 O HETATM 2286 O HOH 189 95.578 22.454 41.958 1.00 29.38 O HETATM 2287 O HOH 190 96.709 15.432 41.308 1.00 17.36 O HETATM 2288 O HOH 191 99.387 12.551 43.977 1.00 16.79 O HETATM 2289 O HOH 192 90.564 13.361 34.393 1.00 22.26 O HETATM 2290 O HOH 193 92.859 10.618 36.402 1.00 22.48 O HETATM 2291 O HOH 194 73.707 14.982 39.159 1.00 28.90 O HETATM 2292 O HOH 195 71.974 8.755 51.881 1.00 13.16 O HETATM 2293 O HOH 196 74.496 4.533 52.198 1.00 10.62 O HETATM 2294 O HOH 197 71.590 13.780 48.310 1.00 13.19 O HETATM 2295 O HOH 198 70.284 11.461 45.696 1.00 33.93 O HETATM 2296 O HOH 199 69.346 15.403 48.010 1.00 28.77 O HETATM 2297 O HOH 200 69.700 16.907 45.822 1.00 31.38 O HETATM 2298 O HOH 201 81.742 9.785 47.974 1.00 10.27 O HETATM 2299 O HOH 202 97.918 6.499 39.460 1.00 19.56 O HETATM 2300 O HOH 203 101.863 6.458 40.423 1.00 37.30 O HETATM 2301 O HOH 204 101.248 10.381 39.641 1.00 41.35 O HETATM 2302 O HOH 205 101.095 4.299 42.453 1.00 32.85 O HETATM 2303 O HOH 206 104.432 7.820 42.671 1.00 34.72 O HETATM 2304 O HOH 207 100.989 12.779 46.644 1.00 35.09 O HETATM 2305 O HOH 208 98.173 2.134 39.697 1.00 19.16 O HETATM 2306 O HOH 209 78.620 4.574 53.019 1.00 9.70 O HETATM 2307 O HOH 210 80.985 3.191 53.453 1.00 12.40 O HETATM 2308 O HOH 211 80.734 0.679 54.748 1.00 10.96 O HETATM 2309 O HOH 212 85.093 -4.978 55.164 1.00 12.35 O HETATM 2310 O HOH 213 84.899 -4.705 58.940 1.00 19.10 O HETATM 2311 O HOH 214 83.902 -1.829 60.269 1.00 18.08 O HETATM 2312 O HOH 215 81.575 0.421 58.789 1.00 17.77 O HETATM 2313 O HOH 216 86.271 -3.750 52.928 1.00 12.06 O HETATM 2314 O HOH 217 77.220 -8.062 57.001 1.00 18.18 O HETATM 2315 O HOH 218 86.177 -7.492 55.271 1.00 17.48 O HETATM 2316 O HOH 219 82.986 -9.205 57.765 1.00 27.31 O HETATM 2317 O HOH 220 79.478 0.058 57.224 1.00 22.19 O HETATM 2318 O HOH 221 76.158 4.554 54.223 1.00 13.06 O HETATM 2319 O HOH 222 75.338 -4.923 56.446 1.00 14.12 O HETATM 2320 O HOH 223 75.195 -8.721 50.303 1.00 24.70 O HETATM 2321 O HOH 224 72.945 -8.483 55.352 1.00 36.21 O HETATM 2322 O HOH 225 75.243 -11.758 54.203 1.00 36.25 O HETATM 2323 O HOH 226 72.855 -1.866 56.900 1.00 18.99 O HETATM 2324 O HOH 227 69.132 -2.106 54.775 1.00 31.72 O HETATM 2325 O HOH 228 70.975 -4.279 50.597 1.00 18.80 O HETATM 2326 O HOH 229 68.624 1.051 54.707 1.00 34.57 O HETATM 2327 O HOH 230 67.950 4.975 54.984 1.00 20.47 O HETATM 2328 O HOH 231 72.609 2.925 58.698 1.00 16.28 O HETATM 2329 O HOH 232 68.925 6.294 57.588 1.00 29.61 O HETATM 2330 O HOH 233 72.461 9.763 59.040 1.00 17.94 O HETATM 2331 O HOH 234 66.635 5.842 48.685 1.00 24.90 O HETATM 2332 O HOH 235 65.561 6.144 53.970 1.00 38.11 O HETATM 2333 O HOH 236 66.821 10.174 48.199 1.00 26.82 O HETATM 2334 O HOH 237 66.903 13.132 54.254 1.00 36.46 O HETATM 2335 O HOH 238 66.819 6.592 45.986 1.00 19.09 O HETATM 2336 O HOH 239 67.994 11.463 44.639 1.00 37.02 O HETATM 2337 O HOH 240 67.135 9.596 39.476 1.00 26.20 O HETATM 2338 O HOH 241 70.743 11.516 39.227 1.00 25.91 O HETATM 2339 O HOH 242 69.753 0.347 41.616 1.00 16.90 O HETATM 2340 O HOH 243 68.269 2.109 37.512 1.00 16.97 O HETATM 2341 O HOH 244 72.386 2.939 37.781 1.00 14.49 O HETATM 2342 O HOH 245 74.507 8.270 37.434 1.00 19.56 O HETATM 2343 O HOH 246 71.865 5.631 34.460 1.00 22.61 O HETATM 2344 O HOH 247 73.309 8.971 34.524 1.00 27.92 O HETATM 2345 O HOH 248 67.770 8.763 36.986 1.00 29.21 O HETATM 2346 O HOH 249 78.102 -0.555 38.802 1.00 25.24 O HETATM 2347 O HOH 250 78.397 4.501 33.902 1.00 21.70 O HETATM 2348 O HOH 251 74.333 1.939 33.806 1.00 33.59 O HETATM 2349 O HOH 252 80.670 4.249 32.843 1.00 28.45 O HETATM 2350 O HOH 253 81.282 -0.836 38.222 1.00 32.07 O HETATM 2351 O HOH 254 84.014 7.468 33.751 1.00 28.46 O HETATM 2352 O HOH 255 79.514 8.928 31.604 1.00 35.76 O HETATM 2353 O HOH 256 84.361 -2.028 39.322 1.00 37.03 O HETATM 2354 O HOH 257 90.502 -2.056 36.724 1.00 21.88 O HETATM 2355 O HOH 258 87.561 -0.740 33.608 1.00 39.55 O HETATM 2356 O HOH 259 88.470 3.090 31.349 1.00 30.09 O HETATM 2357 O HOH 260 86.249 7.939 32.411 1.00 33.26 O HETATM 2358 O HOH 261 90.532 8.106 33.127 1.00 37.50 O HETATM 2359 O HOH 262 92.762 8.041 36.017 1.00 22.52 O HETATM 2360 O HOH 263 93.877 -1.478 39.117 1.00 22.57 O HETATM 2361 O HOH 264 93.844 4.670 33.695 1.00 25.50 O HETATM 2362 O HOH 265 96.737 7.623 37.186 1.00 31.52 O HETATM 2363 O HOH 266 92.222 -2.590 42.679 1.00 21.77 O HETATM 2364 O HOH 267 93.986 -3.641 44.538 1.00 31.30 O HETATM 2365 O HOH 268 88.547 -5.128 52.050 1.00 15.31 O HETATM 2366 O HOH 269 91.734 -4.086 54.341 1.00 34.41 O HETATM 2367 O HOH 270 89.190 -5.901 49.104 1.00 28.00 O HETATM 2368 O HOH 271 90.024 -5.687 44.250 1.00 32.49 O HETATM 2369 O HOH 272 84.621 -3.847 41.178 1.00 22.82 O HETATM 2370 O HOH 273 87.309 -6.826 41.554 1.00 27.57 O HETATM 2371 O HOH 274 88.871 -8.375 48.435 1.00 25.98 O HETATM 2372 O HOH 275 91.375 -6.850 46.483 1.00 34.08 O HETATM 2373 O HOH 276 88.072 -8.950 44.967 1.00 30.10 O HETATM 2374 O HOH 277 85.251 -6.594 40.640 1.00 30.00 O HETATM 2375 O HOH 278 89.375 -8.774 42.032 1.00 37.60 O HETATM 2376 O HOH 279 78.485 -4.459 38.124 1.00 35.48 O HETATM 2377 O HOH 280 79.726 -2.414 39.613 1.00 31.31 O HETATM 2378 O HOH 281 72.749 -8.095 44.151 1.00 24.47 O HETATM 2379 O HOH 282 75.605 -6.509 40.859 1.00 30.66 O HETATM 2380 O HOH 283 69.541 -7.584 43.266 1.00 29.62 O HETATM 2381 O HOH 284 74.023 -1.342 36.334 1.00 28.64 O HETATM 2382 O HOH 285 75.775 -5.452 38.463 1.00 26.84 O HETATM 2383 O HOH 286 76.258 -1.975 37.466 1.00 37.30 O HETATM 2384 O HOH 287 66.943 -8.168 47.333 1.00 28.08 O HETATM 2385 O HOH 288 67.982 -3.340 52.399 1.00 33.22 O HETATM 2386 O HOH 289 65.337 3.572 49.406 1.00 25.68 O HETATM 2387 O HOH 290 65.113 2.523 51.418 1.00 28.19 O HETATM 2388 O HOH 291 60.455 -6.521 45.161 1.00 36.02 O HETATM 2389 O HOH 292 64.222 -9.257 47.460 1.00 42.66 O HETATM 2390 O HOH 293 61.505 -0.313 52.313 1.00 38.15 O HETATM 2391 O HOH 294 60.533 2.237 50.731 1.00 32.06 O HETATM 2392 O HOH 295 59.660 -8.036 48.208 1.00 33.89 O HETATM 2393 O HOH 296 91.889 28.990 43.305 1.00 27.18 O HETATM 2394 O2 MCO A 297 75.753 5.613 56.437 1.00 -0.57 O HETATM 2395 C9 MCO A 297 75.225 4.957 57.352 1.00 0.06 C HETATM 2396 O3 MCO A 297 74.614 3.954 57.096 1.00 -0.57 O HETATM 2397 C8 MCO A 297 75.287 5.458 58.713 1.00 0.10 C HETATM 2398 C7 MCO A 297 76.072 4.518 59.583 1.00 -0.02 C HETATM 2399 C6 MCO A 297 77.460 4.991 59.520 1.00 -0.03 C HETATM 2400 C5 MCO A 297 77.374 6.451 59.196 1.00 0.04 C HETATM 2401 N MCO A 297 76.035 6.675 58.739 1.00 -0.26 N HETATM 2402 C4 MCO A 297 75.532 7.947 58.357 1.00 0.18 C HETATM 2403 O1 MCO A 297 74.430 8.034 57.999 1.00 -0.40 O HETATM 2404 C2 MCO A 297 76.480 9.093 58.405 1.00 0.05 C HETATM 2405 C3 MCO A 297 76.105 10.052 59.521 1.00 -0.04 C HETATM 2406 H9 MCO A 297 76.817 10.890 59.539 1.00 0.03 H HETATM 2407 H10 MCO A 297 76.137 9.523 60.485 1.00 0.03 H HETATM 2408 H11 MCO A 297 75.089 10.437 59.347 1.00 0.03 H HETATM 2409 C1 MCO A 297 76.406 9.827 57.091 1.00 0.01 C HETATM 2410 S MCO A 297 76.936 8.869 55.615 1.00 -0.18 S HETATM 2411 H14 MCO A 297 76.849 9.446 54.793 1.00 0.10 H HETATM 2412 H12 MCO A 297 77.047 10.718 57.164 1.00 0.04 H HETATM 2413 H13 MCO A 297 75.362 10.138 56.935 1.00 0.04 H HETATM 2414 H8 MCO A 297 77.501 8.720 58.569 1.00 0.05 H HETATM 2415 H6 MCO A 297 78.096 6.711 58.407 1.00 0.05 H HETATM 2416 H7 MCO A 297 77.578 7.054 60.093 1.00 0.05 H HETATM 2417 H4 MCO A 297 78.013 4.455 58.734 1.00 0.03 H HETATM 2418 H5 MCO A 297 77.961 4.841 60.488 1.00 0.03 H HETATM 2419 H2 MCO A 297 75.999 3.489 59.201 1.00 0.03 H HETATM 2420 H3 MCO A 297 75.701 4.552 60.618 1.00 0.03 H HETATM 2421 H1 MCO A 297 74.271 5.606 59.107 1.00 0.07 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 757 755 756 2099 CONECT 777 776 779 2099 CONECT 798 796 2100 CONECT 1115 1113 1114 2101 CONECT 1266 1265 2098 CONECT 1267 1265 2098 CONECT 1337 1335 1336 2099 CONECT 1348 1349 1356 1357 1358 CONECT 1356 1348 CONECT 1357 1348 CONECT 1358 1348 CONECT 1492 1491 2100 CONECT 1787 1785 1786 2098 CONECT 1888 1886 1887 2100 CONECT 2093 2078 2094 2095 2096 CONECT 2094 2093 CONECT 2095 2093 CONECT 2096 2093 CONECT 2098 1266 1267 1787 CONECT 2099 757 777 1337 CONECT 2100 798 1492 1888 CONECT 2101 1115 CONECT 2394 2395 CONECT 2395 2394 2396 2397 CONECT 2396 2395 CONECT 2397 2395 2398 2401 2421 CONECT 2398 2397 2399 2419 2420 CONECT 2399 2398 2400 2417 2418 CONECT 2400 2399 2401 2415 2416 CONECT 2401 2397 2400 2402 CONECT 2402 2401 2403 2404 CONECT 2403 2402 CONECT 2404 2402 2405 2409 2414 CONECT 2405 2404 2406 2407 2408 CONECT 2406 2405 CONECT 2407 2405 CONECT 2408 2405 CONECT 2409 2404 2410 2412 2413 CONECT 2410 2409 2411 CONECT 2411 2410 CONECT 2412 2409 CONECT 2413 2409 CONECT 2414 2404 CONECT 2415 2400 CONECT 2416 2400 CONECT 2417 2399 CONECT 2418 2399 CONECT 2419 2398 CONECT 2420 2398 CONECT 2421 2397 MASTER 0 0 0 0 0 0 0 0 2419 2 54 19 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 4c1e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2yz3
RCSB PDB
PDBbind
266aa, >2YZ3_1|Chains... *
4c1d
RCSB PDB
PDBbind
242aa, >4C1D_1|Chains... at 99%
4pvo
RCSB PDB
PDBbind
242aa, >4PVO_1|Chains... at 99%
4pvt
RCSB PDB
PDBbind
242aa, >4PVT_1|Chains... at 99%
5acw
RCSB PDB
PDBbind
266aa, >5ACW_1|Chains... at 100%
5acx
RCSB PDB
PDBbind
266aa, >5ACX_1|Chains... at 100%
5fqc
RCSB PDB
PDBbind
242aa, >5FQC_1|Chains... at 99%
5k48
RCSB PDB
PDBbind
242aa, >5K48_1|Chains... at 99%
5lca
RCSB PDB
PDBbind
266aa, >5LCA_1|Chain... at 100%
5lcf
RCSB PDB
PDBbind
266aa, >5LCF_1|Chain... at 100%
5lch
RCSB PDB
PDBbind
266aa, >5LCH_1|Chain... at 100%
5le1
RCSB PDB
PDBbind
266aa, >5LE1_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
RCSB PDB
PDBbind
242aa, >6DD0_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1jt1
RCSB PDB
PDBbind
MCO
1m2x
RCSB PDB
PDBbind
MCO
2fu8
RCSB PDB
PDBbind
MCO
4c1c
RCSB PDB
PDBbind
MCO
4c1g
RCSB PDB
PDBbind
MCO
Entry Information
PDB ID
4c1e
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
metallo-beta-lactamase VIM-2
Ligand Name
MCO
EC.Number
E.C.3.5.2.6
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
IC50=0.072uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Antimicrob.Agents Chemother. Vol. 60: pp. 142-150
Ligand Properties
Formula
C
9
H
1
5
NO
3
S
Molecular Weight
217.285
Exact Mass
217.077
No. of atoms
29
No. of bonds
29
Polar Surface Area
96.41
LOGP Value
1.52 (
Computed with XLOGP3
)
0.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 1
Canonical SMILES
SC[C@H](C(=O)N1CCC[C@@H]1C(=O)O)C
InChI String
InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9K2N0
Entrez Gene ID
NCBI Entrez Gene ID:
61723701
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓