Browse entries in the PDBbind-CN Database
HEADER 5YC2_COMPLEX COMPND 5YC2_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 202 HIS ILE ASN LEU LYS VAL SER ASP GLY SER SER GLU ILE SEQRES 2 A 202 PHE PHE LYS ILE LYS LYS THR THR PRO LEU ARG ARG LEU SEQRES 3 A 202 MET GLU ALA PHE ALA LYS ARG GLN GLY LYS GLU MET ASP SEQRES 4 A 202 SER LEU ARG PHE LEU TYR ASP GLY ILE ARG ILE GLU ALA SEQRES 5 A 202 ASP GLN THR PRO GLU ASP LEU ASP MET GLU ASP ASN ASP SEQRES 6 A 202 ILE ILE GLU ALA HIS ARG SER LEU PRO ALA GLU ARG ASN SEQRES 7 A 202 PRO LEU TYR LYS ASP ASP THR LEU ASP HIS THR PRO LEU SEQRES 8 A 202 ILE PRO LYS CYS ARG ALA GLN VAL ILE GLU PHE PRO ASP SEQRES 9 A 202 GLY PRO ALA THR PHE VAL ARG LEU LYS CYS THR ASN PRO SEQRES 10 A 202 GLU SER LYS VAL PRO HIS PHE LEU MET ARG MET ALA LYS SEQRES 11 A 202 ASP SER SER ILE SER ALA THR SER MET PHE ARG SER ALA SEQRES 12 A 202 PHE PRO LYS ALA THR GLN GLU GLU GLU ASP LEU GLU MET SEQRES 13 A 202 ARG TRP ILE ARG ASP ASN LEU ASN PRO ILE GLU ASP LYS SEQRES 14 A 202 ARG VAL ALA GLY LEU TRP VAL PRO PRO ALA ASP ALA LEU SEQRES 15 A 202 ALA LEU ALA LYS ASP TYR SER MET THR PRO PHE ILE ASN SEQRES 16 A 202 ALA LEU LEU GLU ALA SER SER HET PRO A 222 215 ATOM 1 N HIS A 11 36.443 37.357 105.072 1.00 95.64 N ATOM 2 CA HIS A 11 36.853 38.266 104.008 1.00 90.21 C ATOM 3 C HIS A 11 37.773 37.566 103.013 1.00 87.33 C ATOM 4 O HIS A 11 38.633 36.776 103.402 1.00 89.43 O ATOM 5 CB HIS A 11 37.549 39.499 104.591 1.00 92.20 C ATOM 6 CG HIS A 11 36.667 40.342 105.461 1.00 96.92 C ATOM 7 ND1 HIS A 11 36.156 39.894 106.660 1.00103.29 N ATOM 8 CD2 HIS A 11 36.211 41.608 105.307 1.00 95.97 C ATOM 9 CE1 HIS A 11 35.421 40.846 107.206 1.00105.46 C ATOM 10 NE2 HIS A 11 35.438 41.896 106.405 1.00101.12 N ATOM 11 HN3 HIS A 11 37.285 37.016 105.579 1.00 0.00 H ATOM 12 HN2 HIS A 11 35.935 36.549 104.659 1.00 0.00 H ATOM 13 HN1 HIS A 11 35.818 37.860 105.734 1.00 0.00 H ATOM 14 N ILE A 12 37.587 37.859 101.724 1.00 81.28 N ATOM 15 CA ILE A 12 38.408 37.290 100.663 1.00 75.18 C ATOM 16 C ILE A 12 38.768 38.381 99.666 1.00 66.10 C ATOM 17 O ILE A 12 38.095 39.408 99.559 1.00 63.59 O ATOM 18 CB ILE A 12 37.709 36.124 99.927 1.00 74.86 C ATOM 19 CG1 ILE A 12 36.310 36.538 99.462 1.00 69.81 C ATOM 20 CG2 ILE A 12 37.663 34.888 100.805 1.00 82.36 C ATOM 21 CD1 ILE A 12 35.607 35.487 98.630 1.00 66.91 C ATOM 22 H ILE A 12 36.826 38.520 101.467 1.00 0.00 H ATOM 23 N ASN A 13 39.851 38.141 98.931 1.00 60.24 N ATOM 24 CA ASN A 13 40.262 39.014 97.843 1.00 54.63 C ATOM 25 C ASN A 13 39.629 38.546 96.540 1.00 48.73 C ATOM 26 O ASN A 13 39.607 37.348 96.241 1.00 45.39 O ATOM 27 CB ASN A 13 41.785 39.036 97.708 1.00 57.91 C ATOM 28 CG ASN A 13 42.461 39.779 98.844 1.00 64.78 C ATOM 29 OD1 ASN A 13 41.850 40.049 99.878 1.00 69.41 O ATOM 30 ND2 ASN A 13 43.732 40.116 98.655 1.00 65.96 N ATOM 31 HD22 ASN A 13 44.209 39.867 97.765 1.00 0.00 H ATOM 32 HD21 ASN A 13 44.250 40.629 99.397 1.00 0.00 H ATOM 33 H ASN A 13 40.424 37.299 99.142 1.00 0.00 H ATOM 34 N LEU A 14 39.112 39.497 95.767 1.00 45.70 N ATOM 35 CA LEU A 14 38.450 39.199 94.506 1.00 46.82 C ATOM 36 C LEU A 14 38.981 40.108 93.409 1.00 45.28 C ATOM 37 O LEU A 14 39.145 41.315 93.612 1.00 45.55 O ATOM 38 CB LEU A 14 36.929 39.354 94.625 1.00 49.64 C ATOM 39 CG LEU A 14 36.231 38.347 95.541 1.00 54.10 C ATOM 40 CD1 LEU A 14 34.741 38.633 95.612 1.00 44.80 C ATOM 41 CD2 LEU A 14 36.485 36.924 95.064 1.00 43.76 C ATOM 42 H LEU A 14 39.183 40.488 96.075 1.00 0.00 H ATOM 43 N LYS A 15 39.244 39.518 92.248 1.00 46.55 N ATOM 44 CA LYS A 15 39.712 40.242 91.075 1.00 46.77 C ATOM 45 C LYS A 15 38.557 40.407 90.096 1.00 45.13 C ATOM 46 O LYS A 15 37.843 39.442 89.803 1.00 46.20 O ATOM 47 CB LYS A 15 40.874 39.499 90.414 1.00 51.36 C ATOM 48 CG LYS A 15 41.456 40.182 89.189 1.00 56.45 C ATOM 49 CD LYS A 15 42.546 39.321 88.564 1.00 62.75 C ATOM 50 CE LYS A 15 43.191 40.006 87.371 1.00 66.03 C ATOM 51 NZ LYS A 15 44.242 39.156 86.745 1.00 68.17 N ATOM 52 HZ1 LYS A 15 44.984 38.952 87.445 1.00 0.00 H ATOM 53 HZ2 LYS A 15 43.817 38.265 86.419 1.00 0.00 H ATOM 54 HZ3 LYS A 15 44.657 39.660 85.935 1.00 0.00 H ATOM 55 H LYS A 15 39.109 38.489 92.174 1.00 0.00 H ATOM 56 N VAL A 16 38.367 41.629 89.603 1.00 43.08 N ATOM 57 CA VAL A 16 37.306 41.943 88.652 1.00 40.99 C ATOM 58 C VAL A 16 37.944 42.607 87.441 1.00 42.66 C ATOM 59 O VAL A 16 38.613 43.638 87.576 1.00 45.06 O ATOM 60 CB VAL A 16 36.230 42.856 89.264 1.00 37.43 C ATOM 61 CG1 VAL A 16 35.077 43.039 88.290 1.00 34.21 C ATOM 62 CG2 VAL A 16 35.737 42.285 90.583 1.00 35.44 C ATOM 63 H VAL A 16 39.003 42.393 89.909 1.00 0.00 H ATOM 64 N SER A 17 37.731 42.026 86.264 1.00 42.78 N ATOM 65 CA SER A 17 38.341 42.520 85.039 1.00 41.73 C ATOM 66 C SER A 17 37.313 42.536 83.919 1.00 40.55 C ATOM 67 O SER A 17 36.477 41.633 83.820 1.00 39.05 O ATOM 68 CB SER A 17 39.540 41.656 84.630 1.00 44.94 C ATOM 69 OG SER A 17 40.109 42.116 83.416 1.00 48.95 O ATOM 70 HG SER A 17 40.879 41.542 83.176 1.00 0.00 H ATOM 71 H SER A 17 37.110 41.193 86.218 1.00 0.00 H ATOM 72 N ASP A 18 37.381 43.566 83.076 1.00 36.31 N ATOM 73 CA ASP A 18 36.556 43.651 81.879 1.00 37.37 C ATOM 74 C ASP A 18 37.364 43.403 80.610 1.00 41.94 C ATOM 75 O ASP A 18 36.954 43.825 79.524 1.00 45.55 O ATOM 76 CB ASP A 18 35.845 45.004 81.808 1.00 39.70 C ATOM 77 CG ASP A 18 36.802 46.182 81.917 1.00 46.35 C ATOM 78 OD1 ASP A 18 38.019 46.002 81.701 1.00 47.09 O ATOM 79 OD2 ASP A 18 36.330 47.300 82.215 1.00 50.50 O ATOM 80 H ASP A 18 38.048 44.337 83.281 1.00 0.00 H ATOM 81 N GLY A 19 38.510 42.735 80.730 1.00 44.46 N ATOM 82 CA GLY A 19 39.383 42.465 79.612 1.00 51.59 C ATOM 83 C GLY A 19 40.472 43.498 79.401 1.00 58.96 C ATOM 84 O GLY A 19 41.535 43.164 78.865 1.00 62.94 O ATOM 85 H GLY A 19 38.789 42.392 81.672 1.00 0.00 H ATOM 86 N SER A 20 40.236 44.742 79.810 1.00 62.50 N ATOM 87 CA SER A 20 41.203 45.822 79.653 1.00 66.48 C ATOM 88 C SER A 20 41.821 46.276 80.965 1.00 65.05 C ATOM 89 O SER A 20 43.013 46.592 81.001 1.00 68.06 O ATOM 90 CB SER A 20 40.542 47.026 78.970 1.00 70.13 C ATOM 91 OG SER A 20 40.003 46.667 77.710 1.00 73.39 O ATOM 92 HG SER A 20 39.584 47.461 77.293 1.00 0.00 H ATOM 93 H SER A 20 39.323 44.953 80.261 1.00 0.00 H ATOM 94 N SER A 21 41.045 46.312 82.046 1.00 57.60 N ATOM 95 CA SER A 21 41.512 46.813 83.331 1.00 55.66 C ATOM 96 C SER A 21 41.090 45.856 84.435 1.00 50.17 C ATOM 97 O SER A 21 39.934 45.424 84.481 1.00 50.13 O ATOM 98 CB SER A 21 40.961 48.215 83.603 1.00 56.00 C ATOM 99 OG SER A 21 39.546 48.209 83.647 1.00 54.53 O ATOM 100 HG SER A 21 39.242 47.604 84.369 1.00 0.00 H ATOM 101 H SER A 21 40.066 45.969 81.970 1.00 0.00 H ATOM 102 N GLU A 22 42.027 45.532 85.321 1.00 47.94 N ATOM 103 CA GLU A 22 41.794 44.613 86.426 1.00 44.26 C ATOM 104 C GLU A 22 41.900 45.369 87.742 1.00 47.13 C ATOM 105 O GLU A 22 42.879 46.087 87.973 1.00 49.93 O ATOM 106 CB GLU A 22 42.800 43.460 86.398 1.00 44.63 C ATOM 107 CG GLU A 22 42.929 42.778 85.045 1.00 46.23 C ATOM 108 H GLU A 22 42.972 45.955 85.220 1.00 0.00 H ATOM 109 N ILE A 23 40.893 45.211 88.598 1.00 46.65 N ATOM 110 CA ILE A 23 40.870 45.836 89.914 1.00 48.88 C ATOM 111 C ILE A 23 40.647 44.750 90.957 1.00 46.50 C ATOM 112 O ILE A 23 39.777 43.888 90.785 1.00 36.38 O ATOM 113 CB ILE A 23 39.782 46.922 90.019 1.00 49.93 C ATOM 114 CG1 ILE A 23 39.876 47.891 88.838 1.00 39.24 C ATOM 115 CG2 ILE A 23 39.924 47.682 91.325 1.00 40.19 C ATOM 116 CD1 ILE A 23 38.843 48.998 88.872 1.00 40.31 C ATOM 117 H ILE A 23 40.088 44.616 88.315 1.00 0.00 H ATOM 118 N PHE A 24 41.427 44.793 92.033 1.00 47.05 N ATOM 119 CA PHE A 24 41.368 43.798 93.095 1.00 46.79 C ATOM 120 C PHE A 24 40.646 44.383 94.302 1.00 45.46 C ATOM 121 O PHE A 24 40.912 45.524 94.697 1.00 46.37 O ATOM 122 CB PHE A 24 42.775 43.342 93.484 1.00 53.61 C ATOM 123 CG PHE A 24 43.627 42.928 92.314 1.00 59.65 C ATOM 124 CD1 PHE A 24 44.364 43.867 91.606 1.00 63.26 C ATOM 125 CD2 PHE A 24 43.693 41.601 91.922 1.00 61.61 C ATOM 126 CE1 PHE A 24 45.147 43.491 90.527 1.00 63.59 C ATOM 127 CE2 PHE A 24 44.476 41.218 90.847 1.00 62.56 C ATOM 128 CZ PHE A 24 45.203 42.164 90.148 1.00 63.51 C ATOM 129 H PHE A 24 42.110 45.572 92.120 1.00 0.00 H ATOM 130 N PHE A 25 39.739 43.607 94.883 1.00 46.29 N ATOM 131 CA PHE A 25 38.907 44.059 95.990 1.00 50.43 C ATOM 132 C PHE A 25 39.068 43.127 97.187 1.00 55.39 C ATOM 133 O PHE A 25 39.821 42.150 97.153 1.00 56.69 O ATOM 134 CB PHE A 25 37.438 44.142 95.566 1.00 50.05 C ATOM 135 CG PHE A 25 37.193 45.066 94.411 1.00 48.75 C ATOM 136 CD1 PHE A 25 37.085 46.432 94.610 1.00 50.48 C ATOM 137 CD2 PHE A 25 37.068 44.567 93.124 1.00 44.46 C ATOM 138 CE1 PHE A 25 36.861 47.286 93.546 1.00 49.21 C ATOM 139 CE2 PHE A 25 36.842 45.414 92.055 1.00 42.66 C ATOM 140 CZ PHE A 25 36.735 46.775 92.266 1.00 45.40 C ATOM 141 H PHE A 25 39.617 42.635 94.533 1.00 0.00 H ATOM 142 N LYS A 26 38.338 43.449 98.255 1.00 59.32 N ATOM 143 CA LYS A 26 38.371 42.660 99.484 1.00 62.33 C ATOM 144 C LYS A 26 37.070 42.915 100.233 1.00 66.31 C ATOM 145 O LYS A 26 36.844 44.029 100.715 1.00 70.61 O ATOM 146 CB LYS A 26 39.580 43.030 100.337 1.00 65.01 C ATOM 147 CG LYS A 26 39.607 42.356 101.703 1.00 69.25 C ATOM 148 H LYS A 26 37.726 44.288 98.212 1.00 0.00 H ATOM 149 N ILE A 27 36.220 41.889 100.326 1.00 67.03 N ATOM 150 CA ILE A 27 34.937 41.990 101.009 1.00 70.04 C ATOM 151 C ILE A 27 34.719 40.739 101.848 1.00 73.13 C ATOM 152 O ILE A 27 35.287 39.677 101.584 1.00 71.02 O ATOM 153 CB ILE A 27 33.755 42.174 100.027 1.00 68.81 C ATOM 154 CG1 ILE A 27 33.664 40.978 99.076 1.00 66.16 C ATOM 155 CG2 ILE A 27 33.888 43.481 99.253 1.00 67.23 C ATOM 156 CD1 ILE A 27 32.458 41.013 98.168 1.00 66.77 C ATOM 157 H ILE A 27 36.485 40.981 99.893 1.00 0.00 H ATOM 158 N LYS A 28 33.880 40.877 102.871 1.00 75.80 N ATOM 159 CA LYS A 28 33.482 39.724 103.663 1.00 79.61 C ATOM 160 C LYS A 28 32.499 38.859 102.879 1.00 76.24 C ATOM 161 O LYS A 28 31.770 39.339 102.007 1.00 66.84 O ATOM 162 CB LYS A 28 32.858 40.167 104.987 1.00 83.44 C ATOM 163 CG LYS A 28 31.701 41.136 104.836 1.00 81.27 C ATOM 164 CD LYS A 28 30.968 41.351 106.152 1.00 86.12 C ATOM 165 CE LYS A 28 31.880 41.939 107.216 1.00 86.78 C ATOM 166 NZ LYS A 28 31.147 42.196 108.488 1.00 98.51 N ATOM 167 HZ1 LYS A 28 30.373 42.868 108.311 1.00 0.00 H ATOM 168 HZ2 LYS A 28 30.756 41.302 108.848 1.00 0.00 H ATOM 169 HZ3 LYS A 28 31.802 42.597 109.189 1.00 0.00 H ATOM 170 H LYS A 28 33.505 41.818 103.107 1.00 0.00 H ATOM 171 N LYS A 29 32.483 37.565 103.203 1.00 76.41 N ATOM 172 CA LYS A 29 31.679 36.609 102.449 1.00 74.69 C ATOM 173 C LYS A 29 30.181 36.781 102.663 1.00 81.27 C ATOM 174 O LYS A 29 29.400 36.105 101.983 1.00 83.62 O ATOM 175 CB LYS A 29 32.081 35.179 102.811 1.00 76.39 C ATOM 176 CG LYS A 29 33.543 34.853 102.560 1.00 73.31 C ATOM 177 CD LYS A 29 33.793 33.360 102.695 1.00 79.28 C ATOM 178 CE LYS A 29 35.274 33.035 102.625 1.00 81.07 C ATOM 179 NZ LYS A 29 35.528 31.568 102.635 1.00 86.01 N ATOM 180 HZ1 LYS A 29 35.147 31.157 103.511 1.00 0.00 H ATOM 181 HZ2 LYS A 29 35.061 31.131 101.815 1.00 0.00 H ATOM 182 HZ3 LYS A 29 36.552 31.394 102.586 1.00 0.00 H ATOM 183 H LYS A 29 33.053 37.232 104.007 1.00 0.00 H ATOM 184 N THR A 30 29.758 37.655 103.576 1.00 85.11 N ATOM 185 CA THR A 30 28.342 37.865 103.840 1.00 88.44 C ATOM 186 C THR A 30 27.805 39.167 103.258 1.00 87.35 C ATOM 187 O THR A 30 26.595 39.403 103.330 1.00 88.63 O ATOM 188 CB THR A 30 28.068 37.836 105.349 1.00 94.48 C ATOM 189 OG1 THR A 30 28.880 38.817 106.005 1.00 94.61 O ATOM 190 CG2 THR A 30 28.381 36.460 105.919 1.00 98.49 C ATOM 191 HG1 THR A 30 28.700 38.795 106.978 1.00 0.00 H ATOM 192 H THR A 30 30.459 38.202 104.115 1.00 0.00 H ATOM 193 N THR A 31 28.666 40.014 102.690 1.00 82.72 N ATOM 194 CA THR A 31 28.187 41.232 102.059 1.00 81.75 C ATOM 195 C THR A 31 27.684 40.942 100.647 1.00 77.82 C ATOM 196 O THR A 31 28.208 40.059 99.961 1.00 74.66 O ATOM 197 CB THR A 31 29.292 42.284 101.999 1.00 77.08 C ATOM 198 OG1 THR A 31 30.566 41.639 101.872 1.00 73.94 O ATOM 199 CG2 THR A 31 29.272 43.159 103.246 1.00 80.72 C ATOM 200 HG1 THR A 31 30.715 41.049 102.653 1.00 0.00 H ATOM 201 H THR A 31 29.684 39.801 102.699 1.00 0.00 H ATOM 202 N PRO A 32 26.660 41.665 100.197 1.00 80.58 N ATOM 203 CA PRO A 32 26.170 41.472 98.829 1.00 77.27 C ATOM 204 C PRO A 32 27.226 41.856 97.805 1.00 73.55 C ATOM 205 O PRO A 32 28.007 42.791 98.001 1.00 71.67 O ATOM 206 CB PRO A 32 24.951 42.401 98.752 1.00 79.71 C ATOM 207 CG PRO A 32 24.552 42.635 100.179 1.00 85.43 C ATOM 208 CD PRO A 32 25.833 42.620 100.953 1.00 84.37 C ATOM 209 N LEU A 33 27.245 41.114 96.696 1.00 72.60 N ATOM 210 CA LEU A 33 28.209 41.381 95.637 1.00 68.98 C ATOM 211 C LEU A 33 27.896 42.652 94.862 1.00 68.71 C ATOM 212 O LEU A 33 28.741 43.101 94.080 1.00 65.48 O ATOM 213 CB LEU A 33 28.281 40.185 94.688 1.00 66.84 C ATOM 214 CG LEU A 33 29.049 39.006 95.288 1.00 66.88 C ATOM 215 CD1 LEU A 33 28.945 37.766 94.421 1.00 65.91 C ATOM 216 CD2 LEU A 33 30.504 39.394 95.498 1.00 63.95 C ATOM 217 H LEU A 33 26.564 40.336 96.586 1.00 0.00 H ATOM 218 N ARG A 34 26.712 43.237 95.060 1.00 71.31 N ATOM 219 CA ARG A 34 26.418 44.544 94.482 1.00 69.66 C ATOM 220 C ARG A 34 27.411 45.596 94.957 1.00 65.47 C ATOM 221 O ARG A 34 27.765 46.505 94.197 1.00 60.85 O ATOM 222 CB ARG A 34 24.986 44.949 94.833 1.00 75.80 C ATOM 223 CG ARG A 34 24.665 46.424 94.672 1.00 77.63 C ATOM 224 CD ARG A 34 23.165 46.632 94.747 1.00 82.37 C ATOM 225 NE ARG A 34 22.567 45.789 95.777 1.00 88.38 N ATOM 226 CZ ARG A 34 21.305 45.373 95.760 1.00 95.45 C ATOM 227 NH1 ARG A 34 20.507 45.718 94.760 1.00 97.27 N ATOM 228 NH2 ARG A 34 20.843 44.605 96.737 1.00100.55 N ATOM 229 HE ARG A 34 23.166 45.495 96.575 1.00 0.00 H ATOM 230 HH12 ARG A 34 19.519 45.392 94.747 1.00 0.00 H ATOM 231 HH11 ARG A 34 20.868 46.314 93.988 1.00 0.00 H ATOM 232 HH22 ARG A 34 19.855 44.281 96.721 1.00 0.00 H ATOM 233 HH21 ARG A 34 21.469 44.326 97.520 1.00 0.00 H ATOM 234 H ARG A 34 25.991 42.755 95.633 1.00 0.00 H ATOM 235 N ARG A 35 27.877 45.482 96.203 1.00 65.15 N ATOM 236 CA ARG A 35 28.917 46.379 96.694 1.00 64.21 C ATOM 237 C ARG A 35 30.186 46.260 95.858 1.00 57.22 C ATOM 238 O ARG A 35 30.818 47.270 95.527 1.00 53.78 O ATOM 239 CB ARG A 35 29.210 46.077 98.163 1.00 68.03 C ATOM 240 CG ARG A 35 28.442 46.938 99.156 1.00 72.47 C ATOM 241 CD ARG A 35 27.101 47.404 98.611 1.00 72.30 C ATOM 242 NE ARG A 35 26.922 48.839 98.806 1.00 73.08 N ATOM 243 CZ ARG A 35 26.340 49.381 99.870 1.00 78.51 C ATOM 244 NH1 ARG A 35 25.873 48.606 100.837 1.00 75.44 N ATOM 245 NH2 ARG A 35 26.224 50.698 99.966 1.00 79.79 N ATOM 246 HE ARG A 35 27.273 49.478 98.064 1.00 0.00 H ATOM 247 HH12 ARG A 35 25.417 49.031 101.670 1.00 0.00 H ATOM 248 HH11 ARG A 35 25.962 47.572 100.764 1.00 0.00 H ATOM 249 HH22 ARG A 35 25.768 51.120 100.800 1.00 0.00 H ATOM 250 HH21 ARG A 35 26.589 51.309 99.208 1.00 0.00 H ATOM 251 H ARG A 35 27.494 44.746 96.830 1.00 0.00 H ATOM 252 N LEU A 36 30.574 45.031 95.508 1.00 58.62 N ATOM 253 CA LEU A 36 31.723 44.845 94.630 1.00 54.94 C ATOM 254 C LEU A 36 31.375 45.184 93.185 1.00 53.10 C ATOM 255 O LEU A 36 32.257 45.577 92.411 1.00 49.90 O ATOM 256 CB LEU A 36 32.239 43.410 94.752 1.00 55.65 C ATOM 257 CG LEU A 36 33.379 42.948 93.842 1.00 55.03 C ATOM 258 CD1 LEU A 36 34.415 42.183 94.646 1.00 56.22 C ATOM 259 CD2 LEU A 36 32.826 42.082 92.724 1.00 54.79 C ATOM 260 H LEU A 36 30.054 44.203 95.863 1.00 0.00 H ATOM 261 N MET A 37 30.103 45.039 92.804 1.00 54.21 N ATOM 262 CA MET A 37 29.670 45.469 91.478 1.00 52.09 C ATOM 263 C MET A 37 29.715 46.987 91.354 1.00 51.09 C ATOM 264 O MET A 37 30.208 47.524 90.356 1.00 48.85 O ATOM 265 CB MET A 37 28.262 44.949 91.194 1.00 54.67 C ATOM 266 CG MET A 37 28.173 43.449 91.005 1.00 54.61 C ATOM 267 SD MET A 37 26.473 42.921 90.743 1.00 59.17 S ATOM 268 CE MET A 37 26.714 41.198 90.334 1.00 58.87 C ATOM 269 H MET A 37 29.414 44.616 93.458 1.00 0.00 H ATOM 270 N GLU A 38 29.194 47.695 92.359 1.00 53.17 N ATOM 271 CA GLU A 38 29.224 49.153 92.334 1.00 54.52 C ATOM 272 C GLU A 38 30.636 49.689 92.520 1.00 52.19 C ATOM 273 O GLU A 38 30.948 50.787 92.046 1.00 48.46 O ATOM 274 CB GLU A 38 28.298 49.715 93.411 1.00 59.77 C ATOM 275 CG GLU A 38 26.829 49.408 93.182 1.00 62.64 C ATOM 276 CD GLU A 38 25.951 49.877 94.324 1.00 66.26 C ATOM 277 H GLU A 38 28.763 47.202 93.167 1.00 0.00 H ATOM 278 N ALA A 39 31.498 48.936 93.205 1.00 46.74 N ATOM 279 CA ALA A 39 32.886 49.355 93.357 1.00 47.16 C ATOM 280 C ALA A 39 33.598 49.381 92.010 1.00 47.52 C ATOM 281 O ALA A 39 34.270 50.360 91.668 1.00 51.39 O ATOM 282 CB ALA A 39 33.609 48.428 94.334 1.00 45.82 C ATOM 283 H ALA A 39 31.178 48.044 93.633 1.00 0.00 H ATOM 284 N PHE A 40 33.457 48.307 91.228 1.00 45.17 N ATOM 285 CA PHE A 40 34.104 48.252 89.921 1.00 40.07 C ATOM 286 C PHE A 40 33.460 49.228 88.943 1.00 41.19 C ATOM 287 O PHE A 40 34.161 49.915 88.192 1.00 41.62 O ATOM 288 CB PHE A 40 34.052 46.825 89.370 1.00 38.95 C ATOM 289 CG PHE A 40 34.591 46.690 87.972 1.00 37.00 C ATOM 290 CD1 PHE A 40 35.948 46.517 87.750 1.00 36.43 C ATOM 291 CD2 PHE A 40 33.741 46.728 86.879 1.00 37.15 C ATOM 292 CE1 PHE A 40 36.446 46.393 86.467 1.00 36.17 C ATOM 293 CE2 PHE A 40 34.233 46.608 85.595 1.00 36.83 C ATOM 294 CZ PHE A 40 35.587 46.438 85.389 1.00 36.41 C ATOM 295 H PHE A 40 32.882 47.504 91.553 1.00 0.00 H ATOM 296 N ALA A 41 32.127 49.304 88.941 1.00 44.94 N ATOM 297 CA ALA A 41 31.435 50.150 87.974 1.00 46.15 C ATOM 298 C ALA A 41 31.762 51.623 88.185 1.00 46.13 C ATOM 299 O ALA A 41 31.885 52.383 87.217 1.00 47.35 O ATOM 300 CB ALA A 41 29.927 49.918 88.062 1.00 44.97 C ATOM 301 H ALA A 41 31.578 48.756 89.634 1.00 0.00 H ATOM 302 N LYS A 42 31.905 52.045 89.444 1.00 47.39 N ATOM 303 CA LYS A 42 32.213 53.444 89.725 1.00 50.17 C ATOM 304 C LYS A 42 33.588 53.825 89.191 1.00 51.58 C ATOM 305 O LYS A 42 33.786 54.945 88.705 1.00 54.12 O ATOM 306 CB LYS A 42 32.128 53.709 91.228 1.00 51.90 C ATOM 307 H LYS A 42 31.796 51.372 90.230 1.00 0.00 H ATOM 308 N ARG A 43 34.551 52.905 89.265 1.00 49.82 N ATOM 309 CA ARG A 43 35.896 53.184 88.779 1.00 51.56 C ATOM 310 C ARG A 43 36.015 53.084 87.264 1.00 53.62 C ATOM 311 O ARG A 43 37.068 53.432 86.719 1.00 56.96 O ATOM 312 CB ARG A 43 36.903 52.242 89.442 1.00 48.50 C ATOM 313 CG ARG A 43 37.233 52.621 90.875 1.00 49.52 C ATOM 314 CD ARG A 43 38.701 52.389 91.182 1.00 50.08 C ATOM 315 NE ARG A 43 39.096 53.028 92.434 1.00 49.57 N ATOM 316 CZ ARG A 43 40.321 52.977 92.946 1.00 50.44 C ATOM 317 NH1 ARG A 43 41.278 52.310 92.318 1.00 49.18 N ATOM 318 NH2 ARG A 43 40.587 53.592 94.091 1.00 53.01 N ATOM 319 HE ARG A 43 38.371 53.558 92.959 1.00 0.00 H ATOM 320 HH12 ARG A 43 42.236 52.272 92.721 1.00 0.00 H ATOM 321 HH11 ARG A 43 41.071 51.825 91.422 1.00 0.00 H ATOM 322 HH22 ARG A 43 41.546 53.552 94.492 1.00 0.00 H ATOM 323 HH21 ARG A 43 39.837 54.114 94.588 1.00 0.00 H ATOM 324 H ARG A 43 34.338 51.974 89.676 1.00 0.00 H ATOM 325 N GLN A 44 34.974 52.624 86.576 1.00 52.95 N ATOM 326 CA GLN A 44 34.943 52.626 85.122 1.00 53.63 C ATOM 327 C GLN A 44 34.157 53.799 84.558 1.00 57.94 C ATOM 328 O GLN A 44 34.112 53.968 83.337 1.00 59.83 O ATOM 329 CB GLN A 44 34.348 51.313 84.598 1.00 52.95 C ATOM 330 CG GLN A 44 35.024 50.061 85.125 1.00 52.49 C ATOM 331 CD GLN A 44 36.513 50.035 84.845 1.00 56.66 C ATOM 332 OE1 GLN A 44 36.964 50.444 83.775 1.00 60.36 O ATOM 333 NE2 GLN A 44 37.287 49.555 85.813 1.00 57.71 N ATOM 334 HE22 GLN A 44 36.862 49.220 86.701 1.00 0.00 H ATOM 335 HE21 GLN A 44 38.318 49.514 85.682 1.00 0.00 H ATOM 336 H GLN A 44 34.154 52.250 87.095 1.00 0.00 H ATOM 337 N GLY A 45 33.543 54.613 85.414 1.00 53.81 N ATOM 338 CA GLY A 45 32.690 55.682 84.936 1.00 59.62 C ATOM 339 C GLY A 45 31.384 55.211 84.344 1.00 62.02 C ATOM 340 O GLY A 45 30.786 55.924 83.534 1.00 66.64 O ATOM 341 H GLY A 45 33.677 54.480 86.437 1.00 0.00 H ATOM 342 N LYS A 46 30.921 54.024 84.728 1.00 60.19 N ATOM 343 CA LYS A 46 29.713 53.431 84.183 1.00 60.16 C ATOM 344 C LYS A 46 28.697 53.206 85.295 1.00 61.52 C ATOM 345 O LYS A 46 29.037 53.175 86.481 1.00 59.94 O ATOM 346 CB LYS A 46 30.017 52.098 83.484 1.00 57.71 C ATOM 347 CG LYS A 46 31.192 52.152 82.521 1.00 58.16 C ATOM 348 CD LYS A 46 31.577 50.760 82.043 1.00 56.61 C ATOM 349 CE LYS A 46 32.790 50.802 81.126 1.00 57.38 C ATOM 350 NZ LYS A 46 33.211 49.441 80.690 1.00 56.65 N ATOM 351 HZ1 LYS A 46 33.455 48.871 81.525 1.00 0.00 H ATOM 352 HZ2 LYS A 46 32.430 48.986 80.175 1.00 0.00 H ATOM 353 HZ3 LYS A 46 34.040 49.519 80.067 1.00 0.00 H ATOM 354 H LYS A 46 31.449 53.497 85.452 1.00 0.00 H ATOM 355 N GLU A 47 27.438 53.052 84.895 1.00 63.48 N ATOM 356 CA GLU A 47 26.388 52.695 85.835 1.00 64.84 C ATOM 357 C GLU A 47 26.376 51.188 86.061 1.00 62.02 C ATOM 358 O GLU A 47 26.780 50.405 85.196 1.00 61.85 O ATOM 359 CB GLU A 47 25.024 53.164 85.328 1.00 66.22 C ATOM 360 CG GLU A 47 24.612 54.537 85.835 1.00 68.04 C ATOM 361 CD GLU A 47 25.633 55.609 85.511 1.00 67.29 C ATOM 362 H GLU A 47 27.200 53.189 83.892 1.00 0.00 H ATOM 363 N MET A 48 25.907 50.787 87.244 1.00 63.36 N ATOM 364 CA MET A 48 25.931 49.373 87.605 1.00 61.58 C ATOM 365 C MET A 48 25.005 48.558 86.712 1.00 65.49 C ATOM 366 O MET A 48 25.315 47.412 86.364 1.00 65.35 O ATOM 367 CB MET A 48 25.551 49.201 89.075 1.00 62.48 C ATOM 368 CG MET A 48 25.756 47.791 89.604 1.00 61.19 C ATOM 369 H MET A 48 25.523 51.485 87.912 1.00 0.00 H ATOM 370 N ASP A 49 23.863 49.132 86.327 1.00 67.98 N ATOM 371 CA ASP A 49 22.949 48.444 85.423 1.00 69.17 C ATOM 372 C ASP A 49 23.529 48.289 84.023 1.00 68.88 C ATOM 373 O ASP A 49 23.090 47.407 83.277 1.00 73.92 O ATOM 374 CB ASP A 49 21.615 49.190 85.358 1.00 68.87 C ATOM 375 H ASP A 49 23.622 50.082 86.676 1.00 0.00 H ATOM 376 N SER A 50 24.506 49.120 83.654 1.00 66.31 N ATOM 377 CA SER A 50 25.140 49.046 82.343 1.00 63.01 C ATOM 378 C SER A 50 26.106 47.878 82.210 1.00 58.35 C ATOM 379 O SER A 50 26.671 47.691 81.126 1.00 55.87 O ATOM 380 CB SER A 50 25.875 50.355 82.045 1.00 66.17 C ATOM 381 OG SER A 50 26.695 50.227 80.897 1.00 70.84 O ATOM 382 HG SER A 50 27.365 49.514 81.049 1.00 0.00 H ATOM 383 H SER A 50 24.827 49.846 84.326 1.00 0.00 H ATOM 384 N LEU A 51 26.311 47.094 83.266 1.00 53.41 N ATOM 385 CA LEU A 51 27.260 45.992 83.252 1.00 48.83 C ATOM 386 C LEU A 51 26.596 44.727 83.775 1.00 48.53 C ATOM 387 O LEU A 51 25.571 44.772 84.461 1.00 52.85 O ATOM 388 CB LEU A 51 28.502 46.308 84.098 1.00 44.60 C ATOM 389 CG LEU A 51 29.358 47.507 83.686 1.00 42.12 C ATOM 390 CD1 LEU A 51 30.318 47.880 84.805 1.00 41.33 C ATOM 391 CD2 LEU A 51 30.119 47.201 82.408 1.00 39.09 C ATOM 392 H LEU A 51 25.771 47.277 84.136 1.00 0.00 H ATOM 393 N ARG A 52 27.198 43.590 83.434 1.00 44.65 N ATOM 394 CA ARG A 52 26.834 42.305 84.011 1.00 44.11 C ATOM 395 C ARG A 52 28.116 41.558 84.344 1.00 43.07 C ATOM 396 O ARG A 52 29.143 41.732 83.683 1.00 44.49 O ATOM 397 CB ARG A 52 25.945 41.480 83.067 1.00 45.55 C ATOM 398 CG ARG A 52 26.693 40.699 82.002 1.00 45.90 C ATOM 399 CD ARG A 52 25.728 39.998 81.063 1.00 49.19 C ATOM 400 NE ARG A 52 26.385 38.961 80.275 1.00 51.06 N ATOM 401 CZ ARG A 52 27.045 39.185 79.143 1.00 52.11 C ATOM 402 NH1 ARG A 52 27.144 40.416 78.663 1.00 52.64 N ATOM 403 NH2 ARG A 52 27.610 38.177 78.493 1.00 52.42 N ATOM 404 HE ARG A 52 26.334 37.982 80.622 1.00 0.00 H ATOM 405 HH12 ARG A 52 27.661 40.589 77.777 1.00 0.00 H ATOM 406 HH11 ARG A 52 26.705 41.209 79.172 1.00 0.00 H ATOM 407 HH22 ARG A 52 28.126 38.353 77.607 1.00 0.00 H ATOM 408 HH21 ARG A 52 27.537 37.210 78.869 1.00 0.00 H ATOM 409 H ARG A 52 27.959 43.621 82.726 1.00 0.00 H ATOM 410 N PHE A 53 28.055 40.733 85.384 1.00 42.40 N ATOM 411 CA PHE A 53 29.240 40.098 85.945 1.00 41.65 C ATOM 412 C PHE A 53 29.079 38.587 85.911 1.00 45.49 C ATOM 413 O PHE A 53 28.025 38.061 86.282 1.00 49.43 O ATOM 414 CB PHE A 53 29.488 40.589 87.373 1.00 41.61 C ATOM 415 CG PHE A 53 29.659 42.079 87.476 1.00 40.43 C ATOM 416 CD1 PHE A 53 28.554 42.914 87.545 1.00 42.07 C ATOM 417 CD2 PHE A 53 30.924 42.645 87.497 1.00 41.70 C ATOM 418 CE1 PHE A 53 28.709 44.286 87.636 1.00 45.56 C ATOM 419 CE2 PHE A 53 31.086 44.018 87.590 1.00 43.78 C ATOM 420 CZ PHE A 53 29.976 44.839 87.660 1.00 45.71 C ATOM 421 H PHE A 53 27.129 40.534 85.813 1.00 0.00 H ATOM 422 N LEU A 54 30.127 37.896 85.467 1.00 45.20 N ATOM 423 CA LEU A 54 30.110 36.450 85.306 1.00 46.19 C ATOM 424 C LEU A 54 31.143 35.814 86.226 1.00 46.15 C ATOM 425 O LEU A 54 32.235 36.357 86.420 1.00 43.52 O ATOM 426 CB LEU A 54 30.395 36.052 83.853 1.00 46.05 C ATOM 427 CG LEU A 54 29.605 36.780 82.763 1.00 44.17 C ATOM 428 CD1 LEU A 54 30.018 36.281 81.387 1.00 43.53 C ATOM 429 CD2 LEU A 54 28.106 36.617 82.969 1.00 45.58 C ATOM 430 H LEU A 54 30.996 38.413 85.225 1.00 0.00 H ATOM 431 N TYR A 55 30.785 34.663 86.792 1.00 47.00 N ATOM 432 CA TYR A 55 31.701 33.862 87.601 1.00 46.81 C ATOM 433 C TYR A 55 31.523 32.408 87.187 1.00 46.66 C ATOM 434 O TYR A 55 30.454 31.828 87.405 1.00 47.83 O ATOM 435 CB TYR A 55 31.438 34.050 89.096 1.00 48.16 C ATOM 436 CG TYR A 55 32.336 33.224 89.988 1.00 45.34 C ATOM 437 CD1 TYR A 55 33.717 33.353 89.925 1.00 48.12 C ATOM 438 CD2 TYR A 55 31.804 32.325 90.902 1.00 48.86 C ATOM 439 CE1 TYR A 55 34.543 32.602 90.741 1.00 51.28 C ATOM 440 CE2 TYR A 55 32.621 31.570 91.722 1.00 51.47 C ATOM 441 CZ TYR A 55 33.989 31.713 91.638 1.00 50.52 C ATOM 442 OH TYR A 55 34.808 30.965 92.453 1.00 53.64 O ATOM 443 HH TYR A 55 35.754 31.190 92.264 1.00 0.00 H ATOM 444 H TYR A 55 29.813 34.320 86.652 1.00 0.00 H ATOM 445 N ASP A 56 32.566 31.829 86.588 1.00 46.56 N ATOM 446 CA ASP A 56 32.493 30.495 85.987 1.00 50.64 C ATOM 447 C ASP A 56 31.360 30.419 84.965 1.00 53.17 C ATOM 448 O ASP A 56 30.667 29.407 84.845 1.00 54.96 O ATOM 449 CB ASP A 56 32.344 29.408 87.054 1.00 54.22 C ATOM 450 CG ASP A 56 33.623 29.177 87.835 1.00 56.90 C ATOM 451 OD1 ASP A 56 34.700 29.590 87.355 1.00 57.00 O ATOM 452 OD2 ASP A 56 33.553 28.574 88.927 1.00 59.60 O ATOM 453 H ASP A 56 33.467 32.346 86.546 1.00 0.00 H ATOM 454 N GLY A 57 31.173 31.507 84.220 1.00 53.22 N ATOM 455 CA GLY A 57 30.121 31.584 83.231 1.00 53.69 C ATOM 456 C GLY A 57 28.732 31.815 83.779 1.00 56.34 C ATOM 457 O GLY A 57 27.763 31.747 83.014 1.00 57.59 O ATOM 458 H GLY A 57 31.802 32.325 84.353 1.00 0.00 H ATOM 459 N ILE A 58 28.598 32.091 85.073 1.00 58.72 N ATOM 460 CA ILE A 58 27.302 32.285 85.714 1.00 62.63 C ATOM 461 C ILE A 58 27.119 33.773 85.982 1.00 61.85 C ATOM 462 O ILE A 58 27.964 34.402 86.632 1.00 60.88 O ATOM 463 CB ILE A 58 27.186 31.471 87.010 1.00 67.21 C ATOM 464 CG1 ILE A 58 27.485 29.995 86.741 1.00 71.07 C ATOM 465 CG2 ILE A 58 25.805 31.640 87.625 1.00 69.17 C ATOM 466 CD1 ILE A 58 26.635 29.384 85.648 1.00 73.65 C ATOM 467 H ILE A 58 29.456 32.172 85.655 1.00 0.00 H ATOM 468 N ARG A 59 26.017 34.333 85.488 1.00 62.24 N ATOM 469 CA ARG A 59 25.733 35.747 85.693 1.00 60.51 C ATOM 470 C ARG A 59 25.389 35.995 87.157 1.00 60.25 C ATOM 471 O ARG A 59 24.390 35.473 87.665 1.00 62.90 O ATOM 472 CB ARG A 59 24.589 36.197 84.789 1.00 63.29 C ATOM 473 CG ARG A 59 24.435 37.707 84.699 1.00 64.64 C ATOM 474 CD ARG A 59 23.240 38.102 83.844 1.00 68.55 C ATOM 475 NE ARG A 59 21.995 38.118 84.606 1.00 73.47 N ATOM 476 CZ ARG A 59 21.544 39.177 85.272 1.00 75.06 C ATOM 477 NH1 ARG A 59 20.400 39.108 85.938 1.00 78.20 N ATOM 478 NH2 ARG A 59 22.238 40.307 85.272 1.00 73.19 N ATOM 479 HE ARG A 59 21.426 37.248 84.629 1.00 0.00 H ATOM 480 HH12 ARG A 59 20.050 39.938 86.458 1.00 0.00 H ATOM 481 HH11 ARG A 59 19.852 38.224 85.941 1.00 0.00 H ATOM 482 HH22 ARG A 59 21.884 41.135 85.793 1.00 0.00 H ATOM 483 HH21 ARG A 59 23.136 40.366 84.751 1.00 0.00 H ATOM 484 H ARG A 59 25.347 33.751 84.946 1.00 0.00 H ATOM 485 N ILE A 60 26.214 36.786 87.834 1.00 58.78 N ATOM 486 CA ILE A 60 26.020 37.054 89.253 1.00 60.43 C ATOM 487 C ILE A 60 24.879 38.046 89.425 1.00 63.99 C ATOM 488 O ILE A 60 24.810 39.061 88.721 1.00 64.56 O ATOM 489 CB ILE A 60 27.312 37.589 89.888 1.00 56.64 C ATOM 490 CG1 ILE A 60 28.488 36.655 89.602 1.00 54.09 C ATOM 491 CG2 ILE A 60 27.128 37.760 91.383 1.00 58.82 C ATOM 492 CD1 ILE A 60 29.798 37.133 90.195 1.00 51.51 C ATOM 493 H ILE A 60 27.017 37.224 87.340 1.00 0.00 H ATOM 494 N GLU A 61 23.978 37.755 90.358 1.00 66.24 N ATOM 495 CA GLU A 61 22.953 38.705 90.757 1.00 66.54 C ATOM 496 C GLU A 61 23.454 39.553 91.923 1.00 62.28 C ATOM 497 O GLU A 61 24.376 39.174 92.649 1.00 61.19 O ATOM 498 CB GLU A 61 21.656 37.990 91.140 1.00 75.04 C ATOM 499 CG GLU A 61 20.616 37.937 90.025 1.00 80.70 C ATOM 500 CD GLU A 61 20.969 36.947 88.930 1.00 83.70 C ATOM 501 OE1 GLU A 61 21.771 36.027 89.193 1.00 84.32 O ATOM 502 OE2 GLU A 61 20.442 37.089 87.807 1.00 85.07 O ATOM 503 H GLU A 61 24.007 36.821 90.815 1.00 0.00 H ATOM 504 N ALA A 62 22.824 40.717 92.095 1.00 60.64 N ATOM 505 CA ALA A 62 23.298 41.681 93.083 1.00 59.69 C ATOM 506 C ALA A 62 23.146 41.153 94.505 1.00 60.80 C ATOM 507 O ALA A 62 24.042 41.334 95.338 1.00 61.38 O ATOM 508 CB ALA A 62 22.553 43.004 92.921 1.00 60.02 C ATOM 509 H ALA A 62 21.987 40.939 91.519 1.00 0.00 H ATOM 510 N ASP A 63 22.021 40.500 94.803 1.00 63.06 N ATOM 511 CA ASP A 63 21.744 40.059 96.165 1.00 64.65 C ATOM 512 C ASP A 63 22.614 38.889 96.608 1.00 63.71 C ATOM 513 O ASP A 63 22.636 38.579 97.804 1.00 66.05 O ATOM 514 CB ASP A 63 20.267 39.680 96.301 1.00 68.61 C ATOM 515 H ASP A 63 21.330 40.302 94.051 1.00 0.00 H ATOM 516 N GLN A 64 23.326 38.240 95.691 1.00 61.41 N ATOM 517 CA GLN A 64 24.149 37.096 96.053 1.00 61.71 C ATOM 518 C GLN A 64 25.432 37.551 96.739 1.00 60.71 C ATOM 519 O GLN A 64 25.916 38.667 96.529 1.00 55.69 O ATOM 520 CB GLN A 64 24.484 36.257 94.819 1.00 61.07 C ATOM 521 CG GLN A 64 23.269 35.658 94.127 1.00 64.42 C ATOM 522 CD GLN A 64 23.645 34.741 92.979 1.00 64.50 C ATOM 523 OE1 GLN A 64 23.268 34.976 91.831 1.00 64.05 O ATOM 524 NE2 GLN A 64 24.388 33.684 93.287 1.00 65.57 N ATOM 525 HE22 GLN A 64 24.684 33.525 94.271 1.00 0.00 H ATOM 526 HE21 GLN A 64 24.674 33.015 92.544 1.00 0.00 H ATOM 527 H GLN A 64 23.294 38.555 94.700 1.00 0.00 H ATOM 528 N THR A 65 25.979 36.670 97.566 1.00 55.98 N ATOM 529 CA THR A 65 27.163 36.929 98.367 1.00 57.81 C ATOM 530 C THR A 65 28.273 35.955 97.993 1.00 60.57 C ATOM 531 O THR A 65 28.021 34.933 97.344 1.00 47.71 O ATOM 532 CB THR A 65 26.846 36.798 99.865 1.00 53.72 C ATOM 533 OG1 THR A 65 26.497 35.441 100.165 1.00 52.04 O ATOM 534 CG2 THR A 65 25.691 37.711 100.250 1.00 51.10 C ATOM 535 HG1 THR A 65 25.702 35.181 99.636 1.00 0.00 H ATOM 536 H THR A 65 25.532 35.734 97.646 1.00 0.00 H ATOM 537 N PRO A 66 29.522 36.250 98.373 1.00 58.97 N ATOM 538 CA PRO A 66 30.594 35.261 98.169 1.00 58.65 C ATOM 539 C PRO A 66 30.322 33.925 98.834 1.00 64.11 C ATOM 540 O PRO A 66 30.840 32.900 98.374 1.00 65.42 O ATOM 541 CB PRO A 66 31.822 35.955 98.774 1.00 54.55 C ATOM 542 CG PRO A 66 31.542 37.404 98.603 1.00 51.44 C ATOM 543 CD PRO A 66 30.056 37.560 98.791 1.00 53.57 C ATOM 544 N GLU A 67 29.527 33.903 99.908 1.00 67.72 N ATOM 545 CA GLU A 67 29.159 32.641 100.538 1.00 69.55 C ATOM 546 C GLU A 67 28.051 31.927 99.777 1.00 69.50 C ATOM 547 O GLU A 67 27.970 30.694 99.824 1.00 72.13 O ATOM 548 CB GLU A 67 28.730 32.878 101.987 1.00 72.58 C ATOM 549 H GLU A 67 29.167 34.797 100.299 1.00 0.00 H ATOM 550 N ASP A 68 27.192 32.675 99.079 1.00 68.56 N ATOM 551 CA ASP A 68 26.157 32.048 98.262 1.00 69.59 C ATOM 552 C ASP A 68 26.776 31.209 97.153 1.00 68.44 C ATOM 553 O ASP A 68 26.359 30.071 96.910 1.00 66.70 O ATOM 554 CB ASP A 68 25.225 33.113 97.688 1.00 69.58 C ATOM 555 CG ASP A 68 24.214 33.603 98.703 1.00 71.50 C ATOM 556 OD1 ASP A 68 24.363 33.264 99.895 1.00 74.35 O ATOM 557 OD2 ASP A 68 23.274 34.326 98.312 1.00 70.46 O ATOM 558 H ASP A 68 27.261 33.712 99.118 1.00 0.00 H ATOM 559 N LEU A 69 27.771 31.760 96.465 1.00 66.31 N ATOM 560 CA LEU A 69 28.613 30.964 95.590 1.00 66.24 C ATOM 561 C LEU A 69 29.719 30.310 96.416 1.00 70.33 C ATOM 562 O LEU A 69 29.791 30.462 97.639 1.00 76.32 O ATOM 563 CB LEU A 69 29.183 31.827 94.467 1.00 57.39 C ATOM 564 H LEU A 69 27.950 32.781 96.555 1.00 0.00 H ATOM 565 N ASP A 70 30.594 29.564 95.749 1.00 72.34 N ATOM 566 CA ASP A 70 31.715 28.910 96.420 1.00 75.42 C ATOM 567 C ASP A 70 33.024 29.644 96.164 1.00 75.92 C ATOM 568 O ASP A 70 34.062 29.020 95.925 1.00 77.35 O ATOM 569 CB ASP A 70 31.818 27.452 95.983 1.00 81.95 C ATOM 570 CG ASP A 70 32.183 26.529 97.127 1.00 90.78 C ATOM 571 OD1 ASP A 70 31.653 26.730 98.240 1.00 91.87 O ATOM 572 OD2 ASP A 70 33.001 25.609 96.919 1.00 97.33 O ATOM 573 H ASP A 70 30.478 29.443 94.723 1.00 0.00 H ATOM 574 N MET A 71 33.000 30.973 96.218 1.00 71.88 N ATOM 575 CA MET A 71 34.160 31.763 95.831 1.00 68.29 C ATOM 576 C MET A 71 35.290 31.616 96.842 1.00 68.36 C ATOM 577 O MET A 71 35.072 31.647 98.056 1.00 68.91 O ATOM 578 CB MET A 71 33.776 33.235 95.683 1.00 61.99 C ATOM 579 CG MET A 71 32.699 33.476 94.642 1.00 58.47 C ATOM 580 SD MET A 71 32.808 35.086 93.835 1.00 53.97 S ATOM 581 CE MET A 71 32.174 36.161 95.117 1.00 52.05 C ATOM 582 H MET A 71 32.138 31.456 96.542 1.00 0.00 H ATOM 583 N GLU A 72 36.504 31.450 96.327 1.00 70.41 N ATOM 584 CA GLU A 72 37.722 31.403 97.121 1.00 73.18 C ATOM 585 C GLU A 72 38.516 32.685 96.891 1.00 73.57 C ATOM 586 O GLU A 72 38.076 33.601 96.191 1.00 73.25 O ATOM 587 CB GLU A 72 38.551 30.166 96.767 1.00 76.92 C ATOM 588 CG GLU A 72 37.760 28.866 96.721 1.00 81.18 C ATOM 589 CD GLU A 72 37.327 28.386 98.094 1.00 85.74 C ATOM 590 OE1 GLU A 72 37.839 28.913 99.105 1.00 87.26 O ATOM 591 OE2 GLU A 72 36.475 27.475 98.161 1.00 88.14 O ATOM 592 H GLU A 72 36.588 31.348 95.295 1.00 0.00 H ATOM 593 N ASP A 73 39.702 32.746 97.489 1.00 74.18 N ATOM 594 CA ASP A 73 40.567 33.900 97.297 1.00 71.89 C ATOM 595 C ASP A 73 41.136 33.916 95.882 1.00 70.39 C ATOM 596 O ASP A 73 41.376 32.870 95.272 1.00 73.47 O ATOM 597 CB ASP A 73 41.702 33.898 98.322 1.00 75.19 C ATOM 598 CG ASP A 73 41.483 34.904 99.435 1.00 77.36 C ATOM 599 OD1 ASP A 73 40.959 36.000 99.149 1.00 76.59 O ATOM 600 OD2 ASP A 73 41.833 34.601 100.595 1.00 80.63 O ATOM 601 H ASP A 73 40.014 31.963 98.098 1.00 0.00 H ATOM 602 N ASN A 74 41.329 35.126 95.357 1.00 66.01 N ATOM 603 CA ASN A 74 41.925 35.404 94.051 1.00 64.24 C ATOM 604 C ASN A 74 41.075 34.934 92.878 1.00 61.72 C ATOM 605 O ASN A 74 41.562 34.923 91.740 1.00 62.76 O ATOM 606 CB ASN A 74 43.329 34.799 93.925 1.00 67.91 C ATOM 607 CG ASN A 74 44.338 35.477 94.830 1.00 71.10 C ATOM 608 OD1 ASN A 74 43.980 36.290 95.682 1.00 71.59 O ATOM 609 ND2 ASN A 74 45.610 35.143 94.650 1.00 73.62 N ATOM 610 HD22 ASN A 74 45.867 34.451 93.918 1.00 0.00 H ATOM 611 HD21 ASN A 74 46.349 35.573 95.241 1.00 0.00 H ATOM 612 H ASN A 74 41.030 35.944 95.926 1.00 0.00 H ATOM 613 N ASP A 75 39.823 34.546 93.109 1.00 57.17 N ATOM 614 CA ASP A 75 38.947 34.195 92.000 1.00 53.43 C ATOM 615 C ASP A 75 38.627 35.430 91.166 1.00 48.97 C ATOM 616 O ASP A 75 38.567 36.553 91.674 1.00 47.41 O ATOM 617 CB ASP A 75 37.657 33.554 92.511 1.00 53.65 C ATOM 618 CG ASP A 75 37.867 32.136 93.003 1.00 57.20 C ATOM 619 OD1 ASP A 75 38.942 31.565 92.723 1.00 59.07 O ATOM 620 OD2 ASP A 75 36.957 31.589 93.659 1.00 58.32 O ATOM 621 H ASP A 75 39.469 34.493 94.085 1.00 0.00 H ATOM 622 N ILE A 76 38.419 35.213 89.870 1.00 47.11 N ATOM 623 CA ILE A 76 38.229 36.290 88.906 1.00 44.89 C ATOM 624 C ILE A 76 36.755 36.370 88.537 1.00 45.66 C ATOM 625 O ILE A 76 36.129 35.351 88.220 1.00 47.85 O ATOM 626 CB ILE A 76 39.100 36.083 87.655 1.00 44.15 C ATOM 627 CG1 ILE A 76 40.575 35.970 88.049 1.00 45.55 C ATOM 628 CG2 ILE A 76 38.897 37.220 86.667 1.00 42.02 C ATOM 629 CD1 ILE A 76 41.514 35.827 86.871 1.00 46.18 C ATOM 630 H ILE A 76 38.391 34.231 89.529 1.00 0.00 H ATOM 631 N ILE A 77 36.206 37.580 88.580 1.00 43.28 N ATOM 632 CA ILE A 77 34.837 37.859 88.167 1.00 41.23 C ATOM 633 C ILE A 77 34.910 38.656 86.873 1.00 44.56 C ATOM 634 O ILE A 77 35.382 39.799 86.863 1.00 48.56 O ATOM 635 CB ILE A 77 34.060 38.625 89.246 1.00 39.78 C ATOM 636 CG1 ILE A 77 33.941 37.784 90.519 1.00 40.76 C ATOM 637 CG2 ILE A 77 32.686 39.025 88.734 1.00 38.16 C ATOM 638 CD1 ILE A 77 33.363 38.542 91.693 1.00 38.17 C ATOM 639 H ILE A 77 36.785 38.371 88.927 1.00 0.00 H ATOM 640 N GLU A 78 34.451 38.057 85.778 1.00 43.84 N ATOM 641 CA GLU A 78 34.463 38.731 84.487 1.00 42.84 C ATOM 642 C GLU A 78 33.374 39.794 84.436 1.00 42.14 C ATOM 643 O GLU A 78 32.218 39.532 84.782 1.00 43.05 O ATOM 644 CB GLU A 78 34.275 37.726 83.352 1.00 43.75 C ATOM 645 CG GLU A 78 35.486 36.843 83.102 1.00 48.86 C ATOM 646 CD GLU A 78 35.428 36.141 81.761 1.00 53.06 C ATOM 647 OE1 GLU A 78 34.495 36.423 80.979 1.00 54.37 O ATOM 648 OE2 GLU A 78 36.318 35.308 81.488 1.00 55.46 O ATOM 649 H GLU A 78 34.076 37.089 85.845 1.00 0.00 H ATOM 650 N ALA A 79 33.746 40.992 83.997 1.00 43.45 N ATOM 651 CA ALA A 79 32.824 42.111 83.861 1.00 42.92 C ATOM 652 C ALA A 79 32.552 42.349 82.382 1.00 42.42 C ATOM 653 O ALA A 79 33.481 42.610 81.610 1.00 42.04 O ATOM 654 CB ALA A 79 33.392 43.370 84.515 1.00 43.83 C ATOM 655 H ALA A 79 34.743 41.137 83.738 1.00 0.00 H ATOM 656 N HIS A 80 31.285 42.253 81.992 1.00 41.21 N ATOM 657 CA HIS A 80 30.868 42.495 80.621 1.00 40.59 C ATOM 658 C HIS A 80 29.690 43.458 80.621 1.00 38.46 C ATOM 659 O HIS A 80 29.046 43.681 81.649 1.00 37.62 O ATOM 660 CB HIS A 80 30.481 41.192 79.905 1.00 43.11 C ATOM 661 CG HIS A 80 31.600 40.203 79.802 1.00 46.68 C ATOM 662 ND1 HIS A 80 32.507 40.211 78.764 1.00 48.50 N ATOM 663 CD2 HIS A 80 31.960 39.175 80.607 1.00 48.51 C ATOM 664 CE1 HIS A 80 33.377 39.231 78.934 1.00 49.74 C ATOM 665 NE2 HIS A 80 33.067 38.588 80.045 1.00 49.30 N ATOM 666 H HIS A 80 30.564 41.995 82.695 1.00 0.00 H ATOM 667 N ARG A 81 29.416 44.033 79.454 1.00 40.81 N ATOM 668 CA ARG A 81 28.256 44.898 79.317 1.00 40.99 C ATOM 669 C ARG A 81 26.974 44.085 79.458 1.00 41.15 C ATOM 670 O ARG A 81 26.946 42.876 79.214 1.00 42.17 O ATOM 671 CB ARG A 81 28.276 45.620 77.971 1.00 42.06 C ATOM 672 CG ARG A 81 27.896 44.744 76.793 1.00 45.08 C ATOM 673 CD ARG A 81 27.923 45.526 75.495 1.00 48.05 C ATOM 674 NE ARG A 81 27.416 44.737 74.377 1.00 48.24 N ATOM 675 CZ ARG A 81 28.141 43.853 73.698 1.00 47.55 C ATOM 676 NH1 ARG A 81 29.407 43.639 74.027 1.00 46.92 N ATOM 677 NH2 ARG A 81 27.599 43.180 72.692 1.00 47.04 N ATOM 678 HE ARG A 81 26.425 44.875 74.093 1.00 0.00 H ATOM 679 HH12 ARG A 81 29.973 42.947 73.495 1.00 0.00 H ATOM 680 HH11 ARG A 81 29.835 44.163 74.817 1.00 0.00 H ATOM 681 HH22 ARG A 81 28.168 42.489 72.162 1.00 0.00 H ATOM 682 HH21 ARG A 81 26.605 43.343 72.433 1.00 0.00 H ATOM 683 H ARG A 81 30.035 43.863 78.635 1.00 0.00 H ATOM 684 N SER A 82 25.907 44.762 79.867 1.00 39.81 N ATOM 685 CA SER A 82 24.639 44.083 80.085 1.00 37.86 C ATOM 686 C SER A 82 24.020 43.648 78.762 1.00 40.13 C ATOM 687 O SER A 82 24.158 44.313 77.731 1.00 42.74 O ATOM 688 CB SER A 82 23.672 44.989 80.846 1.00 37.00 C ATOM 689 OG SER A 82 23.496 46.225 80.175 1.00 38.08 O ATOM 690 HG SER A 82 23.130 46.059 79.270 1.00 0.00 H ATOM 691 H SER A 82 25.979 45.786 80.033 1.00 0.00 H ATOM 692 N LEU A 83 23.341 42.511 78.802 1.00 39.02 N ATOM 693 CA LEU A 83 22.598 41.964 77.679 1.00 37.10 C ATOM 694 C LEU A 83 21.284 41.416 78.211 1.00 38.51 C ATOM 695 O LEU A 83 21.168 41.129 79.408 1.00 37.76 O ATOM 696 CB LEU A 83 23.391 40.866 76.956 1.00 35.92 C ATOM 697 CG LEU A 83 24.540 41.349 76.065 1.00 35.50 C ATOM 698 CD1 LEU A 83 25.254 40.179 75.402 1.00 35.16 C ATOM 699 CD2 LEU A 83 24.029 42.330 75.019 1.00 35.36 C ATOM 700 H LEU A 83 23.340 41.976 79.694 1.00 0.00 H ATOM 701 N PRO A 84 20.268 41.279 77.354 1.00 38.67 N ATOM 702 CA PRO A 84 18.967 40.789 77.825 1.00 35.86 C ATOM 703 C PRO A 84 19.080 39.441 78.523 1.00 45.30 C ATOM 704 O PRO A 84 19.983 38.642 78.262 1.00 44.41 O ATOM 705 CB PRO A 84 18.142 40.683 76.538 1.00 40.56 C ATOM 706 CG PRO A 84 18.741 41.703 75.640 1.00 39.38 C ATOM 707 CD PRO A 84 20.216 41.699 75.942 1.00 33.99 C ATOM 708 N ALA A 85 18.129 39.196 79.429 1.00 47.21 N ATOM 709 CA ALA A 85 18.192 38.029 80.303 1.00 47.10 C ATOM 710 C ALA A 85 17.866 36.740 79.558 1.00 49.16 C ATOM 711 O ALA A 85 18.622 35.767 79.632 1.00 50.92 O ATOM 712 CB ALA A 85 17.243 38.215 81.489 1.00 48.46 C ATOM 713 H ALA A 85 17.326 39.852 79.513 1.00 0.00 H ATOM 714 N GLU A 86 16.747 36.711 78.843 1.00 50.40 N ATOM 715 CA GLU A 86 16.281 35.493 78.184 1.00 52.57 C ATOM 716 C GLU A 86 16.909 35.413 76.798 1.00 49.36 C ATOM 717 O GLU A 86 16.468 36.084 75.862 1.00 49.46 O ATOM 718 CB GLU A 86 14.759 35.469 78.111 1.00 57.74 C ATOM 719 CG GLU A 86 14.082 35.705 79.451 1.00 62.52 C ATOM 720 CD GLU A 86 12.594 35.420 79.412 1.00 68.23 C ATOM 721 OE1 GLU A 86 12.163 34.607 78.567 1.00 70.39 O ATOM 722 OE2 GLU A 86 11.856 36.009 80.230 1.00 72.17 O ATOM 723 H GLU A 86 16.186 37.581 78.749 1.00 0.00 H ATOM 724 N ARG A 87 17.939 34.586 76.666 1.00 42.84 N ATOM 725 CA ARG A 87 18.563 34.343 75.376 1.00 41.32 C ATOM 726 C ARG A 87 17.845 33.207 74.659 1.00 46.21 C ATOM 727 O ARG A 87 17.276 32.311 75.289 1.00 51.16 O ATOM 728 CB ARG A 87 20.047 34.010 75.543 1.00 37.50 C ATOM 729 CG ARG A 87 20.840 34.000 74.240 1.00 36.14 C ATOM 730 CD ARG A 87 22.319 33.763 74.494 1.00 36.88 C ATOM 731 NE ARG A 87 22.585 32.414 74.984 1.00 39.49 N ATOM 732 CZ ARG A 87 23.719 32.044 75.571 1.00 40.56 C ATOM 733 NH1 ARG A 87 24.691 32.928 75.752 1.00 43.02 N ATOM 734 NH2 ARG A 87 23.878 30.795 75.987 1.00 39.26 N ATOM 735 HE ARG A 87 21.841 31.697 74.867 1.00 0.00 H ATOM 736 HH12 ARG A 87 25.578 32.639 76.211 1.00 0.00 H ATOM 737 HH11 ARG A 87 24.566 33.911 75.435 1.00 0.00 H ATOM 738 HH22 ARG A 87 24.766 30.509 76.446 1.00 0.00 H ATOM 739 HH21 ARG A 87 23.114 30.102 75.854 1.00 0.00 H ATOM 740 H ARG A 87 18.309 34.099 77.507 1.00 0.00 H ATOM 741 N ASN A 88 17.869 33.263 73.332 1.00 45.11 N ATOM 742 CA ASN A 88 17.260 32.232 72.503 1.00 42.85 C ATOM 743 C ASN A 88 17.832 30.867 72.872 1.00 43.07 C ATOM 744 O ASN A 88 19.059 30.691 72.835 1.00 43.59 O ATOM 745 CB ASN A 88 17.511 32.537 71.027 1.00 40.53 C ATOM 746 CG ASN A 88 16.610 31.742 70.098 1.00 43.37 C ATOM 747 OD1 ASN A 88 16.292 30.581 70.356 1.00 47.53 O ATOM 748 ND2 ASN A 88 16.197 32.370 69.004 1.00 41.29 N ATOM 749 HD22 ASN A 88 16.490 33.352 68.826 1.00 0.00 H ATOM 750 HD21 ASN A 88 15.580 31.880 68.325 1.00 0.00 H ATOM 751 H ASN A 88 18.338 34.069 72.870 1.00 0.00 H ATOM 752 N PRO A 89 16.998 29.890 73.242 1.00 42.81 N ATOM 753 CA PRO A 89 17.531 28.561 73.591 1.00 43.75 C ATOM 754 C PRO A 89 18.290 27.897 72.457 1.00 45.33 C ATOM 755 O PRO A 89 19.029 26.936 72.704 1.00 47.98 O ATOM 756 CB PRO A 89 16.273 27.762 73.962 1.00 44.78 C ATOM 757 CG PRO A 89 15.245 28.793 74.307 1.00 45.07 C ATOM 758 CD PRO A 89 15.538 29.968 73.422 1.00 42.67 C ATOM 759 N LEU A 90 18.131 28.380 71.222 1.00 43.64 N ATOM 760 CA LEU A 90 18.888 27.836 70.100 1.00 42.57 C ATOM 761 C LEU A 90 20.384 28.068 70.264 1.00 45.04 C ATOM 762 O LEU A 90 21.194 27.316 69.708 1.00 46.18 O ATOM 763 CB LEU A 90 18.388 28.461 68.795 1.00 38.31 C ATOM 764 CG LEU A 90 19.054 28.068 67.474 1.00 37.00 C ATOM 765 CD1 LEU A 90 18.956 26.569 67.246 1.00 37.49 C ATOM 766 CD2 LEU A 90 18.431 28.832 66.313 1.00 36.78 C ATOM 767 H LEU A 90 17.458 29.155 71.058 1.00 0.00 H ATOM 768 N TYR A 91 20.771 29.090 71.029 1.00 44.67 N ATOM 769 CA TYR A 91 22.168 29.477 71.184 1.00 41.93 C ATOM 770 C TYR A 91 22.708 29.160 72.576 1.00 44.14 C ATOM 771 O TYR A 91 23.586 29.864 73.080 1.00 41.49 O ATOM 772 CB TYR A 91 22.339 30.962 70.872 1.00 35.97 C ATOM 773 CG TYR A 91 21.740 31.375 69.549 1.00 34.55 C ATOM 774 CD1 TYR A 91 22.206 30.839 68.356 1.00 34.52 C ATOM 775 CD2 TYR A 91 20.711 32.306 69.490 1.00 34.97 C ATOM 776 CE1 TYR A 91 21.662 31.214 67.144 1.00 34.63 C ATOM 777 CE2 TYR A 91 20.162 32.689 68.282 1.00 36.16 C ATOM 778 CZ TYR A 91 20.641 32.139 67.111 1.00 36.59 C ATOM 779 OH TYR A 91 20.098 32.513 65.903 1.00 38.41 O ATOM 780 HH TYR A 91 20.217 33.488 65.777 1.00 0.00 H ATOM 781 H TYR A 91 20.045 29.634 71.537 1.00 0.00 H ATOM 782 N LYS A 92 22.200 28.104 73.208 1.00 52.61 N ATOM 783 CA LYS A 92 22.723 27.686 74.502 1.00 56.62 C ATOM 784 C LYS A 92 24.046 26.940 74.388 1.00 61.51 C ATOM 785 O LYS A 92 24.560 26.463 75.405 1.00 65.56 O ATOM 786 CB LYS A 92 21.697 26.816 75.235 1.00 60.85 C ATOM 787 CG LYS A 92 21.534 25.412 74.674 1.00 64.29 C ATOM 788 CD LYS A 92 20.546 24.610 75.510 1.00 67.59 C ATOM 789 CE LYS A 92 20.535 23.141 75.117 1.00 69.55 C ATOM 790 NZ LYS A 92 20.063 22.936 73.721 1.00 69.58 N ATOM 791 HZ1 LYS A 92 19.095 23.304 73.626 1.00 0.00 H ATOM 792 HZ2 LYS A 92 20.693 23.442 73.066 1.00 0.00 H ATOM 793 HZ3 LYS A 92 20.073 21.920 73.499 1.00 0.00 H ATOM 794 H LYS A 92 21.420 27.571 72.773 1.00 0.00 H ATOM 795 N ASP A 93 24.608 26.835 73.184 1.00 58.26 N ATOM 796 CA ASP A 93 25.871 26.133 72.968 1.00 57.44 C ATOM 797 C ASP A 93 26.605 26.843 71.839 1.00 56.85 C ATOM 798 O ASP A 93 26.163 26.797 70.687 1.00 57.63 O ATOM 799 CB ASP A 93 25.631 24.663 72.630 1.00 55.77 C ATOM 800 CG ASP A 93 26.906 23.834 72.655 1.00 54.27 C ATOM 801 OD1 ASP A 93 28.010 24.415 72.731 1.00 50.71 O ATOM 802 OD2 ASP A 93 26.801 22.591 72.591 1.00 57.01 O ATOM 803 H ASP A 93 24.130 27.269 72.368 1.00 0.00 H ATOM 804 N ASP A 94 27.721 27.490 72.166 1.00 54.23 N ATOM 805 CA ASP A 94 28.510 28.223 71.187 1.00 52.38 C ATOM 806 C ASP A 94 29.568 27.360 70.513 1.00 51.12 C ATOM 807 O ASP A 94 30.325 27.871 69.680 1.00 49.74 O ATOM 808 CB ASP A 94 29.183 29.429 71.852 1.00 53.36 C ATOM 809 CG ASP A 94 29.537 30.518 70.862 1.00 53.60 C ATOM 810 OD1 ASP A 94 28.723 30.774 69.953 1.00 54.58 O ATOM 811 OD2 ASP A 94 30.627 31.114 70.988 1.00 52.26 O ATOM 812 H ASP A 94 28.040 27.471 73.156 1.00 0.00 H ATOM 813 N THR A 95 29.639 26.072 70.843 1.00 55.21 N ATOM 814 CA THR A 95 30.688 25.193 70.344 1.00 55.55 C ATOM 815 C THR A 95 30.188 24.197 69.305 1.00 56.54 C ATOM 816 O THR A 95 30.956 23.328 68.879 1.00 57.24 O ATOM 817 CB THR A 95 31.337 24.438 71.507 1.00 58.80 C ATOM 818 OG1 THR A 95 30.364 23.594 72.133 1.00 61.21 O ATOM 819 CG2 THR A 95 31.887 25.414 72.530 1.00 57.91 C ATOM 820 HG1 THR A 95 29.619 24.149 72.475 1.00 0.00 H ATOM 821 H THR A 95 28.918 25.679 71.481 1.00 0.00 H ATOM 822 N LEU A 96 28.927 24.298 68.890 1.00 55.46 N ATOM 823 CA LEU A 96 28.383 23.366 67.911 1.00 56.88 C ATOM 824 C LEU A 96 29.092 23.525 66.571 1.00 55.96 C ATOM 825 O LEU A 96 29.479 24.630 66.182 1.00 58.11 O ATOM 826 CB LEU A 96 26.879 23.589 67.743 1.00 52.34 C ATOM 827 H LEU A 96 28.321 25.053 69.270 1.00 0.00 H ATOM 828 N ASP A 97 29.274 22.407 65.870 1.00 58.32 N ATOM 829 CA ASP A 97 29.943 22.437 64.576 1.00 58.66 C ATOM 830 C ASP A 97 29.117 23.233 63.574 1.00 56.31 C ATOM 831 O ASP A 97 27.934 22.954 63.362 1.00 56.51 O ATOM 832 CB ASP A 97 30.174 21.014 64.065 1.00 64.62 C ATOM 833 CG ASP A 97 30.971 20.977 62.773 1.00 70.47 C ATOM 834 OD1 ASP A 97 31.905 21.792 62.622 1.00 72.84 O ATOM 835 OD2 ASP A 97 30.663 20.130 61.909 1.00 76.35 O ATOM 836 H ASP A 97 28.934 21.501 66.251 1.00 0.00 H ATOM 837 N HIS A 98 29.749 24.233 62.961 1.00 52.40 N ATOM 838 CA HIS A 98 29.077 25.112 62.015 1.00 48.51 C ATOM 839 C HIS A 98 28.858 24.471 60.651 1.00 49.81 C ATOM 840 O HIS A 98 28.079 25.006 59.855 1.00 50.22 O ATOM 841 CB HIS A 98 29.885 26.397 61.831 1.00 43.28 C ATOM 842 CG HIS A 98 31.077 26.233 60.941 1.00 42.76 C ATOM 843 ND1 HIS A 98 32.256 25.665 61.373 1.00 44.71 N ATOM 844 CD2 HIS A 98 31.269 26.554 59.639 1.00 42.15 C ATOM 845 CE1 HIS A 98 33.125 25.647 60.377 1.00 45.78 C ATOM 846 NE2 HIS A 98 32.550 26.181 59.314 1.00 44.31 N ATOM 847 H HIS A 98 30.756 24.391 63.165 1.00 0.00 H ATOM 848 N THR A 99 29.524 23.353 60.366 1.00 52.06 N ATOM 849 CA THR A 99 29.494 22.795 59.017 1.00 53.87 C ATOM 850 C THR A 99 28.099 22.399 58.537 1.00 54.17 C ATOM 851 O THR A 99 27.764 22.728 57.385 1.00 55.06 O ATOM 852 CB THR A 99 30.460 21.605 58.933 1.00 57.34 C ATOM 853 OG1 THR A 99 31.725 21.979 59.493 1.00 59.88 O ATOM 854 CG2 THR A 99 30.664 21.188 57.486 1.00 57.36 C ATOM 855 HG1 THR A 99 31.601 22.239 60.440 1.00 0.00 H ATOM 856 H THR A 99 30.070 22.874 61.110 1.00 0.00 H ATOM 857 N PRO A 100 27.250 21.717 59.319 1.00 53.67 N ATOM 858 CA PRO A 100 25.924 21.348 58.796 1.00 51.70 C ATOM 859 C PRO A 100 24.969 22.521 58.627 1.00 47.93 C ATOM 860 O PRO A 100 23.885 22.329 58.061 1.00 47.02 O ATOM 861 CB PRO A 100 25.398 20.357 59.842 1.00 54.44 C ATOM 862 CG PRO A 100 26.089 20.741 61.091 1.00 55.66 C ATOM 863 CD PRO A 100 27.465 21.157 60.667 1.00 55.94 C ATOM 864 N LEU A 101 25.327 23.718 59.092 1.00 43.62 N ATOM 865 CA LEU A 101 24.457 24.883 58.986 1.00 41.83 C ATOM 866 C LEU A 101 24.627 25.647 57.679 1.00 43.23 C ATOM 867 O LEU A 101 23.779 26.487 57.359 1.00 44.81 O ATOM 868 CB LEU A 101 24.703 25.835 60.163 1.00 38.85 C ATOM 869 CG LEU A 101 24.201 25.381 61.534 1.00 38.33 C ATOM 870 CD1 LEU A 101 24.626 26.363 62.614 1.00 35.91 C ATOM 871 CD2 LEU A 101 22.689 25.227 61.518 1.00 38.71 C ATOM 872 H LEU A 101 26.257 23.824 59.545 1.00 0.00 H ATOM 873 N ILE A 102 25.687 25.380 56.924 1.00 45.52 N ATOM 874 CA ILE A 102 25.972 26.111 55.689 1.00 45.76 C ATOM 875 C ILE A 102 24.936 25.799 54.609 1.00 45.62 C ATOM 876 O ILE A 102 24.409 26.740 53.997 1.00 43.02 O ATOM 877 CB ILE A 102 27.398 25.825 55.190 1.00 48.32 C ATOM 878 CG1 ILE A 102 28.409 26.043 56.318 1.00 50.70 C ATOM 879 CG2 ILE A 102 27.732 26.715 54.001 1.00 47.00 C ATOM 880 CD1 ILE A 102 29.839 25.744 55.925 1.00 53.64 C ATOM 881 H ILE A 102 26.337 24.625 57.221 1.00 0.00 H ATOM 882 N PRO A 103 24.604 24.530 54.321 1.00 48.77 N ATOM 883 CA PRO A 103 23.596 24.269 53.279 1.00 47.38 C ATOM 884 C PRO A 103 22.204 24.778 53.621 1.00 44.48 C ATOM 885 O PRO A 103 21.343 24.803 52.732 1.00 43.77 O ATOM 886 CB PRO A 103 23.610 22.740 53.146 1.00 50.63 C ATOM 887 CG PRO A 103 24.130 22.256 54.440 1.00 52.62 C ATOM 888 CD PRO A 103 25.152 23.266 54.850 1.00 51.56 C ATOM 889 N LYS A 104 21.951 25.179 54.869 1.00 42.53 N ATOM 890 CA LYS A 104 20.681 25.809 55.202 1.00 40.32 C ATOM 891 C LYS A 104 20.653 27.283 54.829 1.00 37.69 C ATOM 892 O LYS A 104 19.569 27.873 54.769 1.00 37.82 O ATOM 893 CB LYS A 104 20.378 25.646 56.693 1.00 40.53 C ATOM 894 CG LYS A 104 20.186 24.204 57.131 1.00 44.06 C ATOM 895 CD LYS A 104 19.462 24.130 58.464 1.00 46.83 C ATOM 896 H LYS A 104 22.667 25.040 55.610 1.00 0.00 H ATOM 897 N CYS A 105 21.812 27.884 54.577 1.00 37.41 N ATOM 898 CA CYS A 105 21.856 29.263 54.116 1.00 36.05 C ATOM 899 C CYS A 105 21.402 29.346 52.663 1.00 36.28 C ATOM 900 O CYS A 105 21.706 28.471 51.849 1.00 37.94 O ATOM 901 CB CYS A 105 23.268 29.827 54.261 1.00 37.55 C ATOM 902 SG CYS A 105 23.928 29.763 55.942 1.00 39.62 S ATOM 903 H CYS A 105 22.700 27.360 54.712 1.00 0.00 H ATOM 904 N ARG A 106 20.669 30.408 52.340 1.00 35.29 N ATOM 905 CA ARG A 106 20.108 30.594 51.011 1.00 36.20 C ATOM 906 C ARG A 106 20.461 31.976 50.486 1.00 40.22 C ATOM 907 O ARG A 106 20.417 32.963 51.227 1.00 40.54 O ATOM 908 CB ARG A 106 18.584 30.422 51.021 1.00 34.52 C ATOM 909 CG ARG A 106 18.113 29.013 51.337 1.00 34.56 C ATOM 910 CD ARG A 106 18.459 28.047 50.217 1.00 35.51 C ATOM 911 NE ARG A 106 17.902 26.718 50.454 1.00 37.92 N ATOM 912 CZ ARG A 106 18.582 25.706 50.980 1.00 39.15 C ATOM 913 NH1 ARG A 106 19.853 25.866 51.322 1.00 39.26 N ATOM 914 NH2 ARG A 106 17.994 24.531 51.161 1.00 40.15 N ATOM 915 HE ARG A 106 16.909 26.554 50.194 1.00 0.00 H ATOM 916 HH12 ARG A 106 20.385 25.073 51.734 1.00 0.00 H ATOM 917 HH11 ARG A 106 20.318 26.785 51.178 1.00 0.00 H ATOM 918 HH22 ARG A 106 18.529 23.740 51.573 1.00 0.00 H ATOM 919 HH21 ARG A 106 16.998 24.401 50.891 1.00 0.00 H ATOM 920 H ARG A 106 20.490 31.132 53.065 1.00 0.00 H ATOM 921 N ALA A 107 20.814 32.038 49.205 1.00 43.04 N ATOM 922 CA ALA A 107 21.042 33.302 48.523 1.00 31.57 C ATOM 923 C ALA A 107 19.731 33.811 47.940 1.00 34.98 C ATOM 924 O ALA A 107 18.917 33.030 47.438 1.00 37.96 O ATOM 925 CB ALA A 107 22.085 33.143 47.417 1.00 32.48 C ATOM 926 H ALA A 107 20.931 31.152 48.673 1.00 0.00 H ATOM 927 N GLN A 108 19.529 35.124 48.014 1.00 33.35 N ATOM 928 CA GLN A 108 18.290 35.725 47.542 1.00 32.65 C ATOM 929 C GLN A 108 18.586 37.102 46.966 1.00 35.46 C ATOM 930 O GLN A 108 19.329 37.887 47.562 1.00 38.25 O ATOM 931 CB GLN A 108 17.255 35.831 48.668 1.00 32.07 C ATOM 932 CG GLN A 108 15.927 36.437 48.240 1.00 32.98 C ATOM 933 CD GLN A 108 14.834 36.238 49.274 1.00 33.98 C ATOM 934 OE1 GLN A 108 14.976 35.440 50.201 1.00 32.82 O ATOM 935 NE2 GLN A 108 13.732 36.964 49.116 1.00 36.19 N ATOM 936 HE22 GLN A 108 13.656 37.626 48.318 1.00 0.00 H ATOM 937 HE21 GLN A 108 12.946 36.870 49.791 1.00 0.00 H ATOM 938 H GLN A 108 20.270 35.732 48.417 1.00 0.00 H ATOM 939 N VAL A 109 17.997 37.385 45.809 1.00 34.87 N ATOM 940 CA VAL A 109 18.136 38.670 45.135 1.00 37.67 C ATOM 941 C VAL A 109 16.940 39.538 45.494 1.00 40.32 C ATOM 942 O VAL A 109 15.794 39.070 45.494 1.00 42.22 O ATOM 943 CB VAL A 109 18.249 38.487 43.610 1.00 38.21 C ATOM 944 CG1 VAL A 109 18.417 39.833 42.922 1.00 40.28 C ATOM 945 CG2 VAL A 109 19.402 37.558 43.273 1.00 37.47 C ATOM 946 H VAL A 109 17.408 36.654 45.362 1.00 0.00 H ATOM 947 N ILE A 110 17.203 40.804 45.809 1.00 41.18 N ATOM 948 CA ILE A 110 16.167 41.762 46.173 1.00 39.87 C ATOM 949 C ILE A 110 16.338 43.002 45.309 1.00 44.03 C ATOM 950 O ILE A 110 17.429 43.581 45.257 1.00 44.08 O ATOM 951 CB ILE A 110 16.225 42.127 47.668 1.00 38.90 C ATOM 952 CG1 ILE A 110 16.055 40.867 48.521 1.00 39.56 C ATOM 953 CG2 ILE A 110 15.166 43.163 48.006 1.00 39.98 C ATOM 954 CD1 ILE A 110 16.011 41.125 50.005 1.00 42.88 C ATOM 955 H ILE A 110 18.192 41.124 45.795 1.00 0.00 H ATOM 956 N GLU A 111 15.265 43.407 44.635 1.00 46.66 N ATOM 957 CA GLU A 111 15.302 44.534 43.711 1.00 52.15 C ATOM 958 C GLU A 111 15.058 45.832 44.473 1.00 54.54 C ATOM 959 O GLU A 111 14.042 45.973 45.162 1.00 55.83 O ATOM 960 CB GLU A 111 14.262 44.355 42.605 1.00 45.74 C ATOM 961 H GLU A 111 14.367 42.901 44.772 1.00 0.00 H ATOM 962 N PHE A 112 15.983 46.771 44.342 1.00 58.18 N ATOM 963 CA PHE A 112 15.942 48.070 44.990 1.00 59.82 C ATOM 964 C PHE A 112 15.711 49.175 43.965 1.00 65.62 C ATOM 965 O PHE A 112 15.776 48.940 42.753 1.00 66.23 O ATOM 966 CB PHE A 112 17.253 48.313 45.750 1.00 58.66 C ATOM 967 CG PHE A 112 17.395 47.484 46.996 1.00 57.20 C ATOM 968 CD1 PHE A 112 17.963 46.222 46.946 1.00 55.79 C ATOM 969 CD2 PHE A 112 16.962 47.970 48.219 1.00 57.31 C ATOM 970 CE1 PHE A 112 18.095 45.458 48.093 1.00 54.21 C ATOM 971 CE2 PHE A 112 17.091 47.213 49.369 1.00 55.18 C ATOM 972 CZ PHE A 112 17.658 45.955 49.306 1.00 53.99 C ATOM 973 H PHE A 112 16.798 46.563 43.730 1.00 0.00 H ATOM 974 N PRO A 113 15.410 50.398 44.416 1.00 69.33 N ATOM 975 CA PRO A 113 15.267 51.506 43.457 1.00 72.94 C ATOM 976 C PRO A 113 16.510 51.762 42.621 1.00 73.02 C ATOM 977 O PRO A 113 16.393 52.292 41.508 1.00 76.20 O ATOM 978 CB PRO A 113 14.935 52.703 44.357 1.00 75.89 C ATOM 979 CG PRO A 113 14.270 52.100 45.538 1.00 74.02 C ATOM 980 CD PRO A 113 14.958 50.785 45.766 1.00 70.04 C ATOM 981 N ASP A 114 17.696 51.403 43.112 1.00 70.54 N ATOM 982 CA ASP A 114 18.934 51.605 42.370 1.00 71.63 C ATOM 983 C ASP A 114 19.510 50.308 41.813 1.00 68.95 C ATOM 984 O ASP A 114 20.675 50.286 41.404 1.00 69.56 O ATOM 985 CB ASP A 114 19.973 52.309 43.247 1.00 74.94 C ATOM 986 CG ASP A 114 20.255 51.560 44.532 1.00 75.86 C ATOM 987 OD1 ASP A 114 19.316 50.935 45.072 1.00 75.58 O ATOM 988 OD2 ASP A 114 21.411 51.593 45.003 1.00 77.62 O ATOM 989 H ASP A 114 17.739 50.965 44.054 1.00 0.00 H ATOM 990 N GLY A 115 18.730 49.232 41.782 1.00 74.46 N ATOM 991 CA GLY A 115 19.185 47.995 41.195 1.00 73.62 C ATOM 992 C GLY A 115 19.082 46.813 42.136 1.00 68.27 C ATOM 993 O GLY A 115 18.868 46.963 43.343 1.00 68.44 O ATOM 994 H GLY A 115 17.774 49.283 42.188 1.00 0.00 H ATOM 995 N PRO A 116 19.238 45.607 41.596 1.00 65.72 N ATOM 996 CA PRO A 116 19.140 44.410 42.436 1.00 60.35 C ATOM 997 C PRO A 116 20.380 44.220 43.294 1.00 57.85 C ATOM 998 O PRO A 116 21.484 44.640 42.938 1.00 60.45 O ATOM 999 CB PRO A 116 18.992 43.276 41.415 1.00 60.61 C ATOM 1000 CG PRO A 116 19.706 43.782 40.207 1.00 63.04 C ATOM 1001 CD PRO A 116 19.470 45.274 40.179 1.00 65.52 C ATOM 1002 N ALA A 117 20.181 43.580 44.444 1.00 54.32 N ATOM 1003 CA ALA A 117 21.262 43.252 45.360 1.00 50.25 C ATOM 1004 C ALA A 117 21.048 41.845 45.898 1.00 48.03 C ATOM 1005 O ALA A 117 19.909 41.420 46.112 1.00 48.69 O ATOM 1006 CB ALA A 117 21.346 44.258 46.515 1.00 49.31 C ATOM 1007 H ALA A 117 19.211 43.303 44.698 1.00 0.00 H ATOM 1008 N THR A 118 22.146 41.124 46.105 1.00 43.85 N ATOM 1009 CA THR A 118 22.100 39.737 46.546 1.00 41.61 C ATOM 1010 C THR A 118 22.367 39.653 48.044 1.00 38.26 C ATOM 1011 O THR A 118 23.343 40.225 48.540 1.00 37.86 O ATOM 1012 CB THR A 118 23.117 38.885 45.783 1.00 41.73 C ATOM 1013 OG1 THR A 118 22.816 38.921 44.383 1.00 45.39 O ATOM 1014 CG2 THR A 118 23.080 37.442 46.270 1.00 37.90 C ATOM 1015 HG1 THR A 118 23.475 38.370 43.891 1.00 0.00 H ATOM 1016 H THR A 118 23.073 41.568 45.946 1.00 0.00 H ATOM 1017 N PHE A 119 21.502 38.936 48.756 1.00 37.31 N ATOM 1018 CA PHE A 119 21.673 38.666 50.174 1.00 36.87 C ATOM 1019 C PHE A 119 21.775 37.163 50.399 1.00 38.49 C ATOM 1020 O PHE A 119 21.399 36.358 49.543 1.00 41.52 O ATOM 1021 CB PHE A 119 20.510 39.231 51.002 1.00 37.76 C ATOM 1022 CG PHE A 119 20.447 40.732 51.026 1.00 38.75 C ATOM 1023 CD1 PHE A 119 19.754 41.425 50.048 1.00 39.82 C ATOM 1024 CD2 PHE A 119 21.067 41.448 52.037 1.00 37.31 C ATOM 1025 CE1 PHE A 119 19.689 42.806 50.069 1.00 40.54 C ATOM 1026 CE2 PHE A 119 21.005 42.828 52.065 1.00 38.70 C ATOM 1027 CZ PHE A 119 20.315 43.509 51.080 1.00 40.67 C ATOM 1028 H PHE A 119 20.664 38.550 48.276 1.00 0.00 H ATOM 1029 N VAL A 120 22.290 36.791 51.568 1.00 37.72 N ATOM 1030 CA VAL A 120 22.352 35.400 52.004 1.00 36.44 C ATOM 1031 C VAL A 120 21.658 35.314 53.355 1.00 34.05 C ATOM 1032 O VAL A 120 22.035 36.023 54.298 1.00 31.28 O ATOM 1033 CB VAL A 120 23.797 34.883 52.092 1.00 34.30 C ATOM 1034 CG1 VAL A 120 23.807 33.405 52.454 1.00 31.67 C ATOM 1035 CG2 VAL A 120 24.529 35.121 50.781 1.00 34.51 C ATOM 1036 H VAL A 120 22.666 37.526 52.201 1.00 0.00 H ATOM 1037 N ARG A 121 20.648 34.456 53.449 1.00 36.85 N ATOM 1038 CA ARG A 121 19.809 34.360 54.633 1.00 38.69 C ATOM 1039 C ARG A 121 19.977 33.004 55.305 1.00 39.44 C ATOM 1040 O ARG A 121 20.227 31.991 54.647 1.00 41.53 O ATOM 1041 CB ARG A 121 18.335 34.579 54.280 1.00 41.46 C ATOM 1042 CG ARG A 121 17.805 33.628 53.219 1.00 42.86 C ATOM 1043 CD ARG A 121 16.331 33.872 52.945 1.00 46.23 C ATOM 1044 NE ARG A 121 15.862 33.121 51.785 1.00 48.35 N ATOM 1045 CZ ARG A 121 15.408 31.873 51.835 1.00 52.29 C ATOM 1046 NH1 ARG A 121 15.362 31.229 52.994 1.00 53.96 N ATOM 1047 NH2 ARG A 121 15.003 31.269 50.727 1.00 55.29 N ATOM 1048 HE ARG A 121 15.885 33.593 50.859 1.00 0.00 H ATOM 1049 HH12 ARG A 121 15.007 30.252 53.032 1.00 0.00 H ATOM 1050 HH11 ARG A 121 15.681 31.701 53.864 1.00 0.00 H ATOM 1051 HH22 ARG A 121 14.648 30.292 50.767 1.00 0.00 H ATOM 1052 HH21 ARG A 121 15.040 31.772 49.817 1.00 0.00 H ATOM 1053 H ARG A 121 20.450 33.828 52.644 1.00 0.00 H ATOM 1054 N LEU A 122 19.833 32.999 56.628 1.00 39.09 N ATOM 1055 CA LEU A 122 19.854 31.779 57.425 1.00 39.35 C ATOM 1056 C LEU A 122 18.694 31.831 58.404 1.00 41.37 C ATOM 1057 O LEU A 122 18.664 32.693 59.288 1.00 42.11 O ATOM 1058 CB LEU A 122 21.182 31.620 58.171 1.00 37.76 C ATOM 1059 CG LEU A 122 21.272 30.439 59.141 1.00 37.74 C ATOM 1060 CD1 LEU A 122 20.966 29.125 58.431 1.00 38.64 C ATOM 1061 CD2 LEU A 122 22.640 30.394 59.805 1.00 35.32 C ATOM 1062 H LEU A 122 19.699 33.908 57.116 1.00 0.00 H ATOM 1063 N LYS A 123 17.744 30.914 58.247 1.00 41.03 N ATOM 1064 CA LYS A 123 16.564 30.914 59.098 1.00 41.08 C ATOM 1065 C LYS A 123 16.910 30.375 60.481 1.00 38.37 C ATOM 1066 O LYS A 123 17.671 29.412 60.621 1.00 37.65 O ATOM 1067 CB LYS A 123 15.450 30.083 58.461 1.00 43.15 C ATOM 1068 CG LYS A 123 14.139 30.096 59.232 1.00 43.89 C ATOM 1069 CD LYS A 123 12.975 29.646 58.363 1.00 44.20 C ATOM 1070 CE LYS A 123 13.216 28.270 57.762 1.00 44.40 C ATOM 1071 NZ LYS A 123 12.037 27.801 56.979 1.00 45.70 N ATOM 1072 HZ1 LYS A 123 11.207 27.747 57.603 1.00 0.00 H ATOM 1073 HZ2 LYS A 123 11.848 28.470 56.205 1.00 0.00 H ATOM 1074 HZ3 LYS A 123 12.237 26.860 56.584 1.00 0.00 H ATOM 1075 H LYS A 123 17.846 30.189 57.508 1.00 0.00 H ATOM 1076 N CYS A 124 16.358 31.016 61.511 1.00 40.57 N ATOM 1077 CA CYS A 124 16.567 30.616 62.896 1.00 42.72 C ATOM 1078 C CYS A 124 15.226 30.608 63.613 1.00 45.35 C ATOM 1079 O CYS A 124 14.444 31.555 63.483 1.00 48.77 O ATOM 1080 CB CYS A 124 17.552 31.551 63.606 1.00 44.35 C ATOM 1081 SG CYS A 124 19.253 31.438 63.002 1.00 46.62 S ATOM 1082 H CYS A 124 15.751 31.838 61.317 1.00 0.00 H ATOM 1083 N THR A 125 14.969 29.542 64.369 1.00 45.14 N ATOM 1084 CA THR A 125 13.682 29.377 65.032 1.00 51.05 C ATOM 1085 C THR A 125 13.492 30.437 66.109 1.00 51.32 C ATOM 1086 O THR A 125 14.342 30.603 66.990 1.00 52.20 O ATOM 1087 CB THR A 125 13.580 27.982 65.647 1.00 56.47 C ATOM 1088 OG1 THR A 125 13.847 26.995 64.643 1.00 58.13 O ATOM 1089 CG2 THR A 125 12.187 27.749 66.222 1.00 60.55 C ATOM 1090 HG1 THR A 125 13.780 26.092 65.044 1.00 0.00 H ATOM 1091 H THR A 125 15.701 28.813 64.488 1.00 0.00 H ATOM 1092 N ASN A 126 12.371 31.154 66.036 1.00 52.07 N ATOM 1093 CA ASN A 126 12.017 32.130 67.054 1.00 54.24 C ATOM 1094 C ASN A 126 10.994 31.509 67.991 1.00 59.30 C ATOM 1095 O ASN A 126 9.870 31.213 67.556 1.00 59.00 O ATOM 1096 CB ASN A 126 11.459 33.400 66.415 1.00 56.35 C ATOM 1097 CG ASN A 126 11.142 34.477 67.436 1.00 62.34 C ATOM 1098 OD1 ASN A 126 11.587 34.417 68.582 1.00 63.84 O ATOM 1099 ND2 ASN A 126 10.369 35.474 67.020 1.00 66.14 N ATOM 1100 HD22 ASN A 126 10.015 35.484 66.042 1.00 0.00 H ATOM 1101 HD21 ASN A 126 10.118 36.244 67.672 1.00 0.00 H ATOM 1102 H ASN A 126 11.732 31.011 65.228 1.00 0.00 H ATOM 1103 N PRO A 127 11.325 31.285 69.266 1.00 62.30 N ATOM 1104 CA PRO A 127 10.370 30.628 70.173 1.00 68.40 C ATOM 1105 C PRO A 127 9.197 31.506 70.582 1.00 73.11 C ATOM 1106 O PRO A 127 8.288 31.008 71.258 1.00 78.08 O ATOM 1107 CB PRO A 127 11.233 30.265 71.393 1.00 67.21 C ATOM 1108 CG PRO A 127 12.662 30.410 70.935 1.00 62.81 C ATOM 1109 CD PRO A 127 12.639 31.483 69.897 1.00 61.04 C ATOM 1110 N GLU A 128 9.179 32.783 70.196 1.00 75.46 N ATOM 1111 CA GLU A 128 8.145 33.708 70.638 1.00 81.67 C ATOM 1112 C GLU A 128 7.204 34.163 69.531 1.00 85.89 C ATOM 1113 O GLU A 128 6.230 34.864 69.825 1.00 92.12 O ATOM 1114 CB GLU A 128 8.786 34.942 71.291 1.00 81.70 C ATOM 1115 H GLU A 128 9.926 33.128 69.560 1.00 0.00 H ATOM 1116 N SER A 129 7.453 33.788 68.278 1.00 86.50 N ATOM 1117 CA SER A 129 6.617 34.251 67.182 1.00 85.54 C ATOM 1118 C SER A 129 6.627 33.224 66.060 1.00 82.95 C ATOM 1119 O SER A 129 7.601 32.490 65.876 1.00 80.10 O ATOM 1120 CB SER A 129 7.084 35.612 66.653 1.00 84.77 C ATOM 1121 OG SER A 129 6.325 36.011 65.525 1.00 86.11 O ATOM 1122 HG SER A 129 6.648 36.891 65.206 1.00 0.00 H ATOM 1123 H SER A 129 8.255 33.156 68.081 1.00 0.00 H ATOM 1124 N LYS A 130 5.525 33.186 65.311 1.00 82.72 N ATOM 1125 CA LYS A 130 5.401 32.296 64.164 1.00 79.12 C ATOM 1126 C LYS A 130 6.064 32.853 62.912 1.00 77.65 C ATOM 1127 O LYS A 130 6.266 32.101 61.952 1.00 77.77 O ATOM 1128 CB LYS A 130 3.924 32.014 63.877 1.00 80.29 C ATOM 1129 CG LYS A 130 3.607 30.550 63.617 1.00 81.62 C ATOM 1130 CD LYS A 130 3.782 29.720 64.879 1.00 81.43 C ATOM 1131 CE LYS A 130 3.457 28.256 64.629 1.00 82.68 C ATOM 1132 NZ LYS A 130 3.584 27.438 65.867 1.00 83.11 N ATOM 1133 HZ1 LYS A 130 4.559 27.499 66.223 1.00 0.00 H ATOM 1134 HZ2 LYS A 130 2.927 27.799 66.588 1.00 0.00 H ATOM 1135 HZ3 LYS A 130 3.354 26.447 65.651 1.00 0.00 H ATOM 1136 H LYS A 130 4.729 33.811 65.553 1.00 0.00 H ATOM 1137 N VAL A 131 6.399 34.137 62.896 1.00 75.36 N ATOM 1138 CA VAL A 131 7.050 34.732 61.722 1.00 70.02 C ATOM 1139 C VAL A 131 8.497 34.261 61.660 1.00 63.86 C ATOM 1140 O VAL A 131 9.183 34.242 62.698 1.00 62.64 O ATOM 1141 CB VAL A 131 6.968 36.258 61.785 1.00 70.04 C ATOM 1142 H VAL A 131 6.198 34.730 63.726 1.00 0.00 H ATOM 1143 N PRO A 132 9.002 33.871 60.492 1.00 61.32 N ATOM 1144 CA PRO A 132 10.387 33.389 60.416 1.00 57.02 C ATOM 1145 C PRO A 132 11.381 34.530 60.564 1.00 54.83 C ATOM 1146 O PRO A 132 11.209 35.609 59.992 1.00 54.81 O ATOM 1147 CB PRO A 132 10.470 32.755 59.020 1.00 55.43 C ATOM 1148 CG PRO A 132 9.044 32.611 58.555 1.00 58.49 C ATOM 1149 CD PRO A 132 8.297 33.728 59.209 1.00 61.16 C ATOM 1150 N HIS A 133 12.430 34.281 61.342 1.00 52.65 N ATOM 1151 CA HIS A 133 13.511 35.236 61.537 1.00 48.97 C ATOM 1152 C HIS A 133 14.767 34.738 60.834 1.00 44.23 C ATOM 1153 O HIS A 133 15.066 33.540 60.850 1.00 42.71 O ATOM 1154 CB HIS A 133 13.792 35.461 63.024 1.00 49.63 C ATOM 1155 CG HIS A 133 14.679 36.635 63.297 1.00 50.70 C ATOM 1156 ND1 HIS A 133 14.197 37.922 63.408 1.00 53.61 N ATOM 1157 CD2 HIS A 133 16.019 36.720 63.467 1.00 50.49 C ATOM 1158 CE1 HIS A 133 15.201 38.748 63.642 1.00 54.28 C ATOM 1159 NE2 HIS A 133 16.318 38.044 63.683 1.00 52.04 N ATOM 1160 H HIS A 133 12.480 33.365 61.832 1.00 0.00 H ATOM 1161 N PHE A 134 15.503 35.663 60.223 1.00 41.87 N ATOM 1162 CA PHE A 134 16.647 35.318 59.394 1.00 40.37 C ATOM 1163 C PHE A 134 17.872 36.121 59.801 1.00 37.69 C ATOM 1164 O PHE A 134 17.778 37.318 60.090 1.00 36.41 O ATOM 1165 CB PHE A 134 16.353 35.568 57.910 1.00 40.68 C ATOM 1166 CG PHE A 134 15.212 34.758 57.371 1.00 40.50 C ATOM 1167 CD1 PHE A 134 15.431 33.500 56.837 1.00 33.83 C ATOM 1168 CD2 PHE A 134 13.921 35.257 57.391 1.00 40.67 C ATOM 1169 CE1 PHE A 134 14.383 32.755 56.337 1.00 35.83 C ATOM 1170 CE2 PHE A 134 12.870 34.516 56.893 1.00 38.39 C ATOM 1171 CZ PHE A 134 13.101 33.264 56.366 1.00 38.89 C ATOM 1172 H PHE A 134 15.252 36.665 60.342 1.00 0.00 H ATOM 1173 N LEU A 135 19.019 35.446 59.827 1.00 36.53 N ATOM 1174 CA LEU A 135 20.309 36.120 59.872 1.00 35.64 C ATOM 1175 C LEU A 135 20.698 36.489 58.447 1.00 41.04 C ATOM 1176 O LEU A 135 20.800 35.612 57.582 1.00 44.97 O ATOM 1177 CB LEU A 135 21.366 35.221 60.510 1.00 29.61 C ATOM 1178 CG LEU A 135 21.074 34.689 61.913 1.00 29.40 C ATOM 1179 CD1 LEU A 135 22.200 33.780 62.382 1.00 29.19 C ATOM 1180 CD2 LEU A 135 20.861 35.836 62.890 1.00 30.19 C ATOM 1181 H LEU A 135 18.993 34.406 59.815 1.00 0.00 H ATOM 1182 N MET A 136 20.902 37.778 58.193 1.00 42.15 N ATOM 1183 CA MET A 136 21.093 38.280 56.842 1.00 41.65 C ATOM 1184 C MET A 136 22.523 38.759 56.635 1.00 40.13 C ATOM 1185 O MET A 136 23.138 39.339 57.536 1.00 38.99 O ATOM 1186 CB MET A 136 20.108 39.412 56.536 1.00 44.21 C ATOM 1187 CG MET A 136 19.978 40.441 57.639 1.00 45.96 C ATOM 1188 SD MET A 136 18.470 41.413 57.477 1.00 50.36 S ATOM 1189 CE MET A 136 17.234 40.118 57.586 1.00 51.07 C ATOM 1190 H MET A 136 20.926 38.449 58.987 1.00 0.00 H ATOM 1191 N ARG A 137 23.042 38.503 55.436 1.00 41.13 N ATOM 1192 CA ARG A 137 24.383 38.898 55.032 1.00 40.89 C ATOM 1193 C ARG A 137 24.310 39.467 53.625 1.00 44.89 C ATOM 1194 O ARG A 137 23.736 38.838 52.731 1.00 46.86 O ATOM 1195 CB ARG A 137 25.347 37.708 55.072 1.00 38.40 C ATOM 1196 CG ARG A 137 26.528 37.825 54.120 1.00 39.62 C ATOM 1197 CD ARG A 137 27.202 36.477 53.925 1.00 39.43 C ATOM 1198 NE ARG A 137 28.236 36.517 52.895 1.00 41.56 N ATOM 1199 CZ ARG A 137 28.914 35.454 52.478 1.00 45.10 C ATOM 1200 NH1 ARG A 137 28.666 34.262 53.003 1.00 45.14 N ATOM 1201 NH2 ARG A 137 29.839 35.579 51.535 1.00 49.29 N ATOM 1202 HE ARG A 137 28.455 37.436 52.460 1.00 0.00 H ATOM 1203 HH12 ARG A 137 29.197 33.429 52.677 1.00 0.00 H ATOM 1204 HH11 ARG A 137 27.941 34.160 53.741 1.00 0.00 H ATOM 1205 HH22 ARG A 137 30.368 34.744 51.211 1.00 0.00 H ATOM 1206 HH21 ARG A 137 30.035 36.512 51.120 1.00 0.00 H ATOM 1207 H ARG A 137 22.454 37.991 54.748 1.00 0.00 H ATOM 1208 N MET A 138 24.881 40.654 53.430 1.00 44.87 N ATOM 1209 CA MET A 138 24.911 41.262 52.108 1.00 45.27 C ATOM 1210 C MET A 138 26.106 40.719 51.335 1.00 42.29 C ATOM 1211 O MET A 138 27.221 40.662 51.862 1.00 41.71 O ATOM 1212 CB MET A 138 24.984 42.783 52.215 1.00 48.42 C ATOM 1213 CG MET A 138 24.339 43.505 51.046 1.00 52.44 C ATOM 1214 SD MET A 138 24.313 45.294 51.254 1.00 56.36 S ATOM 1215 CE MET A 138 26.031 45.690 50.952 1.00 58.13 C ATOM 1216 H MET A 138 25.312 41.154 54.234 1.00 0.00 H ATOM 1217 N ALA A 139 25.872 40.312 50.085 1.00 43.07 N ATOM 1218 CA ALA A 139 26.913 39.623 49.328 1.00 42.42 C ATOM 1219 C ALA A 139 28.021 40.568 48.879 1.00 43.76 C ATOM 1220 O ALA A 139 29.168 40.134 48.718 1.00 44.52 O ATOM 1221 CB ALA A 139 26.303 38.914 48.119 1.00 43.26 C ATOM 1222 H ALA A 139 24.944 40.487 49.649 1.00 0.00 H ATOM 1223 N LYS A 140 27.709 41.850 48.677 1.00 42.85 N ATOM 1224 CA LYS A 140 28.693 42.773 48.118 1.00 45.13 C ATOM 1225 C LYS A 140 29.883 42.958 49.054 1.00 44.27 C ATOM 1226 O LYS A 140 31.040 42.860 48.630 1.00 47.06 O ATOM 1227 CB LYS A 140 28.037 44.120 47.808 1.00 42.05 C ATOM 1228 CG LYS A 140 27.305 44.165 46.475 1.00 43.91 C ATOM 1229 CD LYS A 140 26.654 45.520 46.247 1.00 45.73 C ATOM 1230 CE LYS A 140 25.632 45.828 47.327 1.00 44.09 C ATOM 1231 NZ LYS A 140 24.888 47.082 47.039 1.00 46.46 N ATOM 1232 HZ1 LYS A 140 25.557 47.876 46.985 1.00 0.00 H ATOM 1233 HZ2 LYS A 140 24.388 46.986 46.132 1.00 0.00 H ATOM 1234 HZ3 LYS A 140 24.200 47.258 47.799 1.00 0.00 H ATOM 1235 H LYS A 140 26.758 42.194 48.920 1.00 0.00 H ATOM 1236 N ASP A 141 29.620 43.229 50.333 1.00 40.64 N ATOM 1237 CA ASP A 141 30.676 43.528 51.293 1.00 39.61 C ATOM 1238 C ASP A 141 30.744 42.536 52.447 1.00 39.60 C ATOM 1239 O ASP A 141 31.523 42.752 53.384 1.00 40.21 O ATOM 1240 CB ASP A 141 30.501 44.947 51.849 1.00 39.40 C ATOM 1241 CG ASP A 141 29.118 45.184 52.423 1.00 39.21 C ATOM 1242 OD1 ASP A 141 28.358 44.204 52.584 1.00 39.20 O ATOM 1243 OD2 ASP A 141 28.788 46.351 52.717 1.00 39.44 O ATOM 1244 H ASP A 141 28.631 43.227 50.656 1.00 0.00 H ATOM 1245 N SER A 142 29.948 41.468 52.412 1.00 35.27 N ATOM 1246 CA SER A 142 29.872 40.481 53.488 1.00 33.64 C ATOM 1247 C SER A 142 29.457 41.099 54.821 1.00 32.60 C ATOM 1248 O SER A 142 29.707 40.518 55.882 1.00 31.86 O ATOM 1249 CB SER A 142 31.194 39.722 53.648 1.00 34.60 C ATOM 1250 OG SER A 142 31.381 38.796 52.594 1.00 46.32 O ATOM 1251 HG SER A 142 32.240 38.321 52.722 1.00 0.00 H ATOM 1252 H SER A 142 29.348 41.329 51.574 1.00 0.00 H ATOM 1253 N SER A 143 28.818 42.268 54.791 1.00 32.94 N ATOM 1254 CA SER A 143 28.338 42.886 56.020 1.00 33.85 C ATOM 1255 C SER A 143 27.153 42.104 56.573 1.00 36.16 C ATOM 1256 O SER A 143 26.320 41.591 55.820 1.00 40.02 O ATOM 1257 CB SER A 143 27.937 44.340 55.770 1.00 34.33 C ATOM 1258 OG SER A 143 26.793 44.422 54.938 1.00 36.01 O ATOM 1259 HG SER A 143 26.989 43.994 54.067 1.00 0.00 H ATOM 1260 H SER A 143 28.660 42.745 53.880 1.00 0.00 H ATOM 1261 N ILE A 144 27.081 42.012 57.897 1.00 36.96 N ATOM 1262 CA ILE A 144 26.037 41.266 58.586 1.00 36.92 C ATOM 1263 C ILE A 144 25.247 42.231 59.457 1.00 39.55 C ATOM 1264 O ILE A 144 25.827 43.082 60.140 1.00 41.92 O ATOM 1265 CB ILE A 144 26.625 40.113 59.426 1.00 39.03 C ATOM 1266 CG1 ILE A 144 27.196 39.029 58.509 1.00 40.92 C ATOM 1267 CG2 ILE A 144 25.578 39.526 60.361 1.00 38.85 C ATOM 1268 CD1 ILE A 144 27.683 37.800 59.241 1.00 42.44 C ATOM 1269 H ILE A 144 27.804 42.495 58.468 1.00 0.00 H ATOM 1270 N SER A 145 23.922 42.104 59.420 1.00 39.57 N ATOM 1271 CA SER A 145 23.044 42.970 60.201 1.00 40.25 C ATOM 1272 C SER A 145 23.168 42.630 61.680 1.00 41.22 C ATOM 1273 O SER A 145 22.793 41.534 62.107 1.00 40.30 O ATOM 1274 CB SER A 145 21.603 42.820 59.726 1.00 39.30 C ATOM 1275 OG SER A 145 20.702 43.454 60.618 1.00 40.85 O ATOM 1276 HG SER A 145 20.784 43.044 61.515 1.00 0.00 H ATOM 1277 H SER A 145 23.501 41.368 58.818 1.00 0.00 H ATOM 1278 N ALA A 146 23.698 43.570 62.467 1.00 32.40 N ATOM 1279 CA ALA A 146 23.735 43.390 63.913 1.00 30.81 C ATOM 1280 C ALA A 146 22.342 43.407 64.525 1.00 32.32 C ATOM 1281 O ALA A 146 22.145 42.846 65.609 1.00 31.95 O ATOM 1282 CB ALA A 146 24.602 44.472 64.557 1.00 28.70 C ATOM 1283 H ALA A 146 24.087 44.437 62.045 1.00 0.00 H ATOM 1284 N THR A 147 21.373 44.031 63.853 1.00 34.19 N ATOM 1285 CA THR A 147 20.010 44.054 64.372 1.00 32.89 C ATOM 1286 C THR A 147 19.365 42.676 64.282 1.00 33.49 C ATOM 1287 O THR A 147 18.712 42.227 65.232 1.00 34.89 O ATOM 1288 CB THR A 147 19.175 45.089 63.619 1.00 33.95 C ATOM 1289 OG1 THR A 147 19.849 46.354 63.643 1.00 36.58 O ATOM 1290 CG2 THR A 147 17.808 45.241 64.266 1.00 35.21 C ATOM 1291 HG1 THR A 147 19.308 47.024 63.155 1.00 0.00 H ATOM 1292 H THR A 147 21.591 44.504 62.953 1.00 0.00 H ATOM 1293 N SER A 148 19.539 41.988 63.150 1.00 31.67 N ATOM 1294 CA SER A 148 18.983 40.646 63.011 1.00 30.17 C ATOM 1295 C SER A 148 19.659 39.660 63.953 1.00 29.91 C ATOM 1296 O SER A 148 19.032 38.686 64.384 1.00 32.01 O ATOM 1297 CB SER A 148 19.108 40.168 61.564 1.00 29.46 C ATOM 1298 OG SER A 148 20.450 39.842 61.247 1.00 29.22 O ATOM 1299 HG SER A 148 21.020 40.643 61.366 1.00 0.00 H ATOM 1300 H SER A 148 20.073 42.411 62.364 1.00 0.00 H ATOM 1301 N MET A 149 20.933 39.893 64.280 1.00 29.85 N ATOM 1302 CA MET A 149 21.612 39.047 65.255 1.00 29.89 C ATOM 1303 C MET A 149 21.057 39.270 66.655 1.00 31.78 C ATOM 1304 O MET A 149 20.846 38.311 67.407 1.00 34.22 O ATOM 1305 CB MET A 149 23.116 39.320 65.233 1.00 30.68 C ATOM 1306 CG MET A 149 23.816 38.917 63.948 1.00 30.97 C ATOM 1307 SD MET A 149 25.591 39.237 64.026 1.00 34.77 S ATOM 1308 CE MET A 149 26.036 38.307 65.492 1.00 37.47 C ATOM 1309 H MET A 149 21.444 40.683 63.837 1.00 0.00 H ATOM 1310 N PHE A 150 20.814 40.530 67.022 1.00 32.30 N ATOM 1311 CA PHE A 150 20.332 40.834 68.365 1.00 33.39 C ATOM 1312 C PHE A 150 18.906 40.341 68.570 1.00 34.94 C ATOM 1313 O PHE A 150 18.592 39.753 69.612 1.00 36.08 O ATOM 1314 CB PHE A 150 20.423 42.338 68.623 1.00 32.96 C ATOM 1315 CG PHE A 150 19.959 42.750 69.991 1.00 32.92 C ATOM 1316 CD1 PHE A 150 20.817 42.687 71.076 1.00 32.98 C ATOM 1317 CD2 PHE A 150 18.665 43.206 70.191 1.00 31.73 C ATOM 1318 CE1 PHE A 150 20.395 43.067 72.336 1.00 32.82 C ATOM 1319 CE2 PHE A 150 18.236 43.587 71.449 1.00 31.71 C ATOM 1320 CZ PHE A 150 19.103 43.518 72.523 1.00 32.23 C ATOM 1321 H PHE A 150 20.970 41.303 66.344 1.00 0.00 H ATOM 1322 N ARG A 151 18.025 40.575 67.594 1.00 33.89 N ATOM 1323 CA ARG A 151 16.636 40.157 67.747 1.00 33.52 C ATOM 1324 C ARG A 151 16.494 38.641 67.706 1.00 35.06 C ATOM 1325 O ARG A 151 15.563 38.092 68.305 1.00 35.77 O ATOM 1326 CB ARG A 151 15.770 40.809 66.670 1.00 32.11 C ATOM 1327 CG ARG A 151 15.803 42.328 66.709 1.00 34.02 C ATOM 1328 CD ARG A 151 14.861 42.948 65.693 1.00 35.40 C ATOM 1329 NE ARG A 151 14.906 44.407 65.747 1.00 37.62 N ATOM 1330 CZ ARG A 151 14.203 45.212 64.957 1.00 40.62 C ATOM 1331 NH1 ARG A 151 13.392 44.705 64.040 1.00 41.28 N ATOM 1332 NH2 ARG A 151 14.314 46.528 65.084 1.00 43.22 N ATOM 1333 HE ARG A 151 15.531 44.846 66.452 1.00 0.00 H ATOM 1334 HH12 ARG A 151 12.844 45.338 63.424 1.00 0.00 H ATOM 1335 HH11 ARG A 151 13.304 43.674 63.937 1.00 0.00 H ATOM 1336 HH22 ARG A 151 13.764 47.158 64.466 1.00 0.00 H ATOM 1337 HH21 ARG A 151 14.951 46.929 65.802 1.00 0.00 H ATOM 1338 H ARG A 151 18.330 41.056 66.724 1.00 0.00 H ATOM 1339 N SER A 152 17.403 37.948 67.015 1.00 32.84 N ATOM 1340 CA SER A 152 17.361 36.490 67.007 1.00 30.72 C ATOM 1341 C SER A 152 17.746 35.920 68.366 1.00 31.55 C ATOM 1342 O SER A 152 17.111 34.978 68.855 1.00 33.57 O ATOM 1343 CB SER A 152 18.283 35.944 65.918 1.00 28.28 C ATOM 1344 OG SER A 152 18.266 34.528 65.903 1.00 29.52 O ATOM 1345 HG SER A 152 18.870 34.199 65.191 1.00 0.00 H ATOM 1346 H SER A 152 18.142 38.449 66.482 1.00 0.00 H ATOM 1347 N ALA A 153 18.778 36.484 68.995 1.00 32.06 N ATOM 1348 CA ALA A 153 19.269 35.964 70.264 1.00 32.39 C ATOM 1349 C ALA A 153 18.436 36.411 71.457 1.00 34.66 C ATOM 1350 O ALA A 153 18.470 35.749 72.499 1.00 35.25 O ATOM 1351 CB ALA A 153 20.725 36.385 70.473 1.00 32.74 C ATOM 1352 H ALA A 153 19.242 37.312 68.571 1.00 0.00 H ATOM 1353 N PHE A 154 17.697 37.513 71.338 1.00 34.06 N ATOM 1354 CA PHE A 154 16.915 38.064 72.445 1.00 33.97 C ATOM 1355 C PHE A 154 15.529 38.437 71.936 1.00 35.10 C ATOM 1356 O PHE A 154 15.242 39.615 71.684 1.00 36.10 O ATOM 1357 CB PHE A 154 17.623 39.267 73.070 1.00 31.07 C ATOM 1358 CG PHE A 154 19.084 39.036 73.335 1.00 29.70 C ATOM 1359 CD1 PHE A 154 19.495 38.242 74.393 1.00 29.84 C ATOM 1360 CD2 PHE A 154 20.048 39.607 72.520 1.00 28.91 C ATOM 1361 CE1 PHE A 154 20.840 38.026 74.635 1.00 30.08 C ATOM 1362 CE2 PHE A 154 21.395 39.396 72.757 1.00 27.80 C ATOM 1363 CZ PHE A 154 21.792 38.604 73.815 1.00 29.37 C ATOM 1364 H PHE A 154 17.675 38.002 70.420 1.00 0.00 H ATOM 1365 N PRO A 155 14.639 37.453 71.778 1.00 34.18 N ATOM 1366 CA PRO A 155 13.296 37.767 71.264 1.00 33.99 C ATOM 1367 C PRO A 155 12.450 38.579 72.229 1.00 35.41 C ATOM 1368 O PRO A 155 11.575 39.329 71.781 1.00 36.95 O ATOM 1369 CB PRO A 155 12.684 36.380 71.009 1.00 33.45 C ATOM 1370 CG PRO A 155 13.851 35.433 70.970 1.00 32.37 C ATOM 1371 CD PRO A 155 14.849 36.004 71.925 1.00 33.66 C ATOM 1372 N LYS A 156 12.677 38.453 73.537 1.00 37.21 N ATOM 1373 CA LYS A 156 11.904 39.178 74.537 1.00 38.64 C ATOM 1374 C LYS A 156 12.587 40.463 74.988 1.00 39.87 C ATOM 1375 O LYS A 156 12.301 40.957 76.085 1.00 42.75 O ATOM 1376 CB LYS A 156 11.628 38.283 75.746 1.00 40.09 C ATOM 1377 CG LYS A 156 10.644 37.159 75.476 1.00 42.67 C ATOM 1378 CD LYS A 156 10.245 36.464 76.765 1.00 45.26 C ATOM 1379 H LYS A 156 13.433 37.814 73.855 1.00 0.00 H ATOM 1380 N ALA A 157 13.479 41.012 74.170 1.00 36.10 N ATOM 1381 CA ALA A 157 14.163 42.247 74.515 1.00 36.93 C ATOM 1382 C ALA A 157 13.242 43.445 74.317 1.00 37.34 C ATOM 1383 O ALA A 157 12.357 43.444 73.456 1.00 39.07 O ATOM 1384 CB ALA A 157 15.425 42.417 73.667 1.00 34.69 C ATOM 1385 H ALA A 157 13.692 40.548 73.264 1.00 0.00 H ATOM 1386 N THR A 158 13.456 44.473 75.131 1.00 39.10 N ATOM 1387 CA THR A 158 12.730 45.725 74.994 1.00 39.96 C ATOM 1388 C THR A 158 13.454 46.647 74.018 1.00 41.02 C ATOM 1389 O THR A 158 14.649 46.495 73.750 1.00 41.45 O ATOM 1390 CB THR A 158 12.571 46.412 76.352 1.00 41.16 C ATOM 1391 OG1 THR A 158 13.857 46.807 76.843 1.00 43.65 O ATOM 1392 CG2 THR A 158 11.931 45.466 77.355 1.00 40.91 C ATOM 1393 HG1 THR A 158 14.431 46.006 76.943 1.00 0.00 H ATOM 1394 H THR A 158 14.163 44.379 75.888 1.00 0.00 H ATOM 1395 N GLN A 159 12.706 47.612 73.477 1.00 41.13 N ATOM 1396 CA GLN A 159 13.293 48.544 72.520 1.00 42.25 C ATOM 1397 C GLN A 159 14.414 49.358 73.149 1.00 46.51 C ATOM 1398 O GLN A 159 15.393 49.695 72.472 1.00 48.26 O ATOM 1399 CB GLN A 159 12.215 49.468 71.954 1.00 45.66 C ATOM 1400 CG GLN A 159 12.684 50.297 70.769 1.00 48.46 C ATOM 1401 CD GLN A 159 13.167 49.436 69.617 1.00 50.80 C ATOM 1402 OE1 GLN A 159 12.491 48.492 69.207 1.00 51.98 O ATOM 1403 NE2 GLN A 159 14.346 49.753 69.094 1.00 51.42 N ATOM 1404 HE22 GLN A 159 14.883 50.559 69.472 1.00 0.00 H ATOM 1405 HE21 GLN A 159 14.732 49.195 68.306 1.00 0.00 H ATOM 1406 H GLN A 159 11.703 47.699 73.738 1.00 0.00 H ATOM 1407 N GLU A 160 14.291 49.686 74.437 1.00 49.07 N ATOM 1408 CA GLU A 160 15.378 50.367 75.131 1.00 49.22 C ATOM 1409 C GLU A 160 16.610 49.476 75.226 1.00 47.84 C ATOM 1410 O GLU A 160 17.738 49.948 75.046 1.00 48.62 O ATOM 1411 CB GLU A 160 14.922 50.804 76.523 1.00 50.30 C ATOM 1412 H GLU A 160 13.415 49.455 74.948 1.00 0.00 H ATOM 1413 N GLU A 161 16.414 48.183 75.499 1.00 46.37 N ATOM 1414 CA GLU A 161 17.544 47.261 75.548 1.00 45.36 C ATOM 1415 C GLU A 161 18.220 47.126 74.189 1.00 46.58 C ATOM 1416 O GLU A 161 19.438 46.924 74.119 1.00 48.04 O ATOM 1417 CB GLU A 161 17.087 45.892 76.055 1.00 44.41 C ATOM 1418 CG GLU A 161 16.876 45.821 77.560 1.00 46.22 C ATOM 1419 CD GLU A 161 16.224 44.522 77.994 1.00 47.94 C ATOM 1420 OE1 GLU A 161 15.322 44.040 77.277 1.00 49.07 O ATOM 1421 OE2 GLU A 161 16.618 43.981 79.049 1.00 49.64 O ATOM 1422 H GLU A 161 15.451 47.832 75.677 1.00 0.00 H ATOM 1423 N GLU A 162 17.454 47.236 73.103 1.00 45.48 N ATOM 1424 CA GLU A 162 18.047 47.200 71.771 1.00 42.74 C ATOM 1425 C GLU A 162 18.753 48.509 71.437 1.00 42.12 C ATOM 1426 O GLU A 162 19.868 48.495 70.904 1.00 42.76 O ATOM 1427 CB GLU A 162 16.975 46.893 70.725 1.00 41.32 C ATOM 1428 CG GLU A 162 17.454 47.050 69.293 1.00 41.24 C ATOM 1429 CD GLU A 162 16.432 46.580 68.279 1.00 43.61 C ATOM 1430 OE1 GLU A 162 16.257 45.352 68.134 1.00 46.34 O ATOM 1431 OE2 GLU A 162 15.799 47.438 67.629 1.00 43.90 O ATOM 1432 H GLU A 162 16.425 47.348 73.207 1.00 0.00 H ATOM 1433 N ASP A 163 18.119 49.644 71.746 1.00 40.55 N ATOM 1434 CA ASP A 163 18.720 50.940 71.444 1.00 41.67 C ATOM 1435 C ASP A 163 20.046 51.130 72.167 1.00 44.05 C ATOM 1436 O ASP A 163 20.955 51.778 71.634 1.00 46.61 O ATOM 1437 CB ASP A 163 17.755 52.070 71.811 1.00 44.81 C ATOM 1438 CG ASP A 163 16.546 52.128 70.897 1.00 47.14 C ATOM 1439 OD1 ASP A 163 16.643 51.654 69.746 1.00 47.38 O ATOM 1440 OD2 ASP A 163 15.499 52.656 71.328 1.00 49.52 O ATOM 1441 H ASP A 163 17.187 49.604 72.207 1.00 0.00 H ATOM 1442 N LEU A 164 20.177 50.582 73.377 1.00 42.48 N ATOM 1443 CA LEU A 164 21.445 50.670 74.092 1.00 41.84 C ATOM 1444 C LEU A 164 22.496 49.766 73.461 1.00 37.00 C ATOM 1445 O LEU A 164 23.681 50.115 73.425 1.00 37.63 O ATOM 1446 CB LEU A 164 21.244 50.315 75.565 1.00 42.73 C ATOM 1447 CG LEU A 164 20.317 51.245 76.348 1.00 44.79 C ATOM 1448 CD1 LEU A 164 20.283 50.865 77.822 1.00 39.46 C ATOM 1449 CD2 LEU A 164 20.742 52.694 76.169 1.00 40.13 C ATOM 1450 H LEU A 164 19.371 50.090 73.812 1.00 0.00 H ATOM 1451 N GLU A 165 22.082 48.602 72.958 1.00 33.41 N ATOM 1452 CA GLU A 165 23.026 47.708 72.295 1.00 32.37 C ATOM 1453 C GLU A 165 23.526 48.311 70.989 1.00 35.74 C ATOM 1454 O GLU A 165 24.733 48.325 70.724 1.00 38.45 O ATOM 1455 CB GLU A 165 22.379 46.342 72.051 1.00 29.77 C ATOM 1456 CG GLU A 165 23.218 45.385 71.207 1.00 28.04 C ATOM 1457 CD GLU A 165 24.468 44.890 71.922 1.00 30.06 C ATOM 1458 OE1 GLU A 165 24.622 45.151 73.134 1.00 32.89 O ATOM 1459 OE2 GLU A 165 25.300 44.228 71.266 1.00 30.00 O ATOM 1460 H GLU A 165 21.081 48.330 73.039 1.00 0.00 H ATOM 1461 N MET A 166 22.610 48.821 70.160 1.00 36.27 N ATOM 1462 CA MET A 166 23.015 49.433 68.898 1.00 34.85 C ATOM 1463 C MET A 166 23.862 50.677 69.127 1.00 36.53 C ATOM 1464 O MET A 166 24.746 50.984 68.319 1.00 37.13 O ATOM 1465 CB MET A 166 21.784 49.769 68.058 1.00 34.71 C ATOM 1466 CG MET A 166 20.903 48.565 67.784 1.00 35.59 C ATOM 1467 SD MET A 166 21.814 47.240 66.972 1.00 36.39 S ATOM 1468 CE MET A 166 20.886 45.811 67.521 1.00 34.31 C ATOM 1469 H MET A 166 21.603 48.782 70.416 1.00 0.00 H ATOM 1470 N ARG A 167 23.608 51.406 70.216 1.00 39.75 N ATOM 1471 CA ARG A 167 24.498 52.497 70.596 1.00 44.96 C ATOM 1472 C ARG A 167 25.878 51.975 70.972 1.00 48.23 C ATOM 1473 O ARG A 167 26.886 52.643 70.715 1.00 49.88 O ATOM 1474 CB ARG A 167 23.895 53.291 71.753 1.00 46.82 C ATOM 1475 H ARG A 167 22.771 51.195 70.796 1.00 0.00 H ATOM 1476 N TRP A 168 25.943 50.789 71.580 1.00 47.59 N ATOM 1477 CA TRP A 168 27.238 50.196 71.895 1.00 46.25 C ATOM 1478 C TRP A 168 27.943 49.713 70.634 1.00 47.12 C ATOM 1479 O TRP A 168 29.174 49.780 70.542 1.00 49.48 O ATOM 1480 CB TRP A 168 27.063 49.047 72.886 1.00 42.07 C ATOM 1481 CG TRP A 168 28.358 48.503 73.408 1.00 43.35 C ATOM 1482 CD1 TRP A 168 29.000 48.876 74.552 1.00 46.39 C ATOM 1483 CD2 TRP A 168 29.172 47.492 72.801 1.00 42.18 C ATOM 1484 NE1 TRP A 168 30.162 48.157 74.698 1.00 46.72 N ATOM 1485 CE2 TRP A 168 30.291 47.301 73.636 1.00 45.61 C ATOM 1486 CE3 TRP A 168 29.063 46.727 71.635 1.00 42.24 C ATOM 1487 CZ2 TRP A 168 31.293 46.379 73.342 1.00 48.89 C ATOM 1488 CZ3 TRP A 168 30.058 45.814 71.345 1.00 44.93 C ATOM 1489 CH2 TRP A 168 31.159 45.647 72.194 1.00 48.33 C ATOM 1490 HE1 TRP A 168 30.834 48.248 75.486 1.00 0.00 H ATOM 1491 H TRP A 168 25.068 50.286 71.830 1.00 0.00 H ATOM 1492 N ILE A 169 27.180 49.225 69.652 1.00 43.66 N ATOM 1493 CA ILE A 169 27.771 48.793 68.389 1.00 43.19 C ATOM 1494 C ILE A 169 28.414 49.975 67.678 1.00 43.43 C ATOM 1495 O ILE A 169 29.540 49.885 67.176 1.00 43.47 O ATOM 1496 CB ILE A 169 26.711 48.114 67.502 1.00 43.52 C ATOM 1497 CG1 ILE A 169 26.030 46.968 68.249 1.00 44.71 C ATOM 1498 CG2 ILE A 169 27.347 47.600 66.225 1.00 42.41 C ATOM 1499 CD1 ILE A 169 26.980 45.909 68.718 1.00 45.83 C ATOM 1500 H ILE A 169 26.152 49.152 69.789 1.00 0.00 H ATOM 1501 N ARG A 170 27.704 51.106 67.625 1.00 46.70 N ATOM 1502 CA ARG A 170 28.229 52.277 66.932 1.00 51.57 C ATOM 1503 C ARG A 170 29.463 52.842 67.624 1.00 58.08 C ATOM 1504 O ARG A 170 30.337 53.409 66.959 1.00 63.55 O ATOM 1505 CB ARG A 170 27.146 53.351 66.816 1.00 52.50 C ATOM 1506 CG ARG A 170 26.099 53.066 65.750 1.00 52.47 C ATOM 1507 CD ARG A 170 25.144 54.236 65.574 1.00 56.39 C ATOM 1508 NE ARG A 170 24.024 54.185 66.510 1.00 59.02 N ATOM 1509 CZ ARG A 170 22.831 53.676 66.218 1.00 60.09 C ATOM 1510 NH1 ARG A 170 22.600 53.175 65.013 1.00 60.04 N ATOM 1511 NH2 ARG A 170 21.868 53.668 67.129 1.00 61.35 N ATOM 1512 HE ARG A 170 24.169 54.571 67.465 1.00 0.00 H ATOM 1513 HH12 ARG A 170 21.666 52.777 64.785 1.00 0.00 H ATOM 1514 HH11 ARG A 170 23.352 53.180 64.295 1.00 0.00 H ATOM 1515 HH22 ARG A 170 20.936 53.269 66.897 1.00 0.00 H ATOM 1516 HH21 ARG A 170 22.044 54.061 68.076 1.00 0.00 H ATOM 1517 H ARG A 170 26.770 51.151 68.081 1.00 0.00 H ATOM 1518 N ASP A 171 29.560 52.690 68.945 1.00 58.57 N ATOM 1519 CA ASP A 171 30.684 53.267 69.676 1.00 61.02 C ATOM 1520 C ASP A 171 31.899 52.347 69.671 1.00 63.03 C ATOM 1521 O ASP A 171 33.037 52.823 69.589 1.00 67.72 O ATOM 1522 CB ASP A 171 30.266 53.586 71.112 1.00 61.63 C ATOM 1523 CG ASP A 171 29.218 54.677 71.185 1.00 63.45 C ATOM 1524 OD1 ASP A 171 28.685 55.063 70.125 1.00 64.88 O ATOM 1525 OD2 ASP A 171 28.922 55.145 72.305 1.00 63.91 O ATOM 1526 H ASP A 171 28.830 52.156 69.458 1.00 0.00 H ATOM 1527 N ASN A 172 31.684 51.032 69.753 1.00 59.97 N ATOM 1528 CA ASN A 172 32.783 50.089 69.903 1.00 59.60 C ATOM 1529 C ASN A 172 33.114 49.307 68.640 1.00 57.85 C ATOM 1530 O ASN A 172 34.198 48.718 68.569 1.00 59.87 O ATOM 1531 CB ASN A 172 32.480 49.095 71.033 1.00 60.02 C ATOM 1532 CG ASN A 172 32.298 49.777 72.374 1.00 62.46 C ATOM 1533 OD1 ASN A 172 31.594 50.782 72.482 1.00 64.22 O ATOM 1534 ND2 ASN A 172 32.942 49.240 73.404 1.00 62.91 N ATOM 1535 HD22 ASN A 172 33.526 48.390 73.267 1.00 0.00 H ATOM 1536 HD21 ASN A 172 32.862 49.669 74.348 1.00 0.00 H ATOM 1537 H ASN A 172 30.709 50.673 69.709 1.00 0.00 H ATOM 1538 N LEU A 173 32.225 49.283 67.648 1.00 53.91 N ATOM 1539 CA LEU A 173 32.496 48.540 66.423 1.00 51.61 C ATOM 1540 C LEU A 173 32.518 49.467 65.214 1.00 54.90 C ATOM 1541 O LEU A 173 32.826 50.657 65.342 1.00 57.51 O ATOM 1542 CB LEU A 173 31.461 47.429 66.231 1.00 46.09 C ATOM 1543 CG LEU A 173 31.357 46.406 67.365 1.00 44.52 C ATOM 1544 CD1 LEU A 173 30.378 45.298 67.006 1.00 42.95 C ATOM 1545 CD2 LEU A 173 32.725 45.831 67.707 1.00 44.35 C ATOM 1546 H LEU A 173 31.328 49.800 67.748 1.00 0.00 H ATOM 1547 N ASN A 174 32.199 48.932 64.034 1.00 54.65 N ATOM 1548 CA ASN A 174 32.195 49.690 62.783 1.00 56.39 C ATOM 1549 C ASN A 174 30.796 49.635 62.185 1.00 56.93 C ATOM 1550 O ASN A 174 30.481 48.730 61.396 1.00 53.30 O ATOM 1551 CB ASN A 174 33.236 49.145 61.807 1.00 54.96 C ATOM 1552 CG ASN A 174 34.656 49.345 62.298 1.00 56.44 C ATOM 1553 OD1 ASN A 174 34.972 50.360 62.920 1.00 60.64 O ATOM 1554 ND2 ASN A 174 35.520 48.376 62.023 1.00 54.38 N ATOM 1555 HD22 ASN A 174 35.209 47.536 61.495 1.00 0.00 H ATOM 1556 HD21 ASN A 174 36.509 48.457 62.336 1.00 0.00 H ATOM 1557 H ASN A 174 31.940 47.925 64.002 1.00 0.00 H ATOM 1558 N PRO A 175 29.927 50.583 62.524 1.00 65.57 N ATOM 1559 CA PRO A 175 28.546 50.527 62.036 1.00 62.83 C ATOM 1560 C PRO A 175 28.423 51.015 60.602 1.00 60.82 C ATOM 1561 O PRO A 175 29.086 51.967 60.183 1.00 61.99 O ATOM 1562 CB PRO A 175 27.801 51.457 62.999 1.00 66.96 C ATOM 1563 CG PRO A 175 28.826 52.461 63.383 1.00 70.92 C ATOM 1564 CD PRO A 175 30.148 51.731 63.421 1.00 69.22 C ATOM 1565 N ILE A 176 27.557 50.344 59.847 1.00 55.97 N ATOM 1566 CA ILE A 176 27.207 50.736 58.488 1.00 53.96 C ATOM 1567 C ILE A 176 25.689 50.828 58.435 1.00 52.15 C ATOM 1568 O ILE A 176 24.998 49.809 58.555 1.00 50.87 O ATOM 1569 CB ILE A 176 27.730 49.747 57.437 1.00 49.91 C ATOM 1570 CG1 ILE A 176 29.222 49.483 57.644 1.00 47.63 C ATOM 1571 CG2 ILE A 176 27.468 50.278 56.034 1.00 49.68 C ATOM 1572 CD1 ILE A 176 29.790 48.424 56.727 1.00 45.47 C ATOM 1573 H ILE A 176 27.107 49.496 60.247 1.00 0.00 H ATOM 1574 N GLU A 177 25.169 52.041 58.262 1.00 50.34 N ATOM 1575 CA GLU A 177 23.732 52.273 58.224 1.00 49.13 C ATOM 1576 C GLU A 177 23.363 52.991 56.936 1.00 50.83 C ATOM 1577 O GLU A 177 23.994 53.989 56.572 1.00 54.30 O ATOM 1578 CB GLU A 177 23.270 53.082 59.440 1.00 50.38 C ATOM 1579 CG GLU A 177 23.145 52.257 60.709 1.00 50.60 C ATOM 1580 CD GLU A 177 22.664 53.072 61.890 1.00 54.06 C ATOM 1581 OE1 GLU A 177 23.394 53.992 62.315 1.00 56.30 O ATOM 1582 OE2 GLU A 177 21.552 52.799 62.388 1.00 55.10 O ATOM 1583 H GLU A 177 25.811 52.851 58.150 1.00 0.00 H ATOM 1584 N ASP A 178 22.340 52.481 56.255 1.00 51.03 N ATOM 1585 CA ASP A 178 21.861 53.035 54.997 1.00 56.39 C ATOM 1586 C ASP A 178 20.342 53.009 55.022 1.00 61.78 C ATOM 1587 O ASP A 178 19.746 51.971 55.320 1.00 62.13 O ATOM 1588 CB ASP A 178 22.409 52.235 53.806 1.00 57.24 C ATOM 1589 CG ASP A 178 21.965 52.786 52.462 1.00 64.81 C ATOM 1590 OD1 ASP A 178 21.327 53.859 52.417 1.00 69.87 O ATOM 1591 OD2 ASP A 178 22.273 52.141 51.438 1.00 66.41 O ATOM 1592 H ASP A 178 21.858 51.644 56.641 1.00 0.00 H ATOM 1593 N LYS A 179 19.718 54.149 54.714 1.00 69.67 N ATOM 1594 CA LYS A 179 18.265 54.248 54.804 1.00 74.08 C ATOM 1595 C LYS A 179 17.551 53.308 53.841 1.00 73.02 C ATOM 1596 O LYS A 179 16.363 53.030 54.034 1.00 72.63 O ATOM 1597 CB LYS A 179 17.816 55.689 54.552 1.00 82.75 C ATOM 1598 CG LYS A 179 17.353 56.436 55.798 1.00 88.34 C ATOM 1599 CD LYS A 179 18.489 56.657 56.785 1.00 88.78 C ATOM 1600 CE LYS A 179 18.062 57.588 57.911 1.00 91.53 C ATOM 1601 NZ LYS A 179 17.632 58.917 57.393 1.00 96.78 N ATOM 1602 HZ1 LYS A 179 18.422 59.361 56.882 1.00 0.00 H ATOM 1603 HZ2 LYS A 179 16.826 58.792 56.747 1.00 0.00 H ATOM 1604 HZ3 LYS A 179 17.349 59.523 58.189 1.00 0.00 H ATOM 1605 H LYS A 179 20.273 54.974 54.407 1.00 0.00 H ATOM 1606 N ARG A 180 18.241 52.810 52.813 1.00 72.24 N ATOM 1607 CA ARG A 180 17.621 51.878 51.880 1.00 71.95 C ATOM 1608 C ARG A 180 17.547 50.458 52.428 1.00 67.11 C ATOM 1609 O ARG A 180 16.792 49.641 51.889 1.00 65.75 O ATOM 1610 CB ARG A 180 18.380 51.870 50.550 1.00 76.76 C ATOM 1611 CG ARG A 180 19.500 50.843 50.486 1.00 78.40 C ATOM 1612 CD ARG A 180 20.314 50.975 49.209 1.00 83.98 C ATOM 1613 NE ARG A 180 21.465 50.075 49.215 1.00 83.23 N ATOM 1614 CZ ARG A 180 21.562 48.977 48.472 1.00 82.02 C ATOM 1615 NH1 ARG A 180 20.581 48.641 47.646 1.00 83.60 N ATOM 1616 NH2 ARG A 180 22.646 48.219 48.550 1.00 79.51 N ATOM 1617 HE ARG A 180 22.261 50.309 49.842 1.00 0.00 H ATOM 1618 HH12 ARG A 180 20.661 47.781 47.066 1.00 0.00 H ATOM 1619 HH11 ARG A 180 19.732 49.237 47.578 1.00 0.00 H ATOM 1620 HH22 ARG A 180 22.723 47.360 47.969 1.00 0.00 H ATOM 1621 HH21 ARG A 180 23.420 48.483 49.192 1.00 0.00 H ATOM 1622 H ARG A 180 19.233 53.090 52.676 1.00 0.00 H ATOM 1623 N VAL A 181 18.307 50.146 53.478 1.00 61.85 N ATOM 1624 CA VAL A 181 18.344 48.806 54.057 1.00 56.77 C ATOM 1625 C VAL A 181 18.283 48.936 55.574 1.00 53.48 C ATOM 1626 O VAL A 181 19.182 49.520 56.189 1.00 55.22 O ATOM 1627 CB VAL A 181 19.596 48.022 53.623 1.00 51.56 C ATOM 1628 CG1 VAL A 181 20.820 48.927 53.601 1.00 50.39 C ATOM 1629 CG2 VAL A 181 19.822 46.830 54.536 1.00 48.41 C ATOM 1630 H VAL A 181 18.899 50.888 53.903 1.00 0.00 H ATOM 1631 N ALA A 182 17.233 48.386 56.178 1.00 51.14 N ATOM 1632 CA ALA A 182 16.992 48.576 57.600 1.00 47.01 C ATOM 1633 C ALA A 182 18.079 47.915 58.444 1.00 44.93 C ATOM 1634 O ALA A 182 18.815 47.033 57.990 1.00 42.71 O ATOM 1635 CB ALA A 182 15.623 48.019 57.988 1.00 45.61 C ATOM 1636 H ALA A 182 16.571 47.808 55.622 1.00 0.00 H ATOM 1637 N GLY A 183 18.177 48.366 59.693 1.00 42.67 N ATOM 1638 CA GLY A 183 19.062 47.752 60.660 1.00 42.67 C ATOM 1639 C GLY A 183 20.458 48.342 60.670 1.00 43.21 C ATOM 1640 O GLY A 183 20.821 49.220 59.882 1.00 46.06 O ATOM 1641 H GLY A 183 17.601 49.183 59.982 1.00 0.00 H ATOM 1642 N LEU A 184 21.256 47.834 61.605 1.00 42.04 N ATOM 1643 CA LEU A 184 22.653 48.212 61.764 1.00 40.77 C ATOM 1644 C LEU A 184 23.521 47.063 61.271 1.00 40.14 C ATOM 1645 O LEU A 184 23.334 45.917 61.692 1.00 40.44 O ATOM 1646 CB LEU A 184 22.962 48.539 63.229 1.00 40.67 C ATOM 1647 CG LEU A 184 24.146 49.446 63.579 1.00 42.21 C ATOM 1648 CD1 LEU A 184 24.065 49.880 65.035 1.00 41.67 C ATOM 1649 CD2 LEU A 184 25.476 48.763 63.310 1.00 44.67 C ATOM 1650 H LEU A 184 20.860 47.128 62.258 1.00 0.00 H ATOM 1651 N TRP A 185 24.469 47.368 60.389 1.00 39.24 N ATOM 1652 CA TRP A 185 25.283 46.355 59.733 1.00 35.99 C ATOM 1653 C TRP A 185 26.749 46.533 60.103 1.00 37.80 C ATOM 1654 O TRP A 185 27.234 47.662 60.236 1.00 40.98 O ATOM 1655 CB TRP A 185 25.105 46.415 58.214 1.00 33.07 C ATOM 1656 CG TRP A 185 23.715 46.067 57.776 1.00 32.53 C ATOM 1657 CD1 TRP A 185 22.580 46.793 57.997 1.00 33.20 C ATOM 1658 CD2 TRP A 185 23.311 44.904 57.042 1.00 32.85 C ATOM 1659 NE1 TRP A 185 21.495 46.154 57.448 1.00 33.17 N ATOM 1660 CE2 TRP A 185 21.916 44.993 56.855 1.00 32.46 C ATOM 1661 CE3 TRP A 185 23.992 43.798 56.525 1.00 32.75 C ATOM 1662 CZ2 TRP A 185 21.191 44.016 56.173 1.00 30.77 C ATOM 1663 CZ3 TRP A 185 23.269 42.830 55.848 1.00 30.85 C ATOM 1664 CH2 TRP A 185 21.885 42.946 55.679 1.00 30.22 C ATOM 1665 HE1 TRP A 185 20.513 46.496 57.478 1.00 0.00 H ATOM 1666 H TRP A 185 24.635 48.369 60.159 1.00 0.00 H ATOM 1667 N VAL A 186 27.449 45.414 60.266 1.00 36.58 N ATOM 1668 CA VAL A 186 28.840 45.412 60.715 1.00 37.34 C ATOM 1669 C VAL A 186 29.674 44.533 59.788 1.00 38.43 C ATOM 1670 O VAL A 186 29.135 43.608 59.163 1.00 37.61 O ATOM 1671 CB VAL A 186 28.949 44.936 62.173 1.00 35.64 C ATOM 1672 CG1 VAL A 186 28.274 45.925 63.108 1.00 34.80 C ATOM 1673 CG2 VAL A 186 28.341 43.552 62.331 1.00 32.79 C ATOM 1674 H VAL A 186 26.988 44.503 60.066 1.00 0.00 H ATOM 1675 N PRO A 187 30.977 44.777 59.667 1.00 39.54 N ATOM 1676 CA PRO A 187 31.824 43.924 58.822 1.00 37.93 C ATOM 1677 C PRO A 187 31.965 42.533 59.415 1.00 35.98 C ATOM 1678 O PRO A 187 31.601 42.310 60.580 1.00 34.31 O ATOM 1679 CB PRO A 187 33.168 44.670 58.806 1.00 39.69 C ATOM 1680 CG PRO A 187 33.152 45.511 60.034 1.00 41.05 C ATOM 1681 CD PRO A 187 31.725 45.917 60.225 1.00 40.48 C ATOM 1682 N PRO A 188 32.478 41.567 58.644 1.00 36.90 N ATOM 1683 CA PRO A 188 32.563 40.187 59.157 1.00 39.08 C ATOM 1684 C PRO A 188 33.353 40.049 60.446 1.00 44.13 C ATOM 1685 O PRO A 188 33.022 39.187 61.271 1.00 46.01 O ATOM 1686 CB PRO A 188 33.238 39.432 58.005 1.00 38.65 C ATOM 1687 CG PRO A 188 32.884 40.211 56.794 1.00 36.98 C ATOM 1688 CD PRO A 188 32.859 41.647 57.223 1.00 36.15 C ATOM 1689 N ALA A 189 34.392 40.864 60.646 1.00 46.00 N ATOM 1690 CA ALA A 189 35.172 40.774 61.876 1.00 45.21 C ATOM 1691 C ALA A 189 34.331 41.145 63.090 1.00 45.33 C ATOM 1692 O ALA A 189 34.390 40.472 64.126 1.00 46.53 O ATOM 1693 CB ALA A 189 36.409 41.667 61.781 1.00 42.82 C ATOM 1694 H ALA A 189 34.646 41.566 59.922 1.00 0.00 H ATOM 1695 N ASP A 190 33.537 42.213 62.982 1.00 46.70 N ATOM 1696 CA ASP A 190 32.675 42.604 64.090 1.00 46.85 C ATOM 1697 C ASP A 190 31.522 41.627 64.275 1.00 44.85 C ATOM 1698 O ASP A 190 31.039 41.448 65.399 1.00 45.60 O ATOM 1699 CB ASP A 190 32.139 44.018 63.869 1.00 49.96 C ATOM 1700 CG ASP A 190 33.241 45.026 63.614 1.00 56.46 C ATOM 1701 OD1 ASP A 190 34.425 44.674 63.793 1.00 60.70 O ATOM 1702 OD2 ASP A 190 32.923 46.175 63.242 1.00 58.94 O ATOM 1703 H ASP A 190 33.534 42.769 62.103 1.00 0.00 H ATOM 1704 N ALA A 191 31.070 40.988 63.193 1.00 42.73 N ATOM 1705 CA ALA A 191 29.964 40.042 63.303 1.00 40.14 C ATOM 1706 C ALA A 191 30.362 38.820 64.122 1.00 38.15 C ATOM 1707 O ALA A 191 29.558 38.298 64.903 1.00 36.94 O ATOM 1708 CB ALA A 191 29.486 39.631 61.910 1.00 41.98 C ATOM 1709 H ALA A 191 31.509 41.165 62.267 1.00 0.00 H ATOM 1710 N LEU A 192 31.601 38.352 63.959 1.00 34.60 N ATOM 1711 CA LEU A 192 32.093 37.234 64.754 1.00 34.74 C ATOM 1712 C LEU A 192 32.359 37.625 66.201 1.00 36.57 C ATOM 1713 O LEU A 192 32.313 36.762 67.084 1.00 40.16 O ATOM 1714 CB LEU A 192 33.361 36.663 64.122 1.00 36.02 C ATOM 1715 CG LEU A 192 33.192 35.980 62.766 1.00 35.90 C ATOM 1716 CD1 LEU A 192 34.548 35.625 62.173 1.00 40.20 C ATOM 1717 CD2 LEU A 192 32.324 34.735 62.897 1.00 35.86 C ATOM 1718 H LEU A 192 32.226 38.792 63.253 1.00 0.00 H ATOM 1719 N ALA A 193 32.628 38.904 66.467 1.00 36.04 N ATOM 1720 CA ALA A 193 32.756 39.350 67.849 1.00 36.59 C ATOM 1721 C ALA A 193 31.402 39.377 68.541 1.00 37.02 C ATOM 1722 O ALA A 193 31.279 38.953 69.696 1.00 40.10 O ATOM 1723 CB ALA A 193 33.408 40.730 67.907 1.00 36.10 C ATOM 1724 H ALA A 193 32.746 39.583 65.688 1.00 0.00 H ATOM 1725 N LEU A 194 30.373 39.879 67.851 1.00 35.23 N ATOM 1726 CA LEU A 194 29.021 39.831 68.397 1.00 34.57 C ATOM 1727 C LEU A 194 28.546 38.397 68.580 1.00 35.23 C ATOM 1728 O LEU A 194 27.774 38.109 69.502 1.00 36.26 O ATOM 1729 CB LEU A 194 28.059 40.592 67.486 1.00 31.89 C ATOM 1730 CG LEU A 194 28.244 42.105 67.472 1.00 28.46 C ATOM 1731 CD1 LEU A 194 27.186 42.777 66.609 1.00 27.02 C ATOM 1732 CD2 LEU A 194 28.192 42.619 68.897 1.00 33.68 C ATOM 1733 H LEU A 194 30.538 40.307 66.918 1.00 0.00 H ATOM 1734 N ALA A 195 28.990 37.490 67.706 1.00 34.31 N ATOM 1735 CA ALA A 195 28.649 36.081 67.853 1.00 35.76 C ATOM 1736 C ALA A 195 29.189 35.508 69.156 1.00 40.61 C ATOM 1737 O ALA A 195 28.569 34.615 69.745 1.00 43.92 O ATOM 1738 CB ALA A 195 29.183 35.292 66.658 1.00 35.28 C ATOM 1739 H ALA A 195 29.587 37.793 66.910 1.00 0.00 H ATOM 1740 N LYS A 196 30.337 36.005 69.621 1.00 41.95 N ATOM 1741 CA LYS A 196 30.878 35.547 70.896 1.00 43.52 C ATOM 1742 C LYS A 196 30.042 36.056 72.064 1.00 42.30 C ATOM 1743 O LYS A 196 29.790 35.315 73.022 1.00 45.08 O ATOM 1744 CB LYS A 196 32.335 35.988 71.040 1.00 47.82 C ATOM 1745 CG LYS A 196 33.333 34.848 70.924 1.00 52.26 C ATOM 1746 CD LYS A 196 34.766 35.331 71.085 1.00 58.30 C ATOM 1747 CE LYS A 196 35.158 36.299 69.981 1.00 59.31 C ATOM 1748 NZ LYS A 196 36.618 36.593 70.001 1.00 62.57 N ATOM 1749 HZ1 LYS A 196 36.872 37.017 70.916 1.00 0.00 H ATOM 1750 HZ2 LYS A 196 37.150 35.709 69.867 1.00 0.00 H ATOM 1751 HZ3 LYS A 196 36.847 37.257 69.234 1.00 0.00 H ATOM 1752 H LYS A 196 30.849 36.724 69.071 1.00 0.00 H ATOM 1753 N ASP A 197 29.602 37.314 72.003 1.00 37.00 N ATOM 1754 CA ASP A 197 28.757 37.847 73.067 1.00 37.25 C ATOM 1755 C ASP A 197 27.393 37.168 73.078 1.00 37.58 C ATOM 1756 O ASP A 197 26.867 36.836 74.147 1.00 40.73 O ATOM 1757 CB ASP A 197 28.595 39.359 72.909 1.00 37.66 C ATOM 1758 CG ASP A 197 29.921 40.087 72.831 1.00 43.78 C ATOM 1759 OD1 ASP A 197 30.947 39.510 73.249 1.00 49.44 O ATOM 1760 OD2 ASP A 197 29.934 41.242 72.354 1.00 43.33 O ATOM 1761 H ASP A 197 29.862 37.916 71.196 1.00 0.00 H ATOM 1762 N TYR A 198 26.809 36.950 71.901 1.00 37.12 N ATOM 1763 CA TYR A 198 25.473 36.383 71.781 1.00 35.39 C ATOM 1764 C TYR A 198 25.468 34.861 71.767 1.00 38.81 C ATOM 1765 O TYR A 198 24.387 34.265 71.695 1.00 38.44 O ATOM 1766 CB TYR A 198 24.789 36.893 70.507 1.00 33.23 C ATOM 1767 CG TYR A 198 24.630 38.395 70.415 1.00 32.38 C ATOM 1768 CD1 TYR A 198 24.778 39.207 71.532 1.00 33.95 C ATOM 1769 CD2 TYR A 198 24.321 38.998 69.204 1.00 33.28 C ATOM 1770 CE1 TYR A 198 24.631 40.579 71.441 1.00 35.03 C ATOM 1771 CE2 TYR A 198 24.171 40.364 69.104 1.00 35.28 C ATOM 1772 CZ TYR A 198 24.326 41.151 70.223 1.00 36.30 C ATOM 1773 OH TYR A 198 24.174 42.512 70.118 1.00 37.41 O ATOM 1774 HH TYR A 198 24.317 42.928 71.005 1.00 0.00 H ATOM 1775 H TYR A 198 27.328 37.194 71.033 1.00 0.00 H ATOM 1776 N SER A 199 26.640 34.225 71.835 1.00 42.16 N ATOM 1777 CA SER A 199 26.767 32.771 71.722 1.00 44.18 C ATOM 1778 C SER A 199 26.188 32.278 70.396 1.00 44.50 C ATOM 1779 O SER A 199 25.445 31.295 70.338 1.00 47.88 O ATOM 1780 CB SER A 199 26.114 32.060 72.912 1.00 43.16 C ATOM 1781 OG SER A 199 26.309 30.659 72.841 1.00 44.03 O ATOM 1782 HG SER A 199 25.906 30.313 72.006 1.00 0.00 H ATOM 1783 H SER A 199 27.503 34.789 71.975 1.00 0.00 H ATOM 1784 N MET A 200 26.547 32.975 69.317 1.00 42.50 N ATOM 1785 CA MET A 200 26.056 32.666 67.978 1.00 39.29 C ATOM 1786 C MET A 200 27.182 32.297 67.019 1.00 39.46 C ATOM 1787 O MET A 200 26.978 32.318 65.801 1.00 38.85 O ATOM 1788 CB MET A 200 25.265 33.849 67.415 1.00 37.46 C ATOM 1789 CG MET A 200 24.012 34.206 68.197 1.00 37.69 C ATOM 1790 SD MET A 200 23.133 35.583 67.431 1.00 36.40 S ATOM 1791 CE MET A 200 23.008 34.988 65.746 1.00 34.47 C ATOM 1792 H MET A 200 27.204 33.772 69.435 1.00 0.00 H ATOM 1793 N THR A 201 28.362 31.958 67.542 1.00 40.29 N ATOM 1794 CA THR A 201 29.526 31.693 66.696 1.00 41.09 C ATOM 1795 C THR A 201 29.276 30.649 65.613 1.00 41.84 C ATOM 1796 O THR A 201 29.612 30.919 64.450 1.00 42.10 O ATOM 1797 CB THR A 201 30.722 31.294 67.573 1.00 44.07 C ATOM 1798 OG1 THR A 201 30.905 32.270 68.608 1.00 46.97 O ATOM 1799 CG2 THR A 201 31.992 31.207 66.738 1.00 41.98 C ATOM 1800 HG1 THR A 201 30.088 32.316 69.165 1.00 0.00 H ATOM 1801 H THR A 201 28.456 31.880 68.575 1.00 0.00 H ATOM 1802 N PRO A 202 28.705 29.470 65.897 1.00 42.39 N ATOM 1803 CA PRO A 202 28.487 28.501 64.807 1.00 42.42 C ATOM 1804 C PRO A 202 27.544 29.001 63.730 1.00 41.56 C ATOM 1805 O PRO A 202 27.648 28.571 62.576 1.00 43.03 O ATOM 1806 CB PRO A 202 27.908 27.279 65.535 1.00 43.26 C ATOM 1807 CG PRO A 202 27.314 27.828 66.777 1.00 42.18 C ATOM 1808 CD PRO A 202 28.233 28.934 67.187 1.00 41.86 C ATOM 1809 N PHE A 203 26.623 29.899 64.071 1.00 39.69 N ATOM 1810 CA PHE A 203 25.659 30.385 63.089 1.00 38.02 C ATOM 1811 C PHE A 203 26.264 31.470 62.205 1.00 39.56 C ATOM 1812 O PHE A 203 26.092 31.451 60.982 1.00 37.49 O ATOM 1813 CB PHE A 203 24.406 30.897 63.802 1.00 34.73 C ATOM 1814 CG PHE A 203 23.595 29.811 64.453 1.00 36.31 C ATOM 1815 CD1 PHE A 203 24.013 29.227 65.638 1.00 37.01 C ATOM 1816 CD2 PHE A 203 22.414 29.373 63.879 1.00 36.39 C ATOM 1817 CE1 PHE A 203 23.270 28.227 66.238 1.00 37.17 C ATOM 1818 CE2 PHE A 203 21.663 28.374 64.473 1.00 36.74 C ATOM 1819 CZ PHE A 203 22.092 27.800 65.655 1.00 36.94 C ATOM 1820 H PHE A 203 26.590 30.258 65.047 1.00 0.00 H ATOM 1821 N ILE A 204 26.977 32.423 62.807 1.00 41.98 N ATOM 1822 CA ILE A 204 27.620 33.470 62.020 1.00 31.37 C ATOM 1823 C ILE A 204 28.773 32.893 61.206 1.00 33.27 C ATOM 1824 O ILE A 204 29.016 33.308 60.066 1.00 33.08 O ATOM 1825 CB ILE A 204 28.083 34.618 62.936 1.00 32.32 C ATOM 1826 CG1 ILE A 204 26.886 35.226 63.671 1.00 28.95 C ATOM 1827 CG2 ILE A 204 28.813 35.685 62.135 1.00 30.22 C ATOM 1828 CD1 ILE A 204 25.800 35.741 62.753 1.00 27.51 C ATOM 1829 H ILE A 204 27.075 32.420 63.842 1.00 0.00 H ATOM 1830 N ASN A 205 29.492 31.918 61.770 1.00 35.46 N ATOM 1831 CA ASN A 205 30.586 31.280 61.044 1.00 37.77 C ATOM 1832 C ASN A 205 30.086 30.622 59.764 1.00 43.89 C ATOM 1833 O ASN A 205 30.749 30.688 58.722 1.00 39.15 O ATOM 1834 CB ASN A 205 31.279 30.253 61.941 1.00 40.51 C ATOM 1835 CG ASN A 205 32.598 29.771 61.372 1.00 52.94 C ATOM 1836 OD1 ASN A 205 33.191 30.422 60.512 1.00 53.63 O ATOM 1837 ND2 ASN A 205 33.070 28.627 61.857 1.00 46.34 N ATOM 1838 HD22 ASN A 205 32.535 28.110 62.584 1.00 0.00 H ATOM 1839 HD21 ASN A 205 33.975 28.249 61.510 1.00 0.00 H ATOM 1840 H ASN A 205 29.269 31.610 62.738 1.00 0.00 H ATOM 1841 N ALA A 206 28.913 29.988 59.824 1.00 42.71 N ATOM 1842 CA ALA A 206 28.343 29.352 58.643 1.00 43.36 C ATOM 1843 C ALA A 206 27.738 30.366 57.683 1.00 39.98 C ATOM 1844 O ALA A 206 27.748 30.142 56.467 1.00 40.96 O ATOM 1845 CB ALA A 206 27.284 28.328 59.056 1.00 44.88 C ATOM 1846 H ALA A 206 28.398 29.947 60.727 1.00 0.00 H ATOM 1847 N LEU A 207 27.210 31.478 58.201 1.00 38.49 N ATOM 1848 CA LEU A 207 26.637 32.498 57.328 1.00 39.10 C ATOM 1849 C LEU A 207 27.710 33.196 56.503 1.00 41.44 C ATOM 1850 O LEU A 207 27.447 33.609 55.368 1.00 42.16 O ATOM 1851 CB LEU A 207 25.848 33.516 58.155 1.00 36.82 C ATOM 1852 CG LEU A 207 25.109 34.616 57.387 1.00 34.76 C ATOM 1853 CD1 LEU A 207 24.140 34.010 56.384 1.00 35.86 C ATOM 1854 CD2 LEU A 207 24.379 35.553 58.339 1.00 32.12 C ATOM 1855 H LEU A 207 27.207 31.618 59.232 1.00 0.00 H ATOM 1856 N LEU A 208 28.922 33.329 57.047 1.00 42.61 N ATOM 1857 CA LEU A 208 30.011 33.959 56.309 1.00 45.71 C ATOM 1858 C LEU A 208 30.634 33.017 55.287 1.00 51.43 C ATOM 1859 O LEU A 208 31.135 33.475 54.254 1.00 55.58 O ATOM 1860 CB LEU A 208 31.080 34.458 57.281 1.00 43.69 C ATOM 1861 CG LEU A 208 30.710 35.706 58.081 1.00 40.76 C ATOM 1862 CD1 LEU A 208 31.779 36.016 59.114 1.00 42.86 C ATOM 1863 CD2 LEU A 208 30.514 36.884 57.140 1.00 38.97 C ATOM 1864 H LEU A 208 29.092 32.978 58.011 1.00 0.00 H ATOM 1865 N GLU A 209 30.609 31.714 55.550 1.00 52.21 N ATOM 1866 CA GLU A 209 31.193 30.720 54.659 1.00 56.49 C ATOM 1867 C GLU A 209 30.224 30.253 53.581 1.00 57.60 C ATOM 1868 O GLU A 209 30.600 29.426 52.743 1.00 61.59 O ATOM 1869 CB GLU A 209 31.682 29.520 55.478 1.00 61.11 C ATOM 1870 CG GLU A 209 32.892 28.801 54.898 1.00 69.45 C ATOM 1871 CD GLU A 209 33.555 27.877 55.905 1.00 76.69 C ATOM 1872 OE1 GLU A 209 33.458 28.154 57.119 1.00 77.13 O ATOM 1873 OE2 GLU A 209 34.171 26.875 55.483 1.00 82.45 O ATOM 1874 H GLU A 209 30.154 31.391 56.428 1.00 0.00 H ATOM 1875 N ALA A 210 28.996 30.762 53.578 1.00 55.49 N ATOM 1876 CA ALA A 210 27.987 30.311 52.633 1.00 54.26 C ATOM 1877 C ALA A 210 28.172 30.981 51.278 1.00 56.34 C ATOM 1878 O ALA A 210 28.654 32.114 51.178 1.00 57.71 O ATOM 1879 CB ALA A 210 26.586 30.598 53.168 1.00 52.54 C ATOM 1880 H ALA A 210 28.751 31.500 54.268 1.00 0.00 H ATOM 1881 N SER A 211 27.773 30.266 50.230 1.00 57.21 N ATOM 1882 CA SER A 211 27.905 30.779 48.875 1.00 59.62 C ATOM 1883 C SER A 211 26.915 31.911 48.631 1.00 58.81 C ATOM 1884 O SER A 211 25.781 31.885 49.118 1.00 59.00 O ATOM 1885 CB SER A 211 27.681 29.658 47.862 1.00 63.28 C ATOM 1886 OG SER A 211 27.689 30.156 46.536 1.00 65.71 O ATOM 1887 HG SER A 211 27.542 29.409 45.903 1.00 0.00 H ATOM 1888 H SER A 211 27.359 29.324 50.382 1.00 0.00 H ATOM 1889 N SER A 212 27.353 32.908 47.870 1.00 57.68 N ATOM 1890 CA SER A 212 26.525 34.068 47.571 1.00 56.13 C ATOM 1891 C SER A 212 26.110 34.077 46.105 1.00 56.12 C ATOM 1892 O SER A 212 25.386 33.190 45.650 1.00 57.58 O ATOM 1893 CB SER A 212 27.270 35.359 47.917 1.00 58.03 C ATOM 1894 OG SER A 212 28.492 35.446 47.206 1.00 61.23 O ATOM 1895 HG SER A 212 28.953 36.288 47.447 1.00 0.00 H ATOM 1896 H SER A 212 28.314 32.859 47.477 1.00 0.00 H TER 1897 SER A 212 HETATM 1898 O HOH 1 30.335 33.086 73.512 1.00 30.91 O HETATM 1899 O HOH 2 25.756 33.037 43.230 1.00 47.92 O HETATM 1900 O HOH 3 25.303 42.238 48.134 1.00 32.43 O HETATM 1901 O HOH 4 17.498 28.936 55.820 1.00 42.60 O HETATM 1902 O HOH 5 35.691 33.901 86.129 1.00 47.46 O HETATM 1903 O HOH 6 35.498 26.929 89.514 1.00 32.24 O HETATM 1904 O HOH 7 25.091 40.644 86.571 1.00 44.67 O HETATM 1905 O HOH 8 30.145 49.483 96.980 1.00 40.52 O HETATM 1906 O HOH 9 25.370 22.276 64.242 1.00 37.06 O HETATM 1907 O HOH 10 23.290 49.417 56.374 1.00 30.56 O HETATM 1908 O HOH 11 35.334 36.556 107.580 1.00 44.41 O HETATM 1909 O HOH 12 31.294 33.501 49.918 1.00 36.65 O HETATM 1910 O HOH 13 36.655 30.374 89.654 1.00 39.47 O HETATM 1911 O HOH 14 2.508 33.843 66.515 1.00 39.70 O HETATM 1912 O HOH 15 17.516 51.682 60.400 1.00 55.13 O HETATM 1913 O HOH 16 18.762 53.527 58.986 1.00 42.04 O HETATM 1914 O HOH 17 13.733 41.086 41.114 1.00 47.38 O HETATM 1915 O HOH 18 11.936 40.759 39.181 1.00 43.41 O HETATM 1916 O HOH 19 13.377 46.813 61.546 1.00 38.32 O HETATM 1917 N PRO A 20 3.272 35.441 52.216 1.00 0.25 N HETATM 1918 CA PRO A 20 3.392 36.280 53.413 1.00 0.07 C HETATM 1919 C PRO A 20 4.250 35.626 54.488 1.00 0.23 C HETATM 1920 O PRO A 20 5.054 36.298 55.136 1.00 -0.39 O HETATM 1921 N PRO A 20 4.071 34.320 54.673 1.00 -0.26 N HETATM 1922 CA PRO A 20 4.833 33.551 55.645 1.00 0.13 C HETATM 1923 C PRO A 20 5.926 32.710 55.004 1.00 0.20 C HETATM 1924 O PRO A 20 6.645 32.004 55.718 1.00 -0.39 O HETATM 1925 N PRO A 20 6.065 32.763 53.683 1.00 -0.26 N HETATM 1926 CA PRO A 20 7.126 32.033 53.011 1.00 0.14 C HETATM 1927 C PRO A 20 8.482 32.660 53.326 1.00 0.21 C HETATM 1928 O PRO A 20 8.585 33.835 53.689 1.00 -0.39 O HETATM 1929 N PRO A 20 9.536 31.851 53.183 1.00 -0.26 N HETATM 1930 CA PRO A 20 10.881 32.311 53.519 1.00 0.14 C HETATM 1931 C PRO A 20 11.288 33.508 52.667 1.00 0.21 C HETATM 1932 O PRO A 20 11.802 34.507 53.184 1.00 -0.39 O HETATM 1933 N PRO A 20 11.056 33.428 51.355 1.00 -0.26 N HETATM 1934 CA PRO A 20 11.515 34.485 50.458 1.00 0.13 C HETATM 1935 C PRO A 20 10.790 35.799 50.722 1.00 0.20 C HETATM 1936 O PRO A 20 11.411 36.868 50.724 1.00 -0.39 O HETATM 1937 N PRO A 20 9.476 35.742 50.953 1.00 -0.26 N HETATM 1938 CA PRO A 20 8.718 36.973 51.153 1.00 0.13 C HETATM 1939 C PRO A 20 8.980 37.572 52.530 1.00 0.20 C HETATM 1940 O PRO A 20 9.106 38.795 52.665 1.00 -0.39 O HETATM 1941 N PRO A 20 9.067 36.731 53.563 1.00 -0.26 N HETATM 1942 CA PRO A 20 9.334 37.241 54.903 1.00 0.13 C HETATM 1943 C PRO A 20 10.713 37.881 54.983 1.00 0.20 C HETATM 1944 O PRO A 20 10.891 38.912 55.644 1.00 -0.39 O HETATM 1945 N PRO A 20 11.701 37.287 54.309 1.00 -0.26 N HETATM 1946 CA PRO A 20 13.056 37.828 54.353 1.00 0.14 C HETATM 1947 C PRO A 20 13.128 39.202 53.700 1.00 0.21 C HETATM 1948 O PRO A 20 13.843 40.088 54.181 1.00 -0.39 O HETATM 1949 N PRO A 20 12.395 39.398 52.600 1.00 -0.26 N HETATM 1950 CA PRO A 20 12.419 40.686 51.915 1.00 0.13 C HETATM 1951 C PRO A 20 11.816 41.782 52.783 1.00 0.20 C HETATM 1952 O PRO A 20 12.372 42.882 52.885 1.00 -0.39 O HETATM 1953 N PRO A 20 10.673 41.504 53.417 1.00 -0.26 N HETATM 1954 CA PRO A 20 10.059 42.509 54.276 1.00 0.13 C HETATM 1955 C PRO A 20 10.916 42.784 55.505 1.00 0.20 C HETATM 1956 O PRO A 20 10.828 43.866 56.094 1.00 -0.39 O HETATM 1957 N PRO A 20 11.754 41.821 55.903 1.00 -0.26 N HETATM 1958 CA PRO A 20 12.587 42.009 57.085 1.00 0.13 C HETATM 1959 C PRO A 20 13.756 42.950 56.809 1.00 0.20 C HETATM 1960 O PRO A 20 14.239 43.621 57.729 1.00 -0.39 O HETATM 1961 N PRO A 20 14.219 43.024 55.559 1.00 -0.26 N HETATM 1962 CA PRO A 20 15.370 43.861 55.238 1.00 0.13 C HETATM 1963 C PRO A 20 14.993 45.276 54.811 1.00 0.20 C HETATM 1964 O PRO A 20 15.859 46.161 54.817 1.00 -0.39 O HETATM 1965 N PRO A 20 13.735 45.518 54.446 1.00 -0.26 N HETATM 1966 CA PRO A 20 13.304 46.815 53.932 1.00 0.16 C HETATM 1967 C PRO A 20 12.120 47.351 54.724 1.00 0.21 C HETATM 1968 O PRO A 20 11.176 47.914 54.161 1.00 -0.39 O HETATM 1969 N PRO A 20 12.155 47.189 56.043 1.00 -0.27 N HETATM 1970 CA PRO A 20 11.120 47.727 56.920 1.00 0.12 C HETATM 1971 C PRO A 20 11.635 47.825 58.351 1.00 0.06 C HETATM 1972 O PRO A 20 11.307 46.995 59.197 1.00 -0.57 O HETATM 1973 OXT PRO A 20 12.389 48.736 58.688 1.00 -0.57 O HETATM 1974 CB PRO A 20 9.857 46.863 56.874 1.00 0.08 C HETATM 1975 OG PRO A 20 9.256 46.896 55.591 1.00 -0.39 O HETATM 1976 H102 PRO A 20 9.871 46.567 54.946 1.00 0.21 H HETATM 1977 H100 PRO A 20 9.138 47.240 57.616 1.00 0.06 H HETATM 1978 H101 PRO A 20 10.125 45.824 57.117 1.00 0.06 H HETATM 1979 H99 PRO A 20 10.862 48.738 56.571 1.00 0.07 H HETATM 1980 H98 PRO A 20 12.916 46.682 56.448 1.00 0.19 H HETATM 1981 CB PRO A 20 12.961 46.730 52.447 1.00 0.09 C HETATM 1982 OG1 PRO A 20 12.101 45.607 52.216 1.00 -0.39 O HETATM 1983 H94 PRO A 20 12.543 44.810 52.485 1.00 0.21 H HETATM 1984 CG2 PRO A 20 14.226 46.581 51.612 1.00 -0.03 C HETATM 1985 H95 PRO A 20 13.957 46.522 50.547 1.00 0.03 H HETATM 1986 H96 PRO A 20 14.755 45.663 51.908 1.00 0.03 H HETATM 1987 H97 PRO A 20 14.879 47.450 51.778 1.00 0.03 H HETATM 1988 H93 PRO A 20 12.441 47.652 52.147 1.00 0.06 H HETATM 1989 H92 PRO A 20 14.140 47.521 54.049 1.00 0.08 H HETATM 1990 H91 PRO A 20 13.061 44.784 54.527 1.00 0.19 H HETATM 1991 CB PRO A 20 16.229 43.223 54.130 1.00 -0.01 C HETATM 1992 CG1 PRO A 20 16.541 41.774 54.453 1.00 -0.06 C HETATM 1993 H85 PRO A 20 17.154 41.343 53.648 1.00 0.02 H HETATM 1994 H86 PRO A 20 15.602 41.208 54.542 1.00 0.02 H HETATM 1995 H87 PRO A 20 17.093 41.721 55.403 1.00 0.02 H HETATM 1996 CG2 PRO A 20 15.540 43.342 52.784 1.00 -0.06 C HETATM 1997 H88 PRO A 20 15.325 44.400 52.574 1.00 0.02 H HETATM 1998 H89 PRO A 20 14.598 42.774 52.803 1.00 0.02 H HETATM 1999 H90 PRO A 20 16.197 42.939 51.999 1.00 0.02 H HETATM 2000 H84 PRO A 20 17.180 43.772 54.076 1.00 0.03 H HETATM 2001 H83 PRO A 20 15.983 43.937 56.148 1.00 0.08 H HETATM 2002 H82 PRO A 20 13.772 42.500 54.834 1.00 0.19 H HETATM 2003 CB PRO A 20 13.085 40.651 57.582 1.00 0.00 C HETATM 2004 CG PRO A 20 13.839 40.703 58.900 1.00 0.04 C HETATM 2005 CD PRO A 20 14.218 39.328 59.408 1.00 0.17 C HETATM 2006 OE1 PRO A 20 13.542 38.338 59.122 1.00 -0.40 O HETATM 2007 NE2 PRO A 20 15.306 39.258 60.166 1.00 -0.30 N HETATM 2008 H80 PRO A 20 15.606 38.376 60.531 1.00 0.18 H HETATM 2009 H81 PRO A 20 15.826 40.087 60.372 1.00 0.18 H HETATM 2010 H78 PRO A 20 13.202 41.193 59.651 1.00 0.05 H HETATM 2011 H79 PRO A 20 14.757 41.291 58.758 1.00 0.05 H HETATM 2012 H76 PRO A 20 13.756 40.230 56.818 1.00 0.03 H HETATM 2013 H77 PRO A 20 12.214 39.991 57.710 1.00 0.03 H HETATM 2014 H75 PRO A 20 11.967 42.461 57.874 1.00 0.08 H HETATM 2015 H74 PRO A 20 11.810 40.966 55.387 1.00 0.19 H HETATM 2016 CB PRO A 20 8.657 42.056 54.693 1.00 -0.01 C HETATM 2017 CG PRO A 20 7.707 41.830 53.534 1.00 -0.04 C HETATM 2018 CD PRO A 20 6.593 42.864 53.497 1.00 -0.01 C HETATM 2019 CE PRO A 20 7.135 44.255 53.215 1.00 -0.04 C HETATM 2020 NZ PRO A 20 6.068 45.289 53.225 1.00 0.22 N HETATM 2021 H71 PRO A 20 6.473 46.192 53.034 1.00 0.20 H HETATM 2022 H72 PRO A 20 5.624 45.305 54.130 1.00 0.20 H HETATM 2023 H73 PRO A 20 5.383 45.072 52.518 1.00 0.20 H HETATM 2024 H69 PRO A 20 7.617 44.253 52.226 1.00 0.08 H HETATM 2025 H70 PRO A 20 7.879 44.507 53.985 1.00 0.08 H HETATM 2026 H67 PRO A 20 6.079 42.871 54.469 1.00 0.03 H HETATM 2027 H68 PRO A 20 5.878 42.592 52.706 1.00 0.03 H HETATM 2028 H65 PRO A 20 7.259 40.830 53.632 1.00 0.03 H HETATM 2029 H66 PRO A 20 8.275 41.887 52.594 1.00 0.03 H HETATM 2030 H63 PRO A 20 8.225 42.828 55.347 1.00 0.03 H HETATM 2031 H64 PRO A 20 8.751 41.113 55.251 1.00 0.03 H HETATM 2032 H62 PRO A 20 9.968 43.444 53.704 1.00 0.08 H HETATM 2033 H61 PRO A 20 10.240 40.610 53.303 1.00 0.19 H HETATM 2034 CB PRO A 20 11.681 40.592 50.580 1.00 -0.00 C HETATM 2035 CG PRO A 20 11.533 41.933 49.877 1.00 0.00 C HETATM 2036 CD PRO A 20 11.010 41.807 48.459 1.00 0.04 C HETATM 2037 OE1 PRO A 20 10.681 40.677 48.039 1.00 -0.57 O HETATM 2038 OE2 PRO A 20 10.932 42.841 47.762 1.00 -0.57 O HETATM 2039 H59 PRO A 20 12.518 42.422 49.845 1.00 0.04 H HETATM 2040 H60 PRO A 20 10.833 42.556 50.454 1.00 0.04 H HETATM 2041 H57 PRO A 20 10.677 40.182 50.764 1.00 0.03 H HETATM 2042 H58 PRO A 20 12.239 39.912 49.920 1.00 0.03 H HETATM 2043 H56 PRO A 20 13.468 40.948 51.712 1.00 0.08 H HETATM 2044 H55 PRO A 20 11.826 38.657 52.244 1.00 0.19 H HETATM 2045 CB PRO A 20 14.029 36.864 53.675 1.00 0.02 C HETATM 2046 CG PRO A 20 15.433 37.386 53.584 1.00 -0.04 C HETATM 2047 CD1 PRO A 20 16.235 37.450 54.711 1.00 -0.06 C HETATM 2048 CE1 PRO A 20 17.527 37.931 54.637 1.00 -0.07 C HETATM 2049 CZ PRO A 20 18.036 38.352 53.427 1.00 -0.07 C HETATM 2050 CE2 PRO A 20 17.247 38.294 52.290 1.00 -0.07 C HETATM 2051 CD2 PRO A 20 15.953 37.812 52.372 1.00 -0.06 C HETATM 2052 H51 PRO A 20 15.340 37.767 51.479 1.00 0.06 H HETATM 2053 H53 PRO A 20 17.643 38.626 51.337 1.00 0.06 H HETATM 2054 H54 PRO A 20 19.051 38.727 53.365 1.00 0.06 H HETATM 2055 H52 PRO A 20 18.141 37.978 55.529 1.00 0.06 H HETATM 2056 H50 PRO A 20 15.843 37.118 55.665 1.00 0.06 H HETATM 2057 H48 PRO A 20 13.666 36.665 52.656 1.00 0.05 H HETATM 2058 H49 PRO A 20 14.044 35.926 54.249 1.00 0.05 H HETATM 2059 H47 PRO A 20 13.350 37.934 55.408 1.00 0.08 H HETATM 2060 H46 PRO A 20 11.511 36.466 53.770 1.00 0.19 H HETATM 2061 CB PRO A 20 9.204 36.118 55.931 1.00 -0.02 C HETATM 2062 H43 PRO A 20 9.408 36.516 56.936 1.00 0.03 H HETATM 2063 H44 PRO A 20 9.927 35.322 55.698 1.00 0.03 H HETATM 2064 H45 PRO A 20 8.184 35.708 55.899 1.00 0.03 H HETATM 2065 H42 PRO A 20 8.584 38.011 55.134 1.00 0.08 H HETATM 2066 H41 PRO A 20 8.949 35.749 53.418 1.00 0.19 H HETATM 2067 CB PRO A 20 7.226 36.713 50.951 1.00 -0.00 C HETATM 2068 CG PRO A 20 6.358 37.938 51.188 1.00 0.00 C HETATM 2069 CD PRO A 20 4.946 37.764 50.673 1.00 0.04 C HETATM 2070 OE1 PRO A 20 4.720 36.854 49.848 1.00 -0.57 O HETATM 2071 OE2 PRO A 20 4.060 38.536 51.094 1.00 -0.57 O HETATM 2072 H39 PRO A 20 6.816 38.797 50.676 1.00 0.04 H HETATM 2073 H40 PRO A 20 6.316 38.135 52.269 1.00 0.04 H HETATM 2074 H37 PRO A 20 6.912 35.924 51.650 1.00 0.03 H HETATM 2075 H38 PRO A 20 7.069 36.370 49.917 1.00 0.03 H HETATM 2076 H36 PRO A 20 9.046 37.702 50.398 1.00 0.08 H HETATM 2077 H35 PRO A 20 9.012 34.857 50.989 1.00 0.19 H HETATM 2078 CB PRO A 20 11.334 34.051 49.004 1.00 -0.00 C HETATM 2079 CG PRO A 20 12.149 32.827 48.620 1.00 0.00 C HETATM 2080 CD PRO A 20 13.114 33.101 47.485 1.00 0.04 C HETATM 2081 OE1 PRO A 20 12.867 34.047 46.707 1.00 -0.57 O HETATM 2082 OE2 PRO A 20 14.124 32.374 47.372 1.00 -0.57 O HETATM 2083 H33 PRO A 20 11.460 32.028 48.311 1.00 0.04 H HETATM 2084 H34 PRO A 20 12.723 32.496 49.498 1.00 0.04 H HETATM 2085 H31 PRO A 20 11.635 34.885 48.354 1.00 0.03 H HETATM 2086 H32 PRO A 20 10.270 33.824 48.840 1.00 0.03 H HETATM 2087 H30 PRO A 20 12.588 34.646 50.640 1.00 0.08 H HETATM 2088 H29 PRO A 20 10.565 32.640 50.984 1.00 0.19 H HETATM 2089 CB PRO A 20 11.884 31.168 53.352 1.00 0.04 C HETATM 2090 CG PRO A 20 11.862 30.193 54.514 1.00 0.04 C HETATM 2091 OD1 PRO A 20 10.884 30.207 55.291 1.00 -0.57 O HETATM 2092 OD2 PRO A 20 12.825 29.410 54.649 1.00 -0.57 O HETATM 2093 H27 PRO A 20 12.894 31.596 53.271 1.00 0.05 H HETATM 2094 H28 PRO A 20 11.643 30.620 52.429 1.00 0.05 H HETATM 2095 H26 PRO A 20 10.884 32.624 54.573 1.00 0.08 H HETATM 2096 H25 PRO A 20 9.402 30.920 52.842 1.00 0.19 H HETATM 2097 CB PRO A 20 6.885 32.014 51.501 1.00 0.04 C HETATM 2098 CG PRO A 20 5.427 31.785 51.145 1.00 0.04 C HETATM 2099 OD1 PRO A 20 4.663 32.773 51.105 1.00 -0.57 O HETATM 2100 OD2 PRO A 20 5.045 30.620 50.901 1.00 -0.57 O HETATM 2101 H23 PRO A 20 7.487 31.206 51.058 1.00 0.05 H HETATM 2102 H24 PRO A 20 7.202 32.980 51.081 1.00 0.05 H HETATM 2103 H22 PRO A 20 7.125 30.996 53.379 1.00 0.08 H HETATM 2104 H21 PRO A 20 5.429 33.314 53.143 1.00 0.19 H HETATM 2105 CB PRO A 20 3.896 32.652 56.458 1.00 -0.01 C HETATM 2106 CG PRO A 20 2.890 33.384 57.348 1.00 -0.04 C HETATM 2107 CD1 PRO A 20 1.950 32.399 58.024 1.00 -0.06 C HETATM 2108 H15 PRO A 20 1.237 32.948 58.657 1.00 0.02 H HETATM 2109 H16 PRO A 20 2.533 31.704 58.646 1.00 0.02 H HETATM 2110 H17 PRO A 20 1.399 31.833 57.258 1.00 0.02 H HETATM 2111 CD2 PRO A 20 3.615 34.231 58.382 1.00 -0.06 C HETATM 2112 H18 PRO A 20 4.289 34.935 57.872 1.00 0.02 H HETATM 2113 H19 PRO A 20 4.201 33.578 59.045 1.00 0.02 H HETATM 2114 H20 PRO A 20 2.880 34.792 58.977 1.00 0.02 H HETATM 2115 H14 PRO A 20 2.290 34.052 56.713 1.00 0.03 H HETATM 2116 H12 PRO A 20 4.516 32.011 57.103 1.00 0.03 H HETATM 2117 H13 PRO A 20 3.331 32.025 55.752 1.00 0.03 H HETATM 2118 H11 PRO A 20 5.314 34.262 56.333 1.00 0.08 H HETATM 2119 H10 PRO A 20 3.384 33.848 54.121 1.00 0.19 H HETATM 2120 CB PRO A 20 1.942 36.427 53.888 1.00 0.01 C HETATM 2121 CG PRO A 20 1.116 36.171 52.673 1.00 -0.01 C HETATM 2122 CD PRO A 20 1.868 35.136 51.896 1.00 -0.03 C HETATM 2123 H8 PRO A 20 1.599 34.121 52.224 1.00 0.08 H HETATM 2124 H9 PRO A 20 1.677 35.235 50.817 1.00 0.08 H HETATM 2125 H6 PRO A 20 1.005 37.092 52.081 1.00 0.03 H HETATM 2126 H7 PRO A 20 0.122 35.794 52.955 1.00 0.03 H HETATM 2127 H4 PRO A 20 1.761 37.441 54.273 1.00 0.03 H HETATM 2128 H5 PRO A 20 1.715 35.691 54.673 1.00 0.03 H HETATM 2129 H3 PRO A 20 3.821 37.260 53.157 1.00 0.11 H HETATM 2130 H1 PRO A 20 3.765 34.576 52.374 1.00 0.20 H HETATM 2131 H2 PRO A 20 3.686 35.926 51.435 1.00 0.20 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1917 1918 2122 2130 2131 CONECT 1918 1917 1919 2120 2129 CONECT 1919 1918 1920 1921 CONECT 1920 1919 CONECT 1921 1919 1922 2119 CONECT 1922 1921 1923 2105 2118 CONECT 1923 1922 1924 1925 CONECT 1924 1923 CONECT 1925 1923 1926 2104 CONECT 1926 1925 1927 2097 2103 CONECT 1927 1926 1928 1929 CONECT 1928 1927 CONECT 1929 1927 1930 2096 CONECT 1930 1929 1931 2089 2095 CONECT 1931 1930 1932 1933 CONECT 1932 1931 CONECT 1933 1931 1934 2088 CONECT 1934 1933 1935 2078 2087 CONECT 1935 1934 1936 1937 CONECT 1936 1935 CONECT 1937 1935 1938 2077 CONECT 1938 1937 1939 2067 2076 CONECT 1939 1938 1940 1941 CONECT 1940 1939 CONECT 1941 1939 1942 2066 CONECT 1942 1941 1943 2061 2065 CONECT 1943 1942 1944 1945 CONECT 1944 1943 CONECT 1945 1943 1946 2060 CONECT 1946 1945 1947 2045 2059 CONECT 1947 1946 1948 1949 CONECT 1948 1947 CONECT 1949 1947 1950 2044 CONECT 1950 1949 1951 2034 2043 CONECT 1951 1950 1952 1953 CONECT 1952 1951 CONECT 1953 1951 1954 2033 CONECT 1954 1953 1955 2016 2032 CONECT 1955 1954 1956 1957 CONECT 1956 1955 CONECT 1957 1955 1958 2015 CONECT 1958 1957 1959 2003 2014 CONECT 1959 1958 1960 1961 CONECT 1960 1959 CONECT 1961 1959 1962 2002 CONECT 1962 1961 1963 1991 2001 CONECT 1963 1962 1964 1965 CONECT 1964 1963 CONECT 1965 1963 1966 1990 CONECT 1966 1965 1967 1981 1989 CONECT 1967 1966 1968 1969 CONECT 1968 1967 CONECT 1969 1967 1970 1980 CONECT 1970 1969 1971 1974 1979 CONECT 1971 1970 1972 1973 CONECT 1972 1971 CONECT 1973 1971 CONECT 1974 1970 1975 1977 1978 CONECT 1975 1974 1976 CONECT 1976 1975 CONECT 1977 1974 CONECT 1978 1974 CONECT 1979 1970 CONECT 1980 1969 CONECT 1981 1966 1982 1984 1988 CONECT 1982 1981 1983 CONECT 1983 1982 CONECT 1984 1981 1985 1986 1987 CONECT 1985 1984 CONECT 1986 1984 CONECT 1987 1984 CONECT 1988 1981 CONECT 1989 1966 CONECT 1990 1965 CONECT 1991 1962 1992 1996 2000 CONECT 1992 1991 1993 1994 1995 CONECT 1993 1992 CONECT 1994 1992 CONECT 1995 1992 CONECT 1996 1991 1997 1998 1999 CONECT 1997 1996 CONECT 1998 1996 CONECT 1999 1996 CONECT 2000 1991 CONECT 2001 1962 CONECT 2002 1961 CONECT 2003 1958 2004 2012 2013 CONECT 2004 2003 2005 2010 2011 CONECT 2005 2004 2006 2007 CONECT 2006 2005 CONECT 2007 2005 2008 2009 CONECT 2008 2007 CONECT 2009 2007 CONECT 2010 2004 CONECT 2011 2004 CONECT 2012 2003 CONECT 2013 2003 CONECT 2014 1958 CONECT 2015 1957 CONECT 2016 1954 2017 2030 2031 CONECT 2017 2016 2018 2028 2029 CONECT 2018 2017 2019 2026 2027 CONECT 2019 2018 2020 2024 2025 CONECT 2020 2019 2021 2022 2023 CONECT 2021 2020 CONECT 2022 2020 CONECT 2023 2020 CONECT 2024 2019 CONECT 2025 2019 CONECT 2026 2018 CONECT 2027 2018 CONECT 2028 2017 CONECT 2029 2017 CONECT 2030 2016 CONECT 2031 2016 CONECT 2032 1954 CONECT 2033 1953 CONECT 2034 1950 2035 2041 2042 CONECT 2035 2034 2036 2039 2040 CONECT 2036 2035 2037 2038 CONECT 2037 2036 CONECT 2038 2036 CONECT 2039 2035 CONECT 2040 2035 CONECT 2041 2034 CONECT 2042 2034 CONECT 2043 1950 CONECT 2044 1949 CONECT 2045 1946 2046 2057 2058 CONECT 2046 2045 2047 2051 CONECT 2047 2046 2048 2056 CONECT 2048 2047 2049 2055 CONECT 2049 2048 2050 2054 CONECT 2050 2049 2051 2053 CONECT 2051 2046 2050 2052 CONECT 2052 2051 CONECT 2053 2050 CONECT 2054 2049 CONECT 2055 2048 CONECT 2056 2047 CONECT 2057 2045 CONECT 2058 2045 CONECT 2059 1946 CONECT 2060 1945 CONECT 2061 1942 2062 2063 2064 CONECT 2062 2061 CONECT 2063 2061 CONECT 2064 2061 CONECT 2065 1942 CONECT 2066 1941 CONECT 2067 1938 2068 2074 2075 CONECT 2068 2067 2069 2072 2073 CONECT 2069 2068 2070 2071 CONECT 2070 2069 CONECT 2071 2069 CONECT 2072 2068 CONECT 2073 2068 CONECT 2074 2067 CONECT 2075 2067 CONECT 2076 1938 CONECT 2077 1937 CONECT 2078 1934 2079 2085 2086 CONECT 2079 2078 2080 2083 2084 CONECT 2080 2079 2081 2082 CONECT 2081 2080 CONECT 2082 2080 CONECT 2083 2079 CONECT 2084 2079 CONECT 2085 2078 CONECT 2086 2078 CONECT 2087 1934 CONECT 2088 1933 CONECT 2089 1930 2090 2093 2094 CONECT 2090 2089 2091 2092 CONECT 2091 2090 CONECT 2092 2090 CONECT 2093 2089 CONECT 2094 2089 CONECT 2095 1930 CONECT 2096 1929 CONECT 2097 1926 2098 2101 2102 CONECT 2098 2097 2099 2100 CONECT 2099 2098 CONECT 2100 2098 CONECT 2101 2097 CONECT 2102 2097 CONECT 2103 1926 CONECT 2104 1925 CONECT 2105 1922 2106 2116 2117 CONECT 2106 2105 2107 2111 2115 CONECT 2107 2106 2108 2109 2110 CONECT 2108 2107 CONECT 2109 2107 CONECT 2110 2107 CONECT 2111 2106 2112 2113 2114 CONECT 2112 2111 CONECT 2113 2111 CONECT 2114 2111 CONECT 2115 2106 CONECT 2116 2105 CONECT 2117 2105 CONECT 2118 1922 CONECT 2119 1921 CONECT 2120 1918 2121 2127 2128 CONECT 2121 2120 2122 2125 2126 CONECT 2122 1917 2121 2123 2124 CONECT 2123 2122 CONECT 2124 2122 CONECT 2125 2121 CONECT 2126 2121 CONECT 2127 2120 CONECT 2128 2120 CONECT 2129 1918 CONECT 2130 1917 CONECT 2131 1917 MASTER 0 0 0 0 0 0 0 0 2130 1 219 16 END
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Entry Information
PDB ID
5yc2
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bouquet formation protein 4
Ligand Name
18-mer
EC.Number
E.C.-.-.-.-
Resolution
2.7(Å)
Affinity (Kd/Ki/IC50)
Kd=11.4uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Nucleic Acids Res. Vol. : pp. -
Ligand Properties
Formula
C
6
9
H
1
0
8
N
1
6
O
2
8
Molecular Weight
1609.690
Exact Mass
1608.750
No. of atoms
221
No. of bonds
222
Polar Surface Area
729.9
LOGP Value
-2.31 (
Computed with XLOGP3
)
-1.99 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 18
No. of Hydrogen Bond Acceptors: 28
No. of Rotatable Bonds: 63
No. of Nitrogen and Oxygen Atoms: 44
No. of Rings: 2
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)[C@H](O)C)C(C)C)CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC[NH2+]1)CC(C)C)CC(=O)O)CC(=O)O)CCC(=O)O)CCC(=O)O)C)Cc1ccccc1)CCC(=O)O
InChI String
InChI=1S/C69H106N16O28/c1-32(2)27-43(80-57(100)37-16-12-26-72-37)63(106)81-46(30-53(97)98)66(109)82-45(29-52(95)96)65(108)78-42(20-24-51(93)94)61(104)76-40(18-22-49(89)90)58(101)73-34(5)56(99)79-44(28-36-13-8-7-9-14-36)64(107)77-41(19-23-50(91)92)60(103)74-38(15-10-11-25-70)59(102)75-39(17-21-48(71)88)62(105)84-54(33(3)4)67(110)85-55(35(6)87)68(111)83-47(31-86)69(112)113/h7-9,13-14,32-35,37-47,54-55,72,86-87H,10-12,15-31,70H2,1-6H3,(H2,71,88)(H,73,101)(H,74,103)(H,75,102)(H,76,104)(H,77,107)(H,78,108)(H,79,99)(H,80,100)(H,81,106)(H,82,109)(H,83,111)(H,84,105)(H,85,110)(H,89,90)(H,91,92)(H,93,94)(H,95,96)(H,97,98)(H,112,113)/p+2/t34-,35+,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,54-,55-/m0/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):
Q96TL7
O60158
Q12306
Entrez Gene ID
NCBI Entrez Gene ID:
2540115
2540694
852122
ASD
Information of known allosteric effects of PDB entries
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