Browse entries in the PDBbind-CN Database
HEADER 6HAI_COMPLEX COMPND 6HAI_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 212 MET TYR ASP ARG TRP PHE SER GLN GLN GLU LEU GLN VAL SEQRES 2 A 212 LEU PRO PHE ALA GLU GLN ASP GLU GLN ARG ASN GLN THR SEQRES 3 A 212 TRP LEU GLU LEU VAL GLY GLU ALA GLN GLN LEU MET ASP SEQRES 4 A 212 GLU ARG CYS PRO ALA ASP GLU PRO ARG ALA ILE ALA LEU SEQRES 5 A 212 ALA THR ARG TRP MET GLU GLN LEU GLU GLN ASP THR ALA SEQRES 6 A 212 GLY ARG PRO GLU PHE LEU THR ARG LEU ASN GLU MET HIS SEQRES 7 A 212 ALA ALA GLU PRO GLN MET ARG GLU GLN THR GLY VAL THR SEQRES 8 A 212 PRO GLU MET ILE ASP PHE ILE THR ARG ALA PHE ALA GLU SEQRES 9 A 212 SER LYS LEU ALA ILE TRP ALA ARG TYR LEU ASN ASP GLU SEQRES 10 A 212 GLU LEU ALA PHE THR ARG GLN HIS TYR PHE ASP ARG LEU SEQRES 11 A 212 ALA GLU TRP PRO ALA LEU VAL ALA ASP LEU HIS ARG ALA SEQRES 12 A 212 CYS ARG GLU LYS ARG ASP PRO ALA SER PRO GLY GLY GLN SEQRES 13 A 212 GLN LEU ALA GLN ARG TRP LEU ALA LEU PHE GLN SER TYR SEQRES 14 A 212 ALA GLY LYS ASP ALA GLN THR GLN GLN LYS PHE ARG TYR SEQRES 15 A 212 ALA MET GLU GLN GLU PRO HIS LEU MET LYS GLY THR TRP SEQRES 16 A 212 MET THR SER GLU VAL LEU SER TRP LEU GLN GLN ALA ILE SEQRES 17 A 212 GLY VAL MET MET HET FWW A 255 98 ATOM 1 N MET A 1 -27.838 95.369 58.724 1.00 67.09 N ATOM 2 CA MET A 1 -26.842 94.434 59.239 1.00 67.38 C ATOM 3 C MET A 1 -25.527 95.155 59.526 1.00 65.11 C ATOM 4 O MET A 1 -24.993 95.077 60.635 1.00 61.90 O ATOM 5 CB MET A 1 -26.603 93.298 58.245 1.00 68.52 C ATOM 6 CG MET A 1 -25.655 92.225 58.759 1.00 68.33 C ATOM 7 SD MET A 1 -24.994 91.165 57.446 1.00 71.23 S ATOM 8 CE MET A 1 -24.202 89.910 58.427 1.00 68.49 C ATOM 9 HN3 MET A 1 -27.488 95.796 57.843 1.00 0.00 H ATOM 10 HN2 MET A 1 -28.008 96.115 59.428 1.00 0.00 H ATOM 11 HN1 MET A 1 -28.725 94.860 58.535 1.00 0.00 H ATOM 12 N TYR A 2 -24.999 95.843 58.509 1.00 65.47 N ATOM 13 CA TYR A 2 -23.795 96.640 58.700 1.00 62.14 C ATOM 14 C TYR A 2 -23.982 97.680 59.803 1.00 60.62 C ATOM 15 O TYR A 2 -23.014 98.048 60.477 1.00 55.16 O ATOM 16 CB TYR A 2 -23.411 97.330 57.392 1.00 63.82 C ATOM 17 CG TYR A 2 -22.834 96.415 56.335 1.00 65.79 C ATOM 18 CD1 TYR A 2 -21.815 95.520 56.639 1.00 64.95 C ATOM 19 CD2 TYR A 2 -23.306 96.452 55.028 1.00 68.63 C ATOM 20 CE1 TYR A 2 -21.285 94.684 55.672 1.00 64.87 C ATOM 21 CE2 TYR A 2 -22.784 95.620 54.055 1.00 68.91 C ATOM 22 CZ TYR A 2 -21.773 94.739 54.382 1.00 67.37 C ATOM 23 OH TYR A 2 -21.248 93.911 53.416 1.00 67.70 O ATOM 24 HH TYR A 2 -20.538 93.348 53.816 1.00 0.00 H ATOM 25 H TYR A 2 -25.452 95.809 57.573 1.00 0.00 H ATOM 26 N ASP A 3 -25.216 98.161 59.997 1.00 62.51 N ATOM 27 CA ASP A 3 -25.468 99.167 61.020 1.00 64.76 C ATOM 28 C ASP A 3 -25.080 98.672 62.406 1.00 61.65 C ATOM 29 O ASP A 3 -24.668 99.469 63.256 1.00 59.75 O ATOM 30 CB ASP A 3 -26.943 99.572 61.002 1.00 71.07 C ATOM 31 CG ASP A 3 -27.246 100.635 59.963 1.00 76.91 C ATOM 32 OD1 ASP A 3 -26.436 101.575 59.820 1.00 77.83 O ATOM 33 OD2 ASP A 3 -28.296 100.537 59.293 1.00 86.09 O ATOM 34 H ASP A 3 -26.002 97.813 59.412 1.00 0.00 H ATOM 35 N ARG A 4 -25.202 97.366 62.657 1.00 60.81 N ATOM 36 CA ARG A 4 -24.836 96.820 63.954 1.00 56.19 C ATOM 37 C ARG A 4 -23.335 96.847 64.204 1.00 53.54 C ATOM 38 O ARG A 4 -22.916 96.654 65.350 1.00 52.39 O ATOM 39 CB ARG A 4 -25.343 95.384 64.079 1.00 59.66 C ATOM 40 CG ARG A 4 -26.852 95.269 64.161 1.00 65.86 C ATOM 41 CD ARG A 4 -27.292 93.866 64.547 1.00 68.22 C ATOM 42 NE ARG A 4 -27.022 92.892 63.498 1.00 70.21 N ATOM 43 CZ ARG A 4 -27.743 92.770 62.387 1.00 75.13 C ATOM 44 NH1 ARG A 4 -28.776 93.574 62.171 1.00 75.80 N ATOM 45 NH2 ARG A 4 -27.426 91.847 61.487 1.00 76.76 N ATOM 46 HE ARG A 4 -26.213 92.251 63.626 1.00 0.00 H ATOM 47 HH12 ARG A 4 -29.338 93.476 61.301 1.00 0.00 H ATOM 48 HH11 ARG A 4 -29.024 94.302 62.871 1.00 0.00 H ATOM 49 HH22 ARG A 4 -27.990 91.752 60.619 1.00 0.00 H ATOM 50 HH21 ARG A 4 -26.613 91.219 61.650 1.00 0.00 H ATOM 51 H ARG A 4 -25.563 96.732 61.916 1.00 0.00 H ATOM 52 N TRP A 5 -22.521 97.087 63.173 1.00 50.25 N ATOM 53 CA TRP A 5 -21.072 97.011 63.306 1.00 48.60 C ATOM 54 C TRP A 5 -20.329 98.234 62.810 1.00 50.39 C ATOM 55 O TRP A 5 -19.176 98.428 63.216 1.00 50.83 O ATOM 56 CB TRP A 5 -20.542 95.777 62.564 1.00 48.29 C ATOM 57 CG TRP A 5 -21.100 94.525 63.127 1.00 50.62 C ATOM 58 CD1 TRP A 5 -22.282 93.935 62.797 1.00 54.29 C ATOM 59 CD2 TRP A 5 -20.515 93.713 64.147 1.00 49.51 C ATOM 60 NE1 TRP A 5 -22.467 92.798 63.545 1.00 55.66 N ATOM 61 CE2 TRP A 5 -21.393 92.638 64.380 1.00 51.84 C ATOM 62 CE3 TRP A 5 -19.329 93.788 64.884 1.00 46.55 C ATOM 63 CZ2 TRP A 5 -21.125 91.645 65.314 1.00 51.28 C ATOM 64 CZ3 TRP A 5 -19.066 92.801 65.815 1.00 45.54 C ATOM 65 CH2 TRP A 5 -19.958 91.744 66.019 1.00 48.93 C ATOM 66 HE1 TRP A 5 -23.288 92.162 63.487 1.00 0.00 H ATOM 67 H TRP A 5 -22.932 97.335 62.250 1.00 0.00 H ATOM 68 N PHE A 6 -20.928 99.057 61.955 1.00 52.49 N ATOM 69 CA PHE A 6 -20.311 100.286 61.484 1.00 52.45 C ATOM 70 C PHE A 6 -21.199 101.466 61.856 1.00 55.16 C ATOM 71 O PHE A 6 -22.427 101.396 61.735 1.00 56.42 O ATOM 72 CB PHE A 6 -20.094 100.259 59.969 1.00 53.71 C ATOM 73 CG PHE A 6 -19.177 99.166 59.508 1.00 51.34 C ATOM 74 CD1 PHE A 6 -19.672 97.902 59.220 1.00 52.73 C ATOM 75 CD2 PHE A 6 -17.819 99.398 59.356 1.00 47.31 C ATOM 76 CE1 PHE A 6 -18.828 96.893 58.791 1.00 48.05 C ATOM 77 CE2 PHE A 6 -16.972 98.388 58.927 1.00 42.75 C ATOM 78 CZ PHE A 6 -17.479 97.138 58.648 1.00 43.19 C ATOM 79 H PHE A 6 -21.877 98.811 61.609 1.00 0.00 H ATOM 80 N SER A 7 -20.575 102.543 62.322 1.00 56.90 N ATOM 81 CA SER A 7 -21.306 103.780 62.535 1.00 62.06 C ATOM 82 C SER A 7 -21.820 104.306 61.198 1.00 65.12 C ATOM 83 O SER A 7 -21.294 103.983 60.129 1.00 63.65 O ATOM 84 CB SER A 7 -20.417 104.822 63.208 1.00 62.21 C ATOM 85 OG SER A 7 -19.340 105.191 62.368 1.00 62.64 O ATOM 86 HG SER A 7 -18.793 104.391 62.164 1.00 0.00 H ATOM 87 H SER A 7 -19.558 102.500 62.535 1.00 0.00 H ATOM 88 N GLN A 8 -22.874 105.122 61.265 1.00 68.19 N ATOM 89 CA GLN A 8 -23.432 105.688 60.045 1.00 70.28 C ATOM 90 C GLN A 8 -22.476 106.672 59.386 1.00 72.10 C ATOM 91 O GLN A 8 -22.610 106.932 58.187 1.00 74.99 O ATOM 92 CB GLN A 8 -24.776 106.348 60.342 1.00 75.01 C ATOM 93 CG GLN A 8 -25.940 105.367 60.295 1.00 75.25 C ATOM 94 CD GLN A 8 -27.226 105.957 60.832 1.00 81.92 C ATOM 95 OE1 GLN A 8 -27.297 106.369 61.990 1.00 85.17 O ATOM 96 NE2 GLN A 8 -28.256 106.002 59.992 1.00 85.09 N ATOM 97 HE22 GLN A 8 -28.152 105.643 59.022 1.00 0.00 H ATOM 98 HE21 GLN A 8 -29.166 106.397 60.305 1.00 0.00 H ATOM 99 H GLN A 8 -23.296 105.353 62.187 1.00 0.00 H ATOM 100 N GLN A 9 -21.513 107.218 60.134 1.00 71.74 N ATOM 101 CA GLN A 9 -20.458 108.009 59.509 1.00 73.23 C ATOM 102 C GLN A 9 -19.480 107.108 58.763 1.00 72.25 C ATOM 103 O GLN A 9 -19.001 107.463 57.678 1.00 71.08 O ATOM 104 CB GLN A 9 -19.727 108.838 60.562 1.00 74.78 C ATOM 105 CG GLN A 9 -18.549 109.625 60.015 1.00 78.96 C ATOM 106 CD GLN A 9 -18.002 110.631 61.011 1.00 83.93 C ATOM 107 OE1 GLN A 9 -18.479 110.726 62.143 1.00 85.36 O ATOM 108 NE2 GLN A 9 -16.995 111.393 60.591 1.00 83.97 N ATOM 109 HE22 GLN A 9 -16.623 111.279 59.626 1.00 0.00 H ATOM 110 HE21 GLN A 9 -16.580 112.103 61.227 1.00 0.00 H ATOM 111 H GLN A 9 -21.515 107.079 61.165 1.00 0.00 H ATOM 112 N GLU A 10 -19.173 105.937 59.330 1.00 68.12 N ATOM 113 CA GLU A 10 -18.303 104.987 58.646 1.00 65.40 C ATOM 114 C GLU A 10 -18.979 104.414 57.405 1.00 63.97 C ATOM 115 O GLU A 10 -18.336 104.246 56.362 1.00 61.90 O ATOM 116 CB GLU A 10 -17.905 103.861 59.597 1.00 62.49 C ATOM 117 CG GLU A 10 -16.914 104.267 60.674 1.00 61.69 C ATOM 118 CD GLU A 10 -16.685 103.164 61.692 1.00 58.59 C ATOM 119 OE1 GLU A 10 -17.621 102.374 61.930 1.00 55.31 O ATOM 120 OE2 GLU A 10 -15.567 103.083 62.245 1.00 57.13 O ATOM 121 H GLU A 10 -19.558 105.701 60.267 1.00 0.00 H ATOM 122 N LEU A 11 -20.274 104.108 57.498 1.00 63.72 N ATOM 123 CA LEU A 11 -20.995 103.570 56.352 1.00 66.68 C ATOM 124 C LEU A 11 -20.945 104.501 55.147 1.00 69.29 C ATOM 125 O LEU A 11 -21.098 104.034 54.014 1.00 68.64 O ATOM 126 CB LEU A 11 -22.446 103.291 56.735 1.00 70.11 C ATOM 127 CG LEU A 11 -22.653 102.164 57.747 1.00 69.32 C ATOM 128 CD1 LEU A 11 -24.088 102.138 58.242 1.00 73.13 C ATOM 129 CD2 LEU A 11 -22.280 100.823 57.139 1.00 68.00 C ATOM 130 H LEU A 11 -20.774 104.255 58.398 1.00 0.00 H ATOM 131 N GLN A 12 -20.733 105.803 55.363 1.00 71.86 N ATOM 132 CA GLN A 12 -20.618 106.727 54.241 1.00 75.97 C ATOM 133 C GLN A 12 -19.365 106.454 53.416 1.00 76.18 C ATOM 134 O GLN A 12 -19.381 106.636 52.193 1.00 78.47 O ATOM 135 CB GLN A 12 -20.608 108.173 54.745 1.00 77.45 C ATOM 136 CG GLN A 12 -21.890 108.602 55.441 1.00 79.27 C ATOM 137 CD GLN A 12 -23.074 108.676 54.493 1.00 82.66 C ATOM 138 OE1 GLN A 12 -23.970 107.831 54.534 1.00 81.61 O ATOM 139 NE2 GLN A 12 -23.088 109.694 53.640 1.00 86.16 N ATOM 140 HE22 GLN A 12 -22.310 110.384 53.641 1.00 0.00 H ATOM 141 HE21 GLN A 12 -23.877 109.801 52.971 1.00 0.00 H ATOM 142 H GLN A 12 -20.650 106.159 56.337 1.00 0.00 H ATOM 143 N VAL A 13 -18.282 106.025 54.059 1.00 76.76 N ATOM 144 CA VAL A 13 -17.009 105.788 53.389 1.00 78.63 C ATOM 145 C VAL A 13 -16.718 104.315 53.200 1.00 81.02 C ATOM 146 O VAL A 13 -15.619 103.970 52.727 1.00 73.66 O ATOM 147 CB VAL A 13 -15.851 106.473 54.156 1.00 78.21 C ATOM 148 CG1 VAL A 13 -16.069 107.986 54.218 1.00 82.98 C ATOM 149 CG2 VAL A 13 -15.716 105.896 55.553 1.00 77.04 C ATOM 150 H VAL A 13 -18.346 105.851 55.082 1.00 0.00 H ATOM 151 N LEU A 14 -17.652 103.434 53.543 1.00 88.33 N ATOM 152 CA LEU A 14 -17.448 102.000 53.410 1.00 91.67 C ATOM 153 C LEU A 14 -18.082 101.523 52.115 1.00 87.61 C ATOM 154 O LEU A 14 -19.315 101.435 52.039 1.00 85.84 O ATOM 155 CB LEU A 14 -18.053 101.263 54.603 1.00100.40 C ATOM 156 CG LEU A 14 -17.990 99.736 54.573 1.00106.91 C ATOM 157 CD1 LEU A 14 -16.552 99.245 54.578 1.00105.66 C ATOM 158 CD2 LEU A 14 -18.762 99.153 55.748 1.00106.78 C ATOM 159 H LEU A 14 -18.558 103.781 53.918 1.00 0.00 H ATOM 160 N PRO A 15 -17.300 101.201 51.080 1.00 87.10 N ATOM 161 CA PRO A 15 -17.911 100.831 49.791 1.00 90.35 C ATOM 162 C PRO A 15 -18.891 99.672 49.869 1.00 84.12 C ATOM 163 O PRO A 15 -19.713 99.519 48.957 1.00 90.17 O ATOM 164 CB PRO A 15 -16.697 100.474 48.917 1.00 93.85 C ATOM 165 CG PRO A 15 -15.565 101.232 49.517 1.00 90.20 C ATOM 166 CD PRO A 15 -15.827 101.261 50.997 1.00 85.15 C ATOM 167 N PHE A 16 -18.820 98.889 50.917 1.00 72.17 N ATOM 168 CA PHE A 16 -19.700 97.709 51.014 1.00 69.25 C ATOM 169 C PHE A 16 -21.160 98.142 51.102 1.00 72.30 C ATOM 170 O PHE A 16 -21.997 97.356 50.711 1.00 75.91 O ATOM 171 CB PHE A 16 -19.187 96.753 52.098 1.00 57.26 C ATOM 172 CG PHE A 16 -18.294 95.661 51.570 1.00 53.90 C ATOM 173 CD1 PHE A 16 -18.702 94.855 50.524 1.00 60.26 C ATOM 174 CD2 PHE A 16 -17.040 95.460 52.088 1.00 48.57 C ATOM 175 CE1 PHE A 16 -17.883 93.861 50.026 1.00 61.05 C ATOM 176 CE2 PHE A 16 -16.229 94.455 51.599 1.00 50.41 C ATOM 177 CZ PHE A 16 -16.649 93.659 50.573 1.00 55.38 C ATOM 178 H PHE A 16 -18.144 99.099 51.679 1.00 0.00 H ATOM 179 N ALA A 17 -21.416 99.276 51.757 1.00 72.51 N ATOM 180 CA ALA A 17 -22.760 99.860 52.008 1.00 74.97 C ATOM 181 C ALA A 17 -23.475 100.363 50.748 1.00 85.40 C ATOM 182 O ALA A 17 -24.641 100.056 50.578 1.00 87.59 O ATOM 183 CB ALA A 17 -22.634 100.940 53.036 1.00 69.56 C ATOM 184 H ALA A 17 -20.598 99.801 52.127 1.00 0.00 H ATOM 185 N GLU A 18 -22.761 101.025 49.848 1.00 90.24 N ATOM 186 CA GLU A 18 -23.380 101.600 48.628 1.00100.06 C ATOM 187 C GLU A 18 -23.948 100.527 47.713 1.00106.45 C ATOM 188 O GLU A 18 -23.415 99.446 47.678 1.00103.76 O ATOM 189 CB GLU A 18 -22.331 102.386 47.872 1.00102.56 C ATOM 190 CG GLU A 18 -21.324 102.980 48.811 1.00 97.16 C ATOM 191 CD GLU A 18 -20.149 103.511 48.035 1.00 98.40 C ATOM 192 OE1 GLU A 18 -19.526 104.483 48.488 1.00 95.56 O ATOM 193 OE2 GLU A 18 -19.902 102.955 46.956 1.00101.72 O ATOM 194 H GLU A 18 -21.739 101.145 50.001 1.00 0.00 H ATOM 195 N GLN A 19 -25.030 100.844 47.007 1.00116.04 N ATOM 196 CA GLN A 19 -25.613 99.854 46.073 1.00125.14 C ATOM 197 C GLN A 19 -25.041 100.219 44.702 1.00130.45 C ATOM 198 O GLN A 19 -25.292 101.366 44.259 1.00133.85 O ATOM 199 CB GLN A 19 -27.140 99.815 46.234 1.00135.10 C ATOM 200 CG GLN A 19 -27.908 100.888 45.468 1.00142.41 C ATOM 201 CD GLN A 19 -29.011 101.620 46.210 1.00145.34 C ATOM 202 OE1 GLN A 19 -29.837 101.042 46.913 1.00144.04 O ATOM 203 NE2 GLN A 19 -29.068 102.928 46.012 1.00149.15 N ATOM 204 HE22 GLN A 19 -28.357 103.395 45.413 1.00 0.00 H ATOM 205 HE21 GLN A 19 -29.823 103.489 46.456 1.00 0.00 H ATOM 206 H GLN A 19 -25.465 101.783 47.111 1.00 0.00 H ATOM 207 N ASP A 20 -24.251 99.315 44.097 1.00130.93 N ATOM 208 CA ASP A 20 -23.542 99.630 42.827 1.00135.45 C ATOM 209 C ASP A 20 -23.783 98.657 41.684 1.00139.63 C ATOM 210 O ASP A 20 -23.551 99.074 40.542 1.00141.49 O ATOM 211 CB ASP A 20 -22.038 99.507 43.005 1.00130.21 C ATOM 212 CG ASP A 20 -21.492 100.712 43.716 1.00129.80 C ATOM 213 OD1 ASP A 20 -21.908 100.949 44.847 1.00123.23 O ATOM 214 OD2 ASP A 20 -20.697 101.410 43.121 1.00137.58 O ATOM 215 H ASP A 20 -24.133 98.375 44.526 1.00 0.00 H ATOM 216 N GLU A 21 -24.067 97.387 41.992 1.00140.64 N ATOM 217 CA GLU A 21 -24.269 96.258 41.030 1.00146.38 C ATOM 218 C GLU A 21 -22.915 95.756 40.498 1.00143.06 C ATOM 219 O GLU A 21 -22.604 94.585 40.755 1.00139.85 O ATOM 220 CB GLU A 21 -25.340 96.486 39.956 1.00157.05 C ATOM 221 CG GLU A 21 -25.032 95.691 38.707 1.00169.93 C ATOM 222 CD GLU A 21 -26.154 95.054 37.910 1.00178.01 C ATOM 223 OE1 GLU A 21 -27.050 94.417 38.524 1.00172.91 O ATOM 224 OE2 GLU A 21 -26.109 95.165 36.666 1.00188.34 O ATOM 225 H GLU A 21 -24.157 97.161 43.003 1.00 0.00 H ATOM 226 N GLN A 22 -22.085 96.614 39.899 1.00 81.94 N ATOM 227 CA GLN A 22 -20.756 96.159 39.449 1.00 83.60 C ATOM 228 C GLN A 22 -19.992 95.697 40.686 1.00 81.04 C ATOM 229 O GLN A 22 -19.373 94.664 40.629 1.00 79.32 O ATOM 230 CB GLN A 22 -20.026 97.279 38.719 1.00 88.88 C ATOM 231 CG GLN A 22 -18.797 96.808 37.968 1.00 89.20 C ATOM 232 CD GLN A 22 -19.083 95.664 37.032 1.00 87.90 C ATOM 233 OE1 GLN A 22 -18.793 94.512 37.325 1.00 85.34 O ATOM 234 NE2 GLN A 22 -19.631 95.982 35.881 1.00 89.24 N ATOM 235 HE22 GLN A 22 -19.862 96.974 35.672 1.00 0.00 H ATOM 236 HE21 GLN A 22 -19.834 95.242 35.179 1.00 0.00 H ATOM 237 H GLN A 22 -22.375 97.601 39.750 1.00 0.00 H ATOM 238 N ARG A 23 -20.049 96.443 41.773 1.00 82.89 N ATOM 239 CA ARG A 23 -19.419 95.969 43.015 1.00 82.37 C ATOM 240 C ARG A 23 -20.118 94.700 43.527 1.00 78.12 C ATOM 241 O ARG A 23 -19.428 93.870 44.066 1.00 75.25 O ATOM 242 CB ARG A 23 -19.388 97.108 44.031 1.00 87.31 C ATOM 243 CG ARG A 23 -18.883 96.684 45.395 1.00 88.13 C ATOM 244 CD ARG A 23 -18.753 97.866 46.332 1.00 94.57 C ATOM 245 NE ARG A 23 -17.823 98.839 45.798 1.00100.56 N ATOM 246 CZ ARG A 23 -18.014 100.145 45.824 1.00107.52 C ATOM 247 NH1 ARG A 23 -19.219 100.633 46.029 1.00108.23 N ATOM 248 NH2 ARG A 23 -16.994 100.961 45.647 1.00111.66 N ATOM 249 HE ARG A 23 -16.946 98.485 45.365 1.00 0.00 H ATOM 250 HH12 ARG A 23 -19.367 101.662 46.049 1.00 0.00 H ATOM 251 HH11 ARG A 23 -20.023 99.989 46.171 1.00 0.00 H ATOM 252 HH22 ARG A 23 -17.142 101.990 45.667 1.00 0.00 H ATOM 253 HH21 ARG A 23 -16.041 100.576 45.487 1.00 0.00 H ATOM 254 H ARG A 23 -20.537 97.361 41.752 1.00 0.00 H ATOM 255 N ASN A 24 -21.444 94.601 43.475 1.00 78.92 N ATOM 256 CA ASN A 24 -22.149 93.387 43.988 1.00 75.03 C ATOM 257 C ASN A 24 -21.902 92.168 43.103 1.00 70.56 C ATOM 258 O ASN A 24 -21.645 91.110 43.619 1.00 65.53 O ATOM 259 CB ASN A 24 -23.654 93.579 44.141 1.00 77.35 C ATOM 260 CG ASN A 24 -24.038 93.993 45.538 1.00 80.11 C ATOM 261 OD1 ASN A 24 -23.637 95.052 46.007 1.00 80.92 O ATOM 262 ND2 ASN A 24 -24.814 93.164 46.210 1.00 80.97 N ATOM 263 HD22 ASN A 24 -25.130 92.276 45.771 1.00 0.00 H ATOM 264 HD21 ASN A 24 -25.110 93.399 47.179 1.00 0.00 H ATOM 265 H ASN A 24 -21.999 95.382 43.070 1.00 0.00 H ATOM 266 N GLN A 25 -22.011 92.372 41.807 1.00 71.41 N ATOM 267 CA GLN A 25 -21.782 91.363 40.756 1.00 69.27 C ATOM 268 C GLN A 25 -20.344 90.856 40.881 1.00 62.63 C ATOM 269 O GLN A 25 -20.131 89.685 40.681 1.00 59.55 O ATOM 270 CB GLN A 25 -22.039 91.982 39.387 1.00 72.52 C ATOM 271 CG GLN A 25 -22.014 91.001 38.238 1.00 75.31 C ATOM 272 CD GLN A 25 -22.831 89.764 38.502 1.00 77.33 C ATOM 273 OE1 GLN A 25 -24.002 89.820 38.894 1.00 79.04 O ATOM 274 NE2 GLN A 25 -22.213 88.625 38.262 1.00 75.90 N ATOM 275 HE22 GLN A 25 -21.226 88.628 37.933 1.00 0.00 H ATOM 276 HE21 GLN A 25 -22.712 87.723 38.401 1.00 0.00 H ATOM 277 H GLN A 25 -22.282 93.327 41.498 1.00 0.00 H ATOM 278 N THR A 26 -19.400 91.734 41.183 1.00 60.96 N ATOM 279 CA THR A 26 -17.984 91.374 41.357 1.00 60.51 C ATOM 280 C THR A 26 -17.844 90.382 42.507 1.00 56.43 C ATOM 281 O THR A 26 -17.162 89.426 42.320 1.00 51.47 O ATOM 282 CB THR A 26 -17.122 92.596 41.623 1.00 61.35 C ATOM 283 OG1 THR A 26 -17.061 93.313 40.405 1.00 63.07 O ATOM 284 CG2 THR A 26 -15.741 92.220 42.100 1.00 59.53 C ATOM 285 HG1 THR A 26 -17.976 93.576 40.132 1.00 0.00 H ATOM 286 H THR A 26 -19.674 92.730 41.304 1.00 0.00 H ATOM 287 N TRP A 27 -18.538 90.582 43.620 1.00 57.84 N ATOM 288 CA TRP A 27 -18.443 89.672 44.754 1.00 53.72 C ATOM 289 C TRP A 27 -19.322 88.442 44.578 1.00 53.64 C ATOM 290 O TRP A 27 -18.995 87.377 45.110 1.00 52.41 O ATOM 291 CB TRP A 27 -18.801 90.404 46.043 1.00 54.66 C ATOM 292 CG TRP A 27 -17.645 91.187 46.580 1.00 58.26 C ATOM 293 CD1 TRP A 27 -17.511 92.541 46.609 1.00 60.22 C ATOM 294 CD2 TRP A 27 -16.444 90.651 47.140 1.00 56.85 C ATOM 295 NE1 TRP A 27 -16.302 92.883 47.161 1.00 60.93 N ATOM 296 CE2 TRP A 27 -15.627 91.739 47.495 1.00 57.39 C ATOM 297 CE3 TRP A 27 -15.979 89.354 47.375 1.00 53.51 C ATOM 298 CZ2 TRP A 27 -14.375 91.571 48.078 1.00 54.71 C ATOM 299 CZ3 TRP A 27 -14.735 89.190 47.953 1.00 52.55 C ATOM 300 CH2 TRP A 27 -13.948 90.294 48.301 1.00 50.15 C ATOM 301 HE1 TRP A 27 -15.955 93.853 47.303 1.00 0.00 H ATOM 302 H TRP A 27 -19.165 91.409 43.685 1.00 0.00 H ATOM 303 N LEU A 28 -20.430 88.559 43.849 1.00 56.15 N ATOM 304 CA LEU A 28 -21.186 87.370 43.477 1.00 58.57 C ATOM 305 C LEU A 28 -20.326 86.430 42.642 1.00 57.67 C ATOM 306 O LEU A 28 -20.401 85.206 42.795 1.00 56.15 O ATOM 307 CB LEU A 28 -22.448 87.765 42.713 1.00 64.63 C ATOM 308 CG LEU A 28 -23.323 86.607 42.224 1.00 70.02 C ATOM 309 CD1 LEU A 28 -23.843 85.788 43.399 1.00 70.37 C ATOM 310 CD2 LEU A 28 -24.479 87.122 41.374 1.00 73.18 C ATOM 311 H LEU A 28 -20.756 89.499 43.545 1.00 0.00 H ATOM 312 N GLU A 29 -19.487 86.990 41.765 1.00 57.31 N ATOM 313 CA GLU A 29 -18.611 86.172 40.935 1.00 56.24 C ATOM 314 C GLU A 29 -17.467 85.582 41.753 1.00 50.92 C ATOM 315 O GLU A 29 -17.148 84.395 41.624 1.00 52.67 O ATOM 316 CB GLU A 29 -18.067 87.006 39.770 1.00 59.91 C ATOM 317 CG GLU A 29 -19.129 87.463 38.781 1.00 65.47 C ATOM 318 CD GLU A 29 -18.608 88.483 37.780 1.00 70.20 C ATOM 319 OE1 GLU A 29 -17.385 88.744 37.769 1.00 70.06 O ATOM 320 OE2 GLU A 29 -19.425 89.029 37.005 1.00 72.64 O ATOM 321 H GLU A 29 -19.459 88.026 41.673 1.00 0.00 H ATOM 322 N LEU A 30 -16.833 86.396 42.594 1.00 48.15 N ATOM 323 CA LEU A 30 -15.695 85.912 43.369 1.00 47.43 C ATOM 324 C LEU A 30 -16.113 84.815 44.343 1.00 45.72 C ATOM 325 O LEU A 30 -15.391 83.829 44.527 1.00 40.60 O ATOM 326 CB LEU A 30 -15.033 87.066 44.121 1.00 45.52 C ATOM 327 CG LEU A 30 -14.279 88.102 43.284 1.00 48.69 C ATOM 328 CD1 LEU A 30 -13.643 89.144 44.189 1.00 49.01 C ATOM 329 CD2 LEU A 30 -13.224 87.453 42.405 1.00 49.07 C ATOM 330 H LEU A 30 -17.150 87.381 42.699 1.00 0.00 H ATOM 331 N VAL A 31 -17.277 84.969 44.980 1.00 46.70 N ATOM 332 CA VAL A 31 -17.731 83.969 45.941 1.00 44.66 C ATOM 333 C VAL A 31 -18.182 82.703 45.219 1.00 46.68 C ATOM 334 O VAL A 31 -17.826 81.586 45.607 1.00 46.31 O ATOM 335 CB VAL A 31 -18.855 84.544 46.821 1.00 45.91 C ATOM 336 CG1 VAL A 31 -19.469 83.450 47.679 1.00 47.03 C ATOM 337 CG2 VAL A 31 -18.317 85.669 47.696 1.00 44.92 C ATOM 338 H VAL A 31 -17.863 85.807 44.790 1.00 0.00 H ATOM 339 N GLY A 32 -18.968 82.857 44.155 1.00 48.62 N ATOM 340 CA GLY A 32 -19.411 81.697 43.408 1.00 48.82 C ATOM 341 C GLY A 32 -18.258 80.867 42.884 1.00 47.86 C ATOM 342 O GLY A 32 -18.320 79.634 42.874 1.00 49.85 O ATOM 343 H GLY A 32 -19.264 83.810 43.860 1.00 0.00 H ATOM 344 N GLU A 33 -17.187 81.529 42.445 1.00 47.96 N ATOM 345 CA GLU A 33 -16.035 80.811 41.915 1.00 53.75 C ATOM 346 C GLU A 33 -15.235 80.138 43.021 1.00 47.13 C ATOM 347 O GLU A 33 -14.684 79.056 42.812 1.00 45.62 O ATOM 348 CB GLU A 33 -15.158 81.768 41.109 1.00 63.24 C ATOM 349 CG GLU A 33 -15.781 82.180 39.779 1.00 74.03 C ATOM 350 CD GLU A 33 -15.394 83.585 39.345 1.00 81.01 C ATOM 351 OE1 GLU A 33 -14.554 84.219 40.022 1.00 82.06 O ATOM 352 OE2 GLU A 33 -15.937 84.060 38.321 1.00 84.72 O ATOM 353 H GLU A 33 -17.174 82.568 42.481 1.00 0.00 H ATOM 354 N ALA A 34 -15.155 80.757 44.200 1.00 45.64 N ATOM 355 CA ALA A 34 -14.470 80.119 45.319 1.00 39.84 C ATOM 356 C ALA A 34 -15.189 78.844 45.739 1.00 41.07 C ATOM 357 O ALA A 34 -14.550 77.823 46.010 1.00 43.12 O ATOM 358 CB ALA A 34 -14.366 81.091 46.499 1.00 37.98 C ATOM 359 H ALA A 34 -15.582 81.697 44.322 1.00 0.00 H ATOM 360 N GLN A 35 -16.522 78.879 45.795 1.00 43.04 N ATOM 361 CA GLN A 35 -17.274 77.693 46.172 1.00 47.97 C ATOM 362 C GLN A 35 -17.155 76.599 45.119 1.00 49.29 C ATOM 363 O GLN A 35 -17.198 75.411 45.456 1.00 48.73 O ATOM 364 CB GLN A 35 -18.740 78.053 46.404 1.00 52.93 C ATOM 365 CG GLN A 35 -19.573 76.922 46.989 1.00 60.35 C ATOM 366 CD GLN A 35 -19.031 76.423 48.317 1.00 62.05 C ATOM 367 OE1 GLN A 35 -18.576 75.279 48.427 1.00 63.14 O ATOM 368 NE2 GLN A 35 -19.077 77.279 49.337 1.00 60.46 N ATOM 369 HE22 GLN A 35 -19.469 78.232 49.198 1.00 0.00 H ATOM 370 HE21 GLN A 35 -18.721 76.994 50.272 1.00 0.00 H ATOM 371 H GLN A 35 -17.026 79.760 45.568 1.00 0.00 H ATOM 372 N GLN A 36 -17.009 76.973 43.846 1.00 49.32 N ATOM 373 CA GLN A 36 -16.872 75.971 42.795 1.00 54.40 C ATOM 374 C GLN A 36 -15.540 75.240 42.913 1.00 52.27 C ATOM 375 O GLN A 36 -15.484 74.010 42.810 1.00 52.72 O ATOM 376 CB GLN A 36 -17.010 76.624 41.422 1.00 60.24 C ATOM 377 CG GLN A 36 -16.967 75.636 40.268 1.00 68.53 C ATOM 378 CD GLN A 36 -17.325 76.271 38.937 1.00 72.02 C ATOM 379 OE1 GLN A 36 -17.778 77.419 38.883 1.00 71.78 O ATOM 380 NE2 GLN A 36 -17.122 75.529 37.854 1.00 73.79 N ATOM 381 HE22 GLN A 36 -16.738 74.567 37.947 1.00 0.00 H ATOM 382 HE21 GLN A 36 -17.347 75.910 36.913 1.00 0.00 H ATOM 383 H GLN A 36 -16.993 77.984 43.602 1.00 0.00 H ATOM 384 N LEU A 37 -14.454 75.983 43.133 1.00 49.00 N ATOM 385 CA LEU A 37 -13.158 75.346 43.335 1.00 47.88 C ATOM 386 C LEU A 37 -13.190 74.409 44.537 1.00 45.57 C ATOM 387 O LEU A 37 -12.644 73.303 44.487 1.00 48.16 O ATOM 388 CB LEU A 37 -12.072 76.404 43.519 1.00 41.58 C ATOM 389 CG LEU A 37 -11.754 77.310 42.331 1.00 39.89 C ATOM 390 CD1 LEU A 37 -10.603 78.237 42.695 1.00 40.56 C ATOM 391 CD2 LEU A 37 -11.419 76.506 41.085 1.00 41.64 C ATOM 392 H LEU A 37 -14.532 77.020 43.161 1.00 0.00 H ATOM 393 N MET A 38 -13.826 74.838 45.629 1.00 41.50 N ATOM 394 CA MET A 38 -13.916 73.995 46.814 1.00 41.64 C ATOM 395 C MET A 38 -14.723 72.733 46.536 1.00 46.98 C ATOM 396 O MET A 38 -14.368 71.644 47.000 1.00 48.37 O ATOM 397 CB MET A 38 -14.531 74.789 47.966 1.00 40.79 C ATOM 398 CG MET A 38 -13.679 75.970 48.412 1.00 37.36 C ATOM 399 SD MET A 38 -14.575 77.125 49.460 1.00 53.26 S ATOM 400 CE MET A 38 -14.987 76.088 50.869 1.00 40.97 C ATOM 401 H MET A 38 -14.261 75.783 45.634 1.00 0.00 H ATOM 402 N ASP A 39 -15.814 72.858 45.778 1.00 51.74 N ATOM 403 CA ASP A 39 -16.608 71.685 45.432 1.00 58.64 C ATOM 404 C ASP A 39 -15.793 70.692 44.613 1.00 61.07 C ATOM 405 O ASP A 39 -15.918 69.478 44.792 1.00 62.36 O ATOM 406 CB ASP A 39 -17.861 72.110 44.666 1.00 60.82 C ATOM 407 CG ASP A 39 -18.851 72.853 45.539 1.00 62.44 C ATOM 408 OD1 ASP A 39 -18.839 72.641 46.772 1.00 62.29 O ATOM 409 OD2 ASP A 39 -19.647 73.643 44.992 1.00 65.03 O ATOM 410 H ASP A 39 -16.099 73.796 45.432 1.00 0.00 H ATOM 411 N GLU A 40 -14.954 71.191 43.714 1.00 50.18 N ATOM 412 CA GLU A 40 -14.091 70.348 42.893 1.00 53.08 C ATOM 413 C GLU A 40 -12.853 69.862 43.641 1.00 55.56 C ATOM 414 O GLU A 40 -11.985 69.233 43.027 1.00 57.79 O ATOM 415 CB GLU A 40 -13.664 71.115 41.637 1.00 53.77 C ATOM 416 CG GLU A 40 -14.827 71.544 40.750 1.00 58.04 C ATOM 417 CD GLU A 40 -14.411 72.523 39.664 1.00 59.36 C ATOM 418 OE1 GLU A 40 -13.243 72.980 39.677 1.00 56.95 O ATOM 419 OE2 GLU A 40 -15.259 72.837 38.797 1.00 61.27 O ATOM 420 H GLU A 40 -14.910 72.223 43.590 1.00 0.00 H ATOM 421 N ARG A 41 -12.753 70.138 44.943 1.00 53.70 N ATOM 422 CA ARG A 41 -11.594 69.750 45.744 1.00 53.16 C ATOM 423 C ARG A 41 -10.312 70.392 45.220 1.00 53.31 C ATOM 424 O ARG A 41 -9.224 69.826 45.341 1.00 62.85 O ATOM 425 CB ARG A 41 -11.430 68.226 45.789 1.00 53.14 C ATOM 426 CG ARG A 41 -12.665 67.468 46.239 1.00 56.44 C ATOM 427 CD ARG A 41 -12.339 65.999 46.452 1.00 60.95 C ATOM 428 NE ARG A 41 -13.524 65.188 46.695 1.00 65.83 N ATOM 429 CZ ARG A 41 -13.508 63.864 46.825 1.00 72.45 C ATOM 430 NH1 ARG A 41 -12.361 63.202 46.743 1.00 74.86 N ATOM 431 NH2 ARG A 41 -14.637 63.197 47.040 1.00 75.94 N ATOM 432 HE ARG A 41 -14.440 65.674 46.772 1.00 0.00 H ATOM 433 HH12 ARG A 41 -12.350 62.167 46.845 1.00 0.00 H ATOM 434 HH11 ARG A 41 -11.473 63.718 46.577 1.00 0.00 H ATOM 435 HH22 ARG A 41 -14.618 62.162 47.141 1.00 0.00 H ATOM 436 HH21 ARG A 41 -15.539 63.710 47.107 1.00 0.00 H ATOM 437 H ARG A 41 -13.531 70.650 45.406 1.00 0.00 H ATOM 438 N CYS A 42 -10.432 71.571 44.636 1.00 52.72 N ATOM 439 CA CYS A 42 -9.267 72.253 44.083 1.00 49.38 C ATOM 440 C CYS A 42 -8.305 72.625 45.205 1.00 45.31 C ATOM 441 O CYS A 42 -8.711 73.279 46.169 1.00 42.84 O ATOM 442 CB CYS A 42 -9.702 73.500 43.317 1.00 47.36 C ATOM 443 SG CYS A 42 -8.355 74.358 42.475 1.00 49.12 S ATOM 444 H CYS A 42 -11.369 72.018 44.570 1.00 0.00 H ATOM 445 N PRO A 43 -7.036 72.220 45.129 1.00 44.62 N ATOM 446 CA PRO A 43 -6.079 72.618 46.164 1.00 43.45 C ATOM 447 C PRO A 43 -5.760 74.106 46.093 1.00 42.44 C ATOM 448 O PRO A 43 -5.899 74.758 45.055 1.00 38.50 O ATOM 449 CB PRO A 43 -4.843 71.767 45.862 1.00 40.95 C ATOM 450 CG PRO A 43 -4.954 71.439 44.420 1.00 47.19 C ATOM 451 CD PRO A 43 -6.426 71.323 44.126 1.00 46.64 C ATOM 452 N ALA A 44 -5.308 74.635 47.232 1.00 42.17 N ATOM 453 CA ALA A 44 -5.065 76.072 47.333 1.00 41.58 C ATOM 454 C ALA A 44 -3.863 76.504 46.504 1.00 40.78 C ATOM 455 O ALA A 44 -3.787 77.663 46.090 1.00 38.14 O ATOM 456 CB ALA A 44 -4.867 76.467 48.797 1.00 38.93 C ATOM 457 H ALA A 44 -5.128 74.021 48.052 1.00 0.00 H ATOM 458 N ASP A 45 -2.918 75.598 46.249 1.00 45.33 N ATOM 459 CA ASP A 45 -1.751 75.909 45.436 1.00 46.05 C ATOM 460 C ASP A 45 -1.998 75.689 43.947 1.00 47.22 C ATOM 461 O ASP A 45 -1.043 75.460 43.194 1.00 46.65 O ATOM 462 CB ASP A 45 -0.546 75.088 45.897 1.00 51.60 C ATOM 463 CG ASP A 45 -0.777 73.596 45.782 1.00 59.17 C ATOM 464 OD1 ASP A 45 -1.898 73.192 45.421 1.00 62.21 O ATOM 465 OD2 ASP A 45 0.167 72.825 46.056 1.00 63.08 O ATOM 466 H ASP A 45 -3.018 74.641 46.643 1.00 0.00 H ATOM 467 N GLU A 46 -3.256 75.746 43.505 1.00 46.74 N ATOM 468 CA GLU A 46 -3.604 75.627 42.096 1.00 46.58 C ATOM 469 C GLU A 46 -3.658 77.015 41.459 1.00 39.87 C ATOM 470 O GLU A 46 -4.188 77.955 42.063 1.00 38.04 O ATOM 471 CB GLU A 46 -4.957 74.933 41.938 1.00 50.38 C ATOM 472 CG GLU A 46 -5.002 73.859 40.857 1.00 54.49 C ATOM 473 CD GLU A 46 -5.490 74.387 39.517 1.00 59.35 C ATOM 474 OE1 GLU A 46 -5.526 75.624 39.329 1.00 56.96 O ATOM 475 OE2 GLU A 46 -5.842 73.555 38.646 1.00 62.34 O ATOM 476 H GLU A 46 -4.021 75.881 44.197 1.00 0.00 H ATOM 477 N PRO A 47 -3.118 77.184 40.249 1.00 36.82 N ATOM 478 CA PRO A 47 -3.100 78.531 39.647 1.00 37.11 C ATOM 479 C PRO A 47 -4.449 79.233 39.671 1.00 38.20 C ATOM 480 O PRO A 47 -4.510 80.434 39.971 1.00 33.92 O ATOM 481 CB PRO A 47 -2.627 78.263 38.211 1.00 37.86 C ATOM 482 CG PRO A 47 -1.803 77.024 38.322 1.00 39.94 C ATOM 483 CD PRO A 47 -2.456 76.184 39.392 1.00 37.27 C ATOM 484 N ARG A 48 -5.531 78.519 39.362 1.00 36.07 N ATOM 485 CA ARG A 48 -6.858 79.112 39.460 1.00 41.23 C ATOM 486 C ARG A 48 -7.132 79.604 40.875 1.00 35.62 C ATOM 487 O ARG A 48 -7.641 80.711 41.069 1.00 33.87 O ATOM 488 CB ARG A 48 -7.925 78.096 39.048 1.00 47.34 C ATOM 489 CG ARG A 48 -7.941 77.755 37.577 1.00 52.61 C ATOM 490 CD ARG A 48 -9.074 76.787 37.278 1.00 56.39 C ATOM 491 NE ARG A 48 -8.930 75.546 38.031 1.00 59.43 N ATOM 492 CZ ARG A 48 -9.895 74.647 38.192 1.00 63.00 C ATOM 493 NH1 ARG A 48 -11.094 74.849 37.656 1.00 63.38 N ATOM 494 NH2 ARG A 48 -9.663 73.545 38.895 1.00 64.52 N ATOM 495 HE ARG A 48 -8.009 75.352 38.472 1.00 0.00 H ATOM 496 HH12 ARG A 48 -11.847 74.143 37.784 1.00 0.00 H ATOM 497 HH11 ARG A 48 -11.280 75.713 37.108 1.00 0.00 H ATOM 498 HH22 ARG A 48 -10.418 72.841 39.022 1.00 0.00 H ATOM 499 HH21 ARG A 48 -8.727 73.386 39.319 1.00 0.00 H ATOM 500 H ARG A 48 -5.427 77.533 39.049 1.00 0.00 H ATOM 501 N ALA A 49 -6.816 78.778 41.875 1.00 34.36 N ATOM 502 CA ALA A 49 -7.039 79.171 43.261 1.00 36.97 C ATOM 503 C ALA A 49 -6.177 80.370 43.633 1.00 33.32 C ATOM 504 O ALA A 49 -6.656 81.312 44.262 1.00 29.25 O ATOM 505 CB ALA A 49 -6.756 77.996 44.198 1.00 32.93 C ATOM 506 H ALA A 49 -6.407 77.846 41.663 1.00 0.00 H ATOM 507 N ILE A 50 -4.901 80.345 43.251 1.00 34.56 N ATOM 508 CA ILE A 50 -4.005 81.455 43.560 1.00 28.83 C ATOM 509 C ILE A 50 -4.501 82.734 42.897 1.00 33.35 C ATOM 510 O ILE A 50 -4.603 83.788 43.540 1.00 33.13 O ATOM 511 CB ILE A 50 -2.568 81.117 43.126 1.00 31.49 C ATOM 512 CG1 ILE A 50 -1.934 80.142 44.129 1.00 33.48 C ATOM 513 CG2 ILE A 50 -1.736 82.388 42.991 1.00 30.90 C ATOM 514 CD1 ILE A 50 -0.630 79.528 43.662 1.00 32.40 C ATOM 515 H ILE A 50 -4.539 79.524 42.726 1.00 0.00 H ATOM 516 N ALA A 51 -4.823 82.660 41.602 1.00 30.05 N ATOM 517 CA ALA A 51 -5.287 83.842 40.885 1.00 33.78 C ATOM 518 C ALA A 51 -6.553 84.409 41.520 1.00 36.66 C ATOM 519 O ALA A 51 -6.687 85.632 41.682 1.00 31.61 O ATOM 520 CB ALA A 51 -5.530 83.501 39.418 1.00 33.59 C ATOM 521 H ALA A 51 -4.742 81.752 41.102 1.00 0.00 H ATOM 522 N LEU A 52 -7.497 83.536 41.887 1.00 35.67 N ATOM 523 CA LEU A 52 -8.706 83.997 42.554 1.00 34.32 C ATOM 524 C LEU A 52 -8.380 84.656 43.889 1.00 34.09 C ATOM 525 O LEU A 52 -8.942 85.702 44.224 1.00 35.07 O ATOM 526 CB LEU A 52 -9.668 82.830 42.759 1.00 34.76 C ATOM 527 CG LEU A 52 -10.932 83.126 43.564 1.00 34.46 C ATOM 528 CD1 LEU A 52 -11.827 84.119 42.838 1.00 35.81 C ATOM 529 CD2 LEU A 52 -11.693 81.839 43.862 1.00 36.76 C ATOM 530 H LEU A 52 -7.367 82.522 41.695 1.00 0.00 H ATOM 531 N ALA A 53 -7.475 84.056 44.666 1.00 30.12 N ATOM 532 CA ALA A 53 -7.160 84.606 45.982 1.00 33.87 C ATOM 533 C ALA A 53 -6.547 85.999 45.862 1.00 31.80 C ATOM 534 O ALA A 53 -6.866 86.893 46.652 1.00 32.11 O ATOM 535 CB ALA A 53 -6.211 83.666 46.731 1.00 29.00 C ATOM 536 H ALA A 53 -6.994 83.196 44.334 1.00 0.00 H ATOM 537 N THR A 54 -5.672 86.199 44.879 1.00 30.16 N ATOM 538 CA THR A 54 -5.070 87.512 44.676 1.00 35.39 C ATOM 539 C THR A 54 -6.129 88.551 44.322 1.00 37.12 C ATOM 540 O THR A 54 -6.178 89.635 44.919 1.00 33.29 O ATOM 541 CB THR A 54 -3.999 87.432 43.591 1.00 35.85 C ATOM 542 OG1 THR A 54 -2.929 86.595 44.054 1.00 32.86 O ATOM 543 CG2 THR A 54 -3.458 88.811 43.257 1.00 35.06 C ATOM 544 HG1 THR A 54 -3.280 85.689 44.246 1.00 0.00 H ATOM 545 H THR A 54 -5.415 85.412 44.250 1.00 0.00 H ATOM 546 N ARG A 55 -6.986 88.238 43.352 1.00 39.52 N ATOM 547 CA ARG A 55 -8.087 89.133 43.019 1.00 44.62 C ATOM 548 C ARG A 55 -8.967 89.380 44.239 1.00 41.64 C ATOM 549 O ARG A 55 -9.499 90.483 44.425 1.00 38.31 O ATOM 550 CB ARG A 55 -8.911 88.547 41.874 1.00 50.48 C ATOM 551 CG ARG A 55 -10.086 89.404 41.445 1.00 57.02 C ATOM 552 CD ARG A 55 -9.632 90.634 40.686 1.00 63.17 C ATOM 553 NE ARG A 55 -10.568 91.744 40.851 1.00 69.75 N ATOM 554 CZ ARG A 55 -11.770 91.805 40.282 1.00 74.25 C ATOM 555 NH1 ARG A 55 -12.547 92.861 40.491 1.00 77.09 N ATOM 556 NH2 ARG A 55 -12.201 90.811 39.513 1.00 72.86 N ATOM 557 HE ARG A 55 -10.275 92.540 41.453 1.00 0.00 H ATOM 558 HH12 ARG A 55 -13.486 92.911 40.048 1.00 0.00 H ATOM 559 HH11 ARG A 55 -12.216 93.638 41.098 1.00 0.00 H ATOM 560 HH22 ARG A 55 -13.141 90.865 39.072 1.00 0.00 H ATOM 561 HH21 ARG A 55 -11.598 89.979 39.352 1.00 0.00 H ATOM 562 H ARG A 55 -6.869 87.348 42.828 1.00 0.00 H ATOM 563 N TRP A 56 -9.137 88.361 45.075 1.00 39.85 N ATOM 564 CA TRP A 56 -9.961 88.497 46.269 1.00 37.05 C ATOM 565 C TRP A 56 -9.387 89.555 47.209 1.00 36.99 C ATOM 566 O TRP A 56 -10.119 90.403 47.726 1.00 32.64 O ATOM 567 CB TRP A 56 -10.064 87.144 46.968 1.00 34.14 C ATOM 568 CG TRP A 56 -11.185 87.025 47.928 1.00 36.94 C ATOM 569 CD1 TRP A 56 -11.336 87.717 49.100 1.00 41.88 C ATOM 570 CD2 TRP A 56 -12.319 86.152 47.830 1.00 35.60 C ATOM 571 NE1 TRP A 56 -12.500 87.335 49.728 1.00 39.93 N ATOM 572 CE2 TRP A 56 -13.115 86.369 48.972 1.00 38.33 C ATOM 573 CE3 TRP A 56 -12.736 85.215 46.890 1.00 39.93 C ATOM 574 CZ2 TRP A 56 -14.304 85.685 49.194 1.00 39.40 C ATOM 575 CZ3 TRP A 56 -13.920 84.536 47.112 1.00 41.20 C ATOM 576 CH2 TRP A 56 -14.689 84.772 48.252 1.00 37.58 C ATOM 577 HE1 TRP A 56 -12.855 87.716 50.628 1.00 0.00 H ATOM 578 H TRP A 56 -8.674 87.452 44.874 1.00 0.00 H ATOM 579 N MET A 57 -8.069 89.519 47.437 1.00 33.32 N ATOM 580 CA MET A 57 -7.450 90.466 48.350 1.00 34.76 C ATOM 581 C MET A 57 -7.406 91.863 47.747 1.00 40.28 C ATOM 582 O MET A 57 -7.559 92.859 48.466 1.00 41.18 O ATOM 583 CB MET A 57 -6.037 90.006 48.709 1.00 31.13 C ATOM 584 CG MET A 57 -5.990 88.736 49.560 1.00 33.87 C ATOM 585 SD MET A 57 -6.668 88.944 51.219 1.00 44.79 S ATOM 586 CE MET A 57 -8.288 88.245 51.016 1.00 28.01 C ATOM 587 H MET A 57 -7.482 88.807 46.957 1.00 0.00 H ATOM 588 N GLU A 58 -7.191 91.959 46.433 1.00 39.69 N ATOM 589 CA GLU A 58 -7.237 93.251 45.765 1.00 40.37 C ATOM 590 C GLU A 58 -8.604 93.900 45.936 1.00 38.84 C ATOM 591 O GLU A 58 -8.706 95.077 46.300 1.00 39.71 O ATOM 592 CB GLU A 58 -6.906 93.087 44.282 1.00 46.14 C ATOM 593 CG GLU A 58 -5.484 92.647 43.997 1.00 49.41 C ATOM 594 CD GLU A 58 -5.288 92.210 42.552 1.00 52.43 C ATOM 595 OE1 GLU A 58 -6.289 92.144 41.801 1.00 53.86 O ATOM 596 OE2 GLU A 58 -4.132 91.935 42.166 1.00 51.85 O ATOM 597 H GLU A 58 -6.988 91.101 45.881 1.00 0.00 H ATOM 598 N GLN A 59 -9.669 93.146 45.669 1.00 37.95 N ATOM 599 CA GLN A 59 -11.012 93.697 45.756 1.00 39.73 C ATOM 600 C GLN A 59 -11.383 94.023 47.199 1.00 39.60 C ATOM 601 O GLN A 59 -12.074 95.013 47.458 1.00 36.03 O ATOM 602 CB GLN A 59 -12.016 92.718 45.153 1.00 40.02 C ATOM 603 CG GLN A 59 -13.420 93.277 45.007 1.00 43.66 C ATOM 604 CD GLN A 59 -13.498 94.397 43.986 1.00 45.29 C ATOM 605 OE1 GLN A 59 -12.816 94.364 42.961 1.00 46.85 O ATOM 606 NE2 GLN A 59 -14.322 95.396 44.266 1.00 45.95 N ATOM 607 HE22 GLN A 59 -14.878 95.381 45.145 1.00 0.00 H ATOM 608 HE21 GLN A 59 -14.412 96.196 43.607 1.00 0.00 H ATOM 609 H GLN A 59 -9.539 92.151 45.395 1.00 0.00 H ATOM 610 N LEU A 60 -10.941 93.196 48.149 1.00 39.19 N ATOM 611 CA LEU A 60 -11.282 93.427 49.547 1.00 39.43 C ATOM 612 C LEU A 60 -10.621 94.697 50.072 1.00 37.20 C ATOM 613 O LEU A 60 -11.215 95.428 50.863 1.00 31.63 O ATOM 614 CB LEU A 60 -10.873 92.220 50.391 1.00 39.51 C ATOM 615 CG LEU A 60 -11.217 92.279 51.882 1.00 38.93 C ATOM 616 CD1 LEU A 60 -12.715 92.443 52.091 1.00 38.23 C ATOM 617 CD2 LEU A 60 -10.707 91.022 52.592 1.00 34.93 C ATOM 618 H LEU A 60 -10.349 92.381 47.890 1.00 0.00 H ATOM 619 N GLU A 61 -9.387 94.973 49.643 1.00 40.51 N ATOM 620 CA GLU A 61 -8.721 96.195 50.060 1.00 46.28 C ATOM 621 C GLU A 61 -9.387 97.419 49.435 1.00 49.24 C ATOM 622 O GLU A 61 -9.490 98.470 50.076 1.00 46.33 O ATOM 623 CB GLU A 61 -7.240 96.137 49.697 1.00 49.80 C ATOM 624 CG GLU A 61 -6.441 97.338 50.188 1.00 58.84 C ATOM 625 CD GLU A 61 -4.938 97.107 50.144 1.00 62.36 C ATOM 626 OE1 GLU A 61 -4.509 95.930 50.095 1.00 60.35 O ATOM 627 OE2 GLU A 61 -4.185 98.110 50.166 1.00 65.92 O ATOM 628 H GLU A 61 -8.900 94.310 49.007 1.00 0.00 H ATOM 629 N GLN A 62 -9.853 97.297 48.187 1.00 48.94 N ATOM 630 CA GLN A 62 -10.559 98.405 47.548 1.00 52.12 C ATOM 631 C GLN A 62 -11.869 98.707 48.268 1.00 48.83 C ATOM 632 O GLN A 62 -12.185 99.867 48.552 1.00 46.31 O ATOM 633 CB GLN A 62 -10.832 98.083 46.079 1.00 54.26 C ATOM 634 CG GLN A 62 -9.608 98.111 45.182 1.00 59.55 C ATOM 635 CD GLN A 62 -9.951 97.855 43.719 1.00 62.89 C ATOM 636 OE1 GLN A 62 -10.961 97.220 43.407 1.00 64.47 O ATOM 637 NE2 GLN A 62 -9.113 98.354 42.817 1.00 64.34 N ATOM 638 HE22 GLN A 62 -8.273 98.884 43.125 1.00 0.00 H ATOM 639 HE21 GLN A 62 -9.297 98.215 41.803 1.00 0.00 H ATOM 640 H GLN A 62 -9.712 96.407 47.668 1.00 0.00 H ATOM 641 N ASP A 63 -12.644 97.666 48.574 1.00 47.33 N ATOM 642 CA ASP A 63 -13.973 97.840 49.146 1.00 48.56 C ATOM 643 C ASP A 63 -13.959 98.045 50.655 1.00 43.53 C ATOM 644 O ASP A 63 -15.034 98.167 51.250 1.00 40.67 O ATOM 645 CB ASP A 63 -14.854 96.639 48.793 1.00 46.99 C ATOM 646 CG ASP A 63 -15.136 96.545 47.312 1.00 48.59 C ATOM 647 OD1 ASP A 63 -15.072 97.584 46.633 1.00 51.11 O ATOM 648 OD2 ASP A 63 -15.411 95.428 46.822 1.00 50.99 O ATOM 649 H ASP A 63 -12.290 96.704 48.400 1.00 0.00 H ATOM 650 N THR A 64 -12.785 98.066 51.284 1.00 38.24 N ATOM 651 CA THR A 64 -12.646 98.561 52.647 1.00 39.23 C ATOM 652 C THR A 64 -12.033 99.956 52.680 1.00 42.33 C ATOM 653 O THR A 64 -11.691 100.447 53.760 1.00 40.42 O ATOM 654 CB THR A 64 -11.802 97.611 53.499 1.00 35.61 C ATOM 655 OG1 THR A 64 -10.564 97.334 52.841 1.00 33.61 O ATOM 656 CG2 THR A 64 -12.554 96.312 53.768 1.00 34.46 C ATOM 657 HG1 THR A 64 -10.745 96.912 51.964 1.00 0.00 H ATOM 658 H THR A 64 -11.941 97.718 50.786 1.00 0.00 H ATOM 659 N ALA A 65 -11.886 100.597 51.515 1.00 43.71 N ATOM 660 CA ALA A 65 -11.275 101.921 51.414 1.00 45.14 C ATOM 661 C ALA A 65 -9.835 101.911 51.918 1.00 46.07 C ATOM 662 O ALA A 65 -9.336 102.920 52.420 1.00 47.65 O ATOM 663 CB ALA A 65 -12.094 102.964 52.172 1.00 47.68 C ATOM 664 H ALA A 65 -12.220 100.134 50.646 1.00 0.00 H ATOM 665 N GLY A 66 -9.159 100.771 51.788 1.00 39.23 N ATOM 666 CA GLY A 66 -7.810 100.649 52.300 1.00 43.68 C ATOM 667 C GLY A 66 -7.693 100.862 53.791 1.00 43.95 C ATOM 668 O GLY A 66 -6.598 101.126 54.286 1.00 44.86 O ATOM 669 H GLY A 66 -9.605 99.960 51.314 1.00 0.00 H ATOM 670 N ARG A 67 -8.800 100.754 54.521 1.00 42.86 N ATOM 671 CA ARG A 67 -8.798 100.967 55.959 1.00 46.21 C ATOM 672 C ARG A 67 -8.732 99.624 56.668 1.00 41.85 C ATOM 673 O ARG A 67 -9.729 98.884 56.660 1.00 35.71 O ATOM 674 CB ARG A 67 -10.047 101.732 56.390 1.00 47.37 C ATOM 675 CG ARG A 67 -10.179 103.111 55.766 1.00 54.04 C ATOM 676 CD ARG A 67 -11.017 104.017 56.647 1.00 63.45 C ATOM 677 NE ARG A 67 -11.271 105.313 56.023 1.00 72.98 N ATOM 678 CZ ARG A 67 -11.958 106.295 56.596 1.00 79.30 C ATOM 679 NH1 ARG A 67 -12.456 106.134 57.816 1.00 80.89 N ATOM 680 NH2 ARG A 67 -12.142 107.441 55.952 1.00 83.90 N ATOM 681 HE ARG A 67 -10.890 105.477 55.069 1.00 0.00 H ATOM 682 HH12 ARG A 67 -12.994 106.903 58.264 1.00 0.00 H ATOM 683 HH11 ARG A 67 -12.308 105.239 58.324 1.00 0.00 H ATOM 684 HH22 ARG A 67 -12.680 108.209 56.401 1.00 0.00 H ATOM 685 HH21 ARG A 67 -11.748 107.571 54.998 1.00 0.00 H ATOM 686 H ARG A 67 -9.694 100.510 54.049 1.00 0.00 H ATOM 687 N PRO A 68 -7.604 99.263 57.284 1.00 40.82 N ATOM 688 CA PRO A 68 -7.552 97.977 57.999 1.00 39.82 C ATOM 689 C PRO A 68 -8.542 97.883 59.148 1.00 39.60 C ATOM 690 O PRO A 68 -8.947 96.770 59.511 1.00 40.45 O ATOM 691 CB PRO A 68 -6.101 97.911 58.499 1.00 38.30 C ATOM 692 CG PRO A 68 -5.668 99.344 58.567 1.00 40.23 C ATOM 693 CD PRO A 68 -6.333 100.004 57.395 1.00 41.51 C ATOM 694 N GLU A 69 -8.945 99.010 59.734 1.00 41.20 N ATOM 695 CA GLU A 69 -9.917 98.963 60.820 1.00 45.12 C ATOM 696 C GLU A 69 -11.258 98.417 60.338 1.00 42.19 C ATOM 697 O GLU A 69 -11.994 97.805 61.116 1.00 37.50 O ATOM 698 CB GLU A 69 -10.089 100.353 61.443 1.00 52.16 C ATOM 699 CG GLU A 69 -10.624 101.419 60.495 1.00 59.33 C ATOM 700 CD GLU A 69 -9.541 102.351 59.978 1.00 61.80 C ATOM 701 OE1 GLU A 69 -9.819 103.568 59.843 1.00 63.13 O ATOM 702 OE2 GLU A 69 -8.414 101.870 59.711 1.00 57.82 O ATOM 703 H GLU A 69 -8.566 99.925 59.416 1.00 0.00 H ATOM 704 N PHE A 70 -11.587 98.617 59.058 1.00 39.21 N ATOM 705 CA PHE A 70 -12.783 98.004 58.498 1.00 36.60 C ATOM 706 C PHE A 70 -12.576 96.516 58.232 1.00 34.61 C ATOM 707 O PHE A 70 -13.521 95.732 58.343 1.00 31.15 O ATOM 708 CB PHE A 70 -13.194 98.700 57.201 1.00 38.13 C ATOM 709 CG PHE A 70 -13.689 100.119 57.385 1.00 39.84 C ATOM 710 CD1 PHE A 70 -14.003 100.612 58.634 1.00 41.68 C ATOM 711 CD2 PHE A 70 -13.843 100.944 56.288 1.00 41.43 C ATOM 712 CE1 PHE A 70 -14.459 101.910 58.788 1.00 45.86 C ATOM 713 CE2 PHE A 70 -14.301 102.240 56.433 1.00 46.62 C ATOM 714 CZ PHE A 70 -14.608 102.725 57.687 1.00 46.09 C ATOM 715 H PHE A 70 -10.984 99.215 58.458 1.00 0.00 H ATOM 716 N LEU A 71 -11.358 96.114 57.863 1.00 35.56 N ATOM 717 CA LEU A 71 -11.062 94.694 57.712 1.00 34.37 C ATOM 718 C LEU A 71 -11.250 93.964 59.037 1.00 38.67 C ATOM 719 O LEU A 71 -11.900 92.913 59.095 1.00 37.13 O ATOM 720 CB LEU A 71 -9.637 94.505 57.197 1.00 34.11 C ATOM 721 CG LEU A 71 -9.172 93.049 57.088 1.00 29.42 C ATOM 722 CD1 LEU A 71 -10.113 92.252 56.195 1.00 27.30 C ATOM 723 CD2 LEU A 71 -7.750 92.970 56.570 1.00 26.50 C ATOM 724 H LEU A 71 -10.615 96.818 57.682 1.00 0.00 H ATOM 725 N THR A 72 -10.690 94.515 60.122 1.00 39.22 N ATOM 726 CA THR A 72 -10.857 93.890 61.425 1.00 40.19 C ATOM 727 C THR A 72 -12.324 93.841 61.831 1.00 42.35 C ATOM 728 O THR A 72 -12.740 92.922 62.545 1.00 44.71 O ATOM 729 CB THR A 72 -10.034 94.634 62.482 1.00 42.68 C ATOM 730 OG1 THR A 72 -10.454 95.998 62.560 1.00 45.49 O ATOM 731 CG2 THR A 72 -8.555 94.583 62.142 1.00 41.10 C ATOM 732 HG1 THR A 72 -10.324 96.433 61.680 1.00 0.00 H ATOM 733 H THR A 72 -10.135 95.390 60.033 1.00 0.00 H ATOM 734 N ARG A 73 -13.125 94.809 61.379 1.00 42.58 N ATOM 735 CA ARG A 73 -14.546 94.808 61.714 1.00 43.36 C ATOM 736 C ARG A 73 -15.280 93.672 61.008 1.00 42.25 C ATOM 737 O ARG A 73 -16.143 93.015 61.604 1.00 39.93 O ATOM 738 CB ARG A 73 -15.165 96.156 61.353 1.00 44.45 C ATOM 739 CG ARG A 73 -16.431 96.503 62.124 1.00 47.58 C ATOM 740 CD ARG A 73 -16.128 96.952 63.553 1.00 50.97 C ATOM 741 NE ARG A 73 -15.129 98.021 63.592 1.00 54.13 N ATOM 742 CZ ARG A 73 -15.373 99.295 63.292 1.00 52.53 C ATOM 743 NH1 ARG A 73 -16.589 99.674 62.926 1.00 51.99 N ATOM 744 NH2 ARG A 73 -14.395 100.188 63.352 1.00 52.92 N ATOM 745 HE ARG A 73 -14.161 97.768 63.874 1.00 0.00 H ATOM 746 HH12 ARG A 73 -16.775 100.670 62.693 1.00 0.00 H ATOM 747 HH11 ARG A 73 -17.357 98.975 62.872 1.00 0.00 H ATOM 748 HH22 ARG A 73 -14.585 101.183 63.118 1.00 0.00 H ATOM 749 HH21 ARG A 73 -13.438 99.893 63.633 1.00 0.00 H ATOM 750 H ARG A 73 -12.734 95.568 60.785 1.00 0.00 H ATOM 751 N LEU A 74 -14.957 93.428 59.734 1.00 42.45 N ATOM 752 CA LEU A 74 -15.593 92.334 59.010 1.00 42.64 C ATOM 753 C LEU A 74 -15.258 90.986 59.637 1.00 39.17 C ATOM 754 O LEU A 74 -16.111 90.099 59.714 1.00 40.02 O ATOM 755 CB LEU A 74 -15.171 92.360 57.544 1.00 41.29 C ATOM 756 CG LEU A 74 -15.686 93.538 56.714 1.00 39.08 C ATOM 757 CD1 LEU A 74 -15.126 93.464 55.298 1.00 40.47 C ATOM 758 CD2 LEU A 74 -17.198 93.562 56.681 1.00 41.06 C ATOM 759 H LEU A 74 -14.249 94.021 59.257 1.00 0.00 H ATOM 760 N ASN A 75 -14.018 90.813 60.092 1.00 42.21 N ATOM 761 CA ASN A 75 -13.644 89.569 60.762 1.00 41.96 C ATOM 762 C ASN A 75 -14.408 89.397 62.066 1.00 43.34 C ATOM 763 O ASN A 75 -14.783 88.274 62.428 1.00 47.94 O ATOM 764 CB ASN A 75 -12.139 89.537 61.006 1.00 37.50 C ATOM 765 CG ASN A 75 -11.351 89.379 59.723 1.00 37.40 C ATOM 766 OD1 ASN A 75 -11.810 88.741 58.774 1.00 42.50 O ATOM 767 ND2 ASN A 75 -10.157 89.956 59.685 1.00 33.68 N ATOM 768 HD22 ASN A 75 -9.809 90.485 60.510 1.00 0.00 H ATOM 769 HD21 ASN A 75 -9.569 89.879 58.830 1.00 0.00 H ATOM 770 H ASN A 75 -13.312 91.567 59.970 1.00 0.00 H ATOM 771 N GLU A 76 -14.653 90.497 62.787 1.00 40.60 N ATOM 772 CA GLU A 76 -15.536 90.435 63.946 1.00 45.13 C ATOM 773 C GLU A 76 -16.917 89.937 63.544 1.00 46.95 C ATOM 774 O GLU A 76 -17.524 89.122 64.248 1.00 48.65 O ATOM 775 CB GLU A 76 -15.644 91.809 64.608 1.00 48.63 C ATOM 776 CG GLU A 76 -14.368 92.299 65.283 1.00 51.26 C ATOM 777 CD GLU A 76 -14.478 93.749 65.767 1.00 56.11 C ATOM 778 OE1 GLU A 76 -13.624 94.577 65.379 1.00 56.15 O ATOM 779 OE2 GLU A 76 -15.424 94.061 66.524 1.00 55.45 O ATOM 780 H GLU A 76 -14.212 91.400 62.520 1.00 0.00 H ATOM 781 N MET A 77 -17.428 90.416 62.407 1.00 48.23 N ATOM 782 CA MET A 77 -18.751 90.007 61.949 1.00 49.08 C ATOM 783 C MET A 77 -18.771 88.527 61.579 1.00 49.39 C ATOM 784 O MET A 77 -19.675 87.792 61.981 1.00 54.77 O ATOM 785 CB MET A 77 -19.176 90.866 60.759 1.00 46.58 C ATOM 786 CG MET A 77 -19.479 92.311 61.120 1.00 49.60 C ATOM 787 SD MET A 77 -19.760 93.353 59.671 1.00 52.99 S ATOM 788 CE MET A 77 -21.273 92.647 59.019 1.00 47.72 C ATOM 789 H MET A 77 -16.875 91.090 61.840 1.00 0.00 H ATOM 790 N HIS A 78 -17.780 88.072 60.815 1.00 47.27 N ATOM 791 CA HIS A 78 -17.743 86.669 60.421 1.00 50.20 C ATOM 792 C HIS A 78 -17.756 85.743 61.628 1.00 52.33 C ATOM 793 O HIS A 78 -18.304 84.639 61.556 1.00 56.64 O ATOM 794 CB HIS A 78 -16.509 86.397 59.561 1.00 47.60 C ATOM 795 CG HIS A 78 -16.626 86.921 58.165 1.00 48.03 C ATOM 796 ND1 HIS A 78 -17.540 86.426 57.259 1.00 47.96 N ATOM 797 CD2 HIS A 78 -15.950 87.905 57.522 1.00 44.22 C ATOM 798 CE1 HIS A 78 -17.423 87.080 56.118 1.00 46.13 C ATOM 799 NE2 HIS A 78 -16.467 87.984 56.252 1.00 45.11 N ATOM 800 H HIS A 78 -17.030 88.719 60.498 1.00 0.00 H ATOM 801 N ALA A 79 -17.172 86.166 62.744 1.00 53.03 N ATOM 802 CA ALA A 79 -17.150 85.343 63.940 1.00 53.28 C ATOM 803 C ALA A 79 -18.405 85.507 64.780 1.00 54.63 C ATOM 804 O ALA A 79 -18.891 84.533 65.363 1.00 56.25 O ATOM 805 CB ALA A 79 -15.912 85.673 64.786 1.00 52.72 C ATOM 806 H ALA A 79 -16.722 87.104 62.761 1.00 0.00 H ATOM 807 N ALA A 80 -18.956 86.720 64.837 1.00 55.39 N ATOM 808 CA ALA A 80 -20.043 87.034 65.756 1.00 55.76 C ATOM 809 C ALA A 80 -21.407 87.165 65.100 1.00 56.44 C ATOM 810 O ALA A 80 -22.417 86.969 65.781 1.00 59.86 O ATOM 811 CB ALA A 80 -19.740 88.341 66.503 1.00 56.01 C ATOM 812 H ALA A 80 -18.599 87.465 64.206 1.00 0.00 H ATOM 813 N GLU A 81 -21.475 87.494 63.812 1.00 56.28 N ATOM 814 CA GLU A 81 -22.761 87.671 63.145 1.00 61.06 C ATOM 815 C GLU A 81 -23.250 86.344 62.583 1.00 63.05 C ATOM 816 O GLU A 81 -22.569 85.757 61.733 1.00 62.57 O ATOM 817 CB GLU A 81 -22.651 88.688 62.022 1.00 60.52 C ATOM 818 CG GLU A 81 -23.040 90.086 62.428 1.00 62.33 C ATOM 819 CD GLU A 81 -24.506 90.200 62.805 1.00 66.70 C ATOM 820 OE1 GLU A 81 -25.331 89.454 62.237 1.00 69.18 O ATOM 821 OE2 GLU A 81 -24.833 91.033 63.675 1.00 67.20 O ATOM 822 H GLU A 81 -20.596 87.627 63.272 1.00 0.00 H ATOM 823 N PRO A 82 -24.412 85.843 63.010 1.00 66.97 N ATOM 824 CA PRO A 82 -24.966 84.644 62.360 1.00 68.76 C ATOM 825 C PRO A 82 -25.465 84.905 60.951 1.00 70.49 C ATOM 826 O PRO A 82 -25.556 83.957 60.160 1.00 72.69 O ATOM 827 CB PRO A 82 -26.113 84.235 63.292 1.00 73.21 C ATOM 828 CG PRO A 82 -26.539 85.514 63.934 1.00 73.47 C ATOM 829 CD PRO A 82 -25.282 86.335 64.097 1.00 68.52 C ATOM 830 N GLN A 83 -25.780 86.158 60.610 1.00 71.34 N ATOM 831 CA GLN A 83 -26.287 86.478 59.283 1.00 71.48 C ATOM 832 C GLN A 83 -25.193 86.550 58.221 1.00 67.22 C ATOM 833 O GLN A 83 -25.511 86.525 57.027 1.00 69.81 O ATOM 834 CB GLN A 83 -27.035 87.813 59.307 1.00 70.02 C ATOM 835 CG GLN A 83 -28.481 87.727 59.741 1.00 78.10 C ATOM 836 CD GLN A 83 -29.341 88.782 59.067 1.00 81.73 C ATOM 837 OE1 GLN A 83 -29.470 88.801 57.841 1.00 81.75 O ATOM 838 NE2 GLN A 83 -29.925 89.669 59.862 1.00 84.37 N ATOM 839 HE22 GLN A 83 -29.788 89.614 60.891 1.00 0.00 H ATOM 840 HE21 GLN A 83 -30.520 90.419 59.456 1.00 0.00 H ATOM 841 H GLN A 83 -25.661 86.921 61.307 1.00 0.00 H ATOM 842 N MET A 84 -23.924 86.649 58.619 1.00 62.68 N ATOM 843 CA MET A 84 -22.855 86.812 57.638 1.00 61.53 C ATOM 844 C MET A 84 -22.867 85.678 56.616 1.00 62.71 C ATOM 845 O MET A 84 -22.794 85.920 55.407 1.00 62.33 O ATOM 846 CB MET A 84 -21.499 86.882 58.342 1.00 58.18 C ATOM 847 CG MET A 84 -21.000 88.295 58.628 1.00 54.50 C ATOM 848 SD MET A 84 -20.880 89.348 57.169 1.00 52.05 S ATOM 849 CE MET A 84 -19.253 90.068 57.367 1.00 44.92 C ATOM 850 H MET A 84 -23.695 86.610 59.633 1.00 0.00 H ATOM 851 N ARG A 85 -22.962 84.433 57.085 1.00 66.63 N ATOM 852 CA ARG A 85 -22.931 83.293 56.177 1.00 68.51 C ATOM 853 C ARG A 85 -24.049 83.387 55.145 1.00 70.42 C ATOM 854 O ARG A 85 -23.814 83.230 53.941 1.00 69.69 O ATOM 855 CB ARG A 85 -23.039 81.992 56.975 1.00 75.98 C ATOM 856 CG ARG A 85 -22.493 80.765 56.259 1.00 80.10 C ATOM 857 CD ARG A 85 -22.857 79.486 57.003 1.00 86.62 C ATOM 858 NE ARG A 85 -21.712 78.594 57.181 1.00 87.39 N ATOM 859 CZ ARG A 85 -21.402 77.584 56.370 1.00 89.44 C ATOM 860 NH1 ARG A 85 -22.148 77.314 55.305 1.00 91.40 N ATOM 861 NH2 ARG A 85 -20.338 76.838 56.629 1.00 89.16 N ATOM 862 HE ARG A 85 -21.094 78.760 58.001 1.00 0.00 H ATOM 863 HH12 ARG A 85 -21.895 76.522 54.680 1.00 0.00 H ATOM 864 HH11 ARG A 85 -22.985 77.894 55.096 1.00 0.00 H ATOM 865 HH22 ARG A 85 -20.091 76.048 55.999 1.00 0.00 H ATOM 866 HH21 ARG A 85 -19.750 77.042 57.462 1.00 0.00 H ATOM 867 H ARG A 85 -23.059 84.274 58.108 1.00 0.00 H ATOM 868 N GLU A 86 -25.280 83.646 55.599 1.00 74.60 N ATOM 869 CA GLU A 86 -26.421 83.702 54.693 1.00 74.67 C ATOM 870 C GLU A 86 -26.451 84.985 53.871 1.00 69.73 C ATOM 871 O GLU A 86 -26.892 84.966 52.718 1.00 71.37 O ATOM 872 CB GLU A 86 -27.727 83.578 55.484 1.00 82.69 C ATOM 873 CG GLU A 86 -28.342 82.185 55.486 1.00 91.22 C ATOM 874 CD GLU A 86 -27.517 81.174 56.260 1.00 92.43 C ATOM 875 OE1 GLU A 86 -26.369 81.501 56.637 1.00 87.74 O ATOM 876 OE2 GLU A 86 -28.020 80.054 56.494 1.00 97.32 O ATOM 877 H GLU A 86 -25.426 83.810 56.616 1.00 0.00 H ATOM 878 N GLN A 87 -25.995 86.101 54.439 1.00 66.48 N ATOM 879 CA GLN A 87 -26.111 87.388 53.764 1.00 65.08 C ATOM 880 C GLN A 87 -25.082 87.540 52.649 1.00 61.45 C ATOM 881 O GLN A 87 -25.383 88.129 51.605 1.00 63.03 O ATOM 882 CB GLN A 87 -25.956 88.522 54.784 1.00 65.55 C ATOM 883 CG GLN A 87 -26.062 89.924 54.204 1.00 68.20 C ATOM 884 CD GLN A 87 -27.481 90.304 53.838 1.00 76.85 C ATOM 885 OE1 GLN A 87 -28.392 89.473 53.871 1.00 82.25 O ATOM 886 NE2 GLN A 87 -27.681 91.572 53.488 1.00 79.46 N ATOM 887 HE22 GLN A 87 -26.884 92.240 53.474 1.00 0.00 H ATOM 888 HE21 GLN A 87 -28.635 91.896 53.229 1.00 0.00 H ATOM 889 H GLN A 87 -25.550 86.053 55.378 1.00 0.00 H ATOM 890 N THR A 88 -23.872 87.019 52.847 1.00 56.65 N ATOM 891 CA THR A 88 -22.778 87.244 51.918 1.00 52.99 C ATOM 892 C THR A 88 -22.335 85.994 51.172 1.00 52.38 C ATOM 893 O THR A 88 -21.579 86.112 50.202 1.00 50.66 O ATOM 894 CB THR A 88 -21.562 87.821 52.660 1.00 49.96 C ATOM 895 OG1 THR A 88 -20.961 86.793 53.463 1.00 48.58 O ATOM 896 CG2 THR A 88 -21.979 88.987 53.551 1.00 49.49 C ATOM 897 HG1 THR A 88 -21.622 86.460 54.120 1.00 0.00 H ATOM 898 H THR A 88 -23.706 86.434 53.691 1.00 0.00 H ATOM 899 N GLY A 89 -22.773 84.810 51.593 1.00 55.09 N ATOM 900 CA GLY A 89 -22.291 83.579 51.009 1.00 55.05 C ATOM 901 C GLY A 89 -20.851 83.239 51.322 1.00 53.58 C ATOM 902 O GLY A 89 -20.341 82.247 50.792 1.00 55.07 O ATOM 903 H GLY A 89 -23.477 84.770 52.358 1.00 0.00 H ATOM 904 N VAL A 90 -20.183 84.025 52.162 1.00 50.63 N ATOM 905 CA VAL A 90 -18.796 83.791 52.541 1.00 50.22 C ATOM 906 C VAL A 90 -18.789 83.008 53.847 1.00 53.37 C ATOM 907 O VAL A 90 -19.263 83.500 54.876 1.00 52.30 O ATOM 908 CB VAL A 90 -18.023 85.111 52.687 1.00 47.94 C ATOM 909 CG1 VAL A 90 -16.601 84.856 53.179 1.00 43.97 C ATOM 910 CG2 VAL A 90 -18.013 85.873 51.364 1.00 45.49 C ATOM 911 H VAL A 90 -20.675 84.847 52.568 1.00 0.00 H ATOM 912 N THR A 91 -18.254 81.793 53.806 1.00 55.70 N ATOM 913 CA THR A 91 -18.182 80.932 54.977 1.00 55.59 C ATOM 914 C THR A 91 -16.794 80.989 55.596 1.00 50.79 C ATOM 915 O THR A 91 -15.824 81.385 54.944 1.00 44.37 O ATOM 916 CB THR A 91 -18.511 79.483 54.601 1.00 57.70 C ATOM 917 OG1 THR A 91 -17.504 78.973 53.714 1.00 55.96 O ATOM 918 CG2 THR A 91 -19.866 79.397 53.921 1.00 57.74 C ATOM 919 HG1 THR A 91 -17.721 78.037 53.474 1.00 0.00 H ATOM 920 H THR A 91 -17.872 81.444 52.904 1.00 0.00 H ATOM 921 N PRO A 92 -16.662 80.610 56.869 1.00 36.10 N ATOM 922 CA PRO A 92 -15.313 80.534 57.459 1.00 36.85 C ATOM 923 C PRO A 92 -14.413 79.560 56.718 1.00 36.95 C ATOM 924 O PRO A 92 -13.211 79.807 56.583 1.00 40.10 O ATOM 925 CB PRO A 92 -15.582 80.083 58.904 1.00 38.37 C ATOM 926 CG PRO A 92 -17.013 80.412 59.164 1.00 38.30 C ATOM 927 CD PRO A 92 -17.715 80.265 57.845 1.00 40.13 C ATOM 928 N GLU A 93 -14.971 78.457 56.221 1.00 42.89 N ATOM 929 CA GLU A 93 -14.187 77.517 55.430 1.00 45.59 C ATOM 930 C GLU A 93 -13.699 78.168 54.142 1.00 43.42 C ATOM 931 O GLU A 93 -12.586 77.894 53.678 1.00 41.08 O ATOM 932 CB GLU A 93 -15.014 76.269 55.119 1.00 51.25 C ATOM 933 CG GLU A 93 -15.394 75.430 56.340 1.00 56.58 C ATOM 934 CD GLU A 93 -16.550 76.017 57.131 1.00 60.10 C ATOM 935 OE1 GLU A 93 -16.408 76.185 58.359 1.00 61.54 O ATOM 936 OE2 GLU A 93 -17.602 76.318 56.524 1.00 62.36 O ATOM 937 H GLU A 93 -15.977 78.265 56.400 1.00 0.00 H ATOM 938 N MET A 94 -14.521 79.036 53.549 1.00 38.61 N ATOM 939 CA MET A 94 -14.117 79.726 52.332 1.00 37.25 C ATOM 940 C MET A 94 -12.971 80.695 52.600 1.00 31.77 C ATOM 941 O MET A 94 -12.034 80.787 51.803 1.00 31.38 O ATOM 942 CB MET A 94 -15.317 80.453 51.729 1.00 35.51 C ATOM 943 CG MET A 94 -15.051 81.068 50.365 1.00 37.84 C ATOM 944 SD MET A 94 -16.527 81.832 49.649 1.00 36.86 S ATOM 945 CE MET A 94 -17.554 80.383 49.396 1.00 42.41 C ATOM 946 H MET A 94 -15.458 79.221 53.960 1.00 0.00 H ATOM 947 N ILE A 95 -13.022 81.416 53.722 1.00 34.32 N ATOM 948 CA ILE A 95 -11.935 82.319 54.080 1.00 31.32 C ATOM 949 C ILE A 95 -10.643 81.545 54.287 1.00 28.23 C ATOM 950 O ILE A 95 -9.566 81.994 53.890 1.00 30.04 O ATOM 951 CB ILE A 95 -12.308 83.135 55.334 1.00 34.34 C ATOM 952 CG1 ILE A 95 -13.495 84.058 55.041 1.00 36.03 C ATOM 953 CG2 ILE A 95 -11.110 83.940 55.824 1.00 35.34 C ATOM 954 CD1 ILE A 95 -14.040 84.768 56.269 1.00 39.65 C ATOM 955 H ILE A 95 -13.848 81.333 54.349 1.00 0.00 H ATOM 956 N ASP A 96 -10.723 80.377 54.926 1.00 34.48 N ATOM 957 CA ASP A 96 -9.530 79.555 55.115 1.00 37.18 C ATOM 958 C ASP A 96 -8.943 79.126 53.777 1.00 33.34 C ATOM 959 O ASP A 96 -7.716 79.072 53.618 1.00 32.10 O ATOM 960 CB ASP A 96 -9.856 78.330 55.970 1.00 35.58 C ATOM 961 CG ASP A 96 -9.995 78.669 57.443 1.00 39.29 C ATOM 962 OD1 ASP A 96 -9.380 79.659 57.889 1.00 42.69 O ATOM 963 OD2 ASP A 96 -10.717 77.947 58.159 1.00 42.85 O ATOM 964 H ASP A 96 -11.640 80.050 55.292 1.00 0.00 H ATOM 965 N PHE A 97 -9.801 78.830 52.802 1.00 31.02 N ATOM 966 CA PHE A 97 -9.319 78.464 51.473 1.00 34.76 C ATOM 967 C PHE A 97 -8.616 79.641 50.801 1.00 32.31 C ATOM 968 O PHE A 97 -7.501 79.498 50.282 1.00 34.73 O ATOM 969 CB PHE A 97 -10.488 77.957 50.622 1.00 34.27 C ATOM 970 CG PHE A 97 -10.109 77.602 49.215 1.00 36.93 C ATOM 971 CD1 PHE A 97 -9.345 76.478 48.952 1.00 41.05 C ATOM 972 CD2 PHE A 97 -10.532 78.381 48.151 1.00 38.18 C ATOM 973 CE1 PHE A 97 -8.998 76.144 47.653 1.00 41.58 C ATOM 974 CE2 PHE A 97 -10.189 78.052 46.850 1.00 39.47 C ATOM 975 CZ PHE A 97 -9.418 76.934 46.605 1.00 40.92 C ATOM 976 H PHE A 97 -10.824 78.860 52.989 1.00 0.00 H ATOM 977 N ILE A 98 -9.244 80.817 50.811 1.00 29.42 N ATOM 978 CA ILE A 98 -8.627 81.990 50.190 1.00 30.83 C ATOM 979 C ILE A 98 -7.326 82.341 50.897 1.00 29.32 C ATOM 980 O ILE A 98 -6.316 82.667 50.256 1.00 28.24 O ATOM 981 CB ILE A 98 -9.611 83.178 50.191 1.00 32.11 C ATOM 982 CG1 ILE A 98 -10.850 82.864 49.344 1.00 29.75 C ATOM 983 CG2 ILE A 98 -8.922 84.452 49.698 1.00 26.95 C ATOM 984 CD1 ILE A 98 -10.568 82.694 47.855 1.00 30.70 C ATOM 985 H ILE A 98 -10.177 80.901 51.262 1.00 0.00 H ATOM 986 N THR A 99 -7.322 82.276 52.231 1.00 26.82 N ATOM 987 CA THR A 99 -6.115 82.581 52.986 1.00 25.65 C ATOM 988 C THR A 99 -4.965 81.671 52.578 1.00 28.88 C ATOM 989 O THR A 99 -3.831 82.127 52.382 1.00 24.22 O ATOM 990 CB THR A 99 -6.391 82.449 54.486 1.00 28.98 C ATOM 991 OG1 THR A 99 -7.356 83.425 54.884 1.00 27.47 O ATOM 992 CG2 THR A 99 -5.110 82.640 55.285 1.00 30.84 C ATOM 993 HG1 THR A 99 -8.196 83.281 54.381 1.00 0.00 H ATOM 994 H THR A 99 -8.190 82.005 52.736 1.00 0.00 H ATOM 995 N ARG A 100 -5.235 80.369 52.455 1.00 29.26 N ATOM 996 CA ARG A 100 -4.181 79.431 52.086 1.00 35.77 C ATOM 997 C ARG A 100 -3.720 79.656 50.650 1.00 31.43 C ATOM 998 O ARG A 100 -2.524 79.564 50.356 1.00 30.07 O ATOM 999 CB ARG A 100 -4.672 77.990 52.278 1.00 35.15 C ATOM 1000 CG ARG A 100 -3.610 76.946 52.067 1.00 35.27 C ATOM 1001 CD ARG A 100 -4.034 75.595 52.651 1.00 41.28 C ATOM 1002 NE ARG A 100 -4.175 75.665 54.101 1.00 42.35 N ATOM 1003 CZ ARG A 100 -3.153 75.617 54.955 1.00 42.08 C ATOM 1004 NH1 ARG A 100 -1.912 75.499 54.505 1.00 39.82 N ATOM 1005 NH2 ARG A 100 -3.373 75.691 56.262 1.00 40.93 N ATOM 1006 HE ARG A 100 -5.134 75.758 54.493 1.00 0.00 H ATOM 1007 HH12 ARG A 100 -1.117 75.462 55.175 1.00 0.00 H ATOM 1008 HH11 ARG A 100 -1.733 75.444 53.482 1.00 0.00 H ATOM 1009 HH22 ARG A 100 -2.574 75.653 56.927 1.00 0.00 H ATOM 1010 HH21 ARG A 100 -4.344 75.787 56.621 1.00 0.00 H ATOM 1011 H ARG A 100 -6.201 80.022 52.623 1.00 0.00 H ATOM 1012 N ALA A 101 -4.650 79.966 49.746 1.00 32.49 N ATOM 1013 CA ALA A 101 -4.281 80.203 48.354 1.00 30.21 C ATOM 1014 C ALA A 101 -3.450 81.470 48.213 1.00 32.14 C ATOM 1015 O ALA A 101 -2.476 81.497 47.449 1.00 32.05 O ATOM 1016 CB ALA A 101 -5.535 80.284 47.484 1.00 32.72 C ATOM 1017 H ALA A 101 -5.646 80.039 50.035 1.00 0.00 H ATOM 1018 N PHE A 102 -3.809 82.531 48.943 1.00 26.63 N ATOM 1019 CA PHE A 102 -3.031 83.760 48.881 1.00 26.91 C ATOM 1020 C PHE A 102 -1.643 83.559 49.471 1.00 29.10 C ATOM 1021 O PHE A 102 -0.655 84.062 48.932 1.00 29.59 O ATOM 1022 CB PHE A 102 -3.777 84.886 49.606 1.00 31.04 C ATOM 1023 CG PHE A 102 -3.192 86.248 49.379 1.00 33.22 C ATOM 1024 CD1 PHE A 102 -3.140 86.790 48.104 1.00 36.58 C ATOM 1025 CD2 PHE A 102 -2.705 86.994 50.434 1.00 30.43 C ATOM 1026 CE1 PHE A 102 -2.605 88.041 47.882 1.00 32.09 C ATOM 1027 CE2 PHE A 102 -2.170 88.249 50.225 1.00 31.45 C ATOM 1028 CZ PHE A 102 -2.120 88.774 48.946 1.00 35.39 C ATOM 1029 H PHE A 102 -4.647 82.478 49.557 1.00 0.00 H ATOM 1030 N ALA A 103 -1.541 82.818 50.582 1.00 32.07 N ATOM 1031 CA ALA A 103 -0.234 82.490 51.133 1.00 28.99 C ATOM 1032 C ALA A 103 0.612 81.727 50.120 1.00 31.16 C ATOM 1033 O ALA A 103 1.825 81.951 50.013 1.00 25.29 O ATOM 1034 CB ALA A 103 -0.393 81.670 52.415 1.00 30.45 C ATOM 1035 H ALA A 103 -2.402 82.475 51.054 1.00 0.00 H ATOM 1036 N GLU A 104 -0.013 80.818 49.364 1.00 33.96 N ATOM 1037 CA GLU A 104 0.722 80.071 48.352 1.00 37.19 C ATOM 1038 C GLU A 104 1.296 80.990 47.284 1.00 32.55 C ATOM 1039 O GLU A 104 2.370 80.710 46.742 1.00 31.86 O ATOM 1040 CB GLU A 104 -0.192 79.028 47.708 1.00 46.72 C ATOM 1041 CG GLU A 104 -0.476 77.832 48.590 1.00 49.01 C ATOM 1042 CD GLU A 104 0.762 76.995 48.827 1.00 52.44 C ATOM 1043 OE1 GLU A 104 0.811 76.276 49.851 1.00 55.28 O ATOM 1044 OE2 GLU A 104 1.696 77.054 47.996 1.00 51.84 O ATOM 1045 H GLU A 104 -1.029 80.643 49.499 1.00 0.00 H ATOM 1046 N SER A 105 0.603 82.090 46.976 1.00 31.51 N ATOM 1047 CA SER A 105 1.097 83.021 45.969 1.00 33.22 C ATOM 1048 C SER A 105 2.360 83.728 46.433 1.00 31.81 C ATOM 1049 O SER A 105 3.180 84.135 45.609 1.00 35.13 O ATOM 1050 CB SER A 105 0.013 84.041 45.621 1.00 34.81 C ATOM 1051 OG SER A 105 -0.167 84.976 46.671 1.00 37.41 O ATOM 1052 HG SER A 105 -0.436 84.497 47.495 1.00 0.00 H ATOM 1053 H SER A 105 -0.297 82.284 47.459 1.00 0.00 H ATOM 1054 N LYS A 106 2.532 83.890 47.742 1.00 32.70 N ATOM 1055 CA LYS A 106 3.745 84.500 48.280 1.00 30.70 C ATOM 1056 C LYS A 106 4.844 83.471 48.498 1.00 29.44 C ATOM 1057 O LYS A 106 6.023 83.773 48.279 1.00 29.37 O ATOM 1058 CB LYS A 106 3.425 85.234 49.588 1.00 29.55 C ATOM 1059 CG LYS A 106 2.447 86.393 49.391 1.00 32.24 C ATOM 1060 CD LYS A 106 2.314 87.259 50.627 1.00 32.10 C ATOM 1061 CE LYS A 106 1.505 88.519 50.309 1.00 37.39 C ATOM 1062 NZ LYS A 106 1.255 89.379 51.508 1.00 40.00 N ATOM 1063 HZ1 LYS A 106 0.724 88.836 52.218 1.00 0.00 H ATOM 1064 HZ2 LYS A 106 2.164 89.683 51.911 1.00 0.00 H ATOM 1065 HZ3 LYS A 106 0.703 90.214 51.225 1.00 0.00 H ATOM 1066 H LYS A 106 1.787 83.576 48.396 1.00 0.00 H ATOM 1067 N LEU A 107 4.481 82.257 48.930 1.00 27.24 N ATOM 1068 CA LEU A 107 5.462 81.183 49.030 1.00 29.93 C ATOM 1069 C LEU A 107 6.060 80.853 47.674 1.00 33.15 C ATOM 1070 O LEU A 107 7.237 80.486 47.589 1.00 34.33 O ATOM 1071 CB LEU A 107 4.819 79.940 49.652 1.00 29.47 C ATOM 1072 CG LEU A 107 4.437 80.079 51.129 1.00 31.08 C ATOM 1073 CD1 LEU A 107 3.372 79.082 51.518 1.00 32.04 C ATOM 1074 CD2 LEU A 107 5.673 79.907 52.013 1.00 35.61 C ATOM 1075 H LEU A 107 3.492 82.079 49.196 1.00 0.00 H ATOM 1076 N ALA A 108 5.269 80.976 46.601 1.00 31.53 N ATOM 1077 CA ALA A 108 5.801 80.784 45.258 1.00 31.74 C ATOM 1078 C ALA A 108 6.894 81.792 44.945 1.00 35.44 C ATOM 1079 O ALA A 108 7.837 81.477 44.214 1.00 41.54 O ATOM 1080 CB ALA A 108 4.678 80.889 44.228 1.00 35.00 C ATOM 1081 H ALA A 108 4.264 81.211 46.727 1.00 0.00 H ATOM 1082 N ILE A 109 6.794 83.004 45.492 1.00 35.94 N ATOM 1083 CA ILE A 109 7.827 84.010 45.293 1.00 34.40 C ATOM 1084 C ILE A 109 8.999 83.772 46.236 1.00 33.24 C ATOM 1085 O ILE A 109 10.165 83.822 45.830 1.00 37.09 O ATOM 1086 CB ILE A 109 7.234 85.421 45.480 1.00 33.93 C ATOM 1087 CG1 ILE A 109 6.155 85.685 44.428 1.00 35.74 C ATOM 1088 CG2 ILE A 109 8.334 86.475 45.403 1.00 36.66 C ATOM 1089 CD1 ILE A 109 5.449 87.022 44.580 1.00 37.59 C ATOM 1090 H ILE A 109 5.962 83.235 46.072 1.00 0.00 H ATOM 1091 N TRP A 110 8.710 83.506 47.510 1.00 34.21 N ATOM 1092 CA TRP A 110 9.777 83.306 48.487 1.00 34.50 C ATOM 1093 C TRP A 110 10.658 82.115 48.129 1.00 36.17 C ATOM 1094 O TRP A 110 11.839 82.091 48.494 1.00 38.02 O ATOM 1095 CB TRP A 110 9.178 83.122 49.882 1.00 32.88 C ATOM 1096 CG TRP A 110 8.690 84.404 50.502 1.00 33.20 C ATOM 1097 CD1 TRP A 110 9.252 85.646 50.377 1.00 33.16 C ATOM 1098 CD2 TRP A 110 7.542 84.571 51.337 1.00 33.17 C ATOM 1099 NE1 TRP A 110 8.528 86.568 51.081 1.00 30.76 N ATOM 1100 CE2 TRP A 110 7.470 85.937 51.681 1.00 32.15 C ATOM 1101 CE3 TRP A 110 6.566 83.700 51.829 1.00 33.11 C ATOM 1102 CZ2 TRP A 110 6.461 86.449 52.496 1.00 30.98 C ATOM 1103 CZ3 TRP A 110 5.567 84.213 52.636 1.00 31.59 C ATOM 1104 CH2 TRP A 110 5.524 85.572 52.962 1.00 30.87 C ATOM 1105 HE1 TRP A 110 8.745 87.583 51.150 1.00 0.00 H ATOM 1106 H TRP A 110 7.717 83.440 47.811 1.00 0.00 H ATOM 1107 N ALA A 111 10.117 81.127 47.408 1.00 34.86 N ATOM 1108 CA ALA A 111 10.917 79.967 47.032 1.00 37.21 C ATOM 1109 C ALA A 111 12.127 80.352 46.189 1.00 40.74 C ATOM 1110 O ALA A 111 13.117 79.615 46.174 1.00 40.90 O ATOM 1111 CB ALA A 111 10.061 78.955 46.268 1.00 38.97 C ATOM 1112 H ALA A 111 9.121 81.186 47.114 1.00 0.00 H ATOM 1113 N ARG A 112 12.075 81.492 45.493 1.00 43.55 N ATOM 1114 CA ARG A 112 13.228 81.965 44.743 1.00 44.78 C ATOM 1115 C ARG A 112 14.269 82.632 45.634 1.00 43.80 C ATOM 1116 O ARG A 112 15.430 82.744 45.227 1.00 47.50 O ATOM 1117 CB ARG A 112 12.798 82.959 43.663 1.00 46.68 C ATOM 1118 CG ARG A 112 11.717 82.454 42.737 1.00 50.79 C ATOM 1119 CD ARG A 112 11.770 83.185 41.394 1.00 52.25 C ATOM 1120 NE ARG A 112 11.843 84.634 41.560 1.00 52.06 N ATOM 1121 CZ ARG A 112 10.788 85.437 41.671 1.00 49.13 C ATOM 1122 NH1 ARG A 112 9.558 84.945 41.639 1.00 46.59 N ATOM 1123 NH2 ARG A 112 10.969 86.743 41.812 1.00 52.06 N ATOM 1124 HE ARG A 112 12.787 85.069 41.594 1.00 0.00 H ATOM 1125 HH12 ARG A 112 8.741 85.582 41.727 1.00 0.00 H ATOM 1126 HH11 ARG A 112 9.410 83.922 41.526 1.00 0.00 H ATOM 1127 HH22 ARG A 112 10.148 87.375 41.899 1.00 0.00 H ATOM 1128 HH21 ARG A 112 11.932 87.135 41.835 1.00 0.00 H ATOM 1129 H ARG A 112 11.197 82.049 45.488 1.00 0.00 H ATOM 1130 N TYR A 113 13.879 83.078 46.823 1.00 40.93 N ATOM 1131 CA TYR A 113 14.782 83.788 47.721 1.00 44.62 C ATOM 1132 C TYR A 113 15.282 82.933 48.878 1.00 44.22 C ATOM 1133 O TYR A 113 16.307 83.274 49.475 1.00 48.73 O ATOM 1134 CB TYR A 113 14.082 85.038 48.289 1.00 39.29 C ATOM 1135 CG TYR A 113 13.763 86.080 47.244 1.00 41.83 C ATOM 1136 CD1 TYR A 113 12.596 86.007 46.491 1.00 39.32 C ATOM 1137 CD2 TYR A 113 14.634 87.135 46.998 1.00 43.12 C ATOM 1138 CE1 TYR A 113 12.306 86.954 45.526 1.00 40.44 C ATOM 1139 CE2 TYR A 113 14.354 88.086 46.035 1.00 43.80 C ATOM 1140 CZ TYR A 113 13.186 87.991 45.302 1.00 43.01 C ATOM 1141 OH TYR A 113 12.903 88.938 44.341 1.00 43.31 O ATOM 1142 HH TYR A 113 12.036 88.724 43.913 1.00 0.00 H ATOM 1143 H TYR A 113 12.897 82.915 47.123 1.00 0.00 H ATOM 1144 N LEU A 114 14.599 81.842 49.199 1.00 45.27 N ATOM 1145 CA LEU A 114 14.927 81.015 50.354 1.00 47.43 C ATOM 1146 C LEU A 114 15.419 79.647 49.904 1.00 49.61 C ATOM 1147 O LEU A 114 15.159 79.207 48.783 1.00 57.19 O ATOM 1148 CB LEU A 114 13.706 80.851 51.268 1.00 42.45 C ATOM 1149 CG LEU A 114 13.023 82.139 51.734 1.00 43.13 C ATOM 1150 CD1 LEU A 114 11.735 81.821 52.474 1.00 38.94 C ATOM 1151 CD2 LEU A 114 13.955 82.955 52.616 1.00 42.14 C ATOM 1152 H LEU A 114 13.795 81.565 48.601 1.00 0.00 H ATOM 1153 N ASN A 115 16.138 78.972 50.802 1.00 49.52 N ATOM 1154 CA ASN A 115 16.556 77.602 50.553 1.00 51.17 C ATOM 1155 C ASN A 115 15.432 76.645 50.946 1.00 51.06 C ATOM 1156 O ASN A 115 14.383 77.051 51.452 1.00 50.39 O ATOM 1157 CB ASN A 115 17.856 77.291 51.293 1.00 54.65 C ATOM 1158 CG ASN A 115 17.725 77.408 52.802 1.00 54.96 C ATOM 1159 OD1 ASN A 115 16.751 76.953 53.393 1.00 54.56 O ATOM 1160 ND2 ASN A 115 18.718 78.022 53.430 1.00 55.95 N ATOM 1161 HD22 ASN A 115 19.525 78.393 52.889 1.00 0.00 H ATOM 1162 HD21 ASN A 115 18.690 78.133 54.464 1.00 0.00 H ATOM 1163 H ASN A 115 16.404 79.433 51.695 1.00 0.00 H ATOM 1164 N ASP A 116 15.652 75.351 50.709 1.00 52.29 N ATOM 1165 CA ASP A 116 14.598 74.369 50.934 1.00 53.56 C ATOM 1166 C ASP A 116 14.174 74.332 52.397 1.00 51.27 C ATOM 1167 O ASP A 116 12.980 74.218 52.699 1.00 46.84 O ATOM 1168 CB ASP A 116 15.069 72.989 50.474 1.00 57.90 C ATOM 1169 CG ASP A 116 15.386 72.947 48.992 1.00 61.76 C ATOM 1170 OD1 ASP A 116 15.184 73.979 48.315 1.00 61.41 O ATOM 1171 OD2 ASP A 116 15.837 71.885 48.506 1.00 66.04 O ATOM 1172 H ASP A 116 16.582 75.040 50.361 1.00 0.00 H ATOM 1173 N GLU A 117 15.134 74.426 53.319 1.00 54.21 N ATOM 1174 CA GLU A 117 14.799 74.357 54.738 1.00 60.17 C ATOM 1175 C GLU A 117 14.090 75.627 55.198 1.00 52.57 C ATOM 1176 O GLU A 117 13.061 75.560 55.875 1.00 48.52 O ATOM 1177 CB GLU A 117 16.058 74.114 55.567 1.00 69.67 C ATOM 1178 CG GLU A 117 16.592 72.693 55.468 1.00 80.81 C ATOM 1179 CD GLU A 117 17.631 72.383 56.529 1.00 88.66 C ATOM 1180 OE1 GLU A 117 18.018 73.308 57.277 1.00 90.04 O ATOM 1181 OE2 GLU A 117 18.058 71.212 56.620 1.00 93.14 O ATOM 1182 H GLU A 117 16.124 74.549 53.026 1.00 0.00 H ATOM 1183 N GLU A 118 14.629 76.793 54.836 1.00 48.26 N ATOM 1184 CA GLU A 118 13.973 78.053 55.174 1.00 45.50 C ATOM 1185 C GLU A 118 12.539 78.075 54.660 1.00 39.48 C ATOM 1186 O GLU A 118 11.605 78.407 55.401 1.00 38.36 O ATOM 1187 CB GLU A 118 14.767 79.226 54.600 1.00 45.51 C ATOM 1188 CG GLU A 118 16.045 79.540 55.361 1.00 47.77 C ATOM 1189 CD GLU A 118 16.957 80.494 54.610 1.00 50.52 C ATOM 1190 OE1 GLU A 118 16.927 80.495 53.358 1.00 51.67 O ATOM 1191 OE2 GLU A 118 17.709 81.242 55.269 1.00 50.41 O ATOM 1192 H GLU A 118 15.525 76.804 54.308 1.00 0.00 H ATOM 1193 N LEU A 119 12.343 77.712 53.390 1.00 37.83 N ATOM 1194 CA LEU A 119 11.004 77.725 52.813 1.00 35.41 C ATOM 1195 C LEU A 119 10.082 76.764 53.551 1.00 35.28 C ATOM 1196 O LEU A 119 8.921 77.089 53.816 1.00 33.19 O ATOM 1197 CB LEU A 119 11.072 77.369 51.329 1.00 36.69 C ATOM 1198 CG LEU A 119 9.746 77.414 50.564 1.00 35.68 C ATOM 1199 CD1 LEU A 119 9.258 78.841 50.397 1.00 31.93 C ATOM 1200 CD2 LEU A 119 9.893 76.733 49.205 1.00 40.58 C ATOM 1201 H LEU A 119 13.153 77.417 52.807 1.00 0.00 H ATOM 1202 N ALA A 120 10.581 75.567 53.881 1.00 36.66 N ATOM 1203 CA ALA A 120 9.759 74.602 54.605 1.00 37.44 C ATOM 1204 C ALA A 120 9.311 75.168 55.948 1.00 34.90 C ATOM 1205 O ALA A 120 8.154 75.005 56.343 1.00 33.17 O ATOM 1206 CB ALA A 120 10.529 73.296 54.800 1.00 35.31 C ATOM 1207 H ALA A 120 11.558 75.323 53.621 1.00 0.00 H ATOM 1208 N PHE A 121 10.217 75.846 56.655 1.00 35.22 N ATOM 1209 CA PHE A 121 9.867 76.449 57.936 1.00 33.79 C ATOM 1210 C PHE A 121 8.765 77.482 57.763 1.00 32.42 C ATOM 1211 O PHE A 121 7.773 77.480 58.503 1.00 30.85 O ATOM 1212 CB PHE A 121 11.114 77.076 58.561 1.00 37.73 C ATOM 1213 CG PHE A 121 10.867 77.751 59.886 1.00 34.79 C ATOM 1214 CD1 PHE A 121 10.463 79.062 59.945 1.00 33.11 C ATOM 1215 CD2 PHE A 121 11.056 77.055 61.075 1.00 34.77 C ATOM 1216 CE1 PHE A 121 10.237 79.687 61.169 1.00 32.67 C ATOM 1217 CE2 PHE A 121 10.837 77.666 62.293 1.00 35.49 C ATOM 1218 CZ PHE A 121 10.427 78.988 62.337 1.00 36.03 C ATOM 1219 H PHE A 121 11.185 75.946 56.288 1.00 0.00 H ATOM 1220 N THR A 122 8.911 78.370 56.770 1.00 34.76 N ATOM 1221 CA THR A 122 7.925 79.431 56.576 1.00 33.62 C ATOM 1222 C THR A 122 6.581 78.865 56.146 1.00 30.59 C ATOM 1223 O THR A 122 5.531 79.325 56.601 1.00 30.99 O ATOM 1224 CB THR A 122 8.427 80.442 55.542 1.00 35.42 C ATOM 1225 OG1 THR A 122 9.597 81.098 56.037 1.00 37.07 O ATOM 1226 CG2 THR A 122 7.355 81.476 55.237 1.00 31.95 C ATOM 1227 HG1 THR A 122 9.378 81.571 56.879 1.00 0.00 H ATOM 1228 H THR A 122 9.731 78.304 56.134 1.00 0.00 H ATOM 1229 N ARG A 123 6.590 77.872 55.261 1.00 33.73 N ATOM 1230 CA ARG A 123 5.339 77.262 54.824 1.00 36.03 C ATOM 1231 C ARG A 123 4.554 76.688 55.995 1.00 35.35 C ATOM 1232 O ARG A 123 3.317 76.716 55.987 1.00 38.71 O ATOM 1233 CB ARG A 123 5.630 76.172 53.790 1.00 40.83 C ATOM 1234 CG ARG A 123 4.412 75.429 53.302 1.00 44.22 C ATOM 1235 CD ARG A 123 4.789 74.441 52.196 1.00 47.15 C ATOM 1236 NE ARG A 123 5.317 75.120 51.013 1.00 45.93 N ATOM 1237 CZ ARG A 123 4.554 75.631 50.053 1.00 47.99 C ATOM 1238 NH1 ARG A 123 3.232 75.540 50.132 1.00 48.66 N ATOM 1239 NH2 ARG A 123 5.112 76.230 49.010 1.00 50.51 N ATOM 1240 HE ARG A 123 6.349 75.208 50.918 1.00 0.00 H ATOM 1241 HH12 ARG A 123 2.637 75.941 49.379 1.00 0.00 H ATOM 1242 HH11 ARG A 123 2.791 75.068 50.947 1.00 0.00 H ATOM 1243 HH22 ARG A 123 4.514 76.630 48.259 1.00 0.00 H ATOM 1244 HH21 ARG A 123 6.147 76.300 48.943 1.00 0.00 H ATOM 1245 H ARG A 123 7.494 77.529 54.878 1.00 0.00 H ATOM 1246 N GLN A 124 5.247 76.164 57.008 1.00 30.32 N ATOM 1247 CA GLN A 124 4.560 75.638 58.178 1.00 38.15 C ATOM 1248 C GLN A 124 4.074 76.751 59.101 1.00 40.56 C ATOM 1249 O GLN A 124 2.933 76.706 59.580 1.00 48.52 O ATOM 1250 CB GLN A 124 5.486 74.696 58.947 1.00 39.90 C ATOM 1251 CG GLN A 124 4.853 74.075 60.182 1.00 45.56 C ATOM 1252 CD GLN A 124 5.852 73.340 61.042 1.00 46.25 C ATOM 1253 OE1 GLN A 124 7.038 73.273 60.714 1.00 48.42 O ATOM 1254 NE2 GLN A 124 5.382 72.782 62.157 1.00 51.30 N ATOM 1255 HE22 GLN A 124 4.373 72.864 62.394 1.00 0.00 H ATOM 1256 HE21 GLN A 124 6.024 72.264 62.790 1.00 0.00 H ATOM 1257 H GLN A 124 6.285 76.131 56.961 1.00 0.00 H ATOM 1258 N HIS A 125 4.910 77.751 59.355 1.00 34.73 N ATOM 1259 CA HIS A 125 4.655 78.724 60.406 1.00 32.24 C ATOM 1260 C HIS A 125 4.027 80.012 59.901 1.00 32.11 C ATOM 1261 O HIS A 125 3.678 80.871 60.716 1.00 29.66 O ATOM 1262 CB HIS A 125 5.961 79.037 61.151 1.00 31.52 C ATOM 1263 CG HIS A 125 6.559 77.844 61.840 1.00 32.10 C ATOM 1264 ND1 HIS A 125 6.036 77.317 62.997 1.00 34.78 N ATOM 1265 CD2 HIS A 125 7.633 77.081 61.533 1.00 33.68 C ATOM 1266 CE1 HIS A 125 6.761 76.275 63.377 1.00 36.13 C ATOM 1267 NE2 HIS A 125 7.739 76.114 62.506 1.00 37.08 N ATOM 1268 H HIS A 125 5.775 77.841 58.784 1.00 0.00 H ATOM 1269 N TYR A 126 3.846 80.166 58.581 1.00 29.75 N ATOM 1270 CA TYR A 126 3.229 81.374 58.065 1.00 30.99 C ATOM 1271 C TYR A 126 1.834 81.592 58.644 1.00 31.42 C ATOM 1272 O TYR A 126 1.404 82.736 58.809 1.00 31.02 O ATOM 1273 CB TYR A 126 3.163 81.313 56.535 1.00 35.04 C ATOM 1274 CG TYR A 126 2.655 82.586 55.896 1.00 31.35 C ATOM 1275 CD1 TYR A 126 3.459 83.718 55.824 1.00 37.22 C ATOM 1276 CD2 TYR A 126 1.377 82.656 55.360 1.00 29.30 C ATOM 1277 CE1 TYR A 126 3.001 84.893 55.242 1.00 30.78 C ATOM 1278 CE2 TYR A 126 0.915 83.809 54.772 1.00 28.95 C ATOM 1279 CZ TYR A 126 1.730 84.925 54.716 1.00 30.83 C ATOM 1280 OH TYR A 126 1.265 86.081 54.135 1.00 44.57 O ATOM 1281 HH TYR A 126 1.968 86.777 54.178 1.00 0.00 H ATOM 1282 H TYR A 126 4.149 79.418 57.925 1.00 0.00 H ATOM 1283 N PHE A 127 1.117 80.512 58.959 1.00 27.46 N ATOM 1284 CA PHE A 127 -0.249 80.624 59.458 1.00 29.87 C ATOM 1285 C PHE A 127 -0.334 80.698 60.978 1.00 27.27 C ATOM 1286 O PHE A 127 -1.423 80.911 61.507 1.00 28.74 O ATOM 1287 CB PHE A 127 -1.081 79.433 58.958 1.00 29.73 C ATOM 1288 CG PHE A 127 -1.076 79.282 57.459 1.00 31.29 C ATOM 1289 CD1 PHE A 127 -0.094 78.544 56.828 1.00 32.67 C ATOM 1290 CD2 PHE A 127 -2.051 79.886 56.685 1.00 32.73 C ATOM 1291 CE1 PHE A 127 -0.081 78.413 55.449 1.00 34.96 C ATOM 1292 CE2 PHE A 127 -2.047 79.757 55.313 1.00 30.66 C ATOM 1293 CZ PHE A 127 -1.060 79.020 54.691 1.00 32.07 C ATOM 1294 H PHE A 127 1.541 79.569 58.846 1.00 0.00 H ATOM 1295 N ASP A 128 0.786 80.542 61.687 1.00 30.63 N ATOM 1296 CA ASP A 128 0.754 80.518 63.145 1.00 31.70 C ATOM 1297 C ASP A 128 0.039 81.746 63.709 1.00 34.73 C ATOM 1298 O ASP A 128 -0.937 81.621 64.467 1.00 33.26 O ATOM 1299 CB ASP A 128 2.176 80.438 63.695 1.00 33.76 C ATOM 1300 CG ASP A 128 2.768 79.045 63.586 1.00 36.50 C ATOM 1301 OD1 ASP A 128 2.124 78.171 62.960 1.00 40.50 O ATOM 1302 OD2 ASP A 128 3.868 78.826 64.128 1.00 36.58 O ATOM 1303 H ASP A 128 1.695 80.436 61.193 1.00 0.00 H ATOM 1304 N ARG A 129 0.520 82.943 63.350 1.00 30.91 N ATOM 1305 CA ARG A 129 -0.005 84.196 63.888 1.00 32.06 C ATOM 1306 C ARG A 129 -0.505 85.118 62.776 1.00 31.10 C ATOM 1307 O ARG A 129 -0.556 86.332 62.945 1.00 32.34 O ATOM 1308 CB ARG A 129 1.058 84.900 64.723 1.00 31.32 C ATOM 1309 CG ARG A 129 1.639 84.044 65.837 1.00 32.81 C ATOM 1310 CD ARG A 129 2.556 84.854 66.748 1.00 34.75 C ATOM 1311 NE ARG A 129 1.844 85.938 67.420 1.00 33.72 N ATOM 1312 CZ ARG A 129 2.376 86.717 68.352 1.00 38.32 C ATOM 1313 NH1 ARG A 129 3.631 86.534 68.743 1.00 39.70 N ATOM 1314 NH2 ARG A 129 1.652 87.677 68.904 1.00 41.44 N ATOM 1315 HE ARG A 129 0.855 86.110 67.150 1.00 0.00 H ATOM 1316 HH12 ARG A 129 4.043 87.148 69.474 1.00 0.00 H ATOM 1317 HH11 ARG A 129 4.203 85.776 68.318 1.00 0.00 H ATOM 1318 HH22 ARG A 129 2.069 88.288 69.635 1.00 0.00 H ATOM 1319 HH21 ARG A 129 0.666 87.821 68.607 1.00 0.00 H ATOM 1320 H ARG A 129 1.298 82.982 62.661 1.00 0.00 H ATOM 1321 N LEU A 130 -0.896 84.538 61.638 1.00 36.29 N ATOM 1322 CA LEU A 130 -1.269 85.335 60.480 1.00 27.97 C ATOM 1323 C LEU A 130 -2.460 86.231 60.777 1.00 28.23 C ATOM 1324 O LEU A 130 -2.498 87.389 60.339 1.00 32.47 O ATOM 1325 CB LEU A 130 -1.581 84.411 59.303 1.00 28.95 C ATOM 1326 CG LEU A 130 -1.945 85.086 57.979 1.00 27.75 C ATOM 1327 CD1 LEU A 130 -0.773 85.893 57.455 1.00 28.45 C ATOM 1328 CD2 LEU A 130 -2.387 84.042 56.958 1.00 29.61 C ATOM 1329 H LEU A 130 -0.934 83.500 61.579 1.00 0.00 H ATOM 1330 N ALA A 131 -3.446 85.724 61.517 1.00 28.52 N ATOM 1331 CA ALA A 131 -4.675 86.469 61.758 1.00 29.22 C ATOM 1332 C ALA A 131 -4.473 87.709 62.621 1.00 26.86 C ATOM 1333 O ALA A 131 -5.400 88.512 62.728 1.00 31.45 O ATOM 1334 CB ALA A 131 -5.718 85.562 62.424 1.00 32.46 C ATOM 1335 H ALA A 131 -3.336 84.776 61.931 1.00 0.00 H ATOM 1336 N GLU A 132 -3.304 87.888 63.226 1.00 26.52 N ATOM 1337 CA GLU A 132 -3.058 89.033 64.085 1.00 29.78 C ATOM 1338 C GLU A 132 -2.506 90.234 63.328 1.00 31.00 C ATOM 1339 O GLU A 132 -2.356 91.304 63.928 1.00 33.53 O ATOM 1340 CB GLU A 132 -2.084 88.664 65.207 1.00 29.82 C ATOM 1341 CG GLU A 132 -2.625 87.619 66.170 1.00 36.65 C ATOM 1342 CD GLU A 132 -1.811 87.520 67.442 1.00 41.90 C ATOM 1343 OE1 GLU A 132 -0.577 87.349 67.354 1.00 43.89 O ATOM 1344 OE2 GLU A 132 -2.405 87.623 68.537 1.00 45.90 O ATOM 1345 H GLU A 132 -2.546 87.191 63.081 1.00 0.00 H ATOM 1346 N TRP A 133 -2.210 90.086 62.033 1.00 26.13 N ATOM 1347 CA TRP A 133 -1.623 91.202 61.289 1.00 28.83 C ATOM 1348 C TRP A 133 -2.602 92.349 61.122 1.00 29.66 C ATOM 1349 O TRP A 133 -2.196 93.506 61.321 1.00 31.00 O ATOM 1350 CB TRP A 133 -1.100 90.714 59.941 1.00 27.28 C ATOM 1351 CG TRP A 133 0.213 90.009 60.037 1.00 26.00 C ATOM 1352 CD1 TRP A 133 0.418 88.668 60.166 1.00 28.71 C ATOM 1353 CD2 TRP A 133 1.508 90.609 60.017 1.00 28.29 C ATOM 1354 NE1 TRP A 133 1.766 88.401 60.216 1.00 26.18 N ATOM 1355 CE2 TRP A 133 2.452 89.574 60.131 1.00 25.60 C ATOM 1356 CE3 TRP A 133 1.967 91.932 59.907 1.00 27.94 C ATOM 1357 CZ2 TRP A 133 3.825 89.818 60.144 1.00 28.52 C ATOM 1358 CZ3 TRP A 133 3.316 92.162 59.915 1.00 27.05 C ATOM 1359 CH2 TRP A 133 4.234 91.111 60.037 1.00 26.03 C ATOM 1360 HE1 TRP A 133 2.192 87.456 60.304 1.00 0.00 H ATOM 1361 H TRP A 133 -2.396 89.181 61.555 1.00 0.00 H ATOM 1362 N PRO A 134 -3.874 92.127 60.759 1.00 29.88 N ATOM 1363 CA PRO A 134 -4.777 93.270 60.544 1.00 28.73 C ATOM 1364 C PRO A 134 -4.894 94.186 61.750 1.00 27.77 C ATOM 1365 O PRO A 134 -4.916 95.410 61.591 1.00 28.36 O ATOM 1366 CB PRO A 134 -6.121 92.596 60.202 1.00 30.33 C ATOM 1367 CG PRO A 134 -5.731 91.269 59.623 1.00 31.64 C ATOM 1368 CD PRO A 134 -4.503 90.841 60.390 1.00 32.02 C ATOM 1369 N ALA A 135 -4.974 93.631 62.960 1.00 32.74 N ATOM 1370 CA ALA A 135 -5.048 94.469 64.151 1.00 29.59 C ATOM 1371 C ALA A 135 -3.796 95.324 64.292 1.00 30.23 C ATOM 1372 O ALA A 135 -3.878 96.491 64.684 1.00 38.43 O ATOM 1373 CB ALA A 135 -5.251 93.608 65.396 1.00 30.44 C ATOM 1374 H ALA A 135 -4.984 92.595 63.055 1.00 0.00 H ATOM 1375 N LEU A 136 -2.632 94.770 63.969 1.00 28.92 N ATOM 1376 CA LEU A 136 -1.397 95.546 64.033 1.00 30.00 C ATOM 1377 C LEU A 136 -1.367 96.637 62.964 1.00 34.19 C ATOM 1378 O LEU A 136 -0.956 97.774 63.237 1.00 32.12 O ATOM 1379 CB LEU A 136 -0.186 94.623 63.879 1.00 26.94 C ATOM 1380 CG LEU A 136 1.174 95.293 63.785 1.00 29.83 C ATOM 1381 CD1 LEU A 136 1.473 96.097 65.055 1.00 29.69 C ATOM 1382 CD2 LEU A 136 2.261 94.279 63.528 1.00 30.67 C ATOM 1383 H LEU A 136 -2.601 93.775 63.668 1.00 0.00 H ATOM 1384 N VAL A 137 -1.775 96.312 61.735 1.00 33.21 N ATOM 1385 CA VAL A 137 -1.721 97.308 60.666 1.00 34.32 C ATOM 1386 C VAL A 137 -2.643 98.481 60.985 1.00 33.12 C ATOM 1387 O VAL A 137 -2.324 99.634 60.689 1.00 30.11 O ATOM 1388 CB VAL A 137 -2.064 96.666 59.313 1.00 31.70 C ATOM 1389 CG1 VAL A 137 -2.149 97.727 58.226 1.00 32.30 C ATOM 1390 CG2 VAL A 137 -1.020 95.620 58.944 1.00 28.43 C ATOM 1391 H VAL A 137 -2.130 95.354 61.539 1.00 0.00 H ATOM 1392 N ALA A 138 -3.792 98.204 61.606 1.00 35.99 N ATOM 1393 CA ALA A 138 -4.700 99.281 61.996 1.00 37.16 C ATOM 1394 C ALA A 138 -4.061 100.194 63.038 1.00 37.52 C ATOM 1395 O ALA A 138 -4.187 101.423 62.956 1.00 37.42 O ATOM 1396 CB ALA A 138 -6.010 98.700 62.525 1.00 35.08 C ATOM 1397 H ALA A 138 -4.042 97.216 61.813 1.00 0.00 H ATOM 1398 N ASP A 139 -3.372 99.615 64.027 1.00 35.86 N ATOM 1399 CA ASP A 139 -2.675 100.437 65.010 1.00 41.05 C ATOM 1400 C ASP A 139 -1.554 101.243 64.365 1.00 39.38 C ATOM 1401 O ASP A 139 -1.267 102.361 64.802 1.00 40.63 O ATOM 1402 CB ASP A 139 -2.119 99.564 66.134 1.00 40.62 C ATOM 1403 CG ASP A 139 -3.206 99.048 67.063 1.00 42.60 C ATOM 1404 OD1 ASP A 139 -4.301 99.644 67.080 1.00 46.65 O ATOM 1405 OD2 ASP A 139 -2.965 98.048 67.780 1.00 44.04 O ATOM 1406 H ASP A 139 -3.333 98.578 64.095 1.00 0.00 H ATOM 1407 N LEU A 140 -0.921 100.702 63.323 1.00 33.13 N ATOM 1408 CA LEU A 140 0.127 101.435 62.629 1.00 34.67 C ATOM 1409 C LEU A 140 -0.452 102.635 61.890 1.00 38.77 C ATOM 1410 O LEU A 140 0.096 103.740 61.958 1.00 39.45 O ATOM 1411 CB LEU A 140 0.868 100.510 61.663 1.00 34.68 C ATOM 1412 CG LEU A 140 1.771 99.459 62.312 1.00 33.77 C ATOM 1413 CD1 LEU A 140 2.218 98.421 61.301 1.00 33.71 C ATOM 1414 CD2 LEU A 140 2.981 100.120 62.958 1.00 36.69 C ATOM 1415 H LEU A 140 -1.179 99.747 63.003 1.00 0.00 H ATOM 1416 N HIS A 141 -1.558 102.434 61.168 1.00 39.84 N ATOM 1417 CA HIS A 141 -2.239 103.553 60.533 1.00 41.24 C ATOM 1418 C HIS A 141 -2.583 104.630 61.559 1.00 43.56 C ATOM 1419 O HIS A 141 -2.369 105.823 61.324 1.00 44.67 O ATOM 1420 CB HIS A 141 -3.505 103.065 59.829 1.00 39.52 C ATOM 1421 CG HIS A 141 -3.260 102.479 58.475 1.00 40.10 C ATOM 1422 ND1 HIS A 141 -3.696 103.081 57.313 1.00 41.31 N ATOM 1423 CD2 HIS A 141 -2.628 101.343 58.097 1.00 37.40 C ATOM 1424 CE1 HIS A 141 -3.342 102.345 56.277 1.00 40.01 C ATOM 1425 NE2 HIS A 141 -2.696 101.280 56.727 1.00 40.97 N ATOM 1426 H HIS A 141 -1.935 101.471 61.059 1.00 0.00 H ATOM 1427 N ARG A 142 -3.114 104.219 62.711 1.00 45.26 N ATOM 1428 CA ARG A 142 -3.487 105.175 63.746 1.00 49.49 C ATOM 1429 C ARG A 142 -2.279 105.974 64.214 1.00 50.35 C ATOM 1430 O ARG A 142 -2.313 107.212 64.247 1.00 52.83 O ATOM 1431 CB ARG A 142 -4.139 104.444 64.916 1.00 54.75 C ATOM 1432 CG ARG A 142 -4.446 105.328 66.116 1.00 64.16 C ATOM 1433 CD ARG A 142 -5.452 104.662 67.052 1.00 72.05 C ATOM 1434 NE ARG A 142 -4.974 103.383 67.579 1.00 76.33 N ATOM 1435 CZ ARG A 142 -4.397 103.221 68.771 1.00 81.51 C ATOM 1436 NH1 ARG A 142 -4.217 104.258 69.584 1.00 84.38 N ATOM 1437 NH2 ARG A 142 -4.002 102.013 69.153 1.00 79.96 N ATOM 1438 HE ARG A 142 -5.093 102.540 66.982 1.00 0.00 H ATOM 1439 HH12 ARG A 142 -3.766 104.120 70.511 1.00 0.00 H ATOM 1440 HH11 ARG A 142 -4.527 105.207 69.293 1.00 0.00 H ATOM 1441 HH22 ARG A 142 -3.552 101.883 70.081 1.00 0.00 H ATOM 1442 HH21 ARG A 142 -4.143 101.197 68.524 1.00 0.00 H ATOM 1443 H ARG A 142 -3.264 103.203 62.873 1.00 0.00 H ATOM 1444 N ALA A 143 -1.194 105.283 64.575 1.00 46.73 N ATOM 1445 CA ALA A 143 0.007 105.976 65.025 1.00 48.79 C ATOM 1446 C ALA A 143 0.508 106.962 63.976 1.00 49.72 C ATOM 1447 O ALA A 143 1.092 107.994 64.322 1.00 46.35 O ATOM 1448 CB ALA A 143 1.103 104.966 65.363 1.00 45.20 C ATOM 1449 H ALA A 143 -1.206 104.244 64.535 1.00 0.00 H ATOM 1450 N CYS A 144 0.291 106.660 62.695 1.00 47.06 N ATOM 1451 CA CYS A 144 0.738 107.555 61.638 1.00 50.94 C ATOM 1452 C CYS A 144 -0.160 108.781 61.537 1.00 52.23 C ATOM 1453 O CYS A 144 0.338 109.903 61.383 1.00 57.05 O ATOM 1454 CB CYS A 144 0.785 106.802 60.311 1.00 53.37 C ATOM 1455 SG CYS A 144 1.803 107.604 59.044 1.00 64.74 S ATOM 1456 H CYS A 144 -0.202 105.778 62.450 1.00 0.00 H ATOM 1457 N ARG A 145 -1.479 108.591 61.631 1.00 51.07 N ATOM 1458 CA ARG A 145 -2.396 109.728 61.603 1.00 55.81 C ATOM 1459 C ARG A 145 -2.120 110.680 62.761 1.00 54.14 C ATOM 1460 O ARG A 145 -1.991 111.891 62.565 1.00 58.03 O ATOM 1461 CB ARG A 145 -3.846 109.243 61.657 1.00 56.89 C ATOM 1462 CG ARG A 145 -4.356 108.638 60.366 1.00 60.28 C ATOM 1463 CD ARG A 145 -5.882 108.663 60.309 1.00 63.36 C ATOM 1464 NE ARG A 145 -6.492 107.867 61.373 1.00 63.62 N ATOM 1465 CZ ARG A 145 -6.760 106.564 61.282 1.00 63.17 C ATOM 1466 NH1 ARG A 145 -6.473 105.892 60.171 1.00 61.52 N ATOM 1467 NH2 ARG A 145 -7.317 105.932 62.307 1.00 61.63 N ATOM 1468 HE ARG A 145 -6.733 108.350 62.262 1.00 0.00 H ATOM 1469 HH12 ARG A 145 -6.685 104.876 60.108 1.00 0.00 H ATOM 1470 HH11 ARG A 145 -6.036 106.383 59.365 1.00 0.00 H ATOM 1471 HH22 ARG A 145 -7.527 104.916 62.239 1.00 0.00 H ATOM 1472 HH21 ARG A 145 -7.543 106.453 63.178 1.00 0.00 H ATOM 1473 H ARG A 145 -1.856 107.626 61.725 1.00 0.00 H ATOM 1474 N GLU A 146 -2.027 110.144 63.978 1.00 53.88 N ATOM 1475 CA GLU A 146 -1.817 110.954 65.169 1.00 57.11 C ATOM 1476 C GLU A 146 -0.413 111.535 65.264 1.00 59.12 C ATOM 1477 O GLU A 146 -0.123 112.235 66.242 1.00 63.20 O ATOM 1478 CB GLU A 146 -2.105 110.119 66.418 1.00 57.31 C ATOM 1479 CG GLU A 146 -3.535 109.614 66.502 1.00 58.42 C ATOM 1480 CD GLU A 146 -3.769 108.730 67.710 1.00 59.50 C ATOM 1481 OE1 GLU A 146 -2.803 108.079 68.177 1.00 58.48 O ATOM 1482 OE2 GLU A 146 -4.920 108.687 68.196 1.00 61.88 O ATOM 1483 H GLU A 146 -2.107 109.112 64.080 1.00 0.00 H ATOM 1484 N LYS A 147 0.456 111.274 64.292 1.00 58.36 N ATOM 1485 CA LYS A 147 1.824 111.791 64.310 1.00 60.61 C ATOM 1486 C LYS A 147 2.583 111.302 65.543 1.00 56.49 C ATOM 1487 O LYS A 147 3.410 112.018 66.110 1.00 55.70 O ATOM 1488 CB LYS A 147 1.835 113.320 64.241 1.00 63.74 C ATOM 1489 CG LYS A 147 1.297 113.896 62.940 1.00 68.75 C ATOM 1490 CD LYS A 147 2.221 113.576 61.771 1.00 70.61 C ATOM 1491 CE LYS A 147 1.808 114.319 60.499 1.00 76.85 C ATOM 1492 NZ LYS A 147 2.705 113.985 59.348 1.00 77.03 N ATOM 1493 HZ1 LYS A 147 3.682 114.253 59.582 1.00 0.00 H ATOM 1494 HZ2 LYS A 147 2.660 112.963 59.160 1.00 0.00 H ATOM 1495 HZ3 LYS A 147 2.394 114.507 58.504 1.00 0.00 H ATOM 1496 H LYS A 147 0.153 110.682 63.492 1.00 0.00 H ATOM 1497 N ARG A 148 2.296 110.069 65.962 1.00 54.01 N ATOM 1498 CA ARG A 148 3.000 109.486 67.096 1.00 53.84 C ATOM 1499 C ARG A 148 4.491 109.377 66.792 1.00 50.64 C ATOM 1500 O ARG A 148 4.895 109.107 65.656 1.00 50.34 O ATOM 1501 CB ARG A 148 2.426 108.111 67.427 1.00 56.58 C ATOM 1502 CG ARG A 148 3.257 107.322 68.432 1.00 62.84 C ATOM 1503 CD ARG A 148 2.605 105.995 68.801 1.00 65.74 C ATOM 1504 NE ARG A 148 1.528 106.156 69.776 1.00 70.74 N ATOM 1505 CZ ARG A 148 1.719 106.363 71.076 1.00 74.35 C ATOM 1506 NH1 ARG A 148 2.949 106.451 71.567 1.00 74.69 N ATOM 1507 NH2 ARG A 148 0.676 106.494 71.885 1.00 78.14 N ATOM 1508 HE ARG A 148 0.548 106.105 69.431 1.00 0.00 H ATOM 1509 HH12 ARG A 148 3.092 106.613 72.584 1.00 0.00 H ATOM 1510 HH11 ARG A 148 3.769 106.358 70.934 1.00 0.00 H ATOM 1511 HH22 ARG A 148 0.824 106.656 72.902 1.00 0.00 H ATOM 1512 HH21 ARG A 148 -0.289 106.435 71.503 1.00 0.00 H ATOM 1513 H ARG A 148 1.562 109.518 65.474 1.00 0.00 H ATOM 1514 N ASP A 149 5.308 109.582 67.815 1.00 47.37 N ATOM 1515 CA ASP A 149 6.754 109.509 67.651 1.00 47.28 C ATOM 1516 C ASP A 149 7.185 108.049 67.592 1.00 46.24 C ATOM 1517 O ASP A 149 6.948 107.308 68.547 1.00 41.01 O ATOM 1518 CB ASP A 149 7.456 110.220 68.805 1.00 48.67 C ATOM 1519 CG ASP A 149 8.937 110.432 68.546 1.00 47.03 C ATOM 1520 OD1 ASP A 149 9.560 109.578 67.884 1.00 47.27 O ATOM 1521 OD2 ASP A 149 9.480 111.455 68.998 1.00 50.36 O ATOM 1522 H ASP A 149 4.910 109.799 68.751 1.00 0.00 H ATOM 1523 N PRO A 150 7.812 107.598 66.501 1.00 47.34 N ATOM 1524 CA PRO A 150 8.234 106.189 66.438 1.00 41.42 C ATOM 1525 C PRO A 150 9.098 105.762 67.609 1.00 41.54 C ATOM 1526 O PRO A 150 9.081 104.580 67.980 1.00 39.65 O ATOM 1527 CB PRO A 150 9.012 106.112 65.114 1.00 43.45 C ATOM 1528 CG PRO A 150 8.478 107.234 64.288 1.00 47.98 C ATOM 1529 CD PRO A 150 8.129 108.336 65.258 1.00 47.02 C ATOM 1530 N ALA A 151 9.857 106.687 68.204 1.00 40.96 N ATOM 1531 CA ALA A 151 10.734 106.358 69.318 1.00 39.18 C ATOM 1532 C ALA A 151 10.013 106.324 70.657 1.00 38.12 C ATOM 1533 O ALA A 151 10.627 105.947 71.660 1.00 37.94 O ATOM 1534 CB ALA A 151 11.887 107.368 69.391 1.00 36.67 C ATOM 1535 H ALA A 151 9.820 107.668 67.862 1.00 0.00 H ATOM 1536 N SER A 152 8.744 106.716 70.705 1.00 38.14 N ATOM 1537 CA SER A 152 8.004 106.717 71.951 1.00 42.14 C ATOM 1538 C SER A 152 7.735 105.285 72.408 1.00 41.43 C ATOM 1539 O SER A 152 7.790 104.344 71.607 1.00 41.11 O ATOM 1540 CB SER A 152 6.685 107.462 71.783 1.00 43.18 C ATOM 1541 OG SER A 152 5.870 106.830 70.814 1.00 40.41 O ATOM 1542 HG SER A 152 6.343 106.817 69.944 1.00 0.00 H ATOM 1543 H SER A 152 8.273 107.028 69.832 1.00 0.00 H ATOM 1544 N PRO A 153 7.445 105.093 73.697 1.00 38.90 N ATOM 1545 CA PRO A 153 7.118 103.734 74.171 1.00 38.11 C ATOM 1546 C PRO A 153 6.043 103.044 73.344 1.00 36.88 C ATOM 1547 O PRO A 153 6.212 101.880 72.955 1.00 35.07 O ATOM 1548 CB PRO A 153 6.664 103.973 75.618 1.00 36.96 C ATOM 1549 CG PRO A 153 7.360 105.227 76.029 1.00 40.98 C ATOM 1550 CD PRO A 153 7.461 106.079 74.791 1.00 39.09 C ATOM 1551 N GLY A 154 4.938 103.735 73.064 1.00 35.84 N ATOM 1552 CA GLY A 154 3.886 103.135 72.265 1.00 36.93 C ATOM 1553 C GLY A 154 4.355 102.754 70.873 1.00 38.32 C ATOM 1554 O GLY A 154 4.016 101.685 70.366 1.00 37.99 O ATOM 1555 H GLY A 154 4.830 104.706 73.419 1.00 0.00 H ATOM 1556 N GLY A 155 5.150 103.618 70.244 1.00 39.11 N ATOM 1557 CA GLY A 155 5.644 103.322 68.912 1.00 41.65 C ATOM 1558 C GLY A 155 6.602 102.149 68.891 1.00 41.80 C ATOM 1559 O GLY A 155 6.607 101.359 67.940 1.00 37.40 O ATOM 1560 H GLY A 155 5.418 104.509 70.710 1.00 0.00 H ATOM 1561 N GLN A 156 7.436 102.024 69.934 1.00 37.49 N ATOM 1562 CA GLN A 156 8.328 100.878 70.029 1.00 35.59 C ATOM 1563 C GLN A 156 7.551 99.594 70.298 1.00 39.03 C ATOM 1564 O GLN A 156 7.975 98.513 69.873 1.00 39.81 O ATOM 1565 CB GLN A 156 9.371 101.110 71.118 1.00 35.58 C ATOM 1566 CG GLN A 156 10.457 102.104 70.729 1.00 35.32 C ATOM 1567 CD GLN A 156 11.250 101.654 69.517 1.00 36.64 C ATOM 1568 OE1 GLN A 156 12.194 100.874 69.637 1.00 40.69 O ATOM 1569 NE2 GLN A 156 10.864 102.135 68.344 1.00 34.58 N ATOM 1570 HE22 GLN A 156 10.060 102.792 68.291 1.00 0.00 H ATOM 1571 HE21 GLN A 156 11.365 101.855 67.477 1.00 0.00 H ATOM 1572 H GLN A 156 7.445 102.750 70.679 1.00 0.00 H ATOM 1573 N GLN A 157 6.414 99.691 70.991 1.00 39.38 N ATOM 1574 CA GLN A 157 5.574 98.522 71.195 1.00 42.87 C ATOM 1575 C GLN A 157 5.010 98.019 69.869 1.00 40.70 C ATOM 1576 O GLN A 157 4.935 96.810 69.639 1.00 40.27 O ATOM 1577 CB GLN A 157 4.450 98.853 72.173 1.00 51.58 C ATOM 1578 CG GLN A 157 3.625 97.656 72.609 1.00 58.45 C ATOM 1579 CD GLN A 157 2.493 98.037 73.553 1.00 67.12 C ATOM 1580 OE1 GLN A 157 1.378 97.517 73.443 1.00 69.77 O ATOM 1581 NE2 GLN A 157 2.775 98.946 74.489 1.00 67.76 N ATOM 1582 HE22 GLN A 157 3.729 99.357 74.544 1.00 0.00 H ATOM 1583 HE21 GLN A 157 2.041 99.243 75.163 1.00 0.00 H ATOM 1584 H GLN A 157 6.127 100.609 71.387 1.00 0.00 H ATOM 1585 N LEU A 158 4.611 98.933 68.982 1.00 38.89 N ATOM 1586 CA LEU A 158 4.159 98.526 67.657 1.00 36.15 C ATOM 1587 C LEU A 158 5.296 97.886 66.866 1.00 35.03 C ATOM 1588 O LEU A 158 5.097 96.883 66.178 1.00 30.37 O ATOM 1589 CB LEU A 158 3.589 99.724 66.905 1.00 35.47 C ATOM 1590 CG LEU A 158 2.406 100.440 67.566 1.00 36.16 C ATOM 1591 CD1 LEU A 158 1.972 101.634 66.725 1.00 40.33 C ATOM 1592 CD2 LEU A 158 1.235 99.495 67.786 1.00 36.14 C ATOM 1593 H LEU A 158 4.623 99.941 69.237 1.00 0.00 H ATOM 1594 N ALA A 159 6.504 98.455 66.958 1.00 35.56 N ATOM 1595 CA ALA A 159 7.662 97.838 66.321 1.00 35.35 C ATOM 1596 C ALA A 159 7.935 96.455 66.898 1.00 38.03 C ATOM 1597 O ALA A 159 8.303 95.528 66.163 1.00 36.14 O ATOM 1598 CB ALA A 159 8.890 98.739 66.481 1.00 36.25 C ATOM 1599 H ALA A 159 6.618 99.343 67.487 1.00 0.00 H ATOM 1600 N GLN A 160 7.764 96.293 68.216 1.00 39.12 N ATOM 1601 CA GLN A 160 7.982 94.996 68.839 1.00 40.58 C ATOM 1602 C GLN A 160 6.984 93.968 68.330 1.00 34.28 C ATOM 1603 O GLN A 160 7.343 92.817 68.069 1.00 30.50 O ATOM 1604 CB GLN A 160 7.879 95.122 70.362 1.00 50.95 C ATOM 1605 CG GLN A 160 9.080 95.775 71.017 1.00 57.94 C ATOM 1606 CD GLN A 160 10.283 94.855 71.071 1.00 64.12 C ATOM 1607 OE1 GLN A 160 10.164 93.642 70.868 1.00 66.19 O ATOM 1608 NE2 GLN A 160 11.451 95.425 71.342 1.00 65.74 N ATOM 1609 HE22 GLN A 160 11.503 96.451 71.506 1.00 0.00 H ATOM 1610 HE21 GLN A 160 12.313 94.846 71.390 1.00 0.00 H ATOM 1611 H GLN A 160 7.472 97.102 68.801 1.00 0.00 H ATOM 1612 N ARG A 161 5.714 94.359 68.204 1.00 36.03 N ATOM 1613 CA ARG A 161 4.701 93.436 67.710 1.00 35.37 C ATOM 1614 C ARG A 161 4.992 93.031 66.267 1.00 31.94 C ATOM 1615 O ARG A 161 4.884 91.854 65.915 1.00 32.34 O ATOM 1616 CB ARG A 161 3.316 94.067 67.831 1.00 33.96 C ATOM 1617 CG ARG A 161 2.862 94.280 69.268 1.00 33.67 C ATOM 1618 CD ARG A 161 1.661 95.214 69.354 1.00 33.95 C ATOM 1619 NE ARG A 161 0.544 94.744 68.541 1.00 36.49 N ATOM 1620 CZ ARG A 161 -0.564 95.438 68.309 1.00 34.72 C ATOM 1621 NH1 ARG A 161 -0.707 96.652 68.830 1.00 37.41 N ATOM 1622 NH2 ARG A 161 -1.527 94.918 67.554 1.00 31.67 N ATOM 1623 HE ARG A 161 0.621 93.799 68.113 1.00 0.00 H ATOM 1624 HH12 ARG A 161 -1.574 97.197 68.649 1.00 0.00 H ATOM 1625 HH11 ARG A 161 0.048 97.058 69.419 1.00 0.00 H ATOM 1626 HH22 ARG A 161 -2.395 95.461 67.372 1.00 0.00 H ATOM 1627 HH21 ARG A 161 -1.412 93.968 67.146 1.00 0.00 H ATOM 1628 H ARG A 161 5.446 95.330 68.461 1.00 0.00 H ATOM 1629 N TRP A 162 5.382 93.987 65.426 1.00 30.51 N ATOM 1630 CA TRP A 162 5.750 93.658 64.053 1.00 31.59 C ATOM 1631 C TRP A 162 6.857 92.611 64.036 1.00 32.55 C ATOM 1632 O TRP A 162 6.781 91.621 63.300 1.00 31.22 O ATOM 1633 CB TRP A 162 6.186 94.912 63.303 1.00 30.85 C ATOM 1634 CG TRP A 162 6.643 94.641 61.905 1.00 29.59 C ATOM 1635 CD1 TRP A 162 5.883 94.688 60.771 1.00 32.73 C ATOM 1636 CD2 TRP A 162 7.960 94.271 61.489 1.00 29.79 C ATOM 1637 NE1 TRP A 162 6.649 94.375 59.673 1.00 34.06 N ATOM 1638 CE2 TRP A 162 7.930 94.112 60.092 1.00 35.05 C ATOM 1639 CE3 TRP A 162 9.167 94.065 62.164 1.00 36.81 C ATOM 1640 CZ2 TRP A 162 9.058 93.753 59.355 1.00 34.95 C ATOM 1641 CZ3 TRP A 162 10.288 93.711 61.432 1.00 35.13 C ATOM 1642 CH2 TRP A 162 10.227 93.563 60.044 1.00 34.66 C ATOM 1643 HE1 TRP A 162 6.314 94.343 58.689 1.00 0.00 H ATOM 1644 H TRP A 162 5.425 94.974 65.750 1.00 0.00 H ATOM 1645 N LEU A 163 7.891 92.811 64.855 1.00 34.31 N ATOM 1646 CA LEU A 163 8.981 91.853 64.936 1.00 35.35 C ATOM 1647 C LEU A 163 8.482 90.490 65.400 1.00 39.44 C ATOM 1648 O LEU A 163 8.928 89.452 64.895 1.00 39.32 O ATOM 1649 CB LEU A 163 10.061 92.377 65.884 1.00 38.59 C ATOM 1650 CG LEU A 163 11.286 91.485 66.091 1.00 42.25 C ATOM 1651 CD1 LEU A 163 12.090 91.355 64.809 1.00 43.70 C ATOM 1652 CD2 LEU A 163 12.160 92.021 67.226 1.00 45.89 C ATOM 1653 H LEU A 163 7.918 93.667 65.445 1.00 0.00 H ATOM 1654 N ALA A 164 7.557 90.470 66.363 1.00 34.82 N ATOM 1655 CA ALA A 164 7.020 89.199 66.840 1.00 35.44 C ATOM 1656 C ALA A 164 6.311 88.449 65.714 1.00 31.75 C ATOM 1657 O ALA A 164 6.542 87.249 65.511 1.00 32.55 O ATOM 1658 CB ALA A 164 6.068 89.432 68.011 1.00 32.23 C ATOM 1659 H ALA A 164 7.218 91.363 66.775 1.00 0.00 H ATOM 1660 N LEU A 165 5.445 89.139 64.975 1.00 28.10 N ATOM 1661 CA LEU A 165 4.699 88.483 63.906 1.00 31.83 C ATOM 1662 C LEU A 165 5.613 88.110 62.745 1.00 27.68 C ATOM 1663 O LEU A 165 5.422 87.072 62.103 1.00 31.82 O ATOM 1664 CB LEU A 165 3.559 89.373 63.423 1.00 29.19 C ATOM 1665 CG LEU A 165 2.516 89.797 64.449 1.00 29.22 C ATOM 1666 CD1 LEU A 165 1.489 90.707 63.782 1.00 31.95 C ATOM 1667 CD2 LEU A 165 1.829 88.611 65.091 1.00 31.60 C ATOM 1668 H LEU A 165 5.299 90.152 65.161 1.00 0.00 H ATOM 1669 N PHE A 166 6.611 88.944 62.454 1.00 31.85 N ATOM 1670 CA PHE A 166 7.538 88.655 61.358 1.00 33.88 C ATOM 1671 C PHE A 166 8.409 87.447 61.682 1.00 35.21 C ATOM 1672 O PHE A 166 8.546 86.526 60.863 1.00 31.01 O ATOM 1673 CB PHE A 166 8.396 89.885 61.072 1.00 31.54 C ATOM 1674 CG PHE A 166 9.481 89.653 60.062 1.00 31.41 C ATOM 1675 CD1 PHE A 166 9.171 89.328 58.751 1.00 31.76 C ATOM 1676 CD2 PHE A 166 10.812 89.787 60.418 1.00 32.32 C ATOM 1677 CE1 PHE A 166 10.171 89.120 57.817 1.00 29.16 C ATOM 1678 CE2 PHE A 166 11.821 89.582 59.479 1.00 35.77 C ATOM 1679 CZ PHE A 166 11.489 89.249 58.174 1.00 30.79 C ATOM 1680 H PHE A 166 6.733 89.812 63.013 1.00 0.00 H ATOM 1681 N GLN A 167 9.017 87.435 62.873 1.00 33.46 N ATOM 1682 CA GLN A 167 9.833 86.297 63.270 1.00 40.41 C ATOM 1683 C GLN A 167 9.019 85.013 63.381 1.00 38.59 C ATOM 1684 O GLN A 167 9.587 83.929 63.275 1.00 42.49 O ATOM 1685 CB GLN A 167 10.523 86.580 64.604 1.00 41.72 C ATOM 1686 CG GLN A 167 11.548 87.695 64.535 1.00 41.93 C ATOM 1687 CD GLN A 167 12.425 87.754 65.770 1.00 46.46 C ATOM 1688 OE1 GLN A 167 13.653 87.684 65.673 1.00 48.94 O ATOM 1689 NE2 GLN A 167 11.804 87.887 66.942 1.00 43.83 N ATOM 1690 HE22 GLN A 167 10.766 87.942 66.977 1.00 0.00 H ATOM 1691 HE21 GLN A 167 12.357 87.936 67.821 1.00 0.00 H ATOM 1692 H GLN A 167 8.906 88.243 63.519 1.00 0.00 H ATOM 1693 N SER A 168 7.703 85.121 63.577 1.00 35.24 N ATOM 1694 CA SER A 168 6.863 83.937 63.684 1.00 37.43 C ATOM 1695 C SER A 168 7.008 83.032 62.460 1.00 38.79 C ATOM 1696 O SER A 168 7.083 81.809 62.588 1.00 37.95 O ATOM 1697 CB SER A 168 5.403 84.357 63.863 1.00 36.46 C ATOM 1698 OG SER A 168 4.537 83.240 63.762 1.00 45.12 O ATOM 1699 HG SER A 168 4.641 82.823 62.870 1.00 0.00 H ATOM 1700 H SER A 168 7.272 86.064 63.654 1.00 0.00 H ATOM 1701 N TYR A 169 7.048 83.616 61.264 1.00 42.21 N ATOM 1702 CA TYR A 169 7.131 82.820 60.045 1.00 41.30 C ATOM 1703 C TYR A 169 8.478 82.898 59.346 1.00 37.53 C ATOM 1704 O TYR A 169 8.775 82.025 58.527 1.00 39.38 O ATOM 1705 CB TYR A 169 6.023 83.229 59.065 1.00 35.89 C ATOM 1706 CG TYR A 169 6.236 84.538 58.344 1.00 35.35 C ATOM 1707 CD1 TYR A 169 7.015 84.603 57.201 1.00 34.83 C ATOM 1708 CD2 TYR A 169 5.630 85.702 58.788 1.00 36.86 C ATOM 1709 CE1 TYR A 169 7.204 85.786 56.532 1.00 36.41 C ATOM 1710 CE2 TYR A 169 5.816 86.902 58.118 1.00 34.72 C ATOM 1711 CZ TYR A 169 6.596 86.930 56.994 1.00 36.39 C ATOM 1712 OH TYR A 169 6.788 88.103 56.311 1.00 41.47 O ATOM 1713 HH TYR A 169 7.375 87.937 55.531 1.00 0.00 H ATOM 1714 H TYR A 169 7.020 84.654 61.198 1.00 0.00 H ATOM 1715 N ALA A 170 9.297 83.901 59.654 1.00 39.51 N ATOM 1716 CA ALA A 170 10.621 84.017 59.058 1.00 38.34 C ATOM 1717 C ALA A 170 11.715 83.405 59.918 1.00 41.15 C ATOM 1718 O ALA A 170 12.781 83.062 59.394 1.00 40.91 O ATOM 1719 CB ALA A 170 10.958 85.487 58.792 1.00 32.21 C ATOM 1720 H ALA A 170 8.984 84.620 60.337 1.00 0.00 H ATOM 1721 N GLY A 171 11.483 83.260 61.221 1.00 47.12 N ATOM 1722 CA GLY A 171 12.494 82.746 62.116 1.00 45.77 C ATOM 1723 C GLY A 171 13.339 83.843 62.719 1.00 48.00 C ATOM 1724 O GLY A 171 13.207 85.031 62.413 1.00 45.20 O ATOM 1725 H GLY A 171 10.552 83.523 61.603 1.00 0.00 H ATOM 1726 N LYS A 172 14.239 83.423 63.608 1.00 50.45 N ATOM 1727 CA LYS A 172 15.110 84.351 64.319 1.00 53.53 C ATOM 1728 C LYS A 172 16.448 84.566 63.625 1.00 53.77 C ATOM 1729 O LYS A 172 17.215 85.435 64.050 1.00 54.51 O ATOM 1730 CB LYS A 172 15.358 83.845 65.743 1.00 61.08 C ATOM 1731 CG LYS A 172 14.093 83.600 66.552 1.00 73.05 C ATOM 1732 CD LYS A 172 14.408 82.861 67.847 1.00 80.97 C ATOM 1733 CE LYS A 172 13.153 82.588 68.661 1.00 82.21 C ATOM 1734 NZ LYS A 172 13.467 81.850 69.926 1.00 84.89 N ATOM 1735 HZ1 LYS A 172 13.913 80.940 69.693 1.00 0.00 H ATOM 1736 HZ2 LYS A 172 14.118 82.418 70.505 1.00 0.00 H ATOM 1737 HZ3 LYS A 172 12.588 81.681 70.455 1.00 0.00 H ATOM 1738 H LYS A 172 14.322 82.404 63.800 1.00 0.00 H ATOM 1739 N ASP A 173 16.745 83.808 62.573 1.00 54.59 N ATOM 1740 CA ASP A 173 18.035 83.918 61.905 1.00 56.44 C ATOM 1741 C ASP A 173 18.146 85.261 61.195 1.00 55.52 C ATOM 1742 O ASP A 173 17.258 85.649 60.430 1.00 51.09 O ATOM 1743 CB ASP A 173 18.209 82.769 60.911 1.00 60.43 C ATOM 1744 CG ASP A 173 19.629 82.655 60.391 1.00 67.19 C ATOM 1745 OD1 ASP A 173 20.210 83.686 59.985 1.00 70.11 O ATOM 1746 OD2 ASP A 173 20.174 81.530 60.395 1.00 70.27 O ATOM 1747 H ASP A 173 16.044 83.125 62.221 1.00 0.00 H ATOM 1748 N ALA A 174 19.250 85.972 61.446 1.00 56.93 N ATOM 1749 CA ALA A 174 19.434 87.288 60.848 1.00 57.06 C ATOM 1750 C ALA A 174 19.634 87.194 59.339 1.00 56.69 C ATOM 1751 O ALA A 174 19.119 88.026 58.586 1.00 51.86 O ATOM 1752 CB ALA A 174 20.620 87.999 61.501 1.00 59.55 C ATOM 1753 H ALA A 174 19.983 85.583 62.073 1.00 0.00 H ATOM 1754 N GLN A 175 20.387 86.193 58.879 1.00 60.18 N ATOM 1755 CA GLN A 175 20.607 86.039 57.446 1.00 61.59 C ATOM 1756 C GLN A 175 19.301 85.738 56.726 1.00 57.65 C ATOM 1757 O GLN A 175 19.016 86.324 55.672 1.00 56.76 O ATOM 1758 CB GLN A 175 21.629 84.927 57.193 1.00 68.59 C ATOM 1759 CG GLN A 175 22.114 84.848 55.753 1.00 72.37 C ATOM 1760 CD GLN A 175 22.901 86.075 55.339 1.00 77.83 C ATOM 1761 OE1 GLN A 175 23.494 86.762 56.177 1.00 81.45 O ATOM 1762 NE2 GLN A 175 22.912 86.363 54.041 1.00 78.78 N ATOM 1763 HE22 GLN A 175 22.399 85.757 53.370 1.00 0.00 H ATOM 1764 HE21 GLN A 175 23.434 87.194 53.697 1.00 0.00 H ATOM 1765 H GLN A 175 20.818 85.521 59.545 1.00 0.00 H ATOM 1766 N THR A 176 18.489 84.836 57.279 1.00 54.65 N ATOM 1767 CA THR A 176 17.216 84.505 56.654 1.00 49.23 C ATOM 1768 C THR A 176 16.299 85.722 56.604 1.00 47.03 C ATOM 1769 O THR A 176 15.656 85.985 55.582 1.00 45.95 O ATOM 1770 CB THR A 176 16.542 83.360 57.413 1.00 47.39 C ATOM 1771 OG1 THR A 176 17.449 82.257 57.527 1.00 49.31 O ATOM 1772 CG2 THR A 176 15.282 82.903 56.696 1.00 42.79 C ATOM 1773 HG1 THR A 176 17.704 81.946 56.622 1.00 0.00 H ATOM 1774 H THR A 176 18.767 84.365 58.164 1.00 0.00 H ATOM 1775 N GLN A 177 16.224 86.475 57.701 1.00 47.62 N ATOM 1776 CA GLN A 177 15.388 87.670 57.718 1.00 49.00 C ATOM 1777 C GLN A 177 15.805 88.652 56.633 1.00 49.35 C ATOM 1778 O GLN A 177 14.952 89.277 55.994 1.00 46.74 O ATOM 1779 CB GLN A 177 15.457 88.332 59.095 1.00 47.85 C ATOM 1780 CG GLN A 177 14.752 87.542 60.181 1.00 48.02 C ATOM 1781 CD GLN A 177 15.045 88.079 61.569 1.00 50.75 C ATOM 1782 OE1 GLN A 177 15.885 88.960 61.741 1.00 53.49 O ATOM 1783 NE2 GLN A 177 14.355 87.546 62.564 1.00 53.44 N ATOM 1784 HE22 GLN A 177 13.654 86.802 62.371 1.00 0.00 H ATOM 1785 HE21 GLN A 177 14.514 87.871 63.539 1.00 0.00 H ATOM 1786 H GLN A 177 16.764 86.209 58.549 1.00 0.00 H ATOM 1787 N GLN A 178 17.116 88.802 56.413 1.00 54.36 N ATOM 1788 CA GLN A 178 17.593 89.681 55.348 1.00 59.38 C ATOM 1789 C GLN A 178 16.982 89.295 54.005 1.00 51.81 C ATOM 1790 O GLN A 178 16.573 90.164 53.227 1.00 48.00 O ATOM 1791 CB GLN A 178 19.119 89.632 55.273 1.00 71.16 C ATOM 1792 CG GLN A 178 19.722 90.518 54.186 1.00 82.26 C ATOM 1793 CD GLN A 178 20.555 89.740 53.174 1.00 91.80 C ATOM 1794 OE1 GLN A 178 21.049 88.645 53.462 1.00 94.69 O ATOM 1795 NE2 GLN A 178 20.712 90.304 51.980 1.00 94.69 N ATOM 1796 HE22 GLN A 178 20.278 91.228 51.780 1.00 0.00 H ATOM 1797 HE21 GLN A 178 21.269 89.821 51.246 1.00 0.00 H ATOM 1798 H GLN A 178 17.801 88.289 57.004 1.00 0.00 H ATOM 1799 N LYS A 179 16.911 87.994 53.716 1.00 47.82 N ATOM 1800 CA LYS A 179 16.336 87.549 52.458 1.00 45.07 C ATOM 1801 C LYS A 179 14.888 88.008 52.327 1.00 44.01 C ATOM 1802 O LYS A 179 14.456 88.421 51.244 1.00 45.43 O ATOM 1803 CB LYS A 179 16.433 86.029 52.349 1.00 46.65 C ATOM 1804 CG LYS A 179 17.837 85.479 52.598 1.00 49.64 C ATOM 1805 CD LYS A 179 17.939 84.007 52.230 1.00 48.20 C ATOM 1806 CE LYS A 179 19.246 83.403 52.708 1.00 50.77 C ATOM 1807 NZ LYS A 179 19.357 81.952 52.366 1.00 52.56 N ATOM 1808 HZ1 LYS A 179 18.577 81.431 52.814 1.00 0.00 H ATOM 1809 HZ2 LYS A 179 19.305 81.835 51.334 1.00 0.00 H ATOM 1810 HZ3 LYS A 179 20.266 81.584 52.713 1.00 0.00 H ATOM 1811 H LYS A 179 17.270 87.294 54.396 1.00 0.00 H ATOM 1812 N PHE A 180 14.125 87.950 53.417 1.00 40.64 N ATOM 1813 CA PHE A 180 12.736 88.389 53.376 1.00 41.93 C ATOM 1814 C PHE A 180 12.643 89.873 53.055 1.00 42.71 C ATOM 1815 O PHE A 180 11.842 90.289 52.213 1.00 38.52 O ATOM 1816 CB PHE A 180 12.043 88.088 54.706 1.00 40.61 C ATOM 1817 CG PHE A 180 11.573 86.671 54.839 1.00 40.70 C ATOM 1818 CD1 PHE A 180 10.343 86.288 54.332 1.00 40.14 C ATOM 1819 CD2 PHE A 180 12.361 85.717 55.466 1.00 40.97 C ATOM 1820 CE1 PHE A 180 9.908 84.977 54.448 1.00 39.55 C ATOM 1821 CE2 PHE A 180 11.930 84.410 55.590 1.00 38.90 C ATOM 1822 CZ PHE A 180 10.701 84.039 55.080 1.00 38.09 C ATOM 1823 H PHE A 180 14.524 87.588 54.306 1.00 0.00 H ATOM 1824 N ARG A 181 13.451 90.691 53.730 1.00 46.89 N ATOM 1825 CA ARG A 181 13.395 92.129 53.502 1.00 50.20 C ATOM 1826 C ARG A 181 13.895 92.486 52.111 1.00 51.43 C ATOM 1827 O ARG A 181 13.400 93.439 51.506 1.00 55.28 O ATOM 1828 CB ARG A 181 14.196 92.858 54.581 1.00 54.53 C ATOM 1829 CG ARG A 181 13.830 92.420 55.999 1.00 57.20 C ATOM 1830 CD ARG A 181 14.296 93.416 57.062 1.00 60.47 C ATOM 1831 NE ARG A 181 13.529 94.658 57.028 1.00 63.58 N ATOM 1832 CZ ARG A 181 13.649 95.643 57.916 1.00 68.53 C ATOM 1833 NH1 ARG A 181 14.503 95.532 58.924 1.00 70.50 N ATOM 1834 NH2 ARG A 181 12.911 96.739 57.798 1.00 69.99 N ATOM 1835 HE ARG A 181 12.842 94.782 56.257 1.00 0.00 H ATOM 1836 HH12 ARG A 181 14.594 96.303 59.616 1.00 0.00 H ATOM 1837 HH11 ARG A 181 15.082 94.674 59.023 1.00 0.00 H ATOM 1838 HH22 ARG A 181 13.006 97.507 58.493 1.00 0.00 H ATOM 1839 HH21 ARG A 181 12.237 96.830 57.011 1.00 0.00 H ATOM 1840 H ARG A 181 14.123 90.301 54.421 1.00 0.00 H ATOM 1841 N TYR A 182 14.858 91.728 51.580 1.00 50.64 N ATOM 1842 CA TYR A 182 15.316 91.962 50.215 1.00 50.36 C ATOM 1843 C TYR A 182 14.250 91.562 49.204 1.00 49.70 C ATOM 1844 O TYR A 182 14.012 92.279 48.226 1.00 48.91 O ATOM 1845 CB TYR A 182 16.617 91.198 49.959 1.00 51.24 C ATOM 1846 CG TYR A 182 17.102 91.262 48.528 1.00 53.16 C ATOM 1847 CD1 TYR A 182 17.426 92.479 47.934 1.00 54.59 C ATOM 1848 CD2 TYR A 182 17.254 90.105 47.774 1.00 51.97 C ATOM 1849 CE1 TYR A 182 17.874 92.540 46.628 1.00 55.97 C ATOM 1850 CE2 TYR A 182 17.705 90.158 46.466 1.00 54.61 C ATOM 1851 CZ TYR A 182 18.012 91.376 45.899 1.00 57.57 C ATOM 1852 OH TYR A 182 18.463 91.431 44.596 1.00 61.58 O ATOM 1853 HH TYR A 182 18.636 92.374 44.347 1.00 0.00 H ATOM 1854 H TYR A 182 15.284 90.965 52.144 1.00 0.00 H ATOM 1855 N ALA A 183 13.600 90.415 49.417 1.00 45.62 N ATOM 1856 CA ALA A 183 12.497 90.025 48.550 1.00 47.05 C ATOM 1857 C ALA A 183 11.376 91.051 48.605 1.00 47.70 C ATOM 1858 O ALA A 183 10.789 91.401 47.574 1.00 45.89 O ATOM 1859 CB ALA A 183 11.979 88.644 48.948 1.00 46.44 C ATOM 1860 H ALA A 183 13.883 89.798 50.205 1.00 0.00 H ATOM 1861 N MET A 184 11.069 91.551 49.805 1.00 49.74 N ATOM 1862 CA MET A 184 10.032 92.565 49.958 1.00 53.83 C ATOM 1863 C MET A 184 10.346 93.808 49.139 1.00 57.76 C ATOM 1864 O MET A 184 9.428 94.458 48.624 1.00 59.50 O ATOM 1865 CB MET A 184 9.869 92.892 51.447 1.00 59.22 C ATOM 1866 CG MET A 184 9.783 94.364 51.809 1.00 67.34 C ATOM 1867 SD MET A 184 8.260 95.145 51.269 1.00 75.61 S ATOM 1868 CE MET A 184 8.535 96.826 51.828 1.00 74.07 C ATOM 1869 H MET A 184 11.579 91.211 50.645 1.00 0.00 H ATOM 1870 N GLU A 185 11.626 94.152 48.995 1.00 58.06 N ATOM 1871 CA GLU A 185 12.007 95.314 48.204 1.00 60.49 C ATOM 1872 C GLU A 185 11.915 95.070 46.704 1.00 57.85 C ATOM 1873 O GLU A 185 11.790 96.037 45.943 1.00 59.93 O ATOM 1874 CB GLU A 185 13.436 95.745 48.546 1.00 64.99 C ATOM 1875 CG GLU A 185 13.600 96.363 49.923 1.00 67.08 C ATOM 1876 CD GLU A 185 15.029 96.793 50.195 1.00 73.71 C ATOM 1877 OE1 GLU A 185 15.822 96.880 49.229 1.00 76.55 O ATOM 1878 OE2 GLU A 185 15.366 97.044 51.375 1.00 75.33 O ATOM 1879 H GLU A 185 12.364 93.582 49.455 1.00 0.00 H ATOM 1880 N GLN A 186 11.977 93.813 46.262 1.00 54.39 N ATOM 1881 CA GLN A 186 12.021 93.494 44.845 1.00 56.06 C ATOM 1882 C GLN A 186 10.698 92.994 44.288 1.00 54.48 C ATOM 1883 O GLN A 186 10.527 92.988 43.065 1.00 56.52 O ATOM 1884 CB GLN A 186 13.096 92.431 44.577 1.00 58.82 C ATOM 1885 CG GLN A 186 14.497 92.842 44.998 1.00 61.97 C ATOM 1886 CD GLN A 186 15.027 94.017 44.199 1.00 66.12 C ATOM 1887 OE1 GLN A 186 15.098 93.967 42.968 1.00 68.22 O ATOM 1888 NE2 GLN A 186 15.398 95.089 44.896 1.00 66.52 N ATOM 1889 HE22 GLN A 186 15.321 95.087 45.933 1.00 0.00 H ATOM 1890 HE21 GLN A 186 15.765 95.928 44.403 1.00 0.00 H ATOM 1891 H GLN A 186 11.994 93.036 46.954 1.00 0.00 H ATOM 1892 N GLU A 187 9.766 92.585 45.142 1.00 56.01 N ATOM 1893 CA GLU A 187 8.532 91.927 44.710 1.00 53.15 C ATOM 1894 C GLU A 187 7.317 92.723 45.162 1.00 48.86 C ATOM 1895 O GLU A 187 6.923 92.642 46.336 1.00 46.37 O ATOM 1896 CB GLU A 187 8.471 90.502 45.270 1.00 54.47 C ATOM 1897 CG GLU A 187 9.666 89.639 44.902 1.00 57.54 C ATOM 1898 CD GLU A 187 9.640 89.195 43.453 1.00 56.55 C ATOM 1899 OE1 GLU A 187 8.544 89.166 42.857 1.00 54.75 O ATOM 1900 OE2 GLU A 187 10.719 88.869 42.914 1.00 58.37 O ATOM 1901 H GLU A 187 9.920 92.739 46.159 1.00 0.00 H ATOM 1902 N PRO A 188 6.682 93.492 44.274 1.00 48.43 N ATOM 1903 CA PRO A 188 5.499 94.256 44.701 1.00 47.48 C ATOM 1904 C PRO A 188 4.366 93.380 45.192 1.00 43.49 C ATOM 1905 O PRO A 188 3.597 93.802 46.063 1.00 44.24 O ATOM 1906 CB PRO A 188 5.099 95.031 43.434 1.00 46.93 C ATOM 1907 CG PRO A 188 6.325 95.045 42.581 1.00 50.72 C ATOM 1908 CD PRO A 188 7.032 93.755 42.865 1.00 49.44 C ATOM 1909 N HIS A 189 4.234 92.166 44.655 1.00 43.03 N ATOM 1910 CA HIS A 189 3.150 91.284 45.073 1.00 41.11 C ATOM 1911 C HIS A 189 3.226 90.957 46.561 1.00 37.29 C ATOM 1912 O HIS A 189 2.195 90.744 47.201 1.00 33.36 O ATOM 1913 CB HIS A 189 3.177 89.998 44.251 1.00 40.99 C ATOM 1914 CG HIS A 189 2.165 88.985 44.681 1.00 42.31 C ATOM 1915 ND1 HIS A 189 0.831 89.086 44.361 1.00 44.03 N ATOM 1916 CD2 HIS A 189 2.290 87.858 45.421 1.00 43.67 C ATOM 1917 CE1 HIS A 189 0.176 88.062 44.879 1.00 44.40 C ATOM 1918 NE2 HIS A 189 1.039 87.302 45.526 1.00 43.75 N ATOM 1919 H HIS A 189 4.910 91.846 43.932 1.00 0.00 H ATOM 1920 N LEU A 190 4.433 90.920 47.129 1.00 36.96 N ATOM 1921 CA LEU A 190 4.572 90.557 48.532 1.00 37.38 C ATOM 1922 C LEU A 190 3.900 91.565 49.455 1.00 36.95 C ATOM 1923 O LEU A 190 3.609 91.238 50.599 1.00 38.27 O ATOM 1924 CB LEU A 190 6.048 90.413 48.900 1.00 39.39 C ATOM 1925 CG LEU A 190 6.777 89.225 48.276 1.00 40.29 C ATOM 1926 CD1 LEU A 190 8.227 89.190 48.730 1.00 45.78 C ATOM 1927 CD2 LEU A 190 6.083 87.908 48.617 1.00 40.89 C ATOM 1928 H LEU A 190 5.277 91.151 46.567 1.00 0.00 H ATOM 1929 N MET A 191 3.634 92.777 48.981 1.00 44.70 N ATOM 1930 CA MET A 191 2.953 93.787 49.778 1.00 44.94 C ATOM 1931 C MET A 191 1.464 93.874 49.469 1.00 40.58 C ATOM 1932 O MET A 191 0.783 94.739 50.022 1.00 38.42 O ATOM 1933 CB MET A 191 3.613 95.152 49.573 1.00 51.44 C ATOM 1934 CG MET A 191 3.854 95.912 50.864 1.00 58.95 C ATOM 1935 SD MET A 191 4.873 94.993 52.054 1.00 64.00 S ATOM 1936 CE MET A 191 4.448 95.829 53.570 1.00 62.18 C ATOM 1937 H MET A 191 3.921 93.012 48.009 1.00 0.00 H ATOM 1938 N LYS A 192 0.942 92.998 48.613 1.00 36.61 N ATOM 1939 CA LYS A 192 -0.490 92.912 48.405 1.00 35.43 C ATOM 1940 C LYS A 192 -1.169 92.282 49.617 1.00 33.98 C ATOM 1941 O LYS A 192 -0.590 91.457 50.326 1.00 35.26 O ATOM 1942 CB LYS A 192 -0.809 92.084 47.162 1.00 39.51 C ATOM 1943 CG LYS A 192 -0.478 92.752 45.845 1.00 47.55 C ATOM 1944 CD LYS A 192 -1.079 91.949 44.693 1.00 53.54 C ATOM 1945 CE LYS A 192 -0.753 92.549 43.339 1.00 55.18 C ATOM 1946 NZ LYS A 192 -1.739 92.109 42.319 1.00 58.08 N ATOM 1947 HZ1 LYS A 192 -1.717 91.072 42.242 1.00 0.00 H ATOM 1948 HZ2 LYS A 192 -2.691 92.417 42.603 1.00 0.00 H ATOM 1949 HZ3 LYS A 192 -1.497 92.531 41.400 1.00 0.00 H ATOM 1950 H LYS A 192 1.573 92.364 48.084 1.00 0.00 H ATOM 1951 N GLY A 193 -2.420 92.664 49.837 1.00 32.15 N ATOM 1952 CA GLY A 193 -3.175 92.108 50.948 1.00 33.30 C ATOM 1953 C GLY A 193 -2.609 92.442 52.304 1.00 33.79 C ATOM 1954 O GLY A 193 -2.782 91.662 53.252 1.00 35.23 O ATOM 1955 H GLY A 193 -2.864 93.366 49.211 1.00 0.00 H ATOM 1956 N THR A 194 -1.927 93.588 52.431 1.00 35.05 N ATOM 1957 CA THR A 194 -1.390 94.029 53.714 1.00 38.26 C ATOM 1958 C THR A 194 -2.024 95.311 54.227 1.00 36.88 C ATOM 1959 O THR A 194 -1.793 95.671 55.385 1.00 38.74 O ATOM 1960 CB THR A 194 0.130 94.249 53.619 1.00 39.42 C ATOM 1961 OG1 THR A 194 0.404 95.314 52.700 1.00 37.73 O ATOM 1962 CG2 THR A 194 0.831 92.969 53.168 1.00 38.35 C ATOM 1963 HG1 THR A 194 0.048 95.077 51.807 1.00 0.00 H ATOM 1964 H THR A 194 -1.776 94.181 51.590 1.00 0.00 H ATOM 1965 N TRP A 195 -2.699 96.056 53.368 1.00 36.28 N ATOM 1966 CA TRP A 195 -3.325 97.341 53.748 1.00 38.24 C ATOM 1967 C TRP A 195 -2.220 98.322 54.143 1.00 43.59 C ATOM 1968 O TRP A 195 -2.496 99.292 54.762 1.00 44.70 O ATOM 1969 CB TRP A 195 -4.359 97.166 54.852 1.00 38.08 C ATOM 1970 CG TRP A 195 -5.698 96.732 54.374 1.00 37.01 C ATOM 1971 CD1 TRP A 195 -6.808 97.498 54.328 1.00 37.80 C ATOM 1972 CD2 TRP A 195 -6.097 95.430 53.924 1.00 35.75 C ATOM 1973 NE1 TRP A 195 -7.849 96.783 53.843 1.00 39.15 N ATOM 1974 CE2 TRP A 195 -7.448 95.515 53.586 1.00 37.10 C ATOM 1975 CE3 TRP A 195 -5.453 94.206 53.761 1.00 34.83 C ATOM 1976 CZ2 TRP A 195 -8.169 94.428 53.118 1.00 36.37 C ATOM 1977 CZ3 TRP A 195 -6.154 93.145 53.266 1.00 34.35 C ATOM 1978 CH2 TRP A 195 -7.500 93.248 52.977 1.00 34.99 C ATOM 1979 HE1 TRP A 195 -8.810 97.151 53.691 1.00 0.00 H ATOM 1980 H TRP A 195 -2.793 95.725 52.387 1.00 0.00 H ATOM 1981 N MET A 196 -0.999 98.052 53.742 1.00 45.26 N ATOM 1982 CA MET A 196 0.111 98.944 54.094 1.00 52.54 C ATOM 1983 C MET A 196 0.250 99.995 53.001 1.00 54.43 C ATOM 1984 O MET A 196 0.004 99.682 51.885 1.00 53.79 O ATOM 1985 CB MET A 196 1.417 98.168 54.241 1.00 30.00 C ATOM 1986 CG MET A 196 1.496 97.324 55.492 1.00 30.00 C ATOM 1987 SD MET A 196 1.659 98.291 56.960 1.00 30.00 S ATOM 1988 CE MET A 196 3.405 98.240 57.231 1.00 30.00 C ATOM 1989 H MET A 196 -0.818 97.201 53.172 1.00 0.00 H ATOM 1990 N THR A 197 0.561 101.217 53.379 1.00 56.39 N ATOM 1991 CA THR A 197 0.829 102.324 52.440 1.00 56.06 C ATOM 1992 C THR A 197 2.273 102.762 52.616 1.00 58.27 C ATOM 1993 O THR A 197 2.889 102.388 53.574 1.00 58.84 O ATOM 1994 CB THR A 197 0.016 103.572 52.735 1.00 54.93 C ATOM 1995 OG1 THR A 197 0.425 104.027 54.010 1.00 56.41 O ATOM 1996 CG2 THR A 197 -1.466 103.329 52.718 1.00 51.66 C ATOM 1997 HG1 THR A 197 1.393 104.232 53.991 1.00 0.00 H ATOM 1998 H THR A 197 0.621 101.414 54.398 1.00 0.00 H ATOM 1999 N SER A 198 2.793 103.484 51.648 1.00 49.75 N ATOM 2000 CA SER A 198 4.186 103.951 51.722 1.00 50.19 C ATOM 2001 C SER A 198 4.364 104.820 52.967 1.00 50.73 C ATOM 2002 O SER A 198 5.379 104.738 53.531 1.00 49.69 O ATOM 2003 CB SER A 198 4.557 104.651 50.469 1.00 53.00 C ATOM 2004 OG SER A 198 3.617 105.656 50.188 1.00 57.06 O ATOM 2005 HG SER A 198 2.721 105.248 50.082 1.00 0.00 H ATOM 2006 H SER A 198 2.213 103.728 50.820 1.00 0.00 H ATOM 2007 N GLU A 199 3.377 105.623 53.329 1.00 50.37 N ATOM 2008 CA GLU A 199 3.434 106.472 54.532 1.00 53.14 C ATOM 2009 C GLU A 199 3.533 105.626 55.819 1.00 48.36 C ATOM 2010 O GLU A 199 4.387 105.895 56.625 1.00 40.54 O ATOM 2011 CB GLU A 199 2.208 107.376 54.455 1.00 63.56 C ATOM 2012 CG GLU A 199 1.937 108.242 55.659 1.00 72.87 C ATOM 2013 CD GLU A 199 0.996 109.434 55.467 1.00 80.90 C ATOM 2014 OE1 GLU A 199 -0.236 109.283 55.640 1.00 83.52 O ATOM 2015 OE2 GLU A 199 1.504 110.527 55.166 1.00 83.75 O ATOM 2016 H GLU A 199 2.522 105.657 52.738 1.00 0.00 H ATOM 2017 N VAL A 200 2.696 104.609 55.978 1.00 45.35 N ATOM 2018 CA VAL A 200 2.754 103.763 57.199 1.00 40.46 C ATOM 2019 C VAL A 200 4.029 102.940 57.183 1.00 40.57 C ATOM 2020 O VAL A 200 4.710 102.927 58.140 1.00 39.27 O ATOM 2021 CB VAL A 200 1.518 102.878 57.332 1.00 39.74 C ATOM 2022 CG1 VAL A 200 1.653 101.967 58.519 1.00 40.79 C ATOM 2023 CG2 VAL A 200 0.279 103.715 57.461 1.00 40.18 C ATOM 2024 H VAL A 200 1.992 104.402 55.241 1.00 0.00 H ATOM 2025 N LEU A 201 4.333 102.325 56.063 1.00 42.95 N ATOM 2026 CA LEU A 201 5.565 101.555 55.959 1.00 44.09 C ATOM 2027 C LEU A 201 6.776 102.412 56.318 1.00 44.76 C ATOM 2028 O LEU A 201 7.732 101.926 56.932 1.00 45.10 O ATOM 2029 CB LEU A 201 5.709 100.989 54.543 1.00 45.78 C ATOM 2030 CG LEU A 201 6.868 100.020 54.323 1.00 46.51 C ATOM 2031 CD1 LEU A 201 6.591 98.695 55.020 1.00 41.97 C ATOM 2032 CD2 LEU A 201 7.122 99.803 52.836 1.00 47.78 C ATOM 2033 H LEU A 201 3.691 102.388 55.247 1.00 0.00 H ATOM 2034 N SER A 202 6.755 103.690 55.932 1.00 42.44 N ATOM 2035 CA SER A 202 7.849 104.590 56.284 1.00 45.16 C ATOM 2036 C SER A 202 7.874 104.861 57.783 1.00 44.02 C ATOM 2037 O SER A 202 8.948 104.930 58.390 1.00 42.43 O ATOM 2038 CB SER A 202 7.721 105.898 55.506 1.00 46.75 C ATOM 2039 OG SER A 202 8.638 106.869 55.975 1.00 48.71 O ATOM 2040 HG SER A 202 8.530 107.703 55.452 1.00 0.00 H ATOM 2041 H SER A 202 5.952 104.047 55.376 1.00 0.00 H ATOM 2042 N TRP A 203 6.698 105.024 58.394 1.00 45.77 N ATOM 2043 CA TRP A 203 6.629 105.194 59.840 1.00 45.46 C ATOM 2044 C TRP A 203 7.108 103.938 60.551 1.00 42.40 C ATOM 2045 O TRP A 203 7.877 104.012 61.516 1.00 41.83 O ATOM 2046 CB TRP A 203 5.196 105.532 60.256 1.00 44.87 C ATOM 2047 CG TRP A 203 5.050 105.886 61.708 1.00 41.66 C ATOM 2048 CD1 TRP A 203 4.949 107.137 62.239 1.00 40.29 C ATOM 2049 CD2 TRP A 203 4.991 104.972 62.814 1.00 37.22 C ATOM 2050 NE1 TRP A 203 4.831 107.062 63.605 1.00 40.69 N ATOM 2051 CE2 TRP A 203 4.852 105.744 63.983 1.00 39.00 C ATOM 2052 CE3 TRP A 203 5.034 103.582 62.927 1.00 36.33 C ATOM 2053 CZ2 TRP A 203 4.762 105.170 65.248 1.00 35.72 C ATOM 2054 CZ3 TRP A 203 4.948 103.013 64.185 1.00 37.42 C ATOM 2055 CH2 TRP A 203 4.813 103.808 65.327 1.00 36.41 C ATOM 2056 HE1 TRP A 203 4.740 107.874 64.249 1.00 0.00 H ATOM 2057 H TRP A 203 5.823 105.030 57.833 1.00 0.00 H ATOM 2058 N LEU A 204 6.668 102.770 60.079 1.00 46.64 N ATOM 2059 CA LEU A 204 7.078 101.508 60.683 1.00 42.49 C ATOM 2060 C LEU A 204 8.587 101.333 60.634 1.00 44.68 C ATOM 2061 O LEU A 204 9.203 100.899 61.615 1.00 43.09 O ATOM 2062 CB LEU A 204 6.379 100.349 59.972 1.00 42.12 C ATOM 2063 CG LEU A 204 6.823 98.933 60.322 1.00 43.19 C ATOM 2064 CD1 LEU A 204 6.487 98.598 61.766 1.00 40.60 C ATOM 2065 CD2 LEU A 204 6.176 97.934 59.371 1.00 43.78 C ATOM 2066 H LEU A 204 6.021 102.760 59.265 1.00 0.00 H ATOM 2067 N GLN A 205 9.207 101.659 59.499 1.00 46.11 N ATOM 2068 CA GLN A 205 10.634 101.414 59.337 1.00 49.26 C ATOM 2069 C GLN A 205 11.494 102.407 60.108 1.00 50.11 C ATOM 2070 O GLN A 205 12.661 102.112 60.377 1.00 52.06 O ATOM 2071 CB GLN A 205 10.991 101.419 57.849 1.00 56.23 C ATOM 2072 CG GLN A 205 10.546 100.139 57.134 1.00 56.81 C ATOM 2073 CD GLN A 205 10.710 100.206 55.635 1.00 61.67 C ATOM 2074 OE1 GLN A 205 10.824 101.288 55.055 1.00 65.31 O ATOM 2075 NE2 GLN A 205 10.726 99.042 54.989 1.00 62.19 N ATOM 2076 HE22 GLN A 205 10.627 98.152 55.518 1.00 0.00 H ATOM 2077 HE21 GLN A 205 10.838 99.022 53.955 1.00 0.00 H ATOM 2078 H GLN A 205 8.667 102.092 58.723 1.00 0.00 H ATOM 2079 N GLN A 206 10.951 103.565 60.480 1.00 50.48 N ATOM 2080 CA GLN A 206 11.639 104.417 61.439 1.00 50.58 C ATOM 2081 C GLN A 206 11.559 103.820 62.839 1.00 44.99 C ATOM 2082 O GLN A 206 12.536 103.854 63.594 1.00 45.75 O ATOM 2083 CB GLN A 206 11.040 105.822 61.427 1.00 57.50 C ATOM 2084 CG GLN A 206 11.274 106.594 60.143 1.00 63.02 C ATOM 2085 CD GLN A 206 10.740 108.014 60.213 1.00 65.55 C ATOM 2086 OE1 GLN A 206 11.503 108.976 60.167 1.00 68.37 O ATOM 2087 NE2 GLN A 206 9.422 108.150 60.320 1.00 64.29 N ATOM 2088 HE22 GLN A 206 8.813 107.307 60.356 1.00 0.00 H ATOM 2089 HE21 GLN A 206 8.999 109.099 60.368 1.00 0.00 H ATOM 2090 H GLN A 206 10.035 103.860 60.085 1.00 0.00 H ATOM 2091 N ALA A 207 10.401 103.263 63.198 1.00 39.66 N ATOM 2092 CA ALA A 207 10.250 102.626 64.501 1.00 37.37 C ATOM 2093 C ALA A 207 11.143 101.398 64.625 1.00 39.33 C ATOM 2094 O ALA A 207 11.738 101.161 65.680 1.00 39.25 O ATOM 2095 CB ALA A 207 8.790 102.250 64.728 1.00 36.44 C ATOM 2096 H ALA A 207 9.596 103.283 62.540 1.00 0.00 H ATOM 2097 N ILE A 208 11.242 100.599 63.557 1.00 40.69 N ATOM 2098 CA ILE A 208 12.152 99.463 63.563 1.00 42.10 C ATOM 2099 C ILE A 208 13.594 99.939 63.650 1.00 46.65 C ATOM 2100 O ILE A 208 14.437 99.299 64.287 1.00 48.02 O ATOM 2101 CB ILE A 208 11.918 98.592 62.314 1.00 42.71 C ATOM 2102 CG1 ILE A 208 10.535 97.936 62.375 1.00 37.96 C ATOM 2103 CG2 ILE A 208 13.012 97.534 62.180 1.00 44.22 C ATOM 2104 CD1 ILE A 208 10.075 97.362 61.046 1.00 36.71 C ATOM 2105 H ILE A 208 10.663 100.791 62.714 1.00 0.00 H ATOM 2106 N GLY A 209 13.901 101.076 63.019 1.00 50.09 N ATOM 2107 CA GLY A 209 15.258 101.597 63.075 1.00 50.70 C ATOM 2108 C GLY A 209 15.686 101.941 64.487 1.00 50.98 C ATOM 2109 O GLY A 209 16.791 101.598 64.918 1.00 55.73 O ATOM 2110 H GLY A 209 13.169 101.589 62.487 1.00 0.00 H ATOM 2111 N VAL A 210 14.817 102.633 65.226 1.00 47.96 N ATOM 2112 CA VAL A 210 15.115 102.952 66.618 1.00 45.52 C ATOM 2113 C VAL A 210 15.288 101.674 67.428 1.00 46.25 C ATOM 2114 O VAL A 210 16.183 101.570 68.269 1.00 45.90 O ATOM 2115 CB VAL A 210 14.006 103.845 67.204 1.00 41.80 C ATOM 2116 CG1 VAL A 210 14.242 104.086 68.687 1.00 43.00 C ATOM 2117 CG2 VAL A 210 13.927 105.165 66.445 1.00 41.00 C ATOM 2118 H VAL A 210 13.919 102.948 64.806 1.00 0.00 H ATOM 2119 N MET A 211 14.432 100.679 67.184 1.00 49.57 N ATOM 2120 CA MET A 211 14.510 99.424 67.923 1.00 51.58 C ATOM 2121 C MET A 211 15.871 98.758 67.767 1.00 58.11 C ATOM 2122 O MET A 211 16.319 98.044 68.671 1.00 58.53 O ATOM 2123 CB MET A 211 13.403 98.477 67.454 1.00 47.65 C ATOM 2124 CG MET A 211 13.354 97.161 68.199 1.00 46.95 C ATOM 2125 SD MET A 211 11.897 96.189 67.786 1.00 45.66 S ATOM 2126 CE MET A 211 12.206 95.800 66.066 1.00 44.84 C ATOM 2127 H MET A 211 13.699 100.801 66.456 1.00 0.00 H ATOM 2128 N MET A 212 16.543 98.980 66.644 1.00 60.11 N ATOM 2129 CA MET A 212 17.841 98.360 66.396 1.00 63.26 C ATOM 2130 C MET A 212 18.920 98.996 67.267 1.00 62.11 C ATOM 2131 O MET A 212 19.094 100.218 67.272 1.00 65.97 O ATOM 2132 CB MET A 212 18.217 98.487 64.919 1.00 68.94 C ATOM 2133 CG MET A 212 18.642 97.186 64.256 1.00 72.99 C ATOM 2134 SD MET A 212 17.409 96.564 63.093 1.00 75.95 S ATOM 2135 CE MET A 212 16.265 95.737 64.205 1.00 71.83 C ATOM 2136 H MET A 212 16.135 99.610 65.924 1.00 0.00 H TER 2137 MET A 212 HETATM 2138 O HOH 1 -31.547 101.255 47.477 1.00 56.32 O HETATM 2139 O HOH 2 14.044 77.695 48.091 1.00 54.88 O HETATM 2140 O HOH 3 6.845 89.919 72.471 1.00 58.80 O HETATM 2141 O HOH 4 -7.928 68.538 46.479 1.00 49.84 O HETATM 2142 O HOH 5 5.374 84.914 74.176 1.00 57.85 O HETATM 2143 O HOH 6 -21.334 80.208 50.151 1.00 54.99 O HETATM 2144 O HOH 7 11.266 73.253 51.329 1.00 38.55 O HETATM 2145 O HOH 8 3.096 77.811 46.203 1.00 38.89 O HETATM 2146 O HOH 9 6.644 94.592 47.813 1.00 51.86 O HETATM 2147 O HOH 10 -1.661 101.932 70.103 1.00 50.48 O HETATM 2148 O HOH 11 2.932 83.292 61.708 1.00 21.09 O HETATM 2149 O HOH 12 -2.465 89.090 53.754 1.00 35.96 O HETATM 2150 O HOH 13 -13.225 86.069 62.330 1.00 44.91 O HETATM 2151 O HOH 14 0.718 98.123 70.877 1.00 42.93 O HETATM 2152 O HOH 15 -6.069 91.043 63.570 1.00 34.40 O HETATM 2153 O HOH 16 -2.204 92.226 66.540 1.00 36.72 O HETATM 2154 O HOH 17 -2.220 81.750 39.076 1.00 28.88 O HETATM 2155 O HOH 18 -8.940 90.796 62.050 1.00 29.81 O HETATM 2156 O HOH 19 9.049 82.200 41.619 1.00 35.20 O HETATM 2157 O HOH 20 9.106 89.011 52.313 1.00 35.91 O HETATM 2158 O HOH 21 9.155 91.177 69.963 1.00 55.08 O HETATM 2159 O HOH 22 20.510 100.434 69.695 1.00 49.94 O HETATM 2160 O HOH 23 -3.050 79.746 64.375 1.00 32.41 O HETATM 2161 O HOH 24 -1.213 97.882 72.347 1.00 56.28 O HETATM 2162 O HOH 25 4.111 90.643 70.747 1.00 45.68 O HETATM 2163 O HOH 26 -2.659 84.569 53.353 1.00 37.49 O HETATM 2164 O HOH 27 -18.817 75.598 53.980 1.00 54.90 O HETATM 2165 O HOH 28 3.375 106.189 74.482 1.00 49.43 O HETATM 2166 O HOH 29 2.272 84.725 42.816 1.00 44.54 O HETATM 2167 O HOH 30 19.560 81.518 49.365 1.00 56.56 O HETATM 2168 O HOH 31 13.132 73.449 58.075 1.00 43.94 O HETATM 2169 O HOH 32 -5.219 87.438 39.692 1.00 46.34 O HETATM 2170 O HOH 33 12.438 80.672 57.290 1.00 35.98 O HETATM 2171 O HOH 34 0.899 104.798 48.918 1.00 61.53 O HETATM 2172 O HOH 35 -12.778 96.421 40.611 1.00 57.04 O HETATM 2173 O HOH 36 1.082 107.086 51.499 1.00 53.65 O HETATM 2174 O HOH 37 -6.739 97.122 66.073 1.00 49.56 O HETATM 2175 O HOH 38 4.793 77.186 45.665 1.00 47.96 O HETATM 2176 O HOH 39 -8.268 97.019 65.121 1.00 53.13 O HETATM 2177 O HOH 40 8.547 73.514 50.809 1.00 47.22 O HETATM 2178 O HOH 41 18.122 81.112 47.146 1.00 57.06 O HETATM 2179 O HOH 42 0.000 80.552 40.293 1.00 41.81 O HETATM 2180 C13 FWW A 43 -12.281 88.613 55.569 1.00 -0.06 C HETATM 2181 C12 FWW A 43 -13.440 88.956 54.885 1.00 -0.04 C HETATM 2182 C11 FWW A 43 -13.674 88.589 53.560 1.00 0.07 C HETATM 2183 C59 FWW A 43 -12.642 87.813 52.986 1.00 -0.04 C HETATM 2184 C58 FWW A 43 -11.484 87.478 53.679 1.00 -0.06 C HETATM 2185 C14 FWW A 43 -11.261 87.866 55.005 1.00 0.03 C HETATM 2186 C15 FWW A 43 -10.052 87.510 55.743 1.00 0.20 C HETATM 2187 N16 FWW A 43 -10.072 87.112 57.087 1.00 -0.26 N HETATM 2188 C17 FWW A 43 -8.897 86.755 57.836 1.00 0.16 C HETATM 2189 C21 FWW A 43 -7.949 87.959 57.697 1.00 0.26 C HETATM 2190 N22 FWW A 43 -6.721 87.641 57.162 1.00 -0.13 N HETATM 2191 C19 FWW A 43 -6.740 86.245 56.912 1.00 0.24 C HETATM 2192 C18 FWW A 43 -8.061 85.634 57.291 1.00 0.09 C HETATM 2193 H11 FWW A 43 -8.544 85.192 56.407 1.00 0.06 H HETATM 2194 H12 FWW A 43 -7.917 84.858 58.057 1.00 0.06 H HETATM 2195 O20 FWW A 43 -5.792 85.618 56.448 1.00 -0.37 O HETATM 2196 C23 FWW A 43 -5.656 88.508 56.956 1.00 0.10 C HETATM 2197 C24 FWW A 43 -4.421 88.313 57.562 1.00 -0.03 C HETATM 2198 C25 FWW A 43 -3.390 89.195 57.379 1.00 -0.05 C HETATM 2199 C26 FWW A 43 -3.493 90.358 56.593 1.00 0.04 C HETATM 2200 C27 FWW A 43 -2.336 91.238 56.485 1.00 0.22 C HETATM 2201 N28 FWW A 43 -1.044 90.765 56.542 1.00 -0.24 N HETATM 2202 C29 FWW A 43 0.161 91.447 56.507 1.00 0.09 C HETATM 2203 C30 FWW A 43 0.225 92.793 56.917 1.00 -0.05 C HETATM 2204 C31 FWW A 43 1.397 93.533 56.925 1.00 -0.07 C HETATM 2205 C32 FWW A 43 2.619 93.016 56.545 1.00 0.06 C HETATM 2206 C33 FWW A 43 3.903 93.784 56.550 1.00 0.21 C HETATM 2207 N34 FWW A 43 5.085 93.261 56.072 1.00 -0.24 N HETATM 2208 C35 FWW A 43 6.399 93.826 56.009 1.00 0.09 C HETATM 2209 C36 FWW A 43 6.682 95.131 56.435 1.00 -0.06 C HETATM 2210 C37 FWW A 43 7.970 95.675 56.379 1.00 -0.08 C HETATM 2211 C38 FWW A 43 9.062 94.951 55.905 1.00 0.02 C HETATM 2212 C39 FWW A 43 10.486 95.545 55.843 1.00 0.05 C HETATM 2213 O40 FWW A 43 10.784 96.400 56.703 1.00 -0.57 O HETATM 2214 O41 FWW A 43 11.223 95.110 54.942 1.00 -0.57 O HETATM 2215 C42 FWW A 43 8.790 93.650 55.485 1.00 0.12 C HETATM 2216 C44 FWW A 43 7.505 93.094 55.533 1.00 0.14 C HETATM 2217 O45 FWW A 43 7.256 91.807 55.106 1.00 -0.33 O HETATM 2218 C46 FWW A 43 7.014 90.869 56.157 1.00 0.05 C HETATM 2219 H18 FWW A 43 6.826 89.875 55.725 1.00 0.06 H HETATM 2220 H19 FWW A 43 6.136 91.188 56.738 1.00 0.06 H HETATM 2221 H20 FWW A 43 7.893 90.822 56.816 1.00 0.06 H HETATM 2222 O43 FWW A 43 9.801 92.868 55.002 1.00 -0.34 O HETATM 2223 H35 FWW A 43 10.615 93.357 55.022 1.00 0.24 H HETATM 2224 H17 FWW A 43 8.123 96.694 56.716 1.00 0.05 H HETATM 2225 H16 FWW A 43 5.874 95.741 56.822 1.00 0.04 H HETATM 2226 H33 FWW A 43 5.013 92.332 55.709 1.00 0.22 H HETATM 2227 O47 FWW A 43 3.869 94.927 57.027 1.00 -0.39 O HETATM 2228 C48 FWW A 43 2.559 91.650 56.151 1.00 0.13 C HETATM 2229 C50 FWW A 43 1.379 90.893 56.137 1.00 0.14 C HETATM 2230 O51 FWW A 43 1.369 89.576 55.737 1.00 -0.33 O HETATM 2231 C52 FWW A 43 1.533 88.557 56.821 1.00 0.05 C HETATM 2232 H21 FWW A 43 1.509 87.548 56.383 1.00 0.06 H HETATM 2233 H22 FWW A 43 0.714 88.660 57.548 1.00 0.06 H HETATM 2234 H23 FWW A 43 2.496 88.713 57.329 1.00 0.06 H HETATM 2235 O49 FWW A 43 3.692 90.998 55.751 1.00 -0.34 O HETATM 2236 H36 FWW A 43 4.431 91.593 55.796 1.00 0.25 H HETATM 2237 H15 FWW A 43 1.352 94.568 57.245 1.00 0.05 H HETATM 2238 H14 FWW A 43 -0.690 93.275 57.243 1.00 0.04 H HETATM 2239 H32 FWW A 43 -0.963 89.771 56.621 1.00 0.22 H HETATM 2240 O53 FWW A 43 -2.532 92.438 56.408 1.00 -0.38 O HETATM 2241 C54 FWW A 43 -4.723 90.549 56.011 1.00 -0.05 C HETATM 2242 C55 FWW A 43 -5.778 89.660 56.181 1.00 -0.03 C HETATM 2243 H25 FWW A 43 -6.725 89.869 55.696 1.00 0.05 H HETATM 2244 H24 FWW A 43 -4.877 91.428 55.395 1.00 0.06 H HETATM 2245 H13 FWW A 43 -2.444 88.987 57.865 1.00 0.06 H HETATM 2246 H3 FWW A 43 -4.271 87.444 58.193 1.00 0.05 H HETATM 2247 O56 FWW A 43 -8.275 89.108 57.988 1.00 -0.37 O HETATM 2248 H2 FWW A 43 -9.173 86.550 58.881 1.00 0.08 H HETATM 2249 H31 FWW A 43 -10.956 87.074 57.553 1.00 0.19 H HETATM 2250 O57 FWW A 43 -8.967 87.554 55.161 1.00 -0.39 O HETATM 2251 H26 FWW A 43 -10.724 86.894 53.172 1.00 0.06 H HETATM 2252 H27 FWW A 43 -12.758 87.465 51.966 1.00 0.05 H HETATM 2253 N10 FWW A 43 -14.894 88.936 52.871 1.00 -0.23 N HETATM 2254 C09 FWW A 43 -16.031 89.582 53.374 1.00 0.23 C HETATM 2255 C07 FWW A 43 -17.309 89.904 52.632 1.00 0.03 C HETATM 2256 C06 FWW A 43 -17.556 89.957 51.315 1.00 -0.05 C HETATM 2257 C05 FWW A 43 -18.874 90.265 50.667 1.00 -0.04 C HETATM 2258 C04 FWW A 43 -19.562 91.465 50.900 1.00 -0.06 C HETATM 2259 C03 FWW A 43 -20.790 91.769 50.323 1.00 -0.03 C HETATM 2260 C02 FWW A 43 -21.400 90.855 49.476 1.00 0.09 C HETATM 2261 C62 FWW A 43 -20.761 89.642 49.223 1.00 -0.03 C HETATM 2262 C61 FWW A 43 -19.529 89.368 49.817 1.00 -0.06 C HETATM 2263 H28 FWW A 43 -19.057 88.415 49.610 1.00 0.06 H HETATM 2264 H29 FWW A 43 -21.221 88.913 48.566 1.00 0.05 H HETATM 2265 O01 FWW A 43 -22.606 91.131 48.898 1.00 -0.33 O HETATM 2266 H34 FWW A 43 -22.899 91.992 49.174 1.00 0.25 H HETATM 2267 H4 FWW A 43 -21.270 92.718 50.534 1.00 0.05 H HETATM 2268 H5 FWW A 43 -19.113 92.194 51.565 1.00 0.06 H HETATM 2269 H6 FWW A 43 -16.717 89.757 50.650 1.00 0.06 H HETATM 2270 C08 FWW A 43 -18.455 90.134 53.469 1.00 -0.02 C HETATM 2271 H7 FWW A 43 -19.329 90.359 52.840 1.00 0.04 H HETATM 2272 H8 FWW A 43 -18.256 90.984 54.138 1.00 0.04 H HETATM 2273 H9 FWW A 43 -18.657 89.235 54.069 1.00 0.04 H HETATM 2274 O60 FWW A 43 -16.011 89.892 54.554 1.00 -0.37 O HETATM 2275 H30 FWW A 43 -14.933 88.681 51.905 1.00 0.23 H HETATM 2276 H10 FWW A 43 -14.196 89.534 55.404 1.00 0.05 H HETATM 2277 H1 FWW A 43 -12.170 88.946 56.594 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2180 2181 2185 2277 CONECT 2181 2180 2182 2276 CONECT 2182 2181 2183 2253 CONECT 2183 2182 2184 2252 CONECT 2184 2183 2185 2251 CONECT 2185 2180 2184 2186 CONECT 2186 2185 2187 2250 CONECT 2187 2186 2188 2249 CONECT 2188 2187 2189 2192 2248 CONECT 2189 2188 2190 2247 CONECT 2190 2189 2191 2196 CONECT 2191 2190 2192 2195 CONECT 2192 2188 2191 2193 2194 CONECT 2193 2192 CONECT 2194 2192 CONECT 2195 2191 CONECT 2196 2190 2197 2242 CONECT 2197 2196 2198 2246 CONECT 2198 2197 2199 2245 CONECT 2199 2198 2200 2241 CONECT 2200 2199 2201 2240 CONECT 2201 2200 2202 2239 CONECT 2202 2201 2203 2229 CONECT 2203 2202 2204 2238 CONECT 2204 2203 2205 2237 CONECT 2205 2204 2206 2228 CONECT 2206 2205 2207 2227 CONECT 2207 2206 2208 2226 CONECT 2208 2207 2209 2216 CONECT 2209 2208 2210 2225 CONECT 2210 2209 2211 2224 CONECT 2211 2210 2212 2215 CONECT 2212 2211 2213 2214 CONECT 2213 2212 CONECT 2214 2212 CONECT 2215 2211 2216 2222 CONECT 2216 2208 2215 2217 CONECT 2217 2216 2218 CONECT 2218 2217 2219 2220 2221 CONECT 2219 2218 CONECT 2220 2218 CONECT 2221 2218 CONECT 2222 2215 2223 CONECT 2223 2222 CONECT 2224 2210 CONECT 2225 2209 CONECT 2226 2207 CONECT 2227 2206 CONECT 2228 2205 2229 2235 CONECT 2229 2202 2228 2230 CONECT 2230 2229 2231 CONECT 2231 2230 2232 2233 2234 CONECT 2232 2231 CONECT 2233 2231 CONECT 2234 2231 CONECT 2235 2228 2236 CONECT 2236 2235 CONECT 2237 2204 CONECT 2238 2203 CONECT 2239 2201 CONECT 2240 2200 CONECT 2241 2199 2242 2244 CONECT 2242 2196 2241 2243 CONECT 2243 2242 CONECT 2244 2241 CONECT 2245 2198 CONECT 2246 2197 CONECT 2247 2189 CONECT 2248 2188 CONECT 2249 2187 CONECT 2250 2186 CONECT 2251 2184 CONECT 2252 2183 CONECT 2253 2182 2254 2275 CONECT 2254 2253 2255 2274 CONECT 2255 2254 2256 2270 CONECT 2256 2255 2257 2269 CONECT 2257 2256 2258 2262 CONECT 2258 2257 2259 2268 CONECT 2259 2258 2260 2267 CONECT 2260 2259 2261 2265 CONECT 2261 2260 2262 2264 CONECT 2262 2257 2261 2263 CONECT 2263 2262 CONECT 2264 2261 CONECT 2265 2260 2266 CONECT 2266 2265 CONECT 2267 2259 CONECT 2268 2258 CONECT 2269 2256 CONECT 2270 2255 2271 2272 2273 CONECT 2271 2270 CONECT 2272 2270 CONECT 2273 2270 CONECT 2274 2254 CONECT 2275 2253 CONECT 2276 2181 CONECT 2277 2180 MASTER 0 0 0 0 0 0 0 0 2276 1 102 17 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6hai
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6et8
RCSB PDB
PDBbind
222aa, >6ET8_1|Chains... at 96%
6h96
RCSB PDB
PDBbind
226aa, >6H96_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6hai
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
AlbA
Ligand Name
FWW
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=11.6nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Am. Chem. Soc. Vol. 140: pp. 16641-16649
Ligand Properties
Formula
C
4
4
H
3
7
N
5
O
1
3
Molecular Weight
843.790
Exact Mass
843.239
No. of atoms
99
No. of bonds
104
Polar Surface Area
270.23
LOGP Value
5.70 (
Computed with XLOGP3
)
5.80 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 19
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 6
Canonical SMILES
COc1c(ccc(c1O)C(=O)Nc1ccc(c(c1OC)O)C(=O)O)NC(=O)c1ccc(cc1)N1C(=O)C[C@@H](C1=O)NC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccc(cc1)O)/C
InChI String
InChI=1S/C44H37N5O13/c1-22(20-23-4-14-28(50)15-5-23)39(54)45-26-10-6-24(7-11-26)41(56)48-33-21-34(51)49(43(33)58)27-12-8-25(9-13-27)40(55)46-31-18-16-29(35(52)37(31)61-2)42(57)47-32-19-17-30(44(59)60)36(53)38(32)62-3/h4-20,33,50,52-53H,21H2,1-3H3,(H,45,54)(H,46,55)(H,47,57)(H,48,56)(H,59,60)/b22-20+/t33-/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):
Q8KRS7
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓