Browse entries in the PDBbind-CN Database
HEADER 4NWC_COMPLEX COMPND 4NWC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 255 THR ASN ARG SER LEU ILE VAL THR THR LEU LEU GLU GLU SEQRES 2 A 255 PRO PHE VAL MET PHE ARG LYS SER ASP ARG THR LEU TYR SEQRES 3 A 255 GLY ASN ASP ARG PHE GLU GLY TYR CYS ILE ASP LEU LEU SEQRES 4 A 255 LYS GLU LEU ALA HIS ILE LEU GLY PHE SER TYR GLU ILE SEQRES 5 A 255 ARG LEU VAL GLU ASP GLY LYS TYR GLY ALA GLN ASP ASP SEQRES 6 A 255 LYS GLY GLN TRP ASN GLY MET VAL LYS GLU LEU ILE ASP SEQRES 7 A 255 HIS LYS ALA ASP LEU ALA VAL ALA PRO LEU THR ILE THR SEQRES 8 A 255 HIS VAL ARG GLU LYS ALA ILE ASP PHE SER LYS PRO PHE SEQRES 9 A 255 MET THR LEU GLY VAL SER ILE LEU TYR ARG LYS GLY THR SEQRES 10 A 255 PRO ILE ASP SER ALA ASP ASP LEU ALA LYS GLN THR LYS SEQRES 11 A 255 ILE GLU TYR GLY ALA VAL LYS ASP GLY ALA THR MET THR SEQRES 12 A 255 PHE PHE LYS LYS SER LYS ILE SER THR PHE GLU LYS MET SEQRES 13 A 255 TRP ALA PHE MET SER SER LYS PRO SER ALA LEU VAL LYS SEQRES 14 A 255 ASN ASN GLU GLU GLY ILE GLN ARG THR LEU THR ALA ASP SEQRES 15 A 255 TYR ALA LEU LEU MET GLU SER THR THR ILE GLU TYR ILE SEQRES 16 A 255 THR GLN ARG ASN CYS ASN LEU THR GLN ILE GLY GLY LEU SEQRES 17 A 255 ILE ASP SER LYS GLY TYR GLY ILE GLY THR PRO MET GLY SEQRES 18 A 255 SER PRO TYR ARG ASP LYS ILE THR ILE ALA ILE LEU GLN SEQRES 19 A 255 LEU GLN GLU GLU ASP LYS LEU HIS ILE MET LYS GLU LYS SEQRES 20 A 255 TRP TRP ARG GLY SER GLY CYS PRO HET K A 1 1 HET K A 2 1 HET UNN A 488 30 SSBOND 1 CYS A 751 CYS A 805 ATOM 1 N THR A 432 3.940 60.551 9.007 1.00 72.28 N ATOM 2 CA THR A 432 3.545 59.944 10.276 1.00 69.17 C ATOM 3 C THR A 432 4.753 59.713 11.193 1.00 63.61 C ATOM 4 O THR A 432 5.688 58.991 10.838 1.00 67.00 O ATOM 5 CB THR A 432 2.750 58.629 10.053 1.00 72.64 C ATOM 6 OG1 THR A 432 2.554 57.959 11.305 1.00 71.09 O ATOM 7 CG2 THR A 432 3.477 57.704 9.076 1.00 70.77 C ATOM 8 HG1 THR A 432 2.046 58.548 11.917 1.00 0.00 H ATOM 9 HN3 THR A 432 4.609 59.923 8.517 1.00 0.00 H ATOM 10 HN2 THR A 432 4.394 61.469 9.190 1.00 0.00 H ATOM 11 HN1 THR A 432 3.097 60.692 8.414 1.00 0.00 H ATOM 12 N ASN A 433 4.726 60.330 12.372 1.00 51.99 N ATOM 13 CA ASN A 433 5.872 60.303 13.281 1.00 43.07 C ATOM 14 C ASN A 433 5.762 59.336 14.465 1.00 33.35 C ATOM 15 O ASN A 433 6.771 58.991 15.084 1.00 27.12 O ATOM 16 CB ASN A 433 6.169 61.717 13.803 1.00 44.72 C ATOM 17 CG ASN A 433 7.098 62.498 12.885 1.00 51.40 C ATOM 18 OD1 ASN A 433 8.069 61.952 12.353 1.00 51.97 O ATOM 19 ND2 ASN A 433 6.806 63.786 12.699 1.00 51.07 N ATOM 20 HD22 ASN A 433 5.977 64.204 13.168 1.00 0.00 H ATOM 21 HD21 ASN A 433 7.407 64.372 12.085 1.00 0.00 H ATOM 22 H ASN A 433 3.868 60.845 12.655 1.00 0.00 H ATOM 23 N ARG A 434 4.548 58.902 14.790 1.00 25.42 N ATOM 24 CA ARG A 434 4.334 58.121 16.012 1.00 19.30 C ATOM 25 C ARG A 434 5.070 56.782 15.988 1.00 15.55 C ATOM 26 O ARG A 434 5.402 56.257 14.918 1.00 17.09 O ATOM 27 CB ARG A 434 2.841 57.875 16.242 1.00 21.19 C ATOM 28 CG ARG A 434 2.218 56.909 15.253 1.00 25.73 C ATOM 29 CD ARG A 434 0.754 56.631 15.577 1.00 27.03 C ATOM 30 NE ARG A 434 0.177 55.734 14.585 1.00 31.06 N ATOM 31 CZ ARG A 434 0.278 54.410 14.639 1.00 34.78 C ATOM 32 NH1 ARG A 434 0.927 53.832 15.650 1.00 30.02 N ATOM 33 NH2 ARG A 434 -0.280 53.663 13.692 1.00 32.88 N ATOM 34 HE ARG A 434 -0.344 56.154 13.789 1.00 0.00 H ATOM 35 HH12 ARG A 434 1.006 52.796 15.693 1.00 0.00 H ATOM 36 HH11 ARG A 434 1.354 54.417 16.396 1.00 0.00 H ATOM 37 HH22 ARG A 434 -0.202 52.627 13.733 1.00 0.00 H ATOM 38 HH21 ARG A 434 -0.795 54.115 12.910 1.00 0.00 H ATOM 39 H ARG A 434 3.741 59.119 14.170 1.00 0.00 H ATOM 40 N SER A 435 5.326 56.240 17.176 1.00 12.80 N ATOM 41 CA SER A 435 5.974 54.940 17.301 1.00 12.01 C ATOM 42 C SER A 435 4.975 53.858 16.944 1.00 17.79 C ATOM 43 O SER A 435 3.795 53.955 17.267 1.00 21.22 O ATOM 44 CB SER A 435 6.491 54.721 18.719 1.00 17.95 C ATOM 45 OG SER A 435 7.532 55.631 19.029 1.00 17.77 O ATOM 46 HG SER A 435 7.848 55.467 19.953 1.00 0.00 H ATOM 47 H SER A 435 5.057 56.757 18.037 1.00 0.00 H ATOM 48 N LEU A 436 5.448 52.830 16.264 1.00 11.30 N ATOM 49 CA LEU A 436 4.569 51.756 15.847 1.00 14.59 C ATOM 50 C LEU A 436 4.397 50.803 17.022 1.00 19.48 C ATOM 51 O LEU A 436 5.333 50.571 17.785 1.00 15.12 O ATOM 52 CB LEU A 436 5.179 51.027 14.653 1.00 12.31 C ATOM 53 CG LEU A 436 5.012 51.633 13.253 1.00 21.71 C ATOM 54 CD1 LEU A 436 5.574 53.036 13.137 1.00 30.33 C ATOM 55 CD2 LEU A 436 5.673 50.735 12.231 1.00 17.68 C ATOM 56 H LEU A 436 6.460 52.791 16.026 1.00 0.00 H ATOM 57 N ILE A 437 3.200 50.255 17.183 1.00 13.76 N ATOM 58 CA ILE A 437 2.989 49.246 18.214 1.00 12.11 C ATOM 59 C ILE A 437 3.317 47.903 17.596 1.00 11.02 C ATOM 60 O ILE A 437 2.746 47.540 16.575 1.00 11.08 O ATOM 61 CB ILE A 437 1.528 49.211 18.708 1.00 12.86 C ATOM 62 CG1 ILE A 437 1.108 50.582 19.239 1.00 14.10 C ATOM 63 CG2 ILE A 437 1.356 48.117 19.773 1.00 12.53 C ATOM 64 CD1 ILE A 437 2.056 51.155 20.276 1.00 21.06 C ATOM 65 H ILE A 437 2.410 50.546 16.572 1.00 0.00 H ATOM 66 N VAL A 438 4.240 47.172 18.215 1.00 12.42 N ATOM 67 CA VAL A 438 4.666 45.883 17.697 1.00 11.70 C ATOM 68 C VAL A 438 4.192 44.785 18.637 1.00 17.50 C ATOM 69 O VAL A 438 4.539 44.787 19.819 1.00 15.14 O ATOM 70 CB VAL A 438 6.204 45.816 17.586 1.00 15.41 C ATOM 71 CG1 VAL A 438 6.645 44.435 17.138 1.00 16.73 C ATOM 72 CG2 VAL A 438 6.712 46.859 16.612 1.00 12.88 C ATOM 73 H VAL A 438 4.668 47.532 19.092 1.00 0.00 H ATOM 74 N THR A 439 3.377 43.863 18.127 1.00 11.06 N ATOM 75 CA THR A 439 2.947 42.745 18.941 1.00 11.53 C ATOM 76 C THR A 439 3.857 41.552 18.669 1.00 11.29 C ATOM 77 O THR A 439 4.357 41.357 17.553 1.00 11.23 O ATOM 78 CB THR A 439 1.464 42.389 18.717 1.00 17.36 C ATOM 79 OG1 THR A 439 1.067 41.372 19.646 1.00 21.43 O ATOM 80 CG2 THR A 439 1.224 41.895 17.296 1.00 11.31 C ATOM 81 HG1 THR A 439 1.190 41.705 20.570 1.00 0.00 H ATOM 82 H THR A 439 3.049 43.946 17.144 1.00 0.00 H ATOM 83 N THR A 440 4.096 40.758 19.702 1.00 12.90 N ATOM 84 CA THR A 440 5.013 39.643 19.553 1.00 13.19 C ATOM 85 C THR A 440 4.749 38.583 20.616 1.00 12.05 C ATOM 86 O THR A 440 3.812 38.702 21.407 1.00 13.88 O ATOM 87 CB THR A 440 6.478 40.120 19.611 1.00 19.10 C ATOM 88 OG1 THR A 440 7.351 39.019 19.316 1.00 25.62 O ATOM 89 CG2 THR A 440 6.797 40.686 20.994 1.00 16.80 C ATOM 90 HG1 THR A 440 7.151 38.674 18.410 1.00 0.00 H ATOM 91 H THR A 440 3.629 40.933 20.615 1.00 0.00 H ATOM 92 N LEU A 441 5.584 37.551 20.621 1.00 14.85 N ATOM 93 CA LEU A 441 5.366 36.361 21.428 1.00 14.54 C ATOM 94 C LEU A 441 6.746 35.884 21.816 1.00 16.47 C ATOM 95 O LEU A 441 7.671 36.022 21.030 1.00 16.42 O ATOM 96 CB LEU A 441 4.720 35.281 20.556 1.00 22.67 C ATOM 97 CG LEU A 441 3.256 34.977 20.826 1.00 32.37 C ATOM 98 CD1 LEU A 441 2.740 33.826 19.990 1.00 22.51 C ATOM 99 CD2 LEU A 441 3.128 34.657 22.274 1.00 40.61 C ATOM 100 H LEU A 441 6.432 37.596 20.021 1.00 0.00 H ATOM 101 N LEU A 442 6.900 35.324 23.010 1.00 12.34 N ATOM 102 CA LEU A 442 8.204 34.783 23.396 1.00 17.15 C ATOM 103 C LEU A 442 8.422 33.470 22.660 1.00 17.77 C ATOM 104 O LEU A 442 7.594 32.569 22.733 1.00 18.11 O ATOM 105 CB LEU A 442 8.289 34.555 24.906 1.00 16.59 C ATOM 106 CG LEU A 442 8.283 35.774 25.836 1.00 18.49 C ATOM 107 CD1 LEU A 442 8.408 35.342 27.301 1.00 18.24 C ATOM 108 CD2 LEU A 442 9.382 36.748 25.469 1.00 16.61 C ATOM 109 H LEU A 442 6.097 35.270 23.669 1.00 0.00 H ATOM 110 N GLU A 443 9.529 33.367 21.936 1.00 13.05 N ATOM 111 CA GLU A 443 9.798 32.177 21.139 1.00 15.23 C ATOM 112 C GLU A 443 11.278 32.150 20.799 1.00 15.69 C ATOM 113 O GLU A 443 11.739 32.886 19.931 1.00 15.96 O ATOM 114 CB GLU A 443 8.979 32.206 19.844 1.00 17.61 C ATOM 115 CG GLU A 443 8.859 30.847 19.155 1.00 26.05 C ATOM 116 CD GLU A 443 7.970 29.892 19.943 1.00 33.40 C ATOM 117 OE1 GLU A 443 6.723 30.025 19.871 1.00 30.19 O ATOM 118 OE2 GLU A 443 8.520 29.027 20.654 1.00 32.54 O ATOM 119 H GLU A 443 10.216 34.148 21.937 1.00 0.00 H ATOM 120 N GLU A 444 12.022 31.295 21.490 1.00 13.28 N ATOM 121 CA GLU A 444 13.458 31.180 21.283 1.00 15.49 C ATOM 122 C GLU A 444 13.761 30.583 19.903 1.00 13.37 C ATOM 123 O GLU A 444 13.132 29.603 19.510 1.00 14.05 O ATOM 124 CB GLU A 444 14.032 30.294 22.392 1.00 19.10 C ATOM 125 CG GLU A 444 15.517 30.117 22.346 1.00 31.23 C ATOM 126 CD GLU A 444 16.023 29.361 23.550 1.00 37.03 C ATOM 127 OE1 GLU A 444 15.196 29.053 24.439 1.00 33.03 O ATOM 128 OE2 GLU A 444 17.237 29.072 23.600 1.00 44.88 O ATOM 129 H GLU A 444 11.565 30.689 22.201 1.00 0.00 H ATOM 130 N PRO A 445 14.730 31.160 19.160 1.00 11.49 N ATOM 131 CA PRO A 445 15.595 32.289 19.517 1.00 12.79 C ATOM 132 C PRO A 445 15.143 33.562 18.834 1.00 13.09 C ATOM 133 O PRO A 445 15.968 34.462 18.618 1.00 10.74 O ATOM 134 CB PRO A 445 16.917 31.878 18.896 1.00 10.91 C ATOM 135 CG PRO A 445 16.468 31.272 17.560 1.00 11.20 C ATOM 136 CD PRO A 445 15.144 30.568 17.872 1.00 13.70 C ATOM 137 N PHE A 446 13.865 33.636 18.473 1.00 12.10 N ATOM 138 CA PHE A 446 13.365 34.800 17.747 1.00 9.31 C ATOM 139 C PHE A 446 13.113 35.986 18.661 1.00 13.89 C ATOM 140 O PHE A 446 13.494 37.114 18.356 1.00 9.61 O ATOM 141 CB PHE A 446 12.069 34.459 17.010 1.00 12.88 C ATOM 142 CG PHE A 446 12.249 33.456 15.905 1.00 15.47 C ATOM 143 CD1 PHE A 446 12.622 33.873 14.636 1.00 13.71 C ATOM 144 CD2 PHE A 446 12.038 32.100 16.137 1.00 12.90 C ATOM 145 CE1 PHE A 446 12.785 32.953 13.604 1.00 14.70 C ATOM 146 CE2 PHE A 446 12.198 31.166 15.105 1.00 14.31 C ATOM 147 CZ PHE A 446 12.571 31.601 13.839 1.00 10.55 C ATOM 148 H PHE A 446 13.216 32.858 18.710 1.00 0.00 H ATOM 149 N VAL A 447 12.418 35.737 19.762 1.00 12.78 N ATOM 150 CA VAL A 447 12.103 36.791 20.711 1.00 15.13 C ATOM 151 C VAL A 447 12.291 36.231 22.104 1.00 13.76 C ATOM 152 O VAL A 447 11.645 35.251 22.473 1.00 11.47 O ATOM 153 CB VAL A 447 10.650 37.278 20.557 1.00 15.33 C ATOM 154 CG1 VAL A 447 10.341 38.349 21.594 1.00 15.49 C ATOM 155 CG2 VAL A 447 10.395 37.801 19.133 1.00 10.24 C ATOM 156 H VAL A 447 12.092 34.768 19.950 1.00 0.00 H ATOM 157 N MET A 448 13.188 36.829 22.880 1.00 11.36 N ATOM 158 CA MET A 448 13.436 36.351 24.236 1.00 11.97 C ATOM 159 C MET A 448 13.609 37.509 25.207 1.00 14.51 C ATOM 160 O MET A 448 13.908 38.631 24.795 1.00 14.37 O ATOM 161 CB MET A 448 14.692 35.467 24.273 1.00 11.27 C ATOM 162 CG MET A 448 14.726 34.369 23.201 1.00 20.40 C ATOM 163 SD MET A 448 16.317 33.528 23.126 1.00 28.43 S ATOM 164 CE MET A 448 17.226 34.682 22.094 1.00 17.67 C ATOM 165 H MET A 448 13.719 37.646 22.517 1.00 0.00 H ATOM 166 N PHE A 449 13.412 37.231 26.494 1.00 12.30 N ATOM 167 CA PHE A 449 13.703 38.205 27.530 1.00 16.22 C ATOM 168 C PHE A 449 15.211 38.217 27.730 1.00 17.07 C ATOM 169 O PHE A 449 15.813 37.212 28.088 1.00 17.59 O ATOM 170 CB PHE A 449 12.993 37.839 28.833 1.00 17.63 C ATOM 171 CG PHE A 449 11.551 38.291 28.900 1.00 20.70 C ATOM 172 CD1 PHE A 449 11.147 39.475 28.300 1.00 20.98 C ATOM 173 CD2 PHE A 449 10.601 37.524 29.563 1.00 26.43 C ATOM 174 CE1 PHE A 449 9.819 39.895 28.364 1.00 23.10 C ATOM 175 CE2 PHE A 449 9.274 37.933 29.640 1.00 27.33 C ATOM 176 CZ PHE A 449 8.881 39.121 29.037 1.00 28.05 C ATOM 177 H PHE A 449 13.042 36.297 26.763 1.00 0.00 H ATOM 178 N ARG A 450 15.815 39.358 27.444 1.00 16.13 N ATOM 179 CA ARG A 450 17.233 39.589 27.656 1.00 19.38 C ATOM 180 C ARG A 450 17.613 39.324 29.117 1.00 20.61 C ATOM 181 O ARG A 450 16.857 39.662 30.025 1.00 19.20 O ATOM 182 CB ARG A 450 17.483 41.055 27.320 1.00 22.63 C ATOM 183 CG ARG A 450 18.892 41.448 27.150 1.00 27.18 C ATOM 184 CD ARG A 450 18.950 42.824 26.501 1.00 21.99 C ATOM 185 NE ARG A 450 18.862 43.971 27.414 1.00 19.80 N ATOM 186 CZ ARG A 450 19.726 44.234 28.391 1.00 19.84 C ATOM 187 NH1 ARG A 450 20.730 43.404 28.646 1.00 15.91 N ATOM 188 NH2 ARG A 450 19.578 45.329 29.133 1.00 13.98 N ATOM 189 HE ARG A 450 18.065 44.627 27.287 1.00 0.00 H ATOM 190 HH12 ARG A 450 21.400 43.618 29.412 1.00 0.00 H ATOM 191 HH11 ARG A 450 20.846 42.539 28.080 1.00 0.00 H ATOM 192 HH22 ARG A 450 20.253 45.535 29.897 1.00 0.00 H ATOM 193 HH21 ARG A 450 18.787 45.979 28.949 1.00 0.00 H ATOM 194 H ARG A 450 15.244 40.131 27.046 1.00 0.00 H ATOM 195 N LYS A 451 18.785 38.731 29.342 1.00 18.87 N ATOM 196 CA LYS A 451 19.267 38.450 30.693 1.00 20.28 C ATOM 197 C LYS A 451 20.040 39.642 31.262 1.00 22.31 C ATOM 198 O LYS A 451 20.910 40.210 30.590 1.00 19.07 O ATOM 199 CB LYS A 451 20.141 37.192 30.679 1.00 25.62 C ATOM 200 CG LYS A 451 20.996 36.970 31.914 1.00 36.84 C ATOM 201 CD LYS A 451 21.984 35.827 31.681 1.00 44.82 C ATOM 202 CE LYS A 451 23.098 35.811 32.717 1.00 48.66 C ATOM 203 NZ LYS A 451 22.624 35.475 34.087 1.00 51.14 N ATOM 204 HZ1 LYS A 451 21.922 36.179 34.392 1.00 0.00 H ATOM 205 HZ2 LYS A 451 22.189 34.530 34.080 1.00 0.00 H ATOM 206 HZ3 LYS A 451 23.431 35.481 34.743 1.00 0.00 H ATOM 207 H LYS A 451 19.376 38.459 28.530 1.00 0.00 H ATOM 208 N SER A 452 19.713 40.027 32.495 1.00 18.83 N ATOM 209 CA SER A 452 20.350 41.171 33.146 1.00 20.74 C ATOM 210 C SER A 452 20.106 41.099 34.642 1.00 23.50 C ATOM 211 O SER A 452 19.111 40.527 35.068 1.00 22.93 O ATOM 212 CB SER A 452 19.760 42.479 32.625 1.00 16.76 C ATOM 213 OG SER A 452 20.333 43.584 33.308 1.00 26.68 O ATOM 214 HG SER A 452 19.942 44.424 32.960 1.00 0.00 H ATOM 215 H SER A 452 18.982 39.497 33.011 1.00 0.00 H ATOM 216 N ASP A 453 21.009 41.679 35.430 1.00 19.79 N ATOM 217 CA ASP A 453 20.816 41.805 36.880 1.00 21.22 C ATOM 218 C ASP A 453 19.798 42.894 37.246 1.00 21.25 C ATOM 219 O ASP A 453 19.177 42.844 38.310 1.00 28.20 O ATOM 220 CB ASP A 453 22.138 42.123 37.575 1.00 27.09 C ATOM 221 CG ASP A 453 23.096 40.949 37.585 1.00 37.61 C ATOM 222 OD1 ASP A 453 22.672 39.817 37.264 1.00 38.40 O ATOM 223 OD2 ASP A 453 24.276 41.164 37.937 1.00 44.04 O ATOM 224 H ASP A 453 21.880 42.055 35.004 1.00 0.00 H ATOM 225 N ARG A 454 19.650 43.885 36.371 1.00 20.25 N ATOM 226 CA ARG A 454 18.723 44.994 36.582 1.00 28.55 C ATOM 227 C ARG A 454 17.320 44.528 36.236 1.00 23.34 C ATOM 228 O ARG A 454 17.153 43.616 35.435 1.00 18.81 O ATOM 229 CB ARG A 454 19.034 46.136 35.611 1.00 27.06 C ATOM 230 CG ARG A 454 20.094 47.119 36.011 1.00 35.20 C ATOM 231 CD ARG A 454 19.978 48.365 35.119 1.00 36.78 C ATOM 232 NE ARG A 454 20.208 48.100 33.692 1.00 36.33 N ATOM 233 CZ ARG A 454 19.295 48.239 32.732 1.00 37.54 C ATOM 234 NH1 ARG A 454 18.057 48.625 33.025 1.00 42.87 N ATOM 235 NH2 ARG A 454 19.616 47.990 31.468 1.00 32.27 N ATOM 236 HE ARG A 454 21.156 47.779 33.410 1.00 0.00 H ATOM 237 HH12 ARG A 454 17.352 48.730 32.268 1.00 0.00 H ATOM 238 HH11 ARG A 454 17.793 48.822 34.012 1.00 0.00 H ATOM 239 HH22 ARG A 454 18.903 48.099 30.719 1.00 0.00 H ATOM 240 HH21 ARG A 454 20.581 47.686 31.227 1.00 0.00 H ATOM 241 H ARG A 454 20.218 43.870 35.500 1.00 0.00 H ATOM 242 N THR A 455 16.306 45.177 36.796 1.00 20.15 N ATOM 243 CA THR A 455 14.955 44.971 36.268 1.00 19.49 C ATOM 244 C THR A 455 14.818 45.815 35.002 1.00 18.25 C ATOM 245 O THR A 455 14.903 47.042 35.051 1.00 18.41 O ATOM 246 CB THR A 455 13.873 45.355 37.283 1.00 21.02 C ATOM 247 OG1 THR A 455 13.994 44.522 38.449 1.00 21.87 O ATOM 248 CG2 THR A 455 12.489 45.183 36.668 1.00 19.99 C ATOM 249 HG1 THR A 455 14.888 44.651 38.854 1.00 0.00 H ATOM 250 H THR A 455 16.468 45.821 37.596 1.00 0.00 H ATOM 251 N LEU A 456 14.642 45.152 33.866 1.00 17.11 N ATOM 252 CA LEU A 456 14.520 45.838 32.586 1.00 16.00 C ATOM 253 C LEU A 456 13.070 46.228 32.292 1.00 21.89 C ATOM 254 O LEU A 456 12.128 45.633 32.823 1.00 16.28 O ATOM 255 CB LEU A 456 15.045 44.952 31.455 1.00 15.01 C ATOM 256 CG LEU A 456 16.416 44.323 31.687 1.00 15.30 C ATOM 257 CD1 LEU A 456 16.843 43.537 30.462 1.00 14.77 C ATOM 258 CD2 LEU A 456 17.423 45.400 32.019 1.00 15.74 C ATOM 259 H LEU A 456 14.590 44.114 33.890 1.00 0.00 H ATOM 260 N TYR A 457 12.901 47.224 31.430 1.00 15.20 N ATOM 261 CA TYR A 457 11.576 47.674 31.040 1.00 17.56 C ATOM 262 C TYR A 457 11.623 48.177 29.603 1.00 14.04 C ATOM 263 O TYR A 457 12.707 48.413 29.053 1.00 13.58 O ATOM 264 CB TYR A 457 11.060 48.753 32.002 1.00 16.11 C ATOM 265 CG TYR A 457 11.883 50.029 32.027 1.00 23.78 C ATOM 266 CD1 TYR A 457 11.645 51.046 31.108 1.00 27.42 C ATOM 267 CD2 TYR A 457 12.871 50.226 32.976 1.00 22.24 C ATOM 268 CE1 TYR A 457 12.375 52.220 31.124 1.00 29.58 C ATOM 269 CE2 TYR A 457 13.619 51.409 33.001 1.00 30.88 C ATOM 270 CZ TYR A 457 13.355 52.398 32.064 1.00 32.12 C ATOM 271 OH TYR A 457 14.063 53.576 32.058 1.00 34.66 O ATOM 272 HH TYR A 457 13.735 54.153 31.323 1.00 0.00 H ATOM 273 H TYR A 457 13.736 47.693 31.025 1.00 0.00 H ATOM 274 N GLY A 458 10.456 48.308 28.976 1.00 14.58 N ATOM 275 CA GLY A 458 10.402 48.791 27.604 1.00 12.96 C ATOM 276 C GLY A 458 11.035 47.828 26.619 1.00 13.62 C ATOM 277 O GLY A 458 11.133 46.625 26.883 1.00 12.07 O ATOM 278 H GLY A 458 9.575 48.063 29.471 1.00 0.00 H ATOM 279 N ASN A 459 11.473 48.354 25.479 1.00 11.49 N ATOM 280 CA ASN A 459 12.007 47.521 24.411 1.00 10.77 C ATOM 281 C ASN A 459 13.278 46.781 24.839 1.00 10.82 C ATOM 282 O ASN A 459 13.593 45.726 24.300 1.00 10.66 O ATOM 283 CB ASN A 459 12.317 48.380 23.182 1.00 10.33 C ATOM 284 CG ASN A 459 11.085 49.044 22.605 1.00 15.46 C ATOM 285 OD1 ASN A 459 9.960 48.560 22.774 1.00 13.04 O ATOM 286 ND2 ASN A 459 11.290 50.159 21.911 1.00 11.25 N ATOM 287 HD22 ASN A 459 12.255 50.529 21.795 1.00 0.00 H ATOM 288 HD21 ASN A 459 10.486 50.661 21.484 1.00 0.00 H ATOM 289 H ASN A 459 11.433 49.385 25.347 1.00 0.00 H ATOM 290 N ASP A 460 14.004 47.360 25.791 1.00 11.37 N ATOM 291 CA ASP A 460 15.264 46.803 26.303 1.00 13.04 C ATOM 292 C ASP A 460 15.096 45.400 26.912 1.00 18.66 C ATOM 293 O ASP A 460 16.070 44.655 27.059 1.00 16.36 O ATOM 294 CB ASP A 460 15.836 47.761 27.350 1.00 12.39 C ATOM 295 CG ASP A 460 17.231 47.364 27.831 1.00 23.18 C ATOM 296 OD1 ASP A 460 18.107 47.068 26.992 1.00 18.73 O ATOM 297 OD2 ASP A 460 17.457 47.372 29.056 1.00 24.19 O ATOM 298 H ASP A 460 13.662 48.255 26.195 1.00 0.00 H ATOM 299 N ARG A 461 13.862 45.043 27.261 1.00 12.00 N ATOM 300 CA ARG A 461 13.559 43.717 27.795 1.00 12.28 C ATOM 301 C ARG A 461 13.849 42.600 26.806 1.00 11.67 C ATOM 302 O ARG A 461 14.105 41.469 27.228 1.00 17.34 O ATOM 303 CB ARG A 461 12.079 43.616 28.194 1.00 12.59 C ATOM 304 CG ARG A 461 11.712 44.381 29.461 1.00 13.52 C ATOM 305 CD ARG A 461 10.205 44.375 29.659 1.00 13.86 C ATOM 306 NE ARG A 461 9.527 45.048 28.551 1.00 15.06 N ATOM 307 CZ ARG A 461 8.218 44.973 28.309 1.00 21.29 C ATOM 308 NH1 ARG A 461 7.427 44.249 29.096 1.00 16.34 N ATOM 309 NH2 ARG A 461 7.700 45.620 27.274 1.00 17.07 N ATOM 310 HE ARG A 461 10.106 45.625 27.908 1.00 0.00 H ATOM 311 HH12 ARG A 461 6.407 44.196 28.900 1.00 0.00 H ATOM 312 HH11 ARG A 461 7.829 43.736 29.907 1.00 0.00 H ATOM 313 HH22 ARG A 461 6.679 45.563 27.083 1.00 0.00 H ATOM 314 HH21 ARG A 461 8.314 46.184 26.653 1.00 0.00 H ATOM 315 H ARG A 461 13.089 45.730 27.150 1.00 0.00 H ATOM 316 N PHE A 462 13.820 42.917 25.509 1.00 10.94 N ATOM 317 CA PHE A 462 13.774 41.900 24.446 1.00 10.87 C ATOM 318 C PHE A 462 15.048 41.767 23.614 1.00 15.08 C ATOM 319 O PHE A 462 15.735 42.760 23.334 1.00 16.09 O ATOM 320 CB PHE A 462 12.616 42.203 23.479 1.00 9.98 C ATOM 321 CG PHE A 462 11.284 42.310 24.157 1.00 16.47 C ATOM 322 CD1 PHE A 462 10.598 41.162 24.546 1.00 18.93 C ATOM 323 CD2 PHE A 462 10.723 43.552 24.420 1.00 15.01 C ATOM 324 CE1 PHE A 462 9.365 41.250 25.189 1.00 22.92 C ATOM 325 CE2 PHE A 462 9.487 43.653 25.061 1.00 18.15 C ATOM 326 CZ PHE A 462 8.808 42.500 25.446 1.00 20.66 C ATOM 327 H PHE A 462 13.830 43.921 25.240 1.00 0.00 H ATOM 328 N GLU A 463 15.346 40.537 23.201 1.00 11.39 N ATOM 329 CA GLU A 463 16.431 40.280 22.247 1.00 11.36 C ATOM 330 C GLU A 463 16.087 39.060 21.398 1.00 13.78 C ATOM 331 O GLU A 463 15.154 38.317 21.716 1.00 13.27 O ATOM 332 CB GLU A 463 17.762 40.053 22.966 1.00 12.65 C ATOM 333 CG GLU A 463 17.845 38.742 23.731 1.00 11.95 C ATOM 334 CD GLU A 463 19.226 38.516 24.323 1.00 19.35 C ATOM 335 OE1 GLU A 463 20.113 39.381 24.121 1.00 18.11 O ATOM 336 OE2 GLU A 463 19.425 37.482 24.990 1.00 24.80 O ATOM 337 H GLU A 463 14.794 39.735 23.565 1.00 0.00 H ATOM 338 N GLY A 464 16.835 38.853 20.319 1.00 9.50 N ATOM 339 CA GLY A 464 16.661 37.654 19.518 1.00 9.92 C ATOM 340 C GLY A 464 16.645 37.972 18.035 1.00 10.83 C ATOM 341 O GLY A 464 16.781 39.132 17.639 1.00 10.74 O ATOM 342 H GLY A 464 17.551 39.556 20.046 1.00 0.00 H ATOM 343 N TYR A 465 16.483 36.949 17.208 1.00 10.75 N ATOM 344 CA TYR A 465 16.514 37.156 15.764 1.00 9.01 C ATOM 345 C TYR A 465 15.507 38.217 15.330 1.00 13.98 C ATOM 346 O TYR A 465 15.849 39.119 14.561 1.00 11.12 O ATOM 347 CB TYR A 465 16.257 35.831 15.043 1.00 9.22 C ATOM 348 CG TYR A 465 16.166 35.927 13.539 1.00 10.50 C ATOM 349 CD1 TYR A 465 14.998 36.343 12.921 1.00 11.06 C ATOM 350 CD2 TYR A 465 17.233 35.566 12.736 1.00 10.47 C ATOM 351 CE1 TYR A 465 14.901 36.422 11.549 1.00 15.66 C ATOM 352 CE2 TYR A 465 17.141 35.632 11.356 1.00 11.58 C ATOM 353 CZ TYR A 465 15.975 36.065 10.775 1.00 17.96 C ATOM 354 OH TYR A 465 15.868 36.136 9.413 1.00 22.97 O ATOM 355 HH TYR A 465 16.007 35.236 9.025 1.00 0.00 H ATOM 356 H TYR A 465 16.333 35.994 17.590 1.00 0.00 H ATOM 357 N CYS A 466 14.265 38.113 15.804 1.00 8.53 N ATOM 358 CA CYS A 466 13.229 39.059 15.355 1.00 9.76 C ATOM 359 C CYS A 466 13.435 40.485 15.855 1.00 9.76 C ATOM 360 O CYS A 466 13.004 41.442 15.204 1.00 10.78 O ATOM 361 CB CYS A 466 11.831 38.565 15.734 1.00 12.65 C ATOM 362 SG CYS A 466 11.266 37.246 14.657 1.00 31.25 S ATOM 363 H CYS A 466 14.029 37.366 16.488 1.00 0.00 H ATOM 364 N ILE A 467 14.090 40.628 17.001 1.00 14.42 N ATOM 365 CA ILE A 467 14.401 41.948 17.534 1.00 10.83 C ATOM 366 C ILE A 467 15.532 42.589 16.720 1.00 11.76 C ATOM 367 O ILE A 467 15.527 43.804 16.460 1.00 8.79 O ATOM 368 CB ILE A 467 14.792 41.873 19.018 1.00 12.02 C ATOM 369 CG1 ILE A 467 13.709 41.128 19.809 1.00 10.33 C ATOM 370 CG2 ILE A 467 14.994 43.270 19.580 1.00 14.23 C ATOM 371 CD1 ILE A 467 12.318 41.727 19.633 1.00 14.42 C ATOM 372 H ILE A 467 14.387 39.782 17.528 1.00 0.00 H ATOM 373 N ASP A 468 16.507 41.779 16.315 1.00 9.08 N ATOM 374 CA ASP A 468 17.537 42.279 15.411 1.00 12.39 C ATOM 375 C ASP A 468 16.947 42.712 14.079 1.00 13.11 C ATOM 376 O ASP A 468 17.344 43.741 13.519 1.00 8.59 O ATOM 377 CB ASP A 468 18.618 41.219 15.171 1.00 13.22 C ATOM 378 CG ASP A 468 19.625 41.153 16.299 1.00 15.53 C ATOM 379 OD1 ASP A 468 19.384 41.792 17.348 1.00 11.92 O ATOM 380 OD2 ASP A 468 20.650 40.459 16.132 1.00 14.56 O ATOM 381 H ASP A 468 16.535 40.792 16.642 1.00 0.00 H ATOM 382 N LEU A 469 16.011 41.928 13.551 1.00 8.39 N ATOM 383 CA LEU A 469 15.368 42.315 12.294 1.00 11.21 C ATOM 384 C LEU A 469 14.576 43.606 12.462 1.00 10.75 C ATOM 385 O LEU A 469 14.666 44.509 11.624 1.00 8.44 O ATOM 386 CB LEU A 469 14.447 41.200 11.793 1.00 10.71 C ATOM 387 CG LEU A 469 13.658 41.485 10.513 1.00 12.90 C ATOM 388 CD1 LEU A 469 14.593 41.772 9.355 1.00 9.89 C ATOM 389 CD2 LEU A 469 12.771 40.300 10.197 1.00 15.16 C ATOM 390 H LEU A 469 15.738 41.045 14.028 1.00 0.00 H ATOM 391 N LEU A 470 13.797 43.700 13.536 1.00 8.16 N ATOM 392 CA LEU A 470 13.038 44.924 13.796 1.00 9.59 C ATOM 393 C LEU A 470 13.964 46.147 13.909 1.00 9.05 C ATOM 394 O LEU A 470 13.693 47.205 13.310 1.00 9.72 O ATOM 395 CB LEU A 470 12.198 44.760 15.063 1.00 10.88 C ATOM 396 CG LEU A 470 11.424 45.988 15.538 1.00 8.33 C ATOM 397 CD1 LEU A 470 10.386 46.434 14.515 1.00 8.47 C ATOM 398 CD2 LEU A 470 10.783 45.679 16.869 1.00 11.74 C ATOM 399 H LEU A 470 13.727 42.899 14.195 1.00 0.00 H ATOM 400 N LYS A 471 15.067 46.009 14.642 1.00 8.33 N ATOM 401 CA LYS A 471 16.025 47.125 14.751 1.00 9.63 C ATOM 402 C LYS A 471 16.577 47.543 13.401 1.00 8.71 C ATOM 403 O LYS A 471 16.689 48.736 13.109 1.00 11.62 O ATOM 404 CB LYS A 471 17.177 46.789 15.699 1.00 8.68 C ATOM 405 CG LYS A 471 16.761 46.768 17.158 1.00 15.50 C ATOM 406 CD LYS A 471 17.790 46.041 18.012 1.00 18.80 C ATOM 407 CE LYS A 471 19.074 46.812 18.109 1.00 26.02 C ATOM 408 NZ LYS A 471 19.999 46.143 19.079 1.00 34.56 N ATOM 409 HZ1 LYS A 471 19.549 46.106 20.016 1.00 0.00 H ATOM 410 HZ2 LYS A 471 20.202 45.177 18.752 1.00 0.00 H ATOM 411 HZ3 LYS A 471 20.885 46.683 19.140 1.00 0.00 H ATOM 412 H LYS A 471 15.253 45.114 15.138 1.00 0.00 H ATOM 413 N GLU A 472 16.927 46.567 12.572 1.00 8.74 N ATOM 414 CA GLU A 472 17.443 46.871 11.238 1.00 10.57 C ATOM 415 C GLU A 472 16.406 47.600 10.362 1.00 9.15 C ATOM 416 O GLU A 472 16.726 48.579 9.683 1.00 9.65 O ATOM 417 CB GLU A 472 17.925 45.577 10.573 1.00 17.90 C ATOM 418 CG GLU A 472 18.904 45.797 9.458 1.00 29.47 C ATOM 419 CD GLU A 472 20.077 46.675 9.878 1.00 34.95 C ATOM 420 OE1 GLU A 472 20.645 46.444 10.971 1.00 34.26 O ATOM 421 OE2 GLU A 472 20.413 47.606 9.114 1.00 36.33 O ATOM 422 H GLU A 472 16.833 45.576 12.874 1.00 0.00 H ATOM 423 N LEU A 473 15.161 47.132 10.381 1.00 9.63 N ATOM 424 CA LEU A 473 14.082 47.785 9.626 1.00 9.85 C ATOM 425 C LEU A 473 13.806 49.196 10.146 1.00 9.23 C ATOM 426 O LEU A 473 13.571 50.131 9.372 1.00 10.66 O ATOM 427 CB LEU A 473 12.808 46.949 9.714 1.00 9.96 C ATOM 428 CG LEU A 473 12.893 45.561 9.095 1.00 12.65 C ATOM 429 CD1 LEU A 473 11.631 44.782 9.415 1.00 11.44 C ATOM 430 CD2 LEU A 473 13.096 45.670 7.599 1.00 9.46 C ATOM 431 H LEU A 473 14.946 46.284 10.943 1.00 0.00 H ATOM 432 N ALA A 474 13.839 49.341 11.466 1.00 9.00 N ATOM 433 CA ALA A 474 13.610 50.634 12.112 1.00 11.44 C ATOM 434 C ALA A 474 14.688 51.641 11.709 1.00 11.59 C ATOM 435 O ALA A 474 14.397 52.805 11.475 1.00 10.57 O ATOM 436 CB ALA A 474 13.586 50.460 13.632 1.00 9.66 C ATOM 437 H ALA A 474 14.034 48.509 12.059 1.00 0.00 H ATOM 438 N HIS A 475 15.935 51.181 11.649 1.00 9.49 N ATOM 439 CA HIS A 475 17.072 51.983 11.188 1.00 9.92 C ATOM 440 C HIS A 475 16.920 52.391 9.712 1.00 12.92 C ATOM 441 O HIS A 475 16.972 53.583 9.358 1.00 10.77 O ATOM 442 CB HIS A 475 18.354 51.166 11.394 1.00 9.91 C ATOM 443 CG HIS A 475 19.591 51.791 10.820 1.00 10.46 C ATOM 444 ND1 HIS A 475 20.190 52.904 11.370 1.00 10.80 N ATOM 445 CD2 HIS A 475 20.367 51.426 9.770 1.00 10.85 C ATOM 446 CE1 HIS A 475 21.268 53.213 10.667 1.00 11.36 C ATOM 447 NE2 HIS A 475 21.398 52.329 9.692 1.00 11.42 N ATOM 448 H HIS A 475 16.113 50.200 11.945 1.00 0.00 H ATOM 449 N ILE A 476 16.721 51.398 8.855 1.00 10.28 N ATOM 450 CA ILE A 476 16.567 51.630 7.419 1.00 10.80 C ATOM 451 C ILE A 476 15.405 52.557 7.076 1.00 11.05 C ATOM 452 O ILE A 476 15.543 53.445 6.245 1.00 11.66 O ATOM 453 CB ILE A 476 16.380 50.298 6.659 1.00 10.76 C ATOM 454 CG1 ILE A 476 17.630 49.429 6.794 1.00 13.42 C ATOM 455 CG2 ILE A 476 16.013 50.550 5.179 1.00 11.89 C ATOM 456 CD1 ILE A 476 17.432 47.974 6.351 1.00 13.59 C ATOM 457 H ILE A 476 16.673 50.424 9.216 1.00 0.00 H ATOM 458 N LEU A 477 14.266 52.351 7.728 1.00 10.68 N ATOM 459 CA LEU A 477 13.035 53.055 7.375 1.00 15.20 C ATOM 460 C LEU A 477 12.775 54.262 8.278 1.00 15.96 C ATOM 461 O LEU A 477 11.864 55.051 8.028 1.00 14.46 O ATOM 462 CB LEU A 477 11.850 52.089 7.423 1.00 12.84 C ATOM 463 CG LEU A 477 11.927 50.939 6.404 1.00 17.09 C ATOM 464 CD1 LEU A 477 10.785 49.936 6.620 1.00 17.23 C ATOM 465 CD2 LEU A 477 11.894 51.492 4.990 1.00 20.04 C ATOM 466 H LEU A 477 14.250 51.669 8.513 1.00 0.00 H ATOM 467 N GLY A 478 13.577 54.403 9.328 1.00 10.83 N ATOM 468 CA GLY A 478 13.456 55.547 10.218 1.00 11.03 C ATOM 469 C GLY A 478 12.151 55.623 10.989 1.00 12.85 C ATOM 470 O GLY A 478 11.471 56.655 10.948 1.00 12.53 O ATOM 471 H GLY A 478 14.304 53.683 9.517 1.00 0.00 H ATOM 472 N PHE A 479 11.797 54.543 11.688 1.00 10.49 N ATOM 473 CA PHE A 479 10.646 54.574 12.589 1.00 10.54 C ATOM 474 C PHE A 479 11.037 54.069 13.977 1.00 10.44 C ATOM 475 O PHE A 479 12.081 53.423 14.146 1.00 11.45 O ATOM 476 CB PHE A 479 9.433 53.806 12.018 1.00 10.54 C ATOM 477 CG PHE A 479 9.618 52.306 11.944 1.00 10.02 C ATOM 478 CD1 PHE A 479 9.438 51.505 13.068 1.00 9.71 C ATOM 479 CD2 PHE A 479 9.940 51.696 10.738 1.00 15.57 C ATOM 480 CE1 PHE A 479 9.607 50.116 12.996 1.00 10.85 C ATOM 481 CE2 PHE A 479 10.100 50.309 10.652 1.00 11.79 C ATOM 482 CZ PHE A 479 9.931 49.520 11.780 1.00 9.26 C ATOM 483 H PHE A 479 12.348 53.666 11.590 1.00 0.00 H ATOM 484 N SER A 480 10.219 54.404 14.971 1.00 10.44 N ATOM 485 CA SER A 480 10.405 53.907 16.325 1.00 10.58 C ATOM 486 C SER A 480 9.199 53.055 16.688 1.00 11.14 C ATOM 487 O SER A 480 8.181 53.049 15.975 1.00 10.46 O ATOM 488 CB SER A 480 10.577 55.054 17.321 1.00 12.56 C ATOM 489 OG SER A 480 9.529 56.014 17.212 1.00 11.37 O ATOM 490 HG SER A 480 8.660 55.574 17.391 1.00 0.00 H ATOM 491 H SER A 480 9.421 55.041 14.774 1.00 0.00 H ATOM 492 N TYR A 481 9.304 52.322 17.786 1.00 10.45 N ATOM 493 CA TYR A 481 8.283 51.329 18.077 1.00 14.89 C ATOM 494 C TYR A 481 8.204 51.047 19.564 1.00 12.87 C ATOM 495 O TYR A 481 9.141 51.340 20.307 1.00 10.84 O ATOM 496 CB TYR A 481 8.602 50.036 17.317 1.00 13.21 C ATOM 497 CG TYR A 481 10.040 49.604 17.497 1.00 14.21 C ATOM 498 CD1 TYR A 481 10.451 48.957 18.659 1.00 12.61 C ATOM 499 CD2 TYR A 481 10.991 49.861 16.519 1.00 10.12 C ATOM 500 CE1 TYR A 481 11.769 48.572 18.842 1.00 11.48 C ATOM 501 CE2 TYR A 481 12.311 49.484 16.695 1.00 12.16 C ATOM 502 CZ TYR A 481 12.688 48.833 17.851 1.00 12.24 C ATOM 503 OH TYR A 481 13.997 48.457 18.037 1.00 10.72 O ATOM 504 HH TYR A 481 14.576 49.260 18.016 1.00 0.00 H ATOM 505 H TYR A 481 10.108 52.455 18.433 1.00 0.00 H ATOM 506 N GLU A 482 7.087 50.468 19.989 1.00 14.83 N ATOM 507 CA GLU A 482 6.957 49.940 21.342 1.00 11.01 C ATOM 508 C GLU A 482 6.519 48.486 21.245 1.00 14.58 C ATOM 509 O GLU A 482 5.454 48.188 20.707 1.00 11.36 O ATOM 510 CB GLU A 482 5.947 50.759 22.151 1.00 15.84 C ATOM 511 CG GLU A 482 6.409 52.191 22.431 1.00 29.73 C ATOM 512 CD GLU A 482 7.681 52.257 23.275 1.00 42.61 C ATOM 513 OE1 GLU A 482 7.871 51.370 24.141 1.00 48.56 O ATOM 514 OE2 GLU A 482 8.493 53.193 23.070 1.00 43.09 O ATOM 515 H GLU A 482 6.281 50.389 19.337 1.00 0.00 H ATOM 516 N ILE A 483 7.352 47.581 21.748 1.00 12.99 N ATOM 517 CA ILE A 483 7.063 46.148 21.699 1.00 12.47 C ATOM 518 C ILE A 483 6.116 45.748 22.837 1.00 17.50 C ATOM 519 O ILE A 483 6.323 46.137 23.988 1.00 14.29 O ATOM 520 CB ILE A 483 8.380 45.330 21.790 1.00 13.70 C ATOM 521 CG1 ILE A 483 9.294 45.664 20.603 1.00 11.46 C ATOM 522 CG2 ILE A 483 8.085 43.837 21.838 1.00 9.95 C ATOM 523 CD1 ILE A 483 10.748 45.229 20.773 1.00 12.91 C ATOM 524 H ILE A 483 8.237 47.902 22.190 1.00 0.00 H ATOM 525 N ARG A 484 5.074 44.979 22.507 1.00 12.76 N ATOM 526 CA ARG A 484 4.153 44.451 23.505 1.00 17.41 C ATOM 527 C ARG A 484 3.918 42.968 23.258 1.00 19.74 C ATOM 528 O ARG A 484 3.772 42.545 22.113 1.00 16.97 O ATOM 529 CB ARG A 484 2.811 45.185 23.439 1.00 24.20 C ATOM 530 CG ARG A 484 2.899 46.679 23.703 1.00 33.72 C ATOM 531 CD ARG A 484 1.535 47.361 23.631 1.00 38.78 C ATOM 532 NE ARG A 484 1.663 48.803 23.842 1.00 43.94 N ATOM 533 CZ ARG A 484 0.709 49.691 23.581 1.00 39.95 C ATOM 534 NH1 ARG A 484 -0.457 49.292 23.094 1.00 36.92 N ATOM 535 NH2 ARG A 484 0.926 50.981 23.809 1.00 42.05 N ATOM 536 HE ARG A 484 2.563 49.158 24.223 1.00 0.00 H ATOM 537 HH12 ARG A 484 -1.202 49.989 22.891 1.00 0.00 H ATOM 538 HH11 ARG A 484 -0.628 48.282 22.915 1.00 0.00 H ATOM 539 HH22 ARG A 484 0.181 51.678 23.606 1.00 0.00 H ATOM 540 HH21 ARG A 484 1.841 51.295 24.191 1.00 0.00 H ATOM 541 H ARG A 484 4.915 44.750 21.505 1.00 0.00 H ATOM 542 N LEU A 485 3.881 42.183 24.329 1.00 18.56 N ATOM 543 CA LEU A 485 3.576 40.761 24.221 1.00 19.22 C ATOM 544 C LEU A 485 2.072 40.562 24.035 1.00 20.30 C ATOM 545 O LEU A 485 1.274 41.179 24.736 1.00 15.93 O ATOM 546 CB LEU A 485 4.048 40.026 25.480 1.00 19.95 C ATOM 547 CG LEU A 485 5.571 39.966 25.634 1.00 18.17 C ATOM 548 CD1 LEU A 485 5.963 39.335 26.951 1.00 23.74 C ATOM 549 CD2 LEU A 485 6.156 39.179 24.479 1.00 14.03 C ATOM 550 H LEU A 485 4.074 42.592 25.266 1.00 0.00 H ATOM 551 N VAL A 486 1.676 39.708 23.094 1.00 18.51 N ATOM 552 CA VAL A 486 0.243 39.436 22.907 1.00 17.58 C ATOM 553 C VAL A 486 -0.312 38.737 24.149 1.00 21.22 C ATOM 554 O VAL A 486 0.255 37.754 24.621 1.00 20.54 O ATOM 555 CB VAL A 486 -0.036 38.612 21.634 1.00 18.37 C ATOM 556 CG1 VAL A 486 0.774 37.336 21.627 1.00 21.19 C ATOM 557 CG2 VAL A 486 -1.520 38.282 21.517 1.00 17.30 C ATOM 558 H VAL A 486 2.379 39.234 22.492 1.00 0.00 H ATOM 559 N GLU A 487 -1.413 39.250 24.687 1.00 25.36 N ATOM 560 CA GLU A 487 -1.936 38.741 25.955 1.00 31.84 C ATOM 561 C GLU A 487 -2.204 37.237 25.977 1.00 28.40 C ATOM 562 O GLU A 487 -1.811 36.562 26.925 1.00 25.78 O ATOM 563 CB GLU A 487 -3.197 39.493 26.379 1.00 37.66 C ATOM 564 CG GLU A 487 -2.967 40.935 26.793 1.00 46.67 C ATOM 565 CD GLU A 487 -4.172 41.522 27.512 1.00 58.17 C ATOM 566 OE1 GLU A 487 -5.006 40.735 28.018 1.00 60.73 O ATOM 567 OE2 GLU A 487 -4.284 42.767 27.571 1.00 62.11 O ATOM 568 H GLU A 487 -1.910 40.023 24.200 1.00 0.00 H ATOM 569 N ASP A 488 -2.854 36.701 24.945 1.00 21.46 N ATOM 570 CA ASP A 488 -3.237 35.287 24.996 1.00 19.00 C ATOM 571 C ASP A 488 -2.107 34.328 24.623 1.00 20.53 C ATOM 572 O ASP A 488 -2.280 33.119 24.696 1.00 23.04 O ATOM 573 CB ASP A 488 -4.523 34.998 24.194 1.00 23.57 C ATOM 574 CG ASP A 488 -4.348 35.160 22.690 1.00 23.25 C ATOM 575 OD1 ASP A 488 -3.232 35.473 22.228 1.00 23.30 O ATOM 576 OD2 ASP A 488 -5.346 34.953 21.960 1.00 23.86 O ATOM 577 H ASP A 488 -3.087 37.279 24.113 1.00 0.00 H ATOM 578 N GLY A 489 -0.959 34.870 24.222 1.00 18.32 N ATOM 579 CA GLY A 489 0.196 34.051 23.901 1.00 18.00 C ATOM 580 C GLY A 489 0.059 33.159 22.675 1.00 22.61 C ATOM 581 O GLY A 489 0.822 32.193 22.522 1.00 23.49 O ATOM 582 H GLY A 489 -0.888 35.904 24.137 1.00 0.00 H ATOM 583 N LYS A 490 -0.894 33.482 21.797 1.00 22.81 N ATOM 584 CA LYS A 490 -1.179 32.664 20.616 1.00 18.85 C ATOM 585 C LYS A 490 -0.747 33.334 19.311 1.00 18.01 C ATOM 586 O LYS A 490 -0.688 34.560 19.216 1.00 13.21 O ATOM 587 CB LYS A 490 -2.675 32.346 20.532 1.00 19.56 C ATOM 588 CG LYS A 490 -3.206 31.423 21.621 1.00 22.32 C ATOM 589 CD LYS A 490 -4.723 31.325 21.543 1.00 25.09 C ATOM 590 CE LYS A 490 -5.281 30.377 22.598 1.00 29.13 C ATOM 591 NZ LYS A 490 -4.846 28.968 22.373 1.00 28.61 N ATOM 592 HZ1 LYS A 490 -5.179 28.648 21.441 1.00 0.00 H ATOM 593 HZ2 LYS A 490 -3.808 28.917 22.408 1.00 0.00 H ATOM 594 HZ3 LYS A 490 -5.249 28.360 23.114 1.00 0.00 H ATOM 595 H LYS A 490 -1.453 34.344 21.957 1.00 0.00 H ATOM 596 N TYR A 491 -0.460 32.522 18.296 1.00 17.31 N ATOM 597 CA TYR A 491 -0.105 33.062 16.988 1.00 16.06 C ATOM 598 C TYR A 491 -1.373 33.520 16.277 1.00 16.99 C ATOM 599 O TYR A 491 -1.489 34.686 15.901 1.00 17.29 O ATOM 600 CB TYR A 491 0.675 32.036 16.163 1.00 14.88 C ATOM 601 CG TYR A 491 2.100 31.900 16.646 1.00 17.09 C ATOM 602 CD1 TYR A 491 2.418 31.027 17.680 1.00 19.92 C ATOM 603 CD2 TYR A 491 3.123 32.672 16.097 1.00 15.80 C ATOM 604 CE1 TYR A 491 3.715 30.906 18.145 1.00 18.89 C ATOM 605 CE2 TYR A 491 4.426 32.560 16.558 1.00 20.21 C ATOM 606 CZ TYR A 491 4.710 31.674 17.585 1.00 21.64 C ATOM 607 OH TYR A 491 5.992 31.543 18.057 1.00 23.52 O ATOM 608 HH TYR A 491 6.008 30.871 18.784 1.00 0.00 H ATOM 609 H TYR A 491 -0.489 31.492 18.437 1.00 0.00 H ATOM 610 N GLY A 492 -2.327 32.609 16.106 1.00 14.00 N ATOM 611 CA GLY A 492 -3.635 32.994 15.607 1.00 16.37 C ATOM 612 C GLY A 492 -4.314 31.964 14.722 1.00 15.36 C ATOM 613 O GLY A 492 -3.745 31.501 13.740 1.00 18.78 O ATOM 614 H GLY A 492 -2.134 31.612 16.332 1.00 0.00 H ATOM 615 N ALA A 493 -5.538 31.599 15.079 1.00 16.36 N ATOM 616 CA ALA A 493 -6.338 30.709 14.255 1.00 17.16 C ATOM 617 C ALA A 493 -7.801 31.060 14.448 1.00 21.32 C ATOM 618 O ALA A 493 -8.133 31.875 15.315 1.00 19.99 O ATOM 619 CB ALA A 493 -6.084 29.246 14.621 1.00 18.53 C ATOM 620 H ALA A 493 -5.935 31.959 15.970 1.00 0.00 H ATOM 621 N GLN A 494 -8.665 30.440 13.644 1.00 19.17 N ATOM 622 CA GLN A 494 -10.098 30.696 13.694 1.00 31.68 C ATOM 623 C GLN A 494 -10.840 29.674 14.530 1.00 33.09 C ATOM 624 O GLN A 494 -10.525 28.480 14.498 1.00 30.87 O ATOM 625 CB GLN A 494 -10.690 30.670 12.289 1.00 35.00 C ATOM 626 CG GLN A 494 -10.483 31.940 11.524 1.00 31.12 C ATOM 627 CD GLN A 494 -10.949 31.835 10.095 1.00 33.50 C ATOM 628 OE1 GLN A 494 -10.364 31.104 9.293 1.00 37.14 O ATOM 629 NE2 GLN A 494 -12.004 32.567 9.765 1.00 29.69 N ATOM 630 HE22 GLN A 494 -12.463 33.169 10.478 1.00 0.00 H ATOM 631 HE21 GLN A 494 -12.372 32.540 8.793 1.00 0.00 H ATOM 632 H GLN A 494 -8.303 29.749 12.956 1.00 0.00 H ATOM 633 N ASP A 495 -11.831 30.143 15.280 1.00 32.96 N ATOM 634 CA ASP A 495 -12.728 29.225 15.963 1.00 36.21 C ATOM 635 C ASP A 495 -13.857 28.861 15.008 1.00 40.42 C ATOM 636 O ASP A 495 -13.879 29.334 13.870 1.00 37.96 O ATOM 637 CB ASP A 495 -13.256 29.814 17.281 1.00 38.04 C ATOM 638 CG ASP A 495 -14.094 31.079 17.089 1.00 41.01 C ATOM 639 OD1 ASP A 495 -14.635 31.312 15.987 1.00 40.98 O ATOM 640 OD2 ASP A 495 -14.224 31.847 18.070 1.00 43.17 O ATOM 641 H ASP A 495 -11.966 31.170 15.379 1.00 0.00 H ATOM 642 N ASP A 496 -14.798 28.045 15.470 1.00 46.59 N ATOM 643 CA ASP A 496 -15.904 27.614 14.620 1.00 51.14 C ATOM 644 C ASP A 496 -16.814 28.771 14.194 1.00 47.35 C ATOM 645 O ASP A 496 -17.496 28.678 13.182 1.00 49.75 O ATOM 646 CB ASP A 496 -16.702 26.502 15.302 1.00 60.34 C ATOM 647 CG ASP A 496 -15.849 25.287 15.617 1.00 69.04 C ATOM 648 OD1 ASP A 496 -14.827 25.086 14.923 1.00 72.67 O ATOM 649 OD2 ASP A 496 -16.197 24.537 16.557 1.00 70.16 O ATOM 650 H ASP A 496 -14.746 27.708 16.452 1.00 0.00 H ATOM 651 N LYS A 497 -16.806 29.859 14.961 1.00 47.33 N ATOM 652 CA LYS A 497 -17.552 31.068 14.607 1.00 47.41 C ATOM 653 C LYS A 497 -16.800 31.938 13.603 1.00 50.30 C ATOM 654 O LYS A 497 -17.308 32.972 13.166 1.00 52.63 O ATOM 655 CB LYS A 497 -17.843 31.905 15.854 1.00 49.37 C ATOM 656 CG LYS A 497 -19.252 31.749 16.414 1.00 52.77 C ATOM 657 CD LYS A 497 -19.466 30.374 17.015 1.00 54.43 C ATOM 658 CE LYS A 497 -20.818 30.285 17.704 1.00 57.16 C ATOM 659 NZ LYS A 497 -20.991 28.983 18.403 1.00 58.86 N ATOM 660 HZ1 LYS A 497 -20.922 28.208 17.713 1.00 0.00 H ATOM 661 HZ2 LYS A 497 -20.247 28.875 19.122 1.00 0.00 H ATOM 662 HZ3 LYS A 497 -21.924 28.958 18.861 1.00 0.00 H ATOM 663 H LYS A 497 -16.251 29.850 15.841 1.00 0.00 H ATOM 664 N GLY A 498 -15.584 31.530 13.255 1.00 46.84 N ATOM 665 CA GLY A 498 -14.776 32.280 12.310 1.00 43.44 C ATOM 666 C GLY A 498 -13.930 33.371 12.943 1.00 38.34 C ATOM 667 O GLY A 498 -13.143 34.027 12.253 1.00 36.78 O ATOM 668 H GLY A 498 -15.203 30.655 13.668 1.00 0.00 H ATOM 669 N GLN A 499 -14.088 33.565 14.252 1.00 33.78 N ATOM 670 CA GLN A 499 -13.335 34.587 14.988 1.00 34.67 C ATOM 671 C GLN A 499 -11.870 34.203 15.204 1.00 23.86 C ATOM 672 O GLN A 499 -11.561 33.047 15.496 1.00 23.10 O ATOM 673 CB GLN A 499 -13.996 34.867 16.340 1.00 44.34 C ATOM 674 CG GLN A 499 -15.323 35.611 16.243 1.00 53.11 C ATOM 675 CD GLN A 499 -15.138 37.087 15.944 1.00 56.64 C ATOM 676 OE1 GLN A 499 -14.544 37.820 16.735 1.00 56.47 O ATOM 677 NE2 GLN A 499 -15.641 37.528 14.795 1.00 57.24 N ATOM 678 HE22 GLN A 499 -16.135 36.871 14.158 1.00 0.00 H ATOM 679 HE21 GLN A 499 -15.540 38.530 14.534 1.00 0.00 H ATOM 680 H GLN A 499 -14.768 32.972 14.769 1.00 0.00 H ATOM 681 N TRP A 500 -10.979 35.182 15.069 1.00 21.00 N ATOM 682 CA TRP A 500 -9.544 34.961 15.231 1.00 19.23 C ATOM 683 C TRP A 500 -9.083 35.245 16.648 1.00 26.41 C ATOM 684 O TRP A 500 -9.719 35.996 17.378 1.00 19.59 O ATOM 685 CB TRP A 500 -8.756 35.869 14.284 1.00 22.29 C ATOM 686 CG TRP A 500 -8.938 35.513 12.849 1.00 19.56 C ATOM 687 CD1 TRP A 500 -9.905 35.969 12.006 1.00 19.48 C ATOM 688 CD2 TRP A 500 -8.129 34.609 12.089 1.00 17.96 C ATOM 689 NE1 TRP A 500 -9.747 35.402 10.763 1.00 19.96 N ATOM 690 CE2 TRP A 500 -8.661 34.565 10.789 1.00 18.58 C ATOM 691 CE3 TRP A 500 -7.008 33.830 12.387 1.00 23.69 C ATOM 692 CZ2 TRP A 500 -8.107 33.770 9.783 1.00 23.44 C ATOM 693 CZ3 TRP A 500 -6.456 33.048 11.390 1.00 20.93 C ATOM 694 CH2 TRP A 500 -7.004 33.022 10.106 1.00 20.40 C ATOM 695 HE1 TRP A 500 -10.353 35.579 9.937 1.00 0.00 H ATOM 696 H TRP A 500 -11.316 36.139 14.840 1.00 0.00 H ATOM 697 N ASN A 501 -7.949 34.666 17.025 1.00 18.02 N ATOM 698 CA ASN A 501 -7.320 35.005 18.288 1.00 17.67 C ATOM 699 C ASN A 501 -5.841 35.278 18.054 1.00 24.25 C ATOM 700 O ASN A 501 -5.386 35.291 16.908 1.00 20.10 O ATOM 701 CB ASN A 501 -7.536 33.886 19.313 1.00 22.59 C ATOM 702 CG ASN A 501 -7.019 32.537 18.831 1.00 25.28 C ATOM 703 OD1 ASN A 501 -6.189 32.462 17.923 1.00 19.92 O ATOM 704 ND2 ASN A 501 -7.505 31.462 19.448 1.00 26.73 N ATOM 705 HD22 ASN A 501 -8.205 31.571 20.210 1.00 0.00 H ATOM 706 HD21 ASN A 501 -7.185 30.513 19.168 1.00 0.00 H ATOM 707 H ASN A 501 -7.505 33.959 16.405 1.00 0.00 H ATOM 708 N GLY A 502 -5.089 35.506 19.125 1.00 15.99 N ATOM 709 CA GLY A 502 -3.647 35.642 19.015 1.00 14.88 C ATOM 710 C GLY A 502 -3.159 36.943 18.403 1.00 17.68 C ATOM 711 O GLY A 502 -3.852 37.956 18.434 1.00 14.68 O ATOM 712 H GLY A 502 -5.540 35.589 20.058 1.00 0.00 H ATOM 713 N MET A 503 -1.946 36.923 17.858 1.00 13.34 N ATOM 714 CA MET A 503 -1.407 38.104 17.192 1.00 13.25 C ATOM 715 C MET A 503 -2.248 38.491 15.977 1.00 14.40 C ATOM 716 O MET A 503 -2.361 39.674 15.648 1.00 13.32 O ATOM 717 CB MET A 503 0.045 37.874 16.771 1.00 12.95 C ATOM 718 CG MET A 503 1.042 37.988 17.918 1.00 16.16 C ATOM 719 SD MET A 503 2.714 37.677 17.322 1.00 20.42 S ATOM 720 CE MET A 503 2.633 35.909 17.035 1.00 19.64 C ATOM 721 H MET A 503 -1.375 36.055 17.907 1.00 0.00 H ATOM 722 N VAL A 504 -2.850 37.503 15.317 1.00 15.39 N ATOM 723 CA VAL A 504 -3.664 37.795 14.136 1.00 15.86 C ATOM 724 C VAL A 504 -4.799 38.729 14.528 1.00 18.84 C ATOM 725 O VAL A 504 -5.034 39.747 13.868 1.00 17.93 O ATOM 726 CB VAL A 504 -4.228 36.521 13.471 1.00 14.54 C ATOM 727 CG1 VAL A 504 -5.220 36.873 12.361 1.00 15.30 C ATOM 728 CG2 VAL A 504 -3.101 35.677 12.908 1.00 13.91 C ATOM 729 H VAL A 504 -2.741 36.521 15.642 1.00 0.00 H ATOM 730 N LYS A 505 -5.481 38.390 15.620 1.00 15.46 N ATOM 731 CA LYS A 505 -6.588 39.203 16.131 1.00 16.41 C ATOM 732 C LYS A 505 -6.135 40.605 16.530 1.00 16.45 C ATOM 733 O LYS A 505 -6.854 41.579 16.303 1.00 18.03 O ATOM 734 CB LYS A 505 -7.234 38.505 17.326 1.00 17.28 C ATOM 735 CG LYS A 505 -8.358 39.287 17.993 1.00 18.99 C ATOM 736 CD LYS A 505 -9.521 39.512 17.041 1.00 25.48 C ATOM 737 CE LYS A 505 -10.781 39.942 17.792 1.00 27.55 C ATOM 738 NZ LYS A 505 -11.758 40.562 16.859 1.00 28.80 N ATOM 739 HZ1 LYS A 505 -11.328 41.398 16.414 1.00 0.00 H ATOM 740 HZ2 LYS A 505 -12.020 39.873 16.125 1.00 0.00 H ATOM 741 HZ3 LYS A 505 -12.607 40.848 17.387 1.00 0.00 H ATOM 742 H LYS A 505 -5.220 37.520 16.127 1.00 0.00 H ATOM 743 N GLU A 506 -4.944 40.705 17.123 1.00 19.95 N ATOM 744 CA GLU A 506 -4.388 42.002 17.504 1.00 20.42 C ATOM 745 C GLU A 506 -4.299 42.918 16.293 1.00 18.83 C ATOM 746 O GLU A 506 -4.630 44.097 16.379 1.00 15.16 O ATOM 747 CB GLU A 506 -2.984 41.849 18.106 1.00 23.10 C ATOM 748 CG GLU A 506 -2.940 41.373 19.547 1.00 33.06 C ATOM 749 CD GLU A 506 -3.651 42.317 20.493 1.00 43.19 C ATOM 750 OE1 GLU A 506 -3.015 43.280 20.974 1.00 47.16 O ATOM 751 OE2 GLU A 506 -4.852 42.097 20.754 1.00 45.35 O ATOM 752 H GLU A 506 -4.399 39.841 17.318 1.00 0.00 H ATOM 753 N LEU A 507 -3.839 42.367 15.172 1.00 14.82 N ATOM 754 CA LEU A 507 -3.728 43.123 13.923 1.00 15.36 C ATOM 755 C LEU A 507 -5.111 43.461 13.356 1.00 19.93 C ATOM 756 O LEU A 507 -5.345 44.587 12.926 1.00 20.60 O ATOM 757 CB LEU A 507 -2.915 42.329 12.888 1.00 13.58 C ATOM 758 CG LEU A 507 -1.451 42.040 13.227 1.00 14.16 C ATOM 759 CD1 LEU A 507 -0.827 41.098 12.208 1.00 12.22 C ATOM 760 CD2 LEU A 507 -0.662 43.327 13.278 1.00 13.58 C ATOM 761 H LEU A 507 -3.549 41.368 15.184 1.00 0.00 H ATOM 762 N ILE A 508 -6.021 42.486 13.344 1.00 15.96 N ATOM 763 CA ILE A 508 -7.398 42.736 12.891 1.00 18.83 C ATOM 764 C ILE A 508 -8.049 43.902 13.635 1.00 20.34 C ATOM 765 O ILE A 508 -8.694 44.760 13.016 1.00 20.52 O ATOM 766 CB ILE A 508 -8.286 41.497 13.069 1.00 20.50 C ATOM 767 CG1 ILE A 508 -7.867 40.387 12.103 1.00 20.82 C ATOM 768 CG2 ILE A 508 -9.767 41.839 12.840 1.00 27.87 C ATOM 769 CD1 ILE A 508 -8.578 39.072 12.366 1.00 22.74 C ATOM 770 H ILE A 508 -5.752 41.532 13.660 1.00 0.00 H ATOM 771 N ASP A 509 -7.880 43.938 14.957 1.00 20.26 N ATOM 772 CA ASP A 509 -8.496 44.986 15.776 1.00 24.56 C ATOM 773 C ASP A 509 -7.691 46.280 15.721 1.00 24.41 C ATOM 774 O ASP A 509 -8.079 47.270 16.335 1.00 20.12 O ATOM 775 CB ASP A 509 -8.593 44.560 17.245 1.00 29.17 C ATOM 776 CG ASP A 509 -9.501 43.364 17.464 1.00 32.59 C ATOM 777 OD1 ASP A 509 -10.340 43.067 16.590 1.00 30.47 O ATOM 778 OD2 ASP A 509 -9.369 42.724 18.531 1.00 36.88 O ATOM 779 H ASP A 509 -7.299 43.208 15.416 1.00 0.00 H ATOM 780 N HIS A 510 -6.563 46.256 15.010 1.00 20.16 N ATOM 781 CA HIS A 510 -5.627 47.384 14.986 1.00 23.28 C ATOM 782 C HIS A 510 -5.126 47.766 16.387 1.00 24.32 C ATOM 783 O HIS A 510 -4.985 48.950 16.692 1.00 28.46 O ATOM 784 CB HIS A 510 -6.230 48.617 14.297 1.00 23.52 C ATOM 785 CG HIS A 510 -6.485 48.439 12.830 1.00 28.83 C ATOM 786 ND1 HIS A 510 -5.705 49.037 11.861 1.00 31.58 N ATOM 787 CD2 HIS A 510 -7.447 47.753 12.166 1.00 27.89 C ATOM 788 CE1 HIS A 510 -6.172 48.722 10.665 1.00 30.17 C ATOM 789 NE2 HIS A 510 -7.229 47.943 10.821 1.00 25.78 N ATOM 790 H HIS A 510 -6.339 45.407 14.453 1.00 0.00 H ATOM 791 N LYS A 511 -4.863 46.761 17.225 1.00 19.48 N ATOM 792 CA LYS A 511 -4.244 46.970 18.537 1.00 19.24 C ATOM 793 C LYS A 511 -2.733 47.021 18.368 1.00 18.48 C ATOM 794 O LYS A 511 -2.007 47.441 19.271 1.00 22.94 O ATOM 795 CB LYS A 511 -4.596 45.834 19.503 1.00 22.94 C ATOM 796 CG LYS A 511 -6.084 45.632 19.751 1.00 33.92 C ATOM 797 CD LYS A 511 -6.691 46.789 20.528 1.00 43.67 C ATOM 798 CE LYS A 511 -8.159 46.519 20.878 1.00 51.22 C ATOM 799 NZ LYS A 511 -8.326 45.263 21.664 1.00 52.27 N ATOM 800 HZ1 LYS A 511 -7.971 44.458 21.109 1.00 0.00 H ATOM 801 HZ2 LYS A 511 -7.789 45.337 22.552 1.00 0.00 H ATOM 802 HZ3 LYS A 511 -9.334 45.121 21.878 1.00 0.00 H ATOM 803 H LYS A 511 -5.107 45.792 16.936 1.00 0.00 H ATOM 804 N ALA A 512 -2.263 46.578 17.206 1.00 15.11 N ATOM 805 CA ALA A 512 -0.845 46.624 16.870 1.00 13.64 C ATOM 806 C ALA A 512 -0.690 47.084 15.431 1.00 14.70 C ATOM 807 O ALA A 512 -1.590 46.887 14.623 1.00 14.51 O ATOM 808 CB ALA A 512 -0.201 45.248 17.049 1.00 12.94 C ATOM 809 H ALA A 512 -2.930 46.185 16.512 1.00 0.00 H ATOM 810 N ASP A 513 0.454 47.687 15.118 1.00 12.20 N ATOM 811 CA ASP A 513 0.767 48.070 13.748 1.00 16.96 C ATOM 812 C ASP A 513 1.506 46.953 13.015 1.00 16.63 C ATOM 813 O ASP A 513 1.350 46.787 11.810 1.00 18.08 O ATOM 814 CB ASP A 513 1.619 49.346 13.743 1.00 11.93 C ATOM 815 CG ASP A 513 0.875 50.526 14.315 1.00 22.31 C ATOM 816 OD1 ASP A 513 -0.051 51.002 13.630 1.00 18.51 O ATOM 817 OD2 ASP A 513 1.191 50.964 15.449 1.00 18.36 O ATOM 818 H ASP A 513 1.142 47.890 15.871 1.00 0.00 H ATOM 819 N LEU A 514 2.323 46.205 13.752 1.00 10.91 N ATOM 820 CA LEU A 514 3.119 45.133 13.166 1.00 10.41 C ATOM 821 C LEU A 514 3.104 43.948 14.108 1.00 11.61 C ATOM 822 O LEU A 514 3.101 44.125 15.335 1.00 11.10 O ATOM 823 CB LEU A 514 4.576 45.572 12.995 1.00 10.28 C ATOM 824 CG LEU A 514 4.909 46.866 12.266 1.00 15.12 C ATOM 825 CD1 LEU A 514 6.414 47.127 12.321 1.00 12.76 C ATOM 826 CD2 LEU A 514 4.434 46.741 10.828 1.00 13.57 C ATOM 827 H LEU A 514 2.396 46.390 14.773 1.00 0.00 H ATOM 828 N ALA A 515 3.094 42.739 13.546 1.00 10.19 N ATOM 829 CA ALA A 515 3.393 41.554 14.343 1.00 14.43 C ATOM 830 C ALA A 515 4.782 41.123 13.930 1.00 15.10 C ATOM 831 O ALA A 515 4.996 40.763 12.773 1.00 11.97 O ATOM 832 CB ALA A 515 2.390 40.442 14.081 1.00 11.20 C ATOM 833 H ALA A 515 2.872 42.640 12.535 1.00 0.00 H ATOM 834 N VAL A 516 5.731 41.184 14.859 1.00 11.58 N ATOM 835 CA VAL A 516 7.098 40.810 14.549 1.00 12.90 C ATOM 836 C VAL A 516 7.418 39.561 15.348 1.00 17.02 C ATOM 837 O VAL A 516 7.634 39.621 16.560 1.00 19.12 O ATOM 838 CB VAL A 516 8.083 41.931 14.878 1.00 18.38 C ATOM 839 CG1 VAL A 516 9.504 41.417 14.772 1.00 24.58 C ATOM 840 CG2 VAL A 516 7.874 43.111 13.928 1.00 17.45 C ATOM 841 H VAL A 516 5.491 41.504 15.819 1.00 0.00 H ATOM 842 N ALA A 517 7.420 38.425 14.660 1.00 19.37 N ATOM 843 CA ALA A 517 7.520 37.125 15.315 1.00 17.85 C ATOM 844 C ALA A 517 7.723 36.101 14.217 1.00 19.85 C ATOM 845 O ALA A 517 7.554 36.435 13.045 1.00 19.66 O ATOM 846 CB ALA A 517 6.242 36.835 16.069 1.00 15.07 C ATOM 847 H ALA A 517 7.348 38.463 13.623 1.00 0.00 H ATOM 848 N PRO A 518 8.068 34.848 14.574 1.00 19.93 N ATOM 849 CA PRO A 518 8.073 33.866 13.482 1.00 16.66 C ATOM 850 C PRO A 518 6.637 33.542 13.071 1.00 15.85 C ATOM 851 O PRO A 518 6.123 32.452 13.378 1.00 16.58 O ATOM 852 CB PRO A 518 8.744 32.644 14.113 1.00 13.87 C ATOM 853 CG PRO A 518 8.460 32.771 15.590 1.00 14.97 C ATOM 854 CD PRO A 518 8.489 34.257 15.861 1.00 19.75 C ATOM 855 N LEU A 519 6.002 34.488 12.383 1.00 12.98 N ATOM 856 CA LEU A 519 4.589 34.368 11.999 1.00 12.43 C ATOM 857 C LEU A 519 4.453 33.784 10.599 1.00 15.76 C ATOM 858 O LEU A 519 4.892 34.381 9.604 1.00 13.39 O ATOM 859 CB LEU A 519 3.911 35.742 12.055 1.00 14.84 C ATOM 860 CG LEU A 519 2.415 35.839 11.758 1.00 14.41 C ATOM 861 CD1 LEU A 519 1.599 35.218 12.887 1.00 16.21 C ATOM 862 CD2 LEU A 519 2.007 37.298 11.539 1.00 19.44 C ATOM 863 H LEU A 519 6.525 35.343 12.107 1.00 0.00 H ATOM 864 N THR A 520 3.822 32.620 10.513 1.00 11.25 N ATOM 865 CA THR A 520 3.754 31.914 9.244 1.00 11.72 C ATOM 866 C THR A 520 2.773 32.582 8.283 1.00 17.62 C ATOM 867 O THR A 520 1.625 32.893 8.651 1.00 12.44 O ATOM 868 CB THR A 520 3.412 30.429 9.454 1.00 12.23 C ATOM 869 OG1 THR A 520 4.346 29.871 10.390 1.00 15.21 O ATOM 870 CG2 THR A 520 3.508 29.666 8.146 1.00 12.79 C ATOM 871 HG1 THR A 520 4.136 28.914 10.534 1.00 0.00 H ATOM 872 H THR A 520 3.374 32.211 11.358 1.00 0.00 H ATOM 873 N ILE A 521 3.243 32.805 7.054 1.00 12.64 N ATOM 874 CA ILE A 521 2.432 33.404 5.997 1.00 12.87 C ATOM 875 C ILE A 521 1.540 32.331 5.400 1.00 18.51 C ATOM 876 O ILE A 521 2.039 31.364 4.820 1.00 15.45 O ATOM 877 CB ILE A 521 3.318 33.972 4.871 1.00 12.90 C ATOM 878 CG1 ILE A 521 4.246 35.061 5.419 1.00 12.80 C ATOM 879 CG2 ILE A 521 2.458 34.518 3.739 1.00 13.78 C ATOM 880 CD1 ILE A 521 5.481 35.335 4.562 1.00 15.40 C ATOM 881 H ILE A 521 4.226 32.542 6.840 1.00 0.00 H ATOM 882 N THR A 522 0.224 32.490 5.538 1.00 14.23 N ATOM 883 CA THR A 522 -0.710 31.505 5.003 1.00 15.17 C ATOM 884 C THR A 522 -1.863 32.212 4.322 1.00 16.46 C ATOM 885 O THR A 522 -2.238 33.325 4.707 1.00 15.74 O ATOM 886 CB THR A 522 -1.317 30.619 6.102 1.00 22.13 C ATOM 887 OG1 THR A 522 -2.161 31.418 6.941 1.00 15.24 O ATOM 888 CG2 THR A 522 -0.234 29.946 6.942 1.00 16.98 C ATOM 889 HG1 THR A 522 -2.553 30.849 7.650 1.00 0.00 H ATOM 890 H THR A 522 -0.142 33.328 6.034 1.00 0.00 H ATOM 891 N HIS A 523 -2.454 31.571 3.327 1.00 16.92 N ATOM 892 CA HIS A 523 -3.535 32.229 2.619 1.00 17.81 C ATOM 893 C HIS A 523 -4.779 32.317 3.485 1.00 20.23 C ATOM 894 O HIS A 523 -5.578 33.240 3.329 1.00 18.65 O ATOM 895 CB HIS A 523 -3.803 31.565 1.265 1.00 18.93 C ATOM 896 CG HIS A 523 -2.716 31.817 0.270 1.00 18.82 C ATOM 897 ND1 HIS A 523 -2.091 30.806 -0.429 1.00 25.36 N ATOM 898 CD2 HIS A 523 -2.105 32.967 -0.106 1.00 26.13 C ATOM 899 CE1 HIS A 523 -1.154 31.324 -1.202 1.00 25.28 C ATOM 900 NE2 HIS A 523 -1.141 32.634 -1.022 1.00 30.31 N ATOM 901 H HIS A 523 -2.149 30.614 3.058 1.00 0.00 H ATOM 902 N VAL A 524 -4.929 31.384 4.423 1.00 18.04 N ATOM 903 CA VAL A 524 -6.070 31.474 5.324 1.00 25.13 C ATOM 904 C VAL A 524 -5.954 32.737 6.185 1.00 17.78 C ATOM 905 O VAL A 524 -6.935 33.438 6.379 1.00 18.35 O ATOM 906 CB VAL A 524 -6.288 30.192 6.173 1.00 37.19 C ATOM 907 CG1 VAL A 524 -5.074 29.876 6.995 1.00 32.33 C ATOM 908 CG2 VAL A 524 -7.510 30.349 7.066 1.00 41.26 C ATOM 909 H VAL A 524 -4.245 30.606 4.511 1.00 0.00 H ATOM 910 N ARG A 525 -4.751 33.062 6.660 1.00 16.66 N ATOM 911 CA ARG A 525 -4.599 34.278 7.454 1.00 16.07 C ATOM 912 C ARG A 525 -4.733 35.516 6.585 1.00 17.85 C ATOM 913 O ARG A 525 -5.112 36.587 7.067 1.00 16.30 O ATOM 914 CB ARG A 525 -3.267 34.291 8.197 1.00 14.94 C ATOM 915 CG ARG A 525 -3.218 33.279 9.333 1.00 14.81 C ATOM 916 CD ARG A 525 -1.818 33.144 9.914 1.00 13.85 C ATOM 917 NE ARG A 525 -1.853 32.494 11.226 1.00 13.79 N ATOM 918 CZ ARG A 525 -0.775 32.070 11.874 1.00 13.21 C ATOM 919 NH1 ARG A 525 -0.896 31.499 13.073 1.00 13.33 N ATOM 920 NH2 ARG A 525 0.419 32.195 11.315 1.00 12.63 N ATOM 921 HE ARG A 525 -2.780 32.356 11.678 1.00 0.00 H ATOM 922 HH12 ARG A 525 -0.050 31.168 13.579 1.00 0.00 H ATOM 923 HH11 ARG A 525 -1.836 31.385 13.502 1.00 0.00 H ATOM 924 HH22 ARG A 525 1.266 31.864 11.819 1.00 0.00 H ATOM 925 HH21 ARG A 525 0.509 32.624 10.372 1.00 0.00 H ATOM 926 H ARG A 525 -3.929 32.455 6.467 1.00 0.00 H ATOM 927 N GLU A 526 -4.429 35.376 5.299 1.00 16.58 N ATOM 928 CA GLU A 526 -4.574 36.515 4.396 1.00 16.96 C ATOM 929 C GLU A 526 -6.040 36.934 4.241 1.00 18.10 C ATOM 930 O GLU A 526 -6.321 38.015 3.733 1.00 22.77 O ATOM 931 CB GLU A 526 -3.883 36.255 3.042 1.00 21.08 C ATOM 932 CG GLU A 526 -2.330 36.202 3.139 1.00 26.98 C ATOM 933 CD GLU A 526 -1.654 35.786 1.829 1.00 40.16 C ATOM 934 OE1 GLU A 526 -2.339 35.807 0.783 1.00 47.47 O ATOM 935 OE2 GLU A 526 -0.441 35.434 1.841 1.00 31.94 O ATOM 936 H GLU A 526 -4.090 34.462 4.938 1.00 0.00 H ATOM 937 N LYS A 527 -6.976 36.095 4.688 1.00 18.72 N ATOM 938 CA LYS A 527 -8.389 36.509 4.753 1.00 25.02 C ATOM 939 C LYS A 527 -8.596 37.598 5.813 1.00 22.39 C ATOM 940 O LYS A 527 -9.576 38.347 5.776 1.00 24.67 O ATOM 941 CB LYS A 527 -9.299 35.333 5.103 1.00 24.66 C ATOM 942 CG LYS A 527 -9.387 34.236 4.065 1.00 27.55 C ATOM 943 CD LYS A 527 -10.413 33.175 4.492 1.00 37.92 C ATOM 944 CE LYS A 527 -10.239 32.768 5.959 1.00 42.92 C ATOM 945 NZ LYS A 527 -11.194 33.462 6.884 1.00 45.73 N ATOM 946 HZ1 LYS A 527 -11.048 34.490 6.824 1.00 0.00 H ATOM 947 HZ2 LYS A 527 -12.170 33.233 6.608 1.00 0.00 H ATOM 948 HZ3 LYS A 527 -11.024 33.143 7.859 1.00 0.00 H ATOM 949 H LYS A 527 -6.706 35.138 4.994 1.00 0.00 H ATOM 950 N ALA A 528 -7.671 37.675 6.760 1.00 19.07 N ATOM 951 CA ALA A 528 -7.809 38.589 7.893 1.00 20.26 C ATOM 952 C ALA A 528 -6.770 39.714 7.919 1.00 18.96 C ATOM 953 O ALA A 528 -7.079 40.843 8.315 1.00 17.45 O ATOM 954 CB ALA A 528 -7.757 37.810 9.183 1.00 19.86 C ATOM 955 H ALA A 528 -6.827 37.071 6.695 1.00 0.00 H ATOM 956 N ILE A 529 -5.532 39.396 7.542 1.00 16.35 N ATOM 957 CA ILE A 529 -4.438 40.362 7.633 1.00 15.51 C ATOM 958 C ILE A 529 -3.560 40.376 6.368 1.00 17.87 C ATOM 959 O ILE A 529 -3.810 39.614 5.437 1.00 17.85 O ATOM 960 CB ILE A 529 -3.540 40.056 8.853 1.00 16.99 C ATOM 961 CG1 ILE A 529 -2.904 38.663 8.719 1.00 18.24 C ATOM 962 CG2 ILE A 529 -4.347 40.151 10.142 1.00 14.82 C ATOM 963 CD1 ILE A 529 -1.815 38.363 9.774 1.00 15.46 C ATOM 964 H ILE A 529 -5.340 38.442 7.176 1.00 0.00 H ATOM 965 N ASP A 530 -2.544 41.243 6.347 1.00 14.64 N ATOM 966 CA ASP A 530 -1.527 41.251 5.288 1.00 14.42 C ATOM 967 C ASP A 530 -0.172 40.803 5.852 1.00 15.97 C ATOM 968 O ASP A 530 0.046 40.840 7.070 1.00 15.65 O ATOM 969 CB ASP A 530 -1.371 42.652 4.672 1.00 14.68 C ATOM 970 CG ASP A 530 -2.572 43.076 3.843 1.00 24.59 C ATOM 971 OD1 ASP A 530 -3.440 42.219 3.542 1.00 24.89 O ATOM 972 OD2 ASP A 530 -2.645 44.279 3.487 1.00 25.71 O ATOM 973 H ASP A 530 -2.470 41.942 7.113 1.00 0.00 H ATOM 974 N PHE A 531 0.725 40.359 4.974 1.00 13.29 N ATOM 975 CA PHE A 531 2.089 40.009 5.375 1.00 12.47 C ATOM 976 C PHE A 531 3.089 40.745 4.501 1.00 12.85 C ATOM 977 O PHE A 531 2.819 40.983 3.325 1.00 13.14 O ATOM 978 CB PHE A 531 2.360 38.516 5.186 1.00 12.50 C ATOM 979 CG PHE A 531 1.526 37.625 6.051 1.00 16.28 C ATOM 980 CD1 PHE A 531 1.961 37.275 7.325 1.00 15.93 C ATOM 981 CD2 PHE A 531 0.319 37.116 5.586 1.00 15.35 C ATOM 982 CE1 PHE A 531 1.205 36.430 8.137 1.00 15.03 C ATOM 983 CE2 PHE A 531 -0.453 36.282 6.393 1.00 18.51 C ATOM 984 CZ PHE A 531 -0.006 35.935 7.670 1.00 12.94 C ATOM 985 H PHE A 531 0.449 40.258 3.976 1.00 0.00 H ATOM 986 N SER A 532 4.253 41.069 5.066 1.00 13.32 N ATOM 987 CA SER A 532 5.408 41.432 4.251 1.00 14.84 C ATOM 988 C SER A 532 5.829 40.182 3.487 1.00 17.15 C ATOM 989 O SER A 532 5.365 39.079 3.804 1.00 17.63 O ATOM 990 CB SER A 532 6.573 41.849 5.139 1.00 11.02 C ATOM 991 OG SER A 532 7.155 40.714 5.788 1.00 16.48 O ATOM 992 HG SER A 532 7.487 40.079 5.105 1.00 0.00 H ATOM 993 H SER A 532 4.339 41.063 6.102 1.00 0.00 H ATOM 994 N LYS A 533 6.708 40.336 2.494 1.00 15.09 N ATOM 995 CA LYS A 533 7.356 39.173 1.884 1.00 12.66 C ATOM 996 C LYS A 533 8.162 38.423 2.965 1.00 12.12 C ATOM 997 O LYS A 533 8.479 38.996 4.014 1.00 13.40 O ATOM 998 CB LYS A 533 8.248 39.597 0.707 1.00 15.40 C ATOM 999 CG LYS A 533 7.536 40.382 -0.391 1.00 19.77 C ATOM 1000 CD LYS A 533 6.310 39.683 -0.956 1.00 19.26 C ATOM 1001 CE LYS A 533 5.591 40.612 -1.949 1.00 16.86 C ATOM 1002 NZ LYS A 533 4.486 39.937 -2.710 1.00 16.67 N ATOM 1003 HZ1 LYS A 533 4.877 39.142 -3.254 1.00 0.00 H ATOM 1004 HZ2 LYS A 533 3.772 39.583 -2.041 1.00 0.00 H ATOM 1005 HZ3 LYS A 533 4.046 40.620 -3.359 1.00 0.00 H ATOM 1006 H LYS A 533 6.935 41.291 2.150 1.00 0.00 H ATOM 1007 N PRO A 534 8.472 37.130 2.732 1.00 12.38 N ATOM 1008 CA PRO A 534 9.104 36.353 3.805 1.00 11.66 C ATOM 1009 C PRO A 534 10.544 36.781 4.114 1.00 14.55 C ATOM 1010 O PRO A 534 11.308 37.113 3.196 1.00 11.74 O ATOM 1011 CB PRO A 534 9.110 34.907 3.263 1.00 14.16 C ATOM 1012 CG PRO A 534 8.311 34.912 2.008 1.00 16.27 C ATOM 1013 CD PRO A 534 8.165 36.317 1.537 1.00 13.08 C ATOM 1014 N PHE A 535 10.902 36.750 5.398 1.00 15.07 N ATOM 1015 CA PHE A 535 12.277 36.996 5.814 1.00 10.57 C ATOM 1016 C PHE A 535 13.007 35.689 6.118 1.00 15.15 C ATOM 1017 O PHE A 535 14.227 35.682 6.328 1.00 13.56 O ATOM 1018 CB PHE A 535 12.340 37.956 7.010 1.00 10.03 C ATOM 1019 CG PHE A 535 11.577 37.494 8.237 1.00 14.73 C ATOM 1020 CD1 PHE A 535 12.124 36.557 9.115 1.00 14.62 C ATOM 1021 CD2 PHE A 535 10.339 38.043 8.544 1.00 14.10 C ATOM 1022 CE1 PHE A 535 11.431 36.153 10.255 1.00 14.78 C ATOM 1023 CE2 PHE A 535 9.644 37.643 9.677 1.00 10.82 C ATOM 1024 CZ PHE A 535 10.189 36.701 10.539 1.00 11.58 C ATOM 1025 H PHE A 535 10.182 36.545 6.120 1.00 0.00 H ATOM 1026 N MET A 536 12.260 34.586 6.146 1.00 10.82 N ATOM 1027 CA MET A 536 12.852 33.273 6.383 1.00 11.11 C ATOM 1028 C MET A 536 11.946 32.229 5.755 1.00 16.97 C ATOM 1029 O MET A 536 10.717 32.364 5.800 1.00 13.42 O ATOM 1030 CB MET A 536 12.977 33.019 7.891 1.00 10.64 C ATOM 1031 CG MET A 536 13.641 31.686 8.267 1.00 12.16 C ATOM 1032 SD MET A 536 13.751 31.485 10.061 1.00 16.89 S ATOM 1033 CE MET A 536 15.238 32.435 10.423 1.00 15.26 C ATOM 1034 H MET A 536 11.234 34.662 5.996 1.00 0.00 H ATOM 1035 N THR A 537 12.539 31.203 5.154 1.00 14.78 N ATOM 1036 CA THR A 537 11.751 30.103 4.596 1.00 19.66 C ATOM 1037 C THR A 537 11.963 28.844 5.420 1.00 19.21 C ATOM 1038 O THR A 537 13.015 28.667 6.057 1.00 18.73 O ATOM 1039 CB THR A 537 12.069 29.827 3.114 1.00 30.03 C ATOM 1040 OG1 THR A 537 13.476 29.627 2.954 1.00 37.33 O ATOM 1041 CG2 THR A 537 11.621 30.997 2.241 1.00 34.91 C ATOM 1042 HG1 THR A 537 13.959 30.439 3.249 1.00 0.00 H ATOM 1043 H THR A 537 13.576 31.181 5.079 1.00 0.00 H ATOM 1044 N LEU A 538 10.960 27.972 5.420 1.00 14.75 N ATOM 1045 CA LEU A 538 10.980 26.813 6.304 1.00 15.69 C ATOM 1046 C LEU A 538 9.954 25.806 5.822 1.00 15.41 C ATOM 1047 O LEU A 538 9.315 26.001 4.783 1.00 14.51 O ATOM 1048 CB LEU A 538 10.630 27.251 7.724 1.00 13.96 C ATOM 1049 CG LEU A 538 9.312 28.023 7.683 1.00 20.03 C ATOM 1050 CD1 LEU A 538 8.281 27.436 8.617 1.00 18.18 C ATOM 1051 CD2 LEU A 538 9.542 29.506 7.957 1.00 19.17 C ATOM 1052 H LEU A 538 10.152 28.118 4.782 1.00 0.00 H ATOM 1053 N GLY A 539 9.800 24.724 6.575 1.00 14.38 N ATOM 1054 CA GLY A 539 8.752 23.762 6.301 1.00 15.03 C ATOM 1055 C GLY A 539 8.342 23.060 7.578 1.00 15.34 C ATOM 1056 O GLY A 539 9.042 23.138 8.594 1.00 17.35 O ATOM 1057 H GLY A 539 10.443 24.564 7.376 1.00 0.00 H ATOM 1058 N VAL A 540 7.206 22.380 7.538 1.00 15.50 N ATOM 1059 CA VAL A 540 6.796 21.571 8.674 1.00 18.63 C ATOM 1060 C VAL A 540 7.593 20.281 8.686 1.00 16.40 C ATOM 1061 O VAL A 540 7.796 19.656 7.640 1.00 19.31 O ATOM 1062 CB VAL A 540 5.305 21.248 8.610 1.00 19.40 C ATOM 1063 CG1 VAL A 540 4.895 20.368 9.778 1.00 19.76 C ATOM 1064 CG2 VAL A 540 4.509 22.538 8.609 1.00 20.61 C ATOM 1065 H VAL A 540 6.605 22.425 6.690 1.00 0.00 H ATOM 1066 N SER A 541 8.054 19.880 9.866 1.00 16.33 N ATOM 1067 CA SER A 541 8.691 18.582 10.011 1.00 17.15 C ATOM 1068 C SER A 541 8.324 18.030 11.393 1.00 18.62 C ATOM 1069 O SER A 541 7.404 18.537 12.047 1.00 19.07 O ATOM 1070 CB SER A 541 10.209 18.700 9.827 1.00 23.98 C ATOM 1071 OG SER A 541 10.820 17.432 9.630 1.00 23.76 O ATOM 1072 HG SER A 541 10.441 17.007 8.820 1.00 0.00 H ATOM 1073 H SER A 541 7.958 20.502 10.694 1.00 0.00 H ATOM 1074 N ILE A 542 9.051 17.014 11.838 1.00 18.78 N ATOM 1075 CA ILE A 542 8.721 16.294 13.063 1.00 19.16 C ATOM 1076 C ILE A 542 9.885 16.321 14.051 1.00 21.04 C ATOM 1077 O ILE A 542 11.018 15.993 13.686 1.00 18.68 O ATOM 1078 CB ILE A 542 8.413 14.809 12.743 1.00 19.64 C ATOM 1079 CG1 ILE A 542 7.232 14.701 11.770 1.00 20.13 C ATOM 1080 CG2 ILE A 542 8.163 14.017 14.017 1.00 20.25 C ATOM 1081 CD1 ILE A 542 7.083 13.329 11.144 1.00 21.13 C ATOM 1082 H ILE A 542 9.887 16.720 11.294 1.00 0.00 H ATOM 1083 N LEU A 543 9.598 16.707 15.295 1.00 19.23 N ATOM 1084 CA LEU A 543 10.565 16.660 16.390 1.00 18.22 C ATOM 1085 C LEU A 543 10.253 15.458 17.279 1.00 21.83 C ATOM 1086 O LEU A 543 9.123 15.302 17.741 1.00 19.45 O ATOM 1087 CB LEU A 543 10.479 17.945 17.223 1.00 17.34 C ATOM 1088 CG LEU A 543 11.369 18.035 18.469 1.00 18.33 C ATOM 1089 CD1 LEU A 543 12.829 18.198 18.082 1.00 17.48 C ATOM 1090 CD2 LEU A 543 10.919 19.163 19.402 1.00 16.90 C ATOM 1091 H LEU A 543 8.640 17.058 15.496 1.00 0.00 H ATOM 1092 N TYR A 544 11.244 14.613 17.534 1.00 21.27 N ATOM 1093 CA TYR A 544 11.001 13.373 18.278 1.00 22.62 C ATOM 1094 C TYR A 544 12.281 12.917 18.987 1.00 24.21 C ATOM 1095 O TYR A 544 13.385 13.316 18.601 1.00 22.68 O ATOM 1096 CB TYR A 544 10.481 12.298 17.304 1.00 21.98 C ATOM 1097 CG TYR A 544 10.047 10.976 17.913 1.00 23.28 C ATOM 1098 CD1 TYR A 544 8.988 10.909 18.807 1.00 23.50 C ATOM 1099 CD2 TYR A 544 10.667 9.785 17.544 1.00 29.19 C ATOM 1100 CE1 TYR A 544 8.584 9.692 19.351 1.00 24.80 C ATOM 1101 CE2 TYR A 544 10.274 8.572 18.075 1.00 30.56 C ATOM 1102 CZ TYR A 544 9.230 8.530 18.978 1.00 34.04 C ATOM 1103 OH TYR A 544 8.834 7.323 19.507 1.00 29.97 O ATOM 1104 HH TYR A 544 8.080 7.469 20.132 1.00 0.00 H ATOM 1105 H TYR A 544 12.205 14.833 17.202 1.00 0.00 H ATOM 1106 N ARG A 545 12.131 12.118 20.041 1.00 22.88 N ATOM 1107 CA ARG A 545 13.281 11.568 20.746 1.00 30.98 C ATOM 1108 C ARG A 545 13.959 10.522 19.863 1.00 33.35 C ATOM 1109 O ARG A 545 13.287 9.750 19.185 1.00 28.53 O ATOM 1110 CB ARG A 545 12.844 10.930 22.071 1.00 32.28 C ATOM 1111 CG ARG A 545 13.605 11.427 23.298 1.00 34.79 C ATOM 1112 CD ARG A 545 13.290 10.589 24.553 1.00 37.47 C ATOM 1113 NE ARG A 545 12.148 11.099 25.314 1.00 36.00 N ATOM 1114 CZ ARG A 545 10.953 10.516 25.370 1.00 33.15 C ATOM 1115 NH1 ARG A 545 10.720 9.386 24.714 1.00 35.44 N ATOM 1116 NH2 ARG A 545 9.986 11.064 26.089 1.00 27.90 N ATOM 1117 HE ARG A 545 12.280 11.981 25.850 1.00 0.00 H ATOM 1118 HH12 ARG A 545 9.782 8.939 24.765 1.00 0.00 H ATOM 1119 HH11 ARG A 545 11.475 8.947 24.149 1.00 0.00 H ATOM 1120 HH22 ARG A 545 9.051 10.611 26.135 1.00 0.00 H ATOM 1121 HH21 ARG A 545 10.161 11.948 26.608 1.00 0.00 H ATOM 1122 H ARG A 545 11.173 11.881 20.368 1.00 0.00 H ATOM 1123 N LYS A 546 15.292 10.506 19.857 1.00 25.01 N ATOM 1124 CA LYS A 546 15.992 9.441 19.143 1.00 27.66 C ATOM 1125 C LYS A 546 15.624 8.133 19.822 1.00 29.63 C ATOM 1126 O LYS A 546 15.584 8.060 21.051 1.00 29.43 O ATOM 1127 CB LYS A 546 17.506 9.629 19.200 1.00 33.99 C ATOM 1128 CG LYS A 546 18.012 10.850 18.475 1.00 36.74 C ATOM 1129 CD LYS A 546 19.520 10.986 18.646 1.00 39.40 C ATOM 1130 CE LYS A 546 20.045 12.151 17.829 1.00 40.03 C ATOM 1131 NZ LYS A 546 21.479 12.405 18.108 1.00 44.10 N ATOM 1132 HZ1 LYS A 546 21.601 12.627 19.117 1.00 0.00 H ATOM 1133 HZ2 LYS A 546 22.033 11.558 17.869 1.00 0.00 H ATOM 1134 HZ3 LYS A 546 21.806 13.208 17.533 1.00 0.00 H ATOM 1135 H LYS A 546 15.828 11.244 20.356 1.00 0.00 H ATOM 1136 N GLY A 547 15.348 7.102 19.033 1.00 29.34 N ATOM 1137 CA GLY A 547 14.944 5.823 19.589 1.00 34.33 C ATOM 1138 C GLY A 547 14.213 5.009 18.544 1.00 41.17 C ATOM 1139 O GLY A 547 14.848 4.394 17.687 1.00 50.45 O ATOM 1140 H GLY A 547 15.422 7.212 18.001 1.00 0.00 H ATOM 1141 N THR A 548 12.883 5.010 18.599 1.00 36.98 N ATOM 1142 CA THR A 548 12.100 4.297 17.600 1.00 37.52 C ATOM 1143 C THR A 548 12.356 4.932 16.249 1.00 34.19 C ATOM 1144 O THR A 548 12.125 6.132 16.069 1.00 34.42 O ATOM 1145 CB THR A 548 10.594 4.300 17.904 1.00 39.18 C ATOM 1146 OG1 THR A 548 10.364 3.700 19.186 1.00 43.01 O ATOM 1147 CG2 THR A 548 9.846 3.501 16.839 1.00 35.21 C ATOM 1148 HG1 THR A 548 9.393 3.702 19.381 1.00 0.00 H ATOM 1149 H THR A 548 12.399 5.525 19.362 1.00 0.00 H ATOM 1150 N PRO A 669 12.847 4.127 15.294 1.00 33.59 N ATOM 1151 CA PRO A 669 13.277 4.637 13.992 1.00 35.98 C ATOM 1152 C PRO A 669 12.117 4.892 13.033 1.00 41.57 C ATOM 1153 O PRO A 669 12.150 4.396 11.903 1.00 44.65 O ATOM 1154 CB PRO A 669 14.161 3.508 13.459 1.00 32.71 C ATOM 1155 CG PRO A 669 13.558 2.273 14.048 1.00 39.93 C ATOM 1156 CD PRO A 669 13.093 2.679 15.428 1.00 39.44 C ATOM 1157 N ILE A 670 11.108 5.646 13.469 1.00 40.10 N ATOM 1158 CA ILE A 670 10.111 6.155 12.529 1.00 40.61 C ATOM 1159 C ILE A 670 10.841 7.099 11.579 1.00 35.20 C ATOM 1160 O ILE A 670 11.834 7.719 11.961 1.00 32.46 O ATOM 1161 CB ILE A 670 8.935 6.876 13.226 1.00 39.04 C ATOM 1162 CG1 ILE A 670 9.420 8.079 14.027 1.00 36.03 C ATOM 1163 CG2 ILE A 670 8.191 5.920 14.143 1.00 44.89 C ATOM 1164 CD1 ILE A 670 8.278 8.922 14.600 1.00 37.67 C ATOM 1165 H ILE A 670 11.030 5.873 14.481 1.00 0.00 H ATOM 1166 N ASP A 671 10.379 7.191 10.338 1.00 36.63 N ATOM 1167 CA ASP A 671 11.122 7.947 9.338 1.00 39.96 C ATOM 1168 C ASP A 671 10.264 8.987 8.625 1.00 32.94 C ATOM 1169 O ASP A 671 10.771 9.753 7.805 1.00 30.47 O ATOM 1170 CB ASP A 671 11.774 6.993 8.324 1.00 48.69 C ATOM 1171 CG ASP A 671 12.852 7.669 7.483 1.00 57.22 C ATOM 1172 OD1 ASP A 671 13.612 8.502 8.028 1.00 57.23 O ATOM 1173 OD2 ASP A 671 12.936 7.366 6.272 1.00 63.82 O ATOM 1174 H ASP A 671 9.487 6.724 10.079 1.00 0.00 H ATOM 1175 N SER A 672 8.973 9.031 8.947 1.00 33.37 N ATOM 1176 CA SER A 672 8.054 9.903 8.224 1.00 30.29 C ATOM 1177 C SER A 672 6.707 10.077 8.920 1.00 29.43 C ATOM 1178 O SER A 672 6.351 9.321 9.820 1.00 25.08 O ATOM 1179 CB SER A 672 7.799 9.343 6.823 1.00 30.56 C ATOM 1180 OG SER A 672 6.974 8.192 6.896 1.00 37.47 O ATOM 1181 HG SER A 672 6.818 7.841 5.984 1.00 0.00 H ATOM 1182 H SER A 672 8.616 8.437 9.722 1.00 0.00 H ATOM 1183 N ALA A 673 5.953 11.073 8.465 1.00 25.85 N ATOM 1184 CA ALA A 673 4.604 11.311 8.963 1.00 27.94 C ATOM 1185 C ALA A 673 3.699 10.100 8.727 1.00 29.51 C ATOM 1186 O ALA A 673 2.814 9.812 9.539 1.00 33.26 O ATOM 1187 CB ALA A 673 4.015 12.568 8.324 1.00 24.59 C ATOM 1188 H ALA A 673 6.338 11.702 7.731 1.00 0.00 H ATOM 1189 N ASP A 674 3.918 9.383 7.627 1.00 31.14 N ATOM 1190 CA ASP A 674 3.136 8.170 7.364 1.00 34.18 C ATOM 1191 C ASP A 674 3.333 7.131 8.472 1.00 32.77 C ATOM 1192 O ASP A 674 2.390 6.435 8.849 1.00 32.95 O ATOM 1193 CB ASP A 674 3.478 7.566 5.997 1.00 41.58 C ATOM 1194 CG ASP A 674 2.617 6.344 5.664 1.00 54.09 C ATOM 1195 OD1 ASP A 674 1.475 6.249 6.171 1.00 57.86 O ATOM 1196 OD2 ASP A 674 3.080 5.476 4.892 1.00 58.53 O ATOM 1197 H ASP A 674 4.648 9.685 6.950 1.00 0.00 H ATOM 1198 N ASP A 675 4.552 7.037 9.001 1.00 30.39 N ATOM 1199 CA ASP A 675 4.832 6.119 10.104 1.00 30.64 C ATOM 1200 C ASP A 675 4.013 6.500 11.336 1.00 30.07 C ATOM 1201 O ASP A 675 3.590 5.640 12.108 1.00 33.86 O ATOM 1202 CB ASP A 675 6.323 6.135 10.453 1.00 35.49 C ATOM 1203 CG ASP A 675 7.171 5.382 9.442 1.00 42.32 C ATOM 1204 OD1 ASP A 675 6.606 4.548 8.705 1.00 39.43 O ATOM 1205 OD2 ASP A 675 8.401 5.618 9.396 1.00 44.15 O ATOM 1206 H ASP A 675 5.319 7.628 8.622 1.00 0.00 H ATOM 1207 N LEU A 676 3.811 7.801 11.523 1.00 29.16 N ATOM 1208 CA LEU A 676 3.015 8.306 12.634 1.00 26.24 C ATOM 1209 C LEU A 676 1.539 8.053 12.374 1.00 26.91 C ATOM 1210 O LEU A 676 0.811 7.586 13.248 1.00 31.80 O ATOM 1211 CB LEU A 676 3.245 9.813 12.811 1.00 24.73 C ATOM 1212 CG LEU A 676 4.478 10.253 13.589 1.00 24.16 C ATOM 1213 CD1 LEU A 676 4.479 11.766 13.741 1.00 24.32 C ATOM 1214 CD2 LEU A 676 4.501 9.573 14.942 1.00 25.40 C ATOM 1215 H LEU A 676 4.234 8.478 10.856 1.00 0.00 H ATOM 1216 N ALA A 677 1.114 8.363 11.155 1.00 29.28 N ATOM 1217 CA ALA A 677 -0.301 8.354 10.791 1.00 30.02 C ATOM 1218 C ALA A 677 -0.973 7.001 10.978 1.00 31.71 C ATOM 1219 O ALA A 677 -2.144 6.932 11.344 1.00 37.15 O ATOM 1220 CB ALA A 677 -0.471 8.829 9.358 1.00 31.25 C ATOM 1221 H ALA A 677 1.815 8.622 10.432 1.00 0.00 H ATOM 1222 N LYS A 678 -0.236 5.927 10.727 1.00 30.90 N ATOM 1223 CA LYS A 678 -0.834 4.599 10.738 1.00 34.61 C ATOM 1224 C LYS A 678 -0.787 3.898 12.100 1.00 33.29 C ATOM 1225 O LYS A 678 -1.060 2.702 12.187 1.00 33.48 O ATOM 1226 CB LYS A 678 -0.191 3.722 9.661 1.00 40.39 C ATOM 1227 CG LYS A 678 1.272 3.397 9.903 1.00 48.22 C ATOM 1228 CD LYS A 678 1.875 2.757 8.660 1.00 56.57 C ATOM 1229 CE LYS A 678 2.923 1.711 9.002 1.00 59.20 C ATOM 1230 NZ LYS A 678 3.086 0.736 7.882 1.00 62.98 N ATOM 1231 HZ1 LYS A 678 2.180 0.258 7.706 1.00 0.00 H ATOM 1232 HZ2 LYS A 678 3.385 1.242 7.024 1.00 0.00 H ATOM 1233 HZ3 LYS A 678 3.807 0.032 8.139 1.00 0.00 H ATOM 1234 H LYS A 678 0.778 6.034 10.521 1.00 0.00 H ATOM 1235 N GLN A 679 -0.460 4.637 13.156 1.00 31.07 N ATOM 1236 CA GLN A 679 -0.430 4.069 14.507 1.00 34.39 C ATOM 1237 C GLN A 679 -0.865 5.087 15.563 1.00 32.42 C ATOM 1238 O GLN A 679 -1.086 6.260 15.255 1.00 29.67 O ATOM 1239 CB GLN A 679 0.967 3.534 14.830 1.00 32.78 C ATOM 1240 CG GLN A 679 2.077 4.578 14.725 1.00 30.86 C ATOM 1241 CD GLN A 679 2.221 5.423 15.984 1.00 29.46 C ATOM 1242 OE1 GLN A 679 2.603 4.920 17.041 1.00 30.04 O ATOM 1243 NE2 GLN A 679 1.912 6.713 15.873 1.00 28.19 N ATOM 1244 HE22 GLN A 679 1.593 7.095 14.960 1.00 0.00 H ATOM 1245 HE21 GLN A 679 1.989 7.339 16.700 1.00 0.00 H ATOM 1246 H GLN A 679 -0.220 5.640 13.020 1.00 0.00 H ATOM 1247 N THR A 680 -0.986 4.635 16.810 1.00 31.50 N ATOM 1248 CA THR A 680 -1.413 5.517 17.899 1.00 30.94 C ATOM 1249 C THR A 680 -0.554 5.394 19.150 1.00 31.01 C ATOM 1250 O THR A 680 -0.672 6.214 20.056 1.00 30.49 O ATOM 1251 CB THR A 680 -2.888 5.285 18.297 1.00 36.07 C ATOM 1252 OG1 THR A 680 -3.097 3.895 18.572 1.00 38.30 O ATOM 1253 CG2 THR A 680 -3.826 5.728 17.187 1.00 42.13 C ATOM 1254 HG1 THR A 680 -2.886 3.364 17.763 1.00 0.00 H ATOM 1255 H THR A 680 -0.773 3.638 17.014 1.00 0.00 H ATOM 1256 N LYS A 681 0.291 4.366 19.206 1.00 33.02 N ATOM 1257 CA LYS A 681 1.194 4.180 20.345 1.00 35.04 C ATOM 1258 C LYS A 681 2.088 5.399 20.553 1.00 35.50 C ATOM 1259 O LYS A 681 2.260 5.869 21.679 1.00 30.36 O ATOM 1260 CB LYS A 681 2.053 2.928 20.162 1.00 45.83 C ATOM 1261 CG LYS A 681 2.976 2.651 21.344 1.00 54.08 C ATOM 1262 CD LYS A 681 3.798 1.393 21.129 1.00 61.18 C ATOM 1263 CE LYS A 681 4.577 1.012 22.376 1.00 65.62 C ATOM 1264 NZ LYS A 681 5.316 -0.269 22.184 1.00 69.47 N ATOM 1265 HZ1 LYS A 681 4.639 -1.030 21.971 1.00 0.00 H ATOM 1266 HZ2 LYS A 681 5.985 -0.167 21.394 1.00 0.00 H ATOM 1267 HZ3 LYS A 681 5.837 -0.501 23.054 1.00 0.00 H ATOM 1268 H LYS A 681 0.310 3.680 18.424 1.00 0.00 H ATOM 1269 N ILE A 682 2.666 5.902 19.464 1.00 29.49 N ATOM 1270 CA ILE A 682 3.397 7.156 19.522 1.00 28.02 C ATOM 1271 C ILE A 682 2.399 8.270 19.260 1.00 38.36 C ATOM 1272 O ILE A 682 1.841 8.378 18.165 1.00 26.90 O ATOM 1273 CB ILE A 682 4.518 7.245 18.469 1.00 27.44 C ATOM 1274 CG1 ILE A 682 5.500 6.081 18.610 1.00 36.72 C ATOM 1275 CG2 ILE A 682 5.254 8.577 18.596 1.00 26.00 C ATOM 1276 CD1 ILE A 682 6.518 6.019 17.482 1.00 37.05 C ATOM 1277 H ILE A 682 2.593 5.391 18.561 1.00 0.00 H ATOM 1278 N GLU A 683 2.160 9.084 20.276 1.00 26.67 N ATOM 1279 CA GLU A 683 1.212 10.178 20.160 1.00 25.92 C ATOM 1280 C GLU A 683 1.895 11.341 19.439 1.00 24.43 C ATOM 1281 O GLU A 683 3.118 11.477 19.487 1.00 25.78 O ATOM 1282 CB GLU A 683 0.735 10.580 21.557 1.00 36.84 C ATOM 1283 CG GLU A 683 -0.165 11.797 21.627 1.00 41.45 C ATOM 1284 CD GLU A 683 -0.364 12.271 23.055 1.00 49.36 C ATOM 1285 OE1 GLU A 683 -0.554 11.410 23.940 1.00 57.65 O ATOM 1286 OE2 GLU A 683 -0.324 13.498 23.295 1.00 46.95 O ATOM 1287 H GLU A 683 2.661 8.937 21.175 1.00 0.00 H ATOM 1288 N TYR A 684 1.119 12.162 18.746 1.00 23.80 N ATOM 1289 CA TYR A 684 1.691 13.295 18.034 1.00 22.49 C ATOM 1290 C TYR A 684 0.722 14.459 17.988 1.00 24.27 C ATOM 1291 O TYR A 684 -0.489 14.275 18.122 1.00 27.52 O ATOM 1292 CB TYR A 684 2.106 12.901 16.615 1.00 22.45 C ATOM 1293 CG TYR A 684 0.997 12.249 15.819 1.00 28.15 C ATOM 1294 CD1 TYR A 684 0.117 13.014 15.057 1.00 25.11 C ATOM 1295 CD2 TYR A 684 0.834 10.871 15.823 1.00 26.85 C ATOM 1296 CE1 TYR A 684 -0.900 12.418 14.326 1.00 27.87 C ATOM 1297 CE2 TYR A 684 -0.182 10.265 15.094 1.00 26.87 C ATOM 1298 CZ TYR A 684 -1.042 11.050 14.345 1.00 27.42 C ATOM 1299 OH TYR A 684 -2.051 10.466 13.617 1.00 29.99 O ATOM 1300 HH TYR A 684 -2.652 9.969 14.227 1.00 0.00 H ATOM 1301 H TYR A 684 0.093 11.995 18.711 1.00 0.00 H ATOM 1302 N GLY A 685 1.259 15.655 17.781 1.00 21.57 N ATOM 1303 CA GLY A 685 0.444 16.850 17.814 1.00 20.18 C ATOM 1304 C GLY A 685 1.200 18.075 17.353 1.00 24.74 C ATOM 1305 O GLY A 685 2.236 17.973 16.683 1.00 23.53 O ATOM 1306 H GLY A 685 2.279 15.734 17.593 1.00 0.00 H ATOM 1307 N ALA A 686 0.679 19.238 17.731 1.00 18.45 N ATOM 1308 CA ALA A 686 1.207 20.510 17.270 1.00 19.08 C ATOM 1309 C ALA A 686 0.778 21.610 18.242 1.00 17.07 C ATOM 1310 O ALA A 686 -0.039 21.370 19.139 1.00 18.79 O ATOM 1311 CB ALA A 686 0.696 20.809 15.862 1.00 17.21 C ATOM 1312 H ALA A 686 -0.134 19.237 18.379 1.00 0.00 H ATOM 1313 N VAL A 687 1.319 22.811 18.065 1.00 16.14 N ATOM 1314 CA VAL A 687 0.937 23.940 18.910 1.00 15.90 C ATOM 1315 C VAL A 687 -0.486 24.387 18.595 1.00 16.56 C ATOM 1316 O VAL A 687 -0.827 24.646 17.433 1.00 16.59 O ATOM 1317 CB VAL A 687 1.898 25.130 18.751 1.00 16.18 C ATOM 1318 CG1 VAL A 687 1.380 26.355 19.532 1.00 18.06 C ATOM 1319 CG2 VAL A 687 3.306 24.748 19.205 1.00 15.18 C ATOM 1320 H VAL A 687 2.025 22.949 17.314 1.00 0.00 H ATOM 1321 N LYS A 688 -1.317 24.472 19.629 1.00 17.40 N ATOM 1322 CA LYS A 688 -2.711 24.862 19.449 1.00 22.10 C ATOM 1323 C LYS A 688 -2.818 26.285 18.900 1.00 16.81 C ATOM 1324 O LYS A 688 -2.126 27.184 19.366 1.00 18.64 O ATOM 1325 CB LYS A 688 -3.473 24.744 20.772 1.00 25.15 C ATOM 1326 CG LYS A 688 -4.950 25.081 20.653 1.00 33.57 C ATOM 1327 CD LYS A 688 -5.676 24.883 21.973 1.00 41.33 C ATOM 1328 CE LYS A 688 -7.157 25.176 21.832 1.00 41.27 C ATOM 1329 NZ LYS A 688 -7.823 25.288 23.164 1.00 47.47 N ATOM 1330 HZ1 LYS A 688 -7.712 24.393 23.682 1.00 0.00 H ATOM 1331 HZ2 LYS A 688 -7.385 26.060 23.706 1.00 0.00 H ATOM 1332 HZ3 LYS A 688 -8.834 25.489 23.029 1.00 0.00 H ATOM 1333 H LYS A 688 -0.967 24.256 20.584 1.00 0.00 H ATOM 1334 N ASP A 689 -3.679 26.469 17.900 1.00 18.77 N ATOM 1335 CA ASP A 689 -3.943 27.779 17.283 1.00 22.80 C ATOM 1336 C ASP A 689 -2.746 28.380 16.559 1.00 24.06 C ATOM 1337 O ASP A 689 -2.613 29.609 16.450 1.00 21.16 O ATOM 1338 CB ASP A 689 -4.534 28.761 18.298 1.00 25.45 C ATOM 1339 CG ASP A 689 -5.892 28.312 18.800 1.00 28.56 C ATOM 1340 OD1 ASP A 689 -6.564 27.575 18.052 1.00 29.16 O ATOM 1341 OD2 ASP A 689 -6.280 28.679 19.929 1.00 30.24 O ATOM 1342 H ASP A 689 -4.193 25.642 17.535 1.00 0.00 H ATOM 1343 N GLY A 690 -1.884 27.500 16.060 1.00 20.19 N ATOM 1344 CA GLY A 690 -0.778 27.901 15.211 1.00 19.90 C ATOM 1345 C GLY A 690 -0.991 27.466 13.766 1.00 22.23 C ATOM 1346 O GLY A 690 -1.961 26.776 13.445 1.00 15.48 O ATOM 1347 H GLY A 690 -2.006 26.492 16.285 1.00 0.00 H ATOM 1348 N ALA A 691 -0.065 27.849 12.898 1.00 20.13 N ATOM 1349 CA ALA A 691 -0.178 27.548 11.478 1.00 14.37 C ATOM 1350 C ALA A 691 -0.066 26.063 11.193 1.00 14.96 C ATOM 1351 O ALA A 691 -0.700 25.545 10.265 1.00 15.64 O ATOM 1352 CB ALA A 691 0.875 28.322 10.698 1.00 13.70 C ATOM 1353 H ALA A 691 0.763 28.378 13.240 1.00 0.00 H ATOM 1354 N THR A 692 0.736 25.360 11.982 1.00 18.34 N ATOM 1355 CA THR A 692 0.899 23.929 11.743 1.00 19.13 C ATOM 1356 C THR A 692 -0.393 23.167 12.035 1.00 18.85 C ATOM 1357 O THR A 692 -0.808 22.307 11.245 1.00 17.13 O ATOM 1358 CB THR A 692 2.048 23.335 12.562 1.00 18.17 C ATOM 1359 OG1 THR A 692 3.270 23.997 12.210 1.00 14.50 O ATOM 1360 CG2 THR A 692 2.182 21.853 12.257 1.00 17.72 C ATOM 1361 HG1 THR A 692 3.188 24.964 12.405 1.00 0.00 H ATOM 1362 H THR A 692 1.243 25.823 12.763 1.00 0.00 H ATOM 1363 N MET A 693 -1.024 23.475 13.167 1.00 17.18 N ATOM 1364 CA MET A 693 -2.340 22.909 13.475 1.00 17.55 C ATOM 1365 C MET A 693 -3.309 23.166 12.325 1.00 17.94 C ATOM 1366 O MET A 693 -3.978 22.246 11.843 1.00 18.87 O ATOM 1367 CB MET A 693 -2.906 23.523 14.758 1.00 18.23 C ATOM 1368 CG MET A 693 -4.217 22.897 15.221 1.00 23.03 C ATOM 1369 SD MET A 693 -5.222 24.067 16.168 1.00 24.49 S ATOM 1370 CE MET A 693 -5.748 25.173 14.853 1.00 26.59 C ATOM 1371 H MET A 693 -0.576 24.127 13.842 1.00 0.00 H ATOM 1372 N THR A 694 -3.377 24.419 11.880 1.00 17.42 N ATOM 1373 CA THR A 694 -4.317 24.790 10.825 1.00 17.97 C ATOM 1374 C THR A 694 -4.002 24.042 9.520 1.00 18.34 C ATOM 1375 O THR A 694 -4.909 23.647 8.801 1.00 19.28 O ATOM 1376 CB THR A 694 -4.357 26.324 10.604 1.00 24.25 C ATOM 1377 OG1 THR A 694 -4.810 26.969 11.805 1.00 23.45 O ATOM 1378 CG2 THR A 694 -5.305 26.691 9.461 1.00 26.34 C ATOM 1379 HG1 THR A 694 -5.717 26.644 12.031 1.00 0.00 H ATOM 1380 H THR A 694 -2.753 25.143 12.289 1.00 0.00 H ATOM 1381 N PHE A 695 -2.717 23.846 9.233 1.00 20.49 N ATOM 1382 CA PHE A 695 -2.303 23.113 8.042 1.00 18.14 C ATOM 1383 C PHE A 695 -2.920 21.712 8.035 1.00 19.22 C ATOM 1384 O PHE A 695 -3.513 21.285 7.044 1.00 20.93 O ATOM 1385 CB PHE A 695 -0.775 23.029 7.973 1.00 17.41 C ATOM 1386 CG PHE A 695 -0.265 22.075 6.923 1.00 26.83 C ATOM 1387 CD1 PHE A 695 -0.077 22.500 5.613 1.00 26.59 C ATOM 1388 CD2 PHE A 695 0.034 20.757 7.244 1.00 21.77 C ATOM 1389 CE1 PHE A 695 0.398 21.629 4.638 1.00 26.97 C ATOM 1390 CE2 PHE A 695 0.504 19.874 6.272 1.00 21.24 C ATOM 1391 CZ PHE A 695 0.686 20.316 4.965 1.00 24.36 C ATOM 1392 H PHE A 695 -1.991 24.225 9.874 1.00 0.00 H ATOM 1393 N PHE A 696 -2.815 21.004 9.151 1.00 19.27 N ATOM 1394 CA PHE A 696 -3.420 19.671 9.230 1.00 20.38 C ATOM 1395 C PHE A 696 -4.940 19.717 9.215 1.00 26.16 C ATOM 1396 O PHE A 696 -5.587 18.890 8.573 1.00 23.92 O ATOM 1397 CB PHE A 696 -2.920 18.927 10.468 1.00 20.32 C ATOM 1398 CG PHE A 696 -1.534 18.387 10.304 1.00 22.72 C ATOM 1399 CD1 PHE A 696 -1.330 17.146 9.721 1.00 20.80 C ATOM 1400 CD2 PHE A 696 -0.433 19.138 10.683 1.00 21.53 C ATOM 1401 CE1 PHE A 696 -0.048 16.646 9.541 1.00 20.62 C ATOM 1402 CE2 PHE A 696 0.852 18.646 10.506 1.00 20.73 C ATOM 1403 CZ PHE A 696 1.040 17.392 9.937 1.00 19.58 C ATOM 1404 H PHE A 696 -2.304 21.394 9.969 1.00 0.00 H ATOM 1405 N LYS A 697 -5.508 20.683 9.928 1.00 24.19 N ATOM 1406 CA LYS A 697 -6.957 20.836 9.971 1.00 24.10 C ATOM 1407 C LYS A 697 -7.548 21.034 8.571 1.00 24.57 C ATOM 1408 O LYS A 697 -8.594 20.482 8.249 1.00 25.20 O ATOM 1409 CB LYS A 697 -7.327 22.010 10.881 1.00 25.58 C ATOM 1410 CG LYS A 697 -8.822 22.186 11.091 1.00 25.43 C ATOM 1411 CD LYS A 697 -9.091 23.242 12.163 1.00 27.83 C ATOM 1412 CE LYS A 697 -10.582 23.316 12.488 1.00 38.89 C ATOM 1413 NZ LYS A 697 -10.885 24.345 13.521 1.00 45.16 N ATOM 1414 HZ1 LYS A 697 -10.375 24.115 14.398 1.00 0.00 H ATOM 1415 HZ2 LYS A 697 -10.583 25.279 13.177 1.00 0.00 H ATOM 1416 HZ3 LYS A 697 -11.908 24.357 13.707 1.00 0.00 H ATOM 1417 H LYS A 697 -4.909 21.342 10.465 1.00 0.00 H ATOM 1418 N LYS A 698 -6.864 21.801 7.729 1.00 26.17 N ATOM 1419 CA LYS A 698 -7.415 22.116 6.414 1.00 28.63 C ATOM 1420 C LYS A 698 -6.898 21.224 5.278 1.00 28.63 C ATOM 1421 O LYS A 698 -7.321 21.375 4.131 1.00 25.06 O ATOM 1422 CB LYS A 698 -7.212 23.610 6.087 1.00 28.34 C ATOM 1423 CG LYS A 698 -8.075 24.558 6.948 1.00 31.82 C ATOM 1424 CD LYS A 698 -7.795 26.034 6.662 1.00 41.70 C ATOM 1425 CE LYS A 698 -8.684 26.596 5.545 1.00 45.95 C ATOM 1426 NZ LYS A 698 -10.065 26.926 6.007 1.00 47.20 N ATOM 1427 HZ1 LYS A 698 -10.522 26.066 6.372 1.00 0.00 H ATOM 1428 HZ2 LYS A 698 -10.015 27.640 6.761 1.00 0.00 H ATOM 1429 HZ3 LYS A 698 -10.616 27.301 5.209 1.00 0.00 H ATOM 1430 H LYS A 698 -5.935 22.177 8.007 1.00 0.00 H ATOM 1431 N SER A 699 -6.010 20.283 5.590 1.00 22.80 N ATOM 1432 CA SER A 699 -5.363 19.487 4.542 1.00 28.52 C ATOM 1433 C SER A 699 -6.326 18.610 3.739 1.00 30.60 C ATOM 1434 O SER A 699 -7.278 18.051 4.280 1.00 26.64 O ATOM 1435 CB SER A 699 -4.254 18.612 5.138 1.00 30.52 C ATOM 1436 OG SER A 699 -3.570 17.903 4.115 1.00 30.87 O ATOM 1437 HG SER A 699 -3.165 18.548 3.483 1.00 0.00 H ATOM 1438 H SER A 699 -5.772 20.110 6.588 1.00 0.00 H ATOM 1439 N LYS A 700 -6.071 18.489 2.442 1.00 25.38 N ATOM 1440 CA LYS A 700 -6.813 17.534 1.620 1.00 27.95 C ATOM 1441 C LYS A 700 -5.952 16.303 1.317 1.00 29.83 C ATOM 1442 O LYS A 700 -6.345 15.432 0.539 1.00 28.73 O ATOM 1443 CB LYS A 700 -7.297 18.195 0.328 1.00 28.99 C ATOM 1444 CG LYS A 700 -8.168 19.424 0.568 1.00 31.96 C ATOM 1445 CD LYS A 700 -8.695 20.002 -0.728 1.00 37.34 C ATOM 1446 CE LYS A 700 -9.509 21.268 -0.474 1.00 40.82 C ATOM 1447 NZ LYS A 700 -10.651 21.019 0.449 1.00 42.24 N ATOM 1448 HZ1 LYS A 700 -11.281 20.304 0.033 1.00 0.00 H ATOM 1449 HZ2 LYS A 700 -10.289 20.676 1.362 1.00 0.00 H ATOM 1450 HZ3 LYS A 700 -11.177 21.904 0.594 1.00 0.00 H ATOM 1451 H LYS A 700 -5.335 19.080 2.005 1.00 0.00 H ATOM 1452 N ILE A 701 -4.772 16.245 1.934 1.00 27.86 N ATOM 1453 CA ILE A 701 -3.892 15.081 1.794 1.00 29.89 C ATOM 1454 C ILE A 701 -4.364 13.981 2.742 1.00 29.23 C ATOM 1455 O ILE A 701 -4.563 14.236 3.928 1.00 29.88 O ATOM 1456 CB ILE A 701 -2.422 15.448 2.099 1.00 25.48 C ATOM 1457 CG1 ILE A 701 -1.948 16.583 1.180 1.00 24.98 C ATOM 1458 CG2 ILE A 701 -1.515 14.217 1.989 1.00 31.20 C ATOM 1459 CD1 ILE A 701 -1.821 16.198 -0.287 1.00 30.63 C ATOM 1460 H ILE A 701 -4.469 17.043 2.528 1.00 0.00 H ATOM 1461 N SER A 702 -4.544 12.765 2.230 1.00 28.61 N ATOM 1462 CA SER A 702 -5.171 11.693 3.014 1.00 38.92 C ATOM 1463 C SER A 702 -4.437 11.370 4.325 1.00 31.45 C ATOM 1464 O SER A 702 -5.063 11.211 5.374 1.00 29.57 O ATOM 1465 CB SER A 702 -5.349 10.427 2.169 1.00 45.18 C ATOM 1466 OG SER A 702 -4.143 9.690 2.093 1.00 52.01 O ATOM 1467 HG SER A 702 -3.440 10.251 1.679 1.00 0.00 H ATOM 1468 H SER A 702 -4.235 12.571 1.256 1.00 0.00 H ATOM 1469 N THR A 703 -3.114 11.280 4.268 1.00 30.72 N ATOM 1470 CA THR A 703 -2.325 11.010 5.469 1.00 30.62 C ATOM 1471 C THR A 703 -2.508 12.106 6.534 1.00 26.10 C ATOM 1472 O THR A 703 -2.675 11.818 7.722 1.00 26.04 O ATOM 1473 CB THR A 703 -0.829 10.861 5.128 1.00 33.53 C ATOM 1474 OG1 THR A 703 -0.629 9.668 4.360 1.00 36.13 O ATOM 1475 CG2 THR A 703 0.008 10.783 6.390 1.00 31.58 C ATOM 1476 HG1 THR A 703 -1.154 9.724 3.523 1.00 0.00 H ATOM 1477 H THR A 703 -2.631 11.403 3.355 1.00 0.00 H ATOM 1478 N PHE A 704 -2.493 13.361 6.098 1.00 25.23 N ATOM 1479 CA PHE A 704 -2.608 14.489 7.025 1.00 30.97 C ATOM 1480 C PHE A 704 -4.010 14.592 7.615 1.00 27.38 C ATOM 1481 O PHE A 704 -4.165 14.991 8.770 1.00 24.07 O ATOM 1482 CB PHE A 704 -2.203 15.798 6.342 1.00 23.14 C ATOM 1483 CG PHE A 704 -0.829 15.756 5.736 1.00 29.84 C ATOM 1484 CD1 PHE A 704 0.116 14.834 6.187 1.00 29.99 C ATOM 1485 CD2 PHE A 704 -0.476 16.630 4.721 1.00 22.39 C ATOM 1486 CE1 PHE A 704 1.386 14.787 5.627 1.00 30.20 C ATOM 1487 CE2 PHE A 704 0.791 16.587 4.157 1.00 22.18 C ATOM 1488 CZ PHE A 704 1.720 15.659 4.609 1.00 22.33 C ATOM 1489 H PHE A 704 -2.398 13.546 5.079 1.00 0.00 H ATOM 1490 N GLU A 705 -5.018 14.238 6.814 1.00 32.46 N ATOM 1491 CA GLU A 705 -6.396 14.131 7.284 1.00 26.54 C ATOM 1492 C GLU A 705 -6.491 13.101 8.408 1.00 27.08 C ATOM 1493 O GLU A 705 -7.131 13.343 9.433 1.00 28.82 O ATOM 1494 CB GLU A 705 -7.332 13.715 6.137 1.00 30.60 C ATOM 1495 CG GLU A 705 -7.523 14.765 5.040 1.00 36.04 C ATOM 1496 CD GLU A 705 -8.539 14.331 3.980 1.00 42.39 C ATOM 1497 OE1 GLU A 705 -8.916 13.142 3.961 1.00 46.94 O ATOM 1498 OE2 GLU A 705 -8.963 15.180 3.170 1.00 43.24 O ATOM 1499 H GLU A 705 -4.813 14.030 5.816 1.00 0.00 H ATOM 1500 N LYS A 706 -5.872 11.941 8.206 1.00 27.65 N ATOM 1501 CA LYS A 706 -5.831 10.917 9.247 1.00 36.92 C ATOM 1502 C LYS A 706 -5.176 11.484 10.497 1.00 27.12 C ATOM 1503 O LYS A 706 -5.671 11.300 11.612 1.00 27.80 O ATOM 1504 CB LYS A 706 -5.049 9.689 8.773 1.00 43.43 C ATOM 1505 CG LYS A 706 -5.816 8.760 7.839 1.00 50.35 C ATOM 1506 CD LYS A 706 -5.010 7.495 7.560 1.00 56.78 C ATOM 1507 CE LYS A 706 -4.547 6.845 8.857 1.00 60.66 C ATOM 1508 NZ LYS A 706 -3.772 5.593 8.619 1.00 64.65 N ATOM 1509 HZ1 LYS A 706 -4.368 4.909 8.111 1.00 0.00 H ATOM 1510 HZ2 LYS A 706 -2.930 5.811 8.049 1.00 0.00 H ATOM 1511 HZ3 LYS A 706 -3.480 5.189 9.532 1.00 0.00 H ATOM 1512 H LYS A 706 -5.410 11.760 7.292 1.00 0.00 H ATOM 1513 N MET A 707 -4.066 12.185 10.305 1.00 25.90 N ATOM 1514 CA MET A 707 -3.340 12.764 11.426 1.00 24.97 C ATOM 1515 C MET A 707 -4.174 13.807 12.151 1.00 24.45 C ATOM 1516 O MET A 707 -4.182 13.846 13.381 1.00 25.51 O ATOM 1517 CB MET A 707 -1.993 13.338 10.971 1.00 23.76 C ATOM 1518 CG MET A 707 -1.017 12.247 10.530 1.00 28.98 C ATOM 1519 SD MET A 707 0.499 12.872 9.794 1.00 27.29 S ATOM 1520 CE MET A 707 1.282 13.612 11.231 1.00 22.56 C ATOM 1521 H MET A 707 -3.709 12.323 9.338 1.00 0.00 H ATOM 1522 N TRP A 708 -4.896 14.634 11.399 1.00 28.34 N ATOM 1523 CA TRP A 708 -5.747 15.634 12.029 1.00 24.09 C ATOM 1524 C TRP A 708 -6.857 14.974 12.841 1.00 29.93 C ATOM 1525 O TRP A 708 -7.166 15.419 13.945 1.00 30.68 O ATOM 1526 CB TRP A 708 -6.352 16.591 11.002 1.00 23.94 C ATOM 1527 CG TRP A 708 -7.310 17.535 11.656 1.00 28.98 C ATOM 1528 CD1 TRP A 708 -8.654 17.628 11.438 1.00 29.10 C ATOM 1529 CD2 TRP A 708 -7.004 18.484 12.690 1.00 24.55 C ATOM 1530 NE1 TRP A 708 -9.197 18.598 12.253 1.00 26.25 N ATOM 1531 CE2 TRP A 708 -8.203 19.138 13.027 1.00 23.57 C ATOM 1532 CE3 TRP A 708 -5.827 18.856 13.348 1.00 24.45 C ATOM 1533 CZ2 TRP A 708 -8.262 20.139 13.999 1.00 24.67 C ATOM 1534 CZ3 TRP A 708 -5.884 19.858 14.310 1.00 28.51 C ATOM 1535 CH2 TRP A 708 -7.093 20.484 14.628 1.00 23.31 C ATOM 1536 HE1 TRP A 708 -10.199 18.875 12.277 1.00 0.00 H ATOM 1537 H TRP A 708 -4.853 14.566 10.362 1.00 0.00 H ATOM 1538 N ALA A 709 -7.450 13.914 12.292 1.00 29.86 N ATOM 1539 CA ALA A 709 -8.510 13.175 12.981 1.00 34.09 C ATOM 1540 C ALA A 709 -8.064 12.667 14.357 1.00 32.82 C ATOM 1541 O ALA A 709 -8.833 12.694 15.318 1.00 32.09 O ATOM 1542 CB ALA A 709 -9.002 12.014 12.119 1.00 29.23 C ATOM 1543 H ALA A 709 -7.151 13.602 11.346 1.00 0.00 H ATOM 1544 N PHE A 710 -6.820 12.207 14.446 1.00 27.41 N ATOM 1545 CA PHE A 710 -6.266 11.726 15.711 1.00 27.51 C ATOM 1546 C PHE A 710 -5.936 12.877 16.656 1.00 29.23 C ATOM 1547 O PHE A 710 -6.297 12.859 17.836 1.00 28.18 O ATOM 1548 CB PHE A 710 -4.995 10.917 15.461 1.00 38.79 C ATOM 1549 CG PHE A 710 -4.283 10.518 16.720 1.00 38.95 C ATOM 1550 CD1 PHE A 710 -4.738 9.445 17.470 1.00 38.42 C ATOM 1551 CD2 PHE A 710 -3.170 11.221 17.164 1.00 40.27 C ATOM 1552 CE1 PHE A 710 -4.099 9.072 18.635 1.00 38.60 C ATOM 1553 CE2 PHE A 710 -2.528 10.854 18.335 1.00 39.87 C ATOM 1554 CZ PHE A 710 -2.993 9.776 19.067 1.00 40.62 C ATOM 1555 H PHE A 710 -6.225 12.189 13.593 1.00 0.00 H ATOM 1556 N MET A 711 -5.217 13.858 16.120 1.00 25.16 N ATOM 1557 CA MET A 711 -4.774 15.036 16.859 1.00 32.65 C ATOM 1558 C MET A 711 -5.924 15.739 17.558 1.00 34.13 C ATOM 1559 O MET A 711 -5.800 16.158 18.710 1.00 37.72 O ATOM 1560 CB MET A 711 -4.158 16.032 15.885 1.00 33.61 C ATOM 1561 CG MET A 711 -2.671 16.173 15.953 1.00 36.62 C ATOM 1562 SD MET A 711 -2.174 17.430 14.762 1.00 33.12 S ATOM 1563 CE MET A 711 -1.971 16.411 13.306 1.00 33.55 C ATOM 1564 H MET A 711 -4.955 13.782 15.116 1.00 0.00 H ATOM 1565 N SER A 712 -7.035 15.876 16.839 1.00 31.76 N ATOM 1566 CA SER A 712 -8.170 16.666 17.296 1.00 36.46 C ATOM 1567 C SER A 712 -9.087 15.885 18.236 1.00 42.47 C ATOM 1568 O SER A 712 -10.000 16.456 18.833 1.00 43.89 O ATOM 1569 CB SER A 712 -8.960 17.194 16.094 1.00 34.02 C ATOM 1570 OG SER A 712 -9.342 16.144 15.223 1.00 40.30 O ATOM 1571 HG SER A 712 -8.532 15.683 14.889 1.00 0.00 H ATOM 1572 H SER A 712 -7.095 15.401 15.916 1.00 0.00 H ATOM 1573 N SER A 713 -8.836 14.583 18.361 1.00 45.68 N ATOM 1574 CA SER A 713 -9.609 13.721 19.254 1.00 51.10 C ATOM 1575 C SER A 713 -8.837 13.448 20.541 1.00 52.10 C ATOM 1576 O SER A 713 -9.401 12.978 21.526 1.00 52.52 O ATOM 1577 CB SER A 713 -9.911 12.389 18.570 1.00 55.63 C ATOM 1578 OG SER A 713 -8.763 11.551 18.599 1.00 59.28 O ATOM 1579 HG SER A 713 -8.018 11.998 18.125 1.00 0.00 H ATOM 1580 H SER A 713 -8.063 14.165 17.804 1.00 0.00 H ATOM 1581 N LYS A 714 -7.537 13.725 20.515 1.00 52.07 N ATOM 1582 CA LYS A 714 -6.669 13.489 21.659 1.00 54.60 C ATOM 1583 C LYS A 714 -6.404 14.838 22.318 1.00 56.37 C ATOM 1584 O LYS A 714 -5.613 15.634 21.808 1.00 54.29 O ATOM 1585 CB LYS A 714 -5.357 12.845 21.193 1.00 55.61 C ATOM 1586 CG LYS A 714 -4.482 12.283 22.303 1.00 58.64 C ATOM 1587 CD LYS A 714 -5.011 10.949 22.817 1.00 62.75 C ATOM 1588 CE LYS A 714 -4.092 10.354 23.881 1.00 64.60 C ATOM 1589 NZ LYS A 714 -2.699 10.163 23.380 1.00 65.42 N ATOM 1590 HZ1 LYS A 714 -2.711 9.517 22.565 1.00 0.00 H ATOM 1591 HZ2 LYS A 714 -2.307 11.082 23.091 1.00 0.00 H ATOM 1592 HZ3 LYS A 714 -2.112 9.757 24.137 1.00 0.00 H ATOM 1593 H LYS A 714 -7.126 14.124 19.647 1.00 0.00 H ATOM 1594 N PRO A 715 -7.068 15.105 23.457 1.00 59.26 N ATOM 1595 CA PRO A 715 -7.029 16.431 24.093 1.00 57.60 C ATOM 1596 C PRO A 715 -5.647 16.828 24.629 1.00 53.70 C ATOM 1597 O PRO A 715 -5.449 17.975 25.026 1.00 52.78 O ATOM 1598 CB PRO A 715 -8.042 16.298 25.240 1.00 59.49 C ATOM 1599 CG PRO A 715 -8.077 14.836 25.546 1.00 61.03 C ATOM 1600 CD PRO A 715 -7.877 14.142 24.229 1.00 59.57 C ATOM 1601 N SER A 716 -4.705 15.891 24.635 1.00 51.68 N ATOM 1602 CA SER A 716 -3.347 16.176 25.086 1.00 46.40 C ATOM 1603 C SER A 716 -2.442 16.566 23.924 1.00 41.69 C ATOM 1604 O SER A 716 -1.417 17.221 24.116 1.00 40.71 O ATOM 1605 CB SER A 716 -2.763 14.959 25.809 1.00 50.09 C ATOM 1606 OG SER A 716 -2.828 13.794 24.999 1.00 49.35 O ATOM 1607 HG SER A 716 -2.313 13.943 24.167 1.00 0.00 H ATOM 1608 H SER A 716 -4.941 14.932 24.310 1.00 0.00 H ATOM 1609 N ALA A 717 -2.831 16.169 22.715 1.00 39.85 N ATOM 1610 CA ALA A 717 -1.975 16.323 21.541 1.00 29.50 C ATOM 1611 C ALA A 717 -1.646 17.773 21.197 1.00 26.90 C ATOM 1612 O ALA A 717 -0.524 18.080 20.785 1.00 27.66 O ATOM 1613 CB ALA A 717 -2.592 15.620 20.345 1.00 27.99 C ATOM 1614 H ALA A 717 -3.770 15.737 22.603 1.00 0.00 H ATOM 1615 N LEU A 718 -2.619 18.666 21.351 1.00 22.52 N ATOM 1616 CA LEU A 718 -2.405 20.059 20.970 1.00 20.34 C ATOM 1617 C LEU A 718 -1.912 20.849 22.169 1.00 28.26 C ATOM 1618 O LEU A 718 -2.640 21.031 23.143 1.00 33.03 O ATOM 1619 CB LEU A 718 -3.677 20.679 20.377 1.00 26.91 C ATOM 1620 CG LEU A 718 -4.248 19.995 19.125 1.00 29.65 C ATOM 1621 CD1 LEU A 718 -5.356 20.832 18.496 1.00 33.68 C ATOM 1622 CD2 LEU A 718 -3.167 19.703 18.099 1.00 24.55 C ATOM 1623 H LEU A 718 -3.536 18.371 21.744 1.00 0.00 H ATOM 1624 N VAL A 719 -0.670 21.317 22.093 1.00 19.09 N ATOM 1625 CA VAL A 719 -0.014 21.927 23.242 1.00 18.92 C ATOM 1626 C VAL A 719 -0.127 23.450 23.215 1.00 26.25 C ATOM 1627 O VAL A 719 -0.370 24.045 22.161 1.00 20.01 O ATOM 1628 CB VAL A 719 1.463 21.504 23.329 1.00 23.91 C ATOM 1629 CG1 VAL A 719 1.579 19.987 23.527 1.00 19.51 C ATOM 1630 CG2 VAL A 719 2.221 21.962 22.080 1.00 17.45 C ATOM 1631 H VAL A 719 -0.155 21.246 21.192 1.00 0.00 H ATOM 1632 N LYS A 720 0.052 24.071 24.380 1.00 22.98 N ATOM 1633 CA LYS A 720 -0.141 25.513 24.532 1.00 23.58 C ATOM 1634 C LYS A 720 0.900 26.314 23.775 1.00 25.00 C ATOM 1635 O LYS A 720 0.603 27.383 23.216 1.00 22.78 O ATOM 1636 CB LYS A 720 -0.098 25.887 26.009 1.00 25.92 C ATOM 1637 CG LYS A 720 -0.261 27.368 26.302 1.00 34.20 C ATOM 1638 CD LYS A 720 -0.028 27.641 27.786 1.00 38.86 C ATOM 1639 CE LYS A 720 -0.323 29.091 28.154 1.00 43.35 C ATOM 1640 NZ LYS A 720 -1.765 29.433 28.007 1.00 44.06 N ATOM 1641 HZ1 LYS A 720 -2.056 29.287 27.019 1.00 0.00 H ATOM 1642 HZ2 LYS A 720 -2.330 28.822 28.630 1.00 0.00 H ATOM 1643 HZ3 LYS A 720 -1.912 30.429 28.269 1.00 0.00 H ATOM 1644 H LYS A 720 0.338 23.512 25.209 1.00 0.00 H ATOM 1645 N ASN A 721 2.130 25.805 23.760 1.00 19.74 N ATOM 1646 CA ASN A 721 3.196 26.479 23.051 1.00 15.22 C ATOM 1647 C ASN A 721 4.349 25.540 22.726 1.00 17.45 C ATOM 1648 O ASN A 721 4.354 24.381 23.137 1.00 19.19 O ATOM 1649 CB ASN A 721 3.679 27.699 23.844 1.00 17.49 C ATOM 1650 CG ASN A 721 4.067 27.351 25.266 1.00 21.53 C ATOM 1651 OD1 ASN A 721 4.728 26.344 25.510 1.00 24.89 O ATOM 1652 ND2 ASN A 721 3.634 28.171 26.219 1.00 18.80 N ATOM 1653 HD22 ASN A 721 3.077 29.013 25.967 1.00 0.00 H ATOM 1654 HD21 ASN A 721 3.852 27.971 27.216 1.00 0.00 H ATOM 1655 H ASN A 721 2.326 24.916 24.262 1.00 0.00 H ATOM 1656 N ASN A 722 5.322 26.051 21.986 1.00 16.76 N ATOM 1657 CA ASN A 722 6.457 25.247 21.551 1.00 23.22 C ATOM 1658 C ASN A 722 7.193 24.602 22.702 1.00 19.74 C ATOM 1659 O ASN A 722 7.496 23.416 22.674 1.00 25.91 O ATOM 1660 CB ASN A 722 7.438 26.126 20.797 1.00 26.98 C ATOM 1661 CG ASN A 722 7.580 25.728 19.363 1.00 40.21 C ATOM 1662 OD1 ASN A 722 6.849 24.866 18.873 1.00 44.11 O ATOM 1663 ND2 ASN A 722 8.522 26.355 18.666 1.00 47.66 N ATOM 1664 HD22 ASN A 722 9.115 27.076 19.124 1.00 0.00 H ATOM 1665 HD21 ASN A 722 8.666 26.124 17.662 1.00 0.00 H ATOM 1666 H ASN A 722 5.275 27.052 21.708 1.00 0.00 H ATOM 1667 N GLU A 723 7.488 25.413 23.709 1.00 24.17 N ATOM 1668 CA GLU A 723 8.212 24.969 24.882 1.00 22.93 C ATOM 1669 C GLU A 723 7.515 23.783 25.527 1.00 26.47 C ATOM 1670 O GLU A 723 8.149 22.795 25.888 1.00 25.80 O ATOM 1671 CB GLU A 723 8.312 26.126 25.873 1.00 29.70 C ATOM 1672 CG GLU A 723 9.243 25.870 27.043 1.00 37.79 C ATOM 1673 CD GLU A 723 9.328 27.063 27.977 1.00 44.87 C ATOM 1674 OE1 GLU A 723 10.420 27.668 28.074 1.00 46.91 O ATOM 1675 OE2 GLU A 723 8.297 27.394 28.605 1.00 45.26 O ATOM 1676 H GLU A 723 7.188 26.407 23.654 1.00 0.00 H ATOM 1677 N GLU A 724 6.199 23.879 25.667 1.00 25.54 N ATOM 1678 CA GLU A 724 5.433 22.788 26.251 1.00 24.37 C ATOM 1679 C GLU A 724 5.445 21.565 25.327 1.00 18.22 C ATOM 1680 O GLU A 724 5.488 20.431 25.793 1.00 19.79 O ATOM 1681 CB GLU A 724 4.006 23.247 26.559 1.00 26.73 C ATOM 1682 CG GLU A 724 3.045 22.121 26.911 1.00 34.83 C ATOM 1683 CD GLU A 724 1.652 22.631 27.253 1.00 39.30 C ATOM 1684 OE1 GLU A 724 1.510 23.345 28.271 1.00 48.67 O ATOM 1685 OE2 GLU A 724 0.705 22.324 26.500 1.00 29.19 O ATOM 1686 H GLU A 724 5.710 24.743 25.356 1.00 0.00 H ATOM 1687 N GLY A 725 5.433 21.800 24.019 1.00 17.42 N ATOM 1688 CA GLY A 725 5.554 20.713 23.060 1.00 19.55 C ATOM 1689 C GLY A 725 6.904 20.010 23.147 1.00 19.34 C ATOM 1690 O GLY A 725 6.977 18.782 23.126 1.00 18.65 O ATOM 1691 H GLY A 725 5.336 22.777 23.676 1.00 0.00 H ATOM 1692 N ILE A 726 7.980 20.792 23.232 1.00 18.08 N ATOM 1693 CA ILE A 726 9.316 20.221 23.395 1.00 19.64 C ATOM 1694 C ILE A 726 9.417 19.423 24.686 1.00 19.22 C ATOM 1695 O ILE A 726 9.918 18.295 24.685 1.00 19.49 O ATOM 1696 CB ILE A 726 10.409 21.306 23.356 1.00 18.21 C ATOM 1697 CG1 ILE A 726 10.398 22.017 22.011 1.00 15.82 C ATOM 1698 CG2 ILE A 726 11.797 20.698 23.588 1.00 17.34 C ATOM 1699 CD1 ILE A 726 10.984 23.409 22.078 1.00 18.84 C ATOM 1700 H ILE A 726 7.867 21.825 23.182 1.00 0.00 H ATOM 1701 N GLN A 727 8.920 19.982 25.785 1.00 18.94 N ATOM 1702 CA GLN A 727 8.928 19.236 27.048 1.00 23.15 C ATOM 1703 C GLN A 727 8.184 17.909 26.924 1.00 26.24 C ATOM 1704 O GLN A 727 8.590 16.895 27.501 1.00 23.08 O ATOM 1705 CB GLN A 727 8.345 20.079 28.185 1.00 22.11 C ATOM 1706 CG GLN A 727 9.175 21.326 28.501 1.00 25.94 C ATOM 1707 CD GLN A 727 8.480 22.273 29.470 1.00 31.56 C ATOM 1708 OE1 GLN A 727 9.053 23.269 29.907 1.00 31.97 O ATOM 1709 NE2 GLN A 727 7.239 21.967 29.801 1.00 41.16 N ATOM 1710 HE22 GLN A 727 6.791 21.114 29.408 1.00 0.00 H ATOM 1711 HE21 GLN A 727 6.709 22.579 30.454 1.00 0.00 H ATOM 1712 H GLN A 727 8.527 20.944 25.749 1.00 0.00 H ATOM 1713 N ARG A 728 7.109 17.904 26.146 1.00 20.79 N ATOM 1714 CA ARG A 728 6.330 16.683 25.977 1.00 21.72 C ATOM 1715 C ARG A 728 7.115 15.613 25.214 1.00 23.88 C ATOM 1716 O ARG A 728 7.043 14.428 25.552 1.00 23.15 O ATOM 1717 CB ARG A 728 4.991 16.970 25.287 1.00 23.80 C ATOM 1718 CG ARG A 728 4.039 15.776 25.336 1.00 27.03 C ATOM 1719 CD ARG A 728 2.605 16.140 24.946 1.00 35.00 C ATOM 1720 NE ARG A 728 1.732 14.968 25.004 1.00 41.12 N ATOM 1721 CZ ARG A 728 1.222 14.475 26.128 1.00 48.90 C ATOM 1722 NH1 ARG A 728 1.489 15.056 27.290 1.00 53.61 N ATOM 1723 NH2 ARG A 728 0.444 13.404 26.095 1.00 52.91 N ATOM 1724 HE ARG A 728 1.496 14.491 24.111 1.00 0.00 H ATOM 1725 HH12 ARG A 728 1.089 14.669 28.169 1.00 0.00 H ATOM 1726 HH11 ARG A 728 2.098 15.898 27.322 1.00 0.00 H ATOM 1727 HH22 ARG A 728 0.047 13.022 26.977 1.00 0.00 H ATOM 1728 HH21 ARG A 728 0.230 12.945 25.187 1.00 0.00 H ATOM 1729 H ARG A 728 6.821 18.774 25.655 1.00 0.00 H ATOM 1730 N THR A 729 7.878 16.027 24.204 1.00 21.07 N ATOM 1731 CA THR A 729 8.718 15.077 23.477 1.00 23.42 C ATOM 1732 C THR A 729 9.791 14.480 24.387 1.00 23.03 C ATOM 1733 O THR A 729 10.235 13.353 24.174 1.00 23.19 O ATOM 1734 CB THR A 729 9.416 15.723 22.261 1.00 20.37 C ATOM 1735 OG1 THR A 729 10.438 16.623 22.709 1.00 19.84 O ATOM 1736 CG2 THR A 729 8.414 16.462 21.380 1.00 19.51 C ATOM 1737 HG1 THR A 729 10.030 17.331 23.268 1.00 0.00 H ATOM 1738 H THR A 729 7.876 17.031 23.931 1.00 0.00 H ATOM 1739 N LEU A 730 10.207 15.245 25.393 1.00 22.21 N ATOM 1740 CA LEU A 730 11.263 14.799 26.305 1.00 23.13 C ATOM 1741 C LEU A 730 10.735 13.928 27.438 1.00 25.45 C ATOM 1742 O LEU A 730 11.502 13.203 28.079 1.00 28.03 O ATOM 1743 CB LEU A 730 12.010 16.001 26.886 1.00 22.54 C ATOM 1744 CG LEU A 730 12.950 16.777 25.967 1.00 21.48 C ATOM 1745 CD1 LEU A 730 13.257 18.150 26.533 1.00 20.79 C ATOM 1746 CD2 LEU A 730 14.239 15.996 25.742 1.00 22.18 C ATOM 1747 H LEU A 730 9.773 16.180 25.535 1.00 0.00 H ATOM 1748 N THR A 731 9.430 13.987 27.695 1.00 24.64 N ATOM 1749 CA THR A 731 8.868 13.294 28.862 1.00 31.21 C ATOM 1750 C THR A 731 7.856 12.201 28.506 1.00 31.81 C ATOM 1751 O THR A 731 7.474 11.397 29.354 1.00 28.21 O ATOM 1752 CB THR A 731 8.243 14.292 29.866 1.00 30.37 C ATOM 1753 OG1 THR A 731 7.172 15.012 29.239 1.00 29.41 O ATOM 1754 CG2 THR A 731 9.280 15.290 30.319 1.00 30.29 C ATOM 1755 HG1 THR A 731 6.478 14.373 28.939 1.00 0.00 H ATOM 1756 H THR A 731 8.804 14.528 27.065 1.00 0.00 H ATOM 1757 N ALA A 732 7.428 12.166 27.250 1.00 26.06 N ATOM 1758 CA ALA A 732 6.435 11.184 26.824 1.00 29.17 C ATOM 1759 C ALA A 732 6.804 10.638 25.451 1.00 27.91 C ATOM 1760 O ALA A 732 7.659 11.208 24.771 1.00 26.60 O ATOM 1761 CB ALA A 732 5.047 11.827 26.782 1.00 27.00 C ATOM 1762 H ALA A 732 7.805 12.847 26.560 1.00 0.00 H ATOM 1763 N ASP A 733 6.158 9.549 25.036 1.00 29.10 N ATOM 1764 CA ASP A 733 6.352 9.039 23.680 1.00 27.14 C ATOM 1765 C ASP A 733 5.493 9.867 22.722 1.00 31.98 C ATOM 1766 O ASP A 733 4.417 9.450 22.275 1.00 26.45 O ATOM 1767 CB ASP A 733 6.041 7.538 23.581 1.00 29.02 C ATOM 1768 CG ASP A 733 6.810 6.859 22.447 1.00 33.14 C ATOM 1769 OD1 ASP A 733 7.522 7.570 21.703 1.00 30.42 O ATOM 1770 OD2 ASP A 733 6.700 5.626 22.283 1.00 35.07 O ATOM 1771 H ASP A 733 5.509 9.057 25.683 1.00 0.00 H ATOM 1772 N TYR A 734 5.993 11.057 22.417 1.00 24.72 N ATOM 1773 CA TYR A 734 5.220 12.065 21.720 1.00 23.67 C ATOM 1774 C TYR A 734 6.093 12.738 20.681 1.00 25.59 C ATOM 1775 O TYR A 734 7.233 13.097 20.964 1.00 23.66 O ATOM 1776 CB TYR A 734 4.714 13.095 22.731 1.00 23.28 C ATOM 1777 CG TYR A 734 4.022 14.292 22.130 1.00 25.79 C ATOM 1778 CD1 TYR A 734 2.670 14.247 21.810 1.00 31.48 C ATOM 1779 CD2 TYR A 734 4.708 15.481 21.912 1.00 21.01 C ATOM 1780 CE1 TYR A 734 2.025 15.350 21.272 1.00 21.64 C ATOM 1781 CE2 TYR A 734 4.073 16.586 21.375 1.00 20.12 C ATOM 1782 CZ TYR A 734 2.735 16.513 21.059 1.00 27.11 C ATOM 1783 OH TYR A 734 2.101 17.608 20.530 1.00 25.51 O ATOM 1784 HH TYR A 734 1.150 17.388 20.362 1.00 0.00 H ATOM 1785 H TYR A 734 6.974 11.274 22.687 1.00 0.00 H ATOM 1786 N ALA A 735 5.552 12.905 19.478 1.00 22.17 N ATOM 1787 CA ALA A 735 6.260 13.571 18.397 1.00 21.23 C ATOM 1788 C ALA A 735 5.580 14.899 18.112 1.00 20.95 C ATOM 1789 O ALA A 735 4.359 14.954 17.966 1.00 20.37 O ATOM 1790 CB ALA A 735 6.264 12.702 17.156 1.00 21.76 C ATOM 1791 H ALA A 735 4.591 12.547 19.305 1.00 0.00 H ATOM 1792 N LEU A 736 6.365 15.967 18.026 1.00 19.21 N ATOM 1793 CA LEU A 736 5.807 17.302 17.802 1.00 18.26 C ATOM 1794 C LEU A 736 5.965 17.731 16.356 1.00 17.71 C ATOM 1795 O LEU A 736 7.084 17.765 15.830 1.00 17.48 O ATOM 1796 CB LEU A 736 6.495 18.317 18.719 1.00 17.60 C ATOM 1797 CG LEU A 736 6.057 19.784 18.678 1.00 17.98 C ATOM 1798 CD1 LEU A 736 4.594 19.928 19.017 1.00 16.97 C ATOM 1799 CD2 LEU A 736 6.896 20.587 19.649 1.00 17.37 C ATOM 1800 H LEU A 736 7.394 15.853 18.119 1.00 0.00 H ATOM 1801 N LEU A 737 4.841 18.041 15.714 1.00 17.66 N ATOM 1802 CA LEU A 737 4.836 18.632 14.380 1.00 19.19 C ATOM 1803 C LEU A 737 5.142 20.105 14.540 1.00 21.26 C ATOM 1804 O LEU A 737 4.386 20.837 15.175 1.00 16.08 O ATOM 1805 CB LEU A 737 3.478 18.437 13.714 1.00 21.61 C ATOM 1806 CG LEU A 737 3.222 16.965 13.433 1.00 28.42 C ATOM 1807 CD1 LEU A 737 1.729 16.672 13.323 1.00 35.02 C ATOM 1808 CD2 LEU A 737 3.947 16.614 12.162 1.00 28.22 C ATOM 1809 H LEU A 737 3.931 17.855 16.181 1.00 0.00 H ATOM 1810 N MET A 738 6.254 20.535 13.961 1.00 15.66 N ATOM 1811 CA MET A 738 6.656 21.917 14.130 1.00 23.66 C ATOM 1812 C MET A 738 7.584 22.353 13.024 1.00 22.38 C ATOM 1813 O MET A 738 7.936 21.574 12.146 1.00 19.00 O ATOM 1814 CB MET A 738 7.308 22.121 15.488 1.00 23.54 C ATOM 1815 CG MET A 738 8.501 21.240 15.701 1.00 14.99 C ATOM 1816 SD MET A 738 9.352 21.657 17.219 1.00 22.72 S ATOM 1817 CE MET A 738 10.360 23.018 16.670 1.00 26.67 C ATOM 1818 H MET A 738 6.833 19.886 13.390 1.00 0.00 H ATOM 1819 N GLU A 739 7.888 23.645 13.004 1.00 13.64 N ATOM 1820 CA GLU A 739 8.556 24.224 11.853 1.00 13.37 C ATOM 1821 C GLU A 739 10.060 23.970 11.854 1.00 16.52 C ATOM 1822 O GLU A 739 10.693 23.946 12.900 1.00 13.35 O ATOM 1823 CB GLU A 739 8.161 25.701 11.731 1.00 13.97 C ATOM 1824 CG GLU A 739 6.659 25.798 11.398 1.00 15.05 C ATOM 1825 CD GLU A 739 6.055 27.170 11.616 1.00 20.30 C ATOM 1826 OE1 GLU A 739 6.636 27.977 12.380 1.00 20.49 O ATOM 1827 OE2 GLU A 739 4.983 27.429 11.015 1.00 21.85 O ATOM 1828 H GLU A 739 7.646 24.246 13.818 1.00 0.00 H ATOM 1829 N SER A 740 10.616 23.760 10.666 1.00 18.32 N ATOM 1830 CA SER A 740 11.968 23.210 10.519 1.00 14.15 C ATOM 1831 C SER A 740 13.143 24.021 11.079 1.00 14.63 C ATOM 1832 O SER A 740 14.105 23.435 11.574 1.00 14.81 O ATOM 1833 CB SER A 740 12.234 22.867 9.053 1.00 14.71 C ATOM 1834 OG SER A 740 12.129 24.019 8.241 1.00 15.02 O ATOM 1835 HG SER A 740 12.792 24.692 8.537 1.00 0.00 H ATOM 1836 H SER A 740 10.074 23.994 9.810 1.00 0.00 H ATOM 1837 N THR A 741 13.111 25.348 10.991 1.00 15.97 N ATOM 1838 CA THR A 741 14.262 26.113 11.486 1.00 14.38 C ATOM 1839 C THR A 741 14.304 26.100 13.016 1.00 13.34 C ATOM 1840 O THR A 741 15.369 26.177 13.633 1.00 17.23 O ATOM 1841 CB THR A 741 14.322 27.551 10.930 1.00 21.73 C ATOM 1842 OG1 THR A 741 13.103 28.239 11.224 1.00 22.01 O ATOM 1843 CG2 THR A 741 14.548 27.533 9.419 1.00 24.62 C ATOM 1844 HG1 THR A 741 12.973 28.273 12.205 1.00 0.00 H ATOM 1845 H THR A 741 12.288 25.833 10.580 1.00 0.00 H ATOM 1846 N THR A 742 13.142 25.975 13.633 1.00 13.11 N ATOM 1847 CA THR A 742 13.098 25.832 15.079 1.00 13.58 C ATOM 1848 C THR A 742 13.575 24.435 15.491 1.00 13.63 C ATOM 1849 O THR A 742 14.280 24.288 16.486 1.00 13.51 O ATOM 1850 CB THR A 742 11.699 26.116 15.616 1.00 17.13 C ATOM 1851 OG1 THR A 742 11.262 27.369 15.088 1.00 25.72 O ATOM 1852 CG2 THR A 742 11.710 26.196 17.140 1.00 20.06 C ATOM 1853 HG1 THR A 742 11.243 27.321 14.099 1.00 0.00 H ATOM 1854 H THR A 742 12.259 25.979 13.084 1.00 0.00 H ATOM 1855 N ILE A 743 13.214 23.415 14.715 1.00 13.76 N ATOM 1856 CA ILE A 743 13.722 22.064 14.975 1.00 16.21 C ATOM 1857 C ILE A 743 15.245 22.033 14.902 1.00 15.47 C ATOM 1858 O ILE A 743 15.913 21.388 15.721 1.00 16.18 O ATOM 1859 CB ILE A 743 13.171 21.051 13.961 1.00 17.22 C ATOM 1860 CG1 ILE A 743 11.675 20.863 14.159 1.00 19.04 C ATOM 1861 CG2 ILE A 743 13.874 19.703 14.107 1.00 16.25 C ATOM 1862 CD1 ILE A 743 11.059 19.865 13.186 1.00 21.86 C ATOM 1863 H ILE A 743 12.566 23.578 13.918 1.00 0.00 H ATOM 1864 N GLU A 744 15.789 22.721 13.903 1.00 15.13 N ATOM 1865 CA GLU A 744 17.233 22.836 13.751 1.00 16.17 C ATOM 1866 C GLU A 744 17.842 23.419 15.029 1.00 15.27 C ATOM 1867 O GLU A 744 18.848 22.913 15.537 1.00 17.20 O ATOM 1868 CB GLU A 744 17.558 23.733 12.551 1.00 19.91 C ATOM 1869 CG GLU A 744 19.041 24.002 12.359 1.00 28.84 C ATOM 1870 CD GLU A 744 19.312 25.036 11.277 1.00 39.70 C ATOM 1871 OE1 GLU A 744 18.338 25.494 10.629 1.00 44.42 O ATOM 1872 OE2 GLU A 744 20.496 25.389 11.083 1.00 37.34 O ATOM 1873 H GLU A 744 15.168 23.189 13.213 1.00 0.00 H ATOM 1874 N TYR A 745 17.216 24.473 15.547 1.00 14.02 N ATOM 1875 CA TYR A 745 17.676 25.132 16.771 1.00 16.04 C ATOM 1876 C TYR A 745 17.626 24.180 17.962 1.00 14.55 C ATOM 1877 O TYR A 745 18.591 24.045 18.702 1.00 15.08 O ATOM 1878 CB TYR A 745 16.817 26.373 17.061 1.00 13.62 C ATOM 1879 CG TYR A 745 17.310 27.186 18.239 1.00 14.72 C ATOM 1880 CD1 TYR A 745 18.328 28.107 18.080 1.00 12.71 C ATOM 1881 CD2 TYR A 745 16.766 27.023 19.510 1.00 15.82 C ATOM 1882 CE1 TYR A 745 18.801 28.841 19.140 1.00 21.53 C ATOM 1883 CE2 TYR A 745 17.242 27.760 20.587 1.00 19.67 C ATOM 1884 CZ TYR A 745 18.256 28.670 20.385 1.00 20.31 C ATOM 1885 OH TYR A 745 18.743 29.423 21.422 1.00 29.13 O ATOM 1886 HH TYR A 745 19.105 28.824 22.122 1.00 0.00 H ATOM 1887 H TYR A 745 16.371 24.841 15.066 1.00 0.00 H ATOM 1888 N ILE A 746 16.493 23.506 18.125 1.00 15.78 N ATOM 1889 CA ILE A 746 16.271 22.604 19.252 1.00 17.36 C ATOM 1890 C ILE A 746 17.214 21.407 19.258 1.00 16.41 C ATOM 1891 O ILE A 746 17.795 21.060 20.286 1.00 17.08 O ATOM 1892 CB ILE A 746 14.817 22.080 19.263 1.00 17.52 C ATOM 1893 CG1 ILE A 746 13.844 23.244 19.424 1.00 16.02 C ATOM 1894 CG2 ILE A 746 14.618 21.062 20.378 1.00 18.45 C ATOM 1895 CD1 ILE A 746 14.129 24.086 20.647 1.00 14.40 C ATOM 1896 H ILE A 746 15.735 23.625 17.423 1.00 0.00 H ATOM 1897 N THR A 747 17.358 20.767 18.104 1.00 16.66 N ATOM 1898 CA THR A 747 18.134 19.525 18.052 1.00 17.80 C ATOM 1899 C THR A 747 19.634 19.751 18.223 1.00 18.25 C ATOM 1900 O THR A 747 20.374 18.829 18.571 1.00 20.21 O ATOM 1901 CB THR A 747 17.859 18.723 16.768 1.00 28.13 C ATOM 1902 OG1 THR A 747 18.187 19.527 15.630 1.00 17.57 O ATOM 1903 CG2 THR A 747 16.389 18.313 16.704 1.00 17.95 C ATOM 1904 HG1 THR A 747 17.632 20.347 15.635 1.00 0.00 H ATOM 1905 H THR A 747 16.921 21.146 17.239 1.00 0.00 H ATOM 1906 N GLN A 748 20.082 20.976 17.979 1.00 17.53 N ATOM 1907 CA GLN A 748 21.473 21.317 18.224 1.00 24.12 C ATOM 1908 C GLN A 748 21.742 21.498 19.730 1.00 24.40 C ATOM 1909 O GLN A 748 22.877 21.362 20.186 1.00 21.91 O ATOM 1910 CB GLN A 748 21.843 22.587 17.456 1.00 29.58 C ATOM 1911 CG GLN A 748 23.321 22.944 17.540 1.00 42.14 C ATOM 1912 CD GLN A 748 23.706 24.033 16.567 1.00 51.71 C ATOM 1913 OE1 GLN A 748 23.449 23.922 15.368 1.00 58.33 O ATOM 1914 NE2 GLN A 748 24.309 25.103 17.077 1.00 51.14 N ATOM 1915 HE22 GLN A 748 24.506 25.152 18.097 1.00 0.00 H ATOM 1916 HE21 GLN A 748 24.584 25.891 16.456 1.00 0.00 H ATOM 1917 H GLN A 748 19.432 21.698 17.609 1.00 0.00 H ATOM 1918 N ARG A 749 20.691 21.776 20.500 1.00 17.79 N ATOM 1919 CA ARG A 749 20.832 22.034 21.936 1.00 18.13 C ATOM 1920 C ARG A 749 20.316 20.906 22.818 1.00 18.99 C ATOM 1921 O ARG A 749 20.648 20.828 24.000 1.00 20.56 O ATOM 1922 CB ARG A 749 20.143 23.345 22.287 1.00 17.10 C ATOM 1923 CG ARG A 749 20.931 24.529 21.784 1.00 21.20 C ATOM 1924 CD ARG A 749 20.087 25.759 21.533 1.00 21.70 C ATOM 1925 NE ARG A 749 20.962 26.792 20.984 1.00 22.33 N ATOM 1926 CZ ARG A 749 21.326 26.841 19.707 1.00 24.97 C ATOM 1927 NH1 ARG A 749 20.855 25.940 18.842 1.00 18.08 N ATOM 1928 NH2 ARG A 749 22.137 27.804 19.283 1.00 27.39 N ATOM 1929 HE ARG A 749 21.319 27.528 21.627 1.00 0.00 H ATOM 1930 HH12 ARG A 749 21.141 25.980 17.843 1.00 0.00 H ATOM 1931 HH11 ARG A 749 20.202 25.199 19.167 1.00 0.00 H ATOM 1932 HH22 ARG A 749 22.421 27.842 18.283 1.00 0.00 H ATOM 1933 HH21 ARG A 749 22.487 28.520 19.951 1.00 0.00 H ATOM 1934 H ARG A 749 19.744 21.811 20.070 1.00 0.00 H ATOM 1935 N ASN A 750 19.507 20.035 22.236 1.00 19.05 N ATOM 1936 CA ASN A 750 18.959 18.889 22.950 1.00 19.95 C ATOM 1937 C ASN A 750 19.309 17.631 22.173 1.00 27.98 C ATOM 1938 O ASN A 750 18.574 17.229 21.272 1.00 20.49 O ATOM 1939 CB ASN A 750 17.434 19.027 23.084 1.00 19.36 C ATOM 1940 CG ASN A 750 17.022 20.320 23.789 1.00 19.61 C ATOM 1941 OD1 ASN A 750 16.892 20.364 25.009 1.00 20.59 O ATOM 1942 ND2 ASN A 750 16.832 21.374 23.020 1.00 21.03 N ATOM 1943 HD22 ASN A 750 16.952 21.295 21.990 1.00 0.00 H ATOM 1944 HD21 ASN A 750 16.562 22.285 23.443 1.00 0.00 H ATOM 1945 H ASN A 750 19.254 20.173 21.237 1.00 0.00 H ATOM 1946 N CYS A 751 20.430 17.009 22.533 1.00 25.72 N ATOM 1947 CA CYS A 751 21.039 15.981 21.703 1.00 29.71 C ATOM 1948 C CYS A 751 20.307 14.638 21.736 1.00 31.41 C ATOM 1949 O CYS A 751 20.633 13.726 20.974 1.00 29.80 O ATOM 1950 CB CYS A 751 22.518 15.834 22.063 1.00 32.46 C ATOM 1951 SG CYS A 751 23.433 17.383 21.771 1.00 52.38 S ATOM 1952 H CYS A 751 20.883 17.265 23.433 1.00 0.00 H ATOM 1953 N ASN A 752 19.314 14.522 22.610 1.00 23.55 N ATOM 1954 CA ASN A 752 18.457 13.344 22.615 1.00 24.26 C ATOM 1955 C ASN A 752 17.243 13.509 21.698 1.00 23.33 C ATOM 1956 O ASN A 752 16.477 12.572 21.501 1.00 26.45 O ATOM 1957 CB ASN A 752 18.033 12.958 24.041 1.00 31.82 C ATOM 1958 CG ASN A 752 17.621 14.161 24.888 1.00 36.55 C ATOM 1959 OD1 ASN A 752 17.520 15.284 24.395 1.00 30.47 O ATOM 1960 ND2 ASN A 752 17.386 13.921 26.180 1.00 40.27 N ATOM 1961 HD22 ASN A 752 17.483 12.956 26.556 1.00 0.00 H ATOM 1962 HD21 ASN A 752 17.106 14.699 26.811 1.00 0.00 H ATOM 1963 H ASN A 752 19.146 15.282 23.300 1.00 0.00 H ATOM 1964 N LEU A 753 17.077 14.701 21.130 1.00 22.02 N ATOM 1965 CA LEU A 753 15.987 14.943 20.193 1.00 23.39 C ATOM 1966 C LEU A 753 16.509 14.959 18.760 1.00 27.49 C ATOM 1967 O LEU A 753 17.678 15.275 18.517 1.00 21.59 O ATOM 1968 CB LEU A 753 15.290 16.269 20.500 1.00 20.00 C ATOM 1969 CG LEU A 753 14.625 16.400 21.869 1.00 24.30 C ATOM 1970 CD1 LEU A 753 13.902 17.738 21.975 1.00 19.03 C ATOM 1971 CD2 LEU A 753 13.675 15.241 22.130 1.00 25.84 C ATOM 1972 H LEU A 753 17.736 15.473 21.358 1.00 0.00 H ATOM 1973 N THR A 754 15.642 14.633 17.810 1.00 20.86 N ATOM 1974 CA THR A 754 16.048 14.619 16.415 1.00 23.45 C ATOM 1975 C THR A 754 14.906 15.022 15.504 1.00 21.27 C ATOM 1976 O THR A 754 13.739 14.991 15.903 1.00 20.75 O ATOM 1977 CB THR A 754 16.597 13.231 16.000 1.00 29.26 C ATOM 1978 OG1 THR A 754 17.220 13.328 14.716 1.00 37.42 O ATOM 1979 CG2 THR A 754 15.476 12.192 15.950 1.00 30.56 C ATOM 1980 HG1 THR A 754 17.965 13.978 14.760 1.00 0.00 H ATOM 1981 H THR A 754 14.665 14.386 18.066 1.00 0.00 H ATOM 1982 N GLN A 755 15.246 15.429 14.284 1.00 20.31 N ATOM 1983 CA GLN A 755 14.235 15.700 13.275 1.00 19.40 C ATOM 1984 C GLN A 755 13.912 14.415 12.517 1.00 25.53 C ATOM 1985 O GLN A 755 14.819 13.667 12.133 1.00 21.38 O ATOM 1986 CB GLN A 755 14.706 16.774 12.299 1.00 25.99 C ATOM 1987 CG GLN A 755 13.717 17.012 11.165 1.00 29.65 C ATOM 1988 CD GLN A 755 14.161 18.115 10.225 1.00 37.95 C ATOM 1989 OE1 GLN A 755 14.837 19.060 10.632 1.00 39.52 O ATOM 1990 NE2 GLN A 755 13.785 17.995 8.958 1.00 36.41 N ATOM 1991 HE22 GLN A 755 13.214 17.179 8.660 1.00 0.00 H ATOM 1992 HE21 GLN A 755 14.062 18.717 8.263 1.00 0.00 H ATOM 1993 H GLN A 755 16.251 15.555 14.048 1.00 0.00 H ATOM 1994 N ILE A 756 12.622 14.156 12.325 1.00 20.48 N ATOM 1995 CA ILE A 756 12.169 12.945 11.659 1.00 24.47 C ATOM 1996 C ILE A 756 11.654 13.264 10.255 1.00 26.74 C ATOM 1997 O ILE A 756 10.771 14.105 10.084 1.00 23.14 O ATOM 1998 CB ILE A 756 11.061 12.239 12.466 1.00 23.02 C ATOM 1999 CG1 ILE A 756 11.607 11.734 13.815 1.00 26.23 C ATOM 2000 CG2 ILE A 756 10.449 11.111 11.653 1.00 23.04 C ATOM 2001 CD1 ILE A 756 12.761 10.725 13.698 1.00 23.53 C ATOM 2002 H ILE A 756 11.915 14.841 12.661 1.00 0.00 H ATOM 2003 N GLY A 757 12.212 12.593 9.251 1.00 27.88 N ATOM 2004 CA GLY A 757 11.830 12.850 7.871 1.00 31.53 C ATOM 2005 C GLY A 757 12.289 14.216 7.403 1.00 32.83 C ATOM 2006 O GLY A 757 13.023 14.911 8.111 1.00 34.20 O ATOM 2007 H GLY A 757 12.933 11.873 9.456 1.00 0.00 H ATOM 2008 N GLY A 758 11.857 14.607 6.208 1.00 26.25 N ATOM 2009 CA GLY A 758 12.226 15.903 5.672 1.00 27.28 C ATOM 2010 C GLY A 758 11.164 16.943 5.956 1.00 27.05 C ATOM 2011 O GLY A 758 10.474 16.873 6.980 1.00 22.86 O ATOM 2012 H GLY A 758 11.247 13.976 5.651 1.00 0.00 H ATOM 2013 N LEU A 759 11.029 17.907 5.050 1.00 23.76 N ATOM 2014 CA LEU A 759 9.981 18.908 5.169 1.00 23.30 C ATOM 2015 C LEU A 759 8.683 18.360 4.604 1.00 25.09 C ATOM 2016 O LEU A 759 8.671 17.751 3.541 1.00 25.99 O ATOM 2017 CB LEU A 759 10.359 20.190 4.429 1.00 30.24 C ATOM 2018 CG LEU A 759 11.626 20.896 4.893 1.00 32.67 C ATOM 2019 CD1 LEU A 759 11.616 22.347 4.464 1.00 32.29 C ATOM 2020 CD2 LEU A 759 11.765 20.786 6.389 1.00 30.78 C ATOM 2021 H LEU A 759 11.684 17.946 4.243 1.00 0.00 H ATOM 2022 N ILE A 760 7.593 18.582 5.324 1.00 18.73 N ATOM 2023 CA ILE A 760 6.268 18.174 4.876 1.00 34.25 C ATOM 2024 C ILE A 760 5.766 19.136 3.800 1.00 31.38 C ATOM 2025 O ILE A 760 5.066 18.746 2.862 1.00 29.07 O ATOM 2026 CB ILE A 760 5.277 18.170 6.066 1.00 39.36 C ATOM 2027 CG1 ILE A 760 5.648 17.072 7.058 1.00 40.08 C ATOM 2028 CG2 ILE A 760 3.865 17.980 5.599 1.00 42.90 C ATOM 2029 CD1 ILE A 760 6.068 15.811 6.390 1.00 37.56 C ATOM 2030 H ILE A 760 7.687 19.064 6.241 1.00 0.00 H ATOM 2031 N ASP A 761 6.124 20.405 3.951 1.00 25.99 N ATOM 2032 CA ASP A 761 5.700 21.423 3.002 1.00 30.30 C ATOM 2033 C ASP A 761 6.708 22.563 2.966 1.00 25.83 C ATOM 2034 O ASP A 761 7.788 22.456 3.541 1.00 24.52 O ATOM 2035 CB ASP A 761 4.316 21.949 3.377 1.00 30.57 C ATOM 2036 CG ASP A 761 4.339 22.828 4.603 1.00 37.87 C ATOM 2037 OD1 ASP A 761 5.361 22.835 5.332 1.00 38.30 O ATOM 2038 OD2 ASP A 761 3.324 23.514 4.841 1.00 42.82 O ATOM 2039 H ASP A 761 6.717 20.676 4.761 1.00 0.00 H ATOM 2040 N SER A 762 6.344 23.660 2.315 1.00 19.45 N ATOM 2041 CA SER A 762 7.238 24.804 2.231 1.00 22.19 C ATOM 2042 C SER A 762 6.476 26.082 2.552 1.00 25.51 C ATOM 2043 O SER A 762 5.371 26.291 2.045 1.00 22.88 O ATOM 2044 CB SER A 762 7.836 24.892 0.826 1.00 29.34 C ATOM 2045 OG SER A 762 8.761 25.962 0.730 1.00 36.58 O ATOM 2046 HG SER A 762 9.131 25.995 -0.188 1.00 0.00 H ATOM 2047 H SER A 762 5.410 23.702 1.860 1.00 0.00 H ATOM 2048 N LYS A 763 7.059 26.932 3.394 1.00 21.28 N ATOM 2049 CA LYS A 763 6.486 28.251 3.638 1.00 19.64 C ATOM 2050 C LYS A 763 7.474 29.249 4.202 1.00 17.19 C ATOM 2051 O LYS A 763 8.661 28.957 4.330 1.00 13.49 O ATOM 2052 CB LYS A 763 5.251 28.173 4.530 1.00 27.81 C ATOM 2053 CG LYS A 763 5.383 27.287 5.737 1.00 32.15 C ATOM 2054 CD LYS A 763 3.988 26.786 6.080 1.00 38.37 C ATOM 2055 CE LYS A 763 4.019 25.624 7.035 1.00 37.95 C ATOM 2056 NZ LYS A 763 2.634 25.149 7.351 1.00 32.45 N ATOM 2057 HZ1 LYS A 763 2.094 25.924 7.786 1.00 0.00 H ATOM 2058 HZ2 LYS A 763 2.164 24.847 6.474 1.00 0.00 H ATOM 2059 HZ3 LYS A 763 2.686 24.347 8.011 1.00 0.00 H ATOM 2060 H LYS A 763 7.933 26.653 3.884 1.00 0.00 H ATOM 2061 N GLY A 764 6.964 30.430 4.535 1.00 16.82 N ATOM 2062 CA GLY A 764 7.797 31.530 4.988 1.00 13.54 C ATOM 2063 C GLY A 764 7.205 32.209 6.206 1.00 15.16 C ATOM 2064 O GLY A 764 5.988 32.110 6.450 1.00 11.92 O ATOM 2065 H GLY A 764 5.936 30.571 4.469 1.00 0.00 H ATOM 2066 N TYR A 765 8.072 32.862 6.980 1.00 14.31 N ATOM 2067 CA TYR A 765 7.662 33.773 8.048 1.00 14.19 C ATOM 2068 C TYR A 765 7.673 35.182 7.501 1.00 15.06 C ATOM 2069 O TYR A 765 8.612 35.572 6.806 1.00 11.27 O ATOM 2070 CB TYR A 765 8.673 33.755 9.194 1.00 12.77 C ATOM 2071 CG TYR A 765 8.718 32.477 9.982 1.00 15.92 C ATOM 2072 CD1 TYR A 765 7.579 31.706 10.166 1.00 12.68 C ATOM 2073 CD2 TYR A 765 9.905 32.046 10.551 1.00 15.12 C ATOM 2074 CE1 TYR A 765 7.634 30.518 10.897 1.00 12.74 C ATOM 2075 CE2 TYR A 765 9.968 30.873 11.274 1.00 16.68 C ATOM 2076 CZ TYR A 765 8.835 30.119 11.446 1.00 15.31 C ATOM 2077 OH TYR A 765 8.914 28.954 12.168 1.00 14.43 O ATOM 2078 HH TYR A 765 8.021 28.527 12.203 1.00 0.00 H ATOM 2079 H TYR A 765 9.089 32.717 6.816 1.00 0.00 H ATOM 2080 N GLY A 766 6.658 35.960 7.842 1.00 10.42 N ATOM 2081 CA GLY A 766 6.591 37.336 7.395 1.00 15.07 C ATOM 2082 C GLY A 766 6.194 38.213 8.558 1.00 16.68 C ATOM 2083 O GLY A 766 5.722 37.723 9.591 1.00 13.26 O ATOM 2084 H GLY A 766 5.898 35.578 8.440 1.00 0.00 H ATOM 2085 N ILE A 767 6.404 39.513 8.406 1.00 14.53 N ATOM 2086 CA ILE A 767 5.873 40.469 9.368 1.00 10.30 C ATOM 2087 C ILE A 767 4.403 40.729 9.072 1.00 10.28 C ATOM 2088 O ILE A 767 4.036 41.089 7.953 1.00 13.72 O ATOM 2089 CB ILE A 767 6.684 41.761 9.331 1.00 14.51 C ATOM 2090 CG1 ILE A 767 8.076 41.472 9.902 1.00 15.17 C ATOM 2091 CG2 ILE A 767 6.001 42.860 10.152 1.00 10.99 C ATOM 2092 CD1 ILE A 767 8.963 42.658 9.929 1.00 19.20 C ATOM 2093 H ILE A 767 6.954 39.854 7.591 1.00 0.00 H ATOM 2094 N GLY A 768 3.547 40.526 10.065 1.00 10.54 N ATOM 2095 CA GLY A 768 2.121 40.717 9.840 1.00 11.02 C ATOM 2096 C GLY A 768 1.726 42.176 10.015 1.00 11.20 C ATOM 2097 O GLY A 768 2.314 42.886 10.828 1.00 14.16 O ATOM 2098 H GLY A 768 3.893 40.232 11.001 1.00 0.00 H ATOM 2099 N THR A 769 0.736 42.631 9.255 1.00 11.89 N ATOM 2100 CA THR A 769 0.200 43.973 9.445 1.00 12.25 C ATOM 2101 C THR A 769 -1.311 43.923 9.269 1.00 15.77 C ATOM 2102 O THR A 769 -1.845 42.971 8.685 1.00 14.64 O ATOM 2103 CB THR A 769 0.768 44.991 8.420 1.00 21.50 C ATOM 2104 OG1 THR A 769 0.193 44.747 7.134 1.00 25.34 O ATOM 2105 CG2 THR A 769 2.301 44.955 8.338 1.00 15.04 C ATOM 2106 HG1 THR A 769 -0.790 44.848 7.189 1.00 0.00 H ATOM 2107 H THR A 769 0.337 42.021 8.513 1.00 0.00 H ATOM 2108 N PRO A 770 -2.015 44.947 9.768 1.00 13.66 N ATOM 2109 CA PRO A 770 -3.429 45.013 9.415 1.00 14.73 C ATOM 2110 C PRO A 770 -3.555 45.199 7.907 1.00 15.24 C ATOM 2111 O PRO A 770 -2.620 45.706 7.259 1.00 14.87 O ATOM 2112 CB PRO A 770 -3.901 46.287 10.121 1.00 18.88 C ATOM 2113 CG PRO A 770 -2.913 46.487 11.244 1.00 17.81 C ATOM 2114 CD PRO A 770 -1.609 46.058 10.649 1.00 18.05 C ATOM 2115 N MET A 771 -4.689 44.791 7.356 1.00 16.19 N ATOM 2116 CA MET A 771 -4.929 44.959 5.936 1.00 25.01 C ATOM 2117 C MET A 771 -4.862 46.443 5.564 1.00 27.88 C ATOM 2118 O MET A 771 -5.476 47.288 6.219 1.00 27.74 O ATOM 2119 CB MET A 771 -6.289 44.371 5.578 1.00 32.10 C ATOM 2120 CG MET A 771 -6.249 43.402 4.428 1.00 34.78 C ATOM 2121 SD MET A 771 -7.909 42.837 4.045 1.00 30.13 S ATOM 2122 CE MET A 771 -8.051 41.388 5.089 1.00 19.45 C ATOM 2123 H MET A 771 -5.417 44.344 7.950 1.00 0.00 H ATOM 2124 N GLY A 772 -4.088 46.768 4.536 1.00 23.59 N ATOM 2125 CA GLY A 772 -3.980 48.150 4.097 1.00 25.44 C ATOM 2126 C GLY A 772 -2.995 49.015 4.859 1.00 23.01 C ATOM 2127 O GLY A 772 -3.014 50.231 4.731 1.00 25.44 O ATOM 2128 H GLY A 772 -3.553 46.027 4.040 1.00 0.00 H ATOM 2129 N SER A 773 -2.136 48.392 5.657 1.00 22.92 N ATOM 2130 CA SER A 773 -1.088 49.112 6.382 1.00 21.75 C ATOM 2131 C SER A 773 -0.216 49.974 5.481 1.00 22.17 C ATOM 2132 O SER A 773 0.233 49.510 4.440 1.00 21.04 O ATOM 2133 CB SER A 773 -0.170 48.127 7.088 1.00 13.85 C ATOM 2134 OG SER A 773 0.978 48.798 7.584 1.00 19.54 O ATOM 2135 HG SER A 773 0.698 49.498 8.225 1.00 0.00 H ATOM 2136 H SER A 773 -2.210 47.361 5.770 1.00 0.00 H ATOM 2137 N PRO A 774 0.059 51.223 5.899 1.00 25.23 N ATOM 2138 CA PRO A 774 0.964 52.093 5.142 1.00 25.29 C ATOM 2139 C PRO A 774 2.422 51.689 5.311 1.00 22.80 C ATOM 2140 O PRO A 774 3.278 52.287 4.666 1.00 25.76 O ATOM 2141 CB PRO A 774 0.749 53.467 5.791 1.00 29.72 C ATOM 2142 CG PRO A 774 0.339 53.154 7.198 1.00 29.37 C ATOM 2143 CD PRO A 774 -0.515 51.914 7.071 1.00 29.64 C ATOM 2144 N TYR A 775 2.711 50.710 6.167 1.00 16.54 N ATOM 2145 CA TYR A 775 4.095 50.316 6.390 1.00 13.79 C ATOM 2146 C TYR A 775 4.470 49.028 5.672 1.00 16.60 C ATOM 2147 O TYR A 775 5.656 48.693 5.568 1.00 16.53 O ATOM 2148 CB TYR A 775 4.369 50.144 7.894 1.00 21.18 C ATOM 2149 CG TYR A 775 3.847 51.275 8.754 1.00 28.37 C ATOM 2150 CD1 TYR A 775 4.523 52.485 8.831 1.00 32.85 C ATOM 2151 CD2 TYR A 775 2.684 51.123 9.503 1.00 37.20 C ATOM 2152 CE1 TYR A 775 4.048 53.522 9.615 1.00 36.58 C ATOM 2153 CE2 TYR A 775 2.200 52.156 10.293 1.00 38.70 C ATOM 2154 CZ TYR A 775 2.888 53.353 10.342 1.00 40.43 C ATOM 2155 OH TYR A 775 2.416 54.388 11.124 1.00 43.21 O ATOM 2156 HH TYR A 775 3.024 55.165 11.044 1.00 0.00 H ATOM 2157 H TYR A 775 1.946 50.225 6.678 1.00 0.00 H ATOM 2158 N ARG A 776 3.466 48.285 5.211 1.00 14.95 N ATOM 2159 CA ARG A 776 3.700 46.955 4.660 1.00 15.00 C ATOM 2160 C ARG A 776 4.687 46.994 3.501 1.00 12.88 C ATOM 2161 O ARG A 776 5.664 46.253 3.499 1.00 16.87 O ATOM 2162 CB ARG A 776 2.379 46.313 4.201 1.00 16.57 C ATOM 2163 CG ARG A 776 2.534 44.918 3.563 1.00 24.58 C ATOM 2164 CD ARG A 776 1.879 44.856 2.179 1.00 33.97 C ATOM 2165 NE ARG A 776 1.849 43.496 1.638 1.00 45.97 N ATOM 2166 CZ ARG A 776 2.872 42.874 1.036 1.00 45.10 C ATOM 2167 NH1 ARG A 776 4.064 43.471 0.882 1.00 19.38 N ATOM 2168 NH2 ARG A 776 2.701 41.628 0.590 1.00 48.46 N ATOM 2169 HE ARG A 776 0.958 42.968 1.729 1.00 0.00 H ATOM 2170 HH12 ARG A 776 4.842 42.966 0.411 1.00 0.00 H ATOM 2171 HH11 ARG A 776 4.210 44.439 1.234 1.00 0.00 H ATOM 2172 HH22 ARG A 776 3.485 41.132 0.121 1.00 0.00 H ATOM 2173 HH21 ARG A 776 1.784 41.153 0.712 1.00 0.00 H ATOM 2174 H ARG A 776 2.497 48.660 5.244 1.00 0.00 H ATOM 2175 N ASP A 777 4.438 47.869 2.529 1.00 13.68 N ATOM 2176 CA ASP A 777 5.221 47.889 1.294 1.00 14.16 C ATOM 2177 C ASP A 777 6.691 48.272 1.505 1.00 16.11 C ATOM 2178 O ASP A 777 7.588 47.655 0.931 1.00 16.08 O ATOM 2179 CB ASP A 777 4.584 48.830 0.283 1.00 19.29 C ATOM 2180 CG ASP A 777 3.274 48.290 -0.269 1.00 30.74 C ATOM 2181 OD1 ASP A 777 3.068 47.058 -0.231 1.00 30.04 O ATOM 2182 OD2 ASP A 777 2.455 49.103 -0.738 1.00 28.73 O ATOM 2183 H ASP A 777 3.667 48.556 2.651 1.00 0.00 H ATOM 2184 N LYS A 778 6.941 49.286 2.320 1.00 13.31 N ATOM 2185 CA LYS A 778 8.329 49.678 2.596 1.00 14.55 C ATOM 2186 C LYS A 778 9.082 48.620 3.409 1.00 13.16 C ATOM 2187 O LYS A 778 10.263 48.355 3.156 1.00 14.34 O ATOM 2188 CB LYS A 778 8.396 51.055 3.270 1.00 18.53 C ATOM 2189 CG LYS A 778 8.217 52.214 2.273 1.00 27.34 C ATOM 2190 CD LYS A 778 8.806 53.521 2.808 1.00 35.59 C ATOM 2191 CE LYS A 778 8.763 54.638 1.751 1.00 42.01 C ATOM 2192 NZ LYS A 778 7.369 55.043 1.428 1.00 44.51 N ATOM 2193 HZ1 LYS A 778 6.848 54.223 1.057 1.00 0.00 H ATOM 2194 HZ2 LYS A 778 6.902 55.391 2.290 1.00 0.00 H ATOM 2195 HZ3 LYS A 778 7.385 55.797 0.712 1.00 0.00 H ATOM 2196 H LYS A 778 6.156 49.804 2.764 1.00 0.00 H ATOM 2197 N ILE A 779 8.402 48.008 4.374 1.00 11.73 N ATOM 2198 CA ILE A 779 8.968 46.861 5.088 1.00 10.94 C ATOM 2199 C ILE A 779 9.342 45.725 4.140 1.00 13.47 C ATOM 2200 O ILE A 779 10.429 45.141 4.246 1.00 12.64 O ATOM 2201 CB ILE A 779 8.013 46.366 6.181 1.00 14.54 C ATOM 2202 CG1 ILE A 779 8.050 47.347 7.353 1.00 15.40 C ATOM 2203 CG2 ILE A 779 8.396 44.943 6.659 1.00 10.14 C ATOM 2204 CD1 ILE A 779 6.959 47.153 8.346 1.00 16.70 C ATOM 2205 H ILE A 779 7.452 48.349 4.626 1.00 0.00 H ATOM 2206 N THR A 780 8.446 45.411 3.208 1.00 11.80 N ATOM 2207 CA THR A 780 8.750 44.417 2.179 1.00 12.25 C ATOM 2208 C THR A 780 10.015 44.755 1.370 1.00 14.27 C ATOM 2209 O THR A 780 10.878 43.895 1.177 1.00 12.62 O ATOM 2210 CB THR A 780 7.547 44.245 1.243 1.00 13.04 C ATOM 2211 OG1 THR A 780 6.646 43.294 1.836 1.00 12.90 O ATOM 2212 CG2 THR A 780 7.980 43.766 -0.124 1.00 13.99 C ATOM 2213 HG1 THR A 780 5.862 43.170 1.244 1.00 0.00 H ATOM 2214 H THR A 780 7.517 45.879 3.211 1.00 0.00 H ATOM 2215 N ILE A 781 10.132 45.996 0.908 1.00 13.03 N ATOM 2216 CA ILE A 781 11.326 46.397 0.152 1.00 14.30 C ATOM 2217 C ILE A 781 12.591 46.212 0.984 1.00 12.88 C ATOM 2218 O ILE A 781 13.598 45.691 0.497 1.00 20.15 O ATOM 2219 CB ILE A 781 11.259 47.867 -0.307 1.00 18.83 C ATOM 2220 CG1 ILE A 781 10.045 48.096 -1.208 1.00 22.81 C ATOM 2221 CG2 ILE A 781 12.554 48.263 -1.044 1.00 21.32 C ATOM 2222 CD1 ILE A 781 9.974 47.156 -2.395 1.00 28.16 C ATOM 2223 H ILE A 781 9.374 46.687 1.083 1.00 0.00 H ATOM 2224 N ALA A 782 12.537 46.629 2.240 1.00 12.13 N ATOM 2225 CA ALA A 782 13.707 46.538 3.106 1.00 11.63 C ATOM 2226 C ALA A 782 14.087 45.082 3.363 1.00 17.29 C ATOM 2227 O ALA A 782 15.264 44.731 3.327 1.00 13.80 O ATOM 2228 CB ALA A 782 13.471 47.284 4.410 1.00 11.01 C ATOM 2229 H ALA A 782 11.651 47.026 2.613 1.00 0.00 H ATOM 2230 N ILE A 783 13.091 44.231 3.609 1.00 15.72 N ATOM 2231 CA ILE A 783 13.355 42.806 3.809 1.00 11.01 C ATOM 2232 C ILE A 783 14.001 42.185 2.559 1.00 12.44 C ATOM 2233 O ILE A 783 14.960 41.417 2.658 1.00 16.20 O ATOM 2234 CB ILE A 783 12.061 42.040 4.196 1.00 11.38 C ATOM 2235 CG1 ILE A 783 11.723 42.257 5.675 1.00 10.08 C ATOM 2236 CG2 ILE A 783 12.205 40.547 3.911 1.00 13.17 C ATOM 2237 CD1 ILE A 783 10.331 41.787 6.059 1.00 22.06 C ATOM 2238 H ILE A 783 12.114 44.584 3.659 1.00 0.00 H ATOM 2239 N LEU A 784 13.487 42.520 1.381 1.00 12.46 N ATOM 2240 CA LEU A 784 14.031 41.966 0.148 1.00 16.88 C ATOM 2241 C LEU A 784 15.487 42.389 -0.087 1.00 16.24 C ATOM 2242 O LEU A 784 16.298 41.595 -0.579 1.00 16.83 O ATOM 2243 CB LEU A 784 13.162 42.344 -1.057 1.00 23.17 C ATOM 2244 CG LEU A 784 11.778 41.690 -1.131 1.00 22.76 C ATOM 2245 CD1 LEU A 784 10.983 42.235 -2.316 1.00 20.53 C ATOM 2246 CD2 LEU A 784 11.906 40.186 -1.221 1.00 21.84 C ATOM 2247 H LEU A 784 12.688 43.184 1.338 1.00 0.00 H ATOM 2248 N GLN A 785 15.807 43.628 0.272 1.00 15.30 N ATOM 2249 CA GLN A 785 17.170 44.147 0.187 1.00 17.08 C ATOM 2250 C GLN A 785 18.086 43.393 1.146 1.00 16.53 C ATOM 2251 O GLN A 785 19.163 42.949 0.759 1.00 20.26 O ATOM 2252 CB GLN A 785 17.189 45.636 0.551 1.00 19.81 C ATOM 2253 CG GLN A 785 16.473 46.536 -0.450 1.00 32.28 C ATOM 2254 CD GLN A 785 16.329 47.981 0.030 1.00 32.21 C ATOM 2255 OE1 GLN A 785 16.297 48.262 1.236 1.00 34.95 O ATOM 2256 NE2 GLN A 785 16.239 48.903 -0.920 1.00 33.27 N ATOM 2257 HE22 GLN A 785 16.270 48.623 -1.921 1.00 0.00 H ATOM 2258 HE21 GLN A 785 16.137 49.906 -0.664 1.00 0.00 H ATOM 2259 H GLN A 785 15.056 44.254 0.628 1.00 0.00 H ATOM 2260 N LEU A 786 17.655 43.258 2.398 1.00 12.78 N ATOM 2261 CA LEU A 786 18.464 42.581 3.412 1.00 13.69 C ATOM 2262 C LEU A 786 18.743 41.147 2.979 1.00 18.73 C ATOM 2263 O LEU A 786 19.826 40.589 3.224 1.00 20.23 O ATOM 2264 CB LEU A 786 17.739 42.589 4.755 1.00 11.89 C ATOM 2265 CG LEU A 786 17.672 43.905 5.525 1.00 14.16 C ATOM 2266 CD1 LEU A 786 16.671 43.761 6.658 1.00 11.85 C ATOM 2267 CD2 LEU A 786 19.042 44.287 6.078 1.00 16.27 C ATOM 2268 H LEU A 786 16.725 43.641 2.661 1.00 0.00 H ATOM 2269 N GLN A 787 17.756 40.558 2.317 1.00 16.87 N ATOM 2270 CA GLN A 787 17.835 39.172 1.878 1.00 17.99 C ATOM 2271 C GLN A 787 18.858 39.035 0.757 1.00 17.64 C ATOM 2272 O GLN A 787 19.701 38.133 0.776 1.00 21.50 O ATOM 2273 CB GLN A 787 16.454 38.738 1.396 1.00 26.70 C ATOM 2274 CG GLN A 787 16.296 37.274 1.091 1.00 36.91 C ATOM 2275 CD GLN A 787 14.838 36.919 0.856 1.00 45.87 C ATOM 2276 OE1 GLN A 787 14.291 37.170 -0.222 1.00 39.91 O ATOM 2277 NE2 GLN A 787 14.193 36.356 1.877 1.00 48.94 N ATOM 2278 HE22 GLN A 787 14.696 36.163 2.767 1.00 0.00 H ATOM 2279 HE21 GLN A 787 13.187 36.109 1.784 1.00 0.00 H ATOM 2280 H GLN A 787 16.897 41.104 2.104 1.00 0.00 H ATOM 2281 N GLU A 788 18.789 39.944 -0.209 1.00 17.40 N ATOM 2282 CA GLU A 788 19.696 39.927 -1.362 1.00 25.74 C ATOM 2283 C GLU A 788 21.157 40.126 -0.966 1.00 21.82 C ATOM 2284 O GLU A 788 22.065 39.611 -1.628 1.00 22.43 O ATOM 2285 CB GLU A 788 19.299 41.003 -2.385 1.00 33.94 C ATOM 2286 CG GLU A 788 17.974 40.751 -3.104 1.00 47.63 C ATOM 2287 CD GLU A 788 17.412 42.003 -3.786 1.00 57.31 C ATOM 2288 OE1 GLU A 788 18.099 43.053 -3.796 1.00 61.63 O ATOM 2289 OE2 GLU A 788 16.275 41.935 -4.308 1.00 56.68 O ATOM 2290 H GLU A 788 18.069 40.692 -0.146 1.00 0.00 H ATOM 2291 N GLU A 789 21.383 40.892 0.093 1.00 16.54 N ATOM 2292 CA GLU A 789 22.736 41.179 0.550 1.00 23.81 C ATOM 2293 C GLU A 789 23.198 40.171 1.605 1.00 25.93 C ATOM 2294 O GLU A 789 24.184 40.408 2.300 1.00 26.34 O ATOM 2295 CB GLU A 789 22.812 42.601 1.110 1.00 31.04 C ATOM 2296 CG GLU A 789 22.380 43.675 0.121 1.00 39.62 C ATOM 2297 CD GLU A 789 22.599 45.079 0.652 1.00 42.55 C ATOM 2298 OE1 GLU A 789 21.604 45.754 0.973 1.00 42.70 O ATOM 2299 OE2 GLU A 789 23.766 45.509 0.744 1.00 49.33 O ATOM 2300 H GLU A 789 20.576 41.297 0.609 1.00 0.00 H ATOM 2301 N ASP A 790 22.467 39.060 1.720 1.00 22.38 N ATOM 2302 CA ASP A 790 22.798 37.969 2.639 1.00 25.60 C ATOM 2303 C ASP A 790 22.817 38.375 4.116 1.00 25.56 C ATOM 2304 O ASP A 790 23.421 37.688 4.939 1.00 22.43 O ATOM 2305 CB ASP A 790 24.126 37.308 2.241 1.00 38.82 C ATOM 2306 CG ASP A 790 24.095 36.732 0.823 1.00 52.26 C ATOM 2307 OD1 ASP A 790 23.117 36.028 0.485 1.00 55.71 O ATOM 2308 OD2 ASP A 790 25.047 36.988 0.048 1.00 56.88 O ATOM 2309 H ASP A 790 21.619 38.964 1.126 1.00 0.00 H ATOM 2310 N LYS A 791 22.152 39.481 4.454 1.00 16.31 N ATOM 2311 CA LYS A 791 22.120 39.944 5.839 1.00 14.65 C ATOM 2312 C LYS A 791 21.239 39.059 6.717 1.00 17.27 C ATOM 2313 O LYS A 791 21.488 38.903 7.913 1.00 15.41 O ATOM 2314 CB LYS A 791 21.608 41.379 5.904 1.00 21.40 C ATOM 2315 CG LYS A 791 22.484 42.393 5.179 1.00 28.58 C ATOM 2316 CD LYS A 791 23.810 42.572 5.897 1.00 35.23 C ATOM 2317 CE LYS A 791 24.480 43.892 5.513 1.00 41.31 C ATOM 2318 NZ LYS A 791 24.931 43.893 4.104 1.00 44.62 N ATOM 2319 HZ1 LYS A 791 25.617 43.125 3.960 1.00 0.00 H ATOM 2320 HZ2 LYS A 791 24.112 43.749 3.479 1.00 0.00 H ATOM 2321 HZ3 LYS A 791 25.379 44.806 3.885 1.00 0.00 H ATOM 2322 H LYS A 791 21.649 40.021 3.721 1.00 0.00 H ATOM 2323 N LEU A 792 20.196 38.481 6.132 1.00 11.70 N ATOM 2324 CA LEU A 792 19.299 37.645 6.923 1.00 14.15 C ATOM 2325 C LEU A 792 19.972 36.300 7.206 1.00 17.75 C ATOM 2326 O LEU A 792 19.782 35.710 8.270 1.00 15.66 O ATOM 2327 CB LEU A 792 17.965 37.462 6.211 1.00 13.40 C ATOM 2328 CG LEU A 792 17.188 38.766 5.986 1.00 14.83 C ATOM 2329 CD1 LEU A 792 15.831 38.484 5.359 1.00 20.35 C ATOM 2330 CD2 LEU A 792 17.023 39.508 7.286 1.00 15.33 C ATOM 2331 H LEU A 792 20.020 38.623 5.117 1.00 0.00 H ATOM 2332 N HIS A 793 20.764 35.825 6.252 1.00 14.59 N ATOM 2333 CA HIS A 793 21.536 34.596 6.448 1.00 21.68 C ATOM 2334 C HIS A 793 22.552 34.774 7.589 1.00 20.18 C ATOM 2335 O HIS A 793 22.728 33.896 8.425 1.00 16.19 O ATOM 2336 CB HIS A 793 22.238 34.202 5.143 1.00 26.14 C ATOM 2337 CG HIS A 793 23.111 32.994 5.267 1.00 40.21 C ATOM 2338 ND1 HIS A 793 22.649 31.716 5.041 1.00 45.72 N ATOM 2339 CD2 HIS A 793 24.421 32.869 5.595 1.00 47.36 C ATOM 2340 CE1 HIS A 793 23.636 30.854 5.222 1.00 46.16 C ATOM 2341 NE2 HIS A 793 24.720 31.527 5.561 1.00 47.39 N ATOM 2342 H HIS A 793 20.837 36.335 5.349 1.00 0.00 H ATOM 2343 N ILE A 794 23.214 35.922 7.624 1.00 13.01 N ATOM 2344 CA ILE A 794 24.173 36.225 8.683 1.00 13.09 C ATOM 2345 C ILE A 794 23.485 36.367 10.042 1.00 17.31 C ATOM 2346 O ILE A 794 24.011 35.935 11.070 1.00 18.15 O ATOM 2347 CB ILE A 794 24.928 37.523 8.350 1.00 25.63 C ATOM 2348 CG1 ILE A 794 25.834 37.298 7.132 1.00 26.89 C ATOM 2349 CG2 ILE A 794 25.714 38.031 9.563 1.00 18.68 C ATOM 2350 CD1 ILE A 794 26.414 38.564 6.537 1.00 25.95 C ATOM 2351 H ILE A 794 23.046 36.626 6.877 1.00 0.00 H ATOM 2352 N MET A 795 22.309 36.986 10.041 1.00 13.51 N ATOM 2353 CA MET A 795 21.531 37.182 11.259 1.00 12.58 C ATOM 2354 C MET A 795 21.078 35.842 11.817 1.00 11.45 C ATOM 2355 O MET A 795 21.116 35.617 13.023 1.00 13.49 O ATOM 2356 CB MET A 795 20.315 38.065 10.945 1.00 13.63 C ATOM 2357 CG MET A 795 19.496 38.501 12.143 1.00 20.97 C ATOM 2358 SD MET A 795 18.180 39.632 11.624 1.00 22.97 S ATOM 2359 CE MET A 795 19.165 40.969 10.936 1.00 16.10 C ATOM 2360 H MET A 795 21.930 37.343 9.141 1.00 0.00 H ATOM 2361 N LYS A 796 20.636 34.948 10.939 1.00 11.98 N ATOM 2362 CA LYS A 796 20.259 33.608 11.392 1.00 13.22 C ATOM 2363 C LYS A 796 21.458 32.860 11.981 1.00 16.34 C ATOM 2364 O LYS A 796 21.354 32.251 13.049 1.00 18.47 O ATOM 2365 CB LYS A 796 19.630 32.813 10.255 1.00 12.51 C ATOM 2366 CG LYS A 796 19.388 31.344 10.585 1.00 18.09 C ATOM 2367 CD LYS A 796 18.559 30.698 9.487 1.00 27.18 C ATOM 2368 CE LYS A 796 18.707 29.187 9.474 1.00 32.90 C ATOM 2369 NZ LYS A 796 18.459 28.588 10.800 1.00 38.79 N ATOM 2370 HZ1 LYS A 796 19.140 28.973 11.486 1.00 0.00 H ATOM 2371 HZ2 LYS A 796 17.491 28.815 11.106 1.00 0.00 H ATOM 2372 HZ3 LYS A 796 18.572 27.556 10.739 1.00 0.00 H ATOM 2373 H LYS A 796 20.558 35.200 9.933 1.00 0.00 H ATOM 2374 N GLU A 797 22.598 32.920 11.296 1.00 15.59 N ATOM 2375 CA GLU A 797 23.802 32.258 11.785 1.00 18.05 C ATOM 2376 C GLU A 797 24.140 32.774 13.183 1.00 18.27 C ATOM 2377 O GLU A 797 24.506 31.994 14.059 1.00 18.33 O ATOM 2378 CB GLU A 797 24.972 32.461 10.813 1.00 27.34 C ATOM 2379 CG GLU A 797 26.144 31.494 10.996 1.00 37.17 C ATOM 2380 CD GLU A 797 27.048 31.863 12.159 1.00 50.00 C ATOM 2381 OE1 GLU A 797 27.037 33.046 12.565 1.00 54.26 O ATOM 2382 OE2 GLU A 797 27.772 30.973 12.667 1.00 53.81 O ATOM 2383 H GLU A 797 22.630 33.446 10.400 1.00 0.00 H ATOM 2384 N LYS A 798 23.986 34.081 13.395 1.00 17.39 N ATOM 2385 CA LYS A 798 24.205 34.684 14.713 1.00 17.24 C ATOM 2386 C LYS A 798 23.401 33.991 15.820 1.00 18.96 C ATOM 2387 O LYS A 798 23.953 33.611 16.861 1.00 16.26 O ATOM 2388 CB LYS A 798 23.847 36.179 14.682 1.00 15.92 C ATOM 2389 CG LYS A 798 24.027 36.888 16.032 1.00 17.09 C ATOM 2390 CD LYS A 798 23.551 38.332 15.978 1.00 20.48 C ATOM 2391 CE LYS A 798 23.675 39.008 17.340 1.00 22.90 C ATOM 2392 NZ LYS A 798 22.932 40.293 17.406 1.00 18.59 N ATOM 2393 HZ1 LYS A 798 23.306 40.946 16.688 1.00 0.00 H ATOM 2394 HZ2 LYS A 798 21.923 40.118 17.225 1.00 0.00 H ATOM 2395 HZ3 LYS A 798 23.048 40.711 18.351 1.00 0.00 H ATOM 2396 H LYS A 798 23.702 34.691 12.602 1.00 0.00 H ATOM 2397 N TRP A 799 22.101 33.820 15.600 1.00 17.32 N ATOM 2398 CA TRP A 799 21.223 33.311 16.657 1.00 14.85 C ATOM 2399 C TRP A 799 21.148 31.784 16.737 1.00 18.96 C ATOM 2400 O TRP A 799 20.770 31.238 17.773 1.00 20.47 O ATOM 2401 CB TRP A 799 19.820 33.941 16.540 1.00 13.84 C ATOM 2402 CG TRP A 799 19.881 35.409 16.848 1.00 10.40 C ATOM 2403 CD1 TRP A 799 19.961 36.444 15.955 1.00 11.75 C ATOM 2404 CD2 TRP A 799 19.930 35.992 18.150 1.00 10.43 C ATOM 2405 NE1 TRP A 799 20.037 37.643 16.634 1.00 10.38 N ATOM 2406 CE2 TRP A 799 20.028 37.388 17.981 1.00 12.77 C ATOM 2407 CE3 TRP A 799 19.899 35.466 19.445 1.00 14.62 C ATOM 2408 CZ2 TRP A 799 20.092 38.268 19.074 1.00 15.27 C ATOM 2409 CZ3 TRP A 799 19.966 36.340 20.524 1.00 15.58 C ATOM 2410 CH2 TRP A 799 20.065 37.726 20.330 1.00 16.34 C ATOM 2411 HE1 TRP A 799 20.092 38.585 16.196 1.00 0.00 H ATOM 2412 H TRP A 799 21.703 34.050 14.667 1.00 0.00 H ATOM 2413 N TRP A 800 21.511 31.099 15.656 1.00 14.13 N ATOM 2414 CA TRP A 800 21.461 29.636 15.634 1.00 15.82 C ATOM 2415 C TRP A 800 22.793 28.995 16.016 1.00 18.22 C ATOM 2416 O TRP A 800 22.831 27.840 16.427 1.00 23.68 O ATOM 2417 CB TRP A 800 21.025 29.126 14.249 1.00 13.04 C ATOM 2418 CG TRP A 800 19.529 28.893 14.094 1.00 12.53 C ATOM 2419 CD1 TRP A 800 18.905 27.683 13.945 1.00 17.38 C ATOM 2420 CD2 TRP A 800 18.485 29.882 14.061 1.00 13.90 C ATOM 2421 NE1 TRP A 800 17.549 27.860 13.825 1.00 13.79 N ATOM 2422 CE2 TRP A 800 17.263 29.197 13.895 1.00 11.66 C ATOM 2423 CE3 TRP A 800 18.465 31.280 14.152 1.00 12.55 C ATOM 2424 CZ2 TRP A 800 16.031 29.859 13.828 1.00 13.04 C ATOM 2425 CZ3 TRP A 800 17.247 31.935 14.080 1.00 10.58 C ATOM 2426 CH2 TRP A 800 16.045 31.226 13.917 1.00 13.29 C ATOM 2427 HE1 TRP A 800 16.850 27.100 13.701 1.00 0.00 H ATOM 2428 H TRP A 800 21.836 31.612 14.812 1.00 0.00 H ATOM 2429 N ARG A 801 23.892 29.728 15.881 1.00 23.07 N ATOM 2430 CA ARG A 801 25.195 29.085 16.051 1.00 32.25 C ATOM 2431 C ARG A 801 25.428 28.622 17.488 1.00 32.11 C ATOM 2432 O ARG A 801 24.888 29.199 18.432 1.00 30.17 O ATOM 2433 CB ARG A 801 26.340 29.978 15.555 1.00 37.48 C ATOM 2434 CG ARG A 801 26.902 30.933 16.581 1.00 46.33 C ATOM 2435 CD ARG A 801 28.004 31.790 15.972 1.00 57.41 C ATOM 2436 NE ARG A 801 27.882 33.185 16.386 1.00 68.68 N ATOM 2437 CZ ARG A 801 28.509 34.199 15.799 1.00 76.19 C ATOM 2438 NH1 ARG A 801 29.307 33.980 14.762 1.00 80.55 N ATOM 2439 NH2 ARG A 801 28.334 35.435 16.245 1.00 76.73 N ATOM 2440 HE ARG A 801 27.263 33.399 17.194 1.00 0.00 H ATOM 2441 HH12 ARG A 801 29.796 34.776 14.305 1.00 0.00 H ATOM 2442 HH11 ARG A 801 29.443 33.012 14.406 1.00 0.00 H ATOM 2443 HH22 ARG A 801 28.825 36.228 15.785 1.00 0.00 H ATOM 2444 HH21 ARG A 801 27.706 35.612 17.055 1.00 0.00 H ATOM 2445 H ARG A 801 23.828 30.742 15.658 1.00 0.00 H ATOM 2446 N GLY A 802 26.221 27.565 17.637 1.00 35.84 N ATOM 2447 CA GLY A 802 26.528 27.010 18.943 1.00 39.60 C ATOM 2448 C GLY A 802 27.234 25.674 18.819 1.00 47.84 C ATOM 2449 O GLY A 802 27.565 25.242 17.711 1.00 47.78 O ATOM 2450 H GLY A 802 26.634 27.122 16.792 1.00 0.00 H ATOM 2451 N SER A 803 27.471 25.023 19.956 1.00 51.87 N ATOM 2452 CA SER A 803 28.103 23.707 19.971 1.00 55.97 C ATOM 2453 C SER A 803 27.109 22.635 19.542 1.00 56.90 C ATOM 2454 O SER A 803 25.967 22.616 20.000 1.00 58.40 O ATOM 2455 CB SER A 803 28.652 23.384 21.366 1.00 56.34 C ATOM 2456 OG SER A 803 27.607 23.267 22.320 1.00 55.19 O ATOM 2457 HG SER A 803 26.993 22.540 22.047 1.00 0.00 H ATOM 2458 H SER A 803 27.199 25.464 20.858 1.00 0.00 H ATOM 2459 N GLY A 804 27.544 21.745 18.658 1.00 57.18 N ATOM 2460 CA GLY A 804 26.690 20.674 18.182 1.00 52.24 C ATOM 2461 C GLY A 804 26.571 19.516 19.156 1.00 49.19 C ATOM 2462 O GLY A 804 26.823 19.665 20.350 1.00 47.49 O ATOM 2463 H GLY A 804 28.518 21.817 18.299 1.00 0.00 H ATOM 2464 N CYS A 805 26.182 18.358 18.631 1.00 48.10 N ATOM 2465 CA CYS A 805 25.996 17.155 19.430 1.00 45.90 C ATOM 2466 C CYS A 805 26.976 16.070 18.993 1.00 50.84 C ATOM 2467 O CYS A 805 27.552 16.155 17.907 1.00 49.84 O ATOM 2468 CB CYS A 805 24.565 16.648 19.266 1.00 45.07 C ATOM 2469 SG CYS A 805 23.292 17.826 19.783 1.00 46.37 S ATOM 2470 H CYS A 805 26.003 18.309 17.608 1.00 0.00 H ATOM 2471 N PRO A 806 27.184 15.048 19.841 1.00 54.43 N ATOM 2472 CA PRO A 806 27.981 13.911 19.364 1.00 57.07 C ATOM 2473 C PRO A 806 27.327 13.221 18.162 1.00 55.64 C ATOM 2474 O PRO A 806 26.117 13.329 17.948 1.00 48.03 O ATOM 2475 CB PRO A 806 28.034 12.970 20.582 1.00 59.32 C ATOM 2476 CG PRO A 806 26.987 13.483 21.547 1.00 57.97 C ATOM 2477 CD PRO A 806 26.886 14.953 21.282 1.00 55.66 C ATOM 2478 OXT PRO A 806 27.999 12.559 17.365 1.00 59.52 O TER 2479 PRO A 806 HETATM 2480 K K A 1 9.312 58.498 15.846 1.00 20.96 K HETATM 2481 K K A 2 16.428 40.987 35.220 1.00 32.61 K HETATM 2482 O HOH 3 12.071 52.158 18.866 1.00 11.86 O HETATM 2483 O HOH 4 8.397 47.534 24.998 1.00 13.53 O HETATM 2484 O HOH 5 1.328 37.460 1.510 1.00 17.47 O HETATM 2485 O HOH 6 3.467 23.095 15.984 1.00 14.91 O HETATM 2486 O HOH 7 11.101 51.369 25.082 1.00 19.56 O HETATM 2487 O HOH 8 19.965 36.759 3.482 1.00 15.33 O HETATM 2488 O HOH 9 12.542 34.399 27.048 1.00 16.13 O HETATM 2489 O HOH 10 9.595 11.864 21.857 1.00 23.52 O HETATM 2490 O HOH 11 15.576 31.484 5.206 1.00 23.58 O HETATM 2491 O HOH 12 6.823 25.219 14.925 1.00 22.40 O HETATM 2492 O HOH 13 13.793 50.140 26.932 1.00 16.45 O HETATM 2493 O HOH 14 -2.656 29.741 9.160 1.00 16.28 O HETATM 2494 O HOH 15 0.472 24.786 15.186 1.00 17.96 O HETATM 2495 O HOH 16 3.265 25.603 9.971 1.00 24.10 O HETATM 2496 O HOH 17 1.476 29.538 21.276 1.00 19.88 O HETATM 2497 O HOH 18 14.157 41.028 29.847 1.00 19.82 O HETATM 2498 O HOH 19 8.770 14.798 8.321 1.00 22.65 O HETATM 2499 O HOH 20 20.147 16.338 18.255 1.00 21.16 O HETATM 2500 O HOH 21 -6.499 43.406 9.187 1.00 23.13 O HETATM 2501 O HOH 22 15.362 50.775 17.157 1.00 13.58 O HETATM 2502 O HOH 23 18.388 41.349 19.684 1.00 15.37 O HETATM 2503 O HOH 24 13.809 8.191 16.681 1.00 26.71 O HETATM 2504 O HOH 25 4.063 37.486 1.651 1.00 16.75 O HETATM 2505 O HOH 26 4.237 31.006 3.214 1.00 17.33 O HETATM 2506 O HOH 27 4.962 51.348 2.981 1.00 19.89 O HETATM 2507 O HOH 28 -2.034 19.930 2.773 1.00 22.89 O HETATM 2508 O HOH 29 19.794 44.687 13.994 1.00 20.53 O HETATM 2509 O HOH 30 2.686 39.088 -1.174 1.00 31.20 O HETATM 2510 O HOH 31 14.027 45.632 -2.209 1.00 40.47 O HETATM 2511 O HOH 32 7.431 28.474 23.494 1.00 26.84 O HETATM 2512 O HOH 33 -0.530 29.627 19.008 1.00 19.77 O HETATM 2513 O HOH 34 16.935 34.273 7.840 1.00 22.49 O HETATM 2514 O HOH 35 2.108 49.681 2.385 1.00 20.30 O HETATM 2515 O HOH 36 4.018 23.682 0.590 1.00 33.88 O HETATM 2516 O HOH 37 4.532 19.368 28.270 1.00 32.79 O HETATM 2517 O HOH 38 15.439 39.082 -1.898 1.00 33.71 O HETATM 2518 O HOH 39 8.237 56.356 14.142 1.00 15.44 O HETATM 2519 O HOH 40 -4.832 35.135 -0.326 1.00 20.01 O HETATM 2520 O HOH 41 22.982 40.595 9.265 1.00 17.28 O HETATM 2521 O HOH 42 -1.908 27.952 22.060 1.00 27.28 O HETATM 2522 O HOH 43 -0.736 2.098 17.702 1.00 34.37 O HETATM 2523 O HOH 44 -3.284 22.046 4.506 1.00 22.47 O HETATM 2524 O HOH 45 -7.307 29.148 11.373 1.00 30.22 O HETATM 2525 O HOH 46 -0.099 39.853 2.204 1.00 18.04 O HETATM 2526 O HOH 47 0.683 48.790 10.091 1.00 26.63 O HETATM 2527 O HOH 48 15.951 31.291 2.225 1.00 40.62 O HETATM 2528 O HOH 49 4.558 43.441 26.950 1.00 19.19 O HETATM 2529 O HOH 50 4.970 45.969 26.769 1.00 25.08 O HETATM 2530 O HOH 51 -7.423 17.665 7.086 1.00 30.46 O HETATM 2531 O HOH 52 17.583 17.291 26.223 1.00 34.07 O HETATM 2532 O HOH 53 20.688 31.841 20.333 1.00 27.07 O HETATM 2533 O HOH 54 26.490 35.670 12.026 1.00 24.61 O HETATM 2534 O HOH 55 -7.002 34.748 1.343 1.00 24.21 O HETATM 2535 O HOH 56 8.004 4.093 19.986 1.00 38.49 O HETATM 2536 O HOH 57 6.590 46.673 -1.612 1.00 18.16 O HETATM 2537 O HOH 58 11.081 34.027 29.292 1.00 31.28 O HETATM 2538 O HOH 59 21.972 40.823 28.050 1.00 30.19 O HETATM 2539 O HOH 60 -5.429 38.602 20.552 1.00 20.80 O HETATM 2540 O HOH 61 23.411 42.640 34.405 1.00 32.94 O HETATM 2541 O HOH 62 -1.758 27.066 8.243 1.00 16.02 O HETATM 2542 O HOH 63 -4.423 45.104 1.479 1.00 21.70 O HETATM 2543 O HOH 64 11.752 33.256 24.760 1.00 22.60 O HETATM 2544 O HOH 65 8.004 47.834 30.566 1.00 23.64 O HETATM 2545 O HOH 66 0.259 26.665 6.313 1.00 41.61 O HETATM 2546 O HOH 67 4.768 34.986 24.788 1.00 18.14 O HETATM 2547 O HOH 68 5.757 32.877 1.885 1.00 24.41 O HETATM 2548 O HOH 69 23.509 39.652 11.892 1.00 25.19 O HETATM 2549 O HOH 70 11.764 50.299 1.843 1.00 22.69 O HETATM 2550 O HOH 71 7.474 13.125 6.977 1.00 28.23 O HETATM 2551 O HOH 72 4.432 57.565 19.544 1.00 27.20 O HETATM 2552 O HOH 73 20.415 37.585 27.254 1.00 25.09 O HETATM 2553 O HOH 74 11.497 36.895 0.591 1.00 26.91 O HETATM 2554 O HOH 75 20.593 42.018 23.509 1.00 30.33 O HETATM 2555 O HOH 76 24.686 21.080 21.954 1.00 25.67 O HETATM 2556 O HOH 77 -11.495 36.114 8.788 1.00 22.35 O HETATM 2557 O HOH 78 -7.441 26.834 11.908 1.00 26.78 O HETATM 2558 O HOH 79 -4.163 20.069 1.096 1.00 25.97 O HETATM 2559 O HOH 80 8.722 57.569 11.829 1.00 27.91 O HETATM 2560 O HOH 81 -4.447 38.599 22.959 1.00 26.64 O HETATM 2561 O HOH 82 9.756 53.564 25.534 1.00 30.75 O HETATM 2562 O HOH 83 10.460 30.955 25.322 1.00 30.17 O HETATM 2563 O HOH 84 14.944 26.899 6.061 1.00 31.22 O HETATM 2564 O HOH 85 4.727 56.315 12.261 1.00 23.90 O HETATM 2565 O HOH 86 22.853 22.195 24.685 1.00 30.75 O HETATM 2566 O HOH 87 0.384 20.103 1.397 1.00 30.51 O HETATM 2567 O HOH 88 -10.010 31.928 17.694 1.00 27.92 O HETATM 2568 O HOH 89 21.152 41.082 21.081 1.00 33.21 O HETATM 2569 O HOH 90 7.706 31.353 0.683 1.00 28.25 O HETATM 2570 O HOH 91 -2.752 7.835 13.731 1.00 31.95 O HETATM 2571 O HOH 92 8.247 34.092 30.475 1.00 40.88 O HETATM 2572 O HOH 93 9.471 9.288 22.674 1.00 31.04 O HETATM 2573 O HOH 94 3.025 19.729 1.393 1.00 32.67 O HETATM 2574 O HOH 95 10.578 29.229 23.066 1.00 32.89 O HETATM 2575 O HOH 96 11.232 27.802 12.319 1.00 28.08 O HETATM 2576 O HOH 97 14.494 24.465 7.181 1.00 29.26 O HETATM 2577 O HOH 98 4.596 28.714 20.818 1.00 25.38 O HETATM 2578 O HOH 99 -8.948 31.776 21.978 1.00 38.14 O HETATM 2579 O HOH 100 8.631 55.579 21.298 1.00 30.76 O HETATM 2580 O HOH 101 -9.835 41.408 8.923 1.00 33.53 O HETATM 2581 O HOH 102 -7.026 9.104 12.694 1.00 36.50 O HETATM 2582 O HOH 103 24.130 13.202 19.849 1.00 39.91 O HETATM 2583 O HOH 104 15.680 14.038 9.134 1.00 39.55 O HETATM 2584 O HOH 105 25.399 41.835 8.746 1.00 33.39 O HETATM 2585 O HOH 106 9.635 36.744 -1.623 1.00 33.80 O HETATM 2586 O HOH 107 2.628 36.338 25.336 1.00 28.44 O HETATM 2587 O HOH 108 -4.305 12.481 -0.863 1.00 41.22 O HETATM 2588 O HOH 109 4.123 2.863 16.813 1.00 38.56 O HETATM 2589 O HOH 110 5.950 2.818 14.546 1.00 39.58 O HETATM 2590 O HOH 111 21.233 25.410 15.821 1.00 28.34 O HETATM 2591 O HOH 112 1.918 24.457 3.339 1.00 46.51 O HETATM 2592 O HOH 113 1.694 28.482 4.224 1.00 31.73 O HETATM 2593 O HOH 114 14.999 50.811 1.845 1.00 42.95 O HETATM 2594 O HOH 115 -5.282 7.379 13.608 1.00 39.03 O HETATM 2595 O HOH 116 6.808 56.525 10.462 1.00 37.51 O HETATM 2596 O HOH 117 6.993 48.997 -3.113 1.00 39.58 O HETATM 2597 O HOH 118 -3.362 26.455 6.176 1.00 33.45 O HETATM 2598 O HOH 119 -9.854 16.661 7.702 1.00 39.36 O HETATM 2599 O HOH 120 17.700 44.369 23.484 1.00 32.16 O HETATM 2600 O HOH 121 -8.472 45.035 10.043 1.00 31.68 O HETATM 2601 O HOH 122 18.499 46.440 24.703 1.00 22.18 O HETATM 2602 O HOH 123 -1.088 30.410 24.927 1.00 37.73 O HETATM 2603 O HOH 124 0.233 42.724 21.692 1.00 24.91 O HETATM 2604 O HOH 125 18.332 34.791 3.568 1.00 27.54 O HETATM 2605 O HOH 126 17.189 12.190 11.811 1.00 40.81 O HETATM 2606 O HOH 127 22.058 40.909 13.990 1.00 23.95 O HETATM 2607 O HOH 128 16.292 49.324 35.069 1.00 39.10 O HETATM 2608 O HOH 129 21.650 42.982 9.709 1.00 30.99 O HETATM 2609 O HOH 130 22.416 31.072 7.957 1.00 29.31 O HETATM 2610 O HOH 131 19.683 15.294 15.552 1.00 38.74 O HETATM 2611 O HOH 132 -7.447 33.713 23.016 1.00 35.58 O HETATM 2612 O HOH 133 11.297 53.330 27.477 1.00 43.01 O HETATM 2613 O HOH 134 -3.931 31.871 26.108 1.00 37.63 O HETATM 2614 O HOH 135 20.881 28.276 23.469 1.00 41.12 O HETATM 2615 O HOH 136 10.681 55.216 5.547 1.00 29.18 O HETATM 2616 O HOH 137 14.147 10.540 9.462 1.00 36.06 O HETATM 2617 O HOH 138 26.271 34.332 17.925 1.00 34.61 O HETATM 2618 O HOH 139 24.044 31.524 19.172 1.00 27.06 O HETATM 2619 O HOH 140 -7.182 23.054 2.096 1.00 39.74 O HETATM 2620 O HOH 141 2.085 30.628 25.376 1.00 37.08 O HETATM 2621 O HOH 142 -12.021 37.501 14.223 1.00 32.74 O HETATM 2622 O HOH 143 23.597 45.455 35.487 1.00 49.26 O HETATM 2623 O HOH 144 -3.446 24.620 4.196 1.00 42.55 O HETATM 2624 O HOH 145 8.646 55.508 8.528 1.00 50.76 O HETATM 2625 O HOH 146 21.732 18.327 25.053 1.00 43.32 O HETATM 2626 O HOH 147 1.706 34.885 27.716 1.00 38.68 O HETATM 2627 O HOH 148 11.584 26.821 22.929 1.00 34.86 O HETATM 2628 O HOH 149 18.825 15.020 11.155 1.00 42.84 O HETATM 2629 O HOH 150 17.276 9.534 23.467 1.00 47.75 O HETATM 2630 O HOH 151 -4.281 29.924 11.402 1.00 25.91 O HETATM 2631 O HOH 152 9.232 32.744 -0.974 1.00 35.48 O HETATM 2632 O HOH 153 17.973 16.222 13.691 1.00 35.30 O HETATM 2633 O HOH 154 -5.047 50.739 19.754 1.00 42.17 O HETATM 2634 O HOH 155 13.105 55.310 28.296 1.00 36.51 O HETATM 2635 O HOH 156 -11.850 19.705 11.848 1.00 36.71 O HETATM 2636 O HOH 157 25.854 45.345 36.353 1.00 44.41 O HETATM 2637 O HOH 158 17.733 35.620 26.121 1.00 40.69 O HETATM 2638 O HOH 159 -7.675 10.229 4.897 1.00 50.03 O HETATM 2639 O HOH 160 5.068 15.975 2.238 1.00 30.48 O HETATM 2640 O HOH 161 -1.325 25.455 3.696 1.00 43.86 O HETATM 2641 O HOH 162 7.225 30.779 25.621 1.00 52.01 O HETATM 2642 O HOH 163 -4.945 49.438 7.546 1.00 40.51 O HETATM 2643 O HOH 164 -2.841 50.177 19.717 1.00 42.11 O HETATM 2644 O HOH 165 10.526 57.840 8.449 1.00 34.98 O HETATM 2645 O HOH 166 3.267 31.913 23.928 1.00 32.91 O HETATM 2646 O HOH 167 21.168 35.504 24.129 1.00 36.77 O HETATM 2647 O HOH 168 12.313 42.300 38.284 1.00 46.34 O HETATM 2648 O HOH 169 -1.778 50.497 17.025 1.00 41.88 O HETATM 2649 O HOH 170 -0.938 50.544 11.269 1.00 32.05 O HETATM 2650 O HOH 171 15.687 35.083 3.888 1.00 30.82 O HETATM 2651 O HOH 172 -9.907 19.391 6.078 1.00 42.52 O HETATM 2652 O HOH 173 -3.653 28.639 4.234 1.00 22.46 O HETATM 2653 O HOH 174 12.648 41.216 31.737 1.00 35.10 O HETATM 2654 O HOH 175 17.440 50.362 15.847 1.00 24.57 O HETATM 2655 O HOH 176 15.519 48.563 30.872 1.00 16.66 O HETATM 2656 O HOH 177 13.157 38.382 32.879 1.00 38.08 O HETATM 2657 O HOH 178 7.815 58.415 8.911 1.00 44.25 O HETATM 2658 O HOH 179 -9.058 9.060 14.681 1.00 35.70 O HETATM 2659 O HOH 180 4.690 14.459 29.812 1.00 44.81 O HETATM 2660 O HOH 181 5.480 27.540 28.583 1.00 47.22 O HETATM 2661 O HOH 182 -0.287 17.924 26.246 1.00 36.54 O HETATM 2662 O HOH 183 20.568 21.239 14.084 1.00 45.57 O HETATM 2663 O HOH 184 19.496 44.569 -2.971 1.00 41.07 O HETATM 2664 O HOH 185 22.325 44.742 8.552 1.00 36.47 O HETATM 2665 O HOH 186 -10.604 36.179 19.735 1.00 34.13 O HETATM 2666 O HOH 187 22.510 29.229 10.491 1.00 38.32 O HETATM 2667 O HOH 188 21.451 18.779 15.536 1.00 45.20 O HETATM 2668 O HOH 189 9.398 59.921 13.173 1.00 36.38 O HETATM 2669 O HOH 190 16.903 41.065 38.196 1.00 51.41 O HETATM 2670 O HOH 191 14.425 38.867 35.583 1.00 42.62 O HETATM 2671 O HOH 192 16.251 39.802 32.626 1.00 41.66 O HETATM 2672 O HOH 193 14.264 42.310 33.974 1.00 20.08 O HETATM 2673 O HOH 194 11.938 42.986 33.489 1.00 36.79 O HETATM 2674 O HOH 195 18.216 32.674 6.219 1.00 30.83 O HETATM 2675 O HOH 196 5.013 10.532 5.110 1.00 39.57 O HETATM 2676 O HOH 197 -10.905 19.396 9.422 1.00 36.46 O HETATM 2677 O HOH 198 -9.801 14.662 9.563 1.00 37.03 O HETATM 2678 O HOH 199 -8.595 27.999 20.921 1.00 41.81 O HETATM 2679 O HOH 200 -10.625 25.579 20.704 1.00 46.05 O HETATM 2680 O HOH 201 -13.281 36.487 11.334 1.00 40.39 O HETATM 2681 O HOH 202 -11.407 38.699 8.107 1.00 40.09 O HETATM 2682 O HOH 203 5.745 30.587 23.105 1.00 50.33 O HETATM 2683 O HOH 204 10.396 41.356 31.701 1.00 34.90 O HETATM 2684 O HOH 205 11.819 55.646 32.528 1.00 45.12 O HETATM 2685 O HOH 206 8.183 54.909 5.683 1.00 49.87 O HETATM 2686 O HOH 207 21.923 37.877 -3.885 1.00 45.18 O HETATM 2687 O HOH 208 -8.648 7.795 11.077 1.00 42.40 O HETATM 2688 O HOH 209 -11.856 16.693 13.935 1.00 49.85 O HETATM 2689 O HOH 210 -7.894 13.342 0.409 1.00 38.80 O HETATM 2690 O HOH 211 -2.826 41.298 23.623 1.00 50.82 O HETATM 2691 O HOH 212 -7.028 41.438 20.843 1.00 47.62 O HETATM 2692 O HOH 213 4.233 28.546 1.338 1.00 45.41 O HETATM 2693 O HOH 214 -1.560 10.836 1.413 1.00 36.37 O HETATM 2694 O HOH 215 24.214 24.908 20.219 1.00 45.43 O HETATM 2695 O HOH 216 22.368 14.662 18.086 1.00 47.59 O HETATM 2696 O HOH 217 17.226 11.152 27.630 1.00 43.91 O HETATM 2697 O HOH 218 -6.716 51.103 6.752 1.00 47.96 O HETATM 2698 O HOH 219 8.073 42.607 31.406 1.00 21.11 O HETATM 2699 O HOH 220 2.100 59.977 13.316 1.00 36.67 O HETATM 2700 O HOH 221 16.353 43.655 39.591 1.00 23.31 O HETATM 2701 O HOH 222 -0.010 0.022 15.857 1.00 48.23 O HETATM 2702 O HOH 223 6.532 28.596 -0.309 1.00 47.70 O HETATM 2703 O HOH 224 7.179 29.247 -2.454 1.00 41.17 O HETATM 2704 O HOH 225 13.916 52.897 17.215 1.00 14.71 O HETATM 2705 O HOH 226 15.619 47.801 -3.193 1.00 48.64 O HETATM 2706 O HOH 227 2.423 26.917 2.446 1.00 45.18 O HETATM 2707 O HOH 228 17.379 38.389 36.592 1.00 48.48 O HETATM 2708 O HOH 229 10.734 26.982 20.526 1.00 53.76 O HETATM 2709 O HOH 230 21.147 46.107 25.907 1.00 40.27 O HETATM 2710 O HOH 231 15.435 50.675 29.647 1.00 39.43 O HETATM 2711 O HOH 232 2.353 63.028 14.900 1.00 48.70 O HETATM 2712 O UNN A 233 2.778 31.426 12.784 1.00 -0.56 O HETATM 2713 C UNN A 233 2.444 30.367 13.350 1.00 0.08 C HETATM 2714 OXT UNN A 233 1.289 30.058 13.715 1.00 -0.56 O HETATM 2715 CA UNN A 233 3.546 29.337 13.582 1.00 0.03 C HETATM 2716 N UNN A 233 4.845 29.935 13.204 1.00 0.23 N HETATM 2717 H UNN A 233 5.581 29.262 13.354 1.00 0.20 H HETATM 2718 H UNN A 233 5.016 30.752 13.770 1.00 0.20 H HETATM 2719 H UNN A 233 4.823 30.198 12.231 1.00 0.20 H HETATM 2720 CB UNN A 233 3.542 28.816 15.023 1.00 0.02 C HETATM 2721 CG UNN A 233 4.343 27.511 15.215 1.00 0.02 C HETATM 2722 CD2 UNN A 233 3.592 26.349 14.551 1.00 0.04 C HETATM 2723 OAG UNN A 233 2.390 26.510 14.257 1.00 -0.57 O HETATM 2724 OAD UNN A 233 4.254 25.302 14.333 1.00 -0.57 O HETATM 2725 CD1 UNN A 233 4.598 27.241 16.708 1.00 -0.02 C HETATM 2726 CAH UNN A 233 5.651 28.173 17.343 1.00 0.05 C HETATM 2727 CAN UNN A 233 7.014 28.007 16.644 1.00 0.23 C HETATM 2728 OAE UNN A 233 7.545 26.887 16.586 1.00 -0.37 O HETATM 2729 OAK UNN A 233 7.539 29.158 16.145 1.00 -0.28 O HETATM 2730 CAA UNN A 233 8.643 28.991 15.259 1.00 0.07 C HETATM 2731 H UNN A 233 8.990 29.977 14.915 1.00 0.06 H HETATM 2732 H UNN A 233 8.330 28.390 14.393 1.00 0.06 H HETATM 2733 H UNN A 233 9.461 28.478 15.785 1.00 0.06 H HETATM 2734 H UNN A 233 5.759 27.924 18.409 1.00 0.05 H HETATM 2735 H UNN A 233 5.318 29.216 17.242 1.00 0.05 H HETATM 2736 H UNN A 233 4.944 26.203 16.818 1.00 0.03 H HETATM 2737 H UNN A 233 3.650 27.371 17.250 1.00 0.03 H HETATM 2738 H UNN A 233 5.317 27.623 14.717 1.00 0.05 H HETATM 2739 H UNN A 233 2.500 28.631 15.322 1.00 0.04 H HETATM 2740 H UNN A 233 3.978 29.589 15.673 1.00 0.04 H HETATM 2741 H UNN A 233 3.359 28.479 12.919 1.00 0.10 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 15 14 2480 CONECT 211 210 2481 CONECT 228 227 2481 CONECT 489 488 490 2480 CONECT 1951 1950 2469 CONECT 2469 1951 2468 CONECT 2480 15 489 CONECT 2481 211 228 CONECT 2712 2713 CONECT 2713 2712 2714 2715 CONECT 2714 2713 CONECT 2715 2713 2716 2720 2741 CONECT 2716 2715 2717 2718 2719 CONECT 2717 2716 CONECT 2718 2716 CONECT 2719 2716 CONECT 2720 2715 2721 2739 2740 CONECT 2721 2720 2722 2725 2738 CONECT 2722 2721 2723 2724 CONECT 2723 2722 CONECT 2724 2722 CONECT 2725 2721 2726 2736 2737 CONECT 2726 2725 2727 2734 2735 CONECT 2727 2726 2728 2729 CONECT 2728 2727 CONECT 2729 2727 2730 CONECT 2730 2729 2731 2732 2733 CONECT 2731 2730 CONECT 2732 2730 CONECT 2733 2730 CONECT 2734 2726 CONECT 2735 2726 CONECT 2736 2725 CONECT 2737 2725 CONECT 2738 2721 CONECT 2739 2720 CONECT 2740 2720 CONECT 2741 2715 MASTER 0 0 0 0 0 0 0 0 2740 1 42 20 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: 4nwc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3s9e
RCSB PDB
PDBbind
258aa, >3S9E_1|Chains... *
3u92
RCSB PDB
PDBbind
257aa, >3U92_1|Chains... at 99%
3u93
RCSB PDB
PDBbind
257aa, >3U93_1|Chains... at 99%
4e0w
RCSB PDB
PDBbind
258aa, >4E0W_1|Chain... at 100%
4g8n
RCSB PDB
PDBbind
258aa, >4G8N_1|Chain... at 100%
4igr
RCSB PDB
PDBbind
258aa, >4IGR_1|Chain... at 100%
4nwd
RCSB PDB
PDBbind
258aa, >4NWD_1|Chain... at 100%
5nf6
RCSB PDB
PDBbind
258aa, >5NF6_1|Chains... at 100%
5o4f
RCSB PDB
PDBbind
258aa, >5O4F_1|Chains... at 100%
6f28
RCSB PDB
PDBbind
258aa, >6F28_1|Chains... at 100%
6f29
RCSB PDB
PDBbind
258aa, >6F29_1|Chain... at 100%
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
4nwc
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Glutamate receptor ionotropic, kainate 3 GluK3 LBD
Ligand Name
2QE
EC.Number
E.C.-.-.-.-
Resolution
2.01(Å)
Affinity (Kd/Ki/IC50)
Ki=1.74uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Chemmedchem Vol. 9: pp. 2254-2259
Ligand Properties
Formula
C
9
H
1
6
NO
6
Molecular Weight
234.226
Exact Mass
234.098
No. of atoms
32
No. of bonds
31
Polar Surface Area
128.54
LOGP Value
-1.21 (
Computed with XLOGP3
)
-1.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 0
Canonical SMILES
COC(=O)CC[C@@H](C(=O)O)C[C@@H](C(=O)O)[NH3+]
InChI String
InChI=1S/C9H15NO6/c1-16-7(11)3-2-5(8(12)13)4-6(10)9(14)15/h5-6H,2-4,10H2,1H3,(H,12,13)(H,14,15)/p+1/t5-,6+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P42264
Entrez Gene ID
NCBI Entrez Gene ID:
298521
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