Browse entries in the PDBbind-CN Database
HEADER 6BKW_COMPLEX COMPND 6BKW_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 88 GLY SER TRP GLU ILE ASP PRO LYS ASP LEU THR PHE LEU SEQRES 2 A 88 LYS GLU LEU GLY THR GLY GLN PHE GLY VAL VAL LYS TYR SEQRES 3 A 88 GLY LYS TRP ARG GLY GLN TYR ASP VAL ALA ILE LYS MET SEQRES 4 A 88 ILE LYS GLU GLY SER MET SER GLU ASP GLU PHE ILE GLU SEQRES 5 A 88 GLU ALA LYS VAL MET MET ASN LEU SER HIS GLU LYS LEU SEQRES 6 A 88 VAL GLN LEU TYR GLY VAL CYS THR LYS GLN ARG PRO ILE SEQRES 7 A 88 PHE ILE ILE THR GLU TYR MET ALA ASN GLY SEQRES 1 A 177 LEU LEU ASN TYR LEU ARG GLU MET ARG HIS ARG PHE GLN SEQRES 2 A 177 THR GLN GLN LEU LEU GLU MET CYS LYS ASP VAL CYS GLU SEQRES 3 A 177 ALA MET GLU TYR LEU GLU SER LYS GLN PHE LEU HIS ARG SEQRES 4 A 177 ASP LEU ALA ALA ARG ASN CYS LEU VAL ASN ASP GLN GLY SEQRES 5 A 177 VAL VAL LYS VAL SER ASP PHE GLY LEU SER ARG TYR VAL SEQRES 6 A 177 LEU ASP ASP GLU TYR THR SER SER VAL GLY SER LYS PHE SEQRES 7 A 177 PRO VAL ARG TRP SER PRO PRO GLU VAL LEU MET TYR SER SEQRES 8 A 177 LYS PHE SER SER LYS SER ASP ILE TRP ALA PHE GLY VAL SEQRES 9 A 177 LEU MET TRP GLU ILE TYR SER LEU GLY LYS MET PRO TYR SEQRES 10 A 177 GLU ARG PHE THR ASN SER GLU THR ALA GLU HIS ILE ALA SEQRES 11 A 177 GLN GLY LEU ARG LEU TYR ARG PRO HIS LEU ALA SER GLU SEQRES 12 A 177 LYS VAL TYR THR ILE MET TYR SER CYS TRP HIS GLU LYS SEQRES 13 A 177 ALA ASP GLU ARG PRO THR PHE LYS ILE LEU LEU SER ASN SEQRES 14 A 177 ILE LEU ASP VAL MET ASP GLU ASN HET DXM A 469 60 ATOM 1 N GLY A 393 54.553 -6.467 -7.581 1.00 37.43 N ATOM 2 CA GLY A 393 54.019 -5.120 -7.459 1.00 50.87 C ATOM 3 C GLY A 393 53.155 -4.922 -6.222 1.00 53.60 C ATOM 4 O GLY A 393 52.654 -3.825 -5.966 1.00 54.19 O ATOM 5 HN3 GLY A 393 53.767 -7.146 -7.636 1.00 0.00 H ATOM 6 HN2 GLY A 393 55.141 -6.682 -6.751 1.00 0.00 H ATOM 7 HN1 GLY A 393 55.131 -6.533 -8.443 1.00 0.00 H ATOM 8 N SER A 394 52.981 -5.990 -5.449 1.00 42.41 N ATOM 9 CA SER A 394 52.178 -5.925 -4.238 1.00 45.79 C ATOM 10 C SER A 394 52.878 -5.071 -3.179 1.00 44.41 C ATOM 11 O SER A 394 54.022 -4.635 -3.340 1.00 35.44 O ATOM 12 CB SER A 394 51.927 -7.336 -3.708 1.00 46.62 C ATOM 13 OG SER A 394 53.130 -8.083 -3.677 1.00 53.59 O ATOM 14 HG SER A 394 52.944 -8.992 -3.331 1.00 0.00 H ATOM 15 H SER A 394 53.428 -6.890 -5.716 1.00 0.00 H ATOM 16 N TRP A 395 52.170 -4.813 -2.083 1.00 39.50 N ATOM 17 CA TRP A 395 52.782 -4.107 -0.967 1.00 25.37 C ATOM 18 C TRP A 395 53.761 -5.037 -0.264 1.00 25.40 C ATOM 19 O TRP A 395 53.369 -6.075 0.283 1.00 23.33 O ATOM 20 CB TRP A 395 51.723 -3.603 0.006 1.00 27.72 C ATOM 21 CG TRP A 395 52.278 -2.845 1.181 1.00 38.34 C ATOM 22 CD1 TRP A 395 53.569 -2.429 1.366 1.00 42.16 C ATOM 23 CD2 TRP A 395 51.551 -2.407 2.332 1.00 41.85 C ATOM 24 NE1 TRP A 395 53.685 -1.766 2.562 1.00 36.04 N ATOM 25 CE2 TRP A 395 52.461 -1.736 3.173 1.00 40.14 C ATOM 26 CE3 TRP A 395 50.218 -2.512 2.731 1.00 41.29 C ATOM 27 CZ2 TRP A 395 52.080 -1.178 4.388 1.00 56.75 C ATOM 28 CZ3 TRP A 395 49.845 -1.959 3.935 1.00 47.22 C ATOM 29 CH2 TRP A 395 50.769 -1.302 4.752 1.00 54.97 C ATOM 30 HE1 TRP A 395 54.561 -1.353 2.942 1.00 0.00 H ATOM 31 H TRP A 395 51.177 -5.116 -2.023 1.00 0.00 H ATOM 32 N GLU A 396 55.033 -4.658 -0.291 1.00 23.36 N ATOM 33 CA GLU A 396 56.091 -5.370 0.412 1.00 22.50 C ATOM 34 C GLU A 396 56.130 -4.830 1.838 1.00 24.12 C ATOM 35 O GLU A 396 56.730 -3.787 2.114 1.00 24.64 O ATOM 36 CB GLU A 396 57.402 -5.168 -0.338 1.00 29.34 C ATOM 37 CG GLU A 396 58.556 -6.021 0.134 1.00 30.85 C ATOM 38 CD GLU A 396 58.402 -7.510 -0.159 1.00 26.53 C ATOM 39 OE1 GLU A 396 58.014 -7.923 -1.276 1.00 29.09 O ATOM 40 OE2 GLU A 396 58.706 -8.274 0.752 1.00 20.96 O ATOM 41 H GLU A 396 55.286 -3.812 -0.841 1.00 0.00 H ATOM 42 N ILE A 397 55.476 -5.548 2.750 1.00 16.34 N ATOM 43 CA ILE A 397 55.405 -5.146 4.148 1.00 16.76 C ATOM 44 C ILE A 397 56.751 -5.394 4.806 1.00 19.72 C ATOM 45 O ILE A 397 57.417 -6.400 4.541 1.00 19.47 O ATOM 46 CB ILE A 397 54.270 -5.917 4.847 1.00 19.26 C ATOM 47 CG1 ILE A 397 52.923 -5.335 4.403 1.00 18.41 C ATOM 48 CG2 ILE A 397 54.426 -5.876 6.384 1.00 19.06 C ATOM 49 CD1 ILE A 397 51.711 -6.126 4.848 1.00 22.88 C ATOM 50 H ILE A 397 55.001 -6.424 2.454 1.00 0.00 H ATOM 51 N ASP A 398 57.173 -4.464 5.651 1.00 17.77 N ATOM 52 CA ASP A 398 58.430 -4.613 6.371 1.00 18.90 C ATOM 53 C ASP A 398 58.228 -5.597 7.517 1.00 21.30 C ATOM 54 O ASP A 398 57.413 -5.331 8.405 1.00 18.12 O ATOM 55 CB ASP A 398 58.838 -3.256 6.940 1.00 18.84 C ATOM 56 CG ASP A 398 60.229 -3.258 7.543 1.00 27.05 C ATOM 57 OD1 ASP A 398 60.769 -4.345 7.842 1.00 22.27 O ATOM 58 OD2 ASP A 398 60.777 -2.148 7.741 1.00 27.77 O ATOM 59 H ASP A 398 56.596 -3.612 5.803 1.00 0.00 H ATOM 60 N PRO A 399 58.906 -6.744 7.525 1.00 20.89 N ATOM 61 CA PRO A 399 58.649 -7.716 8.603 1.00 20.70 C ATOM 62 C PRO A 399 58.954 -7.165 9.987 1.00 17.14 C ATOM 63 O PRO A 399 58.354 -7.636 10.965 1.00 18.08 O ATOM 64 CB PRO A 399 59.539 -8.915 8.239 1.00 26.05 C ATOM 65 CG PRO A 399 60.525 -8.393 7.261 1.00 27.69 C ATOM 66 CD PRO A 399 59.909 -7.228 6.560 1.00 23.85 C ATOM 67 N LYS A 400 59.835 -6.166 10.091 1.00 19.26 N ATOM 68 CA LYS A 400 60.070 -5.506 11.371 1.00 22.66 C ATOM 69 C LYS A 400 58.790 -4.920 11.953 1.00 23.54 C ATOM 70 O LYS A 400 58.694 -4.751 13.173 1.00 20.69 O ATOM 71 CB LYS A 400 61.095 -4.380 11.213 1.00 28.89 C ATOM 72 CG LYS A 400 62.467 -4.823 10.734 1.00 55.49 C ATOM 73 CD LYS A 400 63.370 -3.628 10.419 1.00 55.04 C ATOM 74 CE LYS A 400 63.578 -2.739 11.634 1.00 60.62 C ATOM 75 NZ LYS A 400 64.643 -1.722 11.406 1.00 73.07 N ATOM 76 HZ1 LYS A 400 65.541 -2.203 11.197 1.00 0.00 H ATOM 77 HZ2 LYS A 400 64.377 -1.118 10.602 1.00 0.00 H ATOM 78 HZ3 LYS A 400 64.751 -1.138 12.260 1.00 0.00 H ATOM 79 H LYS A 400 60.360 -5.855 9.249 1.00 0.00 H ATOM 80 N ASP A 401 57.802 -4.595 11.108 1.00 16.42 N ATOM 81 CA ASP A 401 56.560 -3.995 11.579 1.00 15.24 C ATOM 82 C ASP A 401 55.541 -5.018 12.070 1.00 17.45 C ATOM 83 O ASP A 401 54.444 -4.623 12.480 1.00 15.79 O ATOM 84 CB ASP A 401 55.910 -3.165 10.469 1.00 16.81 C ATOM 85 CG ASP A 401 56.644 -1.869 10.183 1.00 21.37 C ATOM 86 OD1 ASP A 401 56.493 -1.350 9.058 1.00 18.76 O ATOM 87 OD2 ASP A 401 57.375 -1.381 11.069 1.00 23.50 O ATOM 88 H ASP A 401 57.924 -4.775 10.091 1.00 0.00 H ATOM 89 N LEU A 402 55.862 -6.307 12.049 1.00 15.70 N ATOM 90 CA LEU A 402 54.942 -7.356 12.453 1.00 18.38 C ATOM 91 C LEU A 402 55.342 -7.850 13.835 1.00 22.83 C ATOM 92 O LEU A 402 56.521 -8.113 14.086 1.00 25.98 O ATOM 93 CB LEU A 402 54.992 -8.509 11.448 1.00 19.60 C ATOM 94 CG LEU A 402 54.525 -8.168 10.033 1.00 17.28 C ATOM 95 CD1 LEU A 402 54.836 -9.337 9.086 1.00 20.18 C ATOM 96 CD2 LEU A 402 53.039 -7.818 10.021 1.00 20.07 C ATOM 97 H LEU A 402 56.814 -6.577 11.729 1.00 0.00 H ATOM 98 N THR A 403 54.372 -7.948 14.739 1.00 17.49 N ATOM 99 CA THR A 403 54.575 -8.576 16.044 1.00 19.39 C ATOM 100 C THR A 403 53.737 -9.845 16.074 1.00 20.01 C ATOM 101 O THR A 403 52.519 -9.778 15.919 1.00 18.19 O ATOM 102 CB THR A 403 54.133 -7.649 17.179 1.00 27.40 C ATOM 103 OG1 THR A 403 54.867 -6.415 17.129 1.00 22.79 O ATOM 104 CG2 THR A 403 54.375 -8.314 18.536 1.00 29.12 C ATOM 105 HG1 THR A 403 54.700 -5.968 16.262 1.00 0.00 H ATOM 106 H THR A 403 53.433 -7.563 14.509 1.00 0.00 H ATOM 107 N PHE A 404 54.381 -10.996 16.251 1.00 18.43 N ATOM 108 CA PHE A 404 53.642 -12.250 16.348 1.00 17.26 C ATOM 109 C PHE A 404 53.130 -12.430 17.771 1.00 20.62 C ATOM 110 O PHE A 404 53.872 -12.220 18.740 1.00 21.26 O ATOM 111 CB PHE A 404 54.543 -13.435 16.005 1.00 20.10 C ATOM 112 CG PHE A 404 55.030 -13.460 14.584 1.00 26.66 C ATOM 113 CD1 PHE A 404 54.552 -12.576 13.637 1.00 39.86 C ATOM 114 CD2 PHE A 404 55.972 -14.397 14.195 1.00 50.80 C ATOM 115 CE1 PHE A 404 55.019 -12.616 12.331 1.00 42.97 C ATOM 116 CE2 PHE A 404 56.433 -14.444 12.892 1.00 50.98 C ATOM 117 CZ PHE A 404 55.956 -13.554 11.962 1.00 42.22 C ATOM 118 H PHE A 404 55.419 -11.002 16.321 1.00 0.00 H ATOM 119 N LEU A 405 51.865 -12.857 17.897 1.00 18.06 N ATOM 120 CA LEU A 405 51.203 -12.919 19.197 1.00 17.50 C ATOM 121 C LEU A 405 50.615 -14.282 19.531 1.00 19.16 C ATOM 122 O LEU A 405 50.715 -14.709 20.684 1.00 24.01 O ATOM 123 CB LEU A 405 50.105 -11.832 19.302 1.00 20.22 C ATOM 124 CG LEU A 405 50.630 -10.391 19.291 1.00 24.50 C ATOM 125 CD1 LEU A 405 49.464 -9.437 19.165 1.00 29.57 C ATOM 126 CD2 LEU A 405 51.437 -10.077 20.541 1.00 28.51 C ATOM 127 H LEU A 405 51.342 -13.151 17.047 1.00 0.00 H ATOM 128 N LYS A 406 49.989 -14.966 18.574 1.00 16.79 N ATOM 129 CA LYS A 406 49.362 -16.246 18.869 1.00 16.91 C ATOM 130 C LYS A 406 49.401 -17.155 17.652 1.00 17.70 C ATOM 131 O LYS A 406 49.424 -16.698 16.506 1.00 19.86 O ATOM 132 CB LYS A 406 47.899 -16.091 19.296 1.00 21.22 C ATOM 133 CG LYS A 406 47.679 -15.269 20.553 1.00 44.61 C ATOM 134 CD LYS A 406 48.156 -15.999 21.797 1.00 55.29 C ATOM 135 CE LYS A 406 48.098 -15.095 23.018 1.00 68.22 C ATOM 136 NZ LYS A 406 48.453 -15.816 24.270 1.00 76.82 N ATOM 137 HZ1 LYS A 406 47.787 -16.601 24.417 1.00 0.00 H ATOM 138 HZ2 LYS A 406 49.420 -16.190 24.191 1.00 0.00 H ATOM 139 HZ3 LYS A 406 48.399 -15.159 25.074 1.00 0.00 H ATOM 140 H LYS A 406 49.948 -14.582 17.608 1.00 0.00 H ATOM 141 N GLU A 407 49.394 -18.456 17.922 1.00 18.84 N ATOM 142 CA GLU A 407 49.260 -19.461 16.879 1.00 17.61 C ATOM 143 C GLU A 407 47.784 -19.612 16.504 1.00 20.80 C ATOM 144 O GLU A 407 46.923 -19.706 17.386 1.00 21.55 O ATOM 145 CB GLU A 407 49.761 -20.806 17.405 1.00 22.15 C ATOM 146 CG GLU A 407 51.191 -20.817 17.935 1.00 35.83 C ATOM 147 CD GLU A 407 52.237 -20.765 16.839 1.00 45.48 C ATOM 148 OE1 GLU A 407 51.860 -20.725 15.653 1.00 45.39 O ATOM 149 OE2 GLU A 407 53.445 -20.763 17.166 1.00 50.96 O ATOM 150 H GLU A 407 49.487 -18.766 18.910 1.00 0.00 H ATOM 151 N LEU A 408 47.489 -19.647 15.200 1.00 16.94 N ATOM 152 CA LEU A 408 46.126 -19.855 14.717 1.00 15.46 C ATOM 153 C LEU A 408 45.931 -21.218 14.069 1.00 17.82 C ATOM 154 O LEU A 408 44.862 -21.475 13.504 1.00 22.90 O ATOM 155 CB LEU A 408 45.718 -18.784 13.706 1.00 17.51 C ATOM 156 CG LEU A 408 45.636 -17.359 14.244 1.00 17.54 C ATOM 157 CD1 LEU A 408 45.332 -16.373 13.116 1.00 14.24 C ATOM 158 CD2 LEU A 408 44.620 -17.221 15.390 1.00 15.98 C ATOM 159 H LEU A 408 48.255 -19.522 14.507 1.00 0.00 H ATOM 160 N GLY A 409 46.933 -22.064 14.091 1.00 20.81 N ATOM 161 CA GLY A 409 46.824 -23.376 13.491 1.00 20.30 C ATOM 162 C GLY A 409 47.644 -23.502 12.220 1.00 19.85 C ATOM 163 O GLY A 409 48.453 -22.640 11.865 1.00 20.40 O ATOM 164 H GLY A 409 47.824 -21.786 14.549 1.00 0.00 H ATOM 165 N THR A 410 47.437 -24.628 11.542 1.00 17.95 N ATOM 166 CA THR A 410 48.199 -24.992 10.361 1.00 16.88 C ATOM 167 C THR A 410 47.248 -25.330 9.225 1.00 19.64 C ATOM 168 O THR A 410 46.203 -25.963 9.432 1.00 23.22 O ATOM 169 CB THR A 410 49.097 -26.212 10.653 1.00 29.91 C ATOM 170 OG1 THR A 410 50.058 -25.878 11.661 1.00 34.85 O ATOM 171 CG2 THR A 410 49.838 -26.671 9.397 1.00 34.61 C ATOM 172 HG1 THR A 410 50.630 -26.665 11.843 1.00 0.00 H ATOM 173 H THR A 410 46.695 -25.277 11.873 1.00 0.00 H ATOM 174 N GLY A 411 47.627 -24.900 8.026 1.00 20.01 N ATOM 175 CA GLY A 411 46.881 -25.167 6.817 1.00 20.71 C ATOM 176 C GLY A 411 47.760 -25.728 5.722 1.00 17.93 C ATOM 177 O GLY A 411 48.849 -26.257 5.978 1.00 18.68 O ATOM 178 H GLY A 411 48.503 -24.344 7.954 1.00 0.00 H ATOM 179 N GLN A 412 47.295 -25.575 4.482 1.00 17.66 N ATOM 180 CA GLN A 412 47.959 -26.159 3.323 1.00 18.90 C ATOM 181 C GLN A 412 49.346 -25.577 3.087 1.00 18.80 C ATOM 182 O GLN A 412 50.175 -26.230 2.445 1.00 23.80 O ATOM 183 CB GLN A 412 47.064 -25.972 2.094 1.00 29.88 C ATOM 184 CG GLN A 412 47.542 -26.698 0.853 1.00 35.41 C ATOM 185 CD GLN A 412 47.450 -28.205 0.992 1.00 40.20 C ATOM 186 OE1 GLN A 412 46.515 -28.729 1.596 1.00 28.90 O ATOM 187 NE2 GLN A 412 48.427 -28.909 0.439 1.00 47.91 N ATOM 188 HE22 GLN A 412 49.198 -28.424 -0.062 1.00 0.00 H ATOM 189 HE21 GLN A 412 48.423 -29.947 0.506 1.00 0.00 H ATOM 190 H GLN A 412 46.428 -25.019 4.336 1.00 0.00 H ATOM 191 N PHE A 413 49.624 -24.372 3.585 1.00 17.97 N ATOM 192 CA PHE A 413 50.943 -23.763 3.473 1.00 18.99 C ATOM 193 C PHE A 413 51.672 -23.725 4.805 1.00 21.49 C ATOM 194 O PHE A 413 52.656 -22.986 4.940 1.00 21.55 O ATOM 195 CB PHE A 413 50.840 -22.335 2.940 1.00 22.77 C ATOM 196 CG PHE A 413 50.321 -22.230 1.546 1.00 17.57 C ATOM 197 CD1 PHE A 413 49.333 -21.314 1.248 1.00 17.32 C ATOM 198 CD2 PHE A 413 50.812 -23.030 0.531 1.00 21.71 C ATOM 199 CE1 PHE A 413 48.837 -21.193 -0.028 1.00 19.67 C ATOM 200 CE2 PHE A 413 50.326 -22.909 -0.752 1.00 19.33 C ATOM 201 CZ PHE A 413 49.333 -21.987 -1.031 1.00 19.44 C ATOM 202 H PHE A 413 48.870 -23.846 4.072 1.00 0.00 H ATOM 203 N GLY A 414 51.184 -24.451 5.803 1.00 18.87 N ATOM 204 CA GLY A 414 51.854 -24.494 7.085 1.00 22.04 C ATOM 205 C GLY A 414 51.237 -23.587 8.125 1.00 18.75 C ATOM 206 O GLY A 414 50.021 -23.401 8.151 1.00 19.63 O ATOM 207 H GLY A 414 50.309 -24.996 5.662 1.00 0.00 H ATOM 208 N VAL A 415 52.089 -22.986 8.958 1.00 18.43 N ATOM 209 CA VAL A 415 51.655 -22.305 10.175 1.00 17.01 C ATOM 210 C VAL A 415 51.085 -20.930 9.842 1.00 17.99 C ATOM 211 O VAL A 415 51.597 -20.216 8.969 1.00 19.48 O ATOM 212 CB VAL A 415 52.836 -22.189 11.157 1.00 23.86 C ATOM 213 CG1 VAL A 415 52.437 -21.439 12.416 1.00 29.85 C ATOM 214 CG2 VAL A 415 53.353 -23.565 11.520 1.00 24.59 C ATOM 215 H VAL A 415 53.104 -23.003 8.731 1.00 0.00 H ATOM 216 N VAL A 416 50.023 -20.561 10.557 1.00 17.54 N ATOM 217 CA VAL A 416 49.415 -19.241 10.484 1.00 16.31 C ATOM 218 C VAL A 416 49.402 -18.645 11.887 1.00 18.62 C ATOM 219 O VAL A 416 49.066 -19.329 12.861 1.00 17.27 O ATOM 220 CB VAL A 416 47.973 -19.303 9.925 1.00 16.89 C ATOM 221 CG1 VAL A 416 47.380 -17.894 9.756 1.00 17.14 C ATOM 222 CG2 VAL A 416 47.916 -20.090 8.606 1.00 18.39 C ATOM 223 H VAL A 416 49.604 -21.258 11.206 1.00 0.00 H ATOM 224 N LYS A 417 49.767 -17.368 11.992 1.00 15.75 N ATOM 225 CA LYS A 417 49.802 -16.678 13.271 1.00 13.78 C ATOM 226 C LYS A 417 48.935 -15.430 13.269 1.00 13.86 C ATOM 227 O LYS A 417 48.687 -14.819 12.223 1.00 15.72 O ATOM 228 CB LYS A 417 51.254 -16.331 13.645 1.00 18.69 C ATOM 229 CG LYS A 417 52.067 -17.603 13.922 1.00 30.21 C ATOM 230 CD LYS A 417 53.471 -17.389 14.440 1.00 30.93 C ATOM 231 CE LYS A 417 54.204 -18.753 14.529 1.00 26.33 C ATOM 232 NZ LYS A 417 55.522 -18.614 15.194 1.00 63.73 N ATOM 233 HZ1 LYS A 417 56.115 -17.954 14.651 1.00 0.00 H ATOM 234 HZ2 LYS A 417 55.386 -18.247 16.158 1.00 0.00 H ATOM 235 HZ3 LYS A 417 55.987 -19.543 15.238 1.00 0.00 H ATOM 236 H LYS A 417 50.035 -16.848 11.132 1.00 0.00 H ATOM 237 N TYR A 418 48.440 -15.096 14.459 1.00 13.88 N ATOM 238 CA TYR A 418 47.830 -13.805 14.729 1.00 13.08 C ATOM 239 C TYR A 418 48.913 -12.855 15.219 1.00 14.10 C ATOM 240 O TYR A 418 49.756 -13.235 16.029 1.00 15.44 O ATOM 241 CB TYR A 418 46.757 -13.965 15.811 1.00 17.28 C ATOM 242 CG TYR A 418 46.371 -12.672 16.500 1.00 13.50 C ATOM 243 CD1 TYR A 418 45.700 -11.679 15.817 1.00 13.67 C ATOM 244 CD2 TYR A 418 46.710 -12.438 17.832 1.00 18.12 C ATOM 245 CE1 TYR A 418 45.359 -10.486 16.438 1.00 14.61 C ATOM 246 CE2 TYR A 418 46.375 -11.262 18.457 1.00 20.78 C ATOM 247 CZ TYR A 418 45.696 -10.295 17.758 1.00 20.17 C ATOM 248 OH TYR A 418 45.383 -9.111 18.384 1.00 23.14 O ATOM 249 HH TYR A 418 44.898 -8.523 17.752 1.00 0.00 H ATOM 250 H TYR A 418 48.492 -15.791 15.231 1.00 0.00 H ATOM 251 N GLY A 419 48.863 -11.615 14.754 1.00 14.22 N ATOM 252 CA GLY A 419 49.816 -10.616 15.187 1.00 16.36 C ATOM 253 C GLY A 419 49.275 -9.219 14.959 1.00 13.55 C ATOM 254 O GLY A 419 48.112 -9.030 14.606 1.00 15.82 O ATOM 255 H GLY A 419 48.127 -11.356 14.067 1.00 0.00 H ATOM 256 N LYS A 420 50.150 -8.234 15.145 1.00 14.63 N ATOM 257 CA LYS A 420 49.816 -6.846 14.875 1.00 15.26 C ATOM 258 C LYS A 420 50.806 -6.233 13.900 1.00 15.29 C ATOM 259 O LYS A 420 51.974 -6.625 13.835 1.00 16.08 O ATOM 260 CB LYS A 420 49.762 -5.999 16.146 1.00 18.98 C ATOM 261 CG LYS A 420 48.438 -6.212 16.890 1.00 28.36 C ATOM 262 CD LYS A 420 48.361 -5.499 18.208 1.00 35.03 C ATOM 263 CE LYS A 420 47.007 -5.719 18.864 1.00 30.29 C ATOM 264 NZ LYS A 420 45.890 -5.069 18.118 1.00 31.27 N ATOM 265 HZ1 LYS A 420 46.057 -4.044 18.070 1.00 0.00 H ATOM 266 HZ2 LYS A 420 45.844 -5.460 17.155 1.00 0.00 H ATOM 267 HZ3 LYS A 420 44.993 -5.252 18.611 1.00 0.00 H ATOM 268 H LYS A 420 51.102 -8.465 15.494 1.00 0.00 H ATOM 269 N TRP A 421 50.306 -5.284 13.126 1.00 14.96 N ATOM 270 CA TRP A 421 51.127 -4.451 12.256 1.00 14.63 C ATOM 271 C TRP A 421 51.252 -3.077 12.896 1.00 14.41 C ATOM 272 O TRP A 421 50.248 -2.437 13.245 1.00 14.19 O ATOM 273 CB TRP A 421 50.539 -4.359 10.842 1.00 15.59 C ATOM 274 CG TRP A 421 51.331 -3.501 9.865 1.00 14.73 C ATOM 275 CD1 TRP A 421 52.410 -3.891 9.098 1.00 17.48 C ATOM 276 CD2 TRP A 421 51.112 -2.123 9.553 1.00 17.25 C ATOM 277 NE1 TRP A 421 52.861 -2.841 8.347 1.00 18.60 N ATOM 278 CE2 TRP A 421 52.075 -1.750 8.590 1.00 16.51 C ATOM 279 CE3 TRP A 421 50.184 -1.169 9.979 1.00 29.25 C ATOM 280 CZ2 TRP A 421 52.152 -0.461 8.073 1.00 25.46 C ATOM 281 CZ3 TRP A 421 50.255 0.111 9.449 1.00 29.15 C ATOM 282 CH2 TRP A 421 51.229 0.451 8.507 1.00 27.73 C ATOM 283 HE1 TRP A 421 53.672 -2.868 7.696 1.00 0.00 H ATOM 284 H TRP A 421 49.278 -5.125 13.139 1.00 0.00 H ATOM 285 N ARG A 422 52.502 -2.651 13.072 1.00 14.32 N ATOM 286 CA ARG A 422 52.863 -1.388 13.714 1.00 15.58 C ATOM 287 C ARG A 422 52.173 -1.230 15.061 1.00 16.04 C ATOM 288 O ARG A 422 51.713 -0.153 15.437 1.00 18.39 O ATOM 289 CB ARG A 422 52.650 -0.187 12.798 1.00 15.03 C ATOM 290 CG ARG A 422 53.601 -0.235 11.626 1.00 19.80 C ATOM 291 CD ARG A 422 53.655 1.076 10.866 1.00 19.99 C ATOM 292 NE ARG A 422 54.548 0.961 9.724 1.00 20.35 N ATOM 293 CZ ARG A 422 54.680 1.884 8.779 1.00 23.11 C ATOM 294 NH1 ARG A 422 53.956 2.999 8.833 1.00 20.60 N ATOM 295 NH2 ARG A 422 55.524 1.674 7.775 1.00 21.46 N ATOM 296 HE ARG A 422 55.122 0.098 9.642 1.00 0.00 H ATOM 297 HH12 ARG A 422 54.059 3.722 8.093 1.00 0.00 H ATOM 298 HH11 ARG A 422 53.287 3.147 9.615 1.00 0.00 H ATOM 299 HH22 ARG A 422 55.634 2.391 7.030 1.00 0.00 H ATOM 300 HH21 ARG A 422 56.074 0.793 7.734 1.00 0.00 H ATOM 301 H ARG A 422 53.274 -3.258 12.729 1.00 0.00 H ATOM 302 N GLY A 423 52.090 -2.338 15.787 1.00 15.42 N ATOM 303 CA GLY A 423 51.613 -2.320 17.149 1.00 21.32 C ATOM 304 C GLY A 423 50.128 -2.102 17.312 1.00 23.81 C ATOM 305 O GLY A 423 49.652 -2.082 18.449 1.00 32.97 O ATOM 306 H GLY A 423 52.376 -3.243 15.363 1.00 0.00 H ATOM 307 N GLN A 424 49.376 -1.940 16.225 1.00 18.57 N ATOM 308 CA GLN A 424 47.996 -1.489 16.343 1.00 19.18 C ATOM 309 C GLN A 424 46.997 -2.379 15.611 1.00 21.79 C ATOM 310 O GLN A 424 45.948 -2.717 16.170 1.00 21.95 O ATOM 311 CB GLN A 424 47.876 -0.057 15.827 1.00 20.87 C ATOM 312 CG GLN A 424 46.452 0.456 15.729 1.00 25.40 C ATOM 313 CD GLN A 424 46.386 1.966 15.647 1.00 38.01 C ATOM 314 OE1 GLN A 424 47.361 2.659 15.943 1.00 38.31 O ATOM 315 NE2 GLN A 424 45.231 2.485 15.246 1.00 46.12 N ATOM 316 HE22 GLN A 424 44.435 1.860 15.007 1.00 0.00 H ATOM 317 HE21 GLN A 424 45.122 3.517 15.171 1.00 0.00 H ATOM 318 H GLN A 424 49.777 -2.137 15.286 1.00 0.00 H ATOM 319 N TYR A 425 47.289 -2.746 14.367 1.00 15.83 N ATOM 320 CA TYR A 425 46.303 -3.379 13.499 1.00 13.41 C ATOM 321 C TYR A 425 46.423 -4.895 13.563 1.00 15.40 C ATOM 322 O TYR A 425 47.492 -5.447 13.287 1.00 16.63 O ATOM 323 CB TYR A 425 46.487 -2.922 12.054 1.00 16.79 C ATOM 324 CG TYR A 425 46.199 -1.458 11.858 1.00 16.85 C ATOM 325 CD1 TYR A 425 47.223 -0.544 11.779 1.00 15.67 C ATOM 326 CD2 TYR A 425 44.907 -0.995 11.796 1.00 21.43 C ATOM 327 CE1 TYR A 425 46.973 0.799 11.619 1.00 17.33 C ATOM 328 CE2 TYR A 425 44.637 0.357 11.636 1.00 24.66 C ATOM 329 CZ TYR A 425 45.683 1.250 11.551 1.00 16.68 C ATOM 330 OH TYR A 425 45.464 2.611 11.387 1.00 18.18 O ATOM 331 HH TYR A 425 44.936 2.954 12.151 1.00 0.00 H ATOM 332 H TYR A 425 48.248 -2.577 14.002 1.00 0.00 H ATOM 333 N ASP A 426 45.319 -5.568 13.881 1.00 14.16 N ATOM 334 CA ASP A 426 45.318 -7.024 13.892 1.00 13.39 C ATOM 335 C ASP A 426 45.545 -7.546 12.481 1.00 15.58 C ATOM 336 O ASP A 426 44.944 -7.059 11.513 1.00 16.90 O ATOM 337 CB ASP A 426 43.967 -7.555 14.393 1.00 16.21 C ATOM 338 CG ASP A 426 43.734 -7.301 15.878 1.00 22.00 C ATOM 339 OD1 ASP A 426 42.551 -7.297 16.284 1.00 25.76 O ATOM 340 OD2 ASP A 426 44.705 -7.103 16.647 1.00 21.74 O ATOM 341 H ASP A 426 44.451 -5.050 14.123 1.00 0.00 H ATOM 342 N VAL A 427 46.402 -8.563 12.364 1.00 15.17 N ATOM 343 CA VAL A 427 46.659 -9.219 11.090 1.00 15.42 C ATOM 344 C VAL A 427 46.794 -10.715 11.315 1.00 13.82 C ATOM 345 O VAL A 427 47.071 -11.183 12.422 1.00 14.94 O ATOM 346 CB VAL A 427 47.899 -8.676 10.344 1.00 16.01 C ATOM 347 CG1 VAL A 427 47.717 -7.184 9.984 1.00 16.98 C ATOM 348 CG2 VAL A 427 49.184 -8.880 11.171 1.00 15.94 C ATOM 349 H VAL A 427 46.903 -8.898 13.212 1.00 0.00 H ATOM 350 N ALA A 428 46.556 -11.464 10.243 1.00 13.88 N ATOM 351 CA ALA A 428 46.922 -12.868 10.164 1.00 13.22 C ATOM 352 C ALA A 428 48.133 -12.999 9.254 1.00 15.46 C ATOM 353 O ALA A 428 48.224 -12.324 8.224 1.00 17.61 O ATOM 354 CB ALA A 428 45.766 -13.706 9.604 1.00 14.12 C ATOM 355 H ALA A 428 46.087 -11.026 9.425 1.00 0.00 H ATOM 356 N ILE A 429 49.076 -13.856 9.651 1.00 15.51 N ATOM 357 CA ILE A 429 50.359 -13.987 8.969 1.00 16.98 C ATOM 358 C ILE A 429 50.530 -15.453 8.606 1.00 14.05 C ATOM 359 O ILE A 429 50.687 -16.298 9.494 1.00 16.81 O ATOM 360 CB ILE A 429 51.529 -13.497 9.839 1.00 17.30 C ATOM 361 CG1 ILE A 429 51.292 -12.054 10.288 1.00 17.84 C ATOM 362 CG2 ILE A 429 52.845 -13.631 9.088 1.00 21.42 C ATOM 363 CD1 ILE A 429 51.539 -11.824 11.766 1.00 31.54 C ATOM 364 H ILE A 429 48.889 -14.455 10.480 1.00 0.00 H ATOM 365 N LYS A 430 50.454 -15.769 7.315 1.00 15.27 N ATOM 366 CA LYS A 430 50.785 -17.108 6.845 1.00 14.77 C ATOM 367 C LYS A 430 52.291 -17.182 6.658 1.00 18.95 C ATOM 368 O LYS A 430 52.862 -16.400 5.887 1.00 18.61 O ATOM 369 CB LYS A 430 50.127 -17.402 5.504 1.00 18.60 C ATOM 370 CG LYS A 430 48.612 -17.433 5.466 1.00 23.34 C ATOM 371 CD LYS A 430 48.209 -18.047 4.123 1.00 25.49 C ATOM 372 CE LYS A 430 46.770 -17.811 3.780 1.00 33.71 C ATOM 373 NZ LYS A 430 45.916 -18.473 4.754 1.00 23.64 N ATOM 374 HZ1 LYS A 430 46.109 -19.495 4.745 1.00 0.00 H ATOM 375 HZ2 LYS A 430 46.111 -18.091 5.701 1.00 0.00 H ATOM 376 HZ3 LYS A 430 44.919 -18.305 4.510 1.00 0.00 H ATOM 377 H LYS A 430 50.153 -15.047 6.630 1.00 0.00 H ATOM 378 N MET A 431 52.933 -18.109 7.355 1.00 17.69 N ATOM 379 CA MET A 431 54.363 -18.356 7.206 1.00 18.98 C ATOM 380 C MET A 431 54.468 -19.542 6.257 1.00 17.97 C ATOM 381 O MET A 431 54.158 -20.675 6.627 1.00 21.72 O ATOM 382 CB MET A 431 54.982 -18.619 8.575 1.00 20.69 C ATOM 383 CG MET A 431 54.787 -17.416 9.528 1.00 31.91 C ATOM 384 SD MET A 431 55.424 -17.592 11.212 1.00 34.48 S ATOM 385 CE MET A 431 55.607 -19.365 11.343 1.00 50.86 C ATOM 386 H MET A 431 52.396 -18.683 8.035 1.00 0.00 H ATOM 387 N ILE A 432 54.843 -19.275 5.008 1.00 17.78 N ATOM 388 CA ILE A 432 54.711 -20.266 3.942 1.00 17.47 C ATOM 389 C ILE A 432 55.811 -21.314 4.080 1.00 21.20 C ATOM 390 O ILE A 432 56.988 -21.033 3.847 1.00 22.50 O ATOM 391 CB ILE A 432 54.730 -19.615 2.556 1.00 18.94 C ATOM 392 CG1 ILE A 432 53.654 -18.517 2.458 1.00 18.28 C ATOM 393 CG2 ILE A 432 54.581 -20.683 1.481 1.00 18.90 C ATOM 394 CD1 ILE A 432 52.248 -18.977 2.723 1.00 18.26 C ATOM 395 H ILE A 432 55.239 -18.339 4.786 1.00 0.00 H ATOM 396 N LYS A 433 55.421 -22.536 4.434 1.00 19.97 N ATOM 397 CA LYS A 433 56.384 -23.627 4.581 1.00 23.13 C ATOM 398 C LYS A 433 57.135 -23.880 3.278 1.00 21.67 C ATOM 399 O LYS A 433 56.544 -23.954 2.195 1.00 22.75 O ATOM 400 CB LYS A 433 55.666 -24.911 5.000 1.00 30.99 C ATOM 401 CG LYS A 433 56.621 -26.046 5.369 1.00 39.72 C ATOM 402 CD LYS A 433 56.276 -27.344 4.648 1.00 58.24 C ATOM 403 CE LYS A 433 54.943 -27.917 5.097 1.00 61.39 C ATOM 404 NZ LYS A 433 54.653 -29.241 4.457 1.00 60.32 N ATOM 405 HZ1 LYS A 433 54.625 -29.126 3.424 1.00 0.00 H ATOM 406 HZ2 LYS A 433 55.400 -29.919 4.712 1.00 0.00 H ATOM 407 HZ3 LYS A 433 53.734 -29.593 4.793 1.00 0.00 H ATOM 408 H LYS A 433 54.412 -22.719 4.609 1.00 0.00 H ATOM 409 N GLU A 434 58.456 -24.031 3.387 1.00 25.70 N ATOM 410 CA GLU A 434 59.273 -24.277 2.206 1.00 26.45 C ATOM 411 C GLU A 434 58.793 -25.533 1.490 1.00 22.58 C ATOM 412 O GLU A 434 58.570 -26.574 2.114 1.00 30.47 O ATOM 413 CB GLU A 434 60.742 -24.438 2.611 1.00 36.80 C ATOM 414 CG GLU A 434 61.370 -23.197 3.235 1.00 71.54 C ATOM 415 CD GLU A 434 61.501 -22.046 2.260 1.00 97.98 C ATOM 416 OE1 GLU A 434 61.499 -22.295 1.036 1.00106.97 O ATOM 417 OE2 GLU A 434 61.605 -20.888 2.718 1.00107.16 O ATOM 418 H GLU A 434 58.906 -23.973 4.323 1.00 0.00 H ATOM 419 N GLY A 435 58.640 -25.437 0.172 1.00 25.44 N ATOM 420 CA GLY A 435 58.216 -26.567 -0.623 1.00 25.32 C ATOM 421 C GLY A 435 56.720 -26.741 -0.725 1.00 25.51 C ATOM 422 O GLY A 435 56.266 -27.605 -1.492 1.00 24.54 O ATOM 423 H GLY A 435 58.830 -24.528 -0.297 1.00 0.00 H ATOM 424 N SER A 436 55.935 -25.948 0.010 1.00 22.31 N ATOM 425 CA SER A 436 54.487 -26.117 -0.017 1.00 22.71 C ATOM 426 C SER A 436 53.804 -25.261 -1.071 1.00 21.73 C ATOM 427 O SER A 436 52.641 -25.532 -1.402 1.00 22.09 O ATOM 428 CB SER A 436 53.868 -25.800 1.351 1.00 19.15 C ATOM 429 OG SER A 436 53.923 -24.414 1.635 1.00 19.72 O ATOM 430 HG SER A 436 54.867 -24.117 1.641 1.00 0.00 H ATOM 431 H SER A 436 56.359 -25.207 0.604 1.00 0.00 H ATOM 432 N MET A 437 54.492 -24.261 -1.613 1.00 19.55 N ATOM 433 CA MET A 437 53.890 -23.306 -2.528 1.00 22.78 C ATOM 434 C MET A 437 54.800 -23.054 -3.716 1.00 23.23 C ATOM 435 O MET A 437 56.026 -22.967 -3.571 1.00 24.93 O ATOM 436 CB MET A 437 53.664 -21.962 -1.819 1.00 25.89 C ATOM 437 CG MET A 437 53.147 -20.875 -2.738 1.00 21.18 C ATOM 438 SD MET A 437 53.182 -19.286 -1.931 1.00 31.76 S ATOM 439 CE MET A 437 51.750 -19.391 -0.941 1.00 28.31 C ATOM 440 H MET A 437 55.499 -24.158 -1.373 1.00 0.00 H ATOM 441 N SER A 438 54.186 -22.878 -4.883 1.00 26.21 N ATOM 442 CA SER A 438 54.876 -22.312 -6.032 1.00 26.86 C ATOM 443 C SER A 438 55.066 -20.816 -5.811 1.00 22.95 C ATOM 444 O SER A 438 54.218 -20.014 -6.209 1.00 30.48 O ATOM 445 CB SER A 438 54.063 -22.571 -7.303 1.00 42.64 C ATOM 446 OG SER A 438 54.734 -22.085 -8.451 1.00 66.96 O ATOM 447 HG SER A 438 54.185 -22.267 -9.254 1.00 0.00 H ATOM 448 H SER A 438 53.187 -23.152 -4.976 1.00 0.00 H ATOM 449 N GLU A 439 56.195 -20.431 -5.209 1.00 29.10 N ATOM 450 CA GLU A 439 56.331 -19.090 -4.644 1.00 32.68 C ATOM 451 C GLU A 439 56.530 -18.031 -5.721 1.00 31.33 C ATOM 452 O GLU A 439 55.888 -16.973 -5.686 1.00 30.76 O ATOM 453 CB GLU A 439 57.491 -19.060 -3.653 1.00 29.11 C ATOM 454 CG GLU A 439 57.287 -19.978 -2.476 1.00 26.45 C ATOM 455 CD GLU A 439 58.375 -19.848 -1.439 1.00 42.65 C ATOM 456 OE1 GLU A 439 59.213 -18.925 -1.555 1.00 50.07 O ATOM 457 OE2 GLU A 439 58.392 -20.673 -0.507 1.00 29.91 O ATOM 458 H GLU A 439 56.991 -21.097 -5.141 1.00 0.00 H ATOM 459 N ASP A 440 57.445 -18.269 -6.661 1.00 34.83 N ATOM 460 CA ASP A 440 57.647 -17.298 -7.731 1.00 41.88 C ATOM 461 C ASP A 440 56.355 -17.078 -8.505 1.00 41.92 C ATOM 462 O ASP A 440 56.026 -15.946 -8.879 1.00 40.94 O ATOM 463 CB ASP A 440 58.768 -17.768 -8.660 1.00 45.88 C ATOM 464 H ASP A 440 58.011 -19.141 -6.632 1.00 0.00 H ATOM 465 N GLU A 441 55.596 -18.151 -8.723 1.00 37.59 N ATOM 466 CA GLU A 441 54.312 -18.053 -9.406 1.00 33.58 C ATOM 467 C GLU A 441 53.343 -17.171 -8.621 1.00 39.46 C ATOM 468 O GLU A 441 52.682 -16.292 -9.186 1.00 34.56 O ATOM 469 CB GLU A 441 53.760 -19.468 -9.589 1.00 49.22 C ATOM 470 CG GLU A 441 52.524 -19.603 -10.458 1.00 67.97 C ATOM 471 CD GLU A 441 52.212 -21.060 -10.790 1.00 74.67 C ATOM 472 OE1 GLU A 441 53.030 -21.942 -10.448 1.00 67.64 O ATOM 473 OE2 GLU A 441 51.148 -21.325 -11.390 1.00 75.89 O ATOM 474 H GLU A 441 55.928 -19.081 -8.398 1.00 0.00 H ATOM 475 N PHE A 442 53.252 -17.387 -7.308 1.00 30.88 N ATOM 476 CA PHE A 442 52.372 -16.568 -6.481 1.00 27.40 C ATOM 477 C PHE A 442 52.793 -15.105 -6.496 1.00 33.20 C ATOM 478 O PHE A 442 51.950 -14.202 -6.587 1.00 31.43 O ATOM 479 CB PHE A 442 52.406 -17.084 -5.048 1.00 27.51 C ATOM 480 CG PHE A 442 51.857 -16.110 -4.043 1.00 23.92 C ATOM 481 CD1 PHE A 442 52.703 -15.434 -3.181 1.00 20.48 C ATOM 482 CD2 PHE A 442 50.496 -15.874 -3.963 1.00 22.68 C ATOM 483 CE1 PHE A 442 52.194 -14.533 -2.248 1.00 24.42 C ATOM 484 CE2 PHE A 442 49.983 -14.972 -3.040 1.00 22.74 C ATOM 485 CZ PHE A 442 50.839 -14.307 -2.180 1.00 19.85 C ATOM 486 H PHE A 442 53.813 -18.145 -6.870 1.00 0.00 H ATOM 487 N ILE A 443 54.094 -14.846 -6.379 1.00 29.41 N ATOM 488 CA ILE A 443 54.565 -13.467 -6.310 1.00 31.42 C ATOM 489 C ILE A 443 54.223 -12.716 -7.592 1.00 34.63 C ATOM 490 O ILE A 443 53.881 -11.528 -7.556 1.00 30.90 O ATOM 491 CB ILE A 443 56.066 -13.432 -5.974 1.00 33.01 C ATOM 492 CG1 ILE A 443 56.278 -13.991 -4.564 1.00 29.72 C ATOM 493 CG2 ILE A 443 56.594 -12.005 -6.046 1.00 35.51 C ATOM 494 CD1 ILE A 443 57.698 -14.264 -4.208 1.00 34.81 C ATOM 495 H ILE A 443 54.777 -15.629 -6.337 1.00 0.00 H ATOM 496 N GLU A 444 54.266 -13.402 -8.737 1.00 40.83 N ATOM 497 CA GLU A 444 53.949 -12.751 -10.006 1.00 41.00 C ATOM 498 C GLU A 444 52.546 -12.155 -10.001 1.00 40.24 C ATOM 499 O GLU A 444 52.310 -11.101 -10.601 1.00 44.63 O ATOM 500 CB GLU A 444 54.085 -13.751 -11.152 1.00 44.82 C ATOM 501 CG GLU A 444 55.509 -14.019 -11.575 1.00 50.81 C ATOM 502 CD GLU A 444 56.116 -12.846 -12.320 1.00 51.33 C ATOM 503 OE1 GLU A 444 55.428 -12.283 -13.203 1.00 29.26 O ATOM 504 OE2 GLU A 444 57.277 -12.490 -12.015 1.00 37.87 O ATOM 505 H GLU A 444 54.527 -14.409 -8.725 1.00 0.00 H ATOM 506 N GLU A 445 51.600 -12.815 -9.336 1.00 32.46 N ATOM 507 CA GLU A 445 50.194 -12.434 -9.410 1.00 31.23 C ATOM 508 C GLU A 445 49.652 -11.911 -8.085 1.00 32.70 C ATOM 509 O GLU A 445 48.443 -11.697 -7.958 1.00 28.35 O ATOM 510 CB GLU A 445 49.365 -13.605 -9.939 1.00 43.40 C ATOM 511 CG GLU A 445 49.781 -14.037 -11.349 1.00 54.32 C ATOM 512 CD GLU A 445 49.840 -15.546 -11.509 1.00 77.30 C ATOM 513 OE1 GLU A 445 48.898 -16.230 -11.054 1.00 87.21 O ATOM 514 OE2 GLU A 445 50.835 -16.049 -12.078 1.00 75.05 O ATOM 515 H GLU A 445 51.872 -13.627 -8.746 1.00 0.00 H ATOM 516 N ALA A 446 50.522 -11.642 -7.113 1.00 27.67 N ATOM 517 CA ALA A 446 50.047 -11.179 -5.815 1.00 29.98 C ATOM 518 C ALA A 446 49.375 -9.813 -5.909 1.00 32.52 C ATOM 519 O ALA A 446 48.425 -9.540 -5.171 1.00 25.58 O ATOM 520 CB ALA A 446 51.207 -11.154 -4.821 1.00 32.29 C ATOM 521 H ALA A 446 51.541 -11.762 -7.280 1.00 0.00 H ATOM 522 N LYS A 447 49.842 -8.940 -6.805 1.00 25.61 N ATOM 523 CA LYS A 447 49.245 -7.610 -6.894 1.00 25.33 C ATOM 524 C LYS A 447 47.793 -7.689 -7.355 1.00 27.37 C ATOM 525 O LYS A 447 46.937 -6.945 -6.865 1.00 27.16 O ATOM 526 CB LYS A 447 50.062 -6.736 -7.844 1.00 28.28 C ATOM 527 CG LYS A 447 49.511 -5.336 -8.033 1.00 36.46 C ATOM 528 CD LYS A 447 49.436 -4.572 -6.725 1.00 49.22 C ATOM 529 CE LYS A 447 49.081 -3.109 -6.966 1.00 53.25 C ATOM 530 NZ LYS A 447 48.968 -2.345 -5.694 1.00 52.07 N ATOM 531 HZ1 LYS A 447 48.224 -2.767 -5.103 1.00 0.00 H ATOM 532 HZ2 LYS A 447 49.876 -2.380 -5.188 1.00 0.00 H ATOM 533 HZ3 LYS A 447 48.726 -1.356 -5.905 1.00 0.00 H ATOM 534 H LYS A 447 50.626 -9.205 -7.435 1.00 0.00 H ATOM 535 N VAL A 448 47.501 -8.575 -8.309 1.00 25.87 N ATOM 536 CA VAL A 448 46.119 -8.783 -8.737 1.00 26.70 C ATOM 537 C VAL A 448 45.257 -9.184 -7.550 1.00 26.02 C ATOM 538 O VAL A 448 44.149 -8.666 -7.355 1.00 24.47 O ATOM 539 CB VAL A 448 46.064 -9.835 -9.860 1.00 26.39 C ATOM 540 CG1 VAL A 448 44.610 -10.209 -10.191 1.00 38.05 C ATOM 541 CG2 VAL A 448 46.766 -9.339 -11.104 1.00 34.02 C ATOM 542 H VAL A 448 48.265 -9.124 -8.753 1.00 0.00 H ATOM 543 N MET A 449 45.749 -10.118 -6.739 1.00 23.43 N ATOM 544 CA MET A 449 44.992 -10.552 -5.574 1.00 23.79 C ATOM 545 C MET A 449 44.825 -9.411 -4.579 1.00 27.14 C ATOM 546 O MET A 449 43.758 -9.253 -3.977 1.00 23.66 O ATOM 547 CB MET A 449 45.704 -11.736 -4.929 1.00 21.54 C ATOM 548 CG MET A 449 44.981 -12.319 -3.748 1.00 19.97 C ATOM 549 SD MET A 449 45.954 -13.617 -2.975 1.00 22.37 S ATOM 550 CE MET A 449 46.097 -14.761 -4.344 1.00 30.79 C ATOM 551 H MET A 449 46.679 -10.540 -6.939 1.00 0.00 H ATOM 552 N MET A 450 45.869 -8.603 -4.394 1.00 24.12 N ATOM 553 CA MET A 450 45.774 -7.472 -3.476 1.00 28.34 C ATOM 554 C MET A 450 44.780 -6.425 -3.969 1.00 23.78 C ATOM 555 O MET A 450 44.118 -5.771 -3.152 1.00 25.56 O ATOM 556 CB MET A 450 47.146 -6.829 -3.311 1.00 30.97 C ATOM 557 CG MET A 450 47.140 -5.663 -2.365 1.00 30.54 C ATOM 558 SD MET A 450 48.716 -4.813 -2.400 1.00 30.96 S ATOM 559 CE MET A 450 48.417 -3.548 -1.175 1.00 41.36 C ATOM 560 H MET A 450 46.756 -8.779 -4.907 1.00 0.00 H ATOM 561 N ASN A 451 44.673 -6.248 -5.290 1.00 26.48 N ATOM 562 CA ASN A 451 43.739 -5.296 -5.881 1.00 30.29 C ATOM 563 C ASN A 451 42.282 -5.675 -5.647 1.00 20.69 C ATOM 564 O ASN A 451 41.391 -4.848 -5.889 1.00 26.62 O ATOM 565 CB ASN A 451 43.962 -5.212 -7.395 1.00 31.20 C ATOM 566 CG ASN A 451 45.198 -4.423 -7.775 1.00 38.77 C ATOM 567 OD1 ASN A 451 45.715 -3.627 -6.993 1.00 29.27 O ATOM 568 ND2 ASN A 451 45.667 -4.630 -9.006 1.00 42.62 N ATOM 569 HD22 ASN A 451 45.197 -5.314 -9.633 1.00 0.00 H ATOM 570 HD21 ASN A 451 46.503 -4.108 -9.339 1.00 0.00 H ATOM 571 H ASN A 451 45.279 -6.811 -5.920 1.00 0.00 H ATOM 572 N LEU A 452 42.006 -6.911 -5.243 1.00 19.42 N ATOM 573 CA LEU A 452 40.646 -7.303 -4.913 1.00 17.07 C ATOM 574 C LEU A 452 40.304 -6.658 -3.582 1.00 26.28 C ATOM 575 O LEU A 452 40.946 -6.942 -2.567 1.00 31.08 O ATOM 576 CB LEU A 452 40.546 -8.829 -4.854 1.00 18.40 C ATOM 577 CG LEU A 452 40.915 -9.527 -6.175 1.00 18.33 C ATOM 578 CD1 LEU A 452 41.047 -11.040 -5.975 1.00 17.46 C ATOM 579 CD2 LEU A 452 39.884 -9.211 -7.257 1.00 19.46 C ATOM 580 H LEU A 452 42.774 -7.607 -5.162 1.00 0.00 H ATOM 581 N SER A 453 39.333 -5.750 -3.603 1.00 17.45 N ATOM 582 CA SER A 453 38.963 -4.956 -2.439 1.00 16.40 C ATOM 583 C SER A 453 37.455 -5.003 -2.304 1.00 19.81 C ATOM 584 O SER A 453 36.733 -4.445 -3.135 1.00 23.11 O ATOM 585 CB SER A 453 39.438 -3.515 -2.598 1.00 24.62 C ATOM 586 OG SER A 453 39.093 -2.751 -1.455 1.00 46.03 O ATOM 587 HG SER A 453 39.408 -1.820 -1.574 1.00 0.00 H ATOM 588 H SER A 453 38.814 -5.600 -4.491 1.00 0.00 H ATOM 589 N HIS A 454 36.985 -5.648 -1.247 1.00 19.61 N ATOM 590 CA HIS A 454 35.560 -5.719 -0.965 1.00 15.71 C ATOM 591 C HIS A 454 35.384 -6.012 0.520 1.00 15.37 C ATOM 592 O HIS A 454 36.176 -6.766 1.101 1.00 15.04 O ATOM 593 CB HIS A 454 34.890 -6.809 -1.804 1.00 16.08 C ATOM 594 CG HIS A 454 33.400 -6.739 -1.787 1.00 17.97 C ATOM 595 ND1 HIS A 454 32.644 -7.276 -0.769 1.00 16.66 N ATOM 596 CD2 HIS A 454 32.522 -6.194 -2.663 1.00 18.69 C ATOM 597 CE1 HIS A 454 31.365 -7.042 -1.005 1.00 19.41 C ATOM 598 NE2 HIS A 454 31.266 -6.392 -2.153 1.00 21.04 N ATOM 599 H HIS A 454 37.653 -6.116 -0.602 1.00 0.00 H ATOM 600 N GLU A 455 34.336 -5.429 1.123 1.00 15.82 N ATOM 601 CA GLU A 455 34.073 -5.542 2.559 1.00 15.16 C ATOM 602 C GLU A 455 33.739 -6.964 2.996 1.00 12.77 C ATOM 603 O GLU A 455 33.755 -7.252 4.194 1.00 11.84 O ATOM 604 CB GLU A 455 32.932 -4.590 2.946 1.00 18.96 C ATOM 605 CG GLU A 455 32.318 -4.792 4.342 1.00 22.14 C ATOM 606 CD GLU A 455 33.301 -4.565 5.482 1.00 21.64 C ATOM 607 OE1 GLU A 455 32.944 -4.867 6.642 1.00 25.07 O ATOM 608 OE2 GLU A 455 34.421 -4.081 5.225 1.00 22.71 O ATOM 609 H GLU A 455 33.679 -4.870 0.542 1.00 0.00 H ATOM 610 N LYS A 456 33.449 -7.858 2.064 1.00 14.17 N ATOM 611 CA LYS A 456 33.177 -9.248 2.389 1.00 13.15 C ATOM 612 C LYS A 456 34.258 -10.191 1.903 1.00 13.91 C ATOM 613 O LYS A 456 34.057 -11.415 1.943 1.00 14.08 O ATOM 614 CB LYS A 456 31.793 -9.665 1.877 1.00 15.70 C ATOM 615 CG LYS A 456 30.624 -8.771 2.353 1.00 16.12 C ATOM 616 CD LYS A 456 30.503 -8.655 3.877 1.00 15.68 C ATOM 617 CE LYS A 456 29.515 -7.557 4.269 1.00 15.35 C ATOM 618 NZ LYS A 456 28.140 -7.909 3.854 1.00 21.00 N ATOM 619 HZ1 LYS A 456 28.111 -8.031 2.822 1.00 0.00 H ATOM 620 HZ2 LYS A 456 27.856 -8.796 4.317 1.00 0.00 H ATOM 621 HZ3 LYS A 456 27.489 -7.147 4.132 1.00 0.00 H ATOM 622 H LYS A 456 33.415 -7.557 1.069 1.00 0.00 H ATOM 623 N LEU A 457 35.402 -9.656 1.471 1.00 13.14 N ATOM 624 CA LEU A 457 36.602 -10.446 1.231 1.00 12.35 C ATOM 625 C LEU A 457 37.586 -10.233 2.363 1.00 13.75 C ATOM 626 O LEU A 457 37.815 -9.099 2.797 1.00 17.50 O ATOM 627 CB LEU A 457 37.295 -10.014 -0.054 1.00 17.36 C ATOM 628 CG LEU A 457 36.730 -10.387 -1.405 1.00 23.42 C ATOM 629 CD1 LEU A 457 37.598 -9.731 -2.466 1.00 20.12 C ATOM 630 CD2 LEU A 457 36.691 -11.894 -1.569 1.00 19.09 C ATOM 631 H LEU A 457 35.438 -8.631 1.298 1.00 0.00 H ATOM 632 N VAL A 458 38.200 -11.323 2.811 1.00 13.67 N ATOM 633 CA VAL A 458 39.315 -11.212 3.745 1.00 13.96 C ATOM 634 C VAL A 458 40.490 -10.666 2.941 1.00 18.82 C ATOM 635 O VAL A 458 41.056 -11.367 2.099 1.00 21.92 O ATOM 636 CB VAL A 458 39.630 -12.564 4.403 1.00 14.01 C ATOM 637 CG1 VAL A 458 40.863 -12.471 5.329 1.00 17.83 C ATOM 638 CG2 VAL A 458 38.429 -13.037 5.188 1.00 14.97 C ATOM 639 H VAL A 458 37.884 -12.261 2.494 1.00 0.00 H ATOM 640 N GLN A 459 40.842 -9.410 3.193 1.00 18.34 N ATOM 641 CA GLN A 459 41.756 -8.674 2.333 1.00 23.75 C ATOM 642 C GLN A 459 43.182 -9.200 2.442 1.00 20.84 C ATOM 643 O GLN A 459 43.663 -9.489 3.538 1.00 21.11 O ATOM 644 CB GLN A 459 41.760 -7.219 2.779 1.00 29.72 C ATOM 645 CG GLN A 459 40.465 -6.498 2.551 1.00 60.77 C ATOM 646 CD GLN A 459 40.268 -6.191 1.097 1.00 61.23 C ATOM 647 OE1 GLN A 459 40.918 -5.292 0.549 1.00 39.60 O ATOM 648 NE2 GLN A 459 39.401 -6.960 0.444 1.00 52.64 N ATOM 649 HE22 GLN A 459 38.879 -7.703 0.952 1.00 0.00 H ATOM 650 HE21 GLN A 459 39.245 -6.819 -0.574 1.00 0.00 H ATOM 651 H GLN A 459 40.451 -8.937 4.033 1.00 0.00 H ATOM 652 N LEU A 460 43.849 -9.323 1.293 1.00 17.97 N ATOM 653 CA LEU A 460 45.300 -9.516 1.259 1.00 20.72 C ATOM 654 C LEU A 460 45.954 -8.152 1.436 1.00 22.66 C ATOM 655 O LEU A 460 45.837 -7.285 0.559 1.00 23.77 O ATOM 656 CB LEU A 460 45.722 -10.129 -0.072 1.00 23.74 C ATOM 657 CG LEU A 460 47.225 -10.046 -0.367 1.00 34.45 C ATOM 658 CD1 LEU A 460 47.984 -10.859 0.652 1.00 31.53 C ATOM 659 CD2 LEU A 460 47.540 -10.522 -1.771 1.00 45.10 C ATOM 660 H LEU A 460 43.324 -9.281 0.396 1.00 0.00 H ATOM 661 N TYR A 461 46.644 -7.952 2.567 1.00 16.24 N ATOM 662 CA TYR A 461 47.254 -6.659 2.862 1.00 21.22 C ATOM 663 C TYR A 461 48.595 -6.507 2.165 1.00 21.29 C ATOM 664 O TYR A 461 48.927 -5.420 1.678 1.00 25.29 O ATOM 665 CB TYR A 461 47.468 -6.507 4.365 1.00 19.44 C ATOM 666 CG TYR A 461 46.207 -6.364 5.192 1.00 20.97 C ATOM 667 CD1 TYR A 461 46.231 -6.611 6.546 1.00 17.29 C ATOM 668 CD2 TYR A 461 45.011 -5.949 4.627 1.00 23.71 C ATOM 669 CE1 TYR A 461 45.121 -6.477 7.323 1.00 18.58 C ATOM 670 CE2 TYR A 461 43.874 -5.801 5.401 1.00 24.24 C ATOM 671 CZ TYR A 461 43.939 -6.066 6.749 1.00 18.06 C ATOM 672 OH TYR A 461 42.845 -5.925 7.552 1.00 20.19 O ATOM 673 HH TYR A 461 43.088 -6.160 8.483 1.00 0.00 H ATOM 674 H TYR A 461 46.747 -8.732 3.247 1.00 0.00 H ATOM 675 N GLY A 462 49.385 -7.570 2.132 1.00 18.40 N ATOM 676 CA GLY A 462 50.661 -7.522 1.456 1.00 19.90 C ATOM 677 C GLY A 462 51.457 -8.780 1.737 1.00 16.46 C ATOM 678 O GLY A 462 50.941 -9.749 2.291 1.00 17.35 O ATOM 679 H GLY A 462 49.083 -8.449 2.598 1.00 0.00 H ATOM 680 N VAL A 463 52.739 -8.729 1.375 1.00 16.04 N ATOM 681 CA VAL A 463 53.603 -9.896 1.442 1.00 18.40 C ATOM 682 C VAL A 463 54.962 -9.486 1.992 1.00 19.00 C ATOM 683 O VAL A 463 55.328 -8.307 2.000 1.00 17.74 O ATOM 684 CB VAL A 463 53.763 -10.572 0.063 1.00 17.01 C ATOM 685 CG1 VAL A 463 52.401 -11.076 -0.446 1.00 21.94 C ATOM 686 CG2 VAL A 463 54.395 -9.607 -0.941 1.00 25.10 C ATOM 687 H VAL A 463 53.132 -7.828 1.035 1.00 0.00 H ATOM 688 N CYS A 464 55.703 -10.481 2.465 1.00 16.91 N ATOM 689 CA CYS A 464 57.102 -10.310 2.858 1.00 14.79 C ATOM 690 C CYS A 464 57.881 -11.380 2.115 1.00 17.78 C ATOM 691 O CYS A 464 57.774 -12.563 2.450 1.00 18.26 O ATOM 692 CB CYS A 464 57.292 -10.471 4.371 1.00 17.05 C ATOM 693 SG CYS A 464 56.197 -9.460 5.403 1.00 19.90 S ATOM 694 H CYS A 464 55.271 -11.422 2.560 1.00 0.00 H ATOM 695 N THR A 465 58.658 -10.975 1.108 1.00 18.82 N ATOM 696 CA THR A 465 59.333 -11.933 0.239 1.00 22.12 C ATOM 697 C THR A 465 60.856 -11.837 0.289 1.00 25.26 C ATOM 698 O THR A 465 61.526 -12.496 -0.516 1.00 22.89 O ATOM 699 CB THR A 465 58.862 -11.757 -1.209 1.00 26.79 C ATOM 700 OG1 THR A 465 59.306 -10.489 -1.715 1.00 26.41 O ATOM 701 CG2 THR A 465 57.342 -11.856 -1.304 1.00 33.42 C ATOM 702 HG1 THR A 465 58.930 -9.762 -1.158 1.00 0.00 H ATOM 703 H THR A 465 58.785 -9.957 0.940 1.00 0.00 H ATOM 704 N LYS A 466 61.422 -11.063 1.217 1.00 21.84 N ATOM 705 CA LYS A 466 62.862 -10.810 1.244 1.00 20.96 C ATOM 706 C LYS A 466 63.616 -11.760 2.158 1.00 25.39 C ATOM 707 O LYS A 466 64.821 -11.585 2.348 1.00 32.08 O ATOM 708 CB LYS A 466 63.152 -9.354 1.639 1.00 24.43 C ATOM 709 CG LYS A 466 62.461 -8.317 0.771 1.00 23.03 C ATOM 710 CD LYS A 466 62.770 -8.528 -0.701 1.00 22.53 C ATOM 711 CE LYS A 466 61.984 -7.586 -1.610 1.00 27.96 C ATOM 712 NZ LYS A 466 62.495 -6.198 -1.570 1.00 28.32 N ATOM 713 HZ1 LYS A 466 62.429 -5.833 -0.598 1.00 0.00 H ATOM 714 HZ2 LYS A 466 63.488 -6.186 -1.879 1.00 0.00 H ATOM 715 HZ3 LYS A 466 61.926 -5.602 -2.204 1.00 0.00 H ATOM 716 H LYS A 466 60.820 -10.626 1.944 1.00 0.00 H ATOM 717 N GLN A 467 62.942 -12.758 2.724 1.00 20.35 N ATOM 718 CA GLN A 467 63.599 -13.814 3.467 1.00 30.00 C ATOM 719 C GLN A 467 62.874 -15.119 3.176 1.00 32.68 C ATOM 720 O GLN A 467 61.913 -15.162 2.405 1.00 31.83 O ATOM 721 CB GLN A 467 63.578 -13.525 4.967 1.00 33.05 C ATOM 722 CG GLN A 467 62.230 -13.744 5.603 1.00 48.04 C ATOM 723 CD GLN A 467 61.228 -12.657 5.253 1.00 53.15 C ATOM 724 OE1 GLN A 467 61.545 -11.470 5.318 1.00 56.10 O ATOM 725 NE2 GLN A 467 60.010 -13.059 4.877 1.00 40.91 N ATOM 726 HE22 GLN A 467 59.787 -14.074 4.837 1.00 0.00 H ATOM 727 HE21 GLN A 467 59.285 -12.357 4.625 1.00 0.00 H ATOM 728 H GLN A 467 61.907 -12.781 2.630 1.00 0.00 H ATOM 729 N ARG A 468 63.334 -16.186 3.820 1.00 35.89 N ATOM 730 CA ARG A 468 62.645 -17.457 3.819 1.00 36.91 C ATOM 731 C ARG A 468 62.321 -17.814 5.262 1.00 29.88 C ATOM 732 O ARG A 468 63.194 -17.684 6.132 1.00 28.49 O ATOM 733 CB ARG A 468 63.531 -18.551 3.204 1.00 46.22 C ATOM 734 H ARG A 468 64.227 -16.104 4.347 1.00 0.00 H ATOM 735 N PRO A 469 61.086 -18.237 5.572 1.00 28.82 N ATOM 736 CA PRO A 469 59.950 -18.417 4.664 1.00 25.90 C ATOM 737 C PRO A 469 59.335 -17.079 4.294 1.00 27.86 C ATOM 738 O PRO A 469 59.548 -16.100 5.002 1.00 31.39 O ATOM 739 CB PRO A 469 58.966 -19.220 5.509 1.00 26.07 C ATOM 740 CG PRO A 469 59.250 -18.779 6.900 1.00 28.00 C ATOM 741 CD PRO A 469 60.727 -18.581 6.960 1.00 32.17 C ATOM 742 N ILE A 470 58.608 -17.029 3.193 1.00 21.84 N ATOM 743 CA ILE A 470 57.872 -15.819 2.868 1.00 23.50 C ATOM 744 C ILE A 470 56.604 -15.758 3.711 1.00 17.14 C ATOM 745 O ILE A 470 56.150 -16.755 4.266 1.00 19.23 O ATOM 746 CB ILE A 470 57.588 -15.712 1.357 1.00 24.37 C ATOM 747 CG1 ILE A 470 56.646 -16.808 0.874 1.00 23.55 C ATOM 748 CG2 ILE A 470 58.914 -15.783 0.590 1.00 26.32 C ATOM 749 CD1 ILE A 470 56.206 -16.629 -0.560 1.00 26.59 C ATOM 750 H ILE A 470 58.562 -17.853 2.560 1.00 0.00 H ATOM 751 N PHE A 471 56.051 -14.557 3.844 1.00 17.33 N ATOM 752 CA PHE A 471 54.842 -14.339 4.622 1.00 15.67 C ATOM 753 C PHE A 471 53.772 -13.762 3.709 1.00 19.44 C ATOM 754 O PHE A 471 54.073 -12.978 2.803 1.00 18.78 O ATOM 755 CB PHE A 471 54.994 -13.290 5.736 1.00 17.19 C ATOM 756 CG PHE A 471 56.050 -13.581 6.752 1.00 22.15 C ATOM 757 CD1 PHE A 471 56.554 -14.851 6.944 1.00 20.99 C ATOM 758 CD2 PHE A 471 56.513 -12.551 7.551 1.00 20.21 C ATOM 759 CE1 PHE A 471 57.534 -15.080 7.906 1.00 26.05 C ATOM 760 CE2 PHE A 471 57.482 -12.776 8.512 1.00 25.78 C ATOM 761 CZ PHE A 471 57.988 -14.037 8.688 1.00 24.93 C ATOM 762 H PHE A 471 56.499 -13.744 3.375 1.00 0.00 H ATOM 763 N ILE A 472 52.515 -14.142 3.968 1.00 16.77 N ATOM 764 CA ILE A 472 51.337 -13.493 3.402 1.00 13.65 C ATOM 765 C ILE A 472 50.566 -12.873 4.562 1.00 18.17 C ATOM 766 O ILE A 472 50.237 -13.567 5.535 1.00 16.38 O ATOM 767 CB ILE A 472 50.438 -14.502 2.656 1.00 16.13 C ATOM 768 CG1 ILE A 472 51.193 -15.124 1.475 1.00 19.56 C ATOM 769 CG2 ILE A 472 49.151 -13.834 2.192 1.00 23.69 C ATOM 770 CD1 ILE A 472 50.371 -16.153 0.687 1.00 25.45 C ATOM 771 H ILE A 472 52.369 -14.947 4.610 1.00 0.00 H ATOM 772 N ILE A 473 50.273 -11.580 4.462 1.00 17.13 N ATOM 773 CA ILE A 473 49.653 -10.833 5.546 1.00 14.73 C ATOM 774 C ILE A 473 48.225 -10.493 5.128 1.00 14.77 C ATOM 775 O ILE A 473 48.011 -9.869 4.080 1.00 17.22 O ATOM 776 CB ILE A 473 50.448 -9.556 5.860 1.00 16.65 C ATOM 777 CG1 ILE A 473 51.948 -9.867 6.046 1.00 18.85 C ATOM 778 CG2 ILE A 473 49.836 -8.859 7.094 1.00 19.06 C ATOM 779 CD1 ILE A 473 52.243 -10.672 7.236 1.00 25.98 C ATOM 780 H ILE A 473 50.495 -11.084 3.576 1.00 0.00 H ATOM 781 N THR A 474 47.238 -10.933 5.915 1.00 16.17 N ATOM 782 CA THR A 474 45.842 -10.677 5.576 1.00 16.78 C ATOM 783 C THR A 474 45.079 -10.128 6.773 1.00 15.56 C ATOM 784 O THR A 474 45.550 -10.130 7.914 1.00 14.53 O ATOM 785 CB THR A 474 45.128 -11.937 5.065 1.00 18.48 C ATOM 786 OG1 THR A 474 44.873 -12.814 6.170 1.00 17.85 O ATOM 787 CG2 THR A 474 45.954 -12.655 4.015 1.00 17.14 C ATOM 788 HG1 THR A 474 45.731 -13.066 6.594 1.00 0.00 H ATOM 789 H THR A 474 47.468 -11.464 6.779 1.00 0.00 H ATOM 790 N GLU A 475 43.867 -9.659 6.474 1.00 19.04 N ATOM 791 CA GLU A 475 42.890 -9.291 7.485 1.00 18.00 C ATOM 792 C GLU A 475 42.704 -10.419 8.495 1.00 17.24 C ATOM 793 O GLU A 475 42.677 -11.604 8.135 1.00 20.79 O ATOM 794 CB GLU A 475 41.569 -8.973 6.758 1.00 19.40 C ATOM 795 CG GLU A 475 40.412 -8.507 7.621 1.00 17.90 C ATOM 796 CD GLU A 475 39.230 -7.995 6.786 1.00 16.75 C ATOM 797 OE1 GLU A 475 38.231 -7.538 7.379 1.00 18.44 O ATOM 798 OE2 GLU A 475 39.308 -8.013 5.542 1.00 17.14 O ATOM 799 H GLU A 475 43.609 -9.552 5.472 1.00 0.00 H ATOM 800 N TYR A 476 42.588 -10.045 9.763 1.00 13.67 N ATOM 801 CA TYR A 476 42.338 -10.972 10.860 1.00 14.66 C ATOM 802 C TYR A 476 40.856 -11.005 11.205 1.00 13.29 C ATOM 803 O TYR A 476 40.195 -9.962 11.280 1.00 14.27 O ATOM 804 CB TYR A 476 43.119 -10.552 12.100 1.00 17.91 C ATOM 805 CG TYR A 476 42.839 -11.414 13.299 1.00 12.53 C ATOM 806 CD1 TYR A 476 43.240 -12.735 13.321 1.00 15.16 C ATOM 807 CD2 TYR A 476 42.167 -10.920 14.391 1.00 13.96 C ATOM 808 CE1 TYR A 476 42.994 -13.545 14.417 1.00 15.11 C ATOM 809 CE2 TYR A 476 41.904 -11.712 15.494 1.00 17.76 C ATOM 810 CZ TYR A 476 42.326 -13.038 15.499 1.00 19.79 C ATOM 811 OH TYR A 476 42.092 -13.870 16.574 1.00 22.07 O ATOM 812 HH TYR A 476 41.117 -13.945 16.726 1.00 0.00 H ATOM 813 H TYR A 476 42.681 -9.034 9.987 1.00 0.00 H ATOM 814 N MET A 477 40.342 -12.220 11.418 1.00 12.34 N ATOM 815 CA MET A 477 38.934 -12.468 11.689 1.00 16.12 C ATOM 816 C MET A 477 38.835 -13.181 13.034 1.00 14.31 C ATOM 817 O MET A 477 39.191 -14.361 13.158 1.00 12.92 O ATOM 818 CB MET A 477 38.365 -13.301 10.549 1.00 13.36 C ATOM 819 CG MET A 477 38.550 -12.640 9.181 1.00 13.96 C ATOM 820 SD MET A 477 37.500 -11.203 8.967 1.00 16.53 S ATOM 821 CE MET A 477 35.943 -12.033 8.711 1.00 15.45 C ATOM 822 H MET A 477 40.986 -13.036 11.388 1.00 0.00 H ATOM 823 N ALA A 478 38.359 -12.463 14.054 1.00 13.90 N ATOM 824 CA ALA A 478 38.511 -12.938 15.427 1.00 13.63 C ATOM 825 C ALA A 478 37.718 -14.199 15.748 1.00 14.75 C ATOM 826 O ALA A 478 38.080 -14.907 16.698 1.00 16.87 O ATOM 827 CB ALA A 478 38.121 -11.836 16.401 1.00 16.93 C ATOM 828 H ALA A 478 37.877 -11.560 13.870 1.00 0.00 H ATOM 829 N ASN A 479 36.638 -14.482 15.028 1.00 12.71 N ATOM 830 CA ASN A 479 35.825 -15.656 15.333 1.00 14.21 C ATOM 831 C ASN A 479 36.192 -16.892 14.517 1.00 12.22 C ATOM 832 O ASN A 479 35.530 -17.934 14.656 1.00 13.68 O ATOM 833 CB ASN A 479 34.337 -15.324 15.201 1.00 14.21 C ATOM 834 CG ASN A 479 33.739 -14.791 16.499 1.00 20.29 C ATOM 835 OD1 ASN A 479 33.904 -15.395 17.564 1.00 23.34 O ATOM 836 ND2 ASN A 479 33.037 -13.666 16.420 1.00 20.35 N ATOM 837 HD22 ASN A 479 32.922 -13.188 15.503 1.00 0.00 H ATOM 838 HD21 ASN A 479 32.603 -13.263 17.275 1.00 0.00 H ATOM 839 H ASN A 479 36.369 -13.861 14.239 1.00 0.00 H ATOM 840 N GLY A 480 37.234 -16.829 13.706 1.00 12.82 N ATOM 841 CA GLY A 480 37.771 -17.993 13.042 1.00 13.76 C ATOM 842 C GLY A 480 36.924 -18.428 11.873 1.00 11.84 C ATOM 843 O GLY A 480 36.108 -17.676 11.357 1.00 12.66 O ATOM 844 H GLY A 480 37.684 -15.906 13.540 1.00 0.00 H TER 845 GLY A 480 ATOM 846 N LEU A 482 34.226 -20.281 9.358 1.00 11.77 N ATOM 847 CA LEU A 482 32.775 -20.369 9.407 1.00 11.43 C ATOM 848 C LEU A 482 32.279 -21.748 9.762 1.00 11.74 C ATOM 849 O LEU A 482 31.272 -21.884 10.465 1.00 11.86 O ATOM 850 CB LEU A 482 32.221 -19.941 8.060 1.00 10.46 C ATOM 851 CG LEU A 482 30.701 -20.028 7.923 1.00 11.66 C ATOM 852 CD1 LEU A 482 29.990 -19.120 8.926 1.00 11.13 C ATOM 853 CD2 LEU A 482 30.321 -19.706 6.485 1.00 12.30 C ATOM 854 HN3 LEU A 482 34.588 -20.942 8.641 1.00 0.00 H ATOM 855 HN2 LEU A 482 34.619 -20.528 10.289 1.00 0.00 H ATOM 856 HN1 LEU A 482 34.505 -19.310 9.109 1.00 0.00 H ATOM 857 N LEU A 483 32.966 -22.791 9.303 1.00 11.79 N ATOM 858 CA LEU A 483 32.501 -24.141 9.616 1.00 11.85 C ATOM 859 C LEU A 483 32.487 -24.384 11.124 1.00 12.01 C ATOM 860 O LEU A 483 31.483 -24.848 11.686 1.00 13.31 O ATOM 861 CB LEU A 483 33.348 -25.193 8.897 1.00 14.18 C ATOM 862 CG LEU A 483 32.860 -26.619 9.145 1.00 13.05 C ATOM 863 CD1 LEU A 483 31.446 -26.782 8.663 1.00 14.82 C ATOM 864 CD2 LEU A 483 33.757 -27.594 8.433 1.00 13.85 C ATOM 865 H LEU A 483 33.822 -22.648 8.730 1.00 0.00 H ATOM 866 N ASN A 484 33.587 -24.059 11.805 1.00 12.35 N ATOM 867 CA ASN A 484 33.601 -24.235 13.253 1.00 14.92 C ATOM 868 C ASN A 484 32.632 -23.286 13.947 1.00 14.19 C ATOM 869 O ASN A 484 32.041 -23.645 14.976 1.00 14.13 O ATOM 870 CB ASN A 484 35.021 -24.079 13.784 1.00 13.85 C ATOM 871 CG ASN A 484 35.871 -25.303 13.522 1.00 33.98 C ATOM 872 OD1 ASN A 484 35.403 -26.440 13.656 1.00 33.92 O ATOM 873 ND2 ASN A 484 37.128 -25.085 13.140 1.00 39.56 N ATOM 874 HD22 ASN A 484 37.480 -24.111 13.040 1.00 0.00 H ATOM 875 HD21 ASN A 484 37.758 -25.888 12.941 1.00 0.00 H ATOM 876 H ASN A 484 34.422 -23.686 11.311 1.00 0.00 H ATOM 877 N TYR A 485 32.467 -22.076 13.410 1.00 12.01 N ATOM 878 CA TYR A 485 31.544 -21.108 13.995 1.00 12.06 C ATOM 879 C TYR A 485 30.112 -21.626 13.945 1.00 11.26 C ATOM 880 O TYR A 485 29.378 -21.540 14.932 1.00 14.26 O ATOM 881 CB TYR A 485 31.697 -19.775 13.265 1.00 13.68 C ATOM 882 CG TYR A 485 30.910 -18.604 13.824 1.00 13.06 C ATOM 883 CD1 TYR A 485 31.357 -17.924 14.937 1.00 16.78 C ATOM 884 CD2 TYR A 485 29.738 -18.163 13.210 1.00 15.58 C ATOM 885 CE1 TYR A 485 30.657 -16.842 15.438 1.00 18.66 C ATOM 886 CE2 TYR A 485 29.049 -17.072 13.693 1.00 18.40 C ATOM 887 CZ TYR A 485 29.514 -16.419 14.807 1.00 21.74 C ATOM 888 OH TYR A 485 28.834 -15.333 15.322 1.00 29.95 O ATOM 889 HH TYR A 485 29.313 -14.993 16.119 1.00 0.00 H ATOM 890 H TYR A 485 33.006 -21.818 12.559 1.00 0.00 H ATOM 891 N LEU A 486 29.704 -22.166 12.794 1.00 11.04 N ATOM 892 CA LEU A 486 28.393 -22.806 12.674 1.00 13.51 C ATOM 893 C LEU A 486 28.219 -23.924 13.697 1.00 15.39 C ATOM 894 O LEU A 486 27.181 -24.027 14.364 1.00 14.61 O ATOM 895 CB LEU A 486 28.222 -23.385 11.272 1.00 12.85 C ATOM 896 CG LEU A 486 28.092 -22.371 10.132 1.00 12.14 C ATOM 897 CD1 LEU A 486 28.329 -23.063 8.813 1.00 12.93 C ATOM 898 CD2 LEU A 486 26.754 -21.631 10.149 1.00 14.30 C ATOM 899 H LEU A 486 30.331 -22.131 11.965 1.00 0.00 H ATOM 900 N ARG A 487 29.222 -24.804 13.815 1.00 11.80 N ATOM 901 CA ARG A 487 29.081 -25.962 14.692 1.00 12.82 C ATOM 902 C ARG A 487 29.063 -25.567 16.162 1.00 14.92 C ATOM 903 O ARG A 487 28.306 -26.155 16.945 1.00 18.35 O ATOM 904 CB ARG A 487 30.181 -26.977 14.374 1.00 14.69 C ATOM 905 CG ARG A 487 30.091 -27.565 12.959 1.00 13.55 C ATOM 906 CD ARG A 487 31.198 -28.592 12.692 1.00 15.97 C ATOM 907 NE ARG A 487 31.041 -29.726 13.585 1.00 20.49 N ATOM 908 CZ ARG A 487 30.162 -30.705 13.390 1.00 26.10 C ATOM 909 NH1 ARG A 487 29.367 -30.710 12.317 1.00 20.43 N ATOM 910 NH2 ARG A 487 30.072 -31.679 14.273 1.00 24.72 N ATOM 911 HE ARG A 487 31.651 -29.776 14.426 1.00 0.00 H ATOM 912 HH12 ARG A 487 28.685 -31.483 12.179 1.00 0.00 H ATOM 913 HH11 ARG A 487 29.430 -29.941 11.620 1.00 0.00 H ATOM 914 HH22 ARG A 487 29.388 -32.449 14.130 1.00 0.00 H ATOM 915 HH21 ARG A 487 30.685 -31.678 15.113 1.00 0.00 H ATOM 916 H ARG A 487 30.103 -24.662 13.281 1.00 0.00 H ATOM 917 N GLU A 488 29.847 -24.546 16.548 1.00 13.93 N ATOM 918 CA GLU A 488 29.934 -24.120 17.946 1.00 13.35 C ATOM 919 C GLU A 488 28.729 -23.305 18.400 1.00 17.50 C ATOM 920 O GLU A 488 28.429 -23.280 19.597 1.00 20.67 O ATOM 921 CB GLU A 488 31.204 -23.302 18.164 1.00 19.04 C ATOM 922 CG GLU A 488 32.485 -24.121 18.053 1.00 44.49 C ATOM 923 CD GLU A 488 32.676 -25.072 19.220 1.00 68.14 C ATOM 924 OE1 GLU A 488 32.199 -24.757 20.330 1.00 74.01 O ATOM 925 OE2 GLU A 488 33.302 -26.136 19.025 1.00 76.80 O ATOM 926 H GLU A 488 30.409 -24.043 15.832 1.00 0.00 H ATOM 927 N MET A 489 28.045 -22.633 17.474 1.00 18.12 N ATOM 928 CA MET A 489 26.915 -21.765 17.791 1.00 18.11 C ATOM 929 C MET A 489 25.608 -22.323 17.236 1.00 21.16 C ATOM 930 O MET A 489 24.609 -21.604 17.152 1.00 16.96 O ATOM 931 CB MET A 489 27.184 -20.352 17.267 1.00 18.01 C ATOM 932 CG MET A 489 28.601 -19.828 17.563 1.00 26.72 C ATOM 933 SD MET A 489 29.030 -19.809 19.323 1.00 25.94 S ATOM 934 CE MET A 489 27.797 -18.673 19.924 1.00 22.82 C ATOM 935 H MET A 489 28.330 -22.732 16.479 1.00 0.00 H ATOM 936 N ARG A 490 25.606 -23.611 16.889 1.00 20.00 N ATOM 937 CA ARG A 490 24.514 -24.235 16.155 1.00 21.43 C ATOM 938 C ARG A 490 23.136 -23.859 16.696 1.00 21.57 C ATOM 939 O ARG A 490 22.229 -23.527 15.925 1.00 28.00 O ATOM 940 CB ARG A 490 24.773 -25.740 16.218 1.00 18.31 C ATOM 941 CG ARG A 490 23.829 -26.604 15.511 1.00 29.99 C ATOM 942 CD ARG A 490 24.401 -27.991 15.476 1.00 21.78 C ATOM 943 NE ARG A 490 25.200 -28.229 14.282 1.00 17.64 N ATOM 944 CZ ARG A 490 25.563 -29.443 13.901 1.00 21.21 C ATOM 945 NH1 ARG A 490 26.258 -29.618 12.792 1.00 19.77 N ATOM 946 NH2 ARG A 490 25.226 -30.483 14.650 1.00 21.17 N ATOM 947 HE ARG A 490 25.496 -27.414 13.707 1.00 0.00 H ATOM 948 HH12 ARG A 490 26.539 -30.576 12.500 1.00 0.00 H ATOM 949 HH11 ARG A 490 26.524 -28.798 12.210 1.00 0.00 H ATOM 950 HH22 ARG A 490 25.505 -31.443 14.363 1.00 0.00 H ATOM 951 HH21 ARG A 490 24.683 -30.339 15.525 1.00 0.00 H ATOM 952 H ARG A 490 26.423 -24.197 17.155 1.00 0.00 H ATOM 953 N HIS A 491 22.958 -23.880 18.018 1.00 21.05 N ATOM 954 CA HIS A 491 21.628 -23.777 18.605 1.00 26.00 C ATOM 955 C HIS A 491 21.163 -22.341 18.795 1.00 23.06 C ATOM 956 O HIS A 491 20.052 -22.123 19.289 1.00 32.81 O ATOM 957 CB HIS A 491 21.582 -24.565 19.920 1.00 30.87 C ATOM 958 CG HIS A 491 22.123 -25.956 19.786 1.00 28.32 C ATOM 959 ND1 HIS A 491 23.418 -26.293 20.122 1.00 24.33 N ATOM 960 CD2 HIS A 491 21.558 -27.084 19.296 1.00 25.02 C ATOM 961 CE1 HIS A 491 23.618 -27.574 19.866 1.00 37.35 C ATOM 962 NE2 HIS A 491 22.505 -28.076 19.365 1.00 33.42 N ATOM 963 H HIS A 491 23.785 -23.972 18.642 1.00 0.00 H ATOM 964 N ARG A 492 21.962 -21.360 18.372 1.00 20.39 N ATOM 965 CA ARG A 492 21.642 -19.959 18.541 1.00 25.43 C ATOM 966 C ARG A 492 21.202 -19.247 17.269 1.00 23.26 C ATOM 967 O ARG A 492 20.653 -18.147 17.364 1.00 29.53 O ATOM 968 CB ARG A 492 22.860 -19.215 19.095 1.00 27.53 C ATOM 969 CG ARG A 492 23.237 -19.624 20.500 1.00 52.62 C ATOM 970 CD ARG A 492 24.137 -18.578 21.105 1.00 78.45 C ATOM 971 NE ARG A 492 23.449 -17.294 21.226 1.00 82.71 N ATOM 972 CZ ARG A 492 24.044 -16.108 21.159 1.00 72.35 C ATOM 973 NH1 ARG A 492 25.356 -16.019 20.961 1.00 67.24 N ATOM 974 NH2 ARG A 492 23.317 -15.006 21.280 1.00 62.42 N ATOM 975 HE ARG A 492 22.420 -17.310 21.375 1.00 0.00 H ATOM 976 HH12 ARG A 492 25.812 -15.086 20.910 1.00 0.00 H ATOM 977 HH11 ARG A 492 25.926 -16.883 20.857 1.00 0.00 H ATOM 978 HH22 ARG A 492 23.774 -14.073 21.229 1.00 0.00 H ATOM 979 HH21 ARG A 492 22.290 -15.074 21.426 1.00 0.00 H ATOM 980 H ARG A 492 22.854 -21.613 17.900 1.00 0.00 H ATOM 981 N PHE A 493 21.443 -19.811 16.090 1.00 21.62 N ATOM 982 CA PHE A 493 21.164 -19.083 14.858 1.00 19.68 C ATOM 983 C PHE A 493 19.670 -19.034 14.578 1.00 22.67 C ATOM 984 O PHE A 493 18.973 -20.048 14.674 1.00 25.24 O ATOM 985 CB PHE A 493 21.850 -19.754 13.669 1.00 21.30 C ATOM 986 CG PHE A 493 23.343 -19.689 13.707 1.00 15.02 C ATOM 987 CD1 PHE A 493 23.998 -18.491 13.498 1.00 18.67 C ATOM 988 CD2 PHE A 493 24.096 -20.831 13.948 1.00 16.97 C ATOM 989 CE1 PHE A 493 25.375 -18.437 13.528 1.00 18.61 C ATOM 990 CE2 PHE A 493 25.464 -20.773 13.991 1.00 17.94 C ATOM 991 CZ PHE A 493 26.103 -19.579 13.780 1.00 17.79 C ATOM 992 H PHE A 493 21.832 -20.775 16.046 1.00 0.00 H ATOM 993 N GLN A 494 19.185 -17.855 14.216 1.00 23.85 N ATOM 994 CA GLN A 494 17.872 -17.721 13.600 1.00 27.50 C ATOM 995 C GLN A 494 18.010 -17.826 12.084 1.00 17.53 C ATOM 996 O GLN A 494 19.082 -17.587 11.525 1.00 18.40 O ATOM 997 CB GLN A 494 17.257 -16.377 13.977 1.00 39.75 C ATOM 998 CG GLN A 494 17.031 -16.223 15.474 1.00 62.97 C ATOM 999 CD GLN A 494 16.572 -14.833 15.861 1.00 87.97 C ATOM 1000 OE1 GLN A 494 15.590 -14.674 16.587 1.00103.32 O ATOM 1001 NE2 GLN A 494 17.288 -13.816 15.388 1.00 86.78 N ATOM 1002 HE22 GLN A 494 18.110 -13.998 14.778 1.00 0.00 H ATOM 1003 HE21 GLN A 494 17.025 -12.839 15.629 1.00 0.00 H ATOM 1004 H GLN A 494 19.758 -17.002 14.376 1.00 0.00 H ATOM 1005 N THR A 495 16.909 -18.185 11.408 1.00 20.01 N ATOM 1006 CA THR A 495 16.975 -18.382 9.961 1.00 22.15 C ATOM 1007 C THR A 495 17.372 -17.104 9.228 1.00 18.69 C ATOM 1008 O THR A 495 18.046 -17.170 8.194 1.00 20.60 O ATOM 1009 CB THR A 495 15.668 -18.968 9.398 1.00 28.44 C ATOM 1010 OG1 THR A 495 14.566 -18.104 9.695 1.00 29.54 O ATOM 1011 CG2 THR A 495 15.399 -20.366 9.967 1.00 27.40 C ATOM 1012 HG1 THR A 495 13.734 -18.494 9.327 1.00 0.00 H ATOM 1013 H THR A 495 16.010 -18.323 11.912 1.00 0.00 H ATOM 1014 N GLN A 496 16.982 -15.932 9.739 1.00 18.71 N ATOM 1015 CA GLN A 496 17.396 -14.685 9.097 1.00 17.63 C ATOM 1016 C GLN A 496 18.913 -14.534 9.105 1.00 20.24 C ATOM 1017 O GLN A 496 19.494 -13.990 8.156 1.00 18.16 O ATOM 1018 CB GLN A 496 16.735 -13.485 9.785 1.00 28.11 C ATOM 1019 CG GLN A 496 17.057 -13.360 11.275 1.00 59.68 C ATOM 1020 CD GLN A 496 17.220 -11.926 11.731 1.00 81.31 C ATOM 1021 OE1 GLN A 496 16.423 -11.055 11.383 1.00 96.46 O ATOM 1022 NE2 GLN A 496 18.263 -11.671 12.520 1.00 75.73 N ATOM 1023 HE22 GLN A 496 18.911 -12.438 12.789 1.00 0.00 H ATOM 1024 HE21 GLN A 496 18.429 -10.705 12.867 1.00 0.00 H ATOM 1025 H GLN A 496 16.386 -15.907 10.591 1.00 0.00 H ATOM 1026 N GLN A 497 19.570 -15.011 10.164 1.00 18.35 N ATOM 1027 CA GLN A 497 21.025 -14.904 10.248 1.00 16.08 C ATOM 1028 C GLN A 497 21.686 -15.862 9.274 1.00 13.84 C ATOM 1029 O GLN A 497 22.717 -15.542 8.684 1.00 15.15 O ATOM 1030 CB GLN A 497 21.494 -15.214 11.671 1.00 17.70 C ATOM 1031 CG GLN A 497 21.055 -14.180 12.698 1.00 33.26 C ATOM 1032 CD GLN A 497 21.368 -14.603 14.120 1.00 42.30 C ATOM 1033 OE1 GLN A 497 20.989 -15.689 14.551 1.00 27.91 O ATOM 1034 NE2 GLN A 497 22.070 -13.747 14.855 1.00 52.11 N ATOM 1035 HE22 GLN A 497 22.370 -12.838 14.449 1.00 0.00 H ATOM 1036 HE21 GLN A 497 22.319 -13.986 15.836 1.00 0.00 H ATOM 1037 H GLN A 497 19.041 -15.463 10.937 1.00 0.00 H ATOM 1038 N LEU A 498 21.111 -17.048 9.092 1.00 13.14 N ATOM 1039 CA LEU A 498 21.629 -17.958 8.076 1.00 13.25 C ATOM 1040 C LEU A 498 21.601 -17.311 6.691 1.00 13.57 C ATOM 1041 O LEU A 498 22.582 -17.373 5.939 1.00 14.18 O ATOM 1042 CB LEU A 498 20.852 -19.268 8.102 1.00 15.30 C ATOM 1043 CG LEU A 498 20.815 -19.995 9.456 1.00 14.08 C ATOM 1044 CD1 LEU A 498 19.949 -21.250 9.334 1.00 18.90 C ATOM 1045 CD2 LEU A 498 22.221 -20.306 9.947 1.00 15.79 C ATOM 1046 H LEU A 498 20.294 -17.326 9.673 1.00 0.00 H ATOM 1047 N LEU A 499 20.484 -16.673 6.342 1.00 13.15 N ATOM 1048 CA LEU A 499 20.373 -16.010 5.043 1.00 13.80 C ATOM 1049 C LEU A 499 21.358 -14.850 4.924 1.00 12.18 C ATOM 1050 O LEU A 499 21.961 -14.653 3.866 1.00 15.72 O ATOM 1051 CB LEU A 499 18.944 -15.521 4.813 1.00 15.05 C ATOM 1052 CG LEU A 499 18.678 -15.038 3.391 1.00 17.86 C ATOM 1053 CD1 LEU A 499 18.938 -16.118 2.363 1.00 20.99 C ATOM 1054 CD2 LEU A 499 17.243 -14.518 3.278 1.00 23.79 C ATOM 1055 H LEU A 499 19.681 -16.646 7.002 1.00 0.00 H ATOM 1056 N GLU A 500 21.572 -14.110 6.017 1.00 13.55 N ATOM 1057 CA GLU A 500 22.523 -13.005 6.000 1.00 13.84 C ATOM 1058 C GLU A 500 23.947 -13.492 5.748 1.00 13.20 C ATOM 1059 O GLU A 500 24.725 -12.834 5.031 1.00 14.59 O ATOM 1060 CB GLU A 500 22.437 -12.262 7.334 1.00 17.64 C ATOM 1061 CG GLU A 500 23.329 -11.041 7.466 1.00 22.88 C ATOM 1062 CD GLU A 500 22.897 -9.866 6.602 1.00 36.80 C ATOM 1063 OE1 GLU A 500 23.649 -8.868 6.555 1.00 40.62 O ATOM 1064 OE2 GLU A 500 21.822 -9.929 5.975 1.00 31.15 O ATOM 1065 H GLU A 500 21.053 -14.326 6.892 1.00 0.00 H ATOM 1066 N MET A 501 24.311 -14.645 6.314 1.00 12.65 N ATOM 1067 CA MET A 501 25.649 -15.181 6.095 1.00 12.80 C ATOM 1068 C MET A 501 25.828 -15.659 4.655 1.00 13.66 C ATOM 1069 O MET A 501 26.920 -15.532 4.092 1.00 13.82 O ATOM 1070 CB MET A 501 25.946 -16.284 7.111 1.00 13.03 C ATOM 1071 CG MET A 501 26.098 -15.749 8.539 1.00 14.36 C ATOM 1072 SD MET A 501 26.670 -16.945 9.770 1.00 14.79 S ATOM 1073 CE MET A 501 25.281 -18.073 9.736 1.00 11.10 C ATOM 1074 H MET A 501 23.637 -15.163 6.914 1.00 0.00 H ATOM 1075 N CYS A 502 24.767 -16.200 4.043 1.00 13.71 N ATOM 1076 CA CYS A 502 24.802 -16.499 2.618 1.00 14.56 C ATOM 1077 C CYS A 502 24.956 -15.232 1.788 1.00 14.09 C ATOM 1078 O CYS A 502 25.692 -15.226 0.798 1.00 13.44 O ATOM 1079 CB CYS A 502 23.536 -17.249 2.201 1.00 15.02 C ATOM 1080 SG CYS A 502 23.341 -18.888 2.880 1.00 14.40 S ATOM 1081 H CYS A 502 23.908 -16.409 4.591 1.00 0.00 H ATOM 1082 N LYS A 503 24.238 -14.160 2.157 1.00 12.61 N ATOM 1083 CA LYS A 503 24.343 -12.897 1.447 1.00 12.88 C ATOM 1084 C LYS A 503 25.765 -12.341 1.508 1.00 13.62 C ATOM 1085 O LYS A 503 26.298 -11.881 0.494 1.00 14.06 O ATOM 1086 CB LYS A 503 23.348 -11.908 2.042 1.00 14.84 C ATOM 1087 CG LYS A 503 23.361 -10.568 1.359 1.00 20.99 C ATOM 1088 CD LYS A 503 22.365 -9.607 1.986 1.00 31.41 C ATOM 1089 CE LYS A 503 22.510 -8.213 1.418 1.00 48.08 C ATOM 1090 NZ LYS A 503 21.445 -7.298 1.920 1.00 56.08 N ATOM 1091 HZ1 LYS A 503 20.513 -7.669 1.645 1.00 0.00 H ATOM 1092 HZ2 LYS A 503 21.502 -7.237 2.957 1.00 0.00 H ATOM 1093 HZ3 LYS A 503 21.579 -6.353 1.508 1.00 0.00 H ATOM 1094 H LYS A 503 23.592 -14.235 2.969 1.00 0.00 H ATOM 1095 N ASP A 504 26.389 -12.369 2.694 1.00 12.52 N ATOM 1096 CA ASP A 504 27.772 -11.893 2.839 1.00 13.28 C ATOM 1097 C ASP A 504 28.665 -12.587 1.815 1.00 12.53 C ATOM 1098 O ASP A 504 29.405 -11.943 1.058 1.00 13.23 O ATOM 1099 CB ASP A 504 28.341 -12.179 4.242 1.00 14.36 C ATOM 1100 CG ASP A 504 27.730 -11.333 5.361 1.00 19.50 C ATOM 1101 OD1 ASP A 504 27.839 -11.768 6.540 1.00 18.81 O ATOM 1102 OD2 ASP A 504 27.159 -10.262 5.092 1.00 18.12 O ATOM 1103 H ASP A 504 25.885 -12.734 3.527 1.00 0.00 H ATOM 1104 N VAL A 505 28.604 -13.920 1.782 1.00 12.14 N ATOM 1105 CA VAL A 505 29.452 -14.677 0.872 1.00 12.36 C ATOM 1106 C VAL A 505 29.111 -14.369 -0.575 1.00 11.80 C ATOM 1107 O VAL A 505 30.007 -14.220 -1.422 1.00 13.32 O ATOM 1108 CB VAL A 505 29.338 -16.174 1.192 1.00 12.06 C ATOM 1109 CG1 VAL A 505 30.082 -17.005 0.169 1.00 13.67 C ATOM 1110 CG2 VAL A 505 29.870 -16.463 2.590 1.00 13.49 C ATOM 1111 H VAL A 505 27.946 -14.422 2.411 1.00 0.00 H ATOM 1112 N CYS A 506 27.816 -14.293 -0.891 1.00 12.23 N ATOM 1113 CA CYS A 506 27.390 -14.028 -2.255 1.00 12.65 C ATOM 1114 C CYS A 506 27.886 -12.670 -2.741 1.00 12.04 C ATOM 1115 O CYS A 506 28.270 -12.531 -3.906 1.00 14.76 O ATOM 1116 CB CYS A 506 25.871 -14.113 -2.358 1.00 15.11 C ATOM 1117 SG CYS A 506 25.303 -14.392 -4.043 1.00 15.87 S ATOM 1118 H CYS A 506 27.100 -14.426 -0.148 1.00 0.00 H ATOM 1119 N GLU A 507 27.899 -11.666 -1.865 1.00 13.02 N ATOM 1120 CA GLU A 507 28.423 -10.355 -2.239 1.00 14.71 C ATOM 1121 C GLU A 507 29.900 -10.430 -2.606 1.00 16.57 C ATOM 1122 O GLU A 507 30.332 -9.850 -3.612 1.00 15.17 O ATOM 1123 CB GLU A 507 28.219 -9.346 -1.099 1.00 13.77 C ATOM 1124 CG GLU A 507 26.783 -8.916 -0.887 1.00 15.90 C ATOM 1125 CD GLU A 507 26.600 -8.025 0.317 1.00 23.29 C ATOM 1126 OE1 GLU A 507 25.541 -7.355 0.415 1.00 25.05 O ATOM 1127 OE2 GLU A 507 27.501 -7.985 1.168 1.00 23.27 O ATOM 1128 H GLU A 507 27.532 -11.818 -0.904 1.00 0.00 H ATOM 1129 N ALA A 508 30.693 -11.109 -1.781 1.00 13.23 N ATOM 1130 CA ALA A 508 32.108 -11.292 -2.081 1.00 13.05 C ATOM 1131 C ALA A 508 32.286 -12.000 -3.415 1.00 14.47 C ATOM 1132 O ALA A 508 33.118 -11.603 -4.245 1.00 14.82 O ATOM 1133 CB ALA A 508 32.774 -12.082 -0.953 1.00 13.92 C ATOM 1134 H ALA A 508 30.298 -11.515 -0.909 1.00 0.00 H ATOM 1135 N MET A 509 31.513 -13.066 -3.644 1.00 13.77 N ATOM 1136 CA MET A 509 31.688 -13.834 -4.872 1.00 12.31 C ATOM 1137 C MET A 509 31.210 -13.057 -6.092 1.00 17.34 C ATOM 1138 O MET A 509 31.780 -13.197 -7.178 1.00 15.70 O ATOM 1139 CB MET A 509 30.964 -15.173 -4.767 1.00 12.43 C ATOM 1140 CG MET A 509 31.537 -16.077 -3.684 1.00 13.75 C ATOM 1141 SD MET A 509 33.313 -16.378 -3.867 1.00 14.48 S ATOM 1142 CE MET A 509 33.385 -17.081 -5.511 1.00 15.86 C ATOM 1143 H MET A 509 30.791 -13.347 -2.950 1.00 0.00 H ATOM 1144 N GLU A 510 30.148 -12.265 -5.951 1.00 16.15 N ATOM 1145 CA GLU A 510 29.733 -11.398 -7.052 1.00 16.75 C ATOM 1146 C GLU A 510 30.851 -10.434 -7.417 1.00 15.30 C ATOM 1147 O GLU A 510 31.117 -10.190 -8.601 1.00 16.69 O ATOM 1148 CB GLU A 510 28.463 -10.640 -6.672 1.00 15.28 C ATOM 1149 CG GLU A 510 27.785 -9.903 -7.849 1.00 24.16 C ATOM 1150 CD GLU A 510 28.464 -8.612 -8.250 1.00 40.08 C ATOM 1151 OE1 GLU A 510 29.086 -7.971 -7.384 1.00 37.13 O ATOM 1152 OE2 GLU A 510 28.368 -8.237 -9.441 1.00 44.22 O ATOM 1153 H GLU A 510 29.615 -12.264 -5.058 1.00 0.00 H ATOM 1154 N TYR A 511 31.558 -9.928 -6.415 1.00 16.98 N ATOM 1155 CA TYR A 511 32.688 -9.053 -6.688 1.00 17.06 C ATOM 1156 C TYR A 511 33.805 -9.801 -7.412 1.00 14.60 C ATOM 1157 O TYR A 511 34.306 -9.340 -8.441 1.00 16.52 O ATOM 1158 CB TYR A 511 33.175 -8.422 -5.387 1.00 16.15 C ATOM 1159 CG TYR A 511 34.416 -7.606 -5.571 1.00 19.05 C ATOM 1160 CD1 TYR A 511 34.352 -6.279 -5.992 1.00 18.14 C ATOM 1161 CD2 TYR A 511 35.655 -8.160 -5.337 1.00 17.30 C ATOM 1162 CE1 TYR A 511 35.507 -5.535 -6.175 1.00 18.50 C ATOM 1163 CE2 TYR A 511 36.804 -7.440 -5.511 1.00 19.88 C ATOM 1164 CZ TYR A 511 36.732 -6.122 -5.928 1.00 18.17 C ATOM 1165 OH TYR A 511 37.883 -5.375 -6.101 1.00 20.11 O ATOM 1166 HH TYR A 511 37.641 -4.463 -6.400 1.00 0.00 H ATOM 1167 H TYR A 511 31.304 -10.157 -5.433 1.00 0.00 H ATOM 1168 N LEU A 512 34.194 -10.975 -6.913 1.00 13.71 N ATOM 1169 CA LEU A 512 35.211 -11.761 -7.607 1.00 13.35 C ATOM 1170 C LEU A 512 34.791 -12.056 -9.044 1.00 15.78 C ATOM 1171 O LEU A 512 35.595 -11.936 -9.971 1.00 18.14 O ATOM 1172 CB LEU A 512 35.500 -13.060 -6.837 1.00 12.39 C ATOM 1173 CG LEU A 512 36.158 -12.961 -5.471 1.00 13.64 C ATOM 1174 CD1 LEU A 512 36.427 -14.364 -4.918 1.00 17.27 C ATOM 1175 CD2 LEU A 512 37.458 -12.145 -5.526 1.00 16.62 C ATOM 1176 H LEU A 512 33.774 -11.331 -6.031 1.00 0.00 H ATOM 1177 N GLU A 513 33.534 -12.466 -9.241 1.00 14.81 N ATOM 1178 CA GLU A 513 33.023 -12.752 -10.577 1.00 18.54 C ATOM 1179 C GLU A 513 33.167 -11.542 -11.484 1.00 21.28 C ATOM 1180 O GLU A 513 33.553 -11.678 -12.653 1.00 19.61 O ATOM 1181 CB GLU A 513 31.555 -13.152 -10.459 1.00 17.30 C ATOM 1182 CG GLU A 513 30.817 -13.472 -11.766 1.00 18.08 C ATOM 1183 CD GLU A 513 29.352 -13.804 -11.500 1.00 22.72 C ATOM 1184 OE1 GLU A 513 28.523 -12.862 -11.338 1.00 23.36 O ATOM 1185 OE2 GLU A 513 29.035 -15.009 -11.435 1.00 22.50 O ATOM 1186 H GLU A 513 32.905 -12.584 -8.421 1.00 0.00 H ATOM 1187 N SER A 514 32.864 -10.348 -10.961 1.00 17.13 N ATOM 1188 CA SER A 514 32.956 -9.136 -11.767 1.00 23.06 C ATOM 1189 C SER A 514 34.393 -8.811 -12.154 1.00 20.65 C ATOM 1190 O SER A 514 34.604 -8.073 -13.123 1.00 22.60 O ATOM 1191 CB SER A 514 32.322 -7.947 -11.038 1.00 21.30 C ATOM 1192 OG SER A 514 33.146 -7.449 -10.000 1.00 23.06 O ATOM 1193 HG SER A 514 33.307 -8.165 -9.336 1.00 0.00 H ATOM 1194 H SER A 514 32.560 -10.284 -9.969 1.00 0.00 H ATOM 1195 N LYS A 515 35.375 -9.344 -11.432 1.00 18.60 N ATOM 1196 CA LYS A 515 36.784 -9.186 -11.765 1.00 21.51 C ATOM 1197 C LYS A 515 37.343 -10.414 -12.472 1.00 22.10 C ATOM 1198 O LYS A 515 38.557 -10.511 -12.660 1.00 24.03 O ATOM 1199 CB LYS A 515 37.596 -8.889 -10.505 1.00 22.18 C ATOM 1200 CG LYS A 515 37.098 -7.709 -9.683 1.00 20.17 C ATOM 1201 CD LYS A 515 37.174 -6.409 -10.471 1.00 24.19 C ATOM 1202 CE LYS A 515 36.776 -5.219 -9.629 1.00 29.93 C ATOM 1203 NZ LYS A 515 37.131 -3.963 -10.324 1.00 40.73 N ATOM 1204 HZ1 LYS A 515 38.158 -3.937 -10.488 1.00 0.00 H ATOM 1205 HZ2 LYS A 515 36.632 -3.919 -11.235 1.00 0.00 H ATOM 1206 HZ3 LYS A 515 36.853 -3.152 -9.736 1.00 0.00 H ATOM 1207 H LYS A 515 35.125 -9.900 -10.590 1.00 0.00 H ATOM 1208 N GLN A 516 36.480 -11.356 -12.852 1.00 22.32 N ATOM 1209 CA GLN A 516 36.902 -12.585 -13.523 1.00 28.48 C ATOM 1210 C GLN A 516 38.003 -13.298 -12.740 1.00 21.13 C ATOM 1211 O GLN A 516 38.979 -13.797 -13.304 1.00 23.40 O ATOM 1212 CB GLN A 516 37.324 -12.293 -14.963 1.00 42.36 C ATOM 1213 CG GLN A 516 36.277 -11.501 -15.729 1.00 46.32 C ATOM 1214 CD GLN A 516 36.709 -11.169 -17.141 1.00 57.10 C ATOM 1215 OE1 GLN A 516 36.668 -12.020 -18.030 1.00 50.33 O ATOM 1216 NE2 GLN A 516 37.128 -9.927 -17.354 1.00 62.69 N ATOM 1217 HE22 GLN A 516 37.145 -9.242 -16.571 1.00 0.00 H ATOM 1218 HE21 GLN A 516 37.439 -9.639 -18.304 1.00 0.00 H ATOM 1219 H GLN A 516 35.467 -11.211 -12.664 1.00 0.00 H ATOM 1220 N PHE A 517 37.841 -13.354 -11.419 1.00 18.51 N ATOM 1221 CA PHE A 517 38.816 -13.980 -10.536 1.00 17.27 C ATOM 1222 C PHE A 517 38.150 -15.163 -9.850 1.00 14.77 C ATOM 1223 O PHE A 517 37.094 -15.004 -9.229 1.00 18.23 O ATOM 1224 CB PHE A 517 39.308 -12.983 -9.488 1.00 17.36 C ATOM 1225 CG PHE A 517 40.486 -13.466 -8.722 1.00 17.98 C ATOM 1226 CD1 PHE A 517 41.768 -13.114 -9.093 1.00 19.36 C ATOM 1227 CD2 PHE A 517 40.314 -14.305 -7.639 1.00 16.99 C ATOM 1228 CE1 PHE A 517 42.863 -13.576 -8.392 1.00 22.03 C ATOM 1229 CE2 PHE A 517 41.392 -14.766 -6.931 1.00 18.11 C ATOM 1230 CZ PHE A 517 42.681 -14.407 -7.311 1.00 17.53 C ATOM 1231 H PHE A 517 36.986 -12.935 -11.002 1.00 0.00 H ATOM 1232 N LEU A 518 38.740 -16.352 -10.008 1.00 14.78 N ATOM 1233 CA LEU A 518 38.163 -17.575 -9.477 1.00 13.62 C ATOM 1234 C LEU A 518 38.670 -17.844 -8.073 1.00 14.76 C ATOM 1235 O LEU A 518 39.863 -17.689 -7.782 1.00 16.94 O ATOM 1236 CB LEU A 518 38.516 -18.752 -10.374 1.00 17.19 C ATOM 1237 CG LEU A 518 38.092 -18.615 -11.836 1.00 18.50 C ATOM 1238 CD1 LEU A 518 38.338 -19.911 -12.580 1.00 21.81 C ATOM 1239 CD2 LEU A 518 36.648 -18.205 -11.946 1.00 20.06 C ATOM 1240 H LEU A 518 39.640 -16.403 -10.527 1.00 0.00 H ATOM 1241 N HIS A 519 37.758 -18.279 -7.205 1.00 14.67 N ATOM 1242 CA HIS A 519 38.172 -18.680 -5.871 1.00 13.55 C ATOM 1243 C HIS A 519 38.892 -20.020 -5.932 1.00 14.47 C ATOM 1244 O HIS A 519 40.048 -20.140 -5.510 1.00 14.25 O ATOM 1245 CB HIS A 519 36.979 -18.758 -4.914 1.00 13.03 C ATOM 1246 CG HIS A 519 37.398 -18.944 -3.499 1.00 13.26 C ATOM 1247 ND1 HIS A 519 38.168 -20.017 -3.087 1.00 13.93 N ATOM 1248 CD2 HIS A 519 37.229 -18.160 -2.411 1.00 15.00 C ATOM 1249 CE1 HIS A 519 38.427 -19.894 -1.799 1.00 13.97 C ATOM 1250 NE2 HIS A 519 37.862 -18.782 -1.364 1.00 13.88 N ATOM 1251 H HIS A 519 36.756 -18.331 -7.480 1.00 0.00 H ATOM 1252 N ARG A 520 38.203 -21.048 -6.429 1.00 14.57 N ATOM 1253 CA ARG A 520 38.694 -22.408 -6.683 1.00 12.71 C ATOM 1254 C ARG A 520 38.621 -23.317 -5.463 1.00 15.69 C ATOM 1255 O ARG A 520 38.744 -24.534 -5.619 1.00 15.74 O ATOM 1256 CB ARG A 520 40.114 -22.470 -7.279 1.00 16.37 C ATOM 1257 CG ARG A 520 40.292 -21.711 -8.567 1.00 30.04 C ATOM 1258 CD ARG A 520 41.770 -21.501 -8.860 1.00 47.42 C ATOM 1259 NE ARG A 520 41.987 -20.837 -10.143 1.00 53.01 N ATOM 1260 CZ ARG A 520 42.169 -21.468 -11.300 1.00 46.21 C ATOM 1261 NH1 ARG A 520 42.165 -22.796 -11.356 1.00 33.55 N ATOM 1262 NH2 ARG A 520 42.359 -20.766 -12.407 1.00 46.61 N ATOM 1263 HE ARG A 520 42.000 -19.797 -10.153 1.00 0.00 H ATOM 1264 HH12 ARG A 520 42.308 -23.279 -12.266 1.00 0.00 H ATOM 1265 HH11 ARG A 520 42.019 -23.353 -10.490 1.00 0.00 H ATOM 1266 HH22 ARG A 520 42.502 -21.254 -13.314 1.00 0.00 H ATOM 1267 HH21 ARG A 520 42.365 -19.727 -12.369 1.00 0.00 H ATOM 1268 H ARG A 520 37.206 -20.866 -6.663 1.00 0.00 H ATOM 1269 N ASP A 521 38.405 -22.786 -4.266 1.00 12.25 N ATOM 1270 CA ASP A 521 38.251 -23.632 -3.080 1.00 12.59 C ATOM 1271 C ASP A 521 37.277 -22.958 -2.117 1.00 13.08 C ATOM 1272 O ASP A 521 37.521 -22.837 -0.919 1.00 13.16 O ATOM 1273 CB ASP A 521 39.599 -23.937 -2.426 1.00 13.23 C ATOM 1274 CG ASP A 521 39.543 -25.101 -1.434 1.00 12.98 C ATOM 1275 OD1 ASP A 521 38.450 -25.670 -1.210 1.00 13.09 O ATOM 1276 OD2 ASP A 521 40.608 -25.447 -0.868 1.00 17.27 O ATOM 1277 H ASP A 521 38.344 -21.752 -4.168 1.00 0.00 H ATOM 1278 N LEU A 522 36.121 -22.573 -2.628 1.00 12.91 N ATOM 1279 CA LEU A 522 35.094 -21.977 -1.786 1.00 12.40 C ATOM 1280 C LEU A 522 34.399 -23.060 -0.977 1.00 12.10 C ATOM 1281 O LEU A 522 33.969 -24.085 -1.531 1.00 11.96 O ATOM 1282 CB LEU A 522 34.081 -21.228 -2.642 1.00 12.13 C ATOM 1283 CG LEU A 522 32.959 -20.540 -1.876 1.00 12.58 C ATOM 1284 CD1 LEU A 522 33.513 -19.413 -0.993 1.00 13.81 C ATOM 1285 CD2 LEU A 522 31.925 -19.988 -2.851 1.00 15.09 C ATOM 1286 H LEU A 522 35.943 -22.697 -3.645 1.00 0.00 H ATOM 1287 N ALA A 523 34.296 -22.830 0.331 1.00 11.90 N ATOM 1288 CA ALA A 523 33.708 -23.757 1.298 1.00 11.13 C ATOM 1289 C ALA A 523 33.673 -23.035 2.637 1.00 12.12 C ATOM 1290 O ALA A 523 34.397 -22.061 2.837 1.00 11.46 O ATOM 1291 CB ALA A 523 34.550 -25.038 1.424 1.00 9.96 C ATOM 1292 H ALA A 523 34.660 -21.925 0.691 1.00 0.00 H ATOM 1293 N ALA A 524 32.848 -23.530 3.564 1.00 11.02 N ATOM 1294 CA ALA A 524 32.740 -22.863 4.861 1.00 11.52 C ATOM 1295 C ALA A 524 34.082 -22.797 5.582 1.00 11.81 C ATOM 1296 O ALA A 524 34.371 -21.817 6.277 1.00 12.29 O ATOM 1297 CB ALA A 524 31.670 -23.552 5.723 1.00 11.26 C ATOM 1298 H ALA A 524 32.287 -24.383 3.365 1.00 0.00 H ATOM 1299 N ARG A 525 34.923 -23.822 5.428 1.00 10.58 N ATOM 1300 CA ARG A 525 36.244 -23.792 6.052 1.00 11.67 C ATOM 1301 C ARG A 525 37.111 -22.632 5.555 1.00 12.54 C ATOM 1302 O ARG A 525 38.054 -22.241 6.264 1.00 14.13 O ATOM 1303 CB ARG A 525 36.973 -25.108 5.820 1.00 11.89 C ATOM 1304 CG ARG A 525 37.280 -25.409 4.357 1.00 13.82 C ATOM 1305 CD ARG A 525 38.020 -26.725 4.141 1.00 14.67 C ATOM 1306 NE ARG A 525 38.107 -26.955 2.701 1.00 13.77 N ATOM 1307 CZ ARG A 525 37.130 -27.477 1.966 1.00 13.23 C ATOM 1308 NH1 ARG A 525 37.263 -27.566 0.652 1.00 14.53 N ATOM 1309 NH2 ARG A 525 36.007 -27.917 2.535 1.00 16.36 N ATOM 1310 HE ARG A 525 38.991 -26.693 2.219 1.00 0.00 H ATOM 1311 HH12 ARG A 525 36.498 -27.975 0.078 1.00 0.00 H ATOM 1312 HH11 ARG A 525 38.133 -27.227 0.193 1.00 0.00 H ATOM 1313 HH22 ARG A 525 35.251 -28.323 1.948 1.00 0.00 H ATOM 1314 HH21 ARG A 525 35.887 -27.854 3.566 1.00 0.00 H ATOM 1315 H ARG A 525 34.637 -24.646 4.861 1.00 0.00 H ATOM 1316 N ASN A 526 36.843 -22.113 4.347 1.00 11.70 N ATOM 1317 CA ASN A 526 37.597 -21.001 3.768 1.00 11.56 C ATOM 1318 C ASN A 526 36.800 -19.702 3.779 1.00 15.84 C ATOM 1319 O ASN A 526 37.065 -18.801 2.978 1.00 20.53 O ATOM 1320 CB ASN A 526 38.082 -21.362 2.374 1.00 12.48 C ATOM 1321 CG ASN A 526 39.107 -22.487 2.408 1.00 11.89 C ATOM 1322 OD1 ASN A 526 39.936 -22.551 3.327 1.00 15.89 O ATOM 1323 ND2 ASN A 526 39.055 -23.390 1.435 1.00 12.93 N ATOM 1324 HD22 ASN A 526 38.344 -23.302 0.681 1.00 0.00 H ATOM 1325 HD21 ASN A 526 39.725 -24.185 1.427 1.00 0.00 H ATOM 1326 H ASN A 526 36.061 -22.521 3.796 1.00 0.00 H ATOM 1327 N CYS A 527 35.822 -19.611 4.664 1.00 11.38 N ATOM 1328 CA CYS A 527 35.185 -18.364 5.046 1.00 12.59 C ATOM 1329 C CYS A 527 35.488 -18.145 6.515 1.00 11.80 C ATOM 1330 O CYS A 527 35.670 -19.100 7.271 1.00 12.21 O ATOM 1331 CB CYS A 527 33.672 -18.410 4.848 1.00 10.48 C ATOM 1332 SG CYS A 527 33.190 -18.635 3.131 1.00 14.22 S ATOM 1333 H CYS A 527 35.488 -20.487 5.114 1.00 0.00 H ATOM 1334 N LEU A 528 35.548 -16.880 6.916 1.00 11.65 N ATOM 1335 CA LEU A 528 35.925 -16.508 8.269 1.00 11.11 C ATOM 1336 C LEU A 528 34.898 -15.518 8.799 1.00 11.18 C ATOM 1337 O LEU A 528 34.161 -14.884 8.037 1.00 12.59 O ATOM 1338 CB LEU A 528 37.335 -15.876 8.280 1.00 12.11 C ATOM 1339 CG LEU A 528 38.514 -16.748 7.831 1.00 15.75 C ATOM 1340 CD1 LEU A 528 39.766 -15.912 7.565 1.00 15.90 C ATOM 1341 CD2 LEU A 528 38.830 -17.744 8.901 1.00 22.53 C ATOM 1342 H LEU A 528 35.316 -16.128 6.236 1.00 0.00 H ATOM 1343 N VAL A 529 34.865 -15.375 10.123 1.00 12.69 N ATOM 1344 CA VAL A 529 33.846 -14.590 10.810 1.00 13.19 C ATOM 1345 C VAL A 529 34.524 -13.579 11.723 1.00 13.51 C ATOM 1346 O VAL A 529 35.388 -13.948 12.523 1.00 11.85 O ATOM 1347 CB VAL A 529 32.930 -15.505 11.636 1.00 14.49 C ATOM 1348 CG1 VAL A 529 31.781 -14.730 12.214 1.00 15.28 C ATOM 1349 CG2 VAL A 529 32.415 -16.672 10.769 1.00 13.90 C ATOM 1350 H VAL A 529 35.598 -15.844 10.692 1.00 0.00 H ATOM 1351 N ASN A 530 34.146 -12.306 11.605 1.00 14.13 N ATOM 1352 CA ASN A 530 34.783 -11.295 12.446 1.00 14.55 C ATOM 1353 C ASN A 530 34.051 -11.137 13.779 1.00 12.47 C ATOM 1354 O ASN A 530 33.106 -11.865 14.102 1.00 14.26 O ATOM 1355 CB ASN A 530 34.979 -9.974 11.697 1.00 15.29 C ATOM 1356 CG ASN A 530 33.698 -9.220 11.445 1.00 15.89 C ATOM 1357 OD1 ASN A 530 32.649 -9.506 12.011 1.00 15.59 O ATOM 1358 ND2 ASN A 530 33.791 -8.207 10.575 1.00 19.44 N ATOM 1359 HD22 ASN A 530 34.700 -7.997 10.116 1.00 0.00 H ATOM 1360 HD21 ASN A 530 32.954 -7.629 10.358 1.00 0.00 H ATOM 1361 H ASN A 530 33.408 -12.036 10.924 1.00 0.00 H ATOM 1362 N ASP A 531 34.508 -10.162 14.579 1.00 18.51 N ATOM 1363 CA ASP A 531 33.998 -9.981 15.936 1.00 19.91 C ATOM 1364 C ASP A 531 32.552 -9.501 15.980 1.00 22.60 C ATOM 1365 O ASP A 531 31.927 -9.560 17.044 1.00 23.04 O ATOM 1366 CB ASP A 531 34.911 -9.026 16.711 1.00 19.02 C ATOM 1367 CG ASP A 531 34.861 -7.596 16.193 1.00 33.84 C ATOM 1368 OD1 ASP A 531 35.141 -6.684 16.996 1.00 42.77 O ATOM 1369 OD2 ASP A 531 34.540 -7.373 15.005 1.00 35.76 O ATOM 1370 H ASP A 531 35.244 -9.519 14.224 1.00 0.00 H ATOM 1371 N GLN A 532 32.011 -9.005 14.870 1.00 17.22 N ATOM 1372 CA GLN A 532 30.609 -8.618 14.798 1.00 18.59 C ATOM 1373 C GLN A 532 29.760 -9.585 13.985 1.00 19.01 C ATOM 1374 O GLN A 532 28.632 -9.250 13.624 1.00 19.61 O ATOM 1375 CB GLN A 532 30.472 -7.196 14.259 1.00 16.84 C ATOM 1376 CG GLN A 532 31.006 -6.181 15.250 1.00 20.95 C ATOM 1377 CD GLN A 532 30.906 -4.757 14.763 1.00 27.43 C ATOM 1378 OE1 GLN A 532 31.401 -4.412 13.689 1.00 27.75 O ATOM 1379 NE2 GLN A 532 30.277 -3.917 15.561 1.00 27.05 N ATOM 1380 HE22 GLN A 532 29.875 -4.255 16.459 1.00 0.00 H ATOM 1381 HE21 GLN A 532 30.183 -2.917 15.293 1.00 0.00 H ATOM 1382 H GLN A 532 32.609 -8.890 14.027 1.00 0.00 H ATOM 1383 N GLY A 533 30.254 -10.794 13.718 1.00 17.33 N ATOM 1384 CA GLY A 533 29.450 -11.787 13.041 1.00 16.47 C ATOM 1385 C GLY A 533 29.386 -11.687 11.530 1.00 15.51 C ATOM 1386 O GLY A 533 28.624 -12.443 10.913 1.00 19.14 O ATOM 1387 H GLY A 533 31.228 -11.025 14.000 1.00 0.00 H ATOM 1388 N VAL A 534 30.144 -10.788 10.918 1.00 14.67 N ATOM 1389 CA VAL A 534 30.179 -10.665 9.468 1.00 12.11 C ATOM 1390 C VAL A 534 31.033 -11.788 8.903 1.00 13.07 C ATOM 1391 O VAL A 534 32.146 -12.040 9.376 1.00 13.35 O ATOM 1392 CB VAL A 534 30.724 -9.289 9.055 1.00 16.02 C ATOM 1393 CG1 VAL A 534 30.748 -9.141 7.523 1.00 17.59 C ATOM 1394 CG2 VAL A 534 29.908 -8.190 9.693 1.00 18.24 C ATOM 1395 H VAL A 534 30.732 -10.151 11.492 1.00 0.00 H ATOM 1396 N VAL A 535 30.519 -12.456 7.896 1.00 13.31 N ATOM 1397 CA VAL A 535 31.238 -13.522 7.214 1.00 11.56 C ATOM 1398 C VAL A 535 31.980 -12.945 6.016 1.00 11.98 C ATOM 1399 O VAL A 535 31.432 -12.154 5.243 1.00 13.68 O ATOM 1400 CB VAL A 535 30.270 -14.639 6.786 1.00 12.94 C ATOM 1401 CG1 VAL A 535 31.001 -15.713 6.049 1.00 15.10 C ATOM 1402 CG2 VAL A 535 29.534 -15.206 7.986 1.00 15.02 C ATOM 1403 H VAL A 535 29.561 -12.214 7.573 1.00 0.00 H ATOM 1404 N LYS A 536 33.227 -13.373 5.841 1.00 11.56 N ATOM 1405 CA LYS A 536 34.029 -12.957 4.709 1.00 11.65 C ATOM 1406 C LYS A 536 34.711 -14.155 4.069 1.00 13.15 C ATOM 1407 O LYS A 536 34.987 -15.151 4.728 1.00 12.53 O ATOM 1408 CB LYS A 536 35.064 -11.912 5.127 1.00 13.30 C ATOM 1409 CG LYS A 536 34.453 -10.681 5.785 1.00 13.36 C ATOM 1410 CD LYS A 536 35.485 -9.571 5.980 1.00 14.07 C ATOM 1411 CE LYS A 536 34.890 -8.418 6.755 1.00 12.11 C ATOM 1412 NZ LYS A 536 35.669 -7.150 6.542 1.00 14.69 N ATOM 1413 HZ1 LYS A 536 36.649 -7.289 6.860 1.00 0.00 H ATOM 1414 HZ2 LYS A 536 35.662 -6.906 5.531 1.00 0.00 H ATOM 1415 HZ3 LYS A 536 35.232 -6.380 7.089 1.00 0.00 H ATOM 1416 H LYS A 536 33.639 -14.026 6.538 1.00 0.00 H ATOM 1417 N VAL A 537 34.965 -14.046 2.773 1.00 11.97 N ATOM 1418 CA VAL A 537 35.559 -15.117 1.983 1.00 12.92 C ATOM 1419 C VAL A 537 37.080 -14.969 1.994 1.00 13.53 C ATOM 1420 O VAL A 537 37.612 -13.869 1.773 1.00 14.54 O ATOM 1421 CB VAL A 537 35.007 -15.063 0.551 1.00 12.10 C ATOM 1422 CG1 VAL A 537 35.732 -16.009 -0.364 1.00 15.46 C ATOM 1423 CG2 VAL A 537 33.504 -15.364 0.551 1.00 12.54 C ATOM 1424 H VAL A 537 34.729 -13.152 2.296 1.00 0.00 H ATOM 1425 N SER A 538 37.787 -16.082 2.213 1.00 13.68 N ATOM 1426 CA SER A 538 39.231 -16.058 2.399 1.00 13.32 C ATOM 1427 C SER A 538 39.924 -17.072 1.490 1.00 15.74 C ATOM 1428 O SER A 538 39.334 -18.065 1.054 1.00 14.64 O ATOM 1429 CB SER A 538 39.577 -16.337 3.869 1.00 16.97 C ATOM 1430 OG SER A 538 40.970 -16.349 4.096 1.00 17.49 O ATOM 1431 HG SER A 538 41.351 -15.468 3.852 1.00 0.00 H ATOM 1432 H SER A 538 37.290 -16.995 2.252 1.00 0.00 H ATOM 1433 N ASP A 539 41.201 -16.801 1.215 1.00 14.73 N ATOM 1434 CA ASP A 539 42.089 -17.723 0.516 1.00 16.40 C ATOM 1435 C ASP A 539 41.706 -17.932 -0.947 1.00 16.78 C ATOM 1436 O ASP A 539 42.064 -18.942 -1.551 1.00 16.58 O ATOM 1437 CB ASP A 539 42.251 -19.019 1.318 1.00 17.60 C ATOM 1438 CG ASP A 539 42.930 -18.768 2.661 1.00 27.18 C ATOM 1439 OD1 ASP A 539 44.118 -18.405 2.655 1.00 29.82 O ATOM 1440 OD2 ASP A 539 42.275 -18.869 3.712 1.00 30.47 O ATOM 1441 H ASP A 539 41.584 -15.882 1.515 1.00 0.00 H ATOM 1442 N PHE A 540 41.017 -16.956 -1.525 1.00 14.89 N ATOM 1443 CA PHE A 540 40.624 -16.998 -2.927 1.00 16.24 C ATOM 1444 C PHE A 540 41.847 -17.035 -3.835 1.00 14.55 C ATOM 1445 O PHE A 540 42.792 -16.246 -3.677 1.00 16.51 O ATOM 1446 CB PHE A 540 39.733 -15.788 -3.253 1.00 14.10 C ATOM 1447 CG PHE A 540 40.145 -14.504 -2.552 1.00 12.76 C ATOM 1448 CD1 PHE A 540 39.682 -14.218 -1.265 1.00 15.66 C ATOM 1449 CD2 PHE A 540 40.982 -13.598 -3.166 1.00 15.94 C ATOM 1450 CE1 PHE A 540 40.051 -13.058 -0.604 1.00 15.17 C ATOM 1451 CE2 PHE A 540 41.367 -12.431 -2.498 1.00 16.17 C ATOM 1452 CZ PHE A 540 40.904 -12.170 -1.222 1.00 14.72 C ATOM 1453 H PHE A 540 40.747 -16.129 -0.955 1.00 0.00 H ATOM 1454 N GLY A 541 41.830 -17.977 -4.781 1.00 13.64 N ATOM 1455 CA GLY A 541 42.866 -18.105 -5.778 1.00 15.95 C ATOM 1456 C GLY A 541 44.100 -18.866 -5.343 1.00 17.43 C ATOM 1457 O GLY A 541 44.883 -19.288 -6.204 1.00 19.91 O ATOM 1458 H GLY A 541 41.036 -18.648 -4.800 1.00 0.00 H ATOM 1459 N LEU A 542 44.288 -19.083 -4.040 1.00 14.61 N ATOM 1460 CA LEU A 542 45.536 -19.658 -3.560 1.00 14.04 C ATOM 1461 C LEU A 542 45.703 -21.119 -3.935 1.00 13.90 C ATOM 1462 O LEU A 542 46.842 -21.609 -3.958 1.00 17.48 O ATOM 1463 CB LEU A 542 45.682 -19.459 -2.052 1.00 16.20 C ATOM 1464 CG LEU A 542 45.928 -18.025 -1.577 1.00 19.19 C ATOM 1465 CD1 LEU A 542 46.053 -18.001 -0.074 1.00 22.54 C ATOM 1466 CD2 LEU A 542 47.186 -17.374 -2.211 1.00 20.65 C ATOM 1467 H LEU A 542 43.537 -18.840 -3.362 1.00 0.00 H ATOM 1468 N SER A 543 44.613 -21.827 -4.226 1.00 15.11 N ATOM 1469 CA SER A 543 44.738 -23.222 -4.630 1.00 15.90 C ATOM 1470 C SER A 543 45.672 -23.373 -5.823 1.00 20.02 C ATOM 1471 O SER A 543 46.312 -24.420 -5.982 1.00 21.73 O ATOM 1472 CB SER A 543 43.358 -23.779 -4.962 1.00 20.25 C ATOM 1473 OG SER A 543 42.848 -23.173 -6.131 1.00 18.81 O ATOM 1474 HG SER A 543 41.953 -23.546 -6.331 1.00 0.00 H ATOM 1475 H SER A 543 43.674 -21.385 -4.165 1.00 0.00 H ATOM 1476 N ARG A 544 45.770 -22.342 -6.665 1.00 22.33 N ATOM 1477 CA ARG A 544 46.606 -22.421 -7.857 1.00 28.98 C ATOM 1478 C ARG A 544 48.084 -22.603 -7.540 1.00 36.18 C ATOM 1479 O ARG A 544 48.841 -23.033 -8.418 1.00 31.88 O ATOM 1480 CB ARG A 544 46.414 -21.142 -8.682 1.00 26.98 C ATOM 1481 H ARG A 544 45.242 -21.468 -6.468 1.00 0.00 H ATOM 1482 N TYR A 545 48.518 -22.286 -6.320 1.00 28.05 N ATOM 1483 CA TYR A 545 49.936 -22.302 -5.972 1.00 22.17 C ATOM 1484 C TYR A 545 50.313 -23.445 -5.035 1.00 20.97 C ATOM 1485 O TYR A 545 51.469 -23.519 -4.600 1.00 21.22 O ATOM 1486 CB TYR A 545 50.340 -20.953 -5.373 1.00 21.28 C ATOM 1487 CG TYR A 545 49.826 -19.796 -6.182 1.00 24.46 C ATOM 1488 CD1 TYR A 545 48.829 -18.959 -5.691 1.00 18.87 C ATOM 1489 CD2 TYR A 545 50.305 -19.557 -7.459 1.00 34.12 C ATOM 1490 CE1 TYR A 545 48.348 -17.912 -6.433 1.00 23.62 C ATOM 1491 CE2 TYR A 545 49.821 -18.503 -8.215 1.00 42.81 C ATOM 1492 CZ TYR A 545 48.840 -17.691 -7.700 1.00 34.21 C ATOM 1493 OH TYR A 545 48.358 -16.641 -8.441 1.00 36.22 O ATOM 1494 HH TYR A 545 47.967 -16.985 -9.283 1.00 0.00 H ATOM 1495 H TYR A 545 47.824 -22.019 -5.593 1.00 0.00 H ATOM 1496 N VAL A 546 49.381 -24.348 -4.732 1.00 20.19 N ATOM 1497 CA VAL A 546 49.651 -25.443 -3.809 1.00 21.10 C ATOM 1498 C VAL A 546 50.533 -26.487 -4.487 1.00 23.01 C ATOM 1499 O VAL A 546 50.253 -26.920 -5.611 1.00 23.96 O ATOM 1500 CB VAL A 546 48.335 -26.074 -3.328 1.00 22.03 C ATOM 1501 CG1 VAL A 546 48.612 -27.295 -2.460 1.00 22.08 C ATOM 1502 CG2 VAL A 546 47.517 -25.057 -2.547 1.00 23.25 C ATOM 1503 H VAL A 546 48.438 -24.269 -5.165 1.00 0.00 H ATOM 1504 N LEU A 547 51.595 -26.903 -3.793 1.00 22.27 N ATOM 1505 CA LEU A 547 52.454 -28.008 -4.212 1.00 21.40 C ATOM 1506 C LEU A 547 52.186 -29.158 -3.250 1.00 23.52 C ATOM 1507 O LEU A 547 52.810 -29.276 -2.192 1.00 29.16 O ATOM 1508 CB LEU A 547 53.918 -27.619 -4.174 1.00 28.19 C ATOM 1509 CG LEU A 547 54.347 -26.538 -5.157 1.00 24.09 C ATOM 1510 CD1 LEU A 547 55.822 -26.295 -4.978 1.00 29.61 C ATOM 1511 CD2 LEU A 547 54.038 -26.914 -6.599 1.00 31.72 C ATOM 1512 H LEU A 547 51.824 -26.413 -2.905 1.00 0.00 H ATOM 1513 N ASP A 548 51.246 -30.001 -3.631 1.00 19.11 N ATOM 1514 CA ASP A 548 50.847 -31.156 -2.847 1.00 25.60 C ATOM 1515 C ASP A 548 49.916 -31.961 -3.728 1.00 26.56 C ATOM 1516 O ASP A 548 48.747 -31.603 -3.895 1.00 20.59 O ATOM 1517 CB ASP A 548 50.120 -30.739 -1.572 1.00 23.67 C ATOM 1518 CG ASP A 548 49.711 -31.909 -0.722 1.00 27.88 C ATOM 1519 OD1 ASP A 548 49.817 -33.080 -1.176 1.00 26.92 O ATOM 1520 OD2 ASP A 548 49.270 -31.655 0.417 1.00 29.88 O ATOM 1521 H ASP A 548 50.767 -29.830 -4.538 1.00 0.00 H ATOM 1522 N ASP A 549 50.429 -33.039 -4.317 1.00 20.82 N ATOM 1523 CA ASP A 549 49.625 -33.824 -5.246 1.00 24.47 C ATOM 1524 C ASP A 549 48.331 -34.315 -4.617 1.00 20.19 C ATOM 1525 O ASP A 549 47.365 -34.580 -5.336 1.00 23.15 O ATOM 1526 CB ASP A 549 50.424 -35.027 -5.742 1.00 23.71 C ATOM 1527 CG ASP A 549 51.555 -34.636 -6.666 1.00 40.32 C ATOM 1528 OD1 ASP A 549 51.551 -33.496 -7.177 1.00 42.05 O ATOM 1529 OD2 ASP A 549 52.441 -35.483 -6.894 1.00 35.78 O ATOM 1530 H ASP A 549 51.409 -33.323 -4.113 1.00 0.00 H ATOM 1531 N GLU A 550 48.290 -34.478 -3.292 1.00 21.74 N ATOM 1532 CA GLU A 550 47.060 -34.954 -2.671 1.00 24.32 C ATOM 1533 C GLU A 550 45.963 -33.906 -2.742 1.00 21.35 C ATOM 1534 O GLU A 550 44.783 -34.257 -2.695 1.00 19.37 O ATOM 1535 CB GLU A 550 47.295 -35.360 -1.218 1.00 28.32 C ATOM 1536 CG GLU A 550 48.041 -36.686 -1.065 1.00 34.29 C ATOM 1537 CD GLU A 550 47.277 -37.861 -1.637 1.00 41.93 C ATOM 1538 OE1 GLU A 550 46.048 -37.927 -1.442 1.00 50.11 O ATOM 1539 OE2 GLU A 550 47.910 -38.720 -2.285 1.00 52.05 O ATOM 1540 H GLU A 550 49.126 -34.268 -2.710 1.00 0.00 H ATOM 1541 N TYR A 551 46.334 -32.628 -2.824 1.00 16.16 N ATOM 1542 CA TYR A 551 45.393 -31.520 -2.946 1.00 18.38 C ATOM 1543 C TYR A 551 45.108 -31.157 -4.398 1.00 17.93 C ATOM 1544 O TYR A 551 43.979 -30.773 -4.724 1.00 18.55 O ATOM 1545 CB TYR A 551 45.939 -30.286 -2.221 1.00 18.44 C ATOM 1546 CG TYR A 551 45.030 -29.069 -2.314 1.00 17.53 C ATOM 1547 CD1 TYR A 551 45.193 -28.144 -3.326 1.00 19.04 C ATOM 1548 CD2 TYR A 551 44.013 -28.859 -1.394 1.00 18.75 C ATOM 1549 CE1 TYR A 551 44.378 -27.035 -3.423 1.00 21.45 C ATOM 1550 CE2 TYR A 551 43.187 -27.737 -1.485 1.00 17.55 C ATOM 1551 CZ TYR A 551 43.382 -26.838 -2.506 1.00 20.01 C ATOM 1552 OH TYR A 551 42.581 -25.730 -2.634 1.00 19.63 O ATOM 1553 HH TYR A 551 41.641 -26.016 -2.754 1.00 0.00 H ATOM 1554 H TYR A 551 47.350 -32.409 -2.800 1.00 0.00 H ATOM 1555 N THR A 552 46.107 -31.250 -5.277 1.00 18.94 N ATOM 1556 CA THR A 552 45.949 -30.750 -6.639 1.00 18.18 C ATOM 1557 C THR A 552 45.325 -31.767 -7.576 1.00 23.23 C ATOM 1558 O THR A 552 44.697 -31.376 -8.566 1.00 23.31 O ATOM 1559 CB THR A 552 47.286 -30.271 -7.224 1.00 25.03 C ATOM 1560 OG1 THR A 552 48.222 -31.347 -7.249 1.00 23.67 O ATOM 1561 CG2 THR A 552 47.853 -29.120 -6.405 1.00 35.56 C ATOM 1562 HG1 THR A 552 47.865 -32.081 -7.810 1.00 0.00 H ATOM 1563 H THR A 552 47.008 -31.683 -4.989 1.00 0.00 H ATOM 1564 N SER A 553 45.484 -33.058 -7.295 1.00 20.73 N ATOM 1565 CA SER A 553 44.862 -34.102 -8.105 1.00 24.07 C ATOM 1566 C SER A 553 43.412 -34.328 -7.688 1.00 20.54 C ATOM 1567 O SER A 553 43.105 -34.440 -6.498 1.00 17.60 O ATOM 1568 CB SER A 553 45.628 -35.407 -7.935 1.00 23.09 C ATOM 1569 OG SER A 553 44.862 -36.496 -8.430 1.00 24.31 O ATOM 1570 HG SER A 553 45.372 -37.337 -8.313 1.00 0.00 H ATOM 1571 H SER A 553 46.066 -33.331 -6.477 1.00 0.00 H ATOM 1572 N SER A 554 42.521 -34.430 -8.686 1.00 23.47 N ATOM 1573 CA SER A 554 41.103 -34.646 -8.420 1.00 21.84 C ATOM 1574 C SER A 554 40.821 -35.982 -7.740 1.00 22.70 C ATOM 1575 O SER A 554 39.718 -36.183 -7.216 1.00 23.03 O ATOM 1576 CB SER A 554 40.292 -34.540 -9.715 1.00 29.56 C ATOM 1577 OG SER A 554 40.632 -35.564 -10.625 1.00 30.30 O ATOM 1578 HG SER A 554 40.091 -35.466 -11.448 1.00 0.00 H ATOM 1579 H SER A 554 42.848 -34.353 -9.670 1.00 0.00 H ATOM 1580 N VAL A 555 41.780 -36.903 -7.744 1.00 21.64 N ATOM 1581 CA VAL A 555 41.657 -38.145 -6.988 1.00 20.20 C ATOM 1582 C VAL A 555 42.521 -38.132 -5.734 1.00 23.55 C ATOM 1583 O VAL A 555 42.635 -39.155 -5.049 1.00 23.87 O ATOM 1584 CB VAL A 555 41.914 -39.389 -7.862 1.00 26.49 C ATOM 1585 CG1 VAL A 555 40.869 -39.469 -8.985 1.00 26.50 C ATOM 1586 CG2 VAL A 555 43.316 -39.391 -8.437 1.00 27.10 C ATOM 1587 H VAL A 555 42.642 -36.733 -8.301 1.00 0.00 H ATOM 1588 N GLY A 556 43.141 -36.996 -5.424 1.00 20.96 N ATOM 1589 CA GLY A 556 43.877 -36.871 -4.187 1.00 26.58 C ATOM 1590 C GLY A 556 42.963 -36.798 -2.979 1.00 22.49 C ATOM 1591 O GLY A 556 41.821 -36.339 -3.047 1.00 22.89 O ATOM 1592 H GLY A 556 43.095 -36.190 -6.079 1.00 0.00 H ATOM 1593 N SER A 557 43.493 -37.261 -1.846 1.00 24.63 N ATOM 1594 CA SER A 557 42.739 -37.296 -0.601 1.00 26.93 C ATOM 1595 C SER A 557 42.345 -35.915 -0.090 1.00 24.40 C ATOM 1596 O SER A 557 41.420 -35.813 0.722 1.00 38.40 O ATOM 1597 CB SER A 557 43.584 -37.985 0.468 1.00 51.52 C ATOM 1598 OG SER A 557 44.787 -37.264 0.697 1.00 50.91 O ATOM 1599 HG SER A 557 45.308 -37.218 -0.144 1.00 0.00 H ATOM 1600 H SER A 557 44.474 -37.607 -1.852 1.00 0.00 H ATOM 1601 N LYS A 558 43.016 -34.849 -0.525 1.00 24.08 N ATOM 1602 CA LYS A 558 42.744 -33.509 -0.026 1.00 21.83 C ATOM 1603 C LYS A 558 41.977 -32.636 -1.014 1.00 22.51 C ATOM 1604 O LYS A 558 41.623 -31.500 -0.676 1.00 22.64 O ATOM 1605 CB LYS A 558 44.058 -32.812 0.331 1.00 21.59 C ATOM 1606 CG LYS A 558 44.875 -33.551 1.370 1.00 36.80 C ATOM 1607 CD LYS A 558 46.177 -32.822 1.632 1.00 45.14 C ATOM 1608 CE LYS A 558 47.061 -33.573 2.608 1.00 50.25 C ATOM 1609 NZ LYS A 558 48.334 -32.846 2.841 1.00 47.69 N ATOM 1610 HZ1 LYS A 558 48.843 -32.743 1.940 1.00 0.00 H ATOM 1611 HZ2 LYS A 558 48.128 -31.905 3.233 1.00 0.00 H ATOM 1612 HZ3 LYS A 558 48.920 -33.382 3.513 1.00 0.00 H ATOM 1613 H LYS A 558 43.757 -34.979 -1.243 1.00 0.00 H ATOM 1614 N PHE A 559 41.713 -33.130 -2.214 1.00 19.66 N ATOM 1615 CA PHE A 559 41.032 -32.323 -3.213 1.00 18.47 C ATOM 1616 C PHE A 559 39.611 -32.040 -2.736 1.00 15.66 C ATOM 1617 O PHE A 559 38.988 -32.912 -2.131 1.00 15.64 O ATOM 1618 CB PHE A 559 40.962 -33.115 -4.510 1.00 14.77 C ATOM 1619 CG PHE A 559 40.503 -32.312 -5.700 1.00 13.96 C ATOM 1620 CD1 PHE A 559 41.418 -31.633 -6.480 1.00 15.32 C ATOM 1621 CD2 PHE A 559 39.160 -32.261 -6.044 1.00 18.47 C ATOM 1622 CE1 PHE A 559 41.022 -30.920 -7.560 1.00 14.92 C ATOM 1623 CE2 PHE A 559 38.751 -31.541 -7.131 1.00 16.89 C ATOM 1624 CZ PHE A 559 39.685 -30.871 -7.902 1.00 17.16 C ATOM 1625 H PHE A 559 41.995 -34.104 -2.444 1.00 0.00 H ATOM 1626 N PRO A 560 39.065 -30.854 -3.009 1.00 15.12 N ATOM 1627 CA PRO A 560 37.716 -30.513 -2.505 1.00 15.18 C ATOM 1628 C PRO A 560 36.599 -31.132 -3.338 1.00 13.54 C ATOM 1629 O PRO A 560 35.743 -30.443 -3.910 1.00 14.01 O ATOM 1630 CB PRO A 560 37.728 -28.979 -2.544 1.00 18.44 C ATOM 1631 CG PRO A 560 38.603 -28.665 -3.671 1.00 19.21 C ATOM 1632 CD PRO A 560 39.714 -29.688 -3.634 1.00 15.48 C ATOM 1633 N VAL A 561 36.573 -32.470 -3.371 1.00 14.31 N ATOM 1634 CA VAL A 561 35.605 -33.201 -4.176 1.00 14.29 C ATOM 1635 C VAL A 561 34.185 -32.780 -3.846 1.00 14.91 C ATOM 1636 O VAL A 561 33.355 -32.592 -4.743 1.00 13.49 O ATOM 1637 CB VAL A 561 35.795 -34.714 -3.993 1.00 14.43 C ATOM 1638 CG1 VAL A 561 34.689 -35.477 -4.707 1.00 20.50 C ATOM 1639 CG2 VAL A 561 37.169 -35.138 -4.500 1.00 17.00 C ATOM 1640 H VAL A 561 37.264 -33.003 -2.805 1.00 0.00 H ATOM 1641 N ARG A 562 33.875 -32.627 -2.557 1.00 12.53 N ATOM 1642 CA ARG A 562 32.487 -32.425 -2.153 1.00 11.82 C ATOM 1643 C ARG A 562 31.976 -31.037 -2.505 1.00 12.28 C ATOM 1644 O ARG A 562 30.772 -30.782 -2.366 1.00 13.03 O ATOM 1645 CB ARG A 562 32.332 -32.681 -0.659 1.00 11.65 C ATOM 1646 CG ARG A 562 32.596 -34.116 -0.248 1.00 14.82 C ATOM 1647 CD ARG A 562 32.935 -34.245 1.246 1.00 14.60 C ATOM 1648 NE ARG A 562 33.620 -35.504 1.428 1.00 15.90 N ATOM 1649 CZ ARG A 562 33.026 -36.671 1.642 1.00 18.33 C ATOM 1650 NH1 ARG A 562 33.756 -37.774 1.716 1.00 19.18 N ATOM 1651 NH2 ARG A 562 31.719 -36.747 1.820 1.00 13.91 N ATOM 1652 HE ARG A 562 34.659 -35.495 1.388 1.00 0.00 H ATOM 1653 HH12 ARG A 562 33.296 -38.692 1.884 1.00 0.00 H ATOM 1654 HH11 ARG A 562 34.789 -37.722 1.607 1.00 0.00 H ATOM 1655 HH22 ARG A 562 31.270 -37.670 1.987 1.00 0.00 H ATOM 1656 HH21 ARG A 562 31.140 -35.884 1.794 1.00 0.00 H ATOM 1657 H ARG A 562 34.625 -32.652 -1.837 1.00 0.00 H ATOM 1658 N TRP A 563 32.861 -30.141 -2.953 1.00 11.10 N ATOM 1659 CA TRP A 563 32.498 -28.799 -3.384 1.00 12.09 C ATOM 1660 C TRP A 563 32.686 -28.618 -4.887 1.00 13.12 C ATOM 1661 O TRP A 563 32.650 -27.486 -5.375 1.00 14.81 O ATOM 1662 CB TRP A 563 33.318 -27.762 -2.593 1.00 13.54 C ATOM 1663 CG TRP A 563 32.917 -27.697 -1.130 1.00 10.72 C ATOM 1664 CD1 TRP A 563 32.079 -26.796 -0.564 1.00 12.63 C ATOM 1665 CD2 TRP A 563 33.305 -28.594 -0.077 1.00 12.50 C ATOM 1666 NE1 TRP A 563 31.905 -27.069 0.772 1.00 11.99 N ATOM 1667 CE2 TRP A 563 32.637 -28.178 1.093 1.00 11.48 C ATOM 1668 CE3 TRP A 563 34.149 -29.704 -0.008 1.00 14.63 C ATOM 1669 CZ2 TRP A 563 32.795 -28.823 2.318 1.00 13.37 C ATOM 1670 CZ3 TRP A 563 34.291 -30.355 1.209 1.00 15.13 C ATOM 1671 CH2 TRP A 563 33.605 -29.915 2.348 1.00 15.70 C ATOM 1672 HE1 TRP A 563 31.314 -26.522 1.430 1.00 0.00 H ATOM 1673 H TRP A 563 33.863 -30.418 -2.996 1.00 0.00 H ATOM 1674 N SER A 564 32.880 -29.704 -5.636 1.00 12.74 N ATOM 1675 CA SER A 564 33.282 -29.608 -7.036 1.00 12.64 C ATOM 1676 C SER A 564 32.197 -30.107 -7.978 1.00 15.59 C ATOM 1677 O SER A 564 31.606 -31.170 -7.740 1.00 14.60 O ATOM 1678 CB SER A 564 34.548 -30.430 -7.299 1.00 16.21 C ATOM 1679 OG SER A 564 35.632 -29.905 -6.584 1.00 16.72 O ATOM 1680 HG SER A 564 35.429 -29.928 -5.615 1.00 0.00 H ATOM 1681 H SER A 564 32.741 -30.643 -5.212 1.00 0.00 H ATOM 1682 N PRO A 565 31.957 -29.399 -9.081 1.00 14.53 N ATOM 1683 CA PRO A 565 30.984 -29.861 -10.073 1.00 15.01 C ATOM 1684 C PRO A 565 31.559 -30.967 -10.933 1.00 12.63 C ATOM 1685 O PRO A 565 32.783 -31.184 -10.947 1.00 14.81 O ATOM 1686 CB PRO A 565 30.750 -28.604 -10.918 1.00 13.01 C ATOM 1687 CG PRO A 565 32.061 -27.946 -10.900 1.00 14.35 C ATOM 1688 CD PRO A 565 32.524 -28.096 -9.465 1.00 15.49 C ATOM 1689 N PRO A 566 30.713 -31.661 -11.692 1.00 16.94 N ATOM 1690 CA PRO A 566 31.213 -32.750 -12.544 1.00 21.47 C ATOM 1691 C PRO A 566 32.333 -32.340 -13.484 1.00 18.84 C ATOM 1692 O PRO A 566 33.281 -33.117 -13.659 1.00 20.81 O ATOM 1693 CB PRO A 566 29.967 -33.191 -13.323 1.00 21.84 C ATOM 1694 CG PRO A 566 28.805 -32.681 -12.567 1.00 24.27 C ATOM 1695 CD PRO A 566 29.247 -31.510 -11.762 1.00 17.27 C ATOM 1696 N GLU A 567 32.282 -31.137 -14.075 1.00 17.21 N ATOM 1697 CA GLU A 567 33.311 -30.776 -15.050 1.00 20.38 C ATOM 1698 C GLU A 567 34.662 -30.539 -14.388 1.00 23.97 C ATOM 1699 O GLU A 567 35.696 -30.597 -15.063 1.00 25.93 O ATOM 1700 CB GLU A 567 32.898 -29.567 -15.896 1.00 18.75 C ATOM 1701 CG GLU A 567 32.903 -28.210 -15.193 1.00 23.46 C ATOM 1702 CD GLU A 567 31.632 -27.914 -14.418 1.00 17.04 C ATOM 1703 OE1 GLU A 567 30.778 -28.819 -14.260 1.00 19.23 O ATOM 1704 OE2 GLU A 567 31.512 -26.762 -13.974 1.00 18.45 O ATOM 1705 H GLU A 567 31.520 -30.469 -13.843 1.00 0.00 H ATOM 1706 N VAL A 568 34.681 -30.270 -13.087 1.00 17.21 N ATOM 1707 CA VAL A 568 35.947 -30.203 -12.377 1.00 16.25 C ATOM 1708 C VAL A 568 36.468 -31.602 -12.084 1.00 17.82 C ATOM 1709 O VAL A 568 37.652 -31.893 -12.280 1.00 21.02 O ATOM 1710 CB VAL A 568 35.802 -29.364 -11.093 1.00 16.18 C ATOM 1711 CG1 VAL A 568 36.991 -29.599 -10.143 1.00 16.33 C ATOM 1712 CG2 VAL A 568 35.723 -27.892 -11.454 1.00 18.14 C ATOM 1713 H VAL A 568 33.790 -30.107 -12.577 1.00 0.00 H ATOM 1714 N LEU A 569 35.603 -32.476 -11.577 1.00 21.45 N ATOM 1715 CA LEU A 569 36.046 -33.831 -11.278 1.00 18.01 C ATOM 1716 C LEU A 569 36.522 -34.550 -12.535 1.00 20.99 C ATOM 1717 O LEU A 569 37.459 -35.352 -12.461 1.00 29.88 O ATOM 1718 CB LEU A 569 34.928 -34.600 -10.568 1.00 20.30 C ATOM 1719 CG LEU A 569 34.453 -33.948 -9.262 1.00 20.29 C ATOM 1720 CD1 LEU A 569 33.275 -34.687 -8.668 1.00 22.44 C ATOM 1721 CD2 LEU A 569 35.583 -33.874 -8.257 1.00 22.34 C ATOM 1722 H LEU A 569 34.618 -32.194 -11.396 1.00 0.00 H ATOM 1723 N MET A 570 35.920 -34.262 -13.695 1.00 21.26 N ATOM 1724 CA MET A 570 36.203 -34.979 -14.942 1.00 22.36 C ATOM 1725 C MET A 570 37.246 -34.298 -15.827 1.00 31.90 C ATOM 1726 O MET A 570 38.022 -34.990 -16.494 1.00 34.22 O ATOM 1727 CB MET A 570 34.913 -35.164 -15.758 1.00 27.22 C ATOM 1728 CG MET A 570 33.815 -35.971 -15.073 1.00 34.72 C ATOM 1729 SD MET A 570 32.368 -36.306 -16.128 1.00 44.64 S ATOM 1730 CE MET A 570 31.679 -34.669 -16.371 1.00 55.52 C ATOM 1731 H MET A 570 35.219 -33.494 -13.713 1.00 0.00 H ATOM 1732 N TYR A 571 37.276 -32.964 -15.876 1.00 25.58 N ATOM 1733 CA TYR A 571 38.097 -32.246 -16.847 1.00 27.17 C ATOM 1734 C TYR A 571 38.969 -31.160 -16.230 1.00 31.79 C ATOM 1735 O TYR A 571 39.685 -30.480 -16.975 1.00 28.19 O ATOM 1736 CB TYR A 571 37.214 -31.611 -17.939 1.00 22.55 C ATOM 1737 CG TYR A 571 36.091 -32.495 -18.413 1.00 22.04 C ATOM 1738 CD1 TYR A 571 34.783 -32.035 -18.433 1.00 29.69 C ATOM 1739 CD2 TYR A 571 36.334 -33.788 -18.843 1.00 38.89 C ATOM 1740 CE1 TYR A 571 33.746 -32.837 -18.857 1.00 35.94 C ATOM 1741 CE2 TYR A 571 35.297 -34.606 -19.265 1.00 45.20 C ATOM 1742 CZ TYR A 571 34.006 -34.122 -19.272 1.00 42.80 C ATOM 1743 OH TYR A 571 32.977 -34.918 -19.708 1.00 45.42 O ATOM 1744 HH TYR A 571 32.125 -34.417 -19.647 1.00 0.00 H ATOM 1745 H TYR A 571 36.698 -32.421 -15.203 1.00 0.00 H ATOM 1746 N SER A 572 38.937 -30.975 -14.903 1.00 22.70 N ATOM 1747 CA SER A 572 39.652 -29.877 -14.242 1.00 28.05 C ATOM 1748 C SER A 572 39.275 -28.529 -14.855 1.00 26.20 C ATOM 1749 O SER A 572 40.094 -27.618 -14.991 1.00 25.40 O ATOM 1750 CB SER A 572 41.164 -30.102 -14.246 1.00 37.15 C ATOM 1751 OG SER A 572 41.480 -31.265 -13.501 1.00 54.38 O ATOM 1752 HG SER A 572 42.460 -31.404 -13.508 1.00 0.00 H ATOM 1753 H SER A 572 38.384 -31.635 -14.319 1.00 0.00 H ATOM 1754 N LYS A 573 38.010 -28.398 -15.228 1.00 23.20 N ATOM 1755 CA LYS A 573 37.530 -27.197 -15.906 1.00 23.42 C ATOM 1756 C LYS A 573 36.976 -26.245 -14.852 1.00 24.96 C ATOM 1757 O LYS A 573 35.782 -26.246 -14.556 1.00 23.63 O ATOM 1758 CB LYS A 573 36.479 -27.570 -16.943 1.00 28.16 C ATOM 1759 CG LYS A 573 36.150 -26.465 -17.929 1.00 48.69 C ATOM 1760 CD LYS A 573 35.183 -26.958 -18.997 1.00 67.17 C ATOM 1761 CE LYS A 573 34.914 -25.893 -20.052 1.00 76.37 C ATOM 1762 NZ LYS A 573 36.084 -25.672 -20.948 1.00 76.97 N ATOM 1763 HZ1 LYS A 573 36.900 -25.364 -20.381 1.00 0.00 H ATOM 1764 HZ2 LYS A 573 36.316 -26.559 -21.439 1.00 0.00 H ATOM 1765 HZ3 LYS A 573 35.850 -24.939 -21.647 1.00 0.00 H ATOM 1766 H LYS A 573 37.342 -29.171 -15.033 1.00 0.00 H ATOM 1767 N PHE A 574 37.859 -25.425 -14.275 1.00 30.42 N ATOM 1768 CA PHE A 574 37.447 -24.411 -13.312 1.00 23.01 C ATOM 1769 C PHE A 574 36.938 -23.178 -14.042 1.00 27.88 C ATOM 1770 O PHE A 574 37.471 -22.781 -15.084 1.00 27.74 O ATOM 1771 CB PHE A 574 38.606 -24.009 -12.401 1.00 21.98 C ATOM 1772 CG PHE A 574 39.030 -25.089 -11.453 1.00 30.65 C ATOM 1773 CD1 PHE A 574 39.950 -26.044 -11.845 1.00 31.07 C ATOM 1774 CD2 PHE A 574 38.503 -25.162 -10.174 1.00 23.32 C ATOM 1775 CE1 PHE A 574 40.342 -27.046 -10.974 1.00 33.79 C ATOM 1776 CE2 PHE A 574 38.886 -26.164 -9.302 1.00 26.10 C ATOM 1777 CZ PHE A 574 39.808 -27.107 -9.705 1.00 27.04 C ATOM 1778 H PHE A 574 38.866 -25.512 -14.519 1.00 0.00 H ATOM 1779 N SER A 575 35.897 -22.579 -13.484 1.00 19.52 N ATOM 1780 CA SER A 575 35.283 -21.389 -14.054 1.00 21.66 C ATOM 1781 C SER A 575 34.463 -20.711 -12.969 1.00 19.72 C ATOM 1782 O SER A 575 34.331 -21.214 -11.844 1.00 18.94 O ATOM 1783 CB SER A 575 34.405 -21.734 -15.264 1.00 29.17 C ATOM 1784 OG SER A 575 33.152 -22.285 -14.865 1.00 22.90 O ATOM 1785 HG SER A 575 33.307 -23.113 -14.345 1.00 0.00 H ATOM 1786 H SER A 575 35.504 -22.974 -12.606 1.00 0.00 H ATOM 1787 N SER A 576 33.881 -19.565 -13.326 1.00 26.03 N ATOM 1788 CA SER A 576 32.915 -18.935 -12.443 1.00 26.43 C ATOM 1789 C SER A 576 31.813 -19.919 -12.070 1.00 15.42 C ATOM 1790 O SER A 576 31.289 -19.874 -10.955 1.00 17.08 O ATOM 1791 CB SER A 576 32.312 -17.715 -13.136 1.00 42.66 C ATOM 1792 OG SER A 576 31.693 -18.088 -14.358 1.00 50.71 O ATOM 1793 HG SER A 576 32.367 -18.497 -14.957 1.00 0.00 H ATOM 1794 H SER A 576 34.119 -19.123 -14.237 1.00 0.00 H ATOM 1795 N LYS A 577 31.478 -20.836 -12.983 1.00 18.31 N ATOM 1796 CA LYS A 577 30.416 -21.804 -12.717 1.00 16.88 C ATOM 1797 C LYS A 577 30.823 -22.915 -11.763 1.00 17.31 C ATOM 1798 O LYS A 577 29.940 -23.505 -11.131 1.00 15.03 O ATOM 1799 CB LYS A 577 29.897 -22.421 -14.020 1.00 17.93 C ATOM 1800 CG LYS A 577 29.317 -21.395 -15.004 1.00 18.79 C ATOM 1801 CD LYS A 577 28.260 -20.519 -14.362 1.00 19.00 C ATOM 1802 CE LYS A 577 27.555 -19.646 -15.415 1.00 23.81 C ATOM 1803 NZ LYS A 577 26.645 -18.651 -14.830 1.00 25.26 N ATOM 1804 HZ1 LYS A 577 25.908 -19.138 -14.281 1.00 0.00 H ATOM 1805 HZ2 LYS A 577 27.182 -18.017 -14.205 1.00 0.00 H ATOM 1806 HZ3 LYS A 577 26.203 -18.097 -15.591 1.00 0.00 H ATOM 1807 H LYS A 577 31.979 -20.861 -13.894 1.00 0.00 H ATOM 1808 N SER A 578 32.115 -23.235 -11.641 1.00 16.90 N ATOM 1809 CA SER A 578 32.502 -24.181 -10.596 1.00 15.10 C ATOM 1810 C SER A 578 32.488 -23.512 -9.226 1.00 16.77 C ATOM 1811 O SER A 578 32.174 -24.163 -8.217 1.00 14.72 O ATOM 1812 CB SER A 578 33.838 -24.873 -10.910 1.00 17.46 C ATOM 1813 OG SER A 578 34.903 -23.950 -11.102 1.00 15.82 O ATOM 1814 HG SER A 578 35.025 -23.413 -10.279 1.00 0.00 H ATOM 1815 H SER A 578 32.828 -22.821 -12.275 1.00 0.00 H ATOM 1816 N ASP A 579 32.781 -22.205 -9.171 1.00 14.17 N ATOM 1817 CA ASP A 579 32.586 -21.459 -7.929 1.00 14.62 C ATOM 1818 C ASP A 579 31.103 -21.388 -7.559 1.00 13.34 C ATOM 1819 O ASP A 579 30.749 -21.439 -6.374 1.00 13.07 O ATOM 1820 CB ASP A 579 33.160 -20.042 -8.058 1.00 13.06 C ATOM 1821 CG ASP A 579 34.682 -19.957 -7.830 1.00 14.87 C ATOM 1822 OD1 ASP A 579 35.353 -20.944 -7.444 1.00 14.54 O ATOM 1823 OD2 ASP A 579 35.221 -18.846 -8.059 1.00 15.33 O ATOM 1824 H ASP A 579 33.148 -21.720 -10.015 1.00 0.00 H ATOM 1825 N ILE A 580 30.221 -21.251 -8.560 1.00 13.85 N ATOM 1826 CA ILE A 580 28.776 -21.264 -8.310 1.00 11.70 C ATOM 1827 C ILE A 580 28.363 -22.567 -7.638 1.00 13.11 C ATOM 1828 O ILE A 580 27.635 -22.563 -6.643 1.00 12.64 O ATOM 1829 CB ILE A 580 27.987 -21.041 -9.615 1.00 14.42 C ATOM 1830 CG1 ILE A 580 28.174 -19.607 -10.127 1.00 16.72 C ATOM 1831 CG2 ILE A 580 26.508 -21.363 -9.409 1.00 13.98 C ATOM 1832 CD1 ILE A 580 27.386 -18.561 -9.398 1.00 15.24 C ATOM 1833 H ILE A 580 30.569 -21.133 -9.533 1.00 0.00 H ATOM 1834 N TRP A 581 28.828 -23.697 -8.170 1.00 12.80 N ATOM 1835 CA TRP A 581 28.493 -24.993 -7.580 1.00 12.65 C ATOM 1836 C TRP A 581 28.938 -25.045 -6.125 1.00 11.25 C ATOM 1837 O TRP A 581 28.181 -25.457 -5.232 1.00 12.47 O ATOM 1838 CB TRP A 581 29.178 -26.116 -8.375 1.00 11.54 C ATOM 1839 CG TRP A 581 28.918 -27.495 -7.845 1.00 14.85 C ATOM 1840 CD1 TRP A 581 29.386 -28.031 -6.671 1.00 14.11 C ATOM 1841 CD2 TRP A 581 28.109 -28.507 -8.457 1.00 14.21 C ATOM 1842 NE1 TRP A 581 28.904 -29.310 -6.515 1.00 14.01 N ATOM 1843 CE2 TRP A 581 28.126 -29.628 -7.601 1.00 13.09 C ATOM 1844 CE3 TRP A 581 27.389 -28.578 -9.657 1.00 14.79 C ATOM 1845 CZ2 TRP A 581 27.436 -30.810 -7.899 1.00 13.61 C ATOM 1846 CZ3 TRP A 581 26.695 -29.751 -9.950 1.00 15.48 C ATOM 1847 CH2 TRP A 581 26.733 -30.848 -9.084 1.00 14.61 C ATOM 1848 HE1 TRP A 581 29.097 -29.934 -5.706 1.00 0.00 H ATOM 1849 H TRP A 581 29.435 -23.657 -9.013 1.00 0.00 H ATOM 1850 N ALA A 582 30.182 -24.654 -5.879 1.00 11.66 N ATOM 1851 CA ALA A 582 30.726 -24.654 -4.523 1.00 10.37 C ATOM 1852 C ALA A 582 29.903 -23.757 -3.600 1.00 11.51 C ATOM 1853 O ALA A 582 29.677 -24.091 -2.436 1.00 11.43 O ATOM 1854 CB ALA A 582 32.184 -24.192 -4.575 1.00 10.66 C ATOM 1855 H ALA A 582 30.783 -24.341 -6.668 1.00 0.00 H ATOM 1856 N PHE A 583 29.465 -22.605 -4.091 1.00 12.02 N ATOM 1857 CA PHE A 583 28.632 -21.715 -3.281 1.00 14.27 C ATOM 1858 C PHE A 583 27.323 -22.385 -2.869 1.00 12.30 C ATOM 1859 O PHE A 583 26.856 -22.215 -1.737 1.00 11.57 O ATOM 1860 CB PHE A 583 28.333 -20.426 -4.043 1.00 12.55 C ATOM 1861 CG PHE A 583 27.387 -19.513 -3.310 1.00 12.01 C ATOM 1862 CD1 PHE A 583 27.811 -18.772 -2.225 1.00 13.37 C ATOM 1863 CD2 PHE A 583 26.066 -19.430 -3.683 1.00 15.18 C ATOM 1864 CE1 PHE A 583 26.928 -17.935 -1.534 1.00 14.20 C ATOM 1865 CE2 PHE A 583 25.176 -18.607 -2.989 1.00 12.82 C ATOM 1866 CZ PHE A 583 25.610 -17.871 -1.916 1.00 13.56 C ATOM 1867 H PHE A 583 29.716 -22.331 -5.062 1.00 0.00 H ATOM 1868 N GLY A 584 26.715 -23.143 -3.767 1.00 12.71 N ATOM 1869 CA GLY A 584 25.529 -23.898 -3.388 1.00 12.60 C ATOM 1870 C GLY A 584 25.805 -24.851 -2.242 1.00 13.18 C ATOM 1871 O GLY A 584 25.019 -24.948 -1.294 1.00 12.50 O ATOM 1872 H GLY A 584 27.082 -23.199 -4.738 1.00 0.00 H ATOM 1873 N VAL A 585 26.923 -25.581 -2.315 1.00 12.59 N ATOM 1874 CA VAL A 585 27.312 -26.462 -1.210 1.00 11.01 C ATOM 1875 C VAL A 585 27.548 -25.660 0.062 1.00 10.45 C ATOM 1876 O VAL A 585 27.182 -26.091 1.157 1.00 11.15 O ATOM 1877 CB VAL A 585 28.541 -27.325 -1.579 1.00 12.79 C ATOM 1878 CG1 VAL A 585 28.871 -28.303 -0.452 1.00 13.93 C ATOM 1879 CG2 VAL A 585 28.325 -28.070 -2.910 1.00 13.52 C ATOM 1880 H VAL A 585 27.522 -25.523 -3.163 1.00 0.00 H ATOM 1881 N LEU A 586 28.169 -24.483 -0.056 1.00 11.35 N ATOM 1882 CA LEU A 586 28.360 -23.624 1.109 1.00 11.04 C ATOM 1883 C LEU A 586 27.025 -23.195 1.721 1.00 9.82 C ATOM 1884 O LEU A 586 26.865 -23.202 2.949 1.00 11.58 O ATOM 1885 CB LEU A 586 29.234 -22.423 0.715 1.00 10.98 C ATOM 1886 CG LEU A 586 29.522 -21.353 1.770 1.00 16.86 C ATOM 1887 CD1 LEU A 586 30.835 -20.706 1.373 1.00 25.90 C ATOM 1888 CD2 LEU A 586 28.447 -20.283 1.869 1.00 24.88 C ATOM 1889 H LEU A 586 28.519 -24.176 -0.986 1.00 0.00 H ATOM 1890 N MET A 587 26.043 -22.845 0.889 1.00 12.63 N ATOM 1891 CA MET A 587 24.720 -22.534 1.428 1.00 12.94 C ATOM 1892 C MET A 587 24.184 -23.720 2.221 1.00 11.94 C ATOM 1893 O MET A 587 23.580 -23.553 3.287 1.00 11.30 O ATOM 1894 CB MET A 587 23.736 -22.158 0.318 1.00 13.44 C ATOM 1895 CG MET A 587 23.984 -20.821 -0.358 1.00 13.11 C ATOM 1896 SD MET A 587 22.646 -20.369 -1.488 1.00 15.10 S ATOM 1897 CE MET A 587 21.253 -20.263 -0.380 1.00 20.38 C ATOM 1898 H MET A 587 26.217 -22.794 -0.135 1.00 0.00 H ATOM 1899 N TRP A 588 24.385 -24.929 1.704 1.00 12.33 N ATOM 1900 CA TRP A 588 23.939 -26.126 2.411 1.00 12.04 C ATOM 1901 C TRP A 588 24.692 -26.307 3.729 1.00 12.37 C ATOM 1902 O TRP A 588 24.095 -26.654 4.755 1.00 12.41 O ATOM 1903 CB TRP A 588 24.120 -27.340 1.489 1.00 12.34 C ATOM 1904 CG TRP A 588 23.590 -28.606 2.062 1.00 12.18 C ATOM 1905 CD1 TRP A 588 22.349 -29.158 1.850 1.00 14.27 C ATOM 1906 CD2 TRP A 588 24.268 -29.495 2.958 1.00 13.41 C ATOM 1907 NE1 TRP A 588 22.225 -30.319 2.564 1.00 13.36 N ATOM 1908 CE2 TRP A 588 23.390 -30.554 3.248 1.00 13.53 C ATOM 1909 CE3 TRP A 588 25.538 -29.498 3.533 1.00 12.20 C ATOM 1910 CZ2 TRP A 588 23.743 -31.602 4.106 1.00 13.09 C ATOM 1911 CZ3 TRP A 588 25.889 -30.532 4.378 1.00 11.71 C ATOM 1912 CH2 TRP A 588 24.997 -31.576 4.656 1.00 14.46 C ATOM 1913 HE1 TRP A 588 21.381 -30.927 2.585 1.00 0.00 H ATOM 1914 H TRP A 588 24.865 -25.023 0.786 1.00 0.00 H ATOM 1915 N GLU A 589 26.010 -26.065 3.728 1.00 11.52 N ATOM 1916 CA GLU A 589 26.765 -26.069 4.979 1.00 11.48 C ATOM 1917 C GLU A 589 26.170 -25.103 5.997 1.00 11.73 C ATOM 1918 O GLU A 589 26.057 -25.432 7.187 1.00 12.30 O ATOM 1919 CB GLU A 589 28.233 -25.701 4.727 1.00 12.46 C ATOM 1920 CG GLU A 589 29.015 -26.730 3.953 1.00 12.19 C ATOM 1921 CD GLU A 589 30.480 -26.355 3.879 1.00 13.15 C ATOM 1922 OE1 GLU A 589 31.255 -26.811 4.736 1.00 13.84 O ATOM 1923 OE2 GLU A 589 30.849 -25.543 3.008 1.00 13.06 O ATOM 1924 H GLU A 589 26.499 -25.873 2.830 1.00 0.00 H ATOM 1925 N ILE A 590 25.807 -23.900 5.555 1.00 11.23 N ATOM 1926 CA ILE A 590 25.224 -22.913 6.464 1.00 11.12 C ATOM 1927 C ILE A 590 23.867 -23.391 6.991 1.00 11.57 C ATOM 1928 O ILE A 590 23.628 -23.400 8.207 1.00 12.03 O ATOM 1929 CB ILE A 590 25.136 -21.536 5.778 1.00 11.06 C ATOM 1930 CG1 ILE A 590 26.538 -20.934 5.661 1.00 11.57 C ATOM 1931 CG2 ILE A 590 24.183 -20.591 6.539 1.00 12.09 C ATOM 1932 CD1 ILE A 590 26.588 -19.726 4.740 1.00 13.42 C ATOM 1933 H ILE A 590 25.940 -23.660 4.552 1.00 0.00 H ATOM 1934 N TYR A 591 22.978 -23.818 6.096 1.00 12.61 N ATOM 1935 CA TYR A 591 21.627 -24.141 6.538 1.00 12.70 C ATOM 1936 C TYR A 591 21.554 -25.457 7.300 1.00 13.63 C ATOM 1937 O TYR A 591 20.628 -25.635 8.096 1.00 15.75 O ATOM 1938 CB TYR A 591 20.637 -24.108 5.374 1.00 14.43 C ATOM 1939 CG TYR A 591 20.123 -22.699 5.140 1.00 13.82 C ATOM 1940 CD1 TYR A 591 20.784 -21.827 4.277 1.00 14.81 C ATOM 1941 CD2 TYR A 591 19.000 -22.228 5.818 1.00 12.44 C ATOM 1942 CE1 TYR A 591 20.325 -20.534 4.087 1.00 14.92 C ATOM 1943 CE2 TYR A 591 18.544 -20.947 5.633 1.00 14.37 C ATOM 1944 CZ TYR A 591 19.208 -20.100 4.764 1.00 17.44 C ATOM 1945 OH TYR A 591 18.760 -18.802 4.566 1.00 17.84 O ATOM 1946 HH TYR A 591 17.835 -18.824 4.213 1.00 0.00 H ATOM 1947 H TYR A 591 23.244 -23.920 5.096 1.00 0.00 H ATOM 1948 N SER A 592 22.508 -26.361 7.097 1.00 12.92 N ATOM 1949 CA SER A 592 22.644 -27.548 7.930 1.00 12.35 C ATOM 1950 C SER A 592 23.413 -27.292 9.224 1.00 11.47 C ATOM 1951 O SER A 592 23.635 -28.237 10.001 1.00 14.63 O ATOM 1952 CB SER A 592 23.349 -28.655 7.159 1.00 13.36 C ATOM 1953 OG SER A 592 24.737 -28.402 7.016 1.00 13.41 O ATOM 1954 HG SER A 592 24.868 -27.552 6.526 1.00 0.00 H ATOM 1955 H SER A 592 23.180 -26.215 6.317 1.00 0.00 H ATOM 1956 N LEU A 593 23.831 -26.048 9.476 1.00 12.37 N ATOM 1957 CA LEU A 593 24.567 -25.691 10.687 1.00 12.73 C ATOM 1958 C LEU A 593 25.882 -26.455 10.794 1.00 13.30 C ATOM 1959 O LEU A 593 26.276 -26.922 11.869 1.00 14.47 O ATOM 1960 CB LEU A 593 23.704 -25.869 11.941 1.00 15.70 C ATOM 1961 CG LEU A 593 22.321 -25.210 11.869 1.00 16.91 C ATOM 1962 CD1 LEU A 593 21.507 -25.508 13.120 1.00 18.97 C ATOM 1963 CD2 LEU A 593 22.448 -23.694 11.652 1.00 17.84 C ATOM 1964 H LEU A 593 23.624 -25.303 8.781 1.00 0.00 H ATOM 1965 N GLY A 594 26.568 -26.597 9.668 1.00 12.41 N ATOM 1966 CA GLY A 594 27.918 -27.107 9.668 1.00 12.27 C ATOM 1967 C GLY A 594 28.061 -28.604 9.517 1.00 11.51 C ATOM 1968 O GLY A 594 29.110 -29.152 9.886 1.00 14.47 O ATOM 1969 H GLY A 594 26.123 -26.335 8.765 1.00 0.00 H ATOM 1970 N LYS A 595 27.064 -29.285 8.965 1.00 13.98 N ATOM 1971 CA LYS A 595 27.214 -30.694 8.641 1.00 13.59 C ATOM 1972 C LYS A 595 28.167 -30.884 7.467 1.00 13.74 C ATOM 1973 O LYS A 595 28.381 -29.989 6.646 1.00 14.63 O ATOM 1974 CB LYS A 595 25.847 -31.321 8.362 1.00 13.52 C ATOM 1975 CG LYS A 595 25.021 -31.454 9.608 1.00 15.65 C ATOM 1976 CD LYS A 595 23.729 -32.205 9.368 1.00 18.99 C ATOM 1977 CE LYS A 595 22.942 -32.323 10.655 1.00 26.84 C ATOM 1978 NZ LYS A 595 21.791 -33.233 10.473 1.00 34.87 N ATOM 1979 HZ1 LYS A 595 21.169 -32.859 9.728 1.00 0.00 H ATOM 1980 HZ2 LYS A 595 22.135 -34.175 10.198 1.00 0.00 H ATOM 1981 HZ3 LYS A 595 21.261 -33.303 11.365 1.00 0.00 H ATOM 1982 H LYS A 595 26.164 -28.804 8.762 1.00 0.00 H ATOM 1983 N MET A 596 28.768 -32.074 7.409 1.00 13.07 N ATOM 1984 CA MET A 596 29.661 -32.431 6.310 1.00 14.63 C ATOM 1985 C MET A 596 28.840 -32.867 5.097 1.00 13.33 C ATOM 1986 O MET A 596 28.010 -33.774 5.216 1.00 14.11 O ATOM 1987 CB MET A 596 30.583 -33.571 6.742 1.00 17.78 C ATOM 1988 CG MET A 596 31.563 -34.012 5.661 1.00 22.89 C ATOM 1989 SD MET A 596 32.666 -35.313 6.232 1.00 33.03 S ATOM 1990 CE MET A 596 33.431 -35.776 4.695 1.00 44.40 C ATOM 1991 H MET A 596 28.596 -32.766 8.166 1.00 0.00 H ATOM 1992 N PRO A 597 29.055 -32.273 3.923 1.00 12.47 N ATOM 1993 CA PRO A 597 28.303 -32.701 2.734 1.00 11.79 C ATOM 1994 C PRO A 597 28.608 -34.147 2.379 1.00 12.75 C ATOM 1995 O PRO A 597 29.767 -34.560 2.335 1.00 13.97 O ATOM 1996 CB PRO A 597 28.781 -31.753 1.633 1.00 16.41 C ATOM 1997 CG PRO A 597 29.487 -30.659 2.307 1.00 17.16 C ATOM 1998 CD PRO A 597 29.989 -31.174 3.616 1.00 13.24 C ATOM 1999 N TYR A 598 27.551 -34.902 2.084 1.00 13.06 N ATOM 2000 CA TYR A 598 27.665 -36.298 1.664 1.00 13.67 C ATOM 2001 C TYR A 598 28.359 -37.136 2.734 1.00 14.89 C ATOM 2002 O TYR A 598 29.128 -38.050 2.432 1.00 14.16 O ATOM 2003 CB TYR A 598 28.359 -36.448 0.303 1.00 14.42 C ATOM 2004 CG TYR A 598 27.945 -35.441 -0.764 1.00 12.63 C ATOM 2005 CD1 TYR A 598 28.675 -34.292 -0.976 1.00 13.98 C ATOM 2006 CD2 TYR A 598 26.807 -35.633 -1.541 1.00 16.82 C ATOM 2007 CE1 TYR A 598 28.308 -33.369 -1.935 1.00 15.10 C ATOM 2008 CE2 TYR A 598 26.438 -34.706 -2.509 1.00 12.49 C ATOM 2009 CZ TYR A 598 27.186 -33.580 -2.701 1.00 13.52 C ATOM 2010 OH TYR A 598 26.826 -32.650 -3.665 1.00 13.09 O ATOM 2011 HH TYR A 598 27.478 -31.905 -3.663 1.00 0.00 H ATOM 2012 H TYR A 598 26.603 -34.480 2.156 1.00 0.00 H ATOM 2013 N GLU A 599 28.103 -36.815 4.000 1.00 15.09 N ATOM 2014 CA GLU A 599 28.649 -37.611 5.093 1.00 17.94 C ATOM 2015 C GLU A 599 28.316 -39.083 4.874 1.00 20.45 C ATOM 2016 O GLU A 599 27.231 -39.426 4.397 1.00 16.01 O ATOM 2017 CB GLU A 599 28.070 -37.140 6.434 1.00 21.12 C ATOM 2018 CG GLU A 599 28.737 -37.774 7.653 1.00 29.85 C ATOM 2019 CD GLU A 599 28.113 -37.332 8.966 1.00 38.20 C ATOM 2020 OE1 GLU A 599 27.357 -36.334 8.973 1.00 25.07 O ATOM 2021 OE2 GLU A 599 28.375 -37.991 9.993 1.00 41.01 O ATOM 2022 H GLU A 599 27.508 -35.989 4.212 1.00 0.00 H ATOM 2023 N ARG A 600 29.267 -39.951 5.222 1.00 19.54 N ATOM 2024 CA ARG A 600 29.165 -41.403 5.060 1.00 15.41 C ATOM 2025 C ARG A 600 29.544 -41.879 3.659 1.00 16.98 C ATOM 2026 O ARG A 600 29.770 -43.081 3.465 1.00 19.16 O ATOM 2027 CB ARG A 600 27.786 -41.964 5.429 1.00 19.90 C ATOM 2028 CG ARG A 600 27.273 -41.559 6.804 1.00 21.25 C ATOM 2029 CD ARG A 600 27.597 -42.606 7.855 1.00 32.85 C ATOM 2030 NE ARG A 600 28.870 -42.394 8.499 1.00 46.77 N ATOM 2031 CZ ARG A 600 29.472 -43.309 9.246 1.00 46.11 C ATOM 2032 NH1 ARG A 600 30.641 -43.027 9.802 1.00 69.83 N ATOM 2033 NH2 ARG A 600 28.911 -44.510 9.421 1.00 38.99 N ATOM 2034 HE ARG A 600 29.340 -41.475 8.371 1.00 0.00 H ATOM 2035 HH12 ARG A 600 31.122 -43.737 10.390 1.00 0.00 H ATOM 2036 HH11 ARG A 600 31.078 -42.095 9.651 1.00 0.00 H ATOM 2037 HH22 ARG A 600 29.386 -45.225 10.008 1.00 0.00 H ATOM 2038 HH21 ARG A 600 28.000 -44.729 8.970 1.00 0.00 H ATOM 2039 H ARG A 600 30.141 -39.570 5.637 1.00 0.00 H ATOM 2040 N PHE A 601 29.588 -40.980 2.674 1.00 14.71 N ATOM 2041 CA PHE A 601 30.161 -41.288 1.365 1.00 15.11 C ATOM 2042 C PHE A 601 31.642 -40.919 1.351 1.00 15.58 C ATOM 2043 O PHE A 601 32.037 -39.883 1.888 1.00 18.35 O ATOM 2044 CB PHE A 601 29.500 -40.454 0.261 1.00 15.36 C ATOM 2045 CG PHE A 601 28.036 -40.745 0.020 1.00 16.07 C ATOM 2046 CD1 PHE A 601 27.055 -40.220 0.850 1.00 17.17 C ATOM 2047 CD2 PHE A 601 27.643 -41.471 -1.091 1.00 25.96 C ATOM 2048 CE1 PHE A 601 25.707 -40.453 0.598 1.00 23.75 C ATOM 2049 CE2 PHE A 601 26.294 -41.715 -1.342 1.00 25.63 C ATOM 2050 CZ PHE A 601 25.332 -41.190 -0.495 1.00 25.33 C ATOM 2051 H PHE A 601 29.202 -40.029 2.843 1.00 0.00 H ATOM 2052 N THR A 602 32.454 -41.756 0.713 1.00 18.44 N ATOM 2053 CA THR A 602 33.821 -41.360 0.435 1.00 17.67 C ATOM 2054 C THR A 602 33.847 -40.320 -0.686 1.00 19.39 C ATOM 2055 O THR A 602 32.841 -40.017 -1.332 1.00 15.87 O ATOM 2056 CB THR A 602 34.658 -42.572 0.007 1.00 18.87 C ATOM 2057 OG1 THR A 602 34.170 -43.066 -1.245 1.00 20.79 O ATOM 2058 CG2 THR A 602 34.591 -43.686 1.051 1.00 25.69 C ATOM 2059 HG1 THR A 602 33.223 -43.335 -1.145 1.00 0.00 H ATOM 2060 H THR A 602 32.110 -42.691 0.414 1.00 0.00 H ATOM 2061 N ASN A 603 35.032 -39.765 -0.942 1.00 18.41 N ATOM 2062 CA ASN A 603 35.149 -38.818 -2.049 1.00 16.06 C ATOM 2063 C ASN A 603 34.819 -39.494 -3.376 1.00 16.07 C ATOM 2064 O ASN A 603 34.118 -38.925 -4.215 1.00 16.38 O ATOM 2065 CB ASN A 603 36.561 -38.216 -2.115 1.00 19.37 C ATOM 2066 CG ASN A 603 36.780 -37.068 -1.143 1.00 23.49 C ATOM 2067 OD1 ASN A 603 35.846 -36.484 -0.602 1.00 23.19 O ATOM 2068 ND2 ASN A 603 38.046 -36.708 -0.950 1.00 25.11 N ATOM 2069 HD22 ASN A 603 38.812 -37.226 -1.425 1.00 0.00 H ATOM 2070 HD21 ASN A 603 38.270 -35.908 -0.324 1.00 0.00 H ATOM 2071 H ASN A 603 35.862 -40.003 -0.362 1.00 0.00 H ATOM 2072 N SER A 604 35.354 -40.697 -3.610 1.00 19.17 N ATOM 2073 CA SER A 604 35.098 -41.342 -4.892 1.00 22.25 C ATOM 2074 C SER A 604 33.620 -41.685 -5.036 1.00 17.77 C ATOM 2075 O SER A 604 33.045 -41.544 -6.122 1.00 21.32 O ATOM 2076 CB SER A 604 35.976 -42.585 -5.062 1.00 31.34 C ATOM 2077 OG SER A 604 35.768 -43.505 -4.010 1.00 49.16 O ATOM 2078 HG SER A 604 35.993 -43.074 -3.147 1.00 0.00 H ATOM 2079 H SER A 604 35.942 -41.164 -2.890 1.00 0.00 H ATOM 2080 N GLU A 605 32.976 -42.100 -3.939 1.00 19.62 N ATOM 2081 CA GLU A 605 31.539 -42.358 -3.984 1.00 18.75 C ATOM 2082 C GLU A 605 30.747 -41.080 -4.244 1.00 17.79 C ATOM 2083 O GLU A 605 29.742 -41.104 -4.965 1.00 18.53 O ATOM 2084 CB GLU A 605 31.078 -43.014 -2.680 1.00 24.35 C ATOM 2085 CG GLU A 605 31.629 -44.427 -2.480 1.00 21.71 C ATOM 2086 CD GLU A 605 31.300 -45.017 -1.133 1.00 25.41 C ATOM 2087 OE1 GLU A 605 31.144 -46.261 -1.066 1.00 28.29 O ATOM 2088 OE2 GLU A 605 31.230 -44.258 -0.140 1.00 19.92 O ATOM 2089 H GLU A 605 33.500 -42.239 -3.052 1.00 0.00 H ATOM 2090 N THR A 606 31.159 -39.962 -3.640 1.00 15.31 N ATOM 2091 CA THR A 606 30.514 -38.683 -3.904 1.00 13.98 C ATOM 2092 C THR A 606 30.622 -38.333 -5.376 1.00 16.65 C ATOM 2093 O THR A 606 29.639 -37.920 -6.003 1.00 16.05 O ATOM 2094 CB THR A 606 31.166 -37.591 -3.052 1.00 14.91 C ATOM 2095 OG1 THR A 606 30.973 -37.863 -1.658 1.00 15.75 O ATOM 2096 CG2 THR A 606 30.595 -36.224 -3.377 1.00 15.26 C ATOM 2097 HG1 THR A 606 31.383 -38.736 -1.433 1.00 0.00 H ATOM 2098 H THR A 606 31.953 -40.006 -2.970 1.00 0.00 H ATOM 2099 N ALA A 607 31.826 -38.477 -5.942 1.00 16.20 N ATOM 2100 CA ALA A 607 32.039 -38.146 -7.343 1.00 18.09 C ATOM 2101 C ALA A 607 31.177 -39.015 -8.233 1.00 20.67 C ATOM 2102 O ALA A 607 30.524 -38.521 -9.157 1.00 22.70 O ATOM 2103 CB ALA A 607 33.504 -38.325 -7.703 1.00 17.57 C ATOM 2104 H ALA A 607 32.621 -38.831 -5.372 1.00 0.00 H ATOM 2105 N GLU A 608 31.165 -40.323 -7.963 1.00 18.06 N ATOM 2106 CA GLU A 608 30.373 -41.239 -8.763 1.00 20.10 C ATOM 2107 C GLU A 608 28.912 -40.830 -8.717 1.00 20.55 C ATOM 2108 O GLU A 608 28.244 -40.742 -9.751 1.00 24.29 O ATOM 2109 CB GLU A 608 30.565 -42.664 -8.244 1.00 21.35 C ATOM 2110 CG GLU A 608 29.787 -43.707 -9.000 1.00 27.70 C ATOM 2111 CD GLU A 608 30.126 -45.114 -8.565 1.00 33.17 C ATOM 2112 OE1 GLU A 608 29.193 -45.888 -8.294 1.00 33.77 O ATOM 2113 OE2 GLU A 608 31.328 -45.449 -8.507 1.00 38.95 O ATOM 2114 H GLU A 608 31.730 -40.689 -7.170 1.00 0.00 H ATOM 2115 N HIS A 609 28.410 -40.540 -7.522 1.00 20.42 N ATOM 2116 CA HIS A 609 26.977 -40.350 -7.359 1.00 17.72 C ATOM 2117 C HIS A 609 26.499 -38.966 -7.787 1.00 18.01 C ATOM 2118 O HIS A 609 25.409 -38.855 -8.361 1.00 21.17 O ATOM 2119 CB HIS A 609 26.575 -40.731 -5.936 1.00 24.79 C ATOM 2120 CG HIS A 609 26.604 -42.213 -5.714 1.00 35.35 C ATOM 2121 ND1 HIS A 609 27.536 -42.839 -4.912 1.00 37.42 N ATOM 2122 CD2 HIS A 609 25.855 -43.201 -6.260 1.00 33.69 C ATOM 2123 CE1 HIS A 609 27.332 -44.146 -4.942 1.00 30.45 C ATOM 2124 NE2 HIS A 609 26.323 -44.392 -5.758 1.00 37.04 N ATOM 2125 H HIS A 609 29.042 -40.449 -6.701 1.00 0.00 H ATOM 2126 N ILE A 610 27.285 -37.909 -7.579 1.00 17.82 N ATOM 2127 CA ILE A 610 26.846 -36.618 -8.101 1.00 16.27 C ATOM 2128 C ILE A 610 26.881 -36.599 -9.629 1.00 20.62 C ATOM 2129 O ILE A 610 26.072 -35.919 -10.267 1.00 21.83 O ATOM 2130 CB ILE A 610 27.592 -35.425 -7.463 1.00 21.82 C ATOM 2131 CG1 ILE A 610 29.061 -35.420 -7.871 1.00 22.89 C ATOM 2132 CG2 ILE A 610 27.435 -35.429 -5.938 1.00 23.03 C ATOM 2133 CD1 ILE A 610 29.337 -34.555 -9.081 1.00 24.46 C ATOM 2134 H ILE A 610 28.182 -38.001 -7.061 1.00 0.00 H ATOM 2135 N ALA A 611 27.806 -37.330 -10.249 1.00 19.07 N ATOM 2136 CA ALA A 611 27.831 -37.402 -11.706 1.00 18.88 C ATOM 2137 C ALA A 611 26.600 -38.104 -12.256 1.00 19.57 C ATOM 2138 O ALA A 611 26.218 -37.856 -13.404 1.00 24.55 O ATOM 2139 CB ALA A 611 29.072 -38.160 -12.188 1.00 20.27 C ATOM 2140 H ALA A 611 28.513 -37.851 -9.692 1.00 0.00 H ATOM 2141 N GLN A 612 26.000 -39.003 -11.473 1.00 19.52 N ATOM 2142 CA GLN A 612 24.777 -39.697 -11.830 1.00 23.24 C ATOM 2143 C GLN A 612 23.530 -38.960 -11.372 1.00 30.62 C ATOM 2144 O GLN A 612 22.421 -39.472 -11.552 1.00 30.23 O ATOM 2145 CB GLN A 612 24.774 -41.105 -11.223 1.00 26.64 C ATOM 2146 CG GLN A 612 25.811 -42.019 -11.837 1.00 38.53 C ATOM 2147 CD GLN A 612 25.551 -42.250 -13.309 1.00 42.51 C ATOM 2148 OE1 GLN A 612 24.442 -42.617 -13.698 1.00 30.06 O ATOM 2149 NE2 GLN A 612 26.563 -42.017 -14.140 1.00 44.37 N ATOM 2150 HE22 GLN A 612 27.483 -41.708 -13.766 1.00 0.00 H ATOM 2151 HE21 GLN A 612 26.435 -42.144 -15.164 1.00 0.00 H ATOM 2152 H GLN A 612 26.435 -39.219 -10.553 1.00 0.00 H ATOM 2153 N GLY A 613 23.677 -37.785 -10.770 1.00 22.97 N ATOM 2154 CA GLY A 613 22.535 -36.952 -10.450 1.00 21.13 C ATOM 2155 C GLY A 613 22.222 -36.799 -8.976 1.00 18.76 C ATOM 2156 O GLY A 613 21.277 -36.077 -8.644 1.00 17.20 O ATOM 2157 H GLY A 613 24.632 -37.456 -10.523 1.00 0.00 H ATOM 2158 N LEU A 614 22.954 -37.446 -8.070 1.00 19.46 N ATOM 2159 CA LEU A 614 22.674 -37.257 -6.653 1.00 20.54 C ATOM 2160 C LEU A 614 22.888 -35.789 -6.286 1.00 17.07 C ATOM 2161 O LEU A 614 23.825 -35.151 -6.770 1.00 15.84 O ATOM 2162 CB LEU A 614 23.600 -38.155 -5.819 1.00 19.24 C ATOM 2163 CG LEU A 614 23.355 -38.162 -4.304 1.00 30.47 C ATOM 2164 CD1 LEU A 614 22.023 -38.808 -3.970 1.00 37.02 C ATOM 2165 CD2 LEU A 614 24.490 -38.873 -3.585 1.00 35.06 C ATOM 2166 H LEU A 614 23.720 -38.081 -8.372 1.00 0.00 H ATOM 2167 N ARG A 615 22.017 -35.245 -5.431 1.00 17.52 N ATOM 2168 CA ARG A 615 22.193 -33.888 -4.933 1.00 17.92 C ATOM 2169 C ARG A 615 21.914 -33.841 -3.439 1.00 15.58 C ATOM 2170 O ARG A 615 21.149 -34.651 -2.904 1.00 18.22 O ATOM 2171 CB ARG A 615 21.268 -32.886 -5.634 1.00 14.69 C ATOM 2172 CG ARG A 615 21.459 -32.781 -7.130 1.00 19.48 C ATOM 2173 CD ARG A 615 22.821 -32.188 -7.451 1.00 16.43 C ATOM 2174 NE ARG A 615 23.047 -31.963 -8.883 1.00 17.72 N ATOM 2175 CZ ARG A 615 23.708 -32.786 -9.692 1.00 17.93 C ATOM 2176 NH1 ARG A 615 24.219 -33.923 -9.257 1.00 16.74 N ATOM 2177 NH2 ARG A 615 23.869 -32.451 -10.953 1.00 15.49 N ATOM 2178 HE ARG A 615 22.660 -31.092 -9.298 1.00 0.00 H ATOM 2179 HH12 ARG A 615 24.731 -34.547 -9.912 1.00 0.00 H ATOM 2180 HH11 ARG A 615 24.109 -34.194 -8.259 1.00 0.00 H ATOM 2181 HH22 ARG A 615 24.384 -33.084 -11.598 1.00 0.00 H ATOM 2182 HH21 ARG A 615 23.482 -31.553 -11.306 1.00 0.00 H ATOM 2183 H ARG A 615 21.197 -35.802 -5.115 1.00 0.00 H ATOM 2184 N LEU A 616 22.506 -32.851 -2.778 1.00 12.90 N ATOM 2185 CA LEU A 616 22.272 -32.644 -1.357 1.00 12.10 C ATOM 2186 C LEU A 616 20.804 -32.344 -1.084 1.00 12.74 C ATOM 2187 O LEU A 616 20.159 -31.586 -1.809 1.00 13.99 O ATOM 2188 CB LEU A 616 23.127 -31.484 -0.848 1.00 13.35 C ATOM 2189 CG LEU A 616 24.629 -31.771 -0.850 1.00 13.11 C ATOM 2190 CD1 LEU A 616 25.442 -30.474 -0.846 1.00 13.43 C ATOM 2191 CD2 LEU A 616 25.015 -32.664 0.338 1.00 13.16 C ATOM 2192 H LEU A 616 23.149 -32.212 -3.287 1.00 0.00 H ATOM 2193 N TYR A 617 20.302 -32.922 0.004 1.00 14.19 N ATOM 2194 CA TYR A 617 18.926 -32.784 0.454 1.00 15.13 C ATOM 2195 C TYR A 617 18.695 -31.415 1.092 1.00 14.27 C ATOM 2196 O TYR A 617 19.623 -30.711 1.472 1.00 14.90 O ATOM 2197 CB TYR A 617 18.613 -33.900 1.458 1.00 14.96 C ATOM 2198 CG TYR A 617 19.400 -33.813 2.743 1.00 14.00 C ATOM 2199 CD1 TYR A 617 18.978 -33.011 3.787 1.00 18.08 C ATOM 2200 CD2 TYR A 617 20.576 -34.536 2.906 1.00 21.65 C ATOM 2201 CE1 TYR A 617 19.689 -32.923 4.953 1.00 21.24 C ATOM 2202 CE2 TYR A 617 21.291 -34.459 4.079 1.00 17.35 C ATOM 2203 CZ TYR A 617 20.855 -33.646 5.094 1.00 18.24 C ATOM 2204 OH TYR A 617 21.572 -33.554 6.277 1.00 22.84 O ATOM 2205 HH TYR A 617 21.114 -32.927 6.891 1.00 0.00 H ATOM 2206 H TYR A 617 20.939 -33.515 0.573 1.00 0.00 H ATOM 2207 N ARG A 618 17.430 -31.048 1.223 1.00 14.02 N ATOM 2208 CA ARG A 618 17.090 -29.757 1.806 1.00 13.22 C ATOM 2209 C ARG A 618 17.278 -29.804 3.320 1.00 12.73 C ATOM 2210 O ARG A 618 16.614 -30.598 3.992 1.00 16.01 O ATOM 2211 CB ARG A 618 15.648 -29.402 1.485 1.00 13.89 C ATOM 2212 CG ARG A 618 15.202 -28.046 2.078 1.00 16.63 C ATOM 2213 CD ARG A 618 13.741 -27.700 1.748 1.00 23.64 C ATOM 2214 NE ARG A 618 12.817 -28.641 2.352 1.00 29.34 N ATOM 2215 CZ ARG A 618 12.540 -28.719 3.654 1.00 40.69 C ATOM 2216 NH1 ARG A 618 13.121 -27.905 4.538 1.00 21.77 N ATOM 2217 NH2 ARG A 618 11.675 -29.638 4.075 1.00 42.25 N ATOM 2218 HE ARG A 618 12.332 -29.308 1.719 1.00 0.00 H ATOM 2219 HH12 ARG A 618 12.889 -27.984 5.549 1.00 0.00 H ATOM 2220 HH11 ARG A 618 13.806 -27.191 4.216 1.00 0.00 H ATOM 2221 HH22 ARG A 618 11.447 -29.713 5.087 1.00 0.00 H ATOM 2222 HH21 ARG A 618 11.227 -30.281 3.392 1.00 0.00 H ATOM 2223 H ARG A 618 16.672 -31.687 0.907 1.00 0.00 H ATOM 2224 N PRO A 619 18.153 -28.985 3.888 1.00 12.64 N ATOM 2225 CA PRO A 619 18.246 -28.905 5.350 1.00 12.21 C ATOM 2226 C PRO A 619 16.942 -28.426 5.976 1.00 13.29 C ATOM 2227 O PRO A 619 16.190 -27.638 5.396 1.00 15.14 O ATOM 2228 CB PRO A 619 19.356 -27.881 5.571 1.00 15.59 C ATOM 2229 CG PRO A 619 20.153 -27.922 4.268 1.00 14.80 C ATOM 2230 CD PRO A 619 19.111 -28.081 3.225 1.00 15.66 C ATOM 2231 N HIS A 620 16.701 -28.881 7.209 1.00 17.01 N ATOM 2232 CA HIS A 620 15.436 -28.572 7.869 1.00 17.21 C ATOM 2233 C HIS A 620 15.190 -27.079 7.954 1.00 17.62 C ATOM 2234 O HIS A 620 14.054 -26.627 7.814 1.00 17.74 O ATOM 2235 CB HIS A 620 15.407 -29.192 9.264 1.00 21.36 C ATOM 2236 CG HIS A 620 14.917 -30.605 9.276 1.00 37.42 C ATOM 2237 ND1 HIS A 620 15.703 -31.671 8.892 1.00 45.26 N ATOM 2238 CD2 HIS A 620 13.716 -31.128 9.615 1.00 42.19 C ATOM 2239 CE1 HIS A 620 15.008 -32.789 8.999 1.00 46.83 C ATOM 2240 NE2 HIS A 620 13.798 -32.487 9.434 1.00 42.45 N ATOM 2241 H HIS A 620 17.416 -29.456 7.699 1.00 0.00 H ATOM 2242 N LEU A 621 16.232 -26.294 8.187 1.00 14.67 N ATOM 2243 CA LEU A 621 16.034 -24.868 8.392 1.00 14.51 C ATOM 2244 C LEU A 621 15.936 -24.083 7.094 1.00 17.50 C ATOM 2245 O LEU A 621 15.666 -22.883 7.148 1.00 18.62 O ATOM 2246 CB LEU A 621 17.149 -24.297 9.273 1.00 15.24 C ATOM 2247 CG LEU A 621 17.145 -24.783 10.713 1.00 15.88 C ATOM 2248 CD1 LEU A 621 18.394 -24.267 11.427 1.00 21.55 C ATOM 2249 CD2 LEU A 621 15.897 -24.341 11.438 1.00 21.00 C ATOM 2250 H LEU A 621 17.190 -26.697 8.223 1.00 0.00 H ATOM 2251 N ALA A 622 16.110 -24.712 5.940 1.00 15.74 N ATOM 2252 CA ALA A 622 15.994 -24.020 4.665 1.00 14.69 C ATOM 2253 C ALA A 622 14.557 -24.059 4.166 1.00 17.00 C ATOM 2254 O ALA A 622 13.971 -25.136 4.013 1.00 17.38 O ATOM 2255 CB ALA A 622 16.898 -24.662 3.621 1.00 15.70 C ATOM 2256 H ALA A 622 16.335 -25.727 5.946 1.00 0.00 H ATOM 2257 N SER A 623 13.992 -22.888 3.918 1.00 16.96 N ATOM 2258 CA SER A 623 12.704 -22.811 3.255 1.00 16.53 C ATOM 2259 C SER A 623 12.815 -23.325 1.822 1.00 18.03 C ATOM 2260 O SER A 623 13.908 -23.535 1.284 1.00 17.44 O ATOM 2261 CB SER A 623 12.234 -21.371 3.203 1.00 20.49 C ATOM 2262 OG SER A 623 13.061 -20.627 2.327 1.00 21.40 O ATOM 2263 HG SER A 623 12.748 -19.688 2.298 1.00 0.00 H ATOM 2264 H SER A 623 14.477 -22.013 4.202 1.00 0.00 H ATOM 2265 N GLU A 624 11.653 -23.531 1.194 1.00 20.69 N ATOM 2266 CA GLU A 624 11.639 -23.966 -0.199 1.00 18.72 C ATOM 2267 C GLU A 624 12.317 -22.947 -1.100 1.00 17.21 C ATOM 2268 O GLU A 624 13.072 -23.317 -2.009 1.00 19.01 O ATOM 2269 CB GLU A 624 10.194 -24.194 -0.660 1.00 20.76 C ATOM 2270 H GLU A 624 10.757 -23.381 1.699 1.00 0.00 H ATOM 2271 N LYS A 625 12.086 -21.657 -0.850 1.00 17.82 N ATOM 2272 CA LYS A 625 12.711 -20.626 -1.676 1.00 21.57 C ATOM 2273 C LYS A 625 14.227 -20.656 -1.532 1.00 16.41 C ATOM 2274 O LYS A 625 14.958 -20.562 -2.526 1.00 19.60 O ATOM 2275 CB LYS A 625 12.173 -19.240 -1.313 1.00 23.07 C ATOM 2276 CG LYS A 625 10.699 -19.026 -1.615 1.00 52.75 C ATOM 2277 CD LYS A 625 10.219 -17.690 -1.060 1.00 68.81 C ATOM 2278 CE LYS A 625 8.699 -17.590 -1.060 1.00 76.14 C ATOM 2279 NZ LYS A 625 8.125 -17.545 -2.433 1.00 71.19 N ATOM 2280 HZ1 LYS A 625 8.499 -16.716 -2.937 1.00 0.00 H ATOM 2281 HZ2 LYS A 625 8.387 -18.411 -2.946 1.00 0.00 H ATOM 2282 HZ3 LYS A 625 7.089 -17.477 -2.372 1.00 0.00 H ATOM 2283 H LYS A 625 11.460 -21.385 -0.066 1.00 0.00 H ATOM 2284 N VAL A 626 14.718 -20.823 -0.302 1.00 16.84 N ATOM 2285 CA VAL A 626 16.158 -20.921 -0.076 1.00 15.04 C ATOM 2286 C VAL A 626 16.728 -22.166 -0.757 1.00 15.16 C ATOM 2287 O VAL A 626 17.800 -22.127 -1.380 1.00 15.09 O ATOM 2288 CB VAL A 626 16.454 -20.903 1.433 1.00 17.95 C ATOM 2289 CG1 VAL A 626 17.912 -21.288 1.728 1.00 16.92 C ATOM 2290 CG2 VAL A 626 16.138 -19.533 2.001 1.00 20.38 C ATOM 2291 H VAL A 626 14.067 -20.884 0.506 1.00 0.00 H ATOM 2292 N TYR A 627 16.037 -23.300 -0.631 1.00 15.29 N ATOM 2293 CA TYR A 627 16.531 -24.514 -1.265 1.00 13.79 C ATOM 2294 C TYR A 627 16.598 -24.366 -2.779 1.00 15.12 C ATOM 2295 O TYR A 627 17.538 -24.862 -3.412 1.00 16.86 O ATOM 2296 CB TYR A 627 15.674 -25.706 -0.853 1.00 16.19 C ATOM 2297 CG TYR A 627 16.228 -27.033 -1.281 1.00 12.69 C ATOM 2298 CD1 TYR A 627 17.514 -27.423 -0.928 1.00 13.51 C ATOM 2299 CD2 TYR A 627 15.455 -27.912 -2.026 1.00 14.05 C ATOM 2300 CE1 TYR A 627 18.023 -28.654 -1.327 1.00 14.94 C ATOM 2301 CE2 TYR A 627 15.950 -29.144 -2.428 1.00 15.87 C ATOM 2302 CZ TYR A 627 17.221 -29.511 -2.075 1.00 14.37 C ATOM 2303 OH TYR A 627 17.667 -30.749 -2.495 1.00 16.38 O ATOM 2304 HH TYR A 627 18.593 -30.890 -2.176 1.00 0.00 H ATOM 2305 H TYR A 627 15.152 -23.317 -0.084 1.00 0.00 H ATOM 2306 N THR A 628 15.606 -23.697 -3.378 1.00 14.89 N ATOM 2307 CA THR A 628 15.612 -23.487 -4.818 1.00 14.61 C ATOM 2308 C THR A 628 16.862 -22.733 -5.238 1.00 16.21 C ATOM 2309 O THR A 628 17.447 -23.017 -6.290 1.00 18.25 O ATOM 2310 CB THR A 628 14.346 -22.726 -5.225 1.00 18.25 C ATOM 2311 OG1 THR A 628 13.197 -23.539 -4.953 1.00 23.57 O ATOM 2312 CG2 THR A 628 14.367 -22.381 -6.706 1.00 23.18 C ATOM 2313 HG1 THR A 628 13.163 -23.747 -3.986 1.00 0.00 H ATOM 2314 H THR A 628 14.821 -23.323 -2.808 1.00 0.00 H ATOM 2315 N ILE A 629 17.290 -21.772 -4.414 1.00 16.29 N ATOM 2316 CA ILE A 629 18.492 -21.001 -4.711 1.00 17.93 C ATOM 2317 C ILE A 629 19.722 -21.895 -4.683 1.00 15.78 C ATOM 2318 O ILE A 629 20.493 -21.939 -5.648 1.00 16.16 O ATOM 2319 CB ILE A 629 18.617 -19.810 -3.745 1.00 16.70 C ATOM 2320 CG1 ILE A 629 17.468 -18.834 -3.977 1.00 19.23 C ATOM 2321 CG2 ILE A 629 19.950 -19.094 -3.925 1.00 18.22 C ATOM 2322 CD1 ILE A 629 17.409 -17.729 -2.959 1.00 23.72 C ATOM 2323 H ILE A 629 16.756 -21.570 -3.545 1.00 0.00 H ATOM 2324 N MET A 630 19.922 -22.646 -3.595 1.00 14.71 N ATOM 2325 CA MET A 630 21.122 -23.471 -3.543 1.00 13.13 C ATOM 2326 C MET A 630 21.079 -24.560 -4.609 1.00 13.12 C ATOM 2327 O MET A 630 22.104 -24.868 -5.226 1.00 14.82 O ATOM 2328 CB MET A 630 21.375 -24.034 -2.135 1.00 21.52 C ATOM 2329 CG MET A 630 20.527 -25.201 -1.722 1.00 18.70 C ATOM 2330 SD MET A 630 20.901 -25.833 -0.046 1.00 14.52 S ATOM 2331 CE MET A 630 20.358 -24.457 0.935 1.00 15.82 C ATOM 2332 H MET A 630 19.241 -22.641 -2.809 1.00 0.00 H ATOM 2333 N TYR A 631 19.896 -25.114 -4.881 1.00 14.79 N ATOM 2334 CA TYR A 631 19.800 -26.209 -5.840 1.00 15.25 C ATOM 2335 C TYR A 631 20.083 -25.732 -7.251 1.00 15.24 C ATOM 2336 O TYR A 631 20.590 -26.510 -8.072 1.00 16.44 O ATOM 2337 CB TYR A 631 18.417 -26.855 -5.758 1.00 13.85 C ATOM 2338 CG TYR A 631 18.318 -28.267 -6.289 1.00 15.31 C ATOM 2339 CD1 TYR A 631 18.050 -28.517 -7.628 1.00 18.38 C ATOM 2340 CD2 TYR A 631 18.443 -29.350 -5.436 1.00 19.78 C ATOM 2341 CE1 TYR A 631 17.938 -29.834 -8.106 1.00 20.68 C ATOM 2342 CE2 TYR A 631 18.329 -30.652 -5.902 1.00 16.74 C ATOM 2343 CZ TYR A 631 18.073 -30.886 -7.219 1.00 22.01 C ATOM 2344 OH TYR A 631 17.957 -32.189 -7.655 1.00 26.59 O ATOM 2345 HH TYR A 631 17.772 -32.195 -8.628 1.00 0.00 H ATOM 2346 H TYR A 631 19.039 -24.764 -4.407 1.00 0.00 H ATOM 2347 N SER A 632 19.806 -24.455 -7.540 1.00 14.92 N ATOM 2348 CA SER A 632 20.084 -23.917 -8.871 1.00 14.97 C ATOM 2349 C SER A 632 21.573 -23.900 -9.166 1.00 14.18 C ATOM 2350 O SER A 632 21.973 -23.859 -10.338 1.00 16.36 O ATOM 2351 CB SER A 632 19.479 -22.519 -9.035 1.00 15.37 C ATOM 2352 OG SER A 632 20.208 -21.521 -8.356 1.00 16.76 O ATOM 2353 HG SER A 632 20.228 -21.729 -7.388 1.00 0.00 H ATOM 2354 H SER A 632 19.390 -23.840 -6.812 1.00 0.00 H ATOM 2355 N CYS A 633 22.400 -23.951 -8.131 1.00 14.39 N ATOM 2356 CA CYS A 633 23.842 -23.960 -8.303 1.00 13.31 C ATOM 2357 C CYS A 633 24.365 -25.289 -8.811 1.00 14.61 C ATOM 2358 O CYS A 633 25.547 -25.364 -9.173 1.00 14.18 O ATOM 2359 CB CYS A 633 24.498 -23.643 -6.960 1.00 13.09 C ATOM 2360 SG CYS A 633 24.171 -21.980 -6.335 1.00 14.94 S ATOM 2361 H CYS A 633 22.005 -23.986 -7.169 1.00 0.00 H ATOM 2362 N TRP A 634 23.522 -26.328 -8.844 1.00 13.13 N ATOM 2363 CA TRP A 634 23.992 -27.689 -9.070 1.00 13.25 C ATOM 2364 C TRP A 634 23.516 -28.280 -10.388 1.00 15.55 C ATOM 2365 O TRP A 634 23.529 -29.503 -10.550 1.00 15.04 O ATOM 2366 CB TRP A 634 23.597 -28.594 -7.900 1.00 14.25 C ATOM 2367 CG TRP A 634 24.093 -28.137 -6.555 1.00 10.92 C ATOM 2368 CD1 TRP A 634 25.268 -27.476 -6.282 1.00 13.87 C ATOM 2369 CD2 TRP A 634 23.423 -28.289 -5.305 1.00 12.56 C ATOM 2370 NE1 TRP A 634 25.367 -27.234 -4.937 1.00 13.60 N ATOM 2371 CE2 TRP A 634 24.245 -27.708 -4.315 1.00 13.51 C ATOM 2372 CE3 TRP A 634 22.199 -28.851 -4.923 1.00 10.26 C ATOM 2373 CZ2 TRP A 634 23.889 -27.682 -2.974 1.00 14.68 C ATOM 2374 CZ3 TRP A 634 21.843 -28.827 -3.588 1.00 12.06 C ATOM 2375 CH2 TRP A 634 22.682 -28.236 -2.629 1.00 13.51 C ATOM 2376 HE1 TRP A 634 26.167 -26.765 -4.465 1.00 0.00 H ATOM 2377 H TRP A 634 22.505 -26.160 -8.705 1.00 0.00 H ATOM 2378 N HIS A 635 23.081 -27.452 -11.341 1.00 14.62 N ATOM 2379 CA HIS A 635 22.770 -27.975 -12.663 1.00 16.27 C ATOM 2380 C HIS A 635 23.972 -28.737 -13.205 1.00 20.86 C ATOM 2381 O HIS A 635 25.108 -28.260 -13.142 1.00 17.54 O ATOM 2382 CB HIS A 635 22.423 -26.838 -13.612 1.00 18.82 C ATOM 2383 CG HIS A 635 21.054 -26.267 -13.404 1.00 16.56 C ATOM 2384 ND1 HIS A 635 19.913 -26.896 -13.846 1.00 24.48 N ATOM 2385 CD2 HIS A 635 20.648 -25.123 -12.806 1.00 18.17 C ATOM 2386 CE1 HIS A 635 18.859 -26.164 -13.528 1.00 25.83 C ATOM 2387 NE2 HIS A 635 19.279 -25.082 -12.897 1.00 21.96 N ATOM 2388 H HIS A 635 22.965 -26.438 -11.139 1.00 0.00 H ATOM 2389 N GLU A 636 23.721 -29.931 -13.738 1.00 17.45 N ATOM 2390 CA GLU A 636 24.793 -30.700 -14.358 1.00 16.33 C ATOM 2391 C GLU A 636 25.547 -29.856 -15.382 1.00 17.90 C ATOM 2392 O GLU A 636 26.779 -29.876 -15.429 1.00 19.31 O ATOM 2393 CB GLU A 636 24.196 -31.944 -15.017 1.00 22.55 C ATOM 2394 CG GLU A 636 25.207 -32.792 -15.799 1.00 24.81 C ATOM 2395 CD GLU A 636 24.544 -33.752 -16.781 1.00 39.20 C ATOM 2396 OE1 GLU A 636 23.411 -34.198 -16.525 1.00 39.41 O ATOM 2397 OE2 GLU A 636 25.161 -34.059 -17.821 1.00 50.74 O ATOM 2398 H GLU A 636 22.756 -30.317 -13.712 1.00 0.00 H ATOM 2399 N LYS A 637 24.820 -29.122 -16.219 1.00 20.89 N ATOM 2400 CA LYS A 637 25.428 -28.309 -17.263 1.00 19.75 C ATOM 2401 C LYS A 637 25.778 -26.935 -16.708 1.00 20.15 C ATOM 2402 O LYS A 637 24.899 -26.197 -16.249 1.00 20.94 O ATOM 2403 CB LYS A 637 24.476 -28.167 -18.451 1.00 28.37 C ATOM 2404 CG LYS A 637 23.934 -29.482 -19.013 1.00 32.26 C ATOM 2405 CD LYS A 637 25.038 -30.394 -19.518 1.00 56.70 C ATOM 2406 CE LYS A 637 24.517 -31.363 -20.574 1.00 75.21 C ATOM 2407 NZ LYS A 637 23.179 -31.929 -20.229 1.00 78.96 N ATOM 2408 HZ1 LYS A 637 23.244 -32.444 -19.328 1.00 0.00 H ATOM 2409 HZ2 LYS A 637 22.490 -31.156 -20.139 1.00 0.00 H ATOM 2410 HZ3 LYS A 637 22.875 -32.580 -20.981 1.00 0.00 H ATOM 2411 H LYS A 637 23.784 -29.129 -16.125 1.00 0.00 H ATOM 2412 N ALA A 638 27.059 -26.583 -16.791 1.00 19.16 N ATOM 2413 CA ALA A 638 27.552 -25.364 -16.167 1.00 18.34 C ATOM 2414 C ALA A 638 26.820 -24.127 -16.667 1.00 18.03 C ATOM 2415 O ALA A 638 26.611 -23.175 -15.904 1.00 18.49 O ATOM 2416 CB ALA A 638 29.054 -25.224 -16.417 1.00 17.87 C ATOM 2417 H ALA A 638 27.721 -27.192 -17.313 1.00 0.00 H ATOM 2418 N ASP A 639 26.464 -24.092 -17.954 1.00 18.25 N ATOM 2419 CA ASP A 639 25.880 -22.872 -18.491 1.00 15.90 C ATOM 2420 C ASP A 639 24.443 -22.678 -18.057 1.00 18.49 C ATOM 2421 O ASP A 639 23.876 -21.609 -18.309 1.00 23.35 O ATOM 2422 CB ASP A 639 26.016 -22.771 -20.015 1.00 18.81 C ATOM 2423 CG ASP A 639 25.143 -23.747 -20.764 1.00 29.47 C ATOM 2424 OD1 ASP A 639 24.838 -24.830 -20.234 1.00 25.11 O ATOM 2425 OD2 ASP A 639 24.771 -23.420 -21.911 1.00 31.61 O ATOM 2426 H ASP A 639 26.602 -24.924 -18.563 1.00 0.00 H ATOM 2427 N GLU A 640 23.859 -23.661 -17.384 1.00 19.19 N ATOM 2428 CA GLU A 640 22.534 -23.499 -16.812 1.00 17.11 C ATOM 2429 C GLU A 640 22.566 -22.981 -15.381 1.00 17.78 C ATOM 2430 O GLU A 640 21.507 -22.657 -14.836 1.00 20.71 O ATOM 2431 CB GLU A 640 21.768 -24.825 -16.882 1.00 18.14 C ATOM 2432 CG GLU A 640 21.538 -25.296 -18.325 1.00 19.43 C ATOM 2433 CD GLU A 640 20.656 -26.528 -18.452 1.00 35.03 C ATOM 2434 OE1 GLU A 640 20.508 -27.288 -17.473 1.00 45.08 O ATOM 2435 OE2 GLU A 640 20.100 -26.728 -19.550 1.00 46.70 O ATOM 2436 H GLU A 640 24.360 -24.565 -17.264 1.00 0.00 H ATOM 2437 N ARG A 641 23.726 -22.912 -14.768 1.00 15.01 N ATOM 2438 CA ARG A 641 23.821 -22.398 -13.418 1.00 13.92 C ATOM 2439 C ARG A 641 23.762 -20.875 -13.457 1.00 17.44 C ATOM 2440 O ARG A 641 24.207 -20.248 -14.428 1.00 20.13 O ATOM 2441 CB ARG A 641 25.136 -22.822 -12.774 1.00 15.24 C ATOM 2442 CG ARG A 641 25.304 -24.339 -12.620 1.00 14.03 C ATOM 2443 CD ARG A 641 26.699 -24.769 -12.140 1.00 15.23 C ATOM 2444 NE ARG A 641 26.916 -26.141 -12.567 1.00 14.95 N ATOM 2445 CZ ARG A 641 28.092 -26.665 -12.879 1.00 13.14 C ATOM 2446 NH1 ARG A 641 28.151 -27.901 -13.352 1.00 15.64 N ATOM 2447 NH2 ARG A 641 29.199 -25.958 -12.735 1.00 14.71 N ATOM 2448 HE ARG A 641 26.083 -26.760 -12.633 1.00 0.00 H ATOM 2449 HH12 ARG A 641 29.070 -28.320 -13.599 1.00 0.00 H ATOM 2450 HH11 ARG A 641 27.278 -28.453 -13.476 1.00 0.00 H ATOM 2451 HH22 ARG A 641 30.119 -26.376 -12.982 1.00 0.00 H ATOM 2452 HH21 ARG A 641 29.151 -24.984 -12.375 1.00 0.00 H ATOM 2453 H ARG A 641 24.586 -23.230 -15.258 1.00 0.00 H ATOM 2454 N PRO A 642 23.228 -20.263 -12.411 1.00 17.56 N ATOM 2455 CA PRO A 642 23.144 -18.807 -12.373 1.00 15.94 C ATOM 2456 C PRO A 642 24.515 -18.170 -12.216 1.00 15.37 C ATOM 2457 O PRO A 642 25.535 -18.829 -11.993 1.00 17.15 O ATOM 2458 CB PRO A 642 22.270 -18.556 -11.141 1.00 20.53 C ATOM 2459 CG PRO A 642 22.573 -19.709 -10.252 1.00 20.74 C ATOM 2460 CD PRO A 642 22.658 -20.876 -11.199 1.00 17.58 C ATOM 2461 N THR A 643 24.525 -16.851 -12.358 1.00 17.31 N ATOM 2462 CA THR A 643 25.664 -16.043 -11.963 1.00 16.40 C ATOM 2463 C THR A 643 25.508 -15.643 -10.506 1.00 15.34 C ATOM 2464 O THR A 643 24.436 -15.760 -9.919 1.00 17.81 O ATOM 2465 CB THR A 643 25.740 -14.779 -12.809 1.00 20.38 C ATOM 2466 OG1 THR A 643 24.586 -13.981 -12.554 1.00 21.19 O ATOM 2467 CG2 THR A 643 25.821 -15.122 -14.288 1.00 21.46 C ATOM 2468 HG1 THR A 643 24.629 -13.157 -13.101 1.00 0.00 H ATOM 2469 H THR A 643 23.691 -16.382 -12.765 1.00 0.00 H ATOM 2470 N PHE A 644 26.598 -15.152 -9.914 1.00 15.62 N ATOM 2471 CA PHE A 644 26.509 -14.613 -8.558 1.00 13.64 C ATOM 2472 C PHE A 644 25.659 -13.348 -8.503 1.00 16.39 C ATOM 2473 O PHE A 644 25.033 -13.067 -7.474 1.00 17.63 O ATOM 2474 CB PHE A 644 27.900 -14.373 -7.980 1.00 15.16 C ATOM 2475 CG PHE A 644 28.582 -15.639 -7.527 1.00 13.13 C ATOM 2476 CD1 PHE A 644 28.116 -16.330 -6.419 1.00 13.10 C ATOM 2477 CD2 PHE A 644 29.674 -16.132 -8.200 1.00 14.54 C ATOM 2478 CE1 PHE A 644 28.738 -17.488 -5.997 1.00 14.79 C ATOM 2479 CE2 PHE A 644 30.285 -17.288 -7.790 1.00 16.06 C ATOM 2480 CZ PHE A 644 29.801 -17.979 -6.685 1.00 12.67 C ATOM 2481 H PHE A 644 27.509 -15.153 -10.416 1.00 0.00 H ATOM 2482 N LYS A 645 25.585 -12.597 -9.603 1.00 18.13 N ATOM 2483 CA LYS A 645 24.692 -11.445 -9.631 1.00 18.41 C ATOM 2484 C LYS A 645 23.238 -11.880 -9.506 1.00 19.16 C ATOM 2485 O LYS A 645 22.460 -11.287 -8.747 1.00 21.07 O ATOM 2486 CB LYS A 645 24.916 -10.650 -10.919 1.00 34.33 C ATOM 2487 CG LYS A 645 24.039 -9.420 -11.049 1.00 57.22 C ATOM 2488 CD LYS A 645 24.487 -8.519 -12.196 1.00 69.04 C ATOM 2489 CE LYS A 645 25.779 -7.784 -11.866 1.00 75.18 C ATOM 2490 NZ LYS A 645 26.051 -6.675 -12.822 1.00 79.45 N ATOM 2491 HZ1 LYS A 645 26.133 -7.061 -13.784 1.00 0.00 H ATOM 2492 HZ2 LYS A 645 25.269 -5.990 -12.788 1.00 0.00 H ATOM 2493 HZ3 LYS A 645 26.940 -6.203 -12.559 1.00 0.00 H ATOM 2494 H LYS A 645 26.161 -12.832 -10.436 1.00 0.00 H ATOM 2495 N ILE A 646 22.859 -12.934 -10.229 1.00 19.94 N ATOM 2496 CA ILE A 646 21.507 -13.470 -10.130 1.00 19.42 C ATOM 2497 C ILE A 646 21.259 -14.042 -8.743 1.00 16.73 C ATOM 2498 O ILE A 646 20.210 -13.808 -8.145 1.00 19.49 O ATOM 2499 CB ILE A 646 21.265 -14.509 -11.236 1.00 21.03 C ATOM 2500 CG1 ILE A 646 21.184 -13.809 -12.598 1.00 22.82 C ATOM 2501 CG2 ILE A 646 19.976 -15.262 -10.988 1.00 22.75 C ATOM 2502 CD1 ILE A 646 21.299 -14.764 -13.771 1.00 35.44 C ATOM 2503 H ILE A 646 23.540 -13.382 -10.875 1.00 0.00 H ATOM 2504 N LEU A 647 22.212 -14.815 -8.218 1.00 17.01 N ATOM 2505 CA LEU A 647 22.037 -15.388 -6.886 1.00 17.73 C ATOM 2506 C LEU A 647 21.830 -14.298 -5.842 1.00 17.98 C ATOM 2507 O LEU A 647 20.975 -14.430 -4.964 1.00 16.26 O ATOM 2508 CB LEU A 647 23.240 -16.260 -6.516 1.00 16.13 C ATOM 2509 CG LEU A 647 23.349 -17.592 -7.269 1.00 16.90 C ATOM 2510 CD1 LEU A 647 24.714 -18.229 -7.052 1.00 16.18 C ATOM 2511 CD2 LEU A 647 22.226 -18.534 -6.841 1.00 19.37 C ATOM 2512 H LEU A 647 23.080 -15.009 -8.758 1.00 0.00 H ATOM 2513 N LEU A 648 22.622 -13.224 -5.906 1.00 18.06 N ATOM 2514 CA LEU A 648 22.471 -12.150 -4.931 1.00 19.92 C ATOM 2515 C LEU A 648 21.088 -11.521 -5.035 1.00 19.00 C ATOM 2516 O LEU A 648 20.437 -11.246 -4.020 1.00 19.95 O ATOM 2517 CB LEU A 648 23.559 -11.108 -5.157 1.00 16.06 C ATOM 2518 CG LEU A 648 23.599 -9.941 -4.177 1.00 17.23 C ATOM 2519 CD1 LEU A 648 23.720 -10.423 -2.736 1.00 19.32 C ATOM 2520 CD2 LEU A 648 24.779 -9.034 -4.555 1.00 21.66 C ATOM 2521 H LEU A 648 23.345 -13.154 -6.650 1.00 0.00 H ATOM 2522 N SER A 649 20.618 -11.305 -6.261 1.00 18.17 N ATOM 2523 CA SER A 649 19.273 -10.787 -6.459 1.00 21.35 C ATOM 2524 C SER A 649 18.227 -11.718 -5.855 1.00 20.25 C ATOM 2525 O SER A 649 17.259 -11.260 -5.238 1.00 21.86 O ATOM 2526 CB SER A 649 19.023 -10.595 -7.953 1.00 23.65 C ATOM 2527 OG SER A 649 17.808 -9.900 -8.166 1.00 37.49 O ATOM 2528 HG SER A 649 17.060 -10.419 -7.778 1.00 0.00 H ATOM 2529 H SER A 649 21.218 -11.508 -7.086 1.00 0.00 H ATOM 2530 N ASN A 650 18.402 -13.033 -6.025 1.00 21.70 N ATOM 2531 CA ASN A 650 17.457 -13.990 -5.458 1.00 19.66 C ATOM 2532 C ASN A 650 17.469 -13.929 -3.936 1.00 20.77 C ATOM 2533 O ASN A 650 16.417 -14.017 -3.294 1.00 19.74 O ATOM 2534 CB ASN A 650 17.805 -15.423 -5.885 1.00 20.70 C ATOM 2535 CG ASN A 650 17.694 -15.666 -7.380 1.00 30.48 C ATOM 2536 OD1 ASN A 650 18.327 -16.588 -7.893 1.00 38.15 O ATOM 2537 ND2 ASN A 650 16.898 -14.868 -8.079 1.00 29.74 N ATOM 2538 HD22 ASN A 650 16.382 -14.101 -7.602 1.00 0.00 H ATOM 2539 HD21 ASN A 650 16.790 -15.009 -9.104 1.00 0.00 H ATOM 2540 H ASN A 650 19.220 -13.377 -6.567 1.00 0.00 H ATOM 2541 N ILE A 651 18.656 -13.804 -3.339 1.00 17.79 N ATOM 2542 CA ILE A 651 18.768 -13.744 -1.886 1.00 16.66 C ATOM 2543 C ILE A 651 18.121 -12.474 -1.352 1.00 20.99 C ATOM 2544 O ILE A 651 17.393 -12.504 -0.354 1.00 20.73 O ATOM 2545 CB ILE A 651 20.248 -13.870 -1.479 1.00 14.85 C ATOM 2546 CG1 ILE A 651 20.699 -15.314 -1.646 1.00 14.14 C ATOM 2547 CG2 ILE A 651 20.459 -13.428 -0.037 1.00 19.82 C ATOM 2548 CD1 ILE A 651 22.211 -15.512 -1.547 1.00 16.48 C ATOM 2549 H ILE A 651 19.517 -13.748 -3.920 1.00 0.00 H ATOM 2550 N LEU A 652 18.362 -11.339 -2.013 1.00 22.22 N ATOM 2551 CA LEU A 652 17.710 -10.097 -1.600 1.00 22.62 C ATOM 2552 C LEU A 652 16.192 -10.204 -1.705 1.00 25.67 C ATOM 2553 O LEU A 652 15.472 -9.705 -0.834 1.00 26.37 O ATOM 2554 CB LEU A 652 18.242 -8.925 -2.422 1.00 29.58 C ATOM 2555 CG LEU A 652 19.681 -8.512 -2.094 1.00 36.71 C ATOM 2556 CD1 LEU A 652 20.243 -7.550 -3.134 1.00 34.18 C ATOM 2557 CD2 LEU A 652 19.742 -7.877 -0.719 1.00 45.47 C ATOM 2558 H LEU A 652 19.014 -11.338 -2.823 1.00 0.00 H ATOM 2559 N ASP A 653 15.686 -10.886 -2.738 1.00 25.18 N ATOM 2560 CA ASP A 653 14.240 -11.022 -2.891 1.00 28.11 C ATOM 2561 C ASP A 653 13.636 -11.818 -1.743 1.00 29.55 C ATOM 2562 O ASP A 653 12.553 -11.484 -1.246 1.00 26.50 O ATOM 2563 CB ASP A 653 13.889 -11.685 -4.225 1.00 29.42 C ATOM 2564 CG ASP A 653 14.106 -10.772 -5.417 1.00 35.69 C ATOM 2565 OD1 ASP A 653 14.108 -11.290 -6.555 1.00 38.99 O ATOM 2566 OD2 ASP A 653 14.290 -9.550 -5.223 1.00 34.72 O ATOM 2567 H ASP A 653 16.324 -11.321 -3.435 1.00 0.00 H ATOM 2568 N VAL A 654 14.315 -12.882 -1.309 1.00 26.82 N ATOM 2569 CA VAL A 654 13.832 -13.641 -0.161 1.00 23.49 C ATOM 2570 C VAL A 654 13.827 -12.765 1.085 1.00 25.16 C ATOM 2571 O VAL A 654 12.864 -12.774 1.861 1.00 27.61 O ATOM 2572 CB VAL A 654 14.656 -14.930 0.022 1.00 27.42 C ATOM 2573 CG1 VAL A 654 14.342 -15.597 1.354 1.00 25.51 C ATOM 2574 CG2 VAL A 654 14.385 -15.881 -1.136 1.00 25.25 C ATOM 2575 H VAL A 654 15.190 -13.171 -1.791 1.00 0.00 H ATOM 2576 N MET A 655 14.886 -11.976 1.286 1.00 24.25 N ATOM 2577 CA MET A 655 14.910 -11.049 2.412 1.00 29.78 C ATOM 2578 C MET A 655 13.728 -10.092 2.348 1.00 28.04 C ATOM 2579 O MET A 655 13.044 -9.864 3.352 1.00 36.19 O ATOM 2580 CB MET A 655 16.213 -10.257 2.410 1.00 25.40 C ATOM 2581 CG MET A 655 17.414 -11.072 2.740 1.00 32.86 C ATOM 2582 SD MET A 655 18.825 -10.024 3.078 1.00 36.95 S ATOM 2583 CE MET A 655 19.926 -11.263 3.734 1.00 26.97 C ATOM 2584 H MET A 655 15.697 -12.023 0.637 1.00 0.00 H ATOM 2585 N ASP A 656 13.483 -9.509 1.173 1.00 32.02 N ATOM 2586 CA ASP A 656 12.341 -8.609 1.020 1.00 43.91 C ATOM 2587 C ASP A 656 11.030 -9.322 1.330 1.00 36.75 C ATOM 2588 O ASP A 656 10.142 -8.752 1.972 1.00 39.77 O ATOM 2589 CB ASP A 656 12.303 -8.028 -0.395 1.00 43.11 C ATOM 2590 CG ASP A 656 13.456 -7.082 -0.676 1.00 49.13 C ATOM 2591 OD1 ASP A 656 14.078 -6.586 0.288 1.00 46.35 O ATOM 2592 OD2 ASP A 656 13.734 -6.828 -1.869 1.00 50.75 O ATOM 2593 H ASP A 656 14.107 -9.696 0.362 1.00 0.00 H ATOM 2594 N GLU A 657 10.882 -10.567 0.873 1.00 45.08 N ATOM 2595 CA GLU A 657 9.655 -11.308 1.148 1.00 37.79 C ATOM 2596 C GLU A 657 9.443 -11.481 2.648 1.00 42.14 C ATOM 2597 O GLU A 657 8.324 -11.317 3.147 1.00 56.54 O ATOM 2598 CB GLU A 657 9.688 -12.664 0.441 1.00 37.53 C ATOM 2599 H GLU A 657 11.643 -11.010 0.320 1.00 0.00 H ATOM 2600 N ASN A 658 10.503 -11.796 3.386 1.00 37.00 N ATOM 2601 CA ASN A 658 10.405 -11.993 4.831 1.00 39.40 C ATOM 2602 C ASN A 658 10.392 -10.666 5.590 1.00 35.22 C ATOM 2603 O ASN A 658 9.988 -9.634 5.057 1.00 48.19 O ATOM 2604 CB ASN A 658 11.572 -12.843 5.334 1.00 53.32 C ATOM 2605 CG ASN A 658 11.710 -14.154 4.586 1.00 48.86 C ATOM 2606 OD1 ASN A 658 10.777 -14.616 3.934 1.00 42.75 O ATOM 2607 ND2 ASN A 658 12.886 -14.761 4.677 1.00 60.31 N ATOM 2608 HD22 ASN A 658 13.649 -14.334 5.240 1.00 0.00 H ATOM 2609 HD21 ASN A 658 13.045 -15.663 4.185 1.00 0.00 H ATOM 2610 H ASN A 658 11.427 -11.905 2.922 1.00 0.00 H TER 2611 ASN A 658 HETATM 2612 O HOH 1 36.631 -4.179 5.087 1.00 51.75 O HETATM 2613 O HOH 2 32.510 -6.054 8.597 1.00 17.94 O HETATM 2614 O HOH 3 30.893 -34.130 -20.643 1.00 39.15 O HETATM 2615 O HOH 4 49.992 -21.712 14.404 1.00 29.19 O HETATM 2616 O HOH 5 56.895 -20.892 -8.560 1.00 39.42 O HETATM 2617 O HOH 6 41.161 -20.735 4.952 1.00 22.34 O HETATM 2618 O HOH 7 40.559 -26.426 1.441 1.00 20.49 O HETATM 2619 O HOH 8 29.290 -24.366 21.697 1.00 32.73 O HETATM 2620 O HOH 9 49.745 -26.255 -8.000 1.00 37.19 O HETATM 2621 O HOH 10 24.677 -9.108 4.235 1.00 36.72 O HETATM 2622 O HOH 11 19.871 -22.833 15.176 1.00 28.95 O HETATM 2623 O HOH 12 18.668 -32.609 -10.095 1.00 24.27 O HETATM 2624 O HOH 13 60.561 -9.703 3.698 1.00 23.17 O HETATM 2625 O HOH 14 16.767 -32.522 6.506 1.00 38.64 O HETATM 2626 O HOH 15 41.105 -26.089 -5.228 1.00 35.16 O HETATM 2627 O HOH 16 25.243 -36.020 10.855 1.00 32.10 O HETATM 2628 O HOH 17 39.671 -37.819 -3.106 1.00 31.99 O HETATM 2629 O HOH 18 50.692 -9.143 -9.980 1.00 51.37 O HETATM 2630 O HOH 19 26.087 -29.748 18.772 1.00 43.64 O HETATM 2631 O HOH 20 39.831 -14.071 18.498 1.00 34.46 O HETATM 2632 O HOH 21 21.758 -29.272 -16.305 1.00 29.16 O HETATM 2633 O HOH 22 59.434 -7.380 3.105 1.00 23.73 O HETATM 2634 O HOH 23 46.612 -3.248 -4.549 1.00 35.73 O HETATM 2635 O HOH 24 35.915 -23.292 -8.763 1.00 18.91 O HETATM 2636 O HOH 25 39.056 -34.057 0.240 1.00 38.24 O HETATM 2637 O HOH 26 54.888 -22.839 7.955 1.00 25.83 O HETATM 2638 O HOH 27 23.723 -6.631 -1.364 1.00 35.12 O HETATM 2639 O HOH 28 50.824 -27.209 0.064 1.00 30.21 O HETATM 2640 O HOH 29 42.683 -7.178 10.122 1.00 19.59 O HETATM 2641 O HOH 30 57.011 -22.949 -0.608 1.00 27.11 O HETATM 2642 O HOH 31 37.657 -2.813 -6.808 1.00 29.84 O HETATM 2643 O HOH 32 38.152 -8.330 11.817 1.00 34.31 O HETATM 2644 O HOH 33 26.760 -12.433 8.890 1.00 23.99 O HETATM 2645 O HOH 34 16.337 -18.318 5.580 1.00 22.38 O HETATM 2646 O HOH 35 31.049 -29.110 6.083 1.00 15.93 O HETATM 2647 O HOH 36 41.111 -24.657 4.485 1.00 34.43 O HETATM 2648 O HOH 37 29.035 -7.601 -4.733 1.00 27.58 O HETATM 2649 O HOH 38 33.900 -26.372 4.659 1.00 11.51 O HETATM 2650 O HOH 39 48.093 -24.229 -10.700 1.00 42.80 O HETATM 2651 O HOH 40 48.258 -33.089 -9.291 1.00 33.21 O HETATM 2652 O HOH 41 40.073 -24.721 11.191 1.00 38.21 O HETATM 2653 O HOH 42 29.031 -31.344 -4.476 1.00 12.75 O HETATM 2654 O HOH 43 45.427 -16.784 6.791 1.00 28.59 O HETATM 2655 O HOH 44 33.407 -24.986 -14.738 1.00 22.69 O HETATM 2656 O HOH 45 35.565 -20.581 14.150 1.00 14.51 O HETATM 2657 O HOH 46 17.809 -22.903 -12.296 1.00 35.46 O HETATM 2658 O HOH 47 18.867 -27.385 9.154 1.00 16.80 O HETATM 2659 O HOH 48 16.132 -11.943 -8.765 1.00 42.56 O HETATM 2660 O HOH 49 46.935 -14.556 6.406 1.00 24.97 O HETATM 2661 O HOH 50 58.573 -19.696 2.018 1.00 22.15 O HETATM 2662 O HOH 51 34.442 -3.000 -3.372 1.00 47.45 O HETATM 2663 O HOH 52 30.154 -40.049 10.298 1.00 31.99 O HETATM 2664 O HOH 53 19.159 -18.942 -9.017 1.00 30.57 O HETATM 2665 O HOH 54 50.852 -30.818 -6.691 1.00 29.66 O HETATM 2666 O HOH 55 55.315 -2.484 6.857 1.00 20.43 O HETATM 2667 O HOH 56 37.480 -6.637 4.031 1.00 19.54 O HETATM 2668 O HOH 57 18.335 -12.145 6.488 1.00 29.79 O HETATM 2669 O HOH 58 19.915 -34.793 -10.652 1.00 25.82 O HETATM 2670 O HOH 59 30.834 -33.000 -5.845 1.00 14.79 O HETATM 2671 O HOH 60 29.365 -10.257 -11.110 1.00 26.84 O HETATM 2672 O HOH 61 23.909 -12.130 -14.476 1.00 27.56 O HETATM 2673 O HOH 62 47.281 -3.230 1.981 1.00 36.27 O HETATM 2674 O HOH 63 24.998 -34.751 3.127 1.00 27.06 O HETATM 2675 O HOH 64 36.135 -3.191 7.201 1.00 20.46 O HETATM 2676 O HOH 65 40.092 -20.706 7.327 1.00 30.60 O HETATM 2677 O HOH 66 27.019 -14.308 12.176 1.00 20.54 O HETATM 2678 O HOH 67 26.198 -34.578 7.150 1.00 20.91 O HETATM 2679 O HOH 68 57.696 -4.572 15.751 1.00 34.01 O HETATM 2680 O HOH 69 26.502 -9.003 7.485 1.00 26.16 O HETATM 2681 O HOH 70 28.469 -33.909 9.766 1.00 21.37 O HETATM 2682 O HOH 71 53.676 -4.635 15.347 1.00 18.00 O HETATM 2683 O HOH 72 16.565 -24.681 -8.346 1.00 23.23 O HETATM 2684 O HOH 73 14.846 -20.617 5.741 1.00 20.68 O HETATM 2685 O HOH 74 26.665 -26.188 19.202 1.00 24.03 O HETATM 2686 O HOH 75 19.690 -29.579 -14.585 1.00 30.27 O HETATM 2687 O HOH 76 26.363 -9.136 11.995 1.00 40.93 O HETATM 2688 O HOH 77 51.012 -20.856 6.311 1.00 18.55 O HETATM 2689 O HOH 78 24.426 -31.411 -4.399 1.00 15.36 O HETATM 2690 O HOH 79 35.281 -22.874 -5.415 1.00 16.07 O HETATM 2691 O HOH 80 34.298 -18.157 17.827 1.00 30.74 O HETATM 2692 O HOH 81 22.754 -8.575 -8.072 1.00 30.46 O HETATM 2693 O HOH 82 21.567 -29.440 11.478 1.00 24.89 O HETATM 2694 O HOH 83 42.179 -17.825 -9.371 1.00 22.48 O HETATM 2695 O HOH 84 35.869 -26.046 -2.267 1.00 14.68 O HETATM 2696 O HOH 85 37.515 -27.831 -6.891 1.00 44.81 O HETATM 2697 O HOH 86 43.598 -5.776 -0.381 1.00 30.67 O HETATM 2698 O HOH 87 46.008 -8.458 21.063 1.00 35.98 O HETATM 2699 O HOH 88 31.842 -39.092 6.018 1.00 32.39 O HETATM 2700 O HOH 89 19.980 -27.964 -10.423 1.00 20.93 O HETATM 2701 O HOH 90 47.588 -30.290 3.806 1.00 34.52 O HETATM 2702 O HOH 91 46.243 -26.762 12.973 1.00 31.73 O HETATM 2703 O HOH 92 59.827 -23.718 5.853 1.00 43.92 O HETATM 2704 O HOH 93 41.816 -21.073 -3.422 1.00 14.18 O HETATM 2705 O HOH 94 25.249 -34.459 -12.592 1.00 22.71 O HETATM 2706 O HOH 95 42.935 -4.115 14.536 1.00 22.42 O HETATM 2707 O HOH 96 48.616 -22.605 5.607 1.00 19.64 O HETATM 2708 O HOH 97 15.781 -32.461 -3.815 1.00 31.89 O HETATM 2709 O HOH 98 28.550 -5.761 -2.838 1.00 36.12 O HETATM 2710 O HOH 99 34.377 -16.320 -9.139 1.00 24.91 O HETATM 2711 O HOH 100 31.493 -30.707 9.470 1.00 27.39 O HETATM 2712 O HOH 101 42.645 -8.887 -1.298 1.00 21.86 O HETATM 2713 O HOH 102 32.625 -29.308 15.961 1.00 34.91 O HETATM 2714 O HOH 103 28.910 -16.983 -13.539 1.00 25.64 O HETATM 2715 O HOH 104 45.380 -26.960 -6.994 1.00 39.55 O HETATM 2716 O HOH 105 42.360 -7.723 -9.421 1.00 31.08 O HETATM 2717 O HOH 106 34.730 -18.197 -15.728 1.00 33.27 O HETATM 2718 O HOH 107 34.216 -5.398 12.903 1.00 39.27 O HETATM 2719 O HOH 108 22.979 -35.409 -13.919 1.00 34.74 O HETATM 2720 O HOH 109 36.573 -35.354 1.982 1.00 46.90 O HETATM 2721 O HOH 110 43.148 -3.018 -3.254 1.00 51.35 O HETATM 2722 O HOH 111 49.594 -19.320 20.706 1.00 29.45 O HETATM 2723 O HOH 112 37.642 -41.651 -2.061 1.00 27.53 O HETATM 2724 O HOH 113 21.153 -31.173 -13.073 1.00 20.39 O HETATM 2725 O HOH 114 43.481 -14.977 4.723 1.00 26.27 O HETATM 2726 O HOH 115 36.525 -7.499 9.789 1.00 23.16 O HETATM 2727 O HOH 116 58.129 -7.752 16.515 1.00 43.35 O HETATM 2728 O HOH 117 37.554 -9.637 13.986 1.00 25.25 O HETATM 2729 O HOH 118 14.773 -15.434 11.618 1.00 31.53 O HETATM 2730 O HOH 119 14.620 -18.779 13.161 1.00 33.88 O HETATM 2731 O HOH 120 41.256 -16.393 -11.540 1.00 22.56 O HETATM 2732 O HOH 121 19.342 -36.469 -5.240 1.00 28.81 O HETATM 2733 O HOH 122 33.705 -26.979 16.226 1.00 36.64 O HETATM 2734 O HOH 123 27.490 -35.469 -14.592 1.00 32.50 O HETATM 2735 O HOH 124 35.791 -33.236 -0.392 1.00 16.21 O HETATM 2736 O HOH 125 42.363 -14.305 2.288 1.00 23.49 O HETATM 2737 O HOH 126 36.280 -1.838 -4.459 1.00 37.30 O HETATM 2738 O HOH 127 57.300 -11.005 16.802 1.00 23.53 O HETATM 2739 O HOH 128 29.024 -28.386 -18.100 1.00 28.22 O HETATM 2740 O HOH 129 32.727 -3.432 -0.381 1.00 24.68 O HETATM 2741 O HOH 130 39.964 -20.520 12.235 1.00 15.93 O HETATM 2742 O HOH 131 53.143 -34.065 -3.608 1.00 31.38 O HETATM 2743 O HOH 132 55.801 -1.956 -1.312 1.00 27.38 O HETATM 2744 O HOH 133 30.715 -5.834 -6.071 1.00 39.25 O HETATM 2745 O HOH 134 35.464 -28.770 5.363 1.00 15.83 O HETATM 2746 O HOH 135 34.613 -25.374 -6.930 1.00 29.64 O HETATM 2747 O HOH 136 25.662 -7.673 -8.241 1.00 46.36 O HETATM 2748 O HOH 137 61.833 -4.540 0.858 1.00 37.63 O HETATM 2749 O HOH 138 9.055 -22.546 2.367 1.00 36.18 O HETATM 2750 O HOH 139 43.610 -33.572 -11.367 1.00 40.20 O HETATM 2751 O HOH 140 38.777 -16.301 -14.986 1.00 44.89 O HETATM 2752 O HOH 141 27.585 -26.095 -20.072 1.00 38.23 O HETATM 2753 O HOH 142 42.873 -28.326 -6.127 1.00 31.21 O HETATM 2754 O HOH 143 37.311 -26.584 9.480 1.00 20.72 O HETATM 2755 O HOH 144 44.245 -25.356 4.543 1.00 28.76 O HETATM 2756 O HOH 145 42.782 3.425 12.628 1.00 27.81 O HETATM 2757 O HOH 146 40.235 -5.682 -8.604 1.00 35.76 O HETATM 2758 O HOH 147 26.556 -43.460 11.143 1.00 32.94 O HETATM 2759 O HOH 148 38.793 -4.662 8.408 1.00 31.86 O HETATM 2760 O HOH 149 40.518 -6.864 11.628 1.00 29.34 O HETATM 2761 O HOH 150 36.139 -26.183 -4.967 1.00 27.22 O HETATM 2762 O HOH 151 40.302 -24.130 7.439 1.00 39.34 O HETATM 2763 O HOH 152 25.649 -19.003 -18.025 1.00 26.07 O HETATM 2764 O HOH 153 20.588 -30.730 -10.482 1.00 22.32 O HETATM 2765 O HOH 154 9.545 -20.891 0.912 1.00 29.57 O HETATM 2766 O HOH 155 44.958 -15.466 1.746 1.00 32.88 O HETATM 2767 O HOH 156 22.403 -14.802 17.850 1.00 48.63 O HETATM 2768 O HOH 157 12.279 -19.735 6.708 1.00 34.13 O HETATM 2769 O HOH 158 51.901 -29.008 2.795 1.00 36.90 O HETATM 2770 O HOH 159 33.452 -44.840 -6.133 1.00 38.06 O HETATM 2771 O HOH 160 16.534 -16.372 -10.936 1.00 32.49 O HETATM 2772 O HOH 161 56.057 -0.619 4.521 1.00 37.68 O HETATM 2773 O HOH 162 38.139 -21.465 14.685 1.00 22.15 O HETATM 2774 O HOH 163 24.462 -13.185 10.279 1.00 26.80 O HETATM 2775 O HOH 164 37.155 -17.813 18.080 1.00 34.91 O HETATM 2776 O HOH 165 32.987 -24.403 -17.464 1.00 31.98 O HETATM 2777 O HOH 166 34.283 -14.804 -13.660 1.00 32.24 O HETATM 2778 O HOH 167 40.524 -5.941 13.942 1.00 40.16 O HETATM 2779 O HOH 168 37.615 -38.658 -5.302 1.00 48.19 O HETATM 2780 O HOH 169 32.929 -47.006 1.832 1.00 37.64 O HETATM 2781 O HOH 170 29.290 -22.124 -18.567 1.00 31.51 O HETATM 2782 O HOH 171 40.899 -21.477 9.806 1.00 24.41 O HETATM 2783 O HOH 172 18.305 -11.020 -11.513 1.00 40.76 O HETATM 2784 O HOH 173 8.932 -22.635 4.934 1.00 40.75 O HETATM 2785 O HOH 174 37.860 -31.304 0.861 1.00 37.26 O HETATM 2786 O HOH 175 16.101 -19.403 -7.568 1.00 36.58 O HETATM 2787 O HOH 176 55.806 -2.875 15.338 1.00 25.15 O HETATM 2788 O HOH 177 61.466 -9.415 -4.413 1.00 56.98 O HETATM 2789 O HOH 178 38.393 -8.287 16.198 1.00 29.54 O HETATM 2790 O HOH 179 31.132 -33.361 10.383 1.00 31.32 O HETATM 2791 O HOH 180 42.760 -3.279 3.168 1.00 29.93 O HETATM 2792 O HOH 181 15.543 -12.333 5.880 1.00 35.46 O HETATM 2793 O HOH 182 21.078 -33.862 -13.113 1.00 30.56 O HETATM 2794 O HOH 183 25.884 -9.989 9.805 1.00 41.91 O HETATM 2795 O HOH 184 14.474 -17.420 -6.532 1.00 41.95 O HETATM 2796 O HOH 185 51.181 -29.018 -8.699 1.00 41.52 O HETATM 2797 O HOH 186 20.445 -9.835 -11.704 1.00 45.70 O HETATM 2798 O HOH 187 31.668 -27.392 23.329 1.00 31.27 O HETATM 2799 O HOH 188 18.466 -27.803 12.013 1.00 29.21 O HETATM 2800 O HOH 189 29.795 -14.400 -15.354 1.00 37.53 O HETATM 2801 O HOH 190 47.410 -26.730 -9.310 1.00 41.20 O HETATM 2802 O HOH 191 61.202 -5.424 3.050 1.00 32.88 O HETATM 2803 O HOH 192 14.670 -26.400 -7.757 1.00 34.52 O HETATM 2804 O HOH 193 49.814 -7.103 -11.736 1.00 37.42 O HETATM 2805 O HOH 194 18.537 -18.906 -11.642 1.00 37.95 O HETATM 2806 O HOH 195 33.343 -30.602 5.961 1.00 20.04 O HETATM 2807 O HOH 196 28.168 -19.850 -19.072 1.00 36.38 O HETATM 2808 O HOH 197 21.845 -10.163 -13.885 1.00 36.67 O HETATM 2809 O HOH 198 37.362 -28.477 7.382 1.00 24.54 O HETATM 2810 O HOH 199 32.654 -29.923 -19.622 1.00 38.55 O HETATM 2811 O HOH 200 44.132 -16.139 26.888 1.00 44.14 O HETATM 2812 O HOH 201 40.770 -18.992 20.523 1.00 42.75 O HETATM 2813 O HOH 202 34.093 -31.435 8.579 1.00 31.88 O HETATM 2814 O HOH 203 64.206 -16.550 -4.695 1.00 40.63 O HETATM 2815 C4 DXM A 204 42.555 -17.936 10.865 1.00 -0.01 C HETATM 2816 C5 DXM A 204 43.109 -18.122 9.667 1.00 0.09 C HETATM 2817 C8 DXM A 204 43.655 -19.442 9.208 1.00 0.04 C HETATM 2818 C9 DXM A 204 43.530 -19.876 7.874 1.00 0.17 C HETATM 2819 C10 DXM A 204 44.018 -21.099 7.457 1.00 0.14 C HETATM 2820 C20 DXM A 204 44.648 -21.893 8.383 1.00 0.16 C HETATM 2821 C21 DXM A 204 44.789 -21.488 9.701 1.00 -0.04 C HETATM 2822 C22 DXM A 204 44.296 -20.259 10.123 1.00 -0.06 C HETATM 2823 H19 DXM A 204 44.412 -19.945 11.154 1.00 0.05 H HETATM 2824 H18 DXM A 204 45.289 -22.137 10.411 1.00 0.06 H HETATM 2825 F2 DXM A 204 45.138 -23.099 8.024 1.00 -0.19 F HETATM 2826 N6 DXM A 204 43.852 -21.486 6.103 1.00 -0.24 N HETATM 2827 C11 DXM A 204 44.886 -21.623 5.269 1.00 0.22 C HETATM 2828 C12 DXM A 204 44.718 -22.014 3.836 1.00 0.09 C HETATM 2829 C13 DXM A 204 43.631 -22.313 3.215 1.00 -0.06 C HETATM 2830 C14 DXM A 204 43.808 -22.564 1.959 1.00 -0.05 C HETATM 2831 C15 DXM A 204 45.096 -22.517 1.598 1.00 0.02 C HETATM 2832 C16 DXM A 204 45.607 -22.788 0.196 1.00 -0.01 C HETATM 2833 C17 DXM A 204 44.565 -23.505 -0.644 1.00 -0.04 C HETATM 2834 C18 DXM A 204 43.208 -22.834 -0.504 1.00 -0.05 C HETATM 2835 C19 DXM A 204 42.720 -22.881 0.939 1.00 -0.03 C HETATM 2836 H16 DXM A 204 41.908 -22.148 1.056 1.00 0.04 H HETATM 2837 H17 DXM A 204 42.334 -23.891 1.143 1.00 0.04 H HETATM 2838 H14 DXM A 204 42.482 -23.354 -1.146 1.00 0.03 H HETATM 2839 H15 DXM A 204 43.292 -21.784 -0.821 1.00 0.03 H HETATM 2840 H12 DXM A 204 44.487 -24.550 -0.309 1.00 0.03 H HETATM 2841 H13 DXM A 204 44.873 -23.480 -1.700 1.00 0.03 H HETATM 2842 H10 DXM A 204 46.509 -23.414 0.259 1.00 0.04 H HETATM 2843 H11 DXM A 204 45.858 -21.831 -0.285 1.00 0.04 H HETATM 2844 S1 DXM A 204 46.097 -22.087 2.861 1.00 -0.03 S HETATM 2845 H5 DXM A 204 42.657 -22.351 3.700 1.00 0.05 H HETATM 2846 O2 DXM A 204 46.014 -21.403 5.712 1.00 -0.39 O HETATM 2847 H24 DXM A 204 42.929 -21.662 5.761 1.00 0.22 H HETATM 2848 F1 DXM A 204 42.923 -19.119 6.947 1.00 -0.19 F HETATM 2849 N4 DXM A 204 43.197 -17.133 8.762 1.00 -0.20 N HETATM 2850 N5 DXM A 204 42.705 -15.872 9.062 1.00 -0.17 N HETATM 2851 C6 DXM A 204 42.797 -14.830 8.039 1.00 0.05 C HETATM 2852 H2 DXM A 204 43.267 -15.244 7.135 1.00 0.05 H HETATM 2853 H3 DXM A 204 43.405 -13.996 8.419 1.00 0.05 H HETATM 2854 H4 DXM A 204 41.788 -14.467 7.794 1.00 0.05 H HETATM 2855 C7 DXM A 204 42.177 -15.643 10.255 1.00 0.25 C HETATM 2856 C3 DXM A 204 42.083 -16.754 11.219 1.00 0.09 C HETATM 2857 N3 DXM A 204 41.484 -16.403 12.409 1.00 -0.31 N HETATM 2858 C2 DXM A 204 41.317 -17.172 13.544 1.00 0.05 C HETATM 2859 N2 DXM A 204 41.639 -18.475 13.612 1.00 -0.23 N HETATM 2860 N1 DXM A 204 41.271 -18.819 14.905 1.00 -0.21 N HETATM 2861 C1 DXM A 204 41.549 -20.225 15.296 1.00 0.06 C HETATM 2862 H7 DXM A 204 41.220 -20.389 16.333 1.00 0.06 H HETATM 2863 H8 DXM A 204 42.629 -20.421 15.218 1.00 0.06 H HETATM 2864 H9 DXM A 204 41.004 -20.907 14.627 1.00 0.06 H HETATM 2865 C24 DXM A 204 40.741 -17.793 15.551 1.00 0.06 C HETATM 2866 C23 DXM A 204 40.748 -16.696 14.714 1.00 -0.04 C HETATM 2867 H20 DXM A 204 40.389 -15.690 14.924 1.00 0.02 H HETATM 2868 C25 DXM A 204 40.165 -17.641 16.936 1.00 -0.00 C HETATM 2869 H21 DXM A 204 39.826 -16.605 17.080 1.00 0.04 H HETATM 2870 H22 DXM A 204 40.936 -17.881 17.682 1.00 0.04 H HETATM 2871 H23 DXM A 204 39.313 -18.326 17.056 1.00 0.04 H HETATM 2872 O1 DXM A 204 41.723 -14.504 10.556 1.00 -0.37 O HETATM 2873 H6 DXM A 204 43.630 -17.312 7.845 1.00 0.22 H HETATM 2874 H1 DXM A 204 42.490 -18.770 11.562 1.00 0.04 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 846 847 854 855 856 CONECT 854 846 CONECT 855 846 CONECT 856 846 CONECT 2815 2816 2856 2874 CONECT 2816 2815 2817 2849 CONECT 2817 2816 2818 2822 CONECT 2818 2817 2819 2848 CONECT 2819 2818 2820 2826 CONECT 2820 2819 2821 2825 CONECT 2821 2820 2822 2824 CONECT 2822 2817 2821 2823 CONECT 2823 2822 CONECT 2824 2821 CONECT 2825 2820 CONECT 2826 2819 2827 2847 CONECT 2827 2826 2828 2846 CONECT 2828 2827 2829 2844 CONECT 2829 2828 2830 2845 CONECT 2830 2829 2831 2835 CONECT 2831 2830 2832 2844 CONECT 2832 2831 2833 2842 2843 CONECT 2833 2832 2834 2840 2841 CONECT 2834 2833 2835 2838 2839 CONECT 2835 2830 2834 2836 2837 CONECT 2836 2835 CONECT 2837 2835 CONECT 2838 2834 CONECT 2839 2834 CONECT 2840 2833 CONECT 2841 2833 CONECT 2842 2832 CONECT 2843 2832 CONECT 2844 2828 2831 CONECT 2845 2829 CONECT 2846 2827 CONECT 2847 2826 CONECT 2848 2818 CONECT 2849 2816 2850 2873 CONECT 2850 2849 2851 2855 CONECT 2851 2850 2852 2853 2854 CONECT 2852 2851 CONECT 2853 2851 CONECT 2854 2851 CONECT 2855 2850 2856 2872 CONECT 2856 2815 2855 2857 CONECT 2857 2856 2858 CONECT 2858 2857 2859 2866 CONECT 2859 2858 2860 CONECT 2860 2859 2861 2865 CONECT 2861 2860 2862 2863 2864 CONECT 2862 2861 CONECT 2863 2861 CONECT 2864 2861 CONECT 2865 2860 2866 2868 CONECT 2866 2858 2865 2867 CONECT 2867 2866 CONECT 2868 2865 2869 2870 2871 CONECT 2869 2868 CONECT 2870 2868 CONECT 2871 2868 CONECT 2872 2855 CONECT 2873 2849 CONECT 2874 2815 MASTER 0 0 0 0 0 0 0 0 2872 2 68 21 END
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283aa, >4RFZ_1|Chain... at 95%
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4rx5
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RCSB PDB
PDBbind
271aa, >5FBN_1|Chains... at 100%
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RCSB PDB
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5j87
RCSB PDB
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5vgo
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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
6bkw
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase BTK
Ligand Name
DXM
EC.Number
E.C.2.7.10.2
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
IC50=5nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J. Comput. Aided Mol. Des. Vol. 33: pp. 307-330
Ligand Properties
Formula
C
2
5
H
2
4
F
2
N
6
O
2
S
Molecular Weight
510.559
Exact Mass
510.165
No. of atoms
60
No. of bonds
64
Polar Surface Area
125.31
LOGP Value
4.59 (
Computed with XLOGP3
)
4.20 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 5
Canonical SMILES
Fc1ccc(c(c1NC(=O)c1cc2c(s1)CCCC2)F)c1c/c(=N\c2nn(c(c2)C)C)/c(=O)n([nH]1)C
InChI String
InChI=1S/C25H24F2N6O2S/c1-13-10-21(31-32(13)2)28-18-12-17(30-33(3)25(18)35)15-8-9-16(26)23(22(15)27)29-24(34)20-11-14-6-4-5-7-19(14)36-20/h8-12,30H,4-7H2,1-3H3,(H,29,34)/b28-18+
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):
Q06187
Entrez Gene ID
NCBI Entrez Gene ID:
695
ASD
Information of known allosteric effects of PDB entries
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