Browse entries in the PDBbind-CN Database
HEADER 5A4C_COMPLEX COMPND 5A4C_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 23 GLU LEU PRO GLU ASP PRO ARG TRP GLU LEU PRO ARG ASP SEQRES 2 A 23 ARG LEU VAL LEU GLY LYS PRO LEU GLY GLU SEQRES 1 A 156 PHE GLY GLN VAL VAL LEU ALA GLU ALA ILE GLY LEU ASP SEQRES 2 A 156 LYS ASP LYS PRO ASN ARG VAL THR LYS VAL ALA VAL LYS SEQRES 3 A 156 MET LEU LYS SER ASP ALA THR GLU LYS ASP LEU SER ASP SEQRES 4 A 156 LEU ILE SER GLU MET GLU MET MET LYS MET ILE GLY LYS SEQRES 5 A 156 HIS LYS ASN ILE ILE ASN LEU LEU GLY ALA CYS THR GLN SEQRES 6 A 156 ASP GLY PRO LEU TYR VAL ILE VAL GLU TYR ALA SER LYS SEQRES 7 A 156 GLY ASN LEU ARG GLU TYR LEU GLN ALA ARG ARG PRO PRO SEQRES 8 A 156 GLY LEU GLU TYR SER TYR ASN PRO SER HIS ASN PRO GLU SEQRES 9 A 156 GLU GLN LEU SER SER LYS ASP LEU VAL SER CYS ALA TYR SEQRES 10 A 156 GLN VAL ALA ARG GLY MET GLU TYR LEU ALA SER LYS LYS SEQRES 11 A 156 CYS ILE HIS ARG ASP LEU ALA ALA ARG ASN VAL LEU VAL SEQRES 12 A 156 THR GLU ASP ASN VAL MET LYS ILE ALA ASP PHE GLY LEU SEQRES 1 A 115 ILE ASP TYR TYR LYS LYS THR THR ASN GLY ARG LEU PRO SEQRES 2 A 115 VAL LYS TRP MET ALA PRO GLU ALA LEU PHE ASP ARG ILE SEQRES 3 A 115 TYR THR HIS GLN SER ASP VAL TRP SER PHE GLY VAL LEU SEQRES 4 A 115 LEU TRP GLU ILE PHE THR LEU GLY GLY SER PRO TYR PRO SEQRES 5 A 115 GLY VAL PRO VAL GLU GLU LEU PHE LYS LEU LEU LYS GLU SEQRES 6 A 115 GLY HIS ARG MET ASP LYS PRO SER ASN CYS THR ASN GLU SEQRES 7 A 115 LEU TYR MET MET MET ARG ASP CYS TRP HIS ALA VAL PRO SEQRES 8 A 115 SER GLN ARG PRO THR PHE LYS GLN LEU VAL GLU ASP LEU SEQRES 9 A 115 ASP ARG ILE VAL ALA LEU THR SER ASN GLN GLU HET XOJ A 495 77 ATOM 1 N GLU A 464 106.917 15.249 23.669 1.00 84.92 N ATOM 2 CA GLU A 464 107.206 14.095 22.810 1.00 83.13 C ATOM 3 C GLU A 464 106.764 12.769 23.460 1.00 83.31 C ATOM 4 O GLU A 464 106.529 12.734 24.671 1.00 82.73 O ATOM 5 CB GLU A 464 108.696 14.069 22.408 1.00 85.71 C ATOM 6 HN3 GLU A 464 107.423 15.143 24.571 1.00 0.00 H ATOM 7 HN2 GLU A 464 105.894 15.299 23.848 1.00 0.00 H ATOM 8 HN1 GLU A 464 107.230 16.120 23.194 1.00 0.00 H ATOM 9 N LEU A 465 106.644 11.688 22.648 1.00 76.96 N ATOM 10 CA LEU A 465 106.192 10.351 23.075 1.00 74.04 C ATOM 11 C LEU A 465 107.336 9.337 23.296 1.00 74.12 C ATOM 12 O LEU A 465 108.282 9.327 22.509 1.00 74.12 O ATOM 13 CB LEU A 465 105.214 9.783 22.035 1.00 72.77 C ATOM 14 CG LEU A 465 103.732 10.024 22.262 1.00 76.83 C ATOM 15 CD1 LEU A 465 103.282 11.325 21.610 1.00 77.92 C ATOM 16 CD2 LEU A 465 102.918 8.884 21.680 1.00 78.05 C ATOM 17 H LEU A 465 106.890 11.813 21.645 1.00 0.00 H ATOM 18 N PRO A 466 107.244 8.427 24.305 1.00 67.59 N ATOM 19 CA PRO A 466 108.318 7.426 24.482 1.00 66.58 C ATOM 20 C PRO A 466 108.186 6.253 23.502 1.00 66.11 C ATOM 21 O PRO A 466 107.072 5.903 23.115 1.00 63.93 O ATOM 22 CB PRO A 466 108.139 6.978 25.930 1.00 68.14 C ATOM 23 CG PRO A 466 106.663 7.132 26.189 1.00 71.91 C ATOM 24 CD PRO A 466 106.174 8.260 25.315 1.00 68.13 C ATOM 25 N GLU A 467 109.306 5.643 23.105 1.00 61.24 N ATOM 26 CA GLU A 467 109.244 4.532 22.160 1.00 59.50 C ATOM 27 C GLU A 467 108.983 3.188 22.813 1.00 59.90 C ATOM 28 O GLU A 467 109.744 2.759 23.679 1.00 62.57 O ATOM 29 CB GLU A 467 110.481 4.456 21.256 1.00 61.77 C ATOM 30 CG GLU A 467 110.244 3.633 19.988 1.00 70.30 C ATOM 31 CD GLU A 467 111.461 3.015 19.317 1.00 88.78 C ATOM 32 OE1 GLU A 467 112.569 3.583 19.448 1.00 89.59 O ATOM 33 OE2 GLU A 467 111.301 1.969 18.643 1.00 69.97 O ATOM 34 H GLU A 467 110.226 5.961 23.471 1.00 0.00 H ATOM 35 N ASP A 468 107.940 2.499 22.343 1.00 48.87 N ATOM 36 CA ASP A 468 107.589 1.168 22.800 1.00 45.63 C ATOM 37 C ASP A 468 107.998 0.250 21.641 1.00 49.99 C ATOM 38 O ASP A 468 107.274 0.191 20.636 1.00 48.84 O ATOM 39 CB ASP A 468 106.058 1.084 23.078 1.00 45.34 C ATOM 40 CG ASP A 468 105.573 -0.245 23.640 1.00 45.08 C ATOM 41 OD1 ASP A 468 106.413 -1.159 23.817 1.00 43.58 O ATOM 42 OD2 ASP A 468 104.351 -0.370 23.911 1.00 46.31 O ATOM 43 H ASP A 468 107.348 2.940 21.610 1.00 0.00 H ATOM 44 N PRO A 469 109.160 -0.449 21.723 1.00 47.26 N ATOM 45 CA PRO A 469 109.563 -1.326 20.609 1.00 47.55 C ATOM 46 C PRO A 469 108.664 -2.538 20.367 1.00 50.35 C ATOM 47 O PRO A 469 108.882 -3.248 19.398 1.00 51.00 O ATOM 48 CB PRO A 469 111.004 -1.742 20.963 1.00 50.39 C ATOM 49 CG PRO A 469 111.385 -0.942 22.149 1.00 55.14 C ATOM 50 CD PRO A 469 110.146 -0.492 22.823 1.00 50.03 C ATOM 51 N ARG A 470 107.665 -2.773 21.236 1.00 46.48 N ATOM 52 CA ARG A 470 106.725 -3.899 21.106 1.00 44.84 C ATOM 53 C ARG A 470 105.793 -3.623 19.894 1.00 49.79 C ATOM 54 O ARG A 470 105.421 -4.535 19.163 1.00 50.69 O ATOM 55 CB ARG A 470 105.842 -4.047 22.374 1.00 41.25 C ATOM 56 CG ARG A 470 106.518 -4.303 23.767 1.00 41.67 C ATOM 57 CD ARG A 470 105.458 -4.436 24.886 1.00 46.67 C ATOM 58 NE ARG A 470 104.869 -3.145 25.276 1.00 46.79 N ATOM 59 CZ ARG A 470 103.972 -2.949 26.246 1.00 61.79 C ATOM 60 NH1 ARG A 470 103.496 -3.978 26.949 1.00 46.46 N ATOM 61 NH2 ARG A 470 103.547 -1.723 26.523 1.00 42.92 N ATOM 62 HE ARG A 470 105.181 -2.306 24.746 1.00 0.00 H ATOM 63 HH12 ARG A 470 102.798 -3.815 27.702 1.00 0.00 H ATOM 64 HH11 ARG A 470 103.823 -4.944 26.744 1.00 0.00 H ATOM 65 HH22 ARG A 470 102.848 -1.573 27.279 1.00 0.00 H ATOM 66 HH21 ARG A 470 103.912 -0.912 25.984 1.00 0.00 H ATOM 67 H ARG A 470 107.550 -2.126 22.042 1.00 0.00 H ATOM 68 N TRP A 471 105.461 -2.351 19.694 1.00 44.90 N ATOM 69 CA TRP A 471 104.494 -1.870 18.744 1.00 44.12 C ATOM 70 C TRP A 471 105.007 -0.922 17.677 1.00 45.78 C ATOM 71 O TRP A 471 104.281 -0.669 16.722 1.00 43.01 O ATOM 72 CB TRP A 471 103.372 -1.214 19.546 1.00 42.99 C ATOM 73 CG TRP A 471 102.643 -2.217 20.404 1.00 43.72 C ATOM 74 CD1 TRP A 471 102.788 -2.408 21.746 1.00 47.19 C ATOM 75 CD2 TRP A 471 101.778 -3.263 19.939 1.00 42.74 C ATOM 76 NE1 TRP A 471 101.997 -3.456 22.164 1.00 46.40 N ATOM 77 CE2 TRP A 471 101.382 -4.015 21.071 1.00 47.04 C ATOM 78 CE3 TRP A 471 101.269 -3.617 18.675 1.00 43.14 C ATOM 79 CZ2 TRP A 471 100.465 -5.071 20.987 1.00 45.22 C ATOM 80 CZ3 TRP A 471 100.377 -4.673 18.586 1.00 44.11 C ATOM 81 CH2 TRP A 471 99.983 -5.392 19.730 1.00 44.34 C ATOM 82 HE1 TRP A 471 101.884 -3.772 23.148 1.00 0.00 H ATOM 83 H TRP A 471 105.945 -1.639 20.278 1.00 0.00 H ATOM 84 N GLU A 472 106.227 -0.390 17.828 1.00 43.87 N ATOM 85 CA GLU A 472 106.758 0.594 16.890 1.00 44.68 C ATOM 86 C GLU A 472 106.950 0.067 15.470 1.00 47.93 C ATOM 87 O GLU A 472 107.623 -0.940 15.276 1.00 48.63 O ATOM 88 CB GLU A 472 108.060 1.244 17.405 1.00 46.72 C ATOM 89 CG GLU A 472 108.400 2.575 16.726 1.00 49.75 C ATOM 90 CD GLU A 472 107.482 3.748 17.030 1.00 62.75 C ATOM 91 OE1 GLU A 472 106.946 3.822 18.158 1.00 62.38 O ATOM 92 OE2 GLU A 472 107.315 4.610 16.140 1.00 51.49 O ATOM 93 H GLU A 472 106.812 -0.686 18.636 1.00 0.00 H ATOM 94 N LEU A 473 106.345 0.758 14.487 1.00 42.69 N ATOM 95 CA LEU A 473 106.529 0.448 13.053 1.00 41.23 C ATOM 96 C LEU A 473 107.181 1.655 12.411 1.00 45.82 C ATOM 97 O LEU A 473 106.634 2.746 12.554 1.00 46.77 O ATOM 98 CB LEU A 473 105.195 0.123 12.328 1.00 39.13 C ATOM 99 CG LEU A 473 105.294 -0.185 10.810 1.00 42.32 C ATOM 100 CD1 LEU A 473 105.802 -1.588 10.564 1.00 42.58 C ATOM 101 CD2 LEU A 473 103.954 0.017 10.102 1.00 39.25 C ATOM 102 H LEU A 473 105.719 1.547 14.748 1.00 0.00 H ATOM 103 N PRO A 474 108.320 1.518 11.705 1.00 43.95 N ATOM 104 CA PRO A 474 108.918 2.698 11.045 1.00 46.18 C ATOM 105 C PRO A 474 107.949 3.391 10.071 1.00 53.02 C ATOM 106 O PRO A 474 107.137 2.728 9.425 1.00 51.55 O ATOM 107 CB PRO A 474 110.135 2.116 10.302 1.00 47.41 C ATOM 108 CG PRO A 474 110.465 0.868 11.023 1.00 50.60 C ATOM 109 CD PRO A 474 109.141 0.307 11.468 1.00 45.33 C ATOM 110 N ARG A 475 108.022 4.723 9.997 1.00 53.37 N ATOM 111 CA ARG A 475 107.173 5.590 9.153 1.00 54.59 C ATOM 112 C ARG A 475 107.211 5.269 7.643 1.00 59.19 C ATOM 113 O ARG A 475 106.186 5.397 6.966 1.00 57.75 O ATOM 114 CB ARG A 475 107.516 7.072 9.394 1.00 55.99 C ATOM 115 CG ARG A 475 107.221 7.476 10.822 1.00 60.44 C ATOM 116 CD ARG A 475 107.069 8.957 11.007 1.00 66.76 C ATOM 117 NE ARG A 475 106.707 9.204 12.389 1.00 69.94 N ATOM 118 CZ ARG A 475 105.466 9.321 12.832 1.00 78.40 C ATOM 119 NH1 ARG A 475 104.445 9.300 11.982 1.00 66.26 N ATOM 120 NH2 ARG A 475 105.234 9.501 14.122 1.00 59.70 N ATOM 121 HE ARG A 475 107.478 9.296 13.081 1.00 0.00 H ATOM 122 HH12 ARG A 475 103.472 9.392 12.336 1.00 0.00 H ATOM 123 HH11 ARG A 475 104.619 9.191 10.963 1.00 0.00 H ATOM 124 HH22 ARG A 475 104.257 9.593 14.467 1.00 0.00 H ATOM 125 HH21 ARG A 475 106.029 9.551 14.791 1.00 0.00 H ATOM 126 H ARG A 475 108.740 5.192 10.586 1.00 0.00 H ATOM 127 N ASP A 476 108.373 4.822 7.139 1.00 57.07 N ATOM 128 CA ASP A 476 108.576 4.452 5.730 1.00 58.17 C ATOM 129 C ASP A 476 107.880 3.130 5.367 1.00 59.52 C ATOM 130 O ASP A 476 107.875 2.762 4.193 1.00 60.64 O ATOM 131 CB ASP A 476 110.079 4.332 5.441 1.00 61.97 C ATOM 132 CG ASP A 476 110.715 3.184 6.201 1.00 78.80 C ATOM 133 OD1 ASP A 476 110.744 3.244 7.442 1.00 78.40 O ATOM 134 OD2 ASP A 476 111.146 2.207 5.550 1.00 89.94 O ATOM 135 H ASP A 476 109.181 4.732 7.787 1.00 0.00 H ATOM 136 N ARG A 477 107.362 2.395 6.378 1.00 52.35 N ATOM 137 CA ARG A 477 106.661 1.109 6.235 1.00 50.11 C ATOM 138 C ARG A 477 105.142 1.265 6.145 1.00 51.69 C ATOM 139 O ARG A 477 104.434 0.265 6.015 1.00 50.37 O ATOM 140 CB ARG A 477 106.981 0.173 7.420 1.00 47.90 C ATOM 141 CG ARG A 477 108.415 -0.343 7.562 1.00 55.86 C ATOM 142 CD ARG A 477 108.939 -1.021 6.334 1.00 63.36 C ATOM 143 NE ARG A 477 109.229 -0.011 5.320 1.00 71.10 N ATOM 144 CZ ARG A 477 109.593 -0.266 4.073 1.00 76.96 C ATOM 145 NH1 ARG A 477 109.752 -1.520 3.662 1.00 58.67 N ATOM 146 NH2 ARG A 477 109.807 0.728 3.227 1.00 58.46 N ATOM 147 HE ARG A 477 109.143 0.987 5.599 1.00 0.00 H ATOM 148 HH12 ARG A 477 110.038 -1.713 2.681 1.00 0.00 H ATOM 149 HH11 ARG A 477 109.590 -2.308 4.321 1.00 0.00 H ATOM 150 HH22 ARG A 477 110.093 0.525 2.248 1.00 0.00 H ATOM 151 HH21 ARG A 477 109.689 1.712 3.541 1.00 0.00 H ATOM 152 H ARG A 477 107.469 2.772 7.341 1.00 0.00 H ATOM 153 N LEU A 478 104.646 2.500 6.285 1.00 46.97 N ATOM 154 CA LEU A 478 103.223 2.790 6.271 1.00 45.71 C ATOM 155 C LEU A 478 102.885 3.715 5.106 1.00 52.08 C ATOM 156 O LEU A 478 103.403 4.835 5.010 1.00 54.46 O ATOM 157 CB LEU A 478 102.812 3.369 7.621 1.00 43.87 C ATOM 158 CG LEU A 478 101.336 3.531 7.932 1.00 45.68 C ATOM 159 CD1 LEU A 478 100.609 2.176 7.998 1.00 43.62 C ATOM 160 CD2 LEU A 478 101.182 4.265 9.236 1.00 45.59 C ATOM 161 H LEU A 478 105.311 3.290 6.410 1.00 0.00 H ATOM 162 N VAL A 479 102.061 3.203 4.188 1.00 46.90 N ATOM 163 CA VAL A 479 101.639 3.915 2.986 1.00 47.69 C ATOM 164 C VAL A 479 100.221 4.383 3.227 1.00 52.69 C ATOM 165 O VAL A 479 99.289 3.571 3.163 1.00 50.97 O ATOM 166 CB VAL A 479 101.776 3.050 1.704 1.00 51.98 C ATOM 167 CG1 VAL A 479 101.539 3.891 0.447 1.00 53.41 C ATOM 168 CG2 VAL A 479 103.137 2.350 1.640 1.00 52.16 C ATOM 169 H VAL A 479 101.699 2.240 4.339 1.00 0.00 H ATOM 170 N LEU A 480 100.061 5.683 3.555 1.00 51.51 N ATOM 171 CA LEU A 480 98.753 6.264 3.859 1.00 52.52 C ATOM 172 C LEU A 480 97.859 6.328 2.614 1.00 56.57 C ATOM 173 O LEU A 480 98.349 6.618 1.537 1.00 54.09 O ATOM 174 CB LEU A 480 98.885 7.640 4.545 1.00 53.40 C ATOM 175 CG LEU A 480 99.645 7.689 5.892 1.00 56.04 C ATOM 176 CD1 LEU A 480 99.859 9.118 6.347 1.00 55.76 C ATOM 177 CD2 LEU A 480 98.950 6.884 6.962 1.00 55.10 C ATOM 178 H LEU A 480 100.901 6.296 3.593 1.00 0.00 H ATOM 179 N GLY A 481 96.586 5.960 2.779 1.00 54.11 N ATOM 180 CA GLY A 481 95.623 5.927 1.686 1.00 54.98 C ATOM 181 C GLY A 481 94.408 6.807 1.901 1.00 60.18 C ATOM 182 O GLY A 481 94.488 7.818 2.605 1.00 60.40 O ATOM 183 H GLY A 481 96.268 5.685 3.730 1.00 0.00 H ATOM 184 N LYS A 482 93.270 6.426 1.294 1.00 57.64 N ATOM 185 CA LYS A 482 92.030 7.211 1.361 1.00 59.12 C ATOM 186 C LYS A 482 91.400 7.284 2.756 1.00 62.85 C ATOM 187 O LYS A 482 91.387 6.284 3.483 1.00 59.43 O ATOM 188 CB LYS A 482 90.971 6.763 0.316 1.00 62.40 C ATOM 189 CG LYS A 482 90.545 5.290 0.363 1.00 76.89 C ATOM 190 CD LYS A 482 89.123 5.073 0.877 1.00 83.00 C ATOM 191 CE LYS A 482 88.345 4.098 0.019 1.00 89.96 C ATOM 192 NZ LYS A 482 88.897 2.714 0.067 1.00 92.10 N ATOM 193 HZ1 LYS A 482 89.880 2.722 -0.273 1.00 0.00 H ATOM 194 HZ2 LYS A 482 88.871 2.365 1.047 1.00 0.00 H ATOM 195 HZ3 LYS A 482 88.324 2.092 -0.539 1.00 0.00 H ATOM 196 H LYS A 482 93.268 5.537 0.754 1.00 0.00 H ATOM 197 N PRO A 483 90.819 8.464 3.104 1.00 61.02 N ATOM 198 CA PRO A 483 90.133 8.591 4.398 1.00 59.45 C ATOM 199 C PRO A 483 88.940 7.641 4.507 1.00 60.96 C ATOM 200 O PRO A 483 88.277 7.331 3.507 1.00 59.94 O ATOM 201 CB PRO A 483 89.670 10.054 4.416 1.00 62.36 C ATOM 202 CG PRO A 483 90.522 10.750 3.400 1.00 68.40 C ATOM 203 CD PRO A 483 90.751 9.729 2.336 1.00 63.99 C ATOM 204 N LEU A 484 88.722 7.131 5.719 1.00 55.19 N ATOM 205 CA LEU A 484 87.622 6.235 6.047 1.00 53.95 C ATOM 206 C LEU A 484 86.502 7.005 6.758 1.00 60.56 C ATOM 207 O LEU A 484 85.340 6.584 6.707 1.00 60.14 O ATOM 208 CB LEU A 484 88.098 5.033 6.907 1.00 51.30 C ATOM 209 CG LEU A 484 89.037 4.017 6.214 1.00 53.21 C ATOM 210 CD1 LEU A 484 89.606 3.023 7.204 1.00 50.30 C ATOM 211 CD2 LEU A 484 88.343 3.287 5.086 1.00 52.45 C ATOM 212 H LEU A 484 89.381 7.390 6.481 1.00 0.00 H ATOM 213 N GLY A 485 86.876 8.110 7.414 1.00 58.19 N ATOM 214 CA GLY A 485 85.980 8.982 8.163 1.00 58.60 C ATOM 215 C GLY A 485 86.664 9.790 9.255 1.00 64.86 C ATOM 216 O GLY A 485 87.846 9.581 9.548 1.00 64.37 O ATOM 217 H GLY A 485 87.884 8.366 7.387 1.00 0.00 H ATOM 218 N GLU A 486 85.899 10.723 9.870 1.00 62.86 N ATOM 219 CA GLU A 486 86.312 11.611 10.962 1.00 84.90 C ATOM 220 C GLU A 486 85.339 11.487 12.139 1.00107.34 C ATOM 221 O GLU A 486 84.169 11.146 11.950 1.00 66.52 O ATOM 222 CB GLU A 486 86.379 13.069 10.480 1.00 87.94 C ATOM 223 H GLU A 486 84.920 10.820 9.534 1.00 0.00 H TER 224 GLU A 486 ATOM 225 N PHE A 489 86.647 13.066 18.178 1.00 82.66 N ATOM 226 CA PHE A 489 87.076 11.854 17.478 1.00 81.57 C ATOM 227 C PHE A 489 88.028 12.219 16.340 1.00 85.35 C ATOM 228 O PHE A 489 87.668 13.047 15.493 1.00 87.30 O ATOM 229 CB PHE A 489 85.858 11.081 16.929 1.00 82.26 C ATOM 230 HN3 PHE A 489 86.158 13.696 17.510 1.00 0.00 H ATOM 231 HN2 PHE A 489 87.479 13.552 18.569 1.00 0.00 H ATOM 232 HN1 PHE A 489 86.000 12.808 18.950 1.00 0.00 H ATOM 233 N GLY A 490 89.226 11.614 16.339 1.00 78.15 N ATOM 234 CA GLY A 490 90.261 11.838 15.325 1.00 76.58 C ATOM 235 C GLY A 490 89.929 11.215 13.982 1.00 74.18 C ATOM 236 O GLY A 490 88.890 10.563 13.849 1.00 72.79 O ATOM 237 H GLY A 490 89.433 10.944 17.106 1.00 0.00 H ATOM 238 N GLN A 491 90.805 11.391 12.969 1.00 66.95 N ATOM 239 CA GLN A 491 90.538 10.826 11.637 1.00 63.78 C ATOM 240 C GLN A 491 91.174 9.433 11.412 1.00 61.07 C ATOM 241 O GLN A 491 92.234 9.117 11.953 1.00 60.26 O ATOM 242 CB GLN A 491 90.893 11.795 10.498 1.00 66.03 C ATOM 243 CG GLN A 491 92.327 12.301 10.491 1.00 64.99 C ATOM 244 CD GLN A 491 92.694 12.959 9.184 1.00 89.70 C ATOM 245 OE1 GLN A 491 92.465 12.417 8.091 1.00 84.08 O ATOM 246 NE2 GLN A 491 93.319 14.126 9.267 1.00 86.81 N ATOM 247 HE22 GLN A 491 93.497 14.556 10.197 1.00 0.00 H ATOM 248 HE21 GLN A 491 93.631 14.611 8.402 1.00 0.00 H ATOM 249 H GLN A 491 91.678 11.932 13.132 1.00 0.00 H ATOM 250 N VAL A 492 90.480 8.603 10.623 1.00 52.66 N ATOM 251 CA VAL A 492 90.896 7.247 10.287 1.00 49.24 C ATOM 252 C VAL A 492 91.032 7.138 8.774 1.00 54.66 C ATOM 253 O VAL A 492 90.130 7.546 8.039 1.00 54.19 O ATOM 254 CB VAL A 492 89.998 6.135 10.913 1.00 48.38 C ATOM 255 CG1 VAL A 492 90.604 4.751 10.685 1.00 46.28 C ATOM 256 CG2 VAL A 492 89.806 6.374 12.409 1.00 47.32 C ATOM 257 H VAL A 492 89.584 8.949 10.223 1.00 0.00 H ATOM 258 N VAL A 493 92.201 6.657 8.321 1.00 51.71 N ATOM 259 CA VAL A 493 92.528 6.466 6.906 1.00 50.92 C ATOM 260 C VAL A 493 92.852 4.993 6.641 1.00 51.14 C ATOM 261 O VAL A 493 93.304 4.291 7.553 1.00 50.78 O ATOM 262 CB VAL A 493 93.674 7.413 6.412 1.00 56.78 C ATOM 263 CG1 VAL A 493 93.313 8.889 6.593 1.00 57.47 C ATOM 264 CG2 VAL A 493 95.022 7.095 7.061 1.00 56.27 C ATOM 265 H VAL A 493 92.924 6.402 9.024 1.00 0.00 H ATOM 266 N LEU A 494 92.626 4.525 5.407 1.00 45.52 N ATOM 267 CA LEU A 494 93.015 3.177 5.008 1.00 44.35 C ATOM 268 C LEU A 494 94.521 3.263 4.669 1.00 48.86 C ATOM 269 O LEU A 494 94.989 4.321 4.255 1.00 49.92 O ATOM 270 CB LEU A 494 92.170 2.694 3.815 1.00 44.72 C ATOM 271 CG LEU A 494 92.561 1.415 3.047 1.00 48.84 C ATOM 272 CD1 LEU A 494 92.443 0.156 3.932 1.00 47.37 C ATOM 273 CD2 LEU A 494 91.678 1.255 1.809 1.00 52.40 C ATOM 274 H LEU A 494 92.159 5.141 4.712 1.00 0.00 H ATOM 275 N ALA A 495 95.290 2.190 4.918 1.00 43.78 N ATOM 276 CA ALA A 495 96.726 2.196 4.636 1.00 43.65 C ATOM 277 C ALA A 495 97.232 0.815 4.351 1.00 47.12 C ATOM 278 O ALA A 495 96.499 -0.168 4.485 1.00 44.24 O ATOM 279 CB ALA A 495 97.494 2.788 5.811 1.00 43.70 C ATOM 280 H ALA A 495 94.855 1.335 5.320 1.00 0.00 H ATOM 281 N GLU A 496 98.481 0.748 3.894 1.00 47.15 N ATOM 282 CA GLU A 496 99.188 -0.494 3.619 1.00 46.95 C ATOM 283 C GLU A 496 100.438 -0.492 4.452 1.00 49.10 C ATOM 284 O GLU A 496 101.228 0.451 4.392 1.00 48.77 O ATOM 285 CB GLU A 496 99.507 -0.667 2.131 1.00 49.64 C ATOM 286 CG GLU A 496 98.301 -1.153 1.338 1.00 59.19 C ATOM 287 CD GLU A 496 98.402 -0.906 -0.151 1.00 73.58 C ATOM 288 OE1 GLU A 496 98.824 0.209 -0.531 1.00 64.59 O ATOM 289 OE2 GLU A 496 98.047 -1.816 -0.938 1.00 59.14 O ATOM 290 H GLU A 496 98.984 1.642 3.722 1.00 0.00 H ATOM 291 N ALA A 497 100.571 -1.508 5.290 1.00 43.86 N ATOM 292 CA ALA A 497 101.733 -1.671 6.158 1.00 43.48 C ATOM 293 C ALA A 497 102.616 -2.732 5.547 1.00 48.06 C ATOM 294 O ALA A 497 102.155 -3.842 5.268 1.00 47.95 O ATOM 295 CB ALA A 497 101.295 -2.086 7.559 1.00 41.96 C ATOM 296 H ALA A 497 99.815 -2.221 5.332 1.00 0.00 H ATOM 297 N ILE A 498 103.859 -2.367 5.282 1.00 45.55 N ATOM 298 CA ILE A 498 104.867 -3.258 4.733 1.00 45.52 C ATOM 299 C ILE A 498 105.597 -3.852 5.930 1.00 53.16 C ATOM 300 O ILE A 498 106.043 -3.110 6.824 1.00 51.79 O ATOM 301 CB ILE A 498 105.859 -2.519 3.796 1.00 48.74 C ATOM 302 CG1 ILE A 498 105.149 -1.683 2.705 1.00 48.36 C ATOM 303 CG2 ILE A 498 106.858 -3.513 3.169 1.00 50.46 C ATOM 304 CD1 ILE A 498 106.023 -0.658 2.013 1.00 49.39 C ATOM 305 H ILE A 498 104.132 -1.383 5.478 1.00 0.00 H ATOM 306 N GLY A 499 105.729 -5.173 5.938 1.00 52.39 N ATOM 307 CA GLY A 499 106.495 -5.853 6.976 1.00 53.60 C ATOM 308 C GLY A 499 106.093 -5.571 8.404 1.00 60.22 C ATOM 309 O GLY A 499 106.954 -5.291 9.253 1.00 58.26 O ATOM 310 H GLY A 499 105.277 -5.735 5.188 1.00 0.00 H ATOM 311 N LEU A 500 104.759 -5.616 8.653 1.00 59.61 N ATOM 312 CA LEU A 500 104.105 -5.428 9.952 1.00 60.20 C ATOM 313 C LEU A 500 104.600 -6.528 10.914 1.00 71.41 C ATOM 314 O LEU A 500 104.927 -6.257 12.081 1.00 72.21 O ATOM 315 CB LEU A 500 102.578 -5.531 9.719 1.00 58.40 C ATOM 316 CG LEU A 500 101.634 -4.830 10.662 1.00 59.82 C ATOM 317 CD1 LEU A 500 102.055 -3.394 10.944 1.00 59.27 C ATOM 318 CD2 LEU A 500 100.226 -4.863 10.096 1.00 59.08 C ATOM 319 H LEU A 500 104.138 -5.803 7.840 1.00 0.00 H ATOM 320 N ASP A 501 104.660 -7.768 10.390 1.00 71.38 N ATOM 321 CA ASP A 501 105.190 -8.965 11.035 1.00 72.23 C ATOM 322 C ASP A 501 106.624 -9.142 10.475 1.00 80.49 C ATOM 323 O ASP A 501 106.863 -8.773 9.315 1.00 80.66 O ATOM 324 CB ASP A 501 104.318 -10.174 10.661 1.00 73.50 C ATOM 325 H ASP A 501 104.290 -7.884 9.425 1.00 0.00 H ATOM 326 N LYS A 502 107.569 -9.689 11.285 1.00 79.46 N ATOM 327 CA LYS A 502 108.967 -9.913 10.866 1.00 81.06 C ATOM 328 C LYS A 502 109.099 -10.998 9.768 1.00 87.17 C ATOM 329 O LYS A 502 110.105 -11.045 9.061 1.00 87.97 O ATOM 330 CB LYS A 502 109.861 -10.191 12.069 1.00 84.21 C ATOM 331 H LYS A 502 107.293 -9.964 12.249 1.00 0.00 H ATOM 332 N ASP A 503 108.049 -11.828 9.608 1.00 83.84 N ATOM 333 CA ASP A 503 107.875 -12.827 8.556 1.00 84.15 C ATOM 334 C ASP A 503 106.447 -12.564 7.981 1.00 86.62 C ATOM 335 O ASP A 503 105.447 -12.925 8.613 1.00 86.52 O ATOM 336 CB ASP A 503 108.024 -14.256 9.093 1.00 86.51 C ATOM 337 H ASP A 503 107.282 -11.749 10.306 1.00 0.00 H ATOM 338 N LYS A 504 106.340 -11.842 6.851 1.00 80.11 N ATOM 339 CA LYS A 504 107.470 -11.360 6.054 1.00 79.92 C ATOM 340 C LYS A 504 107.671 -9.847 6.189 1.00 81.26 C ATOM 341 O LYS A 504 106.669 -9.126 6.300 1.00 80.54 O ATOM 342 CB LYS A 504 107.231 -11.693 4.559 1.00 81.97 C ATOM 343 CG LYS A 504 108.497 -11.921 3.736 1.00 74.76 C ATOM 344 CD LYS A 504 108.290 -12.990 2.670 1.00 83.96 C ATOM 345 CE LYS A 504 107.899 -12.463 1.308 1.00 81.37 C ATOM 346 NZ LYS A 504 109.063 -12.415 0.379 1.00 77.12 N ATOM 347 HZ1 LYS A 504 109.795 -11.790 0.774 1.00 0.00 H ATOM 348 HZ2 LYS A 504 109.450 -13.373 0.261 1.00 0.00 H ATOM 349 HZ3 LYS A 504 108.754 -12.048 -0.544 1.00 0.00 H ATOM 350 H LYS A 504 105.383 -11.609 6.518 1.00 0.00 H ATOM 351 N PRO A 505 108.920 -9.321 6.046 1.00 75.16 N ATOM 352 CA PRO A 505 109.074 -7.863 5.988 1.00 72.92 C ATOM 353 C PRO A 505 108.702 -7.328 4.583 1.00 70.02 C ATOM 354 O PRO A 505 108.688 -6.114 4.393 1.00 69.92 O ATOM 355 CB PRO A 505 110.551 -7.657 6.325 1.00 76.34 C ATOM 356 CG PRO A 505 111.226 -8.874 5.781 1.00 82.33 C ATOM 357 CD PRO A 505 110.225 -10.002 5.856 1.00 77.51 C ATOM 358 N ASN A 506 108.370 -8.231 3.618 1.00 61.97 N ATOM 359 CA ASN A 506 108.017 -7.911 2.230 1.00 62.33 C ATOM 360 C ASN A 506 106.520 -7.959 1.871 1.00 65.89 C ATOM 361 O ASN A 506 106.156 -7.651 0.737 1.00 66.37 O ATOM 362 CB ASN A 506 108.781 -8.817 1.271 1.00 63.76 C ATOM 363 CG ASN A 506 110.261 -8.565 1.159 1.00 78.29 C ATOM 364 OD1 ASN A 506 110.824 -7.612 1.707 1.00 73.96 O ATOM 365 ND2 ASN A 506 110.921 -9.426 0.422 1.00 71.93 N ATOM 366 HD22 ASN A 506 110.419 -10.219 -0.027 1.00 0.00 H ATOM 367 HD21 ASN A 506 111.946 -9.316 0.286 1.00 0.00 H ATOM 368 H ASN A 506 108.366 -9.235 3.889 1.00 0.00 H ATOM 369 N ARG A 507 105.673 -8.391 2.801 1.00 62.17 N ATOM 370 CA ARG A 507 104.230 -8.497 2.591 1.00 61.14 C ATOM 371 C ARG A 507 103.526 -7.205 3.018 1.00 58.67 C ATOM 372 O ARG A 507 103.874 -6.651 4.062 1.00 56.94 O ATOM 373 CB ARG A 507 103.675 -9.672 3.431 1.00 62.83 C ATOM 374 H ARG A 507 106.058 -8.668 3.727 1.00 0.00 H ATOM 375 N VAL A 508 102.565 -6.726 2.196 1.00 53.93 N ATOM 376 CA VAL A 508 101.703 -5.582 2.514 1.00 51.16 C ATOM 377 C VAL A 508 100.406 -6.068 3.108 1.00 48.87 C ATOM 378 O VAL A 508 99.787 -6.993 2.588 1.00 47.11 O ATOM 379 CB VAL A 508 101.449 -4.482 1.434 1.00 54.95 C ATOM 380 CG1 VAL A 508 102.735 -3.858 0.951 1.00 56.14 C ATOM 381 CG2 VAL A 508 100.582 -4.951 0.272 1.00 55.46 C ATOM 382 H VAL A 508 102.428 -7.199 1.280 1.00 0.00 H ATOM 383 N THR A 509 99.978 -5.410 4.167 1.00 43.30 N ATOM 384 CA THR A 509 98.706 -5.713 4.821 1.00 41.89 C ATOM 385 C THR A 509 97.879 -4.438 4.802 1.00 43.82 C ATOM 386 O THR A 509 98.385 -3.384 5.181 1.00 42.07 O ATOM 387 CB THR A 509 98.929 -6.181 6.282 1.00 49.86 C ATOM 388 OG1 THR A 509 99.913 -7.207 6.314 1.00 52.15 O ATOM 389 CG2 THR A 509 97.643 -6.672 6.954 1.00 46.78 C ATOM 390 HG1 THR A 509 100.764 -6.858 5.948 1.00 0.00 H ATOM 391 H THR A 509 100.568 -4.645 4.552 1.00 0.00 H ATOM 392 N LYS A 510 96.601 -4.536 4.394 1.00 41.08 N ATOM 393 CA LYS A 510 95.678 -3.403 4.454 1.00 40.14 C ATOM 394 C LYS A 510 95.343 -3.204 5.933 1.00 40.38 C ATOM 395 O LYS A 510 95.019 -4.178 6.614 1.00 38.80 O ATOM 396 CB LYS A 510 94.405 -3.686 3.663 1.00 43.18 C ATOM 397 CG LYS A 510 94.597 -3.614 2.160 1.00 49.13 C ATOM 398 CD LYS A 510 93.269 -3.713 1.447 1.00 54.45 C ATOM 399 CE LYS A 510 93.444 -3.541 -0.038 1.00 64.50 C ATOM 400 NZ LYS A 510 93.961 -4.784 -0.674 1.00 77.83 N ATOM 401 HZ1 LYS A 510 94.883 -5.026 -0.259 1.00 0.00 H ATOM 402 HZ2 LYS A 510 93.290 -5.561 -0.509 1.00 0.00 H ATOM 403 HZ3 LYS A 510 94.069 -4.629 -1.697 1.00 0.00 H ATOM 404 H LYS A 510 96.259 -5.446 4.024 1.00 0.00 H ATOM 405 N VAL A 511 95.507 -1.965 6.444 1.00 35.62 N ATOM 406 CA VAL A 511 95.273 -1.618 7.857 1.00 34.47 C ATOM 407 C VAL A 511 94.431 -0.309 7.932 1.00 39.89 C ATOM 408 O VAL A 511 94.285 0.370 6.922 1.00 39.87 O ATOM 409 CB VAL A 511 96.627 -1.482 8.637 1.00 37.09 C ATOM 410 CG1 VAL A 511 97.401 -2.809 8.674 1.00 35.22 C ATOM 411 CG2 VAL A 511 97.502 -0.355 8.053 1.00 37.70 C ATOM 412 H VAL A 511 95.818 -1.209 5.801 1.00 0.00 H ATOM 413 N ALA A 512 93.898 0.031 9.114 1.00 37.08 N ATOM 414 CA ALA A 512 93.166 1.291 9.344 1.00 37.06 C ATOM 415 C ALA A 512 94.102 2.074 10.255 1.00 42.52 C ATOM 416 O ALA A 512 94.725 1.478 11.128 1.00 40.64 O ATOM 417 CB ALA A 512 91.845 1.023 10.070 1.00 36.54 C ATOM 418 H ALA A 512 94.006 -0.628 9.911 1.00 0.00 H ATOM 419 N VAL A 513 94.286 3.372 10.010 1.00 41.20 N ATOM 420 CA VAL A 513 95.214 4.168 10.827 1.00 40.33 C ATOM 421 C VAL A 513 94.464 5.316 11.502 1.00 44.08 C ATOM 422 O VAL A 513 93.889 6.148 10.809 1.00 41.71 O ATOM 423 CB VAL A 513 96.399 4.705 9.966 1.00 44.34 C ATOM 424 CG1 VAL A 513 97.331 5.584 10.789 1.00 44.80 C ATOM 425 CG2 VAL A 513 97.180 3.572 9.308 1.00 43.82 C ATOM 426 H VAL A 513 93.767 3.827 9.232 1.00 0.00 H ATOM 427 N LYS A 514 94.511 5.395 12.844 1.00 42.72 N ATOM 428 CA LYS A 514 93.900 6.527 13.538 1.00 43.30 C ATOM 429 C LYS A 514 94.961 7.600 13.817 1.00 51.61 C ATOM 430 O LYS A 514 96.094 7.299 14.220 1.00 50.49 O ATOM 431 CB LYS A 514 93.152 6.108 14.804 1.00 43.40 C ATOM 432 CG LYS A 514 92.165 7.173 15.280 1.00 46.38 C ATOM 433 CD LYS A 514 91.521 6.808 16.604 1.00 45.60 C ATOM 434 CE LYS A 514 90.033 6.764 16.483 1.00 44.69 C ATOM 435 NZ LYS A 514 89.391 6.369 17.766 1.00 44.23 N ATOM 436 HZ1 LYS A 514 89.727 5.425 18.044 1.00 0.00 H ATOM 437 HZ2 LYS A 514 89.641 7.058 18.504 1.00 0.00 H ATOM 438 HZ3 LYS A 514 88.358 6.349 17.644 1.00 0.00 H ATOM 439 H LYS A 514 94.984 4.647 13.390 1.00 0.00 H ATOM 440 N MET A 515 94.610 8.847 13.504 1.00 51.43 N ATOM 441 CA MET A 515 95.481 9.995 13.703 1.00 52.97 C ATOM 442 C MET A 515 94.641 11.181 14.087 1.00 59.30 C ATOM 443 O MET A 515 93.420 11.136 13.949 1.00 58.03 O ATOM 444 CB MET A 515 96.299 10.292 12.441 1.00 56.43 C ATOM 445 CG MET A 515 95.450 10.730 11.262 1.00 60.63 C ATOM 446 SD MET A 515 96.401 11.120 9.799 1.00 66.06 S ATOM 447 CE MET A 515 96.809 9.470 9.219 1.00 61.50 C ATOM 448 H MET A 515 93.666 9.007 13.097 1.00 0.00 H ATOM 449 N LEU A 516 95.295 12.253 14.535 1.00 60.09 N ATOM 450 CA LEU A 516 94.639 13.490 14.946 1.00 62.46 C ATOM 451 C LEU A 516 94.345 14.423 13.773 1.00 71.89 C ATOM 452 O LEU A 516 95.116 14.482 12.805 1.00 71.70 O ATOM 453 CB LEU A 516 95.515 14.219 15.970 1.00 63.63 C ATOM 454 CG LEU A 516 95.686 13.547 17.327 1.00 67.27 C ATOM 455 CD1 LEU A 516 96.962 13.977 17.971 1.00 68.25 C ATOM 456 CD2 LEU A 516 94.498 13.828 18.235 1.00 70.19 C ATOM 457 H LEU A 516 96.332 12.205 14.595 1.00 0.00 H ATOM 458 N LYS A 517 93.247 15.196 13.896 1.00 72.60 N ATOM 459 CA LYS A 517 92.843 16.216 12.926 1.00 75.26 C ATOM 460 C LYS A 517 93.726 17.477 13.124 1.00 84.46 C ATOM 461 O LYS A 517 94.502 17.530 14.082 1.00 84.18 O ATOM 462 CB LYS A 517 91.344 16.523 13.074 1.00 77.77 C ATOM 463 H LYS A 517 92.648 15.059 14.735 1.00 0.00 H ATOM 464 N SER A 518 93.642 18.464 12.204 1.00 85.45 N ATOM 465 CA SER A 518 94.457 19.696 12.228 1.00 88.06 C ATOM 466 C SER A 518 94.307 20.544 13.507 1.00 93.59 C ATOM 467 O SER A 518 95.315 20.942 14.093 1.00 93.88 O ATOM 468 CB SER A 518 94.194 20.545 10.987 1.00 93.22 C ATOM 469 H SER A 518 92.959 18.348 11.428 1.00 0.00 H ATOM 470 N ASP A 519 93.059 20.784 13.950 1.00 91.09 N ATOM 471 CA ASP A 519 92.748 21.576 15.145 1.00 92.27 C ATOM 472 C ASP A 519 92.674 20.724 16.434 1.00 94.96 C ATOM 473 O ASP A 519 91.854 21.002 17.318 1.00 94.71 O ATOM 474 CB ASP A 519 91.455 22.387 14.921 1.00 95.00 C ATOM 475 H ASP A 519 92.265 20.383 13.411 1.00 0.00 H ATOM 476 N ALA A 520 93.561 19.706 16.548 1.00 90.31 N ATOM 477 CA ALA A 520 93.615 18.785 17.690 1.00 88.16 C ATOM 478 C ALA A 520 94.186 19.409 18.958 1.00 91.89 C ATOM 479 O ALA A 520 95.293 19.968 18.942 1.00 92.52 O ATOM 480 CB ALA A 520 94.387 17.527 17.330 1.00 87.36 C ATOM 481 H ALA A 520 94.247 19.568 15.778 1.00 0.00 H ATOM 482 N THR A 521 93.416 19.294 20.063 1.00 86.91 N ATOM 483 CA THR A 521 93.772 19.807 21.389 1.00 87.22 C ATOM 484 C THR A 521 94.702 18.819 22.117 1.00 89.19 C ATOM 485 O THR A 521 94.917 17.709 21.628 1.00 87.04 O ATOM 486 CB THR A 521 92.504 20.168 22.201 1.00 95.56 C ATOM 487 OG1 THR A 521 91.752 18.988 22.497 1.00 92.70 O ATOM 488 CG2 THR A 521 91.621 21.202 21.498 1.00 94.98 C ATOM 489 HG1 THR A 521 91.481 18.550 21.652 1.00 0.00 H ATOM 490 H THR A 521 92.503 18.805 19.965 1.00 0.00 H ATOM 491 N GLU A 522 95.268 19.232 23.272 1.00 86.36 N ATOM 492 CA GLU A 522 96.157 18.404 24.091 1.00 85.06 C ATOM 493 C GLU A 522 95.412 17.191 24.646 1.00 85.75 C ATOM 494 O GLU A 522 96.005 16.118 24.765 1.00 84.95 O ATOM 495 CB GLU A 522 96.772 19.226 25.231 1.00 88.32 C ATOM 496 H GLU A 522 95.060 20.197 23.600 1.00 0.00 H ATOM 497 N LYS A 523 94.108 17.355 24.958 1.00 80.35 N ATOM 498 CA LYS A 523 93.254 16.286 25.466 1.00 77.72 C ATOM 499 C LYS A 523 92.890 15.312 24.346 1.00 78.67 C ATOM 500 O LYS A 523 92.671 14.132 24.628 1.00 77.52 O ATOM 501 CB LYS A 523 91.994 16.845 26.138 1.00 80.59 C ATOM 502 H LYS A 523 93.688 18.298 24.829 1.00 0.00 H ATOM 503 N ASP A 524 92.824 15.801 23.080 1.00 73.22 N ATOM 504 CA ASP A 524 92.545 14.972 21.900 1.00 70.15 C ATOM 505 C ASP A 524 93.703 13.995 21.726 1.00 70.86 C ATOM 506 O ASP A 524 93.458 12.809 21.505 1.00 69.24 O ATOM 507 CB ASP A 524 92.363 15.822 20.622 1.00 72.75 C ATOM 508 CG ASP A 524 91.009 16.492 20.448 1.00 80.07 C ATOM 509 OD1 ASP A 524 89.973 15.820 20.676 1.00 77.04 O ATOM 510 OD2 ASP A 524 90.980 17.657 19.995 1.00 88.24 O ATOM 511 H ASP A 524 92.980 16.819 22.939 1.00 0.00 H ATOM 512 N LEU A 525 94.961 14.492 21.863 1.00 67.34 N ATOM 513 CA LEU A 525 96.182 13.684 21.795 1.00 65.82 C ATOM 514 C LEU A 525 96.250 12.731 22.984 1.00 68.83 C ATOM 515 O LEU A 525 96.590 11.565 22.802 1.00 67.61 O ATOM 516 CB LEU A 525 97.454 14.562 21.702 1.00 67.06 C ATOM 517 CG LEU A 525 98.840 13.870 21.829 1.00 70.48 C ATOM 518 CD1 LEU A 525 99.060 12.802 20.754 1.00 68.89 C ATOM 519 CD2 LEU A 525 99.963 14.882 21.790 1.00 73.39 C ATOM 520 H LEU A 525 95.064 15.514 22.027 1.00 0.00 H ATOM 521 N SER A 526 95.891 13.214 24.186 1.00 65.90 N ATOM 522 CA SER A 526 95.876 12.397 25.397 1.00 64.71 C ATOM 523 C SER A 526 94.893 11.231 25.262 1.00 65.20 C ATOM 524 O SER A 526 95.213 10.122 25.696 1.00 63.99 O ATOM 525 CB SER A 526 95.532 13.243 26.619 1.00 69.61 C ATOM 526 OG SER A 526 95.329 12.428 27.763 1.00 76.84 O ATOM 527 HG SER A 526 95.108 13.001 28.540 1.00 0.00 H ATOM 528 H SER A 526 95.612 14.213 24.257 1.00 0.00 H ATOM 529 N ASP A 527 93.711 11.480 24.661 1.00 60.02 N ATOM 530 CA ASP A 527 92.689 10.457 24.465 1.00 58.37 C ATOM 531 C ASP A 527 93.149 9.370 23.479 1.00 60.80 C ATOM 532 O ASP A 527 92.926 8.181 23.736 1.00 59.04 O ATOM 533 CB ASP A 527 91.347 11.084 24.040 1.00 60.50 C ATOM 534 CG ASP A 527 90.617 11.881 25.114 1.00 71.13 C ATOM 535 OD1 ASP A 527 90.962 11.733 26.314 1.00 70.54 O ATOM 536 OD2 ASP A 527 89.677 12.624 24.761 1.00 78.19 O ATOM 537 H ASP A 527 93.520 12.444 24.322 1.00 0.00 H ATOM 538 N LEU A 528 93.805 9.779 22.374 1.00 58.25 N ATOM 539 CA LEU A 528 94.342 8.871 21.351 1.00 57.27 C ATOM 540 C LEU A 528 95.375 7.941 21.967 1.00 58.82 C ATOM 541 O LEU A 528 95.290 6.732 21.763 1.00 57.33 O ATOM 542 CB LEU A 528 94.947 9.654 20.158 1.00 58.44 C ATOM 543 CG LEU A 528 95.458 8.831 18.950 1.00 62.12 C ATOM 544 CD1 LEU A 528 94.394 7.876 18.432 1.00 60.96 C ATOM 545 CD2 LEU A 528 95.905 9.741 17.819 1.00 63.60 C ATOM 546 H LEU A 528 93.939 10.801 22.237 1.00 0.00 H ATOM 547 N ILE A 529 96.322 8.506 22.746 1.00 55.70 N ATOM 548 CA ILE A 529 97.363 7.766 23.477 1.00 55.06 C ATOM 549 C ILE A 529 96.699 6.777 24.429 1.00 55.88 C ATOM 550 O ILE A 529 97.048 5.607 24.404 1.00 55.34 O ATOM 551 CB ILE A 529 98.370 8.707 24.219 1.00 59.61 C ATOM 552 CG1 ILE A 529 99.141 9.613 23.218 1.00 61.08 C ATOM 553 CG2 ILE A 529 99.363 7.894 25.086 1.00 59.79 C ATOM 554 CD1 ILE A 529 99.903 10.800 23.836 1.00 68.85 C ATOM 555 H ILE A 529 96.315 9.542 22.836 1.00 0.00 H ATOM 556 N SER A 530 95.725 7.237 25.228 1.00 52.80 N ATOM 557 CA SER A 530 94.988 6.415 26.205 1.00 51.70 C ATOM 558 C SER A 530 94.246 5.238 25.542 1.00 52.11 C ATOM 559 O SER A 530 94.310 4.122 26.058 1.00 49.61 O ATOM 560 CB SER A 530 94.033 7.280 27.025 1.00 56.65 C ATOM 561 OG SER A 530 93.436 6.544 28.081 1.00 69.85 O ATOM 562 HG SER A 530 92.925 5.784 27.704 1.00 0.00 H ATOM 563 H SER A 530 95.472 8.243 25.153 1.00 0.00 H ATOM 564 N GLU A 531 93.619 5.469 24.362 1.00 48.00 N ATOM 565 CA GLU A 531 92.943 4.403 23.622 1.00 46.02 C ATOM 566 C GLU A 531 93.966 3.356 23.168 1.00 48.58 C ATOM 567 O GLU A 531 93.731 2.171 23.380 1.00 48.73 O ATOM 568 CB GLU A 531 92.136 4.963 22.437 1.00 47.15 C ATOM 569 CG GLU A 531 91.345 3.917 21.665 1.00 55.30 C ATOM 570 CD GLU A 531 90.531 4.423 20.487 1.00 70.82 C ATOM 571 OE1 GLU A 531 90.892 5.480 19.921 1.00 50.61 O ATOM 572 OE2 GLU A 531 89.563 3.729 20.093 1.00 65.32 O ATOM 573 H GLU A 531 93.619 6.433 23.971 1.00 0.00 H ATOM 574 N MET A 532 95.102 3.790 22.588 1.00 44.13 N ATOM 575 CA MET A 532 96.181 2.896 22.144 1.00 43.65 C ATOM 576 C MET A 532 96.726 2.075 23.347 1.00 48.93 C ATOM 577 O MET A 532 96.909 0.855 23.256 1.00 47.98 O ATOM 578 CB MET A 532 97.308 3.711 21.496 1.00 46.26 C ATOM 579 CG MET A 532 98.600 2.909 21.303 1.00 49.68 C ATOM 580 SD MET A 532 99.912 3.786 20.461 1.00 55.14 S ATOM 581 CE MET A 532 100.404 4.967 21.712 1.00 53.02 C ATOM 582 H MET A 532 95.222 4.813 22.447 1.00 0.00 H ATOM 583 N GLU A 533 96.995 2.767 24.459 1.00 46.86 N ATOM 584 CA GLU A 533 97.469 2.157 25.707 1.00 46.79 C ATOM 585 C GLU A 533 96.515 1.098 26.223 1.00 48.17 C ATOM 586 O GLU A 533 96.961 0.011 26.578 1.00 47.22 O ATOM 587 CB GLU A 533 97.764 3.230 26.771 1.00 48.68 C ATOM 588 CG GLU A 533 99.000 4.044 26.408 1.00 53.12 C ATOM 589 CD GLU A 533 100.227 3.201 26.123 1.00 62.75 C ATOM 590 OE1 GLU A 533 100.589 2.372 26.988 1.00 66.15 O ATOM 591 OE2 GLU A 533 100.805 3.341 25.023 1.00 54.35 O ATOM 592 H GLU A 533 96.860 3.798 24.438 1.00 0.00 H ATOM 593 N MET A 534 95.209 1.392 26.187 1.00 44.65 N ATOM 594 CA MET A 534 94.146 0.482 26.594 1.00 45.88 C ATOM 595 C MET A 534 94.132 -0.799 25.703 1.00 44.30 C ATOM 596 O MET A 534 94.044 -1.917 26.213 1.00 41.65 O ATOM 597 CB MET A 534 92.787 1.220 26.579 1.00 50.02 C ATOM 598 CG MET A 534 91.664 0.439 27.215 1.00 57.72 C ATOM 599 SD MET A 534 91.429 0.736 28.996 1.00 67.10 S ATOM 600 CE MET A 534 93.000 0.164 29.689 1.00 64.53 C ATOM 601 H MET A 534 94.934 2.335 25.845 1.00 0.00 H ATOM 602 N MET A 535 94.254 -0.622 24.381 1.00 39.04 N ATOM 603 CA MET A 535 94.302 -1.733 23.426 1.00 37.73 C ATOM 604 C MET A 535 95.511 -2.657 23.695 1.00 39.89 C ATOM 605 O MET A 535 95.336 -3.870 23.674 1.00 40.15 O ATOM 606 CB MET A 535 94.315 -1.186 21.993 1.00 39.64 C ATOM 607 CG MET A 535 92.993 -0.520 21.637 1.00 42.08 C ATOM 608 SD MET A 535 92.991 0.181 19.990 1.00 44.95 S ATOM 609 CE MET A 535 93.016 -1.304 19.036 1.00 41.01 C ATOM 610 H MET A 535 94.318 0.349 24.015 1.00 0.00 H ATOM 611 N LYS A 536 96.696 -2.094 23.999 1.00 35.94 N ATOM 612 CA LYS A 536 97.892 -2.894 24.383 1.00 37.47 C ATOM 613 C LYS A 536 97.602 -3.777 25.622 1.00 44.11 C ATOM 614 O LYS A 536 97.949 -4.944 25.626 1.00 47.07 O ATOM 615 CB LYS A 536 99.082 -1.998 24.738 1.00 39.15 C ATOM 616 CG LYS A 536 99.650 -1.200 23.608 1.00 38.25 C ATOM 617 CD LYS A 536 100.849 -0.393 24.074 1.00 36.98 C ATOM 618 CE LYS A 536 101.218 0.600 23.002 1.00 46.84 C ATOM 619 NZ LYS A 536 102.406 1.399 23.362 1.00 43.75 N ATOM 620 HZ1 LYS A 536 102.215 1.926 24.238 1.00 0.00 H ATOM 621 HZ2 LYS A 536 103.218 0.765 23.507 1.00 0.00 H ATOM 622 HZ3 LYS A 536 102.619 2.067 22.594 1.00 0.00 H ATOM 623 H LYS A 536 96.779 -1.058 23.964 1.00 0.00 H ATOM 624 N MET A 537 96.965 -3.208 26.656 1.00 40.09 N ATOM 625 CA MET A 537 96.649 -3.897 27.905 1.00 39.47 C ATOM 626 C MET A 537 95.597 -5.004 27.735 1.00 43.23 C ATOM 627 O MET A 537 95.731 -6.058 28.352 1.00 43.07 O ATOM 628 CB MET A 537 96.181 -2.879 28.948 1.00 41.97 C ATOM 629 CG MET A 537 96.877 -3.020 30.274 1.00 46.58 C ATOM 630 SD MET A 537 98.466 -2.170 30.340 1.00 51.48 S ATOM 631 CE MET A 537 98.878 -2.425 32.093 1.00 49.24 C ATOM 632 H MET A 537 96.678 -2.213 26.563 1.00 0.00 H ATOM 633 N ILE A 538 94.548 -4.764 26.916 1.00 39.12 N ATOM 634 CA ILE A 538 93.434 -5.734 26.692 1.00 37.35 C ATOM 635 C ILE A 538 93.873 -7.026 25.964 1.00 40.00 C ATOM 636 O ILE A 538 93.329 -8.093 26.224 1.00 38.04 O ATOM 637 CB ILE A 538 92.251 -5.008 25.994 1.00 39.48 C ATOM 638 CG1 ILE A 538 91.495 -4.162 27.050 1.00 40.33 C ATOM 639 CG2 ILE A 538 91.286 -5.981 25.278 1.00 37.74 C ATOM 640 CD1 ILE A 538 90.715 -2.968 26.506 1.00 53.43 C ATOM 641 H ILE A 538 94.515 -3.854 26.414 1.00 0.00 H ATOM 642 N GLY A 539 94.845 -6.926 25.070 1.00 39.57 N ATOM 643 CA GLY A 539 95.301 -8.101 24.351 1.00 39.42 C ATOM 644 C GLY A 539 94.437 -8.446 23.152 1.00 42.22 C ATOM 645 O GLY A 539 93.462 -7.746 22.832 1.00 40.27 O ATOM 646 H GLY A 539 95.283 -6.002 24.883 1.00 0.00 H ATOM 647 N LYS A 540 94.803 -9.563 22.501 1.00 38.55 N ATOM 648 CA LYS A 540 94.269 -10.048 21.228 1.00 38.12 C ATOM 649 C LYS A 540 93.072 -10.974 21.297 1.00 38.38 C ATOM 650 O LYS A 540 93.059 -11.942 22.058 1.00 38.28 O ATOM 651 CB LYS A 540 95.385 -10.742 20.430 1.00 40.12 C ATOM 652 CG LYS A 540 96.052 -9.838 19.416 1.00 59.58 C ATOM 653 CD LYS A 540 97.588 -9.931 19.490 1.00 73.66 C ATOM 654 CE LYS A 540 98.315 -9.633 18.187 1.00 83.24 C ATOM 655 NZ LYS A 540 98.218 -8.207 17.756 1.00 87.81 N ATOM 656 HZ1 LYS A 540 97.219 -7.955 17.617 1.00 0.00 H ATOM 657 HZ2 LYS A 540 98.632 -7.596 18.488 1.00 0.00 H ATOM 658 HZ3 LYS A 540 98.736 -8.080 16.863 1.00 0.00 H ATOM 659 H LYS A 540 95.542 -10.142 22.948 1.00 0.00 H ATOM 660 N HIS A 541 92.129 -10.736 20.403 1.00 33.14 N ATOM 661 CA HIS A 541 90.962 -11.591 20.218 1.00 32.44 C ATOM 662 C HIS A 541 90.476 -11.468 18.814 1.00 38.21 C ATOM 663 O HIS A 541 90.504 -10.376 18.265 1.00 37.62 O ATOM 664 CB HIS A 541 89.843 -11.294 21.211 1.00 31.58 C ATOM 665 CG HIS A 541 88.843 -12.403 21.284 1.00 34.75 C ATOM 666 ND1 HIS A 541 87.732 -12.416 20.461 1.00 35.70 N ATOM 667 CD2 HIS A 541 88.889 -13.569 21.976 1.00 37.03 C ATOM 668 CE1 HIS A 541 87.111 -13.561 20.698 1.00 35.79 C ATOM 669 NE2 HIS A 541 87.756 -14.282 21.620 1.00 37.06 N ATOM 670 H HIS A 541 92.224 -9.895 19.799 1.00 0.00 H ATOM 671 N LYS A 542 90.021 -12.584 18.215 1.00 35.62 N ATOM 672 CA LYS A 542 89.469 -12.588 16.857 1.00 35.66 C ATOM 673 C LYS A 542 88.262 -11.630 16.736 1.00 38.18 C ATOM 674 O LYS A 542 88.074 -11.061 15.659 1.00 37.35 O ATOM 675 CB LYS A 542 89.058 -14.039 16.475 1.00 39.07 C ATOM 676 CG LYS A 542 88.275 -14.247 15.169 1.00 54.32 C ATOM 677 CD LYS A 542 89.140 -14.510 13.929 1.00 66.36 C ATOM 678 H LYS A 542 90.063 -13.482 18.738 1.00 0.00 H ATOM 679 N ASN A 543 87.447 -11.439 17.813 1.00 32.70 N ATOM 680 CA ASN A 543 86.228 -10.653 17.634 1.00 33.29 C ATOM 681 C ASN A 543 86.269 -9.245 18.201 1.00 35.78 C ATOM 682 O ASN A 543 85.233 -8.694 18.603 1.00 34.10 O ATOM 683 CB ASN A 543 84.991 -11.409 18.115 1.00 35.57 C ATOM 684 CG ASN A 543 84.796 -12.712 17.388 1.00 38.45 C ATOM 685 OD1 ASN A 543 84.935 -13.761 17.972 1.00 35.38 O ATOM 686 ND2 ASN A 543 84.645 -12.685 16.063 1.00 29.70 N ATOM 687 HD22 ASN A 543 84.526 -11.776 15.572 1.00 0.00 H ATOM 688 HD21 ASN A 543 84.646 -13.573 15.521 1.00 0.00 H ATOM 689 H ASN A 543 87.688 -11.844 18.740 1.00 0.00 H ATOM 690 N ILE A 544 87.449 -8.629 18.130 1.00 31.90 N ATOM 691 CA ILE A 544 87.666 -7.217 18.469 1.00 31.63 C ATOM 692 C ILE A 544 88.616 -6.632 17.415 1.00 34.43 C ATOM 693 O ILE A 544 89.371 -7.384 16.805 1.00 32.88 O ATOM 694 CB ILE A 544 88.204 -6.985 19.911 1.00 33.76 C ATOM 695 CG1 ILE A 544 89.671 -7.511 20.061 1.00 33.67 C ATOM 696 CG2 ILE A 544 87.269 -7.600 20.950 1.00 33.61 C ATOM 697 CD1 ILE A 544 90.332 -7.303 21.454 1.00 27.75 C ATOM 698 H ILE A 544 88.269 -9.185 17.814 1.00 0.00 H ATOM 699 N ILE A 545 88.595 -5.311 17.213 1.00 32.11 N ATOM 700 CA ILE A 545 89.538 -4.655 16.293 1.00 32.74 C ATOM 701 C ILE A 545 90.832 -4.660 17.065 1.00 38.00 C ATOM 702 O ILE A 545 90.870 -4.163 18.206 1.00 36.14 O ATOM 703 CB ILE A 545 89.062 -3.217 15.910 1.00 35.79 C ATOM 704 CG1 ILE A 545 87.827 -3.268 14.969 1.00 35.36 C ATOM 705 CG2 ILE A 545 90.195 -2.362 15.291 1.00 35.24 C ATOM 706 CD1 ILE A 545 88.148 -3.821 13.511 1.00 37.17 C ATOM 707 H ILE A 545 87.895 -4.732 17.719 1.00 0.00 H ATOM 708 N ASN A 546 91.838 -5.388 16.541 1.00 36.73 N ATOM 709 CA ASN A 546 93.108 -5.535 17.261 1.00 35.93 C ATOM 710 C ASN A 546 94.115 -4.474 16.880 1.00 37.68 C ATOM 711 O ASN A 546 94.101 -4.021 15.752 1.00 36.53 O ATOM 712 CB ASN A 546 93.720 -6.932 17.055 1.00 35.83 C ATOM 713 CG ASN A 546 92.904 -8.026 17.669 1.00 42.79 C ATOM 714 OD1 ASN A 546 92.876 -8.199 18.873 1.00 40.01 O ATOM 715 ND2 ASN A 546 92.153 -8.735 16.864 1.00 31.84 N ATOM 716 HD22 ASN A 546 92.192 -8.571 15.838 1.00 0.00 H ATOM 717 HD21 ASN A 546 91.518 -9.462 17.251 1.00 0.00 H ATOM 718 H ASN A 546 91.713 -5.850 15.618 1.00 0.00 H ATOM 719 N LEU A 547 94.986 -4.087 17.827 1.00 35.17 N ATOM 720 CA LEU A 547 96.109 -3.166 17.603 1.00 35.36 C ATOM 721 C LEU A 547 97.165 -3.957 16.831 1.00 36.86 C ATOM 722 O LEU A 547 97.447 -5.102 17.189 1.00 36.35 O ATOM 723 CB LEU A 547 96.720 -2.707 18.964 1.00 35.29 C ATOM 724 CG LEU A 547 97.869 -1.680 18.879 1.00 39.65 C ATOM 725 CD1 LEU A 547 97.348 -0.308 18.473 1.00 40.14 C ATOM 726 CD2 LEU A 547 98.556 -1.534 20.213 1.00 40.20 C ATOM 727 H LEU A 547 94.856 -4.466 18.787 1.00 0.00 H ATOM 728 N LEU A 548 97.773 -3.340 15.816 1.00 33.93 N ATOM 729 CA LEU A 548 98.817 -3.966 14.993 1.00 33.38 C ATOM 730 C LEU A 548 100.163 -3.255 15.076 1.00 38.14 C ATOM 731 O LEU A 548 101.187 -3.843 14.722 1.00 37.37 O ATOM 732 CB LEU A 548 98.379 -4.043 13.500 1.00 32.47 C ATOM 733 CG LEU A 548 97.074 -4.795 13.199 1.00 35.30 C ATOM 734 CD1 LEU A 548 96.724 -4.658 11.759 1.00 35.25 C ATOM 735 CD2 LEU A 548 97.140 -6.268 13.618 1.00 33.62 C ATOM 736 H LEU A 548 97.493 -2.363 15.595 1.00 0.00 H ATOM 737 N GLY A 549 100.162 -1.990 15.479 1.00 34.46 N ATOM 738 CA GLY A 549 101.412 -1.229 15.508 1.00 34.53 C ATOM 739 C GLY A 549 101.191 0.243 15.735 1.00 38.38 C ATOM 740 O GLY A 549 100.055 0.667 15.867 1.00 38.56 O ATOM 741 H GLY A 549 99.272 -1.539 15.774 1.00 0.00 H ATOM 742 N ALA A 550 102.265 1.042 15.784 1.00 37.91 N ATOM 743 CA ALA A 550 102.136 2.488 16.003 1.00 39.35 C ATOM 744 C ALA A 550 103.364 3.194 15.489 1.00 44.66 C ATOM 745 O ALA A 550 104.446 2.619 15.534 1.00 44.07 O ATOM 746 CB ALA A 550 101.969 2.783 17.513 1.00 40.09 C ATOM 747 H ALA A 550 103.212 0.629 15.664 1.00 0.00 H ATOM 748 N CYS A 551 103.181 4.421 14.956 1.00 43.44 N ATOM 749 CA CYS A 551 104.232 5.339 14.502 1.00 44.82 C ATOM 750 C CYS A 551 104.123 6.474 15.498 1.00 50.03 C ATOM 751 O CYS A 551 103.139 7.223 15.474 1.00 50.02 O ATOM 752 CB CYS A 551 103.973 5.816 13.073 1.00 46.15 C ATOM 753 SG CYS A 551 104.065 4.508 11.829 1.00 50.13 S ATOM 754 H CYS A 551 102.199 4.748 14.858 1.00 0.00 H ATOM 755 N THR A 552 105.042 6.504 16.470 1.00 49.28 N ATOM 756 CA THR A 552 105.005 7.448 17.601 1.00 50.61 C ATOM 757 C THR A 552 106.166 8.452 17.584 1.00 58.27 C ATOM 758 O THR A 552 106.054 9.534 18.169 1.00 59.82 O ATOM 759 CB THR A 552 104.966 6.698 18.978 1.00 52.15 C ATOM 760 OG1 THR A 552 106.237 6.149 19.280 1.00 51.14 O ATOM 761 CG2 THR A 552 103.938 5.587 19.041 1.00 50.72 C ATOM 762 HG1 THR A 552 106.495 5.508 18.571 1.00 0.00 H ATOM 763 H THR A 552 105.827 5.823 16.425 1.00 0.00 H ATOM 764 N GLN A 553 107.279 8.070 16.947 1.00 55.19 N ATOM 765 CA GLN A 553 108.517 8.834 16.894 1.00 56.52 C ATOM 766 C GLN A 553 108.693 9.662 15.621 1.00 64.44 C ATOM 767 O GLN A 553 108.396 9.172 14.532 1.00 63.57 O ATOM 768 CB GLN A 553 109.710 7.868 17.032 1.00 57.67 C ATOM 769 CG GLN A 553 109.705 7.005 18.301 1.00 60.22 C ATOM 770 CD GLN A 553 109.594 7.824 19.555 1.00 73.27 C ATOM 771 OE1 GLN A 553 110.461 8.643 19.866 1.00 69.75 O ATOM 772 NE2 GLN A 553 108.502 7.651 20.279 1.00 64.90 N ATOM 773 HE22 GLN A 553 107.790 6.951 19.988 1.00 0.00 H ATOM 774 HE21 GLN A 553 108.354 8.215 21.140 1.00 0.00 H ATOM 775 H GLN A 553 107.258 7.156 16.451 1.00 0.00 H ATOM 776 N ASP A 554 109.243 10.902 15.766 1.00 63.66 N ATOM 777 CA ASP A 554 109.613 11.826 14.680 1.00 65.08 C ATOM 778 C ASP A 554 108.474 12.155 13.700 1.00 69.41 C ATOM 779 O ASP A 554 108.632 12.047 12.482 1.00 68.83 O ATOM 780 CB ASP A 554 110.848 11.287 13.927 1.00 68.06 C ATOM 781 CG ASP A 554 112.023 10.843 14.792 1.00 82.13 C ATOM 782 OD1 ASP A 554 112.021 11.145 16.014 1.00 82.21 O ATOM 783 OD2 ASP A 554 112.950 10.211 14.245 1.00 91.09 O ATOM 784 H ASP A 554 109.418 11.227 16.738 1.00 0.00 H ATOM 785 N GLY A 555 107.336 12.552 14.251 1.00 66.67 N ATOM 786 CA GLY A 555 106.159 12.890 13.466 1.00 65.91 C ATOM 787 C GLY A 555 104.860 12.702 14.212 1.00 68.12 C ATOM 788 O GLY A 555 104.870 12.377 15.405 1.00 66.54 O ATOM 789 H GLY A 555 107.282 12.625 15.287 1.00 0.00 H ATOM 790 N PRO A 556 103.711 12.892 13.525 1.00 65.37 N ATOM 791 CA PRO A 556 102.415 12.733 14.208 1.00 64.24 C ATOM 792 C PRO A 556 102.161 11.298 14.649 1.00 66.32 C ATOM 793 O PRO A 556 102.652 10.362 14.014 1.00 66.71 O ATOM 794 CB PRO A 556 101.397 13.173 13.153 1.00 66.34 C ATOM 795 CG PRO A 556 102.087 12.966 11.846 1.00 71.86 C ATOM 796 CD PRO A 556 103.531 13.274 12.108 1.00 68.38 C ATOM 797 N LEU A 557 101.402 11.126 15.732 1.00 59.93 N ATOM 798 CA LEU A 557 101.083 9.797 16.223 1.00 56.54 C ATOM 799 C LEU A 557 100.063 9.112 15.321 1.00 58.63 C ATOM 800 O LEU A 557 99.018 9.689 15.015 1.00 59.04 O ATOM 801 CB LEU A 557 100.621 9.841 17.694 1.00 55.33 C ATOM 802 CG LEU A 557 99.971 8.592 18.279 1.00 55.43 C ATOM 803 CD1 LEU A 557 100.971 7.496 18.503 1.00 52.90 C ATOM 804 CD2 LEU A 557 99.249 8.925 19.538 1.00 55.67 C ATOM 805 H LEU A 557 101.032 11.958 16.234 1.00 0.00 H ATOM 806 N TYR A 558 100.405 7.890 14.872 1.00 52.71 N ATOM 807 CA TYR A 558 99.572 7.025 14.032 1.00 49.47 C ATOM 808 C TYR A 558 99.290 5.733 14.797 1.00 47.87 C ATOM 809 O TYR A 558 100.226 5.068 15.222 1.00 47.58 O ATOM 810 CB TYR A 558 100.278 6.712 12.702 1.00 50.62 C ATOM 811 CG TYR A 558 100.466 7.896 11.774 1.00 54.20 C ATOM 812 CD1 TYR A 558 99.625 9.006 11.842 1.00 57.10 C ATOM 813 CD2 TYR A 558 101.444 7.882 10.787 1.00 55.06 C ATOM 814 CE1 TYR A 558 99.809 10.104 11.004 1.00 60.40 C ATOM 815 CE2 TYR A 558 101.605 8.956 9.911 1.00 57.39 C ATOM 816 CZ TYR A 558 100.783 10.063 10.020 1.00 65.56 C ATOM 817 OH TYR A 558 100.945 11.126 9.161 1.00 70.50 O ATOM 818 HH TYR A 558 100.280 11.827 9.376 1.00 0.00 H ATOM 819 H TYR A 558 101.341 7.528 15.145 1.00 0.00 H ATOM 820 N VAL A 559 98.014 5.404 15.022 1.00 42.14 N ATOM 821 CA VAL A 559 97.645 4.174 15.742 1.00 40.66 C ATOM 822 C VAL A 559 97.124 3.204 14.692 1.00 41.47 C ATOM 823 O VAL A 559 96.143 3.503 14.021 1.00 38.47 O ATOM 824 CB VAL A 559 96.646 4.408 16.912 1.00 44.17 C ATOM 825 CG1 VAL A 559 96.273 3.089 17.584 1.00 42.28 C ATOM 826 CG2 VAL A 559 97.219 5.395 17.939 1.00 44.95 C ATOM 827 H VAL A 559 97.261 6.034 14.679 1.00 0.00 H ATOM 828 N ILE A 560 97.831 2.067 14.508 1.00 37.89 N ATOM 829 CA ILE A 560 97.529 1.090 13.459 1.00 35.22 C ATOM 830 C ILE A 560 96.708 -0.056 13.969 1.00 37.23 C ATOM 831 O ILE A 560 97.123 -0.731 14.901 1.00 35.33 O ATOM 832 CB ILE A 560 98.838 0.604 12.761 1.00 36.88 C ATOM 833 CG1 ILE A 560 99.727 1.792 12.374 1.00 37.07 C ATOM 834 CG2 ILE A 560 98.490 -0.280 11.567 1.00 33.68 C ATOM 835 CD1 ILE A 560 101.239 1.456 12.101 1.00 36.93 C ATOM 836 H ILE A 560 98.631 1.876 15.144 1.00 0.00 H ATOM 837 N VAL A 561 95.557 -0.314 13.325 1.00 34.44 N ATOM 838 CA VAL A 561 94.639 -1.358 13.782 1.00 32.97 C ATOM 839 C VAL A 561 94.163 -2.180 12.605 1.00 36.52 C ATOM 840 O VAL A 561 94.361 -1.783 11.457 1.00 37.37 O ATOM 841 CB VAL A 561 93.419 -0.746 14.571 1.00 36.08 C ATOM 842 CG1 VAL A 561 93.878 0.098 15.751 1.00 35.98 C ATOM 843 CG2 VAL A 561 92.512 0.088 13.649 1.00 34.88 C ATOM 844 H VAL A 561 95.313 0.242 12.481 1.00 0.00 H ATOM 845 N GLU A 562 93.495 -3.314 12.878 1.00 32.08 N ATOM 846 CA GLU A 562 92.945 -4.128 11.793 1.00 32.27 C ATOM 847 C GLU A 562 91.928 -3.383 10.933 1.00 37.45 C ATOM 848 O GLU A 562 91.181 -2.518 11.434 1.00 35.44 O ATOM 849 CB GLU A 562 92.315 -5.393 12.339 1.00 33.22 C ATOM 850 CG GLU A 562 93.314 -6.349 12.947 1.00 34.89 C ATOM 851 CD GLU A 562 92.661 -7.508 13.671 1.00 47.29 C ATOM 852 OE1 GLU A 562 91.665 -7.286 14.400 1.00 39.73 O ATOM 853 OE2 GLU A 562 93.171 -8.642 13.532 1.00 37.09 O ATOM 854 H GLU A 562 93.368 -3.615 13.865 1.00 0.00 H ATOM 855 N TYR A 563 91.916 -3.728 9.619 1.00 34.88 N ATOM 856 CA TYR A 563 90.991 -3.188 8.645 1.00 33.66 C ATOM 857 C TYR A 563 89.796 -4.098 8.494 1.00 38.76 C ATOM 858 O TYR A 563 89.960 -5.300 8.335 1.00 37.55 O ATOM 859 CB TYR A 563 91.662 -2.988 7.268 1.00 35.04 C ATOM 860 CG TYR A 563 90.756 -2.392 6.208 1.00 37.44 C ATOM 861 CD1 TYR A 563 90.098 -1.183 6.422 1.00 39.41 C ATOM 862 CD2 TYR A 563 90.605 -3.004 4.969 1.00 39.19 C ATOM 863 CE1 TYR A 563 89.262 -0.626 5.450 1.00 40.54 C ATOM 864 CE2 TYR A 563 89.808 -2.433 3.969 1.00 41.65 C ATOM 865 CZ TYR A 563 89.125 -1.252 4.220 1.00 51.57 C ATOM 866 OH TYR A 563 88.347 -0.676 3.235 1.00 55.16 O ATOM 867 HH TYR A 563 88.914 -0.461 2.452 1.00 0.00 H ATOM 868 H TYR A 563 92.616 -4.424 9.292 1.00 0.00 H ATOM 869 N ALA A 564 88.588 -3.500 8.461 1.00 38.37 N ATOM 870 CA ALA A 564 87.318 -4.210 8.248 1.00 38.14 C ATOM 871 C ALA A 564 86.723 -3.681 6.934 1.00 42.81 C ATOM 872 O ALA A 564 86.091 -2.619 6.906 1.00 43.13 O ATOM 873 CB ALA A 564 86.390 -3.961 9.423 1.00 37.65 C ATOM 874 H ALA A 564 88.552 -2.469 8.595 1.00 0.00 H ATOM 875 N SER A 565 87.022 -4.372 5.820 1.00 40.43 N ATOM 876 CA SER A 565 86.603 -3.917 4.488 1.00 40.74 C ATOM 877 C SER A 565 85.090 -3.789 4.286 1.00 46.52 C ATOM 878 O SER A 565 84.672 -3.014 3.425 1.00 46.68 O ATOM 879 CB SER A 565 87.194 -4.802 3.402 1.00 40.40 C ATOM 880 OG SER A 565 86.584 -6.078 3.487 1.00 48.31 O ATOM 881 HG SER A 565 86.958 -6.668 2.786 1.00 0.00 H ATOM 882 H SER A 565 87.566 -5.254 5.904 1.00 0.00 H ATOM 883 N LYS A 566 84.269 -4.531 5.072 1.00 41.93 N ATOM 884 CA LYS A 566 82.812 -4.463 4.894 1.00 40.14 C ATOM 885 C LYS A 566 82.108 -3.435 5.806 1.00 43.41 C ATOM 886 O LYS A 566 80.881 -3.384 5.808 1.00 43.49 O ATOM 887 CB LYS A 566 82.179 -5.851 4.983 1.00 39.29 C ATOM 888 CG LYS A 566 82.704 -6.746 3.864 1.00 38.93 C ATOM 889 CD LYS A 566 82.005 -8.076 3.742 1.00 48.19 C ATOM 890 CE LYS A 566 82.535 -8.823 2.542 1.00 53.47 C ATOM 891 NZ LYS A 566 82.180 -10.259 2.589 1.00 48.78 N ATOM 892 HZ1 LYS A 566 82.585 -10.687 3.446 1.00 0.00 H ATOM 893 HZ2 LYS A 566 81.145 -10.359 2.606 1.00 0.00 H ATOM 894 HZ3 LYS A 566 82.562 -10.737 1.748 1.00 0.00 H ATOM 895 H LYS A 566 84.673 -5.150 5.803 1.00 0.00 H ATOM 896 N GLY A 567 82.876 -2.557 6.462 1.00 39.53 N ATOM 897 CA GLY A 567 82.338 -1.484 7.300 1.00 38.85 C ATOM 898 C GLY A 567 81.675 -1.917 8.597 1.00 40.31 C ATOM 899 O GLY A 567 81.947 -3.002 9.103 1.00 39.66 O ATOM 900 H GLY A 567 83.909 -2.641 6.372 1.00 0.00 H ATOM 901 N ASN A 568 80.815 -1.064 9.175 1.00 36.56 N ATOM 902 CA ASN A 568 80.156 -1.430 10.422 1.00 35.95 C ATOM 903 C ASN A 568 78.992 -2.428 10.193 1.00 37.49 C ATOM 904 O ASN A 568 78.516 -2.550 9.083 1.00 36.94 O ATOM 905 CB ASN A 568 79.756 -0.198 11.264 1.00 36.53 C ATOM 906 CG ASN A 568 78.627 0.648 10.763 1.00 42.25 C ATOM 907 OD1 ASN A 568 77.540 0.164 10.442 1.00 38.47 O ATOM 908 ND2 ASN A 568 78.794 1.953 10.876 1.00 36.08 N ATOM 909 HD22 ASN A 568 79.721 2.337 11.148 1.00 0.00 H ATOM 910 HD21 ASN A 568 77.998 2.597 10.693 1.00 0.00 H ATOM 911 H ASN A 568 80.619 -0.143 8.733 1.00 0.00 H ATOM 912 N LEU A 569 78.580 -3.162 11.240 1.00 34.59 N ATOM 913 CA LEU A 569 77.540 -4.190 11.175 1.00 33.47 C ATOM 914 C LEU A 569 76.183 -3.641 10.681 1.00 39.60 C ATOM 915 O LEU A 569 75.477 -4.332 9.947 1.00 39.70 O ATOM 916 CB LEU A 569 77.424 -4.880 12.552 1.00 31.22 C ATOM 917 CG LEU A 569 76.392 -6.005 12.725 1.00 33.54 C ATOM 918 CD1 LEU A 569 76.521 -7.088 11.659 1.00 32.48 C ATOM 919 CD2 LEU A 569 76.440 -6.574 14.130 1.00 32.28 C ATOM 920 H LEU A 569 79.031 -2.988 12.161 1.00 0.00 H ATOM 921 N ARG A 570 75.840 -2.401 11.069 1.00 36.67 N ATOM 922 CA ARG A 570 74.588 -1.734 10.664 1.00 37.03 C ATOM 923 C ARG A 570 74.573 -1.582 9.122 1.00 43.56 C ATOM 924 O ARG A 570 73.610 -1.998 8.483 1.00 45.31 O ATOM 925 CB ARG A 570 74.496 -0.362 11.349 1.00 36.47 C ATOM 926 CG ARG A 570 73.098 0.244 11.361 1.00 48.09 C ATOM 927 CD ARG A 570 72.880 1.379 10.386 1.00 46.92 C ATOM 928 NE ARG A 570 74.017 2.300 10.309 1.00 58.56 N ATOM 929 CZ ARG A 570 74.407 2.916 9.196 1.00 74.63 C ATOM 930 NH1 ARG A 570 73.740 2.736 8.060 1.00 60.54 N ATOM 931 NH2 ARG A 570 75.463 3.716 9.209 1.00 62.81 N ATOM 932 HE ARG A 570 74.554 2.484 11.181 1.00 0.00 H ATOM 933 HH12 ARG A 570 74.049 3.220 7.193 1.00 0.00 H ATOM 934 HH11 ARG A 570 72.909 2.111 8.038 1.00 0.00 H ATOM 935 HH22 ARG A 570 75.763 4.195 8.336 1.00 0.00 H ATOM 936 HH21 ARG A 570 75.992 3.865 10.092 1.00 0.00 H ATOM 937 H ARG A 570 76.494 -1.882 11.690 1.00 0.00 H ATOM 938 N GLU A 571 75.666 -1.060 8.535 1.00 39.89 N ATOM 939 CA GLU A 571 75.816 -0.901 7.075 1.00 41.83 C ATOM 940 C GLU A 571 75.792 -2.266 6.372 1.00 45.67 C ATOM 941 O GLU A 571 75.126 -2.437 5.352 1.00 47.27 O ATOM 942 CB GLU A 571 77.151 -0.213 6.751 1.00 43.53 C ATOM 943 CG GLU A 571 77.296 1.183 7.318 1.00 51.40 C ATOM 944 CD GLU A 571 78.679 1.789 7.193 1.00 64.78 C ATOM 945 OE1 GLU A 571 79.687 1.069 7.389 1.00 50.72 O ATOM 946 OE2 GLU A 571 78.745 3.014 6.942 1.00 60.81 O ATOM 947 H GLU A 571 76.450 -0.751 9.145 1.00 0.00 H ATOM 948 N TYR A 572 76.524 -3.232 6.934 1.00 41.44 N ATOM 949 CA TYR A 572 76.657 -4.582 6.403 1.00 41.32 C ATOM 950 C TYR A 572 75.285 -5.255 6.297 1.00 44.17 C ATOM 951 O TYR A 572 74.970 -5.796 5.244 1.00 44.81 O ATOM 952 CB TYR A 572 77.645 -5.368 7.282 1.00 41.33 C ATOM 953 CG TYR A 572 77.719 -6.852 7.009 1.00 41.10 C ATOM 954 CD1 TYR A 572 78.625 -7.364 6.084 1.00 42.91 C ATOM 955 CD2 TYR A 572 76.974 -7.755 7.762 1.00 40.64 C ATOM 956 CE1 TYR A 572 78.730 -8.736 5.858 1.00 44.63 C ATOM 957 CE2 TYR A 572 77.068 -9.126 7.543 1.00 42.26 C ATOM 958 CZ TYR A 572 77.943 -9.613 6.583 1.00 48.33 C ATOM 959 OH TYR A 572 78.030 -10.964 6.349 1.00 48.75 O ATOM 960 HH TYR A 572 78.308 -11.424 7.180 1.00 0.00 H ATOM 961 H TYR A 572 77.034 -3.004 7.811 1.00 0.00 H ATOM 962 N LEU A 573 74.467 -5.180 7.369 1.00 37.76 N ATOM 963 CA LEU A 573 73.114 -5.759 7.425 1.00 36.17 C ATOM 964 C LEU A 573 72.152 -5.070 6.477 1.00 41.33 C ATOM 965 O LEU A 573 71.387 -5.746 5.786 1.00 40.52 O ATOM 966 CB LEU A 573 72.539 -5.716 8.855 1.00 33.42 C ATOM 967 CG LEU A 573 73.227 -6.577 9.903 1.00 36.39 C ATOM 968 CD1 LEU A 573 72.819 -6.157 11.310 1.00 33.54 C ATOM 969 CD2 LEU A 573 73.051 -8.060 9.644 1.00 38.94 C ATOM 970 H LEU A 573 74.816 -4.680 8.211 1.00 0.00 H ATOM 971 N GLN A 574 72.190 -3.730 6.433 1.00 40.23 N ATOM 972 CA GLN A 574 71.304 -2.940 5.570 1.00 42.06 C ATOM 973 C GLN A 574 71.562 -3.205 4.099 1.00 48.48 C ATOM 974 O GLN A 574 70.601 -3.377 3.351 1.00 47.19 O ATOM 975 CB GLN A 574 71.425 -1.453 5.867 1.00 43.31 C ATOM 976 CG GLN A 574 70.755 -1.098 7.169 1.00 52.60 C ATOM 977 CD GLN A 574 70.781 0.368 7.435 1.00 55.95 C ATOM 978 OE1 GLN A 574 71.600 1.106 6.898 1.00 51.33 O ATOM 979 NE2 GLN A 574 69.922 0.800 8.329 1.00 48.24 N ATOM 980 HE22 GLN A 574 69.244 0.140 8.760 1.00 0.00 H ATOM 981 HE21 GLN A 574 69.920 1.802 8.606 1.00 0.00 H ATOM 982 H GLN A 574 72.875 -3.230 7.035 1.00 0.00 H ATOM 983 N ALA A 575 72.855 -3.317 3.701 1.00 46.19 N ATOM 984 CA ALA A 575 73.257 -3.587 2.314 1.00 46.65 C ATOM 985 C ALA A 575 72.843 -4.983 1.860 1.00 53.48 C ATOM 986 O ALA A 575 72.839 -5.251 0.668 1.00 55.07 O ATOM 987 CB ALA A 575 74.760 -3.424 2.160 1.00 46.82 C ATOM 988 H ALA A 575 73.601 -3.206 4.417 1.00 0.00 H ATOM 989 N ARG A 576 72.493 -5.868 2.807 1.00 49.19 N ATOM 990 CA ARG A 576 72.120 -7.253 2.532 1.00 48.59 C ATOM 991 C ARG A 576 70.657 -7.521 2.839 1.00 52.29 C ATOM 992 O ARG A 576 70.261 -8.662 3.041 1.00 53.84 O ATOM 993 CB ARG A 576 73.090 -8.210 3.267 1.00 45.94 C ATOM 994 CG ARG A 576 74.522 -8.016 2.754 1.00 45.03 C ATOM 995 CD ARG A 576 75.624 -8.621 3.600 1.00 43.51 C ATOM 996 NE ARG A 576 76.924 -8.560 2.923 1.00 48.54 N ATOM 997 CZ ARG A 576 77.660 -7.458 2.763 1.00 64.96 C ATOM 998 NH1 ARG A 576 77.230 -6.287 3.222 1.00 53.04 N ATOM 999 NH2 ARG A 576 78.817 -7.515 2.121 1.00 53.32 N ATOM 1000 HE ARG A 576 77.303 -9.448 2.536 1.00 0.00 H ATOM 1001 HH12 ARG A 576 77.810 -5.433 3.093 1.00 0.00 H ATOM 1002 HH11 ARG A 576 76.314 -6.224 3.710 1.00 0.00 H ATOM 1003 HH22 ARG A 576 79.387 -6.654 1.999 1.00 0.00 H ATOM 1004 HH21 ARG A 576 79.156 -8.421 1.739 1.00 0.00 H ATOM 1005 H ARG A 576 72.487 -5.548 3.796 1.00 0.00 H ATOM 1006 N ARG A 577 69.836 -6.469 2.817 1.00 49.45 N ATOM 1007 CA ARG A 577 68.402 -6.588 3.023 1.00 49.89 C ATOM 1008 C ARG A 577 67.770 -7.283 1.809 1.00 54.60 C ATOM 1009 O ARG A 577 68.340 -7.196 0.720 1.00 53.07 O ATOM 1010 CB ARG A 577 67.770 -5.209 3.240 1.00 50.46 C ATOM 1011 CG ARG A 577 67.726 -4.851 4.702 1.00 52.94 C ATOM 1012 CD ARG A 577 67.356 -3.413 4.932 1.00 52.05 C ATOM 1013 NE ARG A 577 67.428 -3.117 6.365 1.00 53.15 N ATOM 1014 CZ ARG A 577 66.594 -2.305 7.000 1.00 63.99 C ATOM 1015 NH1 ARG A 577 65.621 -1.687 6.336 1.00 51.13 N ATOM 1016 NH2 ARG A 577 66.714 -2.111 8.305 1.00 51.40 N ATOM 1017 HE ARG A 577 68.181 -3.573 6.919 1.00 0.00 H ATOM 1018 HH12 ARG A 577 64.970 -1.051 6.840 1.00 0.00 H ATOM 1019 HH11 ARG A 577 65.511 -1.840 5.313 1.00 0.00 H ATOM 1020 HH22 ARG A 577 66.057 -1.473 8.798 1.00 0.00 H ATOM 1021 HH21 ARG A 577 67.465 -2.597 8.836 1.00 0.00 H ATOM 1022 H ARG A 577 70.239 -5.526 2.645 1.00 0.00 H ATOM 1023 N PRO A 578 66.611 -7.976 1.950 1.00 53.10 N ATOM 1024 CA PRO A 578 65.998 -8.613 0.774 1.00 54.73 C ATOM 1025 C PRO A 578 65.639 -7.586 -0.301 1.00 57.74 C ATOM 1026 O PRO A 578 65.509 -6.397 0.036 1.00 53.28 O ATOM 1027 CB PRO A 578 64.751 -9.303 1.356 1.00 57.17 C ATOM 1028 CG PRO A 578 64.437 -8.549 2.591 1.00 60.32 C ATOM 1029 CD PRO A 578 65.776 -8.174 3.154 1.00 54.64 C ATOM 1030 N PRO A 579 65.476 -8.011 -1.592 1.00 58.35 N ATOM 1031 CA PRO A 579 65.196 -7.044 -2.656 1.00 58.98 C ATOM 1032 C PRO A 579 63.946 -6.183 -2.486 1.00 65.44 C ATOM 1033 O PRO A 579 62.964 -6.582 -1.847 1.00 65.84 O ATOM 1034 CB PRO A 579 65.116 -7.914 -3.909 1.00 62.67 C ATOM 1035 CG PRO A 579 65.928 -9.112 -3.590 1.00 67.08 C ATOM 1036 CD PRO A 579 65.635 -9.370 -2.151 1.00 61.15 C ATOM 1037 N GLY A 580 64.027 -4.985 -3.056 1.00 63.01 N ATOM 1038 CA GLY A 580 62.985 -3.972 -3.030 1.00 63.70 C ATOM 1039 C GLY A 580 61.767 -4.349 -3.838 1.00 70.41 C ATOM 1040 O GLY A 580 61.875 -4.894 -4.941 1.00 71.43 O ATOM 1041 H GLY A 580 64.906 -4.754 -3.561 1.00 0.00 H ATOM 1042 N LEU A 581 60.596 -4.080 -3.276 1.00 66.98 N ATOM 1043 CA LEU A 581 59.329 -4.386 -3.931 1.00 68.21 C ATOM 1044 C LEU A 581 58.642 -3.089 -4.307 1.00 73.60 C ATOM 1045 O LEU A 581 59.129 -2.022 -3.928 1.00 73.24 O ATOM 1046 CB LEU A 581 58.465 -5.274 -3.017 1.00 67.49 C ATOM 1047 CG LEU A 581 59.192 -6.497 -2.426 1.00 70.24 C ATOM 1048 CD1 LEU A 581 58.400 -7.118 -1.285 1.00 69.68 C ATOM 1049 CD2 LEU A 581 59.552 -7.510 -3.508 1.00 71.54 C ATOM 1050 H LEU A 581 60.581 -3.636 -2.336 1.00 0.00 H ATOM 1051 N GLU A 582 57.550 -3.161 -5.081 1.00 71.91 N ATOM 1052 CA GLU A 582 56.793 -1.988 -5.542 1.00 73.24 C ATOM 1053 C GLU A 582 56.280 -1.066 -4.396 1.00 78.27 C ATOM 1054 O GLU A 582 55.829 0.051 -4.671 1.00 79.51 O ATOM 1055 CB GLU A 582 55.642 -2.410 -6.483 1.00 76.18 C ATOM 1056 CG GLU A 582 54.678 -3.444 -5.912 1.00 84.41 C ATOM 1057 CD GLU A 582 53.673 -2.943 -4.890 1.00101.47 C ATOM 1058 OE1 GLU A 582 53.299 -1.751 -4.955 1.00 82.11 O ATOM 1059 OE2 GLU A 582 53.259 -3.744 -4.022 1.00 99.92 O ATOM 1060 H GLU A 582 57.219 -4.103 -5.373 1.00 0.00 H ATOM 1061 N TYR A 583 56.307 -1.555 -3.131 1.00 73.33 N ATOM 1062 CA TYR A 583 55.874 -0.789 -1.956 1.00 71.74 C ATOM 1063 C TYR A 583 57.073 -0.272 -1.121 1.00 75.49 C ATOM 1064 O TYR A 583 56.865 0.478 -0.160 1.00 74.75 O ATOM 1065 CB TYR A 583 54.846 -1.581 -1.099 1.00 70.90 C ATOM 1066 CG TYR A 583 55.361 -2.847 -0.438 1.00 70.15 C ATOM 1067 CD1 TYR A 583 56.361 -2.797 0.532 1.00 70.51 C ATOM 1068 CD2 TYR A 583 54.776 -4.083 -0.705 1.00 71.26 C ATOM 1069 CE1 TYR A 583 56.821 -3.954 1.167 1.00 70.63 C ATOM 1070 CE2 TYR A 583 55.211 -5.245 -0.061 1.00 70.95 C ATOM 1071 CZ TYR A 583 56.234 -5.174 0.877 1.00 75.81 C ATOM 1072 OH TYR A 583 56.681 -6.307 1.516 1.00 70.70 O ATOM 1073 HH TYR A 583 55.933 -6.719 2.017 1.00 0.00 H ATOM 1074 H TYR A 583 56.653 -2.525 -2.986 1.00 0.00 H ATOM 1075 N SER A 584 58.315 -0.677 -1.491 1.00 71.97 N ATOM 1076 CA SER A 584 59.552 -0.321 -0.777 1.00 71.35 C ATOM 1077 C SER A 584 60.030 1.104 -1.038 1.00 78.68 C ATOM 1078 O SER A 584 59.752 1.656 -2.101 1.00 79.89 O ATOM 1079 CB SER A 584 60.680 -1.291 -1.128 1.00 73.32 C ATOM 1080 OG SER A 584 60.335 -2.643 -0.880 1.00 78.62 O ATOM 1081 HG SER A 584 61.097 -3.227 -1.123 1.00 0.00 H ATOM 1082 H SER A 584 58.398 -1.279 -2.335 1.00 0.00 H ATOM 1083 N TYR A 585 60.795 1.675 -0.071 1.00 76.44 N ATOM 1084 CA TYR A 585 61.422 2.999 -0.149 1.00 77.39 C ATOM 1085 C TYR A 585 62.404 2.990 -1.324 1.00 85.33 C ATOM 1086 O TYR A 585 62.365 3.896 -2.161 1.00 86.79 O ATOM 1087 CB TYR A 585 62.146 3.344 1.169 1.00 76.45 C ATOM 1088 H TYR A 585 60.949 1.126 0.799 1.00 0.00 H ATOM 1089 N ASN A 586 63.226 1.916 -1.420 1.00 82.97 N ATOM 1090 CA ASN A 586 64.171 1.673 -2.514 1.00 83.69 C ATOM 1091 C ASN A 586 63.793 0.365 -3.279 1.00 87.84 C ATOM 1092 O ASN A 586 64.374 -0.691 -3.004 1.00 86.30 O ATOM 1093 CB ASN A 586 65.611 1.643 -1.997 1.00 84.25 C ATOM 1094 H ASN A 586 63.183 1.209 -0.658 1.00 0.00 H ATOM 1095 N PRO A 587 62.814 0.413 -4.229 1.00 86.38 N ATOM 1096 CA PRO A 587 62.431 -0.815 -4.967 1.00 87.05 C ATOM 1097 C PRO A 587 63.528 -1.442 -5.843 1.00 90.94 C ATOM 1098 O PRO A 587 63.431 -2.627 -6.170 1.00 91.07 O ATOM 1099 CB PRO A 587 61.220 -0.377 -5.800 1.00 90.41 C ATOM 1100 CG PRO A 587 61.346 1.089 -5.924 1.00 95.35 C ATOM 1101 CD PRO A 587 62.007 1.573 -4.668 1.00 89.19 C ATOM 1102 N SER A 588 64.569 -0.660 -6.212 1.00 86.74 N ATOM 1103 CA SER A 588 65.698 -1.127 -7.029 1.00 86.38 C ATOM 1104 C SER A 588 66.723 -1.938 -6.216 1.00 87.91 C ATOM 1105 O SER A 588 67.604 -2.563 -6.823 1.00 87.74 O ATOM 1106 CB SER A 588 66.379 0.040 -7.743 1.00 89.36 C ATOM 1107 OG SER A 588 65.475 0.695 -8.614 1.00 98.09 O ATOM 1108 HG SER A 588 65.938 1.446 -9.064 1.00 0.00 H ATOM 1109 H SER A 588 64.570 0.332 -5.898 1.00 0.00 H ATOM 1110 N HIS A 589 66.606 -1.938 -4.854 1.00 82.08 N ATOM 1111 CA HIS A 589 67.504 -2.686 -3.967 1.00 80.23 C ATOM 1112 C HIS A 589 67.484 -4.170 -4.319 1.00 86.68 C ATOM 1113 O HIS A 589 66.414 -4.763 -4.418 1.00 86.43 O ATOM 1114 CB HIS A 589 67.174 -2.464 -2.476 1.00 78.64 C ATOM 1115 CG HIS A 589 68.088 -3.210 -1.541 1.00 79.93 C ATOM 1116 ND1 HIS A 589 69.395 -2.800 -1.322 1.00 80.60 N ATOM 1117 CD2 HIS A 589 67.858 -4.331 -0.815 1.00 80.01 C ATOM 1118 CE1 HIS A 589 69.907 -3.673 -0.469 1.00 78.44 C ATOM 1119 NE2 HIS A 589 69.022 -4.615 -0.143 1.00 78.55 N ATOM 1120 H HIS A 589 65.841 -1.379 -4.425 1.00 0.00 H ATOM 1121 N ASN A 590 68.669 -4.731 -4.601 1.00 85.11 N ATOM 1122 CA ASN A 590 68.872 -6.129 -4.979 1.00 86.00 C ATOM 1123 C ASN A 590 70.349 -6.468 -4.722 1.00 90.32 C ATOM 1124 O ASN A 590 71.188 -6.233 -5.602 1.00 91.19 O ATOM 1125 CB ASN A 590 68.481 -6.365 -6.453 1.00 89.84 C ATOM 1126 H ASN A 590 69.511 -4.123 -4.546 1.00 0.00 H ATOM 1127 N PRO A 591 70.704 -6.949 -3.501 1.00 85.46 N ATOM 1128 CA PRO A 591 72.122 -7.255 -3.222 1.00 84.69 C ATOM 1129 C PRO A 591 72.659 -8.534 -3.877 1.00 89.15 C ATOM 1130 O PRO A 591 71.953 -9.542 -3.968 1.00 89.34 O ATOM 1131 CB PRO A 591 72.161 -7.362 -1.696 1.00 84.38 C ATOM 1132 CG PRO A 591 70.803 -7.840 -1.323 1.00 88.35 C ATOM 1133 CD PRO A 591 69.847 -7.255 -2.333 1.00 85.27 C ATOM 1134 N GLU A 592 73.938 -8.505 -4.281 1.00 85.60 N ATOM 1135 CA GLU A 592 74.631 -9.665 -4.845 1.00 86.28 C ATOM 1136 C GLU A 592 75.212 -10.495 -3.674 1.00 88.95 C ATOM 1137 O GLU A 592 76.134 -11.296 -3.873 1.00 89.87 O ATOM 1138 CB GLU A 592 75.752 -9.188 -5.789 1.00 88.57 C ATOM 1139 H GLU A 592 74.464 -7.613 -4.189 1.00 0.00 H ATOM 1140 N GLU A 593 74.635 -10.302 -2.455 1.00 82.43 N ATOM 1141 CA GLU A 593 75.029 -10.866 -1.159 1.00 79.94 C ATOM 1142 C GLU A 593 73.785 -11.165 -0.276 1.00 78.15 C ATOM 1143 O GLU A 593 72.941 -10.282 -0.098 1.00 77.96 O ATOM 1144 CB GLU A 593 75.985 -9.868 -0.469 1.00 80.60 C ATOM 1145 CG GLU A 593 75.550 -8.407 -0.636 1.00 91.25 C ATOM 1146 CD GLU A 593 76.555 -7.361 -1.081 1.00104.29 C ATOM 1147 OE1 GLU A 593 77.683 -7.728 -1.485 1.00 92.94 O ATOM 1148 OE2 GLU A 593 76.196 -6.161 -1.046 1.00 91.00 O ATOM 1149 H GLU A 593 73.807 -9.673 -2.441 1.00 0.00 H ATOM 1150 N GLN A 594 73.661 -12.408 0.250 1.00 69.74 N ATOM 1151 CA GLN A 594 72.494 -12.832 1.043 1.00 67.26 C ATOM 1152 C GLN A 594 72.828 -13.542 2.367 1.00 65.47 C ATOM 1153 O GLN A 594 73.743 -14.370 2.420 1.00 65.22 O ATOM 1154 CB GLN A 594 71.562 -13.711 0.193 1.00 70.13 C ATOM 1155 H GLN A 594 74.425 -13.094 0.086 1.00 0.00 H ATOM 1156 N LEU A 595 72.054 -13.242 3.430 1.00 57.12 N ATOM 1157 CA LEU A 595 72.271 -13.814 4.762 1.00 53.25 C ATOM 1158 C LEU A 595 71.181 -14.787 5.178 1.00 54.51 C ATOM 1159 O LEU A 595 70.003 -14.421 5.185 1.00 53.60 O ATOM 1160 CB LEU A 595 72.416 -12.690 5.807 1.00 51.28 C ATOM 1161 CG LEU A 595 73.552 -11.679 5.568 1.00 54.38 C ATOM 1162 CD1 LEU A 595 73.338 -10.436 6.369 1.00 53.03 C ATOM 1163 CD2 LEU A 595 74.910 -12.270 5.885 1.00 53.60 C ATOM 1164 H LEU A 595 71.267 -12.574 3.299 1.00 0.00 H ATOM 1165 N SER A 596 71.564 -16.031 5.544 1.00 49.90 N ATOM 1166 CA SER A 596 70.585 -17.021 6.022 1.00 49.43 C ATOM 1167 C SER A 596 70.282 -16.743 7.513 1.00 49.60 C ATOM 1168 O SER A 596 70.948 -15.906 8.119 1.00 47.72 O ATOM 1169 CB SER A 596 71.129 -18.439 5.872 1.00 53.99 C ATOM 1170 OG SER A 596 72.050 -18.764 6.906 1.00 58.80 O ATOM 1171 HG SER A 596 72.813 -18.133 6.877 1.00 0.00 H ATOM 1172 H SER A 596 72.569 -16.293 5.487 1.00 0.00 H ATOM 1173 N SER A 597 69.304 -17.452 8.098 1.00 44.64 N ATOM 1174 CA SER A 597 68.979 -17.339 9.517 1.00 44.88 C ATOM 1175 C SER A 597 70.185 -17.784 10.390 1.00 46.55 C ATOM 1176 O SER A 597 70.419 -17.198 11.443 1.00 45.06 O ATOM 1177 CB SER A 597 67.743 -18.174 9.851 1.00 51.11 C ATOM 1178 OG SER A 597 66.569 -17.550 9.353 1.00 65.59 O ATOM 1179 HG SER A 597 66.473 -16.655 9.764 1.00 0.00 H ATOM 1180 H SER A 597 68.752 -18.112 7.514 1.00 0.00 H ATOM 1181 N LYS A 598 70.939 -18.810 9.950 1.00 43.56 N ATOM 1182 CA LYS A 598 72.134 -19.276 10.653 1.00 42.68 C ATOM 1183 C LYS A 598 73.208 -18.177 10.679 1.00 46.93 C ATOM 1184 O LYS A 598 73.848 -18.003 11.716 1.00 47.54 O ATOM 1185 CB LYS A 598 72.687 -20.569 10.041 1.00 46.17 C ATOM 1186 CG LYS A 598 73.608 -21.318 11.006 1.00 50.49 C ATOM 1187 CD LYS A 598 74.394 -22.394 10.303 1.00 53.25 C ATOM 1188 CE LYS A 598 74.541 -23.629 11.154 1.00 59.66 C ATOM 1189 NZ LYS A 598 73.273 -24.420 11.210 1.00 56.51 N ATOM 1190 HZ1 LYS A 598 72.517 -23.832 11.615 1.00 0.00 H ATOM 1191 HZ2 LYS A 598 73.007 -24.715 10.249 1.00 0.00 H ATOM 1192 HZ3 LYS A 598 73.416 -25.261 11.805 1.00 0.00 H ATOM 1193 H LYS A 598 70.659 -19.292 9.072 1.00 0.00 H ATOM 1194 N ASP A 599 73.389 -17.432 9.558 1.00 41.88 N ATOM 1195 CA ASP A 599 74.349 -16.328 9.426 1.00 40.57 C ATOM 1196 C ASP A 599 74.106 -15.185 10.421 1.00 42.23 C ATOM 1197 O ASP A 599 75.064 -14.576 10.886 1.00 41.32 O ATOM 1198 CB ASP A 599 74.291 -15.730 8.020 1.00 42.82 C ATOM 1199 CG ASP A 599 74.886 -16.580 6.928 1.00 53.56 C ATOM 1200 OD1 ASP A 599 76.019 -17.092 7.126 1.00 56.66 O ATOM 1201 OD2 ASP A 599 74.286 -16.629 5.823 1.00 55.24 O ATOM 1202 H ASP A 599 72.803 -17.661 8.730 1.00 0.00 H ATOM 1203 N LEU A 600 72.828 -14.844 10.671 1.00 37.33 N ATOM 1204 CA LEU A 600 72.443 -13.775 11.597 1.00 35.49 C ATOM 1205 C LEU A 600 72.703 -14.190 13.045 1.00 40.30 C ATOM 1206 O LEU A 600 73.245 -13.396 13.812 1.00 40.05 O ATOM 1207 CB LEU A 600 70.973 -13.397 11.380 1.00 35.47 C ATOM 1208 CG LEU A 600 70.593 -12.824 10.009 1.00 38.75 C ATOM 1209 CD1 LEU A 600 69.111 -12.716 9.900 1.00 39.54 C ATOM 1210 CD2 LEU A 600 71.212 -11.449 9.780 1.00 36.11 C ATOM 1211 H LEU A 600 72.074 -15.367 10.181 1.00 0.00 H ATOM 1212 N VAL A 601 72.367 -15.450 13.407 1.00 36.82 N ATOM 1213 CA VAL A 601 72.645 -16.003 14.747 1.00 37.81 C ATOM 1214 C VAL A 601 74.169 -16.114 14.947 1.00 40.74 C ATOM 1215 O VAL A 601 74.651 -15.871 16.047 1.00 40.77 O ATOM 1216 CB VAL A 601 71.926 -17.363 15.013 1.00 43.34 C ATOM 1217 CG1 VAL A 601 72.118 -17.797 16.468 1.00 43.60 C ATOM 1218 CG2 VAL A 601 70.438 -17.259 14.699 1.00 43.23 C ATOM 1219 H VAL A 601 71.891 -16.056 12.709 1.00 0.00 H ATOM 1220 N SER A 602 74.916 -16.429 13.869 1.00 36.64 N ATOM 1221 CA SER A 602 76.382 -16.527 13.881 1.00 36.76 C ATOM 1222 C SER A 602 77.011 -15.160 14.174 1.00 40.70 C ATOM 1223 O SER A 602 77.983 -15.101 14.926 1.00 41.41 O ATOM 1224 CB SER A 602 76.904 -17.083 12.564 1.00 41.35 C ATOM 1225 OG SER A 602 78.305 -17.250 12.682 1.00 49.75 O ATOM 1226 HG SER A 602 78.500 -17.880 13.420 1.00 0.00 H ATOM 1227 H SER A 602 74.423 -16.614 12.972 1.00 0.00 H ATOM 1228 N CYS A 603 76.440 -14.095 13.606 1.00 33.81 N ATOM 1229 CA CYS A 603 76.845 -12.717 13.826 1.00 31.38 C ATOM 1230 C CYS A 603 76.720 -12.355 15.323 1.00 36.02 C ATOM 1231 O CYS A 603 77.634 -11.755 15.882 1.00 35.29 O ATOM 1232 CB CYS A 603 75.993 -11.800 12.960 1.00 30.33 C ATOM 1233 SG CYS A 603 76.154 -10.055 13.362 1.00 32.29 S ATOM 1234 H CYS A 603 75.645 -14.265 12.957 1.00 0.00 H ATOM 1235 N ALA A 604 75.577 -12.700 15.948 1.00 33.76 N ATOM 1236 CA ALA A 604 75.272 -12.461 17.364 1.00 32.59 C ATOM 1237 C ALA A 604 76.225 -13.285 18.233 1.00 36.12 C ATOM 1238 O ALA A 604 76.785 -12.760 19.192 1.00 36.60 O ATOM 1239 CB ALA A 604 73.820 -12.853 17.655 1.00 32.77 C ATOM 1240 H ALA A 604 74.849 -13.176 15.379 1.00 0.00 H ATOM 1241 N TYR A 605 76.458 -14.546 17.859 1.00 32.12 N ATOM 1242 CA TYR A 605 77.434 -15.384 18.575 1.00 32.51 C ATOM 1243 C TYR A 605 78.841 -14.702 18.621 1.00 34.61 C ATOM 1244 O TYR A 605 79.421 -14.571 19.699 1.00 33.97 O ATOM 1245 CB TYR A 605 77.502 -16.776 17.935 1.00 34.12 C ATOM 1246 CG TYR A 605 78.667 -17.608 18.424 1.00 37.69 C ATOM 1247 CD1 TYR A 605 78.619 -18.253 19.659 1.00 39.66 C ATOM 1248 CD2 TYR A 605 79.827 -17.742 17.658 1.00 38.83 C ATOM 1249 CE1 TYR A 605 79.698 -19.002 20.126 1.00 41.00 C ATOM 1250 CE2 TYR A 605 80.907 -18.504 18.107 1.00 40.17 C ATOM 1251 CZ TYR A 605 80.838 -19.127 19.346 1.00 48.29 C ATOM 1252 OH TYR A 605 81.873 -19.906 19.786 1.00 51.07 O ATOM 1253 HH TYR A 605 81.655 -20.268 20.681 1.00 0.00 H ATOM 1254 H TYR A 605 75.941 -14.943 17.048 1.00 0.00 H ATOM 1255 N GLN A 606 79.359 -14.259 17.465 1.00 31.30 N ATOM 1256 CA GLN A 606 80.684 -13.625 17.348 1.00 30.92 C ATOM 1257 C GLN A 606 80.810 -12.350 18.176 1.00 34.09 C ATOM 1258 O GLN A 606 81.831 -12.132 18.817 1.00 34.05 O ATOM 1259 CB GLN A 606 81.014 -13.329 15.884 1.00 32.39 C ATOM 1260 CG GLN A 606 81.221 -14.571 15.026 1.00 29.34 C ATOM 1261 CD GLN A 606 81.408 -14.170 13.579 1.00 40.43 C ATOM 1262 OE1 GLN A 606 82.372 -13.517 13.236 1.00 36.01 O ATOM 1263 NE2 GLN A 606 80.477 -14.515 12.701 1.00 37.08 N ATOM 1264 HE22 GLN A 606 79.656 -15.075 13.007 1.00 0.00 H ATOM 1265 HE21 GLN A 606 80.568 -14.226 11.706 1.00 0.00 H ATOM 1266 H GLN A 606 78.792 -14.370 16.600 1.00 0.00 H ATOM 1267 N VAL A 607 79.778 -11.501 18.150 1.00 30.11 N ATOM 1268 CA VAL A 607 79.743 -10.272 18.948 1.00 28.29 C ATOM 1269 C VAL A 607 79.732 -10.628 20.436 1.00 33.60 C ATOM 1270 O VAL A 607 80.485 -10.010 21.206 1.00 34.72 O ATOM 1271 CB VAL A 607 78.534 -9.367 18.561 1.00 28.63 C ATOM 1272 CG1 VAL A 607 78.413 -8.180 19.516 1.00 27.87 C ATOM 1273 CG2 VAL A 607 78.665 -8.879 17.136 1.00 27.06 C ATOM 1274 H VAL A 607 78.966 -11.722 17.538 1.00 0.00 H ATOM 1275 N ALA A 608 78.917 -11.641 20.836 1.00 30.32 N ATOM 1276 CA ALA A 608 78.853 -12.089 22.240 1.00 31.33 C ATOM 1277 C ALA A 608 80.217 -12.612 22.670 1.00 36.68 C ATOM 1278 O ALA A 608 80.630 -12.391 23.806 1.00 38.02 O ATOM 1279 CB ALA A 608 77.785 -13.176 22.421 1.00 32.09 C ATOM 1280 H ALA A 608 78.320 -12.115 20.129 1.00 0.00 H ATOM 1281 N ARG A 609 80.920 -13.302 21.762 1.00 33.92 N ATOM 1282 CA ARG A 609 82.254 -13.856 22.029 1.00 33.41 C ATOM 1283 C ARG A 609 83.278 -12.755 22.244 1.00 35.35 C ATOM 1284 O ARG A 609 84.056 -12.837 23.185 1.00 33.61 O ATOM 1285 CB ARG A 609 82.687 -14.790 20.914 1.00 36.59 C ATOM 1286 CG ARG A 609 82.496 -16.266 21.242 1.00 50.79 C ATOM 1287 CD ARG A 609 83.770 -17.047 20.980 1.00 62.04 C ATOM 1288 NE ARG A 609 84.355 -16.684 19.686 1.00 82.21 N ATOM 1289 CZ ARG A 609 84.563 -17.529 18.684 1.00104.43 C ATOM 1290 NH1 ARG A 609 84.279 -18.820 18.824 1.00 93.36 N ATOM 1291 NH2 ARG A 609 85.080 -17.096 17.541 1.00 94.69 N ATOM 1292 HE ARG A 609 84.627 -15.691 19.542 1.00 0.00 H ATOM 1293 HH12 ARG A 609 84.444 -19.477 18.035 1.00 0.00 H ATOM 1294 HH11 ARG A 609 83.892 -19.173 19.722 1.00 0.00 H ATOM 1295 HH22 ARG A 609 85.241 -17.761 16.758 1.00 0.00 H ATOM 1296 HH21 ARG A 609 85.324 -16.091 17.428 1.00 0.00 H ATOM 1297 H ARG A 609 80.501 -13.453 20.822 1.00 0.00 H ATOM 1298 N GLY A 610 83.201 -11.698 21.444 1.00 33.72 N ATOM 1299 CA GLY A 610 84.076 -10.529 21.591 1.00 33.69 C ATOM 1300 C GLY A 610 83.855 -9.826 22.914 1.00 34.86 C ATOM 1301 O GLY A 610 84.805 -9.432 23.583 1.00 35.21 O ATOM 1302 H GLY A 610 82.492 -11.699 20.683 1.00 0.00 H ATOM 1303 N MET A 611 82.588 -9.681 23.293 1.00 29.94 N ATOM 1304 CA MET A 611 82.157 -9.054 24.523 1.00 27.89 C ATOM 1305 C MET A 611 82.531 -9.889 25.725 1.00 32.62 C ATOM 1306 O MET A 611 83.024 -9.344 26.707 1.00 33.39 O ATOM 1307 CB MET A 611 80.655 -8.741 24.483 1.00 28.94 C ATOM 1308 CG MET A 611 80.288 -7.569 23.577 1.00 30.19 C ATOM 1309 SD MET A 611 81.178 -6.019 23.943 1.00 35.41 S ATOM 1310 CE MET A 611 80.601 -5.666 25.607 1.00 31.98 C ATOM 1311 H MET A 611 81.851 -10.046 22.656 1.00 0.00 H ATOM 1312 N GLU A 612 82.423 -11.221 25.616 1.00 29.99 N ATOM 1313 CA GLU A 612 82.822 -12.111 26.704 1.00 30.44 C ATOM 1314 C GLU A 612 84.314 -11.931 26.958 1.00 35.14 C ATOM 1315 O GLU A 612 84.733 -11.881 28.116 1.00 36.21 O ATOM 1316 CB GLU A 612 82.516 -13.574 26.344 1.00 32.40 C ATOM 1317 CG GLU A 612 83.117 -14.585 27.326 1.00 34.73 C ATOM 1318 CD GLU A 612 82.793 -16.019 26.990 1.00 43.61 C ATOM 1319 OE1 GLU A 612 82.873 -16.386 25.796 1.00 47.45 O ATOM 1320 OE2 GLU A 612 82.450 -16.780 27.921 1.00 55.64 O ATOM 1321 H GLU A 612 82.047 -11.630 24.737 1.00 0.00 H ATOM 1322 N TYR A 613 85.111 -11.847 25.874 1.00 30.76 N ATOM 1323 CA TYR A 613 86.548 -11.638 25.993 1.00 30.77 C ATOM 1324 C TYR A 613 86.826 -10.303 26.663 1.00 32.78 C ATOM 1325 O TYR A 613 87.584 -10.266 27.624 1.00 33.35 O ATOM 1326 CB TYR A 613 87.252 -11.708 24.616 1.00 32.76 C ATOM 1327 CG TYR A 613 88.736 -11.413 24.734 1.00 33.33 C ATOM 1328 CD1 TYR A 613 89.615 -12.365 25.239 1.00 35.13 C ATOM 1329 CD2 TYR A 613 89.241 -10.142 24.450 1.00 33.99 C ATOM 1330 CE1 TYR A 613 90.972 -12.084 25.411 1.00 36.07 C ATOM 1331 CE2 TYR A 613 90.594 -9.841 24.648 1.00 35.56 C ATOM 1332 CZ TYR A 613 91.463 -10.832 25.083 1.00 40.07 C ATOM 1333 OH TYR A 613 92.800 -10.567 25.266 1.00 40.71 O ATOM 1334 HH TYR A 613 92.904 -9.853 25.944 1.00 0.00 H ATOM 1335 H TYR A 613 84.689 -11.934 24.927 1.00 0.00 H ATOM 1336 N LEU A 614 86.214 -9.208 26.165 1.00 29.23 N ATOM 1337 CA LEU A 614 86.411 -7.871 26.760 1.00 28.23 C ATOM 1338 C LEU A 614 86.050 -7.827 28.244 1.00 35.37 C ATOM 1339 O LEU A 614 86.811 -7.282 29.055 1.00 35.92 O ATOM 1340 CB LEU A 614 85.674 -6.800 25.961 1.00 26.28 C ATOM 1341 CG LEU A 614 86.201 -6.507 24.573 1.00 30.51 C ATOM 1342 CD1 LEU A 614 85.216 -5.614 23.804 1.00 28.78 C ATOM 1343 CD2 LEU A 614 87.623 -5.877 24.640 1.00 29.34 C ATOM 1344 H LEU A 614 85.588 -9.308 25.341 1.00 0.00 H ATOM 1345 N ALA A 615 84.925 -8.462 28.606 1.00 34.42 N ATOM 1346 CA ALA A 615 84.463 -8.586 29.998 1.00 35.11 C ATOM 1347 C ALA A 615 85.482 -9.358 30.836 1.00 39.76 C ATOM 1348 O ALA A 615 85.781 -8.944 31.950 1.00 40.10 O ATOM 1349 CB ALA A 615 83.106 -9.287 30.041 1.00 35.52 C ATOM 1350 H ALA A 615 84.344 -8.892 27.858 1.00 0.00 H ATOM 1351 N SER A 616 86.059 -10.452 30.291 1.00 38.46 N ATOM 1352 CA SER A 616 87.101 -11.228 30.997 1.00 38.95 C ATOM 1353 C SER A 616 88.346 -10.346 31.225 1.00 39.87 C ATOM 1354 O SER A 616 89.116 -10.599 32.127 1.00 40.31 O ATOM 1355 CB SER A 616 87.465 -12.490 30.212 1.00 42.43 C ATOM 1356 OG SER A 616 88.457 -12.249 29.228 1.00 49.29 O ATOM 1357 HG SER A 616 88.125 -11.574 28.585 1.00 0.00 H ATOM 1358 H SER A 616 85.760 -10.758 29.343 1.00 0.00 H ATOM 1359 N LYS A 617 88.514 -9.293 30.430 1.00 34.90 N ATOM 1360 CA LYS A 617 89.632 -8.351 30.583 1.00 34.45 C ATOM 1361 C LYS A 617 89.223 -7.137 31.399 1.00 39.55 C ATOM 1362 O LYS A 617 89.970 -6.170 31.458 1.00 40.69 O ATOM 1363 CB LYS A 617 90.192 -7.945 29.216 1.00 35.14 C ATOM 1364 CG LYS A 617 90.745 -9.124 28.415 1.00 41.76 C ATOM 1365 CD LYS A 617 92.055 -9.667 29.037 1.00 47.87 C ATOM 1366 CE LYS A 617 92.328 -11.082 28.604 1.00 54.11 C ATOM 1367 NZ LYS A 617 93.590 -11.619 29.173 1.00 65.33 N ATOM 1368 HZ1 LYS A 617 94.388 -11.029 28.861 1.00 0.00 H ATOM 1369 HZ2 LYS A 617 93.533 -11.607 30.211 1.00 0.00 H ATOM 1370 HZ3 LYS A 617 93.730 -12.595 28.843 1.00 0.00 H ATOM 1371 H LYS A 617 87.825 -9.129 29.668 1.00 0.00 H ATOM 1372 N LYS A 618 88.032 -7.182 32.036 1.00 37.28 N ATOM 1373 CA LYS A 618 87.506 -6.133 32.935 1.00 38.21 C ATOM 1374 C LYS A 618 87.122 -4.860 32.208 1.00 43.96 C ATOM 1375 O LYS A 618 87.057 -3.800 32.828 1.00 46.05 O ATOM 1376 CB LYS A 618 88.478 -5.807 34.126 1.00 40.87 C ATOM 1377 CG LYS A 618 89.224 -6.981 34.756 1.00 46.87 C ATOM 1378 CD LYS A 618 88.314 -8.009 35.351 1.00 52.11 C ATOM 1379 CE LYS A 618 89.068 -9.237 35.778 1.00 59.58 C ATOM 1380 NZ LYS A 618 89.764 -9.020 37.061 1.00 58.09 N ATOM 1381 HZ1 LYS A 618 90.439 -8.235 36.959 1.00 0.00 H ATOM 1382 HZ2 LYS A 618 89.067 -8.786 37.797 1.00 0.00 H ATOM 1383 HZ3 LYS A 618 90.275 -9.886 37.328 1.00 0.00 H ATOM 1384 H LYS A 618 87.438 -8.022 31.881 1.00 0.00 H ATOM 1385 N CYS A 619 86.884 -4.962 30.900 1.00 39.20 N ATOM 1386 CA CYS A 619 86.503 -3.859 30.034 1.00 38.70 C ATOM 1387 C CYS A 619 84.974 -3.733 29.990 1.00 41.33 C ATOM 1388 O CYS A 619 84.287 -4.733 29.811 1.00 40.06 O ATOM 1389 CB CYS A 619 87.087 -4.079 28.637 1.00 38.77 C ATOM 1390 SG CYS A 619 86.655 -2.803 27.420 1.00 43.01 S ATOM 1391 H CYS A 619 86.978 -5.903 30.467 1.00 0.00 H ATOM 1392 N ILE A 620 84.461 -2.511 30.170 1.00 37.55 N ATOM 1393 CA ILE A 620 83.050 -2.149 30.021 1.00 36.16 C ATOM 1394 C ILE A 620 83.027 -1.288 28.782 1.00 39.07 C ATOM 1395 O ILE A 620 83.795 -0.329 28.689 1.00 40.83 O ATOM 1396 CB ILE A 620 82.420 -1.485 31.284 1.00 38.95 C ATOM 1397 CG1 ILE A 620 82.446 -2.472 32.465 1.00 39.05 C ATOM 1398 CG2 ILE A 620 80.973 -1.028 31.008 1.00 35.88 C ATOM 1399 CD1 ILE A 620 82.579 -1.800 33.829 1.00 42.78 C ATOM 1400 H ILE A 620 85.121 -1.753 30.439 1.00 0.00 H ATOM 1401 N HIS A 621 82.258 -1.693 27.778 1.00 33.41 N ATOM 1402 CA HIS A 621 82.246 -0.982 26.507 1.00 32.19 C ATOM 1403 C HIS A 621 81.560 0.388 26.619 1.00 36.25 C ATOM 1404 O HIS A 621 82.131 1.394 26.188 1.00 36.36 O ATOM 1405 CB HIS A 621 81.599 -1.845 25.416 1.00 31.36 C ATOM 1406 CG HIS A 621 81.809 -1.309 24.031 1.00 33.35 C ATOM 1407 ND1 HIS A 621 81.238 -0.108 23.617 1.00 34.63 N ATOM 1408 CD2 HIS A 621 82.503 -1.835 23.003 1.00 33.53 C ATOM 1409 CE1 HIS A 621 81.595 0.049 22.353 1.00 33.15 C ATOM 1410 NE2 HIS A 621 82.363 -0.955 21.938 1.00 33.31 N ATOM 1411 H HIS A 621 81.655 -2.531 27.901 1.00 0.00 H ATOM 1412 N ARG A 622 80.343 0.415 27.195 1.00 32.87 N ATOM 1413 CA ARG A 622 79.476 1.602 27.400 1.00 33.42 C ATOM 1414 C ARG A 622 78.713 2.056 26.139 1.00 37.85 C ATOM 1415 O ARG A 622 77.755 2.803 26.280 1.00 38.30 O ATOM 1416 CB ARG A 622 80.218 2.793 28.034 1.00 32.88 C ATOM 1417 CG ARG A 622 80.832 2.454 29.366 1.00 45.52 C ATOM 1418 CD ARG A 622 81.447 3.652 30.076 1.00 57.38 C ATOM 1419 NE ARG A 622 81.831 3.290 31.445 1.00 63.65 N ATOM 1420 CZ ARG A 622 82.944 2.632 31.769 1.00 74.28 C ATOM 1421 NH1 ARG A 622 83.817 2.282 30.828 1.00 64.26 N ATOM 1422 NH2 ARG A 622 83.198 2.330 33.036 1.00 52.31 N ATOM 1423 HE ARG A 622 81.190 3.566 32.216 1.00 0.00 H ATOM 1424 HH12 ARG A 622 84.683 1.769 31.088 1.00 0.00 H ATOM 1425 HH11 ARG A 622 83.633 2.522 29.833 1.00 0.00 H ATOM 1426 HH22 ARG A 622 84.068 1.816 33.284 1.00 0.00 H ATOM 1427 HH21 ARG A 622 82.527 2.607 33.781 1.00 0.00 H ATOM 1428 H ARG A 622 79.970 -0.495 27.533 1.00 0.00 H ATOM 1429 N ASP A 623 79.116 1.622 24.930 1.00 33.98 N ATOM 1430 CA ASP A 623 78.402 1.965 23.690 1.00 34.88 C ATOM 1431 C ASP A 623 78.319 0.781 22.708 1.00 38.53 C ATOM 1432 O ASP A 623 78.584 0.911 21.504 1.00 39.28 O ATOM 1433 CB ASP A 623 78.951 3.239 23.006 1.00 37.43 C ATOM 1434 CG ASP A 623 77.963 3.892 22.026 1.00 53.48 C ATOM 1435 OD1 ASP A 623 76.784 3.440 21.958 1.00 53.54 O ATOM 1436 OD2 ASP A 623 78.367 4.834 21.320 1.00 63.46 O ATOM 1437 H ASP A 623 79.963 1.022 24.870 1.00 0.00 H ATOM 1438 N LEU A 624 77.920 -0.366 23.224 1.00 32.26 N ATOM 1439 CA LEU A 624 77.773 -1.521 22.370 1.00 32.59 C ATOM 1440 C LEU A 624 76.530 -1.338 21.465 1.00 37.79 C ATOM 1441 O LEU A 624 75.424 -1.162 21.965 1.00 37.48 O ATOM 1442 CB LEU A 624 77.695 -2.798 23.220 1.00 31.54 C ATOM 1443 CG LEU A 624 77.551 -4.092 22.444 1.00 35.27 C ATOM 1444 CD1 LEU A 624 78.731 -4.289 21.459 1.00 34.39 C ATOM 1445 CD2 LEU A 624 77.445 -5.254 23.411 1.00 37.47 C ATOM 1446 H LEU A 624 77.712 -0.438 24.241 1.00 0.00 H ATOM 1447 N ALA A 625 76.753 -1.312 20.125 1.00 34.07 N ATOM 1448 CA ALA A 625 75.729 -1.117 19.100 1.00 32.45 C ATOM 1449 C ALA A 625 76.308 -1.617 17.774 1.00 36.67 C ATOM 1450 O ALA A 625 77.532 -1.665 17.643 1.00 35.50 O ATOM 1451 CB ALA A 625 75.419 0.361 18.995 1.00 32.61 C ATOM 1452 H ALA A 625 77.733 -1.442 19.802 1.00 0.00 H ATOM 1453 N ALA A 626 75.457 -1.986 16.783 1.00 33.24 N ATOM 1454 CA ALA A 626 75.984 -2.447 15.491 1.00 33.09 C ATOM 1455 C ALA A 626 76.943 -1.452 14.837 1.00 37.06 C ATOM 1456 O ALA A 626 77.885 -1.887 14.195 1.00 37.15 O ATOM 1457 CB ALA A 626 74.867 -2.830 14.540 1.00 34.35 C ATOM 1458 H ALA A 626 74.430 -1.942 16.938 1.00 0.00 H ATOM 1459 N ARG A 627 76.767 -0.135 15.062 1.00 34.62 N ATOM 1460 CA ARG A 627 77.689 0.893 14.532 1.00 35.62 C ATOM 1461 C ARG A 627 79.133 0.710 15.016 1.00 37.92 C ATOM 1462 O ARG A 627 80.046 1.146 14.325 1.00 38.02 O ATOM 1463 CB ARG A 627 77.217 2.322 14.894 1.00 34.26 C ATOM 1464 CG ARG A 627 77.192 2.626 16.397 1.00 35.76 C ATOM 1465 CD ARG A 627 76.613 4.021 16.657 1.00 50.03 C ATOM 1466 NE ARG A 627 76.216 4.129 18.058 1.00 50.15 N ATOM 1467 CZ ARG A 627 74.992 3.894 18.511 1.00 52.01 C ATOM 1468 NH1 ARG A 627 74.010 3.610 17.669 1.00 42.25 N ATOM 1469 NH2 ARG A 627 74.742 3.938 19.808 1.00 47.26 N ATOM 1470 HE ARG A 627 76.942 4.409 18.747 1.00 0.00 H ATOM 1471 HH12 ARG A 627 73.052 3.427 18.030 1.00 0.00 H ATOM 1472 HH11 ARG A 627 74.197 3.570 16.647 1.00 0.00 H ATOM 1473 HH22 ARG A 627 73.781 3.753 20.159 1.00 0.00 H ATOM 1474 HH21 ARG A 627 75.507 4.158 20.478 1.00 0.00 H ATOM 1475 H ARG A 627 75.951 0.170 15.630 1.00 0.00 H ATOM 1476 N ASN A 628 79.317 0.095 16.211 1.00 33.72 N ATOM 1477 CA ASN A 628 80.605 -0.159 16.875 1.00 33.04 C ATOM 1478 C ASN A 628 81.079 -1.600 16.743 1.00 36.62 C ATOM 1479 O ASN A 628 81.879 -2.089 17.549 1.00 35.29 O ATOM 1480 CB ASN A 628 80.539 0.285 18.346 1.00 34.96 C ATOM 1481 CG ASN A 628 80.458 1.776 18.460 1.00 45.87 C ATOM 1482 OD1 ASN A 628 81.048 2.486 17.672 1.00 45.34 O ATOM 1483 ND2 ASN A 628 79.664 2.289 19.380 1.00 39.01 N ATOM 1484 HD22 ASN A 628 79.167 1.663 20.046 1.00 0.00 H ATOM 1485 HD21 ASN A 628 79.535 3.319 19.439 1.00 0.00 H ATOM 1486 H ASN A 628 78.462 -0.229 16.707 1.00 0.00 H ATOM 1487 N VAL A 629 80.559 -2.287 15.726 1.00 33.69 N ATOM 1488 CA VAL A 629 80.966 -3.637 15.351 1.00 31.94 C ATOM 1489 C VAL A 629 81.384 -3.506 13.897 1.00 37.29 C ATOM 1490 O VAL A 629 80.649 -2.916 13.093 1.00 35.41 O ATOM 1491 CB VAL A 629 79.867 -4.701 15.531 1.00 32.72 C ATOM 1492 CG1 VAL A 629 80.357 -6.063 15.047 1.00 32.07 C ATOM 1493 CG2 VAL A 629 79.414 -4.778 16.980 1.00 30.69 C ATOM 1494 H VAL A 629 79.814 -1.830 15.162 1.00 0.00 H ATOM 1495 N LEU A 630 82.596 -3.971 13.572 1.00 34.11 N ATOM 1496 CA LEU A 630 83.087 -3.874 12.195 1.00 34.25 C ATOM 1497 C LEU A 630 83.155 -5.251 11.562 1.00 37.19 C ATOM 1498 O LEU A 630 83.255 -6.240 12.292 1.00 36.64 O ATOM 1499 CB LEU A 630 84.428 -3.136 12.139 1.00 34.41 C ATOM 1500 CG LEU A 630 84.452 -1.689 12.697 1.00 38.94 C ATOM 1501 CD1 LEU A 630 85.839 -1.134 12.655 1.00 38.56 C ATOM 1502 CD2 LEU A 630 83.547 -0.743 11.893 1.00 41.44 C ATOM 1503 H LEU A 630 83.195 -4.405 14.303 1.00 0.00 H ATOM 1504 N VAL A 631 82.994 -5.330 10.227 1.00 34.29 N ATOM 1505 CA VAL A 631 82.981 -6.612 9.530 1.00 34.35 C ATOM 1506 C VAL A 631 84.135 -6.703 8.546 1.00 39.25 C ATOM 1507 O VAL A 631 84.280 -5.838 7.685 1.00 38.59 O ATOM 1508 CB VAL A 631 81.606 -6.911 8.867 1.00 37.69 C ATOM 1509 CG1 VAL A 631 81.584 -8.327 8.321 1.00 36.05 C ATOM 1510 CG2 VAL A 631 80.445 -6.700 9.870 1.00 36.64 C ATOM 1511 H VAL A 631 82.876 -4.454 9.679 1.00 0.00 H ATOM 1512 N THR A 632 84.963 -7.742 8.695 1.00 37.91 N ATOM 1513 CA THR A 632 86.119 -7.958 7.831 1.00 39.17 C ATOM 1514 C THR A 632 85.699 -8.550 6.493 1.00 44.90 C ATOM 1515 O THR A 632 84.534 -8.912 6.331 1.00 44.20 O ATOM 1516 CB THR A 632 87.178 -8.864 8.489 1.00 37.76 C ATOM 1517 OG1 THR A 632 86.651 -10.181 8.567 1.00 39.24 O ATOM 1518 CG2 THR A 632 87.651 -8.356 9.849 1.00 33.73 C ATOM 1519 HG1 THR A 632 87.319 -10.778 8.988 1.00 0.00 H ATOM 1520 H THR A 632 84.776 -8.424 9.458 1.00 0.00 H ATOM 1521 N GLU A 633 86.676 -8.713 5.559 1.00 44.14 N ATOM 1522 CA GLU A 633 86.450 -9.321 4.230 1.00 44.24 C ATOM 1523 C GLU A 633 85.943 -10.765 4.376 1.00 48.53 C ATOM 1524 O GLU A 633 85.156 -11.222 3.552 1.00 49.21 O ATOM 1525 CB GLU A 633 87.723 -9.255 3.373 1.00 45.99 C ATOM 1526 CG GLU A 633 87.533 -9.626 1.899 1.00 58.14 C ATOM 1527 CD GLU A 633 86.568 -8.830 1.029 1.00 75.85 C ATOM 1528 OE1 GLU A 633 86.555 -7.579 1.116 1.00 62.59 O ATOM 1529 OE2 GLU A 633 85.872 -9.464 0.202 1.00 70.08 O ATOM 1530 H GLU A 633 87.637 -8.391 5.794 1.00 0.00 H ATOM 1531 N ASP A 634 86.329 -11.430 5.470 1.00 45.48 N ATOM 1532 CA ASP A 634 85.966 -12.810 5.792 1.00 46.31 C ATOM 1533 C ASP A 634 84.725 -12.955 6.674 1.00 47.05 C ATOM 1534 O ASP A 634 84.493 -14.035 7.209 1.00 46.07 O ATOM 1535 CB ASP A 634 87.180 -13.527 6.419 1.00 48.98 C ATOM 1536 CG ASP A 634 88.374 -13.559 5.483 1.00 61.67 C ATOM 1537 OD1 ASP A 634 88.203 -13.975 4.319 1.00 60.72 O ATOM 1538 OD2 ASP A 634 89.466 -13.119 5.900 1.00 72.60 O ATOM 1539 H ASP A 634 86.936 -10.925 6.147 1.00 0.00 H ATOM 1540 N ASN A 635 83.917 -11.881 6.797 1.00 43.28 N ATOM 1541 CA ASN A 635 82.676 -11.829 7.574 1.00 42.30 C ATOM 1542 C ASN A 635 82.869 -12.117 9.063 1.00 45.40 C ATOM 1543 O ASN A 635 82.026 -12.774 9.686 1.00 46.43 O ATOM 1544 CB ASN A 635 81.615 -12.754 6.961 1.00 43.47 C ATOM 1545 CG ASN A 635 81.380 -12.486 5.504 1.00 52.16 C ATOM 1546 OD1 ASN A 635 81.367 -11.339 5.067 1.00 48.07 O ATOM 1547 ND2 ASN A 635 81.259 -13.546 4.717 1.00 42.19 N ATOM 1548 HD22 ASN A 635 81.275 -14.502 5.126 1.00 0.00 H ATOM 1549 HD21 ASN A 635 81.148 -13.422 3.690 1.00 0.00 H ATOM 1550 H ASN A 635 84.200 -11.014 6.296 1.00 0.00 H ATOM 1551 N VAL A 636 84.001 -11.676 9.610 1.00 38.75 N ATOM 1552 CA VAL A 636 84.308 -11.844 11.022 1.00 37.18 C ATOM 1553 C VAL A 636 83.840 -10.576 11.692 1.00 40.00 C ATOM 1554 O VAL A 636 84.156 -9.482 11.229 1.00 38.86 O ATOM 1555 CB VAL A 636 85.826 -12.100 11.291 1.00 39.69 C ATOM 1556 CG1 VAL A 636 86.115 -12.204 12.800 1.00 37.66 C ATOM 1557 CG2 VAL A 636 86.336 -13.342 10.551 1.00 39.37 C ATOM 1558 H VAL A 636 84.693 -11.192 9.003 1.00 0.00 H ATOM 1559 N MET A 637 83.091 -10.723 12.785 1.00 35.91 N ATOM 1560 CA MET A 637 82.580 -9.595 13.558 1.00 33.57 C ATOM 1561 C MET A 637 83.680 -9.165 14.505 1.00 35.13 C ATOM 1562 O MET A 637 84.229 -10.014 15.182 1.00 33.93 O ATOM 1563 CB MET A 637 81.326 -10.012 14.371 1.00 34.39 C ATOM 1564 CG MET A 637 80.152 -10.542 13.527 1.00 37.18 C ATOM 1565 SD MET A 637 79.593 -9.376 12.272 1.00 41.61 S ATOM 1566 CE MET A 637 79.737 -10.349 10.835 1.00 39.58 C ATOM 1567 H MET A 637 82.860 -11.686 13.102 1.00 0.00 H ATOM 1568 N LYS A 638 84.009 -7.865 14.540 1.00 31.99 N ATOM 1569 CA LYS A 638 85.035 -7.298 15.419 1.00 30.40 C ATOM 1570 C LYS A 638 84.469 -6.118 16.217 1.00 34.88 C ATOM 1571 O LYS A 638 84.104 -5.109 15.629 1.00 34.04 O ATOM 1572 CB LYS A 638 86.249 -6.838 14.595 1.00 29.88 C ATOM 1573 CG LYS A 638 87.046 -8.026 14.063 1.00 39.60 C ATOM 1574 CD LYS A 638 88.328 -7.653 13.366 1.00 38.41 C ATOM 1575 CE LYS A 638 89.191 -8.868 13.055 1.00 35.69 C ATOM 1576 NZ LYS A 638 89.816 -9.428 14.277 1.00 36.32 N ATOM 1577 HZ1 LYS A 638 90.418 -8.705 14.720 1.00 0.00 H ATOM 1578 HZ2 LYS A 638 89.072 -9.718 14.944 1.00 0.00 H ATOM 1579 HZ3 LYS A 638 90.395 -10.253 14.022 1.00 0.00 H ATOM 1580 H LYS A 638 83.503 -7.218 13.902 1.00 0.00 H ATOM 1581 N ILE A 639 84.456 -6.212 17.545 1.00 33.64 N ATOM 1582 CA ILE A 639 83.994 -5.093 18.389 1.00 33.31 C ATOM 1583 C ILE A 639 85.009 -3.931 18.222 1.00 34.83 C ATOM 1584 O ILE A 639 86.218 -4.136 18.339 1.00 33.07 O ATOM 1585 CB ILE A 639 83.867 -5.443 19.914 1.00 36.36 C ATOM 1586 CG1 ILE A 639 83.053 -6.751 20.216 1.00 37.65 C ATOM 1587 CG2 ILE A 639 83.308 -4.243 20.699 1.00 35.04 C ATOM 1588 CD1 ILE A 639 81.685 -6.784 19.776 1.00 42.95 C ATOM 1589 H ILE A 639 84.778 -7.092 17.997 1.00 0.00 H ATOM 1590 N ALA A 640 84.507 -2.721 18.028 1.00 29.11 N ATOM 1591 CA ALA A 640 85.361 -1.558 17.862 1.00 30.26 C ATOM 1592 C ALA A 640 85.133 -0.586 18.999 1.00 37.98 C ATOM 1593 O ALA A 640 84.142 -0.712 19.731 1.00 38.48 O ATOM 1594 CB ALA A 640 85.044 -0.886 16.519 1.00 30.69 C ATOM 1595 H ALA A 640 83.475 -2.600 17.994 1.00 0.00 H ATOM 1596 N ASP A 641 86.046 0.390 19.148 1.00 36.22 N ATOM 1597 CA ASP A 641 85.950 1.492 20.114 1.00 36.96 C ATOM 1598 C ASP A 641 85.642 1.036 21.513 1.00 41.82 C ATOM 1599 O ASP A 641 84.796 1.625 22.186 1.00 41.38 O ATOM 1600 CB ASP A 641 84.900 2.530 19.617 1.00 38.83 C ATOM 1601 CG ASP A 641 85.297 3.309 18.371 1.00 46.73 C ATOM 1602 OD1 ASP A 641 86.348 2.985 17.772 1.00 45.06 O ATOM 1603 OD2 ASP A 641 84.523 4.189 17.954 1.00 56.12 O ATOM 1604 H ASP A 641 86.884 0.362 18.532 1.00 0.00 H ATOM 1605 N PHE A 642 86.305 -0.050 21.945 1.00 41.44 N ATOM 1606 CA PHE A 642 86.100 -0.633 23.278 1.00 41.38 C ATOM 1607 C PHE A 642 86.925 0.014 24.374 1.00 51.40 C ATOM 1608 O PHE A 642 86.679 -0.273 25.541 1.00 53.59 O ATOM 1609 CB PHE A 642 86.339 -2.141 23.255 1.00 41.47 C ATOM 1610 CG PHE A 642 87.628 -2.576 22.597 1.00 41.59 C ATOM 1611 CD1 PHE A 642 88.816 -2.624 23.320 1.00 41.97 C ATOM 1612 CD2 PHE A 642 87.645 -2.986 21.269 1.00 40.83 C ATOM 1613 CE1 PHE A 642 90.000 -3.058 22.719 1.00 43.09 C ATOM 1614 CE2 PHE A 642 88.837 -3.398 20.664 1.00 43.04 C ATOM 1615 CZ PHE A 642 90.006 -3.432 21.391 1.00 41.26 C ATOM 1616 H PHE A 642 86.994 -0.498 21.307 1.00 0.00 H ATOM 1617 N GLY A 643 87.882 0.866 24.012 1.00 50.69 N ATOM 1618 CA GLY A 643 88.760 1.512 24.988 1.00 52.30 C ATOM 1619 C GLY A 643 88.814 3.026 24.958 1.00 59.17 C ATOM 1620 O GLY A 643 89.869 3.607 25.226 1.00 59.79 O ATOM 1621 H GLY A 643 88.010 1.079 23.002 1.00 0.00 H ATOM 1622 N LEU A 644 87.673 3.683 24.657 1.00 56.96 N ATOM 1623 CA LEU A 644 87.591 5.148 24.591 1.00 70.05 C ATOM 1624 C LEU A 644 87.555 5.754 25.991 1.00112.73 C ATOM 1625 O LEU A 644 87.060 5.124 26.923 1.00 84.17 O ATOM 1626 CB LEU A 644 86.366 5.620 23.769 1.00 69.45 C ATOM 1627 CG LEU A 644 86.254 5.207 22.286 1.00 72.57 C ATOM 1628 CD1 LEU A 644 84.902 5.593 21.729 1.00 72.01 C ATOM 1629 CD2 LEU A 644 87.326 5.859 21.436 1.00 74.60 C ATOM 1630 H LEU A 644 86.815 3.128 24.464 1.00 0.00 H TER 1631 LEU A 644 ATOM 1632 N ILE A 651 78.613 13.841 28.042 1.00 75.91 N ATOM 1633 CA ILE A 651 77.635 12.854 27.575 1.00 73.86 C ATOM 1634 C ILE A 651 76.306 13.537 27.226 1.00 77.04 C ATOM 1635 O ILE A 651 75.402 13.634 28.066 1.00 77.26 O ATOM 1636 CB ILE A 651 77.468 11.690 28.586 1.00 75.87 C ATOM 1637 HN3 ILE A 651 78.245 14.318 28.890 1.00 0.00 H ATOM 1638 HN2 ILE A 651 78.780 14.543 27.293 1.00 0.00 H ATOM 1639 HN1 ILE A 651 79.506 13.360 28.273 1.00 0.00 H ATOM 1640 N ASP A 652 76.210 14.055 25.989 1.00 72.22 N ATOM 1641 CA ASP A 652 75.008 14.742 25.516 1.00 71.38 C ATOM 1642 C ASP A 652 73.948 13.727 25.062 1.00 69.84 C ATOM 1643 O ASP A 652 74.142 13.036 24.057 1.00 67.76 O ATOM 1644 CB ASP A 652 75.349 15.760 24.403 1.00 74.13 C ATOM 1645 CG ASP A 652 74.176 16.586 23.897 1.00 85.45 C ATOM 1646 OD1 ASP A 652 73.172 16.721 24.641 1.00 85.28 O ATOM 1647 OD2 ASP A 652 74.280 17.141 22.781 1.00 93.26 O ATOM 1648 H ASP A 652 77.021 13.964 25.344 1.00 0.00 H ATOM 1649 N TYR A 653 72.827 13.649 25.813 1.00 63.49 N ATOM 1650 CA TYR A 653 71.717 12.738 25.528 1.00 61.15 C ATOM 1651 C TYR A 653 70.946 13.086 24.253 1.00 62.39 C ATOM 1652 O TYR A 653 70.322 12.202 23.668 1.00 60.35 O ATOM 1653 CB TYR A 653 70.779 12.627 26.739 1.00 63.11 C ATOM 1654 CG TYR A 653 71.346 11.851 27.916 1.00 65.71 C ATOM 1655 CD1 TYR A 653 72.492 11.067 27.779 1.00 66.91 C ATOM 1656 CD2 TYR A 653 70.703 11.849 29.148 1.00 67.63 C ATOM 1657 CE1 TYR A 653 72.999 10.329 28.847 1.00 68.03 C ATOM 1658 CE2 TYR A 653 71.207 11.123 30.229 1.00 68.69 C ATOM 1659 CZ TYR A 653 72.352 10.359 30.071 1.00 76.15 C ATOM 1660 OH TYR A 653 72.858 9.648 31.133 1.00 76.87 O ATOM 1661 HH TYR A 653 73.672 9.163 30.846 1.00 0.00 H ATOM 1662 H TYR A 653 72.748 14.272 26.642 1.00 0.00 H ATOM 1663 N TYR A 654 71.011 14.355 23.803 1.00 58.99 N ATOM 1664 CA TYR A 654 70.316 14.819 22.600 1.00 59.01 C ATOM 1665 C TYR A 654 71.178 14.731 21.333 1.00 63.35 C ATOM 1666 O TYR A 654 70.635 14.777 20.232 1.00 63.49 O ATOM 1667 CB TYR A 654 69.736 16.224 22.818 1.00 61.10 C ATOM 1668 CG TYR A 654 68.708 16.249 23.927 1.00 62.25 C ATOM 1669 CD1 TYR A 654 69.094 16.359 25.261 1.00 64.16 C ATOM 1670 CD2 TYR A 654 67.352 16.114 23.650 1.00 62.97 C ATOM 1671 CE1 TYR A 654 68.157 16.313 26.292 1.00 63.22 C ATOM 1672 CE2 TYR A 654 66.402 16.110 24.671 1.00 64.03 C ATOM 1673 CZ TYR A 654 66.810 16.209 25.993 1.00 70.50 C ATOM 1674 OH TYR A 654 65.877 16.218 27.009 1.00 71.03 O ATOM 1675 HH TYR A 654 66.341 16.294 27.880 1.00 0.00 H ATOM 1676 H TYR A 654 71.584 15.039 24.337 1.00 0.00 H ATOM 1677 N LYS A 655 72.501 14.540 21.490 1.00 59.93 N ATOM 1678 CA LYS A 655 73.464 14.391 20.394 1.00 59.06 C ATOM 1679 C LYS A 655 73.205 13.109 19.590 1.00 61.31 C ATOM 1680 O LYS A 655 73.147 12.015 20.161 1.00 60.06 O ATOM 1681 CB LYS A 655 74.902 14.378 20.938 1.00 60.90 C ATOM 1682 H LYS A 655 72.868 14.495 22.462 1.00 0.00 H ATOM 1683 N LYS A 656 73.040 13.260 18.264 1.00 57.56 N ATOM 1684 CA LYS A 656 72.787 12.161 17.332 1.00 55.85 C ATOM 1685 C LYS A 656 74.081 11.666 16.686 1.00 59.88 C ATOM 1686 O LYS A 656 75.078 12.386 16.662 1.00 60.25 O ATOM 1687 CB LYS A 656 71.789 12.584 16.247 1.00 58.21 C ATOM 1688 CG LYS A 656 70.397 12.909 16.763 1.00 57.84 C ATOM 1689 CD LYS A 656 69.451 13.165 15.632 1.00 58.65 C ATOM 1690 CE LYS A 656 68.082 13.500 16.157 1.00 70.54 C ATOM 1691 NZ LYS A 656 67.188 13.975 15.074 1.00 80.55 N ATOM 1692 HZ1 LYS A 656 67.594 14.829 14.641 1.00 0.00 H ATOM 1693 HZ2 LYS A 656 67.093 13.231 14.354 1.00 0.00 H ATOM 1694 HZ3 LYS A 656 66.253 14.197 15.471 1.00 0.00 H ATOM 1695 H LYS A 656 73.096 14.223 17.875 1.00 0.00 H ATOM 1696 N THR A 657 74.057 10.433 16.147 1.00 55.23 N ATOM 1697 CA THR A 657 75.195 9.811 15.470 1.00 53.57 C ATOM 1698 C THR A 657 75.296 10.393 14.066 1.00 59.91 C ATOM 1699 O THR A 657 74.442 11.183 13.659 1.00 59.98 O ATOM 1700 CB THR A 657 75.001 8.284 15.362 1.00 55.52 C ATOM 1701 OG1 THR A 657 73.825 8.005 14.601 1.00 55.02 O ATOM 1702 CG2 THR A 657 74.916 7.593 16.708 1.00 54.08 C ATOM 1703 HG1 THR A 657 73.040 8.407 15.050 1.00 0.00 H ATOM 1704 H THR A 657 73.174 9.888 16.216 1.00 0.00 H ATOM 1705 N THR A 658 76.325 9.949 13.316 1.00 57.70 N ATOM 1706 CA THR A 658 76.620 10.261 11.919 1.00 58.93 C ATOM 1707 C THR A 658 75.391 9.918 11.045 1.00 61.55 C ATOM 1708 O THR A 658 75.075 10.669 10.125 1.00 62.63 O ATOM 1709 CB THR A 658 77.922 9.498 11.533 1.00 70.59 C ATOM 1710 OG1 THR A 658 79.054 10.307 11.869 1.00 71.17 O ATOM 1711 CG2 THR A 658 77.984 9.071 10.062 1.00 70.84 C ATOM 1712 HG1 THR A 658 79.885 9.827 11.626 1.00 0.00 H ATOM 1713 H THR A 658 76.990 9.305 13.790 1.00 0.00 H ATOM 1714 N ASN A 659 74.694 8.801 11.374 1.00 55.50 N ATOM 1715 CA ASN A 659 73.505 8.294 10.673 1.00 54.85 C ATOM 1716 C ASN A 659 72.164 8.866 11.245 1.00 56.67 C ATOM 1717 O ASN A 659 71.080 8.443 10.830 1.00 56.73 O ATOM 1718 CB ASN A 659 73.534 6.750 10.652 1.00 55.55 C ATOM 1719 CG ASN A 659 72.549 6.093 9.711 1.00 83.22 C ATOM 1720 OD1 ASN A 659 72.551 6.323 8.496 1.00 82.66 O ATOM 1721 ND2 ASN A 659 71.695 5.234 10.250 1.00 71.30 N ATOM 1722 HD22 ASN A 659 71.712 5.057 11.275 1.00 0.00 H ATOM 1723 HD21 ASN A 659 71.008 4.737 9.648 1.00 0.00 H ATOM 1724 H ASN A 659 75.030 8.256 12.193 1.00 0.00 H ATOM 1725 N GLY A 660 72.263 9.843 12.155 1.00 51.01 N ATOM 1726 CA GLY A 660 71.116 10.531 12.742 1.00 50.96 C ATOM 1727 C GLY A 660 70.327 9.778 13.804 1.00 53.70 C ATOM 1728 O GLY A 660 69.183 10.134 14.088 1.00 54.21 O ATOM 1729 H GLY A 660 73.214 10.129 12.463 1.00 0.00 H ATOM 1730 N ARG A 661 70.919 8.747 14.411 1.00 48.16 N ATOM 1731 CA ARG A 661 70.250 7.975 15.470 1.00 46.80 C ATOM 1732 C ARG A 661 70.701 8.424 16.849 1.00 49.17 C ATOM 1733 O ARG A 661 71.786 8.990 16.971 1.00 49.96 O ATOM 1734 CB ARG A 661 70.508 6.479 15.292 1.00 45.49 C ATOM 1735 CG ARG A 661 69.683 5.864 14.186 1.00 47.09 C ATOM 1736 CD ARG A 661 69.918 4.391 14.238 1.00 50.60 C ATOM 1737 NE ARG A 661 69.621 3.734 12.974 1.00 45.57 N ATOM 1738 CZ ARG A 661 69.939 2.474 12.721 1.00 55.04 C ATOM 1739 NH1 ARG A 661 70.605 1.757 13.623 1.00 37.16 N ATOM 1740 NH2 ARG A 661 69.585 1.915 11.574 1.00 44.44 N ATOM 1741 HE ARG A 661 69.136 4.280 12.234 1.00 0.00 H ATOM 1742 HH12 ARG A 661 70.853 0.767 13.421 1.00 0.00 H ATOM 1743 HH11 ARG A 661 70.877 2.186 14.530 1.00 0.00 H ATOM 1744 HH22 ARG A 661 69.836 0.925 11.379 1.00 0.00 H ATOM 1745 HH21 ARG A 661 69.055 2.466 10.869 1.00 0.00 H ATOM 1746 H ARG A 661 71.883 8.481 14.126 1.00 0.00 H ATOM 1747 N LEU A 662 69.886 8.154 17.885 1.00 44.17 N ATOM 1748 CA LEU A 662 70.182 8.534 19.267 1.00 43.99 C ATOM 1749 C LEU A 662 70.800 7.406 20.104 1.00 47.34 C ATOM 1750 O LEU A 662 70.084 6.476 20.482 1.00 46.57 O ATOM 1751 CB LEU A 662 68.950 9.111 19.987 1.00 44.33 C ATOM 1752 CG LEU A 662 68.387 10.415 19.471 1.00 49.32 C ATOM 1753 CD1 LEU A 662 66.930 10.505 19.803 1.00 49.46 C ATOM 1754 CD2 LEU A 662 69.127 11.602 20.057 1.00 52.95 C ATOM 1755 H LEU A 662 68.998 7.648 17.693 1.00 0.00 H ATOM 1756 N PRO A 663 72.102 7.530 20.465 1.00 43.61 N ATOM 1757 CA PRO A 663 72.776 6.477 21.265 1.00 42.26 C ATOM 1758 C PRO A 663 72.155 6.114 22.625 1.00 42.82 C ATOM 1759 O PRO A 663 72.440 5.030 23.123 1.00 40.30 O ATOM 1760 CB PRO A 663 74.204 7.024 21.437 1.00 43.73 C ATOM 1761 CG PRO A 663 74.402 7.870 20.222 1.00 47.91 C ATOM 1762 CD PRO A 663 73.070 8.565 20.040 1.00 44.74 C ATOM 1763 N VAL A 664 71.326 6.993 23.223 1.00 38.80 N ATOM 1764 CA VAL A 664 70.622 6.699 24.487 1.00 37.16 C ATOM 1765 C VAL A 664 69.698 5.478 24.308 1.00 37.35 C ATOM 1766 O VAL A 664 69.378 4.815 25.279 1.00 34.47 O ATOM 1767 CB VAL A 664 69.834 7.917 25.054 1.00 42.92 C ATOM 1768 CG1 VAL A 664 70.791 8.974 25.574 1.00 44.28 C ATOM 1769 CG2 VAL A 664 68.861 8.526 24.028 1.00 42.72 C ATOM 1770 H VAL A 664 71.176 7.919 22.774 1.00 0.00 H ATOM 1771 N LYS A 665 69.341 5.139 23.042 1.00 33.72 N ATOM 1772 CA LYS A 665 68.442 4.021 22.718 1.00 31.78 C ATOM 1773 C LYS A 665 69.095 2.642 22.938 1.00 33.96 C ATOM 1774 O LYS A 665 68.419 1.620 22.879 1.00 32.12 O ATOM 1775 CB LYS A 665 67.876 4.194 21.305 1.00 31.50 C ATOM 1776 CG LYS A 665 66.745 5.232 21.301 1.00 35.76 C ATOM 1777 CD LYS A 665 66.438 5.813 19.908 1.00 32.48 C ATOM 1778 CE LYS A 665 65.412 6.931 20.080 1.00 34.98 C ATOM 1779 NZ LYS A 665 64.731 7.247 18.808 1.00 32.05 N ATOM 1780 HZ1 LYS A 665 65.435 7.553 18.106 1.00 0.00 H ATOM 1781 HZ2 LYS A 665 64.238 6.400 18.460 1.00 0.00 H ATOM 1782 HZ3 LYS A 665 64.042 8.010 18.965 1.00 0.00 H ATOM 1783 H LYS A 665 69.725 5.702 22.257 1.00 0.00 H ATOM 1784 N TRP A 666 70.406 2.628 23.168 1.00 29.89 N ATOM 1785 CA TRP A 666 71.167 1.412 23.463 1.00 30.19 C ATOM 1786 C TRP A 666 71.514 1.322 24.955 1.00 35.44 C ATOM 1787 O TRP A 666 72.045 0.303 25.397 1.00 34.74 O ATOM 1788 CB TRP A 666 72.463 1.394 22.608 1.00 28.62 C ATOM 1789 CG TRP A 666 72.247 1.024 21.169 1.00 29.38 C ATOM 1790 CD1 TRP A 666 72.389 -0.213 20.627 1.00 31.38 C ATOM 1791 CD2 TRP A 666 71.710 1.861 20.124 1.00 30.44 C ATOM 1792 NE1 TRP A 666 72.044 -0.194 19.296 1.00 30.66 N ATOM 1793 CE2 TRP A 666 71.622 1.066 18.959 1.00 33.78 C ATOM 1794 CE3 TRP A 666 71.316 3.211 20.051 1.00 32.34 C ATOM 1795 CZ2 TRP A 666 71.214 1.591 17.717 1.00 33.96 C ATOM 1796 CZ3 TRP A 666 70.907 3.728 18.823 1.00 33.69 C ATOM 1797 CH2 TRP A 666 70.849 2.921 17.680 1.00 34.29 C ATOM 1798 HE1 TRP A 666 72.095 -1.006 18.648 1.00 0.00 H ATOM 1799 H TRP A 666 70.919 3.532 23.136 1.00 0.00 H ATOM 1800 N MET A 667 71.262 2.395 25.726 1.00 33.91 N ATOM 1801 CA MET A 667 71.658 2.441 27.139 1.00 34.87 C ATOM 1802 C MET A 667 70.740 1.751 28.106 1.00 36.36 C ATOM 1803 O MET A 667 69.541 2.021 28.100 1.00 33.76 O ATOM 1804 CB MET A 667 71.868 3.883 27.630 1.00 38.58 C ATOM 1805 CG MET A 667 72.907 4.653 26.879 1.00 44.53 C ATOM 1806 SD MET A 667 73.212 6.181 27.784 1.00 52.27 S ATOM 1807 CE MET A 667 74.422 6.875 26.781 1.00 49.68 C ATOM 1808 H MET A 667 70.774 3.214 25.310 1.00 0.00 H ATOM 1809 N ALA A 668 71.319 0.986 29.060 1.00 34.27 N ATOM 1810 CA ALA A 668 70.510 0.391 30.127 1.00 33.60 C ATOM 1811 C ALA A 668 69.901 1.515 30.978 1.00 37.08 C ATOM 1812 O ALA A 668 70.525 2.584 31.113 1.00 36.43 O ATOM 1813 CB ALA A 668 71.361 -0.516 31.002 1.00 34.22 C ATOM 1814 H ALA A 668 72.345 0.819 29.036 1.00 0.00 H ATOM 1815 N PRO A 669 68.685 1.298 31.555 1.00 33.63 N ATOM 1816 CA PRO A 669 68.059 2.340 32.379 1.00 34.12 C ATOM 1817 C PRO A 669 68.937 2.798 33.529 1.00 37.44 C ATOM 1818 O PRO A 669 69.032 4.001 33.759 1.00 35.03 O ATOM 1819 CB PRO A 669 66.766 1.679 32.872 1.00 35.97 C ATOM 1820 CG PRO A 669 66.486 0.653 31.870 1.00 39.66 C ATOM 1821 CD PRO A 669 67.814 0.113 31.465 1.00 34.08 C ATOM 1822 N GLU A 670 69.630 1.862 34.209 1.00 35.64 N ATOM 1823 CA GLU A 670 70.520 2.261 35.306 1.00 36.36 C ATOM 1824 C GLU A 670 71.750 3.041 34.786 1.00 38.15 C ATOM 1825 O GLU A 670 72.256 3.879 35.509 1.00 37.91 O ATOM 1826 CB GLU A 670 70.901 1.078 36.217 1.00 37.63 C ATOM 1827 CG GLU A 670 71.867 0.079 35.582 1.00 42.46 C ATOM 1828 CD GLU A 670 71.315 -0.927 34.583 1.00 44.06 C ATOM 1829 OE1 GLU A 670 70.100 -0.909 34.284 1.00 34.84 O ATOM 1830 OE2 GLU A 670 72.122 -1.741 34.089 1.00 30.40 O ATOM 1831 H GLU A 670 69.534 0.858 33.956 1.00 0.00 H ATOM 1832 N ALA A 671 72.150 2.856 33.519 1.00 35.86 N ATOM 1833 CA ALA A 671 73.273 3.622 32.940 1.00 36.23 C ATOM 1834 C ALA A 671 72.769 5.010 32.560 1.00 42.43 C ATOM 1835 O ALA A 671 73.416 6.013 32.842 1.00 44.59 O ATOM 1836 CB ALA A 671 73.856 2.913 31.705 1.00 35.47 C ATOM 1837 H ALA A 671 71.657 2.155 32.929 1.00 0.00 H ATOM 1838 N LEU A 672 71.601 5.059 31.956 1.00 39.44 N ATOM 1839 CA LEU A 672 70.972 6.300 31.546 1.00 41.84 C ATOM 1840 C LEU A 672 70.519 7.170 32.728 1.00 49.64 C ATOM 1841 O LEU A 672 70.895 8.339 32.772 1.00 52.21 O ATOM 1842 CB LEU A 672 69.830 5.979 30.584 1.00 42.31 C ATOM 1843 CG LEU A 672 69.109 7.133 29.925 1.00 50.34 C ATOM 1844 CD1 LEU A 672 69.928 7.703 28.787 1.00 51.25 C ATOM 1845 CD2 LEU A 672 67.778 6.660 29.386 1.00 52.49 C ATOM 1846 H LEU A 672 71.105 4.165 31.763 1.00 0.00 H ATOM 1847 N PHE A 673 69.795 6.608 33.712 1.00 45.14 N ATOM 1848 CA PHE A 673 69.287 7.397 34.837 1.00 47.63 C ATOM 1849 C PHE A 673 70.235 7.527 36.023 1.00 54.77 C ATOM 1850 O PHE A 673 70.222 8.563 36.675 1.00 56.53 O ATOM 1851 CB PHE A 673 67.908 6.882 35.321 1.00 49.17 C ATOM 1852 CG PHE A 673 66.866 6.777 34.222 1.00 49.91 C ATOM 1853 CD1 PHE A 673 66.441 7.904 33.534 1.00 53.62 C ATOM 1854 CD2 PHE A 673 66.287 5.555 33.905 1.00 50.45 C ATOM 1855 CE1 PHE A 673 65.485 7.801 32.521 1.00 54.94 C ATOM 1856 CE2 PHE A 673 65.337 5.454 32.896 1.00 53.16 C ATOM 1857 CZ PHE A 673 64.947 6.573 32.206 1.00 52.61 C ATOM 1858 H PHE A 673 69.591 5.589 33.673 1.00 0.00 H ATOM 1859 N ASP A 674 71.022 6.489 36.331 1.00 50.93 N ATOM 1860 CA ASP A 674 71.887 6.518 37.513 1.00 51.13 C ATOM 1861 C ASP A 674 73.386 6.530 37.180 1.00 52.74 C ATOM 1862 O ASP A 674 74.207 6.502 38.097 1.00 50.73 O ATOM 1863 CB ASP A 674 71.508 5.358 38.458 1.00 52.55 C ATOM 1864 CG ASP A 674 70.006 5.255 38.700 1.00 60.89 C ATOM 1865 OD1 ASP A 674 69.359 6.311 38.903 1.00 61.83 O ATOM 1866 OD2 ASP A 674 69.474 4.128 38.644 1.00 63.57 O ATOM 1867 H ASP A 674 71.019 5.647 35.720 1.00 0.00 H ATOM 1868 N ARG A 675 73.727 6.612 35.869 1.00 49.46 N ATOM 1869 CA ARG A 675 75.092 6.616 35.327 1.00 49.89 C ATOM 1870 C ARG A 675 75.945 5.434 35.865 1.00 52.73 C ATOM 1871 O ARG A 675 77.149 5.575 36.081 1.00 53.88 O ATOM 1872 CB ARG A 675 75.767 7.989 35.521 1.00 52.23 C ATOM 1873 H ARG A 675 72.948 6.678 35.183 1.00 0.00 H ATOM 1874 N ILE A 676 75.301 4.271 36.072 1.00 46.95 N ATOM 1875 CA ILE A 676 75.947 3.044 36.521 1.00 46.28 C ATOM 1876 C ILE A 676 76.193 2.169 35.297 1.00 46.27 C ATOM 1877 O ILE A 676 75.262 1.609 34.742 1.00 42.70 O ATOM 1878 CB ILE A 676 75.115 2.298 37.601 1.00 50.76 C ATOM 1879 CG1 ILE A 676 75.039 3.119 38.917 1.00 52.10 C ATOM 1880 CG2 ILE A 676 75.751 0.918 37.859 1.00 53.47 C ATOM 1881 CD1 ILE A 676 73.897 2.745 39.801 1.00 58.36 C ATOM 1882 H ILE A 676 74.276 4.246 35.900 1.00 0.00 H ATOM 1883 N TYR A 677 77.451 2.057 34.887 1.00 43.70 N ATOM 1884 CA TYR A 677 77.876 1.264 33.749 1.00 41.22 C ATOM 1885 C TYR A 677 78.586 0.028 34.272 1.00 42.06 C ATOM 1886 O TYR A 677 79.496 0.147 35.077 1.00 41.50 O ATOM 1887 CB TYR A 677 78.799 2.093 32.882 1.00 42.90 C ATOM 1888 CG TYR A 677 78.112 3.140 32.031 1.00 45.81 C ATOM 1889 CD1 TYR A 677 77.661 2.836 30.750 1.00 46.75 C ATOM 1890 CD2 TYR A 677 77.996 4.461 32.471 1.00 48.44 C ATOM 1891 CE1 TYR A 677 77.101 3.818 29.924 1.00 49.57 C ATOM 1892 CE2 TYR A 677 77.441 5.452 31.653 1.00 49.81 C ATOM 1893 CZ TYR A 677 77.005 5.126 30.377 1.00 59.74 C ATOM 1894 OH TYR A 677 76.460 6.088 29.557 1.00 67.50 O ATOM 1895 HH TYR A 677 75.656 6.472 29.989 1.00 0.00 H ATOM 1896 H TYR A 677 78.181 2.573 35.418 1.00 0.00 H ATOM 1897 N THR A 678 78.111 -1.158 33.879 1.00 36.14 N ATOM 1898 CA THR A 678 78.630 -2.453 34.317 1.00 33.92 C ATOM 1899 C THR A 678 78.665 -3.383 33.102 1.00 35.53 C ATOM 1900 O THR A 678 78.208 -2.986 32.028 1.00 33.15 O ATOM 1901 CB THR A 678 77.679 -3.069 35.387 1.00 37.66 C ATOM 1902 OG1 THR A 678 76.383 -3.284 34.822 1.00 41.71 O ATOM 1903 CG2 THR A 678 77.570 -2.250 36.677 1.00 32.60 C ATOM 1904 HG1 THR A 678 76.011 -2.420 34.513 1.00 0.00 H ATOM 1905 H THR A 678 77.313 -1.160 33.212 1.00 0.00 H ATOM 1906 N HIS A 679 79.109 -4.647 33.272 1.00 32.25 N ATOM 1907 CA HIS A 679 78.984 -5.630 32.194 1.00 32.18 C ATOM 1908 C HIS A 679 77.475 -5.886 31.953 1.00 35.71 C ATOM 1909 O HIS A 679 77.064 -6.143 30.826 1.00 35.33 O ATOM 1910 CB HIS A 679 79.655 -6.956 32.556 1.00 32.59 C ATOM 1911 CG HIS A 679 81.123 -6.836 32.825 1.00 35.23 C ATOM 1912 ND1 HIS A 679 81.996 -6.341 31.872 1.00 35.67 N ATOM 1913 CD2 HIS A 679 81.822 -7.125 33.943 1.00 35.70 C ATOM 1914 CE1 HIS A 679 83.185 -6.318 32.454 1.00 34.82 C ATOM 1915 NE2 HIS A 679 83.135 -6.802 33.676 1.00 35.48 N ATOM 1916 H HIS A 679 79.543 -4.924 34.175 1.00 0.00 H ATOM 1917 N GLN A 680 76.663 -5.783 33.015 1.00 32.65 N ATOM 1918 CA GLN A 680 75.201 -5.978 32.962 1.00 31.45 C ATOM 1919 C GLN A 680 74.500 -4.942 32.098 1.00 33.40 C ATOM 1920 O GLN A 680 73.530 -5.268 31.411 1.00 32.63 O ATOM 1921 CB GLN A 680 74.619 -5.990 34.383 1.00 32.20 C ATOM 1922 CG GLN A 680 75.276 -7.077 35.254 1.00 35.35 C ATOM 1923 CD GLN A 680 75.119 -6.799 36.703 1.00 48.16 C ATOM 1924 OE1 GLN A 680 74.862 -5.670 37.094 1.00 44.54 O ATOM 1925 NE2 GLN A 680 75.170 -7.836 37.528 1.00 43.40 N ATOM 1926 HE22 GLN A 680 75.392 -8.783 37.160 1.00 0.00 H ATOM 1927 HE21 GLN A 680 74.988 -7.702 38.543 1.00 0.00 H ATOM 1928 H GLN A 680 77.090 -5.551 33.934 1.00 0.00 H ATOM 1929 N SER A 681 75.012 -3.700 32.103 1.00 30.71 N ATOM 1930 CA SER A 681 74.462 -2.630 31.259 1.00 30.79 C ATOM 1931 C SER A 681 74.879 -2.794 29.785 1.00 33.72 C ATOM 1932 O SER A 681 74.116 -2.403 28.882 1.00 32.57 O ATOM 1933 CB SER A 681 74.791 -1.250 31.827 1.00 34.23 C ATOM 1934 OG SER A 681 76.184 -1.016 31.872 1.00 44.08 O ATOM 1935 HG SER A 681 76.557 -1.072 30.956 1.00 0.00 H ATOM 1936 H SER A 681 75.821 -3.490 32.722 1.00 0.00 H ATOM 1937 N ASP A 682 76.050 -3.446 29.534 1.00 30.37 N ATOM 1938 CA ASP A 682 76.518 -3.784 28.181 1.00 29.12 C ATOM 1939 C ASP A 682 75.629 -4.931 27.635 1.00 31.70 C ATOM 1940 O ASP A 682 75.441 -5.036 26.438 1.00 32.08 O ATOM 1941 CB ASP A 682 77.983 -4.266 28.233 1.00 30.70 C ATOM 1942 CG ASP A 682 79.072 -3.183 28.165 1.00 37.17 C ATOM 1943 OD1 ASP A 682 78.729 -1.985 27.913 1.00 34.13 O ATOM 1944 OD2 ASP A 682 80.263 -3.540 28.288 1.00 35.97 O ATOM 1945 H ASP A 682 76.644 -3.719 30.343 1.00 0.00 H ATOM 1946 N VAL A 683 75.162 -5.843 28.526 1.00 28.81 N ATOM 1947 CA VAL A 683 74.279 -6.964 28.136 1.00 26.55 C ATOM 1948 C VAL A 683 72.951 -6.364 27.671 1.00 29.10 C ATOM 1949 O VAL A 683 72.453 -6.753 26.619 1.00 30.30 O ATOM 1950 CB VAL A 683 74.132 -8.035 29.244 1.00 28.38 C ATOM 1951 CG1 VAL A 683 72.957 -9.000 28.964 1.00 27.09 C ATOM 1952 CG2 VAL A 683 75.450 -8.795 29.454 1.00 26.43 C ATOM 1953 H VAL A 683 75.437 -5.750 29.525 1.00 0.00 H ATOM 1954 N TRP A 684 72.452 -5.335 28.372 1.00 26.19 N ATOM 1955 CA TRP A 684 71.264 -4.616 27.911 1.00 26.58 C ATOM 1956 C TRP A 684 71.519 -4.111 26.472 1.00 31.01 C ATOM 1957 O TRP A 684 70.743 -4.420 25.572 1.00 32.24 O ATOM 1958 CB TRP A 684 70.921 -3.457 28.862 1.00 26.28 C ATOM 1959 CG TRP A 684 69.773 -2.614 28.365 1.00 28.26 C ATOM 1960 CD1 TRP A 684 69.783 -1.773 27.288 1.00 31.26 C ATOM 1961 CD2 TRP A 684 68.455 -2.573 28.892 1.00 28.50 C ATOM 1962 NE1 TRP A 684 68.562 -1.179 27.137 1.00 30.87 N ATOM 1963 CE2 TRP A 684 67.702 -1.697 28.071 1.00 32.60 C ATOM 1964 CE3 TRP A 684 67.828 -3.164 30.003 1.00 29.95 C ATOM 1965 CZ2 TRP A 684 66.365 -1.381 28.342 1.00 31.58 C ATOM 1966 CZ3 TRP A 684 66.494 -2.866 30.249 1.00 31.30 C ATOM 1967 CH2 TRP A 684 65.779 -1.988 29.427 1.00 32.03 C ATOM 1968 HE1 TRP A 684 68.324 -0.454 26.430 1.00 0.00 H ATOM 1969 H TRP A 684 72.916 -5.044 29.256 1.00 0.00 H ATOM 1970 N SER A 685 72.632 -3.371 26.245 1.00 27.98 N ATOM 1971 CA SER A 685 73.008 -2.853 24.927 1.00 26.72 C ATOM 1972 C SER A 685 73.070 -3.980 23.904 1.00 30.56 C ATOM 1973 O SER A 685 72.627 -3.814 22.767 1.00 31.51 O ATOM 1974 CB SER A 685 74.363 -2.152 25.015 1.00 28.85 C ATOM 1975 OG SER A 685 74.314 -1.056 25.917 1.00 29.30 O ATOM 1976 HG SER A 685 75.203 -0.621 25.955 1.00 0.00 H ATOM 1977 H SER A 685 73.254 -3.159 27.051 1.00 0.00 H ATOM 1978 N PHE A 686 73.615 -5.142 24.308 1.00 29.00 N ATOM 1979 CA PHE A 686 73.719 -6.316 23.431 1.00 28.86 C ATOM 1980 C PHE A 686 72.318 -6.819 23.017 1.00 35.16 C ATOM 1981 O PHE A 686 72.174 -7.384 21.929 1.00 36.22 O ATOM 1982 CB PHE A 686 74.507 -7.446 24.115 1.00 29.70 C ATOM 1983 CG PHE A 686 74.627 -8.677 23.243 1.00 31.06 C ATOM 1984 CD1 PHE A 686 75.512 -8.706 22.166 1.00 33.67 C ATOM 1985 CD2 PHE A 686 73.829 -9.792 23.473 1.00 32.74 C ATOM 1986 CE1 PHE A 686 75.607 -9.832 21.355 1.00 34.48 C ATOM 1987 CE2 PHE A 686 73.939 -10.927 22.664 1.00 35.68 C ATOM 1988 CZ PHE A 686 74.834 -10.944 21.623 1.00 33.90 C ATOM 1989 H PHE A 686 73.977 -5.212 25.280 1.00 0.00 H ATOM 1990 N GLY A 687 71.321 -6.625 23.892 1.00 30.46 N ATOM 1991 CA GLY A 687 69.934 -6.956 23.589 1.00 29.83 C ATOM 1992 C GLY A 687 69.440 -6.098 22.442 1.00 31.82 C ATOM 1993 O GLY A 687 68.804 -6.598 21.523 1.00 30.42 O ATOM 1994 H GLY A 687 71.546 -6.222 24.824 1.00 0.00 H ATOM 1995 N VAL A 688 69.743 -4.790 22.486 1.00 30.48 N ATOM 1996 CA VAL A 688 69.390 -3.834 21.422 1.00 31.00 C ATOM 1997 C VAL A 688 70.156 -4.220 20.148 1.00 34.82 C ATOM 1998 O VAL A 688 69.568 -4.227 19.071 1.00 36.42 O ATOM 1999 CB VAL A 688 69.631 -2.355 21.836 1.00 33.51 C ATOM 2000 CG1 VAL A 688 69.101 -1.377 20.764 1.00 32.75 C ATOM 2001 CG2 VAL A 688 68.970 -2.067 23.170 1.00 32.82 C ATOM 2002 H VAL A 688 70.255 -4.432 23.317 1.00 0.00 H ATOM 2003 N LEU A 689 71.441 -4.587 20.275 1.00 31.47 N ATOM 2004 CA LEU A 689 72.268 -5.028 19.125 1.00 30.99 C ATOM 2005 C LEU A 689 71.635 -6.271 18.468 1.00 32.99 C ATOM 2006 O LEU A 689 71.570 -6.340 17.252 1.00 32.40 O ATOM 2007 CB LEU A 689 73.735 -5.319 19.569 1.00 30.75 C ATOM 2008 CG LEU A 689 74.808 -5.308 18.445 1.00 36.11 C ATOM 2009 CD1 LEU A 689 76.173 -5.087 18.995 1.00 35.28 C ATOM 2010 CD2 LEU A 689 74.865 -6.601 17.723 1.00 39.11 C ATOM 2011 H LEU A 689 71.875 -4.561 21.220 1.00 0.00 H ATOM 2012 N LEU A 690 71.165 -7.248 19.271 1.00 31.32 N ATOM 2013 CA LEU A 690 70.470 -8.433 18.745 1.00 32.60 C ATOM 2014 C LEU A 690 69.246 -8.017 17.905 1.00 37.97 C ATOM 2015 O LEU A 690 69.026 -8.583 16.851 1.00 37.87 O ATOM 2016 CB LEU A 690 69.974 -9.306 19.903 1.00 32.39 C ATOM 2017 CG LEU A 690 70.965 -10.221 20.626 1.00 35.20 C ATOM 2018 CD1 LEU A 690 70.298 -10.854 21.808 1.00 32.69 C ATOM 2019 CD2 LEU A 690 71.474 -11.334 19.724 1.00 37.50 C ATOM 2020 H LEU A 690 71.299 -7.160 20.299 1.00 0.00 H ATOM 2021 N TRP A 691 68.444 -7.035 18.394 1.00 36.23 N ATOM 2022 CA TRP A 691 67.255 -6.509 17.707 1.00 35.16 C ATOM 2023 C TRP A 691 67.690 -5.889 16.399 1.00 37.88 C ATOM 2024 O TRP A 691 67.010 -6.080 15.397 1.00 38.28 O ATOM 2025 CB TRP A 691 66.524 -5.487 18.604 1.00 33.26 C ATOM 2026 CG TRP A 691 65.216 -5.000 18.056 1.00 34.31 C ATOM 2027 CD1 TRP A 691 63.976 -5.480 18.352 1.00 37.59 C ATOM 2028 CD2 TRP A 691 65.017 -3.901 17.142 1.00 34.51 C ATOM 2029 NE1 TRP A 691 63.017 -4.780 17.651 1.00 37.81 N ATOM 2030 CE2 TRP A 691 63.629 -3.804 16.901 1.00 38.61 C ATOM 2031 CE3 TRP A 691 65.881 -2.996 16.502 1.00 35.36 C ATOM 2032 CZ2 TRP A 691 63.078 -2.829 16.053 1.00 38.20 C ATOM 2033 CZ3 TRP A 691 65.335 -2.030 15.665 1.00 38.26 C ATOM 2034 CH2 TRP A 691 63.944 -1.950 15.453 1.00 39.26 C ATOM 2035 HE1 TRP A 691 61.994 -4.962 17.684 1.00 0.00 H ATOM 2036 H TRP A 691 68.688 -6.627 19.319 1.00 0.00 H ATOM 2037 N GLU A 692 68.858 -5.183 16.384 1.00 34.26 N ATOM 2038 CA GLU A 692 69.444 -4.617 15.162 1.00 33.43 C ATOM 2039 C GLU A 692 69.796 -5.704 14.178 1.00 37.26 C ATOM 2040 O GLU A 692 69.592 -5.502 12.997 1.00 38.85 O ATOM 2041 CB GLU A 692 70.725 -3.811 15.450 1.00 34.46 C ATOM 2042 CG GLU A 692 70.524 -2.517 16.204 1.00 32.43 C ATOM 2043 CD GLU A 692 71.836 -1.789 16.362 1.00 44.62 C ATOM 2044 OE1 GLU A 692 72.535 -2.044 17.369 1.00 31.68 O ATOM 2045 OE2 GLU A 692 72.174 -0.968 15.478 1.00 32.60 O ATOM 2046 H GLU A 692 69.359 -5.038 17.284 1.00 0.00 H ATOM 2047 N ILE A 693 70.349 -6.845 14.634 1.00 33.75 N ATOM 2048 CA ILE A 693 70.719 -7.957 13.731 1.00 32.54 C ATOM 2049 C ILE A 693 69.461 -8.528 13.077 1.00 36.32 C ATOM 2050 O ILE A 693 69.375 -8.588 11.855 1.00 35.53 O ATOM 2051 CB ILE A 693 71.533 -9.078 14.474 1.00 34.43 C ATOM 2052 CG1 ILE A 693 72.906 -8.545 14.966 1.00 33.29 C ATOM 2053 CG2 ILE A 693 71.696 -10.373 13.599 1.00 33.05 C ATOM 2054 CD1 ILE A 693 73.655 -9.451 15.935 1.00 26.68 C ATOM 2055 H ILE A 693 70.521 -6.947 15.654 1.00 0.00 H ATOM 2056 N PHE A 694 68.465 -8.904 13.907 1.00 35.18 N ATOM 2057 CA PHE A 694 67.246 -9.556 13.425 1.00 35.86 C ATOM 2058 C PHE A 694 66.305 -8.616 12.644 1.00 40.16 C ATOM 2059 O PHE A 694 65.496 -9.126 11.869 1.00 40.22 O ATOM 2060 CB PHE A 694 66.558 -10.334 14.562 1.00 37.79 C ATOM 2061 CG PHE A 694 67.462 -11.515 14.856 1.00 39.11 C ATOM 2062 CD1 PHE A 694 67.642 -12.524 13.916 1.00 44.51 C ATOM 2063 CD2 PHE A 694 68.255 -11.535 15.993 1.00 41.42 C ATOM 2064 CE1 PHE A 694 68.573 -13.549 14.132 1.00 45.88 C ATOM 2065 CE2 PHE A 694 69.165 -12.573 16.216 1.00 43.60 C ATOM 2066 CZ PHE A 694 69.334 -13.557 15.273 1.00 42.58 C ATOM 2067 H PHE A 694 68.567 -8.724 14.926 1.00 0.00 H ATOM 2068 N THR A 695 66.513 -7.277 12.703 1.00 37.00 N ATOM 2069 CA THR A 695 65.758 -6.332 11.854 1.00 38.37 C ATOM 2070 C THR A 695 66.623 -5.916 10.649 1.00 44.11 C ATOM 2071 O THR A 695 66.246 -5.010 9.879 1.00 45.30 O ATOM 2072 CB THR A 695 65.277 -5.116 12.631 1.00 41.50 C ATOM 2073 OG1 THR A 695 66.409 -4.499 13.242 1.00 40.48 O ATOM 2074 CG2 THR A 695 64.190 -5.456 13.647 1.00 36.13 C ATOM 2075 HG1 THR A 695 66.844 -5.144 13.854 1.00 0.00 H ATOM 2076 H THR A 695 67.224 -6.905 13.364 1.00 0.00 H ATOM 2077 N LEU A 696 67.811 -6.553 10.514 1.00 39.95 N ATOM 2078 CA LEU A 696 68.747 -6.294 9.421 1.00 39.16 C ATOM 2079 C LEU A 696 69.193 -4.836 9.359 1.00 41.11 C ATOM 2080 O LEU A 696 69.219 -4.213 8.291 1.00 39.56 O ATOM 2081 CB LEU A 696 68.143 -6.774 8.067 1.00 40.70 C ATOM 2082 CG LEU A 696 67.998 -8.289 7.879 1.00 45.21 C ATOM 2083 CD1 LEU A 696 67.307 -8.595 6.543 1.00 46.65 C ATOM 2084 CD2 LEU A 696 69.372 -8.962 7.880 1.00 45.54 C ATOM 2085 H LEU A 696 68.071 -7.265 11.226 1.00 0.00 H ATOM 2086 N GLY A 697 69.581 -4.315 10.512 1.00 37.11 N ATOM 2087 CA GLY A 697 70.028 -2.934 10.636 1.00 37.13 C ATOM 2088 C GLY A 697 68.877 -1.971 10.859 1.00 40.30 C ATOM 2089 O GLY A 697 68.963 -0.798 10.496 1.00 39.01 O ATOM 2090 H GLY A 697 69.566 -4.914 11.362 1.00 0.00 H ATOM 2091 N GLY A 698 67.805 -2.459 11.471 1.00 37.32 N ATOM 2092 CA GLY A 698 66.662 -1.621 11.789 1.00 37.04 C ATOM 2093 C GLY A 698 67.050 -0.583 12.817 1.00 39.68 C ATOM 2094 O GLY A 698 67.995 -0.776 13.588 1.00 38.43 O ATOM 2095 H GLY A 698 67.783 -3.466 11.729 1.00 0.00 H ATOM 2096 N SER A 699 66.312 0.508 12.843 1.00 37.56 N ATOM 2097 CA SER A 699 66.547 1.636 13.742 1.00 37.74 C ATOM 2098 C SER A 699 65.705 1.501 15.030 1.00 39.72 C ATOM 2099 O SER A 699 64.492 1.488 14.936 1.00 38.97 O ATOM 2100 CB SER A 699 66.235 2.940 13.009 1.00 41.58 C ATOM 2101 OG SER A 699 66.571 4.076 13.785 1.00 52.29 O ATOM 2102 HG SER A 699 66.053 4.063 14.629 1.00 0.00 H ATOM 2103 H SER A 699 65.512 0.570 12.182 1.00 0.00 H ATOM 2104 N PRO A 700 66.296 1.379 16.240 1.00 36.57 N ATOM 2105 CA PRO A 700 65.456 1.245 17.453 1.00 36.12 C ATOM 2106 C PRO A 700 64.606 2.481 17.701 1.00 40.05 C ATOM 2107 O PRO A 700 65.112 3.598 17.579 1.00 39.69 O ATOM 2108 CB PRO A 700 66.481 1.092 18.579 1.00 36.40 C ATOM 2109 CG PRO A 700 67.737 0.727 17.906 1.00 39.59 C ATOM 2110 CD PRO A 700 67.729 1.358 16.582 1.00 35.83 C ATOM 2111 N TYR A 701 63.323 2.284 18.075 1.00 35.86 N ATOM 2112 CA TYR A 701 62.424 3.386 18.381 1.00 36.57 C ATOM 2113 C TYR A 701 62.446 4.528 17.345 1.00 38.25 C ATOM 2114 O TYR A 701 62.752 5.664 17.684 1.00 36.25 O ATOM 2115 CB TYR A 701 62.703 3.912 19.795 1.00 39.23 C ATOM 2116 CG TYR A 701 62.278 2.942 20.868 1.00 43.53 C ATOM 2117 CD1 TYR A 701 61.010 2.365 20.851 1.00 45.32 C ATOM 2118 CD2 TYR A 701 63.143 2.588 21.895 1.00 45.17 C ATOM 2119 CE1 TYR A 701 60.611 1.472 21.838 1.00 46.18 C ATOM 2120 CE2 TYR A 701 62.753 1.689 22.890 1.00 46.09 C ATOM 2121 CZ TYR A 701 61.482 1.142 22.859 1.00 54.80 C ATOM 2122 OH TYR A 701 61.092 0.227 23.813 1.00 59.96 O ATOM 2123 HH TYR A 701 61.148 0.643 24.710 1.00 0.00 H ATOM 2124 H TYR A 701 62.965 1.310 18.147 1.00 0.00 H ATOM 2125 N PRO A 702 62.135 4.273 16.067 1.00 37.50 N ATOM 2126 CA PRO A 702 62.158 5.381 15.102 1.00 36.93 C ATOM 2127 C PRO A 702 61.067 6.430 15.417 1.00 40.85 C ATOM 2128 O PRO A 702 59.926 6.073 15.754 1.00 38.96 O ATOM 2129 CB PRO A 702 61.969 4.665 13.754 1.00 39.35 C ATOM 2130 CG PRO A 702 61.173 3.440 14.079 1.00 43.54 C ATOM 2131 CD PRO A 702 61.702 3.005 15.434 1.00 38.69 C ATOM 2132 N GLY A 703 61.458 7.710 15.371 1.00 38.44 N ATOM 2133 CA GLY A 703 60.589 8.856 15.638 1.00 38.08 C ATOM 2134 C GLY A 703 60.395 9.150 17.119 1.00 39.60 C ATOM 2135 O GLY A 703 59.604 10.018 17.479 1.00 38.75 O ATOM 2136 H GLY A 703 62.451 7.903 15.128 1.00 0.00 H ATOM 2137 N VAL A 704 61.110 8.425 17.997 1.00 35.87 N ATOM 2138 CA VAL A 704 60.997 8.580 19.456 1.00 34.81 C ATOM 2139 C VAL A 704 62.060 9.570 19.966 1.00 38.76 C ATOM 2140 O VAL A 704 63.241 9.271 19.929 1.00 36.55 O ATOM 2141 CB VAL A 704 61.040 7.205 20.195 1.00 36.13 C ATOM 2142 CG1 VAL A 704 61.016 7.377 21.718 1.00 34.97 C ATOM 2143 CG2 VAL A 704 59.888 6.308 19.733 1.00 35.89 C ATOM 2144 H VAL A 704 61.777 7.719 17.626 1.00 0.00 H ATOM 2145 N PRO A 705 61.681 10.762 20.432 1.00 38.45 N ATOM 2146 CA PRO A 705 62.701 11.677 20.950 1.00 39.51 C ATOM 2147 C PRO A 705 63.115 11.248 22.353 1.00 45.16 C ATOM 2148 O PRO A 705 62.445 10.403 22.974 1.00 45.02 O ATOM 2149 CB PRO A 705 62.009 13.052 20.922 1.00 41.83 C ATOM 2150 CG PRO A 705 60.583 12.776 20.822 1.00 46.38 C ATOM 2151 CD PRO A 705 60.328 11.327 20.574 1.00 40.67 C ATOM 2152 N VAL A 706 64.221 11.823 22.846 1.00 40.44 N ATOM 2153 CA VAL A 706 64.822 11.502 24.140 1.00 38.91 C ATOM 2154 C VAL A 706 63.828 11.461 25.320 1.00 41.93 C ATOM 2155 O VAL A 706 63.843 10.485 26.087 1.00 40.37 O ATOM 2156 CB VAL A 706 65.994 12.468 24.410 1.00 44.18 C ATOM 2157 CG1 VAL A 706 66.481 12.369 25.848 1.00 45.00 C ATOM 2158 CG2 VAL A 706 67.138 12.218 23.436 1.00 42.65 C ATOM 2159 H VAL A 706 64.686 12.550 22.266 1.00 0.00 H ATOM 2160 N GLU A 707 62.981 12.504 25.470 1.00 39.83 N ATOM 2161 CA GLU A 707 62.037 12.591 26.592 1.00 40.64 C ATOM 2162 C GLU A 707 60.974 11.505 26.568 1.00 42.50 C ATOM 2163 O GLU A 707 60.565 11.033 27.627 1.00 39.86 O ATOM 2164 CB GLU A 707 61.393 13.987 26.691 1.00 44.32 C ATOM 2165 H GLU A 707 62.998 13.271 24.767 1.00 0.00 H ATOM 2166 N GLU A 708 60.513 11.121 25.358 1.00 39.39 N ATOM 2167 CA GLU A 708 59.519 10.053 25.197 1.00 38.37 C ATOM 2168 C GLU A 708 60.198 8.694 25.462 1.00 40.12 C ATOM 2169 O GLU A 708 59.570 7.803 26.034 1.00 38.91 O ATOM 2170 CB GLU A 708 58.858 10.114 23.800 1.00 39.62 C ATOM 2171 CG GLU A 708 58.031 11.371 23.582 1.00 46.19 C ATOM 2172 CD GLU A 708 56.625 11.425 24.161 1.00 75.34 C ATOM 2173 OE1 GLU A 708 56.290 10.605 25.050 1.00 59.56 O ATOM 2174 OE2 GLU A 708 55.856 12.314 23.728 1.00 81.54 O ATOM 2175 H GLU A 708 60.876 11.600 24.509 1.00 0.00 H ATOM 2176 N LEU A 709 61.486 8.566 25.111 1.00 37.11 N ATOM 2177 CA LEU A 709 62.249 7.343 25.377 1.00 36.32 C ATOM 2178 C LEU A 709 62.317 7.075 26.872 1.00 40.41 C ATOM 2179 O LEU A 709 62.070 5.944 27.292 1.00 40.36 O ATOM 2180 CB LEU A 709 63.662 7.360 24.765 1.00 35.39 C ATOM 2181 CG LEU A 709 64.577 6.209 25.257 1.00 38.57 C ATOM 2182 CD1 LEU A 709 64.196 4.866 24.627 1.00 36.97 C ATOM 2183 CD2 LEU A 709 66.012 6.535 25.074 1.00 41.02 C ATOM 2184 H LEU A 709 61.959 9.360 24.635 1.00 0.00 H ATOM 2185 N PHE A 710 62.672 8.107 27.657 1.00 37.44 N ATOM 2186 CA PHE A 710 62.746 8.091 29.114 1.00 38.30 C ATOM 2187 C PHE A 710 61.445 7.573 29.708 1.00 42.45 C ATOM 2188 O PHE A 710 61.490 6.708 30.565 1.00 43.23 O ATOM 2189 CB PHE A 710 63.012 9.513 29.649 1.00 42.28 C ATOM 2190 CG PHE A 710 64.397 10.095 29.438 1.00 44.91 C ATOM 2191 CD1 PHE A 710 65.453 9.295 29.025 1.00 47.52 C ATOM 2192 CD2 PHE A 710 64.650 11.438 29.700 1.00 49.71 C ATOM 2193 CE1 PHE A 710 66.734 9.830 28.852 1.00 49.18 C ATOM 2194 CE2 PHE A 710 65.926 11.977 29.510 1.00 53.29 C ATOM 2195 CZ PHE A 710 66.963 11.164 29.118 1.00 50.03 C ATOM 2196 H PHE A 710 62.916 8.999 27.182 1.00 0.00 H ATOM 2197 N LYS A 711 60.292 8.092 29.236 1.00 38.27 N ATOM 2198 CA LYS A 711 58.966 7.686 29.681 1.00 38.91 C ATOM 2199 C LYS A 711 58.689 6.214 29.313 1.00 41.20 C ATOM 2200 O LYS A 711 58.171 5.477 30.142 1.00 40.23 O ATOM 2201 CB LYS A 711 57.895 8.639 29.110 1.00 41.78 C ATOM 2202 CG LYS A 711 56.510 8.414 29.688 1.00 57.91 C ATOM 2203 CD LYS A 711 55.416 9.084 28.851 1.00 72.82 C ATOM 2204 H LYS A 711 60.355 8.831 28.506 1.00 0.00 H ATOM 2205 N LEU A 712 59.056 5.779 28.093 1.00 37.22 N ATOM 2206 CA LEU A 712 58.903 4.379 27.668 1.00 35.94 C ATOM 2207 C LEU A 712 59.712 3.460 28.610 1.00 39.07 C ATOM 2208 O LEU A 712 59.221 2.407 29.040 1.00 38.54 O ATOM 2209 CB LEU A 712 59.404 4.191 26.204 1.00 35.73 C ATOM 2210 CG LEU A 712 58.547 4.726 25.030 1.00 39.80 C ATOM 2211 CD1 LEU A 712 59.180 4.311 23.703 1.00 39.40 C ATOM 2212 CD2 LEU A 712 57.124 4.182 25.066 1.00 40.16 C ATOM 2213 H LEU A 712 59.465 6.461 27.423 1.00 0.00 H ATOM 2214 N LEU A 713 60.942 3.872 28.949 1.00 35.88 N ATOM 2215 CA LEU A 713 61.777 3.095 29.864 1.00 37.36 C ATOM 2216 C LEU A 713 61.189 3.064 31.278 1.00 43.60 C ATOM 2217 O LEU A 713 61.183 2.000 31.894 1.00 43.11 O ATOM 2218 CB LEU A 713 63.225 3.614 29.901 1.00 37.02 C ATOM 2219 CG LEU A 713 64.067 3.416 28.628 1.00 40.37 C ATOM 2220 CD1 LEU A 713 65.390 4.068 28.791 1.00 39.14 C ATOM 2221 CD2 LEU A 713 64.268 1.928 28.288 1.00 41.64 C ATOM 2222 H LEU A 713 61.309 4.761 28.554 1.00 0.00 H ATOM 2223 N LYS A 714 60.685 4.215 31.789 1.00 41.08 N ATOM 2224 CA LYS A 714 60.097 4.259 33.136 1.00 42.25 C ATOM 2225 C LYS A 714 58.831 3.404 33.227 1.00 46.51 C ATOM 2226 O LYS A 714 58.564 2.826 34.284 1.00 47.14 O ATOM 2227 CB LYS A 714 59.845 5.698 33.629 1.00 46.25 C ATOM 2228 CG LYS A 714 61.114 6.566 33.777 1.00 50.27 C ATOM 2229 CD LYS A 714 61.980 6.228 34.985 1.00 57.05 C ATOM 2230 CE LYS A 714 62.992 7.321 35.264 1.00 74.11 C ATOM 2231 NZ LYS A 714 63.819 7.017 36.466 1.00 83.47 N ATOM 2232 HZ1 LYS A 714 63.200 6.925 37.297 1.00 0.00 H ATOM 2233 HZ2 LYS A 714 64.334 6.126 36.315 1.00 0.00 H ATOM 2234 HZ3 LYS A 714 64.498 7.789 36.622 1.00 0.00 H ATOM 2235 H LYS A 714 60.715 5.083 31.217 1.00 0.00 H ATOM 2236 N GLU A 715 58.093 3.269 32.101 1.00 40.35 N ATOM 2237 CA GLU A 715 56.868 2.459 32.007 1.00 40.50 C ATOM 2238 C GLU A 715 57.164 0.946 31.838 1.00 44.29 C ATOM 2239 O GLU A 715 56.236 0.135 31.859 1.00 46.61 O ATOM 2240 CB GLU A 715 56.022 2.912 30.805 1.00 41.88 C ATOM 2241 CG GLU A 715 55.307 4.238 30.959 1.00 52.91 C ATOM 2242 CD GLU A 715 54.771 4.801 29.655 1.00 70.21 C ATOM 2243 OE1 GLU A 715 54.929 4.145 28.598 1.00 64.56 O ATOM 2244 OE2 GLU A 715 54.238 5.933 29.685 1.00 68.36 O ATOM 2245 H GLU A 715 58.412 3.770 31.247 1.00 0.00 H ATOM 2246 N GLY A 716 58.427 0.586 31.615 1.00 38.05 N ATOM 2247 CA GLY A 716 58.814 -0.803 31.411 1.00 36.30 C ATOM 2248 C GLY A 716 58.525 -1.289 30.001 1.00 38.59 C ATOM 2249 O GLY A 716 58.371 -2.488 29.781 1.00 37.00 O ATOM 2250 H GLY A 716 59.161 1.322 31.586 1.00 0.00 H ATOM 2251 N HIS A 717 58.439 -0.365 29.028 1.00 35.52 N ATOM 2252 CA HIS A 717 58.195 -0.726 27.640 1.00 35.89 C ATOM 2253 C HIS A 717 59.408 -1.454 27.044 1.00 38.48 C ATOM 2254 O HIS A 717 60.538 -1.104 27.367 1.00 37.79 O ATOM 2255 CB HIS A 717 57.887 0.541 26.806 1.00 37.55 C ATOM 2256 CG HIS A 717 57.328 0.270 25.449 1.00 40.74 C ATOM 2257 ND1 HIS A 717 58.157 0.018 24.357 1.00 42.23 N ATOM 2258 CD2 HIS A 717 56.048 0.332 25.022 1.00 42.06 C ATOM 2259 CE1 HIS A 717 57.347 -0.140 23.324 1.00 41.42 C ATOM 2260 NE2 HIS A 717 56.067 0.047 23.678 1.00 42.38 N ATOM 2261 H HIS A 717 58.550 0.639 29.275 1.00 0.00 H ATOM 2262 N ARG A 718 59.155 -2.448 26.162 1.00 33.51 N ATOM 2263 CA ARG A 718 60.147 -3.228 25.448 1.00 33.91 C ATOM 2264 C ARG A 718 59.841 -3.219 23.946 1.00 43.38 C ATOM 2265 O ARG A 718 58.674 -3.171 23.570 1.00 44.57 O ATOM 2266 CB ARG A 718 60.208 -4.672 25.974 1.00 34.34 C ATOM 2267 CG ARG A 718 60.643 -4.809 27.460 1.00 40.49 C ATOM 2268 CD ARG A 718 62.006 -4.185 27.706 1.00 36.43 C ATOM 2269 NE ARG A 718 62.471 -4.330 29.083 1.00 31.72 N ATOM 2270 CZ ARG A 718 62.454 -3.364 29.992 1.00 37.30 C ATOM 2271 NH1 ARG A 718 61.984 -2.164 29.686 1.00 29.72 N ATOM 2272 NH2 ARG A 718 62.976 -3.570 31.197 1.00 29.70 N ATOM 2273 HE ARG A 718 62.842 -5.258 29.372 1.00 0.00 H ATOM 2274 HH12 ARG A 718 61.974 -1.411 30.403 1.00 0.00 H ATOM 2275 HH11 ARG A 718 61.625 -1.975 28.728 1.00 0.00 H ATOM 2276 HH22 ARG A 718 62.961 -2.810 31.907 1.00 0.00 H ATOM 2277 HH21 ARG A 718 63.400 -4.491 31.430 1.00 0.00 H ATOM 2278 H ARG A 718 58.156 -2.674 25.979 1.00 0.00 H ATOM 2279 N MET A 719 60.883 -3.250 23.085 1.00 42.02 N ATOM 2280 CA MET A 719 60.709 -3.250 21.629 1.00 42.73 C ATOM 2281 C MET A 719 60.003 -4.525 21.218 1.00 48.05 C ATOM 2282 O MET A 719 60.075 -5.524 21.945 1.00 45.87 O ATOM 2283 CB MET A 719 62.043 -3.100 20.891 1.00 44.83 C ATOM 2284 CG MET A 719 62.699 -1.757 21.111 1.00 48.39 C ATOM 2285 SD MET A 719 64.108 -1.404 20.031 1.00 51.29 S ATOM 2286 CE MET A 719 65.337 -2.334 20.764 1.00 46.47 C ATOM 2287 H MET A 719 61.848 -3.275 23.471 1.00 0.00 H ATOM 2288 N ASP A 720 59.254 -4.469 20.089 1.00 46.34 N ATOM 2289 CA ASP A 720 58.464 -5.598 19.565 1.00 45.96 C ATOM 2290 C ASP A 720 59.351 -6.695 19.037 1.00 44.50 C ATOM 2291 O ASP A 720 60.499 -6.430 18.720 1.00 44.97 O ATOM 2292 CB ASP A 720 57.538 -5.125 18.415 1.00 48.49 C ATOM 2293 H ASP A 720 59.236 -3.574 19.560 1.00 0.00 H ATOM 2294 N LYS A 721 58.800 -7.906 18.862 1.00 40.54 N ATOM 2295 CA LYS A 721 59.540 -8.997 18.247 1.00 40.49 C ATOM 2296 C LYS A 721 59.631 -8.750 16.758 1.00 46.35 C ATOM 2297 O LYS A 721 58.598 -8.665 16.090 1.00 47.37 O ATOM 2298 CB LYS A 721 58.878 -10.359 18.510 1.00 43.22 C ATOM 2299 CG LYS A 721 59.678 -11.537 17.940 1.00 47.54 C ATOM 2300 CD LYS A 721 59.046 -12.866 18.318 1.00 47.96 C ATOM 2301 CE LYS A 721 58.745 -13.691 17.117 1.00 64.32 C ATOM 2302 NZ LYS A 721 57.864 -14.836 17.461 1.00 83.58 N ATOM 2303 HZ1 LYS A 721 58.337 -15.436 18.167 1.00 0.00 H ATOM 2304 HZ2 LYS A 721 56.969 -14.478 17.852 1.00 0.00 H ATOM 2305 HZ3 LYS A 721 57.671 -15.393 16.604 1.00 0.00 H ATOM 2306 H LYS A 721 57.821 -8.068 19.173 1.00 0.00 H ATOM 2307 N PRO A 722 60.859 -8.650 16.211 1.00 42.69 N ATOM 2308 CA PRO A 722 60.994 -8.536 14.747 1.00 41.36 C ATOM 2309 C PRO A 722 60.431 -9.787 14.092 1.00 48.48 C ATOM 2310 O PRO A 722 60.468 -10.868 14.697 1.00 47.50 O ATOM 2311 CB PRO A 722 62.515 -8.574 14.520 1.00 41.91 C ATOM 2312 CG PRO A 722 63.136 -8.344 15.845 1.00 44.98 C ATOM 2313 CD PRO A 722 62.176 -8.764 16.885 1.00 41.08 C ATOM 2314 N SER A 723 59.966 -9.671 12.841 1.00 47.85 N ATOM 2315 CA SER A 723 59.512 -10.833 12.085 1.00 49.85 C ATOM 2316 C SER A 723 60.788 -11.616 11.696 1.00 54.79 C ATOM 2317 O SER A 723 61.874 -11.025 11.675 1.00 53.80 O ATOM 2318 CB SER A 723 58.745 -10.385 10.846 1.00 54.13 C ATOM 2319 OG SER A 723 59.481 -9.380 10.173 1.00 61.62 O ATOM 2320 HG SER A 723 58.982 -9.090 9.369 1.00 0.00 H ATOM 2321 H SER A 723 59.928 -8.731 12.399 1.00 0.00 H ATOM 2322 N ASN A 724 60.680 -12.926 11.420 1.00 53.74 N ATOM 2323 CA ASN A 724 61.864 -13.760 11.093 1.00 55.66 C ATOM 2324 C ASN A 724 62.904 -13.750 12.261 1.00 58.79 C ATOM 2325 O ASN A 724 64.115 -13.535 12.100 1.00 58.48 O ATOM 2326 CB ASN A 724 62.491 -13.411 9.713 1.00 60.35 C ATOM 2327 CG ASN A 724 63.501 -14.428 9.241 1.00 91.82 C ATOM 2328 OD1 ASN A 724 64.710 -14.182 9.250 1.00 90.57 O ATOM 2329 ND2 ASN A 724 63.036 -15.618 8.884 1.00 86.40 N ATOM 2330 HD22 ASN A 724 62.012 -15.798 8.886 1.00 0.00 H ATOM 2331 HD21 ASN A 724 63.696 -16.371 8.603 1.00 0.00 H ATOM 2332 H ASN A 724 59.739 -13.369 11.436 1.00 0.00 H ATOM 2333 N CYS A 725 62.369 -13.959 13.451 1.00 53.12 N ATOM 2334 CA CYS A 725 63.107 -14.016 14.690 1.00 51.25 C ATOM 2335 C CYS A 725 62.327 -15.000 15.523 1.00 53.15 C ATOM 2336 O CYS A 725 61.100 -14.916 15.596 1.00 54.26 O ATOM 2337 CB CYS A 725 63.183 -12.637 15.342 1.00 50.27 C ATOM 2338 SG CYS A 725 63.933 -12.634 16.983 1.00 52.74 S ATOM 2339 H CYS A 725 61.339 -14.092 13.498 1.00 0.00 H ATOM 2340 N THR A 726 63.017 -16.011 16.035 1.00 46.47 N ATOM 2341 CA THR A 726 62.401 -17.077 16.813 1.00 45.64 C ATOM 2342 C THR A 726 61.907 -16.568 18.161 1.00 46.93 C ATOM 2343 O THR A 726 62.356 -15.525 18.640 1.00 45.54 O ATOM 2344 CB THR A 726 63.385 -18.241 16.972 1.00 49.58 C ATOM 2345 OG1 THR A 726 64.539 -17.752 17.653 1.00 49.66 O ATOM 2346 CG2 THR A 726 63.789 -18.851 15.637 1.00 45.46 C ATOM 2347 HG1 THR A 726 65.190 -18.489 17.767 1.00 0.00 H ATOM 2348 H THR A 726 64.044 -16.044 15.874 1.00 0.00 H ATOM 2349 N ASN A 727 60.988 -17.299 18.776 1.00 44.35 N ATOM 2350 CA ASN A 727 60.504 -16.941 20.112 1.00 44.63 C ATOM 2351 C ASN A 727 61.678 -17.004 21.076 1.00 44.89 C ATOM 2352 O ASN A 727 61.776 -16.190 21.991 1.00 43.21 O ATOM 2353 CB ASN A 727 59.394 -17.906 20.576 1.00 47.73 C ATOM 2354 CG ASN A 727 58.069 -17.678 19.883 1.00 72.40 C ATOM 2355 OD1 ASN A 727 57.634 -16.542 19.671 1.00 61.40 O ATOM 2356 ND2 ASN A 727 57.393 -18.757 19.521 1.00 69.60 N ATOM 2357 HD22 ASN A 727 57.782 -19.703 19.711 1.00 0.00 H ATOM 2358 HD21 ASN A 727 56.473 -18.659 19.046 1.00 0.00 H ATOM 2359 H ASN A 727 60.604 -18.141 18.302 1.00 0.00 H ATOM 2360 N GLU A 728 62.576 -17.965 20.840 1.00 41.50 N ATOM 2361 CA GLU A 728 63.760 -18.203 21.645 1.00 41.48 C ATOM 2362 C GLU A 728 64.703 -16.994 21.622 1.00 41.99 C ATOM 2363 O GLU A 728 65.147 -16.563 22.681 1.00 39.98 O ATOM 2364 CB GLU A 728 64.475 -19.454 21.154 1.00 43.82 C ATOM 2365 CG GLU A 728 65.613 -19.869 22.057 1.00 47.86 C ATOM 2366 CD GLU A 728 66.271 -21.159 21.625 1.00 63.56 C ATOM 2367 OE1 GLU A 728 66.309 -21.436 20.404 1.00 53.36 O ATOM 2368 OE2 GLU A 728 66.800 -21.865 22.511 1.00 61.70 O ATOM 2369 H GLU A 728 62.415 -18.586 20.022 1.00 0.00 H ATOM 2370 N LEU A 729 64.996 -16.458 20.430 1.00 37.12 N ATOM 2371 CA LEU A 729 65.861 -15.295 20.296 1.00 36.83 C ATOM 2372 C LEU A 729 65.211 -14.021 20.818 1.00 39.56 C ATOM 2373 O LEU A 729 65.932 -13.186 21.334 1.00 40.36 O ATOM 2374 CB LEU A 729 66.397 -15.118 18.865 1.00 37.18 C ATOM 2375 CG LEU A 729 67.376 -16.191 18.409 1.00 41.84 C ATOM 2376 CD1 LEU A 729 67.481 -16.226 16.883 1.00 43.20 C ATOM 2377 CD2 LEU A 729 68.721 -16.049 19.089 1.00 39.14 C ATOM 2378 H LEU A 729 64.592 -16.887 19.573 1.00 0.00 H ATOM 2379 N TYR A 730 63.867 -13.875 20.733 1.00 35.78 N ATOM 2380 CA TYR A 730 63.170 -12.711 21.292 1.00 34.93 C ATOM 2381 C TYR A 730 63.222 -12.789 22.824 1.00 38.15 C ATOM 2382 O TYR A 730 63.412 -11.762 23.477 1.00 37.73 O ATOM 2383 CB TYR A 730 61.716 -12.585 20.802 1.00 37.04 C ATOM 2384 CG TYR A 730 61.019 -11.332 21.295 1.00 37.67 C ATOM 2385 CD1 TYR A 730 61.578 -10.072 21.089 1.00 39.54 C ATOM 2386 CD2 TYR A 730 59.808 -11.405 21.977 1.00 38.99 C ATOM 2387 CE1 TYR A 730 60.934 -8.913 21.522 1.00 38.53 C ATOM 2388 CE2 TYR A 730 59.151 -10.251 22.417 1.00 39.46 C ATOM 2389 CZ TYR A 730 59.709 -9.006 22.163 1.00 44.62 C ATOM 2390 OH TYR A 730 59.084 -7.854 22.575 1.00 42.49 O ATOM 2391 HH TYR A 730 59.627 -7.071 22.306 1.00 0.00 H ATOM 2392 H TYR A 730 63.311 -14.613 20.256 1.00 0.00 H ATOM 2393 N MET A 731 63.083 -14.011 23.388 1.00 35.81 N ATOM 2394 CA MET A 731 63.202 -14.272 24.826 1.00 36.97 C ATOM 2395 C MET A 731 64.619 -13.869 25.264 1.00 38.63 C ATOM 2396 O MET A 731 64.771 -13.235 26.299 1.00 38.32 O ATOM 2397 CB MET A 731 62.916 -15.761 25.147 1.00 40.91 C ATOM 2398 CG MET A 731 63.365 -16.213 26.553 1.00 45.68 C ATOM 2399 SD MET A 731 62.514 -17.673 27.249 1.00 52.33 S ATOM 2400 CE MET A 731 62.895 -18.920 26.003 1.00 49.49 C ATOM 2401 H MET A 731 62.879 -14.816 22.762 1.00 0.00 H ATOM 2402 N MET A 732 65.635 -14.160 24.434 1.00 33.59 N ATOM 2403 CA MET A 732 67.032 -13.810 24.742 1.00 32.22 C ATOM 2404 C MET A 732 67.156 -12.266 24.836 1.00 35.72 C ATOM 2405 O MET A 732 67.765 -11.746 25.766 1.00 35.63 O ATOM 2406 CB MET A 732 67.963 -14.328 23.643 1.00 33.40 C ATOM 2407 CG MET A 732 69.422 -13.955 23.896 1.00 34.66 C ATOM 2408 SD MET A 732 70.575 -14.610 22.688 1.00 36.55 S ATOM 2409 CE MET A 732 70.592 -16.324 23.147 1.00 33.81 C ATOM 2410 H MET A 732 65.427 -14.651 23.541 1.00 0.00 H ATOM 2411 N MET A 733 66.555 -11.549 23.868 1.00 33.69 N ATOM 2412 CA MET A 733 66.538 -10.078 23.813 1.00 31.80 C ATOM 2413 C MET A 733 65.901 -9.530 25.067 1.00 34.63 C ATOM 2414 O MET A 733 66.461 -8.640 25.695 1.00 35.08 O ATOM 2415 CB MET A 733 65.712 -9.602 22.620 1.00 33.10 C ATOM 2416 CG MET A 733 66.403 -9.745 21.322 1.00 36.24 C ATOM 2417 SD MET A 733 65.326 -9.160 19.993 1.00 38.88 S ATOM 2418 CE MET A 733 66.076 -9.959 18.668 1.00 35.08 C ATOM 2419 H MET A 733 66.071 -12.069 23.109 1.00 0.00 H ATOM 2420 N ARG A 734 64.710 -10.031 25.399 1.00 32.00 N ATOM 2421 CA ARG A 734 63.931 -9.645 26.569 1.00 32.03 C ATOM 2422 C ARG A 734 64.691 -9.930 27.853 1.00 33.95 C ATOM 2423 O ARG A 734 64.616 -9.125 28.770 1.00 36.21 O ATOM 2424 CB ARG A 734 62.542 -10.337 26.577 1.00 34.44 C ATOM 2425 CG ARG A 734 61.593 -9.947 25.433 1.00 39.29 C ATOM 2426 CD ARG A 734 61.183 -8.496 25.488 1.00 46.16 C ATOM 2427 NE ARG A 734 60.446 -8.229 26.717 1.00 64.53 N ATOM 2428 CZ ARG A 734 59.126 -8.112 26.788 1.00 78.07 C ATOM 2429 NH1 ARG A 734 58.386 -8.176 25.687 1.00 61.23 N ATOM 2430 NH2 ARG A 734 58.538 -7.892 27.955 1.00 71.25 N ATOM 2431 HE ARG A 734 60.991 -8.123 27.597 1.00 0.00 H ATOM 2432 HH12 ARG A 734 57.352 -8.084 25.749 1.00 0.00 H ATOM 2433 HH11 ARG A 734 58.841 -8.319 24.763 1.00 0.00 H ATOM 2434 HH22 ARG A 734 57.503 -7.801 28.007 1.00 0.00 H ATOM 2435 HH21 ARG A 734 59.111 -7.811 28.819 1.00 0.00 H ATOM 2436 H ARG A 734 64.305 -10.755 24.773 1.00 0.00 H ATOM 2437 N ASP A 735 65.418 -11.054 27.924 1.00 29.75 N ATOM 2438 CA ASP A 735 66.254 -11.410 29.083 1.00 30.85 C ATOM 2439 C ASP A 735 67.389 -10.411 29.279 1.00 32.60 C ATOM 2440 O ASP A 735 67.657 -10.006 30.416 1.00 30.32 O ATOM 2441 CB ASP A 735 66.783 -12.836 28.951 1.00 33.89 C ATOM 2442 CG ASP A 735 65.702 -13.885 29.173 1.00 36.69 C ATOM 2443 OD1 ASP A 735 64.609 -13.516 29.624 1.00 38.85 O ATOM 2444 OD2 ASP A 735 65.938 -15.056 28.839 1.00 38.29 O ATOM 2445 H ASP A 735 65.390 -11.710 27.117 1.00 0.00 H ATOM 2446 N CYS A 736 68.004 -9.971 28.161 1.00 29.17 N ATOM 2447 CA CYS A 736 69.057 -8.938 28.136 1.00 28.92 C ATOM 2448 C CYS A 736 68.472 -7.617 28.655 1.00 31.62 C ATOM 2449 O CYS A 736 69.162 -6.843 29.282 1.00 31.44 O ATOM 2450 CB CYS A 736 69.604 -8.761 26.718 1.00 28.88 C ATOM 2451 SG CYS A 736 70.678 -10.106 26.152 1.00 33.12 S ATOM 2452 H CYS A 736 67.715 -10.389 27.254 1.00 0.00 H ATOM 2453 N TRP A 737 67.195 -7.383 28.399 1.00 29.53 N ATOM 2454 CA TRP A 737 66.475 -6.182 28.836 1.00 29.63 C ATOM 2455 C TRP A 737 65.738 -6.343 30.182 1.00 32.24 C ATOM 2456 O TRP A 737 64.769 -5.622 30.430 1.00 30.35 O ATOM 2457 CB TRP A 737 65.490 -5.717 27.755 1.00 27.89 C ATOM 2458 CG TRP A 737 66.090 -5.443 26.404 1.00 27.60 C ATOM 2459 CD1 TRP A 737 67.336 -4.944 26.128 1.00 29.47 C ATOM 2460 CD2 TRP A 737 65.451 -5.659 25.141 1.00 27.71 C ATOM 2461 NE1 TRP A 737 67.487 -4.788 24.770 1.00 28.60 N ATOM 2462 CE2 TRP A 737 66.364 -5.266 24.135 1.00 30.71 C ATOM 2463 CE3 TRP A 737 64.173 -6.107 24.757 1.00 30.19 C ATOM 2464 CZ2 TRP A 737 66.024 -5.285 22.769 1.00 29.50 C ATOM 2465 CZ3 TRP A 737 63.852 -6.157 23.405 1.00 30.93 C ATOM 2466 CH2 TRP A 737 64.782 -5.772 22.429 1.00 31.24 C ATOM 2467 HE1 TRP A 737 68.317 -4.375 24.299 1.00 0.00 H ATOM 2468 H TRP A 737 66.669 -8.095 27.854 1.00 0.00 H ATOM 2469 N HIS A 738 66.234 -7.231 31.084 1.00 30.77 N ATOM 2470 CA HIS A 738 65.637 -7.366 32.415 1.00 29.76 C ATOM 2471 C HIS A 738 65.783 -6.060 33.144 1.00 32.85 C ATOM 2472 O HIS A 738 66.843 -5.441 33.080 1.00 32.28 O ATOM 2473 CB HIS A 738 66.279 -8.501 33.242 1.00 30.38 C ATOM 2474 CG HIS A 738 65.296 -9.130 34.197 1.00 34.13 C ATOM 2475 ND1 HIS A 738 64.866 -8.460 35.367 1.00 36.50 N ATOM 2476 CD2 HIS A 738 64.642 -10.312 34.105 1.00 35.11 C ATOM 2477 CE1 HIS A 738 63.987 -9.271 35.933 1.00 36.19 C ATOM 2478 NE2 HIS A 738 63.798 -10.388 35.198 1.00 36.06 N ATOM 2479 H HIS A 738 67.049 -7.823 30.825 1.00 0.00 H ATOM 2480 N ALA A 739 64.713 -5.608 33.798 1.00 32.08 N ATOM 2481 CA ALA A 739 64.749 -4.390 34.626 1.00 33.40 C ATOM 2482 C ALA A 739 65.819 -4.525 35.712 1.00 37.52 C ATOM 2483 O ALA A 739 66.519 -3.551 36.016 1.00 38.78 O ATOM 2484 CB ALA A 739 63.384 -4.144 35.279 1.00 34.99 C ATOM 2485 H ALA A 739 63.820 -6.135 33.721 1.00 0.00 H ATOM 2486 N VAL A 740 65.985 -5.743 36.261 1.00 34.01 N ATOM 2487 CA VAL A 740 66.979 -5.990 37.318 1.00 33.70 C ATOM 2488 C VAL A 740 68.298 -6.440 36.708 1.00 35.52 C ATOM 2489 O VAL A 740 68.354 -7.542 36.133 1.00 33.29 O ATOM 2490 CB VAL A 740 66.470 -6.937 38.430 1.00 38.02 C ATOM 2491 CG1 VAL A 740 67.427 -6.920 39.627 1.00 37.76 C ATOM 2492 CG2 VAL A 740 65.062 -6.544 38.860 1.00 38.01 C ATOM 2493 H VAL A 740 65.394 -6.532 35.929 1.00 0.00 H ATOM 2494 N PRO A 741 69.366 -5.594 36.815 1.00 32.51 N ATOM 2495 CA PRO A 741 70.668 -5.942 36.177 1.00 31.48 C ATOM 2496 C PRO A 741 71.233 -7.313 36.520 1.00 33.95 C ATOM 2497 O PRO A 741 71.767 -8.002 35.637 1.00 32.75 O ATOM 2498 CB PRO A 741 71.598 -4.810 36.621 1.00 32.60 C ATOM 2499 CG PRO A 741 70.660 -3.642 36.809 1.00 37.16 C ATOM 2500 CD PRO A 741 69.427 -4.255 37.443 1.00 33.62 C ATOM 2501 N SER A 742 71.091 -7.719 37.779 1.00 31.57 N ATOM 2502 CA SER A 742 71.579 -9.017 38.301 1.00 31.88 C ATOM 2503 C SER A 742 70.864 -10.234 37.683 1.00 35.93 C ATOM 2504 O SER A 742 71.399 -11.346 37.709 1.00 36.57 O ATOM 2505 CB SER A 742 71.425 -9.065 39.814 1.00 34.30 C ATOM 2506 OG SER A 742 70.052 -9.226 40.155 1.00 37.31 O ATOM 2507 HG SER A 742 69.959 -9.256 41.140 1.00 0.00 H ATOM 2508 H SER A 742 70.604 -7.082 38.442 1.00 0.00 H ATOM 2509 N GLN A 743 69.671 -10.019 37.127 1.00 32.21 N ATOM 2510 CA GLN A 743 68.848 -11.081 36.541 1.00 31.66 C ATOM 2511 C GLN A 743 69.060 -11.277 35.026 1.00 34.41 C ATOM 2512 O GLN A 743 68.526 -12.221 34.451 1.00 34.39 O ATOM 2513 CB GLN A 743 67.366 -10.835 36.879 1.00 32.51 C ATOM 2514 CG GLN A 743 67.095 -10.769 38.384 1.00 34.12 C ATOM 2515 CD GLN A 743 67.631 -12.012 39.056 1.00 40.75 C ATOM 2516 OE1 GLN A 743 67.150 -13.114 38.801 1.00 33.44 O ATOM 2517 NE2 GLN A 743 68.673 -11.861 39.884 1.00 33.98 N ATOM 2518 HE22 GLN A 743 69.052 -10.912 40.075 1.00 0.00 H ATOM 2519 HE21 GLN A 743 69.103 -12.693 40.336 1.00 0.00 H ATOM 2520 H GLN A 743 69.305 -9.046 37.108 1.00 0.00 H ATOM 2521 N ARG A 744 69.825 -10.402 34.407 1.00 30.33 N ATOM 2522 CA ARG A 744 70.164 -10.467 32.987 1.00 31.18 C ATOM 2523 C ARG A 744 71.168 -11.627 32.768 1.00 33.47 C ATOM 2524 O ARG A 744 71.959 -11.919 33.658 1.00 30.84 O ATOM 2525 CB ARG A 744 70.804 -9.137 32.508 1.00 30.55 C ATOM 2526 CG ARG A 744 69.821 -7.995 32.240 1.00 31.70 C ATOM 2527 CD ARG A 744 70.487 -6.626 32.123 1.00 29.52 C ATOM 2528 NE ARG A 744 69.588 -5.556 32.578 1.00 31.39 N ATOM 2529 CZ ARG A 744 69.981 -4.328 32.902 1.00 39.90 C ATOM 2530 NH1 ARG A 744 71.241 -3.965 32.737 1.00 28.77 N ATOM 2531 NH2 ARG A 744 69.102 -3.438 33.349 1.00 27.18 N ATOM 2532 HE ARG A 744 68.574 -5.775 32.652 1.00 0.00 H ATOM 2533 HH12 ARG A 744 71.543 -3.003 32.992 1.00 0.00 H ATOM 2534 HH11 ARG A 744 71.931 -4.641 32.352 1.00 0.00 H ATOM 2535 HH22 ARG A 744 69.415 -2.479 33.601 1.00 0.00 H ATOM 2536 HH21 ARG A 744 68.100 -3.700 33.447 1.00 0.00 H ATOM 2537 H ARG A 744 70.213 -9.614 34.964 1.00 0.00 H ATOM 2538 N PRO A 745 71.188 -12.278 31.581 1.00 30.06 N ATOM 2539 CA PRO A 745 72.202 -13.315 31.349 1.00 29.90 C ATOM 2540 C PRO A 745 73.582 -12.647 31.287 1.00 34.72 C ATOM 2541 O PRO A 745 73.676 -11.457 30.980 1.00 33.21 O ATOM 2542 CB PRO A 745 71.808 -13.875 29.958 1.00 30.75 C ATOM 2543 CG PRO A 745 71.118 -12.774 29.303 1.00 34.06 C ATOM 2544 CD PRO A 745 70.331 -12.093 30.386 1.00 30.26 C ATOM 2545 N THR A 746 74.645 -13.376 31.573 1.00 32.83 N ATOM 2546 CA THR A 746 75.974 -12.775 31.409 1.00 31.58 C ATOM 2547 C THR A 746 76.408 -12.997 29.949 1.00 34.10 C ATOM 2548 O THR A 746 75.781 -13.797 29.251 1.00 35.35 O ATOM 2549 CB THR A 746 76.973 -13.403 32.347 1.00 35.73 C ATOM 2550 OG1 THR A 746 77.118 -14.775 31.978 1.00 32.59 O ATOM 2551 CG2 THR A 746 76.592 -13.234 33.808 1.00 39.82 C ATOM 2552 HG1 THR A 746 77.771 -15.211 32.581 1.00 0.00 H ATOM 2553 H THR A 746 74.543 -14.355 31.907 1.00 0.00 H ATOM 2554 N PHE A 747 77.536 -12.394 29.529 1.00 29.29 N ATOM 2555 CA PHE A 747 78.105 -12.633 28.201 1.00 29.04 C ATOM 2556 C PHE A 747 78.519 -14.081 28.068 1.00 33.46 C ATOM 2557 O PHE A 747 78.313 -14.647 27.010 1.00 32.15 O ATOM 2558 CB PHE A 747 79.252 -11.652 27.840 1.00 29.89 C ATOM 2559 CG PHE A 747 78.726 -10.305 27.365 1.00 30.44 C ATOM 2560 CD1 PHE A 747 77.928 -10.210 26.218 1.00 29.29 C ATOM 2561 CD2 PHE A 747 78.958 -9.146 28.108 1.00 30.21 C ATOM 2562 CE1 PHE A 747 77.382 -8.985 25.819 1.00 28.15 C ATOM 2563 CE2 PHE A 747 78.438 -7.914 27.688 1.00 30.16 C ATOM 2564 CZ PHE A 747 77.657 -7.844 26.544 1.00 26.92 C ATOM 2565 H PHE A 747 78.021 -11.735 30.171 1.00 0.00 H ATOM 2566 N LYS A 748 79.032 -14.701 29.163 1.00 32.19 N ATOM 2567 CA LYS A 748 79.407 -16.117 29.208 1.00 33.78 C ATOM 2568 C LYS A 748 78.178 -17.004 28.907 1.00 37.58 C ATOM 2569 O LYS A 748 78.294 -17.904 28.081 1.00 37.90 O ATOM 2570 CB LYS A 748 80.033 -16.473 30.580 1.00 38.67 C ATOM 2571 CG LYS A 748 80.493 -17.925 30.692 1.00 43.07 C ATOM 2572 CD LYS A 748 81.162 -18.218 32.044 1.00 48.06 C ATOM 2573 CE LYS A 748 81.826 -19.577 32.026 1.00 59.51 C ATOM 2574 NZ LYS A 748 83.080 -19.592 32.836 1.00 75.61 N ATOM 2575 HZ1 LYS A 748 83.749 -18.896 32.450 1.00 0.00 H ATOM 2576 HZ2 LYS A 748 82.857 -19.350 33.823 1.00 0.00 H ATOM 2577 HZ3 LYS A 748 83.504 -20.541 32.798 1.00 0.00 H ATOM 2578 H LYS A 748 79.167 -14.134 30.024 1.00 0.00 H ATOM 2579 N GLN A 749 77.003 -16.752 29.554 1.00 33.53 N ATOM 2580 CA GLN A 749 75.785 -17.531 29.250 1.00 33.43 C ATOM 2581 C GLN A 749 75.317 -17.314 27.799 1.00 36.34 C ATOM 2582 O GLN A 749 74.954 -18.288 27.145 1.00 37.05 O ATOM 2583 CB GLN A 749 74.624 -17.220 30.203 1.00 34.84 C ATOM 2584 CG GLN A 749 74.800 -17.835 31.570 1.00 52.11 C ATOM 2585 CD GLN A 749 74.629 -16.866 32.725 1.00 55.96 C ATOM 2586 OE1 GLN A 749 73.902 -15.863 32.687 1.00 40.02 O ATOM 2587 NE2 GLN A 749 75.219 -17.224 33.825 1.00 52.90 N ATOM 2588 HE22 GLN A 749 75.826 -18.069 33.839 1.00 0.00 H ATOM 2589 HE21 GLN A 749 75.085 -16.666 34.692 1.00 0.00 H ATOM 2590 H GLN A 749 76.964 -16.000 30.272 1.00 0.00 H ATOM 2591 N LEU A 750 75.335 -16.045 27.306 1.00 30.52 N ATOM 2592 CA LEU A 750 74.925 -15.673 25.940 1.00 30.53 C ATOM 2593 C LEU A 750 75.757 -16.382 24.864 1.00 36.61 C ATOM 2594 O LEU A 750 75.196 -16.854 23.882 1.00 37.02 O ATOM 2595 CB LEU A 750 74.955 -14.153 25.733 1.00 29.11 C ATOM 2596 CG LEU A 750 73.903 -13.344 26.531 1.00 30.62 C ATOM 2597 CD1 LEU A 750 74.263 -11.822 26.575 1.00 26.64 C ATOM 2598 CD2 LEU A 750 72.499 -13.580 25.971 1.00 31.60 C ATOM 2599 H LEU A 750 75.661 -15.285 27.937 1.00 0.00 H ATOM 2600 N VAL A 751 77.066 -16.516 25.082 1.00 32.70 N ATOM 2601 CA VAL A 751 77.975 -17.226 24.163 1.00 32.95 C ATOM 2602 C VAL A 751 77.548 -18.705 24.117 1.00 36.38 C ATOM 2603 O VAL A 751 77.403 -19.261 23.036 1.00 35.41 O ATOM 2604 CB VAL A 751 79.467 -17.049 24.598 1.00 35.81 C ATOM 2605 CG1 VAL A 751 80.406 -17.996 23.832 1.00 36.69 C ATOM 2606 CG2 VAL A 751 79.917 -15.608 24.425 1.00 33.21 C ATOM 2607 H VAL A 751 77.467 -16.098 25.946 1.00 0.00 H ATOM 2608 N GLU A 752 77.301 -19.319 25.286 1.00 33.76 N ATOM 2609 CA GLU A 752 76.848 -20.720 25.367 1.00 34.89 C ATOM 2610 C GLU A 752 75.488 -20.936 24.719 1.00 39.17 C ATOM 2611 O GLU A 752 75.305 -21.927 24.015 1.00 40.58 O ATOM 2612 CB GLU A 752 76.782 -21.193 26.829 1.00 36.67 C ATOM 2613 CG GLU A 752 78.153 -21.406 27.449 1.00 48.79 C ATOM 2614 CD GLU A 752 78.161 -21.607 28.955 1.00 68.20 C ATOM 2615 OE1 GLU A 752 77.074 -21.830 29.542 1.00 69.30 O ATOM 2616 OE2 GLU A 752 79.261 -21.538 29.550 1.00 56.80 O ATOM 2617 H GLU A 752 77.435 -18.785 26.169 1.00 0.00 H ATOM 2618 N ASP A 753 74.508 -20.051 24.997 1.00 36.92 N ATOM 2619 CA ASP A 753 73.172 -20.213 24.414 1.00 38.08 C ATOM 2620 C ASP A 753 73.248 -20.024 22.899 1.00 39.80 C ATOM 2621 O ASP A 753 72.672 -20.826 22.165 1.00 36.87 O ATOM 2622 CB ASP A 753 72.135 -19.257 25.036 1.00 40.05 C ATOM 2623 CG ASP A 753 71.984 -19.347 26.543 1.00 52.61 C ATOM 2624 OD1 ASP A 753 72.256 -20.434 27.106 1.00 56.99 O ATOM 2625 OD2 ASP A 753 71.600 -18.328 27.163 1.00 53.18 O ATOM 2626 H ASP A 753 74.701 -19.248 25.629 1.00 0.00 H ATOM 2627 N LEU A 754 74.018 -19.005 22.441 1.00 36.79 N ATOM 2628 CA LEU A 754 74.189 -18.719 21.013 1.00 36.44 C ATOM 2629 C LEU A 754 74.915 -19.813 20.265 1.00 43.57 C ATOM 2630 O LEU A 754 74.540 -20.110 19.138 1.00 44.40 O ATOM 2631 CB LEU A 754 74.834 -17.353 20.761 1.00 35.39 C ATOM 2632 CG LEU A 754 73.853 -16.182 20.987 1.00 38.17 C ATOM 2633 CD1 LEU A 754 74.579 -14.899 21.185 1.00 36.07 C ATOM 2634 CD2 LEU A 754 72.793 -16.084 19.870 1.00 41.73 C ATOM 2635 H LEU A 754 74.508 -18.401 23.132 1.00 0.00 H ATOM 2636 N ASP A 755 75.918 -20.441 20.883 1.00 42.28 N ATOM 2637 CA ASP A 755 76.647 -21.558 20.284 1.00 43.74 C ATOM 2638 C ASP A 755 75.685 -22.726 19.997 1.00 49.42 C ATOM 2639 O ASP A 755 75.707 -23.288 18.895 1.00 51.00 O ATOM 2640 CB ASP A 755 77.770 -22.005 21.233 1.00 47.01 C ATOM 2641 CG ASP A 755 78.810 -22.914 20.616 1.00 60.84 C ATOM 2642 OD1 ASP A 755 79.037 -22.816 19.386 1.00 63.15 O ATOM 2643 OD2 ASP A 755 79.472 -23.644 21.371 1.00 66.95 O ATOM 2644 H ASP A 755 76.193 -20.121 21.834 1.00 0.00 H ATOM 2645 N ARG A 756 74.808 -23.054 20.977 1.00 44.30 N ATOM 2646 CA ARG A 756 73.804 -24.115 20.865 1.00 44.45 C ATOM 2647 C ARG A 756 72.773 -23.761 19.762 1.00 47.77 C ATOM 2648 O ARG A 756 72.542 -24.572 18.882 1.00 48.67 O ATOM 2649 CB ARG A 756 73.144 -24.362 22.248 1.00 44.79 C ATOM 2650 CG ARG A 756 71.925 -25.298 22.251 1.00 54.86 C ATOM 2651 CD ARG A 756 71.165 -25.282 23.577 1.00 66.78 C ATOM 2652 NE ARG A 756 70.921 -23.929 24.097 1.00 77.28 N ATOM 2653 CZ ARG A 756 69.825 -23.211 23.865 1.00 90.61 C ATOM 2654 NH1 ARG A 756 68.845 -23.705 23.118 1.00 76.91 N ATOM 2655 NH2 ARG A 756 69.704 -21.991 24.375 1.00 77.12 N ATOM 2656 HE ARG A 756 71.660 -23.501 24.690 1.00 0.00 H ATOM 2657 HH12 ARG A 756 67.991 -23.139 22.940 1.00 0.00 H ATOM 2658 HH11 ARG A 756 68.931 -24.658 22.711 1.00 0.00 H ATOM 2659 HH22 ARG A 756 68.846 -21.433 24.191 1.00 0.00 H ATOM 2660 HH21 ARG A 756 70.468 -21.593 24.958 1.00 0.00 H ATOM 2661 H ARG A 756 74.851 -22.517 21.867 1.00 0.00 H ATOM 2662 N ILE A 757 72.202 -22.547 19.796 1.00 43.58 N ATOM 2663 CA ILE A 757 71.236 -22.056 18.815 1.00 43.75 C ATOM 2664 C ILE A 757 71.809 -22.068 17.381 1.00 49.21 C ATOM 2665 O ILE A 757 71.110 -22.553 16.481 1.00 50.53 O ATOM 2666 CB ILE A 757 70.629 -20.682 19.199 1.00 45.69 C ATOM 2667 CG1 ILE A 757 69.818 -20.798 20.511 1.00 46.37 C ATOM 2668 CG2 ILE A 757 69.739 -20.143 18.060 1.00 46.21 C ATOM 2669 CD1 ILE A 757 69.540 -19.428 21.255 1.00 53.22 C ATOM 2670 H ILE A 757 72.465 -21.911 20.575 1.00 0.00 H ATOM 2671 N VAL A 758 73.065 -21.580 17.169 1.00 44.21 N ATOM 2672 CA VAL A 758 73.700 -21.563 15.835 1.00 43.96 C ATOM 2673 C VAL A 758 73.589 -22.941 15.182 1.00 50.98 C ATOM 2674 O VAL A 758 73.091 -23.040 14.064 1.00 51.09 O ATOM 2675 CB VAL A 758 75.181 -21.036 15.833 1.00 46.72 C ATOM 2676 CG1 VAL A 758 75.901 -21.361 14.515 1.00 47.49 C ATOM 2677 CG2 VAL A 758 75.240 -19.543 16.084 1.00 44.73 C ATOM 2678 H VAL A 758 73.597 -21.204 17.980 1.00 0.00 H ATOM 2679 N ALA A 759 74.034 -24.000 15.902 1.00 50.15 N ATOM 2680 CA ALA A 759 74.030 -25.404 15.468 1.00 52.21 C ATOM 2681 C ALA A 759 72.642 -25.935 15.094 1.00 59.56 C ATOM 2682 O ALA A 759 72.547 -26.832 14.258 1.00 62.87 O ATOM 2683 CB ALA A 759 74.656 -26.278 16.550 1.00 53.37 C ATOM 2684 H ALA A 759 74.413 -23.800 16.849 1.00 0.00 H ATOM 2685 N LEU A 760 71.575 -25.403 15.709 1.00 55.53 N ATOM 2686 CA LEU A 760 70.194 -25.846 15.453 1.00 56.76 C ATOM 2687 C LEU A 760 69.423 -24.954 14.456 1.00 59.04 C ATOM 2688 O LEU A 760 68.312 -25.301 14.058 1.00 58.63 O ATOM 2689 CB LEU A 760 69.416 -25.967 16.783 1.00 56.86 C ATOM 2690 CG LEU A 760 69.935 -27.018 17.769 1.00 63.37 C ATOM 2691 CD1 LEU A 760 69.699 -26.590 19.200 1.00 63.23 C ATOM 2692 CD2 LEU A 760 69.306 -28.370 17.519 1.00 67.11 C ATOM 2693 H LEU A 760 71.731 -24.641 16.400 1.00 0.00 H ATOM 2694 N THR A 761 69.995 -23.790 14.094 1.00 54.35 N ATOM 2695 CA THR A 761 69.377 -22.830 13.185 1.00 53.38 C ATOM 2696 C THR A 761 69.584 -23.246 11.736 1.00 58.84 C ATOM 2697 O THR A 761 70.699 -23.599 11.347 1.00 56.50 O ATOM 2698 CB THR A 761 69.876 -21.416 13.491 1.00 58.12 C ATOM 2699 OG1 THR A 761 69.518 -21.112 14.833 1.00 53.74 O ATOM 2700 CG2 THR A 761 69.243 -20.367 12.603 1.00 56.33 C ATOM 2701 HG1 THR A 761 69.830 -20.200 15.058 1.00 0.00 H ATOM 2702 H THR A 761 70.931 -23.562 14.485 1.00 0.00 H ATOM 2703 N SER A 762 68.493 -23.194 10.939 1.00 57.41 N ATOM 2704 CA SER A 762 68.501 -23.543 9.530 1.00 58.10 C ATOM 2705 C SER A 762 69.271 -22.528 8.696 1.00 59.51 C ATOM 2706 O SER A 762 69.073 -21.320 8.836 1.00 58.52 O ATOM 2707 CB SER A 762 67.071 -23.640 9.002 1.00 62.89 C ATOM 2708 OG SER A 762 67.048 -23.855 7.600 1.00 69.04 O ATOM 2709 HG SER A 762 66.109 -23.913 7.292 1.00 0.00 H ATOM 2710 H SER A 762 67.594 -22.885 11.361 1.00 0.00 H ATOM 2711 N ASN A 763 70.110 -23.024 7.798 1.00 55.78 N ATOM 2712 CA ASN A 763 70.801 -22.177 6.835 1.00 55.48 C ATOM 2713 C ASN A 763 70.076 -22.275 5.454 1.00 59.00 C ATOM 2714 O ASN A 763 70.438 -21.564 4.517 1.00 59.54 O ATOM 2715 CB ASN A 763 72.313 -22.512 6.755 1.00 57.74 C ATOM 2716 CG ASN A 763 72.678 -23.976 6.630 1.00 78.72 C ATOM 2717 OD1 ASN A 763 71.841 -24.850 6.337 1.00 77.24 O ATOM 2718 ND2 ASN A 763 73.957 -24.272 6.853 1.00 62.59 N ATOM 2719 HD22 ASN A 763 74.631 -23.518 7.096 1.00 0.00 H ATOM 2720 HD21 ASN A 763 74.282 -25.257 6.784 1.00 0.00 H ATOM 2721 H ASN A 763 70.280 -24.050 7.780 1.00 0.00 H ATOM 2722 N GLN A 764 68.996 -23.088 5.374 1.00 54.10 N ATOM 2723 CA GLN A 764 68.219 -23.312 4.157 1.00 55.66 C ATOM 2724 C GLN A 764 67.341 -22.112 3.757 1.00 60.35 C ATOM 2725 O GLN A 764 66.880 -22.041 2.618 1.00 60.64 O ATOM 2726 CB GLN A 764 67.404 -24.619 4.242 1.00 58.30 C ATOM 2727 CG GLN A 764 68.286 -25.864 4.470 1.00 60.05 C ATOM 2728 CD GLN A 764 69.373 -26.037 3.417 1.00 63.90 C ATOM 2729 OE1 GLN A 764 69.127 -26.484 2.292 1.00 55.49 O ATOM 2730 NE2 GLN A 764 70.598 -25.665 3.747 1.00 48.71 N ATOM 2731 HE22 GLN A 764 70.789 -25.291 4.698 1.00 0.00 H ATOM 2732 HE21 GLN A 764 71.370 -25.747 3.055 1.00 0.00 H ATOM 2733 H GLN A 764 68.700 -23.587 6.237 1.00 0.00 H ATOM 2734 N GLU A 765 67.183 -21.145 4.663 1.00 56.30 N ATOM 2735 CA GLU A 765 66.451 -19.894 4.435 1.00 61.84 C ATOM 2736 C GLU A 765 66.925 -18.828 5.451 1.00 68.24 C ATOM 2737 O GLU A 765 67.583 -19.211 6.455 1.00 60.72 O ATOM 2738 CB GLU A 765 64.911 -20.103 4.465 1.00 64.20 C ATOM 2739 CG GLU A 765 64.335 -20.453 5.827 1.00 74.59 C ATOM 2740 CD GLU A 765 62.913 -20.974 5.803 1.00 87.32 C ATOM 2741 OE1 GLU A 765 61.986 -20.181 5.516 1.00 62.11 O ATOM 2742 OE2 GLU A 765 62.724 -22.173 6.110 1.00 81.52 O ATOM 2743 OXT GLU A 765 66.626 -17.631 5.237 1.00 80.33 O ATOM 2744 H GLU A 765 67.610 -21.289 5.600 1.00 0.00 H TER 2745 GLU A 765 HETATM 2746 O HOH 1 104.685 4.888 23.671 1.00 57.74 O HETATM 2747 O HOH 2 109.201 3.734 26.132 1.00 65.16 O HETATM 2748 O HOH 3 105.534 2.147 19.860 1.00 46.49 O HETATM 2749 O HOH 4 103.132 1.449 26.744 1.00 49.14 O HETATM 2750 O HOH 5 103.240 -6.980 18.287 1.00 60.82 O HETATM 2751 O HOH 6 101.752 -5.237 24.413 1.00 44.06 O HETATM 2752 O HOH 7 109.960 -6.120 22.450 1.00 52.37 O HETATM 2753 O HOH 8 107.778 5.374 13.557 1.00 45.47 O HETATM 2754 O HOH 9 110.965 3.052 14.337 1.00 56.98 O HETATM 2755 O HOH 10 111.153 5.623 8.760 1.00 58.26 O HETATM 2756 O HOH 11 110.109 -3.876 5.271 1.00 61.84 O HETATM 2757 O HOH 12 102.202 7.439 3.225 1.00 56.07 O HETATM 2758 O HOH 13 97.761 2.365 0.775 1.00 40.53 O HETATM 2759 O HOH 14 98.369 4.563 -1.435 1.00 54.95 O HETATM 2760 O HOH 15 94.777 8.951 -0.839 1.00 63.55 O HETATM 2761 O HOH 16 93.565 4.088 -0.132 1.00 55.35 O HETATM 2762 O HOH 17 97.312 -4.908 0.046 1.00 60.63 O HETATM 2763 O HOH 18 102.523 -6.435 6.414 1.00 46.98 O HETATM 2764 O HOH 19 108.983 -3.802 8.270 1.00 63.78 O HETATM 2765 O HOH 20 104.485 -8.175 7.659 1.00 47.42 O HETATM 2766 O HOH 21 105.169 -3.969 14.695 1.00 59.13 O HETATM 2767 O HOH 22 102.750 -12.849 8.132 1.00 66.87 O HETATM 2768 O HOH 23 104.744 -13.633 4.093 1.00 65.95 O HETATM 2769 O HOH 24 93.083 -6.907 5.221 1.00 57.06 O HETATM 2770 O HOH 25 94.241 -5.440 8.854 1.00 36.77 O HETATM 2771 O HOH 26 87.636 4.737 16.330 1.00 45.86 O HETATM 2772 O HOH 27 89.209 7.897 23.442 1.00 60.97 O HETATM 2773 O HOH 28 90.862 5.342 27.049 1.00 52.54 O HETATM 2774 O HOH 29 99.428 0.226 28.077 1.00 44.52 O HETATM 2775 O HOH 30 93.035 -5.070 22.497 1.00 44.50 O HETATM 2776 O HOH 31 99.419 -6.645 24.142 1.00 51.05 O HETATM 2777 O HOH 32 103.566 3.133 21.489 1.00 57.26 O HETATM 2778 O HOH 33 94.265 -6.018 20.302 1.00 46.65 O HETATM 2779 O HOH 34 94.678 -12.426 24.262 1.00 53.36 O HETATM 2780 O HOH 35 92.228 -14.470 22.420 1.00 52.73 O HETATM 2781 O HOH 36 96.016 -9.634 15.316 1.00 56.36 O HETATM 2782 O HOH 37 96.799 -6.635 19.582 1.00 58.76 O HETATM 2783 O HOH 38 86.710 -16.805 22.774 1.00 54.59 O HETATM 2784 O HOH 39 90.658 -15.085 19.395 1.00 36.28 O HETATM 2785 O HOH 40 84.708 -15.215 14.197 1.00 48.71 O HETATM 2786 O HOH 41 92.314 -11.045 14.215 1.00 47.02 O HETATM 2787 O HOH 42 101.235 -6.493 14.518 1.00 48.20 O HETATM 2788 O HOH 43 112.632 7.786 13.100 1.00 77.37 O HETATM 2789 O HOH 44 100.139 13.818 16.710 1.00 54.65 O HETATM 2790 O HOH 45 94.865 -9.570 11.653 1.00 50.48 O HETATM 2791 O HOH 46 91.567 -8.855 9.861 1.00 55.48 O HETATM 2792 O HOH 47 88.733 -6.659 6.096 1.00 35.58 O HETATM 2793 O HOH 48 88.410 -1.991 0.879 1.00 71.23 O HETATM 2794 O HOH 49 89.980 -6.062 1.312 1.00 66.89 O HETATM 2795 O HOH 50 79.119 -10.266 1.574 1.00 68.20 O HETATM 2796 O HOH 51 77.060 4.106 11.394 1.00 62.31 O HETATM 2797 O HOH 52 73.432 1.778 4.832 1.00 62.93 O HETATM 2798 O HOH 53 75.015 -0.111 3.817 1.00 43.44 O HETATM 2799 O HOH 54 82.263 2.067 7.926 1.00 56.74 O HETATM 2800 O HOH 55 77.560 -13.153 7.959 1.00 61.05 O HETATM 2801 O HOH 56 67.080 1.903 9.031 1.00 60.94 O HETATM 2802 O HOH 57 69.052 -11.549 4.784 1.00 65.34 O HETATM 2803 O HOH 58 63.791 -5.151 1.633 1.00 55.32 O HETATM 2804 O HOH 59 61.939 -8.683 -0.525 1.00 60.30 O HETATM 2805 O HOH 60 57.075 -5.825 -6.088 1.00 59.30 O HETATM 2806 O HOH 61 49.812 -2.637 -5.551 1.00 61.73 O HETATM 2807 O HOH 62 55.228 -8.609 1.545 1.00 56.66 O HETATM 2808 O HOH 63 67.613 -3.160 -9.522 1.00 66.53 O HETATM 2809 O HOH 64 62.310 2.978 -8.881 1.00 74.42 O HETATM 2810 O HOH 65 66.902 -14.140 7.107 1.00 71.51 O HETATM 2811 O HOH 66 66.442 -15.518 11.700 1.00 56.30 O HETATM 2812 O HOH 67 77.098 -18.874 9.495 1.00 60.40 O HETATM 2813 O HOH 68 80.102 -18.258 14.399 1.00 58.42 O HETATM 2814 O HOH 69 79.448 -13.876 9.753 1.00 61.52 O HETATM 2815 O HOH 70 83.080 -16.504 10.486 1.00 74.07 O HETATM 2816 O HOH 71 84.988 -15.370 24.323 1.00 44.79 O HETATM 2817 O HOH 72 84.894 -19.706 15.419 1.00 62.86 O HETATM 2818 O HOH 73 83.716 -13.336 30.545 1.00 50.98 O HETATM 2819 O HOH 74 84.036 -18.682 24.941 1.00 55.69 O HETATM 2820 O HOH 75 80.997 -19.077 27.099 1.00 53.91 O HETATM 2821 O HOH 76 95.792 -11.050 26.818 1.00 53.19 O HETATM 2822 O HOH 77 85.791 -10.485 34.219 1.00 52.93 O HETATM 2823 O HOH 78 92.239 -13.268 32.078 1.00 68.90 O HETATM 2824 O HOH 79 87.977 -1.976 34.603 1.00 45.32 O HETATM 2825 O HOH 80 81.387 -5.670 29.312 1.00 34.78 O HETATM 2826 O HOH 81 86.372 -0.241 31.323 1.00 43.70 O HETATM 2827 O HOH 82 86.211 1.058 27.943 1.00 50.21 O HETATM 2828 O HOH 83 82.312 3.897 24.823 1.00 57.73 O HETATM 2829 O HOH 84 84.525 2.361 24.848 1.00 53.92 O HETATM 2830 O HOH 85 76.998 -0.545 25.987 1.00 33.57 O HETATM 2831 O HOH 86 75.184 2.136 26.688 1.00 43.42 O HETATM 2832 O HOH 87 77.546 5.406 26.432 1.00 53.20 O HETATM 2833 O HOH 88 81.520 1.867 36.098 1.00 44.01 O HETATM 2834 O HOH 89 84.000 6.724 33.124 1.00 58.68 O HETATM 2835 O HOH 90 74.787 3.808 24.210 1.00 53.13 O HETATM 2836 O HOH 91 74.144 0.752 15.710 1.00 27.82 O HETATM 2837 O HOH 92 83.500 2.446 14.746 1.00 61.30 O HETATM 2838 O HOH 93 82.302 5.086 19.236 1.00 64.03 O HETATM 2839 O HOH 94 105.230 3.266 25.805 1.00 65.32 O HETATM 2840 O HOH 95 92.094 -15.292 4.615 1.00 89.77 O HETATM 2841 O HOH 96 88.959 -15.207 9.343 1.00 55.94 O HETATM 2842 O HOH 97 95.229 2.295 0.782 1.00 41.75 O HETATM 2843 O HOH 98 95.788 4.907 -2.280 1.00 61.78 O HETATM 2844 O HOH 99 90.831 -12.188 12.348 1.00 64.28 O HETATM 2845 O HOH 100 79.507 13.536 31.843 1.00 66.72 O HETATM 2846 O HOH 101 74.133 10.786 22.653 1.00 57.50 O HETATM 2847 O HOH 102 107.211 -14.974 5.154 1.00 69.05 O HETATM 2848 O HOH 103 104.215 -12.684 0.000 1.00106.86 O HETATM 2849 O HOH 104 71.431 10.067 22.481 1.00 46.70 O HETATM 2850 O HOH 105 75.148 8.224 31.235 1.00 54.80 O HETATM 2851 O HOH 106 90.673 -6.581 4.039 1.00 48.08 O HETATM 2852 O HOH 107 95.405 -7.673 9.647 1.00 45.63 O HETATM 2853 O HOH 108 67.522 12.010 13.098 1.00 57.15 O HETATM 2854 O HOH 109 68.179 16.728 12.148 1.00 84.11 O HETATM 2855 O HOH 110 68.254 4.323 9.399 1.00 59.10 O HETATM 2856 O HOH 111 70.348 12.465 9.743 1.00 70.54 O HETATM 2857 O HOH 112 70.785 -0.919 13.211 1.00 41.90 O HETATM 2858 O HOH 113 67.010 7.571 17.067 1.00 42.06 O HETATM 2859 O HOH 114 67.597 3.055 26.557 1.00 29.86 O HETATM 2860 O HOH 115 67.449 0.862 25.193 1.00 35.17 O HETATM 2861 O HOH 116 88.666 -17.127 19.324 1.00 77.38 O HETATM 2862 O HOH 117 93.408 -12.238 16.814 1.00 55.78 O HETATM 2863 O HOH 118 74.336 0.294 28.458 1.00 28.67 O HETATM 2864 O HOH 119 100.263 -8.604 12.397 1.00 62.51 O HETATM 2865 O HOH 120 67.975 -0.849 35.813 1.00 52.77 O HETATM 2866 O HOH 121 74.650 -1.297 35.247 1.00 46.22 O HETATM 2867 O HOH 122 68.782 11.180 32.503 1.00 70.80 O HETATM 2868 O HOH 123 70.057 8.951 39.941 1.00 61.13 O HETATM 2869 O HOH 124 66.223 6.869 38.915 1.00 71.27 O HETATM 2870 O HOH 125 98.112 -8.326 10.234 1.00 55.50 O HETATM 2871 O HOH 126 80.712 -4.482 35.673 1.00 46.93 O HETATM 2872 O HOH 127 63.927 -5.093 4.405 1.00 64.87 O HETATM 2873 O HOH 128 77.239 -9.392 32.862 1.00 32.66 O HETATM 2874 O HOH 129 75.275 -10.708 36.892 1.00 32.14 O HETATM 2875 O HOH 130 77.050 -0.322 29.412 1.00 35.97 O HETATM 2876 O HOH 131 69.313 -1.074 -9.758 1.00 74.81 O HETATM 2877 O HOH 132 66.436 -17.247 13.779 1.00 49.53 O HETATM 2878 O HOH 133 87.068 -14.917 26.665 1.00 47.54 O HETATM 2879 O HOH 134 60.303 -4.233 14.131 1.00 65.95 O HETATM 2880 O HOH 135 85.883 -19.736 26.657 1.00 68.60 O HETATM 2881 O HOH 136 65.334 -11.583 10.801 1.00 72.85 O HETATM 2882 O HOH 137 62.817 -8.682 10.714 1.00 55.48 O HETATM 2883 O HOH 138 83.070 5.978 26.404 1.00 70.25 O HETATM 2884 O HOH 139 64.618 1.221 9.877 1.00 54.73 O HETATM 2885 O HOH 140 67.016 5.024 16.273 1.00 36.89 O HETATM 2886 O HOH 141 61.704 -0.175 17.788 1.00 35.96 O HETATM 2887 O HOH 142 61.867 0.926 26.197 1.00 52.66 O HETATM 2888 O HOH 143 58.589 3.772 16.325 1.00 52.73 O HETATM 2889 O HOH 144 65.319 13.838 20.944 1.00 45.30 O HETATM 2890 O HOH 145 62.959 15.054 24.169 1.00 53.21 O HETATM 2891 O HOH 146 60.480 12.165 30.220 1.00 61.07 O HETATM 2892 O HOH 147 56.693 8.039 25.718 1.00 39.74 O HETATM 2893 O HOH 148 62.844 -0.031 31.286 1.00 39.65 O HETATM 2894 O HOH 149 63.900 2.747 35.024 1.00 64.60 O HETATM 2895 O HOH 150 65.461 9.068 37.473 1.00 61.74 O HETATM 2896 O HOH 151 54.653 6.533 26.320 1.00 54.86 O HETATM 2897 O HOH 152 56.127 -4.635 28.370 1.00 69.72 O HETATM 2898 O HOH 153 58.936 -4.568 31.309 1.00 41.78 O HETATM 2899 O HOH 154 56.162 -3.392 25.991 1.00 43.04 O HETATM 2900 O HOH 155 62.449 -7.445 29.181 1.00 36.57 O HETATM 2901 O HOH 156 62.698 -1.363 33.562 1.00 60.33 O HETATM 2902 O HOH 157 78.720 -7.480 35.740 1.00 41.73 O HETATM 2903 O HOH 158 79.798 -5.987 37.672 1.00 65.41 O HETATM 2904 O HOH 159 77.644 -9.925 35.687 1.00 43.54 O HETATM 2905 O HOH 160 77.713 -9.982 39.502 1.00 64.49 O HETATM 2906 O HOH 161 59.749 -1.937 18.519 1.00 47.96 O HETATM 2907 O HOH 162 55.901 -7.775 16.097 1.00 53.58 O HETATM 2908 O HOH 163 57.746 -17.106 15.808 1.00 68.44 O HETATM 2909 O HOH 164 65.656 -11.942 8.122 1.00 52.58 O HETATM 2910 O HOH 165 66.225 -19.761 18.166 1.00 41.22 O HETATM 2911 O HOH 166 59.805 -19.730 17.212 1.00 59.71 O HETATM 2912 O HOH 167 61.836 -20.399 19.189 1.00 41.32 O HETATM 2913 O HOH 168 57.812 -14.414 21.264 1.00 51.17 O HETATM 2914 O HOH 169 66.229 -17.932 25.095 1.00 46.18 O HETATM 2915 O HOH 170 54.281 -0.882 28.085 1.00 69.48 O HETATM 2916 O HOH 171 62.843 -15.663 31.390 1.00 72.38 O HETATM 2917 O HOH 172 68.598 -15.631 28.199 1.00 49.72 O HETATM 2918 O HOH 173 69.239 -16.062 31.057 1.00 49.01 O HETATM 2919 O HOH 174 62.049 -6.640 33.858 1.00 33.23 O HETATM 2920 O HOH 175 73.287 -10.211 35.156 1.00 30.37 O HETATM 2921 O HOH 176 73.739 -11.915 38.988 1.00 31.63 O HETATM 2922 O HOH 177 67.706 -13.692 32.323 1.00 40.70 O HETATM 2923 O HOH 178 65.392 -15.207 37.906 1.00 27.59 O HETATM 2924 O HOH 179 65.065 -22.637 14.789 1.00 70.68 O HETATM 2925 O HOH 180 74.478 -9.351 32.702 1.00 29.21 O HETATM 2926 O HOH 181 77.890 -16.450 34.075 1.00 47.06 O HETATM 2927 O HOH 182 73.662 -20.394 29.432 1.00 68.74 O HETATM 2928 O HOH 183 71.531 -17.217 31.870 1.00 60.46 O HETATM 2929 O HOH 184 77.225 -19.145 33.623 1.00 54.59 O HETATM 2930 O HOH 185 76.692 -24.219 24.105 1.00 59.68 O HETATM 2931 O HOH 186 72.603 -23.320 26.570 1.00 66.19 O HETATM 2932 O HOH 187 73.597 -27.546 19.716 1.00 66.38 O HETATM 2933 O HOH 188 75.288 -28.033 13.529 1.00 65.34 O HETATM 2934 O HOH 189 67.189 -20.307 15.752 1.00 52.77 O HETATM 2935 O HOH 190 65.601 -23.244 12.021 1.00 57.68 O HETATM 2936 O HOH 191 64.187 -24.459 6.467 1.00 58.20 O HETATM 2937 O HOH 192 76.880 -22.616 7.409 1.00 53.28 O HETATM 2938 O HOH 193 66.875 -27.254 1.063 1.00 40.80 O HETATM 2939 O HOH 194 69.702 -29.110 2.043 1.00 57.31 O HETATM 2940 O HOH 195 59.131 -19.973 6.484 1.00 48.71 O HETATM 2941 O HOH 196 76.978 6.195 13.045 1.00 59.39 O HETATM 2942 O HOH 197 97.882 -7.124 22.017 1.00 56.44 O HETATM 2943 O HOH 198 81.175 -8.343 37.396 1.00 59.87 O HETATM 2944 O HOH 199 84.927 -7.507 40.823 1.00 69.66 O HETATM 2945 O HOH 200 80.196 -22.337 39.364 1.00 56.65 O HETATM 2946 C XOJ A 201 86.032 1.935 2.406 1.00 -0.02 C HETATM 2947 C1 XOJ A 201 85.141 0.735 2.563 1.00 -0.03 C HETATM 2948 N XOJ A 201 83.984 0.924 3.468 1.00 0.23 N HETATM 2949 C2 XOJ A 201 83.019 -0.195 3.512 1.00 -0.03 C HETATM 2950 C3 XOJ A 201 81.582 0.237 3.701 1.00 -0.02 C HETATM 2951 H10 XOJ A 201 80.932 -0.650 3.723 1.00 0.03 H HETATM 2952 H11 XOJ A 201 81.283 0.890 2.868 1.00 0.03 H HETATM 2953 H12 XOJ A 201 81.486 0.785 4.650 1.00 0.03 H HETATM 2954 H8 XOJ A 201 83.294 -0.856 4.347 1.00 0.08 H HETATM 2955 H9 XOJ A 201 83.091 -0.751 2.566 1.00 0.08 H HETATM 2956 C4 XOJ A 201 84.366 1.402 4.814 1.00 -0.03 C HETATM 2957 C5 XOJ A 201 85.343 0.523 5.586 1.00 0.01 C HETATM 2958 C6 XOJ A 201 85.668 1.014 6.992 1.00 0.04 C HETATM 2959 N1 XOJ A 201 86.584 0.089 7.637 1.00 -0.29 N HETATM 2960 C7 XOJ A 201 87.199 0.244 8.828 1.00 0.18 C HETATM 2961 N2 XOJ A 201 88.027 -0.764 9.208 1.00 -0.25 N HETATM 2962 C8 XOJ A 201 88.596 -0.620 10.382 1.00 0.03 C HETATM 2963 C9 XOJ A 201 88.453 0.511 11.183 1.00 0.04 C HETATM 2964 C10 XOJ A 201 89.019 0.644 12.465 1.00 -0.03 C HETATM 2965 C11 XOJ A 201 88.670 1.702 13.265 1.00 0.04 C HETATM 2966 C12 XOJ A 201 87.735 2.661 12.729 1.00 0.15 C HETATM 2967 N3 XOJ A 201 87.221 2.579 11.506 1.00 -0.27 N HETATM 2968 C13 XOJ A 201 87.558 1.501 10.736 1.00 0.09 C HETATM 2969 N4 XOJ A 201 86.914 1.385 9.534 1.00 -0.26 N HETATM 2970 N5 XOJ A 201 87.274 3.727 13.534 1.00 -0.19 N HETATM 2971 C14 XOJ A 201 86.642 4.909 13.229 1.00 0.30 C HETATM 2972 O XOJ A 201 86.519 5.811 14.058 1.00 -0.39 O HETATM 2973 N6 XOJ A 201 86.158 4.980 11.962 1.00 -0.26 N HETATM 2974 C15 XOJ A 201 85.218 5.995 11.432 1.00 0.05 C HETATM 2975 C16 XOJ A 201 84.947 5.680 9.966 1.00 -0.04 C HETATM 2976 H23 XOJ A 201 84.250 6.424 9.554 1.00 0.03 H HETATM 2977 H24 XOJ A 201 84.504 4.677 9.882 1.00 0.03 H HETATM 2978 H25 XOJ A 201 85.892 5.712 9.403 1.00 0.03 H HETATM 2979 C17 XOJ A 201 85.857 7.373 11.544 1.00 -0.04 C HETATM 2980 H26 XOJ A 201 85.164 8.132 11.152 1.00 0.03 H HETATM 2981 H27 XOJ A 201 86.790 7.393 10.962 1.00 0.03 H HETATM 2982 H28 XOJ A 201 86.079 7.590 12.599 1.00 0.03 H HETATM 2983 C18 XOJ A 201 83.908 5.954 12.220 1.00 -0.04 C HETATM 2984 H29 XOJ A 201 83.216 6.710 11.820 1.00 0.03 H HETATM 2985 H30 XOJ A 201 84.111 6.166 13.280 1.00 0.03 H HETATM 2986 H31 XOJ A 201 83.455 4.956 12.126 1.00 0.03 H HETATM 2987 H20 XOJ A 201 86.467 4.276 11.322 1.00 0.19 H HETATM 2988 H17 XOJ A 201 87.439 3.597 14.512 1.00 0.24 H HETATM 2989 C19 XOJ A 201 89.219 1.759 14.651 1.00 -0.03 C HETATM 2990 C20 XOJ A 201 90.330 2.549 14.955 1.00 -0.04 C HETATM 2991 C21 XOJ A 201 90.863 2.543 16.235 1.00 0.08 C HETATM 2992 O2 XOJ A 201 91.974 3.332 16.382 1.00 -0.32 O HETATM 2993 C26 XOJ A 201 92.714 3.244 17.601 1.00 0.06 C HETATM 2994 H38 XOJ A 201 93.569 3.935 17.561 1.00 0.06 H HETATM 2995 H39 XOJ A 201 93.080 2.215 17.735 1.00 0.06 H HETATM 2996 H40 XOJ A 201 92.063 3.514 18.445 1.00 0.06 H HETATM 2997 C22 XOJ A 201 90.296 1.769 17.238 1.00 -0.01 C HETATM 2998 C23 XOJ A 201 89.192 0.990 16.935 1.00 0.08 C HETATM 2999 O1 XOJ A 201 88.587 0.097 17.777 1.00 -0.32 O HETATM 3000 C25 XOJ A 201 89.314 -0.371 18.911 1.00 0.06 C HETATM 3001 H35 XOJ A 201 88.691 -1.077 19.480 1.00 0.06 H HETATM 3002 H36 XOJ A 201 89.582 0.482 19.552 1.00 0.06 H HETATM 3003 H37 XOJ A 201 90.230 -0.879 18.575 1.00 0.06 H HETATM 3004 C24 XOJ A 201 88.645 0.991 15.660 1.00 -0.04 C HETATM 3005 H34 XOJ A 201 87.767 0.391 15.449 1.00 0.04 H HETATM 3006 H33 XOJ A 201 90.710 1.774 18.240 1.00 0.05 H HETATM 3007 H32 XOJ A 201 90.778 3.170 14.187 1.00 0.04 H HETATM 3008 H22 XOJ A 201 89.732 -0.091 12.821 1.00 0.08 H HETATM 3009 H21 XOJ A 201 89.215 -1.430 10.751 1.00 0.10 H HETATM 3010 H7 XOJ A 201 86.787 -0.783 7.128 1.00 0.19 H HETATM 3011 H18 XOJ A 201 86.135 2.008 6.933 1.00 0.05 H HETATM 3012 H19 XOJ A 201 84.740 1.079 7.580 1.00 0.05 H HETATM 3013 H15 XOJ A 201 86.282 0.472 5.016 1.00 0.03 H HETATM 3014 H16 XOJ A 201 84.908 -0.484 5.667 1.00 0.03 H HETATM 3015 H13 XOJ A 201 83.447 1.489 5.413 1.00 0.08 H HETATM 3016 H14 XOJ A 201 84.825 2.395 4.700 1.00 0.08 H HETATM 3017 H4 XOJ A 201 83.468 1.687 3.058 1.00 0.20 H HETATM 3018 H5 XOJ A 201 85.750 -0.092 2.957 1.00 0.08 H HETATM 3019 H6 XOJ A 201 84.755 0.465 1.569 1.00 0.08 H HETATM 3020 H1 XOJ A 201 86.856 1.693 1.718 1.00 0.03 H HETATM 3021 H2 XOJ A 201 86.444 2.217 3.386 1.00 0.03 H HETATM 3022 H3 XOJ A 201 85.449 2.774 1.998 1.00 0.03 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 225 226 230 231 232 CONECT 230 225 CONECT 231 225 CONECT 232 225 CONECT 1632 1633 1637 1638 1639 CONECT 1637 1632 CONECT 1638 1632 CONECT 1639 1632 CONECT 2946 2947 3020 3021 3022 CONECT 2947 2946 2948 3018 3019 CONECT 2948 2947 2949 2956 3017 CONECT 2949 2948 2950 2954 2955 CONECT 2950 2949 2951 2952 2953 CONECT 2951 2950 CONECT 2952 2950 CONECT 2953 2950 CONECT 2954 2949 CONECT 2955 2949 CONECT 2956 2948 2957 3015 3016 CONECT 2957 2956 2958 3013 3014 CONECT 2958 2957 2959 3011 3012 CONECT 2959 2958 2960 3010 CONECT 2960 2959 2961 2969 CONECT 2961 2960 2962 CONECT 2962 2961 2963 3009 CONECT 2963 2962 2964 2968 CONECT 2964 2963 2965 3008 CONECT 2965 2964 2966 2989 CONECT 2966 2965 2967 2970 CONECT 2967 2966 2968 CONECT 2968 2963 2967 2969 CONECT 2969 2960 2968 CONECT 2970 2966 2971 2988 CONECT 2971 2970 2972 2973 CONECT 2972 2971 CONECT 2973 2971 2974 2987 CONECT 2974 2973 2975 2979 2983 CONECT 2975 2974 2976 2977 2978 CONECT 2976 2975 CONECT 2977 2975 CONECT 2978 2975 CONECT 2979 2974 2980 2981 2982 CONECT 2980 2979 CONECT 2981 2979 CONECT 2982 2979 CONECT 2983 2974 2984 2985 2986 CONECT 2984 2983 CONECT 2985 2983 CONECT 2986 2983 CONECT 2987 2973 CONECT 2988 2970 CONECT 2989 2965 2990 3004 CONECT 2990 2989 2991 3007 CONECT 2991 2990 2992 2997 CONECT 2992 2991 2993 CONECT 2993 2992 2994 2995 2996 CONECT 2994 2993 CONECT 2995 2993 CONECT 2996 2993 CONECT 2997 2991 2998 3006 CONECT 2998 2997 2999 3004 CONECT 2999 2998 3000 CONECT 3000 2999 3001 3002 3003 CONECT 3001 3000 CONECT 3002 3000 CONECT 3003 3000 CONECT 3004 2989 2998 3005 CONECT 3005 3004 CONECT 3006 2997 CONECT 3007 2990 CONECT 3008 2964 CONECT 3009 2962 CONECT 3010 2959 CONECT 3011 2958 CONECT 3012 2958 CONECT 3013 2957 CONECT 3014 2957 CONECT 3015 2956 CONECT 3016 2956 CONECT 3017 2948 CONECT 3018 2947 CONECT 3019 2947 CONECT 3020 2946 CONECT 3021 2946 CONECT 3022 2946 MASTER 0 0 0 0 0 0 0 0 3019 3 89 23 END
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RCSB PDB
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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
5a4c
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
FGFR1
Ligand Name
XOJ
EC.Number
E.C.2.7.10.1
Resolution
2.09(Å)
Affinity (Kd/Ki/IC50)
Kd=5.7nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Nat.Commun. Vol. 6: pp. 1-12
Ligand Properties
Formula
C
2
7
H
4
0
N
7
O
3
Molecular Weight
510.652
Exact Mass
510.319
No. of atoms
77
No. of bonds
79
Polar Surface Area
114.73
LOGP Value
4.69 (
Computed with XLOGP3
)
3.89 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 3
Canonical SMILES
COc1cc(OC)cc(c1)c1cc2cnc(nc2nc1NC(=O)NC(C)(C)C)NCCC[NH+](CC)CC
InChI String
InChI=1S/C27H39N7O3/c1-8-34(9-2)12-10-11-28-25-29-17-19-15-22(18-13-20(36-6)16-21(14-18)37-7)24(30-23(19)31-25)32-26(35)33-27(3,4)5/h13-17H,8-12H2,1-7H3,(H3,28,29,30,31,32,33,35)/p+1
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):
P11362
Entrez Gene ID
NCBI Entrez Gene ID:
2260
ASD
Information of known allosteric effects of PDB entries
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