Browse entries in the PDBbind-CN Database
HEADER 6NPM_COMPLEX COMPND 6NPM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 141 SER HIS MET GLY GLN GLY GLY SER ASN PRO LYS PHE GLU SEQRES 2 A 141 ASN ILE ALA GLU GLY LEU ARG ALA LEU LEU ALA ARG SER SEQRES 3 A 141 HIS VAL GLU ARG THR THR ASP GLU GLY THR TRP VAL ALA SEQRES 4 A 141 GLY VAL PHE VAL TYR GLY GLY SER LYS THR SER LEU TYR SEQRES 5 A 141 ASN LEU ARG ARG GLY THR ALA LEU ALA ILE PRO GLN CYS SEQRES 6 A 141 ARG LEU THR PRO LEU SER ARG LEU PRO PHE GLY MET ALA SEQRES 7 A 141 PRO GLY PRO GLY PRO GLN PRO GLY PRO LEU ARG GLU SER SEQRES 8 A 141 ILE VAL CYS TYR PHE MET VAL PHE LEU GLN THR HIS ILE SEQRES 9 A 141 PHE ALA GLU VAL LEU LYS ASP ALA ILE LYS ASP LEU VAL SEQRES 10 A 141 MET THR LYS PRO ALA PRO THR CYS ASN ILE ARG VAL THR SEQRES 11 A 141 VAL CYS SER PHE ASP ASP GLY VAL ASP LEU PRO SEQRES 1 B 134 SER ASN PRO LYS PHE GLU ASN ILE ALA GLU GLY LEU ARG SEQRES 2 B 134 ALA LEU LEU ALA ARG SER HIS VAL GLU ARG THR THR ASP SEQRES 3 B 134 GLU GLY THR TRP VAL ALA GLY VAL PHE VAL TYR GLY GLY SEQRES 4 B 134 SER LYS THR SER LEU TYR ASN LEU ARG ARG GLY THR ALA SEQRES 5 B 134 LEU ALA ILE PRO GLN CYS ARG LEU THR PRO LEU SER ARG SEQRES 6 B 134 LEU PRO PHE GLY MET ALA PRO GLY PRO GLY PRO GLN PRO SEQRES 7 B 134 GLY PRO LEU ARG GLU SER ILE VAL CYS TYR PHE MET VAL SEQRES 8 B 134 PHE LEU GLN THR HIS ILE PHE ALA GLU VAL LEU LYS ASP SEQRES 9 B 134 ALA ILE LYS ASP LEU VAL MET THR LYS PRO ALA PRO THR SEQRES 10 B 134 CYS ASN ILE ARG VAL THR VAL CYS SER PHE ASP ASP GLY SEQRES 11 B 134 VAL ASP LEU PRO HET KVD A 723 25 ATOM 1 N SER A 467 -8.143 9.509 21.309 1.00 27.08 N ATOM 2 CA SER A 467 -8.521 8.706 20.145 1.00 37.11 C ATOM 3 C SER A 467 -10.039 8.546 20.090 1.00 45.97 C ATOM 4 O SER A 467 -10.720 8.670 21.104 1.00 44.03 O ATOM 5 CB SER A 467 -7.848 7.329 20.183 1.00 38.31 C ATOM 6 OG SER A 467 -6.448 7.419 19.952 1.00 45.00 O ATOM 7 HG SER A 467 -6.050 6.513 19.984 1.00 0.00 H ATOM 8 HN3 SER A 467 -8.469 9.036 22.176 1.00 0.00 H ATOM 9 HN2 SER A 467 -8.584 10.448 21.239 1.00 0.00 H ATOM 10 HN1 SER A 467 -7.108 9.612 21.337 1.00 0.00 H ATOM 11 N HIS A 468 -10.566 8.237 18.908 1.00 41.62 N ATOM 12 CA HIS A 468 -12.008 8.175 18.731 1.00 35.62 C ATOM 13 C HIS A 468 -12.643 7.103 19.614 1.00 32.93 C ATOM 14 O HIS A 468 -12.107 6.003 19.771 1.00 28.39 O ATOM 15 CB HIS A 468 -12.336 7.888 17.269 1.00 32.20 C ATOM 16 CG HIS A 468 -13.772 7.550 17.044 1.00 30.99 C ATOM 17 ND1 HIS A 468 -14.748 8.515 16.914 1.00 39.40 N ATOM 18 CD2 HIS A 468 -14.405 6.356 16.952 1.00 31.88 C ATOM 19 CE1 HIS A 468 -15.919 7.929 16.735 1.00 30.12 C ATOM 20 NE2 HIS A 468 -15.738 6.621 16.753 1.00 31.55 N ATOM 21 H HIS A 468 -9.940 8.038 18.102 1.00 0.00 H ATOM 22 N MET A 469 -13.819 7.421 20.163 1.00 30.11 N ATOM 23 CA MET A 469 -14.623 6.465 20.920 1.00 28.08 C ATOM 24 C MET A 469 -16.055 6.518 20.410 1.00 23.22 C ATOM 25 O MET A 469 -16.617 7.601 20.234 1.00 28.18 O ATOM 26 CB MET A 469 -14.578 6.756 22.431 1.00 40.52 C ATOM 27 CG MET A 469 -14.819 5.507 23.290 1.00 31.32 C ATOM 28 SD MET A 469 -13.711 5.359 24.725 1.00 46.35 S ATOM 29 CE MET A 469 -13.863 6.981 25.482 1.00 48.98 C ATOM 30 H MET A 469 -14.177 8.390 20.046 1.00 0.00 H ATOM 31 N GLY A 470 -16.636 5.353 20.176 1.00 19.93 N ATOM 32 CA GLY A 470 -17.983 5.262 19.675 1.00 18.83 C ATOM 33 C GLY A 470 -18.996 5.495 20.776 1.00 18.62 C ATOM 34 O GLY A 470 -18.659 5.736 21.931 1.00 19.46 O ATOM 35 H GLY A 470 -16.105 4.478 20.359 1.00 0.00 H ATOM 36 N GLN A 471 -20.263 5.406 20.390 1.00 18.07 N ATOM 37 CA GLN A 471 -21.366 5.706 21.291 1.00 18.63 C ATOM 38 C GLN A 471 -21.296 4.831 22.529 1.00 18.72 C ATOM 39 O GLN A 471 -21.164 3.607 22.443 1.00 18.59 O ATOM 40 CB GLN A 471 -22.697 5.490 20.571 1.00 19.00 C ATOM 41 CG GLN A 471 -23.945 5.497 21.477 1.00 18.20 C ATOM 42 CD GLN A 471 -24.233 6.838 22.153 1.00 27.36 C ATOM 43 OE1 GLN A 471 -24.568 6.908 23.354 1.00 32.34 O ATOM 44 NE2 GLN A 471 -24.152 7.904 21.379 1.00 19.31 N ATOM 45 HE22 GLN A 471 -23.869 7.803 20.383 1.00 0.00 H ATOM 46 HE21 GLN A 471 -24.371 8.845 21.765 1.00 0.00 H ATOM 47 H GLN A 471 -20.474 5.113 19.415 1.00 0.00 H ATOM 48 N GLY A 472 -21.402 5.464 23.685 1.00 19.44 N ATOM 49 CA GLY A 472 -21.392 4.719 24.907 1.00 20.00 C ATOM 50 C GLY A 472 -20.017 4.318 25.373 1.00 21.32 C ATOM 51 O GLY A 472 -19.907 3.527 26.311 1.00 21.54 O ATOM 52 H GLY A 472 -21.492 6.500 23.706 1.00 0.00 H ATOM 53 N GLY A 473 -18.967 4.833 24.742 1.00 21.05 N ATOM 54 CA GLY A 473 -17.628 4.685 25.273 1.00 22.24 C ATOM 55 C GLY A 473 -16.903 3.431 24.849 1.00 23.17 C ATOM 56 O GLY A 473 -15.953 3.023 25.524 1.00 23.58 O ATOM 57 H GLY A 473 -19.109 5.351 23.852 1.00 0.00 H ATOM 58 N SER A 474 -17.330 2.807 23.766 1.00 22.44 N ATOM 59 CA SER A 474 -16.799 1.541 23.286 1.00 21.35 C ATOM 60 C SER A 474 -16.599 1.646 21.784 1.00 20.42 C ATOM 61 O SER A 474 -17.339 2.355 21.105 1.00 19.46 O ATOM 62 CB SER A 474 -17.760 0.364 23.562 1.00 24.30 C ATOM 63 OG SER A 474 -17.614 -0.122 24.876 1.00 53.03 O ATOM 64 HG SER A 474 -17.813 0.604 25.519 1.00 0.00 H ATOM 65 H SER A 474 -18.097 3.250 23.221 1.00 0.00 H ATOM 66 N ASN A 475 -15.609 0.921 21.269 1.00 15.11 N ATOM 67 CA ASN A 475 -15.506 0.669 19.846 1.00 18.30 C ATOM 68 C ASN A 475 -15.657 -0.822 19.563 1.00 14.94 C ATOM 69 O ASN A 475 -15.328 -1.656 20.414 1.00 17.13 O ATOM 70 CB ASN A 475 -14.155 1.105 19.270 1.00 17.85 C ATOM 71 CG ASN A 475 -13.864 2.570 19.467 1.00 17.58 C ATOM 72 OD1 ASN A 475 -14.720 3.428 19.287 1.00 21.24 O ATOM 73 ND2 ASN A 475 -12.622 2.866 19.856 1.00 24.61 N ATOM 74 HD22 ASN A 475 -11.926 2.106 19.997 1.00 0.00 H ATOM 75 HD21 ASN A 475 -12.350 3.857 20.018 1.00 0.00 H ATOM 76 H ASN A 475 -14.889 0.524 21.906 1.00 0.00 H ATOM 77 N PRO A 476 -16.087 -1.190 18.359 1.00 14.86 N ATOM 78 CA PRO A 476 -16.089 -2.606 17.977 1.00 12.95 C ATOM 79 C PRO A 476 -14.695 -3.209 18.020 1.00 14.22 C ATOM 80 O PRO A 476 -13.688 -2.532 17.787 1.00 13.88 O ATOM 81 CB PRO A 476 -16.624 -2.598 16.540 1.00 17.74 C ATOM 82 CG PRO A 476 -17.100 -1.222 16.253 1.00 27.57 C ATOM 83 CD PRO A 476 -16.547 -0.292 17.288 1.00 19.61 C ATOM 84 N LYS A 477 -14.645 -4.520 18.253 1.00 14.17 N ATOM 85 CA LYS A 477 -13.346 -5.182 18.348 1.00 12.19 C ATOM 86 C LYS A 477 -12.503 -4.986 17.093 1.00 13.61 C ATOM 87 O LYS A 477 -11.286 -4.806 17.196 1.00 12.28 O ATOM 88 CB LYS A 477 -13.520 -6.668 18.651 1.00 14.76 C ATOM 89 CG LYS A 477 -13.827 -6.931 20.123 1.00 17.37 C ATOM 90 CD LYS A 477 -13.704 -8.407 20.462 1.00 30.04 C ATOM 91 CE LYS A 477 -14.138 -8.696 21.912 1.00 24.66 C ATOM 92 NZ LYS A 477 -15.522 -8.237 22.189 1.00 52.60 N ATOM 93 HZ1 LYS A 477 -15.583 -7.211 22.033 1.00 0.00 H ATOM 94 HZ2 LYS A 477 -16.182 -8.726 21.551 1.00 0.00 H ATOM 95 HZ3 LYS A 477 -15.767 -8.454 23.176 1.00 0.00 H ATOM 96 H LYS A 477 -15.522 -5.067 18.366 1.00 0.00 H ATOM 97 N PHE A 478 -13.108 -5.021 15.898 1.00 12.30 N ATOM 98 CA PHE A 478 -12.287 -4.902 14.696 1.00 11.74 C ATOM 99 C PHE A 478 -11.689 -3.509 14.571 1.00 11.66 C ATOM 100 O PHE A 478 -10.587 -3.363 14.029 1.00 11.80 O ATOM 101 CB PHE A 478 -13.086 -5.274 13.436 1.00 13.26 C ATOM 102 CG PHE A 478 -14.265 -4.382 13.159 1.00 19.33 C ATOM 103 CD1 PHE A 478 -14.128 -3.222 12.421 1.00 23.76 C ATOM 104 CD2 PHE A 478 -15.509 -4.723 13.632 1.00 24.64 C ATOM 105 CE1 PHE A 478 -15.250 -2.404 12.190 1.00 31.18 C ATOM 106 CE2 PHE A 478 -16.606 -3.928 13.394 1.00 32.60 C ATOM 107 CZ PHE A 478 -16.466 -2.768 12.684 1.00 23.30 C ATOM 108 H PHE A 478 -14.140 -5.131 15.828 1.00 0.00 H ATOM 109 N GLU A 479 -12.379 -2.482 15.080 1.00 12.03 N ATOM 110 CA GLU A 479 -11.829 -1.127 15.056 1.00 12.15 C ATOM 111 C GLU A 479 -10.657 -1.018 16.009 1.00 11.72 C ATOM 112 O GLU A 479 -9.640 -0.382 15.696 1.00 13.37 O ATOM 113 CB GLU A 479 -12.900 -0.095 15.421 1.00 14.51 C ATOM 114 CG GLU A 479 -13.906 0.175 14.304 1.00 26.33 C ATOM 115 CD GLU A 479 -14.813 1.368 14.599 1.00 32.19 C ATOM 116 OE1 GLU A 479 -14.554 2.096 15.589 1.00 28.07 O ATOM 117 OE2 GLU A 479 -15.780 1.577 13.829 1.00 40.14 O ATOM 118 H GLU A 479 -13.317 -2.649 15.497 1.00 0.00 H ATOM 119 N ASN A 480 -10.762 -1.665 17.169 1.00 11.39 N ATOM 120 CA ASN A 480 -9.653 -1.632 18.113 1.00 12.27 C ATOM 121 C ASN A 480 -8.458 -2.435 17.610 1.00 11.65 C ATOM 122 O ASN A 480 -7.310 -2.042 17.860 1.00 12.71 O ATOM 123 CB ASN A 480 -10.142 -2.142 19.458 1.00 11.49 C ATOM 124 CG ASN A 480 -11.034 -1.154 20.148 1.00 12.17 C ATOM 125 OD1 ASN A 480 -10.961 0.052 19.890 1.00 13.91 O ATOM 126 ND2 ASN A 480 -11.890 -1.653 21.028 1.00 14.39 N ATOM 127 HD22 ASN A 480 -11.912 -2.677 21.209 1.00 0.00 H ATOM 128 HD21 ASN A 480 -12.540 -1.021 21.537 1.00 0.00 H ATOM 129 H ASN A 480 -11.630 -2.190 17.399 1.00 0.00 H ATOM 130 N ILE A 481 -8.689 -3.536 16.894 1.00 10.71 N ATOM 131 CA ILE A 481 -7.595 -4.249 16.239 1.00 10.58 C ATOM 132 C ILE A 481 -6.892 -3.353 15.234 1.00 10.42 C ATOM 133 O ILE A 481 -5.656 -3.306 15.189 1.00 11.41 O ATOM 134 CB ILE A 481 -8.113 -5.538 15.578 1.00 13.95 C ATOM 135 CG1 ILE A 481 -8.403 -6.551 16.687 1.00 16.41 C ATOM 136 CG2 ILE A 481 -7.122 -6.055 14.550 1.00 13.13 C ATOM 137 CD1 ILE A 481 -9.273 -7.658 16.279 1.00 17.78 C ATOM 138 H ILE A 481 -9.662 -3.892 16.801 1.00 0.00 H ATOM 139 N ALA A 482 -7.659 -2.627 14.419 1.00 10.96 N ATOM 140 CA ALA A 482 -7.047 -1.756 13.415 1.00 10.73 C ATOM 141 C ALA A 482 -6.142 -0.723 14.080 1.00 11.39 C ATOM 142 O ALA A 482 -5.021 -0.471 13.631 1.00 12.69 O ATOM 143 CB ALA A 482 -8.139 -1.072 12.595 1.00 12.69 C ATOM 144 H ALA A 482 -8.695 -2.680 14.497 1.00 0.00 H ATOM 145 N GLU A 483 -6.625 -0.115 15.160 1.00 11.03 N ATOM 146 CA GLU A 483 -5.834 0.874 15.883 1.00 13.83 C ATOM 147 C GLU A 483 -4.575 0.264 16.476 1.00 14.63 C ATOM 148 O GLU A 483 -3.501 0.886 16.444 1.00 14.19 O ATOM 149 CB GLU A 483 -6.681 1.501 16.987 1.00 16.65 C ATOM 150 CG GLU A 483 -7.464 2.721 16.525 1.00 30.05 C ATOM 151 CD GLU A 483 -6.529 3.828 16.062 1.00 44.44 C ATOM 152 OE1 GLU A 483 -5.830 4.409 16.921 1.00 41.76 O ATOM 153 OE2 GLU A 483 -6.468 4.090 14.840 1.00 31.54 O ATOM 154 H GLU A 483 -7.582 -0.349 15.494 1.00 0.00 H ATOM 155 N GLY A 484 -4.687 -0.946 17.033 1.00 11.25 N ATOM 156 CA GLY A 484 -3.531 -1.576 17.628 1.00 13.45 C ATOM 157 C GLY A 484 -2.510 -1.933 16.575 1.00 10.62 C ATOM 158 O GLY A 484 -1.297 -1.780 16.793 1.00 12.12 O ATOM 159 H GLY A 484 -5.606 -1.434 17.038 1.00 0.00 H ATOM 160 N LEU A 485 -2.983 -2.408 15.421 1.00 10.68 N ATOM 161 CA LEU A 485 -2.071 -2.727 14.326 1.00 11.77 C ATOM 162 C LEU A 485 -1.389 -1.469 13.830 1.00 13.94 C ATOM 163 O LEU A 485 -0.190 -1.475 13.558 1.00 13.43 O ATOM 164 CB LEU A 485 -2.808 -3.400 13.162 1.00 12.40 C ATOM 165 CG LEU A 485 -3.222 -4.848 13.378 1.00 13.48 C ATOM 166 CD1 LEU A 485 -4.037 -5.391 12.224 1.00 13.28 C ATOM 167 CD2 LEU A 485 -1.982 -5.690 13.597 1.00 11.98 C ATOM 168 H LEU A 485 -4.006 -2.552 15.301 1.00 0.00 H ATOM 169 N ARG A 486 -2.144 -0.379 13.684 1.00 14.86 N ATOM 170 CA ARG A 486 -1.537 0.866 13.220 1.00 14.49 C ATOM 171 C ARG A 486 -0.425 1.319 14.155 1.00 15.66 C ATOM 172 O ARG A 486 0.625 1.789 13.701 1.00 15.05 O ATOM 173 CB ARG A 486 -2.594 1.961 13.103 1.00 17.68 C ATOM 174 CG ARG A 486 -3.556 1.795 11.944 1.00 21.26 C ATOM 175 CD ARG A 486 -4.557 2.955 11.904 1.00 25.92 C ATOM 176 NE ARG A 486 -5.663 2.705 10.982 1.00 32.82 N ATOM 177 CZ ARG A 486 -6.947 2.640 11.332 1.00 41.71 C ATOM 178 NH1 ARG A 486 -7.324 2.819 12.593 1.00 37.29 N ATOM 179 NH2 ARG A 486 -7.867 2.405 10.406 1.00 33.60 N ATOM 180 HE ARG A 486 -5.430 2.568 9.978 1.00 0.00 H ATOM 181 HH12 ARG A 486 -8.331 2.765 12.847 1.00 0.00 H ATOM 182 HH11 ARG A 486 -6.612 3.014 13.326 1.00 0.00 H ATOM 183 HH22 ARG A 486 -8.871 2.353 10.672 1.00 0.00 H ATOM 184 HH21 ARG A 486 -7.584 2.273 9.414 1.00 0.00 H ATOM 185 H ARG A 486 -3.161 -0.415 13.900 1.00 0.00 H ATOM 186 N ALA A 487 -0.641 1.210 15.465 1.00 13.16 N ATOM 187 CA ALA A 487 0.387 1.611 16.420 1.00 13.33 C ATOM 188 C ALA A 487 1.635 0.757 16.275 1.00 13.49 C ATOM 189 O ALA A 487 2.757 1.280 16.280 1.00 14.48 O ATOM 190 CB ALA A 487 -0.162 1.518 17.842 1.00 14.96 C ATOM 191 H ALA A 487 -1.548 0.837 15.809 1.00 0.00 H ATOM 192 N LEU A 488 1.468 -0.555 16.124 1.00 12.96 N ATOM 193 CA LEU A 488 2.640 -1.419 16.050 1.00 12.69 C ATOM 194 C LEU A 488 3.366 -1.231 14.728 1.00 12.18 C ATOM 195 O LEU A 488 4.607 -1.213 14.690 1.00 11.69 O ATOM 196 CB LEU A 488 2.242 -2.887 16.227 1.00 11.90 C ATOM 197 CG LEU A 488 1.741 -3.274 17.621 1.00 11.91 C ATOM 198 CD1 LEU A 488 1.141 -4.644 17.623 1.00 15.19 C ATOM 199 CD2 LEU A 488 2.889 -3.193 18.608 1.00 17.64 C ATOM 200 H LEU A 488 0.512 -0.959 16.060 1.00 0.00 H ATOM 201 N LEU A 489 2.617 -1.096 13.633 1.00 11.21 N ATOM 202 CA LEU A 489 3.235 -0.968 12.319 1.00 11.80 C ATOM 203 C LEU A 489 3.964 0.357 12.165 1.00 16.89 C ATOM 204 O LEU A 489 4.910 0.452 11.375 1.00 16.17 O ATOM 205 CB LEU A 489 2.190 -1.122 11.219 1.00 13.32 C ATOM 206 CG LEU A 489 1.539 -2.501 11.166 1.00 16.66 C ATOM 207 CD1 LEU A 489 0.415 -2.502 10.134 1.00 18.45 C ATOM 208 CD2 LEU A 489 2.543 -3.598 10.878 1.00 20.75 C ATOM 209 H LEU A 489 1.581 -1.082 13.717 1.00 0.00 H ATOM 210 N ALA A 490 3.538 1.384 12.900 1.00 12.19 N ATOM 211 CA ALA A 490 4.181 2.685 12.828 1.00 15.21 C ATOM 212 C ALA A 490 5.631 2.635 13.291 1.00 16.87 C ATOM 213 O ALA A 490 6.412 3.535 12.955 1.00 17.81 O ATOM 214 CB ALA A 490 3.401 3.685 13.671 1.00 16.27 C ATOM 215 H ALA A 490 2.728 1.251 13.539 1.00 0.00 H ATOM 216 N ARG A 491 6.007 1.595 14.035 1.00 14.16 N ATOM 217 CA ARG A 491 7.381 1.450 14.493 1.00 15.97 C ATOM 218 C ARG A 491 8.333 1.003 13.391 1.00 19.90 C ATOM 219 O ARG A 491 9.557 1.075 13.583 1.00 17.03 O ATOM 220 CB ARG A 491 7.448 0.429 15.619 1.00 16.53 C ATOM 221 CG ARG A 491 6.622 0.759 16.835 1.00 14.73 C ATOM 222 CD ARG A 491 6.639 -0.432 17.770 1.00 16.30 C ATOM 223 NE ARG A 491 6.178 -0.082 19.104 1.00 17.08 N ATOM 224 CZ ARG A 491 6.031 -0.959 20.086 1.00 21.26 C ATOM 225 NH1 ARG A 491 6.305 -2.231 19.869 1.00 21.40 N ATOM 226 NH2 ARG A 491 5.629 -0.553 21.288 1.00 23.60 N ATOM 227 HE ARG A 491 5.951 0.914 19.298 1.00 0.00 H ATOM 228 HH12 ARG A 491 6.192 -2.925 20.635 1.00 0.00 H ATOM 229 HH11 ARG A 491 6.634 -2.540 18.932 1.00 0.00 H ATOM 230 HH22 ARG A 491 5.514 -1.242 22.058 1.00 0.00 H ATOM 231 HH21 ARG A 491 5.430 0.454 21.457 1.00 0.00 H ATOM 232 H ARG A 491 5.305 0.873 14.293 1.00 0.00 H ATOM 233 N SER A 492 7.814 0.511 12.270 1.00 14.32 N ATOM 234 CA SER A 492 8.640 -0.106 11.234 1.00 15.51 C ATOM 235 C SER A 492 8.365 0.553 9.889 1.00 17.48 C ATOM 236 O SER A 492 7.338 0.286 9.255 1.00 21.51 O ATOM 237 CB SER A 492 8.348 -1.600 11.161 1.00 17.14 C ATOM 238 OG SER A 492 8.690 -2.234 12.377 1.00 21.14 O ATOM 239 HG SER A 492 8.493 -3.202 12.310 1.00 0.00 H ATOM 240 H SER A 492 6.786 0.567 12.126 1.00 0.00 H ATOM 241 N HIS A 493 9.302 1.378 9.431 1.00 15.24 N ATOM 242 CA HIS A 493 9.148 2.126 8.185 1.00 16.10 C ATOM 243 C HIS A 493 9.741 1.340 7.015 1.00 15.91 C ATOM 244 O HIS A 493 10.755 1.707 6.439 1.00 18.65 O ATOM 245 CB HIS A 493 9.835 3.475 8.293 1.00 18.90 C ATOM 246 CG HIS A 493 9.320 4.352 9.387 1.00 32.82 C ATOM 247 ND1 HIS A 493 9.886 5.578 9.665 1.00 36.35 N ATOM 248 CD2 HIS A 493 8.288 4.206 10.253 1.00 37.99 C ATOM 249 CE1 HIS A 493 9.236 6.143 10.666 1.00 39.46 C ATOM 250 NE2 HIS A 493 8.260 5.333 11.039 1.00 35.34 N ATOM 251 H HIS A 493 10.177 1.495 9.980 1.00 0.00 H ATOM 252 N VAL A 494 9.078 0.255 6.659 1.00 14.50 N ATOM 253 CA VAL A 494 9.562 -0.659 5.641 1.00 14.33 C ATOM 254 C VAL A 494 8.709 -0.537 4.384 1.00 14.20 C ATOM 255 O VAL A 494 7.561 -0.081 4.413 1.00 16.52 O ATOM 256 CB VAL A 494 9.600 -2.118 6.160 1.00 13.89 C ATOM 257 CG1 VAL A 494 10.367 -2.231 7.499 1.00 13.98 C ATOM 258 CG2 VAL A 494 8.204 -2.716 6.340 1.00 15.20 C ATOM 259 H VAL A 494 8.173 0.047 7.127 1.00 0.00 H ATOM 260 N GLU A 495 9.290 -0.933 3.255 1.00 14.67 N ATOM 261 CA GLU A 495 8.528 -0.875 2.016 1.00 17.15 C ATOM 262 C GLU A 495 7.355 -1.833 2.078 1.00 13.34 C ATOM 263 O GLU A 495 7.484 -2.971 2.544 1.00 13.57 O ATOM 264 CB GLU A 495 9.400 -1.218 0.821 1.00 15.60 C ATOM 265 CG GLU A 495 10.136 -2.532 0.902 1.00 33.62 C ATOM 266 CD GLU A 495 11.547 -2.384 1.460 1.00 40.25 C ATOM 267 OE1 GLU A 495 11.865 -1.320 2.026 1.00 33.07 O ATOM 268 OE2 GLU A 495 12.343 -3.329 1.271 1.00 48.34 O ATOM 269 H GLU A 495 10.271 -1.278 3.257 1.00 0.00 H ATOM 270 N ARG A 496 6.206 -1.365 1.578 1.00 13.49 N ATOM 271 CA ARG A 496 5.014 -2.182 1.459 1.00 13.77 C ATOM 272 C ARG A 496 4.673 -2.513 0.020 1.00 13.66 C ATOM 273 O ARG A 496 3.842 -3.394 -0.220 1.00 15.95 O ATOM 274 CB ARG A 496 3.808 -1.464 2.088 1.00 16.38 C ATOM 275 CG ARG A 496 3.991 -1.152 3.570 1.00 13.45 C ATOM 276 CD ARG A 496 2.745 -0.523 4.144 1.00 14.58 C ATOM 277 NE ARG A 496 2.906 -0.238 5.566 1.00 16.18 N ATOM 278 CZ ARG A 496 1.919 0.101 6.375 1.00 14.40 C ATOM 279 NH1 ARG A 496 0.681 0.232 5.917 1.00 14.82 N ATOM 280 NH2 ARG A 496 2.160 0.321 7.664 1.00 15.96 N ATOM 281 HE ARG A 496 3.862 -0.306 5.969 1.00 0.00 H ATOM 282 HH12 ARG A 496 -0.087 0.499 6.565 1.00 0.00 H ATOM 283 HH11 ARG A 496 0.479 0.067 4.910 1.00 0.00 H ATOM 284 HH22 ARG A 496 1.382 0.588 8.300 1.00 0.00 H ATOM 285 HH21 ARG A 496 3.127 0.226 8.036 1.00 0.00 H ATOM 286 H ARG A 496 6.166 -0.375 1.262 1.00 0.00 H ATOM 287 N THR A 497 5.266 -1.818 -0.928 1.00 14.15 N ATOM 288 CA THR A 497 4.939 -1.961 -2.333 1.00 14.80 C ATOM 289 C THR A 497 6.226 -1.990 -3.137 1.00 17.29 C ATOM 290 O THR A 497 7.280 -1.557 -2.670 1.00 16.91 O ATOM 291 CB THR A 497 4.053 -0.812 -2.846 1.00 16.14 C ATOM 292 OG1 THR A 497 4.768 0.427 -2.767 1.00 23.60 O ATOM 293 CG2 THR A 497 2.788 -0.689 -2.031 1.00 22.11 C ATOM 294 HG1 THR A 497 5.585 0.371 -3.323 1.00 0.00 H ATOM 295 H THR A 497 6.002 -1.136 -0.657 1.00 0.00 H ATOM 296 N THR A 498 6.134 -2.535 -4.348 1.00 15.96 N ATOM 297 CA THR A 498 7.236 -2.522 -5.294 1.00 17.15 C ATOM 298 C THR A 498 6.750 -1.948 -6.609 1.00 18.62 C ATOM 299 O THR A 498 5.556 -1.939 -6.903 1.00 18.37 O ATOM 300 CB THR A 498 7.814 -3.922 -5.577 1.00 19.40 C ATOM 301 OG1 THR A 498 6.828 -4.748 -6.222 1.00 20.68 O ATOM 302 CG2 THR A 498 8.283 -4.595 -4.277 1.00 17.29 C ATOM 303 HG1 THR A 498 7.213 -5.643 -6.397 1.00 0.00 H ATOM 304 H THR A 498 5.240 -2.987 -4.627 1.00 0.00 H ATOM 305 N ASP A 499 7.698 -1.506 -7.430 1.00 23.29 N ATOM 306 CA ASP A 499 7.309 -1.055 -8.752 1.00 22.49 C ATOM 307 C ASP A 499 6.692 -2.192 -9.555 1.00 22.77 C ATOM 308 O ASP A 499 5.743 -1.962 -10.313 1.00 22.74 O ATOM 309 CB ASP A 499 8.503 -0.463 -9.486 1.00 30.68 C ATOM 310 CG ASP A 499 8.092 0.643 -10.436 1.00 58.12 C ATOM 311 OD1 ASP A 499 7.790 1.767 -9.957 1.00 64.04 O ATOM 312 OD2 ASP A 499 8.070 0.386 -11.655 1.00 56.30 O ATOM 313 H ASP A 499 8.694 -1.484 -7.131 1.00 0.00 H ATOM 314 N GLU A 500 7.214 -3.418 -9.405 1.00 20.13 N ATOM 315 CA GLU A 500 6.668 -4.572 -10.123 1.00 19.75 C ATOM 316 C GLU A 500 5.231 -4.876 -9.687 1.00 18.61 C ATOM 317 O GLU A 500 4.432 -5.387 -10.487 1.00 18.95 O ATOM 318 CB GLU A 500 7.555 -5.797 -9.888 1.00 25.92 C ATOM 319 CG GLU A 500 9.076 -5.542 -10.005 1.00 50.42 C ATOM 320 CD GLU A 500 9.721 -5.112 -8.673 1.00 55.66 C ATOM 321 OE1 GLU A 500 9.801 -3.884 -8.434 1.00 47.09 O ATOM 322 OE2 GLU A 500 10.136 -5.992 -7.872 1.00 47.36 O ATOM 323 H GLU A 500 8.023 -3.552 -8.766 1.00 0.00 H ATOM 324 N GLY A 501 4.900 -4.596 -8.427 1.00 18.50 N ATOM 325 CA GLY A 501 3.562 -4.784 -7.913 1.00 17.63 C ATOM 326 C GLY A 501 3.130 -6.218 -7.787 1.00 17.89 C ATOM 327 O GLY A 501 1.933 -6.497 -7.745 1.00 27.04 O ATOM 328 H GLY A 501 5.633 -4.228 -7.788 1.00 0.00 H ATOM 329 N THR A 502 4.068 -7.145 -7.743 1.00 12.71 N ATOM 330 CA THR A 502 3.726 -8.551 -7.642 1.00 14.44 C ATOM 331 C THR A 502 3.452 -8.957 -6.196 1.00 11.28 C ATOM 332 O THR A 502 4.013 -8.399 -5.250 1.00 14.11 O ATOM 333 CB THR A 502 4.854 -9.385 -8.239 1.00 15.90 C ATOM 334 OG1 THR A 502 6.095 -8.961 -7.673 1.00 18.34 O ATOM 335 CG2 THR A 502 4.916 -9.171 -9.749 1.00 20.01 C ATOM 336 HG1 THR A 502 6.832 -9.499 -8.057 1.00 0.00 H ATOM 337 H THR A 502 5.068 -6.863 -7.781 1.00 0.00 H ATOM 338 N TRP A 503 2.574 -9.952 -6.039 1.00 11.83 N ATOM 339 CA TRP A 503 2.125 -10.471 -4.741 1.00 10.22 C ATOM 340 C TRP A 503 2.970 -11.707 -4.454 1.00 11.24 C ATOM 341 O TRP A 503 2.614 -12.828 -4.818 1.00 13.15 O ATOM 342 CB TRP A 503 0.617 -10.767 -4.775 1.00 11.20 C ATOM 343 CG TRP A 503 -0.126 -9.513 -5.197 1.00 9.95 C ATOM 344 CD1 TRP A 503 -0.536 -9.173 -6.467 1.00 12.29 C ATOM 345 CD2 TRP A 503 -0.497 -8.403 -4.358 1.00 10.37 C ATOM 346 NE1 TRP A 503 -1.138 -7.924 -6.459 1.00 12.28 N ATOM 347 CE2 TRP A 503 -1.150 -7.448 -5.175 1.00 10.42 C ATOM 348 CE3 TRP A 503 -0.365 -8.140 -2.994 1.00 10.80 C ATOM 349 CZ2 TRP A 503 -1.623 -6.230 -4.674 1.00 10.26 C ATOM 350 CZ3 TRP A 503 -0.850 -6.938 -2.499 1.00 9.31 C ATOM 351 CH2 TRP A 503 -1.480 -6.010 -3.333 1.00 9.54 C ATOM 352 HE1 TRP A 503 -1.518 -7.430 -7.291 1.00 0.00 H ATOM 353 H TRP A 503 2.181 -10.390 -6.897 1.00 0.00 H ATOM 354 N VAL A 504 4.112 -11.484 -3.812 1.00 11.10 N ATOM 355 CA VAL A 504 5.126 -12.522 -3.630 1.00 10.72 C ATOM 356 C VAL A 504 5.208 -12.997 -2.198 1.00 10.29 C ATOM 357 O VAL A 504 5.869 -14.010 -1.940 1.00 10.52 O ATOM 358 CB VAL A 504 6.510 -12.042 -4.108 1.00 15.65 C ATOM 359 CG1 VAL A 504 6.438 -11.739 -5.589 1.00 18.74 C ATOM 360 CG2 VAL A 504 6.968 -10.839 -3.296 1.00 16.99 C ATOM 361 H VAL A 504 4.291 -10.536 -3.424 1.00 0.00 H ATOM 362 N ALA A 505 4.557 -12.316 -1.264 1.00 9.82 N ATOM 363 CA ALA A 505 4.639 -12.623 0.152 1.00 10.26 C ATOM 364 C ALA A 505 3.245 -12.686 0.748 1.00 8.84 C ATOM 365 O ALA A 505 2.258 -12.249 0.155 1.00 10.02 O ATOM 366 CB ALA A 505 5.488 -11.571 0.897 1.00 13.09 C ATOM 367 H ALA A 505 3.957 -11.521 -1.562 1.00 0.00 H ATOM 368 N GLY A 506 3.166 -13.215 1.961 1.00 11.24 N ATOM 369 CA GLY A 506 1.875 -13.232 2.633 1.00 13.93 C ATOM 370 C GLY A 506 2.033 -13.565 4.090 1.00 12.70 C ATOM 371 O GLY A 506 3.141 -13.853 4.578 1.00 11.48 O ATOM 372 H GLY A 506 4.010 -13.610 2.423 1.00 0.00 H ATOM 373 N VAL A 507 0.906 -13.472 4.800 1.00 8.45 N ATOM 374 CA VAL A 507 0.793 -13.925 6.166 1.00 7.57 C ATOM 375 C VAL A 507 -0.394 -14.855 6.228 1.00 9.76 C ATOM 376 O VAL A 507 -1.481 -14.522 5.720 1.00 13.43 O ATOM 377 CB VAL A 507 0.651 -12.756 7.154 1.00 14.21 C ATOM 378 CG1 VAL A 507 0.607 -13.240 8.539 1.00 30.20 C ATOM 379 CG2 VAL A 507 1.845 -11.819 6.963 1.00 18.07 C ATOM 380 H VAL A 507 0.069 -13.053 4.347 1.00 0.00 H ATOM 381 N PHE A 508 -0.188 -16.031 6.789 1.00 9.00 N ATOM 382 CA PHE A 508 -1.180 -17.081 6.916 1.00 7.74 C ATOM 383 C PHE A 508 -1.637 -17.115 8.374 1.00 9.60 C ATOM 384 O PHE A 508 -0.825 -17.364 9.264 1.00 9.37 O ATOM 385 CB PHE A 508 -0.569 -18.418 6.453 1.00 10.35 C ATOM 386 CG PHE A 508 -1.559 -19.506 6.286 1.00 9.22 C ATOM 387 CD1 PHE A 508 -2.161 -19.763 5.078 1.00 9.53 C ATOM 388 CD2 PHE A 508 -1.905 -20.286 7.371 1.00 12.49 C ATOM 389 CE1 PHE A 508 -3.126 -20.759 4.975 1.00 13.21 C ATOM 390 CE2 PHE A 508 -2.871 -21.261 7.257 1.00 12.63 C ATOM 391 CZ PHE A 508 -3.452 -21.510 6.083 1.00 11.95 C ATOM 392 H PHE A 508 0.761 -16.220 7.170 1.00 0.00 H ATOM 393 N VAL A 509 -2.921 -16.811 8.623 1.00 7.49 N ATOM 394 CA VAL A 509 -3.435 -16.553 9.969 1.00 7.47 C ATOM 395 C VAL A 509 -4.503 -17.589 10.269 1.00 10.04 C ATOM 396 O VAL A 509 -5.388 -17.816 9.436 1.00 9.07 O ATOM 397 CB VAL A 509 -4.017 -15.134 10.080 1.00 7.69 C ATOM 398 CG1 VAL A 509 -4.405 -14.826 11.512 1.00 10.35 C ATOM 399 CG2 VAL A 509 -3.042 -14.096 9.511 1.00 11.86 C ATOM 400 H VAL A 509 -3.582 -16.756 7.822 1.00 0.00 H ATOM 401 N TYR A 510 -4.408 -18.246 11.428 1.00 8.45 N ATOM 402 CA TYR A 510 -5.317 -19.358 11.683 1.00 8.66 C ATOM 403 C TYR A 510 -5.498 -19.580 13.175 1.00 11.22 C ATOM 404 O TYR A 510 -4.786 -19.031 14.008 1.00 10.56 O ATOM 405 CB TYR A 510 -4.827 -20.639 10.965 1.00 9.26 C ATOM 406 CG TYR A 510 -3.476 -21.164 11.443 1.00 9.23 C ATOM 407 CD1 TYR A 510 -2.277 -20.569 11.048 1.00 11.44 C ATOM 408 CD2 TYR A 510 -3.401 -22.270 12.268 1.00 9.50 C ATOM 409 CE1 TYR A 510 -1.050 -21.057 11.503 1.00 10.88 C ATOM 410 CE2 TYR A 510 -2.189 -22.760 12.720 1.00 11.44 C ATOM 411 CZ TYR A 510 -1.020 -22.160 12.337 1.00 10.72 C ATOM 412 OH TYR A 510 0.188 -22.666 12.768 1.00 10.46 O ATOM 413 HH TYR A 510 0.925 -22.116 12.401 1.00 0.00 H ATOM 414 H TYR A 510 -3.698 -17.970 12.136 1.00 0.00 H ATOM 415 N GLY A 511 -6.486 -20.403 13.495 1.00 10.72 N ATOM 416 CA GLY A 511 -6.725 -20.750 14.871 1.00 10.90 C ATOM 417 C GLY A 511 -7.601 -19.745 15.595 1.00 10.55 C ATOM 418 O GLY A 511 -8.333 -18.955 15.003 1.00 14.23 O ATOM 419 H GLY A 511 -7.091 -20.800 12.748 1.00 0.00 H ATOM 420 N GLY A 512 -7.525 -19.798 16.921 1.00 13.36 N ATOM 421 CA GLY A 512 -8.386 -18.978 17.743 1.00 15.92 C ATOM 422 C GLY A 512 -9.819 -19.461 17.726 1.00 16.37 C ATOM 423 O GLY A 512 -10.175 -20.434 18.389 1.00 27.27 O ATOM 424 H GLY A 512 -6.839 -20.436 17.372 1.00 0.00 H ATOM 425 N SER A 513 -10.662 -18.725 17.027 1.00 14.78 N ATOM 426 CA SER A 513 -12.057 -19.075 16.780 1.00 13.08 C ATOM 427 C SER A 513 -12.446 -18.341 15.516 1.00 13.65 C ATOM 428 O SER A 513 -11.777 -17.390 15.111 1.00 13.62 O ATOM 429 CB SER A 513 -12.978 -18.664 17.921 1.00 14.64 C ATOM 430 OG SER A 513 -13.017 -17.253 18.011 1.00 16.19 O ATOM 431 HG SER A 513 -13.616 -16.987 18.753 1.00 0.00 H ATOM 432 H SER A 513 -10.308 -17.834 16.624 1.00 0.00 H ATOM 433 N LYS A 514 -13.578 -18.732 14.927 1.00 14.12 N ATOM 434 CA LYS A 514 -14.014 -18.023 13.731 1.00 11.73 C ATOM 435 C LYS A 514 -14.270 -16.548 14.027 1.00 12.72 C ATOM 436 O LYS A 514 -13.902 -15.673 13.236 1.00 12.32 O ATOM 437 CB LYS A 514 -15.273 -18.661 13.145 1.00 12.96 C ATOM 438 CG LYS A 514 -15.528 -18.160 11.741 1.00 15.35 C ATOM 439 CD LYS A 514 -16.698 -18.847 11.075 1.00 18.49 C ATOM 440 CE LYS A 514 -17.179 -18.049 9.860 1.00 29.73 C ATOM 441 NZ LYS A 514 -18.004 -18.890 8.937 1.00 24.82 N ATOM 442 HZ1 LYS A 514 -17.435 -19.692 8.598 1.00 0.00 H ATOM 443 HZ2 LYS A 514 -18.838 -19.246 9.447 1.00 0.00 H ATOM 444 HZ3 LYS A 514 -18.311 -18.315 8.127 1.00 0.00 H ATOM 445 H LYS A 514 -14.134 -19.522 15.312 1.00 0.00 H ATOM 446 N THR A 515 -14.905 -16.253 15.160 1.00 12.33 N ATOM 447 CA THR A 515 -15.222 -14.865 15.481 1.00 13.41 C ATOM 448 C THR A 515 -13.955 -14.056 15.706 1.00 11.67 C ATOM 449 O THR A 515 -13.849 -12.912 15.240 1.00 11.94 O ATOM 450 CB THR A 515 -16.131 -14.784 16.708 1.00 14.36 C ATOM 451 OG1 THR A 515 -17.395 -15.386 16.405 1.00 20.89 O ATOM 452 CG2 THR A 515 -16.372 -13.332 17.092 1.00 19.07 C ATOM 453 HG1 THR A 515 -17.257 -16.335 16.158 1.00 0.00 H ATOM 454 H THR A 515 -15.175 -17.013 15.817 1.00 0.00 H ATOM 455 N SER A 516 -12.973 -14.625 16.410 1.00 10.51 N ATOM 456 CA SER A 516 -11.753 -13.860 16.650 1.00 11.35 C ATOM 457 C SER A 516 -11.020 -13.578 15.343 1.00 10.56 C ATOM 458 O SER A 516 -10.507 -12.463 15.131 1.00 11.35 O ATOM 459 CB SER A 516 -10.851 -14.570 17.666 1.00 17.96 C ATOM 460 OG SER A 516 -10.437 -15.858 17.289 1.00 20.46 O ATOM 461 HG SER A 516 -11.232 -16.434 17.161 1.00 0.00 H ATOM 462 H SER A 516 -13.075 -15.592 16.779 1.00 0.00 H ATOM 463 N LEU A 517 -10.985 -14.557 14.433 1.00 10.22 N ATOM 464 CA LEU A 517 -10.361 -14.340 13.128 1.00 10.91 C ATOM 465 C LEU A 517 -11.159 -13.352 12.284 1.00 8.84 C ATOM 466 O LEU A 517 -10.576 -12.538 11.553 1.00 10.30 O ATOM 467 CB LEU A 517 -10.201 -15.665 12.387 1.00 12.26 C ATOM 468 CG LEU A 517 -9.135 -16.656 12.842 1.00 13.31 C ATOM 469 CD1 LEU A 517 -9.382 -17.962 12.058 1.00 15.93 C ATOM 470 CD2 LEU A 517 -7.710 -16.112 12.621 1.00 12.40 C ATOM 471 H LEU A 517 -11.406 -15.482 14.655 1.00 0.00 H ATOM 472 N TYR A 518 -12.489 -13.413 12.364 1.00 10.42 N ATOM 473 CA TYR A 518 -13.332 -12.429 11.703 1.00 12.32 C ATOM 474 C TYR A 518 -12.923 -11.021 12.101 1.00 11.31 C ATOM 475 O TYR A 518 -12.762 -10.142 11.250 1.00 11.36 O ATOM 476 CB TYR A 518 -14.792 -12.671 12.081 1.00 11.01 C ATOM 477 CG TYR A 518 -15.742 -11.574 11.644 1.00 13.09 C ATOM 478 CD1 TYR A 518 -16.316 -11.607 10.398 1.00 16.20 C ATOM 479 CD2 TYR A 518 -16.039 -10.523 12.481 1.00 18.89 C ATOM 480 CE1 TYR A 518 -17.193 -10.619 9.994 1.00 19.18 C ATOM 481 CE2 TYR A 518 -16.911 -9.536 12.097 1.00 28.41 C ATOM 482 CZ TYR A 518 -17.480 -9.587 10.850 1.00 28.19 C ATOM 483 OH TYR A 518 -18.348 -8.596 10.453 1.00 35.46 O ATOM 484 HH TYR A 518 -18.664 -8.785 9.534 1.00 0.00 H ATOM 485 H TYR A 518 -12.932 -14.179 12.910 1.00 0.00 H ATOM 486 N ASN A 519 -12.782 -10.785 13.402 1.00 11.43 N ATOM 487 CA ASN A 519 -12.430 -9.449 13.876 1.00 10.87 C ATOM 488 C ASN A 519 -11.036 -9.055 13.428 1.00 11.17 C ATOM 489 O ASN A 519 -10.818 -7.915 13.000 1.00 11.10 O ATOM 490 CB ASN A 519 -12.541 -9.396 15.386 1.00 11.18 C ATOM 491 CG ASN A 519 -13.975 -9.404 15.855 1.00 15.28 C ATOM 492 OD1 ASN A 519 -14.842 -8.836 15.205 1.00 18.26 O ATOM 493 ND2 ASN A 519 -14.226 -10.045 16.989 1.00 24.79 N ATOM 494 HD22 ASN A 519 -13.453 -10.512 17.504 1.00 0.00 H ATOM 495 HD21 ASN A 519 -15.196 -10.080 17.363 1.00 0.00 H ATOM 496 H ASN A 519 -12.923 -11.556 14.086 1.00 0.00 H ATOM 497 N LEU A 520 -10.088 -9.988 13.488 1.00 10.87 N ATOM 498 CA LEU A 520 -8.722 -9.694 13.055 1.00 9.45 C ATOM 499 C LEU A 520 -8.660 -9.406 11.561 1.00 11.18 C ATOM 500 O LEU A 520 -7.960 -8.484 11.132 1.00 10.49 O ATOM 501 CB LEU A 520 -7.812 -10.856 13.440 1.00 10.56 C ATOM 502 CG LEU A 520 -6.341 -10.694 13.079 1.00 11.75 C ATOM 503 CD1 LEU A 520 -5.759 -9.443 13.735 1.00 11.80 C ATOM 504 CD2 LEU A 520 -5.569 -11.961 13.474 1.00 12.56 C ATOM 505 H LEU A 520 -10.321 -10.936 13.847 1.00 0.00 H ATOM 506 N ARG A 521 -9.375 -10.193 10.750 1.00 8.45 N ATOM 507 CA ARG A 521 -9.421 -9.958 9.312 1.00 9.02 C ATOM 508 C ARG A 521 -9.973 -8.575 8.989 1.00 9.85 C ATOM 509 O ARG A 521 -9.384 -7.829 8.194 1.00 10.54 O ATOM 510 CB ARG A 521 -10.270 -11.043 8.649 1.00 8.85 C ATOM 511 CG ARG A 521 -10.460 -10.868 7.158 1.00 9.29 C ATOM 512 CD ARG A 521 -11.131 -12.084 6.588 1.00 10.06 C ATOM 513 NE ARG A 521 -11.537 -11.912 5.198 1.00 10.92 N ATOM 514 CZ ARG A 521 -12.678 -11.368 4.806 1.00 11.63 C ATOM 515 NH1 ARG A 521 -13.540 -10.886 5.688 1.00 12.58 N ATOM 516 NH2 ARG A 521 -12.952 -11.260 3.506 1.00 14.41 N ATOM 517 HE ARG A 521 -10.882 -12.241 4.460 1.00 0.00 H ATOM 518 HH12 ARG A 521 -14.433 -10.461 5.364 1.00 0.00 H ATOM 519 HH11 ARG A 521 -13.324 -10.932 6.704 1.00 0.00 H ATOM 520 HH22 ARG A 521 -13.848 -10.833 3.197 1.00 0.00 H ATOM 521 HH21 ARG A 521 -12.269 -11.603 2.800 1.00 0.00 H ATOM 522 H ARG A 521 -9.909 -10.989 11.153 1.00 0.00 H ATOM 523 N ARG A 522 -11.121 -8.222 9.571 1.00 9.29 N ATOM 524 CA ARG A 522 -11.711 -6.909 9.308 1.00 9.45 C ATOM 525 C ARG A 522 -10.784 -5.790 9.765 1.00 14.74 C ATOM 526 O ARG A 522 -10.641 -4.772 9.077 1.00 15.01 O ATOM 527 CB ARG A 522 -13.075 -6.806 10.003 1.00 11.68 C ATOM 528 CG ARG A 522 -14.243 -7.349 9.240 1.00 29.39 C ATOM 529 CD ARG A 522 -15.564 -6.934 9.935 1.00 24.73 C ATOM 530 NE ARG A 522 -16.037 -5.580 9.617 1.00 20.50 N ATOM 531 CZ ARG A 522 -17.196 -5.081 10.052 1.00 18.91 C ATOM 532 NH1 ARG A 522 -17.976 -5.809 10.836 1.00 20.25 N ATOM 533 NH2 ARG A 522 -17.602 -3.863 9.713 1.00 26.67 N ATOM 534 HE ARG A 522 -15.436 -4.977 9.020 1.00 0.00 H ATOM 535 HH12 ARG A 522 -18.879 -5.421 11.176 1.00 0.00 H ATOM 536 HH11 ARG A 522 -17.685 -6.769 11.112 1.00 0.00 H ATOM 537 HH22 ARG A 522 -18.510 -3.500 10.067 1.00 0.00 H ATOM 538 HH21 ARG A 522 -17.012 -3.272 9.093 1.00 0.00 H ATOM 539 H ARG A 522 -11.599 -8.884 10.215 1.00 0.00 H ATOM 540 N GLY A 523 -10.132 -5.961 10.915 1.00 10.87 N ATOM 541 CA GLY A 523 -9.244 -4.924 11.405 1.00 9.67 C ATOM 542 C GLY A 523 -7.968 -4.782 10.592 1.00 12.32 C ATOM 543 O GLY A 523 -7.452 -3.672 10.432 1.00 12.93 O ATOM 544 H GLY A 523 -10.260 -6.837 11.460 1.00 0.00 H ATOM 545 N THR A 524 -7.432 -5.894 10.083 1.00 12.82 N ATOM 546 CA THR A 524 -6.254 -5.841 9.214 1.00 9.17 C ATOM 547 C THR A 524 -6.552 -5.045 7.952 1.00 11.85 C ATOM 548 O THR A 524 -5.774 -4.175 7.540 1.00 11.32 O ATOM 549 CB THR A 524 -5.815 -7.270 8.883 1.00 9.76 C ATOM 550 OG1 THR A 524 -5.439 -7.925 10.106 1.00 11.70 O ATOM 551 CG2 THR A 524 -4.625 -7.265 7.934 1.00 10.31 C ATOM 552 HG1 THR A 524 -6.214 -7.943 10.721 1.00 0.00 H ATOM 553 H THR A 524 -7.859 -6.815 10.308 1.00 0.00 H ATOM 554 N ALA A 525 -7.707 -5.306 7.342 1.00 11.54 N ATOM 555 CA ALA A 525 -8.107 -4.574 6.149 1.00 10.62 C ATOM 556 C ALA A 525 -8.208 -3.081 6.414 1.00 10.18 C ATOM 557 O ALA A 525 -7.788 -2.264 5.585 1.00 13.96 O ATOM 558 CB ALA A 525 -9.452 -5.109 5.664 1.00 15.02 C ATOM 559 H ALA A 525 -8.333 -6.044 7.724 1.00 0.00 H ATOM 560 N LEU A 526 -8.779 -2.703 7.564 1.00 11.19 N ATOM 561 CA LEU A 526 -8.956 -1.292 7.891 1.00 12.73 C ATOM 562 C LEU A 526 -7.617 -0.619 8.122 1.00 13.66 C ATOM 563 O LEU A 526 -7.425 0.549 7.768 1.00 16.83 O ATOM 564 CB LEU A 526 -9.815 -1.154 9.145 1.00 14.76 C ATOM 565 CG LEU A 526 -11.317 -0.915 9.104 1.00 34.77 C ATOM 566 CD1 LEU A 526 -11.798 -0.734 10.552 1.00 38.85 C ATOM 567 CD2 LEU A 526 -11.641 0.302 8.277 1.00 32.42 C ATOM 568 H LEU A 526 -9.102 -3.428 8.236 1.00 0.00 H ATOM 569 N ALA A 527 -6.676 -1.344 8.710 1.00 11.78 N ATOM 570 CA ALA A 527 -5.396 -0.739 9.026 1.00 15.56 C ATOM 571 C ALA A 527 -4.457 -0.652 7.838 1.00 11.43 C ATOM 572 O ALA A 527 -3.588 0.224 7.835 1.00 15.64 O ATOM 573 CB ALA A 527 -4.710 -1.519 10.141 1.00 13.20 C ATOM 574 H ALA A 527 -6.854 -2.342 8.944 1.00 0.00 H ATOM 575 N ILE A 528 -4.572 -1.553 6.860 1.00 10.66 N ATOM 576 CA ILE A 528 -3.537 -1.701 5.838 1.00 10.20 C ATOM 577 C ILE A 528 -4.130 -1.706 4.431 1.00 12.38 C ATOM 578 O ILE A 528 -4.481 -2.770 3.894 1.00 12.68 O ATOM 579 CB ILE A 528 -2.742 -2.993 6.052 1.00 12.66 C ATOM 580 CG1 ILE A 528 -2.184 -3.072 7.474 1.00 16.80 C ATOM 581 CG2 ILE A 528 -1.597 -3.083 5.051 1.00 13.22 C ATOM 582 CD1 ILE A 528 -1.732 -4.486 7.808 1.00 15.37 C ATOM 583 H ILE A 528 -5.414 -2.162 6.824 1.00 0.00 H ATOM 584 N PRO A 529 -4.205 -0.563 3.769 1.00 11.58 N ATOM 585 CA PRO A 529 -4.739 -0.567 2.396 1.00 10.98 C ATOM 586 C PRO A 529 -3.869 -1.306 1.400 1.00 11.67 C ATOM 587 O PRO A 529 -4.379 -1.704 0.342 1.00 13.07 O ATOM 588 CB PRO A 529 -4.835 0.919 2.038 1.00 16.54 C ATOM 589 CG PRO A 529 -4.524 1.689 3.272 1.00 26.56 C ATOM 590 CD PRO A 529 -3.950 0.787 4.292 1.00 12.93 C ATOM 591 N GLN A 530 -2.585 -1.500 1.688 1.00 13.01 N ATOM 592 CA GLN A 530 -1.642 -2.057 0.732 1.00 12.23 C ATOM 593 C GLN A 530 -1.694 -3.577 0.656 1.00 13.25 C ATOM 594 O GLN A 530 -0.936 -4.164 -0.119 1.00 20.67 O ATOM 595 CB GLN A 530 -0.213 -1.622 1.082 1.00 12.86 C ATOM 596 CG GLN A 530 -0.015 -0.113 1.092 1.00 13.64 C ATOM 597 CD GLN A 530 -0.294 0.550 2.444 1.00 15.79 C ATOM 598 OE1 GLN A 530 -0.747 -0.086 3.372 1.00 15.79 O ATOM 599 NE2 GLN A 530 -0.073 1.860 2.516 1.00 31.45 N ATOM 600 HE22 GLN A 530 0.317 2.367 1.696 1.00 0.00 H ATOM 601 HE21 GLN A 530 -0.290 2.377 3.392 1.00 0.00 H ATOM 602 H GLN A 530 -2.242 -1.243 2.635 1.00 0.00 H ATOM 603 N CYS A 531 -2.562 -4.220 1.414 1.00 11.24 N ATOM 604 CA CYS A 531 -2.666 -5.670 1.428 1.00 9.09 C ATOM 605 C CYS A 531 -3.974 -6.105 0.768 1.00 10.26 C ATOM 606 O CYS A 531 -4.831 -5.283 0.412 1.00 9.87 O ATOM 607 CB CYS A 531 -2.584 -6.210 2.865 1.00 10.58 C ATOM 608 SG CYS A 531 -4.128 -6.112 3.834 1.00 13.30 S ATOM 609 H CYS A 531 -3.197 -3.668 2.025 1.00 0.00 H ATOM 610 N ARG A 532 -4.082 -7.416 0.568 1.00 8.64 N ATOM 611 CA ARG A 532 -5.290 -8.046 0.048 1.00 8.15 C ATOM 612 C ARG A 532 -5.552 -9.321 0.831 1.00 9.64 C ATOM 613 O ARG A 532 -4.613 -10.032 1.203 1.00 10.31 O ATOM 614 CB ARG A 532 -5.129 -8.348 -1.421 1.00 8.92 C ATOM 615 CG ARG A 532 -4.812 -7.151 -2.266 1.00 10.50 C ATOM 616 CD ARG A 532 -5.974 -6.188 -2.424 1.00 9.29 C ATOM 617 NE ARG A 532 -5.687 -5.214 -3.465 1.00 9.36 N ATOM 618 CZ ARG A 532 -5.115 -4.038 -3.253 1.00 11.84 C ATOM 619 NH1 ARG A 532 -4.758 -3.685 -2.032 1.00 10.60 N ATOM 620 NH2 ARG A 532 -4.923 -3.207 -4.271 1.00 12.61 N ATOM 621 HE ARG A 532 -5.948 -5.457 -4.442 1.00 0.00 H ATOM 622 HH12 ARG A 532 -4.309 -2.761 -1.868 1.00 0.00 H ATOM 623 HH11 ARG A 532 -4.926 -4.331 -1.234 1.00 0.00 H ATOM 624 HH22 ARG A 532 -4.474 -2.283 -4.110 1.00 0.00 H ATOM 625 HH21 ARG A 532 -5.221 -3.481 -5.229 1.00 0.00 H ATOM 626 H ARG A 532 -3.266 -8.020 0.793 1.00 0.00 H ATOM 627 N LEU A 533 -6.819 -9.597 1.119 1.00 8.24 N ATOM 628 CA LEU A 533 -7.151 -10.679 2.027 1.00 7.61 C ATOM 629 C LEU A 533 -8.100 -11.689 1.397 1.00 8.17 C ATOM 630 O LEU A 533 -9.004 -11.325 0.627 1.00 10.73 O ATOM 631 CB LEU A 533 -7.804 -10.118 3.291 1.00 10.09 C ATOM 632 CG LEU A 533 -6.931 -9.176 4.123 1.00 13.81 C ATOM 633 CD1 LEU A 533 -7.523 -7.798 4.278 1.00 38.88 C ATOM 634 CD2 LEU A 533 -6.762 -9.827 5.477 1.00 29.34 C ATOM 635 H LEU A 533 -7.580 -9.033 0.690 1.00 0.00 H ATOM 636 N THR A 534 -7.906 -12.954 1.731 1.00 8.63 N ATOM 637 CA THR A 534 -8.901 -13.954 1.376 1.00 7.59 C ATOM 638 C THR A 534 -10.056 -13.890 2.359 1.00 8.35 C ATOM 639 O THR A 534 -9.929 -13.352 3.457 1.00 9.82 O ATOM 640 CB THR A 534 -8.326 -15.368 1.417 1.00 8.28 C ATOM 641 OG1 THR A 534 -8.034 -15.738 2.775 1.00 9.90 O ATOM 642 CG2 THR A 534 -7.071 -15.502 0.542 1.00 11.28 C ATOM 643 HG1 THR A 534 -8.866 -15.708 3.310 1.00 0.00 H ATOM 644 H THR A 534 -7.046 -13.232 2.245 1.00 0.00 H ATOM 645 N PRO A 535 -11.174 -14.495 2.013 1.00 8.70 N ATOM 646 CA PRO A 535 -12.198 -14.774 3.015 1.00 8.14 C ATOM 647 C PRO A 535 -11.688 -15.710 4.090 1.00 9.46 C ATOM 648 O PRO A 535 -10.627 -16.340 3.977 1.00 11.80 O ATOM 649 CB PRO A 535 -13.308 -15.454 2.209 1.00 13.67 C ATOM 650 CG PRO A 535 -13.064 -15.050 0.795 1.00 10.48 C ATOM 651 CD PRO A 535 -11.588 -14.857 0.652 1.00 9.91 C ATOM 652 N LEU A 536 -12.496 -15.818 5.139 1.00 9.08 N ATOM 653 CA LEU A 536 -12.322 -16.909 6.075 1.00 8.42 C ATOM 654 C LEU A 536 -12.623 -18.240 5.399 1.00 8.64 C ATOM 655 O LEU A 536 -13.578 -18.376 4.624 1.00 11.81 O ATOM 656 CB LEU A 536 -13.221 -16.752 7.298 1.00 10.19 C ATOM 657 CG LEU A 536 -13.046 -15.464 8.115 1.00 11.47 C ATOM 658 CD1 LEU A 536 -14.094 -15.334 9.238 1.00 14.66 C ATOM 659 CD2 LEU A 536 -11.699 -15.288 8.699 1.00 12.56 C ATOM 660 H LEU A 536 -13.252 -15.120 5.288 1.00 0.00 H ATOM 661 N SER A 537 -11.813 -19.239 5.724 1.00 8.76 N ATOM 662 CA SER A 537 -12.076 -20.588 5.287 1.00 9.95 C ATOM 663 C SER A 537 -11.645 -21.547 6.390 1.00 11.69 C ATOM 664 O SER A 537 -11.394 -21.144 7.532 1.00 13.66 O ATOM 665 CB SER A 537 -11.395 -20.863 3.943 1.00 11.57 C ATOM 666 OG SER A 537 -11.842 -22.111 3.436 1.00 13.25 O ATOM 667 HG SER A 537 -12.824 -22.082 3.311 1.00 0.00 H ATOM 668 H SER A 537 -10.972 -19.046 6.305 1.00 0.00 H ATOM 669 N ARG A 538 -11.604 -22.836 6.065 1.00 12.76 N ATOM 670 CA ARG A 538 -11.287 -23.867 7.044 1.00 12.37 C ATOM 671 C ARG A 538 -10.038 -24.647 6.650 1.00 10.41 C ATOM 672 O ARG A 538 -9.715 -24.803 5.472 1.00 11.16 O ATOM 673 CB ARG A 538 -12.476 -24.826 7.234 1.00 15.47 C ATOM 674 CG ARG A 538 -13.704 -24.152 7.824 1.00 17.39 C ATOM 675 CD ARG A 538 -14.981 -24.916 7.517 1.00 34.21 C ATOM 676 NE ARG A 538 -15.025 -26.144 8.282 1.00 42.01 N ATOM 677 CZ ARG A 538 -16.133 -26.695 8.757 1.00 45.76 C ATOM 678 NH1 ARG A 538 -17.321 -26.122 8.549 1.00 45.78 N ATOM 679 NH2 ARG A 538 -16.035 -27.814 9.463 1.00 37.65 N ATOM 680 HE ARG A 538 -14.124 -26.628 8.472 1.00 0.00 H ATOM 681 HH12 ARG A 538 -18.184 -26.563 8.926 1.00 0.00 H ATOM 682 HH11 ARG A 538 -17.383 -25.235 8.010 1.00 0.00 H ATOM 683 HH22 ARG A 538 -16.891 -28.264 9.846 1.00 0.00 H ATOM 684 HH21 ARG A 538 -15.102 -28.241 9.634 1.00 0.00 H ATOM 685 H ARG A 538 -11.804 -23.116 5.084 1.00 0.00 H ATOM 686 N LEU A 539 -9.327 -25.108 7.664 1.00 10.21 N ATOM 687 CA LEU A 539 -8.149 -25.939 7.510 1.00 9.60 C ATOM 688 C LEU A 539 -8.505 -27.420 7.472 1.00 9.90 C ATOM 689 O LEU A 539 -9.419 -27.865 8.172 1.00 10.85 O ATOM 690 CB LEU A 539 -7.167 -25.702 8.652 1.00 10.90 C ATOM 691 CG LEU A 539 -6.441 -24.354 8.716 1.00 11.39 C ATOM 692 CD1 LEU A 539 -5.571 -24.352 9.984 1.00 14.84 C ATOM 693 CD2 LEU A 539 -5.632 -24.097 7.462 1.00 13.85 C ATOM 694 H LEU A 539 -9.630 -24.861 8.628 1.00 0.00 H ATOM 695 N PRO A 540 -7.757 -28.193 6.677 1.00 9.63 N ATOM 696 CA PRO A 540 -7.802 -29.651 6.807 1.00 9.81 C ATOM 697 C PRO A 540 -7.078 -30.077 8.076 1.00 9.86 C ATOM 698 O PRO A 540 -6.423 -29.289 8.745 1.00 10.79 O ATOM 699 CB PRO A 540 -7.081 -30.145 5.551 1.00 9.98 C ATOM 700 CG PRO A 540 -6.041 -29.100 5.332 1.00 9.15 C ATOM 701 CD PRO A 540 -6.714 -27.775 5.715 1.00 10.71 C ATOM 702 N PHE A 541 -7.203 -31.359 8.404 1.00 12.31 N ATOM 703 CA PHE A 541 -6.469 -31.918 9.524 1.00 10.66 C ATOM 704 C PHE A 541 -5.008 -32.176 9.159 1.00 12.71 C ATOM 705 O PHE A 541 -4.643 -32.265 7.979 1.00 13.60 O ATOM 706 CB PHE A 541 -7.085 -33.249 9.956 1.00 12.53 C ATOM 707 CG PHE A 541 -8.479 -33.131 10.479 1.00 13.07 C ATOM 708 CD1 PHE A 541 -8.718 -32.866 11.815 1.00 16.19 C ATOM 709 CD2 PHE A 541 -9.553 -33.298 9.622 1.00 15.34 C ATOM 710 CE1 PHE A 541 -10.018 -32.776 12.296 1.00 16.86 C ATOM 711 CE2 PHE A 541 -10.846 -33.208 10.094 1.00 18.06 C ATOM 712 CZ PHE A 541 -11.078 -32.932 11.427 1.00 16.36 C ATOM 713 H PHE A 541 -7.836 -31.970 7.850 1.00 0.00 H ATOM 714 N GLY A 542 -4.173 -32.322 10.190 1.00 12.84 N ATOM 715 CA GLY A 542 -2.827 -32.818 10.004 1.00 12.67 C ATOM 716 C GLY A 542 -2.770 -34.329 10.022 1.00 14.06 C ATOM 717 O GLY A 542 -3.466 -34.998 9.261 1.00 16.08 O ATOM 718 H GLY A 542 -4.497 -32.074 11.147 1.00 0.00 H ATOM 719 N MET A 543 -1.939 -34.863 10.904 1.00 15.64 N ATOM 720 CA MET A 543 -1.901 -36.298 11.150 1.00 12.94 C ATOM 721 C MET A 543 -3.271 -36.804 11.586 1.00 16.28 C ATOM 722 O MET A 543 -3.986 -36.148 12.353 1.00 18.36 O ATOM 723 CB MET A 543 -0.843 -36.587 12.216 1.00 16.21 C ATOM 724 CG MET A 543 -0.616 -38.039 12.530 1.00 19.45 C ATOM 725 SD MET A 543 0.845 -38.253 13.572 1.00 20.17 S ATOM 726 CE MET A 543 0.845 -36.756 14.569 1.00 32.22 C ATOM 727 H MET A 543 -1.296 -34.241 11.435 1.00 0.00 H ATOM 728 N ALA A 544 -3.635 -37.975 11.072 1.00 15.64 N ATOM 729 CA ALA A 544 -4.805 -38.747 11.478 1.00 17.61 C ATOM 730 C ALA A 544 -6.080 -37.928 11.344 1.00 21.02 C ATOM 731 O ALA A 544 -6.715 -37.581 12.349 1.00 19.23 O ATOM 732 CB ALA A 544 -4.636 -39.241 12.921 1.00 19.17 C ATOM 733 H ALA A 544 -3.037 -38.373 10.320 1.00 0.00 H ATOM 734 N PRO A 545 -6.507 -37.629 10.125 1.00 16.57 N ATOM 735 CA PRO A 545 -7.737 -36.842 9.953 1.00 16.18 C ATOM 736 C PRO A 545 -8.951 -37.485 10.608 1.00 21.27 C ATOM 737 O PRO A 545 -9.013 -38.700 10.810 1.00 19.70 O ATOM 738 CB PRO A 545 -7.906 -36.771 8.431 1.00 16.66 C ATOM 739 CG PRO A 545 -6.528 -36.983 7.863 1.00 17.52 C ATOM 740 CD PRO A 545 -5.820 -37.904 8.850 1.00 17.10 C ATOM 741 N GLY A 546 -9.920 -36.636 10.948 1.00 20.59 N ATOM 742 CA GLY A 546 -11.183 -37.092 11.485 1.00 20.02 C ATOM 743 C GLY A 546 -11.962 -37.873 10.450 1.00 28.27 C ATOM 744 O GLY A 546 -11.589 -37.934 9.276 1.00 23.32 O ATOM 745 H GLY A 546 -9.763 -35.615 10.824 1.00 0.00 H ATOM 746 N PRO A 547 -13.071 -38.479 10.865 1.00 27.24 N ATOM 747 CA PRO A 547 -13.829 -39.349 9.952 1.00 27.37 C ATOM 748 C PRO A 547 -14.586 -38.565 8.886 1.00 26.28 C ATOM 749 O PRO A 547 -14.925 -37.393 9.050 1.00 27.24 O ATOM 750 CB PRO A 547 -14.802 -40.081 10.888 1.00 27.55 C ATOM 751 CG PRO A 547 -14.985 -39.116 12.069 1.00 32.91 C ATOM 752 CD PRO A 547 -13.646 -38.440 12.228 1.00 30.21 C ATOM 753 N GLY A 548 -14.859 -39.241 7.774 1.00 27.33 N ATOM 754 CA GLY A 548 -15.645 -38.656 6.716 1.00 35.73 C ATOM 755 C GLY A 548 -15.715 -39.572 5.514 1.00 31.00 C ATOM 756 O GLY A 548 -14.876 -40.461 5.339 1.00 30.05 O ATOM 757 H GLY A 548 -14.499 -40.210 7.665 1.00 0.00 H ATOM 758 N PRO A 549 -16.730 -39.380 4.664 1.00 42.78 N ATOM 759 CA PRO A 549 -16.840 -40.198 3.448 1.00 33.07 C ATOM 760 C PRO A 549 -15.826 -39.839 2.373 1.00 40.13 C ATOM 761 O PRO A 549 -15.655 -40.621 1.428 1.00 39.28 O ATOM 762 CB PRO A 549 -18.265 -39.904 2.959 1.00 33.28 C ATOM 763 CG PRO A 549 -18.540 -38.526 3.438 1.00 29.76 C ATOM 764 CD PRO A 549 -17.772 -38.337 4.727 1.00 39.90 C ATOM 765 N GLN A 550 -15.160 -38.682 2.474 1.00 33.15 N ATOM 766 CA GLN A 550 -14.234 -38.236 1.445 1.00 33.84 C ATOM 767 C GLN A 550 -12.817 -38.697 1.770 1.00 22.32 C ATOM 768 O GLN A 550 -12.507 -39.038 2.914 1.00 22.16 O ATOM 769 CB GLN A 550 -14.275 -36.711 1.329 1.00 36.76 C ATOM 770 CG GLN A 550 -15.623 -36.111 0.939 1.00 52.68 C ATOM 771 CD GLN A 550 -15.816 -34.721 1.542 1.00 61.64 C ATOM 772 OE1 GLN A 550 -15.887 -33.719 0.822 1.00 66.50 O ATOM 773 NE2 GLN A 550 -15.913 -34.658 2.874 1.00 57.54 N ATOM 774 HE22 GLN A 550 -15.848 -35.527 3.442 1.00 0.00 H ATOM 775 HE21 GLN A 550 -16.054 -33.740 3.342 1.00 0.00 H ATOM 776 H GLN A 550 -15.309 -38.085 3.312 1.00 0.00 H ATOM 777 N PRO A 551 -11.922 -38.712 0.784 1.00 19.04 N ATOM 778 CA PRO A 551 -10.511 -38.995 1.088 1.00 17.52 C ATOM 779 C PRO A 551 -9.967 -38.062 2.162 1.00 16.25 C ATOM 780 O PRO A 551 -10.321 -36.884 2.226 1.00 14.01 O ATOM 781 CB PRO A 551 -9.811 -38.785 -0.255 1.00 21.05 C ATOM 782 CG PRO A 551 -10.916 -39.096 -1.291 1.00 20.02 C ATOM 783 CD PRO A 551 -12.196 -38.670 -0.667 1.00 21.28 C ATOM 784 N GLY A 552 -9.082 -38.604 2.994 1.00 14.50 N ATOM 785 CA GLY A 552 -8.524 -37.896 4.122 1.00 14.91 C ATOM 786 C GLY A 552 -8.007 -36.503 3.818 1.00 14.02 C ATOM 787 O GLY A 552 -8.245 -35.569 4.594 1.00 13.34 O ATOM 788 H GLY A 552 -8.778 -39.584 2.824 1.00 0.00 H ATOM 789 N PRO A 553 -7.281 -36.320 2.706 1.00 13.76 N ATOM 790 CA PRO A 553 -6.727 -34.978 2.419 1.00 12.38 C ATOM 791 C PRO A 553 -7.766 -33.884 2.339 1.00 14.17 C ATOM 792 O PRO A 553 -7.443 -32.710 2.552 1.00 13.61 O ATOM 793 CB PRO A 553 -6.013 -35.175 1.069 1.00 11.61 C ATOM 794 CG PRO A 553 -5.557 -36.601 1.111 1.00 12.82 C ATOM 795 CD PRO A 553 -6.747 -37.325 1.750 1.00 15.34 C ATOM 796 N LEU A 554 -9.019 -34.232 2.058 1.00 10.22 N ATOM 797 CA LEU A 554 -10.079 -33.250 1.861 1.00 11.77 C ATOM 798 C LEU A 554 -10.848 -32.914 3.126 1.00 11.72 C ATOM 799 O LEU A 554 -11.616 -31.943 3.128 1.00 13.84 O ATOM 800 CB LEU A 554 -11.104 -33.763 0.848 1.00 16.02 C ATOM 801 CG LEU A 554 -10.634 -34.033 -0.579 1.00 18.26 C ATOM 802 CD1 LEU A 554 -11.534 -35.046 -1.264 1.00 18.96 C ATOM 803 CD2 LEU A 554 -10.612 -32.739 -1.385 1.00 17.41 C ATOM 804 H LEU A 554 -9.251 -35.242 1.976 1.00 0.00 H ATOM 805 N ARG A 555 -10.717 -33.717 4.172 1.00 12.06 N ATOM 806 CA ARG A 555 -11.608 -33.560 5.313 1.00 14.23 C ATOM 807 C ARG A 555 -11.305 -32.259 6.037 1.00 11.68 C ATOM 808 O ARG A 555 -10.148 -31.899 6.240 1.00 13.67 O ATOM 809 CB ARG A 555 -11.470 -34.752 6.252 1.00 14.16 C ATOM 810 CG ARG A 555 -11.931 -36.043 5.568 1.00 15.38 C ATOM 811 CD ARG A 555 -11.965 -37.257 6.464 1.00 16.67 C ATOM 812 NE ARG A 555 -11.917 -38.455 5.627 1.00 20.10 N ATOM 813 CZ ARG A 555 -11.446 -39.633 6.018 1.00 23.56 C ATOM 814 NH1 ARG A 555 -10.989 -39.791 7.249 1.00 21.78 N ATOM 815 NH2 ARG A 555 -11.419 -40.644 5.164 1.00 25.38 N ATOM 816 HE ARG A 555 -12.278 -38.379 4.655 1.00 0.00 H ATOM 817 HH12 ARG A 555 -10.621 -40.715 7.552 1.00 0.00 H ATOM 818 HH11 ARG A 555 -10.998 -38.991 7.914 1.00 0.00 H ATOM 819 HH22 ARG A 555 -11.051 -41.569 5.465 1.00 0.00 H ATOM 820 HH21 ARG A 555 -11.766 -40.513 4.192 1.00 0.00 H ATOM 821 H ARG A 555 -9.983 -34.454 4.178 1.00 0.00 H ATOM 822 N GLU A 556 -12.371 -31.569 6.448 1.00 13.56 N ATOM 823 CA GLU A 556 -12.265 -30.236 7.026 1.00 11.36 C ATOM 824 C GLU A 556 -12.357 -30.303 8.544 1.00 12.01 C ATOM 825 O GLU A 556 -13.271 -30.931 9.097 1.00 13.12 O ATOM 826 CB GLU A 556 -13.338 -29.292 6.473 1.00 19.08 C ATOM 827 CG GLU A 556 -13.243 -29.101 4.964 1.00 25.11 C ATOM 828 CD GLU A 556 -14.363 -28.252 4.380 1.00 24.62 C ATOM 829 OE1 GLU A 556 -14.871 -27.358 5.078 1.00 24.27 O ATOM 830 OE2 GLU A 556 -14.729 -28.493 3.213 1.00 23.30 O ATOM 831 H GLU A 556 -13.313 -31.999 6.352 1.00 0.00 H ATOM 832 N SER A 557 -11.401 -29.654 9.203 1.00 11.92 N ATOM 833 CA SER A 557 -11.451 -29.385 10.634 1.00 11.66 C ATOM 834 C SER A 557 -12.411 -28.238 10.919 1.00 16.67 C ATOM 835 O SER A 557 -12.989 -27.636 10.012 1.00 15.79 O ATOM 836 CB SER A 557 -10.062 -29.055 11.158 1.00 13.26 C ATOM 837 OG SER A 557 -9.720 -27.709 10.919 1.00 12.99 O ATOM 838 HG SER A 557 -9.736 -27.534 9.945 1.00 0.00 H ATOM 839 H SER A 557 -10.574 -29.321 8.668 1.00 0.00 H ATOM 840 N ILE A 558 -12.574 -27.906 12.205 1.00 16.99 N ATOM 841 CA ILE A 558 -13.353 -26.727 12.565 1.00 15.27 C ATOM 842 C ILE A 558 -12.464 -25.503 12.759 1.00 12.16 C ATOM 843 O ILE A 558 -12.965 -24.432 13.126 1.00 18.22 O ATOM 844 CB ILE A 558 -14.197 -26.965 13.840 1.00 19.63 C ATOM 845 CG1 ILE A 558 -13.291 -27.182 15.057 1.00 20.35 C ATOM 846 CG2 ILE A 558 -15.146 -28.132 13.643 1.00 20.60 C ATOM 847 CD1 ILE A 558 -14.044 -27.228 16.399 1.00 26.03 C ATOM 848 H ILE A 558 -12.144 -28.491 12.950 1.00 0.00 H ATOM 849 N VAL A 559 -11.166 -25.627 12.515 1.00 11.00 N ATOM 850 CA VAL A 559 -10.234 -24.510 12.662 1.00 10.47 C ATOM 851 C VAL A 559 -10.280 -23.688 11.389 1.00 13.01 C ATOM 852 O VAL A 559 -10.255 -24.237 10.284 1.00 13.47 O ATOM 853 CB VAL A 559 -8.808 -25.018 12.935 1.00 12.70 C ATOM 854 CG1 VAL A 559 -7.843 -23.858 13.100 1.00 12.83 C ATOM 855 CG2 VAL A 559 -8.778 -25.916 14.178 1.00 12.73 C ATOM 856 H VAL A 559 -10.799 -26.550 12.209 1.00 0.00 H ATOM 857 N CYS A 560 -10.362 -22.373 11.546 1.00 11.82 N ATOM 858 CA CYS A 560 -10.469 -21.452 10.426 1.00 11.72 C ATOM 859 C CYS A 560 -9.129 -20.775 10.131 1.00 11.16 C ATOM 860 O CYS A 560 -8.188 -20.814 10.924 1.00 10.91 O ATOM 861 CB CYS A 560 -11.547 -20.411 10.735 1.00 10.41 C ATOM 862 SG CYS A 560 -13.186 -21.197 10.906 1.00 18.32 S ATOM 863 H CYS A 560 -10.349 -21.985 12.511 1.00 0.00 H ATOM 864 N TYR A 561 -9.048 -20.161 8.949 1.00 10.35 N ATOM 865 CA TYR A 561 -7.858 -19.422 8.536 1.00 8.78 C ATOM 866 C TYR A 561 -8.252 -18.337 7.559 1.00 7.68 C ATOM 867 O TYR A 561 -9.358 -18.338 7.010 1.00 10.00 O ATOM 868 CB TYR A 561 -6.797 -20.337 7.886 1.00 10.85 C ATOM 869 CG TYR A 561 -7.020 -20.612 6.400 1.00 7.76 C ATOM 870 CD1 TYR A 561 -6.428 -19.826 5.433 1.00 8.98 C ATOM 871 CD2 TYR A 561 -7.859 -21.647 5.980 1.00 10.46 C ATOM 872 CE1 TYR A 561 -6.631 -20.060 4.075 1.00 8.85 C ATOM 873 CE2 TYR A 561 -8.074 -21.884 4.612 1.00 10.52 C ATOM 874 CZ TYR A 561 -7.460 -21.081 3.683 1.00 10.49 C ATOM 875 OH TYR A 561 -7.651 -21.312 2.330 1.00 12.44 O ATOM 876 HH TYR A 561 -8.614 -21.232 2.116 1.00 0.00 H ATOM 877 H TYR A 561 -9.859 -20.210 8.300 1.00 0.00 H ATOM 878 N PHE A 562 -7.346 -17.378 7.372 1.00 7.60 N ATOM 879 CA PHE A 562 -7.372 -16.505 6.205 1.00 8.57 C ATOM 880 C PHE A 562 -5.938 -16.180 5.822 1.00 8.47 C ATOM 881 O PHE A 562 -5.004 -16.402 6.602 1.00 8.94 O ATOM 882 CB PHE A 562 -8.189 -15.221 6.438 1.00 8.79 C ATOM 883 CG PHE A 562 -7.637 -14.280 7.468 1.00 9.20 C ATOM 884 CD1 PHE A 562 -6.814 -13.241 7.097 1.00 10.11 C ATOM 885 CD2 PHE A 562 -7.996 -14.397 8.803 1.00 9.82 C ATOM 886 CE1 PHE A 562 -6.334 -12.336 8.034 1.00 9.19 C ATOM 887 CE2 PHE A 562 -7.510 -13.493 9.746 1.00 9.96 C ATOM 888 CZ PHE A 562 -6.685 -12.467 9.362 1.00 9.65 C ATOM 889 H PHE A 562 -6.596 -17.248 8.081 1.00 0.00 H ATOM 890 N MET A 563 -5.757 -15.677 4.597 1.00 8.47 N ATOM 891 CA MET A 563 -4.435 -15.297 4.116 1.00 8.37 C ATOM 892 C MET A 563 -4.418 -13.825 3.739 1.00 9.76 C ATOM 893 O MET A 563 -5.406 -13.269 3.258 1.00 10.58 O ATOM 894 CB MET A 563 -3.945 -16.143 2.913 1.00 15.17 C ATOM 895 CG MET A 563 -2.358 -16.228 2.728 1.00 40.74 C ATOM 896 SD MET A 563 -1.839 -17.732 1.862 1.00 26.14 S ATOM 897 CE MET A 563 -3.361 -18.668 2.111 1.00 20.53 C ATOM 898 H MET A 563 -6.579 -15.554 3.972 1.00 0.00 H ATOM 899 N VAL A 564 -3.278 -13.194 4.004 1.00 8.57 N ATOM 900 CA VAL A 564 -2.992 -11.827 3.585 1.00 7.53 C ATOM 901 C VAL A 564 -1.935 -11.901 2.496 1.00 9.21 C ATOM 902 O VAL A 564 -0.886 -12.523 2.697 1.00 10.77 O ATOM 903 CB VAL A 564 -2.470 -10.970 4.752 1.00 9.30 C ATOM 904 CG1 VAL A 564 -2.305 -9.527 4.333 1.00 13.72 C ATOM 905 CG2 VAL A 564 -3.396 -11.058 5.965 1.00 12.97 C ATOM 906 H VAL A 564 -2.548 -13.705 4.541 1.00 0.00 H ATOM 907 N PHE A 565 -2.187 -11.264 1.355 1.00 8.28 N ATOM 908 CA PHE A 565 -1.189 -11.156 0.299 1.00 10.36 C ATOM 909 C PHE A 565 -0.493 -9.806 0.390 1.00 8.89 C ATOM 910 O PHE A 565 -1.152 -8.782 0.610 1.00 9.20 O ATOM 911 CB PHE A 565 -1.808 -11.289 -1.100 1.00 8.00 C ATOM 912 CG PHE A 565 -2.538 -12.577 -1.319 1.00 9.52 C ATOM 913 CD1 PHE A 565 -1.873 -13.691 -1.754 1.00 12.94 C ATOM 914 CD2 PHE A 565 -3.902 -12.664 -1.095 1.00 10.21 C ATOM 915 CE1 PHE A 565 -2.542 -14.881 -1.961 1.00 12.55 C ATOM 916 CE2 PHE A 565 -4.589 -13.870 -1.295 1.00 12.11 C ATOM 917 CZ PHE A 565 -3.911 -14.967 -1.736 1.00 12.62 C ATOM 918 H PHE A 565 -3.122 -10.831 1.213 1.00 0.00 H ATOM 919 N LEU A 566 0.826 -9.827 0.215 1.00 9.33 N ATOM 920 CA LEU A 566 1.678 -8.650 0.315 1.00 7.91 C ATOM 921 C LEU A 566 2.647 -8.585 -0.861 1.00 9.34 C ATOM 922 O LEU A 566 2.969 -9.594 -1.498 1.00 8.05 O ATOM 923 CB LEU A 566 2.493 -8.644 1.612 1.00 9.21 C ATOM 924 CG LEU A 566 1.883 -8.445 3.007 1.00 14.77 C ATOM 925 CD1 LEU A 566 0.808 -7.394 3.090 1.00 7.94 C ATOM 926 CD2 LEU A 566 1.416 -9.781 3.576 1.00 21.62 C ATOM 927 H LEU A 566 1.275 -10.738 -0.006 1.00 0.00 H ATOM 928 N GLN A 567 3.127 -7.365 -1.130 1.00 9.82 N ATOM 929 CA GLN A 567 4.103 -7.141 -2.183 1.00 8.86 C ATOM 930 C GLN A 567 5.542 -7.238 -1.722 1.00 10.03 C ATOM 931 O GLN A 567 6.437 -7.301 -2.576 1.00 12.43 O ATOM 932 CB GLN A 567 3.898 -5.768 -2.833 1.00 8.69 C ATOM 933 CG GLN A 567 2.624 -5.757 -3.660 1.00 10.65 C ATOM 934 CD GLN A 567 2.439 -4.487 -4.430 1.00 14.66 C ATOM 935 OE1 GLN A 567 3.377 -3.716 -4.619 1.00 13.47 O ATOM 936 NE2 GLN A 567 1.207 -4.239 -4.843 1.00 15.11 N ATOM 937 HE22 GLN A 567 0.448 -4.925 -4.657 1.00 0.00 H ATOM 938 HE21 GLN A 567 0.997 -3.358 -5.354 1.00 0.00 H ATOM 939 H GLN A 567 2.792 -6.555 -0.570 1.00 0.00 H ATOM 940 N THR A 568 5.809 -7.214 -0.417 1.00 9.02 N ATOM 941 CA THR A 568 7.189 -7.330 0.029 1.00 8.50 C ATOM 942 C THR A 568 7.332 -8.344 1.155 1.00 9.80 C ATOM 943 O THR A 568 6.484 -8.464 2.036 1.00 9.69 O ATOM 944 CB THR A 568 7.800 -5.995 0.519 1.00 10.00 C ATOM 945 OG1 THR A 568 7.228 -5.622 1.783 1.00 11.44 O ATOM 946 CG2 THR A 568 7.556 -4.876 -0.498 1.00 11.47 C ATOM 947 HG1 THR A 568 7.627 -4.768 2.085 1.00 0.00 H ATOM 948 H THR A 568 5.039 -7.113 0.275 1.00 0.00 H ATOM 949 N HIS A 569 8.472 -9.021 1.140 1.00 9.82 N ATOM 950 CA HIS A 569 8.774 -9.977 2.197 1.00 8.65 C ATOM 951 C HIS A 569 8.973 -9.295 3.543 1.00 9.08 C ATOM 952 O HIS A 569 8.579 -9.839 4.584 1.00 9.89 O ATOM 953 CB HIS A 569 10.007 -10.769 1.791 1.00 10.82 C ATOM 954 CG HIS A 569 9.797 -11.579 0.559 1.00 13.60 C ATOM 955 ND1 HIS A 569 8.917 -12.641 0.509 1.00 13.97 N ATOM 956 CD2 HIS A 569 10.295 -11.444 -0.689 1.00 13.85 C ATOM 957 CE1 HIS A 569 8.931 -13.162 -0.703 1.00 13.86 C ATOM 958 NE2 HIS A 569 9.747 -12.447 -1.454 1.00 16.17 N ATOM 959 H HIS A 569 9.154 -8.869 0.370 1.00 0.00 H ATOM 960 N ILE A 570 9.590 -8.113 3.577 1.00 9.50 N ATOM 961 CA ILE A 570 9.830 -7.504 4.884 1.00 9.71 C ATOM 962 C ILE A 570 8.510 -7.075 5.519 1.00 9.75 C ATOM 963 O ILE A 570 8.326 -7.197 6.734 1.00 9.47 O ATOM 964 CB ILE A 570 10.825 -6.330 4.788 1.00 10.79 C ATOM 965 CG1 ILE A 570 11.158 -5.811 6.191 1.00 11.89 C ATOM 966 CG2 ILE A 570 10.258 -5.172 3.958 1.00 11.64 C ATOM 967 CD1 ILE A 570 11.864 -6.821 7.093 1.00 11.69 C ATOM 968 H ILE A 570 9.891 -7.640 2.701 1.00 0.00 H ATOM 969 N PHE A 571 7.569 -6.563 4.721 1.00 10.44 N ATOM 970 CA PHE A 571 6.308 -6.126 5.306 1.00 9.25 C ATOM 971 C PHE A 571 5.520 -7.330 5.827 1.00 8.36 C ATOM 972 O PHE A 571 4.840 -7.231 6.854 1.00 9.74 O ATOM 973 CB PHE A 571 5.475 -5.314 4.316 1.00 10.15 C ATOM 974 CG PHE A 571 4.252 -4.657 4.947 1.00 11.81 C ATOM 975 CD1 PHE A 571 4.357 -3.962 6.139 1.00 10.50 C ATOM 976 CD2 PHE A 571 3.021 -4.758 4.351 1.00 17.11 C ATOM 977 CE1 PHE A 571 3.256 -3.359 6.723 1.00 15.77 C ATOM 978 CE2 PHE A 571 1.911 -4.161 4.930 1.00 16.93 C ATOM 979 CZ PHE A 571 2.030 -3.476 6.128 1.00 14.86 C ATOM 980 H PHE A 571 7.734 -6.478 3.698 1.00 0.00 H ATOM 981 N ALA A 572 5.620 -8.484 5.156 1.00 9.63 N ATOM 982 CA ALA A 572 5.022 -9.697 5.708 1.00 9.52 C ATOM 983 C ALA A 572 5.617 -10.037 7.068 1.00 9.24 C ATOM 984 O ALA A 572 4.895 -10.419 7.989 1.00 10.38 O ATOM 985 CB ALA A 572 5.205 -10.873 4.740 1.00 9.12 C ATOM 986 H ALA A 572 6.121 -8.517 4.245 1.00 0.00 H ATOM 987 N GLU A 573 6.938 -9.929 7.219 1.00 8.73 N ATOM 988 CA GLU A 573 7.541 -10.197 8.519 1.00 9.80 C ATOM 989 C GLU A 573 7.050 -9.221 9.591 1.00 10.27 C ATOM 990 O GLU A 573 6.701 -9.628 10.708 1.00 10.97 O ATOM 991 CB GLU A 573 9.058 -10.150 8.375 1.00 11.17 C ATOM 992 CG GLU A 573 9.796 -10.518 9.636 1.00 11.67 C ATOM 993 CD GLU A 573 9.847 -12.008 9.906 1.00 19.25 C ATOM 994 OE1 GLU A 573 9.427 -12.794 9.037 1.00 16.84 O ATOM 995 OE2 GLU A 573 10.350 -12.394 10.998 1.00 16.38 O ATOM 996 H GLU A 573 7.535 -9.655 6.413 1.00 0.00 H ATOM 997 N VAL A 574 7.002 -7.928 9.266 1.00 11.30 N ATOM 998 CA VAL A 574 6.545 -6.913 10.213 1.00 10.80 C ATOM 999 C VAL A 574 5.088 -7.144 10.585 1.00 11.56 C ATOM 1000 O VAL A 574 4.698 -7.000 11.752 1.00 11.90 O ATOM 1001 CB VAL A 574 6.770 -5.509 9.622 1.00 13.14 C ATOM 1002 CG1 VAL A 574 6.066 -4.446 10.446 1.00 19.82 C ATOM 1003 CG2 VAL A 574 8.272 -5.230 9.557 1.00 14.16 C ATOM 1004 H VAL A 574 7.298 -7.634 8.313 1.00 0.00 H ATOM 1005 N LEU A 575 4.258 -7.523 9.614 1.00 10.74 N ATOM 1006 CA LEU A 575 2.844 -7.759 9.915 1.00 9.37 C ATOM 1007 C LEU A 575 2.675 -9.012 10.779 1.00 9.93 C ATOM 1008 O LEU A 575 1.874 -9.033 11.725 1.00 9.92 O ATOM 1009 CB LEU A 575 2.034 -7.847 8.622 1.00 10.33 C ATOM 1010 CG LEU A 575 0.543 -8.164 8.829 1.00 12.68 C ATOM 1011 CD1 LEU A 575 -0.096 -7.169 9.746 1.00 12.02 C ATOM 1012 CD2 LEU A 575 -0.139 -8.204 7.474 1.00 9.16 C ATOM 1013 H LEU A 575 4.613 -7.651 8.645 1.00 0.00 H ATOM 1014 N LYS A 576 3.430 -10.072 10.474 1.00 9.27 N ATOM 1015 CA LYS A 576 3.397 -11.266 11.302 1.00 10.03 C ATOM 1016 C LYS A 576 3.742 -10.933 12.747 1.00 12.42 C ATOM 1017 O LYS A 576 3.035 -11.340 13.679 1.00 10.62 O ATOM 1018 CB LYS A 576 4.359 -12.307 10.719 1.00 10.51 C ATOM 1019 CG LYS A 576 4.535 -13.566 11.541 1.00 10.04 C ATOM 1020 CD LYS A 576 5.754 -13.505 12.476 1.00 12.38 C ATOM 1021 CE LYS A 576 7.053 -13.280 11.742 1.00 12.21 C ATOM 1022 NZ LYS A 576 8.208 -13.352 12.688 1.00 15.32 N ATOM 1023 HZ1 LYS A 576 8.102 -12.620 13.420 1.00 0.00 H ATOM 1024 HZ2 LYS A 576 8.230 -14.291 13.135 1.00 0.00 H ATOM 1025 HZ3 LYS A 576 9.093 -13.195 12.165 1.00 0.00 H ATOM 1026 H LYS A 576 4.046 -10.042 9.637 1.00 0.00 H ATOM 1027 N ASP A 577 4.792 -10.145 12.960 1.00 11.18 N ATOM 1028 CA ASP A 577 5.182 -9.816 14.324 1.00 10.21 C ATOM 1029 C ASP A 577 4.123 -8.943 14.993 1.00 11.91 C ATOM 1030 O ASP A 577 3.837 -9.111 16.180 1.00 12.48 O ATOM 1031 CB ASP A 577 6.538 -9.112 14.337 1.00 12.09 C ATOM 1032 CG ASP A 577 7.700 -10.060 14.150 1.00 17.84 C ATOM 1033 OD1 ASP A 577 7.579 -11.269 14.428 1.00 17.24 O ATOM 1034 OD2 ASP A 577 8.757 -9.569 13.722 1.00 23.63 O ATOM 1035 H ASP A 577 5.332 -9.766 12.156 1.00 0.00 H ATOM 1036 N ALA A 578 3.528 -8.010 14.242 1.00 10.64 N ATOM 1037 CA ALA A 578 2.488 -7.155 14.805 1.00 10.04 C ATOM 1038 C ALA A 578 1.270 -7.959 15.234 1.00 10.06 C ATOM 1039 O ALA A 578 0.706 -7.717 16.303 1.00 11.47 O ATOM 1040 CB ALA A 578 2.084 -6.085 13.809 1.00 10.22 C ATOM 1041 H ALA A 578 3.809 -7.893 13.248 1.00 0.00 H ATOM 1042 N ILE A 579 0.822 -8.892 14.398 1.00 9.35 N ATOM 1043 CA ILE A 579 -0.319 -9.723 14.765 1.00 10.14 C ATOM 1044 C ILE A 579 0.007 -10.525 16.014 1.00 11.48 C ATOM 1045 O ILE A 579 -0.803 -10.596 16.951 1.00 10.26 O ATOM 1046 CB ILE A 579 -0.738 -10.635 13.598 1.00 11.80 C ATOM 1047 CG1 ILE A 579 -1.324 -9.805 12.462 1.00 9.78 C ATOM 1048 CG2 ILE A 579 -1.749 -11.654 14.084 1.00 12.47 C ATOM 1049 CD1 ILE A 579 -1.620 -10.611 11.166 1.00 13.93 C ATOM 1050 H ILE A 579 1.288 -9.029 13.478 1.00 0.00 H ATOM 1051 N LYS A 580 1.198 -11.130 16.057 1.00 9.93 N ATOM 1052 CA LYS A 580 1.573 -11.915 17.231 1.00 11.42 C ATOM 1053 C LYS A 580 1.559 -11.058 18.499 1.00 11.45 C ATOM 1054 O LYS A 580 1.057 -11.480 19.550 1.00 12.89 O ATOM 1055 CB LYS A 580 2.959 -12.530 17.039 1.00 15.21 C ATOM 1056 CG LYS A 580 2.993 -13.737 16.132 1.00 20.79 C ATOM 1057 CD LYS A 580 4.334 -14.493 16.305 1.00 22.47 C ATOM 1058 CE LYS A 580 4.349 -15.718 15.422 1.00 37.31 C ATOM 1059 NZ LYS A 580 5.252 -16.768 15.936 1.00 43.87 N ATOM 1060 HZ1 LYS A 580 6.221 -16.395 15.987 1.00 0.00 H ATOM 1061 HZ2 LYS A 580 4.940 -17.058 16.885 1.00 0.00 H ATOM 1062 HZ3 LYS A 580 5.228 -17.588 15.296 1.00 0.00 H ATOM 1063 H LYS A 580 1.856 -11.042 15.257 1.00 0.00 H ATOM 1064 N ASP A 581 2.131 -9.850 18.420 1.00 10.45 N ATOM 1065 CA ASP A 581 2.192 -8.965 19.573 1.00 11.00 C ATOM 1066 C ASP A 581 0.804 -8.517 19.992 1.00 12.08 C ATOM 1067 O ASP A 581 0.540 -8.359 21.188 1.00 14.19 O ATOM 1068 CB ASP A 581 3.057 -7.736 19.273 1.00 11.53 C ATOM 1069 CG ASP A 581 4.540 -8.045 19.245 1.00 19.10 C ATOM 1070 OD1 ASP A 581 4.971 -8.976 19.951 1.00 22.65 O ATOM 1071 OD2 ASP A 581 5.286 -7.352 18.513 1.00 19.36 O ATOM 1072 H ASP A 581 2.540 -9.538 17.516 1.00 0.00 H ATOM 1073 N LEU A 582 -0.072 -8.258 19.019 1.00 10.90 N ATOM 1074 CA LEU A 582 -1.404 -7.742 19.316 1.00 10.65 C ATOM 1075 C LEU A 582 -2.263 -8.814 19.973 1.00 11.63 C ATOM 1076 O LEU A 582 -2.896 -8.566 21.012 1.00 11.96 O ATOM 1077 CB LEU A 582 -2.037 -7.205 18.026 1.00 10.08 C ATOM 1078 CG LEU A 582 -3.467 -6.654 18.133 1.00 14.96 C ATOM 1079 CD1 LEU A 582 -3.516 -5.543 19.145 1.00 23.99 C ATOM 1080 CD2 LEU A 582 -3.939 -6.153 16.768 1.00 26.05 C ATOM 1081 H LEU A 582 0.200 -8.427 18.030 1.00 0.00 H ATOM 1082 N VAL A 583 -2.306 -10.019 19.391 1.00 11.06 N ATOM 1083 CA VAL A 583 -3.238 -11.014 19.916 1.00 9.99 C ATOM 1084 C VAL A 583 -2.822 -11.472 21.306 1.00 12.78 C ATOM 1085 O VAL A 583 -3.681 -11.867 22.106 1.00 12.76 O ATOM 1086 CB VAL A 583 -3.420 -12.226 18.958 1.00 10.19 C ATOM 1087 CG1 VAL A 583 -3.973 -11.776 17.614 1.00 11.54 C ATOM 1088 CG2 VAL A 583 -2.157 -13.051 18.818 1.00 12.31 C ATOM 1089 H VAL A 583 -1.690 -10.242 18.583 1.00 0.00 H ATOM 1090 N MET A 584 -1.535 -11.341 21.663 1.00 12.61 N ATOM 1091 CA MET A 584 -1.074 -11.695 23.003 1.00 13.93 C ATOM 1092 C MET A 584 -1.695 -10.805 24.071 1.00 15.75 C ATOM 1093 O MET A 584 -1.721 -11.189 25.249 1.00 18.00 O ATOM 1094 CB MET A 584 0.456 -11.602 23.040 1.00 18.61 C ATOM 1095 CG MET A 584 1.114 -12.073 24.304 1.00 32.08 C ATOM 1096 SD MET A 584 2.891 -11.881 24.014 1.00 37.62 S ATOM 1097 CE MET A 584 3.237 -13.216 22.871 1.00 40.37 C ATOM 1098 H MET A 584 -0.850 -10.979 20.969 1.00 0.00 H ATOM 1099 N THR A 585 -2.230 -9.645 23.691 1.00 13.46 N ATOM 1100 CA THR A 585 -2.875 -8.741 24.638 1.00 12.17 C ATOM 1101 C THR A 585 -4.368 -8.968 24.774 1.00 12.73 C ATOM 1102 O THR A 585 -5.002 -8.285 25.578 1.00 16.29 O ATOM 1103 CB THR A 585 -2.633 -7.267 24.248 1.00 15.94 C ATOM 1104 OG1 THR A 585 -3.419 -6.904 23.093 1.00 15.00 O ATOM 1105 CG2 THR A 585 -1.170 -7.005 23.989 1.00 15.68 C ATOM 1106 HG1 THR A 585 -3.167 -7.481 22.329 1.00 0.00 H ATOM 1107 H THR A 585 -2.186 -9.375 22.688 1.00 0.00 H ATOM 1108 N LYS A 586 -4.922 -9.886 24.045 1.00 11.79 N ATOM 1109 CA LYS A 586 -6.343 -10.149 24.019 1.00 14.72 C ATOM 1110 C LYS A 586 -6.669 -11.420 24.789 1.00 11.81 C ATOM 1111 O LYS A 586 -5.829 -12.319 24.914 1.00 15.63 O ATOM 1112 CB LYS A 586 -6.818 -10.290 22.571 1.00 12.43 C ATOM 1113 CG LYS A 586 -6.453 -9.106 21.688 1.00 13.79 C ATOM 1114 CD LYS A 586 -7.070 -7.804 22.161 1.00 13.16 C ATOM 1115 CE LYS A 586 -6.837 -6.668 21.152 1.00 16.31 C ATOM 1116 NZ LYS A 586 -7.422 -5.382 21.671 1.00 16.33 N ATOM 1117 HZ1 LYS A 586 -8.444 -5.502 21.818 1.00 0.00 H ATOM 1118 HZ2 LYS A 586 -6.967 -5.135 22.573 1.00 0.00 H ATOM 1119 HZ3 LYS A 586 -7.257 -4.623 20.979 1.00 0.00 H ATOM 1120 H LYS A 586 -4.306 -10.469 23.442 1.00 0.00 H ATOM 1121 N PRO A 587 -7.880 -11.522 25.325 1.00 12.13 N ATOM 1122 CA PRO A 587 -8.267 -12.753 26.007 1.00 14.55 C ATOM 1123 C PRO A 587 -8.455 -13.891 25.020 1.00 15.40 C ATOM 1124 O PRO A 587 -8.641 -13.692 23.815 1.00 17.66 O ATOM 1125 CB PRO A 587 -9.583 -12.388 26.700 1.00 18.25 C ATOM 1126 CG PRO A 587 -10.104 -11.233 25.960 1.00 20.95 C ATOM 1127 CD PRO A 587 -8.949 -10.513 25.325 1.00 18.03 C ATOM 1128 N ALA A 588 -8.390 -15.104 25.557 1.00 16.46 N ATOM 1129 CA ALA A 588 -8.770 -16.262 24.773 1.00 13.74 C ATOM 1130 C ALA A 588 -10.205 -16.084 24.266 1.00 16.30 C ATOM 1131 O ALA A 588 -11.071 -15.579 24.993 1.00 18.79 O ATOM 1132 CB ALA A 588 -8.674 -17.533 25.612 1.00 13.81 C ATOM 1133 H ALA A 588 -8.067 -15.223 26.538 1.00 0.00 H ATOM 1134 N PRO A 589 -10.511 -16.554 23.046 1.00 14.21 N ATOM 1135 CA PRO A 589 -9.607 -17.355 22.206 1.00 13.33 C ATOM 1136 C PRO A 589 -8.714 -16.567 21.263 1.00 11.83 C ATOM 1137 O PRO A 589 -7.926 -17.163 20.548 1.00 13.79 O ATOM 1138 CB PRO A 589 -10.584 -18.232 21.408 1.00 17.71 C ATOM 1139 CG PRO A 589 -11.824 -17.382 21.281 1.00 18.82 C ATOM 1140 CD PRO A 589 -11.915 -16.621 22.589 1.00 16.65 C ATOM 1141 N THR A 590 -8.823 -15.238 21.272 1.00 11.09 N ATOM 1142 CA THR A 590 -8.061 -14.428 20.334 1.00 11.53 C ATOM 1143 C THR A 590 -6.567 -14.635 20.522 1.00 10.94 C ATOM 1144 O THR A 590 -5.817 -14.680 19.541 1.00 10.93 O ATOM 1145 CB THR A 590 -8.443 -12.958 20.488 1.00 12.46 C ATOM 1146 OG1 THR A 590 -9.852 -12.842 20.257 1.00 16.06 O ATOM 1147 CG2 THR A 590 -7.706 -12.047 19.487 1.00 14.57 C ATOM 1148 HG1 THR A 590 -10.124 -11.895 20.352 1.00 0.00 H ATOM 1149 H THR A 590 -9.458 -14.777 21.955 1.00 0.00 H ATOM 1150 N CYS A 591 -6.112 -14.812 21.768 1.00 12.33 N ATOM 1151 CA CYS A 591 -4.673 -14.962 21.965 1.00 13.48 C ATOM 1152 C CYS A 591 -4.147 -16.298 21.444 1.00 12.19 C ATOM 1153 O CYS A 591 -2.934 -16.472 21.381 1.00 13.90 O ATOM 1154 CB CYS A 591 -4.306 -14.807 23.440 1.00 14.30 C ATOM 1155 SG CYS A 591 -5.231 -16.055 24.516 1.00 15.39 S ATOM 1156 H CYS A 591 -6.767 -14.842 22.575 1.00 0.00 H ATOM 1157 N ASN A 592 -5.019 -17.219 21.041 1.00 10.92 N ATOM 1158 CA ASN A 592 -4.623 -18.510 20.497 1.00 10.77 C ATOM 1159 C ASN A 592 -4.446 -18.473 18.982 1.00 10.29 C ATOM 1160 O ASN A 592 -4.105 -19.499 18.384 1.00 12.53 O ATOM 1161 CB ASN A 592 -5.657 -19.566 20.878 1.00 13.78 C ATOM 1162 CG ASN A 592 -5.757 -19.778 22.396 1.00 17.67 C ATOM 1163 OD1 ASN A 592 -4.791 -19.569 23.132 1.00 18.17 O ATOM 1164 ND2 ASN A 592 -6.937 -20.190 22.853 1.00 22.29 N ATOM 1165 HD22 ASN A 592 -7.723 -20.353 22.191 1.00 0.00 H ATOM 1166 HD21 ASN A 592 -7.073 -20.349 23.872 1.00 0.00 H ATOM 1167 H ASN A 592 -6.034 -17.006 21.119 1.00 0.00 H ATOM 1168 N ILE A 593 -4.700 -17.322 18.355 1.00 11.38 N ATOM 1169 CA ILE A 593 -4.462 -17.171 16.925 1.00 9.51 C ATOM 1170 C ILE A 593 -2.979 -17.353 16.629 1.00 10.90 C ATOM 1171 O ILE A 593 -2.106 -16.885 17.369 1.00 12.88 O ATOM 1172 CB ILE A 593 -4.970 -15.799 16.451 1.00 9.28 C ATOM 1173 CG1 ILE A 593 -6.514 -15.767 16.481 1.00 10.51 C ATOM 1174 CG2 ILE A 593 -4.432 -15.485 15.077 1.00 10.16 C ATOM 1175 CD1 ILE A 593 -7.131 -14.361 16.228 1.00 12.63 C ATOM 1176 H ILE A 593 -5.075 -16.518 18.897 1.00 0.00 H ATOM 1177 N ARG A 594 -2.710 -18.092 15.559 1.00 10.02 N ATOM 1178 CA ARG A 594 -1.381 -18.396 15.066 1.00 9.43 C ATOM 1179 C ARG A 594 -1.128 -17.684 13.748 1.00 10.02 C ATOM 1180 O ARG A 594 -2.054 -17.435 12.969 1.00 9.88 O ATOM 1181 CB ARG A 594 -1.218 -19.899 14.863 1.00 10.51 C ATOM 1182 CG ARG A 594 -1.578 -20.717 16.090 1.00 17.07 C ATOM 1183 CD ARG A 594 -0.499 -20.683 17.124 1.00 17.51 C ATOM 1184 NE ARG A 594 0.804 -21.007 16.542 1.00 23.57 N ATOM 1185 CZ ARG A 594 1.225 -22.241 16.284 1.00 25.09 C ATOM 1186 NH1 ARG A 594 0.466 -23.295 16.556 1.00 25.80 N ATOM 1187 NH2 ARG A 594 2.418 -22.424 15.738 1.00 29.96 N ATOM 1188 HE ARG A 594 1.443 -20.219 16.315 1.00 0.00 H ATOM 1189 HH12 ARG A 594 0.812 -24.253 16.347 1.00 0.00 H ATOM 1190 HH11 ARG A 594 -0.475 -23.163 16.978 1.00 0.00 H ATOM 1191 HH22 ARG A 594 2.754 -23.387 15.533 1.00 0.00 H ATOM 1192 HH21 ARG A 594 3.019 -21.605 15.514 1.00 0.00 H ATOM 1193 H ARG A 594 -3.517 -18.484 15.033 1.00 0.00 H ATOM 1194 N VAL A 595 0.133 -17.358 13.484 1.00 10.27 N ATOM 1195 CA VAL A 595 0.472 -16.706 12.226 1.00 9.49 C ATOM 1196 C VAL A 595 1.856 -17.148 11.766 1.00 10.55 C ATOM 1197 O VAL A 595 2.780 -17.311 12.568 1.00 12.30 O ATOM 1198 CB VAL A 595 0.390 -15.172 12.375 1.00 13.29 C ATOM 1199 CG1 VAL A 595 1.220 -14.710 13.536 1.00 17.55 C ATOM 1200 CG2 VAL A 595 0.799 -14.501 11.125 1.00 15.11 C ATOM 1201 H VAL A 595 0.879 -17.569 14.177 1.00 0.00 H ATOM 1202 N THR A 596 1.977 -17.352 10.460 1.00 8.97 N ATOM 1203 CA THR A 596 3.263 -17.555 9.831 1.00 9.20 C ATOM 1204 C THR A 596 3.355 -16.735 8.550 1.00 9.01 C ATOM 1205 O THR A 596 2.390 -16.592 7.804 1.00 10.53 O ATOM 1206 CB THR A 596 3.528 -19.036 9.506 1.00 10.81 C ATOM 1207 OG1 THR A 596 4.837 -19.178 8.919 1.00 11.88 O ATOM 1208 CG2 THR A 596 2.543 -19.602 8.524 1.00 12.30 C ATOM 1209 HG1 THR A 596 4.883 -18.645 8.086 1.00 0.00 H ATOM 1210 H THR A 596 1.120 -17.366 9.871 1.00 0.00 H ATOM 1211 N VAL A 597 4.550 -16.240 8.276 1.00 9.60 N ATOM 1212 CA VAL A 597 4.819 -15.681 6.972 1.00 10.30 C ATOM 1213 C VAL A 597 4.771 -16.782 5.940 1.00 9.54 C ATOM 1214 O VAL A 597 5.139 -17.939 6.214 1.00 10.41 O ATOM 1215 CB VAL A 597 6.189 -14.997 7.005 1.00 9.94 C ATOM 1216 CG1 VAL A 597 6.679 -14.682 5.626 1.00 12.33 C ATOM 1217 CG2 VAL A 597 6.114 -13.749 7.894 1.00 11.17 C ATOM 1218 H VAL A 597 5.297 -16.253 9.000 1.00 0.00 H ATOM 1219 N CYS A 598 4.323 -16.432 4.733 1.00 11.73 N ATOM 1220 CA CYS A 598 4.516 -17.330 3.593 1.00 13.97 C ATOM 1221 C CYS A 598 5.070 -16.559 2.373 1.00 11.64 C ATOM 1222 O CYS A 598 5.283 -15.358 2.385 1.00 10.65 O ATOM 1223 CB CYS A 598 3.258 -18.198 3.205 1.00 17.36 C ATOM 1224 SG CYS A 598 1.792 -17.177 3.030 1.00 21.89 S ATOM 1225 H CYS A 598 3.837 -15.522 4.602 1.00 0.00 H ATOM 1226 N SER A 599 5.659 -17.344 1.511 1.00 11.61 N ATOM 1227 CA SER A 599 6.223 -16.843 0.266 1.00 11.18 C ATOM 1228 C SER A 599 5.665 -17.638 -0.912 1.00 15.71 C ATOM 1229 O SER A 599 5.426 -18.842 -0.822 1.00 16.02 O ATOM 1230 CB SER A 599 7.758 -16.932 0.266 1.00 18.20 C ATOM 1231 OG SER A 599 8.229 -18.261 0.217 1.00 26.56 O ATOM 1232 HG SER A 599 7.897 -18.757 1.007 1.00 0.00 H ATOM 1233 H SER A 599 5.727 -18.360 1.721 1.00 0.00 H ATOM 1234 N PHE A 600 5.464 -16.942 -2.030 1.00 10.59 N ATOM 1235 CA PHE A 600 4.983 -17.531 -3.273 1.00 11.71 C ATOM 1236 C PHE A 600 6.078 -17.428 -4.324 1.00 11.25 C ATOM 1237 O PHE A 600 6.410 -16.322 -4.772 1.00 13.31 O ATOM 1238 CB PHE A 600 3.728 -16.814 -3.737 1.00 10.68 C ATOM 1239 CG PHE A 600 2.658 -16.782 -2.712 1.00 11.85 C ATOM 1240 CD1 PHE A 600 1.873 -17.897 -2.482 1.00 10.73 C ATOM 1241 CD2 PHE A 600 2.408 -15.640 -1.986 1.00 14.60 C ATOM 1242 CE1 PHE A 600 0.854 -17.863 -1.552 1.00 11.56 C ATOM 1243 CE2 PHE A 600 1.396 -15.607 -1.041 1.00 14.23 C ATOM 1244 CZ PHE A 600 0.640 -16.714 -0.817 1.00 10.70 C ATOM 1245 H PHE A 600 5.661 -15.921 -2.015 1.00 0.00 H ATOM 1246 N ASP A 601 6.591 -18.582 -4.753 1.00 11.79 N ATOM 1247 CA ASP A 601 7.771 -18.584 -5.611 1.00 12.40 C ATOM 1248 C ASP A 601 7.559 -17.762 -6.871 1.00 12.62 C ATOM 1249 O ASP A 601 8.465 -17.035 -7.301 1.00 13.44 O ATOM 1250 CB ASP A 601 8.155 -20.011 -6.005 1.00 13.06 C ATOM 1251 CG ASP A 601 8.849 -20.756 -4.907 1.00 26.01 C ATOM 1252 OD1 ASP A 601 8.820 -20.280 -3.755 1.00 25.08 O ATOM 1253 OD2 ASP A 601 9.389 -21.841 -5.198 1.00 18.51 O ATOM 1254 H ASP A 601 6.149 -19.482 -4.476 1.00 0.00 H ATOM 1255 N ASP A 602 6.387 -17.892 -7.506 1.00 12.60 N ATOM 1256 CA ASP A 602 6.094 -17.220 -8.769 1.00 13.11 C ATOM 1257 C ASP A 602 5.083 -16.096 -8.591 1.00 14.23 C ATOM 1258 O ASP A 602 4.559 -15.557 -9.572 1.00 16.29 O ATOM 1259 CB ASP A 602 5.623 -18.250 -9.793 1.00 14.17 C ATOM 1260 CG ASP A 602 6.660 -19.336 -10.041 1.00 14.44 C ATOM 1261 OD1 ASP A 602 7.876 -19.033 -9.957 1.00 16.35 O ATOM 1262 OD2 ASP A 602 6.290 -20.493 -10.319 1.00 18.72 O ATOM 1263 H ASP A 602 5.655 -18.497 -7.082 1.00 0.00 H ATOM 1264 N GLY A 603 4.848 -15.691 -7.353 1.00 11.87 N ATOM 1265 CA GLY A 603 3.800 -14.752 -7.047 1.00 15.66 C ATOM 1266 C GLY A 603 2.424 -15.341 -7.259 1.00 13.91 C ATOM 1267 O GLY A 603 2.267 -16.472 -7.719 1.00 13.98 O ATOM 1268 H GLY A 603 5.437 -16.061 -6.580 1.00 0.00 H ATOM 1269 N VAL A 604 1.410 -14.567 -6.897 1.00 11.37 N ATOM 1270 CA VAL A 604 0.019 -14.892 -7.177 1.00 10.95 C ATOM 1271 C VAL A 604 -0.528 -13.755 -8.018 1.00 11.68 C ATOM 1272 O VAL A 604 -0.464 -12.594 -7.607 1.00 12.79 O ATOM 1273 CB VAL A 604 -0.808 -15.075 -5.892 1.00 12.43 C ATOM 1274 CG1 VAL A 604 -2.277 -15.358 -6.258 1.00 14.07 C ATOM 1275 CG2 VAL A 604 -0.241 -16.201 -5.033 1.00 15.78 C ATOM 1276 H VAL A 604 1.619 -13.684 -6.388 1.00 0.00 H ATOM 1277 N ASP A 605 -1.047 -14.080 -9.197 1.00 12.24 N ATOM 1278 CA ASP A 605 -1.530 -13.073 -10.139 1.00 13.04 C ATOM 1279 C ASP A 605 -2.971 -12.745 -9.759 1.00 13.90 C ATOM 1280 O ASP A 605 -3.928 -13.246 -10.350 1.00 16.73 O ATOM 1281 CB ASP A 605 -1.429 -13.582 -11.574 1.00 15.13 C ATOM 1282 CG ASP A 605 -1.720 -12.503 -12.594 1.00 32.35 C ATOM 1283 OD1 ASP A 605 -1.751 -11.322 -12.195 1.00 38.92 O ATOM 1284 OD2 ASP A 605 -1.909 -12.839 -13.789 1.00 38.00 O ATOM 1285 H ASP A 605 -1.112 -15.085 -9.458 1.00 0.00 H ATOM 1286 N LEU A 606 -3.127 -11.909 -8.734 1.00 12.00 N ATOM 1287 CA LEU A 606 -4.465 -11.525 -8.285 1.00 11.73 C ATOM 1288 C LEU A 606 -5.206 -10.754 -9.376 1.00 15.44 C ATOM 1289 O LEU A 606 -4.589 -9.968 -10.115 1.00 16.89 O ATOM 1290 CB LEU A 606 -4.397 -10.676 -7.019 1.00 10.95 C ATOM 1291 CG LEU A 606 -3.824 -11.373 -5.790 1.00 10.04 C ATOM 1292 CD1 LEU A 606 -3.683 -10.348 -4.651 1.00 10.53 C ATOM 1293 CD2 LEU A 606 -4.637 -12.570 -5.323 1.00 10.71 C ATOM 1294 H LEU A 606 -2.291 -11.526 -8.249 1.00 0.00 H ATOM 1295 N PRO A 607 -6.527 -10.946 -9.504 1.00 13.04 N ATOM 1296 CA PRO A 607 -7.259 -10.353 -10.650 1.00 14.36 C ATOM 1297 C PRO A 607 -7.653 -8.889 -10.551 1.00 28.30 C ATOM 1298 O PRO A 607 -8.273 -8.391 -11.503 1.00 23.93 O ATOM 1299 CB PRO A 607 -8.526 -11.209 -10.723 1.00 14.55 C ATOM 1300 CG PRO A 607 -8.730 -11.670 -9.256 1.00 13.70 C ATOM 1301 CD PRO A 607 -7.347 -11.911 -8.742 1.00 16.41 C ATOM 1302 OXT PRO A 607 -7.391 -8.188 -9.576 1.00 19.45 O TER 1303 PRO A 607 ATOM 1304 N SER B 474 -16.456 -45.080 -8.514 1.00 52.35 N ATOM 1305 CA SER B 474 -17.769 -44.451 -8.418 1.00 53.97 C ATOM 1306 C SER B 474 -17.751 -43.045 -9.003 1.00 51.21 C ATOM 1307 O SER B 474 -18.774 -42.529 -9.447 1.00 46.07 O ATOM 1308 CB SER B 474 -18.233 -44.393 -6.964 1.00 48.76 C ATOM 1309 OG SER B 474 -19.010 -45.529 -6.648 1.00 57.94 O ATOM 1310 HG SER B 474 -19.302 -45.475 -5.704 1.00 0.00 H ATOM 1311 HN3 SER B 474 -15.761 -44.511 -7.990 1.00 0.00 H ATOM 1312 HN2 SER B 474 -16.174 -45.140 -9.513 1.00 0.00 H ATOM 1313 HN1 SER B 474 -16.500 -46.036 -8.107 1.00 0.00 H ATOM 1314 N ASN B 475 -16.579 -42.415 -8.996 1.00 42.60 N ATOM 1315 CA ASN B 475 -16.404 -41.071 -9.538 1.00 38.01 C ATOM 1316 C ASN B 475 -15.347 -41.147 -10.629 1.00 33.32 C ATOM 1317 O ASN B 475 -14.179 -40.794 -10.395 1.00 25.55 O ATOM 1318 CB ASN B 475 -15.992 -40.071 -8.461 1.00 36.60 C ATOM 1319 CG ASN B 475 -16.943 -40.052 -7.287 1.00 27.65 C ATOM 1320 OD1 ASN B 475 -18.149 -40.175 -7.447 1.00 31.76 O ATOM 1321 ND2 ASN B 475 -16.391 -39.915 -6.083 1.00 34.13 N ATOM 1322 HD22 ASN B 475 -15.360 -39.813 -5.992 1.00 0.00 H ATOM 1323 HD21 ASN B 475 -16.991 -39.910 -5.233 1.00 0.00 H ATOM 1324 H ASN B 475 -15.754 -42.900 -8.588 1.00 0.00 H ATOM 1325 N PRO B 476 -15.718 -41.587 -11.833 1.00 30.52 N ATOM 1326 CA PRO B 476 -14.700 -41.764 -12.875 1.00 22.61 C ATOM 1327 C PRO B 476 -14.019 -40.470 -13.250 1.00 23.13 C ATOM 1328 O PRO B 476 -12.820 -40.493 -13.546 1.00 21.83 O ATOM 1329 CB PRO B 476 -15.477 -42.382 -14.045 1.00 30.02 C ATOM 1330 CG PRO B 476 -16.875 -41.880 -13.860 1.00 37.44 C ATOM 1331 CD PRO B 476 -17.086 -41.748 -12.349 1.00 29.97 C ATOM 1332 N LYS B 477 -14.719 -39.330 -13.206 1.00 20.03 N ATOM 1333 CA LYS B 477 -14.053 -38.068 -13.522 1.00 18.71 C ATOM 1334 C LYS B 477 -12.892 -37.792 -12.564 1.00 19.34 C ATOM 1335 O LYS B 477 -11.778 -37.491 -13.005 1.00 18.95 O ATOM 1336 CB LYS B 477 -15.037 -36.900 -13.510 1.00 21.33 C ATOM 1337 CG LYS B 477 -14.377 -35.608 -14.004 1.00 23.28 C ATOM 1338 CD LYS B 477 -15.295 -34.404 -13.844 1.00 30.88 C ATOM 1339 CE LYS B 477 -16.549 -34.534 -14.706 1.00 45.97 C ATOM 1340 NZ LYS B 477 -17.499 -33.396 -14.512 1.00 53.08 N ATOM 1341 HZ1 LYS B 477 -17.797 -33.361 -13.516 1.00 0.00 H ATOM 1342 HZ2 LYS B 477 -17.027 -32.505 -14.766 1.00 0.00 H ATOM 1343 HZ3 LYS B 477 -18.332 -33.534 -15.120 1.00 0.00 H ATOM 1344 H LYS B 477 -15.727 -39.342 -12.950 1.00 0.00 H ATOM 1345 N PHE B 478 -13.135 -37.853 -11.243 1.00 16.38 N ATOM 1346 CA PHE B 478 -12.065 -37.565 -10.286 1.00 15.87 C ATOM 1347 C PHE B 478 -10.967 -38.621 -10.375 1.00 14.68 C ATOM 1348 O PHE B 478 -9.782 -38.308 -10.219 1.00 13.78 O ATOM 1349 CB PHE B 478 -12.595 -37.476 -8.841 1.00 15.66 C ATOM 1350 CG PHE B 478 -13.776 -36.554 -8.668 1.00 16.48 C ATOM 1351 CD1 PHE B 478 -13.895 -35.384 -9.411 1.00 18.13 C ATOM 1352 CD2 PHE B 478 -14.790 -36.872 -7.776 1.00 18.36 C ATOM 1353 CE1 PHE B 478 -14.998 -34.564 -9.260 1.00 17.21 C ATOM 1354 CE2 PHE B 478 -15.903 -36.060 -7.637 1.00 22.48 C ATOM 1355 CZ PHE B 478 -16.004 -34.902 -8.384 1.00 18.76 C ATOM 1356 H PHE B 478 -14.084 -38.105 -10.901 1.00 0.00 H ATOM 1357 N GLU B 479 -11.350 -39.880 -10.616 1.00 16.21 N ATOM 1358 CA GLU B 479 -10.363 -40.951 -10.703 1.00 16.51 C ATOM 1359 C GLU B 479 -9.485 -40.786 -11.937 1.00 15.62 C ATOM 1360 O GLU B 479 -8.295 -41.118 -11.908 1.00 15.22 O ATOM 1361 CB GLU B 479 -11.060 -42.311 -10.743 1.00 20.31 C ATOM 1362 CG GLU B 479 -11.790 -42.686 -9.472 1.00 20.42 C ATOM 1363 CD GLU B 479 -10.859 -43.187 -8.395 1.00 34.29 C ATOM 1364 OE1 GLU B 479 -9.637 -43.227 -8.642 1.00 38.63 O ATOM 1365 OE2 GLU B 479 -11.346 -43.547 -7.302 1.00 34.76 O ATOM 1366 H GLU B 479 -12.359 -40.097 -10.742 1.00 0.00 H ATOM 1367 N ASN B 480 -10.060 -40.293 -13.038 1.00 15.89 N ATOM 1368 CA ASN B 480 -9.271 -40.091 -14.251 1.00 16.63 C ATOM 1369 C ASN B 480 -8.272 -38.949 -14.078 1.00 16.14 C ATOM 1370 O ASN B 480 -7.146 -39.020 -14.593 1.00 16.96 O ATOM 1371 CB ASN B 480 -10.204 -39.833 -15.441 1.00 16.99 C ATOM 1372 CG ASN B 480 -11.013 -41.073 -15.837 1.00 18.98 C ATOM 1373 OD1 ASN B 480 -10.696 -42.195 -15.435 1.00 20.29 O ATOM 1374 ND2 ASN B 480 -12.073 -40.867 -16.621 1.00 28.35 N ATOM 1375 HD22 ASN B 480 -12.306 -39.904 -16.938 1.00 0.00 H ATOM 1376 HD21 ASN B 480 -12.666 -41.669 -16.915 1.00 0.00 H ATOM 1377 H ASN B 480 -11.072 -40.052 -13.031 1.00 0.00 H ATOM 1378 N ILE B 481 -8.658 -37.890 -13.358 1.00 13.84 N ATOM 1379 CA ILE B 481 -7.717 -36.820 -13.038 1.00 11.71 C ATOM 1380 C ILE B 481 -6.606 -37.351 -12.148 1.00 11.74 C ATOM 1381 O ILE B 481 -5.418 -37.087 -12.381 1.00 14.33 O ATOM 1382 CB ILE B 481 -8.455 -35.639 -12.383 1.00 12.72 C ATOM 1383 CG1 ILE B 481 -9.463 -35.046 -13.376 1.00 13.71 C ATOM 1384 CG2 ILE B 481 -7.466 -34.585 -11.937 1.00 13.51 C ATOM 1385 CD1 ILE B 481 -10.414 -34.051 -12.737 1.00 17.56 C ATOM 1386 H ILE B 481 -9.640 -37.828 -13.022 1.00 0.00 H ATOM 1387 N ALA B 482 -6.973 -38.128 -11.132 1.00 12.05 N ATOM 1388 CA ALA B 482 -5.973 -38.720 -10.255 1.00 13.11 C ATOM 1389 C ALA B 482 -5.005 -39.609 -11.028 1.00 16.28 C ATOM 1390 O ALA B 482 -3.802 -39.610 -10.754 1.00 15.33 O ATOM 1391 CB ALA B 482 -6.658 -39.509 -9.142 1.00 15.93 C ATOM 1392 H ALA B 482 -7.982 -38.314 -10.963 1.00 0.00 H ATOM 1393 N GLU B 483 -5.500 -40.375 -12.001 1.00 14.77 N ATOM 1394 CA GLU B 483 -4.608 -41.248 -12.762 1.00 15.63 C ATOM 1395 C GLU B 483 -3.652 -40.434 -13.625 1.00 17.46 C ATOM 1396 O GLU B 483 -2.471 -40.787 -13.762 1.00 17.40 O ATOM 1397 CB GLU B 483 -5.423 -42.218 -13.611 1.00 18.52 C ATOM 1398 CG GLU B 483 -4.565 -43.253 -14.335 1.00 32.41 C ATOM 1399 CD GLU B 483 -3.536 -43.910 -13.408 1.00 53.79 C ATOM 1400 OE1 GLU B 483 -2.337 -43.929 -13.772 1.00 51.73 O ATOM 1401 OE2 GLU B 483 -3.918 -44.394 -12.315 1.00 53.72 O ATOM 1402 H GLU B 483 -6.517 -40.351 -12.218 1.00 0.00 H ATOM 1403 N GLY B 484 -4.143 -39.346 -14.221 1.00 13.66 N ATOM 1404 CA GLY B 484 -3.269 -38.482 -14.990 1.00 13.50 C ATOM 1405 C GLY B 484 -2.193 -37.858 -14.129 1.00 15.27 C ATOM 1406 O GLY B 484 -1.035 -37.766 -14.537 1.00 15.02 O ATOM 1407 H GLY B 484 -5.154 -39.117 -14.134 1.00 0.00 H ATOM 1408 N LEU B 485 -2.564 -37.409 -12.926 1.00 13.86 N ATOM 1409 CA LEU B 485 -1.579 -36.870 -12.000 1.00 11.91 C ATOM 1410 C LEU B 485 -0.592 -37.939 -11.546 1.00 12.94 C ATOM 1411 O LEU B 485 0.616 -37.684 -11.482 1.00 14.91 O ATOM 1412 CB LEU B 485 -2.288 -36.259 -10.788 1.00 15.37 C ATOM 1413 CG LEU B 485 -2.715 -34.801 -10.782 1.00 33.22 C ATOM 1414 CD1 LEU B 485 -3.356 -34.530 -9.411 1.00 33.61 C ATOM 1415 CD2 LEU B 485 -1.546 -33.884 -11.021 1.00 26.89 C ATOM 1416 H LEU B 485 -3.566 -37.445 -12.649 1.00 0.00 H ATOM 1417 N ARG B 486 -1.087 -39.129 -11.193 1.00 13.85 N ATOM 1418 CA ARG B 486 -0.200 -40.203 -10.753 1.00 17.21 C ATOM 1419 C ARG B 486 0.822 -40.541 -11.826 1.00 15.70 C ATOM 1420 O ARG B 486 1.996 -40.782 -11.519 1.00 20.43 O ATOM 1421 CB ARG B 486 -1.007 -41.452 -10.393 1.00 18.35 C ATOM 1422 CG ARG B 486 -1.783 -41.369 -9.085 1.00 22.33 C ATOM 1423 CD ARG B 486 -2.298 -42.770 -8.687 1.00 30.49 C ATOM 1424 NE ARG B 486 -3.404 -42.699 -7.737 1.00 28.39 N ATOM 1425 CZ ARG B 486 -4.686 -42.814 -8.065 1.00 28.83 C ATOM 1426 NH1 ARG B 486 -5.031 -43.036 -9.329 1.00 34.53 N ATOM 1427 NH2 ARG B 486 -5.623 -42.716 -7.127 1.00 30.80 N ATOM 1428 HE ARG B 486 -3.172 -42.548 -6.734 1.00 0.00 H ATOM 1429 HH12 ARG B 486 -6.035 -43.126 -9.586 1.00 0.00 H ATOM 1430 HH11 ARG B 486 -4.297 -43.120 -10.061 1.00 0.00 H ATOM 1431 HH22 ARG B 486 -6.627 -42.806 -7.383 1.00 0.00 H ATOM 1432 HH21 ARG B 486 -5.352 -42.549 -6.137 1.00 0.00 H ATOM 1433 H ARG B 486 -2.113 -39.292 -11.232 1.00 0.00 H ATOM 1434 N ALA B 487 0.402 -40.557 -13.093 1.00 16.69 N ATOM 1435 CA ALA B 487 1.325 -40.890 -14.174 1.00 16.09 C ATOM 1436 C ALA B 487 2.464 -39.879 -14.258 1.00 19.52 C ATOM 1437 O ALA B 487 3.629 -40.251 -14.452 1.00 21.43 O ATOM 1438 CB ALA B 487 0.565 -40.970 -15.500 1.00 22.69 C ATOM 1439 H ALA B 487 -0.589 -40.331 -13.311 1.00 0.00 H ATOM 1440 N LEU B 488 2.148 -38.596 -14.094 1.00 16.50 N ATOM 1441 CA LEU B 488 3.177 -37.566 -14.097 1.00 15.99 C ATOM 1442 C LEU B 488 4.056 -37.663 -12.860 1.00 19.36 C ATOM 1443 O LEU B 488 5.282 -37.519 -12.947 1.00 21.25 O ATOM 1444 CB LEU B 488 2.517 -36.189 -14.178 1.00 17.03 C ATOM 1445 CG LEU B 488 1.895 -35.901 -15.547 1.00 16.64 C ATOM 1446 CD1 LEU B 488 0.793 -34.845 -15.504 1.00 19.62 C ATOM 1447 CD2 LEU B 488 2.979 -35.490 -16.532 1.00 23.58 C ATOM 1448 H LEU B 488 1.152 -38.326 -13.962 1.00 0.00 H ATOM 1449 N LEU B 489 3.444 -37.881 -11.695 1.00 18.18 N ATOM 1450 CA LEU B 489 4.206 -37.959 -10.462 1.00 17.05 C ATOM 1451 C LEU B 489 5.086 -39.195 -10.401 1.00 18.47 C ATOM 1452 O LEU B 489 6.051 -39.208 -9.636 1.00 19.66 O ATOM 1453 CB LEU B 489 3.275 -37.952 -9.257 1.00 16.37 C ATOM 1454 CG LEU B 489 2.507 -36.648 -9.078 1.00 17.05 C ATOM 1455 CD1 LEU B 489 1.462 -36.819 -8.016 1.00 17.33 C ATOM 1456 CD2 LEU B 489 3.421 -35.506 -8.707 1.00 21.11 C ATOM 1457 H LEU B 489 2.411 -37.996 -11.670 1.00 0.00 H ATOM 1458 N ALA B 490 4.754 -40.242 -11.157 1.00 22.78 N ATOM 1459 CA ALA B 490 5.512 -41.485 -11.075 1.00 22.47 C ATOM 1460 C ALA B 490 6.924 -41.340 -11.625 1.00 24.22 C ATOM 1461 O ALA B 490 7.773 -42.190 -11.342 1.00 25.83 O ATOM 1462 CB ALA B 490 4.767 -42.595 -11.820 1.00 29.03 C ATOM 1463 H ALA B 490 3.948 -40.172 -11.810 1.00 0.00 H ATOM 1464 N ARG B 491 7.192 -40.281 -12.385 1.00 23.79 N ATOM 1465 CA ARG B 491 8.500 -40.036 -12.967 1.00 34.01 C ATOM 1466 C ARG B 491 9.490 -39.481 -11.961 1.00 24.72 C ATOM 1467 O ARG B 491 10.686 -39.410 -12.268 1.00 29.56 O ATOM 1468 CB ARG B 491 8.391 -39.044 -14.122 1.00 38.02 C ATOM 1469 CG ARG B 491 7.070 -39.069 -14.846 1.00 40.36 C ATOM 1470 CD ARG B 491 7.113 -40.002 -16.043 1.00 43.88 C ATOM 1471 NE ARG B 491 5.883 -39.917 -16.818 1.00 42.58 N ATOM 1472 CZ ARG B 491 5.460 -38.818 -17.437 1.00 35.91 C ATOM 1473 NH1 ARG B 491 6.179 -37.695 -17.401 1.00 33.38 N ATOM 1474 NH2 ARG B 491 4.325 -38.847 -18.102 1.00 23.05 N ATOM 1475 HE ARG B 491 5.296 -40.772 -16.893 1.00 0.00 H ATOM 1476 HH12 ARG B 491 5.837 -36.843 -17.889 1.00 0.00 H ATOM 1477 HH11 ARG B 491 7.082 -37.672 -16.885 1.00 0.00 H ATOM 1478 HH22 ARG B 491 3.986 -37.993 -18.589 1.00 0.00 H ATOM 1479 HH21 ARG B 491 3.767 -39.724 -18.140 1.00 0.00 H ATOM 1480 H ARG B 491 6.430 -39.598 -12.571 1.00 0.00 H ATOM 1481 N SER B 492 9.020 -39.076 -10.786 1.00 23.68 N ATOM 1482 CA SER B 492 9.855 -38.571 -9.712 1.00 22.50 C ATOM 1483 C SER B 492 9.766 -39.521 -8.524 1.00 30.77 C ATOM 1484 O SER B 492 8.742 -40.177 -8.314 1.00 29.59 O ATOM 1485 CB SER B 492 9.392 -37.177 -9.291 1.00 28.93 C ATOM 1486 OG SER B 492 10.086 -36.727 -8.147 1.00 55.50 O ATOM 1487 HG SER B 492 9.924 -37.352 -7.397 1.00 0.00 H ATOM 1488 H SER B 492 7.993 -39.124 -10.627 1.00 0.00 H ATOM 1489 N HIS B 493 10.833 -39.577 -7.724 1.00 24.44 N ATOM 1490 CA HIS B 493 10.843 -40.443 -6.552 1.00 23.76 C ATOM 1491 C HIS B 493 11.260 -39.680 -5.303 1.00 26.31 C ATOM 1492 O HIS B 493 11.823 -40.256 -4.375 1.00 32.75 O ATOM 1493 CB HIS B 493 11.748 -41.652 -6.797 1.00 30.85 C ATOM 1494 CG HIS B 493 11.180 -42.625 -7.786 1.00 47.28 C ATOM 1495 ND1 HIS B 493 11.275 -42.445 -9.151 1.00 52.68 N ATOM 1496 CD2 HIS B 493 10.475 -43.768 -7.607 1.00 54.40 C ATOM 1497 CE1 HIS B 493 10.673 -43.446 -9.770 1.00 43.19 C ATOM 1498 NE2 HIS B 493 10.183 -44.265 -8.856 1.00 57.93 N ATOM 1499 H HIS B 493 11.668 -38.995 -7.940 1.00 0.00 H ATOM 1500 N VAL B 494 10.931 -38.397 -5.238 1.00 19.91 N ATOM 1501 CA VAL B 494 11.360 -37.577 -4.116 1.00 18.64 C ATOM 1502 C VAL B 494 10.470 -37.843 -2.904 1.00 17.77 C ATOM 1503 O VAL B 494 9.313 -38.268 -3.015 1.00 18.72 O ATOM 1504 CB VAL B 494 11.374 -36.085 -4.490 1.00 19.42 C ATOM 1505 CG1 VAL B 494 12.129 -35.877 -5.794 1.00 22.92 C ATOM 1506 CG2 VAL B 494 9.956 -35.527 -4.586 1.00 19.62 C ATOM 1507 H VAL B 494 10.360 -37.973 -5.997 1.00 0.00 H ATOM 1508 N GLU B 495 11.021 -37.582 -1.727 1.00 17.58 N ATOM 1509 CA GLU B 495 10.290 -37.851 -0.499 1.00 18.22 C ATOM 1510 C GLU B 495 9.105 -36.908 -0.343 1.00 17.05 C ATOM 1511 O GLU B 495 9.208 -35.697 -0.571 1.00 16.25 O ATOM 1512 CB GLU B 495 11.204 -37.721 0.717 1.00 18.91 C ATOM 1513 CG GLU B 495 12.347 -38.728 0.752 1.00 29.04 C ATOM 1514 CD GLU B 495 11.902 -40.160 1.033 1.00 47.71 C ATOM 1515 OE1 GLU B 495 10.800 -40.339 1.589 1.00 51.27 O ATOM 1516 OE2 GLU B 495 12.661 -41.107 0.716 1.00 56.00 O ATOM 1517 H GLU B 495 11.980 -37.183 -1.682 1.00 0.00 H ATOM 1518 N ARG B 496 7.978 -37.471 0.094 1.00 15.16 N ATOM 1519 CA ARG B 496 6.761 -36.701 0.308 1.00 13.25 C ATOM 1520 C ARG B 496 6.485 -36.422 1.776 1.00 12.75 C ATOM 1521 O ARG B 496 5.627 -35.581 2.086 1.00 14.40 O ATOM 1522 CB ARG B 496 5.541 -37.433 -0.263 1.00 13.90 C ATOM 1523 CG ARG B 496 5.613 -37.731 -1.738 1.00 14.53 C ATOM 1524 CD ARG B 496 4.331 -38.371 -2.218 1.00 15.28 C ATOM 1525 NE ARG B 496 4.401 -38.659 -3.649 1.00 16.22 N ATOM 1526 CZ ARG B 496 3.393 -39.113 -4.370 1.00 17.14 C ATOM 1527 NH1 ARG B 496 2.223 -39.357 -3.797 1.00 18.59 N ATOM 1528 NH2 ARG B 496 3.545 -39.334 -5.670 1.00 18.18 N ATOM 1529 HE ARG B 496 5.307 -38.495 -4.132 1.00 0.00 H ATOM 1530 HH12 ARG B 496 1.430 -39.715 -4.366 1.00 0.00 H ATOM 1531 HH11 ARG B 496 2.098 -39.191 -2.778 1.00 0.00 H ATOM 1532 HH22 ARG B 496 2.747 -39.692 -6.233 1.00 0.00 H ATOM 1533 HH21 ARG B 496 4.462 -39.149 -6.125 1.00 0.00 H ATOM 1534 H ARG B 496 7.968 -38.493 0.288 1.00 0.00 H ATOM 1535 N THR B 497 7.142 -37.132 2.675 1.00 14.06 N ATOM 1536 CA THR B 497 6.928 -36.991 4.106 1.00 14.05 C ATOM 1537 C THR B 497 8.275 -36.820 4.788 1.00 15.62 C ATOM 1538 O THR B 497 9.328 -37.123 4.221 1.00 16.85 O ATOM 1539 CB THR B 497 6.221 -38.209 4.702 1.00 15.70 C ATOM 1540 OG1 THR B 497 7.053 -39.371 4.553 1.00 19.99 O ATOM 1541 CG2 THR B 497 4.890 -38.456 3.997 1.00 18.68 C ATOM 1542 HG1 THR B 497 6.592 -40.157 4.940 1.00 0.00 H ATOM 1543 H THR B 497 7.845 -37.824 2.344 1.00 0.00 H ATOM 1544 N THR B 498 8.219 -36.364 6.030 1.00 12.69 N ATOM 1545 CA THR B 498 9.391 -36.254 6.878 1.00 13.48 C ATOM 1546 C THR B 498 9.089 -36.830 8.253 1.00 14.38 C ATOM 1547 O THR B 498 7.940 -36.934 8.671 1.00 14.23 O ATOM 1548 CB THR B 498 9.819 -34.806 7.086 1.00 13.85 C ATOM 1549 OG1 THR B 498 8.805 -34.160 7.851 1.00 14.36 O ATOM 1550 CG2 THR B 498 9.999 -34.099 5.765 1.00 13.21 C ATOM 1551 HG1 THR B 498 9.058 -33.215 8.001 1.00 0.00 H ATOM 1552 H THR B 498 7.297 -36.073 6.413 1.00 0.00 H ATOM 1553 N ASP B 499 10.147 -37.161 8.984 1.00 11.70 N ATOM 1554 CA ASP B 499 9.964 -37.636 10.354 1.00 11.38 C ATOM 1555 C ASP B 499 9.368 -36.556 11.246 1.00 11.39 C ATOM 1556 O ASP B 499 8.652 -36.859 12.208 1.00 15.78 O ATOM 1557 CB ASP B 499 11.291 -38.098 10.942 1.00 12.07 C ATOM 1558 CG ASP B 499 11.111 -38.783 12.284 1.00 13.60 C ATOM 1559 OD1 ASP B 499 10.274 -39.714 12.379 1.00 15.23 O ATOM 1560 OD2 ASP B 499 11.776 -38.376 13.248 1.00 16.07 O ATOM 1561 H ASP B 499 11.103 -37.082 8.583 1.00 0.00 H ATOM 1562 N GLU B 500 9.689 -35.293 10.966 1.00 12.31 N ATOM 1563 CA GLU B 500 9.115 -34.186 11.715 1.00 11.40 C ATOM 1564 C GLU B 500 7.616 -34.082 11.479 1.00 12.81 C ATOM 1565 O GLU B 500 6.865 -33.699 12.386 1.00 15.58 O ATOM 1566 CB GLU B 500 9.819 -32.886 11.308 1.00 17.52 C ATOM 1567 CG GLU B 500 11.269 -32.738 11.815 1.00 22.80 C ATOM 1568 CD GLU B 500 12.297 -33.633 11.098 1.00 22.91 C ATOM 1569 OE1 GLU B 500 12.063 -33.960 9.902 1.00 19.75 O ATOM 1570 OE2 GLU B 500 13.336 -34.010 11.736 1.00 20.38 O ATOM 1571 H GLU B 500 10.362 -35.095 10.198 1.00 0.00 H ATOM 1572 N GLY B 501 7.168 -34.390 10.268 1.00 12.21 N ATOM 1573 CA GLY B 501 5.758 -34.356 9.944 1.00 13.20 C ATOM 1574 C GLY B 501 5.154 -32.979 9.852 1.00 16.37 C ATOM 1575 O GLY B 501 3.920 -32.859 9.864 1.00 18.81 O ATOM 1576 H GLY B 501 7.849 -34.663 9.531 1.00 0.00 H ATOM 1577 N THR B 502 5.962 -31.937 9.747 1.00 10.40 N ATOM 1578 CA THR B 502 5.441 -30.577 9.718 1.00 12.69 C ATOM 1579 C THR B 502 5.072 -30.134 8.302 1.00 12.62 C ATOM 1580 O THR B 502 5.638 -30.601 7.304 1.00 11.95 O ATOM 1581 CB THR B 502 6.494 -29.651 10.301 1.00 14.01 C ATOM 1582 OG1 THR B 502 7.741 -29.985 9.673 1.00 12.99 O ATOM 1583 CG2 THR B 502 6.607 -29.848 11.802 1.00 13.11 C ATOM 1584 HG1 THR B 502 8.456 -29.400 10.029 1.00 0.00 H ATOM 1585 H THR B 502 6.989 -32.092 9.684 1.00 0.00 H ATOM 1586 N TRP B 503 4.092 -29.225 8.230 1.00 10.57 N ATOM 1587 CA TRP B 503 3.497 -28.739 6.966 1.00 9.41 C ATOM 1588 C TRP B 503 4.200 -27.428 6.639 1.00 9.53 C ATOM 1589 O TRP B 503 3.809 -26.355 7.109 1.00 12.33 O ATOM 1590 CB TRP B 503 1.968 -28.592 7.097 1.00 9.53 C ATOM 1591 CG TRP B 503 1.374 -29.902 7.584 1.00 9.89 C ATOM 1592 CD1 TRP B 503 1.042 -30.235 8.865 1.00 10.99 C ATOM 1593 CD2 TRP B 503 1.101 -31.066 6.787 1.00 9.06 C ATOM 1594 NE1 TRP B 503 0.599 -31.541 8.921 1.00 13.93 N ATOM 1595 CE2 TRP B 503 0.624 -32.071 7.660 1.00 9.43 C ATOM 1596 CE3 TRP B 503 1.227 -31.356 5.419 1.00 9.80 C ATOM 1597 CZ2 TRP B 503 0.269 -33.336 7.209 1.00 11.88 C ATOM 1598 CZ3 TRP B 503 0.853 -32.614 4.969 1.00 11.76 C ATOM 1599 CH2 TRP B 503 0.371 -33.581 5.865 1.00 11.64 C ATOM 1600 HE1 TRP B 503 0.296 -32.041 9.781 1.00 0.00 H ATOM 1601 H TRP B 503 3.725 -28.835 9.121 1.00 0.00 H ATOM 1602 N VAL B 504 5.298 -27.526 5.887 1.00 10.77 N ATOM 1603 CA VAL B 504 6.206 -26.401 5.702 1.00 10.75 C ATOM 1604 C VAL B 504 6.206 -25.872 4.289 1.00 10.45 C ATOM 1605 O VAL B 504 6.805 -24.817 4.046 1.00 12.19 O ATOM 1606 CB VAL B 504 7.649 -26.769 6.108 1.00 14.04 C ATOM 1607 CG1 VAL B 504 7.725 -27.156 7.584 1.00 14.59 C ATOM 1608 CG2 VAL B 504 8.148 -27.864 5.188 1.00 16.92 C ATOM 1609 H VAL B 504 5.512 -28.430 5.420 1.00 0.00 H ATOM 1610 N ALA B 505 5.548 -26.544 3.352 1.00 10.87 N ATOM 1611 CA ALA B 505 5.529 -26.129 1.959 1.00 10.96 C ATOM 1612 C ALA B 505 4.139 -26.374 1.402 1.00 10.99 C ATOM 1613 O ALA B 505 3.260 -26.925 2.061 1.00 10.44 O ATOM 1614 CB ALA B 505 6.572 -26.887 1.133 1.00 13.09 C ATOM 1615 H ALA B 505 5.026 -27.401 3.625 1.00 0.00 H ATOM 1616 N GLY B 506 3.952 -26.020 0.147 1.00 13.17 N ATOM 1617 CA GLY B 506 2.661 -26.274 -0.441 1.00 13.63 C ATOM 1618 C GLY B 506 2.648 -25.824 -1.882 1.00 11.58 C ATOM 1619 O GLY B 506 3.654 -25.334 -2.415 1.00 11.00 O ATOM 1620 H GLY B 506 4.712 -25.571 -0.402 1.00 0.00 H ATOM 1621 N VAL B 507 1.491 -26.032 -2.490 1.00 10.64 N ATOM 1622 CA VAL B 507 1.198 -25.520 -3.820 1.00 8.37 C ATOM 1623 C VAL B 507 -0.104 -24.735 -3.734 1.00 8.86 C ATOM 1624 O VAL B 507 -1.064 -25.173 -3.088 1.00 12.34 O ATOM 1625 CB VAL B 507 1.135 -26.660 -4.855 1.00 11.27 C ATOM 1626 CG1 VAL B 507 0.531 -26.188 -6.100 1.00 25.72 C ATOM 1627 CG2 VAL B 507 2.578 -27.205 -5.072 1.00 9.32 C ATOM 1628 H VAL B 507 0.761 -26.584 -1.997 1.00 0.00 H ATOM 1629 N PHE B 508 -0.089 -23.538 -4.322 1.00 9.63 N ATOM 1630 CA PHE B 508 -1.218 -22.613 -4.316 1.00 8.45 C ATOM 1631 C PHE B 508 -1.779 -22.640 -5.732 1.00 9.14 C ATOM 1632 O PHE B 508 -1.069 -22.295 -6.684 1.00 10.24 O ATOM 1633 CB PHE B 508 -0.743 -21.212 -3.894 1.00 8.65 C ATOM 1634 CG PHE B 508 -1.851 -20.228 -3.689 1.00 8.82 C ATOM 1635 CD1 PHE B 508 -2.412 -20.055 -2.446 1.00 12.64 C ATOM 1636 CD2 PHE B 508 -2.336 -19.484 -4.741 1.00 11.71 C ATOM 1637 CE1 PHE B 508 -3.460 -19.176 -2.273 1.00 12.06 C ATOM 1638 CE2 PHE B 508 -3.372 -18.596 -4.555 1.00 10.45 C ATOM 1639 CZ PHE B 508 -3.920 -18.444 -3.327 1.00 10.85 C ATOM 1640 H PHE B 508 0.779 -23.246 -4.814 1.00 0.00 H ATOM 1641 N VAL B 509 -3.029 -23.096 -5.865 1.00 8.41 N ATOM 1642 CA VAL B 509 -3.637 -23.444 -7.152 1.00 8.41 C ATOM 1643 C VAL B 509 -4.824 -22.513 -7.347 1.00 10.05 C ATOM 1644 O VAL B 509 -5.639 -22.363 -6.439 1.00 10.96 O ATOM 1645 CB VAL B 509 -4.093 -24.917 -7.177 1.00 10.58 C ATOM 1646 CG1 VAL B 509 -4.531 -25.317 -8.579 1.00 12.55 C ATOM 1647 CG2 VAL B 509 -3.009 -25.864 -6.670 1.00 9.98 C ATOM 1648 H VAL B 509 -3.603 -23.210 -5.005 1.00 0.00 H ATOM 1649 N TYR B 510 -4.919 -21.863 -8.515 1.00 8.92 N ATOM 1650 CA TYR B 510 -5.966 -20.865 -8.668 1.00 9.01 C ATOM 1651 C TYR B 510 -6.334 -20.658 -10.128 1.00 10.32 C ATOM 1652 O TYR B 510 -5.655 -21.121 -11.037 1.00 11.65 O ATOM 1653 CB TYR B 510 -5.554 -19.534 -8.006 1.00 9.14 C ATOM 1654 CG TYR B 510 -4.337 -18.839 -8.629 1.00 9.97 C ATOM 1655 CD1 TYR B 510 -3.055 -19.282 -8.371 1.00 11.23 C ATOM 1656 CD2 TYR B 510 -4.484 -17.730 -9.444 1.00 10.04 C ATOM 1657 CE1 TYR B 510 -1.956 -18.635 -8.935 1.00 9.66 C ATOM 1658 CE2 TYR B 510 -3.404 -17.081 -9.989 1.00 12.54 C ATOM 1659 CZ TYR B 510 -2.142 -17.536 -9.737 1.00 11.06 C ATOM 1660 OH TYR B 510 -1.063 -16.874 -10.298 1.00 11.05 O ATOM 1661 HH TYR B 510 -0.224 -17.321 -10.023 1.00 0.00 H ATOM 1662 H TYR B 510 -4.260 -22.067 -9.293 1.00 0.00 H ATOM 1663 N GLY B 511 -7.450 -19.966 -10.334 1.00 10.55 N ATOM 1664 CA GLY B 511 -7.923 -19.660 -11.672 1.00 12.94 C ATOM 1665 C GLY B 511 -8.732 -20.764 -12.312 1.00 13.10 C ATOM 1666 O GLY B 511 -9.422 -21.532 -11.636 1.00 15.88 O ATOM 1667 H GLY B 511 -7.999 -19.635 -9.515 1.00 0.00 H ATOM 1668 N GLY B 512 -8.659 -20.847 -13.633 1.00 13.33 N ATOM 1669 CA GLY B 512 -9.521 -21.774 -14.332 1.00 11.35 C ATOM 1670 C GLY B 512 -10.964 -21.374 -14.146 1.00 16.78 C ATOM 1671 O GLY B 512 -11.396 -20.302 -14.578 1.00 22.71 O ATOM 1672 H GLY B 512 -7.989 -20.252 -14.161 1.00 0.00 H ATOM 1673 N SER B 513 -11.713 -22.256 -13.496 1.00 15.03 N ATOM 1674 CA SER B 513 -13.097 -22.002 -13.120 1.00 13.03 C ATOM 1675 C SER B 513 -13.296 -22.671 -11.770 1.00 12.76 C ATOM 1676 O SER B 513 -12.509 -23.528 -11.362 1.00 13.81 O ATOM 1677 CB SER B 513 -14.078 -22.557 -14.153 1.00 17.00 C ATOM 1678 OG SER B 513 -14.085 -23.979 -14.092 1.00 17.91 O ATOM 1679 HG SER B 513 -13.176 -24.321 -14.285 1.00 0.00 H ATOM 1680 H SER B 513 -11.291 -23.172 -13.243 1.00 0.00 H ATOM 1681 N LYS B 514 -14.375 -22.298 -11.077 1.00 11.93 N ATOM 1682 CA LYS B 514 -14.630 -22.917 -9.789 1.00 12.75 C ATOM 1683 C LYS B 514 -14.748 -24.426 -9.939 1.00 11.84 C ATOM 1684 O LYS B 514 -14.172 -25.188 -9.152 1.00 12.55 O ATOM 1685 CB LYS B 514 -15.889 -22.333 -9.141 1.00 13.97 C ATOM 1686 CG LYS B 514 -16.119 -22.842 -7.742 1.00 18.62 C ATOM 1687 CD LYS B 514 -17.430 -22.362 -7.149 1.00 22.33 C ATOM 1688 CE LYS B 514 -17.483 -20.851 -6.949 1.00 27.21 C ATOM 1689 NZ LYS B 514 -18.920 -20.398 -6.705 1.00 32.63 N ATOM 1690 HZ1 LYS B 514 -19.507 -20.653 -7.525 1.00 0.00 H ATOM 1691 HZ2 LYS B 514 -19.290 -20.867 -5.853 1.00 0.00 H ATOM 1692 HZ3 LYS B 514 -18.939 -19.367 -6.571 1.00 0.00 H ATOM 1693 H LYS B 514 -15.022 -21.576 -11.454 1.00 0.00 H ATOM 1694 N THR B 515 -15.494 -24.881 -10.958 1.00 10.57 N ATOM 1695 CA THR B 515 -15.741 -26.313 -11.071 1.00 10.68 C ATOM 1696 C THR B 515 -14.492 -27.068 -11.506 1.00 10.90 C ATOM 1697 O THR B 515 -14.227 -28.157 -10.987 1.00 13.42 O ATOM 1698 CB THR B 515 -16.903 -26.589 -12.031 1.00 15.39 C ATOM 1699 OG1 THR B 515 -16.626 -26.023 -13.314 1.00 30.57 O ATOM 1700 CG2 THR B 515 -18.159 -26.009 -11.489 1.00 11.76 C ATOM 1701 HG1 THR B 515 -17.383 -26.207 -13.925 1.00 0.00 H ATOM 1702 H THR B 515 -15.890 -24.221 -11.657 1.00 0.00 H ATOM 1703 N SER B 516 -13.675 -26.501 -12.410 1.00 13.34 N ATOM 1704 CA SER B 516 -12.473 -27.228 -12.819 1.00 11.57 C ATOM 1705 C SER B 516 -11.464 -27.288 -11.688 1.00 11.16 C ATOM 1706 O SER B 516 -10.802 -28.313 -11.499 1.00 12.08 O ATOM 1707 CB SER B 516 -11.841 -26.619 -14.078 1.00 14.10 C ATOM 1708 OG SER B 516 -11.426 -25.293 -13.878 1.00 17.77 O ATOM 1709 HG SER B 516 -12.207 -24.738 -13.627 1.00 0.00 H ATOM 1710 H SER B 516 -13.892 -25.566 -12.810 1.00 0.00 H ATOM 1711 N LEU B 517 -11.356 -26.226 -10.892 1.00 11.58 N ATOM 1712 CA LEU B 517 -10.490 -26.280 -9.721 1.00 10.70 C ATOM 1713 C LEU B 517 -10.980 -27.322 -8.731 1.00 12.09 C ATOM 1714 O LEU B 517 -10.178 -28.060 -8.156 1.00 10.98 O ATOM 1715 CB LEU B 517 -10.442 -24.920 -9.041 1.00 14.31 C ATOM 1716 CG LEU B 517 -9.498 -23.831 -9.469 1.00 16.53 C ATOM 1717 CD1 LEU B 517 -9.783 -22.653 -8.545 1.00 15.08 C ATOM 1718 CD2 LEU B 517 -8.062 -24.294 -9.370 1.00 13.27 C ATOM 1719 H LEU B 517 -11.889 -25.359 -11.106 1.00 0.00 H ATOM 1720 N TYR B 518 -12.300 -27.370 -8.491 1.00 11.12 N ATOM 1721 CA TYR B 518 -12.865 -28.386 -7.610 1.00 9.58 C ATOM 1722 C TYR B 518 -12.489 -29.787 -8.094 1.00 10.08 C ATOM 1723 O TYR B 518 -12.060 -30.650 -7.313 1.00 10.48 O ATOM 1724 CB TYR B 518 -14.394 -28.224 -7.536 1.00 11.23 C ATOM 1725 CG TYR B 518 -15.034 -29.257 -6.664 1.00 11.63 C ATOM 1726 CD1 TYR B 518 -15.215 -29.031 -5.302 1.00 14.95 C ATOM 1727 CD2 TYR B 518 -15.426 -30.480 -7.184 1.00 11.97 C ATOM 1728 CE1 TYR B 518 -15.775 -30.013 -4.473 1.00 13.79 C ATOM 1729 CE2 TYR B 518 -15.960 -31.460 -6.371 1.00 14.04 C ATOM 1730 CZ TYR B 518 -16.135 -31.217 -5.026 1.00 11.55 C ATOM 1731 OH TYR B 518 -16.667 -32.209 -4.229 1.00 19.77 O ATOM 1732 HH TYR B 518 -16.729 -31.883 -3.296 1.00 0.00 H ATOM 1733 H TYR B 518 -12.928 -26.673 -8.939 1.00 0.00 H ATOM 1734 N ASN B 519 -12.665 -30.039 -9.385 1.00 9.85 N ATOM 1735 CA ASN B 519 -12.350 -31.359 -9.930 1.00 10.00 C ATOM 1736 C ASN B 519 -10.876 -31.688 -9.756 1.00 9.78 C ATOM 1737 O ASN B 519 -10.525 -32.811 -9.381 1.00 11.44 O ATOM 1738 CB ASN B 519 -12.726 -31.427 -11.404 1.00 10.38 C ATOM 1739 CG ASN B 519 -14.233 -31.321 -11.641 1.00 12.63 C ATOM 1740 OD1 ASN B 519 -15.046 -31.625 -10.773 1.00 13.61 O ATOM 1741 ND2 ASN B 519 -14.602 -30.872 -12.836 1.00 15.98 N ATOM 1742 HD22 ASN B 519 -13.881 -30.625 -13.544 1.00 0.00 H ATOM 1743 HD21 ASN B 519 -15.611 -30.767 -13.063 1.00 0.00 H ATOM 1744 H ASN B 519 -13.029 -29.294 -10.013 1.00 0.00 H ATOM 1745 N LEU B 520 -9.996 -30.725 -10.034 1.00 11.28 N ATOM 1746 CA LEU B 520 -8.571 -30.937 -9.815 1.00 9.26 C ATOM 1747 C LEU B 520 -8.279 -31.247 -8.347 1.00 9.34 C ATOM 1748 O LEU B 520 -7.478 -32.141 -8.039 1.00 11.36 O ATOM 1749 CB LEU B 520 -7.797 -29.708 -10.282 1.00 9.08 C ATOM 1750 CG LEU B 520 -6.286 -29.762 -10.023 1.00 8.94 C ATOM 1751 CD1 LEU B 520 -5.673 -30.962 -10.734 1.00 12.80 C ATOM 1752 CD2 LEU B 520 -5.564 -28.477 -10.466 1.00 10.76 C ATOM 1753 H LEU B 520 -10.330 -29.815 -10.410 1.00 0.00 H ATOM 1754 N ARG B 521 -8.936 -30.535 -7.432 1.00 9.80 N ATOM 1755 CA ARG B 521 -8.759 -30.773 -6.007 1.00 9.49 C ATOM 1756 C ARG B 521 -9.149 -32.203 -5.638 1.00 11.63 C ATOM 1757 O ARG B 521 -8.418 -32.880 -4.900 1.00 11.72 O ATOM 1758 CB ARG B 521 -9.582 -29.731 -5.234 1.00 9.88 C ATOM 1759 CG ARG B 521 -9.662 -29.870 -3.730 1.00 10.72 C ATOM 1760 CD ARG B 521 -10.430 -28.640 -3.163 1.00 11.63 C ATOM 1761 NE ARG B 521 -10.815 -28.847 -1.772 1.00 13.33 N ATOM 1762 CZ ARG B 521 -11.872 -29.552 -1.374 1.00 14.08 C ATOM 1763 NH1 ARG B 521 -12.708 -30.078 -2.272 1.00 15.81 N ATOM 1764 NH2 ARG B 521 -12.121 -29.719 -0.081 1.00 16.35 N ATOM 1765 HE ARG B 521 -10.221 -28.412 -1.037 1.00 0.00 H ATOM 1766 HH12 ARG B 521 -13.532 -30.628 -1.956 1.00 0.00 H ATOM 1767 HH11 ARG B 521 -12.535 -29.938 -3.288 1.00 0.00 H ATOM 1768 HH22 ARG B 521 -12.949 -30.271 0.222 1.00 0.00 H ATOM 1769 HH21 ARG B 521 -11.488 -29.298 0.629 1.00 0.00 H ATOM 1770 H ARG B 521 -9.592 -29.791 -7.744 1.00 0.00 H ATOM 1771 N ARG B 522 -10.279 -32.693 -6.172 1.00 11.10 N ATOM 1772 CA ARG B 522 -10.692 -34.074 -5.901 1.00 10.02 C ATOM 1773 C ARG B 522 -9.668 -35.070 -6.438 1.00 10.90 C ATOM 1774 O ARG B 522 -9.345 -36.065 -5.782 1.00 12.23 O ATOM 1775 CB ARG B 522 -12.070 -34.342 -6.509 1.00 12.99 C ATOM 1776 CG ARG B 522 -13.211 -33.547 -5.936 1.00 14.01 C ATOM 1777 CD ARG B 522 -13.438 -33.823 -4.447 1.00 12.94 C ATOM 1778 NE ARG B 522 -13.739 -35.230 -4.197 1.00 15.50 N ATOM 1779 CZ ARG B 522 -14.952 -35.754 -4.074 1.00 23.49 C ATOM 1780 NH1 ARG B 522 -16.025 -34.981 -4.135 1.00 28.60 N ATOM 1781 NH2 ARG B 522 -15.085 -37.062 -3.868 1.00 28.58 N ATOM 1782 HE ARG B 522 -12.931 -35.879 -4.107 1.00 0.00 H ATOM 1783 HH12 ARG B 522 -16.973 -35.398 -4.038 1.00 0.00 H ATOM 1784 HH11 ARG B 522 -15.920 -33.957 -4.280 1.00 0.00 H ATOM 1785 HH22 ARG B 522 -16.033 -37.479 -3.771 1.00 0.00 H ATOM 1786 HH21 ARG B 522 -14.241 -37.667 -3.804 1.00 0.00 H ATOM 1787 H ARG B 522 -10.866 -32.089 -6.782 1.00 0.00 H ATOM 1788 N GLY B 523 -9.139 -34.822 -7.634 1.00 10.84 N ATOM 1789 CA GLY B 523 -8.152 -35.736 -8.194 1.00 12.21 C ATOM 1790 C GLY B 523 -6.854 -35.725 -7.418 1.00 12.49 C ATOM 1791 O GLY B 523 -6.214 -36.765 -7.231 1.00 12.77 O ATOM 1792 H GLY B 523 -9.429 -33.978 -8.168 1.00 0.00 H ATOM 1793 N THR B 524 -6.459 -34.548 -6.942 1.00 10.09 N ATOM 1794 CA THR B 524 -5.240 -34.425 -6.154 1.00 11.03 C ATOM 1795 C THR B 524 -5.354 -35.197 -4.842 1.00 11.36 C ATOM 1796 O THR B 524 -4.398 -35.860 -4.426 1.00 12.18 O ATOM 1797 CB THR B 524 -4.955 -32.949 -5.895 1.00 11.93 C ATOM 1798 OG1 THR B 524 -4.821 -32.253 -7.145 1.00 11.53 O ATOM 1799 CG2 THR B 524 -3.710 -32.793 -5.108 1.00 12.71 C ATOM 1800 HG1 THR B 524 -5.661 -32.339 -7.661 1.00 0.00 H ATOM 1801 H THR B 524 -7.030 -33.701 -7.136 1.00 0.00 H ATOM 1802 N ALA B 525 -6.524 -35.143 -4.194 1.00 10.47 N ATOM 1803 CA ALA B 525 -6.721 -35.870 -2.945 1.00 12.48 C ATOM 1804 C ALA B 525 -6.528 -37.361 -3.148 1.00 14.18 C ATOM 1805 O ALA B 525 -6.015 -38.058 -2.265 1.00 15.18 O ATOM 1806 CB ALA B 525 -8.109 -35.588 -2.384 1.00 12.16 C ATOM 1807 H ALA B 525 -7.302 -34.576 -4.586 1.00 0.00 H ATOM 1808 N LEU B 526 -6.949 -37.873 -4.298 1.00 12.42 N ATOM 1809 CA LEU B 526 -6.842 -39.297 -4.564 1.00 12.99 C ATOM 1810 C LEU B 526 -5.421 -39.685 -4.929 1.00 13.66 C ATOM 1811 O LEU B 526 -4.945 -40.742 -4.512 1.00 16.03 O ATOM 1812 CB LEU B 526 -7.784 -39.674 -5.702 1.00 11.63 C ATOM 1813 CG LEU B 526 -9.283 -39.697 -5.429 1.00 14.28 C ATOM 1814 CD1 LEU B 526 -10.073 -39.859 -6.730 1.00 16.99 C ATOM 1815 CD2 LEU B 526 -9.597 -40.835 -4.453 1.00 16.94 C ATOM 1816 H LEU B 526 -7.361 -37.246 -5.018 1.00 0.00 H ATOM 1817 N ALA B 527 -4.722 -38.832 -5.677 1.00 14.20 N ATOM 1818 CA ALA B 527 -3.384 -39.150 -6.138 1.00 12.49 C ATOM 1819 C ALA B 527 -2.328 -38.951 -5.063 1.00 13.08 C ATOM 1820 O ALA B 527 -1.251 -39.552 -5.144 1.00 15.15 O ATOM 1821 CB ALA B 527 -3.033 -38.285 -7.358 1.00 15.63 C ATOM 1822 H ALA B 527 -5.145 -37.918 -5.936 1.00 0.00 H ATOM 1823 N ILE B 528 -2.618 -38.145 -4.050 1.00 12.72 N ATOM 1824 CA ILE B 528 -1.604 -37.779 -3.072 1.00 10.42 C ATOM 1825 C ILE B 528 -2.169 -37.928 -1.663 1.00 10.52 C ATOM 1826 O ILE B 528 -2.540 -36.930 -1.037 1.00 11.37 O ATOM 1827 CB ILE B 528 -1.089 -36.358 -3.319 1.00 12.90 C ATOM 1828 CG1 ILE B 528 -0.744 -36.165 -4.806 1.00 16.51 C ATOM 1829 CG2 ILE B 528 0.110 -36.117 -2.442 1.00 12.79 C ATOM 1830 CD1 ILE B 528 -0.298 -34.775 -5.152 1.00 18.88 C ATOM 1831 H ILE B 528 -3.583 -37.770 -3.953 1.00 0.00 H ATOM 1832 N PRO B 529 -2.221 -39.132 -1.117 1.00 12.05 N ATOM 1833 CA PRO B 529 -2.673 -39.295 0.277 1.00 12.18 C ATOM 1834 C PRO B 529 -1.852 -38.485 1.278 1.00 11.02 C ATOM 1835 O PRO B 529 -2.338 -38.183 2.383 1.00 15.79 O ATOM 1836 CB PRO B 529 -2.518 -40.804 0.523 1.00 17.80 C ATOM 1837 CG PRO B 529 -2.396 -41.441 -0.810 1.00 21.40 C ATOM 1838 CD PRO B 529 -1.832 -40.408 -1.736 1.00 12.65 C ATOM 1839 N GLN B 530 -0.614 -38.124 0.925 1.00 11.68 N ATOM 1840 CA GLN B 530 0.298 -37.481 1.863 1.00 13.29 C ATOM 1841 C GLN B 530 0.067 -35.983 1.992 1.00 12.96 C ATOM 1842 O GLN B 530 0.709 -35.351 2.839 1.00 14.64 O ATOM 1843 CB GLN B 530 1.760 -37.707 1.421 1.00 14.89 C ATOM 1844 CG GLN B 530 2.148 -39.158 1.267 1.00 14.01 C ATOM 1845 CD GLN B 530 1.751 -39.794 -0.061 1.00 15.66 C ATOM 1846 OE1 GLN B 530 1.348 -39.128 -1.015 1.00 15.60 O ATOM 1847 NE2 GLN B 530 1.838 -41.120 -0.106 1.00 23.14 N ATOM 1848 HE22 GLN B 530 2.184 -41.647 0.721 1.00 0.00 H ATOM 1849 HE21 GLN B 530 1.560 -41.630 -0.969 1.00 0.00 H ATOM 1850 H GLN B 530 -0.292 -38.307 -0.047 1.00 0.00 H ATOM 1851 N CYS B 531 -0.817 -35.406 1.182 1.00 10.77 N ATOM 1852 CA CYS B 531 -1.069 -33.971 1.230 1.00 11.16 C ATOM 1853 C CYS B 531 -2.332 -33.681 2.038 1.00 9.68 C ATOM 1854 O CYS B 531 -3.073 -34.586 2.421 1.00 10.17 O ATOM 1855 CB CYS B 531 -1.222 -33.388 -0.180 1.00 11.78 C ATOM 1856 SG CYS B 531 -2.882 -33.606 -0.928 1.00 12.91 S ATOM 1857 H CYS B 531 -1.340 -35.992 0.500 1.00 0.00 H ATOM 1858 N ARG B 532 -2.542 -32.396 2.325 1.00 9.31 N ATOM 1859 CA ARG B 532 -3.795 -31.909 2.902 1.00 9.26 C ATOM 1860 C ARG B 532 -4.257 -30.713 2.092 1.00 8.93 C ATOM 1861 O ARG B 532 -3.436 -29.962 1.570 1.00 10.30 O ATOM 1862 CB ARG B 532 -3.641 -31.521 4.356 1.00 10.09 C ATOM 1863 CG ARG B 532 -3.189 -32.659 5.256 1.00 12.15 C ATOM 1864 CD ARG B 532 -4.236 -33.773 5.419 1.00 11.86 C ATOM 1865 NE ARG B 532 -3.727 -34.742 6.379 1.00 13.47 N ATOM 1866 CZ ARG B 532 -3.048 -35.841 6.070 1.00 16.75 C ATOM 1867 NH1 ARG B 532 -2.822 -36.175 4.805 1.00 15.76 N ATOM 1868 NH2 ARG B 532 -2.609 -36.629 7.044 1.00 22.76 N ATOM 1869 HE ARG B 532 -3.909 -34.559 7.386 1.00 0.00 H ATOM 1870 HH12 ARG B 532 -2.288 -37.039 4.583 1.00 0.00 H ATOM 1871 HH11 ARG B 532 -3.179 -35.572 4.036 1.00 0.00 H ATOM 1872 HH22 ARG B 532 -2.076 -37.492 6.814 1.00 0.00 H ATOM 1873 HH21 ARG B 532 -2.798 -36.383 8.037 1.00 0.00 H ATOM 1874 H ARG B 532 -1.784 -31.711 2.131 1.00 0.00 H ATOM 1875 N LEU B 533 -5.582 -30.541 1.978 1.00 9.28 N ATOM 1876 CA LEU B 533 -6.154 -29.585 1.057 1.00 10.47 C ATOM 1877 C LEU B 533 -7.116 -28.666 1.769 1.00 10.31 C ATOM 1878 O LEU B 533 -7.916 -29.127 2.588 1.00 10.66 O ATOM 1879 CB LEU B 533 -6.907 -30.302 -0.058 1.00 10.87 C ATOM 1880 CG LEU B 533 -6.069 -31.272 -0.895 1.00 12.25 C ATOM 1881 CD1 LEU B 533 -6.955 -32.322 -1.517 1.00 15.79 C ATOM 1882 CD2 LEU B 533 -5.307 -30.493 -1.936 1.00 16.05 C ATOM 1883 H LEU B 533 -6.217 -31.113 2.570 1.00 0.00 H ATOM 1884 N THR B 534 -7.069 -27.377 1.438 1.00 9.51 N ATOM 1885 CA THR B 534 -8.155 -26.502 1.860 1.00 8.83 C ATOM 1886 C THR B 534 -9.368 -26.711 0.966 1.00 8.78 C ATOM 1887 O THR B 534 -9.254 -27.212 -0.157 1.00 9.90 O ATOM 1888 CB THR B 534 -7.772 -25.021 1.792 1.00 8.46 C ATOM 1889 OG1 THR B 534 -7.567 -24.630 0.437 1.00 9.48 O ATOM 1890 CG2 THR B 534 -6.529 -24.707 2.604 1.00 11.34 C ATOM 1891 HG1 THR B 534 -8.401 -24.774 -0.077 1.00 0.00 H ATOM 1892 H THR B 534 -6.271 -27.001 0.888 1.00 0.00 H ATOM 1893 N PRO B 535 -10.544 -26.285 1.419 1.00 8.96 N ATOM 1894 CA PRO B 535 -11.651 -26.077 0.485 1.00 9.11 C ATOM 1895 C PRO B 535 -11.281 -25.026 -0.545 1.00 11.53 C ATOM 1896 O PRO B 535 -10.324 -24.267 -0.383 1.00 10.72 O ATOM 1897 CB PRO B 535 -12.793 -25.569 1.368 1.00 12.21 C ATOM 1898 CG PRO B 535 -12.380 -25.847 2.770 1.00 13.32 C ATOM 1899 CD PRO B 535 -10.899 -25.918 2.799 1.00 9.14 C ATOM 1900 N LEU B 536 -12.073 -24.952 -1.609 1.00 10.95 N ATOM 1901 CA LEU B 536 -11.977 -23.794 -2.486 1.00 10.19 C ATOM 1902 C LEU B 536 -12.353 -22.534 -1.726 1.00 10.37 C ATOM 1903 O LEU B 536 -13.265 -22.528 -0.894 1.00 10.81 O ATOM 1904 CB LEU B 536 -12.910 -23.919 -3.685 1.00 9.23 C ATOM 1905 CG LEU B 536 -12.705 -25.094 -4.614 1.00 16.32 C ATOM 1906 CD1 LEU B 536 -13.641 -24.876 -5.816 1.00 19.75 C ATOM 1907 CD2 LEU B 536 -11.313 -25.245 -5.085 1.00 19.91 C ATOM 1908 H LEU B 536 -12.753 -25.712 -1.813 1.00 0.00 H ATOM 1909 N SER B 537 -11.707 -21.437 -2.073 1.00 8.98 N ATOM 1910 CA SER B 537 -12.130 -20.138 -1.598 1.00 9.32 C ATOM 1911 C SER B 537 -11.884 -19.144 -2.713 1.00 11.62 C ATOM 1912 O SER B 537 -11.578 -19.515 -3.846 1.00 12.67 O ATOM 1913 CB SER B 537 -11.434 -19.785 -0.286 1.00 11.92 C ATOM 1914 OG SER B 537 -11.974 -18.601 0.247 1.00 15.63 O ATOM 1915 HG SER B 537 -12.941 -18.728 0.416 1.00 0.00 H ATOM 1916 H SER B 537 -10.879 -21.508 -2.699 1.00 0.00 H ATOM 1917 N ARG B 538 -11.989 -17.866 -2.395 1.00 11.60 N ATOM 1918 CA ARG B 538 -11.938 -16.821 -3.405 1.00 11.49 C ATOM 1919 C ARG B 538 -10.741 -15.905 -3.206 1.00 12.38 C ATOM 1920 O ARG B 538 -10.340 -15.611 -2.073 1.00 13.24 O ATOM 1921 CB ARG B 538 -13.215 -15.997 -3.389 1.00 14.68 C ATOM 1922 CG ARG B 538 -14.461 -16.845 -3.505 1.00 19.64 C ATOM 1923 CD ARG B 538 -15.697 -16.008 -3.319 1.00 26.77 C ATOM 1924 NE ARG B 538 -15.930 -15.150 -4.474 1.00 24.20 N ATOM 1925 CZ ARG B 538 -17.133 -14.866 -4.958 1.00 37.86 C ATOM 1926 NH1 ARG B 538 -18.211 -15.370 -4.374 1.00 43.53 N ATOM 1927 NH2 ARG B 538 -17.260 -14.082 -6.019 1.00 35.59 N ATOM 1928 HE ARG B 538 -15.103 -14.735 -4.948 1.00 0.00 H ATOM 1929 HH12 ARG B 538 -19.156 -15.151 -4.749 1.00 0.00 H ATOM 1930 HH11 ARG B 538 -18.112 -15.985 -3.541 1.00 0.00 H ATOM 1931 HH22 ARG B 538 -18.205 -13.863 -6.394 1.00 0.00 H ATOM 1932 HH21 ARG B 538 -16.415 -13.686 -6.477 1.00 0.00 H ATOM 1933 H ARG B 538 -12.111 -17.601 -1.397 1.00 0.00 H ATOM 1934 N LEU B 539 -10.182 -15.452 -4.320 1.00 10.77 N ATOM 1935 CA LEU B 539 -9.093 -14.491 -4.292 1.00 8.67 C ATOM 1936 C LEU B 539 -9.625 -13.068 -4.224 1.00 9.44 C ATOM 1937 O LEU B 539 -10.601 -12.737 -4.905 1.00 10.28 O ATOM 1938 CB LEU B 539 -8.207 -14.596 -5.540 1.00 9.61 C ATOM 1939 CG LEU B 539 -7.377 -15.856 -5.721 1.00 10.24 C ATOM 1940 CD1 LEU B 539 -6.633 -15.836 -7.067 1.00 16.38 C ATOM 1941 CD2 LEU B 539 -6.405 -16.037 -4.552 1.00 12.77 C ATOM 1942 H LEU B 539 -10.532 -15.794 -5.238 1.00 0.00 H ATOM 1943 N PRO B 540 -8.936 -12.216 -3.465 1.00 8.96 N ATOM 1944 CA PRO B 540 -9.140 -10.766 -3.586 1.00 10.15 C ATOM 1945 C PRO B 540 -8.573 -10.252 -4.904 1.00 9.26 C ATOM 1946 O PRO B 540 -7.871 -10.950 -5.642 1.00 10.67 O ATOM 1947 CB PRO B 540 -8.358 -10.215 -2.386 1.00 10.33 C ATOM 1948 CG PRO B 540 -7.168 -11.148 -2.311 1.00 9.07 C ATOM 1949 CD PRO B 540 -7.714 -12.529 -2.690 1.00 9.20 C ATOM 1950 N PHE B 541 -8.875 -8.990 -5.201 1.00 9.81 N ATOM 1951 CA PHE B 541 -8.284 -8.341 -6.357 1.00 9.25 C ATOM 1952 C PHE B 541 -6.840 -7.894 -6.101 1.00 9.74 C ATOM 1953 O PHE B 541 -6.406 -7.710 -4.959 1.00 11.03 O ATOM 1954 CB PHE B 541 -9.115 -7.138 -6.754 1.00 11.33 C ATOM 1955 CG PHE B 541 -10.518 -7.486 -7.200 1.00 10.50 C ATOM 1956 CD1 PHE B 541 -10.753 -7.929 -8.495 1.00 12.80 C ATOM 1957 CD2 PHE B 541 -11.581 -7.363 -6.336 1.00 13.89 C ATOM 1958 CE1 PHE B 541 -12.022 -8.233 -8.905 1.00 13.90 C ATOM 1959 CE2 PHE B 541 -12.845 -7.676 -6.749 1.00 17.50 C ATOM 1960 CZ PHE B 541 -13.060 -8.104 -8.050 1.00 16.06 C ATOM 1961 H PHE B 541 -9.541 -8.464 -4.599 1.00 0.00 H ATOM 1962 N GLY B 542 -6.120 -7.653 -7.194 1.00 11.36 N ATOM 1963 CA GLY B 542 -4.785 -7.088 -7.105 1.00 13.63 C ATOM 1964 C GLY B 542 -4.804 -5.578 -7.220 1.00 14.95 C ATOM 1965 O GLY B 542 -5.643 -4.913 -6.603 1.00 12.39 O ATOM 1966 H GLY B 542 -6.520 -7.873 -8.128 1.00 0.00 H ATOM 1967 N MET B 543 -3.888 -5.022 -8.013 1.00 11.64 N ATOM 1968 CA MET B 543 -3.873 -3.601 -8.286 1.00 11.07 C ATOM 1969 C MET B 543 -4.770 -3.250 -9.462 1.00 13.39 C ATOM 1970 O MET B 543 -4.829 -3.973 -10.465 1.00 15.51 O ATOM 1971 CB MET B 543 -2.454 -3.137 -8.607 1.00 12.74 C ATOM 1972 CG MET B 543 -1.443 -3.476 -7.526 1.00 16.01 C ATOM 1973 SD MET B 543 -1.747 -2.669 -5.968 1.00 16.55 S ATOM 1974 CE MET B 543 -1.664 -0.963 -6.404 1.00 16.95 C ATOM 1975 H MET B 543 -3.163 -5.627 -8.448 1.00 0.00 H ATOM 1976 N ALA B 544 -5.446 -2.119 -9.341 1.00 13.52 N ATOM 1977 CA ALA B 544 -6.188 -1.579 -10.462 1.00 15.70 C ATOM 1978 C ALA B 544 -5.297 -0.638 -11.272 1.00 13.13 C ATOM 1979 O ALA B 544 -4.597 0.208 -10.690 1.00 15.82 O ATOM 1980 CB ALA B 544 -7.415 -0.822 -9.971 1.00 15.27 C ATOM 1981 H ALA B 544 -5.445 -1.613 -8.432 1.00 0.00 H ATOM 1982 N PRO B 545 -5.302 -0.732 -12.603 1.00 14.94 N ATOM 1983 CA PRO B 545 -4.550 0.240 -13.401 1.00 16.31 C ATOM 1984 C PRO B 545 -5.188 1.613 -13.304 1.00 17.91 C ATOM 1985 O PRO B 545 -6.357 1.765 -12.960 1.00 21.42 O ATOM 1986 CB PRO B 545 -4.636 -0.308 -14.829 1.00 20.37 C ATOM 1987 CG PRO B 545 -5.952 -1.071 -14.848 1.00 31.57 C ATOM 1988 CD PRO B 545 -6.070 -1.666 -13.449 1.00 18.09 C ATOM 1989 N GLY B 546 -4.389 2.636 -13.585 1.00 20.16 N ATOM 1990 CA GLY B 546 -4.908 3.982 -13.633 1.00 20.43 C ATOM 1991 C GLY B 546 -4.779 4.686 -12.302 1.00 19.59 C ATOM 1992 O GLY B 546 -4.217 4.148 -11.340 1.00 18.97 O ATOM 1993 H GLY B 546 -3.380 2.466 -13.772 1.00 0.00 H ATOM 1994 N PRO B 547 -5.278 5.925 -12.227 1.00 23.97 N ATOM 1995 CA PRO B 547 -5.211 6.693 -10.981 1.00 28.18 C ATOM 1996 C PRO B 547 -6.427 6.531 -10.080 1.00 44.70 C ATOM 1997 O PRO B 547 -6.435 7.100 -8.983 1.00 51.34 O ATOM 1998 CB PRO B 547 -5.105 8.136 -11.505 1.00 35.03 C ATOM 1999 CG PRO B 547 -5.975 8.127 -12.723 1.00 36.44 C ATOM 2000 CD PRO B 547 -5.853 6.718 -13.325 1.00 34.40 C ATOM 2001 N GLY B 548 -7.434 5.772 -10.509 1.00 42.91 N ATOM 2002 CA GLY B 548 -8.683 5.669 -9.790 1.00 35.19 C ATOM 2003 C GLY B 548 -8.492 4.960 -8.471 1.00 44.46 C ATOM 2004 O GLY B 548 -7.360 4.708 -8.042 1.00 31.04 O ATOM 2005 H GLY B 548 -7.317 5.235 -11.392 1.00 0.00 H ATOM 2006 N PRO B 549 -9.592 4.602 -7.806 1.00 42.68 N ATOM 2007 CA PRO B 549 -9.462 3.948 -6.501 1.00 37.92 C ATOM 2008 C PRO B 549 -8.965 2.517 -6.641 1.00 17.58 C ATOM 2009 O PRO B 549 -9.310 1.806 -7.590 1.00 24.21 O ATOM 2010 CB PRO B 549 -10.888 3.994 -5.937 1.00 25.22 C ATOM 2011 CG PRO B 549 -11.773 3.886 -7.171 1.00 37.81 C ATOM 2012 CD PRO B 549 -10.999 4.647 -8.268 1.00 46.95 C ATOM 2013 N GLN B 550 -8.153 2.098 -5.674 1.00 18.93 N ATOM 2014 CA GLN B 550 -7.760 0.708 -5.541 1.00 13.37 C ATOM 2015 C GLN B 550 -8.882 -0.049 -4.846 1.00 12.41 C ATOM 2016 O GLN B 550 -9.673 0.549 -4.114 1.00 16.87 O ATOM 2017 CB GLN B 550 -6.464 0.602 -4.754 1.00 17.32 C ATOM 2018 CG GLN B 550 -5.285 1.178 -5.519 1.00 14.66 C ATOM 2019 CD GLN B 550 -5.093 0.487 -6.850 1.00 13.84 C ATOM 2020 OE1 GLN B 550 -5.141 -0.744 -6.930 1.00 14.60 O ATOM 2021 NE2 GLN B 550 -4.863 1.271 -7.900 1.00 19.86 N ATOM 2022 HE22 GLN B 550 -4.832 2.304 -7.781 1.00 0.00 H ATOM 2023 HE21 GLN B 550 -4.714 0.851 -8.840 1.00 0.00 H ATOM 2024 H GLN B 550 -7.787 2.791 -4.990 1.00 0.00 H ATOM 2025 N PRO B 551 -8.994 -1.355 -5.069 1.00 12.68 N ATOM 2026 CA PRO B 551 -9.997 -2.133 -4.333 1.00 12.29 C ATOM 2027 C PRO B 551 -9.644 -2.207 -2.855 1.00 12.45 C ATOM 2028 O PRO B 551 -8.467 -2.224 -2.480 1.00 13.27 O ATOM 2029 CB PRO B 551 -9.922 -3.519 -4.974 1.00 11.82 C ATOM 2030 CG PRO B 551 -8.486 -3.597 -5.551 1.00 11.90 C ATOM 2031 CD PRO B 551 -8.173 -2.184 -5.972 1.00 12.75 C ATOM 2032 N GLY B 552 -10.666 -2.248 -2.008 1.00 12.78 N ATOM 2033 CA GLY B 552 -10.398 -2.479 -0.603 1.00 12.45 C ATOM 2034 C GLY B 552 -9.827 -3.870 -0.414 1.00 11.55 C ATOM 2035 O GLY B 552 -10.058 -4.768 -1.229 1.00 11.30 O ATOM 2036 H GLY B 552 -11.640 -2.117 -2.347 1.00 0.00 H ATOM 2037 N PRO B 553 -9.099 -4.085 0.690 1.00 10.46 N ATOM 2038 CA PRO B 553 -8.435 -5.378 0.904 1.00 10.02 C ATOM 2039 C PRO B 553 -9.369 -6.565 1.007 1.00 11.20 C ATOM 2040 O PRO B 553 -8.944 -7.690 0.707 1.00 10.54 O ATOM 2041 CB PRO B 553 -7.655 -5.145 2.209 1.00 10.32 C ATOM 2042 CG PRO B 553 -7.360 -3.660 2.199 1.00 11.13 C ATOM 2043 CD PRO B 553 -8.653 -3.071 1.660 1.00 13.98 C ATOM 2044 N LEU B 554 -10.630 -6.370 1.416 1.00 10.48 N ATOM 2045 CA LEU B 554 -11.566 -7.479 1.567 1.00 10.41 C ATOM 2046 C LEU B 554 -12.354 -7.809 0.303 1.00 10.19 C ATOM 2047 O LEU B 554 -13.012 -8.856 0.275 1.00 12.97 O ATOM 2048 CB LEU B 554 -12.596 -7.207 2.679 1.00 11.24 C ATOM 2049 CG LEU B 554 -12.017 -6.858 4.039 1.00 11.81 C ATOM 2050 CD1 LEU B 554 -13.112 -6.296 4.944 1.00 18.46 C ATOM 2051 CD2 LEU B 554 -11.357 -8.092 4.633 1.00 17.35 C ATOM 2052 H LEU B 554 -10.950 -5.404 1.631 1.00 0.00 H ATOM 2053 N ARG B 555 -12.313 -6.966 -0.723 1.00 11.30 N ATOM 2054 CA ARG B 555 -13.103 -7.213 -1.925 1.00 10.10 C ATOM 2055 C ARG B 555 -12.769 -8.577 -2.508 1.00 12.02 C ATOM 2056 O ARG B 555 -11.599 -8.934 -2.640 1.00 13.49 O ATOM 2057 CB ARG B 555 -12.828 -6.140 -2.988 1.00 13.31 C ATOM 2058 CG ARG B 555 -13.389 -4.765 -2.700 1.00 21.12 C ATOM 2059 CD ARG B 555 -14.798 -4.573 -3.196 1.00 15.81 C ATOM 2060 NE ARG B 555 -15.008 -4.931 -4.600 1.00 14.97 N ATOM 2061 CZ ARG B 555 -14.652 -4.201 -5.654 1.00 22.45 C ATOM 2062 NH1 ARG B 555 -14.025 -3.041 -5.518 1.00 20.92 N ATOM 2063 NH2 ARG B 555 -14.943 -4.647 -6.865 1.00 20.69 N ATOM 2064 HE ARG B 555 -15.478 -5.839 -4.791 1.00 0.00 H ATOM 2065 HH12 ARG B 555 -13.759 -2.492 -6.360 1.00 0.00 H ATOM 2066 HH11 ARG B 555 -13.799 -2.680 -4.569 1.00 0.00 H ATOM 2067 HH22 ARG B 555 -14.674 -4.092 -7.702 1.00 0.00 H ATOM 2068 HH21 ARG B 555 -15.441 -5.553 -6.980 1.00 0.00 H ATOM 2069 H ARG B 555 -11.711 -6.120 -0.669 1.00 0.00 H ATOM 2070 N GLU B 556 -13.794 -9.351 -2.836 1.00 10.54 N ATOM 2071 CA GLU B 556 -13.606 -10.684 -3.391 1.00 10.14 C ATOM 2072 C GLU B 556 -13.888 -10.691 -4.883 1.00 10.56 C ATOM 2073 O GLU B 556 -14.881 -10.112 -5.347 1.00 12.36 O ATOM 2074 CB GLU B 556 -14.515 -11.725 -2.734 1.00 10.68 C ATOM 2075 CG GLU B 556 -14.309 -11.861 -1.248 1.00 15.48 C ATOM 2076 CD GLU B 556 -15.358 -12.700 -0.557 1.00 18.90 C ATOM 2077 OE1 GLU B 556 -15.855 -13.668 -1.163 1.00 21.48 O ATOM 2078 OE2 GLU B 556 -15.688 -12.370 0.601 1.00 21.48 O ATOM 2079 H GLU B 556 -14.761 -8.996 -2.693 1.00 0.00 H ATOM 2080 N SER B 557 -13.029 -11.392 -5.608 1.00 10.54 N ATOM 2081 CA SER B 557 -13.203 -11.609 -7.037 1.00 10.61 C ATOM 2082 C SER B 557 -13.995 -12.892 -7.272 1.00 11.15 C ATOM 2083 O SER B 557 -14.292 -13.640 -6.345 1.00 15.64 O ATOM 2084 CB SER B 557 -11.844 -11.677 -7.722 1.00 12.74 C ATOM 2085 OG SER B 557 -11.241 -12.964 -7.569 1.00 12.38 O ATOM 2086 HG SER B 557 -11.116 -13.156 -6.606 1.00 0.00 H ATOM 2087 H SER B 557 -12.198 -11.804 -5.138 1.00 0.00 H ATOM 2088 N ILE B 558 -14.274 -13.180 -8.548 1.00 13.14 N ATOM 2089 CA ILE B 558 -14.873 -14.458 -8.922 1.00 12.75 C ATOM 2090 C ILE B 558 -13.836 -15.563 -9.121 1.00 12.67 C ATOM 2091 O ILE B 558 -14.213 -16.695 -9.458 1.00 14.35 O ATOM 2092 CB ILE B 558 -15.720 -14.332 -10.204 1.00 19.80 C ATOM 2093 CG1 ILE B 558 -14.836 -13.983 -11.407 1.00 20.89 C ATOM 2094 CG2 ILE B 558 -16.850 -13.322 -9.989 1.00 28.56 C ATOM 2095 CD1 ILE B 558 -15.607 -14.090 -12.735 1.00 39.11 C ATOM 2096 H ILE B 558 -14.060 -12.481 -9.288 1.00 0.00 H ATOM 2097 N VAL B 559 -12.541 -15.259 -8.990 1.00 9.85 N ATOM 2098 CA VAL B 559 -11.478 -16.243 -9.173 1.00 10.15 C ATOM 2099 C VAL B 559 -11.277 -17.018 -7.880 1.00 9.19 C ATOM 2100 O VAL B 559 -11.132 -16.433 -6.798 1.00 12.39 O ATOM 2101 CB VAL B 559 -10.165 -15.562 -9.612 1.00 10.88 C ATOM 2102 CG1 VAL B 559 -9.076 -16.608 -9.820 1.00 12.59 C ATOM 2103 CG2 VAL B 559 -10.377 -14.742 -10.867 1.00 12.93 C ATOM 2104 H VAL B 559 -12.280 -14.282 -8.748 1.00 0.00 H ATOM 2105 N CYS B 560 -11.235 -18.336 -7.987 1.00 9.42 N ATOM 2106 CA CYS B 560 -11.089 -19.186 -6.820 1.00 10.65 C ATOM 2107 C CYS B 560 -9.669 -19.741 -6.702 1.00 10.33 C ATOM 2108 O CYS B 560 -8.854 -19.668 -7.629 1.00 9.69 O ATOM 2109 CB CYS B 560 -12.079 -20.339 -6.885 1.00 9.47 C ATOM 2110 SG CYS B 560 -13.789 -19.780 -6.813 1.00 15.86 S ATOM 2111 H CYS B 560 -11.308 -18.772 -8.928 1.00 0.00 H ATOM 2112 N TYR B 561 -9.381 -20.310 -5.526 1.00 10.48 N ATOM 2113 CA TYR B 561 -8.108 -20.953 -5.245 1.00 8.81 C ATOM 2114 C TYR B 561 -8.320 -22.093 -4.260 1.00 8.30 C ATOM 2115 O TYR B 561 -9.351 -22.171 -3.575 1.00 8.73 O ATOM 2116 CB TYR B 561 -7.084 -19.958 -4.651 1.00 8.24 C ATOM 2117 CG TYR B 561 -7.278 -19.700 -3.171 1.00 8.60 C ATOM 2118 CD1 TYR B 561 -6.624 -20.476 -2.230 1.00 9.95 C ATOM 2119 CD2 TYR B 561 -8.099 -18.682 -2.717 1.00 9.75 C ATOM 2120 CE1 TYR B 561 -6.775 -20.255 -0.892 1.00 10.83 C ATOM 2121 CE2 TYR B 561 -8.282 -18.459 -1.354 1.00 9.57 C ATOM 2122 CZ TYR B 561 -7.632 -19.249 -0.452 1.00 10.05 C ATOM 2123 OH TYR B 561 -7.769 -19.058 0.917 1.00 11.88 O ATOM 2124 HH TYR B 561 -7.222 -19.728 1.399 1.00 0.00 H ATOM 2125 H TYR B 561 -10.102 -20.291 -4.777 1.00 0.00 H ATOM 2126 N PHE B 562 -7.328 -22.984 -4.192 1.00 8.53 N ATOM 2127 CA PHE B 562 -7.192 -23.849 -3.024 1.00 8.72 C ATOM 2128 C PHE B 562 -5.716 -24.028 -2.750 1.00 8.80 C ATOM 2129 O PHE B 562 -4.865 -23.764 -3.597 1.00 8.90 O ATOM 2130 CB PHE B 562 -7.902 -25.208 -3.169 1.00 10.06 C ATOM 2131 CG PHE B 562 -7.356 -26.099 -4.231 1.00 8.92 C ATOM 2132 CD1 PHE B 562 -6.431 -27.089 -3.919 1.00 10.71 C ATOM 2133 CD2 PHE B 562 -7.798 -25.984 -5.538 1.00 9.55 C ATOM 2134 CE1 PHE B 562 -5.938 -27.951 -4.920 1.00 11.08 C ATOM 2135 CE2 PHE B 562 -7.318 -26.838 -6.543 1.00 10.15 C ATOM 2136 CZ PHE B 562 -6.403 -27.819 -6.235 1.00 9.34 C ATOM 2137 H PHE B 562 -6.648 -23.062 -4.975 1.00 0.00 H ATOM 2138 N MET B 563 -5.414 -24.440 -1.521 1.00 9.17 N ATOM 2139 CA MET B 563 -4.051 -24.675 -1.066 1.00 7.74 C ATOM 2140 C MET B 563 -3.829 -26.164 -0.833 1.00 10.68 C ATOM 2141 O MET B 563 -4.693 -26.847 -0.269 1.00 10.26 O ATOM 2142 CB MET B 563 -3.774 -23.898 0.224 1.00 12.08 C ATOM 2143 CG MET B 563 -2.402 -24.150 0.831 1.00 10.90 C ATOM 2144 SD MET B 563 -1.110 -23.170 0.064 1.00 13.07 S ATOM 2145 CE MET B 563 -1.498 -21.587 0.748 1.00 8.26 C ATOM 2146 H MET B 563 -6.192 -24.603 -0.851 1.00 0.00 H ATOM 2147 N VAL B 564 -2.662 -26.652 -1.258 1.00 9.54 N ATOM 2148 CA VAL B 564 -2.183 -28.004 -0.963 1.00 8.08 C ATOM 2149 C VAL B 564 -1.058 -27.861 0.052 1.00 9.59 C ATOM 2150 O VAL B 564 -0.037 -27.223 -0.243 1.00 12.11 O ATOM 2151 CB VAL B 564 -1.657 -28.723 -2.213 1.00 11.01 C ATOM 2152 CG1 VAL B 564 -1.294 -30.160 -1.897 1.00 12.68 C ATOM 2153 CG2 VAL B 564 -2.620 -28.630 -3.363 1.00 10.97 C ATOM 2154 H VAL B 564 -2.055 -26.034 -1.834 1.00 0.00 H ATOM 2155 N PHE B 565 -1.222 -28.444 1.235 1.00 8.04 N ATOM 2156 CA PHE B 565 -0.153 -28.456 2.225 1.00 9.60 C ATOM 2157 C PHE B 565 0.682 -29.721 2.076 1.00 9.96 C ATOM 2158 O PHE B 565 0.137 -30.818 1.885 1.00 10.09 O ATOM 2159 CB PHE B 565 -0.715 -28.399 3.646 1.00 8.56 C ATOM 2160 CG PHE B 565 -1.544 -27.197 3.942 1.00 11.20 C ATOM 2161 CD1 PHE B 565 -0.956 -26.010 4.326 1.00 11.90 C ATOM 2162 CD2 PHE B 565 -2.931 -27.260 3.849 1.00 11.57 C ATOM 2163 CE1 PHE B 565 -1.737 -24.900 4.621 1.00 11.63 C ATOM 2164 CE2 PHE B 565 -3.706 -26.159 4.125 1.00 9.69 C ATOM 2165 CZ PHE B 565 -3.111 -24.980 4.524 1.00 12.95 C ATOM 2166 H PHE B 565 -2.130 -28.900 1.458 1.00 0.00 H ATOM 2167 N LEU B 566 2.007 -29.564 2.208 1.00 9.18 N ATOM 2168 CA LEU B 566 2.967 -30.633 1.996 1.00 7.88 C ATOM 2169 C LEU B 566 4.075 -30.566 3.043 1.00 9.16 C ATOM 2170 O LEU B 566 4.400 -29.501 3.579 1.00 9.09 O ATOM 2171 CB LEU B 566 3.587 -30.548 0.607 1.00 8.72 C ATOM 2172 CG LEU B 566 2.628 -30.728 -0.561 1.00 11.83 C ATOM 2173 CD1 LEU B 566 3.348 -30.350 -1.838 1.00 15.41 C ATOM 2174 CD2 LEU B 566 2.104 -32.138 -0.639 1.00 13.46 C ATOM 2175 H LEU B 566 2.367 -28.626 2.477 1.00 0.00 H ATOM 2176 N GLN B 567 4.691 -31.720 3.290 1.00 9.19 N ATOM 2177 CA GLN B 567 5.752 -31.830 4.282 1.00 8.30 C ATOM 2178 C GLN B 567 7.139 -31.583 3.708 1.00 9.98 C ATOM 2179 O GLN B 567 8.086 -31.417 4.491 1.00 11.23 O ATOM 2180 CB GLN B 567 5.710 -33.210 4.954 1.00 10.30 C ATOM 2181 CG GLN B 567 4.486 -33.393 5.831 1.00 9.88 C ATOM 2182 CD GLN B 567 4.434 -34.725 6.536 1.00 13.09 C ATOM 2183 OE1 GLN B 567 5.398 -35.478 6.597 1.00 11.79 O ATOM 2184 NE2 GLN B 567 3.291 -35.010 7.125 1.00 16.98 N ATOM 2185 HE22 GLN B 567 2.491 -34.349 7.054 1.00 0.00 H ATOM 2186 HE21 GLN B 567 3.189 -35.896 7.661 1.00 0.00 H ATOM 2187 H GLN B 567 4.406 -32.568 2.759 1.00 0.00 H ATOM 2188 N THR B 568 7.295 -31.546 2.386 1.00 10.13 N ATOM 2189 CA THR B 568 8.600 -31.258 1.799 1.00 9.45 C ATOM 2190 C THR B 568 8.482 -30.260 0.651 1.00 11.62 C ATOM 2191 O THR B 568 7.554 -30.319 -0.169 1.00 10.37 O ATOM 2192 CB THR B 568 9.323 -32.515 1.284 1.00 11.40 C ATOM 2193 OG1 THR B 568 8.657 -33.014 0.118 1.00 11.09 O ATOM 2194 CG2 THR B 568 9.383 -33.562 2.345 1.00 11.05 C ATOM 2195 HG1 THR B 568 9.127 -33.822 -0.208 1.00 0.00 H ATOM 2196 H THR B 568 6.479 -31.724 1.766 1.00 0.00 H ATOM 2197 N HIS B 569 9.452 -29.345 0.585 1.00 9.75 N ATOM 2198 CA HIS B 569 9.500 -28.409 -0.524 1.00 9.60 C ATOM 2199 C HIS B 569 9.873 -29.104 -1.828 1.00 11.09 C ATOM 2200 O HIS B 569 9.381 -28.732 -2.902 1.00 12.70 O ATOM 2201 CB HIS B 569 10.494 -27.291 -0.218 1.00 12.88 C ATOM 2202 CG HIS B 569 10.445 -26.143 -1.185 1.00 14.95 C ATOM 2203 ND1 HIS B 569 11.077 -26.176 -2.415 1.00 17.46 N ATOM 2204 CD2 HIS B 569 9.881 -24.914 -1.088 1.00 21.89 C ATOM 2205 CE1 HIS B 569 10.873 -25.032 -3.043 1.00 21.71 C ATOM 2206 NE2 HIS B 569 10.175 -24.239 -2.249 1.00 23.85 N ATOM 2207 H HIS B 569 10.176 -29.303 1.331 1.00 0.00 H ATOM 2208 N ILE B 570 10.731 -30.123 -1.751 1.00 11.75 N ATOM 2209 CA ILE B 570 11.155 -30.814 -2.964 1.00 11.51 C ATOM 2210 C ILE B 570 9.953 -31.451 -3.654 1.00 15.79 C ATOM 2211 O ILE B 570 9.838 -31.410 -4.881 1.00 16.00 O ATOM 2212 CB ILE B 570 12.262 -31.836 -2.642 1.00 14.45 C ATOM 2213 CG1 ILE B 570 12.894 -32.282 -3.958 1.00 23.39 C ATOM 2214 CG2 ILE B 570 11.733 -33.003 -1.834 1.00 14.82 C ATOM 2215 CD1 ILE B 570 14.137 -31.446 -4.334 1.00 35.90 C ATOM 2216 H ILE B 570 11.098 -30.425 -0.826 1.00 0.00 H ATOM 2217 N PHE B 571 9.013 -32.014 -2.889 1.00 10.64 N ATOM 2218 CA PHE B 571 7.822 -32.575 -3.520 1.00 10.23 C ATOM 2219 C PHE B 571 6.856 -31.474 -3.960 1.00 11.53 C ATOM 2220 O PHE B 571 6.136 -31.652 -4.955 1.00 12.29 O ATOM 2221 CB PHE B 571 7.116 -33.573 -2.598 1.00 11.98 C ATOM 2222 CG PHE B 571 5.931 -34.223 -3.237 1.00 11.25 C ATOM 2223 CD1 PHE B 571 6.084 -34.986 -4.375 1.00 10.83 C ATOM 2224 CD2 PHE B 571 4.676 -34.071 -2.701 1.00 15.93 C ATOM 2225 CE1 PHE B 571 4.980 -35.593 -4.985 1.00 14.17 C ATOM 2226 CE2 PHE B 571 3.570 -34.655 -3.313 1.00 19.12 C ATOM 2227 CZ PHE B 571 3.740 -35.420 -4.445 1.00 14.69 C ATOM 2228 H PHE B 571 9.129 -32.052 -1.856 1.00 0.00 H ATOM 2229 N ALA B 572 6.788 -30.344 -3.232 1.00 10.22 N ATOM 2230 CA ALA B 572 6.000 -29.216 -3.728 1.00 12.09 C ATOM 2231 C ALA B 572 6.422 -28.836 -5.145 1.00 11.77 C ATOM 2232 O ALA B 572 5.577 -28.591 -6.006 1.00 11.50 O ATOM 2233 CB ALA B 572 6.125 -28.002 -2.803 1.00 13.21 C ATOM 2234 H ALA B 572 7.291 -30.274 -2.325 1.00 0.00 H ATOM 2235 N GLU B 573 7.732 -28.756 -5.403 1.00 11.12 N ATOM 2236 CA GLU B 573 8.202 -28.403 -6.741 1.00 10.48 C ATOM 2237 C GLU B 573 7.765 -29.447 -7.765 1.00 12.76 C ATOM 2238 O GLU B 573 7.361 -29.103 -8.885 1.00 14.25 O ATOM 2239 CB GLU B 573 9.731 -28.242 -6.729 1.00 13.49 C ATOM 2240 CG GLU B 573 10.259 -27.420 -7.864 1.00 30.64 C ATOM 2241 CD GLU B 573 10.283 -25.933 -7.547 1.00 32.98 C ATOM 2242 OE1 GLU B 573 10.615 -25.558 -6.400 1.00 43.07 O ATOM 2243 OE2 GLU B 573 9.953 -25.140 -8.448 1.00 41.35 O ATOM 2244 H GLU B 573 8.420 -28.946 -4.647 1.00 0.00 H ATOM 2245 N VAL B 574 7.813 -30.725 -7.393 1.00 12.36 N ATOM 2246 CA VAL B 574 7.401 -31.794 -8.300 1.00 11.49 C ATOM 2247 C VAL B 574 5.912 -31.706 -8.594 1.00 10.42 C ATOM 2248 O VAL B 574 5.485 -31.886 -9.739 1.00 13.82 O ATOM 2249 CB VAL B 574 7.762 -33.165 -7.695 1.00 14.98 C ATOM 2250 CG1 VAL B 574 7.031 -34.281 -8.424 1.00 23.14 C ATOM 2251 CG2 VAL B 574 9.243 -33.390 -7.715 1.00 18.14 C ATOM 2252 H VAL B 574 8.150 -30.967 -6.439 1.00 0.00 H ATOM 2253 N LEU B 575 5.101 -31.437 -7.569 1.00 12.27 N ATOM 2254 CA LEU B 575 3.659 -31.347 -7.762 1.00 11.15 C ATOM 2255 C LEU B 575 3.302 -30.141 -8.623 1.00 11.29 C ATOM 2256 O LEU B 575 2.411 -30.222 -9.472 1.00 11.32 O ATOM 2257 CB LEU B 575 2.935 -31.268 -6.420 1.00 11.57 C ATOM 2258 CG LEU B 575 1.414 -31.186 -6.506 1.00 13.68 C ATOM 2259 CD1 LEU B 575 0.824 -32.348 -7.301 1.00 17.32 C ATOM 2260 CD2 LEU B 575 0.825 -31.170 -5.085 1.00 13.65 C ATOM 2261 H LEU B 575 5.503 -31.290 -6.621 1.00 0.00 H ATOM 2262 N LYS B 576 3.962 -29.002 -8.396 1.00 12.32 N ATOM 2263 CA LYS B 576 3.720 -27.821 -9.216 1.00 11.95 C ATOM 2264 C LYS B 576 3.988 -28.139 -10.685 1.00 13.80 C ATOM 2265 O LYS B 576 3.162 -27.852 -11.556 1.00 12.76 O ATOM 2266 CB LYS B 576 4.596 -26.660 -8.723 1.00 13.35 C ATOM 2267 CG LYS B 576 4.551 -25.375 -9.564 1.00 15.43 C ATOM 2268 CD LYS B 576 5.738 -25.291 -10.522 1.00 18.80 C ATOM 2269 CE LYS B 576 7.091 -25.310 -9.841 1.00 25.23 C ATOM 2270 NZ LYS B 576 8.238 -25.073 -10.782 1.00 28.70 N ATOM 2271 HZ1 LYS B 576 8.245 -25.814 -11.512 1.00 0.00 H ATOM 2272 HZ2 LYS B 576 8.128 -24.142 -11.233 1.00 0.00 H ATOM 2273 HZ3 LYS B 576 9.132 -25.099 -10.251 1.00 0.00 H ATOM 2274 H LYS B 576 4.658 -28.957 -7.624 1.00 0.00 H ATOM 2275 N ASP B 577 5.103 -28.802 -10.973 1.00 14.04 N ATOM 2276 CA ASP B 577 5.386 -29.154 -12.360 1.00 12.22 C ATOM 2277 C ASP B 577 4.336 -30.126 -12.906 1.00 13.23 C ATOM 2278 O ASP B 577 3.933 -30.019 -14.072 1.00 14.75 O ATOM 2279 CB ASP B 577 6.787 -29.758 -12.497 1.00 15.46 C ATOM 2280 CG ASP B 577 7.917 -28.732 -12.321 1.00 26.04 C ATOM 2281 OD1 ASP B 577 7.698 -27.514 -12.485 1.00 33.10 O ATOM 2282 OD2 ASP B 577 9.034 -29.178 -12.001 1.00 33.02 O ATOM 2283 H ASP B 577 5.767 -29.067 -10.218 1.00 0.00 H ATOM 2284 N ALA B 578 3.890 -31.089 -12.090 1.00 13.54 N ATOM 2285 CA ALA B 578 2.904 -32.065 -12.556 1.00 12.31 C ATOM 2286 C ALA B 578 1.558 -31.406 -12.853 1.00 10.48 C ATOM 2287 O ALA B 578 0.916 -31.713 -13.867 1.00 12.74 O ATOM 2288 CB ALA B 578 2.737 -33.177 -11.524 1.00 12.90 C ATOM 2289 H ALA B 578 4.248 -31.144 -11.115 1.00 0.00 H ATOM 2290 N ILE B 579 1.110 -30.488 -11.993 1.00 11.37 N ATOM 2291 CA ILE B 579 -0.151 -29.810 -12.255 1.00 9.33 C ATOM 2292 C ILE B 579 -0.053 -28.997 -13.539 1.00 11.09 C ATOM 2293 O ILE B 579 -0.974 -29.017 -14.364 1.00 13.66 O ATOM 2294 CB ILE B 579 -0.565 -28.947 -11.050 1.00 10.96 C ATOM 2295 CG1 ILE B 579 -0.974 -29.861 -9.907 1.00 12.84 C ATOM 2296 CG2 ILE B 579 -1.729 -28.031 -11.425 1.00 12.62 C ATOM 2297 CD1 ILE B 579 -1.207 -29.146 -8.565 1.00 14.43 C ATOM 2298 H ILE B 579 1.659 -30.259 -11.140 1.00 0.00 H ATOM 2299 N LYS B 580 1.060 -28.289 -13.741 1.00 12.43 N ATOM 2300 CA LYS B 580 1.210 -27.494 -14.957 1.00 13.85 C ATOM 2301 C LYS B 580 1.113 -28.384 -16.186 1.00 15.34 C ATOM 2302 O LYS B 580 0.411 -28.056 -17.153 1.00 14.41 O ATOM 2303 CB LYS B 580 2.546 -26.765 -14.949 1.00 14.86 C ATOM 2304 CG LYS B 580 2.604 -25.540 -14.078 1.00 17.90 C ATOM 2305 CD LYS B 580 3.991 -24.924 -14.184 1.00 20.01 C ATOM 2306 CE LYS B 580 4.186 -23.770 -13.231 1.00 22.16 C ATOM 2307 NZ LYS B 580 3.761 -22.485 -13.825 1.00 26.09 N ATOM 2308 HZ1 LYS B 580 4.321 -22.298 -14.681 1.00 0.00 H ATOM 2309 HZ2 LYS B 580 2.752 -22.536 -14.073 1.00 0.00 H ATOM 2310 HZ3 LYS B 580 3.912 -21.720 -13.137 1.00 0.00 H ATOM 2311 H LYS B 580 1.821 -28.303 -13.032 1.00 0.00 H ATOM 2312 N ASP B 581 1.809 -29.527 -16.156 1.00 13.77 N ATOM 2313 CA ASP B 581 1.787 -30.453 -17.282 1.00 15.44 C ATOM 2314 C ASP B 581 0.410 -31.076 -17.474 1.00 12.03 C ATOM 2315 O ASP B 581 -0.014 -31.305 -18.606 1.00 15.06 O ATOM 2316 CB ASP B 581 2.832 -31.553 -17.090 1.00 16.77 C ATOM 2317 CG ASP B 581 4.244 -31.047 -17.220 1.00 25.00 C ATOM 2318 OD1 ASP B 581 4.451 -29.953 -17.791 1.00 22.01 O ATOM 2319 OD2 ASP B 581 5.162 -31.760 -16.741 1.00 23.04 O ATOM 2320 H ASP B 581 2.375 -29.759 -15.315 1.00 0.00 H ATOM 2321 N LEU B 582 -0.291 -31.370 -16.386 1.00 12.64 N ATOM 2322 CA LEU B 582 -1.609 -31.982 -16.499 1.00 12.50 C ATOM 2323 C LEU B 582 -2.605 -31.050 -17.168 1.00 13.04 C ATOM 2324 O LEU B 582 -3.316 -31.449 -18.095 1.00 14.35 O ATOM 2325 CB LEU B 582 -2.118 -32.360 -15.119 1.00 11.96 C ATOM 2326 CG LEU B 582 -3.383 -33.210 -15.056 1.00 14.42 C ATOM 2327 CD1 LEU B 582 -3.022 -34.662 -15.293 1.00 24.13 C ATOM 2328 CD2 LEU B 582 -4.023 -32.985 -13.705 1.00 19.94 C ATOM 2329 H LEU B 582 0.103 -31.162 -15.446 1.00 0.00 H ATOM 2330 N VAL B 583 -2.736 -29.826 -16.648 1.00 12.70 N ATOM 2331 CA VAL B 583 -3.826 -28.963 -17.100 1.00 13.37 C ATOM 2332 C VAL B 583 -3.584 -28.453 -18.515 1.00 16.03 C ATOM 2333 O VAL B 583 -4.553 -28.136 -19.219 1.00 16.75 O ATOM 2334 CB VAL B 583 -4.090 -27.784 -16.141 1.00 11.68 C ATOM 2335 CG1 VAL B 583 -4.526 -28.297 -14.761 1.00 11.56 C ATOM 2336 CG2 VAL B 583 -2.909 -26.828 -16.037 1.00 14.04 C ATOM 2337 H VAL B 583 -2.067 -29.490 -15.926 1.00 0.00 H ATOM 2338 N MET B 584 -2.331 -28.416 -18.981 1.00 16.59 N ATOM 2339 CA MET B 584 -2.105 -27.870 -20.316 1.00 19.53 C ATOM 2340 C MET B 584 -2.559 -28.827 -21.404 1.00 21.59 C ATOM 2341 O MET B 584 -2.663 -28.412 -22.563 1.00 21.87 O ATOM 2342 CB MET B 584 -0.640 -27.467 -20.534 1.00 23.39 C ATOM 2343 CG MET B 584 0.377 -28.558 -20.548 1.00 27.47 C ATOM 2344 SD MET B 584 1.984 -27.917 -21.163 1.00 26.45 S ATOM 2345 CE MET B 584 2.350 -26.577 -20.024 1.00 35.10 C ATOM 2346 H MET B 584 -1.538 -28.767 -18.407 1.00 0.00 H ATOM 2347 N THR B 585 -2.885 -30.065 -21.057 1.00 18.30 N ATOM 2348 CA THR B 585 -3.437 -31.002 -22.020 1.00 16.52 C ATOM 2349 C THR B 585 -4.949 -30.879 -22.182 1.00 20.17 C ATOM 2350 O THR B 585 -5.507 -31.578 -23.032 1.00 19.40 O ATOM 2351 CB THR B 585 -3.112 -32.449 -21.625 1.00 20.32 C ATOM 2352 OG1 THR B 585 -3.926 -32.831 -20.509 1.00 20.71 O ATOM 2353 CG2 THR B 585 -1.637 -32.620 -21.283 1.00 29.51 C ATOM 2354 HG1 THR B 585 -3.740 -32.229 -19.745 1.00 0.00 H ATOM 2355 H THR B 585 -2.742 -30.372 -20.074 1.00 0.00 H ATOM 2356 N LYS B 586 -5.622 -30.012 -21.416 1.00 16.86 N ATOM 2357 CA LYS B 586 -7.078 -29.918 -21.400 1.00 16.62 C ATOM 2358 C LYS B 586 -7.567 -28.627 -22.022 1.00 15.46 C ATOM 2359 O LYS B 586 -6.813 -27.630 -22.112 1.00 19.30 O ATOM 2360 CB LYS B 586 -7.608 -30.045 -19.960 1.00 18.40 C ATOM 2361 CG LYS B 586 -7.324 -31.408 -19.330 1.00 26.55 C ATOM 2362 CD LYS B 586 -8.000 -32.539 -20.125 1.00 36.84 C ATOM 2363 CE LYS B 586 -7.214 -33.847 -19.983 1.00 62.20 C ATOM 2364 NZ LYS B 586 -6.445 -34.211 -21.225 1.00 61.74 N ATOM 2365 HZ1 LYS B 586 -7.106 -34.324 -22.020 1.00 0.00 H ATOM 2366 HZ2 LYS B 586 -5.764 -33.456 -21.444 1.00 0.00 H ATOM 2367 HZ3 LYS B 586 -5.935 -35.103 -21.066 1.00 0.00 H ATOM 2368 H LYS B 586 -5.079 -29.373 -20.801 1.00 0.00 H ATOM 2369 N PRO B 587 -8.811 -28.551 -22.485 1.00 17.31 N ATOM 2370 CA PRO B 587 -9.335 -27.307 -23.022 1.00 18.72 C ATOM 2371 C PRO B 587 -9.624 -26.320 -21.896 1.00 19.40 C ATOM 2372 O PRO B 587 -9.675 -26.677 -20.719 1.00 18.91 O ATOM 2373 CB PRO B 587 -10.610 -27.707 -23.762 1.00 23.08 C ATOM 2374 CG PRO B 587 -11.006 -29.006 -23.185 1.00 32.40 C ATOM 2375 CD PRO B 587 -9.785 -29.671 -22.622 1.00 24.08 C ATOM 2376 N ALA B 588 -9.778 -25.057 -22.290 1.00 19.38 N ATOM 2377 CA ALA B 588 -10.235 -24.028 -21.368 1.00 21.12 C ATOM 2378 C ALA B 588 -11.579 -24.440 -20.775 1.00 18.99 C ATOM 2379 O ALA B 588 -12.415 -25.031 -21.466 1.00 20.47 O ATOM 2380 CB ALA B 588 -10.359 -22.684 -22.080 1.00 23.40 C ATOM 2381 H ALA B 588 -9.568 -24.801 -23.276 1.00 0.00 H ATOM 2382 N PRO B 589 -11.831 -24.125 -19.498 1.00 18.58 N ATOM 2383 CA PRO B 589 -10.974 -23.298 -18.644 1.00 17.01 C ATOM 2384 C PRO B 589 -9.905 -24.046 -17.849 1.00 13.50 C ATOM 2385 O PRO B 589 -9.113 -23.399 -17.167 1.00 16.07 O ATOM 2386 CB PRO B 589 -11.979 -22.662 -17.681 1.00 21.82 C ATOM 2387 CG PRO B 589 -13.023 -23.737 -17.512 1.00 20.23 C ATOM 2388 CD PRO B 589 -13.153 -24.378 -18.886 1.00 21.02 C ATOM 2389 N THR B 590 -9.879 -25.380 -17.927 1.00 14.09 N ATOM 2390 CA THR B 590 -8.926 -26.143 -17.130 1.00 15.04 C ATOM 2391 C THR B 590 -7.501 -25.702 -17.423 1.00 14.44 C ATOM 2392 O THR B 590 -6.690 -25.544 -16.507 1.00 13.40 O ATOM 2393 CB THR B 590 -9.099 -27.638 -17.396 1.00 16.92 C ATOM 2394 OG1 THR B 590 -10.408 -28.038 -16.996 1.00 19.41 O ATOM 2395 CG2 THR B 590 -8.056 -28.440 -16.642 1.00 17.65 C ATOM 2396 HG1 THR B 590 -11.080 -27.528 -17.514 1.00 0.00 H ATOM 2397 H THR B 590 -10.541 -25.875 -18.558 1.00 0.00 H ATOM 2398 N CYS B 591 -7.175 -25.471 -18.691 1.00 13.88 N ATOM 2399 CA CYS B 591 -5.798 -25.116 -18.997 1.00 16.21 C ATOM 2400 C CYS B 591 -5.418 -23.739 -18.477 1.00 15.68 C ATOM 2401 O CYS B 591 -4.239 -23.391 -18.518 1.00 15.77 O ATOM 2402 CB CYS B 591 -5.545 -25.177 -20.504 1.00 18.29 C ATOM 2403 SG CYS B 591 -6.616 -24.074 -21.458 1.00 19.12 S ATOM 2404 H CYS B 591 -7.887 -25.542 -19.446 1.00 0.00 H ATOM 2405 N ASN B 592 -6.375 -22.948 -18.001 1.00 13.09 N ATOM 2406 CA ASN B 592 -6.091 -21.642 -17.425 1.00 16.13 C ATOM 2407 C ASN B 592 -5.816 -21.708 -15.931 1.00 17.25 C ATOM 2408 O ASN B 592 -5.594 -20.660 -15.308 1.00 14.77 O ATOM 2409 CB ASN B 592 -7.257 -20.689 -17.711 1.00 14.86 C ATOM 2410 CG ASN B 592 -7.489 -20.510 -19.204 1.00 18.16 C ATOM 2411 OD1 ASN B 592 -6.536 -20.534 -19.988 1.00 22.77 O ATOM 2412 ND2 ASN B 592 -8.737 -20.321 -19.597 1.00 29.65 N ATOM 2413 HD22 ASN B 592 -9.506 -20.309 -18.897 1.00 0.00 H ATOM 2414 HD21 ASN B 592 -8.949 -20.184 -20.606 1.00 0.00 H ATOM 2415 H ASN B 592 -7.362 -23.274 -18.042 1.00 0.00 H ATOM 2416 N ILE B 593 -5.824 -22.904 -15.338 1.00 14.25 N ATOM 2417 CA ILE B 593 -5.463 -23.045 -13.935 1.00 11.04 C ATOM 2418 C ILE B 593 -3.990 -22.716 -13.787 1.00 11.04 C ATOM 2419 O ILE B 593 -3.163 -23.086 -14.636 1.00 14.15 O ATOM 2420 CB ILE B 593 -5.777 -24.458 -13.430 1.00 10.64 C ATOM 2421 CG1 ILE B 593 -7.293 -24.649 -13.374 1.00 11.81 C ATOM 2422 CG2 ILE B 593 -5.134 -24.700 -12.089 1.00 12.84 C ATOM 2423 CD1 ILE B 593 -7.732 -26.062 -13.104 1.00 14.37 C ATOM 2424 H ILE B 593 -6.092 -23.746 -15.886 1.00 0.00 H ATOM 2425 N ARG B 594 -3.673 -21.983 -12.726 1.00 10.90 N ATOM 2426 CA ARG B 594 -2.321 -21.537 -12.443 1.00 11.82 C ATOM 2427 C ARG B 594 -1.867 -22.138 -11.124 1.00 10.93 C ATOM 2428 O ARG B 594 -2.676 -22.417 -10.227 1.00 11.90 O ATOM 2429 CB ARG B 594 -2.229 -20.016 -12.324 1.00 15.62 C ATOM 2430 CG ARG B 594 -2.921 -19.228 -13.408 1.00 25.67 C ATOM 2431 CD ARG B 594 -1.953 -18.808 -14.471 1.00 28.96 C ATOM 2432 NE ARG B 594 -0.767 -18.105 -13.975 1.00 30.08 N ATOM 2433 CZ ARG B 594 -0.623 -16.783 -13.906 1.00 32.34 C ATOM 2434 NH1 ARG B 594 -1.606 -15.964 -14.278 1.00 31.45 N ATOM 2435 NH2 ARG B 594 0.521 -16.279 -13.460 1.00 39.68 N ATOM 2436 HE ARG B 594 0.030 -18.688 -13.649 1.00 0.00 H ATOM 2437 HH12 ARG B 594 -1.476 -14.934 -14.217 1.00 0.00 H ATOM 2438 HH11 ARG B 594 -2.504 -16.355 -14.629 1.00 0.00 H ATOM 2439 HH22 ARG B 594 0.647 -15.248 -13.401 1.00 0.00 H ATOM 2440 HH21 ARG B 594 1.291 -16.915 -13.170 1.00 0.00 H ATOM 2441 H ARG B 594 -4.430 -21.715 -12.066 1.00 0.00 H ATOM 2442 N VAL B 595 -0.559 -22.271 -10.972 1.00 10.63 N ATOM 2443 CA VAL B 595 -0.025 -22.875 -9.759 1.00 10.81 C ATOM 2444 C VAL B 595 1.337 -22.289 -9.441 1.00 11.81 C ATOM 2445 O VAL B 595 2.175 -22.088 -10.323 1.00 13.34 O ATOM 2446 CB VAL B 595 0.034 -24.406 -9.902 1.00 13.95 C ATOM 2447 CG1 VAL B 595 0.823 -24.819 -11.101 1.00 19.11 C ATOM 2448 CG2 VAL B 595 0.667 -24.998 -8.737 1.00 17.78 C ATOM 2449 H VAL B 595 0.087 -21.944 -11.718 1.00 0.00 H ATOM 2450 N THR B 596 1.562 -22.063 -8.150 1.00 10.95 N ATOM 2451 CA THR B 596 2.869 -21.684 -7.645 1.00 10.99 C ATOM 2452 C THR B 596 3.187 -22.463 -6.377 1.00 10.79 C ATOM 2453 O THR B 596 2.307 -22.756 -5.564 1.00 10.49 O ATOM 2454 CB THR B 596 2.976 -20.174 -7.331 1.00 11.52 C ATOM 2455 OG1 THR B 596 4.284 -19.881 -6.791 1.00 13.31 O ATOM 2456 CG2 THR B 596 1.943 -19.708 -6.323 1.00 12.46 C ATOM 2457 HG1 THR B 596 4.420 -20.400 -5.959 1.00 0.00 H ATOM 2458 H THR B 596 0.774 -22.161 -7.479 1.00 0.00 H ATOM 2459 N VAL B 597 4.465 -22.795 -6.217 1.00 11.13 N ATOM 2460 CA VAL B 597 4.942 -23.308 -4.940 1.00 11.18 C ATOM 2461 C VAL B 597 4.824 -22.213 -3.899 1.00 11.67 C ATOM 2462 O VAL B 597 4.992 -21.020 -4.199 1.00 12.33 O ATOM 2463 CB VAL B 597 6.400 -23.787 -5.047 1.00 11.86 C ATOM 2464 CG1 VAL B 597 6.969 -24.109 -3.680 1.00 12.07 C ATOM 2465 CG2 VAL B 597 6.502 -24.994 -5.960 1.00 13.50 C ATOM 2466 H VAL B 597 5.129 -22.687 -7.010 1.00 0.00 H ATOM 2467 N CYS B 598 4.529 -22.606 -2.665 1.00 12.50 N ATOM 2468 CA CYS B 598 4.597 -21.673 -1.562 1.00 12.94 C ATOM 2469 C CYS B 598 5.330 -22.329 -0.410 1.00 14.10 C ATOM 2470 O CYS B 598 5.497 -23.549 -0.351 1.00 15.59 O ATOM 2471 CB CYS B 598 3.206 -21.191 -1.150 1.00 19.62 C ATOM 2472 SG CYS B 598 2.055 -22.468 -0.779 1.00 20.57 S ATOM 2473 H CYS B 598 4.247 -23.592 -2.491 1.00 0.00 H ATOM 2474 N SER B 599 5.823 -21.495 0.484 1.00 12.91 N ATOM 2475 CA SER B 599 6.506 -21.992 1.668 1.00 12.70 C ATOM 2476 C SER B 599 5.997 -21.221 2.871 1.00 13.82 C ATOM 2477 O SER B 599 5.627 -20.049 2.760 1.00 14.68 O ATOM 2478 CB SER B 599 8.027 -21.869 1.542 1.00 14.83 C ATOM 2479 OG SER B 599 8.416 -20.520 1.444 1.00 28.48 O ATOM 2480 HG SER B 599 7.996 -20.114 0.645 1.00 0.00 H ATOM 2481 H SER B 599 5.722 -20.470 0.341 1.00 0.00 H ATOM 2482 N PHE B 600 5.960 -21.909 4.020 1.00 10.33 N ATOM 2483 CA PHE B 600 5.503 -21.340 5.296 1.00 11.27 C ATOM 2484 C PHE B 600 6.696 -21.266 6.246 1.00 11.85 C ATOM 2485 O PHE B 600 7.213 -22.311 6.671 1.00 12.96 O ATOM 2486 CB PHE B 600 4.377 -22.179 5.914 1.00 11.17 C ATOM 2487 CG PHE B 600 3.242 -22.411 4.997 1.00 11.68 C ATOM 2488 CD1 PHE B 600 2.324 -21.420 4.789 1.00 12.73 C ATOM 2489 CD2 PHE B 600 3.117 -23.610 4.315 1.00 11.86 C ATOM 2490 CE1 PHE B 600 1.290 -21.606 3.928 1.00 13.65 C ATOM 2491 CE2 PHE B 600 2.091 -23.806 3.434 1.00 12.97 C ATOM 2492 CZ PHE B 600 1.167 -22.799 3.251 1.00 13.08 C ATOM 2493 H PHE B 600 6.272 -22.901 4.009 1.00 0.00 H ATOM 2494 N ASP B 601 7.119 -20.041 6.599 1.00 10.76 N ATOM 2495 CA ASP B 601 8.384 -19.872 7.327 1.00 11.17 C ATOM 2496 C ASP B 601 8.409 -20.732 8.583 1.00 11.56 C ATOM 2497 O ASP B 601 9.410 -21.398 8.880 1.00 15.11 O ATOM 2498 CB ASP B 601 8.624 -18.410 7.732 1.00 11.86 C ATOM 2499 CG ASP B 601 9.068 -17.534 6.586 1.00 23.00 C ATOM 2500 OD1 ASP B 601 8.969 -17.978 5.431 1.00 22.97 O ATOM 2501 OD2 ASP B 601 9.479 -16.385 6.857 1.00 19.43 O ATOM 2502 H ASP B 601 6.548 -19.207 6.355 1.00 0.00 H ATOM 2503 N ASP B 602 7.314 -20.717 9.350 1.00 11.10 N ATOM 2504 CA ASP B 602 7.225 -21.403 10.634 1.00 11.45 C ATOM 2505 C ASP B 602 6.362 -22.655 10.558 1.00 12.63 C ATOM 2506 O ASP B 602 6.091 -23.288 11.592 1.00 13.32 O ATOM 2507 CB ASP B 602 6.705 -20.426 11.699 1.00 13.35 C ATOM 2508 CG ASP B 602 7.674 -19.248 11.932 1.00 16.21 C ATOM 2509 OD1 ASP B 602 8.905 -19.455 11.848 1.00 19.84 O ATOM 2510 OD2 ASP B 602 7.220 -18.117 12.192 1.00 19.69 O ATOM 2511 H ASP B 602 6.483 -20.189 9.014 1.00 0.00 H ATOM 2512 N GLY B 603 5.932 -23.033 9.355 1.00 11.39 N ATOM 2513 CA GLY B 603 5.037 -24.151 9.161 1.00 13.92 C ATOM 2514 C GLY B 603 3.623 -23.776 9.537 1.00 9.99 C ATOM 2515 O GLY B 603 3.365 -22.716 10.084 1.00 14.01 O ATOM 2516 H GLY B 603 6.254 -22.502 8.521 1.00 0.00 H ATOM 2517 N VAL B 604 2.682 -24.651 9.177 1.00 10.38 N ATOM 2518 CA VAL B 604 1.289 -24.511 9.585 1.00 10.95 C ATOM 2519 C VAL B 604 0.929 -25.702 10.464 1.00 11.05 C ATOM 2520 O VAL B 604 1.054 -26.855 10.041 1.00 12.51 O ATOM 2521 CB VAL B 604 0.363 -24.420 8.371 1.00 11.66 C ATOM 2522 CG1 VAL B 604 -1.088 -24.348 8.852 1.00 10.94 C ATOM 2523 CG2 VAL B 604 0.727 -23.212 7.490 1.00 13.24 C ATOM 2524 H VAL B 604 2.952 -25.462 8.584 1.00 0.00 H ATOM 2525 N ASP B 605 0.484 -25.420 11.685 1.00 11.23 N ATOM 2526 CA ASP B 605 0.122 -26.460 12.648 1.00 11.42 C ATOM 2527 C ASP B 605 -1.322 -26.877 12.379 1.00 11.27 C ATOM 2528 O ASP B 605 -2.275 -26.485 13.062 1.00 15.15 O ATOM 2529 CB ASP B 605 0.335 -25.968 14.069 1.00 14.33 C ATOM 2530 CG ASP B 605 1.817 -25.907 14.468 1.00 29.22 C ATOM 2531 OD1 ASP B 605 2.685 -26.377 13.698 1.00 35.70 O ATOM 2532 OD2 ASP B 605 2.109 -25.395 15.578 1.00 31.57 O ATOM 2533 H ASP B 605 0.390 -24.423 11.966 1.00 0.00 H ATOM 2534 N LEU B 606 -1.466 -27.691 11.330 1.00 12.07 N ATOM 2535 CA LEU B 606 -2.765 -28.243 10.997 1.00 12.22 C ATOM 2536 C LEU B 606 -3.281 -29.073 12.172 1.00 13.83 C ATOM 2537 O LEU B 606 -2.503 -29.804 12.810 1.00 16.08 O ATOM 2538 CB LEU B 606 -2.673 -29.109 9.750 1.00 10.19 C ATOM 2539 CG LEU B 606 -2.314 -28.376 8.454 1.00 9.72 C ATOM 2540 CD1 LEU B 606 -2.203 -29.405 7.339 1.00 11.33 C ATOM 2541 CD2 LEU B 606 -3.341 -27.316 8.026 1.00 10.75 C ATOM 2542 H LEU B 606 -0.639 -27.931 10.747 1.00 0.00 H ATOM 2543 N PRO B 607 -4.582 -28.983 12.487 1.00 13.31 N ATOM 2544 CA PRO B 607 -5.077 -29.570 13.745 1.00 16.60 C ATOM 2545 C PRO B 607 -5.189 -31.088 13.778 1.00 31.25 C ATOM 2546 O PRO B 607 -5.301 -31.686 14.865 1.00 32.66 O ATOM 2547 CB PRO B 607 -6.469 -28.937 13.897 1.00 24.14 C ATOM 2548 CG PRO B 607 -6.889 -28.545 12.481 1.00 15.11 C ATOM 2549 CD PRO B 607 -5.591 -28.149 11.811 1.00 14.48 C ATOM 2550 OXT PRO B 607 -5.191 -31.764 12.755 1.00 19.97 O TER 2551 PRO B 607 HETATM 2552 O HOH 1 -14.974 -34.149 -0.711 1.00 37.87 O HETATM 2553 O HOH 2 7.863 -20.824 -1.878 1.00 41.62 O HETATM 2554 O HOH 3 9.230 -7.498 12.557 1.00 32.56 O HETATM 2555 O HOH 4 -15.723 -6.597 15.700 1.00 29.19 O HETATM 2556 O HOH 5 -6.239 4.751 19.346 1.00 41.12 O HETATM 2557 O HOH 6 -11.095 -12.154 22.345 1.00 36.19 O HETATM 2558 O HOH 7 10.463 -4.059 12.434 1.00 35.57 O HETATM 2559 O HOH 8 -1.492 1.586 7.314 1.00 29.10 O HETATM 2560 O HOH 9 5.034 -17.928 13.614 1.00 23.15 O HETATM 2561 O HOH 10 -12.599 -22.783 15.054 1.00 37.69 O HETATM 2562 O HOH 11 -18.747 1.089 26.845 1.00 32.01 O HETATM 2563 O HOH 12 7.653 -6.339 18.860 1.00 40.26 O HETATM 2564 O HOH 13 -4.694 2.764 8.571 1.00 37.48 O HETATM 2565 O HOH 14 5.340 -17.435 18.458 1.00 39.20 O HETATM 2566 O HOH 15 9.890 -1.484 -2.839 1.00 23.19 O HETATM 2567 O HOH 16 -14.865 -30.889 11.174 1.00 36.12 O HETATM 2568 O HOH 17 -15.635 -27.666 0.899 1.00 30.69 O HETATM 2569 O HOH 18 4.664 0.406 -10.005 1.00 32.11 O HETATM 2570 O HOH 19 2.323 -21.269 12.093 1.00 13.03 O HETATM 2571 O HOH 20 9.408 -17.999 -2.534 1.00 26.51 O HETATM 2572 O HOH 21 9.239 -16.890 -10.730 1.00 28.16 O HETATM 2573 O HOH 22 -4.370 -13.211 26.946 1.00 30.01 O HETATM 2574 O HOH 23 7.949 -10.413 -8.902 1.00 32.25 O HETATM 2575 O HOH 24 6.460 -2.836 13.691 1.00 18.96 O HETATM 2576 O HOH 25 0.618 3.200 11.448 1.00 26.83 O HETATM 2577 O HOH 26 -9.968 -22.457 1.575 1.00 14.52 O HETATM 2578 O HOH 27 -7.896 -0.072 4.073 1.00 29.80 O HETATM 2579 O HOH 28 3.780 3.330 17.643 1.00 24.30 O HETATM 2580 O HOH 29 11.991 -22.420 -5.137 1.00 41.44 O HETATM 2581 O HOH 30 -12.124 -21.841 19.550 1.00 25.90 O HETATM 2582 O HOH 31 -2.075 -9.070 -10.089 1.00 25.56 O HETATM 2583 O HOH 32 -11.830 -15.807 27.547 1.00 35.63 O HETATM 2584 O HOH 33 6.570 -7.249 -5.252 1.00 13.46 O HETATM 2585 O HOH 34 9.158 -15.425 9.514 1.00 18.62 O HETATM 2586 O HOH 35 1.881 -5.152 0.323 1.00 19.17 O HETATM 2587 O HOH 36 6.422 -22.239 -8.274 1.00 13.48 O HETATM 2588 O HOH 37 -7.930 -33.414 6.471 1.00 14.38 O HETATM 2589 O HOH 38 -17.487 -8.004 20.350 1.00 33.83 O HETATM 2590 O HOH 39 -13.952 -21.715 1.787 1.00 20.20 O HETATM 2591 O HOH 40 5.725 0.398 6.353 1.00 16.90 O HETATM 2592 O HOH 41 9.739 -20.964 -9.545 1.00 18.95 O HETATM 2593 O HOH 42 0.259 -15.555 17.482 1.00 15.55 O HETATM 2594 O HOH 43 7.838 -14.007 2.595 1.00 18.26 O HETATM 2595 O HOH 44 -0.020 -2.895 -2.344 1.00 32.21 O HETATM 2596 O HOH 45 5.078 -5.544 16.491 1.00 15.79 O HETATM 2597 O HOH 46 2.234 -7.816 23.248 1.00 23.25 O HETATM 2598 O HOH 47 11.153 -17.448 -7.077 1.00 25.79 O HETATM 2599 O HOH 48 -1.654 -13.699 26.333 1.00 32.01 O HETATM 2600 O HOH 49 -6.264 -14.358 -11.238 1.00 23.40 O HETATM 2601 O HOH 50 -16.536 3.333 17.243 1.00 31.46 O HETATM 2602 O HOH 51 -8.421 1.909 5.605 1.00 31.67 O HETATM 2603 O HOH 52 -0.768 -14.924 22.040 1.00 15.03 O HETATM 2604 O HOH 53 1.660 -11.183 -8.623 1.00 14.36 O HETATM 2605 O HOH 54 -18.869 8.829 19.251 1.00 37.44 O HETATM 2606 O HOH 55 -7.467 -40.940 10.435 1.00 39.17 O HETATM 2607 O HOH 56 -4.200 -6.473 27.483 1.00 23.34 O HETATM 2608 O HOH 57 10.841 2.075 15.799 1.00 36.08 O HETATM 2609 O HOH 58 10.506 -18.452 1.751 1.00 39.26 O HETATM 2610 O HOH 59 -6.149 -3.423 19.940 1.00 19.42 O HETATM 2611 O HOH 60 -14.509 -3.783 21.962 1.00 23.06 O HETATM 2612 O HOH 61 -8.506 -9.516 -14.011 1.00 27.85 O HETATM 2613 O HOH 62 -8.723 -21.273 20.581 1.00 21.76 O HETATM 2614 O HOH 63 -3.614 -22.056 19.300 1.00 34.79 O HETATM 2615 O HOH 64 -4.264 -4.312 23.537 1.00 30.33 O HETATM 2616 O HOH 65 -6.776 -0.811 -0.716 1.00 17.16 O HETATM 2617 O HOH 66 7.718 -8.474 17.797 1.00 36.70 O HETATM 2618 O HOH 67 -16.159 -25.129 4.042 1.00 33.23 O HETATM 2619 O HOH 68 12.191 -10.820 12.354 1.00 16.86 O HETATM 2620 O HOH 69 8.530 -15.159 -3.406 1.00 29.28 O HETATM 2621 O HOH 70 -11.767 -11.342 0.980 1.00 11.85 O HETATM 2622 O HOH 71 -4.720 -19.629 25.922 1.00 37.24 O HETATM 2623 O HOH 72 0.956 -14.249 19.932 1.00 14.94 O HETATM 2624 O HOH 73 6.880 -3.916 17.711 1.00 24.90 O HETATM 2625 O HOH 74 -1.149 -17.995 19.755 1.00 17.38 O HETATM 2626 O HOH 75 -13.908 -30.948 1.857 1.00 20.75 O HETATM 2627 O HOH 76 11.049 -10.765 14.812 1.00 25.82 O HETATM 2628 O HOH 77 -14.227 -19.249 2.037 1.00 24.98 O HETATM 2629 O HOH 78 4.808 -6.924 -12.809 1.00 37.43 O HETATM 2630 O HOH 79 -10.943 -40.518 11.743 1.00 45.90 O HETATM 2631 O HOH 80 5.967 -5.532 13.791 1.00 12.89 O HETATM 2632 O HOH 81 4.765 -0.761 8.789 1.00 18.92 O HETATM 2633 O HOH 82 -14.567 -33.370 8.505 1.00 25.70 O HETATM 2634 O HOH 83 -8.422 -41.350 2.910 1.00 20.42 O HETATM 2635 O HOH 84 -3.079 3.817 16.567 1.00 34.11 O HETATM 2636 O HOH 85 8.596 4.960 14.074 1.00 39.23 O HETATM 2637 O HOH 86 -11.021 -8.702 -12.148 1.00 22.12 O HETATM 2638 O HOH 87 -17.522 -36.241 8.975 1.00 38.94 O HETATM 2639 O HOH 88 -13.710 -10.899 8.529 1.00 15.88 O HETATM 2640 O HOH 89 -8.116 -39.127 14.285 1.00 39.13 O HETATM 2641 O HOH 90 10.273 -12.738 -4.242 1.00 28.24 O HETATM 2642 O HOH 91 -15.520 -23.893 11.950 1.00 33.75 O HETATM 2643 O HOH 92 8.443 -14.242 -7.937 1.00 37.04 O HETATM 2644 O HOH 93 7.292 -8.118 21.408 1.00 37.71 O HETATM 2645 O HOH 94 4.483 -15.725 -12.443 1.00 41.82 O HETATM 2646 O HOH 95 -10.351 4.596 21.571 1.00 23.99 O HETATM 2647 O HOH 96 -14.917 -14.250 5.129 1.00 12.06 O HETATM 2648 O HOH 97 -7.799 -21.301 25.373 1.00 37.73 O HETATM 2649 O HOH 98 -14.557 1.423 11.218 1.00 44.60 O HETATM 2650 O HOH 99 -10.437 -20.867 14.013 1.00 16.75 O HETATM 2651 O HOH 100 -1.990 -39.565 9.290 1.00 23.26 O HETATM 2652 O HOH 101 -9.123 -41.962 7.772 1.00 33.22 O HETATM 2653 O HOH 102 -15.130 -16.508 19.870 1.00 32.98 O HETATM 2654 O HOH 103 -3.380 -1.140 -2.911 1.00 18.76 O HETATM 2655 O HOH 104 -7.964 -15.402 28.428 1.00 27.19 O HETATM 2656 O HOH 105 -15.873 -9.528 4.576 1.00 20.47 O HETATM 2657 O HOH 106 -12.744 -3.662 7.382 1.00 23.47 O HETATM 2658 O HOH 107 6.546 1.019 -5.015 1.00 33.56 O HETATM 2659 O HOH 108 3.779 -20.423 14.092 1.00 21.60 O HETATM 2660 O HOH 109 -14.828 -21.233 15.793 1.00 18.56 O HETATM 2661 O HOH 110 -11.500 -43.394 6.179 1.00 41.88 O HETATM 2662 O HOH 111 4.372 -9.167 22.822 1.00 32.01 O HETATM 2663 O HOH 112 0.409 -5.369 -9.992 1.00 24.14 O HETATM 2664 O HOH 113 10.330 -8.209 -0.990 1.00 16.79 O HETATM 2665 O HOH 114 11.945 -14.867 10.996 1.00 35.23 O HETATM 2666 O HOH 115 -25.223 10.643 21.499 1.00 29.80 O HETATM 2667 O HOH 116 -8.100 7.928 23.804 1.00 26.21 O HETATM 2668 O HOH 117 11.358 -7.121 1.422 1.00 13.50 O HETATM 2669 O HOH 118 11.653 1.643 11.211 1.00 20.88 O HETATM 2670 O HOH 119 -17.207 -5.943 18.812 1.00 26.46 O HETATM 2671 O HOH 120 -11.194 -10.831 18.501 1.00 25.35 O HETATM 2672 O HOH 121 5.916 6.642 12.377 1.00 38.15 O HETATM 2673 O HOH 122 -6.740 -22.243 18.511 1.00 35.80 O HETATM 2674 O HOH 123 -15.134 -32.344 5.500 1.00 17.73 O HETATM 2675 O HOH 124 -9.992 2.129 14.027 1.00 27.91 O HETATM 2676 O HOH 125 -16.629 -18.303 16.765 1.00 19.28 O HETATM 2677 O HOH 126 -7.716 -6.976 25.976 1.00 20.49 O HETATM 2678 O HOH 127 -16.792 -9.972 18.633 1.00 36.63 O HETATM 2679 O HOH 128 -12.924 -13.350 24.034 1.00 36.24 O HETATM 2680 O HOH 129 -2.361 -24.018 17.535 1.00 35.45 O HETATM 2681 O HOH 130 2.193 -1.628 -6.559 1.00 24.77 O HETATM 2682 O HOH 131 -14.812 -22.830 3.897 1.00 33.76 O HETATM 2683 O HOH 132 -16.310 -19.108 6.329 1.00 32.48 O HETATM 2684 O HOH 133 -5.368 7.488 22.880 1.00 24.75 O HETATM 2685 O HOH 134 -0.880 3.295 5.173 1.00 44.46 O HETATM 2686 O HOH 135 -13.802 -42.235 7.678 1.00 38.90 O HETATM 2687 O HOH 136 -17.792 -28.408 3.843 1.00 48.03 O HETATM 2688 O HOH 137 -17.561 -10.409 15.419 1.00 35.62 O HETATM 2689 O HOH 138 9.810 3.036 -7.902 1.00 39.07 O HETATM 2690 O HOH 139 10.514 -1.365 -6.008 1.00 29.00 O HETATM 2691 O HOH 140 1.924 -17.724 16.072 1.00 14.12 O HETATM 2692 O HOH 141 11.336 -3.515 -1.750 1.00 29.14 O HETATM 2693 O HOH 142 3.366 -12.627 -10.076 1.00 30.21 O HETATM 2694 O HOH 143 -12.689 -41.823 1.214 1.00 45.69 O HETATM 2695 O HOH 144 -15.861 -4.928 6.470 1.00 30.60 O HETATM 2696 O HOH 145 -14.422 -20.217 8.121 1.00 23.61 O HETATM 2697 O HOH 146 -6.739 -9.314 28.098 1.00 38.88 O HETATM 2698 O HOH 147 -16.372 -16.769 4.967 1.00 31.81 O HETATM 2699 O HOH 148 9.060 -8.190 -5.725 1.00 24.24 O HETATM 2700 O HOH 149 -9.763 -20.628 24.413 1.00 47.57 O HETATM 2701 O HOH 150 -9.770 -22.783 16.167 1.00 35.15 O HETATM 2702 O HOH 151 5.058 2.778 9.088 1.00 32.27 O HETATM 2703 O HOH 152 8.745 -6.230 13.778 1.00 25.30 O HETATM 2704 O HOH 153 -10.708 -29.612 14.391 1.00 23.05 O HETATM 2705 O HOH 154 0.630 -9.521 -10.679 1.00 28.98 O HETATM 2706 O HOH 155 -16.014 -12.703 7.206 1.00 18.42 O HETATM 2707 O HOH 156 12.385 -14.418 -2.407 1.00 37.77 O HETATM 2708 O HOH 157 3.189 2.672 1.675 1.00 30.43 O HETATM 2709 O HOH 158 5.216 1.498 -7.239 1.00 45.88 O HETATM 2710 O HOH 159 -16.202 -21.851 9.216 1.00 28.51 O HETATM 2711 O HOH 160 -11.353 -19.447 24.836 1.00 40.32 O HETATM 2712 O HOH 161 -4.841 1.085 -1.778 1.00 26.57 O HETATM 2713 O HOH 162 -14.773 -2.734 7.755 1.00 54.38 O HETATM 2714 O HOH 163 -17.201 10.618 22.197 1.00 37.71 O HETATM 2715 O HOH 164 2.305 -1.132 -9.397 1.00 37.62 O HETATM 2716 O HOH 165 8.687 -3.376 15.859 1.00 27.53 O HETATM 2717 O HOH 166 6.657 -12.576 -9.132 1.00 32.57 O HETATM 2718 O HOH 167 -2.716 1.466 -0.510 1.00 31.50 O HETATM 2719 O HOH 168 -1.106 -20.578 20.292 1.00 45.52 O HETATM 2720 O HOH 169 -27.975 7.082 21.878 1.00 33.19 O HETATM 2721 O HOH 170 -1.175 4.890 15.684 1.00 45.43 O HETATM 2722 O HOH 171 7.589 -14.877 -11.721 1.00 43.65 O HETATM 2723 O HOH 172 -16.298 -0.859 7.733 1.00 37.91 O HETATM 2724 O HOH 173 13.338 -8.553 2.940 1.00 16.59 O HETATM 2725 O HOH 174 1.544 4.042 6.854 1.00 41.08 O HETATM 2726 O HOH 175 -18.774 -18.598 14.753 1.00 35.85 O HETATM 2727 O HOH 176 -10.620 -9.636 22.358 1.00 19.83 O HETATM 2728 O HOH 177 -0.311 -15.869 24.280 1.00 36.90 O HETATM 2729 O HOH 178 11.247 -15.732 1.335 1.00 46.46 O HETATM 2730 O HOH 179 -12.040 -23.866 17.640 1.00 42.23 O HETATM 2731 O HOH 180 -2.937 4.850 9.019 1.00 42.04 O HETATM 2732 O HOH 181 -7.985 -23.758 16.952 1.00 41.76 O HETATM 2733 O HOH 182 1.113 -7.245 -11.736 1.00 34.02 O HETATM 2734 O HOH 183 -9.796 -8.836 19.866 1.00 17.70 O HETATM 2735 O HOH 184 12.516 -1.052 -9.339 1.00 35.26 O HETATM 2736 O HOH 185 5.696 3.109 6.896 1.00 31.32 O HETATM 2737 O HOH 186 -7.559 -41.747 5.548 1.00 29.53 O HETATM 2738 O HOH 187 -8.558 3.826 19.838 1.00 32.33 O HETATM 2739 O HOH 188 2.485 -5.679 -14.029 1.00 34.05 O HETATM 2740 O HOH 189 -11.904 -2.445 4.977 1.00 33.03 O HETATM 2741 O HOH 190 12.783 -14.305 0.546 1.00 48.39 O HETATM 2742 O HOH 191 -17.269 -30.864 5.384 1.00 40.86 O HETATM 2743 O HOH 192 10.166 0.706 18.590 1.00 37.34 O HETATM 2744 O HOH 193 10.394 -21.307 -12.309 1.00 42.01 O HETATM 2745 O HOH 194 -18.994 -16.403 12.721 1.00 42.50 O HETATM 2746 O HOH 195 6.561 -20.700 15.634 1.00 45.64 O HETATM 2747 O HOH 196 -18.754 0.157 11.287 1.00 32.55 O HETATM 2748 O HOH 197 -3.078 4.154 0.755 1.00 40.03 O HETATM 2749 O HOH 198 3.862 -18.301 19.563 1.00 56.02 O HETATM 2750 O HOH 199 9.282 -6.402 16.393 1.00 42.21 O HETATM 2751 O HOH 200 10.817 -9.239 -3.908 1.00 38.51 O HETATM 2752 O HOH 201 -11.856 -42.607 10.214 1.00 48.98 O HETATM 2753 O HOH 202 2.337 -3.126 -13.321 1.00 24.61 O HETATM 2754 O HOH 203 -5.901 -41.039 1.660 1.00 20.42 O HETATM 2755 O HOH 204 1.069 -2.852 -10.903 1.00 25.20 O HETATM 2756 O HOH 205 1.623 0.898 -5.624 1.00 40.68 O HETATM 2757 O HOH 206 -4.090 -40.878 7.922 1.00 34.37 O HETATM 2758 O HOH 207 -12.742 -31.289 14.905 1.00 39.26 O HETATM 2759 O HOH 208 12.181 -17.849 -2.502 1.00 30.18 O HETATM 2760 O HOH 209 11.980 -19.588 -8.659 1.00 20.48 O HETATM 2761 O HOH 210 -1.166 5.046 11.375 1.00 45.66 O HETATM 2762 O HOH 211 1.421 -18.173 19.852 1.00 34.26 O HETATM 2763 O HOH 212 -17.022 -22.664 11.268 1.00 43.12 O HETATM 2764 O HOH 213 -16.582 -25.049 1.160 1.00 21.99 O HETATM 2765 O HOH 214 -0.579 -0.599 -2.824 1.00 35.68 O HETATM 2766 O HOH 215 -16.761 -22.202 14.024 1.00 34.89 O HETATM 2767 O HOH 216 8.299 4.290 17.007 1.00 37.09 O HETATM 2768 O HOH 217 3.292 -15.357 20.490 1.00 35.45 O HETATM 2769 O HOH 218 -9.959 -42.889 1.338 1.00 40.20 O HETATM 2770 O HOH 219 -5.603 -42.195 9.894 1.00 37.32 O HETATM 2771 O HOH 220 -12.204 -13.382 29.224 1.00 36.61 O HETATM 2772 O HOH 221 12.719 1.598 -13.389 1.00 46.99 O HETATM 2773 O HOH 222 -10.279 -28.190 16.918 1.00 27.13 O HETATM 2774 O HOH 223 -18.753 -20.985 13.732 1.00 35.04 O HETATM 2775 O HOH 224 -7.431 3.423 1.225 1.00 35.06 O HETATM 2776 O HOH 225 -5.499 4.446 0.331 1.00 36.70 O HETATM 2777 O HOH 226 -6.859 -40.781 -16.880 1.00 32.28 O HETATM 2778 O HOH 227 -20.374 -14.126 -3.851 1.00 26.44 O HETATM 2779 O HOH 228 9.629 -35.850 -20.529 1.00 22.46 O HETATM 2780 O HOH 229 -18.307 -12.312 -7.149 1.00 32.60 O HETATM 2781 O HOH 230 8.632 -39.898 2.411 1.00 39.92 O HETATM 2782 O HOH 231 1.958 -38.830 -18.277 1.00 30.20 O HETATM 2783 O HOH 232 -12.670 -30.752 -4.558 1.00 30.24 O HETATM 2784 O HOH 233 7.237 -41.946 -7.393 1.00 50.88 O HETATM 2785 O HOH 234 12.413 -32.124 8.218 1.00 33.55 O HETATM 2786 O HOH 235 1.955 -34.309 10.677 1.00 22.91 O HETATM 2787 O HOH 236 8.245 -37.793 -6.695 1.00 30.25 O HETATM 2788 O HOH 237 1.050 -19.833 -14.587 1.00 43.54 O HETATM 2789 O HOH 238 9.056 -22.820 -7.755 1.00 16.90 O HETATM 2790 O HOH 239 9.637 -21.786 -1.637 1.00 36.06 O HETATM 2791 O HOH 240 1.285 -17.957 -9.894 1.00 16.28 O HETATM 2792 O HOH 241 -10.127 -18.243 2.070 1.00 14.29 O HETATM 2793 O HOH 242 -16.567 -15.979 -0.140 1.00 24.41 O HETATM 2794 O HOH 243 -10.237 1.577 -1.752 1.00 31.89 O HETATM 2795 O HOH 244 -14.868 -31.580 -16.723 1.00 36.69 O HETATM 2796 O HOH 245 10.512 -17.466 11.193 1.00 37.20 O HETATM 2797 O HOH 246 10.163 -41.524 10.457 1.00 17.80 O HETATM 2798 O HOH 247 -11.774 -28.252 -19.252 1.00 40.92 O HETATM 2799 O HOH 248 3.954 -20.736 -11.741 1.00 19.45 O HETATM 2800 O HOH 249 -8.688 0.586 -13.482 1.00 41.29 O HETATM 2801 O HOH 250 -13.609 -18.083 -11.650 1.00 22.99 O HETATM 2802 O HOH 251 -8.091 3.589 -11.889 1.00 28.42 O HETATM 2803 O HOH 252 -20.351 -21.435 -4.709 1.00 21.91 O HETATM 2804 O HOH 253 -3.965 -19.820 -19.920 1.00 32.54 O HETATM 2805 O HOH 254 -5.661 -26.607 -24.293 1.00 37.69 O HETATM 2806 O HOH 255 -1.976 0.487 -10.252 1.00 22.46 O HETATM 2807 O HOH 256 -14.137 -28.524 -16.066 1.00 37.25 O HETATM 2808 O HOH 257 -2.684 -25.901 -23.490 1.00 32.36 O HETATM 2809 O HOH 258 -12.271 -34.128 -16.773 1.00 28.16 O HETATM 2810 O HOH 259 6.703 -16.410 10.187 1.00 12.44 O HETATM 2811 O HOH 260 -6.334 -40.274 -0.781 1.00 25.47 O HETATM 2812 O HOH 261 8.370 -31.539 7.161 1.00 13.22 O HETATM 2813 O HOH 262 -2.007 -24.705 -19.245 1.00 17.25 O HETATM 2814 O HOH 263 -13.457 -19.241 -15.964 1.00 41.30 O HETATM 2815 O HOH 264 3.927 -22.079 -16.492 1.00 35.20 O HETATM 2816 O HOH 265 -4.439 -39.485 3.482 1.00 20.03 O HETATM 2817 O HOH 266 5.858 -41.743 5.104 1.00 36.84 O HETATM 2818 O HOH 267 11.949 -36.535 3.801 1.00 37.08 O HETATM 2819 O HOH 268 3.327 -34.185 2.488 1.00 16.16 O HETATM 2820 O HOH 269 6.076 -38.549 -6.996 1.00 18.87 O HETATM 2821 O HOH 270 10.285 -21.592 12.816 1.00 30.13 O HETATM 2822 O HOH 271 4.075 -24.056 13.357 1.00 33.16 O HETATM 2823 O HOH 272 -2.761 -3.999 -12.251 1.00 26.15 O HETATM 2824 O HOH 273 -16.433 -13.287 3.068 1.00 24.76 O HETATM 2825 O HOH 274 7.296 -38.740 -4.806 1.00 19.46 O HETATM 2826 O HOH 275 9.547 -24.038 9.600 1.00 25.73 O HETATM 2827 O HOH 276 1.688 -32.063 -20.619 1.00 17.13 O HETATM 2828 O HOH 277 -4.437 -25.742 14.578 1.00 29.58 O HETATM 2829 O HOH 278 -9.619 -7.067 -2.986 1.00 12.26 O HETATM 2830 O HOH 279 -15.046 -10.033 1.895 1.00 24.11 O HETATM 2831 O HOH 280 3.374 -28.113 10.848 1.00 14.23 O HETATM 2832 O HOH 281 -0.578 -37.974 -17.253 1.00 17.77 O HETATM 2833 O HOH 282 13.049 -27.831 -3.418 1.00 20.45 O HETATM 2834 O HOH 283 6.603 -38.803 10.206 1.00 23.51 O HETATM 2835 O HOH 284 -16.080 -7.629 -5.158 1.00 18.77 O HETATM 2836 O HOH 285 -10.662 -29.383 2.397 1.00 13.51 O HETATM 2837 O HOH 286 -0.050 -30.724 11.927 1.00 21.51 O HETATM 2838 O HOH 287 -11.061 -18.163 -12.852 1.00 29.91 O HETATM 2839 O HOH 288 -7.407 3.975 -3.777 1.00 46.38 O HETATM 2840 O HOH 289 10.307 -26.915 -13.218 1.00 45.56 O HETATM 2841 O HOH 290 6.534 -35.861 -14.788 1.00 22.79 O HETATM 2842 O HOH 291 2.658 -41.672 -8.973 1.00 33.70 O HETATM 2843 O HOH 292 10.098 -39.971 15.141 1.00 15.35 O HETATM 2844 O HOH 293 -16.658 -10.353 -7.472 1.00 19.12 O HETATM 2845 O HOH 294 -14.735 -31.658 -1.203 1.00 21.10 O HETATM 2846 O HOH 295 -15.901 -23.438 -0.883 1.00 21.43 O HETATM 2847 O HOH 296 -17.566 -32.743 -11.222 1.00 25.00 O HETATM 2848 O HOH 297 -8.018 -42.919 -16.412 1.00 41.49 O HETATM 2849 O HOH 298 -0.621 -24.224 -14.882 1.00 16.46 O HETATM 2850 O HOH 299 0.897 -40.363 -6.740 1.00 24.44 O HETATM 2851 O HOH 300 0.007 -25.301 -17.411 1.00 15.07 O HETATM 2852 O HOH 301 -0.739 -29.281 14.920 1.00 45.33 O HETATM 2853 O HOH 302 7.890 -22.515 -11.868 1.00 33.22 O HETATM 2854 O HOH 303 8.513 -16.038 13.553 1.00 18.75 O HETATM 2855 O HOH 304 9.719 -28.238 10.634 1.00 18.83 O HETATM 2856 O HOH 305 -11.503 -36.989 -4.239 1.00 14.01 O HETATM 2857 O HOH 306 -1.718 2.902 -11.670 1.00 26.64 O HETATM 2858 O HOH 307 8.479 -40.916 -2.567 1.00 48.96 O HETATM 2859 O HOH 308 -2.482 -21.769 -17.028 1.00 18.68 O HETATM 2860 O HOH 309 11.862 -31.172 -6.828 1.00 23.06 O HETATM 2861 O HOH 310 -13.055 -24.431 -24.152 1.00 35.42 O HETATM 2862 O HOH 311 8.948 -39.726 6.624 1.00 22.35 O HETATM 2863 O HOH 312 -16.535 -18.195 -8.836 1.00 28.70 O HETATM 2864 O HOH 313 14.315 -34.993 8.524 1.00 51.90 O HETATM 2865 O HOH 314 -13.998 -10.942 -10.272 1.00 25.50 O HETATM 2866 O HOH 315 4.074 -42.882 -15.421 1.00 32.79 O HETATM 2867 O HOH 316 -1.883 -6.717 -9.110 1.00 14.46 O HETATM 2868 O HOH 317 -4.712 -36.405 -21.755 1.00 36.77 O HETATM 2869 O HOH 318 -5.494 -17.932 -16.124 1.00 34.93 O HETATM 2870 O HOH 319 7.074 -35.993 -11.339 1.00 28.68 O HETATM 2871 O HOH 320 -9.296 -24.415 -25.034 1.00 29.08 O HETATM 2872 O HOH 321 -12.489 0.889 -4.487 1.00 29.88 O HETATM 2873 O HOH 322 9.571 -23.361 5.433 1.00 30.58 O HETATM 2874 O HOH 323 -13.477 -43.330 -17.030 1.00 39.57 O HETATM 2875 O HOH 324 6.706 -33.363 -11.869 1.00 18.84 O HETATM 2876 O HOH 325 -6.917 -20.073 -22.794 1.00 40.33 O HETATM 2877 O HOH 326 5.782 -33.194 0.495 1.00 15.12 O HETATM 2878 O HOH 327 -6.040 -42.408 -2.438 1.00 32.76 O HETATM 2879 O HOH 328 -9.762 2.217 -10.406 1.00 30.76 O HETATM 2880 O HOH 329 -14.206 -26.879 -1.891 1.00 15.92 O HETATM 2881 O HOH 330 9.318 -25.066 2.634 1.00 22.69 O HETATM 2882 O HOH 331 12.812 -37.243 7.857 1.00 20.27 O HETATM 2883 O HOH 332 0.888 -22.184 -13.638 1.00 14.90 O HETATM 2884 O HOH 333 4.858 -37.843 8.185 1.00 36.58 O HETATM 2885 O HOH 334 11.408 -29.102 2.712 1.00 14.23 O HETATM 2886 O HOH 335 0.193 -42.070 -5.085 1.00 38.10 O HETATM 2887 O HOH 336 -11.538 -19.956 -10.422 1.00 14.74 O HETATM 2888 O HOH 337 7.662 -40.363 0.177 1.00 27.16 O HETATM 2889 O HOH 338 1.086 -42.837 -2.333 1.00 36.34 O HETATM 2890 O HOH 339 -18.775 -11.971 -4.285 1.00 39.99 O HETATM 2891 O HOH 340 -11.198 -30.576 -18.762 1.00 28.33 O HETATM 2892 O HOH 341 -4.338 4.102 -8.346 1.00 37.42 O HETATM 2893 O HOH 342 -2.666 -42.544 -4.845 1.00 30.64 O HETATM 2894 O HOH 343 9.718 -15.752 3.669 1.00 25.56 O HETATM 2895 O HOH 344 -17.265 -30.466 -14.011 1.00 24.63 O HETATM 2896 O HOH 345 -18.597 -13.145 -0.213 1.00 28.91 O HETATM 2897 O HOH 346 -15.697 -19.939 -12.262 1.00 19.21 O HETATM 2898 O HOH 347 5.454 -33.449 -14.335 1.00 20.55 O HETATM 2899 O HOH 348 -10.455 -19.207 -17.156 1.00 32.55 O HETATM 2900 O HOH 349 13.839 -36.680 -1.742 1.00 22.40 O HETATM 2901 O HOH 350 -16.546 -8.810 -1.873 1.00 17.73 O HETATM 2902 O HOH 351 -8.089 -18.445 -15.277 1.00 32.46 O HETATM 2903 O HOH 352 12.618 -30.336 0.528 1.00 13.37 O HETATM 2904 O HOH 353 -9.683 -18.964 -22.071 1.00 40.87 O HETATM 2905 O HOH 354 -13.387 -1.468 -3.071 1.00 18.46 O HETATM 2906 O HOH 355 -15.878 -8.057 0.499 1.00 27.51 O HETATM 2907 O HOH 356 10.994 -30.753 4.646 1.00 20.56 O HETATM 2908 O HOH 357 8.279 -32.514 14.772 1.00 33.59 O HETATM 2909 O HOH 358 -13.611 -40.951 -6.634 1.00 41.42 O HETATM 2910 O HOH 359 12.340 -35.181 -9.432 1.00 40.64 O HETATM 2911 O HOH 360 5.209 -41.478 -7.785 1.00 41.57 O HETATM 2912 O HOH 361 -13.083 -38.102 -17.507 1.00 20.62 O HETATM 2913 O HOH 362 9.424 -32.231 -11.947 1.00 24.34 O HETATM 2914 O HOH 363 -14.994 -18.179 -0.179 1.00 32.58 O HETATM 2915 O HOH 364 -11.607 -36.550 -15.954 1.00 22.56 O HETATM 2916 O HOH 365 -13.220 -39.398 -4.714 1.00 18.08 O HETATM 2917 O HOH 366 -13.451 -0.288 -6.867 1.00 36.24 O HETATM 2918 O HOH 367 1.383 -37.236 5.234 1.00 41.36 O HETATM 2919 O HOH 368 2.593 -37.207 -20.120 1.00 40.01 O HETATM 2920 O HOH 369 13.434 -38.027 -8.570 1.00 32.77 O HETATM 2921 O HOH 370 -7.000 6.686 -5.610 1.00 44.90 O HETATM 2922 O HOH 371 2.114 -43.022 2.398 1.00 43.58 O HETATM 2923 O HOH 372 -17.492 -19.959 -3.906 1.00 31.55 O HETATM 2924 O HOH 373 6.337 -28.232 -15.888 1.00 36.89 O HETATM 2925 O HOH 374 -0.677 -38.536 5.370 1.00 30.89 O HETATM 2926 O HOH 375 2.197 -36.817 9.520 1.00 27.19 O HETATM 2927 O HOH 376 0.643 -44.329 -12.587 1.00 34.60 O HETATM 2928 O HOH 377 -16.694 -38.179 -10.887 1.00 19.72 O HETATM 2929 O HOH 378 -7.265 -37.392 -20.939 1.00 39.16 O HETATM 2930 O HOH 379 2.598 -18.508 -12.132 1.00 23.14 O HETATM 2931 O HOH 380 4.639 -36.125 13.216 1.00 30.44 O HETATM 2932 O HOH 381 13.761 -38.923 -10.767 1.00 43.71 O HETATM 2933 O HOH 382 -8.745 -31.391 15.263 1.00 30.60 O HETATM 2934 O HOH 383 5.235 -40.768 0.566 1.00 33.70 O HETATM 2935 O HOH 384 -18.244 -38.877 -13.336 1.00 37.21 O HETATM 2936 O HOH 385 -16.845 -1.433 -4.002 1.00 27.55 O HETATM 2937 O HOH 386 -10.896 -39.102 -20.408 1.00 39.08 O HETATM 2938 O HOH 387 -12.326 -43.547 -19.126 1.00 41.39 O HETATM 2939 O HOH 388 4.212 -42.335 2.434 1.00 38.61 O HETATM 2940 O HOH 389 -18.327 -11.067 -2.007 1.00 22.78 O HETATM 2941 O HOH 390 -3.354 -18.908 -17.656 1.00 45.37 O HETATM 2942 O HOH 391 1.317 -19.155 -16.844 1.00 37.61 O HETATM 2943 O HOH 392 -15.294 -5.250 0.960 1.00 19.07 O HETATM 2944 O HOH 393 -5.952 -29.198 17.751 1.00 34.77 O HETATM 2945 O HOH 394 -5.917 3.395 -2.725 1.00 37.10 O HETATM 2946 O HOH 395 2.584 -30.210 12.442 1.00 28.22 O HETATM 2947 O HOH 396 7.037 -41.589 -3.972 1.00 45.95 O HETATM 2948 O HOH 397 10.879 -30.333 7.250 1.00 21.19 O HETATM 2949 O HOH 398 9.180 -31.975 -14.857 1.00 43.71 O HETATM 2950 O HOH 399 4.484 -42.689 -2.683 1.00 48.02 O HETATM 2951 O HOH 400 -15.131 -34.316 -17.628 1.00 50.96 O HETATM 2952 O HOH 401 -1.205 -1.664 -11.854 1.00 25.00 O HETATM 2953 O HOH 402 -10.896 1.014 0.403 1.00 44.73 O HETATM 2954 O HOH 403 2.748 -34.234 13.559 1.00 33.41 O HETATM 2955 O HOH 404 11.108 -27.970 8.306 1.00 25.09 O HETATM 2956 O HOH 405 2.092 -44.446 -9.549 1.00 40.05 O HETATM 2957 O HOH 406 -5.443 -39.482 5.873 1.00 30.05 O HETATM 2958 O HOH 407 1.241 -34.895 -20.383 1.00 21.29 O HETATM 2959 O HOH 408 3.334 -43.075 -17.904 1.00 40.20 O HETATM 2960 O HOH 409 -17.623 -38.424 -16.128 1.00 29.25 O HETATM 2961 O HOH 410 -14.608 -1.683 -0.509 1.00 34.35 O HETATM 2962 O HOH 411 -8.825 -16.596 -13.727 1.00 28.15 O HETATM 2963 O HOH 412 -0.025 -44.754 -1.319 1.00 45.70 O HETATM 2964 O HOH 413 -13.027 -30.628 -20.338 1.00 53.32 O HETATM 2965 O HOH 414 -6.970 -24.253 -25.422 1.00 41.22 O HETATM 2966 O HOH 415 -1.418 -23.687 -21.734 1.00 34.32 O HETATM 2967 O HOH 416 10.775 -25.100 7.162 1.00 25.47 O HETATM 2968 O HOH 417 -18.344 -7.428 -3.410 1.00 23.76 O HETATM 2969 O HOH 418 -6.303 -16.417 -12.574 1.00 28.66 O HETATM 2970 O HOH 419 -14.489 -28.169 -18.725 1.00 39.36 O HETATM 2971 O HOH 420 -8.318 0.709 0.849 1.00 29.65 O HETATM 2972 O HOH 421 -0.957 -35.884 -19.157 1.00 25.78 O HETATM 2973 O HOH 422 -1.852 -40.022 -18.322 1.00 25.56 O HETATM 2974 O HOH 423 -16.094 -9.282 -9.863 1.00 39.83 O HETATM 2975 O HOH 424 -12.988 -0.519 1.441 1.00 34.43 O HETATM 2976 O HOH 425 12.308 -41.802 8.913 1.00 26.62 O HETATM 2977 O HOH 426 2.034 -23.880 -18.044 1.00 31.36 O HETATM 2978 O HOH 427 -13.734 -41.472 -2.703 1.00 44.96 O HETATM 2979 O HOH 428 2.479 -44.682 -14.529 1.00 39.50 O HETATM 2980 O HOH 429 13.455 -35.921 5.852 1.00 38.69 O HETATM 2981 O HOH 430 14.098 -39.674 8.670 1.00 31.29 O HETATM 2982 O HOH 431 -15.664 -21.377 -19.525 1.00 50.38 O HETATM 2983 O HOH 432 -12.894 -36.955 -20.068 1.00 37.91 O HETATM 2984 O HOH 433 0.049 -21.121 -17.581 1.00 30.29 O HETATM 2985 O HOH 434 -10.123 4.661 -1.607 1.00 45.50 O HETATM 2986 O HOH 435 -15.384 -20.542 -17.329 1.00 44.21 O HETATM 2987 O HOH 436 -7.325 -21.713 -24.808 1.00 52.81 O HETATM 2988 O HOH 437 -14.005 2.791 -3.976 1.00 38.95 O HETATM 2989 O HOH 438 14.750 -35.223 0.416 1.00 37.92 O HETATM 2990 O HOH 439 -15.631 -37.060 -17.486 1.00 25.06 O HETATM 2991 O HOH 440 -16.175 -1.207 -1.456 1.00 33.75 O HETATM 2992 O HOH 441 -8.228 -42.784 -1.351 1.00 47.25 O HETATM 2993 O HOH 442 -3.469 4.167 -4.025 1.00 41.14 O HETATM 2994 O HOH 443 -4.564 -44.415 -1.048 1.00 43.60 O HETATM 2995 O HOH 444 15.290 -34.934 -3.196 1.00 33.61 O HETATM 2996 O HOH 445 15.573 -36.878 -7.255 1.00 44.96 O HETATM 2997 O HOH 446 -4.809 -43.636 1.427 1.00 29.60 O HETATM 2998 O HOH 447 15.720 -34.652 -5.969 1.00 40.25 O HETATM 2999 C12 KVD A 448 -6.057 -35.177 -17.049 1.00 0.03 C HETATM 3000 C13 KVD A 448 -4.965 -34.919 -17.860 1.00 -0.05 C HETATM 3001 C14 KVD A 448 -4.316 -35.963 -18.479 1.00 -0.06 C HETATM 3002 C15 KVD A 448 -4.752 -37.255 -18.271 1.00 -0.06 C HETATM 3003 C16 KVD A 448 -5.825 -37.512 -17.448 1.00 -0.06 C HETATM 3004 C17 KVD A 448 -6.493 -36.466 -16.830 1.00 -0.05 C HETATM 3005 H5 KVD A 448 -7.343 -36.659 -16.186 1.00 0.06 H HETATM 3006 H4 KVD A 448 -6.148 -38.533 -17.283 1.00 0.06 H HETATM 3007 H3 KVD A 448 -4.244 -38.077 -18.761 1.00 0.06 H HETATM 3008 H2 KVD A 448 -3.468 -35.771 -19.126 1.00 0.06 H HETATM 3009 H1 KVD A 448 -4.623 -33.901 -18.007 1.00 0.06 H HETATM 3010 C11 KVD A 448 -6.784 -34.031 -16.389 1.00 -0.06 C HETATM 3011 C10 KVD A 448 -7.393 -33.188 -15.848 1.00 -0.05 C HETATM 3012 C08 KVD A 448 -8.248 -32.135 -15.190 1.00 0.06 C HETATM 3013 C07 KVD A 448 -7.698 -31.325 -14.209 1.00 0.03 C HETATM 3014 N06 KVD A 448 -8.430 -30.407 -13.609 1.00 -0.29 N HETATM 3015 C05 KVD A 448 -9.700 -30.247 -13.943 1.00 0.02 C HETATM 3016 C04 KVD A 448 -10.309 -31.034 -14.913 1.00 0.04 C HETATM 3017 C02 KVD A 448 -11.767 -30.835 -15.273 1.00 0.07 C HETATM 3018 O01 KVD A 448 -12.437 -29.997 -14.618 1.00 -0.56 O HETATM 3019 O03 KVD A 448 -12.279 -31.504 -16.221 1.00 -0.56 O HETATM 3020 C09 KVD A 448 -9.567 -31.998 -15.554 1.00 -0.01 C HETATM 3021 H8 KVD A 448 -10.006 -32.628 -16.319 1.00 0.08 H HETATM 3022 H6 KVD A 448 -10.282 -29.480 -13.446 1.00 0.09 H HETATM 3023 H7 KVD A 448 -6.657 -31.447 -13.933 1.00 0.09 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1304 1305 1311 1312 1313 CONECT 1311 1304 CONECT 1312 1304 CONECT 1313 1304 CONECT 2999 3000 3004 3010 CONECT 3000 2999 3001 3009 CONECT 3001 3000 3002 3008 CONECT 3002 3001 3003 3007 CONECT 3003 3002 3004 3006 CONECT 3004 2999 3003 3005 CONECT 3005 3004 CONECT 3006 3003 CONECT 3007 3002 CONECT 3008 3001 CONECT 3009 3000 CONECT 3010 2999 3011 CONECT 3011 3010 3012 CONECT 3012 3011 3013 3020 CONECT 3013 3012 3014 3023 CONECT 3014 3013 3015 CONECT 3015 3014 3016 3022 CONECT 3016 3015 3017 3020 CONECT 3017 3016 3018 3019 CONECT 3018 3017 CONECT 3019 3017 CONECT 3020 3012 3016 3021 CONECT 3021 3020 CONECT 3022 3015 CONECT 3023 3013 MASTER 0 0 0 0 0 0 0 0 3021 2 33 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6npm
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6npp
RCSB PDB
PDBbind
134aa, >6NPP_2|Chain... at 100%
6npi
RCSB PDB
PDBbind
141aa, >6NPI_1|Chains... at 98%
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
6npm
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Epstein-Barr Virus Nuclear Antigen-1, EBNA1
Ligand Name
KVD
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
IC50=110uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Sci Transl Med Vol. 11: pp.eaau5612
Ligand Properties
Formula
C
1
4
H
9
NO
2
Molecular Weight
223.227
Exact Mass
223.063
No. of atoms
26
No. of bonds
27
Polar Surface Area
50.19
LOGP Value
3.48 (
Computed with XLOGP3
)
2.18 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
OC(=O)c1cncc(c1)C#Cc1ccccc1
InChI String
InChI=1S/C14H9NO2/c16-14(17)13-8-12(9-15-10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,(H,16,17)
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03211
Entrez Gene ID
NCBI Entrez Gene ID:
3783709
3783774
ASD
Information of known allosteric effects of PDB entries
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