Browse entries in the PDBbind-CN Database
HEADER 6HP9_COMPLEX COMPND 6HP9_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 121 SER MET PRO ARG VAL ASP PHE PRO ARG SER ARG LEU ARG SEQRES 2 A 121 PHE LYS GLU LYS LEU GLY GLU GLY GLN PHE GLY GLU VAL SEQRES 3 A 121 HIS LEU CYS GLU VAL ASP SER PRO GLN ASP LEU VAL SER SEQRES 4 A 121 LEU ASP PHE PRO LEU ASN VAL ARG LYS GLY HIS PRO LEU SEQRES 5 A 121 LEU VAL ALA VAL LYS ILE LEU ARG PRO ASP ALA THR LYS SEQRES 6 A 121 ASN ALA ARG ASN ASP PHE LEU LYS GLU VAL LYS ILE MET SEQRES 7 A 121 SER ARG LEU LYS ASP PRO ASN ILE ILE ARG LEU LEU GLY SEQRES 8 A 121 VAL CYS VAL GLN ASP ASP PRO LEU CYS MET ILE THR ASP SEQRES 9 A 121 TYR MET GLU ASN GLY ASP LEU ASN GLN PHE LEU SER ALA SEQRES 10 A 121 HIS GLN LEU GLU SEQRES 1 A 176 GLN GLY PRO THR ILE SER TYR PRO MET LEU LEU HIS VAL SEQRES 2 A 176 ALA ALA GLN ILE ALA SER GLY MET ARG TYR LEU ALA THR SEQRES 3 A 176 LEU ASN PHE VAL HIS ARG ASP LEU ALA THR ARG ASN CYS SEQRES 4 A 176 LEU VAL GLY GLU ASN PHE THR ILE LYS ILE ALA ASP PHE SEQRES 5 A 176 GLY MET SER ARG ASN LEU TYR ALA GLY ASP TYR TYR ARG SEQRES 6 A 176 VAL GLN GLY ARG ALA VAL LEU PRO ILE ARG TRP MET ALA SEQRES 7 A 176 TRP GLU CYS ILE LEU MET GLY LYS PHE THR THR ALA SER SEQRES 8 A 176 ASP VAL TRP ALA PHE GLY VAL THR LEU TRP GLU VAL LEU SEQRES 9 A 176 MET LEU CYS ARG ALA GLN PRO PHE GLY GLN LEU THR ASP SEQRES 10 A 176 GLU GLN VAL ILE GLU ASN ALA GLY GLU PHE PHE ARG ASP SEQRES 11 A 176 GLN GLY ARG GLN VAL TYR LEU SER ARG PRO PRO ALA CYS SEQRES 12 A 176 PRO GLN GLY LEU TYR GLU LEU MET LEU ARG CYS TRP SER SEQRES 13 A 176 ARG GLU SER GLU GLN ARG PRO PRO PHE SER GLN LEU HIS SEQRES 14 A 176 ARG PHE LEU ALA GLU ASP ALA HET GKB A 463 56 ATOM 1 N SER A 599 43.353 14.518 -41.667 1.00 59.25 N ATOM 2 CA SER A 599 44.014 14.151 -40.413 1.00 58.55 C ATOM 3 C SER A 599 44.004 15.276 -39.382 1.00 70.11 C ATOM 4 O SER A 599 44.013 16.462 -39.718 1.00 75.98 O ATOM 5 CB SER A 599 45.471 13.733 -40.663 1.00 66.22 C ATOM 6 OG SER A 599 45.582 12.611 -41.525 1.00 72.78 O ATOM 7 HG SER A 599 46.538 12.386 -41.651 1.00 0.00 H ATOM 8 HN3 SER A 599 43.839 15.336 -42.087 1.00 0.00 H ATOM 9 HN2 SER A 599 42.361 14.763 -41.476 1.00 0.00 H ATOM 10 HN1 SER A 599 43.392 13.714 -42.326 1.00 0.00 H ATOM 11 N MET A 600 43.989 14.873 -38.118 1.00 72.27 N ATOM 12 CA MET A 600 44.203 15.723 -36.956 1.00 69.75 C ATOM 13 C MET A 600 45.540 15.457 -36.254 1.00 73.38 C ATOM 14 O MET A 600 45.993 16.326 -35.494 1.00 73.15 O ATOM 15 CB MET A 600 43.049 15.556 -35.959 1.00 64.42 C ATOM 16 CG MET A 600 43.144 16.453 -34.739 1.00 69.93 C ATOM 17 SD MET A 600 41.721 16.324 -33.662 1.00 78.85 S ATOM 18 CE MET A 600 40.461 17.050 -34.707 1.00 73.25 C ATOM 19 H MET A 600 43.809 13.864 -37.943 1.00 0.00 H ATOM 20 N PRO A 601 46.218 14.313 -36.438 1.00 72.00 N ATOM 21 CA PRO A 601 47.564 14.203 -35.852 1.00 69.21 C ATOM 22 C PRO A 601 48.525 15.097 -36.621 1.00 60.06 C ATOM 23 O PRO A 601 48.495 15.146 -37.852 1.00 52.61 O ATOM 24 CB PRO A 601 47.916 12.717 -36.004 1.00 64.20 C ATOM 25 CG PRO A 601 46.609 12.028 -36.295 1.00 59.41 C ATOM 26 CD PRO A 601 45.829 13.035 -37.071 1.00 62.21 C ATOM 27 N ARG A 602 49.350 15.841 -35.888 1.00 49.56 N ATOM 28 CA ARG A 602 50.192 16.822 -36.552 1.00 50.28 C ATOM 29 C ARG A 602 51.413 16.189 -37.199 1.00 47.03 C ATOM 30 O ARG A 602 52.008 16.795 -38.093 1.00 45.22 O ATOM 31 CB ARG A 602 50.593 17.908 -35.554 1.00 45.35 C ATOM 32 CG ARG A 602 49.380 18.457 -34.843 1.00 44.50 C ATOM 33 CD ARG A 602 49.598 19.845 -34.313 1.00 43.62 C ATOM 34 NE ARG A 602 48.361 20.375 -33.750 1.00 40.22 N ATOM 35 CZ ARG A 602 47.375 20.887 -34.478 1.00 43.63 C ATOM 36 NH1 ARG A 602 47.481 20.939 -35.807 1.00 40.46 N ATOM 37 NH2 ARG A 602 46.280 21.345 -33.885 1.00 42.34 N ATOM 38 HE ARG A 602 48.244 20.351 -32.717 1.00 0.00 H ATOM 39 HH12 ARG A 602 46.708 21.340 -36.375 1.00 0.00 H ATOM 40 HH11 ARG A 602 48.337 20.578 -36.275 1.00 0.00 H ATOM 41 HH22 ARG A 602 45.508 21.746 -34.456 1.00 0.00 H ATOM 42 HH21 ARG A 602 46.193 21.303 -32.849 1.00 0.00 H ATOM 43 H ARG A 602 49.391 15.722 -34.856 1.00 0.00 H ATOM 44 N VAL A 603 51.782 14.985 -36.772 1.00 48.01 N ATOM 45 CA VAL A 603 52.926 14.247 -37.282 1.00 46.20 C ATOM 46 C VAL A 603 52.481 12.813 -37.529 1.00 39.28 C ATOM 47 O VAL A 603 51.589 12.296 -36.849 1.00 41.99 O ATOM 48 CB VAL A 603 54.120 14.302 -36.289 1.00 52.94 C ATOM 49 CG1 VAL A 603 55.326 13.550 -36.824 1.00 50.66 C ATOM 50 CG2 VAL A 603 54.500 15.744 -35.977 1.00 57.32 C ATOM 51 H VAL A 603 51.214 14.541 -36.022 1.00 0.00 H ATOM 52 N ASP A 604 53.092 12.176 -38.522 1.00 40.52 N ATOM 53 CA ASP A 604 52.909 10.744 -38.720 1.00 38.76 C ATOM 54 C ASP A 604 53.303 9.968 -37.463 1.00 45.38 C ATOM 55 O ASP A 604 54.298 10.281 -36.803 1.00 40.56 O ATOM 56 CB ASP A 604 53.754 10.259 -39.900 1.00 40.52 C ATOM 57 CG ASP A 604 53.085 10.474 -41.248 1.00 43.93 C ATOM 58 OD1 ASP A 604 51.932 10.970 -41.304 1.00 39.67 O ATOM 59 OD2 ASP A 604 53.732 10.135 -42.265 1.00 40.46 O ATOM 60 H ASP A 604 53.710 12.707 -39.168 1.00 0.00 H ATOM 61 N PHE A 605 52.504 8.965 -37.129 1.00 40.44 N ATOM 62 CA PHE A 605 52.918 7.957 -36.165 1.00 35.04 C ATOM 63 C PHE A 605 54.185 7.275 -36.675 1.00 39.96 C ATOM 64 O PHE A 605 54.251 6.915 -37.856 1.00 35.23 O ATOM 65 CB PHE A 605 51.788 6.946 -36.009 1.00 37.66 C ATOM 66 CG PHE A 605 51.853 6.095 -34.766 1.00 39.71 C ATOM 67 CD1 PHE A 605 52.642 4.956 -34.725 1.00 36.68 C ATOM 68 CD2 PHE A 605 51.058 6.395 -33.668 1.00 35.70 C ATOM 69 CE1 PHE A 605 52.664 4.149 -33.600 1.00 36.80 C ATOM 70 CE2 PHE A 605 51.067 5.596 -32.539 1.00 38.20 C ATOM 71 CZ PHE A 605 51.872 4.470 -32.502 1.00 39.44 C ATOM 72 H PHE A 605 51.562 8.897 -37.565 1.00 0.00 H ATOM 73 N PRO A 606 55.206 7.093 -35.841 1.00 40.89 N ATOM 74 CA PRO A 606 56.430 6.440 -36.323 1.00 35.71 C ATOM 75 C PRO A 606 56.162 4.994 -36.721 1.00 34.78 C ATOM 76 O PRO A 606 55.638 4.200 -35.940 1.00 34.58 O ATOM 77 CB PRO A 606 57.386 6.545 -35.129 1.00 36.29 C ATOM 78 CG PRO A 606 56.491 6.751 -33.934 1.00 43.81 C ATOM 79 CD PRO A 606 55.289 7.491 -34.426 1.00 35.44 C ATOM 80 N ARG A 607 56.526 4.657 -37.958 1.00 31.89 N ATOM 81 CA ARG A 607 56.235 3.323 -38.470 1.00 36.00 C ATOM 82 C ARG A 607 57.025 2.256 -37.737 1.00 32.67 C ATOM 83 O ARG A 607 56.538 1.136 -37.552 1.00 36.22 O ATOM 84 CB ARG A 607 56.542 3.247 -39.963 1.00 36.71 C ATOM 85 CG ARG A 607 55.428 3.702 -40.855 1.00 42.29 C ATOM 86 CD ARG A 607 55.909 3.670 -42.292 1.00 46.08 C ATOM 87 NE ARG A 607 55.166 4.597 -43.128 1.00 43.85 N ATOM 88 CZ ARG A 607 54.068 4.267 -43.789 1.00 38.77 C ATOM 89 NH1 ARG A 607 53.602 3.030 -43.705 1.00 42.14 N ATOM 90 NH2 ARG A 607 53.443 5.166 -44.533 1.00 40.37 N ATOM 91 HE ARG A 607 55.516 5.573 -43.212 1.00 0.00 H ATOM 92 HH12 ARG A 607 52.740 2.763 -44.221 1.00 0.00 H ATOM 93 HH11 ARG A 607 54.098 2.326 -43.123 1.00 0.00 H ATOM 94 HH22 ARG A 607 52.580 4.903 -45.051 1.00 0.00 H ATOM 95 HH21 ARG A 607 53.815 6.135 -44.599 1.00 0.00 H ATOM 96 H ARG A 607 57.019 5.347 -38.560 1.00 0.00 H ATOM 97 N SER A 608 58.256 2.567 -37.337 1.00 35.04 N ATOM 98 CA SER A 608 59.057 1.562 -36.657 1.00 39.76 C ATOM 99 C SER A 608 58.503 1.192 -35.287 1.00 39.30 C ATOM 100 O SER A 608 58.907 0.159 -34.741 1.00 37.49 O ATOM 101 CB SER A 608 60.507 2.038 -36.527 1.00 40.49 C ATOM 102 OG SER A 608 60.595 3.220 -35.748 1.00 43.51 O ATOM 103 HG SER A 608 60.065 3.937 -36.178 1.00 0.00 H ATOM 104 H SER A 608 58.640 3.518 -37.509 1.00 0.00 H ATOM 105 N ARG A 609 57.582 1.985 -34.727 1.00 39.77 N ATOM 106 CA ARG A 609 57.021 1.656 -33.418 1.00 37.43 C ATOM 107 C ARG A 609 55.875 0.662 -33.495 1.00 38.36 C ATOM 108 O ARG A 609 55.393 0.226 -32.445 1.00 42.02 O ATOM 109 CB ARG A 609 56.540 2.919 -32.704 1.00 34.31 C ATOM 110 CG ARG A 609 57.664 3.868 -32.317 1.00 39.90 C ATOM 111 CD ARG A 609 58.486 3.349 -31.149 1.00 40.14 C ATOM 112 NE ARG A 609 57.708 3.313 -29.912 1.00 38.68 N ATOM 113 CZ ARG A 609 57.440 4.378 -29.157 1.00 40.50 C ATOM 114 NH1 ARG A 609 57.872 5.584 -29.509 1.00 38.69 N ATOM 115 NH2 ARG A 609 56.734 4.234 -28.041 1.00 35.31 N ATOM 116 HE ARG A 609 57.338 2.393 -29.599 1.00 0.00 H ATOM 117 HH12 ARG A 609 57.657 6.408 -28.912 1.00 0.00 H ATOM 118 HH11 ARG A 609 58.425 5.704 -30.381 1.00 0.00 H ATOM 119 HH22 ARG A 609 56.523 5.062 -27.449 1.00 0.00 H ATOM 120 HH21 ARG A 609 56.393 3.293 -27.759 1.00 0.00 H ATOM 121 H ARG A 609 57.264 2.840 -35.226 1.00 0.00 H ATOM 122 N LEU A 610 55.427 0.298 -34.698 1.00 38.41 N ATOM 123 CA LEU A 610 54.380 -0.701 -34.887 1.00 39.02 C ATOM 124 C LEU A 610 55.054 -2.040 -35.164 1.00 44.98 C ATOM 125 O LEU A 610 55.694 -2.212 -36.207 1.00 45.14 O ATOM 126 CB LEU A 610 53.450 -0.310 -36.039 1.00 43.74 C ATOM 127 CG LEU A 610 52.690 1.018 -35.952 1.00 36.15 C ATOM 128 CD1 LEU A 610 52.345 1.531 -37.345 1.00 37.71 C ATOM 129 CD2 LEU A 610 51.425 0.882 -35.113 1.00 32.62 C ATOM 130 H LEU A 610 55.843 0.747 -35.539 1.00 0.00 H ATOM 131 N ARG A 611 54.921 -2.982 -34.233 1.00 38.10 N ATOM 132 CA ARG A 611 55.441 -4.334 -34.404 1.00 41.67 C ATOM 133 C ARG A 611 54.315 -5.245 -34.873 1.00 44.17 C ATOM 134 O ARG A 611 53.316 -5.407 -34.165 1.00 39.68 O ATOM 135 CB ARG A 611 56.040 -4.865 -33.102 1.00 45.28 C ATOM 136 CG ARG A 611 56.215 -6.381 -33.088 1.00 47.80 C ATOM 137 CD ARG A 611 56.700 -6.861 -31.733 1.00 51.38 C ATOM 138 NE ARG A 611 57.648 -5.907 -31.173 1.00 54.64 N ATOM 139 CZ ARG A 611 57.510 -5.311 -29.996 1.00 53.99 C ATOM 140 NH1 ARG A 611 56.473 -5.592 -29.214 1.00 43.09 N ATOM 141 NH2 ARG A 611 58.429 -4.445 -29.595 1.00 54.32 N ATOM 142 HE ARG A 611 58.492 -5.677 -31.735 1.00 0.00 H ATOM 143 HH12 ARG A 611 56.373 -5.120 -28.293 1.00 0.00 H ATOM 144 HH11 ARG A 611 55.761 -6.284 -29.523 1.00 0.00 H ATOM 145 HH22 ARG A 611 58.331 -3.972 -28.674 1.00 0.00 H ATOM 146 HH21 ARG A 611 59.248 -4.238 -30.201 1.00 0.00 H ATOM 147 H ARG A 611 54.427 -2.745 -33.349 1.00 0.00 H ATOM 148 N PHE A 612 54.480 -5.845 -36.054 1.00 41.96 N ATOM 149 CA PHE A 612 53.445 -6.713 -36.595 1.00 33.76 C ATOM 150 C PHE A 612 53.226 -7.921 -35.692 1.00 41.44 C ATOM 151 O PHE A 612 54.183 -8.553 -35.238 1.00 43.24 O ATOM 152 CB PHE A 612 53.813 -7.177 -38.007 1.00 38.45 C ATOM 153 CG PHE A 612 52.854 -8.180 -38.561 1.00 40.31 C ATOM 154 CD1 PHE A 612 51.674 -7.767 -39.163 1.00 42.90 C ATOM 155 CD2 PHE A 612 53.095 -9.540 -38.427 1.00 45.80 C ATOM 156 CE1 PHE A 612 50.768 -8.690 -39.650 1.00 39.88 C ATOM 157 CE2 PHE A 612 52.190 -10.468 -38.912 1.00 47.14 C ATOM 158 CZ PHE A 612 51.027 -10.040 -39.531 1.00 41.94 C ATOM 159 H PHE A 612 55.356 -5.691 -36.592 1.00 0.00 H ATOM 160 N LYS A 613 51.960 -8.242 -35.432 1.00 39.80 N ATOM 161 CA LYS A 613 51.599 -9.452 -34.699 1.00 42.61 C ATOM 162 C LYS A 613 50.767 -10.433 -35.507 1.00 44.66 C ATOM 163 O LYS A 613 50.944 -11.642 -35.358 1.00 47.53 O ATOM 164 CB LYS A 613 50.821 -9.120 -33.419 1.00 37.54 C ATOM 165 CG LYS A 613 51.633 -8.431 -32.345 1.00 49.95 C ATOM 166 CD LYS A 613 53.102 -8.893 -32.332 1.00 54.58 C ATOM 167 CE LYS A 613 53.336 -10.126 -31.458 1.00 59.00 C ATOM 168 NZ LYS A 613 54.710 -10.678 -31.651 1.00 57.86 N ATOM 169 HZ1 LYS A 613 54.836 -10.950 -32.647 1.00 0.00 H ATOM 170 HZ2 LYS A 613 55.412 -9.954 -31.396 1.00 0.00 H ATOM 171 HZ3 LYS A 613 54.835 -11.513 -31.044 1.00 0.00 H ATOM 172 H LYS A 613 51.203 -7.610 -35.762 1.00 0.00 H ATOM 173 N GLU A 614 49.863 -9.952 -36.359 1.00 41.96 N ATOM 174 CA GLU A 614 48.833 -10.825 -36.894 1.00 42.30 C ATOM 175 C GLU A 614 47.973 -10.064 -37.890 1.00 47.23 C ATOM 176 O GLU A 614 47.587 -8.923 -37.622 1.00 46.00 O ATOM 177 CB GLU A 614 47.986 -11.368 -35.734 1.00 53.13 C ATOM 178 CG GLU A 614 46.789 -12.221 -36.094 1.00 54.87 C ATOM 179 CD GLU A 614 46.053 -12.728 -34.858 1.00 55.75 C ATOM 180 OE1 GLU A 614 44.837 -13.003 -34.954 1.00 62.86 O ATOM 181 OE2 GLU A 614 46.689 -12.849 -33.787 1.00 56.09 O ATOM 182 H GLU A 614 49.895 -8.951 -36.641 1.00 0.00 H ATOM 183 N LYS A 615 47.675 -10.667 -39.040 1.00 43.62 N ATOM 184 CA LYS A 615 46.732 -10.057 -39.970 1.00 41.00 C ATOM 185 C LYS A 615 45.308 -10.205 -39.445 1.00 44.25 C ATOM 186 O LYS A 615 44.919 -11.268 -38.952 1.00 48.83 O ATOM 187 CB LYS A 615 46.842 -10.703 -41.354 1.00 50.75 C ATOM 188 CG LYS A 615 48.199 -10.567 -42.015 1.00 52.40 C ATOM 189 CD LYS A 615 48.170 -11.120 -43.434 1.00 61.95 C ATOM 190 CE LYS A 615 49.573 -11.221 -44.024 1.00 66.66 C ATOM 191 NZ LYS A 615 50.332 -9.934 -43.978 1.00 63.62 N ATOM 192 HZ1 LYS A 615 49.817 -9.210 -44.519 1.00 0.00 H ATOM 193 HZ2 LYS A 615 50.430 -9.626 -42.990 1.00 0.00 H ATOM 194 HZ3 LYS A 615 51.275 -10.074 -44.394 1.00 0.00 H ATOM 195 H LYS A 615 48.118 -11.578 -39.276 1.00 0.00 H ATOM 196 N LEU A 616 44.524 -9.131 -39.537 1.00 38.32 N ATOM 197 CA LEU A 616 43.130 -9.191 -39.115 1.00 45.27 C ATOM 198 C LEU A 616 42.162 -9.304 -40.283 1.00 41.46 C ATOM 199 O LEU A 616 40.982 -9.592 -40.065 1.00 48.39 O ATOM 200 CB LEU A 616 42.763 -7.962 -38.265 1.00 38.51 C ATOM 201 CG LEU A 616 43.424 -7.886 -36.889 1.00 41.33 C ATOM 202 CD1 LEU A 616 43.067 -6.603 -36.153 1.00 36.97 C ATOM 203 CD2 LEU A 616 43.024 -9.091 -36.073 1.00 46.41 C ATOM 204 H LEU A 616 44.910 -8.242 -39.913 1.00 0.00 H ATOM 205 N GLY A 617 42.625 -9.087 -41.506 1.00 49.86 N ATOM 206 CA GLY A 617 41.757 -9.176 -42.659 1.00 48.45 C ATOM 207 C GLY A 617 42.411 -8.585 -43.881 1.00 57.66 C ATOM 208 O GLY A 617 43.356 -7.798 -43.771 1.00 53.81 O ATOM 209 H GLY A 617 43.629 -8.849 -41.638 1.00 0.00 H ATOM 210 N GLU A 618 41.929 -8.978 -45.055 1.00 63.19 N ATOM 211 CA GLU A 618 42.367 -8.406 -46.318 1.00 65.12 C ATOM 212 C GLU A 618 41.141 -7.954 -47.099 1.00 67.03 C ATOM 213 O GLU A 618 40.095 -8.612 -47.074 1.00 64.59 O ATOM 214 CB GLU A 618 43.192 -9.409 -47.138 1.00 64.49 C ATOM 215 CG GLU A 618 44.328 -10.051 -46.353 1.00 73.30 C ATOM 216 CD GLU A 618 45.385 -10.688 -47.242 1.00 84.99 C ATOM 217 OE1 GLU A 618 45.545 -10.244 -48.402 1.00 81.35 O ATOM 218 OE2 GLU A 618 46.062 -11.632 -46.772 1.00 89.49 O ATOM 219 H GLU A 618 41.208 -9.727 -45.071 1.00 0.00 H ATOM 220 N GLY A 619 41.269 -6.811 -47.764 1.00 62.33 N ATOM 221 CA GLY A 619 40.200 -6.294 -48.592 1.00 65.59 C ATOM 222 C GLY A 619 40.702 -5.984 -49.984 1.00 66.27 C ATOM 223 O GLY A 619 41.840 -6.325 -50.326 1.00 63.20 O ATOM 224 H GLY A 619 42.157 -6.276 -47.688 1.00 0.00 H ATOM 225 N GLN A 620 39.861 -5.340 -50.797 1.00 72.30 N ATOM 226 CA GLN A 620 40.289 -4.953 -52.139 1.00 68.97 C ATOM 227 C GLN A 620 41.364 -3.871 -52.079 1.00 66.55 C ATOM 228 O GLN A 620 42.386 -3.959 -52.774 1.00 65.45 O ATOM 229 CB GLN A 620 39.077 -4.483 -52.951 1.00 68.40 C ATOM 230 CG GLN A 620 39.058 -4.942 -54.411 1.00 68.81 C ATOM 231 CD GLN A 620 39.797 -3.995 -55.351 1.00 78.27 C ATOM 232 OE1 GLN A 620 40.698 -3.260 -54.935 1.00 65.72 O ATOM 233 NE2 GLN A 620 39.413 -4.008 -56.630 1.00 74.28 N ATOM 234 HE22 GLN A 620 38.649 -4.643 -56.937 1.00 0.00 H ATOM 235 HE21 GLN A 620 39.878 -3.383 -57.319 1.00 0.00 H ATOM 236 H GLN A 620 38.899 -5.113 -50.474 1.00 0.00 H ATOM 237 N PHE A 621 41.164 -2.859 -51.231 1.00 71.60 N ATOM 238 CA PHE A 621 42.101 -1.747 -51.131 1.00 68.63 C ATOM 239 C PHE A 621 43.271 -2.016 -50.192 1.00 52.81 C ATOM 240 O PHE A 621 44.278 -1.304 -50.273 1.00 52.88 O ATOM 241 CB PHE A 621 41.369 -0.476 -50.680 1.00 66.22 C ATOM 242 H PHE A 621 40.318 -2.864 -50.626 1.00 0.00 H ATOM 243 N GLY A 622 43.181 -3.008 -49.308 1.00 53.69 N ATOM 244 CA GLY A 622 44.334 -3.303 -48.475 1.00 48.04 C ATOM 245 C GLY A 622 44.170 -4.390 -47.431 1.00 53.21 C ATOM 246 O GLY A 622 43.446 -5.367 -47.646 1.00 49.30 O ATOM 247 H GLY A 622 42.304 -3.560 -49.216 1.00 0.00 H ATOM 248 N GLU A 623 44.857 -4.231 -46.295 1.00 39.86 N ATOM 249 CA GLU A 623 44.842 -5.205 -45.212 1.00 43.28 C ATOM 250 C GLU A 623 44.697 -4.469 -43.889 1.00 35.97 C ATOM 251 O GLU A 623 44.898 -3.255 -43.803 1.00 36.78 O ATOM 252 CB GLU A 623 46.121 -6.063 -45.182 1.00 45.67 C ATOM 253 CG GLU A 623 46.375 -6.886 -46.442 1.00 62.92 C ATOM 254 CD GLU A 623 47.606 -7.778 -46.335 1.00 63.34 C ATOM 255 OE1 GLU A 623 48.375 -7.635 -45.360 1.00 57.24 O ATOM 256 OE2 GLU A 623 47.801 -8.628 -47.230 1.00 72.51 O ATOM 257 H GLU A 623 45.430 -3.371 -46.179 1.00 0.00 H ATOM 258 N VAL A 624 44.364 -5.222 -42.846 1.00 35.00 N ATOM 259 CA VAL A 624 44.358 -4.716 -41.480 1.00 37.58 C ATOM 260 C VAL A 624 45.259 -5.613 -40.638 1.00 36.13 C ATOM 261 O VAL A 624 45.088 -6.838 -40.624 1.00 32.98 O ATOM 262 CB VAL A 624 42.932 -4.656 -40.899 1.00 37.80 C ATOM 263 CG1 VAL A 624 42.966 -4.082 -39.486 1.00 32.38 C ATOM 264 CG2 VAL A 624 42.013 -3.830 -41.803 1.00 34.00 C ATOM 265 H VAL A 624 44.097 -6.213 -43.012 1.00 0.00 H ATOM 266 N HIS A 625 46.217 -5.005 -39.944 1.00 33.23 N ATOM 267 CA HIS A 625 47.188 -5.727 -39.131 1.00 33.86 C ATOM 268 C HIS A 625 46.989 -5.404 -37.656 1.00 31.08 C ATOM 269 O HIS A 625 46.799 -4.244 -37.292 1.00 34.16 O ATOM 270 CB HIS A 625 48.622 -5.360 -39.507 1.00 32.95 C ATOM 271 CG HIS A 625 49.078 -5.904 -40.826 1.00 40.63 C ATOM 272 ND1 HIS A 625 50.333 -5.647 -41.333 1.00 37.91 N ATOM 273 CD2 HIS A 625 48.457 -6.687 -41.738 1.00 41.46 C ATOM 274 CE1 HIS A 625 50.463 -6.242 -42.505 1.00 44.32 C ATOM 275 NE2 HIS A 625 49.339 -6.880 -42.774 1.00 40.62 N ATOM 276 H HIS A 625 46.276 -3.967 -39.983 1.00 0.00 H ATOM 277 N LEU A 626 47.062 -6.426 -36.814 1.00 31.61 N ATOM 278 CA LEU A 626 47.173 -6.242 -35.372 1.00 32.50 C ATOM 279 C LEU A 626 48.646 -6.037 -35.015 1.00 38.59 C ATOM 280 O LEU A 626 49.497 -6.866 -35.356 1.00 39.67 O ATOM 281 CB LEU A 626 46.588 -7.448 -34.638 1.00 34.56 C ATOM 282 CG LEU A 626 46.621 -7.460 -33.107 1.00 34.66 C ATOM 283 CD1 LEU A 626 45.978 -6.209 -32.536 1.00 35.26 C ATOM 284 CD2 LEU A 626 45.915 -8.693 -32.596 1.00 36.31 C ATOM 285 H LEU A 626 47.039 -7.393 -37.196 1.00 0.00 H ATOM 286 N CYS A 627 48.951 -4.929 -34.344 1.00 37.18 N ATOM 287 CA CYS A 627 50.326 -4.563 -34.040 1.00 35.90 C ATOM 288 C CYS A 627 50.468 -4.254 -32.555 1.00 39.82 C ATOM 289 O CYS A 627 49.489 -3.962 -31.861 1.00 35.84 O ATOM 290 CB CYS A 627 50.779 -3.353 -34.868 1.00 31.93 C ATOM 291 SG CYS A 627 50.840 -3.682 -36.653 1.00 35.35 S ATOM 292 H CYS A 627 48.182 -4.305 -34.027 1.00 0.00 H ATOM 293 N GLU A 628 51.705 -4.321 -32.076 1.00 36.75 N ATOM 294 CA GLU A 628 52.043 -3.927 -30.718 1.00 36.79 C ATOM 295 C GLU A 628 52.854 -2.641 -30.746 1.00 36.98 C ATOM 296 O GLU A 628 53.635 -2.398 -31.670 1.00 35.76 O ATOM 297 CB GLU A 628 52.832 -5.021 -29.999 1.00 37.93 C ATOM 298 CG GLU A 628 52.025 -6.251 -29.654 1.00 41.23 C ATOM 299 CD GLU A 628 52.893 -7.402 -29.181 1.00 55.26 C ATOM 300 OE1 GLU A 628 54.139 -7.275 -29.237 1.00 53.28 O ATOM 301 OE2 GLU A 628 52.328 -8.433 -28.753 1.00 56.19 O ATOM 302 H GLU A 628 52.463 -4.669 -32.698 1.00 0.00 H ATOM 303 N VAL A 629 52.659 -1.814 -29.726 1.00 31.85 N ATOM 304 CA VAL A 629 53.398 -0.568 -29.569 1.00 35.75 C ATOM 305 C VAL A 629 54.009 -0.569 -28.168 1.00 39.89 C ATOM 306 O VAL A 629 53.279 -0.545 -27.167 1.00 33.44 O ATOM 307 CB VAL A 629 52.504 0.661 -29.796 1.00 35.32 C ATOM 308 CG1 VAL A 629 53.282 1.943 -29.570 1.00 33.17 C ATOM 309 CG2 VAL A 629 51.935 0.632 -31.225 1.00 35.84 C ATOM 310 H VAL A 629 51.949 -2.066 -29.009 1.00 0.00 H ATOM 311 N ASP A 630 55.341 -0.639 -28.096 1.00 38.54 N ATOM 312 CA ASP A 630 56.035 -0.572 -26.816 1.00 41.96 C ATOM 313 C ASP A 630 56.081 0.863 -26.314 1.00 38.31 C ATOM 314 O ASP A 630 56.166 1.816 -27.096 1.00 38.37 O ATOM 315 CB ASP A 630 57.468 -1.099 -26.934 1.00 40.58 C ATOM 316 CG ASP A 630 57.528 -2.568 -27.293 1.00 43.32 C ATOM 317 OD1 ASP A 630 56.527 -3.291 -27.086 1.00 47.93 O ATOM 318 OD2 ASP A 630 58.593 -3.000 -27.778 1.00 53.48 O ATOM 319 H ASP A 630 55.894 -0.743 -28.971 1.00 0.00 H ATOM 320 N SER A 631 56.056 1.005 -24.992 1.00 41.38 N ATOM 321 CA SER A 631 56.106 2.288 -24.298 1.00 39.25 C ATOM 322 C SER A 631 55.241 3.335 -25.012 1.00 39.01 C ATOM 323 O SER A 631 55.748 4.374 -25.444 1.00 39.65 O ATOM 324 CB SER A 631 57.543 2.773 -24.148 1.00 46.03 C ATOM 325 OG SER A 631 58.213 1.945 -23.214 1.00 45.45 O ATOM 326 HG SER A 631 57.750 1.994 -22.340 1.00 0.00 H ATOM 327 H SER A 631 55.997 0.143 -24.413 1.00 0.00 H ATOM 328 N PRO A 632 53.934 3.091 -25.133 1.00 39.90 N ATOM 329 CA PRO A 632 53.078 3.947 -25.966 1.00 39.05 C ATOM 330 C PRO A 632 52.716 5.302 -25.361 1.00 41.25 C ATOM 331 O PRO A 632 52.054 6.089 -26.048 1.00 35.07 O ATOM 332 CB PRO A 632 51.821 3.080 -26.146 1.00 37.43 C ATOM 333 CG PRO A 632 51.753 2.266 -24.878 1.00 35.17 C ATOM 334 CD PRO A 632 53.180 1.996 -24.484 1.00 37.53 C ATOM 335 N GLN A 633 53.137 5.607 -24.123 1.00 34.13 N ATOM 336 CA GLN A 633 52.698 6.831 -23.447 1.00 34.98 C ATOM 337 C GLN A 633 53.068 8.088 -24.216 1.00 34.46 C ATOM 338 O GLN A 633 52.356 9.094 -24.132 1.00 40.65 O ATOM 339 CB GLN A 633 53.301 6.950 -22.039 1.00 41.37 C ATOM 340 CG GLN A 633 53.430 5.676 -21.234 1.00 50.27 C ATOM 341 CD GLN A 633 54.632 4.835 -21.629 1.00 45.80 C ATOM 342 OE1 GLN A 633 54.467 3.743 -22.157 1.00 46.36 O ATOM 343 NE2 GLN A 633 55.842 5.326 -21.350 1.00 46.22 N ATOM 344 HE22 GLN A 633 55.933 6.259 -20.901 1.00 0.00 H ATOM 345 HE21 GLN A 633 56.693 4.775 -21.582 1.00 0.00 H ATOM 346 H GLN A 633 53.788 4.961 -23.633 1.00 0.00 H ATOM 347 N ASP A 634 54.194 8.083 -24.926 1.00 33.72 N ATOM 348 CA ASP A 634 54.571 9.294 -25.644 1.00 35.15 C ATOM 349 C ASP A 634 53.820 9.457 -26.963 1.00 35.90 C ATOM 350 O ASP A 634 53.780 10.568 -27.499 1.00 38.36 O ATOM 351 CB ASP A 634 56.083 9.320 -25.894 1.00 44.26 C ATOM 352 CG ASP A 634 56.546 8.193 -26.801 1.00 40.81 C ATOM 353 OD1 ASP A 634 56.170 7.026 -26.546 1.00 44.62 O ATOM 354 OD2 ASP A 634 57.279 8.475 -27.773 1.00 45.57 O ATOM 355 H ASP A 634 54.792 7.233 -24.967 1.00 0.00 H ATOM 356 N LEU A 635 53.209 8.390 -27.486 1.00 33.28 N ATOM 357 CA LEU A 635 52.456 8.463 -28.736 1.00 31.05 C ATOM 358 C LEU A 635 50.944 8.566 -28.547 1.00 36.57 C ATOM 359 O LEU A 635 50.254 9.037 -29.460 1.00 37.74 O ATOM 360 CB LEU A 635 52.746 7.233 -29.595 1.00 35.06 C ATOM 361 CG LEU A 635 54.208 7.026 -29.965 1.00 36.73 C ATOM 362 CD1 LEU A 635 54.395 5.635 -30.530 1.00 41.95 C ATOM 363 CD2 LEU A 635 54.610 8.075 -30.970 1.00 36.50 C ATOM 364 H LEU A 635 53.271 7.479 -26.988 1.00 0.00 H ATOM 365 N VAL A 636 50.407 8.125 -27.408 1.00 35.24 N ATOM 366 CA VAL A 636 48.959 8.036 -27.218 1.00 36.87 C ATOM 367 C VAL A 636 48.445 9.315 -26.568 1.00 35.98 C ATOM 368 O VAL A 636 48.957 9.741 -25.525 1.00 32.27 O ATOM 369 CB VAL A 636 48.588 6.806 -26.371 1.00 37.09 C ATOM 370 CG1 VAL A 636 47.084 6.784 -26.075 1.00 29.89 C ATOM 371 CG2 VAL A 636 49.012 5.533 -27.084 1.00 38.71 C ATOM 372 H VAL A 636 51.036 7.836 -26.632 1.00 0.00 H ATOM 373 N SER A 637 47.414 9.909 -27.176 1.00 29.03 N ATOM 374 CA SER A 637 46.750 11.082 -26.618 1.00 27.83 C ATOM 375 C SER A 637 46.374 10.885 -25.149 1.00 28.62 C ATOM 376 O SER A 637 45.965 9.799 -24.731 1.00 29.86 O ATOM 377 CB SER A 637 45.493 11.397 -27.425 1.00 29.74 C ATOM 378 OG SER A 637 44.826 12.499 -26.853 1.00 33.32 O ATOM 379 HG SER A 637 44.573 12.282 -25.921 1.00 0.00 H ATOM 380 H SER A 637 47.073 9.521 -28.079 1.00 0.00 H ATOM 381 N LEU A 638 46.476 11.966 -24.371 1.00 25.41 N ATOM 382 CA LEU A 638 46.268 11.859 -22.921 1.00 31.58 C ATOM 383 C LEU A 638 44.812 11.607 -22.543 1.00 31.95 C ATOM 384 O LEU A 638 44.553 11.207 -21.405 1.00 29.02 O ATOM 385 CB LEU A 638 46.767 13.120 -22.208 1.00 29.46 C ATOM 386 CG LEU A 638 48.281 13.279 -22.016 1.00 33.63 C ATOM 387 CD1 LEU A 638 48.639 14.610 -21.353 1.00 29.94 C ATOM 388 CD2 LEU A 638 48.814 12.143 -21.172 1.00 35.61 C ATOM 389 H LEU A 638 46.704 12.888 -24.794 1.00 0.00 H ATOM 390 N ASP A 639 43.858 11.818 -23.463 1.00 29.85 N ATOM 391 CA ASP A 639 42.449 11.568 -23.182 1.00 25.55 C ATOM 392 C ASP A 639 42.014 10.174 -23.587 1.00 31.56 C ATOM 393 O ASP A 639 40.807 9.909 -23.667 1.00 30.26 O ATOM 394 CB ASP A 639 41.566 12.605 -23.869 1.00 26.58 C ATOM 395 CG ASP A 639 41.713 12.588 -25.381 1.00 28.43 C ATOM 396 OD1 ASP A 639 42.577 11.847 -25.899 1.00 31.73 O ATOM 397 OD2 ASP A 639 40.969 13.323 -26.049 1.00 34.64 O ATOM 398 H ASP A 639 44.131 12.170 -24.403 1.00 0.00 H ATOM 399 N PHE A 640 42.970 9.287 -23.854 1.00 31.55 N ATOM 400 CA PHE A 640 42.724 7.900 -24.197 1.00 32.09 C ATOM 401 C PHE A 640 43.386 7.001 -23.157 1.00 37.85 C ATOM 402 O PHE A 640 44.568 7.202 -22.836 1.00 33.53 O ATOM 403 CB PHE A 640 43.271 7.577 -25.613 1.00 30.14 C ATOM 404 CG PHE A 640 42.979 6.178 -26.065 1.00 32.13 C ATOM 405 CD1 PHE A 640 41.753 5.861 -26.624 1.00 32.24 C ATOM 406 CD2 PHE A 640 43.921 5.176 -25.916 1.00 31.51 C ATOM 407 CE1 PHE A 640 41.476 4.567 -27.028 1.00 34.09 C ATOM 408 CE2 PHE A 640 43.649 3.885 -26.315 1.00 32.60 C ATOM 409 CZ PHE A 640 42.429 3.579 -26.867 1.00 30.90 C ATOM 410 H PHE A 640 43.958 9.610 -23.814 1.00 0.00 H ATOM 411 N PRO A 641 42.677 6.009 -22.612 1.00 40.84 N ATOM 412 CA PRO A 641 43.238 5.229 -21.498 1.00 38.11 C ATOM 413 C PRO A 641 44.336 4.282 -21.949 1.00 43.20 C ATOM 414 O PRO A 641 44.222 3.604 -22.975 1.00 41.16 O ATOM 415 CB PRO A 641 42.031 4.453 -20.965 1.00 40.94 C ATOM 416 CG PRO A 641 41.121 4.336 -22.136 1.00 41.46 C ATOM 417 CD PRO A 641 41.318 5.573 -22.973 1.00 39.11 C ATOM 418 N LEU A 642 45.407 4.239 -21.168 1.00 39.26 N ATOM 419 CA LEU A 642 46.460 3.244 -21.322 1.00 39.72 C ATOM 420 C LEU A 642 46.457 2.370 -20.076 1.00 44.68 C ATOM 421 O LEU A 642 46.765 2.848 -18.980 1.00 41.58 O ATOM 422 CB LEU A 642 47.823 3.893 -21.512 1.00 42.74 C ATOM 423 CG LEU A 642 48.129 4.513 -22.862 1.00 45.57 C ATOM 424 CD1 LEU A 642 49.536 5.046 -22.799 1.00 41.56 C ATOM 425 CD2 LEU A 642 47.978 3.480 -23.967 1.00 39.63 C ATOM 426 H LEU A 642 45.499 4.947 -20.412 1.00 0.00 H ATOM 427 N ASN A 643 46.113 1.100 -20.250 1.00 51.17 N ATOM 428 CA ASN A 643 46.099 0.109 -19.180 1.00 50.74 C ATOM 429 C ASN A 643 47.086 -0.997 -19.538 1.00 55.17 C ATOM 430 O ASN A 643 46.693 -2.137 -19.801 1.00 59.52 O ATOM 431 CB ASN A 643 44.685 -0.451 -18.978 1.00 54.92 C ATOM 432 CG ASN A 643 43.629 0.635 -18.936 1.00 57.59 C ATOM 433 OD1 ASN A 643 43.490 1.333 -17.933 1.00 57.52 O ATOM 434 ND2 ASN A 643 42.870 0.782 -20.030 1.00 56.34 N ATOM 435 HD22 ASN A 643 43.023 0.169 -20.856 1.00 0.00 H ATOM 436 HD21 ASN A 643 42.127 1.510 -20.054 1.00 0.00 H ATOM 437 H ASN A 643 45.837 0.794 -21.205 1.00 0.00 H ATOM 438 N VAL A 644 48.370 -0.658 -19.571 1.00 41.43 N ATOM 439 CA VAL A 644 49.417 -1.618 -19.890 1.00 54.41 C ATOM 440 C VAL A 644 50.339 -1.733 -18.685 1.00 54.03 C ATOM 441 O VAL A 644 50.745 -0.718 -18.104 1.00 49.33 O ATOM 442 CB VAL A 644 50.196 -1.226 -21.165 1.00 48.37 C ATOM 443 CG1 VAL A 644 49.270 -1.241 -22.380 1.00 46.26 C ATOM 444 CG2 VAL A 644 50.857 0.136 -21.018 1.00 49.65 C ATOM 445 H VAL A 644 48.636 0.325 -19.362 1.00 0.00 H ATOM 446 N ARG A 645 50.635 -2.967 -18.289 1.00 55.41 N ATOM 447 CA ARG A 645 51.609 -3.177 -17.232 1.00 55.70 C ATOM 448 C ARG A 645 52.978 -2.684 -17.687 1.00 59.37 C ATOM 449 O ARG A 645 53.243 -2.524 -18.887 1.00 56.10 O ATOM 450 CB ARG A 645 51.681 -4.655 -16.850 1.00 56.71 C ATOM 451 H ARG A 645 50.169 -3.782 -18.736 1.00 0.00 H ATOM 452 N LYS A 646 53.844 -2.416 -16.709 1.00 61.01 N ATOM 453 CA LYS A 646 55.244 -2.124 -16.995 1.00 63.13 C ATOM 454 C LYS A 646 55.805 -3.155 -17.964 1.00 57.14 C ATOM 455 O LYS A 646 55.689 -4.364 -17.740 1.00 60.96 O ATOM 456 CB LYS A 646 56.058 -2.118 -15.695 1.00 57.32 C ATOM 457 H LYS A 646 53.514 -2.415 -15.723 1.00 0.00 H ATOM 458 N GLY A 647 56.371 -2.675 -19.067 1.00 57.80 N ATOM 459 CA GLY A 647 56.939 -3.568 -20.053 1.00 59.92 C ATOM 460 C GLY A 647 55.946 -4.302 -20.926 1.00 60.92 C ATOM 461 O GLY A 647 56.356 -5.187 -21.686 1.00 63.57 O ATOM 462 H GLY A 647 56.406 -1.647 -19.222 1.00 0.00 H ATOM 463 N HIS A 648 54.655 -3.973 -20.845 1.00 59.35 N ATOM 464 CA HIS A 648 53.674 -4.563 -21.750 1.00 57.90 C ATOM 465 C HIS A 648 53.284 -3.578 -22.852 1.00 57.15 C ATOM 466 O HIS A 648 53.211 -2.366 -22.608 1.00 53.33 O ATOM 467 CB HIS A 648 52.421 -4.990 -20.988 1.00 59.30 C ATOM 468 CG HIS A 648 52.588 -6.263 -20.222 1.00 71.11 C ATOM 469 ND1 HIS A 648 53.634 -6.474 -19.349 1.00 67.70 N ATOM 470 CD2 HIS A 648 51.844 -7.395 -20.200 1.00 77.88 C ATOM 471 CE1 HIS A 648 53.526 -7.680 -18.820 1.00 70.60 C ATOM 472 NE2 HIS A 648 52.446 -8.259 -19.318 1.00 72.30 N ATOM 473 H HIS A 648 54.344 -3.287 -20.128 1.00 0.00 H ATOM 474 N PRO A 649 53.027 -4.057 -24.068 1.00 52.10 N ATOM 475 CA PRO A 649 52.699 -3.156 -25.172 1.00 47.65 C ATOM 476 C PRO A 649 51.198 -2.967 -25.343 1.00 43.25 C ATOM 477 O PRO A 649 50.380 -3.793 -24.935 1.00 41.14 O ATOM 478 CB PRO A 649 53.287 -3.888 -26.386 1.00 41.57 C ATOM 479 CG PRO A 649 53.043 -5.321 -26.055 1.00 45.13 C ATOM 480 CD PRO A 649 53.154 -5.450 -24.534 1.00 51.58 C ATOM 481 N LEU A 650 50.854 -1.843 -25.963 1.00 39.57 N ATOM 482 CA LEU A 650 49.486 -1.592 -26.384 1.00 38.12 C ATOM 483 C LEU A 650 49.226 -2.301 -27.704 1.00 35.93 C ATOM 484 O LEU A 650 50.061 -2.261 -28.611 1.00 33.78 O ATOM 485 CB LEU A 650 49.256 -0.094 -26.551 1.00 38.59 C ATOM 486 CG LEU A 650 47.898 0.353 -27.086 1.00 34.80 C ATOM 487 CD1 LEU A 650 46.793 0.121 -26.048 1.00 39.57 C ATOM 488 CD2 LEU A 650 47.983 1.821 -27.505 1.00 33.20 C ATOM 489 H LEU A 650 51.582 -1.125 -26.152 1.00 0.00 H ATOM 490 N LEU A 651 48.073 -2.961 -27.810 1.00 31.83 N ATOM 491 CA LEU A 651 47.641 -3.519 -29.089 1.00 38.43 C ATOM 492 C LEU A 651 46.853 -2.468 -29.860 1.00 36.55 C ATOM 493 O LEU A 651 45.981 -1.798 -29.294 1.00 36.13 O ATOM 494 CB LEU A 651 46.780 -4.766 -28.894 1.00 44.19 C ATOM 495 CG LEU A 651 47.418 -6.005 -28.270 1.00 44.34 C ATOM 496 CD1 LEU A 651 46.327 -7.001 -27.888 1.00 38.60 C ATOM 497 CD2 LEU A 651 48.400 -6.627 -29.244 1.00 38.84 C ATOM 498 H LEU A 651 47.472 -3.081 -26.970 1.00 0.00 H ATOM 499 N VAL A 652 47.161 -2.321 -31.149 1.00 35.73 N ATOM 500 CA VAL A 652 46.439 -1.408 -32.027 1.00 30.87 C ATOM 501 C VAL A 652 46.151 -2.118 -33.343 1.00 33.46 C ATOM 502 O VAL A 652 46.830 -3.073 -33.716 1.00 32.46 O ATOM 503 CB VAL A 652 47.215 -0.099 -32.289 1.00 26.89 C ATOM 504 CG1 VAL A 652 47.538 0.596 -30.989 1.00 26.91 C ATOM 505 CG2 VAL A 652 48.482 -0.370 -33.097 1.00 29.86 C ATOM 506 H VAL A 652 47.946 -2.879 -31.543 1.00 0.00 H ATOM 507 N ALA A 653 45.115 -1.642 -34.039 1.00 34.18 N ATOM 508 CA ALA A 653 44.762 -2.108 -35.378 1.00 33.99 C ATOM 509 C ALA A 653 45.279 -1.122 -36.418 1.00 26.90 C ATOM 510 O ALA A 653 45.076 0.086 -36.281 1.00 31.31 O ATOM 511 CB ALA A 653 43.241 -2.260 -35.522 1.00 28.43 C ATOM 512 H ALA A 653 44.529 -0.901 -33.605 1.00 0.00 H ATOM 513 N VAL A 654 45.928 -1.632 -37.466 1.00 28.57 N ATOM 514 CA VAL A 654 46.511 -0.788 -38.510 1.00 28.74 C ATOM 515 C VAL A 654 45.860 -1.157 -39.850 1.00 31.53 C ATOM 516 O VAL A 654 46.038 -2.276 -40.347 1.00 30.31 O ATOM 517 CB VAL A 654 48.041 -0.928 -38.584 1.00 29.39 C ATOM 518 CG1 VAL A 654 48.630 0.077 -39.579 1.00 32.35 C ATOM 519 CG2 VAL A 654 48.681 -0.760 -37.217 1.00 31.29 C ATOM 520 H VAL A 654 46.023 -2.665 -37.544 1.00 0.00 H ATOM 521 N LYS A 655 45.110 -0.221 -40.431 1.00 29.26 N ATOM 522 CA LYS A 655 44.519 -0.401 -41.758 1.00 27.87 C ATOM 523 C LYS A 655 45.472 0.175 -42.804 1.00 33.16 C ATOM 524 O LYS A 655 45.819 1.361 -42.753 1.00 34.90 O ATOM 525 CB LYS A 655 43.140 0.264 -41.828 1.00 32.33 C ATOM 526 CG LYS A 655 42.468 0.274 -43.228 1.00 25.94 C ATOM 527 CD LYS A 655 40.993 0.632 -43.118 1.00 26.10 C ATOM 528 CE LYS A 655 40.364 0.836 -44.486 1.00 30.37 C ATOM 529 NZ LYS A 655 38.938 1.247 -44.373 1.00 33.17 N ATOM 530 HZ1 LYS A 655 38.404 0.509 -43.871 1.00 0.00 H ATOM 531 HZ2 LYS A 655 38.877 2.141 -43.845 1.00 0.00 H ATOM 532 HZ3 LYS A 655 38.540 1.378 -45.325 1.00 0.00 H ATOM 533 H LYS A 655 44.938 0.670 -39.923 1.00 0.00 H ATOM 534 N ILE A 656 45.908 -0.667 -43.742 1.00 35.70 N ATOM 535 CA ILE A 656 46.973 -0.327 -44.681 1.00 33.19 C ATOM 536 C ILE A 656 46.413 -0.354 -46.093 1.00 33.61 C ATOM 537 O ILE A 656 45.845 -1.364 -46.520 1.00 35.73 O ATOM 538 CB ILE A 656 48.161 -1.292 -44.558 1.00 31.83 C ATOM 539 CG1 ILE A 656 48.550 -1.441 -43.083 1.00 31.77 C ATOM 540 CG2 ILE A 656 49.338 -0.804 -45.422 1.00 28.87 C ATOM 541 CD1 ILE A 656 49.418 -2.626 -42.798 1.00 36.66 C ATOM 542 H ILE A 656 45.470 -1.608 -43.807 1.00 0.00 H ATOM 543 N LEU A 657 46.593 0.747 -46.815 1.00 32.42 N ATOM 544 CA LEU A 657 46.131 0.849 -48.191 1.00 40.25 C ATOM 545 C LEU A 657 47.145 0.212 -49.134 1.00 43.06 C ATOM 546 O LEU A 657 48.351 0.426 -48.991 1.00 35.62 O ATOM 547 CB LEU A 657 45.925 2.320 -48.558 1.00 34.89 C ATOM 548 CG LEU A 657 45.550 2.673 -49.997 1.00 41.55 C ATOM 549 CD1 LEU A 657 44.065 2.407 -50.249 1.00 41.83 C ATOM 550 CD2 LEU A 657 45.910 4.119 -50.280 1.00 37.43 C ATOM 551 H LEU A 657 47.078 1.560 -46.384 1.00 0.00 H ATOM 552 N ARG A 658 46.649 -0.562 -50.102 1.00 46.95 N ATOM 553 CA ARG A 658 47.516 -1.190 -51.097 1.00 50.25 C ATOM 554 C ARG A 658 48.507 -0.174 -51.666 1.00 46.01 C ATOM 555 O ARG A 658 48.129 0.970 -51.943 1.00 49.70 O ATOM 556 CB ARG A 658 46.677 -1.790 -52.231 1.00 47.92 C ATOM 557 H ARG A 658 45.622 -0.722 -50.149 1.00 0.00 H ATOM 558 N PRO A 659 49.780 -0.540 -51.837 1.00 55.92 N ATOM 559 CA PRO A 659 50.757 0.438 -52.345 1.00 57.17 C ATOM 560 C PRO A 659 50.580 0.775 -53.820 1.00 56.25 C ATOM 561 O PRO A 659 51.249 1.695 -54.305 1.00 57.59 O ATOM 562 CB PRO A 659 52.104 -0.246 -52.089 1.00 46.18 C ATOM 563 CG PRO A 659 51.786 -1.700 -52.162 1.00 58.83 C ATOM 564 CD PRO A 659 50.390 -1.861 -51.602 1.00 58.96 C ATOM 565 N ASP A 660 49.714 0.066 -54.545 1.00 54.73 N ATOM 566 CA ASP A 660 49.365 0.406 -55.920 1.00 62.78 C ATOM 567 C ASP A 660 47.916 0.860 -56.048 1.00 62.32 C ATOM 568 O ASP A 660 47.323 0.747 -57.126 1.00 59.66 O ATOM 569 CB ASP A 660 49.624 -0.780 -56.852 1.00 63.23 C ATOM 570 CG ASP A 660 48.935 -2.053 -56.384 1.00 70.22 C ATOM 571 OD1 ASP A 660 47.707 -2.030 -56.129 1.00 72.61 O ATOM 572 OD2 ASP A 660 49.629 -3.088 -56.284 1.00 75.06 O ATOM 573 H ASP A 660 49.267 -0.767 -54.111 1.00 0.00 H ATOM 574 N ALA A 661 47.325 1.344 -54.961 1.00 57.39 N ATOM 575 CA ALA A 661 45.933 1.763 -54.997 1.00 48.98 C ATOM 576 C ALA A 661 45.737 2.896 -56.003 1.00 46.63 C ATOM 577 O ALA A 661 46.658 3.655 -56.316 1.00 40.59 O ATOM 578 CB ALA A 661 45.484 2.207 -53.603 1.00 44.71 C ATOM 579 H ALA A 661 47.864 1.424 -54.075 1.00 0.00 H ATOM 580 N THR A 662 44.514 3.013 -56.504 1.00 44.08 N ATOM 581 CA THR A 662 44.221 4.082 -57.439 1.00 47.51 C ATOM 582 C THR A 662 44.211 5.438 -56.737 1.00 50.97 C ATOM 583 O THR A 662 44.212 5.544 -55.504 1.00 44.30 O ATOM 584 CB THR A 662 42.880 3.849 -58.120 1.00 44.58 C ATOM 585 OG1 THR A 662 41.851 3.751 -57.128 1.00 43.39 O ATOM 586 CG2 THR A 662 42.932 2.569 -58.939 1.00 40.49 C ATOM 587 HG1 THR A 662 40.979 3.599 -57.572 1.00 0.00 H ATOM 588 H THR A 662 43.769 2.342 -56.228 1.00 0.00 H ATOM 589 N LYS A 663 44.216 6.489 -57.559 1.00 48.49 N ATOM 590 CA LYS A 663 43.983 7.835 -57.052 1.00 48.82 C ATOM 591 C LYS A 663 42.666 7.898 -56.285 1.00 45.48 C ATOM 592 O LYS A 663 42.583 8.517 -55.214 1.00 34.47 O ATOM 593 CB LYS A 663 43.992 8.822 -58.223 1.00 47.51 C ATOM 594 CG LYS A 663 44.536 10.199 -57.908 1.00 52.40 C ATOM 595 CD LYS A 663 44.907 10.954 -59.184 1.00 56.92 C ATOM 596 CE LYS A 663 46.226 10.452 -59.765 1.00 58.77 C ATOM 597 NZ LYS A 663 46.620 11.179 -61.010 1.00 67.68 N ATOM 598 HZ1 LYS A 663 45.883 11.051 -61.733 1.00 0.00 H ATOM 599 HZ2 LYS A 663 46.728 12.192 -60.799 1.00 0.00 H ATOM 600 HZ3 LYS A 663 47.522 10.798 -61.362 1.00 0.00 H ATOM 601 H LYS A 663 44.388 6.346 -58.575 1.00 0.00 H ATOM 602 N ASN A 664 41.636 7.224 -56.796 1.00 43.62 N ATOM 603 CA ASN A 664 40.332 7.270 -56.145 1.00 43.61 C ATOM 604 C ASN A 664 40.347 6.552 -54.801 1.00 42.24 C ATOM 605 O ASN A 664 39.805 7.061 -53.811 1.00 39.88 O ATOM 606 CB ASN A 664 39.269 6.663 -57.054 1.00 44.36 C ATOM 607 CG ASN A 664 37.904 7.213 -56.764 1.00 52.91 C ATOM 608 OD1 ASN A 664 37.124 6.625 -56.013 1.00 60.56 O ATOM 609 ND2 ASN A 664 37.611 8.370 -57.334 1.00 62.18 N ATOM 610 HD22 ASN A 664 38.301 8.830 -57.961 1.00 0.00 H ATOM 611 HD21 ASN A 664 36.690 8.820 -57.155 1.00 0.00 H ATOM 612 H ASN A 664 41.763 6.663 -57.663 1.00 0.00 H ATOM 613 N ALA A 665 40.915 5.345 -54.753 1.00 41.47 N ATOM 614 CA ALA A 665 40.957 4.610 -53.493 1.00 42.06 C ATOM 615 C ALA A 665 41.802 5.346 -52.468 1.00 38.77 C ATOM 616 O ALA A 665 41.499 5.330 -51.272 1.00 39.30 O ATOM 617 CB ALA A 665 41.499 3.199 -53.711 1.00 34.80 C ATOM 618 H ALA A 665 41.327 4.929 -55.612 1.00 0.00 H ATOM 619 N ARG A 666 42.869 5.990 -52.920 1.00 35.18 N ATOM 620 CA ARG A 666 43.688 6.781 -52.018 1.00 42.10 C ATOM 621 C ARG A 666 42.906 7.970 -51.486 1.00 42.36 C ATOM 622 O ARG A 666 42.994 8.301 -50.298 1.00 31.73 O ATOM 623 CB ARG A 666 44.948 7.225 -52.750 1.00 38.83 C ATOM 624 CG ARG A 666 45.655 8.410 -52.157 1.00 42.71 C ATOM 625 CD ARG A 666 46.805 8.778 -53.065 1.00 43.13 C ATOM 626 NE ARG A 666 47.550 7.588 -53.463 1.00 45.15 N ATOM 627 CZ ARG A 666 48.657 7.163 -52.856 1.00 53.79 C ATOM 628 NH1 ARG A 666 49.154 7.838 -51.821 1.00 42.87 N ATOM 629 NH2 ARG A 666 49.269 6.066 -53.289 1.00 49.86 N ATOM 630 HE ARG A 666 47.195 7.038 -54.271 1.00 0.00 H ATOM 631 HH12 ARG A 666 50.018 7.504 -51.349 1.00 0.00 H ATOM 632 HH11 ARG A 666 48.678 8.699 -51.485 1.00 0.00 H ATOM 633 HH22 ARG A 666 50.133 5.732 -52.817 1.00 0.00 H ATOM 634 HH21 ARG A 666 48.884 5.541 -54.100 1.00 0.00 H ATOM 635 H ARG A 666 43.121 5.928 -53.927 1.00 0.00 H ATOM 636 N ASN A 667 42.121 8.609 -52.354 1.00 34.76 N ATOM 637 CA ASN A 667 41.271 9.714 -51.934 1.00 36.09 C ATOM 638 C ASN A 667 40.210 9.249 -50.939 1.00 39.08 C ATOM 639 O ASN A 667 39.920 9.948 -49.963 1.00 32.43 O ATOM 640 CB ASN A 667 40.630 10.351 -53.171 1.00 34.94 C ATOM 641 CG ASN A 667 39.810 11.588 -52.849 1.00 36.75 C ATOM 642 OD1 ASN A 667 40.356 12.666 -52.611 1.00 38.35 O ATOM 643 ND2 ASN A 667 38.486 11.447 -52.886 1.00 36.34 N ATOM 644 HD22 ASN A 667 38.068 10.517 -53.091 1.00 0.00 H ATOM 645 HD21 ASN A 667 37.871 12.267 -52.710 1.00 0.00 H ATOM 646 H ASN A 667 42.116 8.312 -53.351 1.00 0.00 H ATOM 647 N ASP A 668 39.605 8.080 -51.183 1.00 35.01 N ATOM 648 CA ASP A 668 38.633 7.536 -50.243 1.00 36.61 C ATOM 649 C ASP A 668 39.278 7.267 -48.888 1.00 35.77 C ATOM 650 O ASP A 668 38.670 7.527 -47.846 1.00 32.05 O ATOM 651 CB ASP A 668 38.017 6.248 -50.794 1.00 33.66 C ATOM 652 CG ASP A 668 37.029 6.493 -51.942 1.00 47.38 C ATOM 653 OD1 ASP A 668 36.617 7.652 -52.182 1.00 40.92 O ATOM 654 OD2 ASP A 668 36.661 5.502 -52.612 1.00 53.75 O ATOM 655 H ASP A 668 39.831 7.555 -52.052 1.00 0.00 H ATOM 656 N PHE A 669 40.510 6.736 -48.897 1.00 33.69 N ATOM 657 CA PHE A 669 41.239 6.433 -47.664 1.00 31.54 C ATOM 658 C PHE A 669 41.474 7.697 -46.846 1.00 32.98 C ATOM 659 O PHE A 669 41.174 7.740 -45.647 1.00 35.32 O ATOM 660 CB PHE A 669 42.562 5.740 -48.015 1.00 34.18 C ATOM 661 CG PHE A 669 43.313 5.139 -46.834 1.00 35.63 C ATOM 662 CD1 PHE A 669 44.220 5.896 -46.101 1.00 30.05 C ATOM 663 CD2 PHE A 669 43.166 3.798 -46.508 1.00 31.20 C ATOM 664 CE1 PHE A 669 44.937 5.333 -45.030 1.00 31.68 C ATOM 665 CE2 PHE A 669 43.880 3.228 -45.451 1.00 30.85 C ATOM 666 CZ PHE A 669 44.764 3.998 -44.708 1.00 29.68 C ATOM 667 H PHE A 669 40.963 6.533 -49.811 1.00 0.00 H ATOM 668 N LEU A 670 41.972 8.757 -47.488 1.00 31.41 N ATOM 669 CA LEU A 670 42.233 9.996 -46.764 1.00 31.19 C ATOM 670 C LEU A 670 40.947 10.662 -46.285 1.00 37.55 C ATOM 671 O LEU A 670 40.952 11.336 -45.245 1.00 29.32 O ATOM 672 CB LEU A 670 43.035 10.953 -47.642 1.00 34.35 C ATOM 673 CG LEU A 670 44.478 10.501 -47.878 1.00 35.36 C ATOM 674 CD1 LEU A 670 45.159 11.335 -48.962 1.00 34.99 C ATOM 675 CD2 LEU A 670 45.251 10.569 -46.566 1.00 36.05 C ATOM 676 H LEU A 670 42.174 8.699 -48.507 1.00 0.00 H ATOM 677 N LYS A 671 39.845 10.506 -47.025 1.00 37.95 N ATOM 678 CA LYS A 671 38.567 11.007 -46.530 1.00 34.41 C ATOM 679 C LYS A 671 38.158 10.281 -45.259 1.00 30.00 C ATOM 680 O LYS A 671 37.683 10.907 -44.308 1.00 27.16 O ATOM 681 CB LYS A 671 37.474 10.874 -47.595 1.00 33.18 C ATOM 682 CG LYS A 671 37.657 11.828 -48.762 1.00 35.82 C ATOM 683 CD LYS A 671 36.341 12.216 -49.434 1.00 42.02 C ATOM 684 CE LYS A 671 35.695 11.060 -50.166 1.00 39.02 C ATOM 685 NZ LYS A 671 34.703 11.571 -51.156 1.00 43.96 N ATOM 686 HZ1 LYS A 671 33.969 12.115 -50.660 1.00 0.00 H ATOM 687 HZ2 LYS A 671 35.186 12.184 -51.843 1.00 0.00 H ATOM 688 HZ3 LYS A 671 34.266 10.769 -51.653 1.00 0.00 H ATOM 689 H LYS A 671 39.898 10.030 -47.948 1.00 0.00 H ATOM 690 N GLU A 672 38.338 8.961 -45.222 1.00 29.31 N ATOM 691 CA GLU A 672 38.041 8.231 -43.998 1.00 31.25 C ATOM 692 C GLU A 672 38.930 8.691 -42.849 1.00 37.26 C ATOM 693 O GLU A 672 38.465 8.799 -41.708 1.00 35.84 O ATOM 694 CB GLU A 672 38.171 6.722 -44.213 1.00 27.26 C ATOM 695 CG GLU A 672 37.969 5.922 -42.921 1.00 31.96 C ATOM 696 CD GLU A 672 37.873 4.427 -43.148 1.00 32.09 C ATOM 697 OE1 GLU A 672 38.493 3.921 -44.107 1.00 35.02 O ATOM 698 OE2 GLU A 672 37.165 3.756 -42.370 1.00 33.24 O ATOM 699 H GLU A 672 38.688 8.456 -46.061 1.00 0.00 H ATOM 700 N VAL A 673 40.207 8.987 -43.124 1.00 31.83 N ATOM 701 CA VAL A 673 41.097 9.459 -42.061 1.00 33.64 C ATOM 702 C VAL A 673 40.587 10.770 -41.475 1.00 36.55 C ATOM 703 O VAL A 673 40.537 10.940 -40.252 1.00 32.53 O ATOM 704 CB VAL A 673 42.541 9.611 -42.574 1.00 34.20 C ATOM 705 CG1 VAL A 673 43.373 10.384 -41.558 1.00 38.34 C ATOM 706 CG2 VAL A 673 43.164 8.259 -42.832 1.00 31.77 C ATOM 707 H VAL A 673 40.567 8.881 -44.094 1.00 0.00 H ATOM 708 N LYS A 674 40.220 11.727 -42.338 1.00 35.54 N ATOM 709 CA LYS A 674 39.791 13.034 -41.843 1.00 35.64 C ATOM 710 C LYS A 674 38.537 12.916 -40.995 1.00 30.90 C ATOM 711 O LYS A 674 38.413 13.578 -39.959 1.00 38.59 O ATOM 712 CB LYS A 674 39.544 14.006 -42.994 1.00 37.35 C ATOM 713 CG LYS A 674 38.831 15.297 -42.567 1.00 41.48 C ATOM 714 CD LYS A 674 38.923 16.407 -43.620 1.00 49.26 C ATOM 715 CE LYS A 674 40.386 16.832 -43.837 1.00 58.11 C ATOM 716 NZ LYS A 674 40.540 18.037 -44.706 1.00 49.64 N ATOM 717 HZ1 LYS A 674 40.132 17.842 -45.643 1.00 0.00 H ATOM 718 HZ2 LYS A 674 40.045 18.842 -44.272 1.00 0.00 H ATOM 719 HZ3 LYS A 674 41.550 18.263 -44.807 1.00 0.00 H ATOM 720 H LYS A 674 40.240 11.540 -43.361 1.00 0.00 H ATOM 721 N ILE A 675 37.596 12.077 -41.412 1.00 31.18 N ATOM 722 CA ILE A 675 36.364 11.947 -40.649 1.00 34.20 C ATOM 723 C ILE A 675 36.630 11.310 -39.294 1.00 32.76 C ATOM 724 O ILE A 675 36.056 11.721 -38.279 1.00 32.75 O ATOM 725 CB ILE A 675 35.332 11.155 -41.459 1.00 34.72 C ATOM 726 CG1 ILE A 675 34.760 12.077 -42.531 1.00 35.60 C ATOM 727 CG2 ILE A 675 34.262 10.576 -40.537 1.00 27.58 C ATOM 728 CD1 ILE A 675 33.954 11.383 -43.502 1.00 36.46 C ATOM 729 H ILE A 675 37.738 11.517 -42.277 1.00 0.00 H ATOM 730 N MET A 676 37.481 10.284 -39.257 1.00 33.46 N ATOM 731 CA MET A 676 37.773 9.618 -37.989 1.00 37.13 C ATOM 732 C MET A 676 38.527 10.523 -37.033 1.00 35.02 C ATOM 733 O MET A 676 38.320 10.439 -35.815 1.00 34.86 O ATOM 734 CB MET A 676 38.579 8.349 -38.234 1.00 31.78 C ATOM 735 CG MET A 676 37.857 7.380 -39.100 1.00 35.30 C ATOM 736 SD MET A 676 38.713 5.828 -39.128 1.00 37.65 S ATOM 737 CE MET A 676 38.249 5.214 -37.493 1.00 30.49 C ATOM 738 H MET A 676 37.938 9.957 -40.132 1.00 0.00 H ATOM 739 N SER A 677 39.399 11.385 -37.564 1.00 30.93 N ATOM 740 CA SER A 677 40.242 12.236 -36.729 1.00 37.98 C ATOM 741 C SER A 677 39.428 13.176 -35.854 1.00 39.64 C ATOM 742 O SER A 677 39.967 13.752 -34.904 1.00 38.73 O ATOM 743 CB SER A 677 41.182 13.056 -37.606 1.00 39.94 C ATOM 744 OG SER A 677 40.460 14.070 -38.282 1.00 39.64 O ATOM 745 HG SER A 677 39.765 13.655 -38.851 1.00 0.00 H ATOM 746 H SER A 677 39.479 11.452 -38.599 1.00 0.00 H ATOM 747 N ARG A 678 38.147 13.344 -36.163 1.00 36.08 N ATOM 748 CA ARG A 678 37.262 14.226 -35.423 1.00 39.30 C ATOM 749 C ARG A 678 36.611 13.560 -34.212 1.00 32.05 C ATOM 750 O ARG A 678 36.084 14.268 -33.350 1.00 39.01 O ATOM 751 CB ARG A 678 36.173 14.747 -36.376 1.00 39.57 C ATOM 752 CG ARG A 678 35.279 15.836 -35.824 1.00 41.47 C ATOM 753 CD ARG A 678 34.248 16.311 -36.864 1.00 40.30 C ATOM 754 NE ARG A 678 33.322 17.268 -36.259 1.00 42.59 N ATOM 755 CZ ARG A 678 32.107 17.539 -36.721 1.00 44.36 C ATOM 756 NH1 ARG A 678 31.650 16.926 -37.812 1.00 41.21 N ATOM 757 NH2 ARG A 678 31.344 18.418 -36.085 1.00 35.71 N ATOM 758 HE ARG A 678 33.638 17.772 -35.406 1.00 0.00 H ATOM 759 HH12 ARG A 678 30.698 17.142 -38.169 1.00 0.00 H ATOM 760 HH11 ARG A 678 32.246 16.231 -38.306 1.00 0.00 H ATOM 761 HH22 ARG A 678 30.392 18.634 -36.442 1.00 0.00 H ATOM 762 HH21 ARG A 678 31.698 18.891 -35.229 1.00 0.00 H ATOM 763 H ARG A 678 37.760 12.819 -36.973 1.00 0.00 H ATOM 764 N LEU A 679 36.628 12.229 -34.114 1.00 32.48 N ATOM 765 CA LEU A 679 35.701 11.504 -33.246 1.00 30.26 C ATOM 766 C LEU A 679 36.406 11.036 -31.971 1.00 34.96 C ATOM 767 O LEU A 679 37.141 10.045 -31.988 1.00 32.36 O ATOM 768 CB LEU A 679 35.090 10.318 -33.984 1.00 29.94 C ATOM 769 CG LEU A 679 34.385 10.627 -35.312 1.00 34.22 C ATOM 770 CD1 LEU A 679 33.849 9.351 -35.908 1.00 35.38 C ATOM 771 CD2 LEU A 679 33.266 11.635 -35.116 1.00 32.53 C ATOM 772 H LEU A 679 37.322 11.691 -34.672 1.00 0.00 H ATOM 773 N LYS A 680 36.128 11.714 -30.859 1.00 33.27 N ATOM 774 CA LYS A 680 36.783 11.446 -29.577 1.00 29.73 C ATOM 775 C LYS A 680 35.694 11.190 -28.542 1.00 31.48 C ATOM 776 O LYS A 680 35.124 12.128 -27.980 1.00 35.46 O ATOM 777 CB LYS A 680 37.677 12.611 -29.161 1.00 36.94 C ATOM 778 CG LYS A 680 38.638 13.111 -30.237 1.00 28.82 C ATOM 779 CD LYS A 680 39.622 12.045 -30.658 1.00 40.79 C ATOM 780 CE LYS A 680 40.700 12.607 -31.623 1.00 44.32 C ATOM 781 NZ LYS A 680 41.395 11.560 -32.467 1.00 37.39 N ATOM 782 HZ1 LYS A 680 41.872 10.876 -31.845 1.00 0.00 H ATOM 783 HZ2 LYS A 680 40.692 11.066 -33.053 1.00 0.00 H ATOM 784 HZ3 LYS A 680 42.097 12.021 -33.080 1.00 0.00 H ATOM 785 H LYS A 680 35.413 12.468 -30.903 1.00 0.00 H ATOM 786 N ASP A 681 35.399 9.919 -28.299 1.00 26.89 N ATOM 787 CA ASP A 681 34.365 9.558 -27.346 1.00 29.48 C ATOM 788 C ASP A 681 34.679 8.171 -26.828 1.00 32.14 C ATOM 789 O ASP A 681 35.256 7.357 -27.563 1.00 31.06 O ATOM 790 CB ASP A 681 32.975 9.584 -27.997 1.00 26.78 C ATOM 791 CG ASP A 681 31.878 9.378 -27.005 1.00 29.43 C ATOM 792 OD1 ASP A 681 31.469 10.373 -26.375 1.00 33.82 O ATOM 793 OD2 ASP A 681 31.448 8.219 -26.823 1.00 30.05 O ATOM 794 H ASP A 681 35.917 9.169 -28.800 1.00 0.00 H ATOM 795 N PRO A 682 34.344 7.878 -25.571 1.00 32.32 N ATOM 796 CA PRO A 682 34.560 6.523 -25.050 1.00 29.77 C ATOM 797 C PRO A 682 33.858 5.434 -25.835 1.00 27.69 C ATOM 798 O PRO A 682 34.262 4.269 -25.731 1.00 28.87 O ATOM 799 CB PRO A 682 34.007 6.615 -23.617 1.00 28.98 C ATOM 800 CG PRO A 682 34.226 8.041 -23.252 1.00 31.08 C ATOM 801 CD PRO A 682 33.938 8.816 -24.505 1.00 27.06 C ATOM 802 N ASN A 683 32.812 5.751 -26.599 1.00 28.95 N ATOM 803 CA ASN A 683 32.050 4.719 -27.292 1.00 28.81 C ATOM 804 C ASN A 683 32.072 4.900 -28.805 1.00 26.29 C ATOM 805 O ASN A 683 31.154 4.457 -29.500 1.00 29.02 O ATOM 806 CB ASN A 683 30.616 4.667 -26.771 1.00 26.25 C ATOM 807 CG ASN A 683 30.544 4.220 -25.324 1.00 32.25 C ATOM 808 OD1 ASN A 683 30.211 5.006 -24.441 1.00 30.73 O ATOM 809 ND2 ASN A 683 30.852 2.954 -25.078 1.00 26.46 N ATOM 810 HD22 ASN A 683 31.129 2.325 -25.859 1.00 0.00 H ATOM 811 HD21 ASN A 683 30.817 2.590 -24.104 1.00 0.00 H ATOM 812 H ASN A 683 32.536 6.748 -26.702 1.00 0.00 H ATOM 813 N ILE A 684 33.112 5.544 -29.330 1.00 29.67 N ATOM 814 CA ILE A 684 33.359 5.607 -30.769 1.00 28.46 C ATOM 815 C ILE A 684 34.774 5.098 -31.004 1.00 31.68 C ATOM 816 O ILE A 684 35.684 5.408 -30.224 1.00 27.09 O ATOM 817 CB ILE A 684 33.200 7.036 -31.342 1.00 28.02 C ATOM 818 CG1 ILE A 684 31.863 7.666 -30.939 1.00 28.87 C ATOM 819 CG2 ILE A 684 33.395 7.048 -32.875 1.00 27.40 C ATOM 820 CD1 ILE A 684 30.649 6.980 -31.511 1.00 26.15 C ATOM 821 H ILE A 684 33.777 6.022 -28.689 1.00 0.00 H ATOM 822 N ILE A 685 34.962 4.314 -32.076 1.00 29.59 N ATOM 823 CA ILE A 685 36.310 3.897 -32.455 1.00 26.21 C ATOM 824 C ILE A 685 37.225 5.120 -32.495 1.00 28.79 C ATOM 825 O ILE A 685 36.816 6.215 -32.891 1.00 27.77 O ATOM 826 CB ILE A 685 36.291 3.129 -33.794 1.00 27.47 C ATOM 827 CG1 ILE A 685 37.709 2.684 -34.181 1.00 32.61 C ATOM 828 CG2 ILE A 685 35.642 3.950 -34.945 1.00 25.97 C ATOM 829 CD1 ILE A 685 37.741 1.608 -35.261 1.00 30.64 C ATOM 830 H ILE A 685 34.145 4.002 -32.639 1.00 0.00 H ATOM 831 N ARG A 686 38.461 4.953 -32.029 1.00 28.82 N ATOM 832 CA ARG A 686 39.397 6.063 -31.926 1.00 26.69 C ATOM 833 C ARG A 686 40.496 5.927 -32.970 1.00 32.22 C ATOM 834 O ARG A 686 41.084 4.850 -33.115 1.00 30.31 O ATOM 835 CB ARG A 686 40.019 6.129 -30.533 1.00 28.09 C ATOM 836 CG ARG A 686 41.069 7.224 -30.386 1.00 30.23 C ATOM 837 CD ARG A 686 40.416 8.577 -30.263 1.00 28.20 C ATOM 838 NE ARG A 686 39.702 8.698 -28.993 1.00 37.05 N ATOM 839 CZ ARG A 686 40.167 9.353 -27.930 1.00 34.15 C ATOM 840 NH1 ARG A 686 39.449 9.405 -26.815 1.00 36.26 N ATOM 841 NH2 ARG A 686 41.344 9.962 -27.982 1.00 33.86 N ATOM 842 HE ARG A 686 38.770 8.243 -28.914 1.00 0.00 H ATOM 843 HH12 ARG A 686 39.813 9.916 -25.986 1.00 0.00 H ATOM 844 HH11 ARG A 686 38.523 8.934 -26.771 1.00 0.00 H ATOM 845 HH22 ARG A 686 41.703 10.472 -27.150 1.00 0.00 H ATOM 846 HH21 ARG A 686 41.908 9.930 -28.855 1.00 0.00 H ATOM 847 H ARG A 686 38.766 4.004 -31.731 1.00 0.00 H ATOM 848 N LEU A 687 40.771 7.021 -33.688 1.00 26.54 N ATOM 849 CA LEU A 687 41.967 7.123 -34.519 1.00 28.75 C ATOM 850 C LEU A 687 43.156 7.498 -33.634 1.00 28.55 C ATOM 851 O LEU A 687 43.256 8.632 -33.158 1.00 27.93 O ATOM 852 CB LEU A 687 41.762 8.152 -35.626 1.00 26.65 C ATOM 853 CG LEU A 687 42.895 8.324 -36.633 1.00 31.01 C ATOM 854 CD1 LEU A 687 42.958 7.151 -37.624 1.00 28.06 C ATOM 855 CD2 LEU A 687 42.751 9.654 -37.368 1.00 30.23 C ATOM 856 H LEU A 687 40.112 7.825 -33.653 1.00 0.00 H ATOM 857 N LEU A 688 44.069 6.556 -33.424 1.00 29.35 N ATOM 858 CA LEU A 688 45.230 6.807 -32.575 1.00 28.33 C ATOM 859 C LEU A 688 46.379 7.452 -33.329 1.00 32.75 C ATOM 860 O LEU A 688 47.149 8.207 -32.732 1.00 30.70 O ATOM 861 CB LEU A 688 45.708 5.502 -31.939 1.00 28.01 C ATOM 862 CG LEU A 688 44.718 4.828 -30.992 1.00 28.39 C ATOM 863 CD1 LEU A 688 45.165 3.426 -30.652 1.00 23.42 C ATOM 864 CD2 LEU A 688 44.540 5.640 -29.723 1.00 27.78 C ATOM 865 H LEU A 688 43.955 5.624 -33.872 1.00 0.00 H ATOM 866 N GLY A 689 46.505 7.185 -34.627 1.00 28.96 N ATOM 867 CA GLY A 689 47.560 7.782 -35.419 1.00 27.68 C ATOM 868 C GLY A 689 47.340 7.481 -36.884 1.00 32.33 C ATOM 869 O GLY A 689 46.433 6.732 -37.264 1.00 32.82 O ATOM 870 H GLY A 689 45.832 6.535 -35.081 1.00 0.00 H ATOM 871 N VAL A 690 48.185 8.100 -37.709 1.00 33.31 N ATOM 872 CA VAL A 690 48.184 7.892 -39.152 1.00 32.87 C ATOM 873 C VAL A 690 49.629 7.857 -39.632 1.00 34.83 C ATOM 874 O VAL A 690 50.542 8.340 -38.959 1.00 35.19 O ATOM 875 CB VAL A 690 47.407 8.990 -39.914 1.00 30.38 C ATOM 876 CG1 VAL A 690 45.963 9.035 -39.462 1.00 32.61 C ATOM 877 CG2 VAL A 690 48.080 10.347 -39.720 1.00 29.72 C ATOM 878 H VAL A 690 48.877 8.762 -37.304 1.00 0.00 H ATOM 879 N CYS A 691 49.822 7.269 -40.816 1.00 32.41 N ATOM 880 CA CYS A 691 51.081 7.335 -41.574 1.00 37.90 C ATOM 881 C CYS A 691 50.691 7.717 -42.997 1.00 34.70 C ATOM 882 O CYS A 691 50.337 6.833 -43.780 1.00 36.23 O ATOM 883 CB CYS A 691 51.830 5.999 -41.542 1.00 37.10 C ATOM 884 SG CYS A 691 51.984 5.239 -39.904 1.00 39.33 S ATOM 885 H CYS A 691 49.033 6.731 -41.228 1.00 0.00 H ATOM 886 N VAL A 692 50.739 9.013 -43.331 1.00 39.16 N ATOM 887 CA VAL A 692 50.211 9.472 -44.617 1.00 39.37 C ATOM 888 C VAL A 692 51.214 10.296 -45.421 1.00 45.91 C ATOM 889 O VAL A 692 50.932 10.669 -46.564 1.00 47.09 O ATOM 890 CB VAL A 692 48.911 10.275 -44.417 1.00 41.93 C ATOM 891 CG1 VAL A 692 47.840 9.402 -43.740 1.00 33.59 C ATOM 892 CG2 VAL A 692 49.196 11.549 -43.628 1.00 39.41 C ATOM 893 H VAL A 692 51.155 9.700 -42.670 1.00 0.00 H ATOM 894 N GLN A 693 52.383 10.599 -44.849 1.00 46.29 N ATOM 895 CA GLN A 693 53.360 11.376 -45.609 1.00 52.76 C ATOM 896 C GLN A 693 54.127 10.529 -46.618 1.00 50.43 C ATOM 897 O GLN A 693 54.833 11.088 -47.462 1.00 53.94 O ATOM 898 CB GLN A 693 54.353 12.081 -44.673 1.00 53.03 C ATOM 899 CG GLN A 693 53.710 13.073 -43.690 1.00 61.92 C ATOM 900 CD GLN A 693 53.244 14.367 -44.344 1.00 64.89 C ATOM 901 OE1 GLN A 693 53.952 14.955 -45.164 1.00 69.50 O ATOM 902 NE2 GLN A 693 52.052 14.824 -43.967 1.00 62.89 N ATOM 903 HE22 GLN A 693 51.488 14.295 -43.272 1.00 0.00 H ATOM 904 HE21 GLN A 693 51.684 15.710 -44.368 1.00 0.00 H ATOM 905 H GLN A 693 52.594 10.287 -43.880 1.00 0.00 H ATOM 906 N ASP A 694 54.009 9.207 -46.544 1.00 46.72 N ATOM 907 CA ASP A 694 54.654 8.303 -47.482 1.00 45.53 C ATOM 908 C ASP A 694 53.764 7.077 -47.646 1.00 43.15 C ATOM 909 O ASP A 694 52.809 6.873 -46.894 1.00 43.93 O ATOM 910 CB ASP A 694 56.083 7.933 -47.020 1.00 53.16 C ATOM 911 CG ASP A 694 56.251 7.962 -45.494 1.00 59.66 C ATOM 912 OD1 ASP A 694 55.240 7.847 -44.761 1.00 59.68 O ATOM 913 OD2 ASP A 694 57.402 8.108 -45.019 1.00 66.34 O ATOM 914 H ASP A 694 53.430 8.802 -45.781 1.00 0.00 H ATOM 915 N ASP A 695 54.049 6.299 -48.648 1.00 40.03 N ATOM 916 CA ASP A 695 53.283 5.086 -48.901 1.00 43.49 C ATOM 917 C ASP A 695 53.912 3.907 -48.164 1.00 41.14 C ATOM 918 O ASP A 695 55.118 3.904 -47.902 1.00 49.27 O ATOM 919 CB ASP A 695 53.234 4.781 -50.405 1.00 42.87 C ATOM 920 CG ASP A 695 52.221 5.638 -51.160 1.00 53.75 C ATOM 921 OD1 ASP A 695 51.102 5.861 -50.657 1.00 54.12 O ATOM 922 OD2 ASP A 695 52.542 6.079 -52.286 1.00 54.97 O ATOM 923 H ASP A 695 54.837 6.547 -49.280 1.00 0.00 H ATOM 924 N PRO A 696 53.131 2.896 -47.771 1.00 42.11 N ATOM 925 CA PRO A 696 51.680 2.811 -47.927 1.00 42.38 C ATOM 926 C PRO A 696 50.928 3.592 -46.843 1.00 43.23 C ATOM 927 O PRO A 696 51.399 3.717 -45.711 1.00 39.19 O ATOM 928 CB PRO A 696 51.418 1.311 -47.822 1.00 43.11 C ATOM 929 CG PRO A 696 52.480 0.830 -46.870 1.00 44.43 C ATOM 930 CD PRO A 696 53.680 1.729 -47.056 1.00 42.25 C ATOM 931 N LEU A 697 49.771 4.135 -47.208 1.00 36.17 N ATOM 932 CA LEU A 697 48.974 4.897 -46.258 1.00 41.09 C ATOM 933 C LEU A 697 48.435 3.979 -45.164 1.00 36.31 C ATOM 934 O LEU A 697 48.031 2.841 -45.421 1.00 34.20 O ATOM 935 CB LEU A 697 47.832 5.609 -46.986 1.00 44.38 C ATOM 936 CG LEU A 697 48.228 6.591 -48.097 1.00 36.22 C ATOM 937 CD1 LEU A 697 46.999 7.305 -48.614 1.00 38.37 C ATOM 938 CD2 LEU A 697 49.247 7.596 -47.606 1.00 36.79 C ATOM 939 H LEU A 697 49.431 4.014 -48.184 1.00 0.00 H ATOM 940 N CYS A 698 48.468 4.473 -43.932 1.00 30.88 N ATOM 941 CA CYS A 698 48.054 3.725 -42.759 1.00 35.71 C ATOM 942 C CYS A 698 47.160 4.598 -41.893 1.00 32.04 C ATOM 943 O CYS A 698 47.329 5.819 -41.827 1.00 34.25 O ATOM 944 CB CYS A 698 49.268 3.259 -41.901 1.00 36.03 C ATOM 945 SG CYS A 698 50.292 1.984 -42.645 1.00 45.56 S ATOM 946 H CYS A 698 48.808 5.447 -43.801 1.00 0.00 H ATOM 947 N MET A 699 46.204 3.964 -41.235 1.00 31.07 N ATOM 948 CA MET A 699 45.464 4.604 -40.161 1.00 32.57 C ATOM 949 C MET A 699 45.445 3.622 -39.004 1.00 30.78 C ATOM 950 O MET A 699 45.272 2.418 -39.208 1.00 35.48 O ATOM 951 CB MET A 699 44.042 5.029 -40.595 1.00 31.05 C ATOM 952 CG MET A 699 43.123 3.914 -41.021 1.00 32.08 C ATOM 953 SD MET A 699 41.478 4.557 -41.409 1.00 40.65 S ATOM 954 CE MET A 699 41.648 4.905 -43.151 1.00 29.80 C ATOM 955 H MET A 699 45.976 2.983 -41.493 1.00 0.00 H ATOM 956 N ILE A 700 45.697 4.127 -37.803 1.00 26.51 N ATOM 957 CA ILE A 700 45.850 3.297 -36.616 1.00 29.25 C ATOM 958 C ILE A 700 44.662 3.565 -35.697 1.00 27.60 C ATOM 959 O ILE A 700 44.376 4.720 -35.361 1.00 30.84 O ATOM 960 CB ILE A 700 47.187 3.577 -35.917 1.00 32.54 C ATOM 961 CG1 ILE A 700 48.340 3.369 -36.914 1.00 31.83 C ATOM 962 CG2 ILE A 700 47.344 2.711 -34.651 1.00 30.03 C ATOM 963 CD1 ILE A 700 49.470 4.377 -36.761 1.00 32.80 C ATOM 964 H ILE A 700 45.789 5.158 -37.705 1.00 0.00 H ATOM 965 N THR A 701 43.945 2.509 -35.328 1.00 25.87 N ATOM 966 CA THR A 701 42.791 2.621 -34.446 1.00 29.25 C ATOM 967 C THR A 701 43.057 1.828 -33.175 1.00 27.94 C ATOM 968 O THR A 701 43.959 0.990 -33.126 1.00 27.74 O ATOM 969 CB THR A 701 41.488 2.113 -35.113 1.00 24.97 C ATOM 970 OG1 THR A 701 41.513 0.684 -35.207 1.00 27.41 O ATOM 971 CG2 THR A 701 41.311 2.696 -36.528 1.00 23.70 C ATOM 972 HG1 THR A 701 41.588 0.296 -34.299 1.00 0.00 H ATOM 973 H THR A 701 44.217 1.569 -35.681 1.00 0.00 H ATOM 974 N ASP A 702 42.265 2.095 -32.136 1.00 29.30 N ATOM 975 CA ASP A 702 42.332 1.204 -30.995 1.00 28.24 C ATOM 976 C ASP A 702 41.780 -0.163 -31.395 1.00 32.22 C ATOM 977 O ASP A 702 41.075 -0.315 -32.398 1.00 31.50 O ATOM 978 CB ASP A 702 41.622 1.799 -29.758 1.00 27.88 C ATOM 979 CG ASP A 702 40.173 2.196 -29.998 1.00 27.67 C ATOM 980 OD1 ASP A 702 39.758 2.404 -31.149 1.00 32.08 O ATOM 981 OD2 ASP A 702 39.433 2.333 -28.992 1.00 30.58 O ATOM 982 H ASP A 702 41.623 2.913 -32.144 1.00 0.00 H ATOM 983 N TYR A 703 42.175 -1.179 -30.639 1.00 28.96 N ATOM 984 CA TYR A 703 41.855 -2.558 -30.963 1.00 31.72 C ATOM 985 C TYR A 703 40.803 -3.071 -29.994 1.00 29.80 C ATOM 986 O TYR A 703 40.970 -2.967 -28.775 1.00 30.86 O ATOM 987 CB TYR A 703 43.110 -3.433 -30.919 1.00 32.57 C ATOM 988 CG TYR A 703 42.837 -4.903 -31.145 1.00 32.29 C ATOM 989 CD1 TYR A 703 42.243 -5.349 -32.320 1.00 33.07 C ATOM 990 CD2 TYR A 703 43.181 -5.842 -30.187 1.00 35.32 C ATOM 991 CE1 TYR A 703 41.997 -6.696 -32.529 1.00 33.62 C ATOM 992 CE2 TYR A 703 42.946 -7.188 -30.387 1.00 38.49 C ATOM 993 CZ TYR A 703 42.356 -7.612 -31.555 1.00 37.23 C ATOM 994 OH TYR A 703 42.119 -8.957 -31.735 1.00 44.31 O ATOM 995 HH TYR A 703 41.693 -9.101 -32.617 1.00 0.00 H ATOM 996 H TYR A 703 42.733 -0.981 -29.784 1.00 0.00 H ATOM 997 N MET A 704 39.729 -3.623 -30.544 1.00 29.89 N ATOM 998 CA MET A 704 38.599 -4.167 -29.797 1.00 31.49 C ATOM 999 C MET A 704 38.632 -5.682 -29.966 1.00 34.14 C ATOM 1000 O MET A 704 38.138 -6.215 -30.966 1.00 29.64 O ATOM 1001 CB MET A 704 37.288 -3.570 -30.302 1.00 28.49 C ATOM 1002 CG MET A 704 36.857 -2.276 -29.592 1.00 31.78 C ATOM 1003 SD MET A 704 37.911 -0.812 -29.783 1.00 29.85 S ATOM 1004 CE MET A 704 37.617 -0.379 -31.499 1.00 27.12 C ATOM 1005 H MET A 704 39.689 -3.672 -31.582 1.00 0.00 H ATOM 1006 N GLU A 705 39.181 -6.378 -28.964 1.00 30.13 N ATOM 1007 CA GLU A 705 39.611 -7.761 -29.134 1.00 29.45 C ATOM 1008 C GLU A 705 38.468 -8.741 -29.359 1.00 37.92 C ATOM 1009 O GLU A 705 38.732 -9.872 -29.779 1.00 41.60 O ATOM 1010 CB GLU A 705 40.434 -8.213 -27.926 1.00 37.57 C ATOM 1011 CG GLU A 705 39.660 -8.239 -26.619 1.00 38.48 C ATOM 1012 CD GLU A 705 40.521 -8.683 -25.456 1.00 46.82 C ATOM 1013 OE1 GLU A 705 39.963 -9.112 -24.426 1.00 47.07 O ATOM 1014 OE2 GLU A 705 41.759 -8.598 -25.579 1.00 53.23 O ATOM 1015 H GLU A 705 39.305 -5.920 -28.038 1.00 0.00 H ATOM 1016 N ASN A 706 37.219 -8.352 -29.116 1.00 33.44 N ATOM 1017 CA ASN A 706 36.102 -9.277 -29.237 1.00 37.07 C ATOM 1018 C ASN A 706 35.321 -9.135 -30.543 1.00 32.46 C ATOM 1019 O ASN A 706 34.239 -9.721 -30.669 1.00 34.75 O ATOM 1020 CB ASN A 706 35.179 -9.118 -28.028 1.00 33.00 C ATOM 1021 CG ASN A 706 35.809 -9.659 -26.770 1.00 39.49 C ATOM 1022 OD1 ASN A 706 36.185 -10.831 -26.721 1.00 42.09 O ATOM 1023 ND2 ASN A 706 35.980 -8.802 -25.762 1.00 31.66 N ATOM 1024 HD22 ASN A 706 35.645 -7.821 -25.851 1.00 0.00 H ATOM 1025 HD21 ASN A 706 36.448 -9.114 -24.888 1.00 0.00 H ATOM 1026 H ASN A 706 37.037 -7.368 -28.834 1.00 0.00 H ATOM 1027 N GLY A 707 35.848 -8.400 -31.526 1.00 35.80 N ATOM 1028 CA GLY A 707 35.200 -8.337 -32.834 1.00 35.21 C ATOM 1029 C GLY A 707 33.888 -7.558 -32.823 1.00 31.56 C ATOM 1030 O GLY A 707 33.535 -6.876 -31.863 1.00 32.68 O ATOM 1031 H GLY A 707 36.726 -7.869 -31.359 1.00 0.00 H ATOM 1032 N ASP A 708 33.141 -7.693 -33.915 1.00 30.94 N ATOM 1033 CA ASP A 708 31.930 -6.897 -34.017 1.00 29.93 C ATOM 1034 C ASP A 708 30.836 -7.449 -33.099 1.00 27.27 C ATOM 1035 O ASP A 708 30.834 -8.622 -32.711 1.00 30.41 O ATOM 1036 CB ASP A 708 31.463 -6.784 -35.484 1.00 31.82 C ATOM 1037 CG ASP A 708 30.712 -8.018 -36.004 1.00 32.04 C ATOM 1038 OD1 ASP A 708 29.736 -8.478 -35.376 1.00 28.64 O ATOM 1039 OD2 ASP A 708 31.060 -8.493 -37.107 1.00 33.34 O ATOM 1040 H ASP A 708 33.416 -8.349 -34.674 1.00 0.00 H ATOM 1041 N LEU A 709 29.886 -6.573 -32.767 1.00 23.77 N ATOM 1042 CA LEU A 709 28.859 -6.891 -31.774 1.00 28.06 C ATOM 1043 C LEU A 709 27.893 -7.976 -32.247 1.00 33.59 C ATOM 1044 O LEU A 709 27.381 -8.750 -31.426 1.00 31.15 O ATOM 1045 CB LEU A 709 28.086 -5.623 -31.414 1.00 26.79 C ATOM 1046 CG LEU A 709 27.020 -5.720 -30.309 1.00 30.69 C ATOM 1047 CD1 LEU A 709 27.654 -6.139 -28.984 1.00 28.78 C ATOM 1048 CD2 LEU A 709 26.267 -4.406 -30.167 1.00 29.49 C ATOM 1049 H LEU A 709 29.875 -5.640 -33.226 1.00 0.00 H ATOM 1050 N ASN A 710 27.610 -8.044 -33.550 1.00 30.12 N ATOM 1051 CA ASN A 710 26.716 -9.083 -34.047 1.00 25.13 C ATOM 1052 C ASN A 710 27.298 -10.476 -33.797 1.00 29.27 C ATOM 1053 O ASN A 710 26.614 -11.365 -33.272 1.00 31.17 O ATOM 1054 CB ASN A 710 26.449 -8.849 -35.538 1.00 30.44 C ATOM 1055 CG ASN A 710 25.407 -9.782 -36.088 1.00 32.92 C ATOM 1056 OD1 ASN A 710 25.591 -10.998 -36.094 1.00 38.01 O ATOM 1057 ND2 ASN A 710 24.306 -9.221 -36.563 1.00 31.92 N ATOM 1058 HD22 ASN A 710 24.196 -8.187 -36.536 1.00 0.00 H ATOM 1059 HD21 ASN A 710 23.551 -9.814 -36.963 1.00 0.00 H ATOM 1060 H ASN A 710 28.027 -7.357 -34.210 1.00 0.00 H ATOM 1061 N GLN A 711 28.563 -10.682 -34.183 1.00 28.65 N ATOM 1062 CA GLN A 711 29.269 -11.928 -33.891 1.00 32.83 C ATOM 1063 C GLN A 711 29.365 -12.182 -32.392 1.00 31.40 C ATOM 1064 O GLN A 711 29.275 -13.328 -31.936 1.00 29.50 O ATOM 1065 CB GLN A 711 30.682 -11.864 -34.462 1.00 29.32 C ATOM 1066 CG GLN A 711 30.763 -11.680 -35.947 1.00 43.18 C ATOM 1067 CD GLN A 711 30.672 -12.994 -36.660 1.00 45.55 C ATOM 1068 OE1 GLN A 711 29.634 -13.662 -36.622 1.00 44.84 O ATOM 1069 NE2 GLN A 711 31.766 -13.392 -37.306 1.00 55.72 N ATOM 1070 HE22 GLN A 711 32.616 -12.792 -37.308 1.00 0.00 H ATOM 1071 HE21 GLN A 711 31.771 -14.303 -37.809 1.00 0.00 H ATOM 1072 H GLN A 711 29.059 -9.933 -34.707 1.00 0.00 H ATOM 1073 N PHE A 712 29.614 -11.129 -31.624 1.00 29.93 N ATOM 1074 CA PHE A 712 29.799 -11.274 -30.183 1.00 30.70 C ATOM 1075 C PHE A 712 28.525 -11.780 -29.513 1.00 31.26 C ATOM 1076 O PHE A 712 28.557 -12.759 -28.760 1.00 32.50 O ATOM 1077 CB PHE A 712 30.235 -9.930 -29.607 1.00 31.07 C ATOM 1078 CG PHE A 712 30.512 -9.949 -28.140 1.00 32.06 C ATOM 1079 CD1 PHE A 712 31.721 -10.442 -27.651 1.00 29.80 C ATOM 1080 CD2 PHE A 712 29.583 -9.443 -27.249 1.00 31.84 C ATOM 1081 CE1 PHE A 712 31.985 -10.440 -26.290 1.00 34.09 C ATOM 1082 CE2 PHE A 712 29.848 -9.441 -25.880 1.00 36.27 C ATOM 1083 CZ PHE A 712 31.046 -9.939 -25.409 1.00 33.15 C ATOM 1084 H PHE A 712 29.678 -10.185 -32.056 1.00 0.00 H ATOM 1085 N LEU A 713 27.382 -11.148 -29.809 1.00 31.04 N ATOM 1086 CA LEU A 713 26.124 -11.580 -29.205 1.00 32.65 C ATOM 1087 C LEU A 713 25.690 -12.952 -29.709 1.00 37.64 C ATOM 1088 O LEU A 713 25.078 -13.724 -28.956 1.00 33.55 O ATOM 1089 CB LEU A 713 25.022 -10.552 -29.465 1.00 28.81 C ATOM 1090 CG LEU A 713 25.161 -9.180 -28.801 1.00 34.62 C ATOM 1091 CD1 LEU A 713 23.947 -8.303 -29.125 1.00 30.21 C ATOM 1092 CD2 LEU A 713 25.378 -9.307 -27.272 1.00 30.55 C ATOM 1093 H LEU A 713 27.390 -10.346 -30.472 1.00 0.00 H ATOM 1094 N SER A 714 25.995 -13.274 -30.970 1.00 30.08 N ATOM 1095 CA SER A 714 25.657 -14.591 -31.496 1.00 33.24 C ATOM 1096 C SER A 714 26.302 -15.698 -30.671 1.00 36.09 C ATOM 1097 O SER A 714 25.705 -16.764 -30.473 1.00 33.87 O ATOM 1098 CB SER A 714 26.075 -14.682 -32.965 1.00 34.21 C ATOM 1099 OG SER A 714 25.362 -13.730 -33.733 1.00 32.35 O ATOM 1100 HG SER A 714 25.558 -12.821 -33.394 1.00 0.00 H ATOM 1101 H SER A 714 26.476 -12.582 -31.579 1.00 0.00 H ATOM 1102 N ALA A 715 27.511 -15.459 -30.164 1.00 35.70 N ATOM 1103 CA ALA A 715 28.238 -16.461 -29.399 1.00 34.68 C ATOM 1104 C ALA A 715 27.803 -16.531 -27.939 1.00 38.98 C ATOM 1105 O ALA A 715 28.295 -17.401 -27.211 1.00 36.99 O ATOM 1106 CB ALA A 715 29.746 -16.191 -29.484 1.00 32.14 C ATOM 1107 H ALA A 715 27.948 -14.528 -30.320 1.00 0.00 H ATOM 1108 N HIS A 716 26.897 -15.655 -27.501 1.00 39.16 N ATOM 1109 CA HIS A 716 26.369 -15.655 -26.141 1.00 40.79 C ATOM 1110 C HIS A 716 24.936 -16.169 -26.099 1.00 42.21 C ATOM 1111 O HIS A 716 24.140 -15.925 -27.009 1.00 34.37 O ATOM 1112 CB HIS A 716 26.381 -14.249 -25.531 1.00 40.72 C ATOM 1113 CG HIS A 716 27.740 -13.767 -25.155 1.00 39.81 C ATOM 1114 ND1 HIS A 716 28.670 -13.374 -26.089 1.00 33.65 N ATOM 1115 CD2 HIS A 716 28.331 -13.620 -23.944 1.00 40.85 C ATOM 1116 CE1 HIS A 716 29.779 -13.006 -25.472 1.00 41.34 C ATOM 1117 NE2 HIS A 716 29.599 -13.145 -24.170 1.00 39.48 N ATOM 1118 H HIS A 716 26.549 -14.934 -28.164 1.00 0.00 H ATOM 1119 N GLN A 717 24.602 -16.846 -25.006 1.00 38.93 N ATOM 1120 CA GLN A 717 23.233 -17.234 -24.713 1.00 36.42 C ATOM 1121 C GLN A 717 22.682 -16.380 -23.579 1.00 47.27 C ATOM 1122 O GLN A 717 23.431 -15.874 -22.736 1.00 39.28 O ATOM 1123 CB GLN A 717 23.149 -18.717 -24.336 1.00 43.10 C ATOM 1124 CG GLN A 717 23.569 -19.672 -25.448 1.00 45.96 C ATOM 1125 CD GLN A 717 23.408 -21.125 -25.051 1.00 47.56 C ATOM 1126 OE1 GLN A 717 22.290 -21.623 -24.911 1.00 41.79 O ATOM 1127 NE2 GLN A 717 24.529 -21.811 -24.857 1.00 48.03 N ATOM 1128 HE22 GLN A 717 25.451 -21.348 -24.987 1.00 0.00 H ATOM 1129 HE21 GLN A 717 24.484 -22.811 -24.575 1.00 0.00 H ATOM 1130 H GLN A 717 25.350 -17.109 -24.333 1.00 0.00 H ATOM 1131 N LEU A 718 21.362 -16.225 -23.559 1.00 39.38 N ATOM 1132 CA LEU A 718 20.714 -15.433 -22.525 1.00 42.99 C ATOM 1133 C LEU A 718 20.653 -16.238 -21.232 1.00 45.17 C ATOM 1134 O LEU A 718 20.323 -17.429 -21.250 1.00 45.68 O ATOM 1135 CB LEU A 718 19.314 -15.025 -22.981 1.00 41.24 C ATOM 1136 CG LEU A 718 18.446 -14.146 -22.083 1.00 45.49 C ATOM 1137 CD1 LEU A 718 18.953 -12.715 -22.058 1.00 44.82 C ATOM 1138 CD2 LEU A 718 17.003 -14.197 -22.562 1.00 49.11 C ATOM 1139 H LEU A 718 20.783 -16.677 -24.295 1.00 0.00 H ATOM 1140 N GLU A 719 20.991 -15.596 -20.114 1.00 50.22 N ATOM 1141 CA GLU A 719 20.927 -16.241 -18.791 1.00 48.53 C ATOM 1142 C GLU A 719 19.644 -15.892 -18.030 1.00 56.78 C ATOM 1143 O GLU A 719 18.530 -16.124 -18.514 1.00 57.55 O ATOM 1144 CB GLU A 719 22.135 -15.847 -17.946 1.00 49.63 C ATOM 1145 H GLU A 719 21.310 -14.608 -20.178 1.00 0.00 H TER 1146 GLU A 719 ATOM 1147 N GLN A 734 26.384 -25.125 -20.626 1.00 68.54 N ATOM 1148 CA GLN A 734 26.222 -23.847 -21.310 1.00 68.87 C ATOM 1149 C GLN A 734 27.542 -23.378 -21.943 1.00 67.28 C ATOM 1150 O GLN A 734 28.570 -24.047 -21.824 1.00 71.73 O ATOM 1151 CB GLN A 734 25.686 -22.793 -20.331 1.00 62.24 C ATOM 1152 HN3 GLN A 734 27.095 -25.026 -19.873 1.00 0.00 H ATOM 1153 HN2 GLN A 734 26.697 -25.845 -21.308 1.00 0.00 H ATOM 1154 HN1 GLN A 734 25.475 -25.412 -20.211 1.00 0.00 H ATOM 1155 N GLY A 735 27.499 -22.242 -22.640 1.00 64.55 N ATOM 1156 CA GLY A 735 28.694 -21.551 -23.070 1.00 54.15 C ATOM 1157 C GLY A 735 28.779 -20.194 -22.397 1.00 52.94 C ATOM 1158 O GLY A 735 28.356 -20.030 -21.246 1.00 62.67 O ATOM 1159 H GLY A 735 26.572 -21.838 -22.883 1.00 0.00 H ATOM 1160 N PRO A 736 29.330 -19.193 -23.087 1.00 43.33 N ATOM 1161 CA PRO A 736 29.269 -17.821 -22.554 1.00 44.85 C ATOM 1162 C PRO A 736 27.839 -17.292 -22.531 1.00 49.61 C ATOM 1163 O PRO A 736 27.067 -17.483 -23.476 1.00 45.23 O ATOM 1164 CB PRO A 736 30.154 -17.017 -23.516 1.00 40.71 C ATOM 1165 CG PRO A 736 30.365 -17.898 -24.713 1.00 47.24 C ATOM 1166 CD PRO A 736 30.240 -19.311 -24.236 1.00 42.60 C ATOM 1167 N THR A 737 27.476 -16.632 -21.433 1.00 43.37 N ATOM 1168 CA THR A 737 26.120 -16.119 -21.289 1.00 41.20 C ATOM 1169 C THR A 737 26.140 -14.610 -21.080 1.00 39.53 C ATOM 1170 O THR A 737 27.185 -14.001 -20.834 1.00 44.20 O ATOM 1171 CB THR A 737 25.366 -16.800 -20.134 1.00 47.44 C ATOM 1172 OG1 THR A 737 25.953 -16.425 -18.883 1.00 56.85 O ATOM 1173 CG2 THR A 737 25.398 -18.320 -20.274 1.00 46.17 C ATOM 1174 HG1 THR A 737 25.899 -15.442 -18.776 1.00 0.00 H ATOM 1175 H THR A 737 28.167 -16.481 -20.671 1.00 0.00 H ATOM 1176 N ILE A 738 24.956 -14.016 -21.194 1.00 36.27 N ATOM 1177 CA ILE A 738 24.749 -12.581 -21.030 1.00 37.79 C ATOM 1178 C ILE A 738 23.325 -12.380 -20.530 1.00 40.31 C ATOM 1179 O ILE A 738 22.418 -13.132 -20.893 1.00 41.69 O ATOM 1180 CB ILE A 738 25.017 -11.810 -22.348 1.00 43.32 C ATOM 1181 CG1 ILE A 738 24.903 -10.297 -22.129 1.00 40.48 C ATOM 1182 CG2 ILE A 738 24.038 -12.244 -23.434 1.00 38.54 C ATOM 1183 CD1 ILE A 738 25.646 -9.462 -23.164 1.00 36.34 C ATOM 1184 H ILE A 738 24.130 -14.608 -21.413 1.00 0.00 H ATOM 1185 N SER A 739 23.132 -11.388 -19.666 1.00 39.40 N ATOM 1186 CA SER A 739 21.850 -11.168 -19.018 1.00 34.44 C ATOM 1187 C SER A 739 21.224 -9.872 -19.506 1.00 35.73 C ATOM 1188 O SER A 739 21.878 -9.026 -20.123 1.00 33.26 O ATOM 1189 CB SER A 739 22.010 -11.126 -17.494 1.00 44.53 C ATOM 1190 OG SER A 739 22.759 -9.986 -17.111 1.00 31.30 O ATOM 1191 HG SER A 739 23.655 -10.025 -17.530 1.00 0.00 H ATOM 1192 H SER A 739 23.923 -10.750 -19.447 1.00 0.00 H ATOM 1193 N TYR A 740 19.933 -9.736 -19.205 1.00 34.62 N ATOM 1194 CA TYR A 740 19.162 -8.564 -19.613 1.00 35.41 C ATOM 1195 C TYR A 740 19.804 -7.241 -19.214 1.00 38.38 C ATOM 1196 O TYR A 740 19.940 -6.367 -20.086 1.00 38.02 O ATOM 1197 CB TYR A 740 17.730 -8.679 -19.063 1.00 36.45 C ATOM 1198 CG TYR A 740 16.916 -7.432 -19.316 1.00 41.13 C ATOM 1199 CD1 TYR A 740 16.500 -7.106 -20.593 1.00 42.75 C ATOM 1200 CD2 TYR A 740 16.593 -6.565 -18.283 1.00 39.33 C ATOM 1201 CE1 TYR A 740 15.775 -5.958 -20.837 1.00 44.39 C ATOM 1202 CE2 TYR A 740 15.865 -5.418 -18.517 1.00 41.31 C ATOM 1203 CZ TYR A 740 15.461 -5.119 -19.798 1.00 41.04 C ATOM 1204 OH TYR A 740 14.740 -3.977 -20.050 1.00 39.78 O ATOM 1205 HH TYR A 740 14.537 -3.923 -21.017 1.00 0.00 H ATOM 1206 H TYR A 740 19.460 -10.487 -18.663 1.00 0.00 H ATOM 1207 N PRO A 741 20.218 -7.011 -17.957 1.00 36.50 N ATOM 1208 CA PRO A 741 20.826 -5.708 -17.644 1.00 35.10 C ATOM 1209 C PRO A 741 22.135 -5.466 -18.385 1.00 31.59 C ATOM 1210 O PRO A 741 22.454 -4.314 -18.702 1.00 32.49 O ATOM 1211 CB PRO A 741 21.028 -5.770 -16.121 1.00 39.94 C ATOM 1212 CG PRO A 741 21.123 -7.223 -15.813 1.00 39.32 C ATOM 1213 CD PRO A 741 20.170 -7.883 -16.766 1.00 38.13 C ATOM 1214 N MET A 742 22.904 -6.517 -18.668 1.00 30.97 N ATOM 1215 CA MET A 742 24.080 -6.363 -19.519 1.00 34.94 C ATOM 1216 C MET A 742 23.695 -5.961 -20.944 1.00 32.81 C ATOM 1217 O MET A 742 24.395 -5.162 -21.578 1.00 31.46 O ATOM 1218 CB MET A 742 24.891 -7.657 -19.508 1.00 35.38 C ATOM 1219 CG MET A 742 25.300 -8.082 -18.085 1.00 35.30 C ATOM 1220 SD MET A 742 26.123 -9.682 -18.015 1.00 37.04 S ATOM 1221 CE MET A 742 27.674 -9.347 -18.825 1.00 37.83 C ATOM 1222 H MET A 742 22.665 -7.452 -18.280 1.00 0.00 H ATOM 1223 N LEU A 743 22.581 -6.487 -21.467 1.00 36.77 N ATOM 1224 CA LEU A 743 22.141 -6.070 -22.800 1.00 33.35 C ATOM 1225 C LEU A 743 21.730 -4.604 -22.800 1.00 33.47 C ATOM 1226 O LEU A 743 22.025 -3.868 -23.748 1.00 29.64 O ATOM 1227 CB LEU A 743 20.987 -6.955 -23.275 1.00 33.14 C ATOM 1228 CG LEU A 743 21.347 -8.420 -23.529 1.00 36.25 C ATOM 1229 CD1 LEU A 743 20.105 -9.238 -23.807 1.00 37.93 C ATOM 1230 CD2 LEU A 743 22.317 -8.544 -24.688 1.00 31.78 C ATOM 1231 H LEU A 743 22.031 -7.188 -20.930 1.00 0.00 H ATOM 1232 N LEU A 744 21.057 -4.164 -21.730 1.00 33.42 N ATOM 1233 CA LEU A 744 20.718 -2.753 -21.571 1.00 34.70 C ATOM 1234 C LEU A 744 21.961 -1.874 -21.586 1.00 30.25 C ATOM 1235 O LEU A 744 21.952 -0.773 -22.153 1.00 35.30 O ATOM 1236 CB LEU A 744 19.962 -2.544 -20.254 1.00 36.74 C ATOM 1237 CG LEU A 744 18.505 -2.992 -20.172 1.00 39.24 C ATOM 1238 CD1 LEU A 744 17.983 -2.747 -18.763 1.00 46.59 C ATOM 1239 CD2 LEU A 744 17.655 -2.248 -21.180 1.00 32.84 C ATOM 1240 H LEU A 744 20.769 -4.842 -20.996 1.00 0.00 H ATOM 1241 N HIS A 745 23.027 -2.324 -20.927 1.00 34.99 N ATOM 1242 CA HIS A 745 24.252 -1.531 -20.866 1.00 35.60 C ATOM 1243 C HIS A 745 24.937 -1.467 -22.230 1.00 31.36 C ATOM 1244 O HIS A 745 25.476 -0.424 -22.615 1.00 31.08 O ATOM 1245 CB HIS A 745 25.183 -2.121 -19.819 1.00 27.17 C ATOM 1246 CG HIS A 745 26.392 -1.280 -19.549 1.00 34.83 C ATOM 1247 ND1 HIS A 745 27.520 -1.781 -18.941 1.00 33.63 N ATOM 1248 CD2 HIS A 745 26.642 0.028 -19.790 1.00 31.11 C ATOM 1249 CE1 HIS A 745 28.418 -0.819 -18.829 1.00 39.15 C ATOM 1250 NE2 HIS A 745 27.910 0.287 -19.339 1.00 36.11 N ATOM 1251 H HIS A 745 22.987 -3.248 -20.452 1.00 0.00 H ATOM 1252 N VAL A 746 24.932 -2.575 -22.967 1.00 30.46 N ATOM 1253 CA VAL A 746 25.384 -2.555 -24.361 1.00 31.69 C ATOM 1254 C VAL A 746 24.642 -1.472 -25.142 1.00 25.46 C ATOM 1255 O VAL A 746 25.256 -0.594 -25.758 1.00 28.17 O ATOM 1256 CB VAL A 746 25.200 -3.945 -24.997 1.00 31.36 C ATOM 1257 CG1 VAL A 746 25.357 -3.881 -26.538 1.00 25.91 C ATOM 1258 CG2 VAL A 746 26.180 -4.930 -24.374 1.00 30.23 C ATOM 1259 H VAL A 746 24.603 -3.468 -22.548 1.00 0.00 H ATOM 1260 N ALA A 747 23.305 -1.486 -25.077 1.00 27.33 N ATOM 1261 CA ALA A 747 22.525 -0.517 -25.840 1.00 24.52 C ATOM 1262 C ALA A 747 22.713 0.900 -25.326 1.00 31.66 C ATOM 1263 O ALA A 747 22.666 1.848 -26.119 1.00 25.99 O ATOM 1264 CB ALA A 747 21.044 -0.889 -25.814 1.00 28.58 C ATOM 1265 H ALA A 747 22.821 -2.189 -24.482 1.00 0.00 H ATOM 1266 N ALA A 748 22.897 1.067 -24.005 1.00 28.75 N ATOM 1267 CA ALA A 748 23.159 2.394 -23.451 1.00 29.49 C ATOM 1268 C ALA A 748 24.483 2.958 -23.959 1.00 25.32 C ATOM 1269 O ALA A 748 24.584 4.154 -24.253 1.00 32.40 O ATOM 1270 CB ALA A 748 23.162 2.340 -21.915 1.00 28.06 C ATOM 1271 H ALA A 748 22.853 0.244 -23.371 1.00 0.00 H ATOM 1272 N GLN A 749 25.516 2.119 -24.052 1.00 27.26 N ATOM 1273 CA GLN A 749 26.775 2.575 -24.638 1.00 24.21 C ATOM 1274 C GLN A 749 26.596 3.028 -26.082 1.00 26.52 C ATOM 1275 O GLN A 749 27.133 4.070 -26.480 1.00 27.39 O ATOM 1276 CB GLN A 749 27.819 1.474 -24.550 1.00 27.29 C ATOM 1277 CG GLN A 749 28.283 1.213 -23.120 1.00 27.03 C ATOM 1278 CD GLN A 749 29.275 0.104 -23.078 1.00 28.58 C ATOM 1279 OE1 GLN A 749 30.414 0.263 -23.514 1.00 31.69 O ATOM 1280 NE2 GLN A 749 28.852 -1.046 -22.578 1.00 27.90 N ATOM 1281 HE22 GLN A 749 27.879 -1.131 -22.221 1.00 0.00 H ATOM 1282 HE21 GLN A 749 29.493 -1.864 -22.542 1.00 0.00 H ATOM 1283 H GLN A 749 25.426 1.142 -23.708 1.00 0.00 H ATOM 1284 N ILE A 750 25.852 2.265 -26.886 1.00 31.18 N ATOM 1285 CA ILE A 750 25.599 2.686 -28.266 1.00 23.06 C ATOM 1286 C ILE A 750 24.874 4.024 -28.271 1.00 24.99 C ATOM 1287 O ILE A 750 25.293 4.974 -28.943 1.00 26.10 O ATOM 1288 CB ILE A 750 24.824 1.600 -29.032 1.00 25.25 C ATOM 1289 CG1 ILE A 750 25.674 0.340 -29.177 1.00 24.92 C ATOM 1290 CG2 ILE A 750 24.448 2.081 -30.429 1.00 23.50 C ATOM 1291 CD1 ILE A 750 24.866 -0.899 -29.526 1.00 24.05 C ATOM 1292 H ILE A 750 25.452 1.372 -26.533 1.00 0.00 H ATOM 1293 N ALA A 751 23.824 4.147 -27.443 1.00 29.36 N ATOM 1294 CA ALA A 751 23.075 5.399 -27.378 1.00 27.73 C ATOM 1295 C ALA A 751 23.968 6.559 -26.954 1.00 25.81 C ATOM 1296 O ALA A 751 23.846 7.674 -27.480 1.00 30.90 O ATOM 1297 CB ALA A 751 21.887 5.248 -26.423 1.00 31.46 C ATOM 1298 H ALA A 751 23.542 3.345 -26.844 1.00 0.00 H ATOM 1299 N SER A 752 24.869 6.314 -26.002 1.00 27.93 N ATOM 1300 CA SER A 752 25.822 7.342 -25.584 1.00 31.28 C ATOM 1301 C SER A 752 26.748 7.730 -26.724 1.00 31.03 C ATOM 1302 O SER A 752 27.023 8.917 -26.943 1.00 30.26 O ATOM 1303 CB SER A 752 26.639 6.836 -24.390 1.00 27.71 C ATOM 1304 OG SER A 752 27.486 7.850 -23.889 1.00 31.56 O ATOM 1305 HG SER A 752 28.110 8.139 -24.601 1.00 0.00 H ATOM 1306 H SER A 752 24.895 5.378 -25.550 1.00 0.00 H ATOM 1307 N GLY A 753 27.255 6.737 -27.453 1.00 28.03 N ATOM 1308 CA GLY A 753 28.064 7.043 -28.619 1.00 29.46 C ATOM 1309 C GLY A 753 27.298 7.846 -29.652 1.00 29.39 C ATOM 1310 O GLY A 753 27.830 8.794 -30.236 1.00 30.72 O ATOM 1311 H GLY A 753 27.072 5.748 -27.188 1.00 0.00 H ATOM 1312 N MET A 754 26.031 7.491 -29.879 1.00 30.05 N ATOM 1313 CA MET A 754 25.255 8.197 -30.895 1.00 25.91 C ATOM 1314 C MET A 754 24.903 9.608 -30.449 1.00 30.76 C ATOM 1315 O MET A 754 24.869 10.526 -31.276 1.00 30.48 O ATOM 1316 CB MET A 754 23.995 7.411 -31.237 1.00 28.93 C ATOM 1317 CG MET A 754 24.272 6.116 -31.951 1.00 27.14 C ATOM 1318 SD MET A 754 25.141 6.423 -33.515 1.00 28.18 S ATOM 1319 CE MET A 754 23.902 7.290 -34.472 1.00 31.57 C ATOM 1320 H MET A 754 25.599 6.716 -29.336 1.00 0.00 H ATOM 1321 N ARG A 755 24.646 9.798 -29.143 1.00 34.07 N ATOM 1322 CA ARG A 755 24.356 11.131 -28.621 1.00 32.68 C ATOM 1323 C ARG A 755 25.515 12.071 -28.897 1.00 33.49 C ATOM 1324 O ARG A 755 25.312 13.232 -29.280 1.00 35.67 O ATOM 1325 CB ARG A 755 24.062 11.056 -27.109 1.00 37.39 C ATOM 1326 CG ARG A 755 23.705 12.395 -26.426 1.00 37.51 C ATOM 1327 CD ARG A 755 24.202 12.477 -24.963 1.00 37.82 C ATOM 1328 NE ARG A 755 25.635 12.183 -24.905 1.00 46.93 N ATOM 1329 CZ ARG A 755 26.608 13.070 -25.118 1.00 46.75 C ATOM 1330 NH1 ARG A 755 27.876 12.678 -25.074 1.00 44.79 N ATOM 1331 NH2 ARG A 755 26.324 14.348 -25.363 1.00 42.65 N ATOM 1332 HE ARG A 755 25.916 11.207 -24.680 1.00 0.00 H ATOM 1333 HH12 ARG A 755 28.639 13.365 -25.239 1.00 0.00 H ATOM 1334 HH11 ARG A 755 28.106 11.684 -24.874 1.00 0.00 H ATOM 1335 HH22 ARG A 755 27.092 15.029 -25.527 1.00 0.00 H ATOM 1336 HH21 ARG A 755 25.334 14.665 -25.390 1.00 0.00 H ATOM 1337 H ARG A 755 24.654 8.984 -28.495 1.00 0.00 H ATOM 1338 N TYR A 756 26.742 11.573 -28.726 1.00 30.60 N ATOM 1339 CA TYR A 756 27.929 12.350 -29.058 1.00 32.20 C ATOM 1340 C TYR A 756 27.973 12.700 -30.542 1.00 32.19 C ATOM 1341 O TYR A 756 28.274 13.842 -30.912 1.00 34.22 O ATOM 1342 CB TYR A 756 29.191 11.573 -28.652 1.00 31.79 C ATOM 1343 CG TYR A 756 30.469 12.112 -29.266 1.00 26.57 C ATOM 1344 CD1 TYR A 756 31.084 13.239 -28.741 1.00 31.78 C ATOM 1345 CD2 TYR A 756 31.053 11.498 -30.368 1.00 29.97 C ATOM 1346 CE1 TYR A 756 32.245 13.744 -29.290 1.00 39.52 C ATOM 1347 CE2 TYR A 756 32.222 11.998 -30.927 1.00 29.09 C ATOM 1348 CZ TYR A 756 32.813 13.121 -30.377 1.00 29.46 C ATOM 1349 OH TYR A 756 33.960 13.651 -30.905 1.00 28.68 O ATOM 1350 HH TYR A 756 34.228 14.446 -30.379 1.00 0.00 H ATOM 1351 H TYR A 756 26.853 10.610 -28.348 1.00 0.00 H ATOM 1352 N LEU A 757 27.723 11.722 -31.415 1.00 29.44 N ATOM 1353 CA LEU A 757 27.753 12.020 -32.848 1.00 31.24 C ATOM 1354 C LEU A 757 26.716 13.080 -33.205 1.00 33.49 C ATOM 1355 O LEU A 757 26.986 13.976 -34.014 1.00 34.01 O ATOM 1356 CB LEU A 757 27.523 10.751 -33.669 1.00 29.73 C ATOM 1357 CG LEU A 757 28.573 9.635 -33.611 1.00 32.93 C ATOM 1358 CD1 LEU A 757 28.141 8.482 -34.508 1.00 33.44 C ATOM 1359 CD2 LEU A 757 29.960 10.136 -34.001 1.00 28.76 C ATOM 1360 H LEU A 757 27.510 10.760 -31.082 1.00 0.00 H ATOM 1361 N ALA A 758 25.540 13.017 -32.572 1.00 28.99 N ATOM 1362 CA ALA A 758 24.500 14.012 -32.825 1.00 37.34 C ATOM 1363 C ALA A 758 24.983 15.422 -32.496 1.00 35.25 C ATOM 1364 O ALA A 758 24.729 16.365 -33.255 1.00 38.43 O ATOM 1365 CB ALA A 758 23.242 13.670 -32.020 1.00 35.42 C ATOM 1366 H ALA A 758 25.363 12.251 -31.891 1.00 0.00 H ATOM 1367 N THR A 759 25.700 15.587 -31.382 1.00 33.21 N ATOM 1368 CA THR A 759 26.212 16.908 -31.029 1.00 35.18 C ATOM 1369 C THR A 759 27.225 17.436 -32.043 1.00 38.09 C ATOM 1370 O THR A 759 27.434 18.653 -32.120 1.00 38.69 O ATOM 1371 CB THR A 759 26.849 16.873 -29.637 1.00 35.78 C ATOM 1372 OG1 THR A 759 27.999 16.020 -29.669 1.00 36.18 O ATOM 1373 CG2 THR A 759 25.861 16.342 -28.621 1.00 34.20 C ATOM 1374 HG1 THR A 759 27.724 15.106 -29.933 1.00 0.00 H ATOM 1375 H THR A 759 25.894 14.773 -30.764 1.00 0.00 H ATOM 1376 N LEU A 760 27.868 16.559 -32.811 1.00 35.87 N ATOM 1377 CA LEU A 760 28.740 16.998 -33.891 1.00 37.68 C ATOM 1378 C LEU A 760 27.982 17.245 -35.190 1.00 40.07 C ATOM 1379 O LEU A 760 28.608 17.588 -36.197 1.00 40.06 O ATOM 1380 CB LEU A 760 29.839 15.964 -34.142 1.00 37.74 C ATOM 1381 CG LEU A 760 30.788 15.637 -32.993 1.00 38.21 C ATOM 1382 CD1 LEU A 760 31.693 14.494 -33.398 1.00 38.39 C ATOM 1383 CD2 LEU A 760 31.606 16.856 -32.614 1.00 36.41 C ATOM 1384 H LEU A 760 27.745 15.541 -32.636 1.00 0.00 H ATOM 1385 N ASN A 761 26.658 17.075 -35.189 1.00 42.51 N ATOM 1386 CA ASN A 761 25.868 17.139 -36.415 1.00 46.23 C ATOM 1387 C ASN A 761 26.367 16.101 -37.424 1.00 47.16 C ATOM 1388 O ASN A 761 26.462 16.358 -38.627 1.00 43.52 O ATOM 1389 CB ASN A 761 25.884 18.556 -37.004 1.00 45.60 C ATOM 1390 CG ASN A 761 24.968 18.705 -38.203 1.00 59.11 C ATOM 1391 OD1 ASN A 761 23.886 18.113 -38.252 1.00 65.67 O ATOM 1392 ND2 ASN A 761 25.406 19.482 -39.189 1.00 61.08 N ATOM 1393 HD22 ASN A 761 26.325 19.962 -39.104 1.00 0.00 H ATOM 1394 HD21 ASN A 761 24.830 19.610 -40.045 1.00 0.00 H ATOM 1395 H ASN A 761 26.174 16.891 -34.287 1.00 0.00 H ATOM 1396 N PHE A 762 26.701 14.913 -36.925 1.00 40.04 N ATOM 1397 CA PHE A 762 27.273 13.845 -37.738 1.00 43.80 C ATOM 1398 C PHE A 762 26.258 12.713 -37.841 1.00 37.19 C ATOM 1399 O PHE A 762 25.829 12.166 -36.821 1.00 35.13 O ATOM 1400 CB PHE A 762 28.596 13.346 -37.144 1.00 38.39 C ATOM 1401 CG PHE A 762 29.222 12.221 -37.921 1.00 34.57 C ATOM 1402 CD1 PHE A 762 30.111 12.485 -38.940 1.00 42.03 C ATOM 1403 CD2 PHE A 762 28.907 10.899 -37.635 1.00 30.39 C ATOM 1404 CE1 PHE A 762 30.686 11.449 -39.666 1.00 48.05 C ATOM 1405 CE2 PHE A 762 29.473 9.863 -38.347 1.00 30.99 C ATOM 1406 CZ PHE A 762 30.363 10.136 -39.367 1.00 43.33 C ATOM 1407 H PHE A 762 26.548 14.738 -35.911 1.00 0.00 H ATOM 1408 N VAL A 763 25.876 12.367 -39.069 1.00 37.71 N ATOM 1409 CA VAL A 763 24.889 11.326 -39.324 1.00 27.78 C ATOM 1410 C VAL A 763 25.640 10.064 -39.706 1.00 33.79 C ATOM 1411 O VAL A 763 26.356 10.040 -40.717 1.00 33.75 O ATOM 1412 CB VAL A 763 23.901 11.745 -40.427 1.00 34.97 C ATOM 1413 CG1 VAL A 763 22.813 10.700 -40.595 1.00 33.93 C ATOM 1414 CG2 VAL A 763 23.307 13.114 -40.117 1.00 33.97 C ATOM 1415 H VAL A 763 26.300 12.861 -39.880 1.00 0.00 H ATOM 1416 N HIS A 764 25.466 9.008 -38.912 1.00 30.89 N ATOM 1417 CA HIS A 764 26.185 7.767 -39.171 1.00 32.08 C ATOM 1418 C HIS A 764 25.742 7.126 -40.485 1.00 30.43 C ATOM 1419 O HIS A 764 26.575 6.784 -41.333 1.00 31.83 O ATOM 1420 CB HIS A 764 25.981 6.802 -38.016 1.00 28.63 C ATOM 1421 CG HIS A 764 26.887 5.616 -38.062 1.00 32.41 C ATOM 1422 ND1 HIS A 764 26.714 4.584 -38.957 1.00 29.81 N ATOM 1423 CD2 HIS A 764 27.975 5.294 -37.321 1.00 28.42 C ATOM 1424 CE1 HIS A 764 27.656 3.678 -38.769 1.00 30.78 C ATOM 1425 NE2 HIS A 764 28.432 4.083 -37.779 1.00 30.77 N ATOM 1426 H HIS A 764 24.814 9.070 -38.104 1.00 0.00 H ATOM 1427 N ARG A 765 24.435 6.940 -40.662 1.00 28.98 N ATOM 1428 CA ARG A 765 23.789 6.389 -41.850 1.00 36.05 C ATOM 1429 C ARG A 765 23.892 4.869 -41.953 1.00 34.64 C ATOM 1430 O ARG A 765 23.313 4.317 -42.886 1.00 31.95 O ATOM 1431 CB ARG A 765 24.325 6.989 -43.165 1.00 30.59 C ATOM 1432 CG ARG A 765 24.418 8.515 -43.162 1.00 34.13 C ATOM 1433 CD ARG A 765 25.094 9.041 -44.411 1.00 43.58 C ATOM 1434 NE ARG A 765 24.213 8.920 -45.566 1.00 53.09 N ATOM 1435 CZ ARG A 765 24.598 9.102 -46.827 1.00 62.24 C ATOM 1436 NH1 ARG A 765 23.721 8.965 -47.810 1.00 53.78 N ATOM 1437 NH2 ARG A 765 25.859 9.411 -47.107 1.00 67.98 N ATOM 1438 HE ARG A 765 23.217 8.675 -45.393 1.00 0.00 H ATOM 1439 HH12 ARG A 765 24.019 9.107 -48.796 1.00 0.00 H ATOM 1440 HH11 ARG A 765 22.734 8.716 -47.596 1.00 0.00 H ATOM 1441 HH22 ARG A 765 26.153 9.552 -48.095 1.00 0.00 H ATOM 1442 HH21 ARG A 765 26.553 9.512 -46.339 1.00 0.00 H ATOM 1443 H ARG A 765 23.812 7.215 -39.876 1.00 0.00 H ATOM 1444 N ASP A 766 24.589 4.171 -41.048 1.00 28.21 N ATOM 1445 CA ASP A 766 24.651 2.713 -41.132 1.00 26.47 C ATOM 1446 C ASP A 766 24.833 2.099 -39.747 1.00 27.95 C ATOM 1447 O ASP A 766 25.622 1.167 -39.559 1.00 27.93 O ATOM 1448 CB ASP A 766 25.772 2.251 -42.073 1.00 29.25 C ATOM 1449 CG ASP A 766 25.610 0.794 -42.515 1.00 29.51 C ATOM 1450 OD1 ASP A 766 24.567 0.165 -42.186 1.00 29.52 O ATOM 1451 OD2 ASP A 766 26.532 0.273 -43.197 1.00 28.85 O ATOM 1452 H ASP A 766 25.088 4.668 -40.283 1.00 0.00 H ATOM 1453 N LEU A 767 24.098 2.602 -38.763 1.00 26.02 N ATOM 1454 CA LEU A 767 24.163 2.012 -37.437 1.00 24.97 C ATOM 1455 C LEU A 767 23.441 0.668 -37.419 1.00 24.13 C ATOM 1456 O LEU A 767 22.323 0.537 -37.929 1.00 27.26 O ATOM 1457 CB LEU A 767 23.556 2.972 -36.410 1.00 26.02 C ATOM 1458 CG LEU A 767 23.497 2.463 -34.988 1.00 25.56 C ATOM 1459 CD1 LEU A 767 24.902 2.241 -34.420 1.00 24.80 C ATOM 1460 CD2 LEU A 767 22.660 3.444 -34.131 1.00 22.38 C ATOM 1461 H LEU A 767 23.477 3.417 -38.941 1.00 0.00 H ATOM 1462 N ALA A 768 24.081 -0.326 -36.815 1.00 22.44 N ATOM 1463 CA ALA A 768 23.624 -1.708 -36.757 1.00 22.52 C ATOM 1464 C ALA A 768 24.651 -2.423 -35.905 1.00 24.40 C ATOM 1465 O ALA A 768 25.764 -1.920 -35.726 1.00 26.03 O ATOM 1466 CB ALA A 768 23.517 -2.356 -38.161 1.00 25.00 C ATOM 1467 H ALA A 768 24.981 -0.100 -36.345 1.00 0.00 H ATOM 1468 N THR A 769 24.285 -3.587 -35.368 1.00 27.41 N ATOM 1469 CA THR A 769 25.239 -4.246 -34.482 1.00 27.54 C ATOM 1470 C THR A 769 26.484 -4.692 -35.244 1.00 34.00 C ATOM 1471 O THR A 769 27.563 -4.804 -34.649 1.00 25.10 O ATOM 1472 CB THR A 769 24.601 -5.438 -33.763 1.00 30.86 C ATOM 1473 OG1 THR A 769 24.185 -6.411 -34.721 1.00 29.76 O ATOM 1474 CG2 THR A 769 23.391 -5.007 -32.900 1.00 25.17 C ATOM 1475 HG1 THR A 769 23.523 -6.005 -35.336 1.00 0.00 H ATOM 1476 H THR A 769 23.357 -4.009 -35.572 1.00 0.00 H ATOM 1477 N ARG A 770 26.367 -4.932 -36.558 1.00 27.36 N ATOM 1478 CA ARG A 770 27.541 -5.332 -37.330 1.00 26.27 C ATOM 1479 C ARG A 770 28.572 -4.210 -37.414 1.00 24.51 C ATOM 1480 O ARG A 770 29.746 -4.479 -37.681 1.00 24.81 O ATOM 1481 CB ARG A 770 27.123 -5.785 -38.748 1.00 28.88 C ATOM 1482 CG ARG A 770 26.589 -4.651 -39.604 1.00 28.82 C ATOM 1483 CD ARG A 770 26.167 -5.045 -41.025 1.00 26.92 C ATOM 1484 NE ARG A 770 25.505 -3.877 -41.579 1.00 26.26 N ATOM 1485 CZ ARG A 770 24.205 -3.621 -41.460 1.00 25.53 C ATOM 1486 NH1 ARG A 770 23.396 -4.490 -40.855 1.00 26.57 N ATOM 1487 NH2 ARG A 770 23.717 -2.492 -41.953 1.00 25.84 N ATOM 1488 HE ARG A 770 26.087 -3.194 -42.105 1.00 0.00 H ATOM 1489 HH12 ARG A 770 22.381 -4.281 -40.767 1.00 0.00 H ATOM 1490 HH11 ARG A 770 23.780 -5.377 -40.471 1.00 0.00 H ATOM 1491 HH22 ARG A 770 22.702 -2.282 -41.865 1.00 0.00 H ATOM 1492 HH21 ARG A 770 24.349 -1.816 -42.428 1.00 0.00 H ATOM 1493 H ARG A 770 25.444 -4.834 -37.026 1.00 0.00 H ATOM 1494 N ASN A 771 28.166 -2.962 -37.181 1.00 22.99 N ATOM 1495 CA ASN A 771 29.083 -1.835 -37.192 1.00 26.92 C ATOM 1496 C ASN A 771 29.502 -1.389 -35.792 1.00 28.79 C ATOM 1497 O ASN A 771 30.056 -0.297 -35.645 1.00 34.74 O ATOM 1498 CB ASN A 771 28.473 -0.661 -37.957 1.00 26.40 C ATOM 1499 CG ASN A 771 28.745 -0.747 -39.460 1.00 28.95 C ATOM 1500 OD1 ASN A 771 29.767 -1.287 -39.880 1.00 28.61 O ATOM 1501 ND2 ASN A 771 27.822 -0.229 -40.270 1.00 24.74 N ATOM 1502 HD22 ASN A 771 26.972 0.219 -39.871 1.00 0.00 H ATOM 1503 HD21 ASN A 771 27.951 -0.272 -41.301 1.00 0.00 H ATOM 1504 H ASN A 771 27.159 -2.789 -36.985 1.00 0.00 H ATOM 1505 N CYS A 772 29.272 -2.204 -34.771 1.00 23.73 N ATOM 1506 CA CYS A 772 29.801 -1.946 -33.436 1.00 22.05 C ATOM 1507 C CYS A 772 30.855 -2.979 -33.087 1.00 27.90 C ATOM 1508 O CYS A 772 30.694 -4.167 -33.381 1.00 29.66 O ATOM 1509 CB CYS A 772 28.689 -1.973 -32.375 1.00 22.83 C ATOM 1510 SG CYS A 772 27.427 -0.708 -32.601 1.00 30.31 S ATOM 1511 H CYS A 772 28.695 -3.055 -34.927 1.00 0.00 H ATOM 1512 N LEU A 773 31.918 -2.527 -32.419 1.00 23.70 N ATOM 1513 CA LEU A 773 33.010 -3.389 -32.012 1.00 24.35 C ATOM 1514 C LEU A 773 33.038 -3.512 -30.493 1.00 27.38 C ATOM 1515 O LEU A 773 32.680 -2.577 -29.774 1.00 27.06 O ATOM 1516 CB LEU A 773 34.341 -2.842 -32.532 1.00 27.06 C ATOM 1517 CG LEU A 773 34.553 -2.943 -34.045 1.00 27.16 C ATOM 1518 CD1 LEU A 773 35.819 -2.205 -34.470 1.00 29.10 C ATOM 1519 CD2 LEU A 773 34.641 -4.400 -34.455 1.00 30.83 C ATOM 1520 H LEU A 773 31.965 -1.516 -32.181 1.00 0.00 H ATOM 1521 N VAL A 774 33.471 -4.670 -30.009 1.00 25.72 N ATOM 1522 CA VAL A 774 33.431 -4.988 -28.588 1.00 29.19 C ATOM 1523 C VAL A 774 34.859 -5.154 -28.079 1.00 31.90 C ATOM 1524 O VAL A 774 35.608 -6.001 -28.580 1.00 31.91 O ATOM 1525 CB VAL A 774 32.597 -6.248 -28.307 1.00 27.20 C ATOM 1526 CG1 VAL A 774 32.476 -6.474 -26.774 1.00 28.18 C ATOM 1527 CG2 VAL A 774 31.213 -6.135 -28.958 1.00 27.45 C ATOM 1528 H VAL A 774 33.853 -5.377 -30.669 1.00 0.00 H ATOM 1529 N GLY A 775 35.227 -4.353 -27.082 1.00 31.25 N ATOM 1530 CA GLY A 775 36.510 -4.460 -26.407 1.00 31.43 C ATOM 1531 C GLY A 775 36.429 -5.341 -25.179 1.00 31.73 C ATOM 1532 O GLY A 775 35.604 -6.255 -25.093 1.00 32.59 O ATOM 1533 H GLY A 775 34.564 -3.614 -26.771 1.00 0.00 H ATOM 1534 N GLU A 776 37.291 -5.064 -24.207 1.00 37.41 N ATOM 1535 CA GLU A 776 37.255 -5.813 -22.959 1.00 30.99 C ATOM 1536 C GLU A 776 36.079 -5.371 -22.096 1.00 34.11 C ATOM 1537 O GLU A 776 35.607 -4.235 -22.186 1.00 31.23 O ATOM 1538 CB GLU A 776 38.565 -5.634 -22.191 1.00 38.29 C ATOM 1539 CG GLU A 776 39.774 -6.089 -22.982 1.00 39.39 C ATOM 1540 CD GLU A 776 41.079 -5.901 -22.234 1.00 55.34 C ATOM 1541 OE1 GLU A 776 41.046 -5.840 -20.982 1.00 47.62 O ATOM 1542 OE2 GLU A 776 42.133 -5.812 -22.904 1.00 55.16 O ATOM 1543 H GLU A 776 37.994 -4.309 -24.338 1.00 0.00 H ATOM 1544 N ASN A 777 35.592 -6.295 -21.266 1.00 34.97 N ATOM 1545 CA ASN A 777 34.542 -5.996 -20.286 1.00 37.58 C ATOM 1546 C ASN A 777 33.316 -5.361 -20.931 1.00 34.54 C ATOM 1547 O ASN A 777 32.726 -4.422 -20.396 1.00 34.09 O ATOM 1548 CB ASN A 777 35.074 -5.098 -19.172 1.00 39.18 C ATOM 1549 CG ASN A 777 36.183 -5.750 -18.395 1.00 44.11 C ATOM 1550 OD1 ASN A 777 35.966 -6.755 -17.719 1.00 52.40 O ATOM 1551 ND2 ASN A 777 37.378 -5.187 -18.485 1.00 37.06 N ATOM 1552 HD22 ASN A 777 37.510 -4.337 -19.070 1.00 0.00 H ATOM 1553 HD21 ASN A 777 38.185 -5.594 -17.970 1.00 0.00 H ATOM 1554 H ASN A 777 35.970 -7.262 -21.315 1.00 0.00 H ATOM 1555 N PHE A 778 32.941 -5.863 -22.105 1.00 36.23 N ATOM 1556 CA PHE A 778 31.690 -5.477 -22.749 1.00 34.36 C ATOM 1557 C PHE A 778 31.655 -3.997 -23.126 1.00 30.10 C ATOM 1558 O PHE A 778 30.577 -3.411 -23.235 1.00 32.07 O ATOM 1559 CB PHE A 778 30.492 -5.832 -21.862 1.00 29.54 C ATOM 1560 CG PHE A 778 30.343 -7.303 -21.627 1.00 34.97 C ATOM 1561 CD1 PHE A 778 31.089 -7.942 -20.650 1.00 34.98 C ATOM 1562 CD2 PHE A 778 29.463 -8.053 -22.394 1.00 40.11 C ATOM 1563 CE1 PHE A 778 30.967 -9.300 -20.439 1.00 36.89 C ATOM 1564 CE2 PHE A 778 29.328 -9.416 -22.183 1.00 38.86 C ATOM 1565 CZ PHE A 778 30.088 -10.039 -21.206 1.00 40.74 C ATOM 1566 H PHE A 778 33.559 -6.552 -22.578 1.00 0.00 H ATOM 1567 N THR A 779 32.819 -3.370 -23.333 1.00 28.69 N ATOM 1568 CA THR A 779 32.831 -1.989 -23.794 1.00 29.98 C ATOM 1569 C THR A 779 32.548 -1.957 -25.294 1.00 30.61 C ATOM 1570 O THR A 779 33.115 -2.743 -26.057 1.00 28.67 O ATOM 1571 CB THR A 779 34.165 -1.316 -23.505 1.00 29.95 C ATOM 1572 OG1 THR A 779 35.199 -1.985 -24.233 1.00 33.18 O ATOM 1573 CG2 THR A 779 34.486 -1.363 -22.021 1.00 33.23 C ATOM 1574 HG1 THR A 779 35.238 -2.934 -23.952 1.00 0.00 H ATOM 1575 H THR A 779 33.716 -3.869 -23.164 1.00 0.00 H ATOM 1576 N ILE A 780 31.675 -1.046 -25.709 1.00 26.14 N ATOM 1577 CA ILE A 780 31.184 -0.984 -27.082 1.00 27.33 C ATOM 1578 C ILE A 780 31.759 0.251 -27.755 1.00 30.02 C ATOM 1579 O ILE A 780 31.745 1.344 -27.173 1.00 31.71 O ATOM 1580 CB ILE A 780 29.645 -0.970 -27.130 1.00 25.52 C ATOM 1581 CG1 ILE A 780 29.085 -2.167 -26.369 1.00 27.29 C ATOM 1582 CG2 ILE A 780 29.160 -1.030 -28.574 1.00 26.37 C ATOM 1583 CD1 ILE A 780 29.532 -3.507 -26.925 1.00 30.37 C ATOM 1584 H ILE A 780 31.326 -0.345 -25.025 1.00 0.00 H ATOM 1585 N LYS A 781 32.273 0.074 -28.976 1.00 25.04 N ATOM 1586 CA LYS A 781 32.759 1.166 -29.808 1.00 25.47 C ATOM 1587 C LYS A 781 31.977 1.164 -31.115 1.00 28.94 C ATOM 1588 O LYS A 781 32.030 0.188 -31.876 1.00 29.39 O ATOM 1589 CB LYS A 781 34.262 1.028 -30.089 1.00 29.32 C ATOM 1590 CG LYS A 781 35.197 1.588 -29.009 1.00 29.18 C ATOM 1591 CD LYS A 781 35.178 0.792 -27.713 1.00 32.47 C ATOM 1592 CE LYS A 781 36.441 1.084 -26.904 1.00 31.22 C ATOM 1593 NZ LYS A 781 36.524 2.524 -26.530 1.00 32.91 N ATOM 1594 HZ1 LYS A 781 36.542 3.105 -27.393 1.00 0.00 H ATOM 1595 HZ2 LYS A 781 35.696 2.780 -25.955 1.00 0.00 H ATOM 1596 HZ3 LYS A 781 37.392 2.689 -25.982 1.00 0.00 H ATOM 1597 H LYS A 781 32.329 -0.894 -29.352 1.00 0.00 H ATOM 1598 N ILE A 782 31.271 2.260 -31.389 1.00 28.89 N ATOM 1599 CA ILE A 782 30.612 2.390 -32.678 1.00 27.28 C ATOM 1600 C ILE A 782 31.677 2.582 -33.751 1.00 25.08 C ATOM 1601 O ILE A 782 32.694 3.256 -33.539 1.00 24.97 O ATOM 1602 CB ILE A 782 29.596 3.545 -32.671 1.00 26.62 C ATOM 1603 CG1 ILE A 782 28.496 3.272 -31.649 1.00 27.69 C ATOM 1604 CG2 ILE A 782 28.945 3.710 -34.047 1.00 29.42 C ATOM 1605 CD1 ILE A 782 27.466 4.353 -31.590 1.00 26.93 C ATOM 1606 H ILE A 782 31.192 3.020 -30.683 1.00 0.00 H ATOM 1607 N ALA A 783 31.456 1.969 -34.906 1.00 26.84 N ATOM 1608 CA ALA A 783 32.418 2.021 -35.997 1.00 20.73 C ATOM 1609 C ALA A 783 31.640 2.036 -37.312 1.00 30.41 C ATOM 1610 O ALA A 783 30.412 2.161 -37.320 1.00 26.03 O ATOM 1611 CB ALA A 783 33.391 0.844 -35.869 1.00 22.15 C ATOM 1612 H ALA A 783 30.572 1.437 -35.036 1.00 0.00 H ATOM 1613 N ASP A 784 32.359 1.925 -38.437 1.00 27.85 N ATOM 1614 CA ASP A 784 31.722 1.864 -39.759 1.00 32.57 C ATOM 1615 C ASP A 784 32.661 1.090 -40.679 1.00 26.23 C ATOM 1616 O ASP A 784 33.671 1.632 -41.139 1.00 29.57 O ATOM 1617 CB ASP A 784 31.428 3.252 -40.317 1.00 30.97 C ATOM 1618 CG ASP A 784 30.641 3.202 -41.620 1.00 33.39 C ATOM 1619 OD1 ASP A 784 30.345 2.087 -42.100 1.00 33.62 O ATOM 1620 OD2 ASP A 784 30.296 4.274 -42.163 1.00 31.92 O ATOM 1621 H ASP A 784 33.396 1.881 -38.372 1.00 0.00 H ATOM 1622 N PHE A 785 32.325 -0.169 -40.940 1.00 29.71 N ATOM 1623 CA PHE A 785 33.144 -0.979 -41.832 1.00 31.55 C ATOM 1624 C PHE A 785 32.906 -0.657 -43.295 1.00 35.84 C ATOM 1625 O PHE A 785 33.509 -1.303 -44.162 1.00 33.35 O ATOM 1626 CB PHE A 785 32.883 -2.466 -41.588 1.00 30.78 C ATOM 1627 CG PHE A 785 33.570 -3.001 -40.375 1.00 32.16 C ATOM 1628 CD1 PHE A 785 33.035 -2.788 -39.117 1.00 28.04 C ATOM 1629 CD2 PHE A 785 34.757 -3.717 -40.491 1.00 30.74 C ATOM 1630 CE1 PHE A 785 33.676 -3.277 -37.990 1.00 34.47 C ATOM 1631 CE2 PHE A 785 35.399 -4.208 -39.364 1.00 29.55 C ATOM 1632 CZ PHE A 785 34.860 -3.986 -38.121 1.00 32.49 C ATOM 1633 H PHE A 785 31.473 -0.578 -40.505 1.00 0.00 H ATOM 1634 N GLY A 786 32.074 0.338 -43.587 1.00 29.60 N ATOM 1635 CA GLY A 786 31.682 0.493 -44.961 1.00 32.01 C ATOM 1636 C GLY A 786 30.818 -0.701 -45.310 1.00 34.12 C ATOM 1637 O GLY A 786 30.234 -1.363 -44.453 1.00 50.46 O ATOM 1638 H GLY A 786 31.720 0.980 -42.849 1.00 0.00 H ATOM 1639 N MET A 787 30.755 -0.993 -46.594 1.00 48.45 N ATOM 1640 CA MET A 787 30.034 -2.166 -47.069 1.00 45.58 C ATOM 1641 C MET A 787 31.089 -3.001 -47.783 1.00 42.65 C ATOM 1642 O MET A 787 31.219 -2.984 -49.005 1.00 63.10 O ATOM 1643 CB MET A 787 28.857 -1.738 -47.941 1.00 47.24 C ATOM 1644 CG MET A 787 27.935 -0.743 -47.189 1.00 38.55 C ATOM 1645 SD MET A 787 27.114 0.497 -48.229 1.00 54.92 S ATOM 1646 CE MET A 787 26.050 1.345 -47.069 1.00 38.83 C ATOM 1647 H MET A 787 31.230 -0.373 -47.281 1.00 0.00 H ATOM 1648 N SER A 788 31.901 -3.691 -46.977 1.00 51.52 N ATOM 1649 CA SER A 788 33.115 -4.337 -47.456 1.00 57.23 C ATOM 1650 C SER A 788 33.327 -5.699 -46.811 1.00 52.02 C ATOM 1651 O SER A 788 34.466 -6.181 -46.765 1.00 53.96 O ATOM 1652 CB SER A 788 34.341 -3.472 -47.171 1.00 52.24 C ATOM 1653 OG SER A 788 34.639 -3.492 -45.781 1.00 57.32 O ATOM 1654 HG SER A 788 33.866 -3.139 -45.274 1.00 0.00 H ATOM 1655 H SER A 788 31.657 -3.770 -45.969 1.00 0.00 H ATOM 1656 N ARG A 789 32.275 -6.319 -46.290 1.00 44.65 N ATOM 1657 CA ARG A 789 32.371 -7.637 -45.684 1.00 36.60 C ATOM 1658 C ARG A 789 31.293 -8.508 -46.305 1.00 40.74 C ATOM 1659 O ARG A 789 30.103 -8.200 -46.173 1.00 35.79 O ATOM 1660 CB ARG A 789 32.200 -7.560 -44.162 1.00 39.06 C ATOM 1661 CG ARG A 789 33.270 -6.739 -43.446 1.00 33.98 C ATOM 1662 CD ARG A 789 32.984 -6.620 -41.967 1.00 38.01 C ATOM 1663 NE ARG A 789 31.805 -5.803 -41.725 1.00 30.80 N ATOM 1664 CZ ARG A 789 31.305 -5.569 -40.518 1.00 37.88 C ATOM 1665 NH1 ARG A 789 31.892 -6.091 -39.453 1.00 34.56 N ATOM 1666 NH2 ARG A 789 30.226 -4.816 -40.380 1.00 31.23 N ATOM 1667 HE ARG A 789 31.326 -5.378 -42.545 1.00 0.00 H ATOM 1668 HH12 ARG A 789 31.504 -5.911 -38.505 1.00 0.00 H ATOM 1669 HH11 ARG A 789 32.741 -6.681 -39.564 1.00 0.00 H ATOM 1670 HH22 ARG A 789 29.836 -4.634 -39.433 1.00 0.00 H ATOM 1671 HH21 ARG A 789 29.767 -4.406 -41.218 1.00 0.00 H ATOM 1672 H ARG A 789 31.350 -5.845 -46.316 1.00 0.00 H ATOM 1673 N ASN A 790 31.711 -9.582 -46.993 1.00 38.28 N ATOM 1674 CA ASN A 790 30.759 -10.549 -47.545 1.00 40.89 C ATOM 1675 C ASN A 790 29.782 -11.053 -46.497 1.00 31.84 C ATOM 1676 O ASN A 790 28.635 -11.377 -46.816 1.00 32.44 O ATOM 1677 CB ASN A 790 31.495 -11.757 -48.133 1.00 35.11 C ATOM 1678 CG ASN A 790 32.206 -11.431 -49.402 1.00 50.59 C ATOM 1679 OD1 ASN A 790 31.814 -10.510 -50.119 1.00 59.59 O ATOM 1680 ND2 ASN A 790 33.267 -12.180 -49.701 1.00 44.18 N ATOM 1681 HD22 ASN A 790 33.559 -12.947 -49.062 1.00 0.00 H ATOM 1682 HD21 ASN A 790 33.803 -11.997 -50.573 1.00 0.00 H ATOM 1683 H ASN A 790 32.730 -9.731 -47.137 1.00 0.00 H ATOM 1684 N LEU A 791 30.232 -11.152 -45.247 1.00 32.77 N ATOM 1685 CA LEU A 791 29.408 -11.715 -44.189 1.00 34.42 C ATOM 1686 C LEU A 791 28.063 -11.016 -44.090 1.00 30.29 C ATOM 1687 O LEU A 791 27.055 -11.657 -43.775 1.00 30.77 O ATOM 1688 CB LEU A 791 30.170 -11.634 -42.856 1.00 31.01 C ATOM 1689 CG LEU A 791 29.521 -12.286 -41.639 1.00 33.46 C ATOM 1690 CD1 LEU A 791 29.090 -13.701 -41.985 1.00 35.05 C ATOM 1691 CD2 LEU A 791 30.470 -12.272 -40.445 1.00 36.14 C ATOM 1692 H LEU A 791 31.192 -10.820 -45.023 1.00 0.00 H ATOM 1693 N TYR A 792 28.017 -9.715 -44.391 1.00 25.51 N ATOM 1694 CA TYR A 792 26.809 -8.920 -44.223 1.00 31.35 C ATOM 1695 C TYR A 792 26.218 -8.443 -45.549 1.00 31.62 C ATOM 1696 O TYR A 792 25.439 -7.488 -45.562 1.00 30.14 O ATOM 1697 CB TYR A 792 27.094 -7.739 -43.300 1.00 29.33 C ATOM 1698 CG TYR A 792 27.556 -8.204 -41.933 1.00 29.11 C ATOM 1699 CD1 TYR A 792 26.677 -8.848 -41.072 1.00 26.68 C ATOM 1700 CD2 TYR A 792 28.875 -8.037 -41.522 1.00 25.72 C ATOM 1701 CE1 TYR A 792 27.094 -9.303 -39.817 1.00 30.74 C ATOM 1702 CE2 TYR A 792 29.309 -8.486 -40.253 1.00 30.05 C ATOM 1703 CZ TYR A 792 28.409 -9.118 -39.409 1.00 33.65 C ATOM 1704 OH TYR A 792 28.801 -9.574 -38.155 1.00 29.47 O ATOM 1705 HH TYR A 792 29.127 -8.811 -37.615 1.00 0.00 H ATOM 1706 H TYR A 792 28.874 -9.254 -44.758 1.00 0.00 H ATOM 1707 N ALA A 793 26.561 -9.101 -46.664 1.00 30.03 N ATOM 1708 CA ALA A 793 25.995 -8.716 -47.961 1.00 28.16 C ATOM 1709 C ALA A 793 24.465 -8.737 -47.956 1.00 27.13 C ATOM 1710 O ALA A 793 23.834 -7.910 -48.626 1.00 29.78 O ATOM 1711 CB ALA A 793 26.528 -9.638 -49.059 1.00 25.46 C ATOM 1712 H ALA A 793 27.234 -9.892 -46.610 1.00 0.00 H ATOM 1713 N GLY A 794 23.853 -9.651 -47.196 1.00 31.21 N ATOM 1714 CA GLY A 794 22.402 -9.751 -47.144 1.00 33.89 C ATOM 1715 C GLY A 794 21.707 -8.604 -46.432 1.00 34.83 C ATOM 1716 O GLY A 794 20.495 -8.427 -46.607 1.00 31.59 O ATOM 1717 H GLY A 794 24.428 -10.306 -46.628 1.00 0.00 H ATOM 1718 N ASP A 795 22.438 -7.822 -45.638 1.00 29.86 N ATOM 1719 CA ASP A 795 21.877 -6.646 -44.983 1.00 25.65 C ATOM 1720 C ASP A 795 21.876 -5.410 -45.866 1.00 29.64 C ATOM 1721 O ASP A 795 21.540 -4.325 -45.377 1.00 26.08 O ATOM 1722 CB ASP A 795 22.652 -6.308 -43.695 1.00 27.52 C ATOM 1723 CG ASP A 795 22.579 -7.397 -42.668 1.00 29.62 C ATOM 1724 OD1 ASP A 795 21.687 -8.261 -42.788 1.00 31.83 O ATOM 1725 OD2 ASP A 795 23.404 -7.374 -41.715 1.00 32.58 O ATOM 1726 H ASP A 795 23.439 -8.058 -45.481 1.00 0.00 H ATOM 1727 N TYR A 796 22.281 -5.511 -47.132 1.00 27.16 N ATOM 1728 CA TYR A 796 22.260 -4.357 -48.010 1.00 26.71 C ATOM 1729 C TYR A 796 21.498 -4.702 -49.285 1.00 31.65 C ATOM 1730 O TYR A 796 21.478 -5.851 -49.736 1.00 27.61 O ATOM 1731 CB TYR A 796 23.676 -3.863 -48.343 1.00 26.33 C ATOM 1732 CG TYR A 796 24.457 -3.425 -47.114 1.00 28.21 C ATOM 1733 CD1 TYR A 796 24.401 -2.112 -46.664 1.00 27.42 C ATOM 1734 CD2 TYR A 796 25.236 -4.329 -46.404 1.00 24.71 C ATOM 1735 CE1 TYR A 796 25.107 -1.703 -45.525 1.00 32.69 C ATOM 1736 CE2 TYR A 796 25.959 -3.924 -45.259 1.00 29.76 C ATOM 1737 CZ TYR A 796 25.884 -2.607 -44.832 1.00 32.24 C ATOM 1738 OH TYR A 796 26.579 -2.181 -43.714 1.00 31.67 O ATOM 1739 HH TYR A 796 26.404 -1.218 -43.565 1.00 0.00 H ATOM 1740 H TYR A 796 22.615 -6.427 -47.494 1.00 0.00 H ATOM 1741 N TYR A 797 20.867 -3.687 -49.852 1.00 31.93 N ATOM 1742 CA TYR A 797 20.058 -3.829 -51.053 1.00 29.94 C ATOM 1743 C TYR A 797 20.629 -2.910 -52.118 1.00 31.61 C ATOM 1744 O TYR A 797 20.855 -1.725 -51.861 1.00 36.90 O ATOM 1745 CB TYR A 797 18.599 -3.492 -50.757 1.00 29.37 C ATOM 1746 CG TYR A 797 17.693 -3.427 -51.977 1.00 34.23 C ATOM 1747 CD1 TYR A 797 17.188 -4.584 -52.558 1.00 36.29 C ATOM 1748 CD2 TYR A 797 17.319 -2.205 -52.519 1.00 35.18 C ATOM 1749 CE1 TYR A 797 16.334 -4.524 -53.669 1.00 36.38 C ATOM 1750 CE2 TYR A 797 16.476 -2.133 -53.623 1.00 40.98 C ATOM 1751 CZ TYR A 797 15.985 -3.293 -54.192 1.00 39.35 C ATOM 1752 OH TYR A 797 15.144 -3.212 -55.290 1.00 50.31 O ATOM 1753 HH TYR A 797 14.884 -4.124 -55.573 1.00 0.00 H ATOM 1754 H TYR A 797 20.953 -2.745 -49.420 1.00 0.00 H ATOM 1755 N ARG A 798 20.872 -3.451 -53.307 1.00 32.47 N ATOM 1756 CA ARG A 798 21.461 -2.660 -54.376 1.00 37.97 C ATOM 1757 C ARG A 798 20.352 -1.929 -55.119 1.00 37.30 C ATOM 1758 O ARG A 798 19.368 -2.545 -55.541 1.00 40.01 O ATOM 1759 CB ARG A 798 22.270 -3.535 -55.333 1.00 37.35 C ATOM 1760 CG ARG A 798 23.111 -2.727 -56.325 1.00 41.13 C ATOM 1761 CD ARG A 798 24.028 -3.610 -57.157 1.00 44.04 C ATOM 1762 NE ARG A 798 24.867 -4.498 -56.351 1.00 42.99 N ATOM 1763 CZ ARG A 798 26.108 -4.217 -55.976 1.00 44.45 C ATOM 1764 NH1 ARG A 798 26.800 -5.094 -55.258 1.00 45.72 N ATOM 1765 NH2 ARG A 798 26.655 -3.055 -56.314 1.00 42.31 N ATOM 1766 HE ARG A 798 24.464 -5.409 -56.053 1.00 0.00 H ATOM 1767 HH12 ARG A 798 27.773 -4.873 -54.964 1.00 0.00 H ATOM 1768 HH11 ARG A 798 26.369 -6.002 -54.989 1.00 0.00 H ATOM 1769 HH22 ARG A 798 27.628 -2.833 -56.021 1.00 0.00 H ATOM 1770 HH21 ARG A 798 26.111 -2.367 -56.872 1.00 0.00 H ATOM 1771 H ARG A 798 20.639 -4.450 -53.475 1.00 0.00 H ATOM 1772 N VAL A 799 20.508 -0.621 -55.276 1.00 37.57 N ATOM 1773 CA VAL A 799 19.521 0.199 -55.968 1.00 43.05 C ATOM 1774 C VAL A 799 20.011 0.463 -57.391 1.00 40.65 C ATOM 1775 O VAL A 799 21.073 1.068 -57.594 1.00 38.71 O ATOM 1776 CB VAL A 799 19.250 1.508 -55.211 1.00 44.93 C ATOM 1777 CG1 VAL A 799 18.252 2.359 -55.977 1.00 44.35 C ATOM 1778 CG2 VAL A 799 18.722 1.202 -53.800 1.00 47.19 C ATOM 1779 H VAL A 799 21.361 -0.166 -54.893 1.00 0.00 H ATOM 1780 N GLN A 800 19.244 -0.014 -58.371 1.00 46.24 N ATOM 1781 CA GLN A 800 19.467 0.284 -59.786 1.00 42.32 C ATOM 1782 C GLN A 800 20.909 -0.017 -60.189 1.00 41.65 C ATOM 1783 O GLN A 800 21.582 0.772 -60.858 1.00 47.84 O ATOM 1784 CB GLN A 800 19.066 1.732 -60.092 1.00 40.16 C ATOM 1785 CG GLN A 800 17.561 1.967 -59.858 1.00 50.75 C ATOM 1786 CD GLN A 800 17.128 3.424 -59.976 1.00 62.33 C ATOM 1787 OE1 GLN A 800 17.272 4.206 -59.033 1.00 67.84 O ATOM 1788 NE2 GLN A 800 16.575 3.787 -61.133 1.00 58.80 N ATOM 1789 HE22 GLN A 800 16.474 3.093 -61.901 1.00 0.00 H ATOM 1790 HE21 GLN A 800 16.245 4.764 -61.268 1.00 0.00 H ATOM 1791 H GLN A 800 18.446 -0.630 -58.117 1.00 0.00 H ATOM 1792 N GLY A 801 21.388 -1.179 -59.744 1.00 41.93 N ATOM 1793 CA GLY A 801 22.704 -1.674 -60.099 1.00 38.79 C ATOM 1794 C GLY A 801 23.884 -0.861 -59.609 1.00 46.15 C ATOM 1795 O GLY A 801 25.021 -1.159 -59.990 1.00 46.33 O ATOM 1796 H GLY A 801 20.792 -1.755 -59.115 1.00 0.00 H ATOM 1797 N ARG A 802 23.662 0.159 -58.773 1.00 43.16 N ATOM 1798 CA ARG A 802 24.749 1.031 -58.350 1.00 49.25 C ATOM 1799 C ARG A 802 24.929 0.891 -56.846 1.00 44.55 C ATOM 1800 O ARG A 802 25.504 -0.105 -56.381 1.00 41.69 O ATOM 1801 CB ARG A 802 24.486 2.473 -58.811 1.00 47.26 C ATOM 1802 H ARG A 802 22.699 0.332 -58.420 1.00 0.00 H ATOM 1803 N ALA A 803 24.447 1.847 -56.052 1.00 43.49 N ATOM 1804 CA ALA A 803 24.751 1.910 -54.625 1.00 49.43 C ATOM 1805 C ALA A 803 23.999 0.831 -53.843 1.00 45.89 C ATOM 1806 O ALA A 803 23.064 0.189 -54.333 1.00 42.98 O ATOM 1807 CB ALA A 803 24.411 3.291 -54.061 1.00 40.09 C ATOM 1808 H ALA A 803 23.831 2.576 -56.465 1.00 0.00 H ATOM 1809 N VAL A 804 24.422 0.648 -52.595 1.00 43.19 N ATOM 1810 CA VAL A 804 23.923 -0.415 -51.732 1.00 37.85 C ATOM 1811 C VAL A 804 23.499 0.202 -50.403 1.00 41.71 C ATOM 1812 O VAL A 804 24.261 0.964 -49.795 1.00 41.10 O ATOM 1813 CB VAL A 804 24.989 -1.509 -51.538 1.00 42.60 C ATOM 1814 CG1 VAL A 804 25.186 -2.241 -52.845 1.00 43.43 C ATOM 1815 CG2 VAL A 804 26.305 -0.886 -51.170 1.00 47.04 C ATOM 1816 H VAL A 804 25.144 1.295 -52.217 1.00 0.00 H ATOM 1817 N LEU A 805 22.277 -0.112 -49.962 1.00 32.78 N ATOM 1818 CA LEU A 805 21.683 0.568 -48.819 1.00 34.34 C ATOM 1819 C LEU A 805 21.204 -0.426 -47.769 1.00 30.00 C ATOM 1820 O LEU A 805 20.704 -1.505 -48.108 1.00 28.50 O ATOM 1821 CB LEU A 805 20.508 1.454 -49.274 1.00 37.01 C ATOM 1822 CG LEU A 805 20.914 2.613 -50.191 1.00 38.93 C ATOM 1823 CD1 LEU A 805 19.711 3.255 -50.860 1.00 40.80 C ATOM 1824 CD2 LEU A 805 21.679 3.644 -49.405 1.00 41.82 C ATOM 1825 H LEU A 805 21.738 -0.859 -50.446 1.00 0.00 H ATOM 1826 N PRO A 806 21.354 -0.096 -46.476 1.00 30.69 N ATOM 1827 CA PRO A 806 20.888 -0.995 -45.395 1.00 28.63 C ATOM 1828 C PRO A 806 19.405 -0.817 -45.083 1.00 33.26 C ATOM 1829 O PRO A 806 19.025 -0.349 -44.006 1.00 29.01 O ATOM 1830 CB PRO A 806 21.785 -0.578 -44.222 1.00 28.62 C ATOM 1831 CG PRO A 806 21.937 0.901 -44.429 1.00 25.54 C ATOM 1832 CD PRO A 806 22.102 1.055 -45.943 1.00 27.51 C ATOM 1833 N ILE A 807 18.534 -1.227 -46.023 1.00 30.21 N ATOM 1834 CA ILE A 807 17.115 -0.844 -45.981 1.00 31.59 C ATOM 1835 C ILE A 807 16.384 -1.350 -44.733 1.00 27.03 C ATOM 1836 O ILE A 807 15.445 -0.703 -44.256 1.00 27.70 O ATOM 1837 CB ILE A 807 16.399 -1.323 -47.262 1.00 26.40 C ATOM 1838 CG1 ILE A 807 16.502 -2.845 -47.403 1.00 26.22 C ATOM 1839 CG2 ILE A 807 16.988 -0.643 -48.479 1.00 28.18 C ATOM 1840 CD1 ILE A 807 15.690 -3.421 -48.577 1.00 32.54 C ATOM 1841 H ILE A 807 18.873 -1.830 -46.799 1.00 0.00 H ATOM 1842 N ARG A 808 16.752 -2.518 -44.207 1.00 28.22 N ATOM 1843 CA ARG A 808 16.071 -3.037 -43.028 1.00 34.95 C ATOM 1844 C ARG A 808 16.332 -2.209 -41.768 1.00 32.26 C ATOM 1845 O ARG A 808 15.584 -2.350 -40.788 1.00 30.17 O ATOM 1846 CB ARG A 808 16.472 -4.498 -42.805 1.00 36.54 C ATOM 1847 CG ARG A 808 15.965 -5.396 -43.917 1.00 31.38 C ATOM 1848 CD ARG A 808 16.590 -6.778 -43.939 1.00 26.55 C ATOM 1849 NE ARG A 808 16.255 -7.454 -45.198 1.00 29.40 N ATOM 1850 CZ ARG A 808 15.199 -8.248 -45.371 1.00 33.47 C ATOM 1851 NH1 ARG A 808 14.361 -8.493 -44.357 1.00 28.76 N ATOM 1852 NH2 ARG A 808 14.978 -8.803 -46.559 1.00 33.13 N ATOM 1853 HE ARG A 808 16.885 -7.303 -46.011 1.00 0.00 H ATOM 1854 HH12 ARG A 808 13.539 -9.114 -44.500 1.00 0.00 H ATOM 1855 HH11 ARG A 808 14.532 -8.063 -43.426 1.00 0.00 H ATOM 1856 HH22 ARG A 808 14.155 -9.423 -46.698 1.00 0.00 H ATOM 1857 HH21 ARG A 808 15.628 -8.617 -47.349 1.00 0.00 H ATOM 1858 H ARG A 808 17.527 -3.060 -44.639 1.00 0.00 H ATOM 1859 N TRP A 809 17.352 -1.350 -41.776 1.00 31.94 N ATOM 1860 CA TRP A 809 17.663 -0.446 -40.672 1.00 35.81 C ATOM 1861 C TRP A 809 17.251 0.990 -40.967 1.00 32.25 C ATOM 1862 O TRP A 809 17.365 1.848 -40.089 1.00 28.56 O ATOM 1863 CB TRP A 809 19.180 -0.484 -40.348 1.00 30.97 C ATOM 1864 CG TRP A 809 19.623 -1.714 -39.586 1.00 27.20 C ATOM 1865 CD1 TRP A 809 19.885 -1.804 -38.242 1.00 26.62 C ATOM 1866 CD2 TRP A 809 19.826 -3.030 -40.122 1.00 30.66 C ATOM 1867 NE1 TRP A 809 20.243 -3.098 -37.913 1.00 28.02 N ATOM 1868 CE2 TRP A 809 20.210 -3.868 -39.048 1.00 28.62 C ATOM 1869 CE3 TRP A 809 19.736 -3.579 -41.411 1.00 26.87 C ATOM 1870 CZ2 TRP A 809 20.489 -5.227 -39.221 1.00 30.90 C ATOM 1871 CZ3 TRP A 809 20.011 -4.934 -41.580 1.00 24.85 C ATOM 1872 CH2 TRP A 809 20.389 -5.740 -40.491 1.00 29.33 C ATOM 1873 HE1 TRP A 809 20.496 -3.433 -36.961 1.00 0.00 H ATOM 1874 H TRP A 809 17.962 -1.322 -42.618 1.00 0.00 H ATOM 1875 N MET A 810 16.779 1.278 -42.173 1.00 27.86 N ATOM 1876 CA MET A 810 16.560 2.658 -42.582 1.00 30.84 C ATOM 1877 C MET A 810 15.131 3.104 -42.303 1.00 34.38 C ATOM 1878 O MET A 810 14.177 2.321 -42.417 1.00 34.48 O ATOM 1879 CB MET A 810 16.884 2.830 -44.069 1.00 31.13 C ATOM 1880 CG MET A 810 18.381 2.733 -44.377 1.00 32.59 C ATOM 1881 SD MET A 810 18.726 2.385 -46.127 1.00 32.07 S ATOM 1882 CE MET A 810 18.112 3.879 -46.912 1.00 31.15 C ATOM 1883 H MET A 810 16.562 0.507 -42.836 1.00 0.00 H ATOM 1884 N ALA A 811 14.997 4.370 -41.923 1.00 32.46 N ATOM 1885 CA ALA A 811 13.691 4.980 -41.745 1.00 32.30 C ATOM 1886 C ALA A 811 12.967 5.059 -43.084 1.00 35.82 C ATOM 1887 O ALA A 811 13.598 5.156 -44.142 1.00 34.86 O ATOM 1888 CB ALA A 811 13.845 6.373 -41.147 1.00 27.36 C ATOM 1889 H ALA A 811 15.850 4.939 -41.748 1.00 0.00 H ATOM 1890 N TRP A 812 11.627 5.019 -43.032 1.00 36.19 N ATOM 1891 CA TRP A 812 10.842 5.058 -44.264 1.00 34.05 C ATOM 1892 C TRP A 812 11.208 6.257 -45.123 1.00 35.67 C ATOM 1893 O TRP A 812 11.219 6.156 -46.356 1.00 42.69 O ATOM 1894 CB TRP A 812 9.334 5.074 -43.954 1.00 40.08 C ATOM 1895 CG TRP A 812 8.883 6.362 -43.324 1.00 42.17 C ATOM 1896 CD1 TRP A 812 8.762 6.623 -41.990 1.00 40.96 C ATOM 1897 CD2 TRP A 812 8.528 7.575 -44.003 1.00 46.19 C ATOM 1898 NE1 TRP A 812 8.348 7.918 -41.796 1.00 42.51 N ATOM 1899 CE2 TRP A 812 8.201 8.526 -43.015 1.00 42.77 C ATOM 1900 CE3 TRP A 812 8.455 7.948 -45.351 1.00 46.62 C ATOM 1901 CZ2 TRP A 812 7.802 9.823 -43.330 1.00 45.66 C ATOM 1902 CZ3 TRP A 812 8.068 9.239 -45.663 1.00 50.93 C ATOM 1903 CH2 TRP A 812 7.740 10.160 -44.656 1.00 53.78 C ATOM 1904 HE1 TRP A 812 8.174 8.365 -40.873 1.00 0.00 H ATOM 1905 H TRP A 812 11.145 4.960 -42.112 1.00 0.00 H ATOM 1906 N GLU A 813 11.534 7.394 -44.502 1.00 35.34 N ATOM 1907 CA GLU A 813 11.915 8.567 -45.286 1.00 39.48 C ATOM 1908 C GLU A 813 13.314 8.463 -45.886 1.00 42.31 C ATOM 1909 O GLU A 813 13.619 9.201 -46.828 1.00 46.31 O ATOM 1910 CB GLU A 813 11.803 9.844 -44.442 1.00 47.54 C ATOM 1911 CG GLU A 813 12.929 10.080 -43.449 1.00 41.65 C ATOM 1912 CD GLU A 813 12.672 9.422 -42.111 1.00 44.75 C ATOM 1913 OE1 GLU A 813 11.669 8.681 -41.990 1.00 39.66 O ATOM 1914 OE2 GLU A 813 13.484 9.637 -41.181 1.00 41.56 O ATOM 1915 H GLU A 813 11.517 7.444 -43.463 1.00 0.00 H ATOM 1916 N CYS A 814 14.181 7.582 -45.373 1.00 37.08 N ATOM 1917 CA CYS A 814 15.431 7.328 -46.088 1.00 36.38 C ATOM 1918 C CYS A 814 15.175 6.500 -47.334 1.00 38.97 C ATOM 1919 O CYS A 814 15.741 6.771 -48.395 1.00 37.04 O ATOM 1920 CB CYS A 814 16.442 6.595 -45.209 1.00 35.04 C ATOM 1921 SG CYS A 814 16.835 7.383 -43.659 1.00 40.02 S ATOM 1922 H CYS A 814 13.970 7.087 -44.483 1.00 0.00 H ATOM 1923 N ILE A 815 14.348 5.466 -47.203 1.00 39.37 N ATOM 1924 CA ILE A 815 14.029 4.598 -48.328 1.00 41.69 C ATOM 1925 C ILE A 815 13.388 5.400 -49.456 1.00 40.92 C ATOM 1926 O ILE A 815 13.827 5.338 -50.609 1.00 36.08 O ATOM 1927 CB ILE A 815 13.126 3.446 -47.849 1.00 41.63 C ATOM 1928 CG1 ILE A 815 13.882 2.619 -46.806 1.00 33.86 C ATOM 1929 CG2 ILE A 815 12.656 2.587 -49.019 1.00 37.99 C ATOM 1930 CD1 ILE A 815 13.165 1.380 -46.358 1.00 35.65 C ATOM 1931 H ILE A 815 13.919 5.273 -46.275 1.00 0.00 H ATOM 1932 N LEU A 816 12.376 6.203 -49.130 1.00 38.67 N ATOM 1933 CA LEU A 816 11.531 6.816 -50.153 1.00 41.83 C ATOM 1934 C LEU A 816 12.060 8.149 -50.668 1.00 45.72 C ATOM 1935 O LEU A 816 11.844 8.476 -51.842 1.00 51.96 O ATOM 1936 CB LEU A 816 10.109 7.005 -49.621 1.00 38.07 C ATOM 1937 CG LEU A 816 9.389 5.715 -49.214 1.00 38.42 C ATOM 1938 CD1 LEU A 816 7.921 5.986 -48.896 1.00 43.88 C ATOM 1939 CD2 LEU A 816 9.532 4.634 -50.279 1.00 45.31 C ATOM 1940 H LEU A 816 12.183 6.398 -48.127 1.00 0.00 H ATOM 1941 N MET A 817 12.750 8.929 -49.839 1.00 44.87 N ATOM 1942 CA MET A 817 13.239 10.227 -50.275 1.00 45.60 C ATOM 1943 C MET A 817 14.736 10.426 -50.067 1.00 44.54 C ATOM 1944 O MET A 817 15.244 11.510 -50.372 1.00 47.22 O ATOM 1945 CB MET A 817 12.456 11.352 -49.576 1.00 48.97 C ATOM 1946 CG MET A 817 11.619 10.864 -48.400 1.00 62.25 C ATOM 1947 SD MET A 817 9.862 11.275 -48.440 1.00 70.65 S ATOM 1948 CE MET A 817 9.850 12.897 -47.676 1.00 56.49 C ATOM 1949 H MET A 817 12.941 8.607 -48.869 1.00 0.00 H ATOM 1950 N GLY A 818 15.457 9.419 -49.583 1.00 50.63 N ATOM 1951 CA GLY A 818 16.906 9.533 -49.461 1.00 48.40 C ATOM 1952 C GLY A 818 17.379 10.570 -48.466 1.00 45.16 C ATOM 1953 O GLY A 818 18.484 11.102 -48.612 1.00 56.92 O ATOM 1954 H GLY A 818 14.983 8.541 -49.289 1.00 0.00 H ATOM 1955 N LYS A 819 16.577 10.871 -47.452 1.00 41.55 N ATOM 1956 CA LYS A 819 16.907 11.892 -46.465 1.00 53.72 C ATOM 1957 C LYS A 819 17.477 11.231 -45.210 1.00 41.48 C ATOM 1958 O LYS A 819 16.785 10.456 -44.542 1.00 42.43 O ATOM 1959 CB LYS A 819 15.670 12.726 -46.124 1.00 58.84 C ATOM 1960 CG LYS A 819 15.936 13.833 -45.123 1.00 63.04 C ATOM 1961 CD LYS A 819 14.684 14.643 -44.822 1.00 67.15 C ATOM 1962 CE LYS A 819 14.980 15.733 -43.802 1.00 58.52 C ATOM 1963 NZ LYS A 819 16.176 16.535 -44.200 1.00 64.43 N ATOM 1964 HZ1 LYS A 819 17.004 15.910 -44.268 1.00 0.00 H ATOM 1965 HZ2 LYS A 819 16.001 16.982 -45.123 1.00 0.00 H ATOM 1966 HZ3 LYS A 819 16.353 17.270 -43.485 1.00 0.00 H ATOM 1967 H LYS A 819 15.677 10.358 -47.358 1.00 0.00 H ATOM 1968 N PHE A 820 18.736 11.531 -44.903 1.00 47.44 N ATOM 1969 CA PHE A 820 19.436 10.962 -43.758 1.00 41.05 C ATOM 1970 C PHE A 820 19.670 12.052 -42.723 1.00 37.93 C ATOM 1971 O PHE A 820 20.206 13.118 -43.049 1.00 43.52 O ATOM 1972 CB PHE A 820 20.766 10.330 -44.184 1.00 39.22 C ATOM 1973 CG PHE A 820 20.599 9.068 -44.978 1.00 41.29 C ATOM 1974 CD1 PHE A 820 20.454 9.115 -46.356 1.00 46.94 C ATOM 1975 CD2 PHE A 820 20.560 7.837 -44.343 1.00 39.21 C ATOM 1976 CE1 PHE A 820 20.288 7.953 -47.090 1.00 46.32 C ATOM 1977 CE2 PHE A 820 20.396 6.671 -45.068 1.00 42.09 C ATOM 1978 CZ PHE A 820 20.255 6.728 -46.444 1.00 40.84 C ATOM 1979 H PHE A 820 19.246 12.205 -45.510 1.00 0.00 H ATOM 1980 N THR A 821 19.267 11.779 -41.480 1.00 39.57 N ATOM 1981 CA THR A 821 19.336 12.745 -40.389 1.00 39.63 C ATOM 1982 C THR A 821 19.601 12.007 -39.079 1.00 35.88 C ATOM 1983 O THR A 821 19.465 10.783 -38.987 1.00 33.99 O ATOM 1984 CB THR A 821 18.028 13.548 -40.252 1.00 42.01 C ATOM 1985 OG1 THR A 821 16.960 12.655 -39.920 1.00 33.76 O ATOM 1986 CG2 THR A 821 17.671 14.296 -41.543 1.00 43.14 C ATOM 1987 HG1 THR A 821 16.862 11.979 -40.636 1.00 0.00 H ATOM 1988 H THR A 821 18.886 10.832 -41.280 1.00 0.00 H ATOM 1989 N THR A 822 19.932 12.773 -38.039 1.00 34.60 N ATOM 1990 CA THR A 822 19.995 12.170 -36.711 1.00 33.04 C ATOM 1991 C THR A 822 18.702 11.429 -36.402 1.00 30.26 C ATOM 1992 O THR A 822 18.731 10.357 -35.783 1.00 28.91 O ATOM 1993 CB THR A 822 20.301 13.242 -35.661 1.00 36.53 C ATOM 1994 OG1 THR A 822 21.592 13.798 -35.932 1.00 41.97 O ATOM 1995 CG2 THR A 822 20.313 12.653 -34.247 1.00 29.15 C ATOM 1996 HG1 THR A 822 22.274 13.082 -35.890 1.00 0.00 H ATOM 1997 H THR A 822 20.142 13.783 -38.172 1.00 0.00 H ATOM 1998 N ALA A 823 17.573 11.932 -36.924 1.00 34.95 N ATOM 1999 CA ALA A 823 16.272 11.307 -36.701 1.00 32.88 C ATOM 2000 C ALA A 823 16.179 9.924 -37.340 1.00 30.83 C ATOM 2001 O ALA A 823 15.578 9.009 -36.763 1.00 33.48 O ATOM 2002 CB ALA A 823 15.166 12.220 -37.231 1.00 39.60 C ATOM 2003 H ALA A 823 17.626 12.793 -37.505 1.00 0.00 H ATOM 2004 N SER A 824 16.757 9.748 -38.535 1.00 37.85 N ATOM 2005 CA SER A 824 16.842 8.408 -39.105 1.00 32.18 C ATOM 2006 C SER A 824 17.890 7.547 -38.397 1.00 30.26 C ATOM 2007 O SER A 824 17.743 6.319 -38.333 1.00 29.59 O ATOM 2008 CB SER A 824 17.123 8.489 -40.610 1.00 34.01 C ATOM 2009 OG SER A 824 18.164 9.393 -40.938 1.00 35.17 O ATOM 2010 HG SER A 824 19.001 9.107 -40.493 1.00 0.00 H ATOM 2011 H SER A 824 17.143 10.562 -39.054 1.00 0.00 H ATOM 2012 N ASP A 825 18.947 8.156 -37.856 1.00 29.59 N ATOM 2013 CA ASP A 825 19.851 7.391 -37.002 1.00 31.90 C ATOM 2014 C ASP A 825 19.114 6.867 -35.768 1.00 32.37 C ATOM 2015 O ASP A 825 19.323 5.723 -35.344 1.00 28.42 O ATOM 2016 CB ASP A 825 21.053 8.252 -36.606 1.00 27.38 C ATOM 2017 CG ASP A 825 22.181 8.219 -37.637 1.00 31.56 C ATOM 2018 OD1 ASP A 825 22.162 7.382 -38.573 1.00 31.93 O ATOM 2019 OD2 ASP A 825 23.108 9.045 -37.501 1.00 32.08 O ATOM 2020 H ASP A 825 19.125 9.164 -38.041 1.00 0.00 H ATOM 2021 N VAL A 826 18.211 7.677 -35.204 1.00 35.03 N ATOM 2022 CA VAL A 826 17.385 7.215 -34.086 1.00 30.83 C ATOM 2023 C VAL A 826 16.538 6.014 -34.504 1.00 31.37 C ATOM 2024 O VAL A 826 16.430 5.025 -33.769 1.00 28.17 O ATOM 2025 CB VAL A 826 16.518 8.373 -33.545 1.00 34.90 C ATOM 2026 CG1 VAL A 826 15.398 7.847 -32.655 1.00 33.84 C ATOM 2027 CG2 VAL A 826 17.387 9.391 -32.792 1.00 30.29 C ATOM 2028 H VAL A 826 18.094 8.646 -35.563 1.00 0.00 H ATOM 2029 N TRP A 827 15.942 6.065 -35.699 1.00 31.82 N ATOM 2030 CA TRP A 827 15.237 4.892 -36.211 1.00 30.08 C ATOM 2031 C TRP A 827 16.165 3.678 -36.270 1.00 28.49 C ATOM 2032 O TRP A 827 15.831 2.594 -35.766 1.00 28.13 O ATOM 2033 CB TRP A 827 14.662 5.215 -37.592 1.00 32.99 C ATOM 2034 CG TRP A 827 13.878 4.125 -38.245 1.00 35.97 C ATOM 2035 CD1 TRP A 827 14.325 2.882 -38.613 1.00 33.76 C ATOM 2036 CD2 TRP A 827 12.509 4.202 -38.670 1.00 37.86 C ATOM 2037 NE1 TRP A 827 13.303 2.174 -39.213 1.00 35.80 N ATOM 2038 CE2 TRP A 827 12.184 2.964 -39.265 1.00 36.77 C ATOM 2039 CE3 TRP A 827 11.525 5.196 -38.591 1.00 36.81 C ATOM 2040 CZ2 TRP A 827 10.912 2.691 -39.773 1.00 38.35 C ATOM 2041 CZ3 TRP A 827 10.263 4.925 -39.103 1.00 36.55 C ATOM 2042 CH2 TRP A 827 9.971 3.681 -39.687 1.00 39.93 C ATOM 2043 HE1 TRP A 827 13.371 1.199 -39.568 1.00 0.00 H ATOM 2044 H TRP A 827 15.980 6.938 -36.263 1.00 0.00 H ATOM 2045 N ALA A 828 17.340 3.846 -36.895 1.00 27.06 N ATOM 2046 CA ALA A 828 18.312 2.761 -36.970 1.00 31.46 C ATOM 2047 C ALA A 828 18.662 2.231 -35.585 1.00 28.84 C ATOM 2048 O ALA A 828 18.740 1.013 -35.371 1.00 27.04 O ATOM 2049 CB ALA A 828 19.575 3.242 -37.693 1.00 28.14 C ATOM 2050 H ALA A 828 17.561 4.763 -37.332 1.00 0.00 H ATOM 2051 N PHE A 829 18.865 3.134 -34.625 1.00 27.79 N ATOM 2052 CA PHE A 829 19.146 2.698 -33.261 1.00 29.82 C ATOM 2053 C PHE A 829 18.046 1.781 -32.727 1.00 29.25 C ATOM 2054 O PHE A 829 18.330 0.800 -32.023 1.00 30.11 O ATOM 2055 CB PHE A 829 19.315 3.908 -32.354 1.00 26.84 C ATOM 2056 CG PHE A 829 19.508 3.541 -30.931 1.00 31.76 C ATOM 2057 CD1 PHE A 829 20.778 3.259 -30.460 1.00 29.70 C ATOM 2058 CD2 PHE A 829 18.424 3.434 -30.068 1.00 29.66 C ATOM 2059 CE1 PHE A 829 20.979 2.905 -29.149 1.00 28.24 C ATOM 2060 CE2 PHE A 829 18.614 3.068 -28.737 1.00 34.07 C ATOM 2061 CZ PHE A 829 19.896 2.803 -28.279 1.00 29.07 C ATOM 2062 H PHE A 829 18.823 4.149 -34.848 1.00 0.00 H ATOM 2063 N GLY A 830 16.783 2.095 -33.040 1.00 31.47 N ATOM 2064 CA GLY A 830 15.685 1.235 -32.618 1.00 28.00 C ATOM 2065 C GLY A 830 15.798 -0.175 -33.163 1.00 26.67 C ATOM 2066 O GLY A 830 15.591 -1.150 -32.437 1.00 24.50 O ATOM 2067 H GLY A 830 16.584 2.957 -33.587 1.00 0.00 H ATOM 2068 N VAL A 831 16.124 -0.306 -34.456 1.00 30.79 N ATOM 2069 CA VAL A 831 16.405 -1.627 -35.014 1.00 25.62 C ATOM 2070 C VAL A 831 17.620 -2.250 -34.332 1.00 26.86 C ATOM 2071 O VAL A 831 17.645 -3.455 -34.051 1.00 27.59 O ATOM 2072 CB VAL A 831 16.620 -1.529 -36.537 1.00 31.05 C ATOM 2073 CG1 VAL A 831 16.794 -2.915 -37.118 1.00 27.31 C ATOM 2074 CG2 VAL A 831 15.465 -0.776 -37.199 1.00 29.21 C ATOM 2075 H VAL A 831 16.177 0.536 -35.065 1.00 0.00 H ATOM 2076 N THR A 832 18.660 -1.446 -34.091 1.00 23.73 N ATOM 2077 CA THR A 832 19.866 -1.954 -33.439 1.00 26.82 C ATOM 2078 C THR A 832 19.568 -2.389 -32.011 1.00 27.96 C ATOM 2079 O THR A 832 20.133 -3.373 -31.519 1.00 28.44 O ATOM 2080 CB THR A 832 20.965 -0.886 -33.468 1.00 28.81 C ATOM 2081 OG1 THR A 832 21.272 -0.551 -34.832 1.00 28.50 O ATOM 2082 CG2 THR A 832 22.246 -1.379 -32.779 1.00 29.71 C ATOM 2083 HG1 THR A 832 20.459 -0.201 -35.276 1.00 0.00 H ATOM 2084 H THR A 832 18.611 -0.446 -34.371 1.00 0.00 H ATOM 2085 N LEU A 833 18.662 -1.679 -31.339 1.00 26.69 N ATOM 2086 CA LEU A 833 18.236 -2.106 -30.006 1.00 27.17 C ATOM 2087 C LEU A 833 17.488 -3.422 -30.088 1.00 26.40 C ATOM 2088 O LEU A 833 17.720 -4.328 -29.276 1.00 25.17 O ATOM 2089 CB LEU A 833 17.376 -1.017 -29.368 1.00 28.82 C ATOM 2090 CG LEU A 833 16.722 -1.247 -27.995 1.00 32.21 C ATOM 2091 CD1 LEU A 833 17.689 -1.858 -26.990 1.00 26.39 C ATOM 2092 CD2 LEU A 833 16.249 0.101 -27.511 1.00 32.04 C ATOM 2093 H LEU A 833 18.257 -0.820 -31.763 1.00 0.00 H ATOM 2094 N TRP A 834 16.618 -3.557 -31.100 1.00 32.05 N ATOM 2095 CA TRP A 834 15.926 -4.821 -31.347 1.00 31.66 C ATOM 2096 C TRP A 834 16.916 -5.964 -31.567 1.00 27.87 C ATOM 2097 O TRP A 834 16.743 -7.057 -31.015 1.00 30.14 O ATOM 2098 CB TRP A 834 14.980 -4.663 -32.548 1.00 25.54 C ATOM 2099 CG TRP A 834 14.148 -5.879 -32.863 1.00 33.02 C ATOM 2100 CD1 TRP A 834 12.904 -6.187 -32.356 1.00 31.37 C ATOM 2101 CD2 TRP A 834 14.485 -6.943 -33.762 1.00 37.78 C ATOM 2102 NE1 TRP A 834 12.461 -7.379 -32.879 1.00 34.79 N ATOM 2103 CE2 TRP A 834 13.406 -7.862 -33.750 1.00 33.88 C ATOM 2104 CE3 TRP A 834 15.593 -7.210 -34.582 1.00 31.47 C ATOM 2105 CZ2 TRP A 834 13.406 -9.029 -34.525 1.00 38.08 C ATOM 2106 CZ3 TRP A 834 15.591 -8.373 -35.352 1.00 30.73 C ATOM 2107 CH2 TRP A 834 14.505 -9.265 -35.322 1.00 32.32 C ATOM 2108 HE1 TRP A 834 11.557 -7.840 -32.652 1.00 0.00 H ATOM 2109 H TRP A 834 16.432 -2.745 -31.722 1.00 0.00 H ATOM 2110 N GLU A 835 17.959 -5.737 -32.375 1.00 28.51 N ATOM 2111 CA GLU A 835 18.992 -6.759 -32.555 1.00 28.67 C ATOM 2112 C GLU A 835 19.586 -7.182 -31.220 1.00 29.90 C ATOM 2113 O GLU A 835 19.720 -8.380 -30.937 1.00 28.64 O ATOM 2114 CB GLU A 835 20.127 -6.249 -33.445 1.00 27.46 C ATOM 2115 CG GLU A 835 19.823 -5.910 -34.884 1.00 28.20 C ATOM 2116 CD GLU A 835 21.096 -5.495 -35.594 1.00 26.71 C ATOM 2117 OE1 GLU A 835 21.357 -4.276 -35.726 1.00 25.59 O ATOM 2118 OE2 GLU A 835 21.863 -6.399 -35.984 1.00 29.92 O ATOM 2119 H GLU A 835 18.036 -4.830 -32.878 1.00 0.00 H ATOM 2120 N VAL A 836 20.006 -6.202 -30.413 1.00 28.76 N ATOM 2121 CA VAL A 836 20.657 -6.504 -29.136 1.00 30.42 C ATOM 2122 C VAL A 836 19.752 -7.382 -28.288 1.00 29.31 C ATOM 2123 O VAL A 836 20.175 -8.418 -27.762 1.00 33.77 O ATOM 2124 CB VAL A 836 21.045 -5.202 -28.408 1.00 28.05 C ATOM 2125 CG1 VAL A 836 21.485 -5.471 -26.932 1.00 28.92 C ATOM 2126 CG2 VAL A 836 22.144 -4.503 -29.156 1.00 25.41 C ATOM 2127 H VAL A 836 19.868 -5.211 -30.696 1.00 0.00 H ATOM 2128 N LEU A 837 18.478 -7.014 -28.196 1.00 29.95 N ATOM 2129 CA LEU A 837 17.558 -7.782 -27.366 1.00 34.78 C ATOM 2130 C LEU A 837 17.216 -9.133 -27.977 1.00 38.99 C ATOM 2131 O LEU A 837 16.786 -10.029 -27.246 1.00 35.46 O ATOM 2132 CB LEU A 837 16.295 -6.972 -27.113 1.00 31.72 C ATOM 2133 CG LEU A 837 16.525 -5.866 -26.083 1.00 40.12 C ATOM 2134 CD1 LEU A 837 15.524 -4.742 -26.257 1.00 41.31 C ATOM 2135 CD2 LEU A 837 16.422 -6.464 -24.684 1.00 37.98 C ATOM 2136 H LEU A 837 18.138 -6.180 -28.715 1.00 0.00 H ATOM 2137 N MET A 838 17.396 -9.298 -29.291 1.00 28.98 N ATOM 2138 CA MET A 838 17.267 -10.598 -29.935 1.00 31.22 C ATOM 2139 C MET A 838 18.529 -11.437 -29.809 1.00 38.53 C ATOM 2140 O MET A 838 18.532 -12.581 -30.277 1.00 38.60 O ATOM 2141 CB MET A 838 16.923 -10.423 -31.428 1.00 32.35 C ATOM 2142 CG MET A 838 15.519 -9.864 -31.714 1.00 35.88 C ATOM 2143 SD MET A 838 14.155 -10.888 -31.093 1.00 38.95 S ATOM 2144 CE MET A 838 14.278 -12.254 -32.249 1.00 45.36 C ATOM 2145 H MET A 838 17.636 -8.470 -29.873 1.00 0.00 H ATOM 2146 N LEU A 839 19.585 -10.900 -29.181 1.00 36.59 N ATOM 2147 CA LEU A 839 20.926 -11.492 -29.194 1.00 33.73 C ATOM 2148 C LEU A 839 21.377 -11.799 -30.627 1.00 35.63 C ATOM 2149 O LEU A 839 22.113 -12.761 -30.880 1.00 31.32 O ATOM 2150 CB LEU A 839 21.007 -12.734 -28.296 1.00 32.25 C ATOM 2151 CG LEU A 839 21.043 -12.448 -26.770 1.00 38.20 C ATOM 2152 CD1 LEU A 839 19.681 -12.045 -26.235 1.00 37.57 C ATOM 2153 CD2 LEU A 839 21.583 -13.623 -25.964 1.00 37.49 C ATOM 2154 H LEU A 839 19.445 -10.014 -28.655 1.00 0.00 H ATOM 2155 N CYS A 840 20.942 -10.960 -31.569 1.00 31.52 N ATOM 2156 CA CYS A 840 21.359 -11.043 -32.972 1.00 34.96 C ATOM 2157 C CYS A 840 20.989 -12.382 -33.607 1.00 33.20 C ATOM 2158 O CYS A 840 21.633 -12.828 -34.560 1.00 39.12 O ATOM 2159 CB CYS A 840 22.866 -10.783 -33.122 1.00 31.27 C ATOM 2160 SG CYS A 840 23.374 -9.120 -32.658 1.00 33.12 S ATOM 2161 H CYS A 840 20.275 -10.211 -31.295 1.00 0.00 H ATOM 2162 N ARG A 841 19.940 -13.031 -33.105 1.00 33.40 N ATOM 2163 CA ARG A 841 19.551 -14.339 -33.619 1.00 35.65 C ATOM 2164 C ARG A 841 18.721 -14.259 -34.894 1.00 36.67 C ATOM 2165 O ARG A 841 18.437 -15.303 -35.490 1.00 45.10 O ATOM 2166 CB ARG A 841 18.766 -15.120 -32.558 1.00 34.86 C ATOM 2167 CG ARG A 841 19.565 -15.441 -31.306 1.00 38.26 C ATOM 2168 CD ARG A 841 20.802 -16.198 -31.681 1.00 39.88 C ATOM 2169 NE ARG A 841 21.288 -17.047 -30.605 1.00 40.24 N ATOM 2170 CZ ARG A 841 22.177 -16.664 -29.695 1.00 35.97 C ATOM 2171 NH1 ARG A 841 22.675 -15.432 -29.721 1.00 37.53 N ATOM 2172 NH2 ARG A 841 22.574 -17.518 -28.759 1.00 40.69 N ATOM 2173 HE ARG A 841 20.916 -18.016 -30.544 1.00 0.00 H ATOM 2174 HH12 ARG A 841 23.371 -15.137 -29.006 1.00 0.00 H ATOM 2175 HH11 ARG A 841 22.369 -14.763 -30.456 1.00 0.00 H ATOM 2176 HH22 ARG A 841 23.270 -17.221 -28.045 1.00 0.00 H ATOM 2177 HH21 ARG A 841 22.189 -18.484 -28.739 1.00 0.00 H ATOM 2178 H ARG A 841 19.390 -12.599 -32.335 1.00 0.00 H ATOM 2179 N ALA A 842 18.339 -13.065 -35.338 1.00 34.89 N ATOM 2180 CA ALA A 842 17.393 -12.941 -36.439 1.00 34.82 C ATOM 2181 C ALA A 842 17.616 -11.626 -37.164 1.00 36.13 C ATOM 2182 O ALA A 842 17.720 -10.576 -36.525 1.00 30.85 O ATOM 2183 CB ALA A 842 15.952 -13.014 -35.928 1.00 35.01 C ATOM 2184 H ALA A 842 18.721 -12.207 -34.892 1.00 0.00 H ATOM 2185 N GLN A 843 17.680 -11.684 -38.490 1.00 32.14 N ATOM 2186 CA GLN A 843 17.718 -10.460 -39.269 1.00 30.24 C ATOM 2187 C GLN A 843 16.431 -9.669 -39.049 1.00 31.67 C ATOM 2188 O GLN A 843 15.342 -10.249 -39.018 1.00 33.83 O ATOM 2189 CB GLN A 843 17.879 -10.770 -40.762 1.00 35.80 C ATOM 2190 CG GLN A 843 18.023 -9.536 -41.641 1.00 28.78 C ATOM 2191 CD GLN A 843 17.956 -9.871 -43.125 1.00 36.35 C ATOM 2192 OE1 GLN A 843 17.029 -10.552 -43.575 1.00 33.54 O ATOM 2193 NE2 GLN A 843 18.943 -9.406 -43.885 1.00 33.54 N ATOM 2194 HE22 GLN A 843 19.702 -8.836 -43.460 1.00 0.00 H ATOM 2195 HE21 GLN A 843 18.956 -9.612 -44.904 1.00 0.00 H ATOM 2196 H GLN A 843 17.703 -12.607 -38.970 1.00 0.00 H ATOM 2197 N PRO A 844 16.514 -8.353 -38.890 1.00 29.93 N ATOM 2198 CA PRO A 844 15.292 -7.553 -38.790 1.00 27.34 C ATOM 2199 C PRO A 844 14.446 -7.701 -40.047 1.00 36.64 C ATOM 2200 O PRO A 844 14.959 -7.680 -41.171 1.00 29.24 O ATOM 2201 CB PRO A 844 15.813 -6.125 -38.630 1.00 29.30 C ATOM 2202 CG PRO A 844 17.214 -6.283 -38.109 1.00 35.69 C ATOM 2203 CD PRO A 844 17.734 -7.548 -38.707 1.00 32.14 C ATOM 2204 N PHE A 845 13.136 -7.849 -39.841 1.00 30.36 N ATOM 2205 CA PHE A 845 12.187 -8.111 -40.929 1.00 35.81 C ATOM 2206 C PHE A 845 12.590 -9.335 -41.729 1.00 35.60 C ATOM 2207 O PHE A 845 12.390 -9.383 -42.941 1.00 35.31 O ATOM 2208 CB PHE A 845 12.047 -6.911 -41.868 1.00 32.08 C ATOM 2209 CG PHE A 845 11.599 -5.668 -41.183 1.00 32.16 C ATOM 2210 CD1 PHE A 845 10.301 -5.550 -40.721 1.00 35.64 C ATOM 2211 CD2 PHE A 845 12.476 -4.608 -41.009 1.00 36.28 C ATOM 2212 CE1 PHE A 845 9.880 -4.397 -40.086 1.00 36.09 C ATOM 2213 CE2 PHE A 845 12.064 -3.447 -40.385 1.00 40.38 C ATOM 2214 CZ PHE A 845 10.761 -3.340 -39.925 1.00 34.42 C ATOM 2215 H PHE A 845 12.773 -7.776 -38.869 1.00 0.00 H ATOM 2216 N GLY A 846 13.163 -10.329 -41.050 1.00 38.13 N ATOM 2217 CA GLY A 846 13.671 -11.492 -41.752 1.00 39.00 C ATOM 2218 C GLY A 846 12.628 -12.177 -42.608 1.00 41.56 C ATOM 2219 O GLY A 846 12.959 -12.768 -43.642 1.00 41.28 O ATOM 2220 H GLY A 846 13.246 -10.270 -40.015 1.00 0.00 H ATOM 2221 N GLN A 847 11.355 -12.091 -42.204 1.00 39.73 N ATOM 2222 CA GLN A 847 10.274 -12.754 -42.928 1.00 40.49 C ATOM 2223 C GLN A 847 9.961 -12.081 -44.260 1.00 35.82 C ATOM 2224 O GLN A 847 9.327 -12.696 -45.120 1.00 37.82 O ATOM 2225 CB GLN A 847 9.018 -12.797 -42.047 1.00 42.87 C ATOM 2226 CG GLN A 847 8.313 -11.436 -41.827 1.00 47.17 C ATOM 2227 CD GLN A 847 8.943 -10.540 -40.743 1.00 41.18 C ATOM 2228 OE1 GLN A 847 10.045 -10.802 -40.239 1.00 35.76 O ATOM 2229 NE2 GLN A 847 8.228 -9.469 -40.384 1.00 40.04 N ATOM 2230 HE22 GLN A 847 7.307 -9.285 -40.831 1.00 0.00 H ATOM 2231 HE21 GLN A 847 8.592 -8.820 -39.657 1.00 0.00 H ATOM 2232 H GLN A 847 11.130 -11.538 -41.353 1.00 0.00 H ATOM 2233 N LEU A 848 10.390 -10.841 -44.448 1.00 36.56 N ATOM 2234 CA LEU A 848 10.092 -10.063 -45.638 1.00 28.77 C ATOM 2235 C LEU A 848 11.276 -10.065 -46.597 1.00 40.72 C ATOM 2236 O LEU A 848 12.433 -9.925 -46.178 1.00 32.78 O ATOM 2237 CB LEU A 848 9.759 -8.620 -45.264 1.00 32.46 C ATOM 2238 CG LEU A 848 8.695 -8.441 -44.184 1.00 36.28 C ATOM 2239 CD1 LEU A 848 8.457 -6.962 -43.958 1.00 30.49 C ATOM 2240 CD2 LEU A 848 7.418 -9.167 -44.604 1.00 37.79 C ATOM 2241 H LEU A 848 10.970 -10.402 -43.705 1.00 0.00 H ATOM 2242 N THR A 849 10.975 -10.208 -47.885 1.00 33.50 N ATOM 2243 CA THR A 849 11.957 -9.989 -48.927 1.00 31.50 C ATOM 2244 C THR A 849 12.359 -8.519 -48.945 1.00 30.45 C ATOM 2245 O THR A 849 11.720 -7.670 -48.326 1.00 30.18 O ATOM 2246 CB THR A 849 11.392 -10.394 -50.294 1.00 34.65 C ATOM 2247 OG1 THR A 849 10.356 -9.479 -50.671 1.00 34.30 O ATOM 2248 CG2 THR A 849 10.814 -11.789 -50.236 1.00 33.10 C ATOM 2249 HG1 THR A 849 9.634 -9.503 -49.994 1.00 0.00 H ATOM 2250 H THR A 849 10.008 -10.485 -48.151 1.00 0.00 H ATOM 2251 N ASP A 850 13.431 -8.214 -49.682 1.00 30.92 N ATOM 2252 CA ASP A 850 13.865 -6.821 -49.778 1.00 32.34 C ATOM 2253 C ASP A 850 12.772 -5.945 -50.370 1.00 34.77 C ATOM 2254 O ASP A 850 12.586 -4.798 -49.941 1.00 32.52 O ATOM 2255 CB ASP A 850 15.144 -6.702 -50.616 1.00 38.65 C ATOM 2256 CG ASP A 850 16.385 -7.199 -49.885 1.00 38.55 C ATOM 2257 OD1 ASP A 850 16.380 -7.233 -48.636 1.00 33.02 O ATOM 2258 OD2 ASP A 850 17.371 -7.553 -50.569 1.00 38.76 O ATOM 2259 H ASP A 850 13.952 -8.961 -50.183 1.00 0.00 H ATOM 2260 N GLU A 851 12.057 -6.458 -51.382 1.00 33.58 N ATOM 2261 CA GLU A 851 10.985 -5.689 -52.000 1.00 30.42 C ATOM 2262 C GLU A 851 9.839 -5.457 -51.021 1.00 31.96 C ATOM 2263 O GLU A 851 9.201 -4.398 -51.047 1.00 35.44 O ATOM 2264 CB GLU A 851 10.468 -6.406 -53.253 1.00 36.76 C ATOM 2265 H GLU A 851 12.270 -7.415 -51.729 1.00 0.00 H ATOM 2266 N GLN A 852 9.553 -6.443 -50.167 1.00 30.14 N ATOM 2267 CA GLN A 852 8.528 -6.253 -49.136 1.00 35.08 C ATOM 2268 C GLN A 852 8.953 -5.213 -48.106 1.00 37.34 C ATOM 2269 O GLN A 852 8.115 -4.444 -47.616 1.00 33.75 O ATOM 2270 CB GLN A 852 8.205 -7.586 -48.461 1.00 29.30 C ATOM 2271 CG GLN A 852 7.491 -8.555 -49.395 1.00 36.47 C ATOM 2272 CD GLN A 852 7.228 -9.899 -48.761 1.00 34.49 C ATOM 2273 OE1 GLN A 852 8.144 -10.577 -48.303 1.00 38.13 O ATOM 2274 NE2 GLN A 852 5.962 -10.293 -48.725 1.00 47.18 N ATOM 2275 HE22 GLN A 852 5.217 -9.687 -49.125 1.00 0.00 H ATOM 2276 HE21 GLN A 852 5.714 -11.208 -48.297 1.00 0.00 H ATOM 2277 H GLN A 852 10.059 -7.349 -50.233 1.00 0.00 H ATOM 2278 N VAL A 853 10.248 -5.175 -47.759 1.00 36.64 N ATOM 2279 CA VAL A 853 10.757 -4.136 -46.860 1.00 34.73 C ATOM 2280 C VAL A 853 10.530 -2.764 -47.471 1.00 32.69 C ATOM 2281 O VAL A 853 10.107 -1.820 -46.792 1.00 30.65 O ATOM 2282 CB VAL A 853 12.253 -4.380 -46.548 1.00 28.85 C ATOM 2283 CG1 VAL A 853 12.871 -3.203 -45.792 1.00 26.42 C ATOM 2284 CG2 VAL A 853 12.422 -5.649 -45.757 1.00 27.42 C ATOM 2285 H VAL A 853 10.900 -5.893 -48.133 1.00 0.00 H ATOM 2286 N ILE A 854 10.784 -2.637 -48.774 1.00 32.90 N ATOM 2287 CA ILE A 854 10.573 -1.364 -49.450 1.00 32.14 C ATOM 2288 C ILE A 854 9.083 -1.034 -49.519 1.00 32.09 C ATOM 2289 O ILE A 854 8.682 0.128 -49.376 1.00 36.70 O ATOM 2290 CB ILE A 854 11.227 -1.408 -50.840 1.00 32.36 C ATOM 2291 CG1 ILE A 854 12.746 -1.473 -50.669 1.00 33.24 C ATOM 2292 CG2 ILE A 854 10.815 -0.203 -51.661 1.00 31.49 C ATOM 2293 CD1 ILE A 854 13.502 -2.007 -51.866 1.00 38.07 C ATOM 2294 H ILE A 854 11.136 -3.454 -49.312 1.00 0.00 H ATOM 2295 N GLU A 855 8.241 -2.042 -49.722 1.00 34.54 N ATOM 2296 CA GLU A 855 6.799 -1.794 -49.707 1.00 37.98 C ATOM 2297 C GLU A 855 6.333 -1.417 -48.303 1.00 39.04 C ATOM 2298 O GLU A 855 5.509 -0.509 -48.136 1.00 39.28 O ATOM 2299 CB GLU A 855 6.049 -3.022 -50.231 1.00 41.83 C ATOM 2300 CG GLU A 855 6.227 -3.238 -51.749 1.00 53.63 C ATOM 2301 CD GLU A 855 5.826 -4.633 -52.239 1.00 58.05 C ATOM 2302 OE1 GLU A 855 5.711 -5.568 -51.414 1.00 57.19 O ATOM 2303 OE2 GLU A 855 5.633 -4.793 -53.467 1.00 61.97 O ATOM 2304 H GLU A 855 8.605 -3.002 -49.891 1.00 0.00 H ATOM 2305 N ASN A 856 6.884 -2.078 -47.280 1.00 42.00 N ATOM 2306 CA ASN A 856 6.570 -1.708 -45.903 1.00 37.42 C ATOM 2307 C ASN A 856 6.905 -0.246 -45.645 1.00 35.38 C ATOM 2308 O ASN A 856 6.199 0.428 -44.893 1.00 41.91 O ATOM 2309 CB ASN A 856 7.316 -2.625 -44.929 1.00 35.22 C ATOM 2310 CG ASN A 856 6.805 -2.504 -43.494 1.00 42.79 C ATOM 2311 OD1 ASN A 856 5.600 -2.445 -43.257 1.00 37.66 O ATOM 2312 ND2 ASN A 856 7.725 -2.470 -42.533 1.00 33.97 N ATOM 2313 HD22 ASN A 856 8.734 -2.523 -42.777 1.00 0.00 H ATOM 2314 HD21 ASN A 856 7.434 -2.391 -41.538 1.00 0.00 H ATOM 2315 H ASN A 856 7.541 -2.862 -47.466 1.00 0.00 H ATOM 2316 N ALA A 857 7.959 0.270 -46.275 1.00 36.29 N ATOM 2317 CA ALA A 857 8.260 1.688 -46.126 1.00 36.50 C ATOM 2318 C ALA A 857 7.199 2.557 -46.788 1.00 40.79 C ATOM 2319 O ALA A 857 6.924 3.662 -46.308 1.00 41.31 O ATOM 2320 CB ALA A 857 9.640 2.001 -46.691 1.00 34.37 C ATOM 2321 H ALA A 857 8.562 -0.334 -46.869 1.00 0.00 H ATOM 2322 N GLY A 858 6.597 2.085 -47.884 1.00 41.15 N ATOM 2323 CA GLY A 858 5.435 2.774 -48.420 1.00 37.44 C ATOM 2324 C GLY A 858 4.284 2.829 -47.431 1.00 39.50 C ATOM 2325 O GLY A 858 3.610 3.852 -47.305 1.00 47.65 O ATOM 2326 H GLY A 858 6.958 1.229 -48.351 1.00 0.00 H ATOM 2327 N GLU A 859 4.048 1.730 -46.709 1.00 38.30 N ATOM 2328 CA GLU A 859 2.950 1.694 -45.747 1.00 42.31 C ATOM 2329 C GLU A 859 3.163 2.684 -44.606 1.00 50.73 C ATOM 2330 O GLU A 859 2.197 3.274 -44.106 1.00 48.80 O ATOM 2331 CB GLU A 859 2.772 0.279 -45.198 1.00 36.91 C ATOM 2332 CG GLU A 859 2.297 -0.733 -46.236 1.00 46.92 C ATOM 2333 CD GLU A 859 0.937 -0.381 -46.845 1.00 53.60 C ATOM 2334 OE1 GLU A 859 0.120 0.293 -46.174 1.00 53.20 O ATOM 2335 OE2 GLU A 859 0.684 -0.789 -47.996 1.00 48.12 O ATOM 2336 H GLU A 859 4.652 0.892 -46.833 1.00 0.00 H ATOM 2337 N PHE A 860 4.414 2.861 -44.159 1.00 42.35 N ATOM 2338 CA PHE A 860 4.699 3.897 -43.166 1.00 45.95 C ATOM 2339 C PHE A 860 4.338 5.271 -43.703 1.00 45.82 C ATOM 2340 O PHE A 860 3.760 6.097 -42.987 1.00 54.29 O ATOM 2341 CB PHE A 860 6.179 3.883 -42.759 1.00 43.23 C ATOM 2342 CG PHE A 860 6.524 2.844 -41.739 1.00 43.52 C ATOM 2343 CD1 PHE A 860 6.264 3.061 -40.401 1.00 44.81 C ATOM 2344 CD2 PHE A 860 7.127 1.655 -42.117 1.00 44.73 C ATOM 2345 CE1 PHE A 860 6.587 2.106 -39.463 1.00 41.44 C ATOM 2346 CE2 PHE A 860 7.450 0.692 -41.182 1.00 36.98 C ATOM 2347 CZ PHE A 860 7.179 0.919 -39.853 1.00 46.18 C ATOM 2348 H PHE A 860 5.184 2.261 -44.519 1.00 0.00 H ATOM 2349 N PHE A 861 4.682 5.533 -44.964 1.00 42.45 N ATOM 2350 CA PHE A 861 4.363 6.819 -45.572 1.00 52.49 C ATOM 2351 C PHE A 861 2.855 7.048 -45.637 1.00 55.00 C ATOM 2352 O PHE A 861 2.378 8.157 -45.371 1.00 59.79 O ATOM 2353 CB PHE A 861 4.984 6.901 -46.966 1.00 48.86 C ATOM 2354 CG PHE A 861 4.379 7.965 -47.835 1.00 54.50 C ATOM 2355 CD1 PHE A 861 4.664 9.305 -47.616 1.00 48.11 C ATOM 2356 CD2 PHE A 861 3.526 7.624 -48.879 1.00 58.04 C ATOM 2357 CE1 PHE A 861 4.109 10.286 -48.419 1.00 51.97 C ATOM 2358 CE2 PHE A 861 2.966 8.598 -49.688 1.00 55.91 C ATOM 2359 CZ PHE A 861 3.258 9.932 -49.459 1.00 60.00 C ATOM 2360 H PHE A 861 5.184 4.812 -45.520 1.00 0.00 H ATOM 2361 N ARG A 862 2.086 6.015 -45.986 1.00 51.91 N ATOM 2362 CA ARG A 862 0.636 6.180 -46.057 1.00 58.00 C ATOM 2363 C ARG A 862 -0.026 6.142 -44.684 1.00 57.85 C ATOM 2364 O ARG A 862 -1.119 6.698 -44.523 1.00 57.66 O ATOM 2365 CB ARG A 862 0.034 5.115 -46.976 1.00 51.33 C ATOM 2366 CG ARG A 862 0.374 5.342 -48.443 1.00 56.32 C ATOM 2367 CD ARG A 862 -0.248 4.286 -49.338 1.00 63.47 C ATOM 2368 NE ARG A 862 0.447 3.002 -49.250 1.00 62.01 N ATOM 2369 CZ ARG A 862 1.395 2.603 -50.095 1.00 54.75 C ATOM 2370 NH1 ARG A 862 1.971 1.417 -49.933 1.00 54.31 N ATOM 2371 NH2 ARG A 862 1.770 3.388 -51.099 1.00 58.32 N ATOM 2372 HE ARG A 862 0.183 2.359 -48.477 1.00 0.00 H ATOM 2373 HH12 ARG A 862 2.712 1.104 -50.593 1.00 0.00 H ATOM 2374 HH11 ARG A 862 1.681 0.801 -49.147 1.00 0.00 H ATOM 2375 HH22 ARG A 862 2.511 3.072 -51.757 1.00 0.00 H ATOM 2376 HH21 ARG A 862 1.323 4.318 -51.227 1.00 0.00 H ATOM 2377 H ARG A 862 2.518 5.095 -46.207 1.00 0.00 H ATOM 2378 N ASP A 863 0.619 5.514 -43.698 1.00 56.58 N ATOM 2379 CA ASP A 863 0.160 5.512 -42.306 1.00 61.43 C ATOM 2380 C ASP A 863 -1.276 5.003 -42.184 1.00 61.05 C ATOM 2381 O ASP A 863 -2.098 5.570 -41.462 1.00 60.65 O ATOM 2382 CB ASP A 863 0.297 6.899 -41.675 1.00 57.91 C ATOM 2383 CG ASP A 863 0.232 6.857 -40.154 1.00 61.86 C ATOM 2384 OD1 ASP A 863 0.284 5.744 -39.573 1.00 54.11 O ATOM 2385 OD2 ASP A 863 0.122 7.942 -39.540 1.00 63.98 O ATOM 2386 H ASP A 863 1.493 4.999 -43.930 1.00 0.00 H ATOM 2387 N GLN A 864 -1.581 3.917 -42.889 1.00 52.60 N ATOM 2388 CA GLN A 864 -2.903 3.313 -42.850 1.00 52.58 C ATOM 2389 C GLN A 864 -2.962 2.101 -41.939 1.00 51.95 C ATOM 2390 O GLN A 864 -3.917 1.320 -42.019 1.00 50.67 O ATOM 2391 CB GLN A 864 -3.350 2.920 -44.254 1.00 46.81 C ATOM 2392 CG GLN A 864 -3.784 4.077 -45.106 1.00 53.28 C ATOM 2393 CD GLN A 864 -4.909 3.673 -46.028 1.00 58.60 C ATOM 2394 OE1 GLN A 864 -5.024 2.503 -46.408 1.00 56.62 O ATOM 2395 NE2 GLN A 864 -5.764 4.628 -46.373 1.00 56.59 N ATOM 2396 HE22 GLN A 864 -5.626 5.599 -46.028 1.00 0.00 H ATOM 2397 HE21 GLN A 864 -6.572 4.405 -46.988 1.00 0.00 H ATOM 2398 H GLN A 864 -0.849 3.485 -43.488 1.00 0.00 H ATOM 2399 N GLY A 865 -1.963 1.920 -41.081 1.00 45.88 N ATOM 2400 CA GLY A 865 -2.003 0.804 -40.160 1.00 44.64 C ATOM 2401 C GLY A 865 -1.670 -0.536 -40.764 1.00 46.09 C ATOM 2402 O GLY A 865 -1.776 -1.555 -40.073 1.00 49.27 O ATOM 2403 H GLY A 865 -1.157 2.577 -41.071 1.00 0.00 H ATOM 2404 N ARG A 866 -1.264 -0.575 -42.031 1.00 40.45 N ATOM 2405 CA ARG A 866 -0.821 -1.821 -42.637 1.00 44.74 C ATOM 2406 C ARG A 866 0.694 -2.009 -42.567 1.00 50.86 C ATOM 2407 O ARG A 866 1.181 -3.100 -42.889 1.00 47.40 O ATOM 2408 CB ARG A 866 -1.311 -1.887 -44.088 1.00 44.91 C ATOM 2409 CG ARG A 866 -2.841 -2.001 -44.190 1.00 46.55 C ATOM 2410 CD ARG A 866 -3.360 -1.816 -45.617 1.00 59.95 C ATOM 2411 NE ARG A 866 -2.748 -2.749 -46.563 1.00 74.86 N ATOM 2412 CZ ARG A 866 -3.052 -4.043 -46.654 1.00 79.89 C ATOM 2413 NH1 ARG A 866 -2.436 -4.808 -47.550 1.00 70.83 N ATOM 2414 NH2 ARG A 866 -3.963 -4.578 -45.846 1.00 77.86 N ATOM 2415 HE ARG A 866 -2.024 -2.376 -47.210 1.00 0.00 H ATOM 2416 HH12 ARG A 866 -2.673 -5.818 -47.622 1.00 0.00 H ATOM 2417 HH11 ARG A 866 -1.717 -4.396 -48.179 1.00 0.00 H ATOM 2418 HH22 ARG A 866 -4.196 -5.589 -45.922 1.00 0.00 H ATOM 2419 HH21 ARG A 866 -4.442 -3.986 -45.138 1.00 0.00 H ATOM 2420 H ARG A 866 -1.263 0.298 -42.596 1.00 0.00 H ATOM 2421 N GLN A 867 1.441 -0.987 -42.140 1.00 40.97 N ATOM 2422 CA GLN A 867 2.887 -1.121 -41.992 1.00 49.48 C ATOM 2423 C GLN A 867 3.217 -2.173 -40.938 1.00 42.81 C ATOM 2424 O GLN A 867 2.417 -2.458 -40.046 1.00 42.03 O ATOM 2425 CB GLN A 867 3.524 0.228 -41.629 1.00 39.18 C ATOM 2426 CG GLN A 867 3.171 0.778 -40.250 1.00 40.80 C ATOM 2427 CD GLN A 867 1.765 1.357 -40.177 1.00 53.83 C ATOM 2428 OE1 GLN A 867 1.119 1.577 -41.203 1.00 50.63 O ATOM 2429 NE2 GLN A 867 1.284 1.606 -38.957 1.00 49.46 N ATOM 2430 HE22 GLN A 867 1.865 1.405 -38.118 1.00 0.00 H ATOM 2431 HE21 GLN A 867 0.329 2.001 -38.845 1.00 0.00 H ATOM 2432 H GLN A 867 0.985 -0.081 -41.909 1.00 0.00 H ATOM 2433 N VAL A 868 4.399 -2.772 -41.058 1.00 44.16 N ATOM 2434 CA VAL A 868 4.823 -3.876 -40.199 1.00 42.55 C ATOM 2435 C VAL A 868 5.939 -3.391 -39.281 1.00 44.33 C ATOM 2436 O VAL A 868 6.959 -2.872 -39.757 1.00 40.03 O ATOM 2437 CB VAL A 868 5.295 -5.078 -41.034 1.00 45.37 C ATOM 2438 CG1 VAL A 868 5.733 -6.226 -40.131 1.00 41.15 C ATOM 2439 CG2 VAL A 868 4.207 -5.509 -42.003 1.00 43.21 C ATOM 2440 H VAL A 868 5.051 -2.439 -41.797 1.00 0.00 H ATOM 2441 N TYR A 869 5.750 -3.567 -37.972 1.00 36.39 N ATOM 2442 CA TYR A 869 6.767 -3.263 -36.974 1.00 34.37 C ATOM 2443 C TYR A 869 7.495 -4.539 -36.574 1.00 35.64 C ATOM 2444 O TYR A 869 6.918 -5.633 -36.587 1.00 31.74 O ATOM 2445 CB TYR A 869 6.151 -2.601 -35.720 1.00 32.20 C ATOM 2446 CG TYR A 869 5.535 -1.260 -36.023 1.00 34.38 C ATOM 2447 CD1 TYR A 869 6.319 -0.109 -36.097 1.00 31.42 C ATOM 2448 CD2 TYR A 869 4.175 -1.148 -36.289 1.00 29.92 C ATOM 2449 CE1 TYR A 869 5.758 1.117 -36.400 1.00 35.37 C ATOM 2450 CE2 TYR A 869 3.606 0.073 -36.596 1.00 33.49 C ATOM 2451 CZ TYR A 869 4.390 1.199 -36.652 1.00 36.17 C ATOM 2452 OH TYR A 869 3.800 2.405 -36.965 1.00 37.35 O ATOM 2453 HH TYR A 869 4.488 3.117 -36.966 1.00 0.00 H ATOM 2454 H TYR A 869 4.834 -3.939 -37.649 1.00 0.00 H ATOM 2455 N LEU A 870 8.777 -4.394 -36.228 1.00 35.79 N ATOM 2456 CA LEU A 870 9.487 -5.492 -35.586 1.00 34.98 C ATOM 2457 C LEU A 870 8.776 -5.872 -34.292 1.00 33.20 C ATOM 2458 O LEU A 870 8.281 -5.009 -33.563 1.00 34.10 O ATOM 2459 CB LEU A 870 10.942 -5.103 -35.291 1.00 30.80 C ATOM 2460 CG LEU A 870 11.832 -4.745 -36.483 1.00 40.48 C ATOM 2461 CD1 LEU A 870 13.196 -4.233 -36.014 1.00 33.41 C ATOM 2462 CD2 LEU A 870 11.979 -5.926 -37.449 1.00 35.59 C ATOM 2463 H LEU A 870 9.268 -3.497 -36.417 1.00 0.00 H ATOM 2464 N SER A 871 8.749 -7.170 -33.999 1.00 36.07 N ATOM 2465 CA SER A 871 8.014 -7.706 -32.863 1.00 34.21 C ATOM 2466 C SER A 871 8.797 -7.534 -31.563 1.00 41.32 C ATOM 2467 O SER A 871 10.017 -7.367 -31.562 1.00 35.78 O ATOM 2468 CB SER A 871 7.700 -9.181 -33.101 1.00 36.26 C ATOM 2469 OG SER A 871 6.784 -9.297 -34.181 1.00 46.78 O ATOM 2470 HG SER A 871 7.187 -8.907 -34.997 1.00 0.00 H ATOM 2471 H SER A 871 9.275 -7.829 -34.607 1.00 0.00 H ATOM 2472 N ARG A 872 8.077 -7.573 -30.442 1.00 39.15 N ATOM 2473 CA ARG A 872 8.733 -7.429 -29.146 1.00 31.56 C ATOM 2474 C ARG A 872 9.649 -8.623 -28.913 1.00 33.81 C ATOM 2475 O ARG A 872 9.180 -9.767 -28.961 1.00 37.04 O ATOM 2476 CB ARG A 872 7.686 -7.322 -28.023 1.00 42.22 C ATOM 2477 CG ARG A 872 8.290 -7.076 -26.622 1.00 36.70 C ATOM 2478 CD ARG A 872 7.213 -6.907 -25.534 1.00 40.08 C ATOM 2479 NE ARG A 872 6.398 -8.110 -25.402 1.00 42.94 N ATOM 2480 CZ ARG A 872 6.735 -9.172 -24.679 1.00 49.98 C ATOM 2481 NH1 ARG A 872 7.876 -9.185 -23.997 1.00 45.13 N ATOM 2482 NH2 ARG A 872 5.927 -10.224 -24.635 1.00 50.35 N ATOM 2483 HE ARG A 872 5.490 -8.138 -25.909 1.00 0.00 H ATOM 2484 HH12 ARG A 872 8.135 -10.019 -23.433 1.00 0.00 H ATOM 2485 HH11 ARG A 872 8.510 -8.361 -24.028 1.00 0.00 H ATOM 2486 HH22 ARG A 872 6.188 -11.057 -24.070 1.00 0.00 H ATOM 2487 HH21 ARG A 872 5.033 -10.215 -25.166 1.00 0.00 H ATOM 2488 H ARG A 872 7.047 -7.706 -30.491 1.00 0.00 H ATOM 2489 N PRO A 873 10.948 -8.427 -28.700 1.00 35.46 N ATOM 2490 CA PRO A 873 11.802 -9.557 -28.350 1.00 37.91 C ATOM 2491 C PRO A 873 11.349 -10.192 -27.047 1.00 41.38 C ATOM 2492 O PRO A 873 10.913 -9.492 -26.119 1.00 37.04 O ATOM 2493 CB PRO A 873 13.197 -8.924 -28.221 1.00 37.59 C ATOM 2494 CG PRO A 873 13.143 -7.734 -29.146 1.00 36.80 C ATOM 2495 CD PRO A 873 11.734 -7.209 -28.975 1.00 34.70 C ATOM 2496 N PRO A 874 11.402 -11.525 -26.964 1.00 39.80 N ATOM 2497 CA PRO A 874 11.056 -12.216 -25.709 1.00 41.69 C ATOM 2498 C PRO A 874 11.699 -11.629 -24.462 1.00 44.89 C ATOM 2499 O PRO A 874 11.038 -11.538 -23.418 1.00 48.44 O ATOM 2500 CB PRO A 874 11.549 -13.646 -25.970 1.00 44.74 C ATOM 2501 CG PRO A 874 11.426 -13.817 -27.449 1.00 40.69 C ATOM 2502 CD PRO A 874 11.699 -12.467 -28.059 1.00 43.48 C ATOM 2503 N ALA A 875 12.964 -11.229 -24.528 1.00 45.71 N ATOM 2504 CA ALA A 875 13.633 -10.680 -23.352 1.00 45.79 C ATOM 2505 C ALA A 875 13.341 -9.198 -23.139 1.00 47.59 C ATOM 2506 O ALA A 875 13.962 -8.586 -22.262 1.00 48.47 O ATOM 2507 CB ALA A 875 15.145 -10.906 -23.454 1.00 51.31 C ATOM 2508 H ALA A 875 13.483 -11.308 -25.426 1.00 0.00 H ATOM 2509 N CYS A 876 12.399 -8.620 -23.890 1.00 41.87 N ATOM 2510 CA CYS A 876 12.143 -7.183 -23.848 1.00 43.63 C ATOM 2511 C CYS A 876 10.858 -6.868 -23.094 1.00 41.53 C ATOM 2512 O CYS A 876 9.762 -7.198 -23.582 1.00 41.68 O ATOM 2513 CB CYS A 876 12.064 -6.613 -25.264 1.00 31.97 C ATOM 2514 SG CYS A 876 11.843 -4.821 -25.290 1.00 41.93 S ATOM 2515 H CYS A 876 11.829 -9.214 -24.526 1.00 0.00 H ATOM 2516 N PRO A 877 10.931 -6.204 -21.943 1.00 41.24 N ATOM 2517 CA PRO A 877 9.708 -5.789 -21.249 1.00 42.91 C ATOM 2518 C PRO A 877 8.968 -4.726 -22.042 1.00 43.15 C ATOM 2519 O PRO A 877 9.546 -4.013 -22.869 1.00 38.98 O ATOM 2520 CB PRO A 877 10.217 -5.218 -19.916 1.00 43.70 C ATOM 2521 CG PRO A 877 11.662 -5.607 -19.827 1.00 39.79 C ATOM 2522 CD PRO A 877 12.137 -5.747 -21.243 1.00 40.64 C ATOM 2523 N GLN A 878 7.671 -4.606 -21.735 1.00 39.62 N ATOM 2524 CA GLN A 878 6.760 -3.803 -22.549 1.00 41.90 C ATOM 2525 C GLN A 878 7.158 -2.330 -22.566 1.00 42.61 C ATOM 2526 O GLN A 878 7.062 -1.666 -23.606 1.00 35.09 O ATOM 2527 CB GLN A 878 5.327 -3.969 -22.029 1.00 40.06 C ATOM 2528 CG GLN A 878 4.256 -3.255 -22.841 1.00 44.24 C ATOM 2529 CD GLN A 878 4.128 -3.780 -24.269 1.00 44.32 C ATOM 2530 OE1 GLN A 878 4.273 -4.979 -24.531 1.00 44.89 O ATOM 2531 NE2 GLN A 878 3.857 -2.876 -25.199 1.00 38.37 N ATOM 2532 HE22 GLN A 878 3.743 -1.877 -24.935 1.00 0.00 H ATOM 2533 HE21 GLN A 878 3.759 -3.166 -26.193 1.00 0.00 H ATOM 2534 H GLN A 878 7.302 -5.097 -20.896 1.00 0.00 H ATOM 2535 N GLY A 879 7.584 -1.791 -21.422 1.00 45.71 N ATOM 2536 CA GLY A 879 7.962 -0.385 -21.386 1.00 41.23 C ATOM 2537 C GLY A 879 9.114 -0.073 -22.325 1.00 43.92 C ATOM 2538 O GLY A 879 9.142 0.982 -22.968 1.00 40.49 O ATOM 2539 H GLY A 879 7.646 -2.371 -20.561 1.00 0.00 H ATOM 2540 N LEU A 880 10.074 -0.992 -22.423 1.00 33.96 N ATOM 2541 CA LEU A 880 11.204 -0.794 -23.322 1.00 41.26 C ATOM 2542 C LEU A 880 10.779 -0.965 -24.781 1.00 38.65 C ATOM 2543 O LEU A 880 11.164 -0.164 -25.641 1.00 43.32 O ATOM 2544 CB LEU A 880 12.330 -1.762 -22.953 1.00 33.04 C ATOM 2545 CG LEU A 880 13.622 -1.693 -23.783 1.00 35.79 C ATOM 2546 CD1 LEU A 880 14.301 -0.341 -23.618 1.00 33.56 C ATOM 2547 CD2 LEU A 880 14.572 -2.820 -23.408 1.00 35.70 C ATOM 2548 H LEU A 880 10.016 -1.859 -21.852 1.00 0.00 H ATOM 2549 N TYR A 881 9.971 -1.986 -25.077 1.00 38.25 N ATOM 2550 CA TYR A 881 9.449 -2.124 -26.435 1.00 38.62 C ATOM 2551 C TYR A 881 8.689 -0.873 -26.862 1.00 38.34 C ATOM 2552 O TYR A 881 8.754 -0.464 -28.026 1.00 38.04 O ATOM 2553 CB TYR A 881 8.560 -3.362 -26.540 1.00 40.36 C ATOM 2554 CG TYR A 881 8.026 -3.620 -27.939 1.00 43.89 C ATOM 2555 CD1 TYR A 881 8.892 -3.827 -29.015 1.00 40.81 C ATOM 2556 CD2 TYR A 881 6.662 -3.675 -28.180 1.00 38.70 C ATOM 2557 CE1 TYR A 881 8.407 -4.066 -30.295 1.00 38.70 C ATOM 2558 CE2 TYR A 881 6.168 -3.913 -29.451 1.00 42.01 C ATOM 2559 CZ TYR A 881 7.046 -4.108 -30.503 1.00 39.60 C ATOM 2560 OH TYR A 881 6.547 -4.344 -31.754 1.00 37.41 O ATOM 2561 HH TYR A 881 7.296 -4.461 -32.390 1.00 0.00 H ATOM 2562 H TYR A 881 9.715 -2.679 -24.345 1.00 0.00 H ATOM 2563 N GLU A 882 7.986 -0.231 -25.927 1.00 44.11 N ATOM 2564 CA GLU A 882 7.287 1.005 -26.264 1.00 44.97 C ATOM 2565 C GLU A 882 8.262 2.117 -26.622 1.00 39.61 C ATOM 2566 O GLU A 882 7.944 2.977 -27.453 1.00 40.68 O ATOM 2567 CB GLU A 882 6.378 1.433 -25.103 1.00 43.46 C ATOM 2568 CG GLU A 882 5.023 0.741 -25.115 1.00 45.30 C ATOM 2569 CD GLU A 882 4.235 0.927 -23.814 1.00 57.94 C ATOM 2570 OE1 GLU A 882 4.409 1.962 -23.129 1.00 57.03 O ATOM 2571 OE2 GLU A 882 3.442 0.024 -23.474 1.00 53.97 O ATOM 2572 H GLU A 882 7.936 -0.611 -24.960 1.00 0.00 H ATOM 2573 N LEU A 883 9.444 2.123 -26.002 1.00 38.52 N ATOM 2574 CA LEU A 883 10.462 3.094 -26.377 1.00 37.67 C ATOM 2575 C LEU A 883 10.986 2.819 -27.783 1.00 36.59 C ATOM 2576 O LEU A 883 11.212 3.757 -28.560 1.00 33.77 O ATOM 2577 CB LEU A 883 11.607 3.074 -25.363 1.00 41.31 C ATOM 2578 CG LEU A 883 12.758 4.041 -25.658 1.00 42.05 C ATOM 2579 CD1 LEU A 883 12.259 5.480 -25.741 1.00 44.61 C ATOM 2580 CD2 LEU A 883 13.881 3.902 -24.633 1.00 45.58 C ATOM 2581 H LEU A 883 9.638 1.432 -25.249 1.00 0.00 H ATOM 2582 N MET A 884 11.180 1.541 -28.125 1.00 31.96 N ATOM 2583 CA MET A 884 11.615 1.192 -29.475 1.00 37.11 C ATOM 2584 C MET A 884 10.608 1.678 -30.503 1.00 34.03 C ATOM 2585 O MET A 884 10.978 2.318 -31.492 1.00 32.72 O ATOM 2586 CB MET A 884 11.820 -0.319 -29.601 1.00 41.84 C ATOM 2587 CG MET A 884 12.877 -0.891 -28.667 1.00 46.04 C ATOM 2588 SD MET A 884 12.935 -2.701 -28.680 1.00 58.36 S ATOM 2589 CE MET A 884 12.474 -3.021 -30.354 1.00 31.07 C ATOM 2590 H MET A 884 11.020 0.789 -27.424 1.00 0.00 H ATOM 2591 N LEU A 885 9.314 1.423 -30.252 1.00 35.10 N ATOM 2592 CA LEU A 885 8.269 1.849 -31.175 1.00 34.42 C ATOM 2593 C LEU A 885 8.327 3.347 -31.431 1.00 38.67 C ATOM 2594 O LEU A 885 8.067 3.791 -32.554 1.00 33.15 O ATOM 2595 CB LEU A 885 6.891 1.444 -30.642 1.00 34.83 C ATOM 2596 CG LEU A 885 6.574 -0.058 -30.559 1.00 37.69 C ATOM 2597 CD1 LEU A 885 5.311 -0.298 -29.739 1.00 38.80 C ATOM 2598 CD2 LEU A 885 6.438 -0.715 -31.947 1.00 33.20 C ATOM 2599 H LEU A 885 9.053 0.913 -29.384 1.00 0.00 H ATOM 2600 N ARG A 886 8.694 4.143 -30.421 1.00 33.90 N ATOM 2601 CA ARG A 886 8.789 5.584 -30.644 1.00 35.34 C ATOM 2602 C ARG A 886 9.964 5.941 -31.550 1.00 40.03 C ATOM 2603 O ARG A 886 9.918 6.959 -32.252 1.00 33.06 O ATOM 2604 CB ARG A 886 8.886 6.322 -29.307 1.00 41.68 C ATOM 2605 CG ARG A 886 7.560 6.338 -28.535 1.00 47.04 C ATOM 2606 CD ARG A 886 7.642 7.041 -27.178 1.00 43.89 C ATOM 2607 NE ARG A 886 8.604 8.145 -27.122 1.00 54.77 N ATOM 2608 CZ ARG A 886 8.499 9.294 -27.794 1.00 55.02 C ATOM 2609 NH1 ARG A 886 9.433 10.231 -27.652 1.00 56.98 N ATOM 2610 NH2 ARG A 886 7.481 9.504 -28.623 1.00 57.58 N ATOM 2611 HE ARG A 886 9.436 8.024 -26.509 1.00 0.00 H ATOM 2612 HH12 ARG A 886 9.354 11.127 -28.174 1.00 0.00 H ATOM 2613 HH11 ARG A 886 10.242 10.067 -27.019 1.00 0.00 H ATOM 2614 HH22 ARG A 886 7.409 10.403 -29.141 1.00 0.00 H ATOM 2615 HH21 ARG A 886 6.756 8.769 -28.753 1.00 0.00 H ATOM 2616 H ARG A 886 8.910 3.741 -29.487 1.00 0.00 H ATOM 2617 N CYS A 887 11.020 5.123 -31.560 1.00 36.36 N ATOM 2618 CA CYS A 887 12.082 5.332 -32.539 1.00 33.78 C ATOM 2619 C CYS A 887 11.591 5.149 -33.970 1.00 32.96 C ATOM 2620 O CYS A 887 12.226 5.653 -34.901 1.00 35.38 O ATOM 2621 CB CYS A 887 13.242 4.378 -32.285 1.00 36.43 C ATOM 2622 SG CYS A 887 14.067 4.637 -30.719 1.00 35.09 S ATOM 2623 H CYS A 887 11.085 4.343 -30.875 1.00 0.00 H ATOM 2624 N TRP A 888 10.495 4.420 -34.171 1.00 34.83 N ATOM 2625 CA TRP A 888 9.932 4.207 -35.499 1.00 38.10 C ATOM 2626 C TRP A 888 8.727 5.101 -35.769 1.00 43.22 C ATOM 2627 O TRP A 888 7.953 4.823 -36.695 1.00 41.85 O ATOM 2628 CB TRP A 888 9.577 2.727 -35.679 1.00 32.46 C ATOM 2629 CG TRP A 888 10.759 1.854 -35.382 1.00 36.99 C ATOM 2630 CD1 TRP A 888 12.073 2.113 -35.703 1.00 30.59 C ATOM 2631 CD2 TRP A 888 10.761 0.622 -34.655 1.00 30.13 C ATOM 2632 NE1 TRP A 888 12.883 1.107 -35.225 1.00 28.73 N ATOM 2633 CE2 TRP A 888 12.106 0.179 -34.583 1.00 32.58 C ATOM 2634 CE3 TRP A 888 9.763 -0.156 -34.069 1.00 28.13 C ATOM 2635 CZ2 TRP A 888 12.470 -1.008 -33.950 1.00 31.00 C ATOM 2636 CZ3 TRP A 888 10.125 -1.334 -33.439 1.00 29.87 C ATOM 2637 CH2 TRP A 888 11.469 -1.750 -33.387 1.00 33.83 C ATOM 2638 HE1 TRP A 888 13.916 1.059 -35.334 1.00 0.00 H ATOM 2639 H TRP A 888 10.024 3.987 -33.351 1.00 0.00 H ATOM 2640 N SER A 889 8.550 6.164 -34.981 1.00 39.13 N ATOM 2641 CA SER A 889 7.464 7.100 -35.238 1.00 42.63 C ATOM 2642 C SER A 889 7.571 7.631 -36.658 1.00 42.27 C ATOM 2643 O SER A 889 8.672 7.862 -37.163 1.00 42.11 O ATOM 2644 CB SER A 889 7.499 8.263 -34.247 1.00 39.24 C ATOM 2645 OG SER A 889 7.494 7.789 -32.916 1.00 40.16 O ATOM 2646 HG SER A 889 8.289 7.218 -32.767 1.00 0.00 H ATOM 2647 H SER A 889 9.192 6.325 -34.178 1.00 0.00 H ATOM 2648 N ARG A 890 6.415 7.820 -37.301 1.00 36.77 N ATOM 2649 CA ARG A 890 6.406 8.277 -38.684 1.00 33.81 C ATOM 2650 C ARG A 890 7.014 9.665 -38.815 1.00 36.43 C ATOM 2651 O ARG A 890 7.721 9.954 -39.788 1.00 40.40 O ATOM 2652 CB ARG A 890 4.970 8.267 -39.225 1.00 38.06 C ATOM 2653 CG ARG A 890 4.860 8.696 -40.675 1.00 39.25 C ATOM 2654 CD ARG A 890 3.400 8.799 -41.132 1.00 46.87 C ATOM 2655 NE ARG A 890 3.317 9.103 -42.558 1.00 52.09 N ATOM 2656 CZ ARG A 890 3.503 10.314 -43.070 1.00 46.46 C ATOM 2657 NH1 ARG A 890 3.772 11.333 -42.270 1.00 47.97 N ATOM 2658 NH2 ARG A 890 3.415 10.508 -44.377 1.00 48.81 N ATOM 2659 HE ARG A 890 3.099 8.324 -43.212 1.00 0.00 H ATOM 2660 HH12 ARG A 890 3.918 12.282 -42.668 1.00 0.00 H ATOM 2661 HH11 ARG A 890 3.837 11.184 -41.243 1.00 0.00 H ATOM 2662 HH22 ARG A 890 3.562 11.459 -44.773 1.00 0.00 H ATOM 2663 HH21 ARG A 890 3.199 9.710 -45.008 1.00 0.00 H ATOM 2664 H ARG A 890 5.516 7.640 -36.811 1.00 0.00 H ATOM 2665 N GLU A 891 6.738 10.546 -37.859 1.00 35.79 N ATOM 2666 CA GLU A 891 7.293 11.892 -37.887 1.00 40.50 C ATOM 2667 C GLU A 891 8.666 11.875 -37.233 1.00 43.96 C ATOM 2668 O GLU A 891 8.829 11.315 -36.144 1.00 43.56 O ATOM 2669 CB GLU A 891 6.382 12.881 -37.159 1.00 43.26 C ATOM 2670 CG GLU A 891 4.938 12.820 -37.581 1.00 47.05 C ATOM 2671 CD GLU A 891 4.777 12.952 -39.078 1.00 47.31 C ATOM 2672 OE1 GLU A 891 5.545 13.725 -39.705 1.00 53.13 O ATOM 2673 OE2 GLU A 891 3.887 12.268 -39.629 1.00 53.12 O ATOM 2674 H GLU A 891 6.113 10.269 -37.075 1.00 0.00 H ATOM 2675 N SER A 892 9.644 12.496 -37.896 1.00 44.51 N ATOM 2676 CA SER A 892 10.991 12.565 -37.342 1.00 48.27 C ATOM 2677 C SER A 892 10.993 13.224 -35.966 1.00 49.66 C ATOM 2678 O SER A 892 11.711 12.787 -35.055 1.00 48.37 O ATOM 2679 CB SER A 892 11.901 13.327 -38.298 1.00 41.10 C ATOM 2680 OG SER A 892 12.037 12.623 -39.517 1.00 53.26 O ATOM 2681 HG SER A 892 12.630 13.131 -40.126 1.00 0.00 H ATOM 2682 H SER A 892 9.443 12.935 -38.817 1.00 0.00 H ATOM 2683 N GLU A 893 10.173 14.261 -35.792 1.00 54.13 N ATOM 2684 CA GLU A 893 10.180 15.046 -34.567 1.00 50.42 C ATOM 2685 C GLU A 893 9.614 14.282 -33.378 1.00 48.63 C ATOM 2686 O GLU A 893 9.844 14.686 -32.236 1.00 50.66 O ATOM 2687 CB GLU A 893 9.398 16.347 -34.776 1.00 61.42 C ATOM 2688 CG GLU A 893 9.817 17.147 -36.014 1.00 62.25 C ATOM 2689 CD GLU A 893 9.289 16.553 -37.317 1.00 63.78 C ATOM 2690 OE1 GLU A 893 8.174 15.983 -37.309 1.00 56.84 O ATOM 2691 OE2 GLU A 893 10.001 16.635 -38.343 1.00 66.40 O ATOM 2692 H GLU A 893 9.511 14.516 -36.552 1.00 0.00 H ATOM 2693 N GLN A 894 8.891 13.193 -33.603 1.00 44.54 N ATOM 2694 CA GLN A 894 8.342 12.431 -32.488 1.00 46.84 C ATOM 2695 C GLN A 894 9.242 11.286 -32.044 1.00 42.97 C ATOM 2696 O GLN A 894 8.908 10.590 -31.075 1.00 42.03 O ATOM 2697 CB GLN A 894 6.959 11.897 -32.850 1.00 44.00 C ATOM 2698 CG GLN A 894 5.922 12.983 -32.979 1.00 48.56 C ATOM 2699 CD GLN A 894 4.531 12.410 -33.105 1.00 62.95 C ATOM 2700 OE1 GLN A 894 4.337 11.378 -33.748 1.00 59.77 O ATOM 2701 NE2 GLN A 894 3.554 13.061 -32.473 1.00 68.59 N ATOM 2702 HE22 GLN A 894 3.767 13.930 -31.942 1.00 0.00 H ATOM 2703 HE21 GLN A 894 2.579 12.700 -32.511 1.00 0.00 H ATOM 2704 H GLN A 894 8.715 12.881 -34.579 1.00 0.00 H ATOM 2705 N ARG A 895 10.370 11.066 -32.740 1.00 43.91 N ATOM 2706 CA ARG A 895 11.364 10.104 -32.292 1.00 39.71 C ATOM 2707 C ARG A 895 12.191 10.716 -31.162 1.00 38.73 C ATOM 2708 O ARG A 895 12.478 11.917 -31.184 1.00 40.19 O ATOM 2709 CB ARG A 895 12.268 9.682 -33.458 1.00 36.39 C ATOM 2710 CG ARG A 895 11.479 9.030 -34.605 1.00 31.17 C ATOM 2711 CD ARG A 895 12.253 9.002 -35.902 1.00 35.35 C ATOM 2712 NE ARG A 895 11.397 8.620 -37.025 1.00 38.52 N ATOM 2713 CZ ARG A 895 11.772 8.671 -38.297 1.00 37.99 C ATOM 2714 NH1 ARG A 895 12.993 9.091 -38.604 1.00 34.89 N ATOM 2715 NH2 ARG A 895 10.929 8.307 -39.261 1.00 36.54 N ATOM 2716 HE ARG A 895 10.434 8.288 -36.813 1.00 0.00 H ATOM 2717 HH12 ARG A 895 13.294 9.133 -39.599 1.00 0.00 H ATOM 2718 HH11 ARG A 895 13.649 9.378 -37.850 1.00 0.00 H ATOM 2719 HH22 ARG A 895 11.228 8.349 -40.256 1.00 0.00 H ATOM 2720 HH21 ARG A 895 9.972 7.981 -39.019 1.00 0.00 H ATOM 2721 H ARG A 895 10.536 11.596 -33.619 1.00 0.00 H ATOM 2722 N PRO A 896 12.555 9.927 -30.157 1.00 38.95 N ATOM 2723 CA PRO A 896 13.284 10.473 -29.006 1.00 38.28 C ATOM 2724 C PRO A 896 14.715 10.804 -29.381 1.00 45.48 C ATOM 2725 O PRO A 896 15.356 10.052 -30.130 1.00 42.81 O ATOM 2726 CB PRO A 896 13.238 9.333 -27.977 1.00 45.27 C ATOM 2727 CG PRO A 896 12.279 8.308 -28.537 1.00 47.28 C ATOM 2728 CD PRO A 896 12.289 8.489 -30.014 1.00 37.09 C ATOM 2729 N PRO A 897 15.254 11.914 -28.885 1.00 43.74 N ATOM 2730 CA PRO A 897 16.677 12.193 -29.094 1.00 38.72 C ATOM 2731 C PRO A 897 17.532 11.169 -28.364 1.00 35.54 C ATOM 2732 O PRO A 897 17.082 10.493 -27.435 1.00 38.68 O ATOM 2733 CB PRO A 897 16.859 13.597 -28.514 1.00 39.00 C ATOM 2734 CG PRO A 897 15.732 13.736 -27.527 1.00 48.47 C ATOM 2735 CD PRO A 897 14.583 12.971 -28.109 1.00 40.86 C ATOM 2736 N PHE A 898 18.782 11.032 -28.818 1.00 32.86 N ATOM 2737 CA PHE A 898 19.656 10.038 -28.199 1.00 31.81 C ATOM 2738 C PHE A 898 19.891 10.327 -26.721 1.00 36.01 C ATOM 2739 O PHE A 898 20.058 9.390 -25.929 1.00 39.15 O ATOM 2740 CB PHE A 898 20.984 9.953 -28.945 1.00 33.53 C ATOM 2741 CG PHE A 898 20.901 9.158 -30.200 1.00 31.33 C ATOM 2742 CD1 PHE A 898 20.676 7.793 -30.149 1.00 31.09 C ATOM 2743 CD2 PHE A 898 21.018 9.774 -31.428 1.00 27.72 C ATOM 2744 CE1 PHE A 898 20.575 7.048 -31.307 1.00 36.12 C ATOM 2745 CE2 PHE A 898 20.926 9.031 -32.612 1.00 35.02 C ATOM 2746 CZ PHE A 898 20.707 7.668 -32.551 1.00 30.40 C ATOM 2747 H PHE A 898 19.127 11.624 -29.600 1.00 0.00 H ATOM 2748 N SER A 899 19.901 11.606 -26.331 1.00 35.02 N ATOM 2749 CA SER A 899 20.055 11.957 -24.916 1.00 39.24 C ATOM 2750 C SER A 899 18.943 11.346 -24.067 1.00 34.10 C ATOM 2751 O SER A 899 19.192 10.852 -22.958 1.00 40.03 O ATOM 2752 CB SER A 899 20.066 13.475 -24.761 1.00 32.71 C ATOM 2753 OG SER A 899 18.808 14.012 -25.165 1.00 39.52 O ATOM 2754 HG SER A 899 18.822 14.997 -25.062 1.00 0.00 H ATOM 2755 H SER A 899 19.798 12.360 -27.040 1.00 0.00 H ATOM 2756 N GLN A 900 17.706 11.382 -24.570 1.00 38.71 N ATOM 2757 CA GLN A 900 16.586 10.743 -23.885 1.00 41.43 C ATOM 2758 C GLN A 900 16.717 9.223 -23.902 1.00 42.40 C ATOM 2759 O GLN A 900 16.436 8.558 -22.897 1.00 37.25 O ATOM 2760 CB GLN A 900 15.273 11.187 -24.532 1.00 44.74 C ATOM 2761 CG GLN A 900 14.018 10.493 -24.014 1.00 53.15 C ATOM 2762 CD GLN A 900 12.749 11.018 -24.678 1.00 57.88 C ATOM 2763 OE1 GLN A 900 12.686 12.180 -25.088 1.00 58.99 O ATOM 2764 NE2 GLN A 900 11.734 10.160 -24.794 1.00 58.89 N ATOM 2765 HE22 GLN A 900 11.830 9.189 -24.434 1.00 0.00 H ATOM 2766 HE21 GLN A 900 10.847 10.462 -25.244 1.00 0.00 H ATOM 2767 H GLN A 900 17.537 11.876 -25.469 1.00 0.00 H ATOM 2768 N LEU A 901 17.141 8.658 -25.040 1.00 39.24 N ATOM 2769 CA LEU A 901 17.316 7.212 -25.149 1.00 37.07 C ATOM 2770 C LEU A 901 18.390 6.706 -24.191 1.00 30.98 C ATOM 2771 O LEU A 901 18.218 5.668 -23.536 1.00 33.81 O ATOM 2772 CB LEU A 901 17.672 6.843 -26.598 1.00 36.40 C ATOM 2773 CG LEU A 901 16.530 6.920 -27.617 1.00 33.62 C ATOM 2774 CD1 LEU A 901 17.036 6.921 -29.070 1.00 36.35 C ATOM 2775 CD2 LEU A 901 15.569 5.764 -27.401 1.00 33.15 C ATOM 2776 H LEU A 901 17.350 9.260 -25.862 1.00 0.00 H ATOM 2777 N HIS A 902 19.519 7.407 -24.118 1.00 31.88 N ATOM 2778 CA HIS A 902 20.576 6.980 -23.216 1.00 34.65 C ATOM 2779 C HIS A 902 20.124 7.076 -21.762 1.00 37.50 C ATOM 2780 O HIS A 902 20.404 6.180 -20.957 1.00 40.28 O ATOM 2781 CB HIS A 902 21.833 7.812 -23.447 1.00 33.26 C ATOM 2782 CG HIS A 902 22.938 7.482 -22.496 1.00 37.74 C ATOM 2783 ND1 HIS A 902 23.183 8.216 -21.356 1.00 46.85 N ATOM 2784 CD2 HIS A 902 23.832 6.468 -22.490 1.00 35.38 C ATOM 2785 CE1 HIS A 902 24.195 7.680 -20.701 1.00 40.61 C ATOM 2786 NE2 HIS A 902 24.606 6.617 -21.367 1.00 41.30 N ATOM 2787 H HIS A 902 19.645 8.257 -24.704 1.00 0.00 H ATOM 2788 N ARG A 903 19.415 8.150 -21.413 1.00 37.56 N ATOM 2789 CA ARG A 903 18.891 8.283 -20.055 1.00 44.52 C ATOM 2790 C ARG A 903 18.007 7.098 -19.696 1.00 45.63 C ATOM 2791 O ARG A 903 18.205 6.449 -18.661 1.00 45.56 O ATOM 2792 CB ARG A 903 18.109 9.588 -19.923 1.00 44.66 C ATOM 2793 CG ARG A 903 17.730 9.944 -18.494 1.00 56.82 C ATOM 2794 CD ARG A 903 16.474 10.804 -18.457 1.00 58.14 C ATOM 2795 NE ARG A 903 15.254 9.996 -18.384 1.00 63.97 N ATOM 2796 CZ ARG A 903 14.365 9.873 -19.368 1.00 66.40 C ATOM 2797 NH1 ARG A 903 13.286 9.117 -19.196 1.00 62.07 N ATOM 2798 NH2 ARG A 903 14.548 10.510 -20.519 1.00 60.73 N ATOM 2799 HE ARG A 903 15.069 9.481 -17.500 1.00 0.00 H ATOM 2800 HH12 ARG A 903 12.591 9.020 -19.964 1.00 0.00 H ATOM 2801 HH11 ARG A 903 13.136 8.622 -18.294 1.00 0.00 H ATOM 2802 HH22 ARG A 903 13.851 10.411 -21.285 1.00 0.00 H ATOM 2803 HH21 ARG A 903 15.388 11.108 -20.655 1.00 0.00 H ATOM 2804 H ARG A 903 19.234 8.898 -22.112 1.00 0.00 H ATOM 2805 N PHE A 904 17.032 6.791 -20.555 1.00 39.95 N ATOM 2806 CA PHE A 904 16.139 5.670 -20.296 1.00 38.64 C ATOM 2807 C PHE A 904 16.914 4.371 -20.128 1.00 41.36 C ATOM 2808 O PHE A 904 16.626 3.583 -19.222 1.00 41.79 O ATOM 2809 CB PHE A 904 15.129 5.539 -21.433 1.00 39.95 C ATOM 2810 CG PHE A 904 14.000 4.586 -21.149 1.00 46.78 C ATOM 2811 CD1 PHE A 904 14.189 3.210 -21.209 1.00 44.79 C ATOM 2812 CD2 PHE A 904 12.734 5.068 -20.854 1.00 50.16 C ATOM 2813 CE1 PHE A 904 13.138 2.336 -20.960 1.00 46.67 C ATOM 2814 CE2 PHE A 904 11.681 4.201 -20.604 1.00 52.57 C ATOM 2815 CZ PHE A 904 11.884 2.832 -20.657 1.00 47.13 C ATOM 2816 H PHE A 904 16.909 7.358 -21.418 1.00 0.00 H ATOM 2817 N LEU A 905 17.891 4.120 -21.006 1.00 36.40 N ATOM 2818 CA LEU A 905 18.594 2.842 -20.990 1.00 37.01 C ATOM 2819 C LEU A 905 19.575 2.733 -19.826 1.00 39.94 C ATOM 2820 O LEU A 905 19.834 1.625 -19.345 1.00 34.82 O ATOM 2821 CB LEU A 905 19.332 2.633 -22.318 1.00 29.90 C ATOM 2822 CG LEU A 905 18.423 2.523 -23.552 1.00 35.03 C ATOM 2823 CD1 LEU A 905 19.227 2.536 -24.852 1.00 30.48 C ATOM 2824 CD2 LEU A 905 17.587 1.268 -23.470 1.00 34.43 C ATOM 2825 H LEU A 905 18.152 4.843 -21.707 1.00 0.00 H ATOM 2826 N ALA A 906 20.143 3.853 -19.381 1.00 37.39 N ATOM 2827 CA ALA A 906 21.093 3.864 -18.279 1.00 45.36 C ATOM 2828 C ALA A 906 20.427 3.934 -16.908 1.00 44.44 C ATOM 2829 O ALA A 906 21.117 3.740 -15.902 1.00 53.81 O ATOM 2830 CB ALA A 906 22.063 5.041 -18.441 1.00 47.65 C ATOM 2831 H ALA A 906 19.898 4.754 -19.839 1.00 0.00 H ATOM 2832 N GLU A 907 19.108 4.178 -16.850 1.00 50.28 N ATOM 2833 CA GLU A 907 18.377 4.404 -15.601 1.00 57.03 C ATOM 2834 C GLU A 907 17.001 3.739 -15.571 1.00 55.40 C ATOM 2835 O GLU A 907 16.793 2.759 -14.850 1.00 62.59 O ATOM 2836 CB GLU A 907 18.199 5.906 -15.352 1.00 52.61 C ATOM 2837 CG GLU A 907 19.486 6.660 -15.072 1.00 58.49 C ATOM 2838 CD GLU A 907 19.355 8.155 -15.310 1.00 63.95 C ATOM 2839 OE1 GLU A 907 18.223 8.691 -15.203 1.00 58.65 O ATOM 2840 OE2 GLU A 907 20.392 8.790 -15.610 1.00 65.92 O ATOM 2841 H GLU A 907 18.575 4.208 -17.743 1.00 0.00 H ATOM 2842 N ASP A 908 16.054 4.269 -16.353 1.00 57.36 N ATOM 2843 CA ASP A 908 14.641 3.915 -16.191 1.00 63.10 C ATOM 2844 C ASP A 908 14.343 2.453 -16.517 1.00 65.32 C ATOM 2845 O ASP A 908 13.409 1.875 -15.943 1.00 58.32 O ATOM 2846 CB ASP A 908 13.768 4.810 -17.072 1.00 57.33 C ATOM 2847 CG ASP A 908 14.034 6.284 -16.857 1.00 61.10 C ATOM 2848 OD1 ASP A 908 14.994 6.627 -16.130 1.00 63.94 O ATOM 2849 OD2 ASP A 908 13.275 7.102 -17.420 1.00 72.84 O ATOM 2850 H ASP A 908 16.326 4.948 -17.093 1.00 0.00 H ATOM 2851 N ALA A 909 15.088 1.850 -17.442 1.00 64.46 N ATOM 2852 CA ALA A 909 14.745 0.520 -17.951 1.00 57.53 C ATOM 2853 C ALA A 909 15.013 -0.584 -16.928 1.00 61.93 C ATOM 2854 O ALA A 909 14.632 -1.739 -17.141 1.00 58.72 O ATOM 2855 CB ALA A 909 15.503 0.237 -19.235 1.00 48.96 C ATOM 2856 H ALA A 909 15.931 2.334 -17.811 1.00 0.00 H TER 2857 ALA A 909 HETATM 2858 O HOH 1 30.495 9.135 -44.600 1.00 49.02 O HETATM 2859 O HOH 2 29.144 -2.231 -42.657 1.00 38.19 O HETATM 2860 O HOH 3 20.193 -20.642 -24.980 1.00 47.74 O HETATM 2861 O HOH 4 39.395 17.923 -46.735 1.00 47.51 O HETATM 2862 O HOH 5 46.274 0.284 -22.449 1.00 47.93 O HETATM 2863 O HOH 6 23.415 -8.186 -39.500 1.00 32.46 O HETATM 2864 O HOH 7 36.766 -8.351 -20.976 1.00 38.79 O HETATM 2865 O HOH 8 22.331 2.918 -56.396 1.00 47.20 O HETATM 2866 O HOH 9 56.792 -0.195 -30.514 1.00 33.89 O HETATM 2867 O HOH 10 43.683 1.398 -23.817 1.00 41.74 O HETATM 2868 O HOH 11 48.824 10.055 -50.903 1.00 46.56 O HETATM 2869 O HOH 12 30.020 7.424 -24.642 1.00 28.27 O HETATM 2870 O HOH 13 14.832 -11.365 -26.665 1.00 38.01 O HETATM 2871 O HOH 14 11.220 7.228 -53.841 1.00 51.76 O HETATM 2872 O HOH 15 37.834 -6.710 -50.909 1.00 57.69 O HETATM 2873 O HOH 16 17.409 4.830 -40.270 1.00 32.61 O HETATM 2874 O HOH 17 35.099 15.679 -30.067 1.00 37.35 O HETATM 2875 O HOH 18 39.360 -2.530 -49.565 1.00 61.66 O HETATM 2876 O HOH 19 13.203 0.105 -43.098 1.00 36.02 O HETATM 2877 O HOH 20 4.725 10.053 -35.852 1.00 42.37 O HETATM 2878 O HOH 21 18.563 -10.049 -34.208 1.00 39.63 O HETATM 2879 O HOH 22 25.162 3.314 -50.035 1.00 46.76 O HETATM 2880 O HOH 23 32.735 12.486 -25.798 1.00 38.41 O HETATM 2881 O HOH 24 43.879 10.663 -54.870 1.00 40.92 O HETATM 2882 O HOH 25 32.923 -11.119 -32.335 1.00 38.41 O HETATM 2883 O HOH 26 24.920 -14.216 -18.130 1.00 51.92 O HETATM 2884 O HOH 27 33.445 -7.890 -38.522 1.00 34.89 O HETATM 2885 O HOH 28 35.747 1.662 -42.761 1.00 33.19 O HETATM 2886 O HOH 29 36.986 9.495 -53.919 1.00 43.21 O HETATM 2887 O HOH 30 22.051 4.872 -39.152 1.00 30.85 O HETATM 2888 O HOH 31 57.592 1.803 -20.703 1.00 50.52 O HETATM 2889 O HOH 32 13.677 -0.610 -40.541 1.00 31.43 O HETATM 2890 O HOH 33 20.401 -3.236 -58.504 1.00 35.11 O HETATM 2891 O HOH 34 33.639 -8.001 -23.409 1.00 34.42 O HETATM 2892 O HOH 35 36.144 7.025 -47.468 1.00 40.12 O HETATM 2893 O HOH 36 31.634 -12.926 -22.557 1.00 36.99 O HETATM 2894 O HOH 37 37.658 4.224 -28.697 1.00 33.58 O HETATM 2895 O HOH 38 28.699 1.855 -44.118 1.00 29.59 O HETATM 2896 O HOH 39 23.388 11.911 -35.672 1.00 36.60 O HETATM 2897 O HOH 40 19.522 13.012 -30.381 1.00 41.17 O HETATM 2898 O HOH 41 38.785 4.178 -46.708 1.00 43.10 O HETATM 2899 O HOH 42 43.902 -0.339 -28.602 1.00 32.18 O HETATM 2900 O HOH 43 22.175 0.565 -18.774 1.00 40.57 O HETATM 2901 O HOH 44 37.524 -9.637 -23.546 1.00 42.06 O HETATM 2902 O HOH 45 9.900 -2.032 -36.673 1.00 31.98 O HETATM 2903 O HOH 46 21.113 -9.622 -40.582 1.00 44.84 O HETATM 2904 O HOH 47 36.833 7.806 -30.123 1.00 27.91 O HETATM 2905 O HOH 48 28.390 9.463 -42.367 1.00 43.90 O HETATM 2906 O HOH 49 40.215 0.748 -26.969 1.00 33.41 O HETATM 2907 O HOH 50 32.759 13.271 -50.416 1.00 48.52 O HETATM 2908 O HOH 51 32.469 -2.018 -19.224 1.00 51.12 O HETATM 2909 O HOH 52 57.315 6.232 -24.230 1.00 45.84 O HETATM 2910 O HOH 53 19.863 -19.348 -30.557 1.00 45.67 O HETATM 2911 O HOH 54 29.322 17.255 -39.157 1.00 45.42 O HETATM 2912 O HOH 55 20.368 15.344 -38.803 1.00 42.92 O HETATM 2913 O HOH 56 34.351 -9.861 -47.672 1.00 45.61 O HETATM 2914 O HOH 57 18.800 -4.383 -45.221 1.00 29.89 O HETATM 2915 O HOH 58 22.205 0.328 -40.796 1.00 25.32 O HETATM 2916 O HOH 59 15.503 11.461 -41.925 1.00 40.50 O HETATM 2917 O HOH 60 37.865 6.536 -27.257 1.00 31.56 O HETATM 2918 O HOH 61 29.959 -19.243 -28.406 1.00 51.45 O HETATM 2919 O HOH 62 36.522 13.231 -45.227 1.00 43.24 O HETATM 2920 O HOH 63 38.158 0.425 -46.890 1.00 49.28 O HETATM 2921 O HOH 64 31.561 4.417 -44.621 1.00 43.71 O HETATM 2922 O HOH 65 50.786 13.387 -40.591 1.00 42.62 O HETATM 2923 O HOH 66 46.514 -3.257 -25.541 1.00 39.87 O HETATM 2924 O HOH 67 24.248 3.580 -45.391 1.00 42.07 O HETATM 2925 O HOH 68 56.272 11.250 -42.103 1.00 51.00 O HETATM 2926 O HOH 69 -1.637 1.900 -47.775 1.00 55.02 O HETATM 2927 O HOH 70 -0.221 1.524 -43.702 1.00 44.54 O HETATM 2928 O HOH 71 20.400 7.536 -40.722 1.00 33.67 O HETATM 2929 O HOH 72 29.596 2.500 -19.457 1.00 39.17 O HETATM 2930 O HOH 73 18.487 -6.507 -46.963 1.00 29.81 O HETATM 2931 O HOH 74 23.959 -6.205 -37.813 1.00 29.96 O HETATM 2932 O HOH 75 37.457 -7.529 -35.679 1.00 35.78 O HETATM 2933 O HOH 76 20.499 -6.182 -53.744 1.00 42.14 O HETATM 2934 O HOH 77 24.638 -11.530 -45.169 1.00 31.81 O HETATM 2935 O HOH 78 28.759 -5.748 -46.089 1.00 33.19 O HETATM 2936 O HOH 79 26.923 13.806 -41.229 1.00 40.11 O HETATM 2937 O HOH 80 13.341 -11.816 -37.844 1.00 39.28 O HETATM 2938 O HOH 81 29.421 -15.731 -33.378 1.00 45.87 O HETATM 2939 O HOH 82 39.562 9.617 -33.377 1.00 31.01 O HETATM 2940 O HOH 83 5.265 -7.903 -30.576 1.00 38.30 O HETATM 2941 O HOH 84 39.469 -1.505 -26.861 1.00 40.24 O HETATM 2942 O HOH 85 20.084 -17.723 -25.603 1.00 37.46 O HETATM 2943 O HOH 86 42.966 13.165 -44.436 1.00 40.22 O HETATM 2944 O HOH 87 29.494 6.618 -40.763 1.00 28.98 O HETATM 2945 O HOH 88 23.893 -18.042 -32.277 1.00 40.20 O HETATM 2946 O HOH 89 49.761 10.203 -36.179 1.00 36.16 O HETATM 2947 O HOH 90 38.157 8.860 -23.407 1.00 34.85 O HETATM 2948 O HOH 91 37.367 7.619 -35.324 1.00 32.47 O HETATM 2949 O HOH 92 31.789 0.252 -20.990 1.00 39.18 O HETATM 2950 O HOH 93 9.575 -9.051 -36.010 1.00 36.31 O HETATM 2951 O HOH 94 26.584 4.586 -20.860 1.00 38.07 O HETATM 2952 O HOH 95 17.299 -14.124 -39.974 1.00 43.68 O HETATM 2953 O HOH 96 11.457 -9.616 -38.024 1.00 30.02 O HETATM 2954 O HOH 97 25.646 -18.960 -28.594 1.00 44.52 O HETATM 2955 O HOH 98 35.272 -12.305 -24.403 1.00 46.55 O HETATM 2956 O HOH 99 39.135 -2.860 -24.605 1.00 38.27 O HETATM 2957 O HOH 100 3.929 7.389 -35.869 1.00 42.77 O HETATM 2958 O HOH 101 40.041 -4.844 -26.654 1.00 33.38 O HETATM 2959 O HOH 102 61.282 4.919 -33.486 1.00 53.78 O HETATM 2960 O HOH 103 46.590 9.294 -29.908 1.00 33.41 O HETATM 2961 O HOH 104 22.995 14.858 -28.549 1.00 43.83 O HETATM 2962 O HOH 105 33.109 -11.457 -44.786 1.00 33.02 O HETATM 2963 O HOH 106 5.237 3.935 -28.074 1.00 45.84 O HETATM 2964 O HOH 107 28.739 -12.665 -18.727 1.00 50.04 O HETATM 2965 O HOH 108 42.341 3.878 -16.998 1.00 43.16 O HETATM 2966 O HOH 109 18.374 -11.915 -17.982 1.00 43.39 O HETATM 2967 O HOH 110 7.778 -8.273 -37.730 1.00 42.46 O HETATM 2968 O HOH 111 21.088 -9.264 -35.942 1.00 37.76 O HETATM 2969 O HOH 112 59.845 -4.459 -32.582 1.00 56.80 O HETATM 2970 O HOH 113 38.710 3.104 -24.581 1.00 36.53 O HETATM 2971 O HOH 114 34.274 -9.621 -35.905 1.00 37.75 O HETATM 2972 O HOH 115 33.009 14.943 -39.612 1.00 42.72 O HETATM 2973 O HOH 116 48.080 14.161 -25.701 1.00 31.13 O HETATM 2974 O HOH 117 20.990 2.643 -41.851 1.00 35.47 O HETATM 2975 O HOH 118 59.689 5.099 -38.241 1.00 47.33 O HETATM 2976 O HOH 119 48.480 14.451 -40.827 1.00 45.78 O HETATM 2977 O HOH 120 49.256 3.215 -50.106 1.00 40.25 O HETATM 2978 O HOH 121 19.667 -18.118 -35.098 1.00 43.46 O HETATM 2979 O HOH 122 23.432 15.510 -25.499 1.00 46.80 O HETATM 2980 O HOH 123 53.168 9.137 -52.115 1.00 54.47 O HETATM 2981 O HOH 124 30.278 -4.613 -44.216 1.00 34.50 O HETATM 2982 O HOH 125 57.327 7.048 -39.859 1.00 51.75 O HETATM 2983 O HOH 126 10.621 -1.524 -43.426 1.00 35.50 O HETATM 2984 O HOH 127 38.307 -1.455 -53.835 1.00 52.50 O HETATM 2985 O HOH 128 24.958 -6.415 -51.222 1.00 45.51 O HETATM 2986 O HOH 129 49.659 10.199 -32.801 1.00 54.86 O HETATM 2987 O HOH 130 35.787 1.483 -45.090 1.00 48.16 O HETATM 2988 O HOH 131 27.614 12.214 -42.776 1.00 45.43 O HETATM 2989 O HOH 132 20.338 14.109 -28.387 1.00 36.20 O HETATM 2990 O HOH 133 37.531 -0.979 -42.387 1.00 32.98 O HETATM 2991 O HOH 134 41.186 6.040 -59.852 1.00 47.99 O HETATM 2992 O HOH 135 43.654 -3.122 -26.815 1.00 50.96 O HETATM 2993 O HOH 136 17.748 15.301 -37.450 1.00 46.48 O HETATM 2994 O HOH 137 53.195 0.122 -41.794 1.00 57.24 O HETATM 2995 O HOH 138 10.398 13.137 -42.581 1.00 44.97 O HETATM 2996 O HOH 139 37.274 -1.752 -19.282 1.00 53.20 O HETATM 2997 O HOH 140 12.903 -1.076 -14.077 1.00 58.99 O HETATM 2998 O HOH 141 36.838 10.693 -24.801 1.00 41.61 O HETATM 2999 O HOH 142 28.931 19.503 -39.638 1.00 50.04 O HETATM 3000 O HOH 143 52.035 9.554 -49.836 1.00 49.36 O HETATM 3001 O HOH 144 23.426 -6.055 -52.792 1.00 49.12 O HETATM 3002 O HOH 145 32.830 -13.301 -31.127 1.00 43.79 O HETATM 3003 O HOH 146 19.952 5.021 -41.003 1.00 35.92 O HETATM 3004 O HOH 147 30.839 8.872 -22.399 1.00 44.02 O HETATM 3005 O HOH 148 58.933 -3.956 -35.112 1.00 52.10 O HETATM 3006 O HOH 149 15.275 -13.568 -26.900 1.00 42.01 O HETATM 3007 O HOH 150 22.255 17.082 -30.344 1.00 43.33 O HETATM 3008 O HOH 151 18.908 -17.178 -27.395 1.00 44.09 O HETATM 3009 O HOH 152 42.998 -0.613 -26.345 1.00 44.79 O HETATM 3010 O HOH 153 33.661 -10.535 -23.031 1.00 38.58 O HETATM 3011 O HOH 154 27.360 4.290 -44.865 1.00 44.28 O HETATM 3012 O HOH 155 40.409 2.196 -48.017 1.00 44.09 O HETATM 3013 O HOH 156 31.071 -12.941 -20.278 1.00 60.20 O HETATM 3014 O HOH 157 38.412 5.715 -24.803 1.00 37.11 O HETATM 3015 O HOH 158 27.324 -13.235 -16.640 1.00 50.35 O HETATM 3016 O HOH 159 10.439 -11.486 -34.553 1.00 45.27 O HETATM 3017 O HOH 160 39.058 -5.663 -39.484 1.00 33.54 O HETATM 3018 O HOH 161 22.341 -13.964 -15.464 1.00 53.23 O HETATM 3019 O HOH 162 29.935 12.323 -42.927 1.00 48.71 O HETATM 3020 O HOH 163 49.587 17.925 -46.698 1.00 46.28 O HETATM 3021 O HOH 164 38.162 -3.255 -42.171 1.00 39.19 O HETATM 3022 O HOH 165 12.635 -12.784 -35.527 1.00 45.47 O HETATM 3023 N1 GKB A 166 33.400 7.194 -42.053 1.00 -0.22 N HETATM 3024 C6 GKB A 166 33.666 6.457 -40.857 1.00 0.11 C HETATM 3025 C5 GKB A 166 32.872 6.659 -39.729 1.00 -0.01 C HETATM 3026 C3 GKB A 166 33.122 5.913 -38.584 1.00 0.03 C HETATM 3027 C4 GKB A 166 32.320 6.150 -37.342 1.00 0.37 C HETATM 3028 F GKB A 166 31.653 7.293 -37.358 1.00 -0.22 F HETATM 3029 F1 GKB A 166 33.089 6.170 -36.244 1.00 -0.22 F HETATM 3030 F2 GKB A 166 31.393 5.226 -37.132 1.00 -0.22 F HETATM 3031 C2 GKB A 166 34.145 4.967 -38.571 1.00 -0.02 C HETATM 3032 C1 GKB A 166 34.931 4.767 -39.705 1.00 0.09 C HETATM 3033 N GKB A 166 35.864 3.704 -39.796 1.00 -0.23 N HETATM 3034 C GKB A 166 35.999 2.664 -38.940 1.00 0.23 C HETATM 3035 O GKB A 166 35.171 2.405 -38.071 1.00 -0.38 O HETATM 3036 C12 GKB A 166 37.205 1.797 -39.123 1.00 0.04 C HETATM 3037 C13 GKB A 166 37.087 0.471 -38.713 1.00 -0.05 C HETATM 3038 C14 GKB A 166 38.184 -0.378 -38.731 1.00 -0.03 C HETATM 3039 C15 GKB A 166 39.421 0.095 -39.136 1.00 -0.03 C HETATM 3040 C16 GKB A 166 40.463 -0.983 -39.000 1.00 0.01 C HETATM 3041 C17 GKB A 166 39.753 -2.070 -38.189 1.00 0.06 C HETATM 3042 N3 GKB A 166 39.985 -1.943 -36.757 1.00 -0.31 N HETATM 3043 C18 GKB A 166 39.594 -2.909 -35.838 1.00 0.09 C HETATM 3044 C21 GKB A 166 39.771 -2.702 -34.474 1.00 0.05 C HETATM 3045 N5 GKB A 166 39.413 -3.589 -33.545 1.00 -0.28 N HETATM 3046 C20 GKB A 166 38.876 -4.716 -33.998 1.00 0.08 C HETATM 3047 N4 GKB A 166 38.665 -5.049 -35.268 1.00 -0.28 N HETATM 3048 C19 GKB A 166 39.031 -4.137 -36.171 1.00 0.05 C HETATM 3049 H16 GKB A 166 38.882 -4.365 -37.220 1.00 0.08 H HETATM 3050 H7 GKB A 166 38.577 -5.443 -33.252 1.00 0.10 H HETATM 3051 H8 GKB A 166 40.223 -1.772 -34.150 1.00 0.08 H HETATM 3052 H1 GKB A 166 40.461 -1.098 -36.409 1.00 0.18 H HETATM 3053 C22 GKB A 166 38.262 -1.852 -38.446 1.00 0.00 C HETATM 3054 H9 GKB A 166 37.665 -2.116 -37.561 1.00 0.04 H HETATM 3055 H10 GKB A 166 37.919 -2.441 -39.309 1.00 0.04 H HETATM 3056 H6 GKB A 166 40.073 -3.066 -38.528 1.00 0.06 H HETATM 3057 H14 GKB A 166 41.348 -0.609 -38.465 1.00 0.04 H HETATM 3058 H15 GKB A 166 40.765 -1.364 -39.987 1.00 0.04 H HETATM 3059 C23 GKB A 166 39.546 1.411 -39.574 1.00 -0.06 C HETATM 3060 C24 GKB A 166 38.443 2.251 -39.577 1.00 -0.05 C HETATM 3061 H11 GKB A 166 38.544 3.269 -39.935 1.00 0.06 H HETATM 3062 H18 GKB A 166 40.507 1.779 -39.913 1.00 0.06 H HETATM 3063 H5 GKB A 166 36.127 0.098 -38.376 1.00 0.06 H HETATM 3064 H12 GKB A 166 36.489 3.724 -40.576 1.00 0.23 H HETATM 3065 C11 GKB A 166 34.700 5.525 -40.845 1.00 0.02 C HETATM 3066 H13 GKB A 166 35.322 5.392 -41.722 1.00 0.07 H HETATM 3067 H17 GKB A 166 34.330 4.384 -37.676 1.00 0.07 H HETATM 3068 H2 GKB A 166 32.070 7.388 -39.745 1.00 0.07 H HETATM 3069 C7 GKB A 166 34.294 7.408 -43.084 1.00 0.05 C HETATM 3070 C8 GKB A 166 33.632 8.072 -44.069 1.00 -0.01 C HETATM 3071 C9 GKB A 166 34.127 8.495 -45.421 1.00 -0.04 C HETATM 3072 H19 GKB A 166 33.321 9.013 -45.961 1.00 0.03 H HETATM 3073 H20 GKB A 166 34.439 7.608 -45.991 1.00 0.03 H HETATM 3074 H21 GKB A 166 34.984 9.174 -45.302 1.00 0.03 H HETATM 3075 N2 GKB A 166 32.290 8.297 -43.634 1.00 -0.32 N HETATM 3076 C10 GKB A 166 32.221 7.753 -42.440 1.00 0.11 C HETATM 3077 H4 GKB A 166 31.320 7.750 -41.828 1.00 0.12 H HETATM 3078 H3 GKB A 166 35.339 7.101 -43.104 1.00 0.07 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1147 1148 1152 1153 1154 CONECT 1152 1147 CONECT 1153 1147 CONECT 1154 1147 CONECT 3023 3024 3069 3076 CONECT 3024 3023 3025 3065 CONECT 3025 3024 3026 3068 CONECT 3026 3025 3027 3031 CONECT 3027 3026 3028 3029 3030 CONECT 3028 3027 CONECT 3029 3027 CONECT 3030 3027 CONECT 3031 3026 3032 3067 CONECT 3032 3031 3033 3065 CONECT 3033 3032 3034 3064 CONECT 3034 3033 3035 3036 CONECT 3035 3034 CONECT 3036 3034 3037 3060 CONECT 3037 3036 3038 3063 CONECT 3038 3037 3039 3053 CONECT 3039 3038 3040 3059 CONECT 3040 3039 3041 3057 3058 CONECT 3041 3040 3042 3053 3056 CONECT 3042 3041 3043 3052 CONECT 3043 3042 3044 3048 CONECT 3044 3043 3045 3051 CONECT 3045 3044 3046 CONECT 3046 3045 3047 3050 CONECT 3047 3046 3048 CONECT 3048 3043 3047 3049 CONECT 3049 3048 CONECT 3050 3046 CONECT 3051 3044 CONECT 3052 3042 CONECT 3053 3038 3041 3054 3055 CONECT 3054 3053 CONECT 3055 3053 CONECT 3056 3041 CONECT 3057 3040 CONECT 3058 3040 CONECT 3059 3039 3060 3062 CONECT 3060 3036 3059 3061 CONECT 3061 3060 CONECT 3062 3059 CONECT 3063 3037 CONECT 3064 3033 CONECT 3065 3024 3032 3066 CONECT 3066 3065 CONECT 3067 3031 CONECT 3068 3025 CONECT 3069 3023 3070 3078 CONECT 3070 3069 3071 3075 CONECT 3071 3070 3072 3073 3074 CONECT 3072 3071 CONECT 3073 3071 CONECT 3074 3071 CONECT 3075 3070 3076 CONECT 3076 3023 3075 3077 CONECT 3077 3076 CONECT 3078 3069 MASTER 0 0 0 0 0 0 0 0 3076 2 64 24 END
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Structure:
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Related entries of code: 6hp9
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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PDBbind
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PDBbind
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5bvn
RCSB PDB
PDBbind
324aa, >5BVN_1|Chain... at 96%
5bvo
RCSB PDB
PDBbind
324aa, >5BVO_1|Chain... at 96%
5bvw
RCSB PDB
PDBbind
324aa, >5BVW_1|Chain... at 96%
5fdp
RCSB PDB
PDBbind
337aa, >5FDP_1|Chain... *
6few
RCSB PDB
PDBbind
321aa, >6FEW_1|Chain... at 95%
6fex
RCSB PDB
PDBbind
321aa, >6FEX_1|Chain... at 95%
6fil
RCSB PDB
PDBbind
321aa, >6FIL_1|Chain... at 95%
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RCSB PDB
PDBbind
315aa, >6GWR_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6hp9
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DDR1
Ligand Name
GKB
EC.Number
E.C.-.-.-.-
Resolution
1.96(Å)
Affinity (Kd/Ki/IC50)
IC50=5.6nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 7431-7444
Ligand Properties
Formula
C
2
5
H
2
1
F
3
N
6
O
Molecular Weight
478.469
Exact Mass
478.173
No. of atoms
56
No. of bonds
60
Polar Surface Area
84.73
LOGP Value
4.11 (
Computed with XLOGP3
)
4.97 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 5
Canonical SMILES
Cc1ncn(c1)c1cc(NC(=O)c2ccc3c(c2)C[C@@H](C3)Nc2cncnc2)cc(c1)C(F)(F)F
InChI String
InChI=1S/C25H21F3N6O/c1-15-12-34(14-31-15)23-8-19(25(26,27)28)7-21(9-23)33-24(35)17-3-2-16-5-20(6-18(16)4-17)32-22-10-29-13-30-11-22/h2-4,7-14,20,32H,5-6H2,1H3,(H,33,35)/t20-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q08345
Entrez Gene ID
NCBI Entrez Gene ID:
780
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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