Browse entries in the PDBbind-CN Database
HEADER 4OAR_COMPLEX COMPND 4OAR_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 218 GLN LEU ILE PRO PRO LEU ILE ASN LEU LEU MET SER ILE SEQRES 2 A 218 GLU PRO ASP VAL ILE TYR ALA GLY HIS ASP ASN THR LYS SEQRES 3 A 218 PRO ASP THR SER SER SER LEU LEU THR SER LEU ASN GLN SEQRES 4 A 218 LEU GLY GLU ARG GLN LEU LEU SER VAL VAL LYS TRP SER SEQRES 5 A 218 LYS SER LEU PRO GLY PHE ARG ASN LEU HIS ILE ASP ASP SEQRES 6 A 218 GLN ILE THR LEU ILE GLN TYR SER TRP MET SER LEU MET SEQRES 7 A 218 VAL PHE GLY LEU GLY TRP ARG SER TYR LYS HIS VAL SER SEQRES 8 A 218 GLY GLN MET LEU TYR PHE ALA PRO ASP LEU ILE LEU ASN SEQRES 9 A 218 GLU GLN ARG MET LYS GLU SER SER PHE TYR SER LEU CYS SEQRES 10 A 218 LEU THR MET TRP GLN ILE PRO GLN GLU PHE VAL LYS LEU SEQRES 11 A 218 GLN VAL SER GLN GLU GLU PHE LEU CYS MET LYS VAL LEU SEQRES 12 A 218 LEU LEU LEU ASN THR ILE PRO LEU GLU GLY LEU ARG SER SEQRES 13 A 218 GLN THR GLN PHE GLU GLU MET ARG SER SER TYR ILE ARG SEQRES 14 A 218 GLU LEU ILE LYS ALA ILE GLY LEU ARG GLN LYS GLY VAL SEQRES 15 A 218 VAL SER SER SER GLN ARG PHE TYR GLN LEU THR LYS LEU SEQRES 16 A 218 LEU ASP ASN LEU HIS ASP LEU VAL LYS GLN LEU HIS LEU SEQRES 17 A 218 TYR CYS LEU ASN THR PHE ILE GLN SER ARG SEQRES 1 A 23 MET SER GLU VAL ILE ALA ALA GLN LEU PRO LYS ILE LEU SEQRES 2 A 23 ALA GLY MET VAL LYS PRO LEU LEU PHE HIS HET UNN A 284 72 ATOM 1 N GLN A 682 0.975 59.813 16.361 1.00 63.47 N ATOM 2 CA GLN A 682 1.010 60.162 17.814 1.00 63.50 C ATOM 3 C GLN A 682 1.193 58.895 18.652 1.00 62.45 C ATOM 4 O GLN A 682 2.316 58.423 18.858 1.00 62.83 O ATOM 5 CB GLN A 682 -0.297 60.857 18.234 1.00 65.01 C ATOM 6 CG GLN A 682 -0.661 62.118 17.452 1.00 66.50 C ATOM 7 CD GLN A 682 -1.970 62.747 17.929 1.00 67.73 C ATOM 8 OE1 GLN A 682 -2.691 62.173 18.753 1.00 67.06 O ATOM 9 NE2 GLN A 682 -2.278 63.934 17.411 1.00 67.83 N ATOM 10 HE22 GLN A 682 -1.642 64.381 16.720 1.00 0.00 H ATOM 11 HE21 GLN A 682 -3.155 64.415 17.697 1.00 0.00 H ATOM 12 HN3 GLN A 682 0.182 59.165 16.180 1.00 0.00 H ATOM 13 HN2 GLN A 682 1.868 59.352 16.095 1.00 0.00 H ATOM 14 HN1 GLN A 682 0.850 60.680 15.800 1.00 0.00 H ATOM 15 N LEU A 683 0.070 58.353 19.122 1.00 60.30 N ATOM 16 CA LEU A 683 0.049 57.146 19.942 1.00 57.01 C ATOM 17 C LEU A 683 -0.066 55.887 19.085 1.00 53.93 C ATOM 18 O LEU A 683 -0.345 55.949 17.886 1.00 53.52 O ATOM 19 CB LEU A 683 -1.129 57.198 20.921 1.00 57.64 C ATOM 20 CG LEU A 683 -1.182 58.337 21.942 1.00 58.09 C ATOM 21 CD1 LEU A 683 -2.633 58.667 22.268 1.00 58.06 C ATOM 22 CD2 LEU A 683 -0.400 57.965 23.200 1.00 58.29 C ATOM 23 H LEU A 683 -0.835 58.812 18.893 1.00 0.00 H ATOM 24 N ILE A 684 0.134 54.747 19.733 1.00 50.46 N ATOM 25 CA ILE A 684 0.058 53.442 19.096 1.00 46.44 C ATOM 26 C ILE A 684 -1.332 52.855 19.321 1.00 43.13 C ATOM 27 O ILE A 684 -1.854 52.916 20.434 1.00 43.05 O ATOM 28 CB ILE A 684 1.099 52.490 19.724 1.00 46.84 C ATOM 29 CG1 ILE A 684 2.512 52.985 19.410 1.00 47.33 C ATOM 30 CG2 ILE A 684 0.893 51.061 19.239 1.00 46.71 C ATOM 31 CD1 ILE A 684 3.556 52.507 20.409 1.00 49.24 C ATOM 32 H ILE A 684 0.356 54.789 20.748 1.00 0.00 H ATOM 33 N PRO A 685 -1.957 52.304 18.262 1.00 39.41 N ATOM 34 CA PRO A 685 -3.292 51.699 18.359 1.00 36.80 C ATOM 35 C PRO A 685 -3.306 50.649 19.479 1.00 33.90 C ATOM 36 O PRO A 685 -2.376 49.854 19.598 1.00 34.91 O ATOM 37 CB PRO A 685 -3.466 51.056 16.980 1.00 36.93 C ATOM 38 CG PRO A 685 -2.753 52.011 16.089 1.00 37.17 C ATOM 39 CD PRO A 685 -1.478 52.281 16.868 1.00 38.89 C ATOM 40 N PRO A 686 -4.376 50.621 20.291 1.00 30.85 N ATOM 41 CA PRO A 686 -4.554 49.694 21.419 1.00 27.87 C ATOM 42 C PRO A 686 -4.268 48.218 21.153 1.00 24.79 C ATOM 43 O PRO A 686 -3.587 47.574 21.944 1.00 23.22 O ATOM 44 CB PRO A 686 -6.013 49.923 21.825 1.00 28.45 C ATOM 45 CG PRO A 686 -6.231 51.356 21.480 1.00 28.78 C ATOM 46 CD PRO A 686 -5.575 51.461 20.121 1.00 30.39 C ATOM 47 N LEU A 687 -4.783 47.678 20.051 1.00 23.31 N ATOM 48 CA LEU A 687 -4.550 46.270 19.740 1.00 22.48 C ATOM 49 C LEU A 687 -3.062 45.976 19.514 1.00 21.02 C ATOM 50 O LEU A 687 -2.532 44.977 20.004 1.00 20.67 O ATOM 51 CB LEU A 687 -5.374 45.832 18.523 1.00 21.75 C ATOM 52 CG LEU A 687 -5.303 44.337 18.205 1.00 21.70 C ATOM 53 CD1 LEU A 687 -5.619 43.520 19.453 1.00 21.65 C ATOM 54 CD2 LEU A 687 -6.267 44.007 17.089 1.00 21.78 C ATOM 55 H LEU A 687 -5.355 48.262 19.408 1.00 0.00 H ATOM 56 N ILE A 688 -2.391 46.861 18.788 1.00 20.27 N ATOM 57 CA ILE A 688 -0.971 46.693 18.517 1.00 20.70 C ATOM 58 C ILE A 688 -0.182 46.802 19.815 1.00 20.60 C ATOM 59 O ILE A 688 0.795 46.080 20.016 1.00 19.47 O ATOM 60 CB ILE A 688 -0.466 47.734 17.506 1.00 20.31 C ATOM 61 CG1 ILE A 688 -1.181 47.534 16.163 1.00 20.70 C ATOM 62 CG2 ILE A 688 1.033 47.605 17.346 1.00 19.00 C ATOM 63 CD1 ILE A 688 -0.991 48.669 15.147 1.00 22.73 C ATOM 64 H ILE A 688 -2.889 47.690 18.406 1.00 0.00 H ATOM 65 N ASN A 689 -0.623 47.690 20.703 1.00 21.36 N ATOM 66 CA ASN A 689 0.042 47.852 21.985 1.00 22.82 C ATOM 67 C ASN A 689 -0.176 46.593 22.803 1.00 22.13 C ATOM 68 O ASN A 689 0.723 46.133 23.500 1.00 22.28 O ATOM 69 CB ASN A 689 -0.490 49.062 22.741 1.00 25.81 C ATOM 70 CG ASN A 689 0.417 49.461 23.884 1.00 28.46 C ATOM 71 OD1 ASN A 689 0.012 49.463 25.043 1.00 28.18 O ATOM 72 ND2 ASN A 689 1.673 49.779 23.558 1.00 30.19 N ATOM 73 HD22 ASN A 689 1.972 49.763 22.562 1.00 0.00 H ATOM 74 HD21 ASN A 689 2.352 50.042 24.300 1.00 0.00 H ATOM 75 H ASN A 689 -1.453 48.275 20.477 1.00 0.00 H ATOM 76 N LEU A 690 -1.376 46.028 22.702 1.00 23.36 N ATOM 77 CA LEU A 690 -1.693 44.793 23.409 1.00 23.39 C ATOM 78 C LEU A 690 -0.765 43.693 22.885 1.00 23.25 C ATOM 79 O LEU A 690 -0.199 42.926 23.673 1.00 22.16 O ATOM 80 CB LEU A 690 -3.166 44.406 23.208 1.00 23.00 C ATOM 81 CG LEU A 690 -3.618 43.055 23.794 1.00 24.49 C ATOM 82 CD1 LEU A 690 -3.155 42.898 25.234 1.00 25.66 C ATOM 83 CD2 LEU A 690 -5.127 42.956 23.744 1.00 23.52 C ATOM 84 H LEU A 690 -2.102 46.476 22.107 1.00 0.00 H ATOM 85 N LEU A 691 -0.573 43.662 21.562 1.00 22.15 N ATOM 86 CA LEU A 691 0.303 42.672 20.925 1.00 22.49 C ATOM 87 C LEU A 691 1.735 42.763 21.456 1.00 21.86 C ATOM 88 O LEU A 691 2.370 41.748 21.723 1.00 21.09 O ATOM 89 CB LEU A 691 0.276 42.821 19.398 1.00 21.85 C ATOM 90 CG LEU A 691 -1.034 42.390 18.715 1.00 22.06 C ATOM 91 CD1 LEU A 691 -0.992 42.672 17.213 1.00 20.28 C ATOM 92 CD2 LEU A 691 -1.308 40.909 18.988 1.00 20.52 C ATOM 93 H LEU A 691 -1.060 44.361 20.966 1.00 0.00 H ATOM 94 N MET A 692 2.227 43.987 21.618 1.00 24.05 N ATOM 95 CA MET A 692 3.566 44.228 22.161 1.00 25.46 C ATOM 96 C MET A 692 3.701 43.648 23.575 1.00 24.71 C ATOM 97 O MET A 692 4.718 43.047 23.913 1.00 23.67 O ATOM 98 CB MET A 692 3.838 45.730 22.260 1.00 28.38 C ATOM 99 CG MET A 692 4.355 46.402 21.015 1.00 34.90 C ATOM 100 SD MET A 692 4.637 48.205 21.243 1.00 43.37 S ATOM 101 CE MET A 692 3.510 48.863 19.999 1.00 39.29 C ATOM 102 H MET A 692 1.640 44.803 21.350 1.00 0.00 H ATOM 103 N SER A 693 2.672 43.836 24.398 1.00 24.83 N ATOM 104 CA SER A 693 2.712 43.368 25.783 1.00 25.22 C ATOM 105 C SER A 693 2.617 41.861 25.974 1.00 25.29 C ATOM 106 O SER A 693 2.975 41.355 27.030 1.00 24.72 O ATOM 107 CB SER A 693 1.649 44.077 26.633 1.00 25.19 C ATOM 108 OG SER A 693 0.355 43.549 26.399 1.00 28.68 O ATOM 109 HG SER A 693 0.120 43.665 25.444 1.00 0.00 H ATOM 110 H SER A 693 1.823 44.325 24.049 1.00 0.00 H ATOM 111 N ILE A 694 2.122 41.142 24.971 1.00 26.74 N ATOM 112 CA ILE A 694 2.014 39.697 25.096 1.00 26.59 C ATOM 113 C ILE A 694 3.163 38.991 24.393 1.00 28.91 C ATOM 114 O ILE A 694 3.197 37.762 24.311 1.00 29.89 O ATOM 115 CB ILE A 694 0.650 39.153 24.618 1.00 25.06 C ATOM 116 CG1 ILE A 694 0.483 39.321 23.103 1.00 23.11 C ATOM 117 CG2 ILE A 694 -0.476 39.847 25.388 1.00 22.94 C ATOM 118 CD1 ILE A 694 -0.748 38.618 22.551 1.00 19.42 C ATOM 119 H ILE A 694 1.812 41.613 24.097 1.00 0.00 H ATOM 120 N GLU A 695 4.105 39.778 23.883 1.00 30.32 N ATOM 121 CA GLU A 695 5.277 39.220 23.229 1.00 32.98 C ATOM 122 C GLU A 695 6.021 38.379 24.260 1.00 35.24 C ATOM 123 O GLU A 695 6.168 38.781 25.420 1.00 34.26 O ATOM 124 CB GLU A 695 6.194 40.332 22.714 1.00 31.13 C ATOM 125 CG GLU A 695 5.909 40.759 21.288 1.00 32.33 C ATOM 126 CD GLU A 695 6.188 39.650 20.266 1.00 33.12 C ATOM 127 OE1 GLU A 695 5.235 38.930 19.878 1.00 30.12 O ATOM 128 OE2 GLU A 695 7.363 39.505 19.848 1.00 33.49 O ATOM 129 H GLU A 695 4.002 40.810 23.953 1.00 0.00 H ATOM 130 N PRO A 696 6.446 37.171 23.869 1.00 37.94 N ATOM 131 CA PRO A 696 7.172 36.300 24.794 1.00 39.89 C ATOM 132 C PRO A 696 8.492 36.933 25.221 1.00 41.78 C ATOM 133 O PRO A 696 9.113 37.668 24.453 1.00 41.68 O ATOM 134 CB PRO A 696 7.405 35.042 23.955 1.00 39.74 C ATOM 135 CG PRO A 696 7.485 35.575 22.550 1.00 39.74 C ATOM 136 CD PRO A 696 6.333 36.550 22.537 1.00 38.99 C ATOM 137 N ASP A 697 8.882 36.707 26.469 1.00 43.97 N ATOM 138 CA ASP A 697 10.145 37.242 26.953 1.00 47.19 C ATOM 139 C ASP A 697 11.283 36.323 26.501 1.00 47.12 C ATOM 140 O ASP A 697 11.044 35.204 26.040 1.00 47.51 O ATOM 141 CB ASP A 697 10.134 37.410 28.482 1.00 50.71 C ATOM 142 CG ASP A 697 9.818 36.115 29.228 1.00 54.31 C ATOM 143 OD1 ASP A 697 9.500 35.086 28.582 1.00 55.44 O ATOM 144 OD2 ASP A 697 9.886 36.139 30.480 1.00 55.63 O ATOM 145 H ASP A 697 8.281 36.144 27.105 1.00 0.00 H ATOM 146 N VAL A 698 12.511 36.818 26.613 1.00 47.08 N ATOM 147 CA VAL A 698 13.712 36.084 26.219 1.00 46.04 C ATOM 148 C VAL A 698 13.762 34.625 26.660 1.00 44.39 C ATOM 149 O VAL A 698 13.461 34.297 27.809 1.00 43.87 O ATOM 150 CB VAL A 698 14.984 36.804 26.735 1.00 46.36 C ATOM 151 CG1 VAL A 698 16.226 35.949 26.496 1.00 46.65 C ATOM 152 CG2 VAL A 698 15.135 38.150 26.039 1.00 47.00 C ATOM 153 H VAL A 698 12.623 37.776 27.001 1.00 0.00 H ATOM 154 N ILE A 699 14.102 33.753 25.714 1.00 43.46 N ATOM 155 CA ILE A 699 14.235 32.327 25.980 1.00 43.05 C ATOM 156 C ILE A 699 15.646 31.904 25.588 1.00 43.14 C ATOM 157 O ILE A 699 16.045 32.022 24.425 1.00 43.01 O ATOM 158 CB ILE A 699 13.205 31.482 25.193 1.00 42.87 C ATOM 159 CG1 ILE A 699 11.785 31.779 25.691 1.00 43.39 C ATOM 160 CG2 ILE A 699 13.520 29.991 25.346 1.00 42.12 C ATOM 161 CD1 ILE A 699 10.699 30.961 25.009 1.00 41.04 C ATOM 162 H ILE A 699 14.279 34.102 24.750 1.00 0.00 H ATOM 163 N TYR A 700 16.413 31.462 26.580 1.00 43.31 N ATOM 164 CA TYR A 700 17.785 31.019 26.364 1.00 43.23 C ATOM 165 C TYR A 700 17.805 29.581 25.878 1.00 43.65 C ATOM 166 O TYR A 700 16.908 28.802 26.189 1.00 43.48 O ATOM 167 CB TYR A 700 18.595 31.155 27.656 1.00 42.98 C ATOM 168 CG TYR A 700 18.778 32.590 28.091 1.00 44.48 C ATOM 169 CD1 TYR A 700 19.836 33.350 27.604 1.00 44.77 C ATOM 170 CD2 TYR A 700 17.873 33.202 28.965 1.00 45.92 C ATOM 171 CE1 TYR A 700 19.996 34.682 27.967 1.00 45.95 C ATOM 172 CE2 TYR A 700 18.023 34.539 29.338 1.00 46.86 C ATOM 173 CZ TYR A 700 19.091 35.272 28.830 1.00 47.39 C ATOM 174 OH TYR A 700 19.255 36.596 29.172 1.00 48.20 O ATOM 175 HH TYR A 700 20.060 36.955 28.722 1.00 0.00 H ATOM 176 H TYR A 700 16.021 31.431 27.543 1.00 0.00 H ATOM 177 N ALA A 701 18.822 29.238 25.095 1.00 45.00 N ATOM 178 CA ALA A 701 18.955 27.885 24.564 1.00 46.48 C ATOM 179 C ALA A 701 19.609 26.941 25.569 1.00 47.84 C ATOM 180 O ALA A 701 19.428 25.724 25.492 1.00 47.64 O ATOM 181 CB ALA A 701 19.753 27.906 23.265 1.00 45.68 C ATOM 182 H ALA A 701 19.540 29.951 24.855 1.00 0.00 H ATOM 183 N GLY A 702 20.329 27.513 26.532 1.00 49.67 N ATOM 184 CA GLY A 702 21.023 26.713 27.528 1.00 53.36 C ATOM 185 C GLY A 702 22.305 26.206 26.893 1.00 55.94 C ATOM 186 O GLY A 702 22.751 25.080 27.137 1.00 56.45 O ATOM 187 H GLY A 702 20.396 28.550 26.572 1.00 0.00 H ATOM 188 N HIS A 703 22.888 27.068 26.065 1.00 57.50 N ATOM 189 CA HIS A 703 24.103 26.771 25.329 1.00 58.73 C ATOM 190 C HIS A 703 25.337 27.427 25.939 1.00 60.23 C ATOM 191 O HIS A 703 25.311 28.597 26.328 1.00 59.46 O ATOM 192 CB HIS A 703 23.930 27.221 23.877 1.00 58.13 C ATOM 193 CG HIS A 703 25.131 26.976 23.022 1.00 58.25 C ATOM 194 ND1 HIS A 703 25.964 27.991 22.605 1.00 58.30 N ATOM 195 CD2 HIS A 703 25.651 25.831 22.522 1.00 58.27 C ATOM 196 CE1 HIS A 703 26.948 27.483 21.886 1.00 58.59 C ATOM 197 NE2 HIS A 703 26.781 26.174 21.821 1.00 58.64 N ATOM 198 H HIS A 703 22.451 28.003 25.938 1.00 0.00 H ATOM 199 N ASP A 704 26.418 26.656 26.011 1.00 62.73 N ATOM 200 CA ASP A 704 27.676 27.142 26.558 1.00 65.33 C ATOM 201 C ASP A 704 28.552 27.648 25.416 1.00 66.53 C ATOM 202 O ASP A 704 28.954 26.881 24.537 1.00 66.37 O ATOM 203 CB ASP A 704 28.391 26.026 27.327 1.00 66.20 C ATOM 204 CG ASP A 704 29.549 26.541 28.176 1.00 68.14 C ATOM 205 OD1 ASP A 704 29.899 27.740 28.068 1.00 68.57 O ATOM 206 OD2 ASP A 704 30.109 25.742 28.960 1.00 68.40 O ATOM 207 H ASP A 704 26.363 25.676 25.666 1.00 0.00 H ATOM 208 N ASN A 705 28.836 28.946 25.440 1.00 67.95 N ATOM 209 CA ASN A 705 29.654 29.586 24.415 1.00 69.82 C ATOM 210 C ASN A 705 31.134 29.616 24.795 1.00 70.45 C ATOM 211 O ASN A 705 31.991 29.918 23.961 1.00 70.08 O ATOM 212 CB ASN A 705 29.155 31.009 24.174 1.00 70.81 C ATOM 213 CG ASN A 705 27.653 31.070 23.990 1.00 71.87 C ATOM 214 OD1 ASN A 705 27.127 30.671 22.949 1.00 72.41 O ATOM 215 ND2 ASN A 705 26.949 31.552 25.013 1.00 71.54 N ATOM 216 HD22 ASN A 705 27.436 31.877 25.872 1.00 0.00 H ATOM 217 HD21 ASN A 705 25.912 31.603 24.953 1.00 0.00 H ATOM 218 H ASN A 705 28.462 29.527 26.217 1.00 0.00 H ATOM 219 N THR A 706 31.422 29.303 26.058 1.00 71.10 N ATOM 220 CA THR A 706 32.792 29.289 26.570 1.00 71.49 C ATOM 221 C THR A 706 33.498 27.983 26.201 1.00 70.90 C ATOM 222 O THR A 706 34.453 27.568 26.866 1.00 70.64 O ATOM 223 CB THR A 706 32.829 29.480 28.115 1.00 72.35 C ATOM 224 OG1 THR A 706 32.393 28.278 28.767 1.00 72.44 O ATOM 225 CG2 THR A 706 31.918 30.638 28.536 1.00 72.52 C ATOM 226 HG1 THR A 706 31.467 28.068 28.486 1.00 0.00 H ATOM 227 H THR A 706 30.644 29.060 26.704 1.00 0.00 H ATOM 228 N LYS A 707 33.006 27.334 25.147 1.00 69.84 N ATOM 229 CA LYS A 707 33.577 26.082 24.664 1.00 68.63 C ATOM 230 C LYS A 707 33.139 25.808 23.226 1.00 67.12 C ATOM 231 O LYS A 707 31.978 26.029 22.863 1.00 66.64 O ATOM 232 CB LYS A 707 33.189 24.913 25.582 1.00 69.16 C ATOM 233 CG LYS A 707 31.704 24.570 25.610 1.00 70.21 C ATOM 234 CD LYS A 707 31.394 23.476 26.638 1.00 70.56 C ATOM 235 CE LYS A 707 32.143 22.180 26.348 1.00 71.33 C ATOM 236 NZ LYS A 707 31.796 21.598 25.014 1.00 72.07 N ATOM 237 HZ1 LYS A 707 30.777 21.392 24.982 1.00 0.00 H ATOM 238 HZ2 LYS A 707 32.037 22.280 24.266 1.00 0.00 H ATOM 239 HZ3 LYS A 707 32.334 20.719 24.870 1.00 0.00 H ATOM 240 H LYS A 707 32.185 27.735 24.650 1.00 0.00 H ATOM 241 N PRO A 708 34.077 25.342 22.380 1.00 65.52 N ATOM 242 CA PRO A 708 33.802 25.035 20.974 1.00 64.39 C ATOM 243 C PRO A 708 32.684 24.012 20.759 1.00 63.53 C ATOM 244 O PRO A 708 32.542 23.042 21.510 1.00 62.65 O ATOM 245 CB PRO A 708 35.158 24.540 20.459 1.00 64.26 C ATOM 246 CG PRO A 708 35.837 24.023 21.685 1.00 64.14 C ATOM 247 CD PRO A 708 35.486 25.067 22.703 1.00 65.00 C ATOM 248 N ASP A 709 31.875 24.264 19.737 1.00 63.11 N ATOM 249 CA ASP A 709 30.754 23.397 19.397 1.00 62.74 C ATOM 250 C ASP A 709 31.110 22.236 18.495 1.00 61.47 C ATOM 251 O ASP A 709 32.050 22.301 17.702 1.00 61.39 O ATOM 252 CB ASP A 709 29.643 24.193 18.702 1.00 63.63 C ATOM 253 CG ASP A 709 28.667 24.817 19.675 1.00 64.12 C ATOM 254 OD1 ASP A 709 28.262 25.976 19.432 1.00 65.06 O ATOM 255 OD2 ASP A 709 28.292 24.145 20.662 1.00 64.16 O ATOM 256 H ASP A 709 32.047 25.111 19.158 1.00 0.00 H ATOM 257 N THR A 710 30.322 21.179 18.627 1.00 60.36 N ATOM 258 CA THR A 710 30.452 19.988 17.806 1.00 59.41 C ATOM 259 C THR A 710 29.110 19.876 17.076 1.00 58.29 C ATOM 260 O THR A 710 28.150 20.571 17.423 1.00 58.15 O ATOM 261 CB THR A 710 30.734 18.722 18.661 1.00 59.43 C ATOM 262 OG1 THR A 710 30.707 17.559 17.824 1.00 60.69 O ATOM 263 CG2 THR A 710 29.720 18.572 19.775 1.00 58.88 C ATOM 264 HG1 THR A 710 30.887 16.755 18.373 1.00 0.00 H ATOM 265 H THR A 710 29.576 21.203 19.352 1.00 0.00 H ATOM 266 N SER A 711 29.042 19.042 16.047 1.00 57.02 N ATOM 267 CA SER A 711 27.796 18.890 15.303 1.00 55.98 C ATOM 268 C SER A 711 26.690 18.359 16.218 1.00 54.91 C ATOM 269 O SER A 711 25.521 18.710 16.061 1.00 55.21 O ATOM 270 CB SER A 711 27.995 17.957 14.108 1.00 55.79 C ATOM 271 OG SER A 711 26.914 18.069 13.202 1.00 56.56 O ATOM 272 HG SER A 711 26.854 19.001 12.875 1.00 0.00 H ATOM 273 H SER A 711 29.881 18.494 15.769 1.00 0.00 H ATOM 274 N SER A 712 27.083 17.550 17.198 1.00 53.52 N ATOM 275 CA SER A 712 26.156 16.964 18.158 1.00 52.10 C ATOM 276 C SER A 712 25.542 18.002 19.095 1.00 50.87 C ATOM 277 O SER A 712 24.318 18.104 19.195 1.00 51.34 O ATOM 278 CB SER A 712 26.863 15.886 18.987 1.00 52.91 C ATOM 279 OG SER A 712 26.002 15.350 19.980 1.00 53.58 O ATOM 280 HG SER A 712 26.487 14.659 20.497 1.00 0.00 H ATOM 281 H SER A 712 28.095 17.326 17.283 1.00 0.00 H ATOM 282 N SER A 713 26.392 18.777 19.765 1.00 48.77 N ATOM 283 CA SER A 713 25.930 19.788 20.713 1.00 47.43 C ATOM 284 C SER A 713 25.104 20.921 20.100 1.00 46.08 C ATOM 285 O SER A 713 24.160 21.410 20.726 1.00 46.00 O ATOM 286 CB SER A 713 27.109 20.367 21.504 1.00 47.26 C ATOM 287 OG SER A 713 27.993 21.095 20.665 1.00 47.88 O ATOM 288 HG SER A 713 27.503 21.843 20.241 1.00 0.00 H ATOM 289 H SER A 713 27.414 18.659 19.609 1.00 0.00 H ATOM 290 N LEU A 714 25.463 21.344 18.890 1.00 43.92 N ATOM 291 CA LEU A 714 24.740 22.418 18.215 1.00 42.70 C ATOM 292 C LEU A 714 23.305 21.978 17.902 1.00 42.00 C ATOM 293 O LEU A 714 22.352 22.704 18.180 1.00 41.84 O ATOM 294 CB LEU A 714 25.462 22.813 16.926 1.00 42.81 C ATOM 295 CG LEU A 714 25.492 24.296 16.539 1.00 43.50 C ATOM 296 CD1 LEU A 714 26.235 24.451 15.226 1.00 43.30 C ATOM 297 CD2 LEU A 714 24.093 24.868 16.419 1.00 43.12 C ATOM 298 H LEU A 714 26.275 20.900 18.416 1.00 0.00 H ATOM 299 N LEU A 715 23.157 20.789 17.323 1.00 40.76 N ATOM 300 CA LEU A 715 21.840 20.257 16.994 1.00 39.74 C ATOM 301 C LEU A 715 21.019 20.001 18.255 1.00 38.84 C ATOM 302 O LEU A 715 19.793 20.142 18.239 1.00 38.83 O ATOM 303 CB LEU A 715 21.964 18.971 16.172 1.00 41.21 C ATOM 304 CG LEU A 715 22.248 19.146 14.676 1.00 42.92 C ATOM 305 CD1 LEU A 715 23.053 17.965 14.146 1.00 42.98 C ATOM 306 CD2 LEU A 715 20.937 19.295 13.909 1.00 43.06 C ATOM 307 H LEU A 715 24.002 20.225 17.100 1.00 0.00 H ATOM 308 N THR A 716 21.698 19.632 19.342 1.00 36.89 N ATOM 309 CA THR A 716 21.035 19.377 20.618 1.00 35.33 C ATOM 310 C THR A 716 20.521 20.697 21.193 1.00 35.34 C ATOM 311 O THR A 716 19.417 20.756 21.742 1.00 34.60 O ATOM 312 CB THR A 716 21.988 18.675 21.629 1.00 35.68 C ATOM 313 OG1 THR A 716 22.237 17.331 21.197 1.00 35.44 O ATOM 314 CG2 THR A 716 21.377 18.637 23.029 1.00 34.20 C ATOM 315 HG1 THR A 716 22.658 17.346 20.301 1.00 0.00 H ATOM 316 H THR A 716 22.730 19.523 19.279 1.00 0.00 H ATOM 317 N SER A 717 21.317 21.754 21.046 1.00 34.71 N ATOM 318 CA SER A 717 20.936 23.083 21.526 1.00 34.65 C ATOM 319 C SER A 717 19.699 23.605 20.799 1.00 33.75 C ATOM 320 O SER A 717 18.822 24.206 21.416 1.00 33.21 O ATOM 321 CB SER A 717 22.081 24.085 21.335 1.00 35.20 C ATOM 322 OG SER A 717 23.028 23.995 22.381 1.00 37.60 O ATOM 323 HG SER A 717 23.410 23.082 22.401 1.00 0.00 H ATOM 324 H SER A 717 22.237 21.632 20.576 1.00 0.00 H ATOM 325 N LEU A 718 19.641 23.375 19.490 1.00 32.81 N ATOM 326 CA LEU A 718 18.524 23.826 18.668 1.00 33.84 C ATOM 327 C LEU A 718 17.220 23.102 18.987 1.00 33.86 C ATOM 328 O LEU A 718 16.154 23.718 19.007 1.00 33.31 O ATOM 329 CB LEU A 718 18.858 23.675 17.185 1.00 33.86 C ATOM 330 CG LEU A 718 19.921 24.642 16.658 1.00 36.23 C ATOM 331 CD1 LEU A 718 20.356 24.231 15.246 1.00 35.82 C ATOM 332 CD2 LEU A 718 19.384 26.074 16.686 1.00 33.77 C ATOM 333 H LEU A 718 20.420 22.855 19.037 1.00 0.00 H ATOM 334 N ASN A 719 17.303 21.796 19.223 1.00 33.78 N ATOM 335 CA ASN A 719 16.122 21.015 19.559 1.00 33.80 C ATOM 336 C ASN A 719 15.565 21.447 20.912 1.00 34.72 C ATOM 337 O ASN A 719 14.352 21.583 21.065 1.00 35.01 O ATOM 338 CB ASN A 719 16.435 19.519 19.535 1.00 33.64 C ATOM 339 CG ASN A 719 16.571 18.977 18.117 1.00 35.08 C ATOM 340 OD1 ASN A 719 16.467 19.721 17.138 1.00 36.97 O ATOM 341 ND2 ASN A 719 16.799 17.676 18.001 1.00 35.21 N ATOM 342 HD22 ASN A 719 16.880 17.084 18.852 1.00 0.00 H ATOM 343 HD21 ASN A 719 16.897 17.247 17.059 1.00 0.00 H ATOM 344 H ASN A 719 18.228 21.324 19.166 1.00 0.00 H ATOM 345 N GLN A 720 16.454 21.720 21.866 1.00 35.71 N ATOM 346 CA GLN A 720 16.053 22.171 23.198 1.00 37.24 C ATOM 347 C GLN A 720 15.373 23.528 23.104 1.00 36.80 C ATOM 348 O GLN A 720 14.427 23.816 23.846 1.00 37.46 O ATOM 349 CB GLN A 720 17.264 22.320 24.123 1.00 39.36 C ATOM 350 CG GLN A 720 17.750 21.048 24.800 1.00 43.97 C ATOM 351 CD GLN A 720 18.789 21.344 25.875 1.00 47.30 C ATOM 352 OE1 GLN A 720 18.519 22.080 26.834 1.00 49.04 O ATOM 353 NE2 GLN A 720 19.988 20.795 25.708 1.00 48.27 N ATOM 354 HE22 GLN A 720 20.170 20.183 24.887 1.00 0.00 H ATOM 355 HE21 GLN A 720 20.744 20.978 26.398 1.00 0.00 H ATOM 356 H GLN A 720 17.467 21.609 21.656 1.00 0.00 H ATOM 357 N LEU A 721 15.894 24.378 22.222 1.00 34.87 N ATOM 358 CA LEU A 721 15.345 25.713 22.031 1.00 33.98 C ATOM 359 C LEU A 721 13.980 25.611 21.355 1.00 33.64 C ATOM 360 O LEU A 721 13.035 26.296 21.741 1.00 33.05 O ATOM 361 CB LEU A 721 16.307 26.569 21.199 1.00 33.71 C ATOM 362 CG LEU A 721 16.003 28.064 21.070 1.00 31.30 C ATOM 363 CD1 LEU A 721 15.964 28.705 22.444 1.00 31.66 C ATOM 364 CD2 LEU A 721 17.043 28.733 20.197 1.00 30.78 C ATOM 365 H LEU A 721 16.714 24.081 21.655 1.00 0.00 H ATOM 366 N GLY A 722 13.882 24.718 20.375 1.00 33.93 N ATOM 367 CA GLY A 722 12.634 24.516 19.663 1.00 34.99 C ATOM 368 C GLY A 722 11.501 24.069 20.570 1.00 36.08 C ATOM 369 O GLY A 722 10.376 24.554 20.435 1.00 35.62 O ATOM 370 H GLY A 722 14.716 24.154 20.114 1.00 0.00 H ATOM 371 N GLU A 723 11.798 23.148 21.492 1.00 37.49 N ATOM 372 CA GLU A 723 10.807 22.641 22.442 1.00 38.60 C ATOM 373 C GLU A 723 10.319 23.773 23.337 1.00 38.23 C ATOM 374 O GLU A 723 9.120 23.915 23.566 1.00 38.63 O ATOM 375 CB GLU A 723 11.394 21.515 23.303 1.00 41.36 C ATOM 376 CG GLU A 723 11.873 20.303 22.500 1.00 48.26 C ATOM 377 CD GLU A 723 12.337 19.132 23.368 1.00 50.93 C ATOM 378 OE1 GLU A 723 11.616 18.110 23.416 1.00 54.01 O ATOM 379 OE2 GLU A 723 13.425 19.218 23.981 1.00 51.96 O ATOM 380 H GLU A 723 12.769 22.778 21.536 1.00 0.00 H ATOM 381 N ARG A 724 11.250 24.589 23.825 1.00 37.76 N ATOM 382 CA ARG A 724 10.906 25.717 24.687 1.00 37.63 C ATOM 383 C ARG A 724 10.094 26.766 23.927 1.00 36.22 C ATOM 384 O ARG A 724 9.131 27.319 24.464 1.00 35.90 O ATOM 385 CB ARG A 724 12.169 26.363 25.265 1.00 39.53 C ATOM 386 CG ARG A 724 12.942 25.484 26.229 1.00 41.85 C ATOM 387 CD ARG A 724 14.198 26.184 26.731 1.00 44.43 C ATOM 388 NE ARG A 724 15.054 25.279 27.496 1.00 47.07 N ATOM 389 CZ ARG A 724 16.162 25.641 28.138 1.00 48.74 C ATOM 390 NH1 ARG A 724 16.574 26.906 28.117 1.00 47.51 N ATOM 391 NH2 ARG A 724 16.859 24.732 28.812 1.00 49.48 N ATOM 392 HE ARG A 724 14.776 24.278 27.542 1.00 0.00 H ATOM 393 HH12 ARG A 724 17.441 27.179 28.622 1.00 0.00 H ATOM 394 HH11 ARG A 724 16.029 27.622 27.596 1.00 0.00 H ATOM 395 HH22 ARG A 724 17.726 25.010 29.315 1.00 0.00 H ATOM 396 HH21 ARG A 724 16.538 23.743 28.836 1.00 0.00 H ATOM 397 H ARG A 724 12.248 24.419 23.587 1.00 0.00 H ATOM 398 N GLN A 725 10.479 27.030 22.679 1.00 34.08 N ATOM 399 CA GLN A 725 9.775 28.012 21.860 1.00 33.11 C ATOM 400 C GLN A 725 8.364 27.576 21.479 1.00 31.13 C ATOM 401 O GLN A 725 7.489 28.420 21.261 1.00 30.04 O ATOM 402 CB GLN A 725 10.592 28.380 20.614 1.00 33.51 C ATOM 403 CG GLN A 725 11.720 29.370 20.919 1.00 35.29 C ATOM 404 CD GLN A 725 12.496 29.818 19.688 1.00 35.86 C ATOM 405 OE1 GLN A 725 13.433 30.613 19.787 1.00 35.43 O ATOM 406 NE2 GLN A 725 12.110 29.311 18.523 1.00 36.87 N ATOM 407 HE22 GLN A 725 11.314 28.643 18.485 1.00 0.00 H ATOM 408 HE21 GLN A 725 12.604 29.582 17.649 1.00 0.00 H ATOM 409 H GLN A 725 11.297 26.527 22.281 1.00 0.00 H ATOM 410 N LEU A 726 8.143 26.264 21.418 1.00 29.55 N ATOM 411 CA LEU A 726 6.826 25.728 21.085 1.00 29.91 C ATOM 412 C LEU A 726 5.837 26.044 22.211 1.00 29.50 C ATOM 413 O LEU A 726 4.719 26.507 21.958 1.00 28.73 O ATOM 414 CB LEU A 726 6.895 24.215 20.857 1.00 30.88 C ATOM 415 CG LEU A 726 5.583 23.541 20.431 1.00 32.59 C ATOM 416 CD1 LEU A 726 5.164 23.995 19.037 1.00 32.23 C ATOM 417 CD2 LEU A 726 5.748 22.035 20.464 1.00 33.25 C ATOM 418 H LEU A 726 8.925 25.607 21.612 1.00 0.00 H ATOM 419 N LEU A 727 6.259 25.807 23.451 1.00 28.69 N ATOM 420 CA LEU A 727 5.409 26.086 24.603 1.00 30.23 C ATOM 421 C LEU A 727 5.091 27.574 24.649 1.00 30.17 C ATOM 422 O LEU A 727 3.991 27.971 25.046 1.00 31.23 O ATOM 423 CB LEU A 727 6.074 25.641 25.914 1.00 29.58 C ATOM 424 CG LEU A 727 6.421 24.148 25.992 1.00 32.31 C ATOM 425 CD1 LEU A 727 7.169 23.843 27.287 1.00 32.40 C ATOM 426 CD2 LEU A 727 5.159 23.296 25.883 1.00 30.97 C ATOM 427 H LEU A 727 7.211 25.416 23.601 1.00 0.00 H ATOM 428 N SER A 728 6.042 28.389 24.201 1.00 29.00 N ATOM 429 CA SER A 728 5.856 29.832 24.180 1.00 28.84 C ATOM 430 C SER A 728 4.824 30.246 23.114 1.00 28.84 C ATOM 431 O SER A 728 4.049 31.181 23.322 1.00 28.51 O ATOM 432 CB SER A 728 7.192 30.526 23.934 1.00 28.81 C ATOM 433 OG SER A 728 7.077 31.926 24.136 1.00 30.67 O ATOM 434 HG SER A 728 7.954 32.355 23.971 1.00 0.00 H ATOM 435 H SER A 728 6.938 27.986 23.858 1.00 0.00 H ATOM 436 N VAL A 729 4.824 29.552 21.975 1.00 28.39 N ATOM 437 CA VAL A 729 3.877 29.833 20.894 1.00 27.43 C ATOM 438 C VAL A 729 2.465 29.548 21.397 1.00 26.63 C ATOM 439 O VAL A 729 1.551 30.348 21.193 1.00 27.09 O ATOM 440 CB VAL A 729 4.173 28.967 19.633 1.00 27.89 C ATOM 441 CG1 VAL A 729 3.011 29.011 18.665 1.00 28.89 C ATOM 442 CG2 VAL A 729 5.437 29.457 18.931 1.00 27.58 C ATOM 443 H VAL A 729 5.518 28.788 21.851 1.00 0.00 H ATOM 444 N VAL A 730 2.299 28.417 22.078 1.00 25.54 N ATOM 445 CA VAL A 730 1.001 28.040 22.628 1.00 25.68 C ATOM 446 C VAL A 730 0.516 29.064 23.660 1.00 26.46 C ATOM 447 O VAL A 730 -0.632 29.507 23.608 1.00 26.04 O ATOM 448 CB VAL A 730 1.043 26.631 23.269 1.00 25.04 C ATOM 449 CG1 VAL A 730 -0.222 26.379 24.086 1.00 22.20 C ATOM 450 CG2 VAL A 730 1.176 25.575 22.181 1.00 22.33 C ATOM 451 H VAL A 730 3.114 27.787 22.222 1.00 0.00 H ATOM 452 N LYS A 731 1.410 29.457 24.565 1.00 26.67 N ATOM 453 CA LYS A 731 1.097 30.428 25.613 1.00 27.82 C ATOM 454 C LYS A 731 0.739 31.793 25.025 1.00 27.14 C ATOM 455 O LYS A 731 -0.151 32.487 25.532 1.00 27.51 O ATOM 456 CB LYS A 731 2.285 30.557 26.572 1.00 30.03 C ATOM 457 CG LYS A 731 2.016 31.413 27.797 1.00 34.47 C ATOM 458 CD LYS A 731 3.249 31.515 28.684 1.00 38.18 C ATOM 459 CE LYS A 731 3.000 32.439 29.879 1.00 41.17 C ATOM 460 NZ LYS A 731 1.973 31.890 30.825 1.00 42.85 N ATOM 461 HZ1 LYS A 731 1.071 31.766 30.322 1.00 0.00 H ATOM 462 HZ2 LYS A 731 2.296 30.972 31.191 1.00 0.00 H ATOM 463 HZ3 LYS A 731 1.842 32.553 31.615 1.00 0.00 H ATOM 464 H LYS A 731 2.369 29.057 24.525 1.00 0.00 H ATOM 465 N TRP A 732 1.439 32.171 23.957 1.00 26.05 N ATOM 466 CA TRP A 732 1.206 33.438 23.272 1.00 25.00 C ATOM 467 C TRP A 732 -0.166 33.448 22.579 1.00 26.10 C ATOM 468 O TRP A 732 -0.908 34.429 22.668 1.00 25.12 O ATOM 469 CB TRP A 732 2.328 33.683 22.256 1.00 23.55 C ATOM 470 CG TRP A 732 2.049 34.768 21.249 1.00 21.89 C ATOM 471 CD1 TRP A 732 2.097 36.117 21.457 1.00 20.86 C ATOM 472 CD2 TRP A 732 1.702 34.585 19.868 1.00 20.28 C ATOM 473 NE1 TRP A 732 1.806 36.785 20.290 1.00 22.06 N ATOM 474 CE2 TRP A 732 1.561 35.868 19.300 1.00 21.24 C ATOM 475 CE3 TRP A 732 1.499 33.458 19.058 1.00 21.05 C ATOM 476 CZ2 TRP A 732 1.227 36.061 17.951 1.00 21.52 C ATOM 477 CZ3 TRP A 732 1.167 33.647 17.716 1.00 21.62 C ATOM 478 CH2 TRP A 732 1.034 34.942 17.177 1.00 22.20 C ATOM 479 HE1 TRP A 732 1.777 37.818 20.177 1.00 0.00 H ATOM 480 H TRP A 732 2.181 31.538 23.597 1.00 0.00 H ATOM 481 N SER A 733 -0.502 32.341 21.918 1.00 26.63 N ATOM 482 CA SER A 733 -1.773 32.202 21.206 1.00 29.26 C ATOM 483 C SER A 733 -3.025 32.346 22.087 1.00 30.43 C ATOM 484 O SER A 733 -4.046 32.865 21.641 1.00 31.79 O ATOM 485 CB SER A 733 -1.820 30.858 20.472 1.00 29.46 C ATOM 486 OG SER A 733 -2.028 29.791 21.382 1.00 30.25 O ATOM 487 HG SER A 733 -1.287 29.770 22.039 1.00 0.00 H ATOM 488 H SER A 733 0.166 31.544 21.908 1.00 0.00 H ATOM 489 N LYS A 734 -2.945 31.883 23.330 1.00 31.43 N ATOM 490 CA LYS A 734 -4.073 31.968 24.258 1.00 32.63 C ATOM 491 C LYS A 734 -4.358 33.392 24.751 1.00 32.42 C ATOM 492 O LYS A 734 -5.433 33.665 25.286 1.00 33.92 O ATOM 493 CB LYS A 734 -3.844 31.038 25.453 1.00 33.11 C ATOM 494 CG LYS A 734 -3.671 29.578 25.063 1.00 35.29 C ATOM 495 CD LYS A 734 -3.644 28.661 26.278 1.00 37.25 C ATOM 496 CE LYS A 734 -2.502 28.986 27.218 1.00 38.72 C ATOM 497 NZ LYS A 734 -2.568 28.134 28.444 1.00 39.96 N ATOM 498 HZ1 LYS A 734 -3.468 28.306 28.936 1.00 0.00 H ATOM 499 HZ2 LYS A 734 -2.506 27.132 28.172 1.00 0.00 H ATOM 500 HZ3 LYS A 734 -1.776 28.373 29.074 1.00 0.00 H ATOM 501 H LYS A 734 -2.057 31.448 23.652 1.00 0.00 H ATOM 502 N SER A 735 -3.392 34.290 24.575 1.00 31.26 N ATOM 503 CA SER A 735 -3.531 35.678 25.002 1.00 29.34 C ATOM 504 C SER A 735 -3.951 36.536 23.812 1.00 27.74 C ATOM 505 O SER A 735 -4.180 37.742 23.932 1.00 27.39 O ATOM 506 CB SER A 735 -2.191 36.186 25.546 1.00 30.23 C ATOM 507 OG SER A 735 -1.601 35.245 26.431 1.00 33.12 O ATOM 508 HG SER A 735 -1.443 34.395 25.949 1.00 0.00 H ATOM 509 H SER A 735 -2.507 33.992 24.117 1.00 0.00 H ATOM 510 N LEU A 736 -4.080 35.888 22.664 1.00 25.71 N ATOM 511 CA LEU A 736 -4.433 36.556 21.424 1.00 24.75 C ATOM 512 C LEU A 736 -5.938 36.766 21.281 1.00 23.59 C ATOM 513 O LEU A 736 -6.695 35.804 21.205 1.00 23.94 O ATOM 514 CB LEU A 736 -3.910 35.704 20.275 1.00 25.60 C ATOM 515 CG LEU A 736 -3.657 36.326 18.911 1.00 26.32 C ATOM 516 CD1 LEU A 736 -2.810 37.589 19.044 1.00 27.10 C ATOM 517 CD2 LEU A 736 -2.936 35.284 18.081 1.00 26.88 C ATOM 518 H LEU A 736 -3.922 34.860 22.650 1.00 0.00 H ATOM 519 N PRO A 737 -6.394 38.032 21.243 1.00 23.69 N ATOM 520 CA PRO A 737 -7.832 38.313 21.103 1.00 22.81 C ATOM 521 C PRO A 737 -8.431 37.578 19.903 1.00 23.54 C ATOM 522 O PRO A 737 -7.896 37.640 18.789 1.00 23.47 O ATOM 523 CB PRO A 737 -7.863 39.824 20.910 1.00 20.98 C ATOM 524 CG PRO A 737 -6.720 40.277 21.786 1.00 22.60 C ATOM 525 CD PRO A 737 -5.628 39.280 21.409 1.00 22.24 C ATOM 526 N GLY A 738 -9.493 36.819 20.164 1.00 23.31 N ATOM 527 CA GLY A 738 -10.152 36.063 19.115 1.00 23.49 C ATOM 528 C GLY A 738 -9.806 34.581 19.078 1.00 24.53 C ATOM 529 O GLY A 738 -10.647 33.761 18.710 1.00 26.08 O ATOM 530 H GLY A 738 -9.857 36.767 21.137 1.00 0.00 H ATOM 531 N PHE A 739 -8.591 34.227 19.485 1.00 23.00 N ATOM 532 CA PHE A 739 -8.156 32.839 19.458 1.00 23.91 C ATOM 533 C PHE A 739 -8.955 31.868 20.337 1.00 24.79 C ATOM 534 O PHE A 739 -9.221 30.736 19.931 1.00 24.30 O ATOM 535 CB PHE A 739 -6.667 32.744 19.801 1.00 23.01 C ATOM 536 CG PHE A 739 -6.062 31.396 19.499 1.00 22.49 C ATOM 537 CD1 PHE A 739 -5.804 31.019 18.183 1.00 21.75 C ATOM 538 CD2 PHE A 739 -5.729 30.516 20.529 1.00 20.92 C ATOM 539 CE1 PHE A 739 -5.218 29.776 17.889 1.00 21.96 C ATOM 540 CE2 PHE A 739 -5.140 29.273 20.249 1.00 21.49 C ATOM 541 CZ PHE A 739 -4.885 28.905 18.922 1.00 21.29 C ATOM 542 H PHE A 739 -7.937 34.958 19.830 1.00 0.00 H ATOM 543 N ARG A 740 -9.310 32.296 21.542 1.00 26.12 N ATOM 544 CA ARG A 740 -10.064 31.444 22.458 1.00 28.75 C ATOM 545 C ARG A 740 -11.516 31.197 22.055 1.00 28.23 C ATOM 546 O ARG A 740 -12.150 30.275 22.561 1.00 27.91 O ATOM 547 CB ARG A 740 -9.993 31.988 23.886 1.00 30.57 C ATOM 548 CG ARG A 740 -8.671 31.689 24.586 1.00 35.30 C ATOM 549 CD ARG A 740 -8.249 30.241 24.343 1.00 39.69 C ATOM 550 NE ARG A 740 -7.495 29.684 25.465 1.00 43.67 N ATOM 551 CZ ARG A 740 -7.302 28.380 25.672 1.00 45.28 C ATOM 552 NH1 ARG A 740 -7.799 27.477 24.830 1.00 43.55 N ATOM 553 NH2 ARG A 740 -6.638 27.974 26.750 1.00 46.71 N ATOM 554 HE ARG A 740 -7.081 30.350 26.148 1.00 0.00 H ATOM 555 HH12 ARG A 740 -7.642 26.463 25.002 1.00 0.00 H ATOM 556 HH11 ARG A 740 -8.345 27.785 24.000 1.00 0.00 H ATOM 557 HH22 ARG A 740 -6.485 26.959 26.915 1.00 0.00 H ATOM 558 HH21 ARG A 740 -6.271 28.672 27.428 1.00 0.00 H ATOM 559 H ARG A 740 -9.046 33.257 21.840 1.00 0.00 H ATOM 560 N ASN A 741 -12.035 32.024 21.152 1.00 28.62 N ATOM 561 CA ASN A 741 -13.402 31.880 20.659 1.00 29.76 C ATOM 562 C ASN A 741 -13.512 30.637 19.785 1.00 29.99 C ATOM 563 O ASN A 741 -14.598 30.087 19.612 1.00 29.35 O ATOM 564 CB ASN A 741 -13.797 33.087 19.795 1.00 31.07 C ATOM 565 CG ASN A 741 -14.099 34.325 20.610 1.00 32.81 C ATOM 566 OD1 ASN A 741 -14.292 34.259 21.827 1.00 32.82 O ATOM 567 ND2 ASN A 741 -14.159 35.469 19.934 1.00 33.36 N ATOM 568 HD22 ASN A 741 -13.989 35.476 18.908 1.00 0.00 H ATOM 569 HD21 ASN A 741 -14.376 36.356 20.431 1.00 0.00 H ATOM 570 H ASN A 741 -11.447 32.799 20.785 1.00 0.00 H ATOM 571 N LEU A 742 -12.388 30.231 19.202 1.00 28.97 N ATOM 572 CA LEU A 742 -12.362 29.081 18.315 1.00 29.72 C ATOM 573 C LEU A 742 -12.414 27.748 19.050 1.00 30.36 C ATOM 574 O LEU A 742 -11.940 27.619 20.183 1.00 28.66 O ATOM 575 CB LEU A 742 -11.114 29.135 17.422 1.00 29.71 C ATOM 576 CG LEU A 742 -10.841 30.437 16.658 1.00 29.76 C ATOM 577 CD1 LEU A 742 -9.512 30.339 15.931 1.00 27.44 C ATOM 578 CD2 LEU A 742 -11.963 30.734 15.674 1.00 28.45 C ATOM 579 H LEU A 742 -11.506 30.750 19.386 1.00 0.00 H ATOM 580 N HIS A 743 -12.999 26.759 18.382 1.00 31.96 N ATOM 581 CA HIS A 743 -13.120 25.409 18.913 1.00 33.91 C ATOM 582 C HIS A 743 -11.706 24.890 19.219 1.00 34.64 C ATOM 583 O HIS A 743 -10.763 25.185 18.482 1.00 34.03 O ATOM 584 CB HIS A 743 -13.803 24.520 17.867 1.00 36.33 C ATOM 585 CG HIS A 743 -14.164 23.156 18.368 1.00 39.60 C ATOM 586 ND1 HIS A 743 -13.218 22.211 18.708 1.00 40.45 N ATOM 587 CD2 HIS A 743 -15.369 22.580 18.591 1.00 39.99 C ATOM 588 CE1 HIS A 743 -13.825 21.112 19.120 1.00 41.29 C ATOM 589 NE2 HIS A 743 -15.130 21.309 19.058 1.00 42.22 N ATOM 590 H HIS A 743 -13.388 26.958 17.438 1.00 0.00 H ATOM 591 N ILE A 744 -11.568 24.140 20.314 1.00 34.68 N ATOM 592 CA ILE A 744 -10.278 23.593 20.738 1.00 34.09 C ATOM 593 C ILE A 744 -9.549 22.871 19.603 1.00 34.35 C ATOM 594 O ILE A 744 -8.324 22.926 19.525 1.00 33.91 O ATOM 595 CB ILE A 744 -10.441 22.639 21.963 1.00 34.38 C ATOM 596 CG1 ILE A 744 -9.072 22.258 22.548 1.00 34.01 C ATOM 597 CG2 ILE A 744 -11.211 21.383 21.565 1.00 34.18 C ATOM 598 CD1 ILE A 744 -8.298 23.430 23.130 1.00 33.32 C ATOM 599 H ILE A 744 -12.410 23.936 20.889 1.00 0.00 H ATOM 600 N ASP A 745 -10.308 22.222 18.719 1.00 35.26 N ATOM 601 CA ASP A 745 -9.746 21.495 17.580 1.00 35.79 C ATOM 602 C ASP A 745 -9.178 22.436 16.515 1.00 35.34 C ATOM 603 O ASP A 745 -8.252 22.074 15.787 1.00 36.36 O ATOM 604 CB ASP A 745 -10.797 20.574 16.954 1.00 37.71 C ATOM 605 CG ASP A 745 -10.984 19.268 17.728 1.00 41.80 C ATOM 606 OD1 ASP A 745 -10.374 19.084 18.810 1.00 42.33 O ATOM 607 OD2 ASP A 745 -11.755 18.412 17.242 1.00 44.23 O ATOM 608 H ASP A 745 -11.340 22.233 18.844 1.00 0.00 H ATOM 609 N ASP A 746 -9.763 23.624 16.396 1.00 34.04 N ATOM 610 CA ASP A 746 -9.282 24.614 15.444 1.00 32.92 C ATOM 611 C ASP A 746 -7.988 25.200 16.000 1.00 31.76 C ATOM 612 O ASP A 746 -7.021 25.402 15.265 1.00 32.57 O ATOM 613 CB ASP A 746 -10.309 25.731 15.249 1.00 34.50 C ATOM 614 CG ASP A 746 -11.639 25.226 14.705 1.00 36.19 C ATOM 615 OD1 ASP A 746 -11.708 24.070 14.227 1.00 36.65 O ATOM 616 OD2 ASP A 746 -12.622 26.002 14.752 1.00 36.84 O ATOM 617 H ASP A 746 -10.582 23.851 16.996 1.00 0.00 H ATOM 618 N GLN A 747 -7.972 25.440 17.309 1.00 29.16 N ATOM 619 CA GLN A 747 -6.805 25.988 17.988 1.00 28.14 C ATOM 620 C GLN A 747 -5.588 25.079 17.800 1.00 28.47 C ATOM 621 O GLN A 747 -4.488 25.560 17.524 1.00 28.12 O ATOM 622 CB GLN A 747 -7.089 26.186 19.482 1.00 25.57 C ATOM 623 CG GLN A 747 -8.167 27.228 19.790 1.00 26.08 C ATOM 624 CD GLN A 747 -8.428 27.399 21.291 1.00 26.45 C ATOM 625 OE1 GLN A 747 -7.499 27.486 22.090 1.00 26.72 O ATOM 626 NE2 GLN A 747 -9.697 27.457 21.668 1.00 25.56 N ATOM 627 HE22 GLN A 747 -10.454 27.379 20.959 1.00 0.00 H ATOM 628 HE21 GLN A 747 -9.936 27.580 22.673 1.00 0.00 H ATOM 629 H GLN A 747 -8.823 25.229 17.868 1.00 0.00 H ATOM 630 N ILE A 748 -5.798 23.769 17.924 1.00 28.25 N ATOM 631 CA ILE A 748 -4.724 22.794 17.772 1.00 27.83 C ATOM 632 C ILE A 748 -4.211 22.777 16.338 1.00 27.91 C ATOM 633 O ILE A 748 -3.006 22.868 16.094 1.00 27.63 O ATOM 634 CB ILE A 748 -5.200 21.383 18.175 1.00 28.15 C ATOM 635 CG1 ILE A 748 -5.594 21.380 19.658 1.00 28.49 C ATOM 636 CG2 ILE A 748 -4.092 20.362 17.932 1.00 27.89 C ATOM 637 CD1 ILE A 748 -6.305 20.128 20.116 1.00 27.89 C ATOM 638 H ILE A 748 -6.758 23.431 18.136 1.00 0.00 H ATOM 639 N THR A 749 -5.144 22.700 15.396 1.00 28.03 N ATOM 640 CA THR A 749 -4.832 22.685 13.973 1.00 27.11 C ATOM 641 C THR A 749 -3.983 23.883 13.540 1.00 26.82 C ATOM 642 O THR A 749 -2.940 23.711 12.900 1.00 27.42 O ATOM 643 CB THR A 749 -6.132 22.651 13.142 1.00 26.62 C ATOM 644 OG1 THR A 749 -6.826 21.426 13.407 1.00 26.96 O ATOM 645 CG2 THR A 749 -5.841 22.756 11.657 1.00 24.01 C ATOM 646 HG1 THR A 749 -7.045 21.374 14.371 1.00 0.00 H ATOM 647 H THR A 749 -6.141 22.648 15.687 1.00 0.00 H ATOM 648 N LEU A 750 -4.433 25.088 13.887 1.00 26.08 N ATOM 649 CA LEU A 750 -3.724 26.313 13.523 1.00 26.47 C ATOM 650 C LEU A 750 -2.285 26.327 14.031 1.00 27.42 C ATOM 651 O LEU A 750 -1.377 26.732 13.309 1.00 26.94 O ATOM 652 CB LEU A 750 -4.484 27.547 14.016 1.00 24.93 C ATOM 653 CG LEU A 750 -5.841 27.759 13.333 1.00 24.30 C ATOM 654 CD1 LEU A 750 -6.603 28.911 13.993 1.00 21.81 C ATOM 655 CD2 LEU A 750 -5.648 28.000 11.834 1.00 19.36 C ATOM 656 H LEU A 750 -5.315 25.159 14.433 1.00 0.00 H ATOM 657 N ILE A 751 -2.074 25.856 15.257 1.00 26.86 N ATOM 658 CA ILE A 751 -0.731 25.806 15.810 1.00 27.63 C ATOM 659 C ILE A 751 0.113 24.749 15.080 1.00 28.66 C ATOM 660 O ILE A 751 1.291 24.979 14.801 1.00 29.57 O ATOM 661 CB ILE A 751 -0.757 25.568 17.337 1.00 27.06 C ATOM 662 CG1 ILE A 751 -1.404 26.774 18.026 1.00 25.39 C ATOM 663 CG2 ILE A 751 0.663 25.362 17.878 1.00 26.66 C ATOM 664 CD1 ILE A 751 -1.560 26.615 19.527 1.00 24.73 C ATOM 665 H ILE A 751 -2.878 25.520 15.825 1.00 0.00 H ATOM 666 N GLN A 752 -0.498 23.620 14.724 1.00 29.48 N ATOM 667 CA GLN A 752 0.214 22.567 13.996 1.00 30.91 C ATOM 668 C GLN A 752 0.687 23.089 12.640 1.00 30.16 C ATOM 669 O GLN A 752 1.808 22.817 12.226 1.00 29.95 O ATOM 670 CB GLN A 752 -0.669 21.334 13.787 1.00 32.67 C ATOM 671 CG GLN A 752 -0.882 20.479 15.034 1.00 38.35 C ATOM 672 CD GLN A 752 -1.674 19.204 14.739 1.00 42.25 C ATOM 673 OE1 GLN A 752 -2.799 19.260 14.230 1.00 45.24 O ATOM 674 NE2 GLN A 752 -1.080 18.050 15.043 1.00 43.00 N ATOM 675 HE22 GLN A 752 -0.132 18.050 15.470 1.00 0.00 H ATOM 676 HE21 GLN A 752 -1.565 17.150 14.853 1.00 0.00 H ATOM 677 H GLN A 752 -1.500 23.484 14.968 1.00 0.00 H ATOM 678 N TYR A 753 -0.166 23.858 11.969 1.00 30.50 N ATOM 679 CA TYR A 753 0.162 24.430 10.668 1.00 31.39 C ATOM 680 C TYR A 753 0.896 25.776 10.741 1.00 29.97 C ATOM 681 O TYR A 753 1.083 26.410 9.709 1.00 32.08 O ATOM 682 CB TYR A 753 -1.110 24.640 9.827 1.00 33.75 C ATOM 683 CG TYR A 753 -1.908 23.397 9.484 1.00 36.64 C ATOM 684 CD1 TYR A 753 -1.481 22.126 9.874 1.00 38.01 C ATOM 685 CD2 TYR A 753 -3.104 23.499 8.768 1.00 39.19 C ATOM 686 CE1 TYR A 753 -2.226 20.984 9.558 1.00 40.40 C ATOM 687 CE2 TYR A 753 -3.860 22.365 8.445 1.00 40.63 C ATOM 688 CZ TYR A 753 -3.414 21.109 8.845 1.00 41.55 C ATOM 689 OH TYR A 753 -4.156 19.984 8.543 1.00 43.23 O ATOM 690 HH TYR A 753 -3.697 19.182 8.899 1.00 0.00 H ATOM 691 H TYR A 753 -1.098 24.058 12.386 1.00 0.00 H ATOM 692 N SER A 754 1.325 26.214 11.924 1.00 27.54 N ATOM 693 CA SER A 754 1.996 27.515 12.027 1.00 25.80 C ATOM 694 C SER A 754 3.283 27.600 12.832 1.00 25.35 C ATOM 695 O SER A 754 4.061 28.533 12.621 1.00 24.05 O ATOM 696 CB SER A 754 1.045 28.568 12.600 1.00 24.76 C ATOM 697 OG SER A 754 -0.149 28.644 11.860 1.00 28.07 O ATOM 698 HG SER A 754 -0.605 27.766 11.881 1.00 0.00 H ATOM 699 H SER A 754 1.184 25.633 12.775 1.00 0.00 H ATOM 700 N TRP A 755 3.513 26.659 13.753 1.00 24.29 N ATOM 701 CA TRP A 755 4.710 26.727 14.591 1.00 25.53 C ATOM 702 C TRP A 755 6.040 26.963 13.877 1.00 25.31 C ATOM 703 O TRP A 755 6.853 27.757 14.361 1.00 25.68 O ATOM 704 CB TRP A 755 4.795 25.560 15.591 1.00 25.94 C ATOM 705 CG TRP A 755 4.993 24.195 14.997 1.00 26.53 C ATOM 706 CD1 TRP A 755 4.026 23.276 14.718 1.00 25.92 C ATOM 707 CD2 TRP A 755 6.245 23.585 14.641 1.00 26.99 C ATOM 708 NE1 TRP A 755 4.595 22.132 14.210 1.00 28.29 N ATOM 709 CE2 TRP A 755 5.955 22.295 14.152 1.00 26.96 C ATOM 710 CE3 TRP A 755 7.584 24.007 14.691 1.00 25.45 C ATOM 711 CZ2 TRP A 755 6.955 21.417 13.709 1.00 26.48 C ATOM 712 CZ3 TRP A 755 8.575 23.140 14.253 1.00 25.77 C ATOM 713 CH2 TRP A 755 8.256 21.858 13.767 1.00 26.41 C ATOM 714 HE1 TRP A 755 4.077 21.279 13.917 1.00 0.00 H ATOM 715 H TRP A 755 2.839 25.876 13.874 1.00 0.00 H ATOM 716 N MET A 756 6.239 26.338 12.712 1.00 24.38 N ATOM 717 CA MET A 756 7.485 26.513 11.951 1.00 23.82 C ATOM 718 C MET A 756 7.615 27.933 11.435 1.00 23.17 C ATOM 719 O MET A 756 8.665 28.550 11.565 1.00 24.40 O ATOM 720 CB MET A 756 7.539 25.572 10.752 1.00 26.03 C ATOM 721 CG MET A 756 8.836 25.588 9.977 1.00 30.16 C ATOM 722 SD MET A 756 10.328 25.238 10.919 1.00 33.04 S ATOM 723 CE MET A 756 10.245 23.482 10.916 1.00 31.18 C ATOM 724 H MET A 756 5.496 25.715 12.336 1.00 0.00 H ATOM 725 N SER A 757 6.551 28.434 10.818 1.00 21.92 N ATOM 726 CA SER A 757 6.545 29.785 10.277 1.00 22.29 C ATOM 727 C SER A 757 6.801 30.813 11.377 1.00 22.34 C ATOM 728 O SER A 757 7.640 31.700 11.219 1.00 20.70 O ATOM 729 CB SER A 757 5.207 30.074 9.598 1.00 21.14 C ATOM 730 OG SER A 757 4.945 29.106 8.603 1.00 23.26 O ATOM 731 HG SER A 757 4.076 29.305 8.172 1.00 0.00 H ATOM 732 H SER A 757 5.699 27.845 10.719 1.00 0.00 H ATOM 733 N LEU A 758 6.078 30.678 12.488 1.00 21.81 N ATOM 734 CA LEU A 758 6.221 31.586 13.620 1.00 22.49 C ATOM 735 C LEU A 758 7.648 31.588 14.179 1.00 22.41 C ATOM 736 O LEU A 758 8.194 32.648 14.481 1.00 22.97 O ATOM 737 CB LEU A 758 5.223 31.217 14.731 1.00 21.99 C ATOM 738 CG LEU A 758 3.733 31.427 14.432 1.00 21.37 C ATOM 739 CD1 LEU A 758 2.871 30.807 15.521 1.00 20.82 C ATOM 740 CD2 LEU A 758 3.439 32.907 14.307 1.00 21.24 C ATOM 741 H LEU A 758 5.390 29.901 12.550 1.00 0.00 H ATOM 742 N MET A 759 8.259 30.409 14.285 1.00 22.48 N ATOM 743 CA MET A 759 9.617 30.314 14.814 1.00 23.61 C ATOM 744 C MET A 759 10.677 30.939 13.905 1.00 23.24 C ATOM 745 O MET A 759 11.580 31.628 14.394 1.00 24.28 O ATOM 746 CB MET A 759 9.996 28.853 15.057 1.00 25.26 C ATOM 747 CG MET A 759 9.319 28.230 16.266 1.00 26.70 C ATOM 748 SD MET A 759 9.950 26.585 16.645 1.00 30.31 S ATOM 749 CE MET A 759 9.146 26.267 18.214 1.00 28.82 C ATOM 750 H MET A 759 7.763 29.545 13.987 1.00 0.00 H ATOM 751 N VAL A 760 10.558 30.733 12.592 1.00 21.87 N ATOM 752 CA VAL A 760 11.522 31.314 11.668 1.00 22.08 C ATOM 753 C VAL A 760 11.283 32.821 11.453 1.00 21.84 C ATOM 754 O VAL A 760 12.200 33.553 11.093 1.00 22.38 O ATOM 755 CB VAL A 760 11.557 30.556 10.310 1.00 23.66 C ATOM 756 CG1 VAL A 760 10.421 31.002 9.392 1.00 24.50 C ATOM 757 CG2 VAL A 760 12.909 30.764 9.629 1.00 26.15 C ATOM 758 H VAL A 760 9.774 30.155 12.227 1.00 0.00 H ATOM 759 N PHE A 761 10.054 33.279 11.684 1.00 20.54 N ATOM 760 CA PHE A 761 9.714 34.698 11.536 1.00 19.72 C ATOM 761 C PHE A 761 10.273 35.429 12.766 1.00 19.75 C ATOM 762 O PHE A 761 10.787 36.548 12.660 1.00 19.76 O ATOM 763 CB PHE A 761 8.193 34.864 11.460 1.00 18.87 C ATOM 764 CG PHE A 761 7.736 36.140 10.807 1.00 17.79 C ATOM 765 CD1 PHE A 761 8.002 36.389 9.456 1.00 18.11 C ATOM 766 CD2 PHE A 761 6.977 37.071 11.520 1.00 16.89 C ATOM 767 CE1 PHE A 761 7.511 37.548 8.819 1.00 15.86 C ATOM 768 CE2 PHE A 761 6.483 38.234 10.894 1.00 14.63 C ATOM 769 CZ PHE A 761 6.748 38.470 9.544 1.00 16.35 C ATOM 770 H PHE A 761 9.313 32.611 11.978 1.00 0.00 H ATOM 771 N GLY A 762 10.178 34.781 13.928 1.00 18.43 N ATOM 772 CA GLY A 762 10.694 35.362 15.161 1.00 19.98 C ATOM 773 C GLY A 762 12.213 35.469 15.100 1.00 20.25 C ATOM 774 O GLY A 762 12.802 36.454 15.548 1.00 19.46 O ATOM 775 H GLY A 762 9.727 33.844 13.955 1.00 0.00 H ATOM 776 N LEU A 763 12.841 34.441 14.533 1.00 21.90 N ATOM 777 CA LEU A 763 14.290 34.408 14.355 1.00 22.84 C ATOM 778 C LEU A 763 14.663 35.575 13.439 1.00 22.91 C ATOM 779 O LEU A 763 15.636 36.293 13.684 1.00 23.90 O ATOM 780 CB LEU A 763 14.710 33.085 13.707 1.00 21.82 C ATOM 781 CG LEU A 763 16.163 32.941 13.240 1.00 24.09 C ATOM 782 CD1 LEU A 763 17.084 32.848 14.450 1.00 22.05 C ATOM 783 CD2 LEU A 763 16.312 31.703 12.345 1.00 21.74 C ATOM 784 H LEU A 763 12.278 33.631 14.204 1.00 0.00 H ATOM 785 N GLY A 764 13.847 35.790 12.410 1.00 22.92 N ATOM 786 CA GLY A 764 14.111 36.877 11.485 1.00 21.88 C ATOM 787 C GLY A 764 14.114 38.235 12.161 1.00 21.29 C ATOM 788 O GLY A 764 14.967 39.072 11.868 1.00 20.05 O ATOM 789 H GLY A 764 13.018 35.178 12.268 1.00 0.00 H ATOM 790 N TRP A 765 13.152 38.454 13.055 1.00 20.92 N ATOM 791 CA TRP A 765 13.037 39.719 13.773 1.00 20.86 C ATOM 792 C TRP A 765 14.218 39.963 14.709 1.00 21.10 C ATOM 793 O TRP A 765 14.801 41.044 14.700 1.00 21.41 O ATOM 794 CB TRP A 765 11.729 39.772 14.565 1.00 21.00 C ATOM 795 CG TRP A 765 11.509 41.092 15.241 1.00 21.00 C ATOM 796 CD1 TRP A 765 11.550 41.346 16.586 1.00 19.51 C ATOM 797 CD2 TRP A 765 11.273 42.355 14.600 1.00 21.60 C ATOM 798 NE1 TRP A 765 11.363 42.688 16.819 1.00 22.07 N ATOM 799 CE2 TRP A 765 11.193 43.331 15.619 1.00 22.06 C ATOM 800 CE3 TRP A 765 11.125 42.755 13.263 1.00 20.95 C ATOM 801 CZ2 TRP A 765 10.977 44.687 15.343 1.00 23.14 C ATOM 802 CZ3 TRP A 765 10.909 44.105 12.988 1.00 21.93 C ATOM 803 CH2 TRP A 765 10.838 45.053 14.023 1.00 21.19 C ATOM 804 HE1 TRP A 765 11.352 43.143 17.754 1.00 0.00 H ATOM 805 H TRP A 765 12.462 37.700 13.247 1.00 0.00 H ATOM 806 N ARG A 766 14.555 38.964 15.522 1.00 21.35 N ATOM 807 CA ARG A 766 15.674 39.079 16.461 1.00 22.42 C ATOM 808 C ARG A 766 16.999 39.354 15.737 1.00 22.22 C ATOM 809 O ARG A 766 17.769 40.225 16.151 1.00 23.25 O ATOM 810 CB ARG A 766 15.802 37.814 17.318 1.00 20.93 C ATOM 811 CG ARG A 766 14.652 37.602 18.286 1.00 21.30 C ATOM 812 CD ARG A 766 14.934 36.469 19.280 1.00 20.59 C ATOM 813 NE ARG A 766 15.209 35.196 18.614 1.00 21.49 N ATOM 814 CZ ARG A 766 14.279 34.338 18.198 1.00 21.67 C ATOM 815 NH1 ARG A 766 12.993 34.607 18.370 1.00 22.08 N ATOM 816 NH2 ARG A 766 14.637 33.191 17.630 1.00 20.64 N ATOM 817 HE ARG A 766 16.205 34.942 18.453 1.00 0.00 H ATOM 818 HH12 ARG A 766 12.272 33.932 18.043 1.00 0.00 H ATOM 819 HH11 ARG A 766 12.704 35.493 18.832 1.00 0.00 H ATOM 820 HH22 ARG A 766 13.910 32.522 17.306 1.00 0.00 H ATOM 821 HH21 ARG A 766 15.644 32.962 17.510 1.00 0.00 H ATOM 822 H ARG A 766 14.010 38.079 15.490 1.00 0.00 H ATOM 823 N SER A 767 17.236 38.634 14.642 1.00 20.80 N ATOM 824 CA SER A 767 18.452 38.803 13.861 1.00 20.87 C ATOM 825 C SER A 767 18.506 40.222 13.293 1.00 22.53 C ATOM 826 O SER A 767 19.560 40.861 13.275 1.00 21.97 O ATOM 827 CB SER A 767 18.504 37.767 12.733 1.00 20.79 C ATOM 828 OG SER A 767 18.461 36.443 13.250 1.00 16.82 O ATOM 829 HG SER A 767 17.621 36.316 13.759 1.00 0.00 H ATOM 830 H SER A 767 16.532 37.932 14.337 1.00 0.00 H ATOM 831 N TYR A 768 17.347 40.715 12.868 1.00 23.69 N ATOM 832 CA TYR A 768 17.197 42.054 12.313 1.00 24.73 C ATOM 833 C TYR A 768 17.463 43.139 13.364 1.00 27.00 C ATOM 834 O TYR A 768 18.283 44.030 13.143 1.00 25.83 O ATOM 835 CB TYR A 768 15.782 42.192 11.735 1.00 24.44 C ATOM 836 CG TYR A 768 15.315 43.598 11.398 1.00 23.28 C ATOM 837 CD1 TYR A 768 15.975 44.370 10.442 1.00 23.05 C ATOM 838 CD2 TYR A 768 14.165 44.127 11.991 1.00 21.98 C ATOM 839 CE1 TYR A 768 15.499 45.632 10.078 1.00 22.69 C ATOM 840 CE2 TYR A 768 13.683 45.388 11.633 1.00 22.34 C ATOM 841 CZ TYR A 768 14.356 46.132 10.676 1.00 23.84 C ATOM 842 OH TYR A 768 13.878 47.368 10.302 1.00 24.37 O ATOM 843 HH TYR A 768 12.966 47.269 9.931 1.00 0.00 H ATOM 844 H TYR A 768 16.502 40.113 12.935 1.00 0.00 H ATOM 845 N LYS A 769 16.797 43.042 14.513 1.00 28.73 N ATOM 846 CA LYS A 769 16.954 44.039 15.575 1.00 31.63 C ATOM 847 C LYS A 769 18.252 44.041 16.371 1.00 31.92 C ATOM 848 O LYS A 769 18.799 45.109 16.669 1.00 31.64 O ATOM 849 CB LYS A 769 15.765 44.002 16.545 1.00 32.71 C ATOM 850 CG LYS A 769 14.555 44.740 16.011 1.00 37.31 C ATOM 851 CD LYS A 769 14.916 46.192 15.682 1.00 39.85 C ATOM 852 CE LYS A 769 13.771 46.947 14.999 1.00 41.25 C ATOM 853 NZ LYS A 769 14.144 48.349 14.625 1.00 41.56 N ATOM 854 HZ1 LYS A 769 14.408 48.877 15.482 1.00 0.00 H ATOM 855 HZ2 LYS A 769 14.949 48.328 13.967 1.00 0.00 H ATOM 856 HZ3 LYS A 769 13.333 48.812 14.167 1.00 0.00 H ATOM 857 H LYS A 769 16.151 42.240 14.660 1.00 0.00 H ATOM 858 N HIS A 770 18.758 42.860 16.697 1.00 31.33 N ATOM 859 CA HIS A 770 19.971 42.771 17.493 1.00 30.20 C ATOM 860 C HIS A 770 21.303 42.841 16.761 1.00 30.07 C ATOM 861 O HIS A 770 22.269 43.373 17.307 1.00 30.12 O ATOM 862 CB HIS A 770 19.926 41.519 18.366 1.00 31.58 C ATOM 863 CG HIS A 770 18.823 41.532 19.381 1.00 32.42 C ATOM 864 ND1 HIS A 770 18.668 42.549 20.299 1.00 32.54 N ATOM 865 CD2 HIS A 770 17.840 40.637 19.642 1.00 33.08 C ATOM 866 CE1 HIS A 770 17.641 42.277 21.086 1.00 33.40 C ATOM 867 NE2 HIS A 770 17.122 41.122 20.708 1.00 34.35 N ATOM 868 H HIS A 770 18.283 41.990 16.381 1.00 0.00 H ATOM 869 N VAL A 771 21.372 42.313 15.541 1.00 28.41 N ATOM 870 CA VAL A 771 22.633 42.319 14.800 1.00 27.77 C ATOM 871 C VAL A 771 22.520 42.808 13.354 1.00 27.38 C ATOM 872 O VAL A 771 23.307 42.415 12.491 1.00 27.01 O ATOM 873 CB VAL A 771 23.319 40.912 14.842 1.00 28.85 C ATOM 874 CG1 VAL A 771 23.893 40.642 16.238 1.00 27.55 C ATOM 875 CG2 VAL A 771 22.321 39.812 14.489 1.00 27.87 C ATOM 876 H VAL A 771 20.523 41.893 15.112 1.00 0.00 H ATOM 877 N SER A 772 21.550 43.682 13.103 1.00 27.38 N ATOM 878 CA SER A 772 21.315 44.239 11.771 1.00 28.07 C ATOM 879 C SER A 772 21.149 43.188 10.673 1.00 27.33 C ATOM 880 O SER A 772 21.458 43.449 9.502 1.00 28.78 O ATOM 881 CB SER A 772 22.444 45.201 11.392 1.00 28.58 C ATOM 882 OG SER A 772 22.435 46.342 12.225 1.00 31.81 O ATOM 883 HG SER A 772 23.172 46.948 11.961 1.00 0.00 H ATOM 884 H SER A 772 20.934 43.982 13.885 1.00 0.00 H ATOM 885 N GLY A 773 20.671 42.006 11.049 1.00 26.02 N ATOM 886 CA GLY A 773 20.480 40.934 10.085 1.00 26.42 C ATOM 887 C GLY A 773 21.761 40.342 9.505 1.00 26.34 C ATOM 888 O GLY A 773 21.717 39.648 8.487 1.00 24.77 O ATOM 889 H GLY A 773 20.430 41.845 12.048 1.00 0.00 H ATOM 890 N GLN A 774 22.896 40.583 10.160 1.00 27.17 N ATOM 891 CA GLN A 774 24.183 40.079 9.682 1.00 29.16 C ATOM 892 C GLN A 774 24.494 38.648 10.128 1.00 29.80 C ATOM 893 O GLN A 774 25.399 37.998 9.593 1.00 29.30 O ATOM 894 CB GLN A 774 25.301 41.033 10.098 1.00 30.41 C ATOM 895 CG GLN A 774 25.218 42.408 9.418 1.00 33.33 C ATOM 896 CD GLN A 774 26.206 43.421 9.990 1.00 34.34 C ATOM 897 OE1 GLN A 774 26.767 43.224 11.075 1.00 36.29 O ATOM 898 NE2 GLN A 774 26.415 44.515 9.265 1.00 34.35 N ATOM 899 HE22 GLN A 774 25.922 44.640 8.358 1.00 0.00 H ATOM 900 HE21 GLN A 774 27.072 45.246 9.605 1.00 0.00 H ATOM 901 H GLN A 774 22.866 41.145 11.035 1.00 0.00 H ATOM 902 N MET A 775 23.731 38.163 11.103 1.00 30.09 N ATOM 903 CA MET A 775 23.899 36.811 11.629 1.00 30.13 C ATOM 904 C MET A 775 22.596 36.290 12.226 1.00 29.06 C ATOM 905 O MET A 775 21.666 37.062 12.478 1.00 28.61 O ATOM 906 CB MET A 775 25.039 36.754 12.660 1.00 30.53 C ATOM 907 CG MET A 775 25.261 38.021 13.458 1.00 32.15 C ATOM 908 SD MET A 775 26.692 37.915 14.570 1.00 36.16 S ATOM 909 CE MET A 775 27.850 38.940 13.746 1.00 33.46 C ATOM 910 H MET A 775 22.987 38.769 11.506 1.00 0.00 H ATOM 911 N LEU A 776 22.516 34.974 12.413 1.00 27.14 N ATOM 912 CA LEU A 776 21.312 34.364 12.966 1.00 25.82 C ATOM 913 C LEU A 776 21.285 34.366 14.491 1.00 24.12 C ATOM 914 O LEU A 776 22.033 33.645 15.149 1.00 23.01 O ATOM 915 CB LEU A 776 21.126 32.950 12.415 1.00 25.98 C ATOM 916 CG LEU A 776 20.969 32.909 10.894 1.00 27.97 C ATOM 917 CD1 LEU A 776 20.848 31.465 10.415 1.00 28.03 C ATOM 918 CD2 LEU A 776 19.747 33.729 10.474 1.00 27.62 C ATOM 919 H LEU A 776 23.325 34.371 12.161 1.00 0.00 H ATOM 920 N TYR A 777 20.400 35.193 15.034 1.00 24.10 N ATOM 921 CA TYR A 777 20.223 35.338 16.473 1.00 24.23 C ATOM 922 C TYR A 777 19.137 34.375 16.965 1.00 23.80 C ATOM 923 O TYR A 777 17.977 34.767 17.122 1.00 24.28 O ATOM 924 CB TYR A 777 19.816 36.781 16.766 1.00 23.99 C ATOM 925 CG TYR A 777 20.018 37.248 18.188 1.00 25.81 C ATOM 926 CD1 TYR A 777 19.096 36.941 19.187 1.00 24.69 C ATOM 927 CD2 TYR A 777 21.099 38.070 18.519 1.00 27.40 C ATOM 928 CE1 TYR A 777 19.243 37.443 20.474 1.00 26.21 C ATOM 929 CE2 TYR A 777 21.254 38.577 19.807 1.00 27.23 C ATOM 930 CZ TYR A 777 20.325 38.263 20.777 1.00 27.49 C ATOM 931 OH TYR A 777 20.460 38.796 22.042 1.00 28.13 O ATOM 932 HH TYR A 777 19.719 38.476 22.615 1.00 0.00 H ATOM 933 H TYR A 777 19.804 35.765 14.402 1.00 0.00 H ATOM 934 N PHE A 778 19.502 33.114 17.185 1.00 22.78 N ATOM 935 CA PHE A 778 18.543 32.117 17.666 1.00 22.76 C ATOM 936 C PHE A 778 18.127 32.442 19.103 1.00 23.19 C ATOM 937 O PHE A 778 16.953 32.344 19.462 1.00 23.90 O ATOM 938 CB PHE A 778 19.135 30.701 17.587 1.00 21.98 C ATOM 939 CG PHE A 778 19.249 30.164 16.189 1.00 23.34 C ATOM 940 CD1 PHE A 778 20.425 30.327 15.457 1.00 25.43 C ATOM 941 CD2 PHE A 778 18.184 29.488 15.602 1.00 24.32 C ATOM 942 CE1 PHE A 778 20.539 29.822 14.155 1.00 25.92 C ATOM 943 CE2 PHE A 778 18.281 28.973 14.294 1.00 25.40 C ATOM 944 CZ PHE A 778 19.461 29.141 13.570 1.00 25.82 C ATOM 945 H PHE A 778 20.488 32.831 17.012 1.00 0.00 H ATOM 946 N ALA A 779 19.104 32.848 19.906 1.00 23.22 N ATOM 947 CA ALA A 779 18.894 33.218 21.301 1.00 24.41 C ATOM 948 C ALA A 779 20.134 33.992 21.740 1.00 25.52 C ATOM 949 O ALA A 779 21.143 33.979 21.047 1.00 24.52 O ATOM 950 CB ALA A 779 18.704 31.966 22.170 1.00 23.38 C ATOM 951 H ALA A 779 20.068 32.905 19.520 1.00 0.00 H ATOM 952 N PRO A 780 20.069 34.692 22.888 1.00 27.50 N ATOM 953 CA PRO A 780 21.219 35.463 23.378 1.00 28.10 C ATOM 954 C PRO A 780 22.485 34.624 23.557 1.00 28.33 C ATOM 955 O PRO A 780 23.600 35.116 23.383 1.00 28.61 O ATOM 956 CB PRO A 780 20.712 36.004 24.713 1.00 28.10 C ATOM 957 CG PRO A 780 19.250 36.204 24.442 1.00 27.59 C ATOM 958 CD PRO A 780 18.895 34.907 23.755 1.00 27.48 C ATOM 959 N ASP A 781 22.298 33.353 23.885 1.00 29.29 N ATOM 960 CA ASP A 781 23.414 32.441 24.092 1.00 30.04 C ATOM 961 C ASP A 781 23.621 31.497 22.904 1.00 30.69 C ATOM 962 O ASP A 781 24.301 30.475 23.024 1.00 30.78 O ATOM 963 CB ASP A 781 23.222 31.649 25.400 1.00 29.74 C ATOM 964 CG ASP A 781 21.930 30.830 25.426 1.00 32.38 C ATOM 965 OD1 ASP A 781 21.028 31.062 24.588 1.00 32.89 O ATOM 966 OD2 ASP A 781 21.812 29.943 26.304 1.00 33.47 O ATOM 967 H ASP A 781 21.327 32.998 23.998 1.00 0.00 H ATOM 968 N LEU A 782 23.040 31.846 21.757 1.00 30.15 N ATOM 969 CA LEU A 782 23.174 31.027 20.557 1.00 29.05 C ATOM 970 C LEU A 782 23.013 31.880 19.294 1.00 28.74 C ATOM 971 O LEU A 782 21.943 31.942 18.679 1.00 27.24 O ATOM 972 CB LEU A 782 22.175 29.863 20.583 1.00 30.31 C ATOM 973 CG LEU A 782 22.263 28.780 19.498 1.00 30.94 C ATOM 974 CD1 LEU A 782 23.677 28.299 19.321 1.00 32.50 C ATOM 975 CD2 LEU A 782 21.378 27.617 19.871 1.00 31.55 C ATOM 976 H LEU A 782 22.479 32.721 21.716 1.00 0.00 H ATOM 977 N ILE A 783 24.099 32.557 18.938 1.00 27.89 N ATOM 978 CA ILE A 783 24.139 33.413 17.768 1.00 27.18 C ATOM 979 C ILE A 783 25.143 32.820 16.778 1.00 28.31 C ATOM 980 O ILE A 783 26.314 32.615 17.112 1.00 27.88 O ATOM 981 CB ILE A 783 24.581 34.827 18.139 1.00 25.95 C ATOM 982 CG1 ILE A 783 23.795 35.317 19.355 1.00 24.76 C ATOM 983 CG2 ILE A 783 24.366 35.762 16.952 1.00 27.13 C ATOM 984 CD1 ILE A 783 24.353 36.582 19.978 1.00 25.04 C ATOM 985 H ILE A 783 24.955 32.470 19.522 1.00 0.00 H ATOM 986 N LEU A 784 24.666 32.528 15.571 1.00 27.94 N ATOM 987 CA LEU A 784 25.492 31.948 14.524 1.00 28.46 C ATOM 988 C LEU A 784 25.918 32.986 13.486 1.00 29.03 C ATOM 989 O LEU A 784 25.083 33.478 12.724 1.00 29.92 O ATOM 990 CB LEU A 784 24.712 30.833 13.827 1.00 28.62 C ATOM 991 CG LEU A 784 25.244 29.398 13.819 1.00 29.79 C ATOM 992 CD1 LEU A 784 25.340 28.842 15.239 1.00 28.31 C ATOM 993 CD2 LEU A 784 24.318 28.547 12.972 1.00 28.56 C ATOM 994 H LEU A 784 23.664 32.722 15.368 1.00 0.00 H ATOM 995 N ASN A 785 27.203 33.335 13.461 1.00 28.41 N ATOM 996 CA ASN A 785 27.692 34.298 12.475 1.00 29.92 C ATOM 997 C ASN A 785 27.925 33.597 11.131 1.00 30.29 C ATOM 998 O ASN A 785 27.812 32.378 11.035 1.00 30.84 O ATOM 999 CB ASN A 785 28.965 35.013 12.964 1.00 30.21 C ATOM 1000 CG ASN A 785 30.121 34.058 13.243 1.00 31.12 C ATOM 1001 OD1 ASN A 785 30.384 33.128 12.478 1.00 32.91 O ATOM 1002 ND2 ASN A 785 30.824 34.296 14.340 1.00 30.47 N ATOM 1003 HD22 ASN A 785 30.568 35.092 14.959 1.00 0.00 H ATOM 1004 HD21 ASN A 785 31.632 33.687 14.582 1.00 0.00 H ATOM 1005 H ASN A 785 27.864 32.919 14.148 1.00 0.00 H ATOM 1006 N GLU A 786 28.270 34.363 10.105 1.00 32.23 N ATOM 1007 CA GLU A 786 28.489 33.809 8.771 1.00 34.55 C ATOM 1008 C GLU A 786 29.521 32.672 8.693 1.00 34.56 C ATOM 1009 O GLU A 786 29.244 31.618 8.110 1.00 33.82 O ATOM 1010 CB GLU A 786 28.838 34.930 7.784 1.00 36.62 C ATOM 1011 CG GLU A 786 28.788 34.499 6.315 1.00 41.38 C ATOM 1012 CD GLU A 786 29.011 35.648 5.332 1.00 43.52 C ATOM 1013 OE1 GLU A 786 28.698 36.815 5.668 1.00 45.84 O ATOM 1014 OE2 GLU A 786 29.491 35.379 4.211 1.00 44.38 O ATOM 1015 H GLU A 786 28.388 35.386 10.254 1.00 0.00 H ATOM 1016 N GLN A 787 30.689 32.873 9.299 1.00 34.92 N ATOM 1017 CA GLN A 787 31.748 31.862 9.284 1.00 35.42 C ATOM 1018 C GLN A 787 31.321 30.554 9.955 1.00 35.31 C ATOM 1019 O GLN A 787 31.731 29.469 9.533 1.00 34.66 O ATOM 1020 CB GLN A 787 33.022 32.415 9.946 1.00 36.76 C ATOM 1021 CG GLN A 787 34.196 31.425 10.035 1.00 39.85 C ATOM 1022 CD GLN A 787 34.684 30.930 8.669 1.00 43.42 C ATOM 1023 OE1 GLN A 787 34.636 31.658 7.661 1.00 43.17 O ATOM 1024 NE2 GLN A 787 35.163 29.684 8.633 1.00 43.25 N ATOM 1025 HE22 GLN A 787 35.185 29.110 9.500 1.00 0.00 H ATOM 1026 HE21 GLN A 787 35.514 29.288 7.738 1.00 0.00 H ATOM 1027 H GLN A 787 30.854 33.772 9.796 1.00 0.00 H ATOM 1028 N ARG A 788 30.489 30.657 10.989 1.00 35.44 N ATOM 1029 CA ARG A 788 30.017 29.477 11.705 1.00 36.54 C ATOM 1030 C ARG A 788 28.961 28.699 10.919 1.00 35.55 C ATOM 1031 O ARG A 788 28.889 27.475 11.017 1.00 35.14 O ATOM 1032 CB ARG A 788 29.477 29.865 13.084 1.00 37.75 C ATOM 1033 CG ARG A 788 30.288 29.321 14.251 1.00 40.23 C ATOM 1034 CD ARG A 788 31.660 29.982 14.367 1.00 42.31 C ATOM 1035 NE ARG A 788 32.745 29.031 14.140 1.00 44.98 N ATOM 1036 CZ ARG A 788 33.955 29.103 14.697 1.00 45.48 C ATOM 1037 NH1 ARG A 788 34.861 28.177 14.411 1.00 44.74 N ATOM 1038 NH2 ARG A 788 34.260 30.084 15.542 1.00 44.50 N ATOM 1039 HE ARG A 788 32.560 28.237 13.495 1.00 0.00 H ATOM 1040 HH12 ARG A 788 35.807 28.225 14.840 1.00 0.00 H ATOM 1041 HH11 ARG A 788 34.625 27.403 13.757 1.00 0.00 H ATOM 1042 HH22 ARG A 788 35.208 30.127 15.968 1.00 0.00 H ATOM 1043 HH21 ARG A 788 33.551 30.808 15.776 1.00 0.00 H ATOM 1044 H ARG A 788 30.169 31.599 11.293 1.00 0.00 H ATOM 1045 N MET A 789 28.133 29.419 10.163 1.00 34.94 N ATOM 1046 CA MET A 789 27.084 28.808 9.343 1.00 34.87 C ATOM 1047 C MET A 789 27.736 27.923 8.269 1.00 35.54 C ATOM 1048 O MET A 789 27.271 26.813 7.989 1.00 33.65 O ATOM 1049 CB MET A 789 26.232 29.893 8.663 1.00 33.96 C ATOM 1050 CG MET A 789 25.472 30.829 9.606 1.00 35.21 C ATOM 1051 SD MET A 789 24.471 32.051 8.690 1.00 37.90 S ATOM 1052 CE MET A 789 24.999 33.603 9.341 1.00 34.50 C ATOM 1053 H MET A 789 28.235 30.454 10.155 1.00 0.00 H ATOM 1054 N LYS A 790 28.833 28.420 7.696 1.00 37.14 N ATOM 1055 CA LYS A 790 29.567 27.707 6.655 1.00 39.04 C ATOM 1056 C LYS A 790 30.225 26.433 7.160 1.00 39.98 C ATOM 1057 O LYS A 790 30.158 25.397 6.495 1.00 41.64 O ATOM 1058 CB LYS A 790 30.608 28.621 6.006 1.00 39.69 C ATOM 1059 CG LYS A 790 30.007 29.884 5.398 1.00 42.18 C ATOM 1060 CD LYS A 790 31.052 30.759 4.715 1.00 45.10 C ATOM 1061 CE LYS A 790 30.416 32.036 4.168 1.00 46.53 C ATOM 1062 NZ LYS A 790 31.421 33.050 3.707 1.00 48.01 N ATOM 1063 HZ1 LYS A 790 32.030 33.320 4.505 1.00 0.00 H ATOM 1064 HZ2 LYS A 790 32.003 32.640 2.949 1.00 0.00 H ATOM 1065 HZ3 LYS A 790 30.924 33.890 3.348 1.00 0.00 H ATOM 1066 H LYS A 790 29.179 29.352 8.003 1.00 0.00 H ATOM 1067 N GLU A 791 30.826 26.503 8.345 1.00 40.28 N ATOM 1068 CA GLU A 791 31.495 25.352 8.947 1.00 40.67 C ATOM 1069 C GLU A 791 30.515 24.271 9.390 1.00 40.32 C ATOM 1070 O GLU A 791 30.908 23.119 9.614 1.00 39.99 O ATOM 1071 CB GLU A 791 32.323 25.790 10.155 1.00 42.23 C ATOM 1072 CG GLU A 791 33.501 26.698 9.829 1.00 45.10 C ATOM 1073 CD GLU A 791 34.223 27.211 11.079 1.00 46.16 C ATOM 1074 OE1 GLU A 791 33.970 26.692 12.193 1.00 44.35 O ATOM 1075 OE2 GLU A 791 35.039 28.149 10.939 1.00 46.62 O ATOM 1076 H GLU A 791 30.819 27.407 8.860 1.00 0.00 H ATOM 1077 N SER A 792 29.249 24.648 9.551 1.00 39.54 N ATOM 1078 CA SER A 792 28.228 23.694 9.977 1.00 39.64 C ATOM 1079 C SER A 792 27.812 22.778 8.826 1.00 39.48 C ATOM 1080 O SER A 792 28.124 23.037 7.654 1.00 38.39 O ATOM 1081 CB SER A 792 26.993 24.424 10.523 1.00 39.66 C ATOM 1082 OG SER A 792 26.223 24.979 9.468 1.00 40.49 O ATOM 1083 HG SER A 792 26.776 25.625 8.962 1.00 0.00 H ATOM 1084 H SER A 792 28.982 25.637 9.371 1.00 0.00 H ATOM 1085 N SER A 793 27.092 21.719 9.177 1.00 39.42 N ATOM 1086 CA SER A 793 26.603 20.745 8.208 1.00 39.71 C ATOM 1087 C SER A 793 25.223 21.118 7.651 1.00 39.69 C ATOM 1088 O SER A 793 24.509 20.262 7.129 1.00 40.79 O ATOM 1089 CB SER A 793 26.538 19.366 8.862 1.00 39.91 C ATOM 1090 OG SER A 793 25.726 19.401 10.022 1.00 40.52 O ATOM 1091 HG SER A 793 26.106 20.046 10.670 1.00 0.00 H ATOM 1092 H SER A 793 26.868 21.579 10.183 1.00 0.00 H ATOM 1093 N PHE A 794 24.853 22.393 7.765 1.00 38.62 N ATOM 1094 CA PHE A 794 23.563 22.870 7.276 1.00 36.81 C ATOM 1095 C PHE A 794 23.611 24.330 6.847 1.00 35.77 C ATOM 1096 O PHE A 794 22.714 25.116 7.161 1.00 35.88 O ATOM 1097 CB PHE A 794 22.464 22.652 8.333 1.00 37.66 C ATOM 1098 CG PHE A 794 22.743 23.311 9.661 1.00 37.39 C ATOM 1099 CD1 PHE A 794 22.346 24.624 9.899 1.00 37.98 C ATOM 1100 CD2 PHE A 794 23.382 22.613 10.674 1.00 37.13 C ATOM 1101 CE1 PHE A 794 22.581 25.235 11.128 1.00 37.64 C ATOM 1102 CE2 PHE A 794 23.624 23.214 11.907 1.00 38.49 C ATOM 1103 CZ PHE A 794 23.221 24.529 12.133 1.00 37.91 C ATOM 1104 H PHE A 794 25.503 23.068 8.216 1.00 0.00 H ATOM 1105 N TYR A 795 24.655 24.680 6.104 1.00 35.13 N ATOM 1106 CA TYR A 795 24.830 26.040 5.612 1.00 34.53 C ATOM 1107 C TYR A 795 23.691 26.403 4.661 1.00 34.41 C ATOM 1108 O TYR A 795 23.238 27.548 4.630 1.00 35.04 O ATOM 1109 CB TYR A 795 26.183 26.166 4.902 1.00 34.90 C ATOM 1110 CG TYR A 795 26.477 27.544 4.359 1.00 36.41 C ATOM 1111 CD1 TYR A 795 26.355 28.673 5.164 1.00 37.19 C ATOM 1112 CD2 TYR A 795 26.876 27.722 3.036 1.00 37.96 C ATOM 1113 CE1 TYR A 795 26.621 29.943 4.667 1.00 38.14 C ATOM 1114 CE2 TYR A 795 27.148 28.990 2.526 1.00 37.29 C ATOM 1115 CZ TYR A 795 27.018 30.096 3.348 1.00 38.93 C ATOM 1116 OH TYR A 795 27.292 31.359 2.858 1.00 40.52 O ATOM 1117 HH TYR A 795 27.149 32.028 3.574 1.00 0.00 H ATOM 1118 H TYR A 795 25.369 23.962 5.866 1.00 0.00 H ATOM 1119 N SER A 796 23.210 25.411 3.914 1.00 34.21 N ATOM 1120 CA SER A 796 22.129 25.606 2.957 1.00 33.19 C ATOM 1121 C SER A 796 20.865 26.049 3.679 1.00 32.37 C ATOM 1122 O SER A 796 20.202 26.992 3.254 1.00 32.95 O ATOM 1123 CB SER A 796 21.884 24.321 2.161 1.00 34.07 C ATOM 1124 OG SER A 796 21.417 24.619 0.855 1.00 34.07 O ATOM 1125 HG SER A 796 21.266 23.775 0.359 1.00 0.00 H ATOM 1126 H SER A 796 23.621 24.462 4.018 1.00 0.00 H ATOM 1127 N LEU A 797 20.555 25.383 4.788 1.00 31.98 N ATOM 1128 CA LEU A 797 19.395 25.727 5.609 1.00 31.46 C ATOM 1129 C LEU A 797 19.571 27.151 6.156 1.00 32.09 C ATOM 1130 O LEU A 797 18.639 27.966 6.090 1.00 31.82 O ATOM 1131 CB LEU A 797 19.253 24.738 6.771 1.00 30.74 C ATOM 1132 CG LEU A 797 18.166 25.039 7.812 1.00 31.49 C ATOM 1133 CD1 LEU A 797 16.790 24.794 7.221 1.00 30.83 C ATOM 1134 CD2 LEU A 797 18.366 24.179 9.050 1.00 28.99 C ATOM 1135 H LEU A 797 21.159 24.589 5.082 1.00 0.00 H ATOM 1136 N CYS A 798 20.778 27.451 6.654 1.00 31.54 N ATOM 1137 CA CYS A 798 21.098 28.778 7.200 1.00 31.17 C ATOM 1138 C CYS A 798 20.801 29.887 6.196 1.00 31.46 C ATOM 1139 O CYS A 798 20.207 30.904 6.547 1.00 30.59 O ATOM 1140 CB CYS A 798 22.576 28.866 7.618 1.00 30.35 C ATOM 1141 SG CYS A 798 23.022 27.927 9.099 1.00 31.00 S ATOM 1142 H CYS A 798 21.516 26.718 6.654 1.00 0.00 H ATOM 1143 N LEU A 799 21.236 29.688 4.952 1.00 32.27 N ATOM 1144 CA LEU A 799 21.011 30.665 3.883 1.00 33.43 C ATOM 1145 C LEU A 799 19.525 30.847 3.609 1.00 33.24 C ATOM 1146 O LEU A 799 19.069 31.957 3.349 1.00 33.57 O ATOM 1147 CB LEU A 799 21.727 30.233 2.603 1.00 33.99 C ATOM 1148 CG LEU A 799 23.249 30.369 2.612 1.00 35.55 C ATOM 1149 CD1 LEU A 799 23.839 29.655 1.409 1.00 36.96 C ATOM 1150 CD2 LEU A 799 23.636 31.834 2.605 1.00 34.69 C ATOM 1151 H LEU A 799 21.751 28.812 4.733 1.00 0.00 H ATOM 1152 N THR A 800 18.770 29.754 3.661 1.00 33.67 N ATOM 1153 CA THR A 800 17.331 29.834 3.446 1.00 34.51 C ATOM 1154 C THR A 800 16.698 30.706 4.536 1.00 33.81 C ATOM 1155 O THR A 800 16.015 31.686 4.225 1.00 34.18 O ATOM 1156 CB THR A 800 16.664 28.437 3.456 1.00 34.62 C ATOM 1157 OG1 THR A 800 16.874 27.798 2.192 1.00 35.52 O ATOM 1158 CG2 THR A 800 15.159 28.563 3.714 1.00 34.54 C ATOM 1159 HG1 THR A 800 16.447 26.905 2.200 1.00 0.00 H ATOM 1160 H THR A 800 19.211 28.833 3.857 1.00 0.00 H ATOM 1161 N MET A 801 16.965 30.377 5.802 1.00 32.25 N ATOM 1162 CA MET A 801 16.411 31.135 6.925 1.00 31.61 C ATOM 1163 C MET A 801 16.883 32.584 6.952 1.00 30.42 C ATOM 1164 O MET A 801 16.121 33.486 7.303 1.00 30.15 O ATOM 1165 CB MET A 801 16.738 30.456 8.259 1.00 31.27 C ATOM 1166 CG MET A 801 16.046 29.115 8.447 1.00 32.14 C ATOM 1167 SD MET A 801 16.364 28.370 10.058 1.00 32.82 S ATOM 1168 CE MET A 801 18.138 28.085 9.965 1.00 31.92 C ATOM 1169 H MET A 801 17.582 29.562 5.995 1.00 0.00 H ATOM 1170 N TRP A 802 18.119 32.798 6.513 1.00 29.49 N ATOM 1171 CA TRP A 802 18.738 34.121 6.483 1.00 29.32 C ATOM 1172 C TRP A 802 18.038 35.086 5.515 1.00 29.37 C ATOM 1173 O TRP A 802 18.254 36.301 5.577 1.00 28.96 O ATOM 1174 CB TRP A 802 20.220 33.970 6.117 1.00 29.93 C ATOM 1175 CG TRP A 802 21.119 35.100 6.550 1.00 30.85 C ATOM 1176 CD1 TRP A 802 20.766 36.224 7.249 1.00 30.11 C ATOM 1177 CD2 TRP A 802 22.523 35.216 6.290 1.00 29.56 C ATOM 1178 NE1 TRP A 802 21.860 37.030 7.432 1.00 29.60 N ATOM 1179 CE2 TRP A 802 22.952 36.437 6.855 1.00 29.78 C ATOM 1180 CE3 TRP A 802 23.458 34.407 5.632 1.00 30.54 C ATOM 1181 CZ2 TRP A 802 24.284 36.873 6.783 1.00 30.03 C ATOM 1182 CZ3 TRP A 802 24.786 34.839 5.559 1.00 31.30 C ATOM 1183 CH2 TRP A 802 25.183 36.065 6.133 1.00 29.98 C ATOM 1184 HE1 TRP A 802 21.861 37.944 7.929 1.00 0.00 H ATOM 1185 H TRP A 802 18.672 31.985 6.175 1.00 0.00 H ATOM 1186 N GLN A 803 17.190 34.545 4.641 1.00 29.28 N ATOM 1187 CA GLN A 803 16.440 35.349 3.666 1.00 30.03 C ATOM 1188 C GLN A 803 15.495 36.364 4.323 1.00 29.03 C ATOM 1189 O GLN A 803 15.348 37.487 3.839 1.00 29.20 O ATOM 1190 CB GLN A 803 15.611 34.439 2.744 1.00 31.55 C ATOM 1191 CG GLN A 803 16.392 33.755 1.633 1.00 33.66 C ATOM 1192 CD GLN A 803 15.564 32.736 0.858 1.00 34.86 C ATOM 1193 OE1 GLN A 803 14.327 32.793 0.838 1.00 34.39 O ATOM 1194 NE2 GLN A 803 16.248 31.791 0.213 1.00 34.79 N ATOM 1195 HE22 GLN A 803 17.287 31.780 0.256 1.00 0.00 H ATOM 1196 HE21 GLN A 803 15.743 31.065 -0.334 1.00 0.00 H ATOM 1197 H GLN A 803 17.054 33.514 4.649 1.00 0.00 H ATOM 1198 N ILE A 804 14.862 35.959 5.422 1.00 27.61 N ATOM 1199 CA ILE A 804 13.913 36.806 6.137 1.00 26.27 C ATOM 1200 C ILE A 804 14.506 38.076 6.758 1.00 25.84 C ATOM 1201 O ILE A 804 13.981 39.167 6.531 1.00 26.19 O ATOM 1202 CB ILE A 804 13.119 35.985 7.181 1.00 27.47 C ATOM 1203 CG1 ILE A 804 12.440 34.806 6.479 1.00 26.05 C ATOM 1204 CG2 ILE A 804 12.078 36.867 7.882 1.00 25.30 C ATOM 1205 CD1 ILE A 804 12.024 33.704 7.395 1.00 28.22 C ATOM 1206 H ILE A 804 15.051 35.003 5.785 1.00 0.00 H ATOM 1207 N PRO A 805 15.581 37.957 7.571 1.00 25.98 N ATOM 1208 CA PRO A 805 16.199 39.140 8.190 1.00 26.53 C ATOM 1209 C PRO A 805 16.640 40.118 7.102 1.00 28.01 C ATOM 1210 O PRO A 805 16.514 41.338 7.256 1.00 27.96 O ATOM 1211 CB PRO A 805 17.424 38.558 8.900 1.00 24.28 C ATOM 1212 CG PRO A 805 17.005 37.195 9.236 1.00 25.75 C ATOM 1213 CD PRO A 805 16.273 36.730 8.007 1.00 25.63 C ATOM 1214 N GLN A 806 17.169 39.570 6.006 1.00 29.88 N ATOM 1215 CA GLN A 806 17.615 40.393 4.886 1.00 32.90 C ATOM 1216 C GLN A 806 16.465 41.191 4.296 1.00 31.88 C ATOM 1217 O GLN A 806 16.634 42.364 3.949 1.00 32.38 O ATOM 1218 CB GLN A 806 18.297 39.546 3.810 1.00 34.83 C ATOM 1219 CG GLN A 806 19.774 39.294 4.099 1.00 39.96 C ATOM 1220 CD GLN A 806 20.537 40.588 4.400 1.00 43.56 C ATOM 1221 OE1 GLN A 806 20.738 41.434 3.514 1.00 45.55 O ATOM 1222 NE2 GLN A 806 20.944 40.757 5.659 1.00 42.89 N ATOM 1223 HE22 GLN A 806 20.754 40.022 6.370 1.00 0.00 H ATOM 1224 HE21 GLN A 806 21.451 41.624 5.930 1.00 0.00 H ATOM 1225 H GLN A 806 17.265 38.536 5.949 1.00 0.00 H ATOM 1226 N GLU A 807 15.295 40.559 4.204 1.00 31.46 N ATOM 1227 CA GLU A 807 14.102 41.225 3.692 1.00 31.17 C ATOM 1228 C GLU A 807 13.637 42.308 4.677 1.00 28.34 C ATOM 1229 O GLU A 807 13.206 43.379 4.257 1.00 27.25 O ATOM 1230 CB GLU A 807 12.989 40.205 3.415 1.00 34.83 C ATOM 1231 CG GLU A 807 13.249 39.330 2.178 1.00 41.16 C ATOM 1232 CD GLU A 807 12.220 38.208 1.997 1.00 46.00 C ATOM 1233 OE1 GLU A 807 12.458 37.089 2.513 1.00 48.47 O ATOM 1234 OE2 GLU A 807 11.182 38.440 1.331 1.00 47.88 O ATOM 1235 H GLU A 807 15.231 39.566 4.505 1.00 0.00 H ATOM 1236 N PHE A 808 13.752 42.040 5.982 1.00 25.46 N ATOM 1237 CA PHE A 808 13.357 43.018 6.999 1.00 24.17 C ATOM 1238 C PHE A 808 14.237 44.264 6.874 1.00 23.72 C ATOM 1239 O PHE A 808 13.759 45.394 7.035 1.00 21.95 O ATOM 1240 CB PHE A 808 13.495 42.444 8.415 1.00 23.72 C ATOM 1241 CG PHE A 808 12.383 41.520 8.819 1.00 24.55 C ATOM 1242 CD1 PHE A 808 12.438 40.852 10.041 1.00 23.64 C ATOM 1243 CD2 PHE A 808 11.272 41.323 7.994 1.00 24.40 C ATOM 1244 CE1 PHE A 808 11.401 39.999 10.445 1.00 24.59 C ATOM 1245 CE2 PHE A 808 10.231 40.474 8.387 1.00 25.26 C ATOM 1246 CZ PHE A 808 10.297 39.807 9.621 1.00 23.48 C ATOM 1247 H PHE A 808 14.130 41.118 6.281 1.00 0.00 H ATOM 1248 N VAL A 809 15.527 44.047 6.611 1.00 22.14 N ATOM 1249 CA VAL A 809 16.465 45.148 6.433 1.00 23.55 C ATOM 1250 C VAL A 809 16.093 45.999 5.208 1.00 25.16 C ATOM 1251 O VAL A 809 15.992 47.227 5.318 1.00 25.94 O ATOM 1252 CB VAL A 809 17.929 44.646 6.284 1.00 24.27 C ATOM 1253 CG1 VAL A 809 18.839 45.787 5.805 1.00 22.14 C ATOM 1254 CG2 VAL A 809 18.437 44.085 7.616 1.00 22.55 C ATOM 1255 H VAL A 809 15.871 43.069 6.531 1.00 0.00 H ATOM 1256 N LYS A 810 15.873 45.354 4.060 1.00 24.82 N ATOM 1257 CA LYS A 810 15.517 46.077 2.834 1.00 27.04 C ATOM 1258 C LYS A 810 14.205 46.850 2.953 1.00 26.52 C ATOM 1259 O LYS A 810 14.105 47.987 2.487 1.00 25.68 O ATOM 1260 CB LYS A 810 15.419 45.130 1.638 1.00 28.92 C ATOM 1261 CG LYS A 810 16.676 44.347 1.334 1.00 33.01 C ATOM 1262 CD LYS A 810 16.445 43.469 0.118 1.00 38.40 C ATOM 1263 CE LYS A 810 17.617 42.546 -0.173 1.00 41.07 C ATOM 1264 NZ LYS A 810 17.331 41.722 -1.392 1.00 42.61 N ATOM 1265 HZ1 LYS A 810 16.477 41.151 -1.230 1.00 0.00 H ATOM 1266 HZ2 LYS A 810 17.180 42.351 -2.206 1.00 0.00 H ATOM 1267 HZ3 LYS A 810 18.138 41.095 -1.582 1.00 0.00 H ATOM 1268 H LYS A 810 15.956 44.318 4.034 1.00 0.00 H ATOM 1269 N LEU A 811 13.196 46.230 3.560 1.00 25.92 N ATOM 1270 CA LEU A 811 11.898 46.886 3.728 1.00 26.32 C ATOM 1271 C LEU A 811 11.840 47.810 4.935 1.00 26.12 C ATOM 1272 O LEU A 811 10.945 48.653 5.027 1.00 25.89 O ATOM 1273 CB LEU A 811 10.772 45.852 3.831 1.00 26.54 C ATOM 1274 CG LEU A 811 10.552 44.933 2.625 1.00 28.47 C ATOM 1275 CD1 LEU A 811 9.591 43.827 2.989 1.00 27.83 C ATOM 1276 CD2 LEU A 811 10.016 45.733 1.451 1.00 27.95 C ATOM 1277 H LEU A 811 13.332 45.264 3.921 1.00 0.00 H ATOM 1278 N GLN A 812 12.809 47.672 5.841 1.00 27.12 N ATOM 1279 CA GLN A 812 12.849 48.469 7.068 1.00 26.72 C ATOM 1280 C GLN A 812 11.530 48.301 7.835 1.00 25.62 C ATOM 1281 O GLN A 812 10.858 49.279 8.184 1.00 24.54 O ATOM 1282 CB GLN A 812 13.120 49.946 6.751 1.00 28.53 C ATOM 1283 CG GLN A 812 14.591 50.264 6.486 1.00 31.73 C ATOM 1284 CD GLN A 812 15.491 49.963 7.690 1.00 32.74 C ATOM 1285 OE1 GLN A 812 16.215 48.960 7.709 1.00 32.46 O ATOM 1286 NE2 GLN A 812 15.448 50.835 8.695 1.00 31.86 N ATOM 1287 HE22 GLN A 812 14.824 51.665 8.637 1.00 0.00 H ATOM 1288 HE21 GLN A 812 16.038 50.686 9.538 1.00 0.00 H ATOM 1289 H GLN A 812 13.561 46.975 5.670 1.00 0.00 H ATOM 1290 N VAL A 813 11.157 47.043 8.055 1.00 23.84 N ATOM 1291 CA VAL A 813 9.925 46.706 8.759 1.00 23.85 C ATOM 1292 C VAL A 813 9.873 47.270 10.182 1.00 23.63 C ATOM 1293 O VAL A 813 10.868 47.249 10.911 1.00 25.21 O ATOM 1294 CB VAL A 813 9.712 45.169 8.783 1.00 23.30 C ATOM 1295 CG1 VAL A 813 8.528 44.798 9.678 1.00 22.07 C ATOM 1296 CG2 VAL A 813 9.489 44.653 7.370 1.00 20.92 C ATOM 1297 H VAL A 813 11.766 46.272 7.713 1.00 0.00 H ATOM 1298 N SER A 814 8.716 47.806 10.559 1.00 23.66 N ATOM 1299 CA SER A 814 8.532 48.371 11.894 1.00 23.94 C ATOM 1300 C SER A 814 8.081 47.287 12.881 1.00 22.98 C ATOM 1301 O SER A 814 7.685 46.196 12.467 1.00 21.08 O ATOM 1302 CB SER A 814 7.505 49.506 11.855 1.00 24.20 C ATOM 1303 OG SER A 814 6.187 49.012 11.668 1.00 26.48 O ATOM 1304 HG SER A 814 6.140 48.517 10.812 1.00 0.00 H ATOM 1305 H SER A 814 7.922 47.824 9.887 1.00 0.00 H ATOM 1306 N GLN A 815 8.177 47.576 14.178 1.00 23.38 N ATOM 1307 CA GLN A 815 7.766 46.615 15.205 1.00 24.72 C ATOM 1308 C GLN A 815 6.253 46.379 15.128 1.00 23.65 C ATOM 1309 O GLN A 815 5.779 45.249 15.262 1.00 22.10 O ATOM 1310 CB GLN A 815 8.133 47.119 16.606 1.00 25.70 C ATOM 1311 CG GLN A 815 8.042 46.033 17.682 1.00 32.86 C ATOM 1312 CD GLN A 815 8.264 46.559 19.099 1.00 38.13 C ATOM 1313 OE1 GLN A 815 8.424 47.771 19.314 1.00 40.12 O ATOM 1314 NE2 GLN A 815 8.257 45.646 20.079 1.00 40.43 N ATOM 1315 HE22 GLN A 815 8.119 44.640 19.852 1.00 0.00 H ATOM 1316 HE21 GLN A 815 8.389 45.943 21.067 1.00 0.00 H ATOM 1317 H GLN A 815 8.551 48.502 14.467 1.00 0.00 H ATOM 1318 N GLU A 816 5.512 47.461 14.897 1.00 22.71 N ATOM 1319 CA GLU A 816 4.066 47.409 14.784 1.00 24.01 C ATOM 1320 C GLU A 816 3.624 46.539 13.597 1.00 23.52 C ATOM 1321 O GLU A 816 2.635 45.801 13.692 1.00 22.88 O ATOM 1322 CB GLU A 816 3.510 48.826 14.648 1.00 26.25 C ATOM 1323 CG GLU A 816 3.746 49.716 15.879 1.00 30.41 C ATOM 1324 CD GLU A 816 5.083 50.471 15.872 1.00 32.59 C ATOM 1325 OE1 GLU A 816 5.231 51.389 16.703 1.00 33.48 O ATOM 1326 OE2 GLU A 816 5.979 50.167 15.050 1.00 33.77 O ATOM 1327 H GLU A 816 5.988 48.380 14.793 1.00 0.00 H ATOM 1328 N GLU A 817 4.350 46.643 12.483 1.00 21.36 N ATOM 1329 CA GLU A 817 4.054 45.851 11.288 1.00 21.79 C ATOM 1330 C GLU A 817 4.372 44.383 11.541 1.00 20.01 C ATOM 1331 O GLU A 817 3.580 43.506 11.207 1.00 20.51 O ATOM 1332 CB GLU A 817 4.857 46.352 10.084 1.00 22.52 C ATOM 1333 CG GLU A 817 4.372 47.672 9.519 1.00 24.82 C ATOM 1334 CD GLU A 817 5.364 48.307 8.548 1.00 26.77 C ATOM 1335 OE1 GLU A 817 4.946 49.194 7.775 1.00 27.91 O ATOM 1336 OE2 GLU A 817 6.559 47.936 8.565 1.00 25.33 O ATOM 1337 H GLU A 817 5.150 47.307 12.463 1.00 0.00 H ATOM 1338 N PHE A 818 5.530 44.127 12.143 1.00 18.65 N ATOM 1339 CA PHE A 818 5.960 42.772 12.471 1.00 17.80 C ATOM 1340 C PHE A 818 4.929 42.040 13.339 1.00 18.71 C ATOM 1341 O PHE A 818 4.598 40.875 13.083 1.00 18.56 O ATOM 1342 CB PHE A 818 7.308 42.822 13.210 1.00 18.75 C ATOM 1343 CG PHE A 818 7.658 41.545 13.946 1.00 17.79 C ATOM 1344 CD1 PHE A 818 8.154 40.442 13.258 1.00 18.01 C ATOM 1345 CD2 PHE A 818 7.460 41.444 15.320 1.00 17.63 C ATOM 1346 CE1 PHE A 818 8.446 39.252 13.927 1.00 19.06 C ATOM 1347 CE2 PHE A 818 7.747 40.267 16.004 1.00 17.17 C ATOM 1348 CZ PHE A 818 8.242 39.164 15.303 1.00 18.95 C ATOM 1349 H PHE A 818 6.153 44.923 12.389 1.00 0.00 H ATOM 1350 N LEU A 819 4.438 42.722 14.371 1.00 17.74 N ATOM 1351 CA LEU A 819 3.465 42.136 15.284 1.00 18.14 C ATOM 1352 C LEU A 819 2.162 41.704 14.596 1.00 18.50 C ATOM 1353 O LEU A 819 1.637 40.627 14.878 1.00 16.78 O ATOM 1354 CB LEU A 819 3.185 43.105 16.438 1.00 17.89 C ATOM 1355 CG LEU A 819 4.356 43.333 17.422 1.00 19.87 C ATOM 1356 CD1 LEU A 819 4.073 44.533 18.318 1.00 16.59 C ATOM 1357 CD2 LEU A 819 4.627 42.074 18.261 1.00 17.52 C ATOM 1358 H LEU A 819 4.757 43.699 14.530 1.00 0.00 H ATOM 1359 N CYS A 820 1.654 42.534 13.687 1.00 18.65 N ATOM 1360 CA CYS A 820 0.418 42.211 12.968 1.00 20.63 C ATOM 1361 C CYS A 820 0.639 41.102 11.943 1.00 20.62 C ATOM 1362 O CYS A 820 -0.209 40.227 11.781 1.00 20.54 O ATOM 1363 CB CYS A 820 -0.158 43.451 12.284 1.00 20.72 C ATOM 1364 SG CYS A 820 -0.680 44.736 13.436 1.00 22.76 S ATOM 1365 H CYS A 820 2.144 43.429 13.483 1.00 0.00 H ATOM 1366 N MET A 821 1.797 41.133 11.284 1.00 21.07 N ATOM 1367 CA MET A 821 2.163 40.125 10.291 1.00 21.79 C ATOM 1368 C MET A 821 2.283 38.758 10.952 1.00 21.18 C ATOM 1369 O MET A 821 1.867 37.742 10.387 1.00 21.01 O ATOM 1370 CB MET A 821 3.504 40.478 9.637 1.00 22.31 C ATOM 1371 CG MET A 821 3.460 41.655 8.673 1.00 22.34 C ATOM 1372 SD MET A 821 5.096 42.017 7.983 1.00 27.04 S ATOM 1373 CE MET A 821 5.381 40.514 6.974 1.00 22.39 C ATOM 1374 H MET A 821 2.466 41.904 11.484 1.00 0.00 H ATOM 1375 N LYS A 822 2.836 38.745 12.162 1.00 20.34 N ATOM 1376 CA LYS A 822 3.021 37.502 12.904 1.00 20.95 C ATOM 1377 C LYS A 822 1.698 36.796 13.203 1.00 21.08 C ATOM 1378 O LYS A 822 1.598 35.574 13.055 1.00 20.64 O ATOM 1379 CB LYS A 822 3.796 37.761 14.196 1.00 19.93 C ATOM 1380 CG LYS A 822 4.237 36.501 14.912 1.00 21.53 C ATOM 1381 CD LYS A 822 5.446 36.785 15.800 1.00 24.81 C ATOM 1382 CE LYS A 822 5.062 37.477 17.096 1.00 23.00 C ATOM 1383 NZ LYS A 822 4.783 36.457 18.151 1.00 27.07 N ATOM 1384 HZ1 LYS A 822 4.000 35.846 17.842 1.00 0.00 H ATOM 1385 HZ2 LYS A 822 5.634 35.880 18.308 1.00 0.00 H ATOM 1386 HZ3 LYS A 822 4.521 36.937 19.035 1.00 0.00 H ATOM 1387 H LYS A 822 3.144 39.642 12.589 1.00 0.00 H ATOM 1388 N VAL A 823 0.691 37.562 13.620 1.00 20.21 N ATOM 1389 CA VAL A 823 -0.618 36.999 13.911 1.00 19.97 C ATOM 1390 C VAL A 823 -1.204 36.413 12.615 1.00 20.60 C ATOM 1391 O VAL A 823 -1.785 35.320 12.619 1.00 19.29 O ATOM 1392 CB VAL A 823 -1.593 38.075 14.450 1.00 20.75 C ATOM 1393 CG1 VAL A 823 -2.896 37.429 14.867 1.00 20.11 C ATOM 1394 CG2 VAL A 823 -0.978 38.809 15.622 1.00 19.79 C ATOM 1395 H VAL A 823 0.844 38.584 13.740 1.00 0.00 H ATOM 1396 N LEU A 824 -1.016 37.133 11.509 1.00 18.99 N ATOM 1397 CA LEU A 824 -1.516 36.693 10.216 1.00 18.95 C ATOM 1398 C LEU A 824 -0.926 35.352 9.774 1.00 18.64 C ATOM 1399 O LEU A 824 -1.570 34.610 9.025 1.00 16.94 O ATOM 1400 CB LEU A 824 -1.293 37.778 9.149 1.00 19.18 C ATOM 1401 CG LEU A 824 -2.242 38.972 9.272 1.00 18.51 C ATOM 1402 CD1 LEU A 824 -1.893 40.053 8.262 1.00 18.67 C ATOM 1403 CD2 LEU A 824 -3.674 38.494 9.078 1.00 18.51 C ATOM 1404 H LEU A 824 -0.498 38.033 11.572 1.00 0.00 H ATOM 1405 N LEU A 825 0.284 35.039 10.238 1.00 18.62 N ATOM 1406 CA LEU A 825 0.919 33.765 9.902 1.00 19.64 C ATOM 1407 C LEU A 825 0.204 32.616 10.602 1.00 20.58 C ATOM 1408 O LEU A 825 0.112 31.507 10.062 1.00 22.03 O ATOM 1409 CB LEU A 825 2.391 33.755 10.305 1.00 18.81 C ATOM 1410 CG LEU A 825 3.343 34.477 9.360 1.00 21.53 C ATOM 1411 CD1 LEU A 825 4.719 34.538 9.989 1.00 20.65 C ATOM 1412 CD2 LEU A 825 3.381 33.761 8.001 1.00 20.98 C ATOM 1413 H LEU A 825 0.786 35.713 10.850 1.00 0.00 H ATOM 1414 N LEU A 826 -0.275 32.876 11.817 1.00 19.77 N ATOM 1415 CA LEU A 826 -0.992 31.869 12.583 1.00 19.66 C ATOM 1416 C LEU A 826 -2.334 31.578 11.906 1.00 20.36 C ATOM 1417 O LEU A 826 -2.902 30.501 12.062 1.00 20.61 O ATOM 1418 CB LEU A 826 -1.230 32.368 14.016 1.00 17.77 C ATOM 1419 CG LEU A 826 -2.112 31.490 14.918 1.00 18.30 C ATOM 1420 CD1 LEU A 826 -1.372 30.224 15.343 1.00 15.90 C ATOM 1421 CD2 LEU A 826 -2.539 32.269 16.134 1.00 17.66 C ATOM 1422 H LEU A 826 -0.133 33.821 12.228 1.00 0.00 H ATOM 1423 N LEU A 827 -2.809 32.536 11.114 1.00 21.77 N ATOM 1424 CA LEU A 827 -4.098 32.417 10.436 1.00 21.85 C ATOM 1425 C LEU A 827 -3.967 32.355 8.909 1.00 23.33 C ATOM 1426 O LEU A 827 -4.853 32.831 8.193 1.00 23.56 O ATOM 1427 CB LEU A 827 -4.955 33.627 10.822 1.00 20.44 C ATOM 1428 CG LEU A 827 -4.937 34.076 12.296 1.00 19.54 C ATOM 1429 CD1 LEU A 827 -5.745 35.362 12.458 1.00 17.39 C ATOM 1430 CD2 LEU A 827 -5.486 32.981 13.216 1.00 19.41 C ATOM 1431 H LEU A 827 -2.244 33.398 10.973 1.00 0.00 H ATOM 1432 N ASN A 828 -2.891 31.744 8.410 1.00 23.54 N ATOM 1433 CA ASN A 828 -2.658 31.686 6.960 1.00 23.41 C ATOM 1434 C ASN A 828 -2.920 30.350 6.276 1.00 23.78 C ATOM 1435 O ASN A 828 -2.844 30.253 5.046 1.00 22.33 O ATOM 1436 CB ASN A 828 -1.225 32.144 6.635 1.00 22.11 C ATOM 1437 CG ASN A 828 -0.166 31.094 6.978 1.00 19.99 C ATOM 1438 OD1 ASN A 828 0.979 31.201 6.547 1.00 19.38 O ATOM 1439 ND2 ASN A 828 -0.542 30.087 7.755 1.00 20.27 N ATOM 1440 HD22 ASN A 828 -1.522 30.033 8.099 1.00 0.00 H ATOM 1441 HD21 ASN A 828 0.143 29.351 8.020 1.00 0.00 H ATOM 1442 H ASN A 828 -2.207 31.302 9.057 1.00 0.00 H ATOM 1443 N THR A 829 -3.181 29.319 7.072 1.00 23.95 N ATOM 1444 CA THR A 829 -3.431 27.987 6.538 1.00 24.58 C ATOM 1445 C THR A 829 -4.511 27.272 7.338 1.00 25.18 C ATOM 1446 O THR A 829 -4.468 27.240 8.576 1.00 23.62 O ATOM 1447 CB THR A 829 -2.159 27.098 6.596 1.00 24.32 C ATOM 1448 OG1 THR A 829 -1.045 27.797 6.031 1.00 25.49 O ATOM 1449 CG2 THR A 829 -2.381 25.807 5.832 1.00 22.86 C ATOM 1450 HG1 THR A 829 -0.240 27.222 6.073 1.00 0.00 H ATOM 1451 H THR A 829 -3.207 29.466 8.101 1.00 0.00 H ATOM 1452 N ILE A 830 -5.478 26.710 6.615 1.00 26.88 N ATOM 1453 CA ILE A 830 -6.573 25.951 7.216 1.00 28.66 C ATOM 1454 C ILE A 830 -6.727 24.639 6.444 1.00 29.78 C ATOM 1455 O ILE A 830 -6.169 24.478 5.353 1.00 27.50 O ATOM 1456 CB ILE A 830 -7.920 26.736 7.189 1.00 28.40 C ATOM 1457 CG1 ILE A 830 -8.357 27.020 5.752 1.00 27.95 C ATOM 1458 CG2 ILE A 830 -7.785 28.049 7.955 1.00 29.00 C ATOM 1459 CD1 ILE A 830 -9.712 27.706 5.660 1.00 26.59 C ATOM 1460 H ILE A 830 -5.453 26.815 5.581 1.00 0.00 H ATOM 1461 N PRO A 831 -7.422 23.655 7.032 1.00 31.44 N ATOM 1462 CA PRO A 831 -7.583 22.394 6.300 1.00 32.45 C ATOM 1463 C PRO A 831 -8.517 22.567 5.110 1.00 33.11 C ATOM 1464 O PRO A 831 -9.252 23.553 5.022 1.00 32.43 O ATOM 1465 CB PRO A 831 -8.136 21.436 7.364 1.00 33.07 C ATOM 1466 CG PRO A 831 -8.808 22.339 8.349 1.00 33.73 C ATOM 1467 CD PRO A 831 -7.902 23.536 8.419 1.00 32.44 C ATOM 1468 N LEU A 832 -8.429 21.632 4.168 1.00 35.06 N ATOM 1469 CA LEU A 832 -9.242 21.649 2.953 1.00 35.67 C ATOM 1470 C LEU A 832 -10.745 21.743 3.236 1.00 35.87 C ATOM 1471 O LEU A 832 -11.477 22.437 2.529 1.00 35.11 O ATOM 1472 CB LEU A 832 -8.929 20.411 2.104 1.00 35.73 C ATOM 1473 CG LEU A 832 -7.524 20.377 1.488 1.00 36.21 C ATOM 1474 CD1 LEU A 832 -7.295 19.044 0.787 1.00 36.59 C ATOM 1475 CD2 LEU A 832 -7.351 21.531 0.506 1.00 34.66 C ATOM 1476 H LEU A 832 -7.752 20.854 4.302 1.00 0.00 H ATOM 1477 N GLU A 833 -11.187 21.057 4.285 1.00 36.59 N ATOM 1478 CA GLU A 833 -12.590 21.057 4.685 1.00 38.08 C ATOM 1479 C GLU A 833 -12.953 22.349 5.425 1.00 38.19 C ATOM 1480 O GLU A 833 -14.123 22.736 5.479 1.00 39.57 O ATOM 1481 CB GLU A 833 -12.872 19.846 5.586 1.00 39.86 C ATOM 1482 CG GLU A 833 -12.148 19.889 6.935 1.00 43.60 C ATOM 1483 CD GLU A 833 -11.603 18.532 7.371 1.00 46.12 C ATOM 1484 OE1 GLU A 833 -12.409 17.635 7.710 1.00 46.71 O ATOM 1485 OE2 GLU A 833 -10.360 18.367 7.376 1.00 47.15 O ATOM 1486 H GLU A 833 -10.508 20.500 4.841 1.00 0.00 H ATOM 1487 N GLY A 834 -11.945 23.014 5.986 1.00 36.85 N ATOM 1488 CA GLY A 834 -12.181 24.241 6.729 1.00 33.60 C ATOM 1489 C GLY A 834 -12.227 23.981 8.228 1.00 32.61 C ATOM 1490 O GLY A 834 -12.027 22.848 8.675 1.00 31.70 O ATOM 1491 H GLY A 834 -10.975 22.650 5.891 1.00 0.00 H ATOM 1492 N LEU A 835 -12.484 25.032 9.002 1.00 30.79 N ATOM 1493 CA LEU A 835 -12.556 24.936 10.455 1.00 31.38 C ATOM 1494 C LEU A 835 -13.990 24.815 10.983 1.00 31.93 C ATOM 1495 O LEU A 835 -14.958 25.081 10.264 1.00 31.34 O ATOM 1496 CB LEU A 835 -11.904 26.172 11.086 1.00 31.68 C ATOM 1497 CG LEU A 835 -10.407 26.234 11.407 1.00 31.29 C ATOM 1498 CD1 LEU A 835 -9.646 25.083 10.789 1.00 29.53 C ATOM 1499 CD2 LEU A 835 -9.860 27.575 10.961 1.00 28.74 C ATOM 1500 H LEU A 835 -12.639 25.957 8.554 1.00 0.00 H ATOM 1501 N ARG A 836 -14.112 24.427 12.252 1.00 32.10 N ATOM 1502 CA ARG A 836 -15.415 24.298 12.898 1.00 33.18 C ATOM 1503 C ARG A 836 -16.007 25.683 13.153 1.00 31.59 C ATOM 1504 O ARG A 836 -17.203 25.903 12.954 1.00 32.44 O ATOM 1505 CB ARG A 836 -15.296 23.505 14.204 1.00 35.67 C ATOM 1506 CG ARG A 836 -14.809 22.087 13.961 1.00 41.27 C ATOM 1507 CD ARG A 836 -14.858 21.194 15.189 1.00 45.52 C ATOM 1508 NE ARG A 836 -14.368 19.859 14.842 1.00 50.58 N ATOM 1509 CZ ARG A 836 -14.337 18.814 15.668 1.00 52.29 C ATOM 1510 NH1 ARG A 836 -14.772 18.927 16.920 1.00 52.72 N ATOM 1511 NH2 ARG A 836 -13.848 17.653 15.243 1.00 52.51 N ATOM 1512 HE ARG A 836 -14.016 19.715 13.874 1.00 0.00 H ATOM 1513 HH12 ARG A 836 -14.743 18.105 17.557 1.00 0.00 H ATOM 1514 HH11 ARG A 836 -15.141 19.837 17.262 1.00 0.00 H ATOM 1515 HH22 ARG A 836 -13.821 16.834 15.884 1.00 0.00 H ATOM 1516 HH21 ARG A 836 -13.492 17.564 14.270 1.00 0.00 H ATOM 1517 H ARG A 836 -13.254 24.210 12.798 1.00 0.00 H ATOM 1518 N SER A 837 -15.157 26.614 13.576 1.00 28.96 N ATOM 1519 CA SER A 837 -15.578 27.985 13.830 1.00 27.07 C ATOM 1520 C SER A 837 -15.110 28.835 12.642 1.00 26.58 C ATOM 1521 O SER A 837 -14.466 29.872 12.820 1.00 25.30 O ATOM 1522 CB SER A 837 -14.945 28.496 15.125 1.00 27.25 C ATOM 1523 OG SER A 837 -15.183 27.609 16.203 1.00 25.68 O ATOM 1524 HG SER A 837 -14.761 27.968 17.024 1.00 0.00 H ATOM 1525 H SER A 837 -14.162 26.355 13.730 1.00 0.00 H ATOM 1526 N GLN A 838 -15.463 28.396 11.434 1.00 26.45 N ATOM 1527 CA GLN A 838 -15.062 29.070 10.200 1.00 26.74 C ATOM 1528 C GLN A 838 -15.384 30.563 10.155 1.00 25.80 C ATOM 1529 O GLN A 838 -14.514 31.372 9.840 1.00 27.02 O ATOM 1530 CB GLN A 838 -15.657 28.344 8.980 1.00 28.11 C ATOM 1531 CG GLN A 838 -15.139 28.814 7.610 1.00 29.87 C ATOM 1532 CD GLN A 838 -13.634 28.612 7.438 1.00 31.61 C ATOM 1533 OE1 GLN A 838 -13.068 27.622 7.914 1.00 34.89 O ATOM 1534 NE2 GLN A 838 -12.980 29.559 6.773 1.00 28.18 N ATOM 1535 HE22 GLN A 838 -13.497 30.376 6.389 1.00 0.00 H ATOM 1536 HE21 GLN A 838 -11.952 29.483 6.637 1.00 0.00 H ATOM 1537 H GLN A 838 -16.048 27.539 11.366 1.00 0.00 H ATOM 1538 N THR A 839 -16.613 30.933 10.505 1.00 25.18 N ATOM 1539 CA THR A 839 -17.023 32.345 10.488 1.00 24.04 C ATOM 1540 C THR A 839 -16.239 33.178 11.510 1.00 24.62 C ATOM 1541 O THR A 839 -15.800 34.285 11.203 1.00 24.68 O ATOM 1542 CB THR A 839 -18.541 32.504 10.735 1.00 22.02 C ATOM 1543 OG1 THR A 839 -19.257 31.594 9.888 1.00 22.51 O ATOM 1544 CG2 THR A 839 -18.989 33.933 10.412 1.00 20.27 C ATOM 1545 HG1 THR A 839 -20.229 31.695 10.045 1.00 0.00 H ATOM 1546 H THR A 839 -17.299 30.208 10.797 1.00 0.00 H ATOM 1547 N GLN A 840 -16.061 32.640 12.714 1.00 24.68 N ATOM 1548 CA GLN A 840 -15.298 33.322 13.759 1.00 25.91 C ATOM 1549 C GLN A 840 -13.846 33.514 13.302 1.00 25.33 C ATOM 1550 O GLN A 840 -13.236 34.551 13.560 1.00 24.15 O ATOM 1551 CB GLN A 840 -15.338 32.528 15.074 1.00 27.14 C ATOM 1552 CG GLN A 840 -16.744 32.323 15.665 1.00 30.07 C ATOM 1553 CD GLN A 840 -17.523 31.135 15.058 1.00 32.31 C ATOM 1554 OE1 GLN A 840 -17.474 30.864 13.839 1.00 30.51 O ATOM 1555 NE2 GLN A 840 -18.271 30.441 15.916 1.00 31.77 N ATOM 1556 HE22 GLN A 840 -18.283 30.700 16.923 1.00 0.00 H ATOM 1557 HE21 GLN A 840 -18.842 29.640 15.578 1.00 0.00 H ATOM 1558 H GLN A 840 -16.476 31.708 12.918 1.00 0.00 H ATOM 1559 N PHE A 841 -13.315 32.521 12.591 1.00 25.22 N ATOM 1560 CA PHE A 841 -11.949 32.570 12.076 1.00 24.33 C ATOM 1561 C PHE A 841 -11.768 33.644 11.000 1.00 24.03 C ATOM 1562 O PHE A 841 -10.813 34.428 11.049 1.00 23.37 O ATOM 1563 CB PHE A 841 -11.542 31.203 11.515 1.00 23.54 C ATOM 1564 CG PHE A 841 -10.282 31.237 10.692 1.00 23.85 C ATOM 1565 CD1 PHE A 841 -10.343 31.240 9.300 1.00 22.42 C ATOM 1566 CD2 PHE A 841 -9.033 31.295 11.308 1.00 22.21 C ATOM 1567 CE1 PHE A 841 -9.183 31.305 8.542 1.00 23.28 C ATOM 1568 CE2 PHE A 841 -7.876 31.358 10.555 1.00 20.34 C ATOM 1569 CZ PHE A 841 -7.948 31.365 9.174 1.00 22.17 C ATOM 1570 H PHE A 841 -13.894 31.680 12.395 1.00 0.00 H ATOM 1571 N GLU A 842 -12.685 33.672 10.034 1.00 23.66 N ATOM 1572 CA GLU A 842 -12.617 34.640 8.945 1.00 23.78 C ATOM 1573 C GLU A 842 -12.692 36.061 9.478 1.00 22.77 C ATOM 1574 O GLU A 842 -11.987 36.950 8.994 1.00 21.17 O ATOM 1575 CB GLU A 842 -13.721 34.380 7.901 1.00 25.64 C ATOM 1576 CG GLU A 842 -13.645 32.978 7.261 1.00 31.37 C ATOM 1577 CD GLU A 842 -14.766 32.673 6.247 1.00 35.00 C ATOM 1578 OE1 GLU A 842 -14.892 31.492 5.844 1.00 34.56 O ATOM 1579 OE2 GLU A 842 -15.518 33.598 5.846 1.00 37.99 O ATOM 1580 H GLU A 842 -13.468 32.988 10.057 1.00 0.00 H ATOM 1581 N GLU A 843 -13.507 36.263 10.512 1.00 22.57 N ATOM 1582 CA GLU A 843 -13.658 37.591 11.107 1.00 22.58 C ATOM 1583 C GLU A 843 -12.357 38.015 11.800 1.00 21.57 C ATOM 1584 O GLU A 843 -11.914 39.164 11.664 1.00 21.60 O ATOM 1585 CB GLU A 843 -14.832 37.599 12.090 1.00 23.49 C ATOM 1586 CG GLU A 843 -15.398 38.985 12.386 1.00 26.05 C ATOM 1587 CD GLU A 843 -14.456 39.850 13.198 1.00 29.75 C ATOM 1588 OE1 GLU A 843 -13.798 39.302 14.106 1.00 29.82 O ATOM 1589 OE2 GLU A 843 -14.364 41.074 12.923 1.00 33.62 O ATOM 1590 H GLU A 843 -14.045 35.463 10.903 1.00 0.00 H ATOM 1591 N MET A 844 -11.747 37.080 12.526 1.00 20.79 N ATOM 1592 CA MET A 844 -10.493 37.329 13.227 1.00 22.18 C ATOM 1593 C MET A 844 -9.399 37.668 12.208 1.00 22.58 C ATOM 1594 O MET A 844 -8.658 38.636 12.374 1.00 20.51 O ATOM 1595 CB MET A 844 -10.089 36.091 14.039 1.00 23.93 C ATOM 1596 CG MET A 844 -8.845 36.283 14.902 1.00 25.74 C ATOM 1597 SD MET A 844 -8.382 34.796 15.855 1.00 28.18 S ATOM 1598 CE MET A 844 -6.672 35.219 16.353 1.00 28.24 C ATOM 1599 H MET A 844 -12.181 36.137 12.596 1.00 0.00 H ATOM 1600 N ARG A 845 -9.333 36.893 11.128 1.00 22.92 N ATOM 1601 CA ARG A 845 -8.336 37.138 10.096 1.00 24.09 C ATOM 1602 C ARG A 845 -8.522 38.541 9.512 1.00 24.50 C ATOM 1603 O ARG A 845 -7.566 39.304 9.368 1.00 24.96 O ATOM 1604 CB ARG A 845 -8.418 36.070 9.002 1.00 23.11 C ATOM 1605 CG ARG A 845 -7.316 36.180 7.972 1.00 24.03 C ATOM 1606 CD ARG A 845 -7.246 34.953 7.062 1.00 25.39 C ATOM 1607 NE ARG A 845 -6.118 35.059 6.145 1.00 25.10 N ATOM 1608 CZ ARG A 845 -6.186 35.619 4.942 1.00 26.92 C ATOM 1609 NH1 ARG A 845 -7.337 36.115 4.497 1.00 28.68 N ATOM 1610 NH2 ARG A 845 -5.090 35.736 4.204 1.00 27.68 N ATOM 1611 HE ARG A 845 -5.203 34.672 6.452 1.00 0.00 H ATOM 1612 HH12 ARG A 845 -7.385 36.552 3.555 1.00 0.00 H ATOM 1613 HH11 ARG A 845 -8.189 36.066 5.091 1.00 0.00 H ATOM 1614 HH22 ARG A 845 -5.142 36.174 3.262 1.00 0.00 H ATOM 1615 HH21 ARG A 845 -4.179 35.390 4.567 1.00 0.00 H ATOM 1616 H ARG A 845 -10.001 36.103 11.020 1.00 0.00 H ATOM 1617 N SER A 846 -9.771 38.907 9.262 1.00 24.77 N ATOM 1618 CA SER A 846 -10.072 40.218 8.717 1.00 25.85 C ATOM 1619 C SER A 846 -9.693 41.375 9.657 1.00 26.44 C ATOM 1620 O SER A 846 -9.292 42.447 9.191 1.00 26.39 O ATOM 1621 CB SER A 846 -11.544 40.296 8.344 1.00 25.93 C ATOM 1622 OG SER A 846 -11.763 41.427 7.532 1.00 32.97 O ATOM 1623 HG SER A 846 -11.504 42.243 8.028 1.00 0.00 H ATOM 1624 H SER A 846 -10.548 38.244 9.459 1.00 0.00 H ATOM 1625 N SER A 847 -9.812 41.161 10.970 1.00 26.43 N ATOM 1626 CA SER A 847 -9.467 42.197 11.950 1.00 26.81 C ATOM 1627 C SER A 847 -7.975 42.475 11.961 1.00 25.77 C ATOM 1628 O SER A 847 -7.556 43.628 12.042 1.00 26.18 O ATOM 1629 CB SER A 847 -9.897 41.802 13.366 1.00 28.75 C ATOM 1630 OG SER A 847 -11.295 41.623 13.445 1.00 35.49 O ATOM 1631 HG SER A 847 -11.571 40.907 12.820 1.00 0.00 H ATOM 1632 H SER A 847 -10.157 40.239 11.305 1.00 0.00 H ATOM 1633 N TYR A 848 -7.167 41.421 11.912 1.00 24.86 N ATOM 1634 CA TYR A 848 -5.721 41.612 11.911 1.00 24.61 C ATOM 1635 C TYR A 848 -5.190 42.180 10.599 1.00 23.82 C ATOM 1636 O TYR A 848 -4.134 42.817 10.582 1.00 24.35 O ATOM 1637 CB TYR A 848 -4.998 40.344 12.348 1.00 23.35 C ATOM 1638 CG TYR A 848 -5.162 40.119 13.838 1.00 24.58 C ATOM 1639 CD1 TYR A 848 -4.343 40.788 14.758 1.00 23.17 C ATOM 1640 CD2 TYR A 848 -6.165 39.286 14.333 1.00 22.23 C ATOM 1641 CE1 TYR A 848 -4.517 40.632 16.124 1.00 21.46 C ATOM 1642 CE2 TYR A 848 -6.350 39.124 15.701 1.00 23.34 C ATOM 1643 CZ TYR A 848 -5.524 39.797 16.592 1.00 23.79 C ATOM 1644 OH TYR A 848 -5.705 39.631 17.950 1.00 22.74 O ATOM 1645 HH TYR A 848 -5.039 40.176 18.440 1.00 0.00 H ATOM 1646 H TYR A 848 -7.565 40.461 11.874 1.00 0.00 H ATOM 1647 N ILE A 849 -5.958 42.003 9.523 1.00 22.88 N ATOM 1648 CA ILE A 849 -5.598 42.550 8.218 1.00 22.93 C ATOM 1649 C ILE A 849 -5.771 44.069 8.347 1.00 23.96 C ATOM 1650 O ILE A 849 -4.912 44.839 7.916 1.00 24.60 O ATOM 1651 CB ILE A 849 -6.508 41.991 7.089 1.00 22.64 C ATOM 1652 CG1 ILE A 849 -6.225 40.498 6.875 1.00 21.73 C ATOM 1653 CG2 ILE A 849 -6.295 42.775 5.787 1.00 21.21 C ATOM 1654 CD1 ILE A 849 -7.124 39.817 5.833 1.00 21.03 C ATOM 1655 H ILE A 849 -6.840 41.459 9.616 1.00 0.00 H ATOM 1656 N ARG A 850 -6.859 44.486 8.999 1.00 25.33 N ATOM 1657 CA ARG A 850 -7.135 45.904 9.234 1.00 25.56 C ATOM 1658 C ARG A 850 -6.091 46.506 10.166 1.00 24.60 C ATOM 1659 O ARG A 850 -5.716 47.669 10.016 1.00 23.70 O ATOM 1660 CB ARG A 850 -8.506 46.103 9.878 1.00 28.00 C ATOM 1661 CG ARG A 850 -9.682 45.938 8.952 1.00 32.51 C ATOM 1662 CD ARG A 850 -10.914 46.612 9.542 1.00 34.64 C ATOM 1663 NE ARG A 850 -11.264 46.104 10.874 1.00 37.19 N ATOM 1664 CZ ARG A 850 -11.931 44.971 11.098 1.00 37.07 C ATOM 1665 NH1 ARG A 850 -12.326 44.209 10.078 1.00 35.56 N ATOM 1666 NH2 ARG A 850 -12.224 44.611 12.347 1.00 37.65 N ATOM 1667 HE ARG A 850 -10.972 46.666 11.699 1.00 0.00 H ATOM 1668 HH12 ARG A 850 -12.846 43.327 10.259 1.00 0.00 H ATOM 1669 HH11 ARG A 850 -12.114 44.497 9.101 1.00 0.00 H ATOM 1670 HH22 ARG A 850 -12.744 43.728 12.525 1.00 0.00 H ATOM 1671 HH21 ARG A 850 -11.933 45.213 13.144 1.00 0.00 H ATOM 1672 H ARG A 850 -7.534 43.778 9.352 1.00 0.00 H ATOM 1673 N GLU A 851 -5.649 45.727 11.151 1.00 23.97 N ATOM 1674 CA GLU A 851 -4.651 46.224 12.084 1.00 23.18 C ATOM 1675 C GLU A 851 -3.326 46.456 11.361 1.00 22.81 C ATOM 1676 O GLU A 851 -2.665 47.466 11.604 1.00 23.47 O ATOM 1677 CB GLU A 851 -4.466 45.264 13.256 1.00 23.20 C ATOM 1678 CG GLU A 851 -3.945 45.952 14.509 1.00 25.72 C ATOM 1679 CD GLU A 851 -4.917 46.998 15.064 1.00 27.90 C ATOM 1680 OE1 GLU A 851 -4.503 47.790 15.928 1.00 28.29 O ATOM 1681 OE2 GLU A 851 -6.102 47.023 14.660 1.00 29.52 O ATOM 1682 H GLU A 851 -6.019 44.760 11.253 1.00 0.00 H ATOM 1683 N LEU A 852 -2.942 45.528 10.479 1.00 21.87 N ATOM 1684 CA LEU A 852 -1.704 45.672 9.706 1.00 21.94 C ATOM 1685 C LEU A 852 -1.764 46.972 8.902 1.00 21.94 C ATOM 1686 O LEU A 852 -0.780 47.703 8.819 1.00 21.88 O ATOM 1687 CB LEU A 852 -1.505 44.481 8.761 1.00 21.49 C ATOM 1688 CG LEU A 852 -0.330 44.521 7.767 1.00 22.21 C ATOM 1689 CD1 LEU A 852 0.985 44.835 8.475 1.00 20.95 C ATOM 1690 CD2 LEU A 852 -0.235 43.188 7.042 1.00 20.20 C ATOM 1691 H LEU A 852 -3.534 44.685 10.338 1.00 0.00 H ATOM 1692 N ILE A 853 -2.936 47.267 8.342 1.00 22.64 N ATOM 1693 CA ILE A 853 -3.143 48.492 7.571 1.00 24.05 C ATOM 1694 C ILE A 853 -2.954 49.714 8.474 1.00 25.13 C ATOM 1695 O ILE A 853 -2.409 50.727 8.039 1.00 26.56 O ATOM 1696 CB ILE A 853 -4.548 48.516 6.907 1.00 24.61 C ATOM 1697 CG1 ILE A 853 -4.643 47.410 5.857 1.00 22.25 C ATOM 1698 CG2 ILE A 853 -4.816 49.880 6.257 1.00 24.54 C ATOM 1699 CD1 ILE A 853 -6.045 47.194 5.316 1.00 23.33 C ATOM 1700 H ILE A 853 -3.729 46.605 8.457 1.00 0.00 H ATOM 1701 N LYS A 854 -3.376 49.608 9.732 1.00 25.11 N ATOM 1702 CA LYS A 854 -3.206 50.701 10.690 1.00 26.26 C ATOM 1703 C LYS A 854 -1.725 50.852 11.033 1.00 26.40 C ATOM 1704 O LYS A 854 -1.232 51.970 11.207 1.00 26.77 O ATOM 1705 CB LYS A 854 -3.982 50.433 11.984 1.00 28.36 C ATOM 1706 CG LYS A 854 -5.429 50.885 11.987 1.00 30.31 C ATOM 1707 CD LYS A 854 -6.073 50.529 13.322 1.00 32.71 C ATOM 1708 CE LYS A 854 -7.526 50.972 13.405 1.00 34.31 C ATOM 1709 NZ LYS A 854 -8.110 50.652 14.746 1.00 36.39 N ATOM 1710 HZ1 LYS A 854 -8.064 49.625 14.907 1.00 0.00 H ATOM 1711 HZ2 LYS A 854 -7.568 51.144 15.485 1.00 0.00 H ATOM 1712 HZ3 LYS A 854 -9.101 50.965 14.775 1.00 0.00 H ATOM 1713 H LYS A 854 -3.837 48.728 10.041 1.00 0.00 H ATOM 1714 N ALA A 855 -1.035 49.720 11.173 1.00 25.38 N ATOM 1715 CA ALA A 855 0.394 49.718 11.485 1.00 24.55 C ATOM 1716 C ALA A 855 1.145 50.430 10.361 1.00 25.08 C ATOM 1717 O ALA A 855 1.998 51.282 10.613 1.00 25.27 O ATOM 1718 CB ALA A 855 0.902 48.288 11.645 1.00 23.68 C ATOM 1719 H ALA A 855 -1.527 48.811 11.057 1.00 0.00 H ATOM 1720 N ILE A 856 0.789 50.101 9.120 1.00 24.86 N ATOM 1721 CA ILE A 856 1.407 50.709 7.947 1.00 23.79 C ATOM 1722 C ILE A 856 1.142 52.214 7.929 1.00 24.25 C ATOM 1723 O ILE A 856 2.042 53.001 7.647 1.00 25.43 O ATOM 1724 CB ILE A 856 0.857 50.072 6.642 1.00 22.48 C ATOM 1725 CG1 ILE A 856 1.559 48.741 6.366 1.00 20.60 C ATOM 1726 CG2 ILE A 856 1.013 51.024 5.466 1.00 21.44 C ATOM 1727 CD1 ILE A 856 0.700 47.737 5.654 1.00 19.18 C ATOM 1728 H ILE A 856 0.046 49.387 8.983 1.00 0.00 H ATOM 1729 N GLY A 857 -0.090 52.601 8.254 1.00 25.42 N ATOM 1730 CA GLY A 857 -0.472 54.003 8.261 1.00 25.47 C ATOM 1731 C GLY A 857 0.302 54.880 9.231 1.00 27.39 C ATOM 1732 O GLY A 857 0.324 56.098 9.079 1.00 26.86 O ATOM 1733 H GLY A 857 -0.797 51.882 8.509 1.00 0.00 H ATOM 1734 N LEU A 858 0.928 54.267 10.231 1.00 29.01 N ATOM 1735 CA LEU A 858 1.707 55.006 11.217 1.00 32.07 C ATOM 1736 C LEU A 858 2.888 55.749 10.596 1.00 35.14 C ATOM 1737 O LEU A 858 3.327 56.774 11.117 1.00 36.02 O ATOM 1738 CB LEU A 858 2.222 54.067 12.312 1.00 31.11 C ATOM 1739 CG LEU A 858 1.240 53.559 13.368 1.00 29.42 C ATOM 1740 CD1 LEU A 858 1.994 52.672 14.351 1.00 28.18 C ATOM 1741 CD2 LEU A 858 0.609 54.738 14.094 1.00 28.11 C ATOM 1742 H LEU A 858 0.860 53.232 10.312 1.00 0.00 H ATOM 1743 N ARG A 859 3.409 55.225 9.493 1.00 37.68 N ATOM 1744 CA ARG A 859 4.541 55.855 8.825 1.00 40.83 C ATOM 1745 C ARG A 859 4.235 56.200 7.375 1.00 42.71 C ATOM 1746 O ARG A 859 4.608 57.274 6.903 1.00 44.07 O ATOM 1747 CB ARG A 859 5.789 54.974 8.940 1.00 41.13 C ATOM 1748 CG ARG A 859 6.299 54.867 10.378 1.00 42.45 C ATOM 1749 CD ARG A 859 7.435 53.867 10.539 1.00 44.09 C ATOM 1750 NE ARG A 859 7.963 53.864 11.904 1.00 45.60 N ATOM 1751 CZ ARG A 859 7.373 53.286 12.953 1.00 46.63 C ATOM 1752 NH1 ARG A 859 6.219 52.642 12.816 1.00 45.70 N ATOM 1753 NH2 ARG A 859 7.940 53.364 14.152 1.00 45.96 N ATOM 1754 HE ARG A 859 8.868 54.350 12.070 1.00 0.00 H ATOM 1755 HH12 ARG A 859 5.771 52.196 13.642 1.00 0.00 H ATOM 1756 HH11 ARG A 859 5.764 52.583 11.883 1.00 0.00 H ATOM 1757 HH22 ARG A 859 7.485 52.916 14.973 1.00 0.00 H ATOM 1758 HH21 ARG A 859 8.839 53.873 14.270 1.00 0.00 H ATOM 1759 H ARG A 859 3.003 54.352 9.100 1.00 0.00 H ATOM 1760 N GLN A 860 3.532 55.313 6.675 1.00 43.86 N ATOM 1761 CA GLN A 860 3.177 55.567 5.280 1.00 44.81 C ATOM 1762 C GLN A 860 1.980 56.505 5.181 1.00 45.66 C ATOM 1763 O GLN A 860 0.827 56.080 5.336 1.00 45.26 O ATOM 1764 CB GLN A 860 2.868 54.262 4.544 1.00 44.92 C ATOM 1765 CG GLN A 860 4.010 53.262 4.530 1.00 45.61 C ATOM 1766 CD GLN A 860 5.242 53.785 3.827 1.00 46.05 C ATOM 1767 OE1 GLN A 860 5.143 54.515 2.841 1.00 47.58 O ATOM 1768 NE2 GLN A 860 6.413 53.419 4.334 1.00 45.67 N ATOM 1769 HE22 GLN A 860 6.447 52.800 5.169 1.00 0.00 H ATOM 1770 HE21 GLN A 860 7.296 53.751 3.896 1.00 0.00 H ATOM 1771 H GLN A 860 3.231 54.426 7.127 1.00 0.00 H ATOM 1772 N LYS A 861 2.268 57.787 4.964 1.00 46.30 N ATOM 1773 CA LYS A 861 1.230 58.806 4.824 1.00 47.09 C ATOM 1774 C LYS A 861 0.825 58.919 3.354 1.00 46.91 C ATOM 1775 O LYS A 861 1.635 59.301 2.500 1.00 48.64 O ATOM 1776 CB LYS A 861 1.728 60.163 5.343 1.00 48.24 C ATOM 1777 CG LYS A 861 2.157 60.172 6.817 1.00 49.13 C ATOM 1778 CD LYS A 861 1.656 58.954 7.583 1.00 49.56 C ATOM 1779 CE LYS A 861 1.913 59.092 9.077 1.00 49.70 C ATOM 1780 NZ LYS A 861 0.791 59.786 9.774 1.00 50.06 N ATOM 1781 HZ1 LYS A 861 0.673 60.739 9.374 1.00 0.00 H ATOM 1782 HZ2 LYS A 861 -0.086 59.242 9.643 1.00 0.00 H ATOM 1783 HZ3 LYS A 861 1.007 59.859 10.789 1.00 0.00 H ATOM 1784 H LYS A 861 3.265 58.073 4.892 1.00 0.00 H ATOM 1785 N GLY A 862 -0.427 58.577 3.063 1.00 45.19 N ATOM 1786 CA GLY A 862 -0.917 58.629 1.697 1.00 41.68 C ATOM 1787 C GLY A 862 -1.456 57.274 1.295 1.00 40.56 C ATOM 1788 O GLY A 862 -0.892 56.239 1.667 1.00 39.96 O ATOM 1789 H GLY A 862 -1.064 58.268 3.825 1.00 0.00 H ATOM 1790 N VAL A 863 -2.540 57.281 0.526 1.00 38.66 N ATOM 1791 CA VAL A 863 -3.182 56.052 0.075 1.00 37.75 C ATOM 1792 C VAL A 863 -2.358 55.223 -0.940 1.00 36.49 C ATOM 1793 O VAL A 863 -2.457 53.994 -0.956 1.00 35.93 O ATOM 1794 CB VAL A 863 -4.601 56.358 -0.480 1.00 38.67 C ATOM 1795 CG1 VAL A 863 -4.511 57.127 -1.795 1.00 39.15 C ATOM 1796 CG2 VAL A 863 -5.407 55.073 -0.644 1.00 39.25 C ATOM 1797 H VAL A 863 -2.944 58.194 0.236 1.00 0.00 H ATOM 1798 N VAL A 864 -1.559 55.892 -1.777 1.00 34.38 N ATOM 1799 CA VAL A 864 -0.719 55.212 -2.775 1.00 31.53 C ATOM 1800 C VAL A 864 0.466 54.518 -2.093 1.00 29.53 C ATOM 1801 O VAL A 864 0.738 53.352 -2.366 1.00 28.54 O ATOM 1802 CB VAL A 864 -0.212 56.198 -3.897 1.00 32.70 C ATOM 1803 CG1 VAL A 864 0.910 55.561 -4.717 1.00 30.88 C ATOM 1804 CG2 VAL A 864 -1.361 56.581 -4.829 1.00 29.53 C ATOM 1805 H VAL A 864 -1.530 56.930 -1.721 1.00 0.00 H ATOM 1806 N SER A 865 1.155 55.233 -1.207 1.00 28.61 N ATOM 1807 CA SER A 865 2.286 54.669 -0.465 1.00 29.42 C ATOM 1808 C SER A 865 1.846 53.522 0.461 1.00 29.42 C ATOM 1809 O SER A 865 2.538 52.505 0.569 1.00 30.11 O ATOM 1810 CB SER A 865 2.984 55.753 0.364 1.00 30.03 C ATOM 1811 OG SER A 865 3.861 56.536 -0.431 1.00 33.77 O ATOM 1812 HG SER A 865 4.293 57.224 0.135 1.00 0.00 H ATOM 1813 H SER A 865 0.883 56.222 -1.036 1.00 0.00 H ATOM 1814 N SER A 866 0.709 53.703 1.135 1.00 28.13 N ATOM 1815 CA SER A 866 0.159 52.691 2.039 1.00 28.75 C ATOM 1816 C SER A 866 -0.197 51.424 1.275 1.00 28.26 C ATOM 1817 O SER A 866 0.092 50.304 1.718 1.00 26.87 O ATOM 1818 CB SER A 866 -1.107 53.211 2.734 1.00 28.64 C ATOM 1819 OG SER A 866 -0.807 54.291 3.605 1.00 30.15 O ATOM 1820 HG SER A 866 -0.405 55.031 3.085 1.00 0.00 H ATOM 1821 H SER A 866 0.193 54.598 1.014 1.00 0.00 H ATOM 1822 N SER A 867 -0.849 51.620 0.133 1.00 27.80 N ATOM 1823 CA SER A 867 -1.268 50.521 -0.724 1.00 28.05 C ATOM 1824 C SER A 867 -0.040 49.753 -1.228 1.00 27.30 C ATOM 1825 O SER A 867 -0.040 48.521 -1.285 1.00 27.27 O ATOM 1826 CB SER A 867 -2.076 51.077 -1.896 1.00 29.81 C ATOM 1827 OG SER A 867 -2.972 50.105 -2.396 1.00 34.32 O ATOM 1828 HG SER A 867 -3.483 50.487 -3.153 1.00 0.00 H ATOM 1829 H SER A 867 -1.068 52.594 -0.158 1.00 0.00 H ATOM 1830 N GLN A 868 1.016 50.491 -1.556 1.00 26.77 N ATOM 1831 CA GLN A 868 2.258 49.895 -2.033 1.00 27.32 C ATOM 1832 C GLN A 868 2.957 49.104 -0.916 1.00 25.91 C ATOM 1833 O GLN A 868 3.552 48.057 -1.174 1.00 25.44 O ATOM 1834 CB GLN A 868 3.178 50.987 -2.599 1.00 28.14 C ATOM 1835 CG GLN A 868 4.595 50.535 -2.929 1.00 30.59 C ATOM 1836 CD GLN A 868 4.648 49.432 -3.967 1.00 33.25 C ATOM 1837 OE1 GLN A 868 5.684 48.799 -4.149 1.00 36.36 O ATOM 1838 NE2 GLN A 868 3.537 49.201 -4.657 1.00 33.82 N ATOM 1839 HE22 GLN A 868 2.682 49.762 -4.469 1.00 0.00 H ATOM 1840 HE21 GLN A 868 3.522 48.459 -5.385 1.00 0.00 H ATOM 1841 H GLN A 868 0.954 51.526 -1.470 1.00 0.00 H ATOM 1842 N ARG A 869 2.862 49.600 0.318 1.00 24.88 N ATOM 1843 CA ARG A 869 3.466 48.943 1.483 1.00 24.82 C ATOM 1844 C ARG A 869 2.755 47.623 1.776 1.00 24.17 C ATOM 1845 O ARG A 869 3.399 46.597 2.009 1.00 24.43 O ATOM 1846 CB ARG A 869 3.343 49.834 2.715 1.00 25.18 C ATOM 1847 CG ARG A 869 4.637 50.102 3.454 1.00 26.34 C ATOM 1848 CD ARG A 869 5.410 48.846 3.737 1.00 25.95 C ATOM 1849 NE ARG A 869 6.171 48.956 4.973 1.00 25.70 N ATOM 1850 CZ ARG A 869 7.490 48.853 5.064 1.00 26.64 C ATOM 1851 NH1 ARG A 869 8.221 48.653 3.975 1.00 25.32 N ATOM 1852 NH2 ARG A 869 8.067 48.845 6.262 1.00 27.21 N ATOM 1853 HE ARG A 869 5.640 49.128 5.851 1.00 0.00 H ATOM 1854 HH12 ARG A 869 9.255 48.573 4.050 1.00 0.00 H ATOM 1855 HH11 ARG A 869 7.760 48.576 3.046 1.00 0.00 H ATOM 1856 HH22 ARG A 869 9.101 48.764 6.341 1.00 0.00 H ATOM 1857 HH21 ARG A 869 7.484 48.919 7.120 1.00 0.00 H ATOM 1858 H ARG A 869 2.339 50.488 0.461 1.00 0.00 H ATOM 1859 N PHE A 870 1.422 47.675 1.771 1.00 23.43 N ATOM 1860 CA PHE A 870 0.571 46.511 2.020 1.00 23.38 C ATOM 1861 C PHE A 870 0.879 45.385 1.035 1.00 23.14 C ATOM 1862 O PHE A 870 0.909 44.216 1.417 1.00 23.11 O ATOM 1863 CB PHE A 870 -0.914 46.910 1.923 1.00 22.05 C ATOM 1864 CG PHE A 870 -1.876 45.792 2.242 1.00 22.04 C ATOM 1865 CD1 PHE A 870 -2.188 45.477 3.566 1.00 22.37 C ATOM 1866 CD2 PHE A 870 -2.493 45.069 1.217 1.00 22.10 C ATOM 1867 CE1 PHE A 870 -3.109 44.457 3.870 1.00 23.38 C ATOM 1868 CE2 PHE A 870 -3.416 44.044 1.505 1.00 23.03 C ATOM 1869 CZ PHE A 870 -3.726 43.738 2.836 1.00 21.94 C ATOM 1870 H PHE A 870 0.964 48.589 1.580 1.00 0.00 H ATOM 1871 N TYR A 871 1.095 45.740 -0.233 1.00 23.24 N ATOM 1872 CA TYR A 871 1.420 44.749 -1.257 1.00 22.18 C ATOM 1873 C TYR A 871 2.770 44.091 -0.958 1.00 21.93 C ATOM 1874 O TYR A 871 2.910 42.879 -1.079 1.00 22.14 O ATOM 1875 CB TYR A 871 1.438 45.399 -2.654 1.00 23.06 C ATOM 1876 CG TYR A 871 2.091 44.551 -3.733 1.00 21.25 C ATOM 1877 CD1 TYR A 871 1.348 43.629 -4.474 1.00 21.47 C ATOM 1878 CD2 TYR A 871 3.465 44.655 -3.991 1.00 21.41 C ATOM 1879 CE1 TYR A 871 1.960 42.824 -5.454 1.00 21.27 C ATOM 1880 CE2 TYR A 871 4.086 43.857 -4.960 1.00 20.96 C ATOM 1881 CZ TYR A 871 3.332 42.946 -5.685 1.00 21.48 C ATOM 1882 OH TYR A 871 3.958 42.129 -6.605 1.00 21.56 O ATOM 1883 HH TYR A 871 3.286 41.542 -7.034 1.00 0.00 H ATOM 1884 H TYR A 871 1.031 46.744 -0.498 1.00 0.00 H ATOM 1885 N GLN A 872 3.755 44.894 -0.561 1.00 21.31 N ATOM 1886 CA GLN A 872 5.092 44.378 -0.247 1.00 21.44 C ATOM 1887 C GLN A 872 5.085 43.421 0.946 1.00 21.55 C ATOM 1888 O GLN A 872 5.648 42.324 0.873 1.00 21.66 O ATOM 1889 CB GLN A 872 6.076 45.527 0.035 1.00 20.77 C ATOM 1890 CG GLN A 872 6.415 46.407 -1.156 1.00 20.20 C ATOM 1891 CD GLN A 872 7.412 47.503 -0.806 1.00 22.26 C ATOM 1892 OE1 GLN A 872 7.256 48.221 0.189 1.00 22.49 O ATOM 1893 NE2 GLN A 872 8.448 47.635 -1.626 1.00 23.33 N ATOM 1894 HE22 GLN A 872 8.541 47.010 -2.452 1.00 0.00 H ATOM 1895 HE21 GLN A 872 9.167 48.364 -1.442 1.00 0.00 H ATOM 1896 H GLN A 872 3.572 45.914 -0.471 1.00 0.00 H ATOM 1897 N LEU A 873 4.433 43.833 2.035 1.00 21.11 N ATOM 1898 CA LEU A 873 4.371 43.018 3.246 1.00 20.73 C ATOM 1899 C LEU A 873 3.574 41.722 3.074 1.00 21.35 C ATOM 1900 O LEU A 873 3.986 40.659 3.559 1.00 20.29 O ATOM 1901 CB LEU A 873 3.820 43.838 4.419 1.00 20.13 C ATOM 1902 CG LEU A 873 4.657 45.046 4.859 1.00 21.30 C ATOM 1903 CD1 LEU A 873 3.978 45.771 6.024 1.00 21.14 C ATOM 1904 CD2 LEU A 873 6.051 44.604 5.254 1.00 19.02 C ATOM 1905 H LEU A 873 3.957 44.758 2.021 1.00 0.00 H ATOM 1906 N THR A 874 2.450 41.801 2.366 1.00 21.63 N ATOM 1907 CA THR A 874 1.623 40.620 2.150 1.00 22.09 C ATOM 1908 C THR A 874 2.265 39.671 1.138 1.00 22.62 C ATOM 1909 O THR A 874 2.081 38.451 1.216 1.00 22.16 O ATOM 1910 CB THR A 874 0.187 40.990 1.724 1.00 22.34 C ATOM 1911 OG1 THR A 874 0.217 41.799 0.540 1.00 23.34 O ATOM 1912 CG2 THR A 874 -0.507 41.755 2.837 1.00 22.26 C ATOM 1913 HG1 THR A 874 0.727 42.628 0.721 1.00 0.00 H ATOM 1914 H THR A 874 2.159 42.714 1.963 1.00 0.00 H ATOM 1915 N LYS A 875 3.042 40.225 0.209 1.00 22.42 N ATOM 1916 CA LYS A 875 3.735 39.400 -0.777 1.00 23.81 C ATOM 1917 C LYS A 875 4.745 38.569 0.028 1.00 23.30 C ATOM 1918 O LYS A 875 4.872 37.363 -0.164 1.00 23.71 O ATOM 1919 CB LYS A 875 4.458 40.280 -1.810 1.00 25.06 C ATOM 1920 CG LYS A 875 4.550 39.668 -3.214 1.00 27.09 C ATOM 1921 CD LYS A 875 3.219 39.757 -3.950 1.00 26.98 C ATOM 1922 CE LYS A 875 3.106 38.716 -5.076 1.00 28.82 C ATOM 1923 NZ LYS A 875 4.377 38.283 -5.700 1.00 28.45 N ATOM 1924 HZ1 LYS A 875 4.855 39.107 -6.118 1.00 0.00 H ATOM 1925 HZ2 LYS A 875 4.990 37.856 -4.976 1.00 0.00 H ATOM 1926 HZ3 LYS A 875 4.176 37.583 -6.442 1.00 0.00 H ATOM 1927 H LYS A 875 3.157 41.258 0.185 1.00 0.00 H ATOM 1928 N LEU A 876 5.403 39.222 0.985 1.00 23.77 N ATOM 1929 CA LEU A 876 6.376 38.571 1.857 1.00 23.44 C ATOM 1930 C LEU A 876 5.691 37.433 2.641 1.00 23.86 C ATOM 1931 O LEU A 876 6.234 36.330 2.748 1.00 22.11 O ATOM 1932 CB LEU A 876 7.005 39.606 2.801 1.00 23.52 C ATOM 1933 CG LEU A 876 8.151 39.179 3.735 1.00 25.14 C ATOM 1934 CD1 LEU A 876 8.953 40.396 4.174 1.00 26.35 C ATOM 1935 CD2 LEU A 876 7.629 38.443 4.961 1.00 23.60 C ATOM 1936 H LEU A 876 5.216 40.237 1.116 1.00 0.00 H ATOM 1937 N LEU A 877 4.492 37.699 3.163 1.00 23.56 N ATOM 1938 CA LEU A 877 3.735 36.684 3.900 1.00 24.07 C ATOM 1939 C LEU A 877 3.387 35.492 3.015 1.00 24.16 C ATOM 1940 O LEU A 877 3.442 34.346 3.457 1.00 23.84 O ATOM 1941 CB LEU A 877 2.451 37.276 4.484 1.00 23.14 C ATOM 1942 CG LEU A 877 2.662 38.173 5.706 1.00 23.23 C ATOM 1943 CD1 LEU A 877 1.382 38.929 6.038 1.00 21.67 C ATOM 1944 CD2 LEU A 877 3.125 37.329 6.879 1.00 22.57 C ATOM 1945 H LEU A 877 4.086 38.649 3.044 1.00 0.00 H ATOM 1946 N ASP A 878 3.006 35.769 1.773 1.00 25.38 N ATOM 1947 CA ASP A 878 2.656 34.720 0.824 1.00 28.15 C ATOM 1948 C ASP A 878 3.857 33.819 0.514 1.00 29.12 C ATOM 1949 O ASP A 878 3.724 32.598 0.409 1.00 28.68 O ATOM 1950 CB ASP A 878 2.149 35.340 -0.484 1.00 29.47 C ATOM 1951 CG ASP A 878 0.709 35.838 -0.397 1.00 31.07 C ATOM 1952 OD1 ASP A 878 0.234 36.383 -1.418 1.00 33.83 O ATOM 1953 OD2 ASP A 878 0.046 35.685 0.657 1.00 31.42 O ATOM 1954 H ASP A 878 2.956 36.762 1.469 1.00 0.00 H ATOM 1955 N ASN A 879 5.023 34.439 0.341 1.00 30.08 N ATOM 1956 CA ASN A 879 6.244 33.710 0.037 1.00 30.97 C ATOM 1957 C ASN A 879 6.651 32.749 1.150 1.00 30.82 C ATOM 1958 O ASN A 879 7.295 31.736 0.888 1.00 31.85 O ATOM 1959 CB ASN A 879 7.379 34.685 -0.284 1.00 33.07 C ATOM 1960 CG ASN A 879 7.132 35.475 -1.571 1.00 35.45 C ATOM 1961 OD1 ASN A 879 6.406 35.032 -2.469 1.00 36.97 O ATOM 1962 ND2 ASN A 879 7.743 36.649 -1.665 1.00 36.24 N ATOM 1963 HD22 ASN A 879 8.345 36.985 -0.887 1.00 0.00 H ATOM 1964 HD21 ASN A 879 7.620 37.233 -2.517 1.00 0.00 H ATOM 1965 H ASN A 879 5.061 35.475 0.426 1.00 0.00 H ATOM 1966 N LEU A 880 6.240 33.040 2.383 1.00 30.34 N ATOM 1967 CA LEU A 880 6.567 32.174 3.514 1.00 29.04 C ATOM 1968 C LEU A 880 5.918 30.798 3.427 1.00 28.92 C ATOM 1969 O LEU A 880 6.387 29.849 4.061 1.00 27.50 O ATOM 1970 CB LEU A 880 6.215 32.842 4.843 1.00 30.67 C ATOM 1971 CG LEU A 880 7.086 34.042 5.233 1.00 31.78 C ATOM 1972 CD1 LEU A 880 6.722 34.460 6.634 1.00 32.67 C ATOM 1973 CD2 LEU A 880 8.569 33.688 5.182 1.00 31.09 C ATOM 1974 H LEU A 880 5.676 33.899 2.544 1.00 0.00 H ATOM 1975 N HIS A 881 4.829 30.692 2.667 1.00 28.59 N ATOM 1976 CA HIS A 881 4.164 29.402 2.488 1.00 29.65 C ATOM 1977 C HIS A 881 5.142 28.439 1.812 1.00 30.16 C ATOM 1978 O HIS A 881 5.232 27.276 2.195 1.00 30.47 O ATOM 1979 CB HIS A 881 2.907 29.541 1.621 1.00 30.79 C ATOM 1980 CG HIS A 881 1.682 29.950 2.380 1.00 32.45 C ATOM 1981 ND1 HIS A 881 0.944 31.069 2.056 1.00 32.02 N ATOM 1982 CD2 HIS A 881 1.052 29.376 3.433 1.00 31.56 C ATOM 1983 CE1 HIS A 881 -0.087 31.166 2.876 1.00 32.28 C ATOM 1984 NE2 HIS A 881 -0.045 30.151 3.720 1.00 32.37 N ATOM 1985 H HIS A 881 4.447 31.537 2.195 1.00 0.00 H ATOM 1986 N ASP A 882 5.877 28.941 0.816 1.00 30.43 N ATOM 1987 CA ASP A 882 6.860 28.143 0.084 1.00 31.33 C ATOM 1988 C ASP A 882 8.100 27.873 0.930 1.00 31.01 C ATOM 1989 O ASP A 882 8.516 26.721 1.077 1.00 32.50 O ATOM 1990 CB ASP A 882 7.279 28.836 -1.234 1.00 33.00 C ATOM 1991 CG ASP A 882 6.217 28.731 -2.334 1.00 34.56 C ATOM 1992 OD1 ASP A 882 5.363 27.815 -2.273 1.00 35.82 O ATOM 1993 OD2 ASP A 882 6.242 29.560 -3.275 1.00 33.49 O ATOM 1994 H ASP A 882 5.745 29.938 0.551 1.00 0.00 H ATOM 1995 N LEU A 883 8.676 28.931 1.497 1.00 30.06 N ATOM 1996 CA LEU A 883 9.879 28.806 2.323 1.00 29.76 C ATOM 1997 C LEU A 883 9.752 27.800 3.459 1.00 29.32 C ATOM 1998 O LEU A 883 10.690 27.054 3.735 1.00 30.29 O ATOM 1999 CB LEU A 883 10.287 30.168 2.885 1.00 29.36 C ATOM 2000 CG LEU A 883 11.545 30.216 3.764 1.00 30.03 C ATOM 2001 CD1 LEU A 883 12.319 31.477 3.461 1.00 29.92 C ATOM 2002 CD2 LEU A 883 11.196 30.153 5.252 1.00 28.96 C ATOM 2003 H LEU A 883 8.260 29.873 1.349 1.00 0.00 H ATOM 2004 N VAL A 884 8.597 27.785 4.119 1.00 28.41 N ATOM 2005 CA VAL A 884 8.360 26.871 5.237 1.00 29.02 C ATOM 2006 C VAL A 884 8.291 25.394 4.828 1.00 28.98 C ATOM 2007 O VAL A 884 8.583 24.510 5.635 1.00 28.48 O ATOM 2008 CB VAL A 884 7.104 27.297 6.057 1.00 28.87 C ATOM 2009 CG1 VAL A 884 6.729 26.242 7.069 1.00 28.21 C ATOM 2010 CG2 VAL A 884 7.395 28.584 6.790 1.00 28.24 C ATOM 2011 H VAL A 884 7.842 28.441 3.833 1.00 0.00 H ATOM 2012 N LYS A 885 7.883 25.116 3.594 1.00 29.99 N ATOM 2013 CA LYS A 885 7.846 23.725 3.138 1.00 31.61 C ATOM 2014 C LYS A 885 9.294 23.206 3.087 1.00 31.27 C ATOM 2015 O LYS A 885 9.567 22.057 3.447 1.00 29.54 O ATOM 2016 CB LYS A 885 7.179 23.603 1.761 1.00 33.69 C ATOM 2017 CG LYS A 885 5.674 23.902 1.749 1.00 36.29 C ATOM 2018 CD LYS A 885 5.055 23.510 0.403 1.00 38.79 C ATOM 2019 CE LYS A 885 3.678 24.130 0.180 1.00 40.56 C ATOM 2020 NZ LYS A 885 2.660 23.707 1.181 1.00 43.24 N ATOM 2021 HZ1 LYS A 885 2.545 22.674 1.141 1.00 0.00 H ATOM 2022 HZ2 LYS A 885 2.975 23.985 2.132 1.00 0.00 H ATOM 2023 HZ3 LYS A 885 1.752 24.167 0.966 1.00 0.00 H ATOM 2024 H LYS A 885 7.591 25.883 2.955 1.00 0.00 H ATOM 2025 N GLN A 886 10.211 24.090 2.688 1.00 31.93 N ATOM 2026 CA GLN A 886 11.638 23.783 2.613 1.00 32.55 C ATOM 2027 C GLN A 886 12.152 23.390 3.992 1.00 31.12 C ATOM 2028 O GLN A 886 12.849 22.391 4.135 1.00 31.37 O ATOM 2029 CB GLN A 886 12.436 25.001 2.116 1.00 35.43 C ATOM 2030 CG GLN A 886 12.077 25.523 0.721 1.00 40.07 C ATOM 2031 CD GLN A 886 13.101 26.538 0.200 1.00 44.41 C ATOM 2032 OE1 GLN A 886 14.311 26.400 0.419 1.00 46.81 O ATOM 2033 NE2 GLN A 886 12.615 27.559 -0.501 1.00 44.18 N ATOM 2034 HE22 GLN A 886 11.591 27.638 -0.662 1.00 0.00 H ATOM 2035 HE21 GLN A 886 13.259 28.278 -0.888 1.00 0.00 H ATOM 2036 H GLN A 886 9.895 25.043 2.417 1.00 0.00 H ATOM 2037 N LEU A 887 11.808 24.187 5.004 1.00 30.57 N ATOM 2038 CA LEU A 887 12.227 23.917 6.380 1.00 29.52 C ATOM 2039 C LEU A 887 11.699 22.574 6.881 1.00 28.90 C ATOM 2040 O LEU A 887 12.403 21.852 7.593 1.00 27.85 O ATOM 2041 CB LEU A 887 11.787 25.046 7.331 1.00 31.13 C ATOM 2042 CG LEU A 887 12.305 26.471 7.058 1.00 32.70 C ATOM 2043 CD1 LEU A 887 11.910 27.408 8.189 1.00 32.79 C ATOM 2044 CD2 LEU A 887 13.803 26.475 6.908 1.00 32.36 C ATOM 2045 H LEU A 887 11.224 25.026 4.810 1.00 0.00 H ATOM 2046 N HIS A 888 10.472 22.231 6.499 1.00 28.11 N ATOM 2047 CA HIS A 888 9.887 20.960 6.917 1.00 28.88 C ATOM 2048 C HIS A 888 10.608 19.774 6.282 1.00 30.20 C ATOM 2049 O HIS A 888 10.742 18.721 6.908 1.00 29.65 O ATOM 2050 CB HIS A 888 8.384 20.916 6.616 1.00 29.45 C ATOM 2051 CG HIS A 888 7.535 21.523 7.692 1.00 29.42 C ATOM 2052 ND1 HIS A 888 7.505 21.033 8.982 1.00 29.92 N ATOM 2053 CD2 HIS A 888 6.708 22.594 7.678 1.00 28.66 C ATOM 2054 CE1 HIS A 888 6.698 21.779 9.716 1.00 29.41 C ATOM 2055 NE2 HIS A 888 6.201 22.734 8.949 1.00 28.99 N ATOM 2056 H HIS A 888 9.923 22.876 5.895 1.00 0.00 H ATOM 2057 N LEU A 889 11.086 19.960 5.048 1.00 31.55 N ATOM 2058 CA LEU A 889 11.825 18.916 4.334 1.00 31.95 C ATOM 2059 C LEU A 889 13.167 18.691 5.023 1.00 32.54 C ATOM 2060 O LEU A 889 13.562 17.552 5.253 1.00 31.60 O ATOM 2061 CB LEU A 889 12.052 19.311 2.871 1.00 32.18 C ATOM 2062 CG LEU A 889 12.853 18.314 2.027 1.00 32.24 C ATOM 2063 CD1 LEU A 889 12.187 16.951 2.062 1.00 31.80 C ATOM 2064 CD2 LEU A 889 12.990 18.810 0.594 1.00 30.94 C ATOM 2065 H LEU A 889 10.928 20.875 4.580 1.00 0.00 H ATOM 2066 N TYR A 890 13.850 19.787 5.363 1.00 33.14 N ATOM 2067 CA TYR A 890 15.140 19.720 6.047 1.00 34.54 C ATOM 2068 C TYR A 890 14.990 18.938 7.336 1.00 34.70 C ATOM 2069 O TYR A 890 15.794 18.052 7.640 1.00 34.09 O ATOM 2070 CB TYR A 890 15.659 21.122 6.377 1.00 35.13 C ATOM 2071 CG TYR A 890 16.513 21.730 5.293 1.00 37.17 C ATOM 2072 CD1 TYR A 890 17.813 21.263 5.056 1.00 37.13 C ATOM 2073 CD2 TYR A 890 16.026 22.779 4.499 1.00 37.54 C ATOM 2074 CE1 TYR A 890 18.612 21.827 4.050 1.00 37.70 C ATOM 2075 CE2 TYR A 890 16.810 23.350 3.496 1.00 38.71 C ATOM 2076 CZ TYR A 890 18.104 22.871 3.273 1.00 39.22 C ATOM 2077 OH TYR A 890 18.867 23.417 2.258 1.00 37.13 O ATOM 2078 HH TYR A 890 19.750 22.970 2.234 1.00 0.00 H ATOM 2079 H TYR A 890 13.451 20.719 5.133 1.00 0.00 H ATOM 2080 N CYS A 891 13.940 19.275 8.079 1.00 34.54 N ATOM 2081 CA CYS A 891 13.636 18.626 9.337 1.00 34.46 C ATOM 2082 C CYS A 891 13.423 17.133 9.121 1.00 34.96 C ATOM 2083 O CYS A 891 13.970 16.311 9.859 1.00 35.65 O ATOM 2084 CB CYS A 891 12.394 19.258 9.966 1.00 34.70 C ATOM 2085 SG CYS A 891 11.866 18.457 11.496 1.00 36.20 S ATOM 2086 H CYS A 891 13.313 20.034 7.744 1.00 0.00 H ATOM 2087 N LEU A 892 12.643 16.788 8.100 1.00 34.98 N ATOM 2088 CA LEU A 892 12.372 15.388 7.780 1.00 36.13 C ATOM 2089 C LEU A 892 13.640 14.659 7.328 1.00 36.24 C ATOM 2090 O LEU A 892 13.855 13.504 7.686 1.00 36.77 O ATOM 2091 CB LEU A 892 11.291 15.275 6.695 1.00 35.99 C ATOM 2092 CG LEU A 892 11.108 13.893 6.052 1.00 37.39 C ATOM 2093 CD1 LEU A 892 10.581 12.899 7.084 1.00 37.23 C ATOM 2094 CD2 LEU A 892 10.167 13.974 4.847 1.00 36.61 C ATOM 2095 H LEU A 892 12.215 17.534 7.515 1.00 0.00 H ATOM 2096 N ASN A 893 14.476 15.337 6.547 1.00 36.58 N ATOM 2097 CA ASN A 893 15.710 14.731 6.061 1.00 37.33 C ATOM 2098 C ASN A 893 16.763 14.587 7.151 1.00 38.68 C ATOM 2099 O ASN A 893 17.545 13.644 7.130 1.00 38.95 O ATOM 2100 CB ASN A 893 16.269 15.504 4.862 1.00 34.50 C ATOM 2101 CG ASN A 893 15.493 15.228 3.583 1.00 32.91 C ATOM 2102 OD1 ASN A 893 14.821 14.206 3.464 1.00 30.60 O ATOM 2103 ND2 ASN A 893 15.589 16.139 2.619 1.00 34.11 N ATOM 2104 HD22 ASN A 893 16.170 16.990 2.763 1.00 0.00 H ATOM 2105 HD21 ASN A 893 15.083 16.001 1.721 1.00 0.00 H ATOM 2106 H ASN A 893 14.246 16.315 6.279 1.00 0.00 H ATOM 2107 N THR A 894 16.764 15.511 8.109 1.00 39.92 N ATOM 2108 CA THR A 894 17.716 15.470 9.212 1.00 42.18 C ATOM 2109 C THR A 894 17.346 14.325 10.158 1.00 44.34 C ATOM 2110 O THR A 894 18.213 13.719 10.793 1.00 44.64 O ATOM 2111 CB THR A 894 17.738 16.811 9.982 1.00 41.91 C ATOM 2112 OG1 THR A 894 18.143 17.863 9.096 1.00 40.45 O ATOM 2113 CG2 THR A 894 18.711 16.750 11.150 1.00 41.47 C ATOM 2114 HG1 THR A 894 17.503 17.924 8.343 1.00 0.00 H ATOM 2115 H THR A 894 16.067 16.282 8.070 1.00 0.00 H ATOM 2116 N PHE A 895 16.052 14.025 10.233 1.00 46.16 N ATOM 2117 CA PHE A 895 15.568 12.944 11.082 1.00 48.30 C ATOM 2118 C PHE A 895 16.076 11.630 10.500 1.00 49.11 C ATOM 2119 O PHE A 895 16.692 10.827 11.200 1.00 50.04 O ATOM 2120 CB PHE A 895 14.037 12.941 11.122 1.00 49.00 C ATOM 2121 CG PHE A 895 13.457 11.868 11.997 1.00 50.36 C ATOM 2122 CD1 PHE A 895 13.159 12.128 13.332 1.00 50.63 C ATOM 2123 CD2 PHE A 895 13.214 10.591 11.489 1.00 50.57 C ATOM 2124 CE1 PHE A 895 12.629 11.133 14.151 1.00 50.90 C ATOM 2125 CE2 PHE A 895 12.684 9.590 12.300 1.00 51.07 C ATOM 2126 CZ PHE A 895 12.390 9.861 13.634 1.00 50.51 C ATOM 2127 H PHE A 895 15.370 14.575 9.673 1.00 0.00 H ATOM 2128 N ILE A 896 15.813 11.431 9.212 1.00 49.39 N ATOM 2129 CA ILE A 896 16.240 10.236 8.494 1.00 49.90 C ATOM 2130 C ILE A 896 17.740 9.989 8.693 1.00 51.54 C ATOM 2131 O ILE A 896 18.162 8.862 8.973 1.00 51.53 O ATOM 2132 CB ILE A 896 15.916 10.369 6.982 1.00 48.49 C ATOM 2133 CG1 ILE A 896 14.405 10.253 6.762 1.00 47.26 C ATOM 2134 CG2 ILE A 896 16.674 9.331 6.168 1.00 48.22 C ATOM 2135 CD1 ILE A 896 13.972 10.356 5.306 1.00 46.13 C ATOM 2136 H ILE A 896 15.280 12.159 8.695 1.00 0.00 H ATOM 2137 N GLN A 897 18.526 11.060 8.607 1.00 52.99 N ATOM 2138 CA GLN A 897 19.973 10.975 8.769 1.00 55.09 C ATOM 2139 C GLN A 897 20.432 10.639 10.181 1.00 56.04 C ATOM 2140 O GLN A 897 21.540 10.143 10.368 1.00 56.81 O ATOM 2141 CB GLN A 897 20.638 12.270 8.314 1.00 55.45 C ATOM 2142 CG GLN A 897 20.545 12.518 6.822 1.00 56.82 C ATOM 2143 CD GLN A 897 21.211 13.813 6.421 1.00 57.78 C ATOM 2144 OE1 GLN A 897 22.262 13.810 5.774 1.00 58.80 O ATOM 2145 NE2 GLN A 897 20.613 14.934 6.816 1.00 58.17 N ATOM 2146 HE22 GLN A 897 19.728 14.887 7.360 1.00 0.00 H ATOM 2147 HE21 GLN A 897 21.031 15.857 6.581 1.00 0.00 H ATOM 2148 H GLN A 897 18.094 11.987 8.418 1.00 0.00 H ATOM 2149 N SER A 898 19.601 10.934 11.175 1.00 57.57 N ATOM 2150 CA SER A 898 19.957 10.641 12.562 1.00 58.81 C ATOM 2151 C SER A 898 19.554 9.215 12.943 1.00 59.88 C ATOM 2152 O SER A 898 19.941 8.714 13.999 1.00 59.93 O ATOM 2153 CB SER A 898 19.303 11.650 13.519 1.00 58.35 C ATOM 2154 OG SER A 898 17.887 11.559 13.493 1.00 57.78 O ATOM 2155 HG SER A 898 17.562 11.744 12.576 1.00 0.00 H ATOM 2156 H SER A 898 18.685 11.379 10.963 1.00 0.00 H ATOM 2157 N ARG A 899 18.784 8.568 12.070 1.00 61.31 N ATOM 2158 CA ARG A 899 18.309 7.206 12.305 1.00 62.99 C ATOM 2159 C ARG A 899 18.717 6.253 11.185 1.00 63.20 C ATOM 2160 O ARG A 899 19.904 5.997 10.976 1.00 63.65 O ATOM 2161 CB ARG A 899 16.783 7.203 12.463 1.00 63.84 C ATOM 2162 CG ARG A 899 16.277 7.983 13.676 1.00 65.30 C ATOM 2163 CD ARG A 899 16.855 7.410 14.959 1.00 67.06 C ATOM 2164 NE ARG A 899 16.464 8.163 16.146 1.00 68.77 N ATOM 2165 CZ ARG A 899 16.917 7.909 17.373 1.00 69.84 C ATOM 2166 NH1 ARG A 899 17.781 6.919 17.576 1.00 69.81 N ATOM 2167 NH2 ARG A 899 16.501 8.639 18.401 1.00 69.94 N ATOM 2168 HE ARG A 899 15.790 8.946 16.027 1.00 0.00 H ATOM 2169 HH12 ARG A 899 18.132 6.724 18.535 1.00 0.00 H ATOM 2170 HH11 ARG A 899 18.106 6.340 16.776 1.00 0.00 H ATOM 2171 HH22 ARG A 899 16.856 8.439 19.358 1.00 0.00 H ATOM 2172 HH21 ARG A 899 15.820 9.411 18.249 1.00 0.00 H ATOM 2173 H ARG A 899 18.511 9.049 11.189 1.00 0.00 H TER 2174 ARG A 899 ATOM 2175 N MET A 909 9.434 2.214 8.060 1.00 85.85 N ATOM 2176 CA MET A 909 10.002 3.549 7.902 1.00 86.31 C ATOM 2177 C MET A 909 9.000 4.509 7.263 1.00 86.25 C ATOM 2178 O MET A 909 9.041 5.716 7.509 1.00 86.27 O ATOM 2179 CB MET A 909 11.280 3.490 7.052 1.00 86.95 C ATOM 2180 CG MET A 909 11.065 3.204 5.558 1.00 87.91 C ATOM 2181 SD MET A 909 10.397 1.561 5.163 1.00 89.83 S ATOM 2182 CE MET A 909 11.878 0.703 4.580 1.00 88.25 C ATOM 2183 HN3 MET A 909 9.166 1.840 7.127 1.00 0.00 H ATOM 2184 HN2 MET A 909 8.592 2.267 8.668 1.00 0.00 H ATOM 2185 HN1 MET A 909 10.140 1.588 8.496 1.00 0.00 H ATOM 2186 N SER A 910 8.089 3.956 6.466 1.00 86.19 N ATOM 2187 CA SER A 910 7.070 4.732 5.761 1.00 85.89 C ATOM 2188 C SER A 910 6.144 5.545 6.665 1.00 85.48 C ATOM 2189 O SER A 910 5.476 6.472 6.200 1.00 85.78 O ATOM 2190 CB SER A 910 6.237 3.813 4.860 1.00 86.15 C ATOM 2191 OG SER A 910 7.045 3.201 3.869 1.00 86.35 O ATOM 2192 HG SER A 910 6.483 2.615 3.303 1.00 0.00 H ATOM 2193 H SER A 910 8.103 2.924 6.339 1.00 0.00 H ATOM 2194 N GLU A 911 6.104 5.198 7.949 1.00 84.80 N ATOM 2195 CA GLU A 911 5.261 5.906 8.908 1.00 84.25 C ATOM 2196 C GLU A 911 5.777 7.329 9.096 1.00 83.46 C ATOM 2197 O GLU A 911 5.002 8.287 9.103 1.00 83.28 O ATOM 2198 CB GLU A 911 5.250 5.186 10.262 1.00 85.35 C ATOM 2199 CG GLU A 911 4.890 3.699 10.211 1.00 85.91 C ATOM 2200 CD GLU A 911 6.027 2.828 9.695 1.00 86.52 C ATOM 2201 OE1 GLU A 911 5.738 1.805 9.038 1.00 86.83 O ATOM 2202 OE2 GLU A 911 7.208 3.164 9.947 1.00 86.64 O ATOM 2203 H GLU A 911 6.688 4.403 8.278 1.00 0.00 H ATOM 2204 N VAL A 912 7.097 7.451 9.227 1.00 82.68 N ATOM 2205 CA VAL A 912 7.762 8.741 9.413 1.00 81.69 C ATOM 2206 C VAL A 912 7.553 9.658 8.208 1.00 80.57 C ATOM 2207 O VAL A 912 7.271 10.848 8.365 1.00 80.49 O ATOM 2208 CB VAL A 912 9.284 8.554 9.639 1.00 81.88 C ATOM 2209 CG1 VAL A 912 9.955 9.897 9.877 1.00 81.97 C ATOM 2210 CG2 VAL A 912 9.531 7.622 10.818 1.00 82.64 C ATOM 2211 H VAL A 912 7.681 6.591 9.196 1.00 0.00 H ATOM 2212 N ILE A 913 7.694 9.092 7.012 1.00 79.12 N ATOM 2213 CA ILE A 913 7.524 9.839 5.770 1.00 77.80 C ATOM 2214 C ILE A 913 6.105 10.390 5.664 1.00 77.31 C ATOM 2215 O ILE A 913 5.905 11.605 5.601 1.00 77.33 O ATOM 2216 CB ILE A 913 7.801 8.945 4.535 1.00 77.78 C ATOM 2217 CG1 ILE A 913 9.185 8.297 4.643 1.00 77.53 C ATOM 2218 CG2 ILE A 913 7.695 9.761 3.250 1.00 76.96 C ATOM 2219 CD1 ILE A 913 10.330 9.288 4.725 1.00 77.56 C ATOM 2220 H ILE A 913 7.934 8.081 6.961 1.00 0.00 H ATOM 2221 N ALA A 914 5.129 9.486 5.693 1.00 76.29 N ATOM 2222 CA ALA A 914 3.716 9.839 5.583 1.00 75.51 C ATOM 2223 C ALA A 914 3.244 10.905 6.572 1.00 74.84 C ATOM 2224 O ALA A 914 2.382 11.724 6.241 1.00 74.72 O ATOM 2225 CB ALA A 914 2.858 8.586 5.709 1.00 75.62 C ATOM 2226 H ALA A 914 5.384 8.483 5.799 1.00 0.00 H ATOM 2227 N ALA A 915 3.814 10.897 7.774 1.00 73.96 N ATOM 2228 CA ALA A 915 3.451 11.860 8.814 1.00 73.24 C ATOM 2229 C ALA A 915 3.791 13.300 8.431 1.00 72.77 C ATOM 2230 O ALA A 915 2.960 14.200 8.578 1.00 72.81 O ATOM 2231 CB ALA A 915 4.129 11.493 10.135 1.00 72.99 C ATOM 2232 H ALA A 915 4.541 10.183 7.981 1.00 0.00 H ATOM 2233 N GLN A 916 5.007 13.508 7.929 1.00 71.95 N ATOM 2234 CA GLN A 916 5.464 14.840 7.536 1.00 70.94 C ATOM 2235 C GLN A 916 5.059 15.302 6.136 1.00 69.30 C ATOM 2236 O GLN A 916 5.005 16.509 5.884 1.00 69.06 O ATOM 2237 CB GLN A 916 6.990 14.919 7.588 1.00 72.23 C ATOM 2238 CG GLN A 916 7.542 15.364 8.931 1.00 74.07 C ATOM 2239 CD GLN A 916 7.364 16.851 9.171 1.00 75.85 C ATOM 2240 OE1 GLN A 916 6.822 17.564 8.328 1.00 77.20 O ATOM 2241 NE2 GLN A 916 7.821 17.321 10.325 1.00 77.00 N ATOM 2242 HE22 GLN A 916 8.272 16.678 11.006 1.00 0.00 H ATOM 2243 HE21 GLN A 916 7.728 18.333 10.548 1.00 0.00 H ATOM 2244 H GLN A 916 5.650 12.699 7.813 1.00 0.00 H ATOM 2245 N LEU A 917 4.754 14.357 5.244 1.00 67.39 N ATOM 2246 CA LEU A 917 4.373 14.679 3.864 1.00 65.47 C ATOM 2247 C LEU A 917 3.405 15.850 3.680 1.00 63.28 C ATOM 2248 O LEU A 917 3.619 16.696 2.814 1.00 63.46 O ATOM 2249 CB LEU A 917 3.843 13.441 3.132 1.00 67.00 C ATOM 2250 CG LEU A 917 4.855 12.349 2.774 1.00 68.45 C ATOM 2251 CD1 LEU A 917 4.177 11.275 1.923 1.00 68.57 C ATOM 2252 CD2 LEU A 917 6.036 12.950 2.024 1.00 68.62 C ATOM 2253 H LEU A 917 4.787 13.360 5.537 1.00 0.00 H ATOM 2254 N PRO A 918 2.317 15.905 4.471 1.00 61.10 N ATOM 2255 CA PRO A 918 1.345 17.001 4.359 1.00 59.34 C ATOM 2256 C PRO A 918 1.927 18.397 4.602 1.00 57.42 C ATOM 2257 O PRO A 918 1.306 19.403 4.245 1.00 56.85 O ATOM 2258 CB PRO A 918 0.314 16.642 5.428 1.00 59.45 C ATOM 2259 CG PRO A 918 0.321 15.156 5.385 1.00 60.04 C ATOM 2260 CD PRO A 918 1.797 14.853 5.364 1.00 60.51 C ATOM 2261 N LYS A 919 3.112 18.452 5.211 1.00 55.02 N ATOM 2262 CA LYS A 919 3.767 19.726 5.499 1.00 52.94 C ATOM 2263 C LYS A 919 4.839 20.135 4.487 1.00 50.59 C ATOM 2264 O LYS A 919 5.415 21.219 4.587 1.00 49.43 O ATOM 2265 CB LYS A 919 4.326 19.731 6.927 1.00 53.62 C ATOM 2266 CG LYS A 919 3.238 19.875 7.994 1.00 54.64 C ATOM 2267 CD LYS A 919 3.796 19.808 9.410 1.00 55.55 C ATOM 2268 CE LYS A 919 2.708 20.106 10.441 1.00 55.91 C ATOM 2269 NZ LYS A 919 3.201 20.026 11.852 1.00 56.83 N ATOM 2270 HZ1 LYS A 919 3.560 19.068 12.039 1.00 0.00 H ATOM 2271 HZ2 LYS A 919 3.966 20.717 11.990 1.00 0.00 H ATOM 2272 HZ3 LYS A 919 2.419 20.238 12.504 1.00 0.00 H ATOM 2273 H LYS A 919 3.582 17.566 5.488 1.00 0.00 H ATOM 2274 N ILE A 920 5.089 19.274 3.503 1.00 48.76 N ATOM 2275 CA ILE A 920 6.080 19.560 2.469 1.00 46.68 C ATOM 2276 C ILE A 920 5.438 19.565 1.085 1.00 44.84 C ATOM 2277 O ILE A 920 5.896 20.268 0.186 1.00 44.43 O ATOM 2278 CB ILE A 920 7.253 18.531 2.474 1.00 46.99 C ATOM 2279 CG1 ILE A 920 6.761 17.153 2.028 1.00 48.10 C ATOM 2280 CG2 ILE A 920 7.874 18.425 3.868 1.00 45.25 C ATOM 2281 CD1 ILE A 920 7.876 16.150 1.780 1.00 48.88 C ATOM 2282 H ILE A 920 4.566 18.376 3.470 1.00 0.00 H ATOM 2283 N LEU A 921 4.362 18.794 0.937 1.00 43.12 N ATOM 2284 CA LEU A 921 3.639 18.657 -0.331 1.00 41.35 C ATOM 2285 C LEU A 921 2.492 19.639 -0.535 1.00 40.46 C ATOM 2286 O LEU A 921 1.798 20.008 0.413 1.00 41.40 O ATOM 2287 CB LEU A 921 3.095 17.230 -0.454 1.00 41.29 C ATOM 2288 CG LEU A 921 3.701 16.250 -1.462 1.00 41.43 C ATOM 2289 CD1 LEU A 921 5.033 16.739 -2.007 1.00 41.26 C ATOM 2290 CD2 LEU A 921 3.856 14.901 -0.787 1.00 41.51 C ATOM 2291 H LEU A 921 4.018 18.263 1.762 1.00 0.00 H ATOM 2292 N ALA A 922 2.287 20.036 -1.788 1.00 39.23 N ATOM 2293 CA ALA A 922 1.207 20.951 -2.153 1.00 38.35 C ATOM 2294 C ALA A 922 -0.107 20.176 -2.265 1.00 37.80 C ATOM 2295 O ALA A 922 -0.107 18.948 -2.281 1.00 36.96 O ATOM 2296 CB ALA A 922 1.522 21.635 -3.475 1.00 37.39 C ATOM 2297 H ALA A 922 2.918 19.682 -2.535 1.00 0.00 H ATOM 2298 N GLY A 923 -1.221 20.904 -2.322 1.00 38.84 N ATOM 2299 CA GLY A 923 -2.536 20.286 -2.434 1.00 38.82 C ATOM 2300 C GLY A 923 -2.993 19.475 -1.231 1.00 39.85 C ATOM 2301 O GLY A 923 -3.995 18.769 -1.305 1.00 39.72 O ATOM 2302 H GLY A 923 -1.150 21.941 -2.286 1.00 0.00 H ATOM 2303 N MET A 924 -2.270 19.575 -0.119 1.00 40.67 N ATOM 2304 CA MET A 924 -2.614 18.829 1.086 1.00 41.16 C ATOM 2305 C MET A 924 -3.493 19.654 2.028 1.00 40.80 C ATOM 2306 O MET A 924 -4.390 19.126 2.686 1.00 41.16 O ATOM 2307 CB MET A 924 -1.341 18.402 1.812 1.00 43.68 C ATOM 2308 CG MET A 924 -1.379 16.979 2.323 1.00 47.29 C ATOM 2309 SD MET A 924 -1.217 15.785 0.994 1.00 50.83 S ATOM 2310 CE MET A 924 0.408 15.101 1.337 1.00 49.82 C ATOM 2311 H MET A 924 -1.439 20.200 -0.109 1.00 0.00 H ATOM 2312 N VAL A 925 -3.199 20.945 2.115 1.00 39.48 N ATOM 2313 CA VAL A 925 -3.945 21.869 2.960 1.00 38.12 C ATOM 2314 C VAL A 925 -4.368 23.076 2.122 1.00 37.26 C ATOM 2315 O VAL A 925 -4.046 23.160 0.937 1.00 37.09 O ATOM 2316 CB VAL A 925 -3.083 22.353 4.144 1.00 38.73 C ATOM 2317 CG1 VAL A 925 -2.691 21.177 5.024 1.00 38.75 C ATOM 2318 CG2 VAL A 925 -1.840 23.073 3.632 1.00 38.36 C ATOM 2319 H VAL A 925 -2.403 21.313 1.557 1.00 0.00 H ATOM 2320 N LYS A 926 -5.098 24.005 2.726 1.00 36.71 N ATOM 2321 CA LYS A 926 -5.533 25.193 2.003 1.00 35.89 C ATOM 2322 C LYS A 926 -4.814 26.444 2.495 1.00 35.35 C ATOM 2323 O LYS A 926 -4.999 26.873 3.635 1.00 35.46 O ATOM 2324 CB LYS A 926 -7.041 25.387 2.140 1.00 36.33 C ATOM 2325 CG LYS A 926 -7.603 26.563 1.354 1.00 37.51 C ATOM 2326 CD LYS A 926 -9.051 26.815 1.757 1.00 41.05 C ATOM 2327 CE LYS A 926 -9.723 27.857 0.872 1.00 42.25 C ATOM 2328 NZ LYS A 926 -9.968 27.352 -0.512 1.00 45.27 N ATOM 2329 HZ1 LYS A 926 -9.061 27.092 -0.951 1.00 0.00 H ATOM 2330 HZ2 LYS A 926 -10.586 26.517 -0.471 1.00 0.00 H ATOM 2331 HZ3 LYS A 926 -10.426 28.096 -1.075 1.00 0.00 H ATOM 2332 H LYS A 926 -5.362 23.884 3.725 1.00 0.00 H ATOM 2333 N PRO A 927 -3.916 26.996 1.667 1.00 35.19 N ATOM 2334 CA PRO A 927 -3.191 28.208 2.059 1.00 33.68 C ATOM 2335 C PRO A 927 -4.079 29.412 1.750 1.00 32.75 C ATOM 2336 O PRO A 927 -4.902 29.356 0.836 1.00 33.40 O ATOM 2337 CB PRO A 927 -1.969 28.171 1.147 1.00 34.23 C ATOM 2338 CG PRO A 927 -2.525 27.555 -0.121 1.00 34.52 C ATOM 2339 CD PRO A 927 -3.371 26.425 0.418 1.00 34.85 C ATOM 2340 N LEU A 928 -3.960 30.472 2.539 1.00 31.16 N ATOM 2341 CA LEU A 928 -4.753 31.676 2.306 1.00 31.18 C ATOM 2342 C LEU A 928 -3.821 32.757 1.757 1.00 32.27 C ATOM 2343 O LEU A 928 -3.052 33.376 2.494 1.00 33.57 O ATOM 2344 CB LEU A 928 -5.448 32.121 3.596 1.00 28.54 C ATOM 2345 CG LEU A 928 -6.322 31.037 4.239 1.00 28.07 C ATOM 2346 CD1 LEU A 928 -6.950 31.567 5.498 1.00 26.64 C ATOM 2347 CD2 LEU A 928 -7.400 30.554 3.264 1.00 27.35 C ATOM 2348 H LEU A 928 -3.292 30.445 3.336 1.00 0.00 H ATOM 2349 N LEU A 929 -3.876 32.951 0.446 1.00 32.29 N ATOM 2350 CA LEU A 929 -3.015 33.916 -0.230 1.00 32.29 C ATOM 2351 C LEU A 929 -3.650 35.286 -0.458 1.00 32.38 C ATOM 2352 O LEU A 929 -4.866 35.405 -0.635 1.00 33.21 O ATOM 2353 CB LEU A 929 -2.560 33.331 -1.571 1.00 31.39 C ATOM 2354 CG LEU A 929 -2.043 31.883 -1.527 1.00 31.54 C ATOM 2355 CD1 LEU A 929 -2.033 31.295 -2.927 1.00 31.24 C ATOM 2356 CD2 LEU A 929 -0.659 31.813 -0.891 1.00 31.00 C ATOM 2357 H LEU A 929 -4.553 32.398 -0.117 1.00 0.00 H ATOM 2358 N PHE A 930 -2.814 36.319 -0.424 1.00 31.75 N ATOM 2359 CA PHE A 930 -3.253 37.686 -0.665 1.00 31.98 C ATOM 2360 C PHE A 930 -3.124 38.005 -2.171 1.00 33.22 C ATOM 2361 O PHE A 930 -3.833 38.867 -2.694 1.00 32.83 O ATOM 2362 CB PHE A 930 -2.403 38.677 0.141 1.00 31.32 C ATOM 2363 CG PHE A 930 -2.618 38.610 1.639 1.00 31.43 C ATOM 2364 CD1 PHE A 930 -1.738 37.897 2.454 1.00 31.10 C ATOM 2365 CD2 PHE A 930 -3.684 39.285 2.235 1.00 30.15 C ATOM 2366 CE1 PHE A 930 -1.911 37.856 3.845 1.00 30.52 C ATOM 2367 CE2 PHE A 930 -3.868 39.253 3.621 1.00 31.23 C ATOM 2368 CZ PHE A 930 -2.978 38.535 4.430 1.00 30.99 C ATOM 2369 H PHE A 930 -1.810 36.144 -0.218 1.00 0.00 H ATOM 2370 N HIS A 931 -2.236 37.285 -2.861 1.00 33.47 N ATOM 2371 CA HIS A 931 -1.992 37.500 -4.291 1.00 35.25 C ATOM 2372 C HIS A 931 -1.970 36.174 -5.055 1.00 36.04 C ATOM 2373 O HIS A 931 -1.120 35.315 -4.717 1.00 37.04 O ATOM 2374 CB HIS A 931 -0.654 38.232 -4.501 1.00 34.64 C ATOM 2375 CG HIS A 931 -0.448 39.392 -3.575 1.00 36.64 C ATOM 2376 ND1 HIS A 931 -1.045 40.619 -3.774 1.00 35.67 N ATOM 2377 CD2 HIS A 931 0.231 39.490 -2.406 1.00 36.24 C ATOM 2378 CE1 HIS A 931 -0.750 41.419 -2.765 1.00 36.02 C ATOM 2379 NE2 HIS A 931 0.024 40.759 -1.921 1.00 35.91 N ATOM 2380 H HIS A 931 -1.698 36.545 -2.366 1.00 0.00 H TER 2381 HIS A 931 HETATM 2382 O HOH 1 -6.546 19.445 4.542 1.00 25.52 O HETATM 2383 O HOH 2 10.944 50.345 1.796 1.00 33.00 O HETATM 2384 O HOH 3 4.410 26.237 9.607 1.00 8.96 O HETATM 2385 O HOH 4 27.781 29.488 19.143 1.00 51.17 O HETATM 2386 O HOH 5 26.636 32.070 20.564 1.00 33.84 O HETATM 2387 O HOH 6 32.968 26.646 17.593 1.00 30.03 O HETATM 2388 O HOH 7 3.243 29.652 6.575 1.00 25.48 O HETATM 2389 O HOH 8 10.721 37.331 19.177 1.00 30.36 O HETATM 2390 O HOH 9 -6.400 49.348 17.629 1.00 20.66 O HETATM 2391 O HOH 10 2.755 39.334 20.269 1.00 20.32 O HETATM 2392 O HOH 11 -10.945 36.404 22.869 1.00 44.38 O HETATM 2393 O HOH 12 0.056 24.309 0.015 1.00 35.93 O HETATM 2394 O HOH 13 2.960 35.393 25.992 1.00 28.95 O HETATM 2395 O HOH 14 -4.668 49.359 1.593 1.00 35.95 O HETATM 2396 O HOH 15 15.014 34.145 9.613 1.00 40.43 O HETATM 2397 O HOH 16 -6.309 36.173 1.845 1.00 39.51 O HETATM 2398 O HOH 17 -10.987 32.279 4.554 1.00 37.37 O HETATM 2399 O HOH 18 -10.484 20.437 12.318 1.00 42.14 O HETATM 2400 O HOH 19 -2.191 52.995 24.169 1.00 40.40 O HETATM 2401 O HOH 20 10.843 18.298 15.418 1.00 42.06 O HETATM 2402 O HOH 21 26.746 21.117 12.444 1.00 32.48 O HETATM 2403 O HOH 22 15.140 32.536 21.763 1.00 25.04 O HETATM 2404 O HOH 23 8.440 32.856 17.915 1.00 37.25 O HETATM 2405 O HOH 24 15.990 37.041 22.806 1.00 29.52 O HETATM 2406 O HOH 25 -1.722 28.912 10.047 1.00 26.71 O HETATM 2407 O HOH 26 1.792 39.247 17.324 1.00 30.63 O HETATM 2408 O HOH 27 3.110 60.108 -3.453 1.00 48.80 O HETATM 2409 O HOH 28 12.479 34.530 22.510 1.00 44.64 O HETATM 2410 O HOH 29 11.958 31.658 17.220 1.00 27.07 O HETATM 2411 O HOH 30 2.314 23.806 4.807 1.00 61.76 O HETATM 2412 O HOH 31 -5.059 39.793 26.488 1.00 40.33 O HETATM 2413 O HOH 32 23.192 45.834 7.793 1.00 39.82 O HETATM 2414 O HOH 33 12.083 51.186 11.118 1.00 42.11 O HETATM 2415 O HOH 34 4.585 37.818 28.848 1.00 50.63 O HETATM 2416 O HOH 35 10.002 50.102 15.057 1.00 22.28 O HETATM 2417 O HOH 36 14.108 39.814 21.500 1.00 45.74 O HETATM 2418 O HOH 37 18.260 47.418 12.943 1.00 41.15 O HETATM 2419 O HOH 38 21.202 34.904 1.612 1.00 45.89 O HETATM 2420 O HOH 39 18.980 47.664 9.716 1.00 43.89 O HETATM 2421 O HOH 40 27.580 38.985 7.129 1.00 41.06 O HETATM 2422 O HOH 41 10.870 34.943 1.091 1.00 52.04 O HETATM 2423 O HOH 42 5.521 25.303 -3.356 1.00 56.64 O HETATM 2424 C1 UNN A 43 14.612 26.442 16.763 1.00 -0.02 C HETATM 2425 C2 UNN A 43 14.822 27.818 17.348 1.00 0.02 C HETATM 2426 C3 UNN A 43 14.444 29.067 16.402 1.00 0.08 C HETATM 2427 C4 UNN A 43 14.001 28.807 15.120 1.00 -0.04 C HETATM 2428 C5 UNN A 43 13.905 27.512 14.577 1.00 -0.05 C HETATM 2429 C6 UNN A 43 13.395 27.443 13.136 1.00 -0.02 C HETATM 2430 C7 UNN A 43 14.067 26.336 12.325 1.00 -0.02 C HETATM 2431 C8 UNN A 43 14.230 25.009 13.045 1.00 0.01 C HETATM 2432 C9 UNN A 43 14.527 25.045 14.590 1.00 -0.02 C HETATM 2433 C10 UNN A 43 14.352 26.323 15.300 1.00 -0.03 C HETATM 2434 C11 UNN A 43 14.982 23.701 15.311 1.00 0.03 C HETATM 2435 C12 UNN A 43 15.427 22.652 14.433 1.00 -0.02 C HETATM 2436 C13 UNN A 43 14.864 22.476 13.003 1.00 0.02 C HETATM 2437 C14 UNN A 43 14.858 23.801 12.301 1.00 -0.02 C HETATM 2438 C15 UNN A 43 14.640 23.492 10.822 1.00 -0.05 C HETATM 2439 C16 UNN A 43 15.260 22.088 10.672 1.00 -0.01 C HETATM 2440 C17 UNN A 43 15.736 21.648 12.084 1.00 0.17 C HETATM 2441 C20 UNN A 43 15.943 20.123 12.282 1.00 0.16 C HETATM 2442 C21 UNN A 43 16.692 19.526 13.465 1.00 0.01 C HETATM 2443 H UNN A 43 16.702 18.430 13.377 1.00 0.05 H HETATM 2444 H UNN A 43 16.190 19.814 14.400 1.00 0.05 H HETATM 2445 H UNN A 43 17.726 19.902 13.472 1.00 0.05 H HETATM 2446 O20 UNN A 43 15.518 19.312 11.497 1.00 -0.33 O HETATM 2447 O17 UNN A 43 17.255 21.966 12.174 1.00 -0.27 O HETATM 2448 C30 UNN A 43 18.443 21.406 11.511 1.00 0.23 C HETATM 2449 C31 UNN A 43 19.815 22.043 11.614 1.00 0.04 C HETATM 2450 H UNN A 43 20.540 21.448 11.038 1.00 0.05 H HETATM 2451 H UNN A 43 20.125 22.078 12.669 1.00 0.05 H HETATM 2452 H UNN A 43 19.776 23.065 11.210 1.00 0.05 H HETATM 2453 O30 UNN A 43 18.327 20.397 10.791 1.00 -0.37 O HETATM 2454 H UNN A 43 16.114 22.124 9.980 1.00 0.03 H HETATM 2455 H UNN A 43 14.508 21.382 10.290 1.00 0.03 H HETATM 2456 H UNN A 43 15.157 24.224 10.184 1.00 0.03 H HETATM 2457 H UNN A 43 13.569 23.481 10.573 1.00 0.03 H HETATM 2458 H UNN A 43 15.916 24.101 12.317 1.00 0.03 H HETATM 2459 C18 UNN A 43 13.477 21.828 13.125 1.00 -0.06 C HETATM 2460 H UNN A 43 12.847 22.433 13.794 1.00 0.02 H HETATM 2461 H UNN A 43 13.581 20.814 13.538 1.00 0.02 H HETATM 2462 H UNN A 43 13.009 21.773 12.131 1.00 0.02 H HETATM 2463 H UNN A 43 15.228 21.707 14.959 1.00 0.03 H HETATM 2464 H UNN A 43 16.513 22.787 14.320 1.00 0.03 H HETATM 2465 C32 UNN A 43 13.748 23.095 16.133 1.00 -0.04 C HETATM 2466 C33 UNN A 43 12.478 23.653 16.027 1.00 -0.07 C HETATM 2467 C34 UNN A 43 11.391 23.080 16.673 1.00 -0.05 C HETATM 2468 C35 UNN A 43 11.566 21.933 17.441 1.00 0.03 C HETATM 2469 C36 UNN A 43 12.823 21.360 17.556 1.00 -0.05 C HETATM 2470 C37 UNN A 43 13.906 21.943 16.903 1.00 -0.07 C HETATM 2471 H UNN A 43 14.888 21.494 16.995 1.00 0.05 H HETATM 2472 H UNN A 43 12.962 20.464 18.150 1.00 0.05 H HETATM 2473 N38 UNN A 43 10.495 21.388 18.114 1.00 -0.32 N HETATM 2474 C39 UNN A 43 9.210 21.813 17.931 1.00 0.01 C HETATM 2475 H UNN A 43 8.536 21.230 18.575 1.00 0.05 H HETATM 2476 H UNN A 43 8.924 21.673 16.878 1.00 0.05 H HETATM 2477 H UNN A 43 9.136 22.879 18.192 1.00 0.05 H HETATM 2478 C40 UNN A 43 10.643 20.385 19.022 1.00 0.01 C HETATM 2479 H UNN A 43 11.706 20.114 19.099 1.00 0.05 H HETATM 2480 H UNN A 43 10.063 19.508 18.698 1.00 0.05 H HETATM 2481 H UNN A 43 10.279 20.722 20.004 1.00 0.05 H HETATM 2482 H UNN A 43 10.407 23.526 16.579 1.00 0.05 H HETATM 2483 H UNN A 43 12.335 24.548 15.432 1.00 0.05 H HETATM 2484 H UNN A 43 15.802 23.949 16.001 1.00 0.07 H HETATM 2485 H UNN A 43 13.177 24.690 13.059 1.00 0.05 H HETATM 2486 H UNN A 43 15.067 26.689 12.033 1.00 0.03 H HETATM 2487 H UNN A 43 13.462 26.161 11.423 1.00 0.03 H HETATM 2488 H UNN A 43 13.593 28.408 12.646 1.00 0.05 H HETATM 2489 H UNN A 43 12.311 27.257 13.155 1.00 0.05 H HETATM 2490 H UNN A 43 13.710 29.650 14.495 1.00 0.02 H HETATM 2491 O3 UNN A 43 14.515 30.249 16.890 1.00 -0.41 O HETATM 2492 H UNN A 43 15.886 27.910 17.613 1.00 0.05 H HETATM 2493 H UNN A 43 14.209 27.891 18.259 1.00 0.05 H HETATM 2494 H UNN A 43 13.751 25.996 17.283 1.00 0.04 H HETATM 2495 H UNN A 43 15.517 25.855 16.981 1.00 0.04 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 2175 2176 2183 2184 2185 CONECT 2183 2175 CONECT 2184 2175 CONECT 2185 2175 CONECT 2424 2425 2433 2494 2495 CONECT 2425 2424 2426 2492 2493 CONECT 2426 2425 2427 2491 CONECT 2427 2426 2428 2490 CONECT 2428 2427 2429 2433 CONECT 2429 2428 2430 2488 2489 CONECT 2430 2429 2431 2486 2487 CONECT 2431 2430 2432 2437 2485 CONECT 2432 2431 2433 2434 CONECT 2433 2424 2428 2432 CONECT 2434 2432 2435 2465 2484 CONECT 2435 2434 2436 2463 2464 CONECT 2436 2435 2437 2440 2459 CONECT 2437 2431 2436 2438 2458 CONECT 2438 2437 2439 2456 2457 CONECT 2439 2438 2440 2454 2455 CONECT 2440 2436 2439 2441 2447 CONECT 2441 2440 2442 2446 CONECT 2442 2441 2443 2444 2445 CONECT 2443 2442 CONECT 2444 2442 CONECT 2445 2442 CONECT 2446 2441 CONECT 2447 2440 2448 CONECT 2448 2447 2449 2453 CONECT 2449 2448 2450 2451 2452 CONECT 2450 2449 CONECT 2451 2449 CONECT 2452 2449 CONECT 2453 2448 CONECT 2454 2439 CONECT 2455 2439 CONECT 2456 2438 CONECT 2457 2438 CONECT 2458 2437 CONECT 2459 2436 2460 2461 2462 CONECT 2460 2459 CONECT 2461 2459 CONECT 2462 2459 CONECT 2463 2435 CONECT 2464 2435 CONECT 2465 2434 2466 2470 CONECT 2466 2465 2467 2483 CONECT 2467 2466 2468 2482 CONECT 2468 2467 2469 2473 CONECT 2469 2468 2470 2472 CONECT 2470 2465 2469 2471 CONECT 2471 2470 CONECT 2472 2469 CONECT 2473 2468 2474 2478 CONECT 2474 2473 2475 2476 2477 CONECT 2475 2474 CONECT 2476 2474 CONECT 2477 2474 CONECT 2478 2473 2479 2480 2481 CONECT 2479 2478 CONECT 2480 2478 CONECT 2481 2478 CONECT 2482 2467 CONECT 2483 2466 CONECT 2484 2434 CONECT 2485 2431 CONECT 2486 2430 CONECT 2487 2430 CONECT 2488 2429 CONECT 2489 2429 CONECT 2490 2427 CONECT 2491 2426 CONECT 2492 2425 CONECT 2493 2425 CONECT 2494 2424 CONECT 2495 2424 MASTER 0 0 0 0 0 0 0 0 2493 2 80 19 END
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Structure:
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Related entries of code: 4oar
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1kkq
RCSB PDB
PDBbind
19aa, >1KKQ_2|Chains... *
3r2a
RCSB PDB
PDBbind
16aa, >3R2A_2|Chains... at 93%
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
4oar
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Progesterone receptor
Ligand Name
2S0
EC.Number
E.C.-.-.-.-
Resolution
2.41(Å)
Affinity (Kd/Ki/IC50)
IC50=38pM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Steroid Biochem.Mol.Biol. Vol. 144PB: pp. 427-435
Ligand Properties
Formula
C
3
0
H
3
7
NO
4
Molecular Weight
475.619
Exact Mass
475.272
No. of atoms
72
No. of bonds
76
Polar Surface Area
63.68
LOGP Value
3.47 (
Computed with XLOGP3
)
5.54 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 5
Canonical SMILES
CC(=O)O[C@@]1(CC[C@@H]2[C@]1(C)C[C@H](c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CC[C@@H]21)C(=O)C
InChI String
InChI=1S/C30H37NO4/c1-18(32)30(35-19(2)33)15-14-27-25-12-8-21-16-23(34)11-13-24(21)28(25)26(17-29(27,30)3)20-6-9-22(10-7-20)31(4)5/h6-7,9-10,16,25-27H,8,11-15,17H2,1-5H3/t25-,26+,27-,29-,30-/m0/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):
Q9Y618
P06401
Entrez Gene ID
NCBI Entrez Gene ID:
9612
5241
ASD
Information of known allosteric effects of PDB entries
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