Browse entries in the PDBbind-CN Database
HEADER 6DYN_COMPLEX COMPND 6DYN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 213 MET LEU LYS MET GLU ALA VAL PRO LEU ARG LEU GLU HIS SEQRES 2 A 213 ARG GLN GLU VAL ILE ASP ILE ILE VAL ALA SER PHE TYR SEQRES 3 A 213 ASN LYS ALA ASP LEU GLU GLN TRP LEU LYS PRO GLY VAL SEQRES 4 A 213 LEU ARG THR ASP TYR SER ASP ILE LEU ASN ASP ILE TRP SEQRES 5 A 213 ASN VAL LEU VAL GLU ARG ASP LEU SER PHE VAL VAL TYR SEQRES 6 A 213 ASP THR ASN THR ASP ARG ILE ILE GLY THR ALA LEU ASN SEQRES 7 A 213 PHE ASP ALA ARG ASN GLU PRO GLU VAL ASP ILE LYS SER SEQRES 8 A 213 LYS LEU LEU ILE VAL PHE GLU PHE LEU GLU PHE CYS GLU SEQRES 9 A 213 GLY PRO ILE ARG ASP ASN TYR LEU PRO LYS GLY LEU ASN SEQRES 10 A 213 GLN ILE LEU HIS SER PHE MET MET GLY THR ALA GLU LYS SEQRES 11 A 213 LEU ASN PRO ARG GLU ASN ILE ALA CYS MET HIS PHE MET SEQRES 12 A 213 GLU HIS GLU VAL LEU ARG VAL ALA ARG GLU LYS GLN PHE SEQRES 13 A 213 ALA GLY ILE PHE THR THR ASN THR SER PRO LEU THR GLN SEQRES 14 A 213 GLN LEU ALA ASP VAL TYR HIS TYR LYS THR LEU LEU ASN SEQRES 15 A 213 PHE GLN VAL ASN GLU TYR VAL HIS SER ASP GLY SER ARG SEQRES 16 A 213 PRO PHE GLY ASP ALA PRO ASP GLU GLN ARG ALA ILE VAL SEQRES 17 A 213 HIS TRP LYS GLU VAL HET CA A 1 1 HET HSM A 361 18 ATOM 1 N MET A 665 12.814 -32.535 10.237 1.00 55.92 N ATOM 2 CA MET A 665 13.446 -31.325 10.754 1.00 47.69 C ATOM 3 C MET A 665 13.595 -30.268 9.677 1.00 46.66 C ATOM 4 O MET A 665 14.008 -30.555 8.544 1.00 46.92 O ATOM 5 CB MET A 665 14.815 -31.637 11.344 1.00 48.73 C ATOM 6 CG MET A 665 15.451 -30.466 12.060 1.00 42.16 C ATOM 7 SD MET A 665 17.220 -30.727 12.308 1.00 60.66 S ATOM 8 CE MET A 665 17.292 -32.521 12.424 1.00 54.23 C ATOM 9 HN3 MET A 665 13.396 -32.928 9.470 1.00 0.00 H ATOM 10 HN2 MET A 665 11.868 -32.302 9.872 1.00 0.00 H ATOM 11 HN1 MET A 665 12.729 -33.234 11.002 1.00 0.00 H ATOM 12 N LEU A 666 13.272 -29.038 10.052 1.00 42.04 N ATOM 13 CA LEU A 666 13.309 -27.923 9.120 1.00 39.51 C ATOM 14 C LEU A 666 14.754 -27.474 8.932 1.00 38.96 C ATOM 15 O LEU A 666 15.432 -27.129 9.903 1.00 42.74 O ATOM 16 CB LEU A 666 12.441 -26.785 9.646 1.00 41.35 C ATOM 17 CG LEU A 666 12.404 -25.542 8.770 1.00 38.13 C ATOM 18 CD1 LEU A 666 11.989 -25.929 7.364 1.00 32.66 C ATOM 19 CD2 LEU A 666 11.479 -24.472 9.381 1.00 31.88 C ATOM 20 H LEU A 666 12.985 -28.867 11.037 1.00 0.00 H ATOM 21 N LYS A 667 15.234 -27.474 7.694 1.00 35.02 N ATOM 22 CA LYS A 667 16.576 -26.988 7.421 1.00 36.73 C ATOM 23 C LYS A 667 16.524 -25.858 6.401 1.00 32.49 C ATOM 24 O LYS A 667 15.772 -25.904 5.426 1.00 30.85 O ATOM 25 CB LYS A 667 17.507 -28.133 7.000 1.00 49.73 C ATOM 26 CG LYS A 667 17.729 -29.075 8.204 1.00 52.57 C ATOM 27 CD LYS A 667 18.392 -30.427 7.922 1.00 57.47 C ATOM 28 CE LYS A 667 19.725 -30.256 7.231 1.00 65.99 C ATOM 29 NZ LYS A 667 20.870 -30.619 8.125 1.00 64.89 N ATOM 30 HZ1 LYS A 667 20.859 -30.008 8.966 1.00 0.00 H ATOM 31 HZ2 LYS A 667 20.779 -31.613 8.416 1.00 0.00 H ATOM 32 HZ3 LYS A 667 21.765 -30.487 7.611 1.00 0.00 H ATOM 33 H LYS A 667 14.644 -27.825 6.913 1.00 0.00 H ATOM 34 N MET A 668 17.320 -24.829 6.659 1.00 32.47 N ATOM 35 CA MET A 668 17.072 -23.497 6.142 1.00 25.52 C ATOM 36 C MET A 668 18.366 -22.886 5.652 1.00 28.50 C ATOM 37 O MET A 668 19.460 -23.258 6.085 1.00 28.26 O ATOM 38 CB MET A 668 16.466 -22.592 7.226 1.00 25.53 C ATOM 39 CG MET A 668 15.014 -22.883 7.537 1.00 22.53 C ATOM 40 SD MET A 668 14.528 -22.073 9.068 1.00 26.38 S ATOM 41 CE MET A 668 15.395 -23.140 10.229 1.00 20.63 C ATOM 42 H MET A 668 18.157 -24.984 7.257 1.00 0.00 H ATOM 43 N GLU A 669 18.230 -21.908 4.770 1.00 25.47 N ATOM 44 CA GLU A 669 19.385 -21.182 4.277 1.00 28.16 C ATOM 45 C GLU A 669 19.022 -19.714 4.129 1.00 25.62 C ATOM 46 O GLU A 669 17.939 -19.381 3.647 1.00 22.85 O ATOM 47 CB GLU A 669 19.858 -21.745 2.938 1.00 23.15 C ATOM 48 CG GLU A 669 21.142 -21.101 2.413 1.00 32.77 C ATOM 49 CD GLU A 669 21.449 -21.520 0.980 1.00 40.60 C ATOM 50 OE1 GLU A 669 20.875 -22.536 0.517 1.00 35.16 O ATOM 51 OE2 GLU A 669 22.247 -20.821 0.317 1.00 43.57 O ATOM 52 H GLU A 669 17.281 -21.657 4.426 1.00 0.00 H ATOM 53 N ALA A 670 19.934 -18.843 4.522 1.00 21.96 N ATOM 54 CA ALA A 670 19.709 -17.411 4.415 1.00 27.34 C ATOM 55 C ALA A 670 20.371 -16.908 3.143 1.00 26.44 C ATOM 56 O ALA A 670 21.557 -17.169 2.907 1.00 26.85 O ATOM 57 CB ALA A 670 20.261 -16.676 5.635 1.00 26.73 C ATOM 58 H ALA A 670 20.832 -19.189 4.916 1.00 0.00 H ATOM 59 N VAL A 671 19.602 -16.189 2.339 1.00 23.08 N ATOM 60 CA VAL A 671 20.049 -15.644 1.064 1.00 26.23 C ATOM 61 C VAL A 671 19.871 -14.133 1.128 1.00 24.73 C ATOM 62 O VAL A 671 18.800 -13.666 1.518 1.00 26.64 O ATOM 63 CB VAL A 671 19.252 -16.230 -0.117 1.00 28.50 C ATOM 64 CG1 VAL A 671 19.551 -15.489 -1.404 1.00 29.87 C ATOM 65 CG2 VAL A 671 19.543 -17.712 -0.263 1.00 32.80 C ATOM 66 H VAL A 671 18.623 -16.003 2.635 1.00 0.00 H ATOM 67 N PRO A 672 20.872 -13.328 0.740 1.00 30.20 N ATOM 68 CA PRO A 672 20.667 -11.869 0.691 1.00 28.40 C ATOM 69 C PRO A 672 19.518 -11.481 -0.233 1.00 28.59 C ATOM 70 O PRO A 672 19.227 -12.149 -1.230 1.00 26.17 O ATOM 71 CB PRO A 672 22.007 -11.328 0.167 1.00 26.29 C ATOM 72 CG PRO A 672 23.003 -12.392 0.477 1.00 31.18 C ATOM 73 CD PRO A 672 22.251 -13.704 0.383 1.00 28.34 C ATOM 74 N LEU A 673 18.860 -10.384 0.131 1.00 23.11 N ATOM 75 CA LEU A 673 17.697 -9.894 -0.594 1.00 29.99 C ATOM 76 C LEU A 673 18.074 -9.545 -2.036 1.00 29.88 C ATOM 77 O LEU A 673 19.099 -8.906 -2.281 1.00 29.28 O ATOM 78 CB LEU A 673 17.127 -8.670 0.149 1.00 23.41 C ATOM 79 CG LEU A 673 15.637 -8.369 0.040 1.00 31.08 C ATOM 80 CD1 LEU A 673 14.744 -9.549 0.468 1.00 29.45 C ATOM 81 CD2 LEU A 673 15.282 -7.105 0.816 1.00 24.09 C ATOM 82 H LEU A 673 19.189 -9.857 0.965 1.00 0.00 H ATOM 83 N ARG A 674 17.254 -9.989 -2.993 1.00 29.40 N ATOM 84 CA ARG A 674 17.424 -9.661 -4.406 1.00 36.36 C ATOM 85 C ARG A 674 16.166 -8.978 -4.932 1.00 33.22 C ATOM 86 O ARG A 674 15.086 -9.082 -4.345 1.00 29.04 O ATOM 87 CB ARG A 674 17.731 -10.909 -5.268 1.00 30.71 C ATOM 88 CG ARG A 674 18.895 -11.756 -4.804 1.00 33.65 C ATOM 89 CD ARG A 674 19.261 -12.821 -5.854 1.00 38.92 C ATOM 90 NE ARG A 674 18.168 -13.765 -6.100 1.00 48.42 N ATOM 91 CZ ARG A 674 18.105 -15.006 -5.611 1.00 48.32 C ATOM 92 NH1 ARG A 674 19.082 -15.474 -4.840 1.00 46.83 N ATOM 93 NH2 ARG A 674 17.058 -15.781 -5.888 1.00 42.87 N ATOM 94 HE ARG A 674 17.382 -13.444 -6.701 1.00 0.00 H ATOM 95 HH12 ARG A 674 19.028 -16.441 -4.462 1.00 0.00 H ATOM 96 HH11 ARG A 674 19.900 -14.873 -4.615 1.00 0.00 H ATOM 97 HH22 ARG A 674 17.011 -16.747 -5.506 1.00 0.00 H ATOM 98 HH21 ARG A 674 16.288 -15.420 -6.486 1.00 0.00 H ATOM 99 H ARG A 674 16.456 -10.597 -2.719 1.00 0.00 H ATOM 100 N LEU A 675 16.311 -8.274 -6.063 1.00 35.44 N ATOM 101 CA LEU A 675 15.193 -7.489 -6.577 1.00 33.68 C ATOM 102 C LEU A 675 13.970 -8.355 -6.885 1.00 36.15 C ATOM 103 O LEU A 675 12.836 -7.872 -6.773 1.00 34.79 O ATOM 104 CB LEU A 675 15.619 -6.702 -7.819 1.00 34.11 C ATOM 105 CG LEU A 675 16.506 -5.458 -7.644 1.00 35.46 C ATOM 106 CD1 LEU A 675 16.991 -4.979 -8.997 1.00 38.98 C ATOM 107 CD2 LEU A 675 15.800 -4.311 -6.917 1.00 33.36 C ATOM 108 H LEU A 675 17.217 -8.287 -6.573 1.00 0.00 H ATOM 109 N GLU A 676 14.162 -9.632 -7.250 1.00 34.45 N ATOM 110 CA GLU A 676 13.023 -10.442 -7.679 1.00 35.98 C ATOM 111 C GLU A 676 12.283 -11.082 -6.521 1.00 39.40 C ATOM 112 O GLU A 676 11.295 -11.794 -6.750 1.00 34.12 O ATOM 113 CB GLU A 676 13.458 -11.532 -8.657 1.00 35.94 C ATOM 114 CG GLU A 676 14.322 -12.615 -8.062 1.00 44.14 C ATOM 115 CD GLU A 676 15.790 -12.309 -8.214 1.00 48.61 C ATOM 116 OE1 GLU A 676 16.140 -11.104 -8.324 1.00 43.27 O ATOM 117 OE2 GLU A 676 16.585 -13.274 -8.235 1.00 50.50 O ATOM 118 H GLU A 676 15.117 -10.044 -7.228 1.00 0.00 H ATOM 119 N HIS A 677 12.750 -10.857 -5.297 1.00 35.76 N ATOM 120 CA HIS A 677 12.085 -11.350 -4.105 1.00 33.03 C ATOM 121 C HIS A 677 10.903 -10.492 -3.702 1.00 33.15 C ATOM 122 O HIS A 677 10.193 -10.869 -2.765 1.00 34.02 O ATOM 123 CB HIS A 677 13.074 -11.402 -2.944 1.00 31.83 C ATOM 124 CG HIS A 677 14.145 -12.429 -3.103 1.00 28.36 C ATOM 125 ND1 HIS A 677 15.437 -12.228 -2.664 1.00 26.77 N ATOM 126 CD2 HIS A 677 14.115 -13.674 -3.630 1.00 31.72 C ATOM 127 CE1 HIS A 677 16.157 -13.305 -2.918 1.00 29.78 C ATOM 128 NE2 HIS A 677 15.378 -14.197 -3.503 1.00 30.72 N ATOM 129 H HIS A 677 13.626 -10.306 -5.189 1.00 0.00 H ATOM 130 N ARG A 678 10.688 -9.362 -4.391 1.00 28.86 N ATOM 131 CA ARG A 678 9.753 -8.339 -3.931 1.00 33.99 C ATOM 132 C ARG A 678 8.401 -8.926 -3.556 1.00 36.78 C ATOM 133 O ARG A 678 7.919 -8.717 -2.436 1.00 32.11 O ATOM 134 CB ARG A 678 9.589 -7.248 -4.996 1.00 31.83 C ATOM 135 CG ARG A 678 8.959 -5.972 -4.464 1.00 33.65 C ATOM 136 CD ARG A 678 8.770 -4.905 -5.566 1.00 38.73 C ATOM 137 NE ARG A 678 7.955 -5.428 -6.661 1.00 45.63 N ATOM 138 CZ ARG A 678 6.628 -5.575 -6.613 1.00 45.47 C ATOM 139 NH1 ARG A 678 5.949 -5.217 -5.532 1.00 43.66 N ATOM 140 NH2 ARG A 678 5.972 -6.080 -7.652 1.00 53.97 N ATOM 141 HE ARG A 678 8.442 -5.705 -7.538 1.00 0.00 H ATOM 142 HH12 ARG A 678 4.916 -5.335 -5.504 1.00 0.00 H ATOM 143 HH11 ARG A 678 6.449 -4.818 -4.712 1.00 0.00 H ATOM 144 HH22 ARG A 678 4.939 -6.193 -7.610 1.00 0.00 H ATOM 145 HH21 ARG A 678 6.491 -6.363 -8.507 1.00 0.00 H ATOM 146 H ARG A 678 11.203 -9.209 -5.281 1.00 0.00 H ATOM 147 N GLN A 679 7.771 -9.672 -4.477 1.00 36.00 N ATOM 148 CA GLN A 679 6.414 -10.144 -4.211 1.00 38.47 C ATOM 149 C GLN A 679 6.392 -11.183 -3.101 1.00 32.90 C ATOM 150 O GLN A 679 5.450 -11.226 -2.306 1.00 33.57 O ATOM 151 CB GLN A 679 5.768 -10.720 -5.468 1.00 40.15 C ATOM 152 CG GLN A 679 4.239 -10.770 -5.369 1.00 35.00 C ATOM 153 CD GLN A 679 3.623 -9.380 -5.178 1.00 44.61 C ATOM 154 OE1 GLN A 679 3.810 -8.487 -6.009 1.00 51.17 O ATOM 155 NE2 GLN A 679 2.889 -9.195 -4.085 1.00 39.86 N ATOM 156 HE22 GLN A 679 2.756 -9.975 -3.410 1.00 0.00 H ATOM 157 HE21 GLN A 679 2.447 -8.271 -3.905 1.00 0.00 H ATOM 158 H GLN A 679 8.244 -9.912 -5.371 1.00 0.00 H ATOM 159 N GLU A 680 7.405 -12.040 -3.033 1.00 34.09 N ATOM 160 CA GLU A 680 7.424 -13.025 -1.955 1.00 36.59 C ATOM 161 C GLU A 680 7.591 -12.348 -0.598 1.00 32.21 C ATOM 162 O GLU A 680 6.908 -12.709 0.368 1.00 35.18 O ATOM 163 CB GLU A 680 8.527 -14.056 -2.205 1.00 39.59 C ATOM 164 CG GLU A 680 8.210 -14.981 -3.372 1.00 42.16 C ATOM 165 CD GLU A 680 9.366 -15.875 -3.749 1.00 51.36 C ATOM 166 OE1 GLU A 680 10.252 -15.404 -4.503 1.00 47.48 O ATOM 167 OE2 GLU A 680 9.383 -17.047 -3.295 1.00 55.84 O ATOM 168 H GLU A 680 8.171 -12.010 -3.735 1.00 0.00 H ATOM 169 N VAL A 681 8.478 -11.350 -0.514 1.00 31.17 N ATOM 170 CA VAL A 681 8.685 -10.621 0.740 1.00 30.27 C ATOM 171 C VAL A 681 7.415 -9.888 1.141 1.00 28.15 C ATOM 172 O VAL A 681 6.978 -9.957 2.294 1.00 26.26 O ATOM 173 CB VAL A 681 9.876 -9.655 0.608 1.00 32.32 C ATOM 174 CG1 VAL A 681 9.869 -8.609 1.741 1.00 29.05 C ATOM 175 CG2 VAL A 681 11.163 -10.432 0.582 1.00 27.03 C ATOM 176 H VAL A 681 9.031 -11.087 -1.355 1.00 0.00 H ATOM 177 N ILE A 682 6.785 -9.201 0.182 1.00 33.62 N ATOM 178 CA ILE A 682 5.535 -8.497 0.458 1.00 32.42 C ATOM 179 C ILE A 682 4.466 -9.465 0.958 1.00 30.04 C ATOM 180 O ILE A 682 3.773 -9.200 1.948 1.00 29.95 O ATOM 181 CB ILE A 682 5.062 -7.737 -0.794 1.00 34.46 C ATOM 182 CG1 ILE A 682 5.933 -6.498 -1.029 1.00 37.41 C ATOM 183 CG2 ILE A 682 3.597 -7.349 -0.652 1.00 31.12 C ATOM 184 CD1 ILE A 682 5.489 -5.639 -2.234 1.00 37.38 C ATOM 185 H ILE A 682 7.191 -9.167 -0.775 1.00 0.00 H ATOM 186 N ASP A 683 4.306 -10.597 0.277 1.00 33.46 N ATOM 187 CA ASP A 683 3.289 -11.552 0.703 1.00 33.22 C ATOM 188 C ASP A 683 3.520 -12.004 2.138 1.00 33.01 C ATOM 189 O ASP A 683 2.563 -12.172 2.902 1.00 34.93 O ATOM 190 CB ASP A 683 3.267 -12.754 -0.238 1.00 34.31 C ATOM 191 CG ASP A 683 2.825 -12.378 -1.638 1.00 40.54 C ATOM 192 OD1 ASP A 683 2.180 -11.313 -1.792 1.00 37.75 O ATOM 193 OD2 ASP A 683 3.138 -13.136 -2.581 1.00 45.06 O ATOM 194 H ASP A 683 4.901 -10.799 -0.552 1.00 0.00 H ATOM 195 N ILE A 684 4.780 -12.218 2.522 1.00 30.10 N ATOM 196 CA ILE A 684 5.074 -12.678 3.878 1.00 29.01 C ATOM 197 C ILE A 684 4.834 -11.562 4.881 1.00 29.06 C ATOM 198 O ILE A 684 4.210 -11.774 5.927 1.00 31.91 O ATOM 199 CB ILE A 684 6.511 -13.214 3.978 1.00 26.90 C ATOM 200 CG1 ILE A 684 6.569 -14.646 3.433 1.00 24.12 C ATOM 201 CG2 ILE A 684 6.991 -13.169 5.453 1.00 25.89 C ATOM 202 CD1 ILE A 684 7.941 -15.136 3.241 1.00 21.48 C ATOM 203 H ILE A 684 5.558 -12.056 1.852 1.00 0.00 H ATOM 204 N ILE A 685 5.331 -10.362 4.583 1.00 28.20 N ATOM 205 CA ILE A 685 5.162 -9.255 5.513 1.00 29.05 C ATOM 206 C ILE A 685 3.684 -8.930 5.681 1.00 34.69 C ATOM 207 O ILE A 685 3.194 -8.763 6.803 1.00 39.75 O ATOM 208 CB ILE A 685 5.970 -8.031 5.056 1.00 32.26 C ATOM 209 CG1 ILE A 685 7.464 -8.280 5.252 1.00 32.11 C ATOM 210 CG2 ILE A 685 5.565 -6.812 5.864 1.00 36.98 C ATOM 211 CD1 ILE A 685 7.856 -8.534 6.719 1.00 33.12 C ATOM 212 H ILE A 685 5.839 -10.217 3.687 1.00 0.00 H ATOM 213 N VAL A 686 2.942 -8.865 4.575 1.00 33.69 N ATOM 214 CA VAL A 686 1.519 -8.540 4.677 1.00 32.86 C ATOM 215 C VAL A 686 0.791 -9.619 5.467 1.00 41.14 C ATOM 216 O VAL A 686 0.050 -9.333 6.416 1.00 45.27 O ATOM 217 CB VAL A 686 0.907 -8.342 3.275 1.00 38.10 C ATOM 218 CG1 VAL A 686 -0.618 -8.274 3.349 1.00 38.64 C ATOM 219 CG2 VAL A 686 1.469 -7.069 2.630 1.00 34.17 C ATOM 220 H VAL A 686 3.372 -9.044 3.645 1.00 0.00 H ATOM 221 N ALA A 687 1.016 -10.882 5.103 1.00 41.48 N ATOM 222 CA ALA A 687 0.398 -11.973 5.839 1.00 38.78 C ATOM 223 C ALA A 687 0.831 -11.984 7.298 1.00 44.15 C ATOM 224 O ALA A 687 0.048 -12.368 8.173 1.00 47.95 O ATOM 225 CB ALA A 687 0.738 -13.300 5.176 1.00 33.78 C ATOM 226 H ALA A 687 1.634 -11.087 4.292 1.00 0.00 H ATOM 227 N SER A 688 2.065 -11.573 7.581 1.00 36.35 N ATOM 228 CA SER A 688 2.570 -11.611 8.946 1.00 41.99 C ATOM 229 C SER A 688 2.080 -10.443 9.792 1.00 42.53 C ATOM 230 O SER A 688 2.041 -10.557 11.024 1.00 44.71 O ATOM 231 CB SER A 688 4.102 -11.639 8.935 1.00 39.09 C ATOM 232 OG SER A 688 4.626 -11.247 10.183 1.00 48.76 O ATOM 233 HG SER A 688 4.327 -10.326 10.391 1.00 0.00 H ATOM 234 H SER A 688 2.676 -11.220 6.817 1.00 0.00 H ATOM 235 N PHE A 689 1.699 -9.333 9.175 1.00 42.95 N ATOM 236 CA PHE A 689 1.323 -8.145 9.932 1.00 44.69 C ATOM 237 C PHE A 689 -0.156 -7.816 9.862 1.00 44.78 C ATOM 238 O PHE A 689 -0.744 -7.466 10.887 1.00 43.20 O ATOM 239 CB PHE A 689 2.134 -6.938 9.455 1.00 42.22 C ATOM 240 CG PHE A 689 3.520 -6.877 10.031 1.00 45.80 C ATOM 241 CD1 PHE A 689 4.509 -7.744 9.587 1.00 44.19 C ATOM 242 CD2 PHE A 689 3.838 -5.948 11.019 1.00 54.20 C ATOM 243 CE1 PHE A 689 5.795 -7.701 10.115 1.00 44.75 C ATOM 244 CE2 PHE A 689 5.123 -5.891 11.552 1.00 55.31 C ATOM 245 CZ PHE A 689 6.107 -6.772 11.098 1.00 50.13 C ATOM 246 H PHE A 689 1.668 -9.309 8.136 1.00 0.00 H ATOM 247 N TYR A 690 -0.780 -7.925 8.689 1.00 45.06 N ATOM 248 CA TYR A 690 -2.158 -7.469 8.540 1.00 48.74 C ATOM 249 C TYR A 690 -3.086 -8.279 9.435 1.00 49.18 C ATOM 250 O TYR A 690 -3.140 -9.508 9.332 1.00 48.04 O ATOM 251 CB TYR A 690 -2.610 -7.573 7.085 1.00 49.57 C ATOM 252 CG TYR A 690 -4.093 -7.326 6.928 1.00 54.33 C ATOM 253 CD1 TYR A 690 -4.603 -6.030 6.922 1.00 53.42 C ATOM 254 CD2 TYR A 690 -4.989 -8.386 6.821 1.00 52.31 C ATOM 255 CE1 TYR A 690 -5.964 -5.796 6.793 1.00 48.51 C ATOM 256 CE2 TYR A 690 -6.353 -8.161 6.699 1.00 55.24 C ATOM 257 CZ TYR A 690 -6.834 -6.863 6.685 1.00 55.91 C ATOM 258 OH TYR A 690 -8.190 -6.633 6.559 1.00 61.88 O ATOM 259 HH TYR A 690 -8.360 -5.658 6.567 1.00 0.00 H ATOM 260 H TYR A 690 -0.281 -8.338 7.875 1.00 0.00 H ATOM 261 N ASN A 691 -3.817 -7.583 10.305 1.00 48.77 N ATOM 262 CA ASN A 691 -4.755 -8.156 11.271 1.00 52.41 C ATOM 263 C ASN A 691 -4.074 -9.028 12.316 1.00 50.75 C ATOM 264 O ASN A 691 -4.757 -9.735 13.067 1.00 55.30 O ATOM 265 CB ASN A 691 -5.872 -8.957 10.586 1.00 52.10 C ATOM 266 CG ASN A 691 -7.150 -8.161 10.446 1.00 55.87 C ATOM 267 OD1 ASN A 691 -7.125 -6.992 10.055 1.00 55.91 O ATOM 268 ND2 ASN A 691 -8.277 -8.783 10.779 1.00 60.23 N ATOM 269 HD22 ASN A 691 -8.249 -9.771 11.104 1.00 0.00 H ATOM 270 HD21 ASN A 691 -9.186 -8.282 10.715 1.00 0.00 H ATOM 271 H ASN A 691 -3.712 -6.548 10.297 1.00 0.00 H ATOM 272 N LYS A 692 -2.744 -9.013 12.374 1.00 46.44 N ATOM 273 CA LYS A 692 -2.002 -9.688 13.426 1.00 47.23 C ATOM 274 C LYS A 692 -1.200 -8.731 14.289 1.00 39.99 C ATOM 275 O LYS A 692 -1.098 -8.953 15.495 1.00 42.48 O ATOM 276 CB LYS A 692 -1.057 -10.738 12.831 1.00 42.80 C ATOM 277 CG LYS A 692 -1.767 -11.942 12.219 1.00 49.57 C ATOM 278 CD LYS A 692 -1.612 -11.922 10.712 1.00 53.45 C ATOM 279 CE LYS A 692 -2.844 -12.441 9.959 1.00 55.11 C ATOM 280 NZ LYS A 692 -2.750 -12.078 8.494 1.00 45.05 N ATOM 281 HZ1 LYS A 692 -2.701 -11.044 8.397 1.00 0.00 H ATOM 282 HZ2 LYS A 692 -1.895 -12.507 8.086 1.00 0.00 H ATOM 283 HZ3 LYS A 692 -3.590 -12.435 7.995 1.00 0.00 H ATOM 284 H LYS A 692 -2.216 -8.499 11.640 1.00 0.00 H ATOM 285 N ALA A 693 -0.681 -7.653 13.699 1.00 35.39 N ATOM 286 CA ALA A 693 0.225 -6.745 14.389 1.00 39.81 C ATOM 287 C ALA A 693 -0.420 -6.135 15.633 1.00 36.04 C ATOM 288 O ALA A 693 -1.582 -5.707 15.623 1.00 27.72 O ATOM 289 CB ALA A 693 0.685 -5.652 13.425 1.00 41.59 C ATOM 290 H ALA A 693 -0.933 -7.454 12.710 1.00 0.00 H ATOM 291 N ASP A 694 0.361 -6.086 16.715 1.00 29.05 N ATOM 292 CA ASP A 694 -0.202 -5.760 18.016 1.00 32.41 C ATOM 293 C ASP A 694 -0.553 -4.278 18.154 1.00 26.45 C ATOM 294 O ASP A 694 -1.408 -3.929 18.969 1.00 26.01 O ATOM 295 CB ASP A 694 0.775 -6.196 19.109 1.00 35.26 C ATOM 296 CG ASP A 694 1.117 -7.689 19.032 1.00 37.55 C ATOM 297 OD1 ASP A 694 1.803 -8.091 18.058 1.00 37.55 O ATOM 298 OD2 ASP A 694 0.716 -8.446 19.946 1.00 34.69 O ATOM 299 H ASP A 694 1.379 -6.282 16.627 1.00 0.00 H ATOM 300 N LEU A 695 0.091 -3.396 17.398 1.00 28.64 N ATOM 301 CA LEU A 695 -0.230 -1.974 17.494 1.00 30.40 C ATOM 302 C LEU A 695 -1.361 -1.606 16.542 1.00 30.75 C ATOM 303 O LEU A 695 -2.317 -0.939 16.940 1.00 29.96 O ATOM 304 CB LEU A 695 1.002 -1.119 17.190 1.00 26.64 C ATOM 305 CG LEU A 695 2.185 -1.223 18.157 1.00 27.90 C ATOM 306 CD1 LEU A 695 3.358 -0.451 17.615 1.00 23.90 C ATOM 307 CD2 LEU A 695 1.786 -0.681 19.521 1.00 23.70 C ATOM 308 H LEU A 695 0.826 -3.718 16.736 1.00 0.00 H ATOM 309 N GLU A 696 -1.277 -2.074 15.298 1.00 26.60 N ATOM 310 CA GLU A 696 -2.245 -1.707 14.270 1.00 35.35 C ATOM 311 C GLU A 696 -3.660 -2.169 14.592 1.00 33.67 C ATOM 312 O GLU A 696 -4.617 -1.593 14.064 1.00 32.41 O ATOM 313 CB GLU A 696 -1.807 -2.279 12.922 1.00 35.40 C ATOM 314 CG GLU A 696 -0.557 -1.630 12.376 1.00 36.33 C ATOM 315 CD GLU A 696 0.740 -2.302 12.839 1.00 45.28 C ATOM 316 OE1 GLU A 696 0.870 -2.637 14.043 1.00 38.42 O ATOM 317 OE2 GLU A 696 1.638 -2.490 11.985 1.00 51.33 O ATOM 318 H GLU A 696 -0.499 -2.719 15.052 1.00 0.00 H ATOM 319 N GLN A 697 -3.816 -3.188 15.442 1.00 28.18 N ATOM 320 CA GLN A 697 -5.142 -3.692 15.755 1.00 27.98 C ATOM 321 C GLN A 697 -5.988 -2.650 16.457 1.00 37.18 C ATOM 322 O GLN A 697 -7.219 -2.770 16.471 1.00 37.81 O ATOM 323 CB GLN A 697 -5.042 -4.936 16.630 1.00 29.13 C ATOM 324 CG GLN A 697 -4.581 -4.639 18.062 1.00 30.20 C ATOM 325 CD GLN A 697 -4.425 -5.900 18.899 1.00 34.86 C ATOM 326 OE1 GLN A 697 -5.361 -6.676 19.055 1.00 36.03 O ATOM 327 NE2 GLN A 697 -3.226 -6.118 19.420 1.00 34.59 N ATOM 328 HE22 GLN A 697 -2.459 -5.434 19.263 1.00 0.00 H ATOM 329 HE21 GLN A 697 -3.052 -6.973 19.985 1.00 0.00 H ATOM 330 H GLN A 697 -2.981 -3.624 15.883 1.00 0.00 H ATOM 331 N TRP A 698 -5.354 -1.637 17.045 1.00 30.14 N ATOM 332 CA TRP A 698 -6.049 -0.612 17.806 1.00 27.91 C ATOM 333 C TRP A 698 -6.391 0.610 16.970 1.00 30.58 C ATOM 334 O TRP A 698 -7.109 1.492 17.452 1.00 29.85 O ATOM 335 CB TRP A 698 -5.197 -0.210 19.011 1.00 28.17 C ATOM 336 CG TRP A 698 -4.830 -1.383 19.863 1.00 29.07 C ATOM 337 CD1 TRP A 698 -3.583 -1.910 20.066 1.00 27.68 C ATOM 338 CD2 TRP A 698 -5.735 -2.195 20.613 1.00 32.57 C ATOM 339 NE1 TRP A 698 -3.662 -3.001 20.903 1.00 28.92 N ATOM 340 CE2 TRP A 698 -4.972 -3.190 21.257 1.00 28.83 C ATOM 341 CE3 TRP A 698 -7.124 -2.173 20.806 1.00 30.77 C ATOM 342 CZ2 TRP A 698 -5.546 -4.151 22.073 1.00 35.59 C ATOM 343 CZ3 TRP A 698 -7.690 -3.126 21.622 1.00 37.91 C ATOM 344 CH2 TRP A 698 -6.904 -4.108 22.240 1.00 33.12 C ATOM 345 HE1 TRP A 698 -2.860 -3.585 21.215 1.00 0.00 H ATOM 346 H TRP A 698 -4.320 -1.577 16.956 1.00 0.00 H ATOM 347 N LEU A 699 -5.873 0.678 15.750 1.00 30.23 N ATOM 348 CA LEU A 699 -6.186 1.708 14.778 1.00 39.70 C ATOM 349 C LEU A 699 -7.387 1.349 13.915 1.00 46.87 C ATOM 350 O LEU A 699 -7.857 2.207 13.158 1.00 52.41 O ATOM 351 CB LEU A 699 -4.975 1.959 13.867 1.00 36.21 C ATOM 352 CG LEU A 699 -3.680 2.399 14.543 1.00 36.50 C ATOM 353 CD1 LEU A 699 -2.541 2.565 13.526 1.00 34.52 C ATOM 354 CD2 LEU A 699 -3.920 3.680 15.313 1.00 30.30 C ATOM 355 H LEU A 699 -5.195 -0.059 15.471 1.00 0.00 H ATOM 356 N LYS A 700 -7.869 0.106 13.998 1.00 45.97 N ATOM 357 CA LYS A 700 -9.058 -0.299 13.261 1.00 51.14 C ATOM 358 C LYS A 700 -10.217 0.648 13.580 1.00 52.33 C ATOM 359 O LYS A 700 -10.347 1.109 14.723 1.00 50.24 O ATOM 360 CB LYS A 700 -9.448 -1.743 13.604 1.00 48.94 C ATOM 361 CG LYS A 700 -8.571 -2.815 12.973 1.00 48.71 C ATOM 362 CD LYS A 700 -9.204 -4.212 13.096 1.00 56.60 C ATOM 363 CE LYS A 700 -8.170 -5.314 12.889 1.00 51.41 C ATOM 364 NZ LYS A 700 -7.069 -4.880 11.966 1.00 49.18 N ATOM 365 HZ1 LYS A 700 -7.472 -4.632 11.040 1.00 0.00 H ATOM 366 HZ2 LYS A 700 -6.587 -4.051 12.369 1.00 0.00 H ATOM 367 HZ3 LYS A 700 -6.387 -5.657 11.852 1.00 0.00 H ATOM 368 H LYS A 700 -7.384 -0.588 14.602 1.00 0.00 H ATOM 369 N PRO A 701 -11.063 0.979 12.595 1.00 53.03 N ATOM 370 CA PRO A 701 -10.920 0.458 11.231 1.00 52.42 C ATOM 371 C PRO A 701 -9.994 1.309 10.368 1.00 52.92 C ATOM 372 O PRO A 701 -9.574 2.399 10.772 1.00 49.32 O ATOM 373 CB PRO A 701 -12.345 0.504 10.703 1.00 45.33 C ATOM 374 CG PRO A 701 -12.916 1.732 11.373 1.00 47.31 C ATOM 375 CD PRO A 701 -12.245 1.849 12.729 1.00 46.47 C ATOM 376 N GLY A 702 -9.678 0.802 9.184 1.00 57.47 N ATOM 377 CA GLY A 702 -8.855 1.530 8.244 1.00 57.84 C ATOM 378 C GLY A 702 -7.411 1.094 8.151 1.00 57.72 C ATOM 379 O GLY A 702 -6.567 1.903 7.747 1.00 58.24 O ATOM 380 H GLY A 702 -10.031 -0.142 8.925 1.00 0.00 H ATOM 381 N VAL A 703 -7.092 -0.140 8.525 1.00 50.59 N ATOM 382 CA VAL A 703 -5.781 -0.717 8.262 1.00 56.77 C ATOM 383 C VAL A 703 -5.933 -1.620 7.050 1.00 48.01 C ATOM 384 O VAL A 703 -6.537 -2.693 7.145 1.00 56.61 O ATOM 385 CB VAL A 703 -5.240 -1.508 9.458 1.00 56.56 C ATOM 386 CG1 VAL A 703 -3.723 -1.615 9.346 1.00 56.75 C ATOM 387 CG2 VAL A 703 -5.685 -0.884 10.786 1.00 55.18 C ATOM 388 H VAL A 703 -7.803 -0.714 9.023 1.00 0.00 H ATOM 389 N LEU A 704 -5.384 -1.201 5.915 1.00 45.15 N ATOM 390 CA LEU A 704 -5.519 -1.953 4.675 1.00 46.84 C ATOM 391 C LEU A 704 -4.241 -2.727 4.385 1.00 42.25 C ATOM 392 O LEU A 704 -3.142 -2.268 4.700 1.00 41.36 O ATOM 393 CB LEU A 704 -5.840 -1.020 3.507 1.00 43.51 C ATOM 394 CG LEU A 704 -7.308 -0.674 3.242 1.00 39.81 C ATOM 395 CD1 LEU A 704 -8.059 -0.356 4.519 1.00 48.13 C ATOM 396 CD2 LEU A 704 -7.370 0.501 2.285 1.00 48.41 C ATOM 397 H LEU A 704 -4.844 -0.312 5.912 1.00 0.00 H ATOM 398 N ARG A 705 -4.398 -3.916 3.785 1.00 44.93 N ATOM 399 CA ARG A 705 -3.231 -4.713 3.410 1.00 43.44 C ATOM 400 C ARG A 705 -2.270 -3.905 2.553 1.00 38.49 C ATOM 401 O ARG A 705 -1.051 -3.986 2.730 1.00 37.52 O ATOM 402 CB ARG A 705 -3.653 -5.983 2.665 1.00 48.88 C ATOM 403 CG ARG A 705 -4.757 -6.776 3.329 1.00 50.71 C ATOM 404 CD ARG A 705 -5.061 -8.042 2.563 1.00 48.65 C ATOM 405 NE ARG A 705 -4.252 -9.155 3.039 1.00 63.00 N ATOM 406 CZ ARG A 705 -4.734 -10.196 3.711 1.00 63.10 C ATOM 407 NH1 ARG A 705 -6.036 -10.262 3.974 1.00 60.65 N ATOM 408 NH2 ARG A 705 -3.914 -11.168 4.115 1.00 59.43 N ATOM 409 HE ARG A 705 -3.231 -9.134 2.841 1.00 0.00 H ATOM 410 HH12 ARG A 705 -6.420 -11.073 4.499 1.00 0.00 H ATOM 411 HH11 ARG A 705 -6.670 -9.502 3.654 1.00 0.00 H ATOM 412 HH22 ARG A 705 -4.292 -11.982 4.641 1.00 0.00 H ATOM 413 HH21 ARG A 705 -2.897 -11.112 3.904 1.00 0.00 H ATOM 414 H ARG A 705 -5.354 -4.273 3.586 1.00 0.00 H ATOM 415 N THR A 706 -2.804 -3.099 1.630 1.00 40.01 N ATOM 416 CA THR A 706 -1.958 -2.303 0.743 1.00 38.28 C ATOM 417 C THR A 706 -1.191 -1.212 1.483 1.00 34.12 C ATOM 418 O THR A 706 -0.206 -0.699 0.945 1.00 33.49 O ATOM 419 CB THR A 706 -2.798 -1.686 -0.396 1.00 40.45 C ATOM 420 OG1 THR A 706 -3.816 -0.831 0.150 1.00 34.25 O ATOM 421 CG2 THR A 706 -3.458 -2.786 -1.253 1.00 30.80 C ATOM 422 HG1 THR A 706 -3.391 -0.105 0.671 1.00 0.00 H ATOM 423 H THR A 706 -3.838 -3.037 1.542 1.00 0.00 H ATOM 424 N ASP A 707 -1.614 -0.832 2.694 1.00 35.43 N ATOM 425 CA ASP A 707 -0.815 0.123 3.462 1.00 38.47 C ATOM 426 C ASP A 707 0.576 -0.438 3.729 1.00 33.44 C ATOM 427 O ASP A 707 1.574 0.288 3.650 1.00 34.80 O ATOM 428 CB ASP A 707 -1.508 0.481 4.782 1.00 40.18 C ATOM 429 CG ASP A 707 -2.881 1.119 4.578 1.00 43.81 C ATOM 430 OD1 ASP A 707 -3.032 1.917 3.635 1.00 40.05 O ATOM 431 OD2 ASP A 707 -3.812 0.815 5.357 1.00 46.47 O ATOM 432 H ASP A 707 -2.500 -1.211 3.085 1.00 0.00 H ATOM 433 N TYR A 708 0.666 -1.735 4.028 1.00 36.10 N ATOM 434 CA TYR A 708 1.975 -2.349 4.233 1.00 35.85 C ATOM 435 C TYR A 708 2.725 -2.511 2.914 1.00 34.97 C ATOM 436 O TYR A 708 3.912 -2.177 2.821 1.00 34.85 O ATOM 437 CB TYR A 708 1.825 -3.697 4.926 1.00 31.23 C ATOM 438 CG TYR A 708 1.224 -3.668 6.316 1.00 39.14 C ATOM 439 CD1 TYR A 708 1.970 -3.266 7.423 1.00 36.52 C ATOM 440 CD2 TYR A 708 -0.089 -4.070 6.523 1.00 41.33 C ATOM 441 CE1 TYR A 708 1.417 -3.268 8.694 1.00 36.66 C ATOM 442 CE2 TYR A 708 -0.652 -4.075 7.788 1.00 45.46 C ATOM 443 CZ TYR A 708 0.100 -3.674 8.869 1.00 42.12 C ATOM 444 OH TYR A 708 -0.483 -3.695 10.116 1.00 37.91 O ATOM 445 HH TYR A 708 0.171 -3.383 10.790 1.00 0.00 H ATOM 446 H TYR A 708 -0.197 -2.309 4.115 1.00 0.00 H ATOM 447 N SER A 709 2.054 -3.025 1.876 1.00 35.11 N ATOM 448 CA SER A 709 2.738 -3.216 0.598 1.00 29.83 C ATOM 449 C SER A 709 3.142 -1.886 -0.032 1.00 32.65 C ATOM 450 O SER A 709 4.170 -1.820 -0.723 1.00 32.76 O ATOM 451 CB SER A 709 1.870 -4.033 -0.360 1.00 29.04 C ATOM 452 OG SER A 709 0.690 -3.344 -0.733 1.00 31.07 O ATOM 453 HG SER A 709 0.933 -2.497 -1.184 1.00 0.00 H ATOM 454 H SER A 709 1.053 -3.287 1.978 1.00 0.00 H ATOM 455 N ASP A 710 2.379 -0.810 0.217 1.00 31.30 N ATOM 456 CA ASP A 710 2.781 0.497 -0.300 1.00 32.23 C ATOM 457 C ASP A 710 4.108 0.937 0.299 1.00 35.63 C ATOM 458 O ASP A 710 4.960 1.500 -0.402 1.00 35.28 O ATOM 459 CB ASP A 710 1.708 1.552 -0.018 1.00 39.42 C ATOM 460 CG ASP A 710 0.529 1.475 -0.981 1.00 39.28 C ATOM 461 OD1 ASP A 710 0.610 0.739 -1.993 1.00 42.16 O ATOM 462 OD2 ASP A 710 -0.493 2.137 -0.703 1.00 40.83 O ATOM 463 H ASP A 710 1.506 -0.906 0.775 1.00 0.00 H ATOM 464 N ILE A 711 4.299 0.700 1.598 1.00 35.34 N ATOM 465 CA ILE A 711 5.556 1.079 2.240 1.00 34.80 C ATOM 466 C ILE A 711 6.713 0.292 1.635 1.00 35.94 C ATOM 467 O ILE A 711 7.735 0.864 1.235 1.00 33.46 O ATOM 468 CB ILE A 711 5.458 0.881 3.767 1.00 35.10 C ATOM 469 CG1 ILE A 711 4.516 1.928 4.375 1.00 44.26 C ATOM 470 CG2 ILE A 711 6.826 0.959 4.404 1.00 33.63 C ATOM 471 CD1 ILE A 711 4.169 1.695 5.832 1.00 37.58 C ATOM 472 H ILE A 711 3.550 0.243 2.156 1.00 0.00 H ATOM 473 N LEU A 712 6.553 -1.034 1.529 1.00 32.75 N ATOM 474 CA LEU A 712 7.631 -1.876 1.022 1.00 28.41 C ATOM 475 C LEU A 712 7.974 -1.529 -0.415 1.00 30.08 C ATOM 476 O LEU A 712 9.146 -1.560 -0.810 1.00 30.94 O ATOM 477 CB LEU A 712 7.233 -3.348 1.114 1.00 31.71 C ATOM 478 CG LEU A 712 7.086 -3.861 2.541 1.00 41.16 C ATOM 479 CD1 LEU A 712 6.503 -5.274 2.544 1.00 37.22 C ATOM 480 CD2 LEU A 712 8.428 -3.796 3.295 1.00 36.33 C ATOM 481 H LEU A 712 5.651 -1.468 1.811 1.00 0.00 H ATOM 482 N ASN A 713 6.961 -1.233 -1.223 1.00 32.76 N ATOM 483 CA ASN A 713 7.211 -0.893 -2.619 1.00 33.86 C ATOM 484 C ASN A 713 8.024 0.389 -2.731 1.00 31.00 C ATOM 485 O ASN A 713 8.951 0.472 -3.543 1.00 35.79 O ATOM 486 CB ASN A 713 5.879 -0.791 -3.370 1.00 31.09 C ATOM 487 CG ASN A 713 5.336 -2.160 -3.778 1.00 34.38 C ATOM 488 OD1 ASN A 713 6.088 -3.013 -4.246 1.00 33.36 O ATOM 489 ND2 ASN A 713 4.031 -2.372 -3.605 1.00 32.76 N ATOM 490 HD22 ASN A 713 3.431 -1.622 -3.206 1.00 0.00 H ATOM 491 HD21 ASN A 713 3.613 -3.287 -3.870 1.00 0.00 H ATOM 492 H ASN A 713 5.987 -1.244 -0.859 1.00 0.00 H ATOM 493 N ASP A 714 7.734 1.377 -1.883 1.00 32.11 N ATOM 494 CA ASP A 714 8.493 2.625 -1.909 1.00 36.41 C ATOM 495 C ASP A 714 9.963 2.414 -1.537 1.00 39.20 C ATOM 496 O ASP A 714 10.851 3.073 -2.096 1.00 33.98 O ATOM 497 CB ASP A 714 7.854 3.647 -0.969 1.00 40.90 C ATOM 498 CG ASP A 714 6.550 4.201 -1.505 1.00 52.06 C ATOM 499 OD1 ASP A 714 6.231 3.949 -2.687 1.00 47.88 O ATOM 500 OD2 ASP A 714 5.836 4.888 -0.740 1.00 58.98 O ATOM 501 H ASP A 714 6.961 1.258 -1.198 1.00 0.00 H ATOM 502 N ILE A 715 10.244 1.524 -0.579 1.00 33.33 N ATOM 503 CA ILE A 715 11.613 1.336 -0.105 1.00 30.83 C ATOM 504 C ILE A 715 12.332 0.187 -0.802 1.00 33.03 C ATOM 505 O ILE A 715 13.520 -0.035 -0.530 1.00 33.86 O ATOM 506 CB ILE A 715 11.667 1.117 1.427 1.00 30.00 C ATOM 507 CG1 ILE A 715 10.876 -0.112 1.853 1.00 28.14 C ATOM 508 CG2 ILE A 715 11.161 2.317 2.167 1.00 34.21 C ATOM 509 CD1 ILE A 715 11.178 -0.551 3.281 1.00 31.45 C ATOM 510 H ILE A 715 9.476 0.957 -0.165 1.00 0.00 H ATOM 511 N TRP A 716 11.661 -0.545 -1.695 1.00 29.73 N ATOM 512 CA TRP A 716 12.203 -1.826 -2.142 1.00 28.49 C ATOM 513 C TRP A 716 13.609 -1.694 -2.726 1.00 31.89 C ATOM 514 O TRP A 716 14.504 -2.478 -2.386 1.00 31.73 O ATOM 515 CB TRP A 716 11.278 -2.485 -3.161 1.00 31.97 C ATOM 516 CG TRP A 716 11.826 -3.822 -3.522 1.00 34.05 C ATOM 517 CD1 TRP A 716 12.393 -4.198 -4.707 1.00 34.26 C ATOM 518 CD2 TRP A 716 11.927 -4.950 -2.652 1.00 29.11 C ATOM 519 NE1 TRP A 716 12.807 -5.516 -4.638 1.00 33.68 N ATOM 520 CE2 TRP A 716 12.537 -5.992 -3.382 1.00 32.13 C ATOM 521 CE3 TRP A 716 11.543 -5.188 -1.330 1.00 30.26 C ATOM 522 CZ2 TRP A 716 12.769 -7.248 -2.829 1.00 35.03 C ATOM 523 CZ3 TRP A 716 11.773 -6.432 -0.783 1.00 31.07 C ATOM 524 CH2 TRP A 716 12.376 -7.447 -1.529 1.00 33.34 C ATOM 525 HE1 TRP A 716 13.249 -6.055 -5.410 1.00 0.00 H ATOM 526 H TRP A 716 10.754 -0.204 -2.072 1.00 0.00 H ATOM 527 N ASN A 717 13.830 -0.720 -3.616 1.00 32.66 N ATOM 528 CA ASN A 717 15.105 -0.671 -4.329 1.00 33.89 C ATOM 529 C ASN A 717 16.252 -0.378 -3.368 1.00 29.58 C ATOM 530 O ASN A 717 17.281 -1.066 -3.379 1.00 29.01 O ATOM 531 CB ASN A 717 15.050 0.370 -5.455 1.00 35.77 C ATOM 532 CG ASN A 717 14.193 -0.081 -6.653 1.00 42.32 C ATOM 533 OD1 ASN A 717 13.063 0.378 -6.829 1.00 42.59 O ATOM 534 ND2 ASN A 717 14.744 -0.954 -7.487 1.00 36.54 N ATOM 535 HD22 ASN A 717 15.701 -1.317 -7.302 1.00 0.00 H ATOM 536 HD21 ASN A 717 14.219 -1.275 -8.325 1.00 0.00 H ATOM 537 H ASN A 717 13.100 -0.003 -3.799 1.00 0.00 H ATOM 538 N VAL A 718 16.078 0.635 -2.514 1.00 29.57 N ATOM 539 CA VAL A 718 17.104 0.976 -1.534 1.00 31.37 C ATOM 540 C VAL A 718 17.300 -0.167 -0.545 1.00 26.38 C ATOM 541 O VAL A 718 18.423 -0.442 -0.109 1.00 26.17 O ATOM 542 CB VAL A 718 16.733 2.288 -0.813 1.00 27.55 C ATOM 543 CG1 VAL A 718 17.814 2.700 0.159 1.00 29.33 C ATOM 544 CG2 VAL A 718 16.469 3.378 -1.811 1.00 36.57 C ATOM 545 H VAL A 718 15.198 1.189 -2.548 1.00 0.00 H ATOM 546 N LEU A 719 16.211 -0.844 -0.169 1.00 27.15 N ATOM 547 CA LEU A 719 16.323 -1.981 0.740 1.00 28.21 C ATOM 548 C LEU A 719 17.271 -3.034 0.175 1.00 29.21 C ATOM 549 O LEU A 719 18.158 -3.537 0.881 1.00 26.29 O ATOM 550 CB LEU A 719 14.934 -2.569 1.006 1.00 27.82 C ATOM 551 CG LEU A 719 14.732 -3.551 2.174 1.00 33.22 C ATOM 552 CD1 LEU A 719 15.038 -2.958 3.553 1.00 21.04 C ATOM 553 CD2 LEU A 719 13.327 -4.127 2.136 1.00 30.50 C ATOM 554 H LEU A 719 15.277 -0.559 -0.526 1.00 0.00 H ATOM 555 N VAL A 720 17.123 -3.354 -1.113 1.00 30.95 N ATOM 556 CA VAL A 720 18.016 -4.329 -1.742 1.00 27.42 C ATOM 557 C VAL A 720 19.421 -3.754 -1.868 1.00 27.65 C ATOM 558 O VAL A 720 20.406 -4.415 -1.526 1.00 30.26 O ATOM 559 CB VAL A 720 17.449 -4.769 -3.105 1.00 30.09 C ATOM 560 CG1 VAL A 720 18.482 -5.554 -3.883 1.00 29.16 C ATOM 561 CG2 VAL A 720 16.199 -5.591 -2.916 1.00 29.18 C ATOM 562 H VAL A 720 16.369 -2.908 -1.673 1.00 0.00 H ATOM 563 N GLU A 721 19.530 -2.493 -2.298 1.00 28.91 N ATOM 564 CA GLU A 721 20.838 -1.864 -2.484 1.00 27.02 C ATOM 565 C GLU A 721 21.671 -1.853 -1.201 1.00 30.55 C ATOM 566 O GLU A 721 22.874 -2.128 -1.241 1.00 31.87 O ATOM 567 CB GLU A 721 20.657 -0.434 -2.999 1.00 35.03 C ATOM 568 CG GLU A 721 20.327 -0.348 -4.480 1.00 42.07 C ATOM 569 CD GLU A 721 20.297 1.084 -4.993 1.00 59.37 C ATOM 570 OE1 GLU A 721 20.144 2.016 -4.167 1.00 52.91 O ATOM 571 OE2 GLU A 721 20.424 1.277 -6.223 1.00 63.67 O ATOM 572 H GLU A 721 18.668 -1.948 -2.504 1.00 0.00 H ATOM 573 N ARG A 722 21.064 -1.520 -0.052 1.00 24.95 N ATOM 574 CA ARG A 722 21.846 -1.440 1.179 1.00 26.26 C ATOM 575 C ARG A 722 22.461 -2.779 1.584 1.00 26.14 C ATOM 576 O ARG A 722 23.456 -2.795 2.317 1.00 27.53 O ATOM 577 CB ARG A 722 20.978 -0.881 2.303 1.00 31.63 C ATOM 578 CG ARG A 722 20.448 0.520 2.017 1.00 25.84 C ATOM 579 CD ARG A 722 21.581 1.509 1.851 1.00 30.96 C ATOM 580 NE ARG A 722 21.079 2.880 1.813 1.00 32.26 N ATOM 581 CZ ARG A 722 21.733 3.916 1.283 1.00 39.63 C ATOM 582 NH1 ARG A 722 22.935 3.757 0.738 1.00 35.91 N ATOM 583 NH2 ARG A 722 21.187 5.124 1.312 1.00 33.27 N ATOM 584 HE ARG A 722 20.144 3.062 2.229 1.00 0.00 H ATOM 585 HH12 ARG A 722 23.433 4.573 0.329 1.00 0.00 H ATOM 586 HH11 ARG A 722 23.378 2.816 0.721 1.00 0.00 H ATOM 587 HH22 ARG A 722 21.693 5.934 0.900 1.00 0.00 H ATOM 588 HH21 ARG A 722 20.252 5.262 1.747 1.00 0.00 H ATOM 589 H ARG A 722 20.043 -1.320 -0.038 1.00 0.00 H ATOM 590 N ASP A 723 21.897 -3.896 1.126 1.00 26.01 N ATOM 591 CA ASP A 723 22.484 -5.226 1.310 1.00 25.53 C ATOM 592 C ASP A 723 22.636 -5.594 2.785 1.00 25.23 C ATOM 593 O ASP A 723 23.673 -6.102 3.215 1.00 21.71 O ATOM 594 CB ASP A 723 23.826 -5.333 0.587 1.00 28.58 C ATOM 595 CG ASP A 723 24.255 -6.771 0.370 1.00 36.38 C ATOM 596 OD1 ASP A 723 23.387 -7.650 0.169 1.00 39.27 O ATOM 597 OD2 ASP A 723 25.467 -7.032 0.432 1.00 43.50 O ATOM 598 H ASP A 723 20.996 -3.820 0.613 1.00 0.00 H ATOM 599 N LEU A 724 21.599 -5.322 3.576 1.00 24.69 N ATOM 600 CA LEU A 724 21.573 -5.701 4.982 1.00 24.77 C ATOM 601 C LEU A 724 20.434 -6.656 5.288 1.00 22.54 C ATOM 602 O LEU A 724 20.265 -7.048 6.445 1.00 21.78 O ATOM 603 CB LEU A 724 21.448 -4.459 5.873 1.00 20.77 C ATOM 604 CG LEU A 724 22.596 -3.457 5.788 1.00 21.44 C ATOM 605 CD1 LEU A 724 22.258 -2.175 6.558 1.00 22.91 C ATOM 606 CD2 LEU A 724 23.887 -4.093 6.302 1.00 24.47 C ATOM 607 H LEU A 724 20.780 -4.822 3.176 1.00 0.00 H ATOM 608 N SER A 725 19.645 -7.027 4.290 1.00 21.22 N ATOM 609 CA SER A 725 18.443 -7.809 4.479 1.00 21.33 C ATOM 610 C SER A 725 18.601 -9.144 3.777 1.00 22.21 C ATOM 611 O SER A 725 19.493 -9.331 2.954 1.00 24.59 O ATOM 612 CB SER A 725 17.218 -7.054 3.963 1.00 19.10 C ATOM 613 OG SER A 725 17.092 -5.843 4.661 1.00 22.55 O ATOM 614 HG SER A 725 17.904 -5.295 4.518 1.00 0.00 H ATOM 615 H SER A 725 19.903 -6.742 3.324 1.00 0.00 H ATOM 616 N PHE A 726 17.721 -10.081 4.122 1.00 24.25 N ATOM 617 CA PHE A 726 17.847 -11.428 3.597 1.00 23.16 C ATOM 618 C PHE A 726 16.501 -12.133 3.688 1.00 24.90 C ATOM 619 O PHE A 726 15.593 -11.699 4.404 1.00 21.66 O ATOM 620 CB PHE A 726 18.951 -12.209 4.335 1.00 22.82 C ATOM 621 CG PHE A 726 18.711 -12.391 5.829 1.00 23.29 C ATOM 622 CD1 PHE A 726 17.843 -13.382 6.303 1.00 26.02 C ATOM 623 CD2 PHE A 726 19.376 -11.596 6.755 1.00 21.43 C ATOM 624 CE1 PHE A 726 17.625 -13.558 7.685 1.00 21.01 C ATOM 625 CE2 PHE A 726 19.171 -11.777 8.130 1.00 24.79 C ATOM 626 CZ PHE A 726 18.294 -12.763 8.590 1.00 20.45 C ATOM 627 H PHE A 726 16.941 -9.847 4.769 1.00 0.00 H ATOM 628 N VAL A 727 16.386 -13.219 2.922 1.00 22.86 N ATOM 629 CA VAL A 727 15.257 -14.135 2.988 1.00 23.82 C ATOM 630 C VAL A 727 15.759 -15.476 3.514 1.00 23.64 C ATOM 631 O VAL A 727 16.953 -15.774 3.502 1.00 23.55 O ATOM 632 CB VAL A 727 14.561 -14.304 1.616 1.00 24.71 C ATOM 633 CG1 VAL A 727 13.872 -13.017 1.220 1.00 23.95 C ATOM 634 CG2 VAL A 727 15.574 -14.696 0.546 1.00 22.87 C ATOM 635 H VAL A 727 17.145 -13.422 2.240 1.00 0.00 H ATOM 636 N VAL A 728 14.835 -16.298 3.988 1.00 19.73 N ATOM 637 CA VAL A 728 15.182 -17.631 4.464 1.00 23.93 C ATOM 638 C VAL A 728 14.488 -18.643 3.568 1.00 24.70 C ATOM 639 O VAL A 728 13.267 -18.582 3.389 1.00 24.91 O ATOM 640 CB VAL A 728 14.803 -17.843 5.937 1.00 22.66 C ATOM 641 CG1 VAL A 728 15.071 -19.296 6.344 1.00 24.45 C ATOM 642 CG2 VAL A 728 15.598 -16.886 6.787 1.00 19.30 C ATOM 643 H VAL A 728 13.843 -15.986 4.021 1.00 0.00 H ATOM 644 N TYR A 729 15.276 -19.541 2.983 1.00 24.97 N ATOM 645 CA TYR A 729 14.775 -20.649 2.187 1.00 32.97 C ATOM 646 C TYR A 729 14.634 -21.903 3.036 1.00 24.23 C ATOM 647 O TYR A 729 15.460 -22.174 3.910 1.00 26.86 O ATOM 648 CB TYR A 729 15.721 -20.930 1.018 1.00 25.95 C ATOM 649 CG TYR A 729 15.528 -19.975 -0.134 1.00 28.21 C ATOM 650 CD1 TYR A 729 14.603 -20.248 -1.140 1.00 33.02 C ATOM 651 CD2 TYR A 729 16.259 -18.804 -0.217 1.00 24.29 C ATOM 652 CE1 TYR A 729 14.416 -19.375 -2.196 1.00 32.65 C ATOM 653 CE2 TYR A 729 16.082 -17.928 -1.270 1.00 29.57 C ATOM 654 CZ TYR A 729 15.164 -18.219 -2.262 1.00 32.08 C ATOM 655 OH TYR A 729 14.981 -17.346 -3.312 1.00 29.66 O ATOM 656 HH TYR A 729 14.685 -16.468 -2.962 1.00 0.00 H ATOM 657 H TYR A 729 16.305 -19.445 3.101 1.00 0.00 H ATOM 658 N ASP A 730 13.575 -22.657 2.784 1.00 29.70 N ATOM 659 CA ASP A 730 13.530 -24.069 3.156 1.00 27.21 C ATOM 660 C ASP A 730 14.305 -24.826 2.079 1.00 32.61 C ATOM 661 O ASP A 730 13.852 -24.916 0.935 1.00 33.39 O ATOM 662 CB ASP A 730 12.073 -24.517 3.265 1.00 30.44 C ATOM 663 CG ASP A 730 11.901 -26.007 3.620 1.00 31.21 C ATOM 664 OD1 ASP A 730 12.849 -26.806 3.565 1.00 34.54 O ATOM 665 OD2 ASP A 730 10.768 -26.375 3.959 1.00 31.50 O ATOM 666 H ASP A 730 12.753 -22.233 2.308 1.00 0.00 H ATOM 667 N THR A 731 15.497 -25.335 2.421 1.00 33.91 N ATOM 668 CA THR A 731 16.329 -25.998 1.413 1.00 38.14 C ATOM 669 C THR A 731 15.777 -27.349 0.984 1.00 46.70 C ATOM 670 O THR A 731 16.350 -27.982 0.090 1.00 52.27 O ATOM 671 CB THR A 731 17.769 -26.181 1.907 1.00 33.93 C ATOM 672 OG1 THR A 731 17.794 -27.105 2.997 1.00 43.00 O ATOM 673 CG2 THR A 731 18.362 -24.846 2.364 1.00 30.19 C ATOM 674 HG1 THR A 731 17.437 -27.978 2.696 1.00 0.00 H ATOM 675 H THR A 731 15.832 -25.259 3.403 1.00 0.00 H ATOM 676 N ASN A 732 14.688 -27.807 1.592 1.00 44.25 N ATOM 677 CA ASN A 732 14.040 -29.035 1.158 1.00 49.25 C ATOM 678 C ASN A 732 12.960 -28.774 0.114 1.00 49.04 C ATOM 679 O ASN A 732 12.729 -29.623 -0.755 1.00 55.50 O ATOM 680 CB ASN A 732 13.449 -29.767 2.374 1.00 49.23 C ATOM 681 CG ASN A 732 12.945 -31.145 2.036 1.00 56.93 C ATOM 682 OD1 ASN A 732 11.861 -31.302 1.474 1.00 59.50 O ATOM 683 ND2 ASN A 732 13.725 -32.162 2.387 1.00 69.87 N ATOM 684 HD22 ASN A 732 14.633 -31.981 2.860 1.00 0.00 H ATOM 685 HD21 ASN A 732 13.427 -33.138 2.188 1.00 0.00 H ATOM 686 H ASN A 732 14.291 -27.277 2.394 1.00 0.00 H ATOM 687 N THR A 733 12.300 -27.616 0.168 1.00 44.71 N ATOM 688 CA THR A 733 11.311 -27.235 -0.828 1.00 41.06 C ATOM 689 C THR A 733 11.769 -26.076 -1.701 1.00 40.67 C ATOM 690 O THR A 733 11.044 -25.687 -2.622 1.00 40.50 O ATOM 691 CB THR A 733 9.986 -26.871 -0.148 1.00 40.77 C ATOM 692 OG1 THR A 733 10.024 -25.507 0.279 1.00 43.09 O ATOM 693 CG2 THR A 733 9.741 -27.763 1.052 1.00 45.22 C ATOM 694 HG1 THR A 733 10.163 -24.920 -0.506 1.00 0.00 H ATOM 695 H THR A 733 12.500 -26.962 0.951 1.00 0.00 H ATOM 696 N ASP A 734 12.947 -25.512 -1.426 1.00 45.32 N ATOM 697 CA ASP A 734 13.495 -24.362 -2.162 1.00 46.88 C ATOM 698 C ASP A 734 12.506 -23.190 -2.245 1.00 41.07 C ATOM 699 O ASP A 734 12.492 -22.433 -3.223 1.00 37.80 O ATOM 700 CB ASP A 734 13.980 -24.784 -3.556 1.00 41.04 C ATOM 701 CG ASP A 734 15.185 -25.728 -3.499 1.00 54.48 C ATOM 702 OD1 ASP A 734 16.016 -25.604 -2.565 1.00 54.70 O ATOM 703 OD2 ASP A 734 15.311 -26.595 -4.395 1.00 62.75 O ATOM 704 H ASP A 734 13.510 -25.908 -0.647 1.00 0.00 H ATOM 705 N ARG A 735 11.689 -23.000 -1.207 1.00 37.44 N ATOM 706 CA ARG A 735 10.778 -21.865 -1.147 1.00 38.42 C ATOM 707 C ARG A 735 11.084 -20.979 0.060 1.00 33.20 C ATOM 708 O ARG A 735 11.608 -21.447 1.078 1.00 30.18 O ATOM 709 CB ARG A 735 9.332 -22.343 -1.104 1.00 40.61 C ATOM 710 CG ARG A 735 8.929 -23.127 -2.350 1.00 41.80 C ATOM 711 CD ARG A 735 7.457 -23.512 -2.336 1.00 44.47 C ATOM 712 NE ARG A 735 7.137 -24.429 -3.433 1.00 49.95 N ATOM 713 CZ ARG A 735 6.061 -25.211 -3.480 1.00 48.61 C ATOM 714 NH1 ARG A 735 5.186 -25.204 -2.485 1.00 46.86 N ATOM 715 NH2 ARG A 735 5.863 -26.003 -4.527 1.00 50.48 N ATOM 716 HE ARG A 735 7.799 -24.472 -4.234 1.00 0.00 H ATOM 717 HH12 ARG A 735 4.347 -25.817 -2.526 1.00 0.00 H ATOM 718 HH11 ARG A 735 5.338 -24.586 -1.663 1.00 0.00 H ATOM 719 HH22 ARG A 735 5.023 -26.615 -4.565 1.00 0.00 H ATOM 720 HH21 ARG A 735 6.548 -26.012 -5.309 1.00 0.00 H ATOM 721 H ARG A 735 11.703 -23.680 -0.420 1.00 0.00 H ATOM 722 N ILE A 736 10.726 -19.697 -0.056 1.00 31.99 N ATOM 723 CA ILE A 736 11.002 -18.707 0.988 1.00 32.08 C ATOM 724 C ILE A 736 9.983 -18.853 2.113 1.00 25.97 C ATOM 725 O ILE A 736 8.769 -18.825 1.878 1.00 28.24 O ATOM 726 CB ILE A 736 10.979 -17.276 0.411 1.00 26.52 C ATOM 727 CG1 ILE A 736 12.118 -17.057 -0.588 1.00 30.59 C ATOM 728 CG2 ILE A 736 11.080 -16.222 1.530 1.00 20.42 C ATOM 729 CD1 ILE A 736 12.118 -15.660 -1.213 1.00 32.45 C ATOM 730 H ILE A 736 10.233 -19.391 -0.919 1.00 0.00 H ATOM 731 N ILE A 737 10.471 -18.972 3.347 1.00 23.57 N ATOM 732 CA ILE A 737 9.590 -19.085 4.505 1.00 21.97 C ATOM 733 C ILE A 737 9.744 -17.944 5.488 1.00 20.37 C ATOM 734 O ILE A 737 8.968 -17.877 6.454 1.00 21.85 O ATOM 735 CB ILE A 737 9.780 -20.425 5.244 1.00 23.45 C ATOM 736 CG1 ILE A 737 11.224 -20.565 5.739 1.00 25.24 C ATOM 737 CG2 ILE A 737 9.375 -21.583 4.356 1.00 24.11 C ATOM 738 CD1 ILE A 737 11.411 -21.713 6.750 1.00 24.08 C ATOM 739 H ILE A 737 11.501 -18.985 3.488 1.00 0.00 H ATOM 740 N GLY A 738 10.707 -17.055 5.298 1.00 25.47 N ATOM 741 CA GLY A 738 10.924 -15.990 6.263 1.00 21.13 C ATOM 742 C GLY A 738 11.788 -14.903 5.667 1.00 19.72 C ATOM 743 O GLY A 738 12.438 -15.085 4.637 1.00 20.76 O ATOM 744 H GLY A 738 11.311 -17.119 4.454 1.00 0.00 H ATOM 745 N THR A 739 11.781 -13.748 6.329 1.00 20.86 N ATOM 746 CA THR A 739 12.565 -12.639 5.821 1.00 23.77 C ATOM 747 C THR A 739 12.863 -11.670 6.954 1.00 20.97 C ATOM 748 O THR A 739 12.029 -11.452 7.834 1.00 24.29 O ATOM 749 CB THR A 739 11.841 -11.922 4.664 1.00 23.13 C ATOM 750 OG1 THR A 739 12.691 -10.904 4.132 1.00 25.45 O ATOM 751 CG2 THR A 739 10.524 -11.293 5.137 1.00 22.62 C ATOM 752 HG1 THR A 739 13.526 -11.316 3.796 1.00 0.00 H ATOM 753 H THR A 739 11.221 -13.643 7.199 1.00 0.00 H ATOM 754 N ALA A 740 14.059 -11.098 6.921 1.00 22.60 N ATOM 755 CA ALA A 740 14.491 -10.096 7.887 1.00 25.43 C ATOM 756 C ALA A 740 14.884 -8.833 7.134 1.00 20.86 C ATOM 757 O ALA A 740 15.836 -8.850 6.346 1.00 22.82 O ATOM 758 CB ALA A 740 15.667 -10.616 8.715 1.00 21.83 C ATOM 759 H ALA A 740 14.721 -11.378 6.169 1.00 0.00 H ATOM 760 N LEU A 741 14.174 -7.740 7.387 1.00 19.81 N ATOM 761 CA LEU A 741 14.434 -6.466 6.719 1.00 22.85 C ATOM 762 C LEU A 741 15.186 -5.527 7.660 1.00 23.40 C ATOM 763 O LEU A 741 14.671 -5.163 8.722 1.00 22.27 O ATOM 764 CB LEU A 741 13.129 -5.827 6.256 1.00 22.01 C ATOM 765 CG LEU A 741 12.257 -6.749 5.398 1.00 24.77 C ATOM 766 CD1 LEU A 741 11.057 -5.995 4.884 1.00 24.70 C ATOM 767 CD2 LEU A 741 13.064 -7.367 4.247 1.00 23.59 C ATOM 768 H LEU A 741 13.405 -7.792 8.086 1.00 0.00 H ATOM 769 N ASN A 742 16.392 -5.120 7.261 1.00 20.53 N ATOM 770 CA ASN A 742 17.246 -4.302 8.107 1.00 21.25 C ATOM 771 C ASN A 742 17.724 -3.071 7.358 1.00 21.07 C ATOM 772 O ASN A 742 17.921 -3.105 6.142 1.00 23.53 O ATOM 773 CB ASN A 742 18.463 -5.089 8.585 1.00 18.91 C ATOM 774 CG ASN A 742 18.080 -6.411 9.173 1.00 22.50 C ATOM 775 OD1 ASN A 742 17.312 -6.449 10.124 1.00 23.74 O ATOM 776 ND2 ASN A 742 18.561 -7.507 8.586 1.00 21.23 N ATOM 777 HD22 ASN A 742 19.212 -7.422 7.779 1.00 0.00 H ATOM 778 HD21 ASN A 742 18.285 -8.447 8.935 1.00 0.00 H ATOM 779 H ASN A 742 16.731 -5.396 6.317 1.00 0.00 H ATOM 780 N PHE A 743 17.961 -2.003 8.112 1.00 21.37 N ATOM 781 CA PHE A 743 18.656 -0.811 7.638 1.00 22.59 C ATOM 782 C PHE A 743 19.684 -0.378 8.679 1.00 23.85 C ATOM 783 O PHE A 743 19.586 -0.721 9.859 1.00 20.21 O ATOM 784 CB PHE A 743 17.697 0.356 7.420 1.00 23.81 C ATOM 785 CG PHE A 743 16.954 0.334 6.112 1.00 25.33 C ATOM 786 CD1 PHE A 743 17.630 0.491 4.911 1.00 25.50 C ATOM 787 CD2 PHE A 743 15.568 0.234 6.096 1.00 24.07 C ATOM 788 CE1 PHE A 743 16.953 0.500 3.724 1.00 23.39 C ATOM 789 CE2 PHE A 743 14.879 0.257 4.913 1.00 28.67 C ATOM 790 CZ PHE A 743 15.567 0.379 3.719 1.00 28.23 C ATOM 791 H PHE A 743 17.632 -2.018 9.098 1.00 0.00 H ATOM 792 N ASP A 744 20.682 0.372 8.231 1.00 22.72 N ATOM 793 CA ASP A 744 21.429 1.238 9.136 1.00 23.67 C ATOM 794 C ASP A 744 20.455 2.232 9.753 1.00 25.37 C ATOM 795 O ASP A 744 19.741 2.937 9.033 1.00 24.19 O ATOM 796 CB ASP A 744 22.547 1.961 8.371 1.00 23.65 C ATOM 797 CG ASP A 744 23.428 2.854 9.261 1.00 27.52 C ATOM 798 OD1 ASP A 744 22.982 3.366 10.313 1.00 27.19 O ATOM 799 OD2 ASP A 744 24.600 3.074 8.882 1.00 27.59 O ATOM 800 H ASP A 744 20.935 0.342 7.223 1.00 0.00 H ATOM 801 N ALA A 745 20.416 2.269 11.089 1.00 25.54 N ATOM 802 CA ALA A 745 19.481 3.137 11.797 1.00 26.08 C ATOM 803 C ALA A 745 19.685 4.613 11.461 1.00 25.21 C ATOM 804 O ALA A 745 18.730 5.393 11.517 1.00 26.82 O ATOM 805 CB ALA A 745 19.613 2.924 13.304 1.00 22.51 C ATOM 806 H ALA A 745 21.065 1.667 11.635 1.00 0.00 H ATOM 807 N ARG A 746 20.904 5.017 11.127 1.00 23.94 N ATOM 808 CA ARG A 746 21.201 6.406 10.803 1.00 30.72 C ATOM 809 C ARG A 746 21.218 6.662 9.304 1.00 31.39 C ATOM 810 O ARG A 746 21.689 7.715 8.872 1.00 32.57 O ATOM 811 CB ARG A 746 22.543 6.820 11.424 1.00 24.64 C ATOM 812 CG ARG A 746 22.627 6.549 12.931 1.00 29.73 C ATOM 813 CD ARG A 746 23.768 7.319 13.568 1.00 30.50 C ATOM 814 NE ARG A 746 23.871 7.074 14.997 1.00 28.41 N ATOM 815 CZ ARG A 746 23.057 7.598 15.902 1.00 28.38 C ATOM 816 NH1 ARG A 746 23.241 7.328 17.188 1.00 27.09 N ATOM 817 NH2 ARG A 746 22.060 8.387 15.521 1.00 26.99 N ATOM 818 HE ARG A 746 24.632 6.448 15.330 1.00 0.00 H ATOM 819 HH12 ARG A 746 22.605 7.737 17.901 1.00 0.00 H ATOM 820 HH11 ARG A 746 24.022 6.707 17.482 1.00 0.00 H ATOM 821 HH22 ARG A 746 21.421 8.798 16.232 1.00 0.00 H ATOM 822 HH21 ARG A 746 21.917 8.594 14.512 1.00 0.00 H ATOM 823 H ARG A 746 21.674 4.318 11.095 1.00 0.00 H ATOM 824 N ASN A 747 20.713 5.725 8.506 1.00 32.68 N ATOM 825 CA ASN A 747 20.750 5.840 7.053 1.00 30.24 C ATOM 826 C ASN A 747 19.555 5.105 6.460 1.00 29.75 C ATOM 827 O ASN A 747 19.686 4.270 5.568 1.00 32.44 O ATOM 828 CB ASN A 747 22.067 5.304 6.493 1.00 30.88 C ATOM 829 CG ASN A 747 22.267 5.673 5.024 1.00 35.82 C ATOM 830 OD1 ASN A 747 21.767 6.693 4.561 1.00 31.25 O ATOM 831 ND2 ASN A 747 22.987 4.835 4.289 1.00 35.46 N ATOM 832 HD22 ASN A 747 23.393 3.981 4.722 1.00 0.00 H ATOM 833 HD21 ASN A 747 23.145 5.032 3.280 1.00 0.00 H ATOM 834 H ASN A 747 20.277 4.883 8.933 1.00 0.00 H ATOM 835 N GLU A 748 18.372 5.411 6.961 1.00 30.46 N ATOM 836 CA GLU A 748 17.100 4.822 6.583 1.00 32.69 C ATOM 837 C GLU A 748 16.346 5.739 5.645 1.00 40.53 C ATOM 838 O GLU A 748 16.362 6.959 5.831 1.00 46.76 O ATOM 839 CB GLU A 748 16.223 4.581 7.808 1.00 34.18 C ATOM 840 CG GLU A 748 16.502 3.298 8.496 1.00 37.02 C ATOM 841 CD GLU A 748 15.542 3.024 9.616 1.00 35.38 C ATOM 842 OE1 GLU A 748 14.701 3.897 9.912 1.00 40.03 O ATOM 843 OE2 GLU A 748 15.642 1.933 10.203 1.00 33.07 O ATOM 844 H GLU A 748 18.349 6.145 7.698 1.00 0.00 H ATOM 845 N PRO A 749 15.657 5.173 4.661 1.00 37.90 N ATOM 846 CA PRO A 749 14.719 5.982 3.879 1.00 47.79 C ATOM 847 C PRO A 749 13.593 6.473 4.767 1.00 50.63 C ATOM 848 O PRO A 749 13.183 5.813 5.727 1.00 51.55 O ATOM 849 CB PRO A 749 14.206 5.007 2.812 1.00 45.85 C ATOM 850 CG PRO A 749 14.354 3.650 3.454 1.00 35.08 C ATOM 851 CD PRO A 749 15.615 3.750 4.280 1.00 32.27 C ATOM 852 N GLU A 750 13.102 7.656 4.452 1.00 58.97 N ATOM 853 CA GLU A 750 11.880 8.148 5.062 1.00 67.66 C ATOM 854 C GLU A 750 10.837 8.220 3.961 1.00 65.83 C ATOM 855 O GLU A 750 11.046 8.888 2.942 1.00 65.16 O ATOM 856 CB GLU A 750 12.072 9.508 5.737 1.00 67.54 C ATOM 857 CG GLU A 750 11.032 9.800 6.814 1.00 69.34 C ATOM 858 CD GLU A 750 10.537 8.536 7.514 1.00 74.40 C ATOM 859 OE1 GLU A 750 9.452 8.027 7.140 1.00 67.20 O ATOM 860 OE2 GLU A 750 11.236 8.053 8.437 1.00 79.27 O ATOM 861 H GLU A 750 13.599 8.246 3.755 1.00 0.00 H ATOM 862 N VAL A 751 9.748 7.493 4.146 1.00 59.83 N ATOM 863 CA VAL A 751 8.623 7.529 3.234 1.00 62.72 C ATOM 864 C VAL A 751 7.532 8.356 3.883 1.00 65.90 C ATOM 865 O VAL A 751 7.218 8.168 5.067 1.00 61.79 O ATOM 866 CB VAL A 751 8.115 6.117 2.909 1.00 64.24 C ATOM 867 CG1 VAL A 751 7.309 6.129 1.622 1.00 64.93 C ATOM 868 CG2 VAL A 751 9.269 5.161 2.827 1.00 56.30 C ATOM 869 H VAL A 751 9.697 6.871 4.978 1.00 0.00 H ATOM 870 N ASP A 752 6.972 9.292 3.125 1.00 67.37 N ATOM 871 CA ASP A 752 5.711 9.885 3.537 1.00 65.28 C ATOM 872 C ASP A 752 4.651 8.795 3.468 1.00 59.83 C ATOM 873 O ASP A 752 4.487 8.139 2.431 1.00 56.99 O ATOM 874 CB ASP A 752 5.349 11.081 2.656 1.00 66.97 C ATOM 875 CG ASP A 752 4.874 10.671 1.275 1.00 72.91 C ATOM 876 OD1 ASP A 752 5.728 10.268 0.455 1.00 73.56 O ATOM 877 OD2 ASP A 752 3.645 10.728 1.025 1.00 69.81 O ATOM 878 H ASP A 752 7.432 9.598 2.244 1.00 0.00 H ATOM 879 N ILE A 753 3.972 8.558 4.581 1.00 56.07 N ATOM 880 CA ILE A 753 3.021 7.462 4.685 1.00 56.68 C ATOM 881 C ILE A 753 1.623 8.058 4.755 1.00 55.38 C ATOM 882 O ILE A 753 1.226 8.635 5.774 1.00 60.43 O ATOM 883 CB ILE A 753 3.322 6.567 5.892 1.00 51.72 C ATOM 884 CG1 ILE A 753 4.704 5.915 5.697 1.00 55.13 C ATOM 885 CG2 ILE A 753 2.201 5.541 6.062 1.00 44.54 C ATOM 886 CD1 ILE A 753 5.491 5.651 6.972 1.00 45.37 C ATOM 887 H ILE A 753 4.124 9.174 5.405 1.00 0.00 H ATOM 888 N LYS A 754 0.871 7.916 3.674 1.00 57.94 N ATOM 889 CA LYS A 754 -0.475 8.466 3.623 1.00 59.42 C ATOM 890 C LYS A 754 -1.486 7.623 4.382 1.00 61.36 C ATOM 891 O LYS A 754 -2.678 7.952 4.359 1.00 70.99 O ATOM 892 CB LYS A 754 -0.925 8.626 2.164 1.00 64.06 C ATOM 893 CG LYS A 754 -1.235 7.311 1.454 1.00 67.35 C ATOM 894 CD LYS A 754 -2.682 7.252 0.969 1.00 59.85 C ATOM 895 CE LYS A 754 -2.929 5.999 0.143 1.00 59.32 C ATOM 896 NZ LYS A 754 -4.371 5.792 -0.165 1.00 58.97 N ATOM 897 HZ1 LYS A 754 -4.904 5.700 0.723 1.00 0.00 H ATOM 898 HZ2 LYS A 754 -4.730 6.606 -0.703 1.00 0.00 H ATOM 899 HZ3 LYS A 754 -4.483 4.925 -0.729 1.00 0.00 H ATOM 900 H LYS A 754 1.248 7.404 2.851 1.00 0.00 H ATOM 901 N SER A 755 -1.055 6.560 5.050 1.00 56.37 N ATOM 902 CA SER A 755 -1.970 5.649 5.717 1.00 51.58 C ATOM 903 C SER A 755 -1.892 5.827 7.226 1.00 53.13 C ATOM 904 O SER A 755 -1.061 6.576 7.756 1.00 48.29 O ATOM 905 CB SER A 755 -1.666 4.196 5.345 1.00 54.09 C ATOM 906 OG SER A 755 -0.613 3.678 6.140 1.00 54.70 O ATOM 907 HG SER A 755 -0.436 2.739 5.880 1.00 0.00 H ATOM 908 H SER A 755 -0.033 6.374 5.097 1.00 0.00 H ATOM 909 N LYS A 756 -2.781 5.115 7.920 1.00 48.09 N ATOM 910 CA LYS A 756 -2.794 5.182 9.372 1.00 48.74 C ATOM 911 C LYS A 756 -1.581 4.512 9.992 1.00 48.27 C ATOM 912 O LYS A 756 -1.394 4.619 11.209 1.00 46.60 O ATOM 913 CB LYS A 756 -4.083 4.567 9.926 1.00 49.77 C ATOM 914 CG LYS A 756 -5.008 5.591 10.580 1.00 56.85 C ATOM 915 CD LYS A 756 -5.220 6.811 9.671 1.00 58.29 C ATOM 916 CE LYS A 756 -5.615 8.056 10.462 1.00 62.44 C ATOM 917 NZ LYS A 756 -5.845 9.225 9.574 1.00 64.22 N ATOM 918 HZ1 LYS A 756 -4.973 9.435 9.047 1.00 0.00 H ATOM 919 HZ2 LYS A 756 -6.611 9.006 8.906 1.00 0.00 H ATOM 920 HZ3 LYS A 756 -6.111 10.049 10.150 1.00 0.00 H ATOM 921 H LYS A 756 -3.466 4.511 7.422 1.00 0.00 H ATOM 922 N LEU A 757 -0.748 3.843 9.187 1.00 41.89 N ATOM 923 CA LEU A 757 0.516 3.326 9.686 1.00 37.09 C ATOM 924 C LEU A 757 1.463 4.441 10.111 1.00 33.53 C ATOM 925 O LEU A 757 2.409 4.178 10.862 1.00 33.04 O ATOM 926 CB LEU A 757 1.190 2.451 8.621 1.00 36.44 C ATOM 927 CG LEU A 757 0.478 1.133 8.296 1.00 39.71 C ATOM 928 CD1 LEU A 757 1.344 0.243 7.427 1.00 35.49 C ATOM 929 CD2 LEU A 757 0.094 0.427 9.573 1.00 38.73 C ATOM 930 H LEU A 757 -1.008 3.691 8.192 1.00 0.00 H ATOM 931 N LEU A 758 1.237 5.677 9.656 1.00 36.79 N ATOM 932 CA LEU A 758 2.116 6.774 10.055 1.00 32.54 C ATOM 933 C LEU A 758 2.132 6.952 11.566 1.00 26.95 C ATOM 934 O LEU A 758 3.161 7.309 12.138 1.00 32.15 O ATOM 935 CB LEU A 758 1.690 8.076 9.381 1.00 34.85 C ATOM 936 CG LEU A 758 2.494 9.315 9.784 1.00 37.04 C ATOM 937 CD1 LEU A 758 3.955 9.098 9.438 1.00 37.97 C ATOM 938 CD2 LEU A 758 1.959 10.581 9.106 1.00 42.72 C ATOM 939 H LEU A 758 0.436 5.858 9.018 1.00 0.00 H ATOM 940 N ILE A 759 1.008 6.710 12.229 1.00 30.43 N ATOM 941 CA ILE A 759 0.983 6.837 13.682 1.00 31.59 C ATOM 942 C ILE A 759 1.845 5.759 14.329 1.00 26.74 C ATOM 943 O ILE A 759 2.487 5.993 15.360 1.00 25.80 O ATOM 944 CB ILE A 759 -0.472 6.799 14.188 1.00 33.12 C ATOM 945 CG1 ILE A 759 -1.247 8.003 13.633 1.00 40.79 C ATOM 946 CG2 ILE A 759 -0.522 6.773 15.720 1.00 34.57 C ATOM 947 CD1 ILE A 759 -2.682 8.113 14.143 1.00 36.92 C ATOM 948 H ILE A 759 0.148 6.431 11.715 1.00 0.00 H ATOM 949 N VAL A 760 1.873 4.561 13.742 1.00 27.39 N ATOM 950 CA VAL A 760 2.724 3.493 14.272 1.00 24.00 C ATOM 951 C VAL A 760 4.191 3.892 14.177 1.00 23.11 C ATOM 952 O VAL A 760 4.952 3.754 15.144 1.00 21.85 O ATOM 953 CB VAL A 760 2.451 2.162 13.547 1.00 23.48 C ATOM 954 CG1 VAL A 760 3.537 1.164 13.856 1.00 30.04 C ATOM 955 CG2 VAL A 760 1.112 1.601 13.976 1.00 30.59 C ATOM 956 H VAL A 760 1.286 4.384 12.902 1.00 0.00 H ATOM 957 N PHE A 761 4.603 4.417 13.019 1.00 20.99 N ATOM 958 CA PHE A 761 6.001 4.806 12.852 1.00 21.62 C ATOM 959 C PHE A 761 6.362 5.998 13.726 1.00 20.59 C ATOM 960 O PHE A 761 7.472 6.059 14.261 1.00 23.07 O ATOM 961 CB PHE A 761 6.299 5.103 11.387 1.00 24.27 C ATOM 962 CG PHE A 761 6.367 3.866 10.541 1.00 29.02 C ATOM 963 CD1 PHE A 761 7.562 3.191 10.377 1.00 30.41 C ATOM 964 CD2 PHE A 761 5.223 3.348 9.946 1.00 30.52 C ATOM 965 CE1 PHE A 761 7.624 2.034 9.608 1.00 40.59 C ATOM 966 CE2 PHE A 761 5.276 2.186 9.177 1.00 35.21 C ATOM 967 CZ PHE A 761 6.480 1.534 9.004 1.00 38.96 C ATOM 968 H PHE A 761 3.929 4.548 12.238 1.00 0.00 H ATOM 969 N GLU A 762 5.437 6.947 13.890 1.00 16.67 N ATOM 970 CA GLU A 762 5.690 8.064 14.795 1.00 21.68 C ATOM 971 C GLU A 762 5.817 7.578 16.235 1.00 19.88 C ATOM 972 O GLU A 762 6.674 8.058 16.985 1.00 21.43 O ATOM 973 CB GLU A 762 4.573 9.099 14.667 1.00 21.76 C ATOM 974 CG GLU A 762 4.792 10.138 13.568 1.00 33.17 C ATOM 975 CD GLU A 762 3.599 11.078 13.372 1.00 34.06 C ATOM 976 OE1 GLU A 762 2.734 11.170 14.268 1.00 38.19 O ATOM 977 OE2 GLU A 762 3.541 11.747 12.323 1.00 41.71 O ATOM 978 H GLU A 762 4.536 6.890 13.373 1.00 0.00 H ATOM 979 N PHE A 763 4.965 6.626 16.640 1.00 19.87 N ATOM 980 CA PHE A 763 5.105 6.022 17.962 1.00 19.23 C ATOM 981 C PHE A 763 6.440 5.309 18.105 1.00 20.77 C ATOM 982 O PHE A 763 7.096 5.419 19.145 1.00 20.20 O ATOM 983 CB PHE A 763 3.969 5.042 18.244 1.00 22.45 C ATOM 984 CG PHE A 763 4.161 4.248 19.535 1.00 23.05 C ATOM 985 CD1 PHE A 763 4.366 4.905 20.739 1.00 19.46 C ATOM 986 CD2 PHE A 763 4.160 2.863 19.526 1.00 22.46 C ATOM 987 CE1 PHE A 763 4.548 4.204 21.920 1.00 23.41 C ATOM 988 CE2 PHE A 763 4.348 2.148 20.695 1.00 20.81 C ATOM 989 CZ PHE A 763 4.536 2.818 21.898 1.00 20.71 C ATOM 990 H PHE A 763 4.199 6.315 16.009 1.00 0.00 H ATOM 991 N LEU A 764 6.864 4.569 17.072 1.00 21.23 N ATOM 992 CA LEU A 764 8.131 3.855 17.177 1.00 22.19 C ATOM 993 C LEU A 764 9.296 4.834 17.289 1.00 21.21 C ATOM 994 O LEU A 764 10.234 4.610 18.070 1.00 21.51 O ATOM 995 CB LEU A 764 8.315 2.910 15.982 1.00 21.48 C ATOM 996 CG LEU A 764 7.349 1.711 15.924 1.00 25.46 C ATOM 997 CD1 LEU A 764 7.556 0.867 14.663 1.00 25.94 C ATOM 998 CD2 LEU A 764 7.488 0.844 17.147 1.00 19.82 C ATOM 999 H LEU A 764 6.295 4.504 16.204 1.00 0.00 H ATOM 1000 N GLU A 765 9.246 5.933 16.526 1.00 18.60 N ATOM 1001 CA GLU A 765 10.278 6.964 16.642 1.00 21.20 C ATOM 1002 C GLU A 765 10.233 7.620 18.016 1.00 21.18 C ATOM 1003 O GLU A 765 11.279 7.947 18.585 1.00 19.99 O ATOM 1004 CB GLU A 765 10.120 8.005 15.525 1.00 22.17 C ATOM 1005 CG GLU A 765 11.123 9.176 15.549 1.00 19.67 C ATOM 1006 CD GLU A 765 12.572 8.727 15.387 1.00 25.56 C ATOM 1007 OE1 GLU A 765 13.471 9.509 15.762 1.00 21.94 O ATOM 1008 OE2 GLU A 765 12.821 7.591 14.913 1.00 21.62 O ATOM 1009 H GLU A 765 8.468 6.055 15.846 1.00 0.00 H ATOM 1010 N PHE A 766 9.032 7.792 18.576 1.00 21.28 N ATOM 1011 CA PHE A 766 8.913 8.290 19.940 1.00 18.10 C ATOM 1012 C PHE A 766 9.663 7.378 20.909 1.00 23.90 C ATOM 1013 O PHE A 766 10.387 7.861 21.793 1.00 16.20 O ATOM 1014 CB PHE A 766 7.423 8.439 20.284 1.00 20.02 C ATOM 1015 CG PHE A 766 7.113 8.512 21.762 1.00 23.16 C ATOM 1016 CD1 PHE A 766 6.943 7.346 22.513 1.00 23.24 C ATOM 1017 CD2 PHE A 766 6.924 9.742 22.385 1.00 19.12 C ATOM 1018 CE1 PHE A 766 6.639 7.408 23.872 1.00 22.48 C ATOM 1019 CE2 PHE A 766 6.621 9.808 23.728 1.00 20.39 C ATOM 1020 CZ PHE A 766 6.472 8.648 24.474 1.00 25.41 C ATOM 1021 H PHE A 766 8.174 7.568 18.033 1.00 0.00 H ATOM 1022 N CYS A 767 9.566 6.053 20.707 1.00 16.60 N ATOM 1023 CA CYS A 767 10.305 5.117 21.551 1.00 16.51 C ATOM 1024 C CYS A 767 11.789 5.117 21.232 1.00 18.32 C ATOM 1025 O CYS A 767 12.625 5.066 22.143 1.00 20.10 O ATOM 1026 CB CYS A 767 9.765 3.692 21.381 1.00 14.43 C ATOM 1027 SG CYS A 767 8.062 3.506 21.888 1.00 21.60 S ATOM 1028 H CYS A 767 8.960 5.691 19.943 1.00 0.00 H ATOM 1029 N GLU A 768 12.120 5.066 19.953 1.00 16.67 N ATOM 1030 CA GLU A 768 13.506 4.926 19.533 1.00 19.61 C ATOM 1031 C GLU A 768 14.388 6.165 19.455 1.00 20.24 C ATOM 1032 O GLU A 768 15.530 6.140 19.885 1.00 21.59 O ATOM 1033 CB GLU A 768 13.561 4.199 18.178 1.00 20.75 C ATOM 1034 CG GLU A 768 12.929 2.815 18.168 1.00 20.02 C ATOM 1035 CD GLU A 768 12.814 2.215 16.777 1.00 22.50 C ATOM 1036 OE1 GLU A 768 12.935 2.954 15.788 1.00 27.70 O ATOM 1037 OE2 GLU A 768 12.597 0.995 16.669 1.00 26.76 O ATOM 1038 H GLU A 768 11.373 5.127 19.231 1.00 0.00 H ATOM 1039 N GLY A 769 13.840 7.246 18.935 1.00 17.52 N ATOM 1040 CA GLY A 769 14.616 8.443 18.669 1.00 19.47 C ATOM 1041 C GLY A 769 15.439 8.964 19.834 1.00 20.59 C ATOM 1042 O GLY A 769 16.655 9.159 19.712 1.00 22.69 O ATOM 1043 H GLY A 769 12.825 7.240 18.710 1.00 0.00 H ATOM 1044 N PRO A 770 14.797 9.233 20.982 1.00 20.50 N ATOM 1045 CA PRO A 770 15.567 9.720 22.143 1.00 23.92 C ATOM 1046 C PRO A 770 16.693 8.791 22.575 1.00 24.84 C ATOM 1047 O PRO A 770 17.775 9.263 22.944 1.00 23.25 O ATOM 1048 CB PRO A 770 14.487 9.867 23.228 1.00 24.59 C ATOM 1049 CG PRO A 770 13.249 10.258 22.416 1.00 21.58 C ATOM 1050 CD PRO A 770 13.344 9.426 21.167 1.00 21.38 C ATOM 1051 N ILE A 771 16.467 7.477 22.527 1.00 24.21 N ATOM 1052 CA ILE A 771 17.486 6.514 22.926 1.00 22.37 C ATOM 1053 C ILE A 771 18.592 6.436 21.876 1.00 22.05 C ATOM 1054 O ILE A 771 19.785 6.500 22.200 1.00 20.03 O ATOM 1055 CB ILE A 771 16.832 5.140 23.158 1.00 25.80 C ATOM 1056 CG1 ILE A 771 15.808 5.226 24.297 1.00 27.91 C ATOM 1057 CG2 ILE A 771 17.882 4.088 23.377 1.00 22.52 C ATOM 1058 CD1 ILE A 771 15.101 3.903 24.607 1.00 25.93 C ATOM 1059 H ILE A 771 15.543 7.132 22.197 1.00 0.00 H ATOM 1060 N ARG A 772 18.199 6.298 20.602 1.00 19.41 N ATOM 1061 CA ARG A 772 19.145 6.173 19.497 1.00 20.61 C ATOM 1062 C ARG A 772 20.107 7.359 19.422 1.00 24.00 C ATOM 1063 O ARG A 772 21.328 7.178 19.282 1.00 21.96 O ATOM 1064 CB ARG A 772 18.376 6.041 18.180 1.00 22.71 C ATOM 1065 CG ARG A 772 19.268 5.945 16.944 1.00 22.51 C ATOM 1066 CD ARG A 772 18.460 6.166 15.682 1.00 26.94 C ATOM 1067 NE ARG A 772 17.890 7.509 15.649 1.00 25.79 N ATOM 1068 CZ ARG A 772 16.597 7.785 15.503 1.00 24.16 C ATOM 1069 NH1 ARG A 772 15.710 6.805 15.364 1.00 23.49 N ATOM 1070 NH2 ARG A 772 16.197 9.048 15.482 1.00 17.87 N ATOM 1071 HE ARG A 772 18.544 8.311 15.747 1.00 0.00 H ATOM 1072 HH12 ARG A 772 14.701 7.029 15.250 1.00 0.00 H ATOM 1073 HH11 ARG A 772 16.025 5.814 15.369 1.00 0.00 H ATOM 1074 HH22 ARG A 772 15.188 9.272 15.368 1.00 0.00 H ATOM 1075 HH21 ARG A 772 16.892 9.815 15.579 1.00 0.00 H ATOM 1076 H ARG A 772 17.181 6.279 20.392 1.00 0.00 H ATOM 1077 N ASP A 773 19.575 8.584 19.496 1.00 23.90 N ATOM 1078 CA ASP A 773 20.351 9.782 19.178 1.00 26.67 C ATOM 1079 C ASP A 773 21.146 10.329 20.351 1.00 25.77 C ATOM 1080 O ASP A 773 22.023 11.176 20.146 1.00 29.31 O ATOM 1081 CB ASP A 773 19.428 10.871 18.621 1.00 21.16 C ATOM 1082 CG ASP A 773 18.900 10.506 17.248 1.00 22.86 C ATOM 1083 OD1 ASP A 773 19.548 9.661 16.618 1.00 24.64 O ATOM 1084 OD2 ASP A 773 17.853 11.031 16.802 1.00 24.61 O ATOM 1085 H ASP A 773 18.582 8.687 19.788 1.00 0.00 H ATOM 1086 N ASN A 774 20.880 9.864 21.563 1.00 26.20 N ATOM 1087 CA ASN A 774 21.568 10.369 22.730 1.00 29.48 C ATOM 1088 C ASN A 774 22.301 9.305 23.527 1.00 27.72 C ATOM 1089 O ASN A 774 23.127 9.666 24.371 1.00 29.89 O ATOM 1090 CB ASN A 774 20.583 11.102 23.656 1.00 25.18 C ATOM 1091 CG ASN A 774 19.736 12.091 22.903 1.00 25.80 C ATOM 1092 OD1 ASN A 774 20.187 13.183 22.585 1.00 29.40 O ATOM 1093 ND2 ASN A 774 18.514 11.703 22.584 1.00 24.89 N ATOM 1094 HD22 ASN A 774 18.173 10.765 22.876 1.00 0.00 H ATOM 1095 HD21 ASN A 774 17.893 12.336 22.041 1.00 0.00 H ATOM 1096 H ASN A 774 20.162 9.121 21.677 1.00 0.00 H ATOM 1097 N TYR A 775 22.048 8.018 23.289 1.00 23.30 N ATOM 1098 CA TYR A 775 22.707 6.981 24.085 1.00 23.64 C ATOM 1099 C TYR A 775 23.442 5.916 23.283 1.00 24.78 C ATOM 1100 O TYR A 775 24.313 5.259 23.853 1.00 27.46 O ATOM 1101 CB TYR A 775 21.696 6.283 25.007 1.00 23.67 C ATOM 1102 CG TYR A 775 21.279 7.137 26.170 1.00 32.52 C ATOM 1103 CD1 TYR A 775 22.195 7.498 27.158 1.00 36.00 C ATOM 1104 CD2 TYR A 775 19.976 7.600 26.282 1.00 31.77 C ATOM 1105 CE1 TYR A 775 21.815 8.297 28.227 1.00 37.48 C ATOM 1106 CE2 TYR A 775 19.588 8.393 27.349 1.00 33.64 C ATOM 1107 CZ TYR A 775 20.504 8.735 28.316 1.00 38.31 C ATOM 1108 OH TYR A 775 20.106 9.528 29.374 1.00 39.43 O ATOM 1109 HH TYR A 775 20.876 9.682 29.977 1.00 0.00 H ATOM 1110 H TYR A 775 21.382 7.750 22.537 1.00 0.00 H ATOM 1111 N LEU A 776 23.137 5.722 22.005 1.00 21.12 N ATOM 1112 CA LEU A 776 23.789 4.720 21.176 1.00 22.68 C ATOM 1113 C LEU A 776 24.904 5.358 20.352 1.00 31.91 C ATOM 1114 O LEU A 776 24.930 6.580 20.184 1.00 24.47 O ATOM 1115 CB LEU A 776 22.755 4.055 20.249 1.00 23.71 C ATOM 1116 CG LEU A 776 21.614 3.287 20.932 1.00 26.32 C ATOM 1117 CD1 LEU A 776 20.691 2.588 19.911 1.00 20.55 C ATOM 1118 CD2 LEU A 776 22.143 2.292 21.943 1.00 20.62 C ATOM 1119 H LEU A 776 22.397 6.314 21.577 1.00 0.00 H ATOM 1120 N PRO A 777 25.840 4.559 19.810 1.00 32.14 N ATOM 1121 CA PRO A 777 27.000 5.141 19.111 1.00 31.09 C ATOM 1122 C PRO A 777 26.609 5.983 17.909 1.00 31.29 C ATOM 1123 O PRO A 777 25.705 5.640 17.145 1.00 32.07 O ATOM 1124 CB PRO A 777 27.808 3.911 18.682 1.00 31.80 C ATOM 1125 CG PRO A 777 27.383 2.835 19.636 1.00 29.68 C ATOM 1126 CD PRO A 777 25.931 3.089 19.865 1.00 22.30 C ATOM 1127 N LYS A 778 27.319 7.097 17.746 1.00 33.95 N ATOM 1128 CA LYS A 778 27.098 8.017 16.643 1.00 32.60 C ATOM 1129 C LYS A 778 27.824 7.534 15.390 1.00 29.36 C ATOM 1130 O LYS A 778 28.752 6.723 15.448 1.00 34.97 O ATOM 1131 CB LYS A 778 27.564 9.437 17.014 1.00 37.48 C ATOM 1132 CG LYS A 778 27.112 9.909 18.399 1.00 36.20 C ATOM 1133 CD LYS A 778 25.673 10.465 18.410 1.00 44.72 C ATOM 1134 CE LYS A 778 25.139 10.693 19.857 1.00 42.85 C ATOM 1135 NZ LYS A 778 24.370 9.489 20.413 1.00 37.69 N ATOM 1136 HZ1 LYS A 778 23.552 9.290 19.803 1.00 0.00 H ATOM 1137 HZ2 LYS A 778 24.997 8.659 20.436 1.00 0.00 H ATOM 1138 HZ3 LYS A 778 24.042 9.704 21.376 1.00 0.00 H ATOM 1139 H LYS A 778 28.064 7.318 18.437 1.00 0.00 H ATOM 1140 N GLY A 779 27.367 8.027 14.245 1.00 29.65 N ATOM 1141 CA GLY A 779 27.996 7.702 12.985 1.00 29.16 C ATOM 1142 C GLY A 779 27.308 6.555 12.268 1.00 33.53 C ATOM 1143 O GLY A 779 26.553 5.769 12.849 1.00 26.93 O ATOM 1144 H GLY A 779 26.541 8.659 14.255 1.00 0.00 H ATOM 1145 N LEU A 780 27.562 6.476 10.967 1.00 33.55 N ATOM 1146 CA LEU A 780 26.980 5.420 10.159 1.00 32.09 C ATOM 1147 C LEU A 780 27.664 4.094 10.448 1.00 26.91 C ATOM 1148 O LEU A 780 28.747 4.034 11.038 1.00 30.27 O ATOM 1149 CB LEU A 780 27.094 5.755 8.670 1.00 33.79 C ATOM 1150 CG LEU A 780 26.538 7.141 8.349 1.00 39.54 C ATOM 1151 CD1 LEU A 780 27.015 7.631 6.980 1.00 43.28 C ATOM 1152 CD2 LEU A 780 25.035 7.099 8.412 1.00 40.28 C ATOM 1153 H LEU A 780 28.185 7.179 10.522 1.00 0.00 H ATOM 1154 N ASN A 781 27.006 3.018 10.027 1.00 26.35 N ATOM 1155 CA ASN A 781 27.553 1.672 10.146 1.00 27.37 C ATOM 1156 C ASN A 781 27.806 1.311 11.602 1.00 29.00 C ATOM 1157 O ASN A 781 28.699 0.526 11.911 1.00 30.99 O ATOM 1158 CB ASN A 781 28.822 1.522 9.295 1.00 28.15 C ATOM 1159 CG ASN A 781 29.024 0.101 8.782 1.00 34.45 C ATOM 1160 OD1 ASN A 781 29.507 -0.097 7.677 1.00 41.81 O ATOM 1161 ND2 ASN A 781 28.735 -0.885 9.618 1.00 32.61 N ATOM 1162 HD22 ASN A 781 28.325 -0.673 10.550 1.00 0.00 H ATOM 1163 HD21 ASN A 781 28.918 -1.871 9.343 1.00 0.00 H ATOM 1164 H ASN A 781 26.067 3.141 9.597 1.00 0.00 H ATOM 1165 N GLN A 782 27.016 1.886 12.507 1.00 24.10 N ATOM 1166 CA GLN A 782 27.067 1.537 13.922 1.00 25.75 C ATOM 1167 C GLN A 782 25.837 0.771 14.382 1.00 20.31 C ATOM 1168 O GLN A 782 25.959 -0.274 15.022 1.00 27.60 O ATOM 1169 CB GLN A 782 27.228 2.806 14.773 1.00 29.05 C ATOM 1170 CG GLN A 782 28.482 3.573 14.497 1.00 29.20 C ATOM 1171 CD GLN A 782 29.647 3.120 15.337 1.00 36.39 C ATOM 1172 OE1 GLN A 782 29.610 2.066 15.974 1.00 36.77 O ATOM 1173 NE2 GLN A 782 30.689 3.936 15.367 1.00 46.35 N ATOM 1174 HE22 GLN A 782 30.677 4.816 14.813 1.00 0.00 H ATOM 1175 HE21 GLN A 782 31.520 3.697 15.945 1.00 0.00 H ATOM 1176 H GLN A 782 26.338 2.610 12.193 1.00 0.00 H ATOM 1177 N ILE A 783 24.650 1.247 14.055 1.00 20.39 N ATOM 1178 CA ILE A 783 23.413 0.709 14.598 1.00 21.84 C ATOM 1179 C ILE A 783 22.693 -0.034 13.482 1.00 25.55 C ATOM 1180 O ILE A 783 22.190 0.593 12.542 1.00 22.77 O ATOM 1181 CB ILE A 783 22.532 1.817 15.186 1.00 24.35 C ATOM 1182 CG1 ILE A 783 23.309 2.705 16.174 1.00 24.40 C ATOM 1183 CG2 ILE A 783 21.359 1.230 15.888 1.00 22.77 C ATOM 1184 CD1 ILE A 783 22.499 3.908 16.619 1.00 24.55 C ATOM 1185 H ILE A 783 24.597 2.038 13.382 1.00 0.00 H ATOM 1186 N LEU A 784 22.614 -1.368 13.596 1.00 19.07 N ATOM 1187 CA LEU A 784 21.833 -2.178 12.664 1.00 24.23 C ATOM 1188 C LEU A 784 20.382 -2.230 13.145 1.00 22.82 C ATOM 1189 O LEU A 784 20.072 -2.905 14.134 1.00 22.49 O ATOM 1190 CB LEU A 784 22.409 -3.588 12.537 1.00 19.55 C ATOM 1191 CG LEU A 784 21.664 -4.351 11.445 1.00 22.39 C ATOM 1192 CD1 LEU A 784 21.955 -3.720 10.085 1.00 24.38 C ATOM 1193 CD2 LEU A 784 21.977 -5.845 11.469 1.00 23.40 C ATOM 1194 H LEU A 784 23.123 -1.840 14.370 1.00 0.00 H ATOM 1195 N HIS A 785 19.490 -1.548 12.427 1.00 18.49 N ATOM 1196 CA HIS A 785 18.079 -1.454 12.795 1.00 18.02 C ATOM 1197 C HIS A 785 17.331 -2.635 12.201 1.00 21.36 C ATOM 1198 O HIS A 785 17.178 -2.727 10.977 1.00 22.35 O ATOM 1199 CB HIS A 785 17.467 -0.140 12.304 1.00 20.52 C ATOM 1200 CG HIS A 785 16.101 0.146 12.856 1.00 27.82 C ATOM 1201 ND1 HIS A 785 15.167 0.911 12.187 1.00 28.23 N ATOM 1202 CD2 HIS A 785 15.518 -0.216 14.027 1.00 26.12 C ATOM 1203 CE1 HIS A 785 14.067 0.997 12.914 1.00 30.74 C ATOM 1204 NE2 HIS A 785 14.255 0.326 14.038 1.00 28.72 N ATOM 1205 H HIS A 785 19.813 -1.061 11.567 1.00 0.00 H ATOM 1206 N SER A 786 16.855 -3.533 13.067 1.00 22.75 N ATOM 1207 CA SER A 786 15.968 -4.620 12.652 1.00 25.76 C ATOM 1208 C SER A 786 14.573 -4.020 12.513 1.00 29.85 C ATOM 1209 O SER A 786 13.885 -3.777 13.502 1.00 34.66 O ATOM 1210 CB SER A 786 15.997 -5.773 13.645 1.00 25.61 C ATOM 1211 OG SER A 786 15.179 -6.837 13.190 1.00 32.37 O ATOM 1212 HG SER A 786 15.512 -7.156 12.314 1.00 0.00 H ATOM 1213 H SER A 786 17.123 -3.457 14.069 1.00 0.00 H ATOM 1214 N PHE A 787 14.180 -3.768 11.269 1.00 24.74 N ATOM 1215 CA PHE A 787 13.047 -2.976 10.812 1.00 32.03 C ATOM 1216 C PHE A 787 11.768 -3.820 10.739 1.00 34.50 C ATOM 1217 O PHE A 787 10.732 -3.455 11.304 1.00 25.62 O ATOM 1218 CB PHE A 787 13.464 -2.361 9.457 1.00 30.70 C ATOM 1219 CG PHE A 787 12.393 -1.618 8.723 1.00 37.31 C ATOM 1220 CD1 PHE A 787 12.159 -0.269 8.990 1.00 48.62 C ATOM 1221 CD2 PHE A 787 11.707 -2.221 7.678 1.00 34.83 C ATOM 1222 CE1 PHE A 787 11.189 0.448 8.280 1.00 50.11 C ATOM 1223 CE2 PHE A 787 10.743 -1.521 6.961 1.00 47.54 C ATOM 1224 CZ PHE A 787 10.476 -0.184 7.264 1.00 54.92 C ATOM 1225 H PHE A 787 14.761 -4.195 10.519 1.00 0.00 H ATOM 1226 N MET A 788 11.834 -4.975 10.090 1.00 27.78 N ATOM 1227 CA MET A 788 10.706 -5.887 10.051 1.00 26.77 C ATOM 1228 C MET A 788 11.242 -7.301 9.949 1.00 28.06 C ATOM 1229 O MET A 788 12.323 -7.531 9.403 1.00 26.36 O ATOM 1230 CB MET A 788 9.754 -5.587 8.879 1.00 31.37 C ATOM 1231 CG MET A 788 8.522 -4.755 9.294 1.00 45.66 C ATOM 1232 SD MET A 788 7.237 -4.507 8.038 1.00 54.91 S ATOM 1233 CE MET A 788 8.045 -3.417 6.878 1.00 30.51 C ATOM 1234 H MET A 788 12.713 -5.233 9.598 1.00 0.00 H ATOM 1235 N MET A 789 10.501 -8.231 10.544 1.00 27.43 N ATOM 1236 CA MET A 789 10.700 -9.660 10.387 1.00 28.46 C ATOM 1237 C MET A 789 9.348 -10.311 10.140 1.00 30.53 C ATOM 1238 O MET A 789 8.306 -9.782 10.531 1.00 36.78 O ATOM 1239 CB MET A 789 11.323 -10.292 11.604 1.00 30.09 C ATOM 1240 CG MET A 789 12.761 -10.648 11.462 1.00 39.39 C ATOM 1241 SD MET A 789 13.350 -11.507 12.934 1.00 43.43 S ATOM 1242 CE MET A 789 15.029 -10.919 12.980 1.00 29.79 C ATOM 1243 H MET A 789 9.728 -7.913 11.163 1.00 0.00 H ATOM 1244 N GLY A 790 9.372 -11.454 9.483 1.00 25.71 N ATOM 1245 CA GLY A 790 8.146 -12.174 9.223 1.00 25.42 C ATOM 1246 C GLY A 790 8.448 -13.575 8.748 1.00 23.12 C ATOM 1247 O GLY A 790 9.543 -13.870 8.250 1.00 20.49 O ATOM 1248 H GLY A 790 10.279 -11.840 9.150 1.00 0.00 H ATOM 1249 N THR A 791 7.443 -14.425 8.876 1.00 25.29 N ATOM 1250 CA THR A 791 7.506 -15.804 8.439 1.00 25.82 C ATOM 1251 C THR A 791 6.236 -16.121 7.666 1.00 23.23 C ATOM 1252 O THR A 791 5.192 -15.522 7.915 1.00 21.24 O ATOM 1253 CB THR A 791 7.628 -16.735 9.640 1.00 24.91 C ATOM 1254 OG1 THR A 791 6.510 -16.495 10.490 1.00 27.76 O ATOM 1255 CG2 THR A 791 8.891 -16.449 10.416 1.00 21.53 C ATOM 1256 HG1 THR A 791 6.565 -17.089 11.280 1.00 0.00 H ATOM 1257 H THR A 791 6.562 -14.086 9.313 1.00 0.00 H ATOM 1258 N ALA A 792 6.334 -17.096 6.758 1.00 27.66 N ATOM 1259 CA ALA A 792 5.213 -17.504 5.918 1.00 24.96 C ATOM 1260 C ALA A 792 4.023 -17.980 6.746 1.00 28.00 C ATOM 1261 O ALA A 792 4.176 -18.612 7.795 1.00 30.10 O ATOM 1262 CB ALA A 792 5.646 -18.621 4.961 1.00 26.51 C ATOM 1263 H ALA A 792 7.246 -17.584 6.645 1.00 0.00 H ATOM 1264 N GLU A 793 2.821 -17.685 6.238 1.00 31.66 N ATOM 1265 CA GLU A 793 1.576 -18.023 6.935 1.00 34.67 C ATOM 1266 C GLU A 793 1.459 -19.519 7.236 1.00 34.49 C ATOM 1267 O GLU A 793 1.030 -19.911 8.328 1.00 40.61 O ATOM 1268 CB GLU A 793 0.380 -17.576 6.093 1.00 35.20 C ATOM 1269 CG GLU A 793 -0.381 -16.381 6.627 1.00 43.06 C ATOM 1270 CD GLU A 793 -1.539 -15.962 5.712 1.00 60.90 C ATOM 1271 OE1 GLU A 793 -1.371 -15.971 4.461 1.00 49.92 O ATOM 1272 OE2 GLU A 793 -2.620 -15.623 6.256 1.00 68.30 O ATOM 1273 H GLU A 793 2.768 -17.200 5.319 1.00 0.00 H ATOM 1274 N LYS A 794 1.817 -20.369 6.281 1.00 28.11 N ATOM 1275 CA LYS A 794 1.574 -21.796 6.417 1.00 31.27 C ATOM 1276 C LYS A 794 2.552 -22.498 7.360 1.00 37.59 C ATOM 1277 O LYS A 794 2.434 -23.714 7.538 1.00 38.09 O ATOM 1278 CB LYS A 794 1.606 -22.468 5.038 1.00 34.10 C ATOM 1279 CG LYS A 794 3.019 -22.750 4.504 1.00 44.38 C ATOM 1280 CD LYS A 794 3.509 -21.646 3.562 1.00 48.57 C ATOM 1281 CE LYS A 794 4.947 -21.878 3.100 1.00 47.34 C ATOM 1282 NZ LYS A 794 5.451 -20.791 2.182 1.00 52.58 N ATOM 1283 HZ1 LYS A 794 4.849 -20.747 1.335 1.00 0.00 H ATOM 1284 HZ2 LYS A 794 5.420 -19.878 2.679 1.00 0.00 H ATOM 1285 HZ3 LYS A 794 6.430 -21.002 1.902 1.00 0.00 H ATOM 1286 H LYS A 794 2.279 -20.008 5.422 1.00 0.00 H ATOM 1287 N LEU A 795 3.504 -21.790 7.970 1.00 34.86 N ATOM 1288 CA LEU A 795 4.407 -22.444 8.911 1.00 31.88 C ATOM 1289 C LEU A 795 3.647 -22.863 10.168 1.00 29.84 C ATOM 1290 O LEU A 795 2.908 -22.060 10.747 1.00 30.01 O ATOM 1291 CB LEU A 795 5.569 -21.514 9.278 1.00 34.50 C ATOM 1292 CG LEU A 795 6.581 -21.147 8.176 1.00 31.97 C ATOM 1293 CD1 LEU A 795 7.820 -20.425 8.743 1.00 20.99 C ATOM 1294 CD2 LEU A 795 6.987 -22.392 7.386 1.00 28.59 C ATOM 1295 H LEU A 795 3.602 -20.773 7.775 1.00 0.00 H ATOM 1296 N ASN A 796 3.823 -24.126 10.583 1.00 29.39 N ATOM 1297 CA ASN A 796 3.261 -24.621 11.840 1.00 31.81 C ATOM 1298 C ASN A 796 4.130 -24.126 12.993 1.00 30.87 C ATOM 1299 O ASN A 796 5.176 -23.514 12.762 1.00 31.98 O ATOM 1300 CB ASN A 796 3.100 -26.150 11.784 1.00 32.50 C ATOM 1301 CG ASN A 796 4.426 -26.917 11.762 1.00 33.31 C ATOM 1302 OD1 ASN A 796 5.373 -26.612 12.499 1.00 33.01 O ATOM 1303 ND2 ASN A 796 4.484 -27.944 10.920 1.00 28.86 N ATOM 1304 HD22 ASN A 796 3.667 -28.169 10.317 1.00 0.00 H ATOM 1305 HD21 ASN A 796 5.346 -28.523 10.864 1.00 0.00 H ATOM 1306 H ASN A 796 4.378 -24.776 9.991 1.00 0.00 H ATOM 1307 N PRO A 797 3.711 -24.320 14.256 1.00 32.66 N ATOM 1308 CA PRO A 797 4.466 -23.681 15.351 1.00 28.61 C ATOM 1309 C PRO A 797 5.914 -24.135 15.445 1.00 27.07 C ATOM 1310 O PRO A 797 6.772 -23.313 15.776 1.00 29.38 O ATOM 1311 CB PRO A 797 3.655 -24.059 16.599 1.00 32.26 C ATOM 1312 CG PRO A 797 2.278 -24.231 16.101 1.00 33.07 C ATOM 1313 CD PRO A 797 2.455 -24.908 14.760 1.00 36.31 C ATOM 1314 N ARG A 798 6.220 -25.411 15.177 1.00 25.12 N ATOM 1315 CA ARG A 798 7.612 -25.850 15.198 1.00 26.45 C ATOM 1316 C ARG A 798 8.425 -25.114 14.137 1.00 26.09 C ATOM 1317 O ARG A 798 9.530 -24.623 14.406 1.00 23.82 O ATOM 1318 CB ARG A 798 7.687 -27.365 14.991 1.00 24.92 C ATOM 1319 CG ARG A 798 9.100 -27.883 14.727 1.00 25.07 C ATOM 1320 CD ARG A 798 9.104 -29.340 14.282 1.00 25.20 C ATOM 1321 NE ARG A 798 8.121 -29.601 13.239 1.00 28.11 N ATOM 1322 CZ ARG A 798 8.389 -29.616 11.939 1.00 27.89 C ATOM 1323 NH1 ARG A 798 9.624 -29.389 11.504 1.00 29.55 N ATOM 1324 NH2 ARG A 798 7.417 -29.861 11.074 1.00 26.50 N ATOM 1325 HE ARG A 798 7.141 -29.789 13.533 1.00 0.00 H ATOM 1326 HH12 ARG A 798 9.827 -29.402 10.484 1.00 0.00 H ATOM 1327 HH11 ARG A 798 10.388 -29.198 12.184 1.00 0.00 H ATOM 1328 HH22 ARG A 798 7.620 -29.874 10.054 1.00 0.00 H ATOM 1329 HH21 ARG A 798 6.451 -30.040 11.415 1.00 0.00 H ATOM 1330 H ARG A 798 5.465 -26.090 14.954 1.00 0.00 H ATOM 1331 N GLU A 799 7.886 -25.017 12.923 1.00 27.03 N ATOM 1332 CA GLU A 799 8.604 -24.349 11.847 1.00 27.99 C ATOM 1333 C GLU A 799 8.717 -22.858 12.111 1.00 21.36 C ATOM 1334 O GLU A 799 9.762 -22.255 11.866 1.00 22.94 O ATOM 1335 CB GLU A 799 7.907 -24.613 10.514 1.00 31.53 C ATOM 1336 CG GLU A 799 7.801 -26.102 10.169 1.00 28.12 C ATOM 1337 CD GLU A 799 6.804 -26.376 9.037 1.00 33.85 C ATOM 1338 OE1 GLU A 799 5.738 -25.713 8.981 1.00 32.51 O ATOM 1339 OE2 GLU A 799 7.103 -27.244 8.193 1.00 35.46 O ATOM 1340 H GLU A 799 6.945 -25.421 12.742 1.00 0.00 H ATOM 1341 N ASN A 800 7.662 -22.248 12.626 1.00 24.81 N ATOM 1342 CA ASN A 800 7.732 -20.830 12.934 1.00 24.02 C ATOM 1343 C ASN A 800 8.819 -20.559 13.967 1.00 25.52 C ATOM 1344 O ASN A 800 9.708 -19.728 13.753 1.00 25.88 O ATOM 1345 CB ASN A 800 6.372 -20.337 13.419 1.00 24.52 C ATOM 1346 CG ASN A 800 6.315 -18.840 13.495 1.00 34.24 C ATOM 1347 OD1 ASN A 800 6.415 -18.156 12.474 1.00 39.10 O ATOM 1348 ND2 ASN A 800 6.194 -18.312 14.701 1.00 32.39 N ATOM 1349 HD22 ASN A 800 6.113 -18.930 15.533 1.00 0.00 H ATOM 1350 HD21 ASN A 800 6.180 -17.279 14.817 1.00 0.00 H ATOM 1351 H ASN A 800 6.788 -22.780 12.809 1.00 0.00 H ATOM 1352 N ILE A 801 8.790 -21.297 15.074 1.00 28.14 N ATOM 1353 CA ILE A 801 9.803 -21.156 16.116 1.00 26.92 C ATOM 1354 C ILE A 801 11.201 -21.384 15.548 1.00 26.46 C ATOM 1355 O ILE A 801 12.133 -20.612 15.819 1.00 25.19 O ATOM 1356 CB ILE A 801 9.494 -22.121 17.277 1.00 32.21 C ATOM 1357 CG1 ILE A 801 8.395 -21.530 18.179 1.00 36.06 C ATOM 1358 CG2 ILE A 801 10.755 -22.469 18.070 1.00 30.85 C ATOM 1359 CD1 ILE A 801 8.772 -20.185 18.842 1.00 35.89 C ATOM 1360 H ILE A 801 8.026 -21.992 15.200 1.00 0.00 H ATOM 1361 N ALA A 802 11.374 -22.447 14.754 1.00 20.52 N ATOM 1362 CA ALA A 802 12.695 -22.710 14.190 1.00 25.56 C ATOM 1363 C ALA A 802 13.144 -21.574 13.275 1.00 19.45 C ATOM 1364 O ALA A 802 14.310 -21.158 13.313 1.00 22.37 O ATOM 1365 CB ALA A 802 12.699 -24.045 13.437 1.00 26.69 C ATOM 1366 H ALA A 802 10.576 -23.079 14.541 1.00 0.00 H ATOM 1367 N CYS A 803 12.237 -21.057 12.444 1.00 20.87 N ATOM 1368 CA CYS A 803 12.613 -19.990 11.517 1.00 21.80 C ATOM 1369 C CYS A 803 12.970 -18.702 12.266 1.00 18.74 C ATOM 1370 O CYS A 803 13.906 -17.992 11.880 1.00 23.60 O ATOM 1371 CB CYS A 803 11.489 -19.768 10.502 1.00 19.27 C ATOM 1372 SG CYS A 803 11.890 -18.586 9.167 1.00 21.68 S ATOM 1373 H CYS A 803 11.260 -21.414 12.456 1.00 0.00 H ATOM 1374 N MET A 804 12.278 -18.411 13.368 1.00 20.65 N ATOM 1375 CA MET A 804 12.617 -17.229 14.155 1.00 22.28 C ATOM 1376 C MET A 804 13.990 -17.372 14.799 1.00 20.67 C ATOM 1377 O MET A 804 14.774 -16.419 14.805 1.00 22.10 O ATOM 1378 CB MET A 804 11.543 -16.965 15.213 1.00 23.13 C ATOM 1379 CG MET A 804 10.190 -16.526 14.645 1.00 25.10 C ATOM 1380 SD MET A 804 10.253 -14.959 13.729 1.00 28.14 S ATOM 1381 CE MET A 804 10.218 -13.761 15.066 1.00 25.79 C ATOM 1382 H MET A 804 11.495 -19.027 13.667 1.00 0.00 H ATOM 1383 N HIS A 805 14.308 -18.563 15.327 1.00 19.23 N ATOM 1384 CA HIS A 805 15.652 -18.787 15.858 1.00 18.26 C ATOM 1385 C HIS A 805 16.692 -18.641 14.763 1.00 21.03 C ATOM 1386 O HIS A 805 17.738 -18.016 14.968 1.00 25.49 O ATOM 1387 CB HIS A 805 15.759 -20.167 16.508 1.00 21.55 C ATOM 1388 CG HIS A 805 15.214 -20.230 17.907 1.00 24.56 C ATOM 1389 ND1 HIS A 805 15.747 -19.501 18.947 1.00 19.51 N ATOM 1390 CD2 HIS A 805 14.182 -20.936 18.434 1.00 24.38 C ATOM 1391 CE1 HIS A 805 15.064 -19.750 20.053 1.00 26.78 C ATOM 1392 NE2 HIS A 805 14.103 -20.611 19.768 1.00 22.27 N ATOM 1393 H HIS A 805 13.601 -19.325 15.359 1.00 0.00 H ATOM 1394 N PHE A 806 16.400 -19.173 13.570 1.00 19.21 N ATOM 1395 CA PHE A 806 17.345 -19.084 12.464 1.00 20.04 C ATOM 1396 C PHE A 806 17.543 -17.630 12.017 1.00 20.21 C ATOM 1397 O PHE A 806 18.667 -17.212 11.722 1.00 22.12 O ATOM 1398 CB PHE A 806 16.856 -19.958 11.304 1.00 20.74 C ATOM 1399 CG PHE A 806 17.804 -20.032 10.149 1.00 21.84 C ATOM 1400 CD1 PHE A 806 18.799 -21.000 10.109 1.00 22.92 C ATOM 1401 CD2 PHE A 806 17.678 -19.163 9.075 1.00 26.80 C ATOM 1402 CE1 PHE A 806 19.665 -21.085 9.026 1.00 26.25 C ATOM 1403 CE2 PHE A 806 18.543 -19.244 7.985 1.00 26.38 C ATOM 1404 CZ PHE A 806 19.544 -20.197 7.966 1.00 24.46 C ATOM 1405 H PHE A 806 15.489 -19.655 13.431 1.00 0.00 H ATOM 1406 N MET A 807 16.473 -16.841 11.985 1.00 18.01 N ATOM 1407 CA MET A 807 16.620 -15.437 11.596 1.00 21.03 C ATOM 1408 C MET A 807 17.361 -14.623 12.654 1.00 20.15 C ATOM 1409 O MET A 807 18.129 -13.723 12.305 1.00 22.81 O ATOM 1410 CB MET A 807 15.254 -14.820 11.288 1.00 21.43 C ATOM 1411 CG MET A 807 14.674 -15.341 9.937 1.00 22.88 C ATOM 1412 SD MET A 807 13.214 -14.434 9.384 1.00 31.60 S ATOM 1413 CE MET A 807 12.083 -14.679 10.742 1.00 29.22 C ATOM 1414 H MET A 807 15.537 -17.219 12.235 1.00 0.00 H ATOM 1415 N GLU A 808 17.187 -14.932 13.939 1.00 21.23 N ATOM 1416 CA GLU A 808 17.916 -14.175 14.949 1.00 21.94 C ATOM 1417 C GLU A 808 19.410 -14.447 14.852 1.00 29.23 C ATOM 1418 O GLU A 808 20.239 -13.527 14.900 1.00 30.09 O ATOM 1419 CB GLU A 808 17.422 -14.525 16.337 1.00 22.23 C ATOM 1420 CG GLU A 808 18.230 -13.790 17.364 1.00 30.36 C ATOM 1421 CD GLU A 808 18.053 -12.279 17.169 1.00 32.26 C ATOM 1422 OE1 GLU A 808 16.893 -11.857 16.954 1.00 31.62 O ATOM 1423 OE2 GLU A 808 19.048 -11.530 17.263 1.00 29.53 O ATOM 1424 H GLU A 808 16.542 -15.700 14.216 1.00 0.00 H ATOM 1425 N HIS A 809 19.763 -15.723 14.702 1.00 23.80 N ATOM 1426 CA HIS A 809 21.140 -16.137 14.486 1.00 23.18 C ATOM 1427 C HIS A 809 21.737 -15.453 13.269 1.00 25.49 C ATOM 1428 O HIS A 809 22.892 -15.021 13.291 1.00 31.83 O ATOM 1429 CB HIS A 809 21.149 -17.657 14.341 1.00 30.25 C ATOM 1430 CG HIS A 809 22.509 -18.265 14.341 1.00 35.07 C ATOM 1431 ND1 HIS A 809 23.293 -18.338 13.209 1.00 37.35 N ATOM 1432 CD2 HIS A 809 23.216 -18.863 15.328 1.00 36.57 C ATOM 1433 CE1 HIS A 809 24.437 -18.933 13.504 1.00 33.68 C ATOM 1434 NE2 HIS A 809 24.415 -19.263 14.783 1.00 41.38 N ATOM 1435 H HIS A 809 19.023 -16.453 14.741 1.00 0.00 H ATOM 1436 N GLU A 810 20.961 -15.326 12.200 1.00 23.79 N ATOM 1437 CA GLU A 810 21.511 -14.746 10.987 1.00 23.08 C ATOM 1438 C GLU A 810 21.579 -13.217 11.047 1.00 24.68 C ATOM 1439 O GLU A 810 22.487 -12.625 10.461 1.00 23.00 O ATOM 1440 CB GLU A 810 20.701 -15.205 9.777 1.00 25.57 C ATOM 1441 CG GLU A 810 21.247 -14.710 8.444 1.00 27.72 C ATOM 1442 CD GLU A 810 22.575 -15.365 8.056 1.00 35.46 C ATOM 1443 OE1 GLU A 810 22.933 -16.436 8.625 1.00 35.30 O ATOM 1444 OE2 GLU A 810 23.247 -14.796 7.170 1.00 34.94 O ATOM 1445 H GLU A 810 19.970 -15.638 12.230 1.00 0.00 H ATOM 1446 N VAL A 811 20.660 -12.554 11.746 1.00 24.75 N ATOM 1447 CA VAL A 811 20.799 -11.103 11.907 1.00 24.66 C ATOM 1448 C VAL A 811 22.103 -10.773 12.634 1.00 26.12 C ATOM 1449 O VAL A 811 22.821 -9.830 12.272 1.00 23.45 O ATOM 1450 CB VAL A 811 19.575 -10.523 12.642 1.00 23.09 C ATOM 1451 CG1 VAL A 811 19.821 -9.065 13.010 1.00 28.82 C ATOM 1452 CG2 VAL A 811 18.356 -10.610 11.765 1.00 25.88 C ATOM 1453 H VAL A 811 19.856 -13.058 12.171 1.00 0.00 H ATOM 1454 N LEU A 812 22.431 -11.550 13.668 1.00 28.53 N ATOM 1455 CA LEU A 812 23.695 -11.357 14.369 1.00 31.06 C ATOM 1456 C LEU A 812 24.880 -11.540 13.433 1.00 28.20 C ATOM 1457 O LEU A 812 25.823 -10.740 13.461 1.00 31.48 O ATOM 1458 CB LEU A 812 23.795 -12.322 15.556 1.00 30.73 C ATOM 1459 CG LEU A 812 25.187 -12.458 16.194 1.00 38.52 C ATOM 1460 CD1 LEU A 812 25.680 -11.136 16.797 1.00 31.26 C ATOM 1461 CD2 LEU A 812 25.234 -13.590 17.240 1.00 41.40 C ATOM 1462 H LEU A 812 21.780 -12.300 13.977 1.00 0.00 H ATOM 1463 N ARG A 813 24.852 -12.582 12.592 1.00 28.51 N ATOM 1464 CA ARG A 813 25.963 -12.826 11.670 1.00 25.46 C ATOM 1465 C ARG A 813 26.147 -11.664 10.705 1.00 28.69 C ATOM 1466 O ARG A 813 27.275 -11.277 10.390 1.00 31.01 O ATOM 1467 CB ARG A 813 25.734 -14.125 10.885 1.00 31.24 C ATOM 1468 CG ARG A 813 27.018 -14.732 10.343 1.00 32.35 C ATOM 1469 CD ARG A 813 26.784 -15.614 9.148 1.00 35.02 C ATOM 1470 NE ARG A 813 25.991 -14.965 8.106 1.00 40.33 N ATOM 1471 CZ ARG A 813 26.478 -14.123 7.196 1.00 44.34 C ATOM 1472 NH1 ARG A 813 27.768 -13.811 7.194 1.00 46.68 N ATOM 1473 NH2 ARG A 813 25.672 -13.593 6.283 1.00 40.41 N ATOM 1474 HE ARG A 813 24.973 -15.176 8.073 1.00 0.00 H ATOM 1475 HH12 ARG A 813 28.143 -13.153 6.481 1.00 0.00 H ATOM 1476 HH11 ARG A 813 28.404 -14.225 7.905 1.00 0.00 H ATOM 1477 HH22 ARG A 813 26.052 -12.936 5.572 1.00 0.00 H ATOM 1478 HH21 ARG A 813 24.661 -13.835 6.279 1.00 0.00 H ATOM 1479 H ARG A 813 24.034 -13.224 12.594 1.00 0.00 H ATOM 1480 N VAL A 814 25.044 -11.119 10.197 1.00 27.91 N ATOM 1481 CA VAL A 814 25.126 -10.000 9.267 1.00 26.06 C ATOM 1482 C VAL A 814 25.716 -8.786 9.967 1.00 26.18 C ATOM 1483 O VAL A 814 26.613 -8.118 9.438 1.00 28.91 O ATOM 1484 CB VAL A 814 23.728 -9.716 8.682 1.00 27.55 C ATOM 1485 CG1 VAL A 814 23.702 -8.393 7.902 1.00 24.66 C ATOM 1486 CG2 VAL A 814 23.279 -10.887 7.816 1.00 25.38 C ATOM 1487 H VAL A 814 24.113 -11.496 10.467 1.00 0.00 H ATOM 1488 N ALA A 815 25.247 -8.509 11.186 1.00 27.35 N ATOM 1489 CA ALA A 815 25.750 -7.385 11.971 1.00 26.01 C ATOM 1490 C ALA A 815 27.259 -7.473 12.172 1.00 29.95 C ATOM 1491 O ALA A 815 27.983 -6.500 11.927 1.00 27.35 O ATOM 1492 CB ALA A 815 25.019 -7.333 13.314 1.00 24.35 C ATOM 1493 H ALA A 815 24.501 -9.112 11.589 1.00 0.00 H ATOM 1494 N ARG A 816 27.758 -8.642 12.603 1.00 29.85 N ATOM 1495 CA ARG A 816 29.200 -8.810 12.796 1.00 34.14 C ATOM 1496 C ARG A 816 29.948 -8.657 11.482 1.00 32.26 C ATOM 1497 O ARG A 816 30.941 -7.928 11.394 1.00 32.59 O ATOM 1498 CB ARG A 816 29.524 -10.183 13.394 1.00 34.79 C ATOM 1499 CG ARG A 816 28.854 -10.542 14.697 1.00 36.79 C ATOM 1500 CD ARG A 816 29.473 -11.808 15.320 1.00 46.84 C ATOM 1501 NE ARG A 816 29.651 -12.918 14.369 1.00 54.80 N ATOM 1502 CZ ARG A 816 28.839 -13.976 14.256 1.00 49.15 C ATOM 1503 NH1 ARG A 816 27.770 -14.086 15.031 1.00 44.18 N ATOM 1504 NH2 ARG A 816 29.096 -14.930 13.362 1.00 44.88 N ATOM 1505 HE ARG A 816 30.474 -12.877 13.734 1.00 0.00 H ATOM 1506 HH12 ARG A 816 27.143 -14.911 14.938 1.00 0.00 H ATOM 1507 HH11 ARG A 816 27.558 -13.348 15.732 1.00 0.00 H ATOM 1508 HH22 ARG A 816 28.461 -15.750 13.279 1.00 0.00 H ATOM 1509 HH21 ARG A 816 29.931 -14.855 12.747 1.00 0.00 H ATOM 1510 H ARG A 816 27.115 -9.435 12.802 1.00 0.00 H ATOM 1511 N GLU A 817 29.497 -9.369 10.453 1.00 32.19 N ATOM 1512 CA GLU A 817 30.195 -9.367 9.176 1.00 32.19 C ATOM 1513 C GLU A 817 30.200 -7.980 8.552 1.00 41.18 C ATOM 1514 O GLU A 817 31.177 -7.578 7.909 1.00 42.00 O ATOM 1515 CB GLU A 817 29.534 -10.376 8.238 1.00 37.44 C ATOM 1516 CG GLU A 817 29.915 -10.224 6.785 1.00 46.34 C ATOM 1517 CD GLU A 817 28.864 -10.814 5.877 1.00 58.64 C ATOM 1518 OE1 GLU A 817 28.296 -10.070 5.038 1.00 58.62 O ATOM 1519 OE2 GLU A 817 28.590 -12.023 6.033 1.00 57.71 O ATOM 1520 H GLU A 817 28.632 -9.936 10.563 1.00 0.00 H ATOM 1521 N LYS A 818 29.123 -7.229 8.734 1.00 38.13 N ATOM 1522 CA LYS A 818 29.043 -5.895 8.171 1.00 31.52 C ATOM 1523 C LYS A 818 29.646 -4.844 9.081 1.00 31.61 C ATOM 1524 O LYS A 818 29.601 -3.658 8.742 1.00 31.06 O ATOM 1525 CB LYS A 818 27.590 -5.551 7.858 1.00 31.24 C ATOM 1526 CG LYS A 818 27.022 -6.396 6.733 1.00 32.40 C ATOM 1527 CD LYS A 818 27.182 -5.661 5.420 1.00 36.78 C ATOM 1528 CE LYS A 818 26.693 -6.491 4.251 1.00 35.74 C ATOM 1529 NZ LYS A 818 26.795 -5.678 3.008 1.00 36.55 N ATOM 1530 HZ1 LYS A 818 26.208 -4.825 3.104 1.00 0.00 H ATOM 1531 HZ2 LYS A 818 27.786 -5.403 2.855 1.00 0.00 H ATOM 1532 HZ3 LYS A 818 26.461 -6.240 2.199 1.00 0.00 H ATOM 1533 H LYS A 818 28.325 -7.601 9.288 1.00 0.00 H ATOM 1534 N GLN A 819 30.183 -5.254 10.235 1.00 34.88 N ATOM 1535 CA GLN A 819 30.931 -4.375 11.138 1.00 36.66 C ATOM 1536 C GLN A 819 30.020 -3.354 11.820 1.00 32.79 C ATOM 1537 O GLN A 819 30.402 -2.201 12.034 1.00 30.36 O ATOM 1538 CB GLN A 819 32.089 -3.682 10.410 1.00 37.78 C ATOM 1539 CG GLN A 819 33.126 -4.656 9.824 1.00 41.13 C ATOM 1540 CD GLN A 819 34.403 -3.959 9.374 1.00 51.35 C ATOM 1541 OE1 GLN A 819 34.477 -2.731 9.340 1.00 56.36 O ATOM 1542 NE2 GLN A 819 35.421 -4.744 9.044 1.00 61.69 N ATOM 1543 HE22 GLN A 819 35.316 -5.778 9.087 1.00 0.00 H ATOM 1544 HE21 GLN A 819 36.324 -4.325 8.743 1.00 0.00 H ATOM 1545 H GLN A 819 30.063 -6.251 10.506 1.00 0.00 H ATOM 1546 N PHE A 820 28.809 -3.779 12.176 1.00 30.99 N ATOM 1547 CA PHE A 820 27.979 -2.926 13.006 1.00 27.36 C ATOM 1548 C PHE A 820 28.343 -3.128 14.468 1.00 29.58 C ATOM 1549 O PHE A 820 28.981 -4.118 14.845 1.00 26.99 O ATOM 1550 CB PHE A 820 26.499 -3.195 12.759 1.00 23.62 C ATOM 1551 CG PHE A 820 25.989 -2.549 11.511 1.00 29.40 C ATOM 1552 CD1 PHE A 820 26.196 -3.151 10.272 1.00 25.82 C ATOM 1553 CD2 PHE A 820 25.341 -1.328 11.562 1.00 23.19 C ATOM 1554 CE1 PHE A 820 25.745 -2.551 9.111 1.00 28.71 C ATOM 1555 CE2 PHE A 820 24.891 -0.727 10.397 1.00 28.46 C ATOM 1556 CZ PHE A 820 25.095 -1.336 9.168 1.00 22.51 C ATOM 1557 H PHE A 820 28.463 -4.709 11.864 1.00 0.00 H ATOM 1558 N ALA A 821 27.979 -2.136 15.288 1.00 23.50 N ATOM 1559 CA ALA A 821 28.255 -2.231 16.716 1.00 23.66 C ATOM 1560 C ALA A 821 27.185 -3.021 17.446 1.00 27.89 C ATOM 1561 O ALA A 821 27.485 -3.693 18.441 1.00 30.77 O ATOM 1562 CB ALA A 821 28.381 -0.841 17.337 1.00 26.43 C ATOM 1563 H ALA A 821 27.499 -1.296 14.906 1.00 0.00 H ATOM 1564 N GLY A 822 25.946 -2.973 16.974 1.00 23.21 N ATOM 1565 CA GLY A 822 24.916 -3.742 17.646 1.00 24.24 C ATOM 1566 C GLY A 822 23.626 -3.689 16.868 1.00 19.86 C ATOM 1567 O GLY A 822 23.535 -3.055 15.817 1.00 21.44 O ATOM 1568 H GLY A 822 25.718 -2.396 16.139 1.00 0.00 H ATOM 1569 N ILE A 823 22.623 -4.370 17.409 1.00 19.58 N ATOM 1570 CA ILE A 823 21.338 -4.544 16.751 1.00 21.43 C ATOM 1571 C ILE A 823 20.288 -3.855 17.607 1.00 22.49 C ATOM 1572 O ILE A 823 20.266 -4.025 18.828 1.00 19.54 O ATOM 1573 CB ILE A 823 21.002 -6.035 16.534 1.00 20.18 C ATOM 1574 CG1 ILE A 823 22.125 -6.709 15.744 1.00 21.64 C ATOM 1575 CG2 ILE A 823 19.685 -6.182 15.774 1.00 20.23 C ATOM 1576 CD1 ILE A 823 22.226 -8.193 15.981 1.00 25.88 C ATOM 1577 H ILE A 823 22.763 -4.799 18.346 1.00 0.00 H ATOM 1578 N PHE A 824 19.434 -3.071 16.958 1.00 22.77 N ATOM 1579 CA PHE A 824 18.504 -2.150 17.598 1.00 18.40 C ATOM 1580 C PHE A 824 17.128 -2.468 17.038 1.00 18.31 C ATOM 1581 O PHE A 824 16.949 -2.463 15.818 1.00 19.96 O ATOM 1582 CB PHE A 824 18.917 -0.709 17.270 1.00 17.99 C ATOM 1583 CG PHE A 824 18.116 0.367 17.943 1.00 17.12 C ATOM 1584 CD1 PHE A 824 18.016 0.426 19.318 1.00 18.62 C ATOM 1585 CD2 PHE A 824 17.550 1.395 17.187 1.00 22.15 C ATOM 1586 CE1 PHE A 824 17.325 1.468 19.945 1.00 17.74 C ATOM 1587 CE2 PHE A 824 16.860 2.430 17.805 1.00 23.19 C ATOM 1588 CZ PHE A 824 16.744 2.451 19.200 1.00 21.51 C ATOM 1589 H PHE A 824 19.429 -3.118 15.919 1.00 0.00 H ATOM 1590 N THR A 825 16.165 -2.756 17.909 1.00 19.56 N ATOM 1591 CA THR A 825 14.822 -3.070 17.440 1.00 21.40 C ATOM 1592 C THR A 825 13.820 -2.732 18.531 1.00 22.16 C ATOM 1593 O THR A 825 14.149 -2.755 19.723 1.00 25.03 O ATOM 1594 CB THR A 825 14.690 -4.556 17.025 1.00 25.64 C ATOM 1595 OG1 THR A 825 13.414 -4.779 16.412 1.00 26.60 O ATOM 1596 CG2 THR A 825 14.811 -5.476 18.224 1.00 23.15 C ATOM 1597 HG1 THR A 825 13.330 -4.206 15.609 1.00 0.00 H ATOM 1598 H THR A 825 16.371 -2.757 18.928 1.00 0.00 H ATOM 1599 N THR A 826 12.600 -2.388 18.113 1.00 19.01 N ATOM 1600 CA THR A 826 11.480 -2.253 19.034 1.00 21.33 C ATOM 1601 C THR A 826 10.580 -3.469 18.859 1.00 22.41 C ATOM 1602 O THR A 826 10.024 -3.680 17.782 1.00 22.50 O ATOM 1603 CB THR A 826 10.705 -0.954 18.800 1.00 18.57 C ATOM 1604 OG1 THR A 826 11.611 0.135 18.924 1.00 14.93 O ATOM 1605 CG2 THR A 826 9.650 -0.753 19.871 1.00 16.26 C ATOM 1606 HG1 THR A 826 12.331 0.042 18.250 1.00 0.00 H ATOM 1607 H THR A 826 12.445 -2.211 17.100 1.00 0.00 H ATOM 1608 N ASN A 827 10.447 -4.265 19.908 1.00 20.86 N ATOM 1609 CA ASN A 827 9.670 -5.493 19.856 1.00 20.11 C ATOM 1610 C ASN A 827 8.295 -5.238 20.455 1.00 19.70 C ATOM 1611 O ASN A 827 8.187 -4.772 21.595 1.00 16.33 O ATOM 1612 CB ASN A 827 10.413 -6.615 20.571 1.00 17.16 C ATOM 1613 CG ASN A 827 11.534 -7.174 19.704 1.00 21.46 C ATOM 1614 OD1 ASN A 827 11.311 -7.490 18.548 1.00 24.51 O ATOM 1615 ND2 ASN A 827 12.744 -7.220 20.231 1.00 19.14 N ATOM 1616 HD22 ASN A 827 12.890 -6.941 21.222 1.00 0.00 H ATOM 1617 HD21 ASN A 827 13.551 -7.535 19.655 1.00 0.00 H ATOM 1618 H ASN A 827 10.914 -4.003 20.800 1.00 0.00 H ATOM 1619 N THR A 828 7.247 -5.520 19.668 1.00 17.94 N ATOM 1620 CA THR A 828 5.887 -5.134 20.023 1.00 21.54 C ATOM 1621 C THR A 828 4.961 -6.317 20.269 1.00 22.25 C ATOM 1622 O THR A 828 3.780 -6.114 20.570 1.00 20.07 O ATOM 1623 CB THR A 828 5.290 -4.243 18.924 1.00 22.37 C ATOM 1624 OG1 THR A 828 5.445 -4.894 17.671 1.00 23.55 O ATOM 1625 CG2 THR A 828 6.008 -2.877 18.874 1.00 19.69 C ATOM 1626 HG1 THR A 828 4.972 -5.764 17.692 1.00 0.00 H ATOM 1627 H THR A 828 7.409 -6.030 18.776 1.00 0.00 H ATOM 1628 N SER A 829 5.450 -7.538 20.149 1.00 22.72 N ATOM 1629 CA SER A 829 4.622 -8.672 20.507 1.00 23.17 C ATOM 1630 C SER A 829 5.302 -9.467 21.609 1.00 22.14 C ATOM 1631 O SER A 829 6.530 -9.422 21.753 1.00 19.08 O ATOM 1632 CB SER A 829 4.359 -9.585 19.306 1.00 20.84 C ATOM 1633 OG SER A 829 5.509 -10.355 19.004 1.00 23.51 O ATOM 1634 HG SER A 829 6.263 -9.750 18.789 1.00 0.00 H ATOM 1635 H SER A 829 6.419 -7.684 19.801 1.00 0.00 H ATOM 1636 N PRO A 830 4.531 -10.203 22.404 1.00 22.13 N ATOM 1637 CA PRO A 830 5.153 -10.979 23.484 1.00 21.40 C ATOM 1638 C PRO A 830 6.203 -11.969 22.991 1.00 21.57 C ATOM 1639 O PRO A 830 7.259 -12.095 23.624 1.00 19.37 O ATOM 1640 CB PRO A 830 3.948 -11.670 24.132 1.00 27.73 C ATOM 1641 CG PRO A 830 2.807 -10.769 23.840 1.00 23.90 C ATOM 1642 CD PRO A 830 3.061 -10.251 22.458 1.00 21.89 C ATOM 1643 N LEU A 831 5.968 -12.632 21.852 1.00 18.46 N ATOM 1644 CA LEU A 831 6.923 -13.619 21.354 1.00 24.01 C ATOM 1645 C LEU A 831 8.242 -12.967 20.977 1.00 18.49 C ATOM 1646 O LEU A 831 9.312 -13.487 21.306 1.00 19.32 O ATOM 1647 CB LEU A 831 6.356 -14.372 20.142 1.00 21.51 C ATOM 1648 CG LEU A 831 7.264 -15.362 19.392 1.00 21.78 C ATOM 1649 CD1 LEU A 831 7.851 -16.441 20.278 1.00 18.18 C ATOM 1650 CD2 LEU A 831 6.472 -16.037 18.262 1.00 31.82 C ATOM 1651 H LEU A 831 5.097 -12.443 21.316 1.00 0.00 H ATOM 1652 N THR A 832 8.196 -11.867 20.216 1.00 17.31 N ATOM 1653 CA THR A 832 9.461 -11.243 19.818 1.00 18.40 C ATOM 1654 C THR A 832 10.157 -10.607 21.010 1.00 15.30 C ATOM 1655 O THR A 832 11.387 -10.571 21.055 1.00 17.03 O ATOM 1656 CB THR A 832 9.262 -10.195 18.726 1.00 21.53 C ATOM 1657 OG1 THR A 832 8.285 -9.222 19.145 1.00 21.24 O ATOM 1658 CG2 THR A 832 8.855 -10.868 17.384 1.00 14.77 C ATOM 1659 HG1 THR A 832 8.164 -8.548 18.430 1.00 0.00 H ATOM 1660 H THR A 832 7.285 -11.465 19.915 1.00 0.00 H ATOM 1661 N GLN A 833 9.387 -10.111 21.974 1.00 17.72 N ATOM 1662 CA GLN A 833 9.966 -9.576 23.206 1.00 19.31 C ATOM 1663 C GLN A 833 10.673 -10.660 24.004 1.00 20.76 C ATOM 1664 O GLN A 833 11.795 -10.452 24.487 1.00 19.30 O ATOM 1665 CB GLN A 833 8.871 -8.916 24.043 1.00 17.95 C ATOM 1666 CG GLN A 833 8.370 -7.619 23.408 1.00 17.99 C ATOM 1667 CD GLN A 833 7.098 -7.126 24.027 1.00 20.54 C ATOM 1668 OE1 GLN A 833 6.614 -7.703 24.995 1.00 23.42 O ATOM 1669 NE2 GLN A 833 6.522 -6.072 23.453 1.00 20.15 N ATOM 1670 HE22 GLN A 833 6.971 -5.616 22.633 1.00 0.00 H ATOM 1671 HE21 GLN A 833 5.623 -5.705 23.824 1.00 0.00 H ATOM 1672 H GLN A 833 8.354 -10.103 21.850 1.00 0.00 H ATOM 1673 N GLN A 834 10.037 -11.834 24.144 1.00 19.47 N ATOM 1674 CA GLN A 834 10.646 -12.922 24.901 1.00 17.61 C ATOM 1675 C GLN A 834 11.851 -13.510 24.168 1.00 19.21 C ATOM 1676 O GLN A 834 12.865 -13.840 24.796 1.00 19.45 O ATOM 1677 CB GLN A 834 9.600 -14.003 25.186 1.00 22.55 C ATOM 1678 CG GLN A 834 10.142 -15.228 25.961 1.00 22.36 C ATOM 1679 CD GLN A 834 9.030 -16.152 26.427 1.00 23.07 C ATOM 1680 OE1 GLN A 834 7.983 -16.228 25.789 1.00 29.11 O ATOM 1681 NE2 GLN A 834 9.254 -16.865 27.529 1.00 20.79 N ATOM 1682 HE22 GLN A 834 10.156 -16.768 28.037 1.00 0.00 H ATOM 1683 HE21 GLN A 834 8.527 -17.519 27.882 1.00 0.00 H ATOM 1684 H GLN A 834 9.102 -11.969 23.709 1.00 0.00 H ATOM 1685 N LEU A 835 11.768 -13.651 22.841 1.00 17.55 N ATOM 1686 CA LEU A 835 12.938 -14.082 22.077 1.00 20.20 C ATOM 1687 C LEU A 835 14.108 -13.126 22.273 1.00 21.75 C ATOM 1688 O LEU A 835 15.237 -13.560 22.518 1.00 19.47 O ATOM 1689 CB LEU A 835 12.601 -14.209 20.593 1.00 16.30 C ATOM 1690 CG LEU A 835 11.800 -15.470 20.219 1.00 17.94 C ATOM 1691 CD1 LEU A 835 11.403 -15.432 18.753 1.00 19.90 C ATOM 1692 CD2 LEU A 835 12.584 -16.746 20.526 1.00 19.24 C ATOM 1693 H LEU A 835 10.871 -13.454 22.352 1.00 0.00 H ATOM 1694 N ALA A 836 13.859 -11.816 22.152 1.00 18.68 N ATOM 1695 CA ALA A 836 14.920 -10.846 22.412 1.00 17.98 C ATOM 1696 C ALA A 836 15.566 -11.095 23.768 1.00 18.70 C ATOM 1697 O ALA A 836 16.792 -11.073 23.901 1.00 20.42 O ATOM 1698 CB ALA A 836 14.356 -9.422 22.350 1.00 19.72 C ATOM 1699 H ALA A 836 12.912 -11.490 21.873 1.00 0.00 H ATOM 1700 N ASP A 837 14.754 -11.349 24.785 1.00 18.77 N ATOM 1701 CA ASP A 837 15.297 -11.542 26.123 1.00 19.26 C ATOM 1702 C ASP A 837 16.155 -12.806 26.225 1.00 26.51 C ATOM 1703 O ASP A 837 17.236 -12.770 26.826 1.00 23.78 O ATOM 1704 CB ASP A 837 14.153 -11.546 27.129 1.00 26.69 C ATOM 1705 CG ASP A 837 13.723 -10.117 27.505 1.00 41.95 C ATOM 1706 OD1 ASP A 837 14.398 -9.478 28.350 1.00 49.80 O ATOM 1707 OD2 ASP A 837 12.731 -9.615 26.932 1.00 43.90 O ATOM 1708 H ASP A 837 13.728 -11.411 24.627 1.00 0.00 H ATOM 1709 N VAL A 838 15.725 -13.929 25.632 1.00 21.12 N ATOM 1710 CA VAL A 838 16.565 -15.125 25.747 1.00 18.91 C ATOM 1711 C VAL A 838 17.786 -15.028 24.852 1.00 19.04 C ATOM 1712 O VAL A 838 18.757 -15.755 25.058 1.00 21.81 O ATOM 1713 CB VAL A 838 15.779 -16.424 25.465 1.00 20.26 C ATOM 1714 CG1 VAL A 838 14.692 -16.583 26.497 1.00 22.01 C ATOM 1715 CG2 VAL A 838 15.213 -16.470 24.035 1.00 14.90 C ATOM 1716 H VAL A 838 14.827 -13.951 25.109 1.00 0.00 H ATOM 1717 N TYR A 839 17.781 -14.130 23.869 1.00 21.47 N ATOM 1718 CA TYR A 839 18.986 -13.856 23.097 1.00 20.65 C ATOM 1719 C TYR A 839 19.821 -12.753 23.722 1.00 20.58 C ATOM 1720 O TYR A 839 20.744 -12.252 23.074 1.00 20.37 O ATOM 1721 CB TYR A 839 18.639 -13.496 21.651 1.00 19.64 C ATOM 1722 CG TYR A 839 18.450 -14.725 20.803 1.00 22.25 C ATOM 1723 CD1 TYR A 839 19.530 -15.335 20.185 1.00 24.06 C ATOM 1724 CD2 TYR A 839 17.194 -15.295 20.648 1.00 21.82 C ATOM 1725 CE1 TYR A 839 19.365 -16.473 19.405 1.00 22.17 C ATOM 1726 CE2 TYR A 839 17.014 -16.432 19.878 1.00 22.79 C ATOM 1727 CZ TYR A 839 18.104 -17.024 19.265 1.00 22.59 C ATOM 1728 OH TYR A 839 17.934 -18.165 18.503 1.00 22.10 O ATOM 1729 HH TYR A 839 18.810 -18.452 18.141 1.00 0.00 H ATOM 1730 H TYR A 839 16.904 -13.616 23.649 1.00 0.00 H ATOM 1731 N HIS A 840 19.506 -12.366 24.960 1.00 23.28 N ATOM 1732 CA HIS A 840 20.319 -11.438 25.752 1.00 24.08 C ATOM 1733 C HIS A 840 20.344 -10.022 25.163 1.00 22.65 C ATOM 1734 O HIS A 840 21.322 -9.286 25.325 1.00 19.66 O ATOM 1735 CB HIS A 840 21.742 -11.978 25.943 1.00 21.57 C ATOM 1736 CG HIS A 840 21.777 -13.393 26.430 1.00 24.26 C ATOM 1737 ND1 HIS A 840 22.175 -14.449 25.635 1.00 28.44 N ATOM 1738 CD2 HIS A 840 21.427 -13.930 27.622 1.00 23.29 C ATOM 1739 CE1 HIS A 840 22.082 -15.574 26.324 1.00 25.58 C ATOM 1740 NE2 HIS A 840 21.624 -15.287 27.531 1.00 22.97 N ATOM 1741 H HIS A 840 18.636 -12.744 25.386 1.00 0.00 H ATOM 1742 N TYR A 841 19.280 -9.622 24.479 1.00 20.98 N ATOM 1743 CA TYR A 841 19.104 -8.208 24.182 1.00 22.41 C ATOM 1744 C TYR A 841 18.907 -7.439 25.482 1.00 25.07 C ATOM 1745 O TYR A 841 18.214 -7.898 26.401 1.00 22.57 O ATOM 1746 CB TYR A 841 17.900 -7.995 23.262 1.00 17.26 C ATOM 1747 CG TYR A 841 18.204 -8.278 21.807 1.00 22.86 C ATOM 1748 CD1 TYR A 841 18.320 -9.590 21.347 1.00 23.15 C ATOM 1749 CD2 TYR A 841 18.404 -7.238 20.895 1.00 21.00 C ATOM 1750 CE1 TYR A 841 18.605 -9.860 20.005 1.00 22.08 C ATOM 1751 CE2 TYR A 841 18.688 -7.504 19.555 1.00 21.89 C ATOM 1752 CZ TYR A 841 18.801 -8.812 19.122 1.00 23.24 C ATOM 1753 OH TYR A 841 19.078 -9.078 17.795 1.00 21.94 O ATOM 1754 HH TYR A 841 19.124 -10.057 17.659 1.00 0.00 H ATOM 1755 H TYR A 841 18.575 -10.315 24.157 1.00 0.00 H ATOM 1756 N LYS A 842 19.519 -6.264 25.544 1.00 20.18 N ATOM 1757 CA LYS A 842 19.330 -5.334 26.649 1.00 24.86 C ATOM 1758 C LYS A 842 18.085 -4.478 26.419 1.00 22.29 C ATOM 1759 O LYS A 842 17.851 -3.960 25.323 1.00 20.08 O ATOM 1760 CB LYS A 842 20.585 -4.459 26.792 1.00 22.32 C ATOM 1761 CG LYS A 842 20.643 -3.588 28.030 1.00 35.49 C ATOM 1762 CD LYS A 842 22.024 -2.956 28.181 1.00 43.39 C ATOM 1763 CE LYS A 842 22.272 -2.501 29.615 1.00 50.95 C ATOM 1764 NZ LYS A 842 23.723 -2.512 29.970 1.00 50.07 N ATOM 1765 HZ1 LYS A 842 24.096 -3.477 29.869 1.00 0.00 H ATOM 1766 HZ2 LYS A 842 24.239 -1.871 29.334 1.00 0.00 H ATOM 1767 HZ3 LYS A 842 23.840 -2.195 30.954 1.00 0.00 H ATOM 1768 H LYS A 842 20.161 -5.995 24.771 1.00 0.00 H ATOM 1769 N THR A 843 17.293 -4.318 27.467 1.00 17.85 N ATOM 1770 CA THR A 843 16.109 -3.474 27.407 1.00 20.23 C ATOM 1771 C THR A 843 16.490 -2.013 27.658 1.00 20.31 C ATOM 1772 O THR A 843 17.018 -1.681 28.719 1.00 22.79 O ATOM 1773 CB THR A 843 15.088 -3.963 28.433 1.00 21.06 C ATOM 1774 OG1 THR A 843 14.497 -5.174 27.961 1.00 20.94 O ATOM 1775 CG2 THR A 843 13.994 -2.921 28.669 1.00 21.36 C ATOM 1776 HG1 THR A 843 15.202 -5.858 27.839 1.00 0.00 H ATOM 1777 H THR A 843 17.522 -4.808 28.355 1.00 0.00 H ATOM 1778 N LEU A 844 16.223 -1.138 26.691 1.00 22.03 N ATOM 1779 CA LEU A 844 16.454 0.292 26.878 1.00 23.49 C ATOM 1780 C LEU A 844 15.182 1.083 27.178 1.00 23.29 C ATOM 1781 O LEU A 844 15.268 2.199 27.706 1.00 24.45 O ATOM 1782 CB LEU A 844 17.141 0.871 25.641 1.00 22.78 C ATOM 1783 CG LEU A 844 18.483 0.199 25.327 1.00 24.64 C ATOM 1784 CD1 LEU A 844 19.275 0.976 24.268 1.00 21.42 C ATOM 1785 CD2 LEU A 844 19.294 0.006 26.605 1.00 22.65 C ATOM 1786 H LEU A 844 15.843 -1.479 25.785 1.00 0.00 H ATOM 1787 N LEU A 845 14.014 0.537 26.860 1.00 19.11 N ATOM 1788 CA LEU A 845 12.743 1.185 27.144 1.00 22.09 C ATOM 1789 C LEU A 845 11.670 0.109 27.172 1.00 22.84 C ATOM 1790 O LEU A 845 11.633 -0.750 26.288 1.00 24.64 O ATOM 1791 CB LEU A 845 12.395 2.241 26.083 1.00 18.81 C ATOM 1792 CG LEU A 845 11.082 3.025 26.240 1.00 24.93 C ATOM 1793 CD1 LEU A 845 11.134 4.002 27.402 1.00 26.76 C ATOM 1794 CD2 LEU A 845 10.705 3.768 24.969 1.00 24.34 C ATOM 1795 H LEU A 845 14.008 -0.390 26.389 1.00 0.00 H ATOM 1796 N ASN A 846 10.794 0.165 28.171 1.00 19.95 N ATOM 1797 CA ASN A 846 9.620 -0.703 28.242 1.00 21.50 C ATOM 1798 C ASN A 846 8.424 0.228 28.336 1.00 20.30 C ATOM 1799 O ASN A 846 8.042 0.638 29.432 1.00 21.11 O ATOM 1800 CB ASN A 846 9.692 -1.660 29.448 1.00 21.94 C ATOM 1801 CG ASN A 846 8.546 -2.663 29.473 1.00 25.25 C ATOM 1802 OD1 ASN A 846 7.438 -2.367 29.031 1.00 25.03 O ATOM 1803 ND2 ASN A 846 8.817 -3.865 29.979 1.00 22.36 N ATOM 1804 HD22 ASN A 846 9.769 -4.074 30.343 1.00 0.00 H ATOM 1805 HD21 ASN A 846 8.077 -4.595 30.010 1.00 0.00 H ATOM 1806 H ASN A 846 10.951 0.855 28.933 1.00 0.00 H ATOM 1807 N PHE A 847 7.805 0.549 27.211 1.00 22.17 N ATOM 1808 CA PHE A 847 6.790 1.595 27.210 1.00 21.80 C ATOM 1809 C PHE A 847 5.400 0.980 27.139 1.00 22.29 C ATOM 1810 O PHE A 847 5.161 0.054 26.360 1.00 21.55 O ATOM 1811 CB PHE A 847 7.011 2.584 26.065 1.00 16.72 C ATOM 1812 CG PHE A 847 6.217 3.854 26.213 1.00 23.28 C ATOM 1813 CD1 PHE A 847 6.708 4.918 26.956 1.00 18.82 C ATOM 1814 CD2 PHE A 847 4.966 3.970 25.640 1.00 20.13 C ATOM 1815 CE1 PHE A 847 5.955 6.083 27.104 1.00 21.41 C ATOM 1816 CE2 PHE A 847 4.210 5.121 25.806 1.00 23.53 C ATOM 1817 CZ PHE A 847 4.708 6.169 26.540 1.00 21.05 C ATOM 1818 H PHE A 847 8.043 0.055 26.327 1.00 0.00 H ATOM 1819 N GLN A 848 4.493 1.498 27.960 1.00 21.78 N ATOM 1820 CA GLN A 848 3.095 1.081 27.970 1.00 21.96 C ATOM 1821 C GLN A 848 2.370 1.740 26.806 1.00 21.02 C ATOM 1822 O GLN A 848 2.094 2.943 26.844 1.00 23.55 O ATOM 1823 CB GLN A 848 2.453 1.456 29.300 1.00 24.68 C ATOM 1824 CG GLN A 848 1.076 0.868 29.546 1.00 26.25 C ATOM 1825 CD GLN A 848 0.650 1.038 30.995 1.00 25.64 C ATOM 1826 OE1 GLN A 848 1.393 0.705 31.904 1.00 29.57 O ATOM 1827 NE2 GLN A 848 -0.533 1.593 31.209 1.00 26.41 N ATOM 1828 HE22 GLN A 848 -1.135 1.862 30.404 1.00 0.00 H ATOM 1829 HE21 GLN A 848 -0.861 1.760 32.182 1.00 0.00 H ATOM 1830 H GLN A 848 4.794 2.236 28.628 1.00 0.00 H ATOM 1831 N VAL A 849 2.017 0.949 25.787 1.00 22.72 N ATOM 1832 CA VAL A 849 1.573 1.537 24.524 1.00 21.10 C ATOM 1833 C VAL A 849 0.282 2.332 24.695 1.00 25.49 C ATOM 1834 O VAL A 849 0.063 3.303 23.973 1.00 22.47 O ATOM 1835 CB VAL A 849 1.436 0.468 23.428 1.00 23.16 C ATOM 1836 CG1 VAL A 849 2.636 -0.497 23.457 1.00 20.91 C ATOM 1837 CG2 VAL A 849 0.120 -0.269 23.549 1.00 23.93 C ATOM 1838 H VAL A 849 2.058 -0.085 25.893 1.00 0.00 H ATOM 1839 N ASN A 850 -0.576 1.975 25.663 1.00 26.99 N ATOM 1840 CA ASN A 850 -1.786 2.787 25.792 1.00 25.08 C ATOM 1841 C ASN A 850 -1.538 4.159 26.429 1.00 26.16 C ATOM 1842 O ASN A 850 -2.494 4.915 26.576 1.00 24.53 O ATOM 1843 CB ASN A 850 -2.894 2.053 26.568 1.00 22.11 C ATOM 1844 CG ASN A 850 -2.559 1.785 28.027 1.00 27.40 C ATOM 1845 OD1 ASN A 850 -1.830 2.535 28.678 1.00 28.49 O ATOM 1846 ND2 ASN A 850 -3.128 0.695 28.562 1.00 28.34 N ATOM 1847 HD22 ASN A 850 -3.737 0.087 27.978 1.00 0.00 H ATOM 1848 HD21 ASN A 850 -2.960 0.458 29.560 1.00 0.00 H ATOM 1849 H ASN A 850 -0.391 1.165 26.288 1.00 0.00 H ATOM 1850 N GLU A 851 -0.314 4.505 26.812 1.00 22.57 N ATOM 1851 CA GLU A 851 -0.039 5.856 27.286 1.00 28.89 C ATOM 1852 C GLU A 851 0.465 6.790 26.186 1.00 25.77 C ATOM 1853 O GLU A 851 0.658 7.978 26.454 1.00 27.47 O ATOM 1854 CB GLU A 851 0.984 5.828 28.430 1.00 28.37 C ATOM 1855 CG GLU A 851 0.582 4.933 29.609 1.00 35.83 C ATOM 1856 CD GLU A 851 -0.263 5.656 30.649 1.00 43.94 C ATOM 1857 OE1 GLU A 851 -0.265 5.216 31.826 1.00 48.34 O ATOM 1858 OE2 GLU A 851 -0.918 6.670 30.301 1.00 50.43 O ATOM 1859 H GLU A 851 0.455 3.806 26.773 1.00 0.00 H ATOM 1860 N TYR A 852 0.690 6.303 24.966 1.00 24.28 N ATOM 1861 CA TYR A 852 1.225 7.186 23.937 1.00 24.59 C ATOM 1862 C TYR A 852 0.170 8.184 23.480 1.00 24.15 C ATOM 1863 O TYR A 852 -0.962 7.810 23.166 1.00 22.82 O ATOM 1864 CB TYR A 852 1.724 6.400 22.734 1.00 20.37 C ATOM 1865 CG TYR A 852 2.191 7.328 21.647 1.00 26.53 C ATOM 1866 CD1 TYR A 852 3.223 8.227 21.883 1.00 24.20 C ATOM 1867 CD2 TYR A 852 1.583 7.335 20.390 1.00 23.62 C ATOM 1868 CE1 TYR A 852 3.657 9.103 20.889 1.00 23.13 C ATOM 1869 CE2 TYR A 852 2.010 8.203 19.393 1.00 21.19 C ATOM 1870 CZ TYR A 852 3.051 9.083 19.655 1.00 25.50 C ATOM 1871 OH TYR A 852 3.486 9.959 18.687 1.00 23.89 O ATOM 1872 HH TYR A 852 4.229 10.505 19.048 1.00 0.00 H ATOM 1873 H TYR A 852 0.487 5.306 24.751 1.00 0.00 H ATOM 1874 N VAL A 853 0.547 9.457 23.420 1.00 26.84 N ATOM 1875 CA VAL A 853 -0.356 10.529 23.016 1.00 26.82 C ATOM 1876 C VAL A 853 0.076 11.049 21.657 1.00 25.39 C ATOM 1877 O VAL A 853 1.239 11.425 21.461 1.00 26.10 O ATOM 1878 CB VAL A 853 -0.398 11.669 24.050 1.00 29.50 C ATOM 1879 CG1 VAL A 853 -1.497 12.670 23.676 1.00 32.93 C ATOM 1880 CG2 VAL A 853 -0.651 11.106 25.410 1.00 23.75 C ATOM 1881 H VAL A 853 1.527 9.699 23.672 1.00 0.00 H ATOM 1882 N HIS A 854 -0.867 11.052 20.725 1.00 25.79 N ATOM 1883 CA HIS A 854 -0.713 11.570 19.379 1.00 29.87 C ATOM 1884 C HIS A 854 -0.706 13.105 19.410 1.00 29.22 C ATOM 1885 O HIS A 854 -1.018 13.734 20.422 1.00 25.33 O ATOM 1886 CB HIS A 854 -1.848 11.013 18.512 1.00 31.12 C ATOM 1887 CG HIS A 854 -1.738 11.338 17.059 1.00 37.84 C ATOM 1888 ND1 HIS A 854 -0.678 10.927 16.281 1.00 41.04 N ATOM 1889 CD2 HIS A 854 -2.567 12.021 16.236 1.00 39.76 C ATOM 1890 CE1 HIS A 854 -0.849 11.363 15.046 1.00 44.04 C ATOM 1891 NE2 HIS A 854 -1.988 12.027 14.991 1.00 37.23 N ATOM 1892 H HIS A 854 -1.792 10.650 20.980 1.00 0.00 H ATOM 1893 N SER A 855 -0.343 13.710 18.279 1.00 30.69 N ATOM 1894 CA SER A 855 -0.296 15.167 18.203 1.00 32.36 C ATOM 1895 C SER A 855 -1.653 15.819 18.431 1.00 33.64 C ATOM 1896 O SER A 855 -1.707 16.991 18.825 1.00 33.42 O ATOM 1897 CB SER A 855 0.254 15.601 16.852 1.00 32.15 C ATOM 1898 OG SER A 855 -0.471 14.991 15.809 1.00 38.06 O ATOM 1899 HG SER A 855 -1.423 15.256 15.871 1.00 0.00 H ATOM 1900 H SER A 855 -0.092 13.141 17.446 1.00 0.00 H ATOM 1901 N ASP A 856 -2.753 15.107 18.198 1.00 34.71 N ATOM 1902 CA ASP A 856 -4.070 15.693 18.407 1.00 31.08 C ATOM 1903 C ASP A 856 -4.595 15.450 19.807 1.00 32.24 C ATOM 1904 O ASP A 856 -5.795 15.600 20.041 1.00 42.94 O ATOM 1905 CB ASP A 856 -5.066 15.183 17.358 1.00 33.23 C ATOM 1906 CG ASP A 856 -5.311 13.679 17.434 1.00 37.98 C ATOM 1907 OD1 ASP A 856 -5.073 13.047 18.482 1.00 39.78 O ATOM 1908 OD2 ASP A 856 -5.760 13.119 16.419 1.00 42.46 O ATOM 1909 H ASP A 856 -2.672 14.125 17.864 1.00 0.00 H ATOM 1910 N GLY A 857 -3.728 15.060 20.735 1.00 30.34 N ATOM 1911 CA GLY A 857 -4.123 14.801 22.096 1.00 31.70 C ATOM 1912 C GLY A 857 -4.775 13.457 22.336 1.00 36.72 C ATOM 1913 O GLY A 857 -4.982 13.089 23.500 1.00 32.42 O ATOM 1914 H GLY A 857 -2.730 14.937 20.470 1.00 0.00 H ATOM 1915 N SER A 858 -5.117 12.712 21.289 1.00 29.40 N ATOM 1916 CA SER A 858 -5.731 11.409 21.493 1.00 34.54 C ATOM 1917 C SER A 858 -4.678 10.344 21.807 1.00 33.28 C ATOM 1918 O SER A 858 -3.472 10.556 21.663 1.00 31.69 O ATOM 1919 CB SER A 858 -6.530 10.993 20.261 1.00 32.41 C ATOM 1920 OG SER A 858 -5.660 10.773 19.170 1.00 34.31 O ATOM 1921 HG SER A 858 -5.165 11.607 18.971 1.00 0.00 H ATOM 1922 H SER A 858 -4.946 13.061 20.324 1.00 0.00 H ATOM 1923 N ARG A 859 -5.160 9.177 22.229 1.00 33.71 N ATOM 1924 CA ARG A 859 -4.321 8.007 22.485 1.00 31.51 C ATOM 1925 C ARG A 859 -4.689 6.918 21.487 1.00 30.92 C ATOM 1926 O ARG A 859 -5.657 6.171 21.712 1.00 36.12 O ATOM 1927 CB ARG A 859 -4.498 7.507 23.921 1.00 30.49 C ATOM 1928 CG ARG A 859 -4.252 8.582 24.973 1.00 34.46 C ATOM 1929 CD ARG A 859 -4.638 8.131 26.396 1.00 40.17 C ATOM 1930 NE ARG A 859 -3.431 8.001 27.211 1.00 50.38 N ATOM 1931 CZ ARG A 859 -2.782 9.023 27.773 1.00 54.22 C ATOM 1932 NH1 ARG A 859 -3.248 10.262 27.630 1.00 52.77 N ATOM 1933 NH2 ARG A 859 -1.667 8.811 28.485 1.00 39.53 N ATOM 1934 HE ARG A 859 -3.051 7.045 27.364 1.00 0.00 H ATOM 1935 HH12 ARG A 859 -2.745 11.061 28.067 1.00 0.00 H ATOM 1936 HH11 ARG A 859 -4.115 10.431 27.082 1.00 0.00 H ATOM 1937 HH22 ARG A 859 -1.167 9.613 28.920 1.00 0.00 H ATOM 1938 HH21 ARG A 859 -1.301 7.845 28.603 1.00 0.00 H ATOM 1939 H ARG A 859 -6.185 9.093 22.384 1.00 0.00 H ATOM 1940 N PRO A 860 -3.959 6.784 20.378 1.00 25.73 N ATOM 1941 CA PRO A 860 -4.364 5.817 19.339 1.00 27.38 C ATOM 1942 C PRO A 860 -4.403 4.371 19.813 1.00 29.86 C ATOM 1943 O PRO A 860 -5.226 3.596 19.312 1.00 28.19 O ATOM 1944 CB PRO A 860 -3.315 6.019 18.237 1.00 26.94 C ATOM 1945 CG PRO A 860 -2.157 6.700 18.903 1.00 31.27 C ATOM 1946 CD PRO A 860 -2.764 7.549 20.007 1.00 28.83 C ATOM 1947 N PHE A 861 -3.542 3.982 20.760 1.00 26.38 N ATOM 1948 CA PHE A 861 -3.561 2.651 21.359 1.00 29.23 C ATOM 1949 C PHE A 861 -4.178 2.662 22.757 1.00 32.99 C ATOM 1950 O PHE A 861 -3.832 1.817 23.589 1.00 31.65 O ATOM 1951 CB PHE A 861 -2.148 2.062 21.421 1.00 29.13 C ATOM 1952 CG PHE A 861 -1.284 2.447 20.258 1.00 26.44 C ATOM 1953 CD1 PHE A 861 -1.557 1.952 18.989 1.00 30.42 C ATOM 1954 CD2 PHE A 861 -0.205 3.311 20.429 1.00 28.19 C ATOM 1955 CE1 PHE A 861 -0.779 2.310 17.897 1.00 26.04 C ATOM 1956 CE2 PHE A 861 0.580 3.689 19.338 1.00 26.31 C ATOM 1957 CZ PHE A 861 0.288 3.188 18.070 1.00 29.31 C ATOM 1958 H PHE A 861 -2.824 4.661 21.085 1.00 0.00 H ATOM 1959 N GLY A 862 -5.085 3.610 23.032 1.00 29.69 N ATOM 1960 CA GLY A 862 -5.570 3.786 24.390 1.00 29.65 C ATOM 1961 C GLY A 862 -6.455 2.649 24.856 1.00 32.03 C ATOM 1962 O GLY A 862 -6.546 2.378 26.059 1.00 33.26 O ATOM 1963 H GLY A 862 -5.443 4.222 22.271 1.00 0.00 H ATOM 1964 N ASP A 863 -7.098 1.955 23.921 1.00 27.13 N ATOM 1965 CA ASP A 863 -7.907 0.793 24.269 1.00 28.35 C ATOM 1966 C ASP A 863 -7.076 -0.444 24.614 1.00 33.40 C ATOM 1967 O ASP A 863 -7.619 -1.387 25.193 1.00 36.53 O ATOM 1968 CB ASP A 863 -8.860 0.455 23.114 1.00 33.52 C ATOM 1969 CG ASP A 863 -9.926 1.526 22.889 1.00 39.98 C ATOM 1970 OD1 ASP A 863 -10.366 2.171 23.870 1.00 40.25 O ATOM 1971 OD2 ASP A 863 -10.327 1.716 21.721 1.00 44.05 O ATOM 1972 H ASP A 863 -7.022 2.246 22.925 1.00 0.00 H ATOM 1973 N ALA A 864 -5.789 -0.480 24.267 1.00 31.93 N ATOM 1974 CA ALA A 864 -4.984 -1.670 24.529 1.00 30.94 C ATOM 1975 C ALA A 864 -4.855 -1.920 26.033 1.00 28.74 C ATOM 1976 O ALA A 864 -4.865 -0.975 26.831 1.00 32.53 O ATOM 1977 CB ALA A 864 -3.597 -1.527 23.906 1.00 29.85 C ATOM 1978 H ALA A 864 -5.355 0.345 23.806 1.00 0.00 H ATOM 1979 N PRO A 865 -4.717 -3.183 26.449 1.00 30.06 N ATOM 1980 CA PRO A 865 -4.522 -3.472 27.874 1.00 28.16 C ATOM 1981 C PRO A 865 -3.227 -2.868 28.384 1.00 28.58 C ATOM 1982 O PRO A 865 -2.282 -2.635 27.627 1.00 22.87 O ATOM 1983 CB PRO A 865 -4.468 -5.004 27.931 1.00 27.03 C ATOM 1984 CG PRO A 865 -4.158 -5.419 26.537 1.00 30.82 C ATOM 1985 CD PRO A 865 -4.769 -4.414 25.638 1.00 25.77 C ATOM 1986 N ASP A 866 -3.190 -2.627 29.698 1.00 23.16 N ATOM 1987 CA ASP A 866 -1.991 -2.054 30.307 1.00 27.91 C ATOM 1988 C ASP A 866 -0.776 -2.940 30.108 1.00 28.18 C ATOM 1989 O ASP A 866 0.355 -2.447 30.125 1.00 25.24 O ATOM 1990 CB ASP A 866 -2.207 -1.813 31.800 1.00 30.68 C ATOM 1991 CG ASP A 866 -3.069 -0.594 32.079 1.00 30.73 C ATOM 1992 OD1 ASP A 866 -3.555 0.041 31.117 1.00 35.48 O ATOM 1993 OD2 ASP A 866 -3.246 -0.258 33.266 1.00 35.65 O ATOM 1994 H ASP A 866 -4.017 -2.848 30.289 1.00 0.00 H ATOM 1995 N GLU A 867 -0.994 -4.233 29.900 1.00 30.86 N ATOM 1996 CA GLU A 867 0.076 -5.207 29.778 1.00 24.61 C ATOM 1997 C GLU A 867 0.766 -5.169 28.424 1.00 22.62 C ATOM 1998 O GLU A 867 1.864 -5.712 28.306 1.00 29.66 O ATOM 1999 CB GLU A 867 -0.482 -6.612 30.027 1.00 30.44 C ATOM 2000 CG GLU A 867 -0.974 -6.856 31.469 1.00 36.33 C ATOM 2001 CD GLU A 867 -2.276 -6.118 31.826 1.00 40.36 C ATOM 2002 OE1 GLU A 867 -3.115 -5.898 30.919 1.00 33.23 O ATOM 2003 OE2 GLU A 867 -2.453 -5.759 33.021 1.00 42.71 O ATOM 2004 H GLU A 867 -1.977 -4.564 29.821 1.00 0.00 H ATOM 2005 N GLN A 868 0.170 -4.550 27.403 1.00 23.60 N ATOM 2006 CA GLN A 868 0.809 -4.498 26.085 1.00 23.38 C ATOM 2007 C GLN A 868 1.905 -3.437 26.089 1.00 20.61 C ATOM 2008 O GLN A 868 1.629 -2.244 26.288 1.00 21.78 O ATOM 2009 CB GLN A 868 -0.199 -4.224 24.968 1.00 20.43 C ATOM 2010 CG GLN A 868 0.461 -4.201 23.583 1.00 21.69 C ATOM 2011 CD GLN A 868 -0.505 -3.984 22.417 1.00 26.83 C ATOM 2012 OE1 GLN A 868 -1.717 -4.086 22.565 1.00 29.78 O ATOM 2013 NE2 GLN A 868 0.042 -3.699 21.248 1.00 26.54 N ATOM 2014 HE22 GLN A 868 1.076 -3.621 21.163 1.00 0.00 H ATOM 2015 HE21 GLN A 868 -0.561 -3.553 20.413 1.00 0.00 H ATOM 2016 H GLN A 868 -0.757 -4.100 27.544 1.00 0.00 H ATOM 2017 N ARG A 869 3.139 -3.881 25.859 1.00 22.56 N ATOM 2018 CA ARG A 869 4.338 -3.060 25.890 1.00 21.85 C ATOM 2019 C ARG A 869 4.941 -2.909 24.494 1.00 21.77 C ATOM 2020 O ARG A 869 4.720 -3.718 23.594 1.00 19.72 O ATOM 2021 CB ARG A 869 5.395 -3.665 26.830 1.00 22.06 C ATOM 2022 CG ARG A 869 4.865 -4.378 28.078 1.00 25.09 C ATOM 2023 CD ARG A 869 3.999 -3.474 28.952 1.00 27.54 C ATOM 2024 NE ARG A 869 4.791 -2.379 29.492 1.00 24.66 N ATOM 2025 CZ ARG A 869 4.311 -1.413 30.263 1.00 25.67 C ATOM 2026 NH1 ARG A 869 3.035 -1.393 30.582 1.00 26.19 N ATOM 2027 NH2 ARG A 869 5.114 -0.462 30.704 1.00 26.51 N ATOM 2028 HE ARG A 869 5.804 -2.352 29.257 1.00 0.00 H ATOM 2029 HH12 ARG A 869 2.662 -0.634 31.187 1.00 0.00 H ATOM 2030 HH11 ARG A 869 2.399 -2.136 30.229 1.00 0.00 H ATOM 2031 HH22 ARG A 869 4.739 0.296 31.309 1.00 0.00 H ATOM 2032 HH21 ARG A 869 6.122 -0.471 30.447 1.00 0.00 H ATOM 2033 H ARG A 869 3.254 -4.891 25.641 1.00 0.00 H ATOM 2034 N ALA A 870 5.691 -1.831 24.311 1.00 21.81 N ATOM 2035 CA ALA A 870 6.667 -1.729 23.237 1.00 17.46 C ATOM 2036 C ALA A 870 8.010 -1.672 23.936 1.00 22.46 C ATOM 2037 O ALA A 870 8.235 -0.795 24.780 1.00 24.29 O ATOM 2038 CB ALA A 870 6.448 -0.491 22.358 1.00 16.72 C ATOM 2039 H ALA A 870 5.577 -1.027 24.961 1.00 0.00 H ATOM 2040 N ILE A 871 8.882 -2.619 23.626 1.00 21.03 N ATOM 2041 CA ILE A 871 10.163 -2.729 24.306 1.00 19.99 C ATOM 2042 C ILE A 871 11.255 -2.460 23.291 1.00 19.37 C ATOM 2043 O ILE A 871 11.320 -3.123 22.244 1.00 16.03 O ATOM 2044 CB ILE A 871 10.342 -4.095 24.982 1.00 16.85 C ATOM 2045 CG1 ILE A 871 9.179 -4.312 25.982 1.00 22.07 C ATOM 2046 CG2 ILE A 871 11.684 -4.155 25.661 1.00 17.69 C ATOM 2047 CD1 ILE A 871 9.100 -5.699 26.547 1.00 24.91 C ATOM 2048 H ILE A 871 8.645 -3.301 22.878 1.00 0.00 H ATOM 2049 N VAL A 872 12.081 -1.467 23.591 1.00 15.75 N ATOM 2050 CA VAL A 872 13.215 -1.097 22.760 1.00 21.54 C ATOM 2051 C VAL A 872 14.383 -1.949 23.209 1.00 17.90 C ATOM 2052 O VAL A 872 14.813 -1.856 24.365 1.00 18.82 O ATOM 2053 CB VAL A 872 13.553 0.396 22.891 1.00 20.98 C ATOM 2054 CG1 VAL A 872 14.784 0.718 22.059 1.00 19.28 C ATOM 2055 CG2 VAL A 872 12.395 1.238 22.451 1.00 19.18 C ATOM 2056 H VAL A 872 11.909 -0.927 24.463 1.00 0.00 H ATOM 2057 N HIS A 873 14.896 -2.763 22.296 1.00 18.94 N ATOM 2058 CA HIS A 873 15.927 -3.749 22.585 1.00 20.14 C ATOM 2059 C HIS A 873 17.208 -3.394 21.847 1.00 17.75 C ATOM 2060 O HIS A 873 17.166 -2.888 20.724 1.00 19.23 O ATOM 2061 CB HIS A 873 15.475 -5.152 22.165 1.00 19.20 C ATOM 2062 CG HIS A 873 14.611 -5.841 23.174 1.00 19.45 C ATOM 2063 ND1 HIS A 873 13.319 -6.238 22.899 1.00 19.71 N ATOM 2064 CD2 HIS A 873 14.859 -6.225 24.450 1.00 20.95 C ATOM 2065 CE1 HIS A 873 12.802 -6.823 23.968 1.00 18.86 C ATOM 2066 NE2 HIS A 873 13.715 -6.824 24.924 1.00 19.08 N ATOM 2067 H HIS A 873 14.542 -2.693 21.321 1.00 0.00 H ATOM 2068 N TRP A 874 18.343 -3.722 22.467 1.00 19.74 N ATOM 2069 CA TRP A 874 19.671 -3.404 21.946 1.00 18.92 C ATOM 2070 C TRP A 874 20.638 -4.517 22.333 1.00 20.97 C ATOM 2071 O TRP A 874 20.718 -4.894 23.504 1.00 18.24 O ATOM 2072 CB TRP A 874 20.146 -2.055 22.515 1.00 19.77 C ATOM 2073 CG TRP A 874 21.619 -1.711 22.338 1.00 21.89 C ATOM 2074 CD1 TRP A 874 22.567 -1.639 23.322 1.00 22.64 C ATOM 2075 CD2 TRP A 874 22.293 -1.360 21.110 1.00 22.51 C ATOM 2076 NE1 TRP A 874 23.783 -1.262 22.784 1.00 26.55 N ATOM 2077 CE2 TRP A 874 23.644 -1.096 21.432 1.00 21.97 C ATOM 2078 CE3 TRP A 874 21.888 -1.262 19.777 1.00 20.35 C ATOM 2079 CZ2 TRP A 874 24.583 -0.734 20.470 1.00 22.18 C ATOM 2080 CZ3 TRP A 874 22.819 -0.886 18.827 1.00 20.83 C ATOM 2081 CH2 TRP A 874 24.150 -0.629 19.178 1.00 20.90 C ATOM 2082 HE1 TRP A 874 24.663 -1.126 23.321 1.00 0.00 H ATOM 2083 H TRP A 874 18.279 -4.232 23.371 1.00 0.00 H ATOM 2084 N LYS A 875 21.390 -5.028 21.370 1.00 20.66 N ATOM 2085 CA LYS A 875 22.377 -6.070 21.643 1.00 24.88 C ATOM 2086 C LYS A 875 23.674 -5.715 20.937 1.00 22.01 C ATOM 2087 O LYS A 875 23.723 -5.702 19.705 1.00 23.15 O ATOM 2088 CB LYS A 875 21.868 -7.438 21.180 1.00 22.31 C ATOM 2089 CG LYS A 875 22.759 -8.643 21.527 1.00 23.76 C ATOM 2090 CD LYS A 875 22.154 -9.898 20.882 1.00 25.35 C ATOM 2091 CE LYS A 875 22.891 -11.171 21.247 1.00 35.29 C ATOM 2092 NZ LYS A 875 24.162 -10.850 21.943 1.00 37.13 N ATOM 2093 HZ1 LYS A 875 24.763 -10.277 21.317 1.00 0.00 H ATOM 2094 HZ2 LYS A 875 23.955 -10.316 22.811 1.00 0.00 H ATOM 2095 HZ3 LYS A 875 24.655 -11.733 22.186 1.00 0.00 H ATOM 2096 H LYS A 875 21.275 -4.679 20.397 1.00 0.00 H ATOM 2097 N GLU A 876 24.720 -5.446 21.703 1.00 19.03 N ATOM 2098 CA GLU A 876 26.035 -5.252 21.106 1.00 29.12 C ATOM 2099 C GLU A 876 26.583 -6.572 20.571 1.00 29.33 C ATOM 2100 O GLU A 876 26.380 -7.631 21.172 1.00 24.88 O ATOM 2101 CB GLU A 876 26.991 -4.657 22.139 1.00 28.93 C ATOM 2102 CG GLU A 876 26.540 -3.289 22.603 1.00 34.84 C ATOM 2103 CD GLU A 876 27.487 -2.679 23.604 1.00 44.72 C ATOM 2104 OE1 GLU A 876 28.687 -3.027 23.573 1.00 48.90 O ATOM 2105 OE2 GLU A 876 27.028 -1.852 24.423 1.00 52.91 O ATOM 2106 H GLU A 876 24.603 -5.373 22.734 1.00 0.00 H ATOM 2107 N VAL A 877 27.278 -6.516 19.435 1.00 25.86 N ATOM 2108 CA VAL A 877 27.770 -7.762 18.833 1.00 33.52 C ATOM 2109 C VAL A 877 29.261 -7.997 19.106 1.00 35.68 C ATOM 2110 O VAL A 877 30.034 -7.051 19.297 1.00 41.02 O ATOM 2111 CB VAL A 877 27.501 -7.806 17.313 1.00 37.58 C ATOM 2112 CG1 VAL A 877 26.093 -7.326 16.991 1.00 33.85 C ATOM 2113 CG2 VAL A 877 28.552 -7.009 16.548 1.00 34.20 C ATOM 2114 H VAL A 877 27.470 -5.601 18.980 1.00 0.00 H TER 2115 VAL A 877 HETATM 2116 CA CA A 1 12.442 -7.815 16.430 1.00 56.58 CA HETATM 2117 O HOH 2 17.650 -9.661 -8.685 1.00 40.44 O HETATM 2118 O HOH 3 3.185 -6.807 17.021 1.00 28.66 O HETATM 2119 O HOH 4 25.937 -3.660 3.204 1.00 42.58 O HETATM 2120 O HOH 5 30.819 -5.385 14.788 1.00 34.56 O HETATM 2121 O HOH 6 19.258 3.625 2.977 1.00 31.86 O HETATM 2122 O HOH 7 -3.130 1.303 0.826 1.00 38.78 O HETATM 2123 O HOH 8 4.040 -26.141 7.420 1.00 32.01 O HETATM 2124 O HOH 9 -9.528 4.583 11.656 1.00 46.03 O HETATM 2125 O HOH 10 -6.894 2.555 20.650 1.00 31.38 O HETATM 2126 O HOH 11 11.925 -15.095 -6.185 1.00 43.42 O HETATM 2127 O HOH 12 14.659 -12.763 17.258 1.00 36.67 O HETATM 2128 O HOH 13 23.659 -19.136 1.371 1.00 44.49 O HETATM 2129 O HOH 14 15.105 -7.627 10.877 1.00 27.76 O HETATM 2130 O HOH 15 19.782 -19.452 17.532 1.00 29.83 O HETATM 2131 O HOH 16 24.070 -8.793 -1.893 1.00 48.72 O HETATM 2132 O HOH 17 11.741 0.705 -4.763 1.00 40.15 O HETATM 2133 O HOH 18 10.730 -8.272 27.563 1.00 36.48 O HETATM 2134 O HOH 19 1.274 -1.572 -2.674 1.00 41.80 O HETATM 2135 O HOH 20 -3.480 12.140 12.950 1.00 40.83 O HETATM 2136 O HOH 21 1.915 10.390 16.728 1.00 28.42 O HETATM 2137 O HOH 22 1.415 2.812 3.965 1.00 40.58 O HETATM 2138 O HOH 23 -1.644 -10.004 17.765 1.00 43.94 O HETATM 2139 O HOH 24 2.409 -3.766 15.783 1.00 42.86 O HETATM 2140 O HOH 25 7.632 10.468 17.149 1.00 26.48 O HETATM 2141 O HOH 26 23.771 -8.370 25.298 1.00 35.56 O HETATM 2142 O HOH 27 10.236 -28.917 4.298 1.00 40.89 O HETATM 2143 O HOH 28 15.995 -7.310 27.718 1.00 24.16 O HETATM 2144 O HOH 29 12.120 5.034 14.413 1.00 23.92 O HETATM 2145 O HOH 30 11.587 -17.054 28.764 1.00 28.46 O HETATM 2146 O HOH 31 -2.378 16.097 14.329 1.00 38.61 O HETATM 2147 O HOH 32 13.355 2.473 -2.763 1.00 37.76 O HETATM 2148 O HOH 33 12.759 -21.441 21.909 1.00 25.01 O HETATM 2149 O HOH 34 5.734 11.389 18.857 1.00 19.68 O HETATM 2150 O HOH 35 11.131 -25.403 16.396 1.00 30.20 O HETATM 2151 O HOH 36 13.576 -28.681 5.324 1.00 42.46 O HETATM 2152 O HOH 37 18.671 -3.727 3.500 1.00 22.99 O HETATM 2153 O HOH 38 18.688 11.100 14.257 1.00 36.05 O HETATM 2154 O HOH 39 25.101 3.023 6.245 1.00 38.13 O HETATM 2155 O HOH 40 24.446 -0.512 3.359 1.00 31.62 O HETATM 2156 O HOH 41 -5.983 3.666 -0.592 1.00 47.20 O HETATM 2157 O HOH 42 2.645 9.662 27.180 1.00 36.55 O HETATM 2158 O HOH 43 21.179 -8.409 -3.938 1.00 40.80 O HETATM 2159 O HOH 44 10.892 -0.073 14.846 1.00 31.91 O HETATM 2160 O HOH 45 4.134 -15.623 -2.081 1.00 41.78 O HETATM 2161 O HOH 46 29.294 7.499 19.585 1.00 40.93 O HETATM 2162 O HOH 47 -2.659 -6.430 23.616 1.00 32.56 O HETATM 2163 O HOH 48 24.618 3.618 12.501 1.00 25.04 O HETATM 2164 O HOH 49 20.830 1.359 5.675 1.00 24.91 O HETATM 2165 O HOH 50 -1.699 5.217 22.617 1.00 26.82 O HETATM 2166 O HOH 51 2.958 -3.602 21.337 1.00 18.63 O HETATM 2167 O HOH 52 12.244 -2.376 15.219 1.00 32.27 O HETATM 2168 O HOH 53 19.246 -1.786 30.371 1.00 37.82 O HETATM 2169 O HOH 54 20.645 -7.600 -0.284 1.00 33.82 O HETATM 2170 O HOH 55 25.559 10.139 14.218 1.00 35.65 O HETATM 2171 O HOH 56 18.957 -7.853 -6.824 1.00 33.12 O HETATM 2172 O HOH 57 8.021 -7.095 17.366 1.00 23.73 O HETATM 2173 O HOH 58 -0.536 -0.568 26.962 1.00 21.76 O HETATM 2174 O HOH 59 -0.305 15.712 22.257 1.00 32.62 O HETATM 2175 O HOH 60 1.948 -7.180 22.389 1.00 33.71 O HETATM 2176 O HOH 61 30.621 1.605 18.539 1.00 37.93 O HETATM 2177 O HOH 62 25.195 -15.990 14.545 1.00 32.75 O HETATM 2178 O HOH 63 8.959 -12.455 -5.363 1.00 41.15 O HETATM 2179 O HOH 64 13.416 -14.026 15.365 1.00 31.22 O HETATM 2180 O HOH 65 3.586 -6.567 25.135 1.00 26.12 O HETATM 2181 O HOH 66 9.817 4.890 13.212 1.00 25.62 O HETATM 2182 O HOH 67 15.774 4.014 14.938 1.00 25.67 O HETATM 2183 O HOH 68 8.727 -10.168 -7.090 1.00 35.13 O HETATM 2184 O HOH 69 12.065 -6.115 29.073 1.00 31.04 O HETATM 2185 O HOH 70 17.892 -29.941 2.954 1.00 47.27 O HETATM 2186 O HOH 71 15.962 4.540 12.374 1.00 26.36 O HETATM 2187 O HOH 72 3.609 12.015 22.912 1.00 25.55 O HETATM 2188 O HOH 73 25.172 -3.241 26.066 1.00 39.92 O HETATM 2189 O HOH 74 3.433 -7.417 29.956 1.00 36.76 O HETATM 2190 O HOH 75 32.705 -7.180 13.506 1.00 45.42 O HETATM 2191 O HOH 76 19.363 -6.089 1.341 1.00 25.25 O HETATM 2192 O HOH 77 24.532 -5.841 24.535 1.00 35.35 O HETATM 2193 O HOH 78 25.482 -9.620 1.672 1.00 40.84 O HETATM 2194 O HOH 79 12.925 -28.464 13.217 1.00 31.46 O HETATM 2195 O HOH 80 1.967 11.284 4.949 1.00 49.10 O HETATM 2196 O HOH 81 30.907 -0.531 14.316 1.00 35.02 O HETATM 2197 O HOH 82 9.505 -29.115 8.645 1.00 41.21 O HETATM 2198 O HOH 83 5.384 3.425 29.913 1.00 22.59 O HETATM 2199 O HOH 84 7.198 -17.724 -0.314 1.00 38.52 O HETATM 2200 O HOH 85 14.481 -8.916 18.582 1.00 30.38 O HETATM 2201 O HOH 86 21.523 -12.612 18.415 1.00 35.85 O HETATM 2202 O HOH 87 16.558 -22.964 13.869 1.00 24.92 O HETATM 2203 O HOH 88 -5.597 -3.149 31.312 1.00 42.19 O HETATM 2204 O HOH 89 22.455 -5.795 -3.152 1.00 41.93 O HETATM 2205 O HOH 90 31.363 5.168 11.833 1.00 44.14 O HETATM 2206 O HOH 91 18.357 -10.315 28.108 1.00 34.19 O HETATM 2207 O HOH 92 21.239 -13.300 -3.093 1.00 28.36 O HETATM 2208 O HOH 93 3.169 10.260 24.579 1.00 27.77 O HETATM 2209 O HOH 94 20.533 9.397 13.172 1.00 36.10 O HETATM 2210 O HOH 95 10.218 -6.264 15.799 1.00 39.06 O HETATM 2211 O HOH 96 3.289 -12.905 20.521 1.00 24.35 O HETATM 2212 O HOH 97 -7.236 -4.803 3.356 1.00 40.38 O HETATM 2213 O HOH 98 17.956 -5.609 30.103 1.00 24.12 O HETATM 2214 O HOH 99 10.805 5.845 10.458 1.00 46.95 O HETATM 2215 O HOH 100 11.496 2.172 30.322 1.00 30.71 O HETATM 2216 O HOH 101 24.410 -17.388 6.114 1.00 43.24 O HETATM 2217 O HOH 102 13.041 -10.852 18.523 1.00 30.20 O HETATM 2218 O HOH 103 2.842 -15.933 3.738 1.00 26.55 O HETATM 2219 O HOH 104 4.125 11.373 5.788 1.00 52.58 O HETATM 2220 O HOH 105 22.064 9.536 6.425 1.00 48.13 O HETATM 2221 O HOH 106 -6.498 0.754 30.532 1.00 44.80 O HETATM 2222 O HOH 107 -6.852 4.620 16.895 1.00 39.30 O HETATM 2223 O HOH 108 17.763 7.712 8.932 1.00 33.96 O HETATM 2224 O HOH 109 -7.395 0.134 28.272 1.00 44.96 O HETATM 2225 O HOH 110 6.057 -13.673 11.754 1.00 41.78 O HETATM 2226 O HOH 111 3.798 -9.077 13.152 1.00 50.92 O HETATM 2227 O HOH 112 4.043 -27.772 15.419 1.00 33.37 O HETATM 2228 O HOH 113 -8.066 14.460 22.020 1.00 39.99 O HETATM 2229 O HOH 114 6.172 -15.818 -0.160 1.00 38.99 O HETATM 2230 O HOH 115 9.057 -7.445 13.360 1.00 39.82 O HETATM 2231 O HOH 116 23.333 1.582 4.951 1.00 31.72 O HETATM 2232 O HOH 117 17.227 -13.823 29.994 1.00 47.27 O HETATM 2233 O HOH 118 11.977 -30.279 -3.953 1.00 42.22 O HETATM 2234 O HOH 119 30.507 -0.388 24.647 1.00 45.50 O HETATM 2235 O HOH 120 26.248 -3.002 32.305 1.00 55.96 O HETATM 2236 O HOH 121 22.364 11.899 28.087 1.00 47.33 O HETATM 2237 O HOH 122 8.296 -9.152 27.743 1.00 37.91 O HETATM 2238 O HOH 123 6.179 -5.795 31.344 1.00 36.79 O HETATM 2239 O HOH 124 -7.624 17.218 22.647 1.00 44.18 O HETATM 2240 O HOH 125 -9.411 -5.011 18.207 1.00 47.88 O HETATM 2241 O HOH 126 8.520 4.206 30.075 1.00 32.91 O HETATM 2242 O HOH 127 -0.329 -13.982 -3.598 1.00 40.31 O HETATM 2243 O HOH 128 9.484 10.886 0.207 1.00 62.03 O HETATM 2244 O HOH 129 25.722 -4.247 -2.437 1.00 56.33 O HETATM 2245 O HOH 130 -4.578 3.600 32.374 1.00 51.07 O HETATM 2246 O HOH 131 8.449 3.057 -6.463 1.00 45.53 O HETATM 2247 O HOH 132 -6.670 -11.846 8.268 1.00 54.83 O HETATM 2248 O HOH 133 23.030 -14.692 20.968 1.00 37.32 O HETATM 2249 O HOH 134 32.699 -12.953 17.079 1.00 48.01 O HETATM 2250 O HOH 135 26.610 -1.640 5.162 1.00 40.41 O HETATM 2251 O HOH 136 3.883 13.157 4.370 1.00 53.14 O HETATM 2252 O HOH 137 7.036 -14.031 -6.826 1.00 43.37 O HETATM 2253 O HOH 138 -7.610 -6.546 1.714 1.00 50.05 O HETATM 2254 O HOH 139 -12.422 -1.264 25.896 1.00 51.18 O HETATM 2255 O HOH 140 -9.410 -6.888 21.060 1.00 50.32 O HETATM 2256 O HOH 141 22.838 -11.014 -3.958 1.00 42.15 O HETATM 2257 O HOH 142 33.707 -15.433 14.217 1.00 46.67 O HETATM 2258 O HOH 143 22.979 -16.027 18.510 1.00 40.59 O HETATM 2259 O HOH 144 33.568 -10.881 18.728 1.00 50.14 O HETATM 2260 O HOH 145 29.753 6.692 25.118 1.00 50.37 O HETATM 2261 O HOH 146 -7.423 -18.830 6.953 1.00 50.13 O HETATM 2262 O HOH 147 -3.117 20.567 12.457 1.00 51.31 O HETATM 2263 N HSM A 148 9.644 -3.538 14.707 1.00 0.22 N HETATM 2264 CA HSM A 148 8.568 -2.665 15.154 1.00 -0.03 C HETATM 2265 CB HSM A 148 7.280 -3.483 15.340 1.00 0.01 C HETATM 2266 CG HSM A 148 6.221 -3.045 14.318 1.00 -0.00 C HETATM 2267 ND1 HSM A 148 6.456 -2.635 13.085 1.00 -0.33 N HETATM 2268 CE1 HSM A 148 5.274 -2.346 12.507 1.00 0.09 C HETATM 2269 NE2 HSM A 148 4.298 -2.592 13.401 1.00 -0.28 N HETATM 2270 CD2 HSM A 148 4.864 -3.019 14.513 1.00 0.03 C HETATM 2271 H8 HSM A 148 4.344 -3.302 15.427 1.00 0.07 H HETATM 2272 H10 HSM A 148 3.288 -2.469 13.244 1.00 0.24 H HETATM 2273 H9 HSM A 148 5.133 -1.977 11.492 1.00 0.12 H HETATM 2274 H6 HSM A 148 6.892 -3.323 16.357 1.00 0.04 H HETATM 2275 H7 HSM A 148 7.504 -4.550 15.197 1.00 0.04 H HETATM 2276 H4 HSM A 148 8.397 -1.881 14.402 1.00 0.08 H HETATM 2277 H5 HSM A 148 8.848 -2.201 16.111 1.00 0.08 H HETATM 2278 H1 HSM A 148 10.486 -2.998 14.586 1.00 0.20 H HETATM 2279 H2 HSM A 148 9.389 -3.963 13.829 1.00 0.20 H HETATM 2280 H3 HSM A 148 9.802 -4.257 15.396 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1614 1613 2116 CONECT 2116 1614 CONECT 2263 2264 2278 2279 2280 CONECT 2264 2263 2265 2276 2277 CONECT 2265 2264 2266 2274 2275 CONECT 2266 2265 2267 2270 CONECT 2267 2266 2268 CONECT 2268 2267 2269 2273 CONECT 2269 2268 2270 2272 CONECT 2270 2266 2269 2271 CONECT 2271 2270 CONECT 2272 2269 CONECT 2273 2268 CONECT 2274 2265 CONECT 2275 2265 CONECT 2276 2264 CONECT 2277 2264 CONECT 2278 2263 CONECT 2279 2263 CONECT 2280 2263 MASTER 0 0 0 0 0 0 0 0 2279 1 24 17 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6dyn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6dys
RCSB PDB
PDBbind
223aa, >6DYS_1|Chain... at 100%
6dyo
RCSB PDB
PDBbind
223aa, >6DYO_1|Chain... at 100%
6dyr
RCSB PDB
PDBbind
223aa, >6DYR_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1avn
RCSB PDB
PDBbind
HSM
1qft
RCSB PDB
PDBbind
HSM
3bu1
RCSB PDB
PDBbind
HSM
3rxh
RCSB PDB
PDBbind
HSM
6fu4
RCSB PDB
PDBbind
HSM
Entry Information
PDB ID
6dyn
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Ebony
Ligand Name
HSM
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=638.9uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
() Vol. : pp. -
Ligand Properties
Formula
C
5
H
1
0
N
3
Molecular Weight
112.153
Exact Mass
112.087
No. of atoms
18
No. of bonds
18
Polar Surface Area
56.32
LOGP Value
-0.58 (
Computed with XLOGP3
)
-0.81 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
Canonical SMILES
C(c1c[nH]cn1)C[NH3+]
InChI String
InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)/p+1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A4GK78
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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