Browse entries in the PDBbind-CN Database
HEADER 6DYR_COMPLEX COMPND 6DYR_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 HJD A 293 28 ATOM 1 N MET A 665 12.962 -30.974 9.948 1.00 46.59 N ATOM 2 CA MET A 665 13.405 -29.710 10.524 1.00 55.33 C ATOM 3 C MET A 665 13.426 -28.622 9.459 1.00 49.24 C ATOM 4 O MET A 665 13.664 -28.899 8.283 1.00 50.67 O ATOM 5 CB MET A 665 14.793 -29.858 11.152 1.00 51.17 C ATOM 6 CG MET A 665 15.060 -28.891 12.293 1.00 44.46 C ATOM 7 SD MET A 665 16.788 -28.865 12.812 1.00 60.91 S ATOM 8 CE MET A 665 17.334 -30.486 12.284 1.00 46.65 C ATOM 9 HN3 MET A 665 13.614 -31.255 9.188 1.00 0.00 H ATOM 10 HN2 MET A 665 12.004 -30.860 9.560 1.00 0.00 H ATOM 11 HN1 MET A 665 12.953 -31.706 10.687 1.00 0.00 H ATOM 12 N LEU A 666 13.179 -27.383 9.872 1.00 44.26 N ATOM 13 CA LEU A 666 13.160 -26.270 8.931 1.00 42.31 C ATOM 14 C LEU A 666 14.584 -25.927 8.508 1.00 37.79 C ATOM 15 O LEU A 666 15.437 -25.637 9.353 1.00 41.25 O ATOM 16 CB LEU A 666 12.475 -25.059 9.558 1.00 38.85 C ATOM 17 CG LEU A 666 12.211 -23.884 8.616 1.00 33.98 C ATOM 18 CD1 LEU A 666 11.448 -24.357 7.388 1.00 38.02 C ATOM 19 CD2 LEU A 666 11.446 -22.784 9.338 1.00 30.89 C ATOM 20 H LEU A 666 12.997 -27.205 10.880 1.00 0.00 H ATOM 21 N LYS A 667 14.842 -25.970 7.203 1.00 31.24 N ATOM 22 CA LYS A 667 16.156 -25.680 6.640 1.00 33.53 C ATOM 23 C LYS A 667 16.098 -24.327 5.945 1.00 31.35 C ATOM 24 O LYS A 667 15.361 -24.159 4.966 1.00 39.85 O ATOM 25 CB LYS A 667 16.591 -26.774 5.664 1.00 42.35 C ATOM 26 CG LYS A 667 16.848 -28.122 6.316 1.00 45.02 C ATOM 27 CD LYS A 667 17.333 -29.146 5.302 1.00 58.01 C ATOM 28 CE LYS A 667 17.730 -30.437 5.991 1.00 62.41 C ATOM 29 NZ LYS A 667 18.751 -30.188 7.046 1.00 65.49 N ATOM 30 HZ1 LYS A 667 19.598 -29.766 6.614 1.00 0.00 H ATOM 31 HZ2 LYS A 667 18.361 -29.536 7.757 1.00 0.00 H ATOM 32 HZ3 LYS A 667 19.004 -31.088 7.501 1.00 0.00 H ATOM 33 H LYS A 667 14.070 -26.222 6.554 1.00 0.00 H ATOM 34 N MET A 668 16.881 -23.373 6.440 1.00 28.21 N ATOM 35 CA MET A 668 16.751 -21.981 6.047 1.00 26.28 C ATOM 36 C MET A 668 18.065 -21.433 5.511 1.00 24.09 C ATOM 37 O MET A 668 19.150 -21.905 5.857 1.00 27.68 O ATOM 38 CB MET A 668 16.275 -21.125 7.225 1.00 26.17 C ATOM 39 CG MET A 668 14.791 -21.256 7.501 1.00 24.87 C ATOM 40 SD MET A 668 14.322 -20.491 9.056 1.00 25.50 S ATOM 41 CE MET A 668 15.066 -21.637 10.213 1.00 16.30 C ATOM 42 H MET A 668 17.612 -23.633 7.133 1.00 0.00 H ATOM 43 N GLU A 669 17.947 -20.415 4.660 1.00 28.96 N ATOM 44 CA GLU A 669 19.099 -19.730 4.090 1.00 26.64 C ATOM 45 C GLU A 669 18.803 -18.242 4.008 1.00 28.92 C ATOM 46 O GLU A 669 17.737 -17.847 3.527 1.00 25.48 O ATOM 47 CB GLU A 669 19.440 -20.270 2.700 1.00 26.17 C ATOM 48 CG GLU A 669 20.634 -19.595 2.058 1.00 28.36 C ATOM 49 CD GLU A 669 20.907 -20.103 0.659 1.00 32.99 C ATOM 50 OE1 GLU A 669 20.077 -20.875 0.128 1.00 35.00 O ATOM 51 OE2 GLU A 669 21.952 -19.727 0.088 1.00 41.57 O ATOM 52 H GLU A 669 16.994 -20.097 4.392 1.00 0.00 H ATOM 53 N ALA A 670 19.748 -17.424 4.466 1.00 29.45 N ATOM 54 CA ALA A 670 19.613 -15.974 4.446 1.00 22.97 C ATOM 55 C ALA A 670 20.281 -15.431 3.189 1.00 26.42 C ATOM 56 O ALA A 670 21.505 -15.520 3.042 1.00 31.16 O ATOM 57 CB ALA A 670 20.229 -15.349 5.697 1.00 17.93 C ATOM 58 H ALA A 670 20.619 -17.838 4.854 1.00 0.00 H ATOM 59 N VAL A 671 19.480 -14.865 2.300 1.00 26.34 N ATOM 60 CA VAL A 671 19.943 -14.309 1.029 1.00 25.89 C ATOM 61 C VAL A 671 19.784 -12.796 1.094 1.00 26.79 C ATOM 62 O VAL A 671 18.724 -12.315 1.510 1.00 20.68 O ATOM 63 CB VAL A 671 19.159 -14.889 -0.166 1.00 26.73 C ATOM 64 CG1 VAL A 671 19.541 -14.182 -1.452 1.00 23.26 C ATOM 65 CG2 VAL A 671 19.413 -16.388 -0.283 1.00 30.14 C ATOM 66 H VAL A 671 18.464 -14.813 2.518 1.00 0.00 H ATOM 67 N PRO A 672 20.803 -12.015 0.719 1.00 27.72 N ATOM 68 CA PRO A 672 20.650 -10.556 0.715 1.00 23.19 C ATOM 69 C PRO A 672 19.480 -10.113 -0.151 1.00 25.25 C ATOM 70 O PRO A 672 19.094 -10.784 -1.111 1.00 25.18 O ATOM 71 CB PRO A 672 21.985 -10.059 0.148 1.00 25.19 C ATOM 72 CG PRO A 672 22.955 -11.145 0.471 1.00 23.96 C ATOM 73 CD PRO A 672 22.176 -12.429 0.376 1.00 23.98 C ATOM 74 N LEU A 673 18.917 -8.962 0.203 1.00 25.02 N ATOM 75 CA LEU A 673 17.734 -8.461 -0.481 1.00 26.46 C ATOM 76 C LEU A 673 18.070 -8.078 -1.918 1.00 31.64 C ATOM 77 O LEU A 673 18.995 -7.298 -2.166 1.00 37.00 O ATOM 78 CB LEU A 673 17.164 -7.261 0.275 1.00 26.14 C ATOM 79 CG LEU A 673 15.708 -6.891 -0.005 1.00 30.65 C ATOM 80 CD1 LEU A 673 14.783 -7.991 0.486 1.00 34.74 C ATOM 81 CD2 LEU A 673 15.360 -5.560 0.643 1.00 28.36 C ATOM 82 H LEU A 673 19.329 -8.410 0.982 1.00 0.00 H ATOM 83 N ARG A 674 17.328 -8.645 -2.864 1.00 33.82 N ATOM 84 CA ARG A 674 17.439 -8.316 -4.277 1.00 39.19 C ATOM 85 C ARG A 674 16.193 -7.564 -4.730 1.00 35.20 C ATOM 86 O ARG A 674 15.129 -7.657 -4.112 1.00 35.22 O ATOM 87 CB ARG A 674 17.627 -9.579 -5.126 1.00 33.71 C ATOM 88 CG ARG A 674 19.030 -10.169 -5.082 1.00 34.44 C ATOM 89 CD ARG A 674 18.977 -11.688 -5.017 1.00 39.17 C ATOM 90 NE ARG A 674 17.852 -12.228 -5.777 1.00 50.52 N ATOM 91 CZ ARG A 674 17.398 -13.474 -5.659 1.00 47.10 C ATOM 92 NH1 ARG A 674 17.971 -14.314 -4.807 1.00 45.61 N ATOM 93 NH2 ARG A 674 16.366 -13.879 -6.386 1.00 40.42 N ATOM 94 HE ARG A 674 17.375 -11.599 -6.454 1.00 0.00 H ATOM 95 HH12 ARG A 674 17.614 -15.287 -4.717 1.00 0.00 H ATOM 96 HH11 ARG A 674 18.777 -14.000 -4.229 1.00 0.00 H ATOM 97 HH22 ARG A 674 16.014 -14.853 -6.292 1.00 0.00 H ATOM 98 HH21 ARG A 674 15.909 -13.223 -7.051 1.00 0.00 H ATOM 99 H ARG A 674 16.631 -9.362 -2.579 1.00 0.00 H ATOM 100 N LEU A 675 16.339 -6.817 -5.830 1.00 33.28 N ATOM 101 CA LEU A 675 15.242 -5.986 -6.324 1.00 30.24 C ATOM 102 C LEU A 675 14.008 -6.807 -6.677 1.00 30.28 C ATOM 103 O LEU A 675 12.881 -6.318 -6.539 1.00 30.72 O ATOM 104 CB LEU A 675 15.696 -5.185 -7.543 1.00 30.89 C ATOM 105 CG LEU A 675 16.521 -3.927 -7.281 1.00 31.82 C ATOM 106 CD1 LEU A 675 17.070 -3.384 -8.588 1.00 28.10 C ATOM 107 CD2 LEU A 675 15.676 -2.878 -6.576 1.00 26.90 C ATOM 108 H LEU A 675 17.245 -6.827 -6.341 1.00 0.00 H ATOM 109 N GLU A 676 14.194 -8.047 -7.136 1.00 31.43 N ATOM 110 CA GLU A 676 13.072 -8.880 -7.552 1.00 29.05 C ATOM 111 C GLU A 676 12.269 -9.426 -6.380 1.00 34.64 C ATOM 112 O GLU A 676 11.214 -10.031 -6.603 1.00 32.24 O ATOM 113 CB GLU A 676 13.576 -10.041 -8.407 1.00 29.73 C ATOM 114 CG GLU A 676 14.359 -11.081 -7.623 1.00 40.70 C ATOM 115 CD GLU A 676 15.564 -11.597 -8.382 1.00 53.26 C ATOM 116 OE1 GLU A 676 16.611 -10.915 -8.369 1.00 57.01 O ATOM 117 OE2 GLU A 676 15.461 -12.679 -8.998 1.00 58.43 O ATOM 118 H GLU A 676 15.160 -8.427 -7.198 1.00 0.00 H ATOM 119 N HIS A 677 12.739 -9.234 -5.150 1.00 34.61 N ATOM 120 CA HIS A 677 12.074 -9.744 -3.960 1.00 29.36 C ATOM 121 C HIS A 677 10.928 -8.863 -3.493 1.00 26.33 C ATOM 122 O HIS A 677 10.339 -9.157 -2.448 1.00 33.51 O ATOM 123 CB HIS A 677 13.083 -9.894 -2.819 1.00 30.49 C ATOM 124 CG HIS A 677 14.065 -11.003 -3.021 1.00 32.03 C ATOM 125 ND1 HIS A 677 15.364 -10.938 -2.567 1.00 22.04 N ATOM 126 CD2 HIS A 677 13.934 -12.211 -3.617 1.00 31.27 C ATOM 127 CE1 HIS A 677 15.993 -12.056 -2.879 1.00 34.75 C ATOM 128 NE2 HIS A 677 15.148 -12.847 -3.515 1.00 34.98 N ATOM 129 H HIS A 677 13.621 -8.695 -5.034 1.00 0.00 H ATOM 130 N ARG A 678 10.594 -7.812 -4.244 1.00 27.13 N ATOM 131 CA ARG A 678 9.713 -6.770 -3.724 1.00 35.40 C ATOM 132 C ARG A 678 8.338 -7.321 -3.362 1.00 35.57 C ATOM 133 O ARG A 678 7.847 -7.104 -2.248 1.00 33.93 O ATOM 134 CB ARG A 678 9.593 -5.635 -4.742 1.00 33.53 C ATOM 135 CG ARG A 678 9.007 -4.354 -4.171 1.00 35.30 C ATOM 136 CD ARG A 678 8.805 -3.309 -5.256 1.00 32.04 C ATOM 137 NE ARG A 678 8.113 -3.874 -6.409 1.00 41.41 N ATOM 138 CZ ARG A 678 6.809 -4.128 -6.447 1.00 47.19 C ATOM 139 NH1 ARG A 678 6.046 -3.868 -5.392 1.00 42.95 N ATOM 140 NH2 ARG A 678 6.266 -4.647 -7.541 1.00 47.07 N ATOM 141 HE ARG A 678 8.676 -4.092 -7.256 1.00 0.00 H ATOM 142 HH12 ARG A 678 5.026 -4.068 -5.426 1.00 0.00 H ATOM 143 HH11 ARG A 678 6.468 -3.464 -4.532 1.00 0.00 H ATOM 144 HH22 ARG A 678 5.246 -4.846 -7.571 1.00 0.00 H ATOM 145 HH21 ARG A 678 6.861 -4.855 -8.368 1.00 0.00 H ATOM 146 H ARG A 678 10.966 -7.734 -5.212 1.00 0.00 H ATOM 147 N GLN A 679 7.700 -8.041 -4.288 1.00 35.78 N ATOM 148 CA GLN A 679 6.344 -8.507 -4.025 1.00 35.38 C ATOM 149 C GLN A 679 6.313 -9.578 -2.942 1.00 33.85 C ATOM 150 O GLN A 679 5.350 -9.644 -2.171 1.00 40.97 O ATOM 151 CB GLN A 679 5.700 -9.032 -5.307 1.00 41.20 C ATOM 152 CG GLN A 679 4.192 -9.166 -5.204 1.00 37.88 C ATOM 153 CD GLN A 679 3.531 -7.867 -4.796 1.00 45.05 C ATOM 154 OE1 GLN A 679 3.144 -7.690 -3.641 1.00 42.43 O ATOM 155 NE2 GLN A 679 3.400 -6.946 -5.745 1.00 50.59 N ATOM 156 HE22 GLN A 679 3.742 -7.139 -6.708 1.00 0.00 H ATOM 157 HE21 GLN A 679 2.956 -6.032 -5.525 1.00 0.00 H ATOM 158 H GLN A 679 8.167 -8.267 -5.189 1.00 0.00 H ATOM 159 N GLU A 680 7.343 -10.419 -2.862 1.00 27.46 N ATOM 160 CA GLU A 680 7.377 -11.427 -1.808 1.00 32.20 C ATOM 161 C GLU A 680 7.572 -10.789 -0.438 1.00 29.88 C ATOM 162 O GLU A 680 6.984 -11.241 0.552 1.00 32.39 O ATOM 163 CB GLU A 680 8.481 -12.445 -2.091 1.00 40.12 C ATOM 164 CG GLU A 680 8.196 -13.355 -3.270 1.00 33.99 C ATOM 165 CD GLU A 680 9.403 -14.176 -3.677 1.00 45.90 C ATOM 166 OE1 GLU A 680 10.345 -13.601 -4.266 1.00 47.04 O ATOM 167 OE2 GLU A 680 9.415 -15.394 -3.397 1.00 49.75 O ATOM 168 H GLU A 680 8.121 -10.357 -3.549 1.00 0.00 H ATOM 169 N VAL A 681 8.391 -9.737 -0.362 1.00 32.05 N ATOM 170 CA VAL A 681 8.622 -9.059 0.910 1.00 24.95 C ATOM 171 C VAL A 681 7.396 -8.250 1.316 1.00 26.29 C ATOM 172 O VAL A 681 7.014 -8.227 2.492 1.00 26.88 O ATOM 173 CB VAL A 681 9.881 -8.179 0.822 1.00 33.09 C ATOM 174 CG1 VAL A 681 9.970 -7.237 2.021 1.00 30.50 C ATOM 175 CG2 VAL A 681 11.129 -9.049 0.730 1.00 27.70 C ATOM 176 H VAL A 681 8.870 -9.396 -1.220 1.00 0.00 H ATOM 177 N ILE A 682 6.759 -7.579 0.354 1.00 33.78 N ATOM 178 CA ILE A 682 5.551 -6.815 0.651 1.00 33.85 C ATOM 179 C ILE A 682 4.470 -7.727 1.216 1.00 27.64 C ATOM 180 O ILE A 682 3.797 -7.384 2.195 1.00 31.47 O ATOM 181 CB ILE A 682 5.068 -6.068 -0.607 1.00 32.49 C ATOM 182 CG1 ILE A 682 5.932 -4.832 -0.852 1.00 30.28 C ATOM 183 CG2 ILE A 682 3.600 -5.689 -0.482 1.00 31.44 C ATOM 184 CD1 ILE A 682 5.476 -3.994 -2.021 1.00 38.57 C ATOM 185 H ILE A 682 7.127 -7.601 -0.618 1.00 0.00 H ATOM 186 N ASP A 683 4.297 -8.908 0.619 1.00 26.50 N ATOM 187 CA ASP A 683 3.290 -9.843 1.113 1.00 35.08 C ATOM 188 C ASP A 683 3.560 -10.232 2.561 1.00 30.10 C ATOM 189 O ASP A 683 2.637 -10.283 3.381 1.00 29.69 O ATOM 190 CB ASP A 683 3.243 -11.087 0.223 1.00 32.23 C ATOM 191 CG ASP A 683 2.788 -10.778 -1.191 1.00 36.48 C ATOM 192 OD1 ASP A 683 2.145 -9.725 -1.396 1.00 30.63 O ATOM 193 OD2 ASP A 683 3.076 -11.587 -2.099 1.00 40.06 O ATOM 194 H ASP A 683 4.882 -9.164 -0.202 1.00 0.00 H ATOM 195 N ILE A 684 4.824 -10.500 2.897 1.00 32.22 N ATOM 196 CA ILE A 684 5.160 -10.891 4.262 1.00 29.52 C ATOM 197 C ILE A 684 4.960 -9.725 5.222 1.00 37.38 C ATOM 198 O ILE A 684 4.398 -9.892 6.311 1.00 42.72 O ATOM 199 CB ILE A 684 6.600 -11.434 4.324 1.00 30.48 C ATOM 200 CG1 ILE A 684 6.701 -12.762 3.570 1.00 27.25 C ATOM 201 CG2 ILE A 684 7.049 -11.597 5.766 1.00 28.63 C ATOM 202 CD1 ILE A 684 8.081 -13.371 3.597 1.00 26.22 C ATOM 203 H ILE A 684 5.575 -10.430 2.181 1.00 0.00 H ATOM 204 N ILE A 685 5.410 -8.529 4.836 1.00 22.61 N ATOM 205 CA ILE A 685 5.306 -7.379 5.728 1.00 31.44 C ATOM 206 C ILE A 685 3.848 -6.994 5.946 1.00 35.82 C ATOM 207 O ILE A 685 3.445 -6.648 7.063 1.00 38.49 O ATOM 208 CB ILE A 685 6.134 -6.201 5.183 1.00 28.33 C ATOM 209 CG1 ILE A 685 7.624 -6.544 5.202 1.00 24.63 C ATOM 210 CG2 ILE A 685 5.870 -4.937 5.989 1.00 21.86 C ATOM 211 CD1 ILE A 685 8.145 -6.891 6.578 1.00 33.08 C ATOM 212 H ILE A 685 5.837 -8.416 3.894 1.00 0.00 H ATOM 213 N VAL A 686 3.032 -7.048 4.891 1.00 32.43 N ATOM 214 CA VAL A 686 1.604 -6.803 5.066 1.00 43.94 C ATOM 215 C VAL A 686 0.998 -7.860 5.978 1.00 42.37 C ATOM 216 O VAL A 686 0.207 -7.549 6.875 1.00 41.96 O ATOM 217 CB VAL A 686 0.893 -6.753 3.700 1.00 45.54 C ATOM 218 CG1 VAL A 686 -0.620 -6.769 3.887 1.00 35.61 C ATOM 219 CG2 VAL A 686 1.318 -5.513 2.926 1.00 37.53 C ATOM 220 H VAL A 686 3.413 -7.264 3.948 1.00 0.00 H ATOM 221 N ALA A 687 1.382 -9.122 5.785 1.00 45.09 N ATOM 222 CA ALA A 687 0.843 -10.195 6.612 1.00 42.87 C ATOM 223 C ALA A 687 1.240 -10.028 8.074 1.00 42.56 C ATOM 224 O ALA A 687 0.461 -10.353 8.978 1.00 52.72 O ATOM 225 CB ALA A 687 1.317 -11.541 6.075 1.00 39.25 C ATOM 226 H ALA A 687 2.072 -9.343 5.039 1.00 0.00 H ATOM 227 N SER A 688 2.445 -9.517 8.327 1.00 41.06 N ATOM 228 CA SER A 688 2.943 -9.403 9.692 1.00 44.73 C ATOM 229 C SER A 688 2.479 -8.136 10.401 1.00 47.48 C ATOM 230 O SER A 688 2.586 -8.063 11.630 1.00 48.00 O ATOM 231 CB SER A 688 4.473 -9.453 9.700 1.00 35.07 C ATOM 232 OG SER A 688 4.941 -10.729 9.298 1.00 32.57 O ATOM 233 HG SER A 688 4.597 -11.417 9.921 1.00 0.00 H ATOM 234 H SER A 688 3.040 -9.194 7.537 1.00 0.00 H ATOM 235 N PHE A 689 1.966 -7.142 9.669 1.00 47.42 N ATOM 236 CA PHE A 689 1.621 -5.862 10.276 1.00 45.02 C ATOM 237 C PHE A 689 0.240 -5.345 9.884 1.00 53.10 C ATOM 238 O PHE A 689 -0.055 -4.169 10.131 1.00 60.00 O ATOM 239 CB PHE A 689 2.675 -4.803 9.931 1.00 36.43 C ATOM 240 CG PHE A 689 4.026 -5.083 10.517 1.00 37.85 C ATOM 241 CD1 PHE A 689 4.328 -4.695 11.813 1.00 42.43 C ATOM 242 CD2 PHE A 689 4.997 -5.732 9.771 1.00 27.55 C ATOM 243 CE1 PHE A 689 5.576 -4.952 12.357 1.00 34.73 C ATOM 244 CE2 PHE A 689 6.247 -5.991 10.307 1.00 35.87 C ATOM 245 CZ PHE A 689 6.538 -5.599 11.602 1.00 30.98 C ATOM 246 H PHE A 689 1.811 -7.284 8.651 1.00 0.00 H ATOM 247 N TYR A 690 -0.612 -6.174 9.289 1.00 55.58 N ATOM 248 CA TYR A 690 -1.976 -5.781 8.946 1.00 61.09 C ATOM 249 C TYR A 690 -2.935 -6.620 9.780 1.00 62.97 C ATOM 250 O TYR A 690 -3.042 -7.835 9.576 1.00 65.68 O ATOM 251 CB TYR A 690 -2.245 -5.949 7.453 1.00 58.73 C ATOM 252 CG TYR A 690 -3.673 -5.675 7.051 1.00 56.97 C ATOM 253 CD1 TYR A 690 -4.115 -4.378 6.834 1.00 45.74 C ATOM 254 CD2 TYR A 690 -4.580 -6.714 6.886 1.00 64.63 C ATOM 255 CE1 TYR A 690 -5.422 -4.122 6.467 1.00 56.57 C ATOM 256 CE2 TYR A 690 -5.889 -6.469 6.521 1.00 60.66 C ATOM 257 CZ TYR A 690 -6.305 -5.172 6.312 1.00 60.58 C ATOM 258 OH TYR A 690 -7.608 -4.925 5.947 1.00 79.94 O ATOM 259 HH TYR A 690 -7.740 -3.950 5.838 1.00 0.00 H ATOM 260 H TYR A 690 -0.296 -7.138 9.059 1.00 0.00 H ATOM 261 N ASN A 691 -3.604 -5.971 10.739 1.00 69.49 N ATOM 262 CA ASN A 691 -4.590 -6.594 11.622 1.00 80.23 C ATOM 263 C ASN A 691 -3.973 -7.650 12.537 1.00 74.62 C ATOM 264 O ASN A 691 -4.610 -8.087 13.502 1.00 70.02 O ATOM 265 CB ASN A 691 -5.740 -7.190 10.803 1.00 71.57 C ATOM 266 CG ASN A 691 -6.598 -6.124 10.147 1.00 72.75 C ATOM 267 OD1 ASN A 691 -6.322 -4.929 10.265 1.00 69.56 O ATOM 268 ND2 ASN A 691 -7.641 -6.551 9.445 1.00 72.98 N ATOM 269 HD22 ASN A 691 -7.837 -7.570 9.372 1.00 0.00 H ATOM 270 HD21 ASN A 691 -8.262 -5.867 8.968 1.00 0.00 H ATOM 271 H ASN A 691 -3.411 -4.957 10.865 1.00 0.00 H ATOM 272 N LYS A 692 -2.744 -8.071 12.244 1.00 65.99 N ATOM 273 CA LYS A 692 -1.946 -8.858 13.174 1.00 64.69 C ATOM 274 C LYS A 692 -1.037 -7.994 14.033 1.00 59.49 C ATOM 275 O LYS A 692 -0.489 -8.488 15.025 1.00 66.65 O ATOM 276 CB LYS A 692 -1.090 -9.882 12.419 1.00 58.15 C ATOM 277 CG LYS A 692 -1.829 -11.142 12.006 1.00 72.79 C ATOM 278 CD LYS A 692 -0.941 -12.367 12.173 1.00 69.42 C ATOM 279 CE LYS A 692 -0.518 -12.540 13.628 1.00 68.86 C ATOM 280 NZ LYS A 692 0.309 -13.761 13.838 1.00 55.23 N ATOM 281 HZ1 LYS A 692 -0.238 -14.601 13.560 1.00 0.00 H ATOM 282 HZ2 LYS A 692 1.170 -13.699 13.258 1.00 0.00 H ATOM 283 HZ3 LYS A 692 0.570 -13.833 14.842 1.00 0.00 H ATOM 284 H LYS A 692 -2.339 -7.829 11.317 1.00 0.00 H ATOM 285 N ALA A 693 -0.877 -6.722 13.683 1.00 52.48 N ATOM 286 CA ALA A 693 0.105 -5.867 14.329 1.00 38.06 C ATOM 287 C ALA A 693 -0.411 -5.335 15.658 1.00 36.13 C ATOM 288 O ALA A 693 -1.590 -4.994 15.797 1.00 31.45 O ATOM 289 CB ALA A 693 0.474 -4.706 13.410 1.00 46.39 C ATOM 290 H ALA A 693 -1.471 -6.327 12.926 1.00 0.00 H ATOM 291 N ASP A 694 0.495 -5.249 16.634 1.00 30.44 N ATOM 292 CA ASP A 694 0.113 -4.835 17.978 1.00 31.31 C ATOM 293 C ASP A 694 -0.183 -3.342 18.049 1.00 31.06 C ATOM 294 O ASP A 694 -0.970 -2.911 18.898 1.00 33.57 O ATOM 295 CB ASP A 694 1.216 -5.209 18.966 1.00 34.50 C ATOM 296 CG ASP A 694 1.677 -6.647 18.803 1.00 38.97 C ATOM 297 OD1 ASP A 694 2.254 -6.970 17.741 1.00 26.70 O ATOM 298 OD2 ASP A 694 1.457 -7.454 19.734 1.00 32.09 O ATOM 299 H ASP A 694 1.489 -5.481 16.432 1.00 0.00 H ATOM 300 N LEU A 695 0.434 -2.542 17.182 1.00 30.88 N ATOM 301 CA LEU A 695 0.164 -1.111 17.146 1.00 29.42 C ATOM 302 C LEU A 695 -0.932 -0.757 16.148 1.00 29.90 C ATOM 303 O LEU A 695 -1.779 0.096 16.435 1.00 29.44 O ATOM 304 CB LEU A 695 1.441 -0.341 16.804 1.00 22.29 C ATOM 305 CG LEU A 695 2.525 -0.251 17.878 1.00 25.27 C ATOM 306 CD1 LEU A 695 3.673 0.616 17.384 1.00 24.92 C ATOM 307 CD2 LEU A 695 1.955 0.304 19.171 1.00 25.04 C ATOM 308 H LEU A 695 1.123 -2.947 16.517 1.00 0.00 H ATOM 309 N GLU A 696 -0.933 -1.408 14.982 1.00 29.81 N ATOM 310 CA GLU A 696 -1.880 -1.086 13.920 1.00 30.79 C ATOM 311 C GLU A 696 -3.303 -1.511 14.254 1.00 36.59 C ATOM 312 O GLU A 696 -4.249 -0.947 13.692 1.00 38.46 O ATOM 313 CB GLU A 696 -1.438 -1.743 12.607 1.00 32.71 C ATOM 314 CG GLU A 696 -0.264 -1.062 11.914 1.00 40.05 C ATOM 315 CD GLU A 696 1.084 -1.309 12.581 1.00 39.95 C ATOM 316 OE1 GLU A 696 2.116 -1.048 11.929 1.00 41.51 O ATOM 317 OE2 GLU A 696 1.122 -1.752 13.748 1.00 41.36 O ATOM 318 H GLU A 696 -0.239 -2.166 14.827 1.00 0.00 H ATOM 319 N GLN A 697 -3.478 -2.498 15.139 1.00 35.67 N ATOM 320 CA GLN A 697 -4.822 -2.948 15.485 1.00 36.73 C ATOM 321 C GLN A 697 -5.632 -1.843 16.148 1.00 40.58 C ATOM 322 O GLN A 697 -6.866 -1.844 16.072 1.00 37.75 O ATOM 323 CB GLN A 697 -4.747 -4.166 16.404 1.00 33.16 C ATOM 324 CG GLN A 697 -4.051 -3.881 17.725 1.00 37.08 C ATOM 325 CD GLN A 697 -3.965 -5.094 18.625 1.00 34.47 C ATOM 326 OE1 GLN A 697 -3.032 -5.226 19.418 1.00 37.71 O ATOM 327 NE2 GLN A 697 -4.942 -5.987 18.512 1.00 31.89 N ATOM 328 HE22 GLN A 697 -5.710 -5.834 17.828 1.00 0.00 H ATOM 329 HE21 GLN A 697 -4.939 -6.840 19.108 1.00 0.00 H ATOM 330 H GLN A 697 -2.652 -2.947 15.583 1.00 0.00 H ATOM 331 N TRP A 698 -4.963 -0.892 16.792 1.00 28.93 N ATOM 332 CA TRP A 698 -5.647 0.178 17.500 1.00 33.75 C ATOM 333 C TRP A 698 -5.947 1.378 16.615 1.00 35.84 C ATOM 334 O TRP A 698 -6.717 2.253 17.025 1.00 34.96 O ATOM 335 CB TRP A 698 -4.816 0.603 18.714 1.00 28.26 C ATOM 336 CG TRP A 698 -4.438 -0.571 19.556 1.00 32.27 C ATOM 337 CD1 TRP A 698 -3.190 -1.090 19.729 1.00 35.44 C ATOM 338 CD2 TRP A 698 -5.327 -1.402 20.309 1.00 32.35 C ATOM 339 NE1 TRP A 698 -3.244 -2.186 20.558 1.00 39.91 N ATOM 340 CE2 TRP A 698 -4.547 -2.398 20.926 1.00 37.92 C ATOM 341 CE3 TRP A 698 -6.708 -1.394 20.529 1.00 30.14 C ATOM 342 CZ2 TRP A 698 -5.101 -3.374 21.748 1.00 38.62 C ATOM 343 CZ3 TRP A 698 -7.254 -2.363 21.343 1.00 27.02 C ATOM 344 CH2 TRP A 698 -6.455 -3.339 21.943 1.00 27.91 C ATOM 345 HE1 TRP A 698 -2.430 -2.760 20.857 1.00 0.00 H ATOM 346 H TRP A 698 -3.923 -0.914 16.789 1.00 0.00 H ATOM 347 N LEU A 699 -5.369 1.434 15.417 1.00 35.53 N ATOM 348 CA LEU A 699 -5.700 2.453 14.434 1.00 40.60 C ATOM 349 C LEU A 699 -6.852 2.036 13.529 1.00 51.29 C ATOM 350 O LEU A 699 -7.091 2.691 12.511 1.00 56.30 O ATOM 351 CB LEU A 699 -4.470 2.789 13.587 1.00 36.74 C ATOM 352 CG LEU A 699 -3.238 3.274 14.353 1.00 34.34 C ATOM 353 CD1 LEU A 699 -2.079 3.526 13.405 1.00 34.69 C ATOM 354 CD2 LEU A 699 -3.562 4.524 15.150 1.00 30.15 C ATOM 355 H LEU A 699 -4.652 0.721 15.175 1.00 0.00 H ATOM 356 N LYS A 700 -7.558 0.960 13.872 1.00 57.74 N ATOM 357 CA LYS A 700 -8.698 0.534 13.077 1.00 53.66 C ATOM 358 C LYS A 700 -9.868 1.494 13.277 1.00 57.42 C ATOM 359 O LYS A 700 -10.166 1.886 14.410 1.00 50.47 O ATOM 360 CB LYS A 700 -9.133 -0.881 13.458 1.00 51.55 C ATOM 361 CG LYS A 700 -8.139 -1.974 13.113 1.00 59.15 C ATOM 362 CD LYS A 700 -8.756 -3.348 13.345 1.00 49.83 C ATOM 363 CE LYS A 700 -7.765 -4.460 13.049 1.00 67.53 C ATOM 364 NZ LYS A 700 -8.401 -5.804 13.121 1.00 78.32 N ATOM 365 HZ1 LYS A 700 -8.784 -5.954 14.076 1.00 0.00 H ATOM 366 HZ2 LYS A 700 -9.171 -5.859 12.424 1.00 0.00 H ATOM 367 HZ3 LYS A 700 -7.690 -6.534 12.913 1.00 0.00 H ATOM 368 H LYS A 700 -7.291 0.418 14.719 1.00 0.00 H ATOM 369 N PRO A 701 -10.550 1.896 12.197 1.00 55.72 N ATOM 370 CA PRO A 701 -10.148 1.569 10.827 1.00 47.66 C ATOM 371 C PRO A 701 -9.384 2.713 10.171 1.00 55.84 C ATOM 372 O PRO A 701 -9.059 3.700 10.832 1.00 52.08 O ATOM 373 CB PRO A 701 -11.482 1.335 10.131 1.00 42.72 C ATOM 374 CG PRO A 701 -12.395 2.309 10.814 1.00 47.94 C ATOM 375 CD PRO A 701 -11.914 2.451 12.242 1.00 47.04 C ATOM 376 N GLY A 702 -9.118 2.588 8.876 1.00 55.64 N ATOM 377 CA GLY A 702 -8.360 3.586 8.157 1.00 54.57 C ATOM 378 C GLY A 702 -6.945 3.178 7.819 1.00 56.74 C ATOM 379 O GLY A 702 -6.196 3.998 7.274 1.00 50.35 O ATOM 380 H GLY A 702 -9.464 1.750 8.366 1.00 0.00 H ATOM 381 N VAL A 703 -6.554 1.948 8.135 1.00 57.18 N ATOM 382 CA VAL A 703 -5.256 1.399 7.765 1.00 49.80 C ATOM 383 C VAL A 703 -5.524 0.217 6.845 1.00 43.61 C ATOM 384 O VAL A 703 -6.039 -0.819 7.287 1.00 37.73 O ATOM 385 CB VAL A 703 -4.432 0.976 8.987 1.00 47.81 C ATOM 386 CG1 VAL A 703 -3.179 0.232 8.547 1.00 46.36 C ATOM 387 CG2 VAL A 703 -4.065 2.191 9.819 1.00 43.04 C ATOM 388 H VAL A 703 -7.208 1.346 8.674 1.00 0.00 H ATOM 389 N LEU A 704 -5.179 0.369 5.571 1.00 44.90 N ATOM 390 CA LEU A 704 -5.449 -0.638 4.558 1.00 45.88 C ATOM 391 C LEU A 704 -4.211 -1.488 4.295 1.00 37.41 C ATOM 392 O LEU A 704 -3.094 -1.147 4.691 1.00 36.30 O ATOM 393 CB LEU A 704 -5.928 0.021 3.262 1.00 48.23 C ATOM 394 CG LEU A 704 -7.201 0.863 3.360 1.00 44.54 C ATOM 395 CD1 LEU A 704 -6.879 2.352 3.443 1.00 48.38 C ATOM 396 CD2 LEU A 704 -8.118 0.563 2.187 1.00 47.29 C ATOM 397 H LEU A 704 -4.696 1.245 5.287 1.00 0.00 H ATOM 398 N ARG A 705 -4.433 -2.617 3.613 1.00 37.86 N ATOM 399 CA ARG A 705 -3.332 -3.508 3.259 1.00 33.09 C ATOM 400 C ARG A 705 -2.273 -2.781 2.445 1.00 32.15 C ATOM 401 O ARG A 705 -1.073 -3.037 2.599 1.00 44.95 O ATOM 402 CB ARG A 705 -3.853 -4.714 2.474 1.00 44.82 C ATOM 403 CG ARG A 705 -4.519 -5.790 3.312 1.00 47.83 C ATOM 404 CD ARG A 705 -4.822 -7.026 2.477 1.00 42.13 C ATOM 405 NE ARG A 705 -3.975 -8.161 2.839 1.00 71.77 N ATOM 406 CZ ARG A 705 -4.279 -9.048 3.782 1.00 78.48 C ATOM 407 NH1 ARG A 705 -5.412 -8.932 4.463 1.00 53.00 N ATOM 408 NH2 ARG A 705 -3.451 -10.052 4.045 1.00 70.24 N ATOM 409 HE ARG A 705 -3.078 -8.283 2.327 1.00 0.00 H ATOM 410 HH12 ARG A 705 -5.649 -9.626 5.200 1.00 0.00 H ATOM 411 HH11 ARG A 705 -6.063 -8.147 4.259 1.00 0.00 H ATOM 412 HH22 ARG A 705 -3.691 -10.744 4.783 1.00 0.00 H ATOM 413 HH21 ARG A 705 -2.562 -10.146 3.513 1.00 0.00 H ATOM 414 H ARG A 705 -5.403 -2.864 3.331 1.00 0.00 H ATOM 415 N THR A 706 -2.698 -1.866 1.576 1.00 38.56 N ATOM 416 CA THR A 706 -1.778 -1.187 0.674 1.00 34.35 C ATOM 417 C THR A 706 -0.884 -0.174 1.379 1.00 29.54 C ATOM 418 O THR A 706 0.115 0.251 0.790 1.00 34.73 O ATOM 419 CB THR A 706 -2.563 -0.493 -0.440 1.00 33.12 C ATOM 420 OG1 THR A 706 -3.393 0.529 0.126 1.00 27.41 O ATOM 421 CG2 THR A 706 -3.437 -1.499 -1.172 1.00 25.34 C ATOM 422 HG1 THR A 706 -3.901 0.978 -0.596 1.00 0.00 H ATOM 423 H THR A 706 -3.710 -1.631 1.541 1.00 0.00 H ATOM 424 N ASP A 707 -1.207 0.221 2.614 1.00 30.64 N ATOM 425 CA ASP A 707 -0.418 1.253 3.281 1.00 37.62 C ATOM 426 C ASP A 707 1.019 0.799 3.505 1.00 35.16 C ATOM 427 O ASP A 707 1.955 1.596 3.379 1.00 37.22 O ATOM 428 CB ASP A 707 -1.071 1.647 4.604 1.00 38.27 C ATOM 429 CG ASP A 707 -2.395 2.346 4.410 1.00 39.64 C ATOM 430 OD1 ASP A 707 -2.563 3.027 3.376 1.00 31.69 O ATOM 431 OD2 ASP A 707 -3.270 2.210 5.290 1.00 40.92 O ATOM 432 H ASP A 707 -2.021 -0.207 3.100 1.00 0.00 H ATOM 433 N TYR A 708 1.219 -0.479 3.825 1.00 28.80 N ATOM 434 CA TYR A 708 2.581 -0.966 3.990 1.00 32.52 C ATOM 435 C TYR A 708 3.253 -1.249 2.655 1.00 37.36 C ATOM 436 O TYR A 708 4.467 -1.051 2.527 1.00 33.17 O ATOM 437 CB TYR A 708 2.598 -2.203 4.887 1.00 26.22 C ATOM 438 CG TYR A 708 2.825 -1.827 6.329 1.00 36.30 C ATOM 439 CD1 TYR A 708 4.030 -1.262 6.727 1.00 37.88 C ATOM 440 CD2 TYR A 708 1.834 -2.004 7.285 1.00 36.51 C ATOM 441 CE1 TYR A 708 4.250 -0.896 8.037 1.00 32.97 C ATOM 442 CE2 TYR A 708 2.046 -1.641 8.604 1.00 41.53 C ATOM 443 CZ TYR A 708 3.258 -1.087 8.971 1.00 42.51 C ATOM 444 OH TYR A 708 3.486 -0.720 10.275 1.00 43.07 O ATOM 445 HH TYR A 708 3.402 -1.514 10.860 1.00 0.00 H ATOM 446 H TYR A 708 0.411 -1.121 3.955 1.00 0.00 H ATOM 447 N SER A 709 2.495 -1.694 1.650 1.00 37.57 N ATOM 448 CA SER A 709 3.067 -1.816 0.314 1.00 37.30 C ATOM 449 C SER A 709 3.481 -0.451 -0.224 1.00 34.98 C ATOM 450 O SER A 709 4.502 -0.331 -0.910 1.00 34.46 O ATOM 451 CB SER A 709 2.073 -2.493 -0.630 1.00 33.32 C ATOM 452 OG SER A 709 0.958 -1.661 -0.885 1.00 41.12 O ATOM 453 HG SER A 709 0.496 -1.459 -0.033 1.00 0.00 H ATOM 454 H SER A 709 1.502 -1.952 1.819 1.00 0.00 H ATOM 455 N ASP A 710 2.707 0.591 0.094 1.00 27.73 N ATOM 456 CA ASP A 710 3.061 1.945 -0.327 1.00 33.32 C ATOM 457 C ASP A 710 4.383 2.385 0.289 1.00 31.45 C ATOM 458 O ASP A 710 5.245 2.951 -0.394 1.00 36.42 O ATOM 459 CB ASP A 710 1.945 2.921 0.049 1.00 37.65 C ATOM 460 CG ASP A 710 0.704 2.752 -0.805 1.00 33.56 C ATOM 461 OD1 ASP A 710 0.751 1.988 -1.793 1.00 39.88 O ATOM 462 OD2 ASP A 710 -0.323 3.385 -0.482 1.00 41.37 O ATOM 463 H ASP A 710 1.841 0.436 0.649 1.00 0.00 H ATOM 464 N ILE A 711 4.558 2.141 1.589 1.00 40.42 N ATOM 465 CA ILE A 711 5.813 2.486 2.250 1.00 36.52 C ATOM 466 C ILE A 711 6.965 1.694 1.645 1.00 37.59 C ATOM 467 O ILE A 711 8.011 2.252 1.294 1.00 33.07 O ATOM 468 CB ILE A 711 5.704 2.250 3.768 1.00 27.63 C ATOM 469 CG1 ILE A 711 4.666 3.190 4.380 1.00 32.13 C ATOM 470 CG2 ILE A 711 7.059 2.428 4.432 1.00 29.10 C ATOM 471 CD1 ILE A 711 4.589 3.112 5.886 1.00 30.20 C ATOM 472 H ILE A 711 3.792 1.700 2.137 1.00 0.00 H ATOM 473 N LEU A 712 6.783 0.378 1.503 1.00 28.86 N ATOM 474 CA LEU A 712 7.855 -0.465 0.984 1.00 30.58 C ATOM 475 C LEU A 712 8.203 -0.104 -0.453 1.00 29.66 C ATOM 476 O LEU A 712 9.378 -0.117 -0.835 1.00 41.19 O ATOM 477 CB LEU A 712 7.458 -1.936 1.088 1.00 27.17 C ATOM 478 CG LEU A 712 7.374 -2.458 2.518 1.00 29.20 C ATOM 479 CD1 LEU A 712 6.847 -3.880 2.530 1.00 34.87 C ATOM 480 CD2 LEU A 712 8.742 -2.372 3.183 1.00 30.46 C ATOM 481 H LEU A 712 5.871 -0.048 1.764 1.00 0.00 H ATOM 482 N ASN A 713 7.197 0.219 -1.268 1.00 32.52 N ATOM 483 CA ASN A 713 7.472 0.584 -2.654 1.00 29.30 C ATOM 484 C ASN A 713 8.258 1.884 -2.737 1.00 28.29 C ATOM 485 O ASN A 713 9.140 2.027 -3.592 1.00 36.57 O ATOM 486 CB ASN A 713 6.165 0.689 -3.438 1.00 35.53 C ATOM 487 CG ASN A 713 5.566 -0.666 -3.750 1.00 37.36 C ATOM 488 OD1 ASN A 713 6.275 -1.592 -4.143 1.00 37.82 O ATOM 489 ND2 ASN A 713 4.256 -0.793 -3.567 1.00 37.76 N ATOM 490 HD22 ASN A 713 3.697 0.018 -3.233 1.00 0.00 H ATOM 491 HD21 ASN A 713 3.790 -1.703 -3.758 1.00 0.00 H ATOM 492 H ASN A 713 6.218 0.211 -0.916 1.00 0.00 H ATOM 493 N ASP A 714 7.961 2.840 -1.854 1.00 35.92 N ATOM 494 CA ASP A 714 8.674 4.113 -1.881 1.00 40.52 C ATOM 495 C ASP A 714 10.135 3.957 -1.472 1.00 39.64 C ATOM 496 O ASP A 714 10.985 4.737 -1.917 1.00 45.21 O ATOM 497 CB ASP A 714 7.978 5.133 -0.977 1.00 35.20 C ATOM 498 CG ASP A 714 6.677 5.650 -1.568 1.00 54.12 C ATOM 499 OD1 ASP A 714 6.571 5.724 -2.813 1.00 45.77 O ATOM 500 OD2 ASP A 714 5.760 5.986 -0.788 1.00 56.05 O ATOM 501 H ASP A 714 7.219 2.677 -1.144 1.00 0.00 H ATOM 502 N ILE A 715 10.450 2.965 -0.638 1.00 30.75 N ATOM 503 CA ILE A 715 11.806 2.774 -0.133 1.00 33.75 C ATOM 504 C ILE A 715 12.492 1.565 -0.734 1.00 36.11 C ATOM 505 O ILE A 715 13.631 1.266 -0.346 1.00 39.24 O ATOM 506 CB ILE A 715 11.832 2.664 1.403 1.00 31.16 C ATOM 507 CG1 ILE A 715 11.137 1.378 1.861 1.00 30.98 C ATOM 508 CG2 ILE A 715 11.197 3.876 2.038 1.00 30.53 C ATOM 509 CD1 ILE A 715 11.432 1.004 3.303 1.00 25.64 C ATOM 510 H ILE A 715 9.704 2.305 -0.337 1.00 0.00 H ATOM 511 N TRP A 716 11.848 0.857 -1.666 1.00 35.46 N ATOM 512 CA TRP A 716 12.356 -0.455 -2.056 1.00 36.36 C ATOM 513 C TRP A 716 13.750 -0.372 -2.668 1.00 30.44 C ATOM 514 O TRP A 716 14.626 -1.179 -2.337 1.00 32.11 O ATOM 515 CB TRP A 716 11.402 -1.144 -3.028 1.00 27.39 C ATOM 516 CG TRP A 716 11.916 -2.493 -3.379 1.00 31.15 C ATOM 517 CD1 TRP A 716 12.440 -2.890 -4.572 1.00 34.04 C ATOM 518 CD2 TRP A 716 12.019 -3.619 -2.500 1.00 33.17 C ATOM 519 NE1 TRP A 716 12.838 -4.204 -4.501 1.00 35.93 N ATOM 520 CE2 TRP A 716 12.589 -4.673 -3.238 1.00 32.43 C ATOM 521 CE3 TRP A 716 11.667 -3.841 -1.165 1.00 29.70 C ATOM 522 CZ2 TRP A 716 12.823 -5.927 -2.684 1.00 35.88 C ATOM 523 CZ3 TRP A 716 11.894 -5.086 -0.620 1.00 29.18 C ATOM 524 CH2 TRP A 716 12.463 -6.115 -1.378 1.00 40.30 C ATOM 525 HE1 TRP A 716 13.259 -4.752 -5.278 1.00 0.00 H ATOM 526 H TRP A 716 10.989 1.238 -2.111 1.00 0.00 H ATOM 527 N ASN A 717 13.976 0.589 -3.565 1.00 33.42 N ATOM 528 CA ASN A 717 15.269 0.671 -4.236 1.00 35.62 C ATOM 529 C ASN A 717 16.379 1.007 -3.248 1.00 33.93 C ATOM 530 O ASN A 717 17.426 0.348 -3.227 1.00 31.31 O ATOM 531 CB ASN A 717 15.211 1.699 -5.365 1.00 35.97 C ATOM 532 CG ASN A 717 14.154 1.366 -6.400 1.00 40.36 C ATOM 533 OD1 ASN A 717 13.007 1.802 -6.296 1.00 49.77 O ATOM 534 ND2 ASN A 717 14.532 0.581 -7.402 1.00 34.67 N ATOM 535 HD22 ASN A 717 15.512 0.235 -7.451 1.00 0.00 H ATOM 536 HD21 ASN A 717 13.848 0.312 -8.138 1.00 0.00 H ATOM 537 H ASN A 717 13.231 1.280 -3.786 1.00 0.00 H ATOM 538 N VAL A 718 16.162 2.027 -2.413 1.00 30.77 N ATOM 539 CA VAL A 718 17.145 2.381 -1.391 1.00 35.68 C ATOM 540 C VAL A 718 17.353 1.222 -0.424 1.00 34.11 C ATOM 541 O VAL A 718 18.481 0.943 0.001 1.00 29.93 O ATOM 542 CB VAL A 718 16.708 3.662 -0.656 1.00 33.30 C ATOM 543 CG1 VAL A 718 17.638 3.960 0.514 1.00 19.82 C ATOM 544 CG2 VAL A 718 16.670 4.836 -1.621 1.00 49.95 C ATOM 545 H VAL A 718 15.282 2.576 -2.491 1.00 0.00 H ATOM 546 N LEU A 719 16.272 0.519 -0.072 1.00 31.49 N ATOM 547 CA LEU A 719 16.385 -0.605 0.853 1.00 28.55 C ATOM 548 C LEU A 719 17.280 -1.699 0.285 1.00 30.10 C ATOM 549 O LEU A 719 18.069 -2.308 1.017 1.00 31.17 O ATOM 550 CB LEU A 719 14.993 -1.153 1.176 1.00 36.30 C ATOM 551 CG LEU A 719 14.844 -2.267 2.215 1.00 34.55 C ATOM 552 CD1 LEU A 719 15.393 -1.846 3.569 1.00 27.50 C ATOM 553 CD2 LEU A 719 13.385 -2.684 2.339 1.00 27.92 C ATOM 554 H LEU A 719 15.342 0.775 -0.461 1.00 0.00 H ATOM 555 N VAL A 720 17.177 -1.961 -1.019 1.00 32.53 N ATOM 556 CA VAL A 720 18.021 -2.973 -1.647 1.00 30.61 C ATOM 557 C VAL A 720 19.437 -2.447 -1.846 1.00 28.52 C ATOM 558 O VAL A 720 20.413 -3.191 -1.693 1.00 31.66 O ATOM 559 CB VAL A 720 17.392 -3.436 -2.976 1.00 33.41 C ATOM 560 CG1 VAL A 720 18.371 -4.288 -3.773 1.00 20.81 C ATOM 561 CG2 VAL A 720 16.112 -4.215 -2.713 1.00 29.15 C ATOM 562 H VAL A 720 16.487 -1.438 -1.595 1.00 0.00 H ATOM 563 N GLU A 721 19.575 -1.157 -2.172 1.00 31.24 N ATOM 564 CA GLU A 721 20.896 -0.598 -2.450 1.00 30.08 C ATOM 565 C GLU A 721 21.770 -0.570 -1.202 1.00 31.05 C ATOM 566 O GLU A 721 22.982 -0.802 -1.287 1.00 29.75 O ATOM 567 CB GLU A 721 20.763 0.806 -3.039 1.00 27.78 C ATOM 568 CG GLU A 721 20.341 0.838 -4.498 1.00 45.76 C ATOM 569 CD GLU A 721 20.187 2.254 -5.026 1.00 61.71 C ATOM 570 OE1 GLU A 721 20.256 3.202 -4.213 1.00 54.19 O ATOM 571 OE2 GLU A 721 20.000 2.418 -6.251 1.00 54.40 O ATOM 572 H GLU A 721 18.735 -0.547 -2.228 1.00 0.00 H ATOM 573 N ARG A 722 21.182 -0.291 -0.033 1.00 26.03 N ATOM 574 CA ARG A 722 21.971 -0.244 1.194 1.00 29.10 C ATOM 575 C ARG A 722 22.606 -1.587 1.526 1.00 31.33 C ATOM 576 O ARG A 722 23.589 -1.623 2.275 1.00 28.65 O ATOM 577 CB ARG A 722 21.114 0.222 2.369 1.00 27.29 C ATOM 578 CG ARG A 722 20.616 1.650 2.251 1.00 29.11 C ATOM 579 CD ARG A 722 21.748 2.642 2.046 1.00 21.57 C ATOM 580 NE ARG A 722 21.225 3.994 1.877 1.00 34.96 N ATOM 581 CZ ARG A 722 21.936 5.030 1.449 1.00 32.51 C ATOM 582 NH1 ARG A 722 23.216 4.878 1.138 1.00 35.50 N ATOM 583 NH2 ARG A 722 21.364 6.222 1.328 1.00 26.34 N ATOM 584 HE ARG A 722 20.224 4.157 2.108 1.00 0.00 H ATOM 585 HH12 ARG A 722 23.770 5.692 0.803 1.00 0.00 H ATOM 586 HH11 ARG A 722 23.666 3.945 1.229 1.00 0.00 H ATOM 587 HH22 ARG A 722 21.920 7.034 0.993 1.00 0.00 H ATOM 588 HH21 ARG A 722 20.360 6.344 1.568 1.00 0.00 H ATOM 589 H ARG A 722 20.159 -0.107 0.001 1.00 0.00 H ATOM 590 N ASP A 723 22.066 -2.683 0.990 1.00 29.44 N ATOM 591 CA ASP A 723 22.633 -4.021 1.162 1.00 25.48 C ATOM 592 C ASP A 723 22.800 -4.363 2.643 1.00 19.42 C ATOM 593 O ASP A 723 23.832 -4.878 3.078 1.00 25.41 O ATOM 594 CB ASP A 723 23.959 -4.154 0.405 1.00 26.00 C ATOM 595 CG ASP A 723 24.385 -5.601 0.223 1.00 39.04 C ATOM 596 OD1 ASP A 723 23.558 -6.411 -0.251 1.00 47.85 O ATOM 597 OD2 ASP A 723 25.545 -5.930 0.548 1.00 41.01 O ATOM 598 H ASP A 723 21.200 -2.581 0.423 1.00 0.00 H ATOM 599 N LEU A 724 21.767 -4.058 3.428 1.00 23.20 N ATOM 600 CA LEU A 724 21.725 -4.428 4.834 1.00 18.20 C ATOM 601 C LEU A 724 20.587 -5.381 5.167 1.00 24.42 C ATOM 602 O LEU A 724 20.557 -5.915 6.282 1.00 24.36 O ATOM 603 CB LEU A 724 21.606 -3.176 5.717 1.00 14.00 C ATOM 604 CG LEU A 724 22.791 -2.206 5.682 1.00 21.06 C ATOM 605 CD1 LEU A 724 22.514 -0.962 6.515 1.00 12.95 C ATOM 606 CD2 LEU A 724 24.056 -2.906 6.159 1.00 20.11 C ATOM 607 H LEU A 724 20.964 -3.538 3.021 1.00 0.00 H ATOM 608 N SER A 725 19.663 -5.612 4.243 1.00 19.88 N ATOM 609 CA SER A 725 18.507 -6.461 4.472 1.00 21.80 C ATOM 610 C SER A 725 18.690 -7.805 3.783 1.00 21.99 C ATOM 611 O SER A 725 19.479 -7.952 2.846 1.00 26.14 O ATOM 612 CB SER A 725 17.229 -5.786 3.966 1.00 16.81 C ATOM 613 OG SER A 725 17.035 -4.530 4.590 1.00 16.56 O ATOM 614 HG SER A 725 17.805 -3.941 4.390 1.00 0.00 H ATOM 615 H SER A 725 19.772 -5.164 3.311 1.00 0.00 H ATOM 616 N PHE A 726 17.936 -8.791 4.258 1.00 23.63 N ATOM 617 CA PHE A 726 18.001 -10.127 3.694 1.00 22.15 C ATOM 618 C PHE A 726 16.624 -10.765 3.770 1.00 21.40 C ATOM 619 O PHE A 726 15.761 -10.341 4.542 1.00 21.59 O ATOM 620 CB PHE A 726 19.043 -10.996 4.417 1.00 22.76 C ATOM 621 CG PHE A 726 18.800 -11.141 5.897 1.00 19.74 C ATOM 622 CD1 PHE A 726 18.002 -12.162 6.386 1.00 25.43 C ATOM 623 CD2 PHE A 726 19.376 -10.259 6.799 1.00 21.25 C ATOM 624 CE1 PHE A 726 17.776 -12.299 7.745 1.00 26.63 C ATOM 625 CE2 PHE A 726 19.153 -10.390 8.160 1.00 25.34 C ATOM 626 CZ PHE A 726 18.353 -11.413 8.633 1.00 23.59 C ATOM 627 H PHE A 726 17.287 -8.602 5.049 1.00 0.00 H ATOM 628 N VAL A 727 16.426 -11.783 2.943 1.00 25.89 N ATOM 629 CA VAL A 727 15.261 -12.647 3.038 1.00 28.63 C ATOM 630 C VAL A 727 15.732 -14.013 3.516 1.00 25.01 C ATOM 631 O VAL A 727 16.913 -14.362 3.429 1.00 24.29 O ATOM 632 CB VAL A 727 14.500 -12.762 1.701 1.00 24.30 C ATOM 633 CG1 VAL A 727 13.871 -11.430 1.333 1.00 28.21 C ATOM 634 CG2 VAL A 727 15.433 -13.238 0.601 1.00 21.50 C ATOM 635 H VAL A 727 17.129 -11.970 2.200 1.00 0.00 H ATOM 636 N VAL A 728 14.793 -14.791 4.042 1.00 30.32 N ATOM 637 CA VAL A 728 15.075 -16.135 4.529 1.00 24.45 C ATOM 638 C VAL A 728 14.302 -17.120 3.667 1.00 28.65 C ATOM 639 O VAL A 728 13.067 -17.070 3.609 1.00 26.39 O ATOM 640 CB VAL A 728 14.714 -16.298 6.012 1.00 20.34 C ATOM 641 CG1 VAL A 728 14.875 -17.745 6.430 1.00 27.85 C ATOM 642 CG2 VAL A 728 15.597 -15.403 6.860 1.00 21.75 C ATOM 643 H VAL A 728 13.821 -14.428 4.109 1.00 0.00 H ATOM 644 N TYR A 729 15.028 -18.005 2.993 1.00 28.00 N ATOM 645 CA TYR A 729 14.423 -19.041 2.173 1.00 34.72 C ATOM 646 C TYR A 729 14.250 -20.320 2.976 1.00 31.58 C ATOM 647 O TYR A 729 15.121 -20.698 3.762 1.00 27.36 O ATOM 648 CB TYR A 729 15.283 -19.333 0.942 1.00 32.53 C ATOM 649 CG TYR A 729 15.126 -18.349 -0.193 1.00 39.00 C ATOM 650 CD1 TYR A 729 14.138 -18.522 -1.154 1.00 35.65 C ATOM 651 CD2 TYR A 729 15.974 -17.257 -0.315 1.00 40.42 C ATOM 652 CE1 TYR A 729 13.994 -17.630 -2.199 1.00 37.14 C ATOM 653 CE2 TYR A 729 15.838 -16.359 -1.358 1.00 38.11 C ATOM 654 CZ TYR A 729 14.845 -16.551 -2.296 1.00 33.54 C ATOM 655 OH TYR A 729 14.702 -15.663 -3.335 1.00 37.22 O ATOM 656 HH TYR A 729 14.519 -14.760 -2.973 1.00 0.00 H ATOM 657 H TYR A 729 16.065 -17.955 3.054 1.00 0.00 H ATOM 658 N ASP A 730 13.114 -20.979 2.778 1.00 30.89 N ATOM 659 CA ASP A 730 12.975 -22.390 3.123 1.00 36.48 C ATOM 660 C ASP A 730 13.610 -23.170 1.981 1.00 40.65 C ATOM 661 O ASP A 730 13.020 -23.308 0.907 1.00 40.04 O ATOM 662 CB ASP A 730 11.507 -22.757 3.318 1.00 35.50 C ATOM 663 CG ASP A 730 11.306 -24.202 3.757 1.00 36.76 C ATOM 664 OD1 ASP A 730 12.187 -25.055 3.514 1.00 36.18 O ATOM 665 OD2 ASP A 730 10.242 -24.489 4.342 1.00 51.68 O ATOM 666 H ASP A 730 12.302 -20.476 2.366 1.00 0.00 H ATOM 667 N THR A 731 14.830 -23.671 2.203 1.00 40.34 N ATOM 668 CA THR A 731 15.572 -24.327 1.131 1.00 39.45 C ATOM 669 C THR A 731 14.889 -25.594 0.631 1.00 47.20 C ATOM 670 O THR A 731 15.197 -26.051 -0.476 1.00 56.51 O ATOM 671 CB THR A 731 16.992 -24.649 1.595 1.00 41.47 C ATOM 672 OG1 THR A 731 16.940 -25.348 2.843 1.00 47.27 O ATOM 673 CG2 THR A 731 17.795 -23.370 1.770 1.00 35.63 C ATOM 674 HG1 THR A 731 16.492 -24.780 3.519 1.00 0.00 H ATOM 675 H THR A 731 15.254 -23.592 3.149 1.00 0.00 H ATOM 676 N ASN A 732 13.970 -26.169 1.411 1.00 51.80 N ATOM 677 CA ASN A 732 13.205 -27.317 0.937 1.00 53.74 C ATOM 678 C ASN A 732 12.130 -26.913 -0.063 1.00 49.63 C ATOM 679 O ASN A 732 11.750 -27.721 -0.918 1.00 55.02 O ATOM 680 CB ASN A 732 12.571 -28.056 2.118 1.00 51.81 C ATOM 681 CG ASN A 732 13.458 -29.164 2.655 1.00 62.41 C ATOM 682 OD1 ASN A 732 14.518 -28.906 3.228 1.00 55.11 O ATOM 683 ND2 ASN A 732 13.024 -30.407 2.474 1.00 64.92 N ATOM 684 HD22 ASN A 732 12.122 -30.577 1.984 1.00 0.00 H ATOM 685 HD21 ASN A 732 13.586 -31.210 2.822 1.00 0.00 H ATOM 686 H ASN A 732 13.798 -25.795 2.366 1.00 0.00 H ATOM 687 N THR A 733 11.627 -25.683 0.030 1.00 42.11 N ATOM 688 CA THR A 733 10.653 -25.171 -0.921 1.00 46.12 C ATOM 689 C THR A 733 11.197 -24.046 -1.786 1.00 47.61 C ATOM 690 O THR A 733 10.519 -23.639 -2.738 1.00 49.22 O ATOM 691 CB THR A 733 9.394 -24.675 -0.190 1.00 44.35 C ATOM 692 OG1 THR A 733 9.649 -23.391 0.392 1.00 46.32 O ATOM 693 CG2 THR A 733 8.995 -25.652 0.907 1.00 44.19 C ATOM 694 HG1 THR A 733 8.836 -23.075 0.861 1.00 0.00 H ATOM 695 H THR A 733 11.941 -25.069 0.808 1.00 0.00 H ATOM 696 N ASP A 734 12.393 -23.536 -1.483 1.00 48.77 N ATOM 697 CA ASP A 734 12.989 -22.419 -2.218 1.00 52.12 C ATOM 698 C ASP A 734 12.042 -21.223 -2.272 1.00 41.89 C ATOM 699 O ASP A 734 12.029 -20.459 -3.241 1.00 37.49 O ATOM 700 CB ASP A 734 13.416 -22.849 -3.623 1.00 46.74 C ATOM 701 CG ASP A 734 14.452 -23.956 -3.600 1.00 50.14 C ATOM 702 OD1 ASP A 734 15.199 -24.053 -2.602 1.00 52.83 O ATOM 703 OD2 ASP A 734 14.523 -24.730 -4.579 1.00 75.68 O ATOM 704 H ASP A 734 12.924 -23.950 -0.691 1.00 0.00 H ATOM 705 N ARG A 735 11.235 -21.062 -1.226 1.00 31.26 N ATOM 706 CA ARG A 735 10.328 -19.934 -1.092 1.00 40.37 C ATOM 707 C ARG A 735 10.710 -19.114 0.131 1.00 36.96 C ATOM 708 O ARG A 735 11.215 -19.647 1.124 1.00 31.77 O ATOM 709 CB ARG A 735 8.871 -20.392 -0.976 1.00 40.14 C ATOM 710 CG ARG A 735 8.356 -21.149 -2.187 1.00 45.10 C ATOM 711 CD ARG A 735 6.849 -21.322 -2.110 1.00 53.51 C ATOM 712 NE ARG A 735 6.332 -22.178 -3.173 1.00 66.18 N ATOM 713 CZ ARG A 735 5.053 -22.519 -3.296 1.00 59.64 C ATOM 714 NH1 ARG A 735 4.159 -22.076 -2.422 1.00 46.74 N ATOM 715 NH2 ARG A 735 4.667 -23.303 -4.293 1.00 55.70 N ATOM 716 HE ARG A 735 7.005 -22.543 -3.877 1.00 0.00 H ATOM 717 HH12 ARG A 735 3.159 -22.344 -2.520 1.00 0.00 H ATOM 718 HH11 ARG A 735 4.458 -21.461 -1.639 1.00 0.00 H ATOM 719 HH22 ARG A 735 3.666 -23.569 -4.388 1.00 0.00 H ATOM 720 HH21 ARG A 735 5.365 -23.652 -4.980 1.00 0.00 H ATOM 721 H ARG A 735 11.254 -21.776 -0.470 1.00 0.00 H ATOM 722 N ILE A 736 10.469 -17.810 0.048 1.00 34.56 N ATOM 723 CA ILE A 736 10.805 -16.901 1.137 1.00 30.84 C ATOM 724 C ILE A 736 9.785 -17.066 2.254 1.00 31.00 C ATOM 725 O ILE A 736 8.571 -17.006 2.021 1.00 31.79 O ATOM 726 CB ILE A 736 10.858 -15.448 0.636 1.00 33.37 C ATOM 727 CG1 ILE A 736 11.898 -15.306 -0.480 1.00 33.18 C ATOM 728 CG2 ILE A 736 11.172 -14.493 1.783 1.00 18.81 C ATOM 729 CD1 ILE A 736 12.029 -13.899 -1.034 1.00 24.58 C ATOM 730 H ILE A 736 10.030 -17.429 -0.814 1.00 0.00 H ATOM 731 N ILE A 737 10.277 -17.286 3.473 1.00 24.55 N ATOM 732 CA ILE A 737 9.421 -17.421 4.648 1.00 28.11 C ATOM 733 C ILE A 737 9.607 -16.289 5.642 1.00 30.10 C ATOM 734 O ILE A 737 8.802 -16.174 6.582 1.00 28.60 O ATOM 735 CB ILE A 737 9.645 -18.772 5.356 1.00 23.63 C ATOM 736 CG1 ILE A 737 11.085 -18.861 5.869 1.00 25.72 C ATOM 737 CG2 ILE A 737 9.331 -19.916 4.417 1.00 24.85 C ATOM 738 CD1 ILE A 737 11.381 -20.125 6.646 1.00 30.35 C ATOM 739 H ILE A 737 11.307 -17.364 3.591 1.00 0.00 H ATOM 740 N GLY A 738 10.633 -15.460 5.479 1.00 28.96 N ATOM 741 CA GLY A 738 10.888 -14.395 6.429 1.00 27.46 C ATOM 742 C GLY A 738 11.795 -13.345 5.836 1.00 24.96 C ATOM 743 O GLY A 738 12.479 -13.578 4.834 1.00 28.80 O ATOM 744 H GLY A 738 11.262 -15.577 4.659 1.00 0.00 H ATOM 745 N THR A 739 11.793 -12.175 6.467 1.00 24.72 N ATOM 746 CA THR A 739 12.620 -11.078 5.992 1.00 25.60 C ATOM 747 C THR A 739 12.959 -10.154 7.151 1.00 22.56 C ATOM 748 O THR A 739 12.175 -9.988 8.091 1.00 22.63 O ATOM 749 CB THR A 739 11.932 -10.293 4.870 1.00 26.84 C ATOM 750 OG1 THR A 739 12.800 -9.247 4.421 1.00 24.65 O ATOM 751 CG2 THR A 739 10.623 -9.688 5.360 1.00 29.80 C ATOM 752 HG1 THR A 739 13.642 -9.642 4.081 1.00 0.00 H ATOM 753 H THR A 739 11.195 -12.043 7.307 1.00 0.00 H ATOM 754 N ALA A 740 14.149 -9.568 7.077 1.00 20.43 N ATOM 755 CA ALA A 740 14.630 -8.605 8.065 1.00 23.98 C ATOM 756 C ALA A 740 15.082 -7.366 7.302 1.00 27.87 C ATOM 757 O ALA A 740 16.138 -7.367 6.664 1.00 24.60 O ATOM 758 CB ALA A 740 15.761 -9.184 8.907 1.00 13.62 C ATOM 759 H ALA A 740 14.769 -9.806 6.276 1.00 0.00 H ATOM 760 N LEU A 741 14.271 -6.319 7.352 1.00 24.23 N ATOM 761 CA LEU A 741 14.582 -5.067 6.682 1.00 27.20 C ATOM 762 C LEU A 741 15.405 -4.201 7.626 1.00 23.06 C ATOM 763 O LEU A 741 14.950 -3.865 8.725 1.00 27.87 O ATOM 764 CB LEU A 741 13.300 -4.356 6.256 1.00 28.66 C ATOM 765 CG LEU A 741 12.270 -5.252 5.561 1.00 23.86 C ATOM 766 CD1 LEU A 741 11.081 -4.436 5.084 1.00 24.79 C ATOM 767 CD2 LEU A 741 12.901 -6.016 4.404 1.00 27.65 C ATOM 768 H LEU A 741 13.383 -6.396 7.888 1.00 0.00 H ATOM 769 N ASN A 742 16.617 -3.854 7.204 1.00 19.86 N ATOM 770 CA ASN A 742 17.548 -3.114 8.039 1.00 23.09 C ATOM 771 C ASN A 742 18.010 -1.858 7.321 1.00 23.02 C ATOM 772 O ASN A 742 18.166 -1.843 6.098 1.00 28.12 O ATOM 773 CB ASN A 742 18.773 -3.956 8.409 1.00 20.80 C ATOM 774 CG ASN A 742 18.401 -5.291 9.005 1.00 20.20 C ATOM 775 OD1 ASN A 742 17.821 -5.358 10.087 1.00 28.96 O ATOM 776 ND2 ASN A 742 18.743 -6.368 8.305 1.00 17.75 N ATOM 777 HD22 ASN A 742 19.233 -6.262 7.394 1.00 0.00 H ATOM 778 HD21 ASN A 742 18.521 -7.317 8.669 1.00 0.00 H ATOM 779 H ASN A 742 16.909 -4.122 6.242 1.00 0.00 H ATOM 780 N PHE A 743 18.232 -0.807 8.104 1.00 23.93 N ATOM 781 CA PHE A 743 18.875 0.409 7.635 1.00 20.34 C ATOM 782 C PHE A 743 19.907 0.846 8.661 1.00 25.09 C ATOM 783 O PHE A 743 19.835 0.482 9.837 1.00 26.57 O ATOM 784 CB PHE A 743 17.878 1.554 7.418 1.00 22.14 C ATOM 785 CG PHE A 743 17.197 1.532 6.081 1.00 30.96 C ATOM 786 CD1 PHE A 743 17.930 1.636 4.910 1.00 26.73 C ATOM 787 CD2 PHE A 743 15.819 1.449 5.998 1.00 21.76 C ATOM 788 CE1 PHE A 743 17.298 1.627 3.681 1.00 30.89 C ATOM 789 CE2 PHE A 743 15.183 1.443 4.777 1.00 25.21 C ATOM 790 CZ PHE A 743 15.921 1.533 3.616 1.00 28.84 C ATOM 791 H PHE A 743 17.932 -0.857 9.098 1.00 0.00 H ATOM 792 N ASP A 744 20.878 1.626 8.199 1.00 24.70 N ATOM 793 CA ASP A 744 21.665 2.439 9.113 1.00 22.09 C ATOM 794 C ASP A 744 20.732 3.439 9.779 1.00 21.07 C ATOM 795 O ASP A 744 20.018 4.180 9.095 1.00 23.82 O ATOM 796 CB ASP A 744 22.786 3.154 8.352 1.00 31.72 C ATOM 797 CG ASP A 744 23.764 3.890 9.270 1.00 24.63 C ATOM 798 OD1 ASP A 744 23.415 4.207 10.427 1.00 29.25 O ATOM 799 OD2 ASP A 744 24.893 4.166 8.816 1.00 31.16 O ATOM 800 H ASP A 744 21.077 1.656 7.179 1.00 0.00 H ATOM 801 N ALA A 745 20.715 3.443 11.114 1.00 24.95 N ATOM 802 CA ALA A 745 19.765 4.291 11.829 1.00 29.83 C ATOM 803 C ALA A 745 19.976 5.767 11.520 1.00 32.55 C ATOM 804 O ALA A 745 19.017 6.547 11.541 1.00 30.76 O ATOM 805 CB ALA A 745 19.867 4.045 13.332 1.00 23.25 C ATOM 806 H ALA A 745 21.378 2.842 11.645 1.00 0.00 H ATOM 807 N ARG A 746 21.214 6.168 11.231 1.00 31.33 N ATOM 808 CA ARG A 746 21.532 7.543 10.878 1.00 26.62 C ATOM 809 C ARG A 746 21.600 7.750 9.369 1.00 32.19 C ATOM 810 O ARG A 746 22.185 8.738 8.909 1.00 27.94 O ATOM 811 CB ARG A 746 22.848 7.961 11.534 1.00 24.42 C ATOM 812 CG ARG A 746 22.894 7.672 13.025 1.00 22.20 C ATOM 813 CD ARG A 746 24.059 8.376 13.699 1.00 23.21 C ATOM 814 NE ARG A 746 24.124 8.087 15.129 1.00 27.39 N ATOM 815 CZ ARG A 746 23.285 8.590 16.030 1.00 21.93 C ATOM 816 NH1 ARG A 746 23.416 8.278 17.311 1.00 20.56 N ATOM 817 NH2 ARG A 746 22.307 9.399 15.648 1.00 25.61 N ATOM 818 HE ARG A 746 24.873 7.448 15.464 1.00 0.00 H ATOM 819 HH12 ARG A 746 22.758 8.673 18.012 1.00 0.00 H ATOM 820 HH11 ARG A 746 24.177 7.638 17.615 1.00 0.00 H ATOM 821 HH22 ARG A 746 21.652 9.792 16.354 1.00 0.00 H ATOM 822 HH21 ARG A 746 22.195 9.641 14.643 1.00 0.00 H ATOM 823 H ARG A 746 21.984 5.469 11.259 1.00 0.00 H ATOM 824 N ASN A 747 21.014 6.844 8.594 1.00 27.75 N ATOM 825 CA ASN A 747 21.050 6.931 7.139 1.00 29.37 C ATOM 826 C ASN A 747 19.834 6.208 6.563 1.00 25.18 C ATOM 827 O ASN A 747 19.950 5.319 5.719 1.00 29.29 O ATOM 828 CB ASN A 747 22.360 6.355 6.601 1.00 32.62 C ATOM 829 CG ASN A 747 22.569 6.644 5.127 1.00 34.40 C ATOM 830 OD1 ASN A 747 21.985 7.578 4.578 1.00 29.17 O ATOM 831 ND2 ASN A 747 23.401 5.837 4.476 1.00 31.93 N ATOM 832 HD22 ASN A 747 23.873 5.060 4.981 1.00 0.00 H ATOM 833 HD21 ASN A 747 23.580 5.983 3.462 1.00 0.00 H ATOM 834 H ASN A 747 20.514 6.048 9.039 1.00 0.00 H ATOM 835 N GLU A 748 18.639 6.589 7.032 1.00 30.03 N ATOM 836 CA GLU A 748 17.370 6.008 6.631 1.00 34.10 C ATOM 837 C GLU A 748 16.670 6.892 5.604 1.00 34.70 C ATOM 838 O GLU A 748 16.841 8.115 5.605 1.00 41.45 O ATOM 839 CB GLU A 748 16.449 5.817 7.840 1.00 28.47 C ATOM 840 CG GLU A 748 16.875 4.712 8.777 1.00 26.80 C ATOM 841 CD GLU A 748 15.757 4.274 9.699 1.00 33.75 C ATOM 842 OE1 GLU A 748 14.742 4.997 9.790 1.00 36.06 O ATOM 843 OE2 GLU A 748 15.890 3.207 10.333 1.00 33.45 O ATOM 844 H GLU A 748 18.618 7.356 7.734 1.00 0.00 H ATOM 845 N PRO A 749 15.878 6.296 4.717 1.00 38.59 N ATOM 846 CA PRO A 749 15.181 7.093 3.703 1.00 44.82 C ATOM 847 C PRO A 749 14.125 7.999 4.316 1.00 46.99 C ATOM 848 O PRO A 749 13.509 7.682 5.338 1.00 38.67 O ATOM 849 CB PRO A 749 14.545 6.035 2.793 1.00 40.75 C ATOM 850 CG PRO A 749 14.448 4.810 3.647 1.00 30.62 C ATOM 851 CD PRO A 749 15.646 4.852 4.542 1.00 33.64 C ATOM 852 N GLU A 750 13.927 9.145 3.670 1.00 46.23 N ATOM 853 CA GLU A 750 12.916 10.109 4.086 1.00 53.39 C ATOM 854 C GLU A 750 11.569 9.687 3.513 1.00 52.78 C ATOM 855 O GLU A 750 11.409 9.601 2.291 1.00 51.99 O ATOM 856 CB GLU A 750 13.289 11.515 3.615 1.00 56.88 C ATOM 857 CG GLU A 750 14.713 11.963 3.953 1.00 63.33 C ATOM 858 CD GLU A 750 15.765 11.353 3.034 1.00 74.31 C ATOM 859 OE1 GLU A 750 16.919 11.171 3.481 1.00 69.86 O ATOM 860 OE2 GLU A 750 15.433 11.044 1.868 1.00 61.35 O ATOM 861 H GLU A 750 14.514 9.361 2.839 1.00 0.00 H ATOM 862 N VAL A 751 10.603 9.420 4.387 1.00 55.42 N ATOM 863 CA VAL A 751 9.305 8.892 3.985 1.00 53.12 C ATOM 864 C VAL A 751 8.221 9.877 4.393 1.00 58.59 C ATOM 865 O VAL A 751 8.048 10.163 5.585 1.00 52.89 O ATOM 866 CB VAL A 751 9.035 7.509 4.597 1.00 47.37 C ATOM 867 CG1 VAL A 751 9.502 6.428 3.655 1.00 26.92 C ATOM 868 CG2 VAL A 751 9.722 7.382 5.952 1.00 57.32 C ATOM 869 H VAL A 751 10.780 9.595 5.397 1.00 0.00 H ATOM 870 N ASP A 752 7.491 10.390 3.405 1.00 63.33 N ATOM 871 CA ASP A 752 6.270 11.152 3.656 1.00 63.89 C ATOM 872 C ASP A 752 5.114 10.164 3.599 1.00 57.51 C ATOM 873 O ASP A 752 4.479 9.969 2.560 1.00 56.06 O ATOM 874 CB ASP A 752 6.112 12.286 2.652 1.00 61.90 C ATOM 875 CG ASP A 752 6.460 13.636 3.244 1.00 76.28 C ATOM 876 OD1 ASP A 752 7.590 13.790 3.757 1.00 76.19 O ATOM 877 OD2 ASP A 752 5.603 14.543 3.198 1.00 84.77 O ATOM 878 H ASP A 752 7.800 10.244 2.423 1.00 0.00 H ATOM 879 N ILE A 753 4.857 9.520 4.734 1.00 45.97 N ATOM 880 CA ILE A 753 3.804 8.517 4.848 1.00 50.63 C ATOM 881 C ILE A 753 2.465 9.242 4.923 1.00 52.93 C ATOM 882 O ILE A 753 2.176 9.928 5.906 1.00 56.18 O ATOM 883 CB ILE A 753 4.022 7.622 6.072 1.00 44.99 C ATOM 884 CG1 ILE A 753 5.398 6.954 5.991 1.00 48.00 C ATOM 885 CG2 ILE A 753 2.903 6.593 6.188 1.00 36.13 C ATOM 886 CD1 ILE A 753 5.854 6.317 7.281 1.00 34.41 C ATOM 887 H ILE A 753 5.430 9.740 5.574 1.00 0.00 H ATOM 888 N LYS A 754 1.647 9.097 3.883 1.00 45.14 N ATOM 889 CA LYS A 754 0.334 9.736 3.825 1.00 52.66 C ATOM 890 C LYS A 754 -0.778 8.767 4.204 1.00 43.62 C ATOM 891 O LYS A 754 -1.838 8.731 3.572 1.00 56.28 O ATOM 892 CB LYS A 754 0.087 10.328 2.440 1.00 66.20 C ATOM 893 CG LYS A 754 -0.920 11.476 2.432 1.00 65.91 C ATOM 894 CD LYS A 754 -1.316 11.873 1.019 1.00 69.63 C ATOM 895 CE LYS A 754 -2.260 13.069 1.023 1.00 69.73 C ATOM 896 NZ LYS A 754 -3.506 12.817 1.805 1.00 51.58 N ATOM 897 HZ1 LYS A 754 -4.016 12.010 1.392 1.00 0.00 H ATOM 898 HZ2 LYS A 754 -3.257 12.604 2.792 1.00 0.00 H ATOM 899 HZ3 LYS A 754 -4.110 13.663 1.774 1.00 0.00 H ATOM 900 H LYS A 754 1.953 8.508 3.083 1.00 0.00 H ATOM 901 N SER A 755 -0.550 7.959 5.234 1.00 41.79 N ATOM 902 CA SER A 755 -1.548 7.042 5.764 1.00 39.27 C ATOM 903 C SER A 755 -1.532 7.142 7.283 1.00 36.98 C ATOM 904 O SER A 755 -0.707 7.847 7.871 1.00 37.11 O ATOM 905 CB SER A 755 -1.286 5.601 5.306 1.00 44.47 C ATOM 906 OG SER A 755 -0.084 5.094 5.863 1.00 37.29 O ATOM 907 HG SER A 755 0.057 4.165 5.550 1.00 0.00 H ATOM 908 H SER A 755 0.388 7.983 5.683 1.00 0.00 H ATOM 909 N LYS A 756 -2.451 6.424 7.928 1.00 38.44 N ATOM 910 CA LYS A 756 -2.470 6.420 9.384 1.00 38.52 C ATOM 911 C LYS A 756 -1.268 5.701 9.980 1.00 33.50 C ATOM 912 O LYS A 756 -1.075 5.762 11.198 1.00 39.41 O ATOM 913 CB LYS A 756 -3.770 5.799 9.897 1.00 49.34 C ATOM 914 CG LYS A 756 -4.967 6.741 9.820 1.00 52.26 C ATOM 915 CD LYS A 756 -4.715 8.015 10.622 1.00 52.83 C ATOM 916 CE LYS A 756 -5.912 8.957 10.576 1.00 56.80 C ATOM 917 NZ LYS A 756 -5.752 10.130 11.487 1.00 38.99 N ATOM 918 HZ1 LYS A 756 -5.645 9.795 12.466 1.00 0.00 H ATOM 919 HZ2 LYS A 756 -4.908 10.670 11.210 1.00 0.00 H ATOM 920 HZ3 LYS A 756 -6.593 10.738 11.418 1.00 0.00 H ATOM 921 H LYS A 756 -3.151 5.870 7.394 1.00 0.00 H ATOM 922 N LEU A 757 -0.458 5.029 9.157 1.00 33.27 N ATOM 923 CA LEU A 757 0.813 4.478 9.607 1.00 34.62 C ATOM 924 C LEU A 757 1.819 5.556 9.985 1.00 31.41 C ATOM 925 O LEU A 757 2.836 5.234 10.609 1.00 35.57 O ATOM 926 CB LEU A 757 1.422 3.585 8.524 1.00 33.52 C ATOM 927 CG LEU A 757 0.715 2.270 8.201 1.00 35.04 C ATOM 928 CD1 LEU A 757 1.521 1.504 7.164 1.00 34.11 C ATOM 929 CD2 LEU A 757 0.524 1.451 9.461 1.00 33.91 C ATOM 930 H LEU A 757 -0.743 4.895 8.166 1.00 0.00 H ATOM 931 N LEU A 758 1.575 6.813 9.605 1.00 32.51 N ATOM 932 CA LEU A 758 2.445 7.900 10.040 1.00 29.81 C ATOM 933 C LEU A 758 2.470 8.003 11.560 1.00 28.70 C ATOM 934 O LEU A 758 3.516 8.288 12.155 1.00 32.09 O ATOM 935 CB LEU A 758 1.985 9.218 9.419 1.00 34.42 C ATOM 936 CG LEU A 758 2.672 10.499 9.906 1.00 41.47 C ATOM 937 CD1 LEU A 758 4.158 10.477 9.572 1.00 38.92 C ATOM 938 CD2 LEU A 758 1.996 11.735 9.322 1.00 35.92 C ATOM 939 H LEU A 758 0.759 7.018 8.994 1.00 0.00 H ATOM 940 N ILE A 759 1.326 7.768 12.204 1.00 28.77 N ATOM 941 CA ILE A 759 1.274 7.781 13.661 1.00 26.63 C ATOM 942 C ILE A 759 2.155 6.680 14.232 1.00 22.41 C ATOM 943 O ILE A 759 2.844 6.875 15.241 1.00 23.06 O ATOM 944 CB ILE A 759 -0.182 7.647 14.143 1.00 30.19 C ATOM 945 CG1 ILE A 759 -1.030 8.804 13.607 1.00 32.66 C ATOM 946 CG2 ILE A 759 -0.233 7.587 15.660 1.00 23.46 C ATOM 947 CD1 ILE A 759 -2.506 8.684 13.921 1.00 24.51 C ATOM 948 H ILE A 759 0.461 7.573 11.661 1.00 0.00 H ATOM 949 N VAL A 760 2.152 5.507 13.593 1.00 27.33 N ATOM 950 CA VAL A 760 2.991 4.402 14.052 1.00 27.60 C ATOM 951 C VAL A 760 4.461 4.794 13.995 1.00 22.93 C ATOM 952 O VAL A 760 5.201 4.646 14.974 1.00 20.89 O ATOM 953 CB VAL A 760 2.715 3.133 13.225 1.00 21.65 C ATOM 954 CG1 VAL A 760 3.851 2.137 13.390 1.00 24.35 C ATOM 955 CG2 VAL A 760 1.403 2.498 13.647 1.00 20.52 C ATOM 956 H VAL A 760 1.545 5.378 12.758 1.00 0.00 H ATOM 957 N PHE A 761 4.905 5.310 12.847 1.00 22.73 N ATOM 958 CA PHE A 761 6.319 5.634 12.708 1.00 22.48 C ATOM 959 C PHE A 761 6.688 6.887 13.485 1.00 20.19 C ATOM 960 O PHE A 761 7.834 7.022 13.927 1.00 22.45 O ATOM 961 CB PHE A 761 6.683 5.759 11.231 1.00 23.83 C ATOM 962 CG PHE A 761 6.733 4.434 10.523 1.00 31.67 C ATOM 963 CD1 PHE A 761 7.882 3.662 10.561 1.00 29.05 C ATOM 964 CD2 PHE A 761 5.624 3.945 9.853 1.00 31.27 C ATOM 965 CE1 PHE A 761 7.931 2.434 9.928 1.00 30.16 C ATOM 966 CE2 PHE A 761 5.668 2.717 9.215 1.00 30.15 C ATOM 967 CZ PHE A 761 6.823 1.962 9.253 1.00 34.22 C ATOM 968 H PHE A 761 4.248 5.479 12.059 1.00 0.00 H ATOM 969 N GLU A 762 5.739 7.804 13.679 1.00 22.69 N ATOM 970 CA GLU A 762 5.997 8.914 14.589 1.00 27.52 C ATOM 971 C GLU A 762 6.098 8.429 16.027 1.00 24.88 C ATOM 972 O GLU A 762 6.898 8.962 16.805 1.00 27.72 O ATOM 973 CB GLU A 762 4.912 9.983 14.456 1.00 30.73 C ATOM 974 CG GLU A 762 5.181 10.986 13.346 1.00 36.68 C ATOM 975 CD GLU A 762 4.049 11.976 13.162 1.00 41.54 C ATOM 976 OE1 GLU A 762 3.064 11.915 13.933 1.00 33.58 O ATOM 977 OE2 GLU A 762 4.144 12.815 12.241 1.00 51.95 O ATOM 978 H GLU A 762 4.826 7.728 13.187 1.00 0.00 H ATOM 979 N PHE A 763 5.309 7.416 16.396 1.00 24.51 N ATOM 980 CA PHE A 763 5.423 6.851 17.736 1.00 24.33 C ATOM 981 C PHE A 763 6.744 6.115 17.912 1.00 24.58 C ATOM 982 O PHE A 763 7.390 6.234 18.959 1.00 24.33 O ATOM 983 CB PHE A 763 4.253 5.911 18.023 1.00 24.55 C ATOM 984 CG PHE A 763 4.425 5.106 19.282 1.00 26.36 C ATOM 985 CD1 PHE A 763 4.555 5.737 20.509 1.00 19.29 C ATOM 986 CD2 PHE A 763 4.462 3.723 19.239 1.00 20.79 C ATOM 987 CE1 PHE A 763 4.716 5.008 21.668 1.00 21.07 C ATOM 988 CE2 PHE A 763 4.623 2.985 20.396 1.00 24.68 C ATOM 989 CZ PHE A 763 4.749 3.628 21.613 1.00 27.96 C ATOM 990 H PHE A 763 4.613 7.030 15.727 1.00 0.00 H ATOM 991 N LEU A 764 7.153 5.337 16.904 1.00 21.30 N ATOM 992 CA LEU A 764 8.432 4.641 16.987 1.00 19.92 C ATOM 993 C LEU A 764 9.585 5.631 17.084 1.00 25.05 C ATOM 994 O LEU A 764 10.522 5.428 17.865 1.00 24.24 O ATOM 995 CB LEU A 764 8.611 3.717 15.784 1.00 21.06 C ATOM 996 CG LEU A 764 7.587 2.589 15.651 1.00 22.39 C ATOM 997 CD1 LEU A 764 7.841 1.797 14.386 1.00 19.92 C ATOM 998 CD2 LEU A 764 7.613 1.678 16.870 1.00 15.31 C ATOM 999 H LEU A 764 6.557 5.228 16.059 1.00 0.00 H ATOM 1000 N GLU A 765 9.528 6.714 16.302 1.00 21.57 N ATOM 1001 CA GLU A 765 10.530 7.767 16.429 1.00 23.64 C ATOM 1002 C GLU A 765 10.456 8.430 17.797 1.00 20.95 C ATOM 1003 O GLU A 765 11.489 8.796 18.372 1.00 19.74 O ATOM 1004 CB GLU A 765 10.356 8.805 15.316 1.00 17.15 C ATOM 1005 CG GLU A 765 11.295 10.006 15.416 1.00 14.01 C ATOM 1006 CD GLU A 765 12.772 9.636 15.298 1.00 25.34 C ATOM 1007 OE1 GLU A 765 13.092 8.479 14.942 1.00 21.63 O ATOM 1008 OE2 GLU A 765 13.622 10.513 15.562 1.00 20.68 O ATOM 1009 H GLU A 765 8.766 6.806 15.600 1.00 0.00 H ATOM 1010 N PHE A 766 9.242 8.592 18.331 1.00 19.74 N ATOM 1011 CA PHE A 766 9.085 9.076 19.699 1.00 19.90 C ATOM 1012 C PHE A 766 9.833 8.180 20.680 1.00 23.26 C ATOM 1013 O PHE A 766 10.422 8.666 21.653 1.00 19.79 O ATOM 1014 CB PHE A 766 7.592 9.160 20.041 1.00 19.44 C ATOM 1015 CG PHE A 766 7.291 9.295 21.513 1.00 23.08 C ATOM 1016 CD1 PHE A 766 7.125 8.169 22.311 1.00 30.61 C ATOM 1017 CD2 PHE A 766 7.131 10.543 22.090 1.00 20.76 C ATOM 1018 CE1 PHE A 766 6.838 8.288 23.661 1.00 22.77 C ATOM 1019 CE2 PHE A 766 6.843 10.670 23.438 1.00 21.79 C ATOM 1020 CZ PHE A 766 6.695 9.541 24.224 1.00 22.78 C ATOM 1021 H PHE A 766 8.398 8.370 17.765 1.00 0.00 H ATOM 1022 N CYS A 767 9.837 6.868 20.428 1.00 20.01 N ATOM 1023 CA CYS A 767 10.560 5.939 21.289 1.00 17.71 C ATOM 1024 C CYS A 767 12.054 5.934 20.987 1.00 16.52 C ATOM 1025 O CYS A 767 12.874 5.836 21.905 1.00 17.21 O ATOM 1026 CB CYS A 767 9.992 4.526 21.130 1.00 16.09 C ATOM 1027 SG CYS A 767 8.253 4.333 21.598 1.00 19.47 S ATOM 1028 H CYS A 767 9.316 6.503 19.605 1.00 0.00 H ATOM 1029 N GLU A 768 12.424 6.039 19.712 1.00 19.39 N ATOM 1030 CA GLU A 768 13.807 5.838 19.297 1.00 24.39 C ATOM 1031 C GLU A 768 14.619 7.124 19.275 1.00 22.05 C ATOM 1032 O GLU A 768 15.769 7.126 19.726 1.00 25.94 O ATOM 1033 CB GLU A 768 13.848 5.182 17.915 1.00 18.78 C ATOM 1034 CG GLU A 768 13.451 3.724 17.932 1.00 18.63 C ATOM 1035 CD GLU A 768 13.325 3.122 16.546 1.00 26.40 C ATOM 1036 OE1 GLU A 768 13.083 1.896 16.455 1.00 25.76 O ATOM 1037 OE2 GLU A 768 13.467 3.869 15.553 1.00 22.86 O ATOM 1038 H GLU A 768 11.708 6.270 18.994 1.00 0.00 H ATOM 1039 N GLY A 769 14.042 8.208 18.756 1.00 20.91 N ATOM 1040 CA GLY A 769 14.738 9.459 18.554 1.00 17.97 C ATOM 1041 C GLY A 769 15.590 9.912 19.723 1.00 19.97 C ATOM 1042 O GLY A 769 16.819 9.997 19.624 1.00 23.30 O ATOM 1043 H GLY A 769 13.040 8.151 18.483 1.00 0.00 H ATOM 1044 N PRO A 770 14.950 10.227 20.853 1.00 19.44 N ATOM 1045 CA PRO A 770 15.715 10.695 22.024 1.00 25.82 C ATOM 1046 C PRO A 770 16.841 9.765 22.439 1.00 25.37 C ATOM 1047 O PRO A 770 17.923 10.237 22.806 1.00 28.65 O ATOM 1048 CB PRO A 770 14.638 10.802 23.112 1.00 21.29 C ATOM 1049 CG PRO A 770 13.388 11.088 22.354 1.00 23.70 C ATOM 1050 CD PRO A 770 13.496 10.309 21.074 1.00 17.76 C ATOM 1051 N ILE A 771 16.619 8.451 22.382 1.00 29.60 N ATOM 1052 CA ILE A 771 17.655 7.506 22.785 1.00 23.49 C ATOM 1053 C ILE A 771 18.743 7.418 21.725 1.00 25.66 C ATOM 1054 O ILE A 771 19.940 7.414 22.038 1.00 28.54 O ATOM 1055 CB ILE A 771 17.032 6.129 23.063 1.00 22.40 C ATOM 1056 CG1 ILE A 771 15.974 6.240 24.160 1.00 29.04 C ATOM 1057 CG2 ILE A 771 18.109 5.141 23.451 1.00 23.70 C ATOM 1058 CD1 ILE A 771 15.331 4.929 24.504 1.00 21.37 C ATOM 1059 H ILE A 771 15.700 8.097 22.048 1.00 0.00 H ATOM 1060 N ARG A 772 18.343 7.341 20.455 1.00 22.99 N ATOM 1061 CA ARG A 772 19.303 7.173 19.370 1.00 24.19 C ATOM 1062 C ARG A 772 20.292 8.333 19.317 1.00 23.19 C ATOM 1063 O ARG A 772 21.510 8.128 19.346 1.00 21.79 O ATOM 1064 CB ARG A 772 18.555 7.042 18.041 1.00 21.35 C ATOM 1065 CG ARG A 772 19.446 6.825 16.833 1.00 26.48 C ATOM 1066 CD ARG A 772 18.682 7.047 15.533 1.00 30.55 C ATOM 1067 NE ARG A 772 18.116 8.392 15.453 1.00 30.90 N ATOM 1068 CZ ARG A 772 16.816 8.665 15.517 1.00 27.85 C ATOM 1069 NH1 ARG A 772 15.934 7.683 15.651 1.00 26.69 N ATOM 1070 NH2 ARG A 772 16.397 9.920 15.438 1.00 22.25 N ATOM 1071 HE ARG A 772 18.774 9.189 15.338 1.00 0.00 H ATOM 1072 HH12 ARG A 772 14.918 7.900 15.701 1.00 0.00 H ATOM 1073 HH11 ARG A 772 16.259 6.696 15.706 1.00 0.00 H ATOM 1074 HH22 ARG A 772 15.380 10.133 15.488 1.00 0.00 H ATOM 1075 HH21 ARG A 772 17.085 10.692 15.326 1.00 0.00 H ATOM 1076 H ARG A 772 17.328 7.402 20.234 1.00 0.00 H ATOM 1077 N ASP A 773 19.782 9.560 19.255 1.00 27.25 N ATOM 1078 CA ASP A 773 20.608 10.732 18.991 1.00 30.50 C ATOM 1079 C ASP A 773 21.285 11.295 20.236 1.00 25.64 C ATOM 1080 O ASP A 773 22.005 12.292 20.126 1.00 30.81 O ATOM 1081 CB ASP A 773 19.761 11.824 18.326 1.00 22.95 C ATOM 1082 CG ASP A 773 19.120 11.357 17.030 1.00 27.65 C ATOM 1083 OD1 ASP A 773 19.707 10.487 16.355 1.00 27.56 O ATOM 1084 OD2 ASP A 773 18.027 11.858 16.686 1.00 28.91 O ATOM 1085 H ASP A 773 18.760 9.688 19.400 1.00 0.00 H ATOM 1086 N ASN A 774 21.085 10.693 21.408 1.00 26.08 N ATOM 1087 CA ASN A 774 21.692 11.196 22.635 1.00 27.69 C ATOM 1088 C ASN A 774 22.476 10.159 23.423 1.00 29.62 C ATOM 1089 O ASN A 774 23.366 10.549 24.190 1.00 27.22 O ATOM 1090 CB ASN A 774 20.623 11.801 23.555 1.00 21.65 C ATOM 1091 CG ASN A 774 19.927 12.988 22.929 1.00 24.01 C ATOM 1092 OD1 ASN A 774 20.409 14.115 23.012 1.00 30.78 O ATOM 1093 ND2 ASN A 774 18.792 12.740 22.288 1.00 26.85 N ATOM 1094 HD22 ASN A 774 18.421 11.769 22.243 1.00 0.00 H ATOM 1095 HD21 ASN A 774 18.273 13.516 21.830 1.00 0.00 H ATOM 1096 H ASN A 774 20.483 9.846 21.449 1.00 0.00 H ATOM 1097 N TYR A 775 22.192 8.867 23.267 1.00 25.02 N ATOM 1098 CA TYR A 775 22.893 7.835 24.013 1.00 26.38 C ATOM 1099 C TYR A 775 23.552 6.779 23.141 1.00 25.34 C ATOM 1100 O TYR A 775 24.286 5.939 23.672 1.00 31.53 O ATOM 1101 CB TYR A 775 21.937 7.138 24.992 1.00 20.93 C ATOM 1102 CG TYR A 775 21.524 8.006 26.154 1.00 26.37 C ATOM 1103 CD1 TYR A 775 22.392 8.238 27.212 1.00 29.75 C ATOM 1104 CD2 TYR A 775 20.267 8.591 26.197 1.00 24.84 C ATOM 1105 CE1 TYR A 775 22.017 9.028 28.283 1.00 32.78 C ATOM 1106 CE2 TYR A 775 19.886 9.383 27.263 1.00 25.87 C ATOM 1107 CZ TYR A 775 20.762 9.597 28.302 1.00 31.15 C ATOM 1108 OH TYR A 775 20.382 10.386 29.363 1.00 37.95 O ATOM 1109 HH TYR A 775 21.123 10.436 30.018 1.00 0.00 H ATOM 1110 H TYR A 775 21.449 8.589 22.594 1.00 0.00 H ATOM 1111 N LEU A 776 23.314 6.787 21.846 1.00 25.12 N ATOM 1112 CA LEU A 776 23.914 5.809 20.958 1.00 26.90 C ATOM 1113 C LEU A 776 25.061 6.432 20.177 1.00 29.69 C ATOM 1114 O LEU A 776 25.119 7.654 20.008 1.00 28.31 O ATOM 1115 CB LEU A 776 22.858 5.251 20.000 1.00 21.72 C ATOM 1116 CG LEU A 776 21.812 4.344 20.652 1.00 29.86 C ATOM 1117 CD1 LEU A 776 20.905 3.743 19.595 1.00 20.65 C ATOM 1118 CD2 LEU A 776 22.476 3.253 21.482 1.00 15.88 C ATOM 1119 H LEU A 776 22.681 7.511 21.450 1.00 0.00 H ATOM 1120 N PRO A 777 26.004 5.616 19.697 1.00 39.90 N ATOM 1121 CA PRO A 777 27.195 6.171 19.041 1.00 29.08 C ATOM 1122 C PRO A 777 26.845 7.056 17.855 1.00 27.09 C ATOM 1123 O PRO A 777 25.861 6.831 17.146 1.00 24.12 O ATOM 1124 CB PRO A 777 27.966 4.924 18.596 1.00 31.59 C ATOM 1125 CG PRO A 777 27.528 3.862 19.538 1.00 28.47 C ATOM 1126 CD PRO A 777 26.084 4.150 19.827 1.00 26.76 C ATOM 1127 N LYS A 778 27.674 8.075 17.650 1.00 26.66 N ATOM 1128 CA LYS A 778 27.487 9.036 16.575 1.00 29.05 C ATOM 1129 C LYS A 778 28.148 8.541 15.294 1.00 24.25 C ATOM 1130 O LYS A 778 29.071 7.722 15.323 1.00 28.27 O ATOM 1131 CB LYS A 778 28.065 10.402 16.961 1.00 29.99 C ATOM 1132 CG LYS A 778 27.078 11.347 17.643 1.00 36.15 C ATOM 1133 CD LYS A 778 26.549 10.773 18.952 1.00 41.33 C ATOM 1134 CE LYS A 778 25.384 11.591 19.494 1.00 39.32 C ATOM 1135 NZ LYS A 778 24.596 10.818 20.502 1.00 36.88 N ATOM 1136 HZ1 LYS A 778 24.217 9.957 20.058 1.00 0.00 H ATOM 1137 HZ2 LYS A 778 25.214 10.556 21.297 1.00 0.00 H ATOM 1138 HZ3 LYS A 778 23.811 11.404 20.850 1.00 0.00 H ATOM 1139 H LYS A 778 28.490 8.189 18.285 1.00 0.00 H ATOM 1140 N GLY A 779 27.663 9.048 14.167 1.00 20.32 N ATOM 1141 CA GLY A 779 28.251 8.752 12.879 1.00 25.41 C ATOM 1142 C GLY A 779 27.534 7.625 12.153 1.00 27.80 C ATOM 1143 O GLY A 779 26.777 6.842 12.733 1.00 25.75 O ATOM 1144 H GLY A 779 26.836 9.677 14.211 1.00 0.00 H ATOM 1145 N LEU A 780 27.786 7.550 10.849 1.00 28.97 N ATOM 1146 CA LEU A 780 27.220 6.494 10.028 1.00 25.62 C ATOM 1147 C LEU A 780 27.905 5.162 10.322 1.00 26.50 C ATOM 1148 O LEU A 780 28.969 5.101 10.944 1.00 26.00 O ATOM 1149 CB LEU A 780 27.364 6.834 8.544 1.00 21.34 C ATOM 1150 CG LEU A 780 26.825 8.194 8.096 1.00 33.83 C ATOM 1151 CD1 LEU A 780 27.287 8.507 6.680 1.00 29.85 C ATOM 1152 CD2 LEU A 780 25.307 8.225 8.187 1.00 35.51 C ATOM 1153 H LEU A 780 28.402 8.263 10.408 1.00 0.00 H ATOM 1154 N ASN A 781 27.274 4.083 9.853 1.00 27.98 N ATOM 1155 CA ASN A 781 27.791 2.723 9.997 1.00 26.15 C ATOM 1156 C ASN A 781 28.031 2.360 11.460 1.00 26.89 C ATOM 1157 O ASN A 781 28.885 1.526 11.773 1.00 28.58 O ATOM 1158 CB ASN A 781 29.069 2.527 9.174 1.00 24.17 C ATOM 1159 CG ASN A 781 29.281 1.083 8.759 1.00 28.83 C ATOM 1160 OD1 ASN A 781 29.207 0.751 7.577 1.00 37.49 O ATOM 1161 ND2 ASN A 781 29.550 0.218 9.730 1.00 30.08 N ATOM 1162 HD22 ASN A 781 29.603 0.543 10.716 1.00 0.00 H ATOM 1163 HD21 ASN A 781 29.708 -0.785 9.504 1.00 0.00 H ATOM 1164 H ASN A 781 26.368 4.217 9.360 1.00 0.00 H ATOM 1165 N GLN A 782 27.284 2.988 12.366 1.00 23.95 N ATOM 1166 CA GLN A 782 27.359 2.704 13.792 1.00 23.49 C ATOM 1167 C GLN A 782 26.138 1.957 14.301 1.00 21.17 C ATOM 1168 O GLN A 782 26.269 0.963 15.020 1.00 26.65 O ATOM 1169 CB GLN A 782 27.524 4.010 14.583 1.00 29.08 C ATOM 1170 CG GLN A 782 28.822 4.744 14.308 1.00 32.23 C ATOM 1171 CD GLN A 782 30.025 4.051 14.915 1.00 37.62 C ATOM 1172 OE1 GLN A 782 29.888 3.163 15.760 1.00 36.13 O ATOM 1173 NE2 GLN A 782 31.215 4.456 14.490 1.00 44.23 N ATOM 1174 HE22 GLN A 782 31.284 5.209 13.776 1.00 0.00 H ATOM 1175 HE21 GLN A 782 32.079 4.021 14.871 1.00 0.00 H ATOM 1176 H GLN A 782 26.616 3.715 12.040 1.00 0.00 H ATOM 1177 N ILE A 783 24.947 2.413 13.937 1.00 24.19 N ATOM 1178 CA ILE A 783 23.699 1.905 14.489 1.00 22.72 C ATOM 1179 C ILE A 783 22.967 1.158 13.384 1.00 21.12 C ATOM 1180 O ILE A 783 22.411 1.774 12.466 1.00 25.32 O ATOM 1181 CB ILE A 783 22.836 3.036 15.061 1.00 24.21 C ATOM 1182 CG1 ILE A 783 23.683 3.974 15.918 1.00 22.45 C ATOM 1183 CG2 ILE A 783 21.725 2.475 15.900 1.00 20.56 C ATOM 1184 CD1 ILE A 783 22.906 5.139 16.457 1.00 19.29 C ATOM 1185 H ILE A 783 24.902 3.169 13.224 1.00 0.00 H ATOM 1186 N LEU A 784 22.966 -0.169 13.465 1.00 23.61 N ATOM 1187 CA LEU A 784 22.177 -0.985 12.549 1.00 21.79 C ATOM 1188 C LEU A 784 20.740 -1.013 13.056 1.00 24.84 C ATOM 1189 O LEU A 784 20.453 -1.598 14.106 1.00 18.00 O ATOM 1190 CB LEU A 784 22.756 -2.392 12.443 1.00 20.04 C ATOM 1191 CG LEU A 784 22.034 -3.277 11.426 1.00 18.87 C ATOM 1192 CD1 LEU A 784 22.207 -2.717 10.023 1.00 21.22 C ATOM 1193 CD2 LEU A 784 22.516 -4.713 11.499 1.00 19.78 C ATOM 1194 H LEU A 784 23.540 -0.635 14.197 1.00 0.00 H ATOM 1195 N HIS A 785 19.837 -0.364 12.327 1.00 23.67 N ATOM 1196 CA HIS A 785 18.433 -0.285 12.723 1.00 28.43 C ATOM 1197 C HIS A 785 17.701 -1.462 12.096 1.00 22.98 C ATOM 1198 O HIS A 785 17.425 -1.468 10.894 1.00 23.62 O ATOM 1199 CB HIS A 785 17.815 1.043 12.298 1.00 23.11 C ATOM 1200 CG HIS A 785 16.475 1.311 12.914 1.00 23.53 C ATOM 1201 ND1 HIS A 785 15.554 2.169 12.351 1.00 27.48 N ATOM 1202 CD2 HIS A 785 15.905 0.840 14.048 1.00 28.33 C ATOM 1203 CE1 HIS A 785 14.473 2.212 13.110 1.00 24.22 C ATOM 1204 NE2 HIS A 785 14.660 1.414 14.146 1.00 26.75 N ATOM 1205 H HIS A 785 20.140 0.102 11.448 1.00 0.00 H ATOM 1206 N SER A 786 17.404 -2.474 12.909 1.00 21.85 N ATOM 1207 CA SER A 786 16.522 -3.561 12.490 1.00 27.50 C ATOM 1208 C SER A 786 15.091 -3.071 12.681 1.00 29.78 C ATOM 1209 O SER A 786 14.431 -3.346 13.684 1.00 32.86 O ATOM 1210 CB SER A 786 16.806 -4.829 13.285 1.00 20.70 C ATOM 1211 OG SER A 786 15.827 -5.819 13.033 1.00 34.56 O ATOM 1212 HG SER A 786 14.936 -5.474 13.293 1.00 0.00 H ATOM 1213 H SER A 786 17.810 -2.491 13.866 1.00 0.00 H ATOM 1214 N PHE A 787 14.609 -2.312 11.697 1.00 24.59 N ATOM 1215 CA PHE A 787 13.340 -1.618 11.858 1.00 32.63 C ATOM 1216 C PHE A 787 12.132 -2.475 11.506 1.00 31.58 C ATOM 1217 O PHE A 787 11.024 -2.170 11.962 1.00 39.32 O ATOM 1218 CB PHE A 787 13.321 -0.331 11.020 1.00 34.85 C ATOM 1219 CG PHE A 787 13.158 -0.562 9.546 1.00 36.72 C ATOM 1220 CD1 PHE A 787 14.256 -0.837 8.752 1.00 34.96 C ATOM 1221 CD2 PHE A 787 11.908 -0.488 8.951 1.00 39.11 C ATOM 1222 CE1 PHE A 787 14.110 -1.050 7.392 1.00 38.28 C ATOM 1223 CE2 PHE A 787 11.754 -0.698 7.591 1.00 38.80 C ATOM 1224 CZ PHE A 787 12.858 -0.975 6.811 1.00 39.58 C ATOM 1225 H PHE A 787 15.143 -2.215 10.810 1.00 0.00 H ATOM 1226 N MET A 788 12.306 -3.539 10.727 1.00 24.11 N ATOM 1227 CA MET A 788 11.166 -4.370 10.364 1.00 30.59 C ATOM 1228 C MET A 788 11.610 -5.816 10.216 1.00 26.54 C ATOM 1229 O MET A 788 12.667 -6.097 9.645 1.00 31.98 O ATOM 1230 CB MET A 788 10.503 -3.874 9.073 1.00 34.57 C ATOM 1231 CG MET A 788 8.990 -4.049 9.051 1.00 37.82 C ATOM 1232 SD MET A 788 8.147 -2.918 7.924 1.00 53.10 S ATOM 1233 CE MET A 788 8.398 -1.346 8.744 1.00 32.80 C ATOM 1234 H MET A 788 13.256 -3.778 10.377 1.00 0.00 H ATOM 1235 N MET A 789 10.794 -6.726 10.741 1.00 26.41 N ATOM 1236 CA MET A 789 11.052 -8.156 10.678 1.00 22.33 C ATOM 1237 C MET A 789 9.718 -8.872 10.546 1.00 30.60 C ATOM 1238 O MET A 789 8.804 -8.629 11.338 1.00 41.38 O ATOM 1239 CB MET A 789 11.809 -8.632 11.925 1.00 32.10 C ATOM 1240 CG MET A 789 12.304 -10.062 11.862 1.00 33.52 C ATOM 1241 SD MET A 789 13.461 -10.456 13.191 1.00 39.22 S ATOM 1242 CE MET A 789 14.873 -9.447 12.746 1.00 22.48 C ATOM 1243 H MET A 789 9.930 -6.399 11.219 1.00 0.00 H ATOM 1244 N GLY A 790 9.599 -9.736 9.540 1.00 27.18 N ATOM 1245 CA GLY A 790 8.351 -10.423 9.287 1.00 20.81 C ATOM 1246 C GLY A 790 8.584 -11.860 8.869 1.00 29.23 C ATOM 1247 O GLY A 790 9.664 -12.235 8.402 1.00 24.41 O ATOM 1248 H GLY A 790 10.417 -9.920 8.925 1.00 0.00 H ATOM 1249 N THR A 791 7.541 -12.668 9.056 1.00 24.09 N ATOM 1250 CA THR A 791 7.526 -14.057 8.627 1.00 22.04 C ATOM 1251 C THR A 791 6.254 -14.321 7.835 1.00 20.87 C ATOM 1252 O THR A 791 5.280 -13.570 7.919 1.00 28.07 O ATOM 1253 CB THR A 791 7.606 -15.024 9.813 1.00 20.00 C ATOM 1254 OG1 THR A 791 6.582 -14.700 10.759 1.00 28.09 O ATOM 1255 CG2 THR A 791 8.961 -14.938 10.486 1.00 18.69 C ATOM 1256 HG1 THR A 791 6.633 -15.324 11.526 1.00 0.00 H ATOM 1257 H THR A 791 6.698 -12.287 9.531 1.00 0.00 H ATOM 1258 N ALA A 792 6.274 -15.407 7.065 1.00 30.94 N ATOM 1259 CA ALA A 792 5.123 -15.785 6.257 1.00 29.36 C ATOM 1260 C ALA A 792 3.989 -16.309 7.133 1.00 26.72 C ATOM 1261 O ALA A 792 4.214 -16.886 8.202 1.00 29.37 O ATOM 1262 CB ALA A 792 5.519 -16.843 5.226 1.00 20.48 C ATOM 1263 H ALA A 792 7.130 -15.998 7.040 1.00 0.00 H ATOM 1264 N GLU A 793 2.753 -16.111 6.661 1.00 26.52 N ATOM 1265 CA GLU A 793 1.582 -16.553 7.416 1.00 34.67 C ATOM 1266 C GLU A 793 1.551 -18.069 7.574 1.00 31.40 C ATOM 1267 O GLU A 793 1.125 -18.582 8.615 1.00 30.82 O ATOM 1268 CB GLU A 793 0.300 -16.079 6.732 1.00 38.56 C ATOM 1269 CG GLU A 793 0.052 -14.598 6.835 1.00 48.94 C ATOM 1270 CD GLU A 793 -0.990 -14.244 7.877 1.00 62.80 C ATOM 1271 OE1 GLU A 793 -2.177 -14.573 7.663 1.00 67.79 O ATOM 1272 OE2 GLU A 793 -0.621 -13.640 8.908 1.00 60.63 O ATOM 1273 H GLU A 793 2.624 -15.636 5.745 1.00 0.00 H ATOM 1274 N LYS A 794 1.994 -18.802 6.549 1.00 32.23 N ATOM 1275 CA LYS A 794 1.843 -20.252 6.547 1.00 32.58 C ATOM 1276 C LYS A 794 2.677 -20.932 7.625 1.00 30.99 C ATOM 1277 O LYS A 794 2.445 -22.111 7.914 1.00 36.61 O ATOM 1278 CB LYS A 794 2.207 -20.818 5.168 1.00 34.75 C ATOM 1279 CG LYS A 794 3.704 -21.008 4.923 1.00 43.51 C ATOM 1280 CD LYS A 794 4.103 -22.481 5.026 1.00 47.97 C ATOM 1281 CE LYS A 794 5.608 -22.666 4.920 1.00 37.98 C ATOM 1282 NZ LYS A 794 6.025 -24.062 5.246 1.00 44.71 N ATOM 1283 HZ1 LYS A 794 5.737 -24.290 6.219 1.00 0.00 H ATOM 1284 HZ2 LYS A 794 5.569 -24.722 4.584 1.00 0.00 H ATOM 1285 HZ3 LYS A 794 7.058 -24.143 5.161 1.00 0.00 H ATOM 1286 H LYS A 794 2.452 -18.332 5.742 1.00 0.00 H ATOM 1287 N LEU A 795 3.633 -20.226 8.222 1.00 30.38 N ATOM 1288 CA LEU A 795 4.522 -20.843 9.196 1.00 33.39 C ATOM 1289 C LEU A 795 3.745 -21.265 10.437 1.00 29.39 C ATOM 1290 O LEU A 795 3.018 -20.462 11.029 1.00 24.95 O ATOM 1291 CB LEU A 795 5.642 -19.878 9.583 1.00 29.14 C ATOM 1292 CG LEU A 795 6.550 -19.370 8.463 1.00 27.64 C ATOM 1293 CD1 LEU A 795 7.737 -18.618 9.039 1.00 21.15 C ATOM 1294 CD2 LEU A 795 7.019 -20.522 7.585 1.00 28.81 C ATOM 1295 H LEU A 795 3.747 -19.219 7.990 1.00 0.00 H ATOM 1296 N ASN A 796 3.898 -22.530 10.829 1.00 31.58 N ATOM 1297 CA ASN A 796 3.366 -22.993 12.098 1.00 31.40 C ATOM 1298 C ASN A 796 4.241 -22.441 13.223 1.00 27.56 C ATOM 1299 O ASN A 796 5.290 -21.845 12.965 1.00 33.31 O ATOM 1300 CB ASN A 796 3.274 -24.524 12.107 1.00 25.90 C ATOM 1301 CG ASN A 796 4.618 -25.214 11.914 1.00 34.56 C ATOM 1302 OD1 ASN A 796 5.618 -24.860 12.540 1.00 32.96 O ATOM 1303 ND2 ASN A 796 4.636 -26.226 11.052 1.00 31.00 N ATOM 1304 HD22 ASN A 796 3.768 -26.492 10.544 1.00 0.00 H ATOM 1305 HD21 ASN A 796 5.518 -26.752 10.886 1.00 0.00 H ATOM 1306 H ASN A 796 4.407 -23.197 10.215 1.00 0.00 H ATOM 1307 N PRO A 797 3.820 -22.590 14.487 1.00 32.04 N ATOM 1308 CA PRO A 797 4.634 -22.047 15.592 1.00 29.92 C ATOM 1309 C PRO A 797 6.102 -22.448 15.570 1.00 22.94 C ATOM 1310 O PRO A 797 6.968 -21.586 15.756 1.00 25.81 O ATOM 1311 CB PRO A 797 3.908 -22.585 16.829 1.00 29.45 C ATOM 1312 CG PRO A 797 2.485 -22.598 16.414 1.00 24.86 C ATOM 1313 CD PRO A 797 2.488 -23.011 14.962 1.00 35.23 C ATOM 1314 N ARG A 798 6.415 -23.728 15.356 1.00 27.38 N ATOM 1315 CA ARG A 798 7.816 -24.138 15.325 1.00 26.48 C ATOM 1316 C ARG A 798 8.564 -23.440 14.195 1.00 34.96 C ATOM 1317 O ARG A 798 9.661 -22.905 14.397 1.00 28.16 O ATOM 1318 CB ARG A 798 7.931 -25.655 15.177 1.00 24.30 C ATOM 1319 CG ARG A 798 9.355 -26.123 14.871 1.00 25.92 C ATOM 1320 CD ARG A 798 9.393 -27.581 14.442 1.00 26.76 C ATOM 1321 NE ARG A 798 8.330 -27.894 13.489 1.00 50.75 N ATOM 1322 CZ ARG A 798 8.456 -27.820 12.167 1.00 43.19 C ATOM 1323 NH1 ARG A 798 7.426 -28.123 11.388 1.00 31.92 N ATOM 1324 NH2 ARG A 798 9.607 -27.446 11.622 1.00 41.90 N ATOM 1325 HE ARG A 798 7.411 -28.196 13.871 1.00 0.00 H ATOM 1326 HH12 ARG A 798 7.522 -28.066 10.354 1.00 0.00 H ATOM 1327 HH11 ARG A 798 6.523 -28.418 11.811 1.00 0.00 H ATOM 1328 HH22 ARG A 798 9.699 -27.390 10.588 1.00 0.00 H ATOM 1329 HH21 ARG A 798 10.417 -27.209 12.229 1.00 0.00 H ATOM 1330 H ARG A 798 5.663 -24.431 15.212 1.00 0.00 H ATOM 1331 N GLU A 799 7.980 -23.438 12.994 1.00 27.99 N ATOM 1332 CA GLU A 799 8.624 -22.791 11.857 1.00 26.07 C ATOM 1333 C GLU A 799 8.823 -21.304 12.117 1.00 25.10 C ATOM 1334 O GLU A 799 9.857 -20.733 11.751 1.00 21.03 O ATOM 1335 CB GLU A 799 7.796 -23.011 10.589 1.00 27.29 C ATOM 1336 CG GLU A 799 7.674 -24.472 10.159 1.00 26.54 C ATOM 1337 CD GLU A 799 6.745 -24.657 8.973 1.00 31.11 C ATOM 1338 OE1 GLU A 799 5.733 -23.932 8.890 1.00 33.20 O ATOM 1339 OE2 GLU A 799 7.031 -25.524 8.119 1.00 44.63 O ATOM 1340 H GLU A 799 7.058 -23.902 12.869 1.00 0.00 H ATOM 1341 N ASN A 800 7.850 -20.665 12.767 1.00 20.70 N ATOM 1342 CA ASN A 800 7.975 -19.243 13.067 1.00 20.48 C ATOM 1343 C ASN A 800 9.039 -18.999 14.132 1.00 25.54 C ATOM 1344 O ASN A 800 9.886 -18.110 13.984 1.00 23.24 O ATOM 1345 CB ASN A 800 6.624 -18.682 13.505 1.00 19.84 C ATOM 1346 CG ASN A 800 6.663 -17.189 13.714 1.00 26.60 C ATOM 1347 OD1 ASN A 800 6.782 -16.423 12.759 1.00 26.76 O ATOM 1348 ND2 ASN A 800 6.566 -16.763 14.969 1.00 27.10 N ATOM 1349 HD22 ASN A 800 6.467 -17.449 15.745 1.00 0.00 H ATOM 1350 HD21 ASN A 800 6.589 -15.744 15.176 1.00 0.00 H ATOM 1351 H ASN A 800 6.998 -21.183 13.062 1.00 0.00 H ATOM 1352 N ILE A 801 9.015 -19.785 15.213 1.00 25.93 N ATOM 1353 CA ILE A 801 10.038 -19.663 16.252 1.00 26.21 C ATOM 1354 C ILE A 801 11.424 -19.893 15.660 1.00 30.18 C ATOM 1355 O ILE A 801 12.372 -19.144 15.934 1.00 26.21 O ATOM 1356 CB ILE A 801 9.752 -20.640 17.408 1.00 25.45 C ATOM 1357 CG1 ILE A 801 8.513 -20.196 18.185 1.00 33.69 C ATOM 1358 CG2 ILE A 801 10.951 -20.732 18.340 1.00 23.20 C ATOM 1359 CD1 ILE A 801 8.673 -18.841 18.844 1.00 35.20 C ATOM 1360 H ILE A 801 8.260 -20.492 15.317 1.00 0.00 H ATOM 1361 N ALA A 802 11.559 -20.934 14.835 1.00 23.10 N ATOM 1362 CA ALA A 802 12.852 -21.238 14.229 1.00 22.17 C ATOM 1363 C ALA A 802 13.293 -20.132 13.279 1.00 23.05 C ATOM 1364 O ALA A 802 14.478 -19.786 13.225 1.00 26.43 O ATOM 1365 CB ALA A 802 12.790 -22.578 13.495 1.00 15.58 C ATOM 1366 H ALA A 802 10.736 -21.533 14.622 1.00 0.00 H ATOM 1367 N CYS A 803 12.352 -19.563 12.520 1.00 22.93 N ATOM 1368 CA CYS A 803 12.713 -18.494 11.596 1.00 27.22 C ATOM 1369 C CYS A 803 13.083 -17.217 12.336 1.00 26.47 C ATOM 1370 O CYS A 803 13.931 -16.451 11.861 1.00 18.64 O ATOM 1371 CB CYS A 803 11.571 -18.226 10.615 1.00 20.70 C ATOM 1372 SG CYS A 803 12.009 -17.081 9.278 1.00 19.91 S ATOM 1373 H CYS A 803 11.364 -19.882 12.588 1.00 0.00 H ATOM 1374 N MET A 804 12.463 -16.973 13.494 1.00 26.53 N ATOM 1375 CA MET A 804 12.814 -15.800 14.287 1.00 22.50 C ATOM 1376 C MET A 804 14.223 -15.918 14.853 1.00 22.11 C ATOM 1377 O MET A 804 14.976 -14.936 14.866 1.00 26.36 O ATOM 1378 CB MET A 804 11.793 -15.600 15.405 1.00 29.39 C ATOM 1379 CG MET A 804 10.414 -15.173 14.920 1.00 31.81 C ATOM 1380 SD MET A 804 10.464 -13.647 13.963 1.00 38.33 S ATOM 1381 CE MET A 804 10.926 -12.477 15.238 1.00 39.18 C ATOM 1382 H MET A 804 11.725 -17.623 13.832 1.00 0.00 H ATOM 1383 N HIS A 805 14.599 -17.110 15.325 1.00 26.64 N ATOM 1384 CA HIS A 805 15.965 -17.318 15.797 1.00 20.24 C ATOM 1385 C HIS A 805 16.964 -17.185 14.656 1.00 23.32 C ATOM 1386 O HIS A 805 18.044 -16.611 14.831 1.00 27.07 O ATOM 1387 CB HIS A 805 16.094 -18.690 16.458 1.00 21.08 C ATOM 1388 CG HIS A 805 15.519 -18.757 17.840 1.00 28.41 C ATOM 1389 ND1 HIS A 805 16.088 -18.110 18.916 1.00 27.18 N ATOM 1390 CD2 HIS A 805 14.433 -19.406 18.323 1.00 26.64 C ATOM 1391 CE1 HIS A 805 15.373 -18.351 20.000 1.00 27.19 C ATOM 1392 NE2 HIS A 805 14.364 -19.136 19.669 1.00 27.22 N ATOM 1393 H HIS A 805 13.916 -17.893 15.356 1.00 0.00 H ATOM 1394 N PHE A 806 16.614 -17.703 13.478 1.00 22.22 N ATOM 1395 CA PHE A 806 17.516 -17.633 12.334 1.00 24.80 C ATOM 1396 C PHE A 806 17.757 -16.190 11.907 1.00 21.94 C ATOM 1397 O PHE A 806 18.891 -15.814 11.587 1.00 26.19 O ATOM 1398 CB PHE A 806 16.943 -18.459 11.181 1.00 19.61 C ATOM 1399 CG PHE A 806 17.892 -18.657 10.038 1.00 17.53 C ATOM 1400 CD1 PHE A 806 18.780 -19.722 10.035 1.00 18.37 C ATOM 1401 CD2 PHE A 806 17.883 -17.794 8.953 1.00 19.90 C ATOM 1402 CE1 PHE A 806 19.650 -19.917 8.978 1.00 15.41 C ATOM 1403 CE2 PHE A 806 18.753 -17.980 7.891 1.00 20.89 C ATOM 1404 CZ PHE A 806 19.639 -19.043 7.905 1.00 18.80 C ATOM 1405 H PHE A 806 15.687 -18.162 13.374 1.00 0.00 H ATOM 1406 N MET A 807 16.708 -15.363 11.911 1.00 18.67 N ATOM 1407 CA MET A 807 16.864 -13.968 11.507 1.00 25.06 C ATOM 1408 C MET A 807 17.624 -13.163 12.553 1.00 19.72 C ATOM 1409 O MET A 807 18.391 -12.257 12.209 1.00 24.89 O ATOM 1410 CB MET A 807 15.497 -13.343 11.236 1.00 23.64 C ATOM 1411 CG MET A 807 14.865 -13.812 9.943 1.00 15.08 C ATOM 1412 SD MET A 807 13.364 -12.913 9.520 1.00 33.60 S ATOM 1413 CE MET A 807 12.251 -13.491 10.797 1.00 23.54 C ATOM 1414 H MET A 807 15.774 -15.715 12.204 1.00 0.00 H ATOM 1415 N GLU A 808 17.418 -13.468 13.836 1.00 24.33 N ATOM 1416 CA GLU A 808 18.209 -12.815 14.873 1.00 26.13 C ATOM 1417 C GLU A 808 19.676 -13.205 14.764 1.00 25.54 C ATOM 1418 O GLU A 808 20.566 -12.362 14.924 1.00 28.46 O ATOM 1419 CB GLU A 808 17.668 -13.176 16.253 1.00 21.33 C ATOM 1420 CG GLU A 808 18.383 -12.462 17.382 1.00 24.09 C ATOM 1421 CD GLU A 808 18.312 -10.952 17.245 1.00 31.82 C ATOM 1422 OE1 GLU A 808 19.381 -10.309 17.229 1.00 29.94 O ATOM 1423 OE2 GLU A 808 17.188 -10.411 17.145 1.00 32.74 O ATOM 1424 H GLU A 808 16.695 -14.169 14.096 1.00 0.00 H ATOM 1425 N HIS A 809 19.944 -14.483 14.499 1.00 29.31 N ATOM 1426 CA HIS A 809 21.318 -14.931 14.321 1.00 21.48 C ATOM 1427 C HIS A 809 21.966 -14.260 13.120 1.00 22.12 C ATOM 1428 O HIS A 809 23.184 -14.051 13.107 1.00 26.69 O ATOM 1429 CB HIS A 809 21.346 -16.454 14.174 1.00 22.88 C ATOM 1430 CG HIS A 809 22.723 -17.025 14.034 1.00 28.75 C ATOM 1431 ND1 HIS A 809 23.381 -17.093 12.825 1.00 30.40 N ATOM 1432 CD2 HIS A 809 23.561 -17.566 14.950 1.00 27.59 C ATOM 1433 CE1 HIS A 809 24.569 -17.645 13.003 1.00 36.64 C ATOM 1434 NE2 HIS A 809 24.702 -17.942 14.283 1.00 34.83 N ATOM 1435 H HIS A 809 19.165 -15.167 14.419 1.00 0.00 H ATOM 1436 N GLU A 810 21.171 -13.895 12.115 1.00 21.39 N ATOM 1437 CA GLU A 810 21.714 -13.321 10.892 1.00 20.30 C ATOM 1438 C GLU A 810 21.862 -11.805 10.959 1.00 24.73 C ATOM 1439 O GLU A 810 22.806 -11.260 10.378 1.00 23.93 O ATOM 1440 CB GLU A 810 20.839 -13.710 9.699 1.00 25.04 C ATOM 1441 CG GLU A 810 21.328 -13.171 8.361 1.00 32.43 C ATOM 1442 CD GLU A 810 22.613 -13.825 7.882 1.00 32.56 C ATOM 1443 OE1 GLU A 810 23.018 -14.861 8.456 1.00 28.85 O ATOM 1444 OE2 GLU A 810 23.219 -13.297 6.925 1.00 31.38 O ATOM 1445 H GLU A 810 20.143 -14.023 12.206 1.00 0.00 H ATOM 1446 N VAL A 811 20.957 -11.101 11.648 1.00 28.14 N ATOM 1447 CA VAL A 811 21.145 -9.660 11.801 1.00 29.69 C ATOM 1448 C VAL A 811 22.404 -9.378 12.607 1.00 26.26 C ATOM 1449 O VAL A 811 23.095 -8.380 12.370 1.00 37.18 O ATOM 1450 CB VAL A 811 19.904 -8.995 12.435 1.00 21.60 C ATOM 1451 CG1 VAL A 811 18.709 -9.106 11.507 1.00 31.30 C ATOM 1452 CG2 VAL A 811 19.589 -9.608 13.779 1.00 35.06 C ATOM 1453 H VAL A 811 20.131 -11.573 12.069 1.00 0.00 H ATOM 1454 N LEU A 812 22.732 -10.250 13.561 1.00 27.29 N ATOM 1455 CA LEU A 812 23.999 -10.118 14.269 1.00 34.22 C ATOM 1456 C LEU A 812 25.173 -10.347 13.326 1.00 27.75 C ATOM 1457 O LEU A 812 26.152 -9.592 13.346 1.00 28.61 O ATOM 1458 CB LEU A 812 24.047 -11.096 15.444 1.00 25.66 C ATOM 1459 CG LEU A 812 25.279 -10.969 16.342 1.00 32.15 C ATOM 1460 CD1 LEU A 812 25.367 -9.564 16.912 1.00 30.64 C ATOM 1461 CD2 LEU A 812 25.255 -12.009 17.457 1.00 27.15 C ATOM 1462 H LEU A 812 22.082 -11.026 13.800 1.00 0.00 H ATOM 1463 N ARG A 813 25.083 -11.379 12.485 1.00 26.37 N ATOM 1464 CA ARG A 813 26.159 -11.669 11.544 1.00 22.51 C ATOM 1465 C ARG A 813 26.326 -10.542 10.534 1.00 28.67 C ATOM 1466 O ARG A 813 27.456 -10.183 10.178 1.00 29.60 O ATOM 1467 CB ARG A 813 25.884 -12.991 10.830 1.00 29.08 C ATOM 1468 CG ARG A 813 27.079 -13.547 10.081 1.00 27.72 C ATOM 1469 CD ARG A 813 26.634 -14.408 8.918 1.00 30.23 C ATOM 1470 NE ARG A 813 25.826 -13.646 7.972 1.00 31.40 N ATOM 1471 CZ ARG A 813 26.328 -12.831 7.048 1.00 37.49 C ATOM 1472 NH1 ARG A 813 27.640 -12.667 6.944 1.00 38.71 N ATOM 1473 NH2 ARG A 813 25.515 -12.177 6.229 1.00 30.84 N ATOM 1474 HE ARG A 813 24.792 -13.746 8.023 1.00 0.00 H ATOM 1475 HH12 ARG A 813 28.029 -12.029 6.220 1.00 0.00 H ATOM 1476 HH11 ARG A 813 28.280 -13.176 7.586 1.00 0.00 H ATOM 1477 HH22 ARG A 813 25.907 -11.540 5.507 1.00 0.00 H ATOM 1478 HH21 ARG A 813 24.486 -12.301 6.309 1.00 0.00 H ATOM 1479 H ARG A 813 24.237 -11.983 12.501 1.00 0.00 H ATOM 1480 N VAL A 814 25.214 -9.980 10.055 1.00 26.48 N ATOM 1481 CA VAL A 814 25.292 -8.847 9.140 1.00 25.75 C ATOM 1482 C VAL A 814 25.877 -7.633 9.849 1.00 26.49 C ATOM 1483 O VAL A 814 26.707 -6.909 9.286 1.00 28.54 O ATOM 1484 CB VAL A 814 23.904 -8.543 8.544 1.00 25.92 C ATOM 1485 CG1 VAL A 814 23.939 -7.246 7.743 1.00 23.08 C ATOM 1486 CG2 VAL A 814 23.434 -9.702 7.676 1.00 20.42 C ATOM 1487 H VAL A 814 24.285 -10.353 10.336 1.00 0.00 H ATOM 1488 N ALA A 815 25.466 -7.400 11.099 1.00 21.91 N ATOM 1489 CA ALA A 815 25.987 -6.264 11.851 1.00 24.77 C ATOM 1490 C ALA A 815 27.497 -6.359 12.022 1.00 27.24 C ATOM 1491 O ALA A 815 28.212 -5.367 11.837 1.00 26.82 O ATOM 1492 CB ALA A 815 25.296 -6.174 13.211 1.00 23.18 C ATOM 1493 H ALA A 815 24.769 -8.034 11.539 1.00 0.00 H ATOM 1494 N ARG A 816 28.001 -7.546 12.371 1.00 29.37 N ATOM 1495 CA ARG A 816 29.442 -7.721 12.522 1.00 28.91 C ATOM 1496 C ARG A 816 30.156 -7.627 11.180 1.00 26.79 C ATOM 1497 O ARG A 816 31.204 -6.980 11.074 1.00 39.70 O ATOM 1498 CB ARG A 816 29.744 -9.060 13.197 1.00 25.81 C ATOM 1499 CG ARG A 816 29.357 -9.108 14.658 1.00 34.23 C ATOM 1500 CD ARG A 816 29.449 -10.516 15.213 1.00 39.29 C ATOM 1501 NE ARG A 816 29.312 -10.531 16.667 1.00 55.41 N ATOM 1502 CZ ARG A 816 29.128 -11.631 17.388 1.00 62.62 C ATOM 1503 NH1 ARG A 816 29.049 -12.812 16.789 1.00 50.56 N ATOM 1504 NH2 ARG A 816 29.016 -11.549 18.707 1.00 69.10 N ATOM 1505 HE ARG A 816 29.362 -9.622 17.170 1.00 0.00 H ATOM 1506 HH12 ARG A 816 28.905 -13.673 17.354 1.00 0.00 H ATOM 1507 HH11 ARG A 816 29.131 -12.877 15.754 1.00 0.00 H ATOM 1508 HH22 ARG A 816 28.872 -12.411 19.271 1.00 0.00 H ATOM 1509 HH21 ARG A 816 29.072 -10.623 19.177 1.00 0.00 H ATOM 1510 H ARG A 816 27.363 -8.350 12.536 1.00 0.00 H ATOM 1511 N GLU A 817 29.603 -8.263 10.143 1.00 33.37 N ATOM 1512 CA GLU A 817 30.236 -8.224 8.828 1.00 33.72 C ATOM 1513 C GLU A 817 30.304 -6.801 8.288 1.00 37.45 C ATOM 1514 O GLU A 817 31.336 -6.383 7.749 1.00 39.65 O ATOM 1515 CB GLU A 817 29.480 -9.132 7.857 1.00 31.19 C ATOM 1516 CG GLU A 817 29.994 -9.075 6.427 1.00 41.42 C ATOM 1517 CD GLU A 817 29.099 -9.826 5.458 1.00 60.33 C ATOM 1518 OE1 GLU A 817 28.165 -10.514 5.924 1.00 54.26 O ATOM 1519 OE2 GLU A 817 29.324 -9.725 4.233 1.00 59.31 O ATOM 1520 H GLU A 817 28.716 -8.789 10.274 1.00 0.00 H ATOM 1521 N LYS A 818 29.220 -6.040 8.431 1.00 30.99 N ATOM 1522 CA LYS A 818 29.175 -4.664 7.953 1.00 27.70 C ATOM 1523 C LYS A 818 29.783 -3.674 8.937 1.00 27.33 C ATOM 1524 O LYS A 818 29.755 -2.467 8.670 1.00 27.88 O ATOM 1525 CB LYS A 818 27.731 -4.269 7.640 1.00 34.76 C ATOM 1526 CG LYS A 818 27.057 -5.153 6.599 1.00 34.34 C ATOM 1527 CD LYS A 818 27.563 -4.854 5.197 1.00 40.16 C ATOM 1528 CE LYS A 818 26.802 -5.662 4.154 1.00 43.96 C ATOM 1529 NZ LYS A 818 27.015 -5.140 2.773 1.00 35.63 N ATOM 1530 HZ1 LYS A 818 26.687 -4.154 2.722 1.00 0.00 H ATOM 1531 HZ2 LYS A 818 28.028 -5.182 2.540 1.00 0.00 H ATOM 1532 HZ3 LYS A 818 26.478 -5.721 2.098 1.00 0.00 H ATOM 1533 H LYS A 818 28.381 -6.440 8.898 1.00 0.00 H ATOM 1534 N GLN A 819 30.309 -4.154 10.067 1.00 28.02 N ATOM 1535 CA GLN A 819 31.077 -3.342 11.015 1.00 29.55 C ATOM 1536 C GLN A 819 30.221 -2.262 11.678 1.00 31.80 C ATOM 1537 O GLN A 819 30.655 -1.120 11.834 1.00 32.68 O ATOM 1538 CB GLN A 819 32.308 -2.723 10.349 1.00 36.38 C ATOM 1539 CG GLN A 819 33.237 -3.741 9.708 1.00 36.36 C ATOM 1540 CD GLN A 819 34.469 -3.106 9.103 1.00 42.80 C ATOM 1541 OE1 GLN A 819 34.875 -2.014 9.497 1.00 45.84 O ATOM 1542 NE2 GLN A 819 35.070 -3.787 8.134 1.00 58.34 N ATOM 1543 HE22 GLN A 819 34.691 -4.708 7.833 1.00 0.00 H ATOM 1544 HE21 GLN A 819 35.920 -3.400 7.676 1.00 0.00 H ATOM 1545 H GLN A 819 30.166 -5.160 10.286 1.00 0.00 H ATOM 1546 N PHE A 820 29.006 -2.621 12.078 1.00 27.26 N ATOM 1547 CA PHE A 820 28.210 -1.745 12.923 1.00 29.84 C ATOM 1548 C PHE A 820 28.575 -1.966 14.387 1.00 30.23 C ATOM 1549 O PHE A 820 29.092 -3.018 14.772 1.00 32.36 O ATOM 1550 CB PHE A 820 26.714 -1.979 12.701 1.00 23.04 C ATOM 1551 CG PHE A 820 26.199 -1.389 11.422 1.00 21.76 C ATOM 1552 CD1 PHE A 820 26.362 -2.058 10.220 1.00 26.43 C ATOM 1553 CD2 PHE A 820 25.570 -0.156 11.417 1.00 26.24 C ATOM 1554 CE1 PHE A 820 25.899 -1.512 9.038 1.00 19.64 C ATOM 1555 CE2 PHE A 820 25.104 0.396 10.239 1.00 24.70 C ATOM 1556 CZ PHE A 820 25.268 -0.284 9.048 1.00 23.65 C ATOM 1557 H PHE A 820 28.619 -3.540 11.783 1.00 0.00 H ATOM 1558 N ALA A 821 28.314 -0.944 15.204 1.00 21.75 N ATOM 1559 CA ALA A 821 28.643 -1.031 16.622 1.00 21.15 C ATOM 1560 C ALA A 821 27.601 -1.818 17.402 1.00 25.66 C ATOM 1561 O ALA A 821 27.926 -2.414 18.436 1.00 31.54 O ATOM 1562 CB ALA A 821 28.790 0.369 17.220 1.00 20.68 C ATOM 1563 H ALA A 821 27.873 -0.080 14.827 1.00 0.00 H ATOM 1564 N GLY A 822 26.361 -1.834 16.932 1.00 23.40 N ATOM 1565 CA GLY A 822 25.316 -2.561 17.627 1.00 24.05 C ATOM 1566 C GLY A 822 24.044 -2.576 16.812 1.00 21.37 C ATOM 1567 O GLY A 822 23.920 -1.886 15.796 1.00 27.53 O ATOM 1568 H GLY A 822 26.136 -1.320 16.056 1.00 0.00 H ATOM 1569 N ILE A 823 23.095 -3.380 17.282 1.00 20.89 N ATOM 1570 CA ILE A 823 21.793 -3.541 16.649 1.00 21.61 C ATOM 1571 C ILE A 823 20.770 -2.774 17.473 1.00 24.51 C ATOM 1572 O ILE A 823 20.756 -2.871 18.706 1.00 23.24 O ATOM 1573 CB ILE A 823 21.408 -5.025 16.523 1.00 18.29 C ATOM 1574 CG1 ILE A 823 22.409 -5.751 15.623 1.00 22.63 C ATOM 1575 CG2 ILE A 823 19.993 -5.171 15.983 1.00 19.99 C ATOM 1576 CD1 ILE A 823 22.148 -7.234 15.495 1.00 29.42 C ATOM 1577 H ILE A 823 23.293 -3.922 18.147 1.00 0.00 H ATOM 1578 N PHE A 824 19.914 -2.020 16.788 1.00 22.98 N ATOM 1579 CA PHE A 824 18.961 -1.111 17.408 1.00 18.75 C ATOM 1580 C PHE A 824 17.583 -1.400 16.839 1.00 20.59 C ATOM 1581 O PHE A 824 17.423 -1.483 15.617 1.00 23.21 O ATOM 1582 CB PHE A 824 19.369 0.338 17.135 1.00 21.21 C ATOM 1583 CG PHE A 824 18.516 1.370 17.812 1.00 21.00 C ATOM 1584 CD1 PHE A 824 18.428 1.427 19.192 1.00 22.25 C ATOM 1585 CD2 PHE A 824 17.845 2.324 17.062 1.00 18.12 C ATOM 1586 CE1 PHE A 824 17.663 2.399 19.811 1.00 17.18 C ATOM 1587 CE2 PHE A 824 17.082 3.298 17.674 1.00 20.63 C ATOM 1588 CZ PHE A 824 16.990 3.335 19.051 1.00 21.80 C ATOM 1589 H PHE A 824 19.927 -2.084 15.750 1.00 0.00 H ATOM 1590 N THR A 825 16.596 -1.564 17.714 1.00 17.95 N ATOM 1591 CA THR A 825 15.260 -1.893 17.242 1.00 20.21 C ATOM 1592 C THR A 825 14.241 -1.578 18.324 1.00 23.83 C ATOM 1593 O THR A 825 14.561 -1.568 19.516 1.00 31.53 O ATOM 1594 CB THR A 825 15.150 -3.369 16.837 1.00 23.90 C ATOM 1595 OG1 THR A 825 13.826 -3.630 16.366 1.00 23.54 O ATOM 1596 CG2 THR A 825 15.442 -4.279 18.023 1.00 18.48 C ATOM 1597 HG1 THR A 825 13.636 -3.055 15.583 1.00 0.00 H ATOM 1598 H THR A 825 16.778 -1.457 18.732 1.00 0.00 H ATOM 1599 N THR A 826 13.013 -1.318 17.889 1.00 23.01 N ATOM 1600 CA THR A 826 11.866 -1.183 18.776 1.00 23.12 C ATOM 1601 C THR A 826 10.965 -2.389 18.563 1.00 18.84 C ATOM 1602 O THR A 826 10.466 -2.607 17.453 1.00 18.75 O ATOM 1603 CB THR A 826 11.108 0.115 18.508 1.00 19.28 C ATOM 1604 OG1 THR A 826 11.969 1.220 18.786 1.00 21.29 O ATOM 1605 CG2 THR A 826 9.882 0.214 19.397 1.00 16.57 C ATOM 1606 HG1 THR A 826 12.766 1.171 18.201 1.00 0.00 H ATOM 1607 H THR A 826 12.864 -1.205 16.866 1.00 0.00 H ATOM 1608 N ASN A 827 10.770 -3.174 19.615 1.00 19.20 N ATOM 1609 CA ASN A 827 9.992 -4.402 19.538 1.00 18.23 C ATOM 1610 C ASN A 827 8.594 -4.142 20.079 1.00 21.25 C ATOM 1611 O ASN A 827 8.434 -3.706 21.225 1.00 23.34 O ATOM 1612 CB ASN A 827 10.690 -5.526 20.298 1.00 16.27 C ATOM 1613 CG ASN A 827 11.901 -6.045 19.556 1.00 18.46 C ATOM 1614 OD1 ASN A 827 11.825 -6.340 18.367 1.00 20.50 O ATOM 1615 ND2 ASN A 827 13.030 -6.133 20.243 1.00 18.36 N ATOM 1616 HD22 ASN A 827 13.048 -5.872 21.250 1.00 0.00 H ATOM 1617 HD21 ASN A 827 13.899 -6.463 19.776 1.00 0.00 H ATOM 1618 H ASN A 827 11.188 -2.902 20.528 1.00 0.00 H ATOM 1619 N THR A 828 7.588 -4.406 19.248 1.00 20.30 N ATOM 1620 CA THR A 828 6.215 -4.029 19.538 1.00 23.29 C ATOM 1621 C THR A 828 5.297 -5.212 19.800 1.00 22.22 C ATOM 1622 O THR A 828 4.134 -5.000 20.160 1.00 25.50 O ATOM 1623 CB THR A 828 5.649 -3.194 18.382 1.00 22.78 C ATOM 1624 OG1 THR A 828 5.903 -3.869 17.144 1.00 24.47 O ATOM 1625 CG2 THR A 828 6.309 -1.822 18.350 1.00 18.66 C ATOM 1626 HG1 THR A 828 5.466 -4.757 17.158 1.00 0.00 H ATOM 1627 H THR A 828 7.793 -4.901 18.357 1.00 0.00 H ATOM 1628 N SER A 829 5.775 -6.440 19.628 1.00 27.77 N ATOM 1629 CA SER A 829 4.978 -7.603 19.977 1.00 19.93 C ATOM 1630 C SER A 829 5.603 -8.324 21.165 1.00 21.88 C ATOM 1631 O SER A 829 6.819 -8.254 21.370 1.00 24.02 O ATOM 1632 CB SER A 829 4.854 -8.581 18.801 1.00 19.23 C ATOM 1633 OG SER A 829 6.097 -9.191 18.504 1.00 21.95 O ATOM 1634 HG SER A 829 5.984 -9.814 17.743 1.00 0.00 H ATOM 1635 H SER A 829 6.731 -6.570 19.239 1.00 0.00 H ATOM 1636 N PRO A 830 4.797 -9.011 21.977 1.00 27.86 N ATOM 1637 CA PRO A 830 5.370 -9.750 23.113 1.00 22.15 C ATOM 1638 C PRO A 830 6.401 -10.793 22.707 1.00 22.74 C ATOM 1639 O PRO A 830 7.333 -11.054 23.475 1.00 20.34 O ATOM 1640 CB PRO A 830 4.136 -10.394 23.763 1.00 20.09 C ATOM 1641 CG PRO A 830 2.999 -9.503 23.369 1.00 16.19 C ATOM 1642 CD PRO A 830 3.323 -9.037 21.982 1.00 20.29 C ATOM 1643 N LEU A 831 6.272 -11.392 21.519 1.00 26.26 N ATOM 1644 CA LEU A 831 7.223 -12.422 21.110 1.00 19.87 C ATOM 1645 C LEU A 831 8.581 -11.818 20.772 1.00 24.85 C ATOM 1646 O LEU A 831 9.618 -12.292 21.254 1.00 18.19 O ATOM 1647 CB LEU A 831 6.678 -13.207 19.918 1.00 20.45 C ATOM 1648 CG LEU A 831 7.651 -14.232 19.329 1.00 22.64 C ATOM 1649 CD1 LEU A 831 8.155 -15.187 20.410 1.00 22.12 C ATOM 1650 CD2 LEU A 831 7.001 -15.005 18.188 1.00 21.04 C ATOM 1651 H LEU A 831 5.493 -11.124 20.885 1.00 0.00 H ATOM 1652 N THR A 832 8.601 -10.777 19.934 1.00 22.80 N ATOM 1653 CA THR A 832 9.874 -10.164 19.571 1.00 16.02 C ATOM 1654 C THR A 832 10.537 -9.505 20.773 1.00 14.82 C ATOM 1655 O THR A 832 11.769 -9.468 20.856 1.00 20.71 O ATOM 1656 CB THR A 832 9.678 -9.151 18.441 1.00 19.65 C ATOM 1657 OG1 THR A 832 8.751 -8.135 18.849 1.00 20.62 O ATOM 1658 CG2 THR A 832 9.149 -9.843 17.193 1.00 15.47 C ATOM 1659 HG1 THR A 832 8.631 -7.485 18.112 1.00 0.00 H ATOM 1660 H THR A 832 7.712 -10.405 19.542 1.00 0.00 H ATOM 1661 N GLN A 833 9.742 -8.995 21.717 1.00 20.00 N ATOM 1662 CA GLN A 833 10.304 -8.435 22.942 1.00 16.66 C ATOM 1663 C GLN A 833 10.969 -9.515 23.786 1.00 20.68 C ATOM 1664 O GLN A 833 12.067 -9.310 24.318 1.00 21.69 O ATOM 1665 CB GLN A 833 9.212 -7.726 23.742 1.00 18.98 C ATOM 1666 CG GLN A 833 8.697 -6.450 23.099 1.00 22.01 C ATOM 1667 CD GLN A 833 7.384 -5.989 23.697 1.00 27.02 C ATOM 1668 OE1 GLN A 833 6.836 -6.636 24.592 1.00 23.37 O ATOM 1669 NE2 GLN A 833 6.867 -4.867 23.202 1.00 19.37 N ATOM 1670 HE22 GLN A 833 7.365 -4.354 22.447 1.00 0.00 H ATOM 1671 HE21 GLN A 833 5.965 -4.503 23.570 1.00 0.00 H ATOM 1672 H GLN A 833 8.711 -8.997 21.578 1.00 0.00 H ATOM 1673 N GLN A 834 10.324 -10.675 23.918 1.00 19.72 N ATOM 1674 CA GLN A 834 10.917 -11.752 24.701 1.00 18.02 C ATOM 1675 C GLN A 834 12.159 -12.313 24.016 1.00 22.06 C ATOM 1676 O GLN A 834 13.167 -12.592 24.677 1.00 18.97 O ATOM 1677 CB GLN A 834 9.884 -12.850 24.943 1.00 16.36 C ATOM 1678 CG GLN A 834 10.407 -13.999 25.783 1.00 30.42 C ATOM 1679 CD GLN A 834 9.297 -14.802 26.420 1.00 21.19 C ATOM 1680 OE1 GLN A 834 8.208 -14.932 25.862 1.00 28.76 O ATOM 1681 NE2 GLN A 834 9.563 -15.333 27.605 1.00 25.26 N ATOM 1682 HE22 GLN A 834 10.499 -15.196 28.038 1.00 0.00 H ATOM 1683 HE21 GLN A 834 8.836 -15.886 28.102 1.00 0.00 H ATOM 1684 H GLN A 834 9.399 -10.811 23.463 1.00 0.00 H ATOM 1685 N LEU A 835 12.106 -12.485 22.692 1.00 17.21 N ATOM 1686 CA LEU A 835 13.283 -12.939 21.959 1.00 20.49 C ATOM 1687 C LEU A 835 14.455 -11.991 22.164 1.00 16.70 C ATOM 1688 O LEU A 835 15.589 -12.433 22.377 1.00 16.03 O ATOM 1689 CB LEU A 835 12.959 -13.071 20.471 1.00 17.02 C ATOM 1690 CG LEU A 835 12.082 -14.257 20.082 1.00 20.30 C ATOM 1691 CD1 LEU A 835 11.615 -14.121 18.643 1.00 11.24 C ATOM 1692 CD2 LEU A 835 12.846 -15.557 20.285 1.00 23.59 C ATOM 1693 H LEU A 835 11.221 -12.294 22.181 1.00 0.00 H ATOM 1694 N ALA A 836 14.198 -10.681 22.101 1.00 18.20 N ATOM 1695 CA ALA A 836 15.263 -9.705 22.308 1.00 19.41 C ATOM 1696 C ALA A 836 15.899 -9.868 23.681 1.00 20.05 C ATOM 1697 O ALA A 836 17.127 -9.808 23.816 1.00 23.81 O ATOM 1698 CB ALA A 836 14.717 -8.288 22.134 1.00 12.90 C ATOM 1699 H ALA A 836 13.231 -10.354 21.903 1.00 0.00 H ATOM 1700 N ASP A 837 15.077 -10.091 24.710 1.00 19.37 N ATOM 1701 CA ASP A 837 15.596 -10.214 26.068 1.00 24.50 C ATOM 1702 C ASP A 837 16.436 -11.476 26.238 1.00 24.50 C ATOM 1703 O ASP A 837 17.502 -11.436 26.863 1.00 32.58 O ATOM 1704 CB ASP A 837 14.441 -10.184 27.070 1.00 23.01 C ATOM 1705 CG ASP A 837 14.016 -8.768 27.422 1.00 39.03 C ATOM 1706 OD1 ASP A 837 14.833 -8.032 28.015 1.00 48.00 O ATOM 1707 OD2 ASP A 837 12.875 -8.381 27.091 1.00 44.93 O ATOM 1708 H ASP A 837 14.055 -10.178 24.541 1.00 0.00 H ATOM 1709 N VAL A 838 15.979 -12.608 25.694 1.00 20.75 N ATOM 1710 CA VAL A 838 16.779 -13.825 25.792 1.00 20.56 C ATOM 1711 C VAL A 838 17.986 -13.776 24.866 1.00 19.89 C ATOM 1712 O VAL A 838 18.921 -14.567 25.034 1.00 22.70 O ATOM 1713 CB VAL A 838 15.929 -15.083 25.513 1.00 19.55 C ATOM 1714 CG1 VAL A 838 14.757 -15.160 26.484 1.00 14.24 C ATOM 1715 CG2 VAL A 838 15.447 -15.113 24.072 1.00 14.37 C ATOM 1716 H VAL A 838 15.061 -12.622 25.205 1.00 0.00 H ATOM 1717 N TYR A 839 17.996 -12.867 23.891 1.00 22.19 N ATOM 1718 CA TYR A 839 19.182 -12.596 23.089 1.00 17.80 C ATOM 1719 C TYR A 839 20.044 -11.491 23.682 1.00 20.41 C ATOM 1720 O TYR A 839 20.945 -10.991 23.000 1.00 17.99 O ATOM 1721 CB TYR A 839 18.790 -12.243 21.652 1.00 15.66 C ATOM 1722 CG TYR A 839 18.683 -13.458 20.760 1.00 24.56 C ATOM 1723 CD1 TYR A 839 19.820 -14.033 20.203 1.00 20.92 C ATOM 1724 CD2 TYR A 839 17.452 -14.041 20.487 1.00 15.30 C ATOM 1725 CE1 TYR A 839 19.733 -15.153 19.392 1.00 18.36 C ATOM 1726 CE2 TYR A 839 17.355 -15.159 19.677 1.00 15.21 C ATOM 1727 CZ TYR A 839 18.499 -15.712 19.132 1.00 22.18 C ATOM 1728 OH TYR A 839 18.409 -16.826 18.328 1.00 23.48 O ATOM 1729 HH TYR A 839 19.315 -17.087 18.026 1.00 0.00 H ATOM 1730 H TYR A 839 17.126 -12.332 23.696 1.00 0.00 H ATOM 1731 N HIS A 840 19.773 -11.095 24.928 1.00 17.23 N ATOM 1732 CA HIS A 840 20.621 -10.176 25.685 1.00 20.04 C ATOM 1733 C HIS A 840 20.673 -8.786 25.062 1.00 21.45 C ATOM 1734 O HIS A 840 21.698 -8.103 25.120 1.00 22.65 O ATOM 1735 CB HIS A 840 22.028 -10.747 25.855 1.00 16.70 C ATOM 1736 CG HIS A 840 22.041 -12.100 26.489 1.00 25.67 C ATOM 1737 ND1 HIS A 840 22.338 -13.249 25.789 1.00 23.47 N ATOM 1738 CD2 HIS A 840 21.756 -12.491 27.753 1.00 23.77 C ATOM 1739 CE1 HIS A 840 22.255 -14.288 26.600 1.00 27.06 C ATOM 1740 NE2 HIS A 840 21.904 -13.856 27.798 1.00 29.19 N ATOM 1741 H HIS A 840 18.913 -11.460 25.384 1.00 0.00 H ATOM 1742 N TYR A 841 19.570 -8.356 24.461 1.00 18.73 N ATOM 1743 CA TYR A 841 19.427 -6.952 24.120 1.00 21.33 C ATOM 1744 C TYR A 841 19.236 -6.140 25.392 1.00 23.56 C ATOM 1745 O TYR A 841 18.535 -6.559 26.318 1.00 18.88 O ATOM 1746 CB TYR A 841 18.241 -6.739 23.177 1.00 17.72 C ATOM 1747 CG TYR A 841 18.546 -7.056 21.734 1.00 18.67 C ATOM 1748 CD1 TYR A 841 18.529 -8.365 21.271 1.00 20.80 C ATOM 1749 CD2 TYR A 841 18.852 -6.047 20.833 1.00 20.22 C ATOM 1750 CE1 TYR A 841 18.811 -8.661 19.948 1.00 23.55 C ATOM 1751 CE2 TYR A 841 19.135 -6.330 19.508 1.00 23.11 C ATOM 1752 CZ TYR A 841 19.113 -7.637 19.070 1.00 23.07 C ATOM 1753 OH TYR A 841 19.393 -7.917 17.750 1.00 21.96 O ATOM 1754 HH TYR A 841 19.335 -8.894 17.602 1.00 0.00 H ATOM 1755 H TYR A 841 18.807 -9.026 24.234 1.00 0.00 H ATOM 1756 N LYS A 842 19.885 -4.985 25.447 1.00 23.84 N ATOM 1757 CA LYS A 842 19.635 -4.042 26.522 1.00 18.28 C ATOM 1758 C LYS A 842 18.311 -3.341 26.261 1.00 22.85 C ATOM 1759 O LYS A 842 17.991 -2.996 25.120 1.00 23.86 O ATOM 1760 CB LYS A 842 20.772 -3.022 26.613 1.00 22.80 C ATOM 1761 CG LYS A 842 21.168 -2.644 28.030 1.00 41.98 C ATOM 1762 CD LYS A 842 22.331 -1.661 28.032 1.00 41.12 C ATOM 1763 CE LYS A 842 23.095 -1.701 29.350 1.00 48.82 C ATOM 1764 NZ LYS A 842 22.199 -1.538 30.527 1.00 62.74 N ATOM 1765 HZ1 LYS A 842 21.710 -0.622 30.465 1.00 0.00 H ATOM 1766 HZ2 LYS A 842 21.498 -2.306 30.537 1.00 0.00 H ATOM 1767 HZ3 LYS A 842 22.765 -1.572 31.399 1.00 0.00 H ATOM 1768 H LYS A 842 20.582 -4.752 24.711 1.00 0.00 H ATOM 1769 N THR A 843 17.524 -3.161 27.315 1.00 23.87 N ATOM 1770 CA THR A 843 16.298 -2.382 27.222 1.00 22.14 C ATOM 1771 C THR A 843 16.627 -0.922 27.496 1.00 22.71 C ATOM 1772 O THR A 843 17.100 -0.581 28.586 1.00 33.20 O ATOM 1773 CB THR A 843 15.239 -2.883 28.201 1.00 21.49 C ATOM 1774 OG1 THR A 843 14.768 -4.168 27.779 1.00 22.62 O ATOM 1775 CG2 THR A 843 14.070 -1.911 28.251 1.00 14.17 C ATOM 1776 HG1 THR A 843 15.526 -4.805 27.757 1.00 0.00 H ATOM 1777 H THR A 843 17.789 -3.586 28.227 1.00 0.00 H ATOM 1778 N LEU A 844 16.392 -0.065 26.504 1.00 22.97 N ATOM 1779 CA LEU A 844 16.634 1.360 26.662 1.00 25.66 C ATOM 1780 C LEU A 844 15.359 2.163 26.862 1.00 27.23 C ATOM 1781 O LEU A 844 15.432 3.303 27.330 1.00 25.84 O ATOM 1782 CB LEU A 844 17.403 1.904 25.451 1.00 25.50 C ATOM 1783 CG LEU A 844 18.809 1.316 25.290 1.00 23.13 C ATOM 1784 CD1 LEU A 844 19.558 1.980 24.145 1.00 17.30 C ATOM 1785 CD2 LEU A 844 19.585 1.440 26.594 1.00 20.63 C ATOM 1786 H LEU A 844 16.028 -0.422 25.598 1.00 0.00 H ATOM 1787 N LEU A 845 14.201 1.595 26.531 1.00 24.75 N ATOM 1788 CA LEU A 845 12.920 2.232 26.810 1.00 25.97 C ATOM 1789 C LEU A 845 11.854 1.154 26.907 1.00 27.94 C ATOM 1790 O LEU A 845 11.801 0.258 26.060 1.00 26.17 O ATOM 1791 CB LEU A 845 12.544 3.240 25.722 1.00 26.76 C ATOM 1792 CG LEU A 845 11.193 3.926 25.932 1.00 24.70 C ATOM 1793 CD1 LEU A 845 11.286 4.986 27.021 1.00 26.78 C ATOM 1794 CD2 LEU A 845 10.681 4.517 24.635 1.00 23.41 C ATOM 1795 H LEU A 845 14.211 0.668 26.059 1.00 0.00 H ATOM 1796 N ASN A 846 11.010 1.245 27.931 1.00 25.00 N ATOM 1797 CA ASN A 846 9.866 0.353 28.102 1.00 20.32 C ATOM 1798 C ASN A 846 8.632 1.239 28.219 1.00 24.46 C ATOM 1799 O ASN A 846 8.164 1.534 29.320 1.00 30.45 O ATOM 1800 CB ASN A 846 10.035 -0.539 29.312 1.00 15.60 C ATOM 1801 CG ASN A 846 9.013 -1.660 29.354 1.00 26.06 C ATOM 1802 OD1 ASN A 846 7.939 -1.565 28.754 1.00 24.35 O ATOM 1803 ND2 ASN A 846 9.343 -2.731 30.064 1.00 21.74 N ATOM 1804 HD22 ASN A 846 10.260 -2.768 30.554 1.00 0.00 H ATOM 1805 HD21 ASN A 846 8.685 -3.534 30.131 1.00 0.00 H ATOM 1806 H ASN A 846 11.172 1.986 28.643 1.00 0.00 H ATOM 1807 N PHE A 847 8.104 1.660 27.077 1.00 24.01 N ATOM 1808 CA PHE A 847 7.038 2.648 27.049 1.00 26.52 C ATOM 1809 C PHE A 847 5.676 1.979 26.923 1.00 21.32 C ATOM 1810 O PHE A 847 5.504 1.024 26.160 1.00 26.46 O ATOM 1811 CB PHE A 847 7.235 3.641 25.903 1.00 21.11 C ATOM 1812 CG PHE A 847 6.374 4.862 26.020 1.00 21.84 C ATOM 1813 CD1 PHE A 847 6.801 5.955 26.755 1.00 22.12 C ATOM 1814 CD2 PHE A 847 5.130 4.912 25.415 1.00 22.01 C ATOM 1815 CE1 PHE A 847 6.008 7.078 26.876 1.00 20.22 C ATOM 1816 CE2 PHE A 847 4.333 6.035 25.532 1.00 26.79 C ATOM 1817 CZ PHE A 847 4.774 7.119 26.262 1.00 20.93 C ATOM 1818 H PHE A 847 8.461 1.274 26.180 1.00 0.00 H ATOM 1819 N GLN A 848 4.713 2.499 27.677 1.00 26.11 N ATOM 1820 CA GLN A 848 3.332 2.030 27.642 1.00 29.93 C ATOM 1821 C GLN A 848 2.621 2.691 26.466 1.00 27.18 C ATOM 1822 O GLN A 848 2.398 3.906 26.473 1.00 25.41 O ATOM 1823 CB GLN A 848 2.649 2.361 28.965 1.00 26.13 C ATOM 1824 CG GLN A 848 1.301 1.717 29.174 1.00 31.96 C ATOM 1825 CD GLN A 848 0.769 1.980 30.565 1.00 33.26 C ATOM 1826 OE1 GLN A 848 1.503 1.883 31.551 1.00 31.16 O ATOM 1827 NE2 GLN A 848 -0.507 2.335 30.654 1.00 32.25 N ATOM 1828 HE22 GLN A 848 -1.089 2.404 29.795 1.00 0.00 H ATOM 1829 HE21 GLN A 848 -0.925 2.544 31.583 1.00 0.00 H ATOM 1830 H GLN A 848 4.955 3.277 28.323 1.00 0.00 H ATOM 1831 N VAL A 849 2.246 1.892 25.462 1.00 28.42 N ATOM 1832 CA VAL A 849 1.770 2.453 24.202 1.00 20.17 C ATOM 1833 C VAL A 849 0.448 3.203 24.349 1.00 28.60 C ATOM 1834 O VAL A 849 0.135 4.053 23.507 1.00 31.73 O ATOM 1835 CB VAL A 849 1.652 1.354 23.126 1.00 21.86 C ATOM 1836 CG1 VAL A 849 2.964 0.593 22.991 1.00 23.35 C ATOM 1837 CG2 VAL A 849 0.509 0.404 23.438 1.00 25.44 C ATOM 1838 H VAL A 849 2.294 0.860 25.580 1.00 0.00 H ATOM 1839 N ASN A 850 -0.342 2.930 25.390 1.00 24.42 N ATOM 1840 CA ASN A 850 -1.578 3.688 25.555 1.00 30.97 C ATOM 1841 C ASN A 850 -1.353 5.064 26.167 1.00 28.60 C ATOM 1842 O ASN A 850 -2.316 5.825 26.307 1.00 37.06 O ATOM 1843 CB ASN A 850 -2.607 2.898 26.385 1.00 23.60 C ATOM 1844 CG ASN A 850 -2.143 2.595 27.803 1.00 31.52 C ATOM 1845 OD1 ASN A 850 -1.369 3.341 28.405 1.00 32.64 O ATOM 1846 ND2 ASN A 850 -2.639 1.490 28.351 1.00 21.38 N ATOM 1847 HD22 ASN A 850 -3.290 0.887 27.808 1.00 0.00 H ATOM 1848 HD21 ASN A 850 -2.376 1.228 29.323 1.00 0.00 H ATOM 1849 H ASN A 850 -0.081 2.189 26.072 1.00 0.00 H ATOM 1850 N GLU A 851 -0.116 5.401 26.528 1.00 26.58 N ATOM 1851 CA GLU A 851 0.207 6.703 27.093 1.00 26.53 C ATOM 1852 C GLU A 851 0.765 7.679 26.067 1.00 28.79 C ATOM 1853 O GLU A 851 0.964 8.853 26.397 1.00 30.53 O ATOM 1854 CB GLU A 851 1.209 6.543 28.241 1.00 26.93 C ATOM 1855 CG GLU A 851 0.662 5.778 29.434 1.00 32.23 C ATOM 1856 CD GLU A 851 1.725 5.486 30.475 1.00 43.05 C ATOM 1857 OE1 GLU A 851 2.917 5.745 30.200 1.00 50.77 O ATOM 1858 OE2 GLU A 851 1.372 4.993 31.568 1.00 60.25 O ATOM 1859 H GLU A 851 0.648 4.707 26.401 1.00 0.00 H ATOM 1860 N TYR A 852 1.019 7.230 24.840 1.00 23.53 N ATOM 1861 CA TYR A 852 1.568 8.101 23.811 1.00 25.58 C ATOM 1862 C TYR A 852 0.488 9.026 23.273 1.00 25.36 C ATOM 1863 O TYR A 852 -0.595 8.574 22.893 1.00 30.65 O ATOM 1864 CB TYR A 852 2.161 7.278 22.672 1.00 28.43 C ATOM 1865 CG TYR A 852 2.522 8.105 21.460 1.00 25.30 C ATOM 1866 CD1 TYR A 852 3.588 8.991 21.496 1.00 21.20 C ATOM 1867 CD2 TYR A 852 1.805 7.991 20.275 1.00 25.81 C ATOM 1868 CE1 TYR A 852 3.928 9.748 20.389 1.00 26.70 C ATOM 1869 CE2 TYR A 852 2.138 8.745 19.160 1.00 28.32 C ATOM 1870 CZ TYR A 852 3.201 9.622 19.224 1.00 27.90 C ATOM 1871 OH TYR A 852 3.542 10.377 18.124 1.00 30.06 O ATOM 1872 HH TYR A 852 4.321 10.946 18.345 1.00 0.00 H ATOM 1873 H TYR A 852 0.821 6.235 24.611 1.00 0.00 H ATOM 1874 N VAL A 853 0.791 10.319 23.228 1.00 33.13 N ATOM 1875 CA VAL A 853 -0.152 11.332 22.770 1.00 34.33 C ATOM 1876 C VAL A 853 0.228 11.754 21.360 1.00 30.10 C ATOM 1877 O VAL A 853 1.386 12.106 21.099 1.00 26.35 O ATOM 1878 CB VAL A 853 -0.178 12.545 23.717 1.00 29.27 C ATOM 1879 CG1 VAL A 853 -1.239 13.534 23.266 1.00 30.31 C ATOM 1880 CG2 VAL A 853 -0.431 12.100 25.148 1.00 13.47 C ATOM 1881 H VAL A 853 1.739 10.620 23.532 1.00 0.00 H ATOM 1882 N HIS A 854 -0.748 11.713 20.454 1.00 36.74 N ATOM 1883 CA HIS A 854 -0.588 12.214 19.098 1.00 34.57 C ATOM 1884 C HIS A 854 -0.522 13.743 19.114 1.00 30.49 C ATOM 1885 O HIS A 854 -0.776 14.395 20.131 1.00 33.95 O ATOM 1886 CB HIS A 854 -1.744 11.721 18.221 1.00 34.52 C ATOM 1887 CG HIS A 854 -1.542 11.931 16.751 1.00 31.60 C ATOM 1888 ND1 HIS A 854 -0.298 12.096 16.180 1.00 36.08 N ATOM 1889 CD2 HIS A 854 -2.433 11.997 15.733 1.00 34.44 C ATOM 1890 CE1 HIS A 854 -0.432 12.259 14.876 1.00 30.04 C ATOM 1891 NE2 HIS A 854 -1.717 12.202 14.578 1.00 25.46 N ATOM 1892 H HIS A 854 -1.664 11.305 20.728 1.00 0.00 H ATOM 1893 N SER A 855 -0.173 14.320 17.962 1.00 26.86 N ATOM 1894 CA SER A 855 -0.066 15.772 17.869 1.00 31.22 C ATOM 1895 C SER A 855 -1.394 16.460 18.162 1.00 32.28 C ATOM 1896 O SER A 855 -1.406 17.609 18.619 1.00 36.07 O ATOM 1897 CB SER A 855 0.450 16.172 16.486 1.00 29.78 C ATOM 1898 OG SER A 855 -0.329 15.594 15.454 1.00 37.55 O ATOM 1899 HG SER A 855 -0.294 14.607 15.529 1.00 0.00 H ATOM 1900 H SER A 855 0.024 13.732 17.127 1.00 0.00 H ATOM 1901 N ASP A 856 -2.516 15.783 17.918 1.00 37.06 N ATOM 1902 CA ASP A 856 -3.836 16.365 18.127 1.00 35.98 C ATOM 1903 C ASP A 856 -4.379 16.122 19.531 1.00 33.46 C ATOM 1904 O ASP A 856 -5.576 16.324 19.762 1.00 41.64 O ATOM 1905 CB ASP A 856 -4.823 15.832 17.080 1.00 28.63 C ATOM 1906 CG ASP A 856 -4.931 14.313 17.081 1.00 42.78 C ATOM 1907 OD1 ASP A 856 -4.686 13.680 18.129 1.00 41.84 O ATOM 1908 OD2 ASP A 856 -5.260 13.746 16.017 1.00 50.66 O ATOM 1909 H ASP A 856 -2.447 14.807 17.567 1.00 0.00 H ATOM 1910 N GLY A 857 -3.537 15.685 20.464 1.00 29.57 N ATOM 1911 CA GLY A 857 -3.954 15.456 21.828 1.00 31.36 C ATOM 1912 C GLY A 857 -4.537 14.088 22.101 1.00 34.76 C ATOM 1913 O GLY A 857 -4.657 13.708 23.272 1.00 41.20 O ATOM 1914 H GLY A 857 -2.547 15.502 20.203 1.00 0.00 H ATOM 1915 N SER A 858 -4.899 13.336 21.066 1.00 32.92 N ATOM 1916 CA SER A 858 -5.487 12.022 21.263 1.00 32.65 C ATOM 1917 C SER A 858 -4.416 10.993 21.612 1.00 35.33 C ATOM 1918 O SER A 858 -3.216 11.208 21.416 1.00 32.86 O ATOM 1919 CB SER A 858 -6.230 11.569 20.008 1.00 31.49 C ATOM 1920 OG SER A 858 -5.312 11.305 18.961 1.00 34.84 O ATOM 1921 HG SER A 858 -4.802 12.128 18.756 1.00 0.00 H ATOM 1922 H SER A 858 -4.759 13.694 20.100 1.00 0.00 H ATOM 1923 N ARG A 859 -4.873 9.854 22.131 1.00 32.60 N ATOM 1924 CA ARG A 859 -4.001 8.713 22.384 1.00 33.24 C ATOM 1925 C ARG A 859 -4.345 7.613 21.391 1.00 31.32 C ATOM 1926 O ARG A 859 -5.282 6.834 21.625 1.00 28.12 O ATOM 1927 CB ARG A 859 -4.146 8.222 23.827 1.00 29.19 C ATOM 1928 CG ARG A 859 -3.529 9.196 24.824 1.00 38.25 C ATOM 1929 CD ARG A 859 -3.641 8.736 26.265 1.00 38.67 C ATOM 1930 NE ARG A 859 -5.025 8.680 26.723 1.00 48.95 N ATOM 1931 CZ ARG A 859 -5.666 7.557 27.028 1.00 61.18 C ATOM 1932 NH1 ARG A 859 -5.043 6.389 26.936 1.00 50.40 N ATOM 1933 NH2 ARG A 859 -6.927 7.602 27.437 1.00 61.96 N ATOM 1934 HE ARG A 859 -5.543 9.577 26.817 1.00 0.00 H ATOM 1935 HH12 ARG A 859 -5.546 5.511 27.175 1.00 0.00 H ATOM 1936 HH11 ARG A 859 -4.051 6.352 26.625 1.00 0.00 H ATOM 1937 HH22 ARG A 859 -7.428 6.722 27.676 1.00 0.00 H ATOM 1938 HH21 ARG A 859 -7.415 8.517 27.519 1.00 0.00 H ATOM 1939 H ARG A 859 -5.884 9.776 22.363 1.00 0.00 H ATOM 1940 N PRO A 860 -3.623 7.513 20.269 1.00 29.81 N ATOM 1941 CA PRO A 860 -4.018 6.565 19.213 1.00 23.24 C ATOM 1942 C PRO A 860 -4.056 5.119 19.668 1.00 29.60 C ATOM 1943 O PRO A 860 -4.873 4.342 19.159 1.00 34.27 O ATOM 1944 CB PRO A 860 -2.947 6.782 18.134 1.00 28.43 C ATOM 1945 CG PRO A 860 -2.368 8.131 18.428 1.00 32.66 C ATOM 1946 CD PRO A 860 -2.414 8.270 19.912 1.00 27.21 C ATOM 1947 N PHE A 861 -3.193 4.730 20.606 1.00 25.86 N ATOM 1948 CA PHE A 861 -3.218 3.394 21.184 1.00 24.68 C ATOM 1949 C PHE A 861 -3.802 3.393 22.591 1.00 28.76 C ATOM 1950 O PHE A 861 -3.485 2.504 23.387 1.00 36.28 O ATOM 1951 CB PHE A 861 -1.814 2.786 21.199 1.00 27.96 C ATOM 1952 CG PHE A 861 -0.963 3.183 20.025 1.00 27.28 C ATOM 1953 CD1 PHE A 861 -1.275 2.757 18.742 1.00 28.35 C ATOM 1954 CD2 PHE A 861 0.160 3.974 20.208 1.00 26.10 C ATOM 1955 CE1 PHE A 861 -0.487 3.122 17.663 1.00 22.15 C ATOM 1956 CE2 PHE A 861 0.951 4.340 19.135 1.00 31.01 C ATOM 1957 CZ PHE A 861 0.626 3.913 17.860 1.00 30.18 C ATOM 1958 H PHE A 861 -2.475 5.406 20.937 1.00 0.00 H ATOM 1959 N GLY A 862 -4.651 4.373 22.912 1.00 29.60 N ATOM 1960 CA GLY A 862 -5.229 4.466 24.241 1.00 26.82 C ATOM 1961 C GLY A 862 -6.153 3.325 24.603 1.00 27.52 C ATOM 1962 O GLY A 862 -6.367 3.071 25.794 1.00 36.66 O ATOM 1963 H GLY A 862 -4.903 5.084 22.196 1.00 0.00 H ATOM 1964 N ASP A 863 -6.712 2.637 23.607 1.00 28.62 N ATOM 1965 CA ASP A 863 -7.555 1.480 23.871 1.00 30.72 C ATOM 1966 C ASP A 863 -6.756 0.210 24.120 1.00 36.48 C ATOM 1967 O ASP A 863 -7.350 -0.820 24.461 1.00 41.75 O ATOM 1968 CB ASP A 863 -8.524 1.253 22.709 1.00 37.77 C ATOM 1969 CG ASP A 863 -9.580 2.333 22.615 1.00 42.50 C ATOM 1970 OD1 ASP A 863 -9.998 2.847 23.673 1.00 41.10 O ATOM 1971 OD2 ASP A 863 -9.986 2.671 21.482 1.00 46.60 O ATOM 1972 H ASP A 863 -6.543 2.932 22.624 1.00 0.00 H ATOM 1973 N ALA A 864 -5.436 0.251 23.947 1.00 31.46 N ATOM 1974 CA ALA A 864 -4.603 -0.900 24.243 1.00 24.14 C ATOM 1975 C ALA A 864 -4.452 -1.064 25.753 1.00 28.18 C ATOM 1976 O ALA A 864 -4.408 -0.074 26.488 1.00 35.32 O ATOM 1977 CB ALA A 864 -3.228 -0.744 23.603 1.00 26.88 C ATOM 1978 H ALA A 864 -4.994 1.124 23.593 1.00 0.00 H ATOM 1979 N PRO A 865 -4.370 -2.301 26.242 1.00 32.44 N ATOM 1980 CA PRO A 865 -4.175 -2.506 27.680 1.00 26.61 C ATOM 1981 C PRO A 865 -2.830 -1.959 28.129 1.00 25.07 C ATOM 1982 O PRO A 865 -1.910 -1.763 27.331 1.00 26.61 O ATOM 1983 CB PRO A 865 -4.242 -4.030 27.839 1.00 28.61 C ATOM 1984 CG PRO A 865 -3.869 -4.561 26.494 1.00 25.80 C ATOM 1985 CD PRO A 865 -4.415 -3.575 25.502 1.00 25.76 C ATOM 1986 N ASP A 866 -2.727 -1.703 29.437 1.00 25.76 N ATOM 1987 CA ASP A 866 -1.479 -1.185 29.992 1.00 29.12 C ATOM 1988 C ASP A 866 -0.316 -2.139 29.757 1.00 25.46 C ATOM 1989 O ASP A 866 0.842 -1.706 29.700 1.00 27.33 O ATOM 1990 CB ASP A 866 -1.640 -0.913 31.489 1.00 27.04 C ATOM 1991 CG ASP A 866 -2.623 0.203 31.777 1.00 24.37 C ATOM 1992 OD1 ASP A 866 -3.130 0.815 30.814 1.00 33.67 O ATOM 1993 OD2 ASP A 866 -2.889 0.469 32.967 1.00 25.32 O ATOM 1994 H ASP A 866 -3.540 -1.874 30.063 1.00 0.00 H ATOM 1995 N GLU A 867 -0.601 -3.431 29.599 1.00 27.38 N ATOM 1996 CA GLU A 867 0.459 -4.421 29.478 1.00 22.87 C ATOM 1997 C GLU A 867 1.157 -4.374 28.125 1.00 25.76 C ATOM 1998 O GLU A 867 2.238 -4.955 27.984 1.00 28.54 O ATOM 1999 CB GLU A 867 -0.104 -5.822 29.727 1.00 19.55 C ATOM 2000 CG GLU A 867 -0.635 -6.043 31.143 1.00 49.33 C ATOM 2001 CD GLU A 867 -1.952 -5.329 31.401 1.00 46.33 C ATOM 2002 OE1 GLU A 867 -2.762 -5.218 30.455 1.00 27.64 O ATOM 2003 OE2 GLU A 867 -2.170 -4.862 32.540 1.00 47.82 O ATOM 2004 H GLU A 867 -1.595 -3.736 29.562 1.00 0.00 H ATOM 2005 N GLN A 868 0.578 -3.702 27.131 1.00 21.45 N ATOM 2006 CA GLN A 868 1.189 -3.645 25.808 1.00 20.89 C ATOM 2007 C GLN A 868 2.282 -2.583 25.795 1.00 28.20 C ATOM 2008 O GLN A 868 2.007 -1.391 25.982 1.00 23.75 O ATOM 2009 CB GLN A 868 0.145 -3.358 24.733 1.00 17.30 C ATOM 2010 CG GLN A 868 0.710 -3.470 23.326 1.00 22.05 C ATOM 2011 CD GLN A 868 -0.304 -3.152 22.250 1.00 26.26 C ATOM 2012 OE1 GLN A 868 -1.504 -3.346 22.432 1.00 39.19 O ATOM 2013 NE2 GLN A 868 0.176 -2.654 21.118 1.00 26.69 N ATOM 2014 HE22 GLN A 868 1.200 -2.506 21.008 1.00 0.00 H ATOM 2015 HE21 GLN A 868 -0.471 -2.411 20.341 1.00 0.00 H ATOM 2016 H GLN A 868 -0.323 -3.211 27.301 1.00 0.00 H ATOM 2017 N ARG A 869 3.518 -3.015 25.565 1.00 25.37 N ATOM 2018 CA ARG A 869 4.678 -2.142 25.620 1.00 23.75 C ATOM 2019 C ARG A 869 5.301 -1.999 24.239 1.00 23.53 C ATOM 2020 O ARG A 869 5.160 -2.871 23.376 1.00 21.87 O ATOM 2021 CB ARG A 869 5.734 -2.680 26.593 1.00 19.98 C ATOM 2022 CG ARG A 869 5.178 -3.496 27.745 1.00 18.63 C ATOM 2023 CD ARG A 869 4.336 -2.647 28.676 1.00 21.51 C ATOM 2024 NE ARG A 869 5.099 -1.539 29.232 1.00 18.44 N ATOM 2025 CZ ARG A 869 4.588 -0.614 30.033 1.00 20.25 C ATOM 2026 NH1 ARG A 869 3.305 -0.663 30.368 1.00 20.63 N ATOM 2027 NH2 ARG A 869 5.358 0.362 30.493 1.00 23.70 N ATOM 2028 HE ARG A 869 6.107 -1.469 28.986 1.00 0.00 H ATOM 2029 HH12 ARG A 869 2.904 0.062 30.996 1.00 0.00 H ATOM 2030 HH11 ARG A 869 2.701 -1.427 30.002 1.00 0.00 H ATOM 2031 HH22 ARG A 869 4.958 1.088 31.121 1.00 0.00 H ATOM 2032 HH21 ARG A 869 6.362 0.402 30.226 1.00 0.00 H ATOM 2033 H ARG A 869 3.660 -4.019 25.336 1.00 0.00 H ATOM 2034 N ALA A 870 5.980 -0.880 24.039 1.00 17.23 N ATOM 2035 CA ALA A 870 6.880 -0.682 22.908 1.00 18.13 C ATOM 2036 C ALA A 870 8.274 -0.575 23.509 1.00 22.73 C ATOM 2037 O ALA A 870 8.635 0.457 24.083 1.00 30.41 O ATOM 2038 CB ALA A 870 6.516 0.560 22.102 1.00 18.50 C ATOM 2039 H ALA A 870 5.866 -0.104 24.722 1.00 0.00 H ATOM 2040 N ILE A 871 9.045 -1.650 23.409 1.00 18.56 N ATOM 2041 CA ILE A 871 10.352 -1.724 24.046 1.00 24.34 C ATOM 2042 C ILE A 871 11.422 -1.418 23.009 1.00 20.25 C ATOM 2043 O ILE A 871 11.475 -2.049 21.945 1.00 15.19 O ATOM 2044 CB ILE A 871 10.584 -3.091 24.703 1.00 22.83 C ATOM 2045 CG1 ILE A 871 9.419 -3.424 25.643 1.00 23.62 C ATOM 2046 CG2 ILE A 871 11.898 -3.076 25.461 1.00 16.28 C ATOM 2047 CD1 ILE A 871 9.570 -4.746 26.379 1.00 24.46 C ATOM 2048 H ILE A 871 8.705 -2.465 22.859 1.00 0.00 H ATOM 2049 N VAL A 872 12.266 -0.442 23.322 1.00 22.22 N ATOM 2050 CA VAL A 872 13.397 -0.076 22.481 1.00 17.20 C ATOM 2051 C VAL A 872 14.586 -0.915 22.917 1.00 17.96 C ATOM 2052 O VAL A 872 15.028 -0.830 24.067 1.00 17.97 O ATOM 2053 CB VAL A 872 13.707 1.424 22.595 1.00 22.74 C ATOM 2054 CG1 VAL A 872 15.011 1.752 21.903 1.00 19.15 C ATOM 2055 CG2 VAL A 872 12.569 2.242 22.017 1.00 16.88 C ATOM 2056 H VAL A 872 12.113 0.084 24.206 1.00 0.00 H ATOM 2057 N HIS A 873 15.100 -1.735 22.009 1.00 21.45 N ATOM 2058 CA HIS A 873 16.186 -2.639 22.341 1.00 25.84 C ATOM 2059 C HIS A 873 17.470 -2.220 21.641 1.00 23.58 C ATOM 2060 O HIS A 873 17.460 -1.499 20.639 1.00 25.65 O ATOM 2061 CB HIS A 873 15.830 -4.084 21.983 1.00 21.63 C ATOM 2062 CG HIS A 873 15.005 -4.773 23.024 1.00 26.98 C ATOM 2063 ND1 HIS A 873 13.688 -5.122 22.822 1.00 20.95 N ATOM 2064 CD2 HIS A 873 15.310 -5.170 24.283 1.00 21.60 C ATOM 2065 CE1 HIS A 873 13.220 -5.716 23.905 1.00 17.66 C ATOM 2066 NE2 HIS A 873 14.183 -5.753 24.808 1.00 26.35 N ATOM 2067 H HIS A 873 14.718 -1.730 21.042 1.00 0.00 H ATOM 2068 N TRP A 874 18.582 -2.689 22.199 1.00 22.74 N ATOM 2069 CA TRP A 874 19.910 -2.350 21.711 1.00 20.32 C ATOM 2070 C TRP A 874 20.892 -3.365 22.270 1.00 19.38 C ATOM 2071 O TRP A 874 20.936 -3.580 23.485 1.00 22.22 O ATOM 2072 CB TRP A 874 20.296 -0.924 22.126 1.00 19.63 C ATOM 2073 CG TRP A 874 21.766 -0.601 22.025 1.00 24.11 C ATOM 2074 CD1 TRP A 874 22.671 -0.588 23.047 1.00 18.39 C ATOM 2075 CD2 TRP A 874 22.492 -0.227 20.844 1.00 21.59 C ATOM 2076 NE1 TRP A 874 23.913 -0.235 22.577 1.00 26.06 N ATOM 2077 CE2 TRP A 874 23.830 -0.007 21.228 1.00 24.91 C ATOM 2078 CE3 TRP A 874 22.139 -0.056 19.501 1.00 18.90 C ATOM 2079 CZ2 TRP A 874 24.817 0.370 20.318 1.00 23.43 C ATOM 2080 CZ3 TRP A 874 23.121 0.321 18.599 1.00 21.57 C ATOM 2081 CH2 TRP A 874 24.444 0.531 19.012 1.00 17.83 C ATOM 2082 HE1 TRP A 874 24.776 -0.154 23.152 1.00 0.00 H ATOM 2083 H TRP A 874 18.499 -3.324 23.018 1.00 0.00 H ATOM 2084 N LYS A 875 21.653 -4.003 21.385 1.00 20.87 N ATOM 2085 CA LYS A 875 22.730 -4.895 21.788 1.00 23.64 C ATOM 2086 C LYS A 875 23.988 -4.523 21.025 1.00 21.15 C ATOM 2087 O LYS A 875 23.967 -4.442 19.794 1.00 19.43 O ATOM 2088 CB LYS A 875 22.384 -6.366 21.534 1.00 19.76 C ATOM 2089 CG LYS A 875 23.568 -7.295 21.754 1.00 23.85 C ATOM 2090 CD LYS A 875 23.141 -8.734 21.951 1.00 21.46 C ATOM 2091 CE LYS A 875 22.561 -9.322 20.689 1.00 20.05 C ATOM 2092 NZ LYS A 875 22.156 -10.735 20.921 1.00 21.63 N ATOM 2093 HZ1 LYS A 875 22.988 -11.291 21.206 1.00 0.00 H ATOM 2094 HZ2 LYS A 875 21.440 -10.770 21.674 1.00 0.00 H ATOM 2095 HZ3 LYS A 875 21.758 -11.129 20.044 1.00 0.00 H ATOM 2096 H LYS A 875 21.472 -3.860 20.371 1.00 0.00 H ATOM 2097 N GLU A 876 25.076 -4.295 21.754 1.00 24.95 N ATOM 2098 CA GLU A 876 26.368 -4.102 21.114 1.00 28.74 C ATOM 2099 C GLU A 876 26.874 -5.428 20.564 1.00 26.78 C ATOM 2100 O GLU A 876 26.711 -6.479 21.190 1.00 29.50 O ATOM 2101 CB GLU A 876 27.369 -3.512 22.107 1.00 18.59 C ATOM 2102 CG GLU A 876 27.028 -2.094 22.524 1.00 29.76 C ATOM 2103 CD GLU A 876 28.153 -1.416 23.277 1.00 43.58 C ATOM 2104 OE1 GLU A 876 28.442 -1.831 24.419 1.00 34.74 O ATOM 2105 OE2 GLU A 876 28.752 -0.470 22.721 1.00 43.40 O ATOM 2106 H GLU A 876 25.003 -4.254 22.791 1.00 0.00 H ATOM 2107 N VAL A 877 27.476 -5.382 19.378 1.00 20.59 N ATOM 2108 CA VAL A 877 27.915 -6.604 18.707 1.00 33.85 C ATOM 2109 C VAL A 877 29.405 -6.868 18.927 1.00 35.77 C ATOM 2110 O VAL A 877 30.164 -5.969 19.290 1.00 39.32 O ATOM 2111 CB VAL A 877 27.602 -6.551 17.202 1.00 29.63 C ATOM 2112 CG1 VAL A 877 26.212 -5.987 16.971 1.00 37.07 C ATOM 2113 CG2 VAL A 877 28.648 -5.736 16.466 1.00 32.09 C ATOM 2114 H VAL A 877 27.637 -4.462 18.921 1.00 0.00 H TER 2115 VAL A 877 HETATM 2116 O HOH 1 16.559 -6.420 27.484 1.00 27.90 O HETATM 2117 O HOH 2 20.539 -6.444 -0.658 1.00 27.10 O HETATM 2118 O HOH 3 1.026 -6.581 21.874 1.00 32.49 O HETATM 2119 O HOH 4 9.551 -0.299 11.609 1.00 30.81 O HETATM 2120 O HOH 5 8.927 -7.826 14.270 1.00 30.59 O HETATM 2121 O HOH 6 18.041 14.209 16.000 1.00 42.54 O HETATM 2122 O HOH 7 11.799 -15.468 28.598 1.00 24.41 O HETATM 2123 O HOH 8 3.701 -5.716 16.161 1.00 28.88 O HETATM 2124 O HOH 9 4.737 -12.271 11.242 1.00 31.94 O HETATM 2125 O HOH 10 29.493 8.633 19.265 1.00 29.48 O HETATM 2126 O HOH 11 24.416 0.545 3.207 1.00 23.00 O HETATM 2127 O HOH 12 20.434 -17.829 17.249 1.00 30.43 O HETATM 2128 O HOH 13 12.471 6.120 14.331 1.00 21.19 O HETATM 2129 O HOH 14 18.635 -2.527 3.710 1.00 30.54 O HETATM 2130 O HOH 15 -6.718 3.169 20.456 1.00 29.66 O HETATM 2131 O HOH 16 10.461 -7.675 27.577 1.00 28.38 O HETATM 2132 O HOH 17 32.640 -6.515 18.917 1.00 30.90 O HETATM 2133 O HOH 18 24.288 -7.988 -2.146 1.00 41.84 O HETATM 2134 O HOH 19 25.143 4.592 12.303 1.00 19.20 O HETATM 2135 O HOH 20 21.275 -11.447 18.569 1.00 25.39 O HETATM 2136 O HOH 21 31.187 -4.409 14.137 1.00 28.71 O HETATM 2137 O HOH 22 19.013 5.388 3.299 1.00 29.58 O HETATM 2138 O HOH 23 25.265 -14.722 14.535 1.00 25.77 O HETATM 2139 O HOH 24 -1.406 6.092 22.520 1.00 30.33 O HETATM 2140 O HOH 25 0.000 -23.003 8.533 1.00 34.67 O HETATM 2141 O HOH 26 19.532 -1.213 30.613 1.00 40.42 O HETATM 2142 O HOH 27 13.191 -19.850 21.982 1.00 22.72 O HETATM 2143 O HOH 28 4.158 -16.163 10.799 1.00 35.81 O HETATM 2144 O HOH 29 17.959 -9.217 28.348 1.00 32.89 O HETATM 2145 O HOH 30 18.837 -6.802 -6.889 1.00 33.81 O HETATM 2146 O HOH 31 -0.381 0.348 26.575 1.00 17.85 O HETATM 2147 O HOH 32 13.732 4.479 29.118 1.00 28.38 O HETATM 2148 O HOH 33 3.093 -2.709 21.238 1.00 19.45 O HETATM 2149 O HOH 34 13.341 -26.964 5.111 1.00 37.56 O HETATM 2150 O HOH 35 5.780 11.959 18.441 1.00 23.31 O HETATM 2151 O HOH 36 2.676 -3.134 15.674 1.00 28.21 O HETATM 2152 O HOH 37 2.734 -17.770 11.595 1.00 34.33 O HETATM 2153 O HOH 38 10.226 5.703 13.433 1.00 21.31 O HETATM 2154 O HOH 39 -2.529 -10.320 8.434 1.00 34.44 O HETATM 2155 O HOH 40 22.226 -12.178 4.573 1.00 35.05 O HETATM 2156 O HOH 41 8.914 -8.503 -7.127 1.00 29.78 O HETATM 2157 O HOH 42 21.075 -15.300 23.379 1.00 25.73 O HETATM 2158 O HOH 43 9.008 -27.513 8.351 1.00 38.24 O HETATM 2159 O HOH 44 25.627 10.966 14.659 1.00 19.84 O HETATM 2160 O HOH 45 8.539 -6.026 16.954 1.00 22.36 O HETATM 2161 O HOH 46 10.080 -30.834 9.926 1.00 40.99 O HETATM 2162 O HOH 47 6.529 13.404 10.720 1.00 43.23 O HETATM 2163 O HOH 48 22.251 9.650 31.454 1.00 31.37 O HETATM 2164 O HOH 49 13.679 3.458 -2.914 1.00 36.79 O HETATM 2165 O HOH 50 16.717 -7.582 16.618 1.00 32.87 O HETATM 2166 O HOH 51 5.126 -27.734 7.944 1.00 39.00 O HETATM 2167 O HOH 52 21.183 2.687 5.389 1.00 24.06 O HETATM 2168 O HOH 53 5.521 4.464 29.697 1.00 25.62 O HETATM 2169 O HOH 54 18.149 -4.722 29.718 1.00 29.46 O HETATM 2170 O HOH 55 3.842 -11.542 19.879 1.00 35.90 O HETATM 2171 O HOH 56 17.701 -12.257 29.677 1.00 32.91 O HETATM 2172 O HOH 57 11.286 1.259 14.190 1.00 23.95 O HETATM 2173 O HOH 58 20.925 10.328 13.198 1.00 29.51 O HETATM 2174 O HOH 59 21.443 -7.113 -3.839 1.00 36.52 O HETATM 2175 O HOH 60 5.337 -11.385 16.651 1.00 32.27 O HETATM 2176 O HOH 61 1.058 2.665 34.390 1.00 31.47 O HETATM 2177 O HOH 62 12.023 -1.453 15.082 1.00 33.32 O HETATM 2178 O HOH 63 7.030 -15.673 -0.160 1.00 34.65 O HETATM 2179 O HOH 64 12.245 2.855 30.125 1.00 29.32 O HETATM 2180 O HOH 65 22.107 -18.816 5.712 1.00 28.77 O HETATM 2181 O HOH 66 16.305 5.500 12.330 1.00 27.63 O HETATM 2182 O HOH 67 16.236 4.855 14.631 1.00 25.72 O HETATM 2183 O HOH 68 3.835 -5.916 24.776 1.00 22.21 O HETATM 2184 O HOH 69 23.506 14.438 21.646 1.00 39.15 O HETATM 2185 O HOH 70 19.307 11.963 13.703 1.00 35.59 O HETATM 2186 O HOH 71 31.071 0.601 14.471 1.00 39.60 O HETATM 2187 O HOH 72 -6.824 1.086 28.144 1.00 28.69 O HETATM 2188 O HOH 73 4.406 2.723 32.447 1.00 35.13 O HETATM 2189 O HOH 74 23.701 2.663 4.941 1.00 30.83 O HETATM 2190 O HOH 75 9.924 -27.612 5.627 1.00 39.17 O HETATM 2191 O HOH 76 -1.696 -9.184 18.163 1.00 39.93 O HETATM 2192 O HOH 77 19.880 -6.479 29.960 1.00 37.89 O HETATM 2193 O HOH 78 10.468 6.891 10.713 1.00 31.11 O HETATM 2194 O HOH 79 20.305 15.456 14.969 1.00 34.07 O HETATM 2195 N1 HJD A 80 6.918 -0.961 12.795 1.00 -0.33 N HETATM 2196 C2 HJD A 80 6.735 -1.776 13.884 1.00 -0.01 C HETATM 2197 C4 HJD A 80 7.873 -2.304 14.691 1.00 -0.01 C HETATM 2198 C5 HJD A 80 8.382 -3.620 14.135 1.00 0.04 C HETATM 2199 N3 HJD A 80 9.689 -3.990 14.648 1.00 -0.29 N HETATM 2200 C6 HJD A 80 10.383 -5.020 14.158 1.00 0.18 C HETATM 2201 C7 HJD A 80 11.812 -5.173 14.630 1.00 0.08 C HETATM 2202 C8 HJD A 80 12.057 -6.491 15.337 1.00 -0.02 C HETATM 2203 N4 HJD A 80 13.409 -6.593 15.878 1.00 0.22 N HETATM 2204 H4 HJD A 80 13.521 -7.484 16.336 1.00 0.20 H HETATM 2205 H5 HJD A 80 13.562 -5.851 16.543 1.00 0.20 H HETATM 2206 H6 HJD A 80 14.078 -6.514 15.128 1.00 0.20 H HETATM 2207 H13 HJD A 80 11.338 -6.586 16.164 1.00 0.08 H HETATM 2208 H14 HJD A 80 11.902 -7.310 14.620 1.00 0.08 H HETATM 2209 H11 HJD A 80 12.043 -4.353 15.325 1.00 0.06 H HETATM 2210 H12 HJD A 80 12.479 -5.112 13.758 1.00 0.06 H HETATM 2211 O1 HJD A 80 9.900 -5.797 13.337 1.00 -0.40 O HETATM 2212 H1 HJD A 80 10.083 -3.454 15.395 1.00 0.19 H HETATM 2213 H7 HJD A 80 7.666 -4.412 14.399 1.00 0.05 H HETATM 2214 H8 HJD A 80 8.447 -3.535 13.040 1.00 0.05 H HETATM 2215 H2 HJD A 80 7.536 -2.459 15.726 1.00 0.04 H HETATM 2216 H3 HJD A 80 8.692 -1.570 14.678 1.00 0.04 H HETATM 2217 C1 HJD A 80 5.391 -1.956 13.984 1.00 0.03 C HETATM 2218 N2 HJD A 80 4.758 -1.256 12.981 1.00 -0.28 N HETATM 2219 C3 HJD A 80 5.714 -0.673 12.293 1.00 0.09 C HETATM 2220 H10 HJD A 80 5.546 -0.037 11.425 1.00 0.12 H HETATM 2221 H15 HJD A 80 3.744 -1.201 12.806 1.00 0.24 H HETATM 2222 H9 HJD A 80 4.892 -2.560 14.740 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 2195 2196 2219 CONECT 2196 2195 2197 2217 CONECT 2197 2196 2198 2215 2216 CONECT 2198 2197 2199 2213 2214 CONECT 2199 2198 2200 2212 CONECT 2200 2199 2201 2211 CONECT 2201 2200 2202 2209 2210 CONECT 2202 2201 2203 2207 2208 CONECT 2203 2202 2204 2205 2206 CONECT 2204 2203 CONECT 2205 2203 CONECT 2206 2203 CONECT 2207 2202 CONECT 2208 2202 CONECT 2209 2201 CONECT 2210 2201 CONECT 2211 2200 CONECT 2212 2199 CONECT 2213 2198 CONECT 2214 2198 CONECT 2215 2197 CONECT 2216 2197 CONECT 2217 2196 2218 2222 CONECT 2218 2217 2219 2221 CONECT 2219 2195 2218 2220 CONECT 2220 2219 CONECT 2221 2218 CONECT 2222 2217 MASTER 0 0 0 0 0 0 0 0 2221 1 32 17 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6dyr
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%
6dyn
RCSB PDB
PDBbind
223aa, >6DYN_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6dyr
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Ebony
Ligand Name
HJD
EC.Number
E.C.-.-.-.-
Resolution
2.45(Å)
Affinity (Kd/Ki/IC50)
Kd=218.6uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Proc. Natl. Acad. Sci. U.S.A. Vol. 116: pp. 2913-2918
Ligand Properties
Formula
C
8
H
1
5
N
4
O
Molecular Weight
183.231
Exact Mass
183.125
No. of atoms
28
No. of bonds
28
Polar Surface Area
85.42
LOGP Value
-1.33 (
Computed with XLOGP3
)
-0.91 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 1
Canonical SMILES
C(NC(=O)CC[NH3+])Cc1c[nH]cn1
InChI String
InChI=1S/C8H14N4O/c9-3-1-8(13)11-4-2-7-5-10-6-12-7/h5-6H,1-4,9H2,(H,10,12)(H,11,13)/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
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓