Browse entries in the PDBbind-CN Database
HEADER 3UGC_COMPLEX COMPND 3UGC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 157 GLN PHE GLU GLU ARG HIS LEU LYS PHE LEU GLN GLN LEU SEQRES 2 A 157 GLY LYS GLY ASN PHE GLY SER VAL GLU MET CYS ARG TYR SEQRES 3 A 157 ASP PRO LEU GLN ASP ASN THR GLY GLU VAL VAL ALA VAL SEQRES 4 A 157 LYS LYS LEU GLN HIS SER THR GLU GLU HIS LEU ARG ASP SEQRES 5 A 157 PHE GLU ARG GLU ILE GLU ILE LEU LYS SER LEU GLN HIS SEQRES 6 A 157 ASP ASN ILE VAL LYS TYR LYS GLY VAL CYS TYR SER ALA SEQRES 7 A 157 GLY ARG ARG ASN LEU LYS LEU ILE MET GLU TYR LEU PRO SEQRES 8 A 157 TYR GLY SER LEU ARG ASP TYR LEU GLN LYS HIS LYS GLU SEQRES 9 A 157 ARG ILE ASP HIS ILE LYS LEU LEU GLN TYR THR SER GLN SEQRES 10 A 157 ILE CYS LYS GLY MET GLU TYR LEU GLY THR LYS ARG TYR SEQRES 11 A 157 ILE HIS ARG ASP LEU ALA THR ARG ASN ILE LEU VAL GLU SEQRES 12 A 157 ASN GLU ASN ARG VAL LYS ILE GLY ASP PHE GLY LEU THR SEQRES 13 A 157 LYS SEQRES 1 A 117 PRO GLY GLU SER PRO ILE PHE TRP TYR ALA PRO GLU SER SEQRES 2 A 117 LEU THR GLU SER LYS PHE SER VAL ALA SER ASP VAL TRP SEQRES 3 A 117 SER PHE GLY VAL VAL LEU TYR GLU LEU PHE THR TYR ILE SEQRES 4 A 117 GLU LYS SER LYS SER PRO PRO ALA GLU PHE MET ARG MET SEQRES 5 A 117 ILE GLY ASN ASP LYS GLN GLY GLN MET ILE VAL PHE HIS SEQRES 6 A 117 LEU ILE GLU LEU LEU LYS ASN ASN GLY ARG LEU PRO ARG SEQRES 7 A 117 PRO ASP GLY CYS PRO ASP GLU ILE TYR MET ILE MET THR SEQRES 8 A 117 GLU CYS TRP ASN ASN ASN VAL ASN GLN ARG PRO SER PHE SEQRES 9 A 117 ARG ASP LEU ALA LEU ARG VAL ASP GLN ILE ARG ASP ASN HET UNN A 550 71 ATOM 1 N GLN A 843 20.782 -35.286 -29.646 1.00 30.25 N ATOM 2 CA GLN A 843 19.805 -35.179 -28.556 1.00 29.34 C ATOM 3 C GLN A 843 18.639 -34.255 -28.934 1.00 30.74 C ATOM 4 O GLN A 843 17.487 -34.555 -28.612 1.00 32.92 O ATOM 5 CB GLN A 843 20.486 -34.731 -27.248 1.00 30.88 C ATOM 6 CG GLN A 843 21.217 -33.405 -27.395 1.00 44.50 C ATOM 7 CD GLN A 843 21.794 -32.774 -26.163 1.00 45.42 C ATOM 8 OE1 GLN A 843 22.536 -31.798 -26.279 1.00 26.25 O ATOM 9 NE2 GLN A 843 21.497 -33.306 -24.978 1.00 38.94 N ATOM 10 HE22 GLN A 843 20.866 -34.131 -24.922 1.00 0.00 H ATOM 11 HE21 GLN A 843 21.896 -32.896 -24.109 1.00 0.00 H ATOM 12 HN3 GLN A 843 21.165 -34.343 -29.861 1.00 0.00 H ATOM 13 HN2 GLN A 843 20.316 -35.673 -30.491 1.00 0.00 H ATOM 14 HN1 GLN A 843 21.556 -35.918 -29.356 1.00 0.00 H ATOM 15 N PHE A 844 18.930 -33.143 -29.626 1.00 23.31 N ATOM 16 CA PHE A 844 17.895 -32.220 -30.068 1.00 20.41 C ATOM 17 C PHE A 844 18.093 -31.948 -31.536 1.00 23.89 C ATOM 18 O PHE A 844 18.910 -31.103 -31.930 1.00 23.24 O ATOM 19 CB PHE A 844 17.858 -30.928 -29.244 1.00 20.39 C ATOM 20 CG PHE A 844 17.370 -31.113 -27.833 1.00 20.03 C ATOM 21 CD1 PHE A 844 18.267 -31.168 -26.773 1.00 20.84 C ATOM 22 CD2 PHE A 844 16.013 -31.263 -27.562 1.00 20.12 C ATOM 23 CE1 PHE A 844 17.813 -31.354 -25.470 1.00 20.73 C ATOM 24 CE2 PHE A 844 15.562 -31.431 -26.255 1.00 21.58 C ATOM 25 CZ PHE A 844 16.467 -31.495 -25.222 1.00 20.05 C ATOM 26 H PHE A 844 19.923 -32.935 -29.853 1.00 0.00 H ATOM 27 N GLU A 845 17.361 -32.710 -32.345 1.00 20.25 N ATOM 28 CA GLU A 845 17.390 -32.626 -33.797 1.00 20.34 C ATOM 29 C GLU A 845 16.561 -31.410 -34.219 1.00 21.40 C ATOM 30 O GLU A 845 15.389 -31.310 -33.822 1.00 20.72 O ATOM 31 CB GLU A 845 16.806 -33.927 -34.398 1.00 22.03 C ATOM 32 CG GLU A 845 17.548 -35.179 -33.956 1.00 32.98 C ATOM 33 CD GLU A 845 17.148 -36.453 -34.672 1.00 63.75 C ATOM 34 OE1 GLU A 845 15.997 -36.912 -34.481 1.00 63.87 O ATOM 35 OE2 GLU A 845 17.988 -36.997 -35.425 1.00 60.64 O ATOM 36 H GLU A 845 16.727 -33.411 -31.911 1.00 0.00 H ATOM 37 N GLU A 846 17.149 -30.488 -35.013 1.00 18.85 N ATOM 38 CA GLU A 846 16.424 -29.272 -35.461 1.00 19.04 C ATOM 39 C GLU A 846 15.088 -29.540 -36.123 1.00 23.33 C ATOM 40 O GLU A 846 14.149 -28.768 -35.916 1.00 22.01 O ATOM 41 CB GLU A 846 17.276 -28.312 -36.344 1.00 21.54 C ATOM 42 CG GLU A 846 17.522 -28.753 -37.780 1.00 34.10 C ATOM 43 CD GLU A 846 18.284 -27.792 -38.678 1.00 50.48 C ATOM 44 OE1 GLU A 846 17.867 -26.617 -38.818 1.00 40.07 O ATOM 45 OE2 GLU A 846 19.290 -28.233 -39.276 1.00 34.43 O ATOM 46 H GLU A 846 18.133 -30.634 -35.318 1.00 0.00 H ATOM 47 N ARG A 847 14.984 -30.639 -36.894 1.00 20.44 N ATOM 48 CA ARG A 847 13.746 -30.964 -37.586 1.00 20.73 C ATOM 49 C ARG A 847 12.578 -31.215 -36.635 1.00 22.97 C ATOM 50 O ARG A 847 11.434 -31.087 -37.067 1.00 23.51 O ATOM 51 CB ARG A 847 13.956 -32.162 -38.530 1.00 22.04 C ATOM 52 CG ARG A 847 14.252 -33.487 -37.839 1.00 26.68 C ATOM 53 CD ARG A 847 14.448 -34.570 -38.890 1.00 35.61 C ATOM 54 NE ARG A 847 14.768 -35.872 -38.308 1.00 44.78 N ATOM 55 CZ ARG A 847 15.996 -36.278 -38.001 1.00 63.45 C ATOM 56 NH1 ARG A 847 17.034 -35.471 -38.185 1.00 49.45 N ATOM 57 NH2 ARG A 847 16.194 -37.488 -37.499 1.00 56.55 N ATOM 58 HE ARG A 847 13.981 -36.526 -38.121 1.00 0.00 H ATOM 59 HH12 ARG A 847 17.993 -35.794 -37.943 1.00 0.00 H ATOM 60 HH11 ARG A 847 16.888 -34.516 -38.571 1.00 0.00 H ATOM 61 HH22 ARG A 847 17.157 -37.801 -37.260 1.00 0.00 H ATOM 62 HH21 ARG A 847 15.387 -38.125 -37.343 1.00 0.00 H ATOM 63 H ARG A 847 15.805 -31.268 -36.997 1.00 0.00 H ATOM 64 N HIS A 848 12.849 -31.579 -35.359 1.00 19.18 N ATOM 65 CA HIS A 848 11.781 -31.856 -34.400 1.00 19.68 C ATOM 66 C HIS A 848 11.558 -30.749 -33.384 1.00 19.29 C ATOM 67 O HIS A 848 10.718 -30.912 -32.503 1.00 18.75 O ATOM 68 CB HIS A 848 12.005 -33.192 -33.684 1.00 22.26 C ATOM 69 CG HIS A 848 12.117 -34.351 -34.619 1.00 27.19 C ATOM 70 ND1 HIS A 848 11.193 -34.553 -35.625 1.00 29.66 N ATOM 71 CD2 HIS A 848 13.032 -35.345 -34.654 1.00 30.52 C ATOM 72 CE1 HIS A 848 11.584 -35.650 -36.253 1.00 29.39 C ATOM 73 NE2 HIS A 848 12.680 -36.162 -35.702 1.00 30.17 N ATOM 74 H HIS A 848 13.840 -31.663 -35.054 1.00 0.00 H ATOM 75 N LEU A 849 12.271 -29.636 -33.531 1.00 15.75 N ATOM 76 CA LEU A 849 12.174 -28.484 -32.632 1.00 15.03 C ATOM 77 C LEU A 849 11.212 -27.476 -33.250 1.00 16.97 C ATOM 78 O LEU A 849 11.570 -26.812 -34.227 1.00 18.44 O ATOM 79 CB LEU A 849 13.577 -27.907 -32.424 1.00 15.53 C ATOM 80 CG LEU A 849 13.719 -26.888 -31.298 1.00 17.30 C ATOM 81 CD1 LEU A 849 13.364 -27.506 -29.906 1.00 16.88 C ATOM 82 CD2 LEU A 849 15.116 -26.293 -31.298 1.00 17.89 C ATOM 83 H LEU A 849 12.935 -29.581 -34.330 1.00 0.00 H ATOM 84 N LYS A 850 9.985 -27.393 -32.707 1.00 14.11 N ATOM 85 CA LYS A 850 8.914 -26.590 -33.311 1.00 14.56 C ATOM 86 C LYS A 850 8.634 -25.317 -32.561 1.00 14.97 C ATOM 87 O LYS A 850 8.372 -25.364 -31.358 1.00 15.01 O ATOM 88 CB LYS A 850 7.618 -27.421 -33.379 1.00 16.93 C ATOM 89 CG LYS A 850 7.773 -28.771 -34.105 1.00 30.39 C ATOM 90 CD LYS A 850 8.055 -28.607 -35.605 1.00 40.31 C ATOM 91 CE LYS A 850 8.379 -29.917 -36.288 1.00 53.51 C ATOM 92 NZ LYS A 850 7.183 -30.791 -36.430 1.00 64.79 N ATOM 93 HZ1 LYS A 850 6.798 -31.005 -35.488 1.00 0.00 H ATOM 94 HZ2 LYS A 850 6.462 -30.301 -36.998 1.00 0.00 H ATOM 95 HZ3 LYS A 850 7.456 -31.676 -36.903 1.00 0.00 H ATOM 96 H LYS A 850 9.788 -27.915 -31.830 1.00 0.00 H ATOM 97 N PHE A 851 8.616 -24.191 -33.270 1.00 13.13 N ATOM 98 CA PHE A 851 8.383 -22.901 -32.682 1.00 12.46 C ATOM 99 C PHE A 851 6.984 -22.805 -32.060 1.00 13.66 C ATOM 100 O PHE A 851 5.984 -23.200 -32.687 1.00 13.94 O ATOM 101 CB PHE A 851 8.508 -21.831 -33.775 1.00 13.52 C ATOM 102 CG PHE A 851 8.134 -20.448 -33.330 1.00 12.80 C ATOM 103 CD1 PHE A 851 9.029 -19.671 -32.608 1.00 13.34 C ATOM 104 CD2 PHE A 851 6.872 -19.922 -33.612 1.00 13.40 C ATOM 105 CE1 PHE A 851 8.697 -18.388 -32.208 1.00 13.08 C ATOM 106 CE2 PHE A 851 6.527 -18.640 -33.178 1.00 14.71 C ATOM 107 CZ PHE A 851 7.448 -17.871 -32.498 1.00 13.33 C ATOM 108 H PHE A 851 8.778 -24.247 -34.296 1.00 0.00 H ATOM 109 N LEU A 852 6.916 -22.216 -30.850 1.00 11.68 N ATOM 110 CA LEU A 852 5.655 -21.923 -30.162 1.00 10.79 C ATOM 111 C LEU A 852 5.445 -20.454 -29.941 1.00 11.37 C ATOM 112 O LEU A 852 4.309 -19.979 -30.085 1.00 11.98 O ATOM 113 CB LEU A 852 5.502 -22.689 -28.832 1.00 10.90 C ATOM 114 CG LEU A 852 5.448 -24.200 -28.942 1.00 12.80 C ATOM 115 CD1 LEU A 852 5.466 -24.824 -27.569 1.00 13.88 C ATOM 116 CD2 LEU A 852 4.195 -24.684 -29.720 1.00 17.42 C ATOM 117 H LEU A 852 7.806 -21.955 -30.379 1.00 0.00 H ATOM 118 N GLN A 853 6.468 -19.723 -29.473 1.00 10.39 N ATOM 119 CA GLN A 853 6.310 -18.321 -29.155 1.00 10.76 C ATOM 120 C GLN A 853 7.657 -17.633 -29.001 1.00 13.56 C ATOM 121 O GLN A 853 8.605 -18.255 -28.543 1.00 12.85 O ATOM 122 CB GLN A 853 5.475 -18.212 -27.844 1.00 13.45 C ATOM 123 CG GLN A 853 5.428 -16.899 -27.156 1.00 13.53 C ATOM 124 CD GLN A 853 4.387 -16.034 -27.770 1.00 16.70 C ATOM 125 OE1 GLN A 853 3.272 -16.517 -28.024 1.00 13.24 O ATOM 126 NE2 GLN A 853 4.712 -14.742 -27.972 1.00 14.08 N ATOM 127 HE22 GLN A 853 5.667 -14.403 -27.737 1.00 0.00 H ATOM 128 HE21 GLN A 853 4.008 -14.084 -28.363 1.00 0.00 H ATOM 129 H GLN A 853 7.395 -20.174 -29.336 1.00 0.00 H ATOM 130 N GLN A 854 7.729 -16.338 -29.313 1.00 13.92 N ATOM 131 CA GLN A 854 8.915 -15.553 -29.018 1.00 15.82 C ATOM 132 C GLN A 854 8.893 -15.208 -27.530 1.00 19.16 C ATOM 133 O GLN A 854 7.814 -14.882 -27.014 1.00 21.64 O ATOM 134 CB GLN A 854 8.880 -14.246 -29.803 1.00 18.62 C ATOM 135 CG GLN A 854 9.143 -14.444 -31.269 1.00 26.56 C ATOM 136 CD GLN A 854 9.339 -13.113 -31.960 1.00 53.76 C ATOM 137 OE1 GLN A 854 8.450 -12.605 -32.664 1.00 47.48 O ATOM 138 NE2 GLN A 854 10.497 -12.498 -31.742 1.00 48.92 N ATOM 139 HE22 GLN A 854 11.222 -12.949 -31.148 1.00 0.00 H ATOM 140 HE21 GLN A 854 10.678 -11.566 -32.166 1.00 0.00 H ATOM 141 H GLN A 854 6.919 -15.881 -29.777 1.00 0.00 H ATOM 142 N LEU A 855 10.049 -15.232 -26.847 1.00 15.72 N ATOM 143 CA LEU A 855 10.122 -14.925 -25.409 1.00 16.40 C ATOM 144 C LEU A 855 10.888 -13.660 -25.041 1.00 25.78 C ATOM 145 O LEU A 855 10.529 -12.997 -24.069 1.00 27.90 O ATOM 146 CB LEU A 855 10.696 -16.101 -24.624 1.00 15.26 C ATOM 147 CG LEU A 855 9.882 -17.393 -24.644 1.00 17.59 C ATOM 148 CD1 LEU A 855 10.607 -18.484 -23.961 1.00 16.20 C ATOM 149 CD2 LEU A 855 8.517 -17.190 -24.017 1.00 19.13 C ATOM 150 H LEU A 855 10.925 -15.476 -27.352 1.00 0.00 H ATOM 151 N GLY A 856 11.970 -13.384 -25.745 1.00 23.79 N ATOM 152 CA GLY A 856 12.784 -12.206 -25.482 1.00 24.01 C ATOM 153 C GLY A 856 13.844 -12.044 -26.539 1.00 28.35 C ATOM 154 O GLY A 856 14.231 -13.024 -27.170 1.00 25.23 O ATOM 155 H GLY A 856 12.250 -14.028 -26.512 1.00 0.00 H ATOM 156 N LYS A 857 14.271 -10.797 -26.781 1.00 26.28 N ATOM 157 CA LYS A 857 15.291 -10.478 -27.777 1.00 27.30 C ATOM 158 C LYS A 857 16.142 -9.297 -27.320 1.00 30.38 C ATOM 159 O LYS A 857 15.676 -8.413 -26.598 1.00 30.46 O ATOM 160 CB LYS A 857 14.644 -10.183 -29.145 1.00 29.75 C ATOM 161 H LYS A 857 13.855 -10.017 -26.232 1.00 0.00 H ATOM 162 N GLY A 858 17.394 -9.312 -27.728 1.00 25.94 N ATOM 163 CA GLY A 858 18.343 -8.247 -27.438 1.00 26.08 C ATOM 164 C GLY A 858 19.354 -8.210 -28.557 1.00 30.17 C ATOM 165 O GLY A 858 19.254 -9.006 -29.494 1.00 28.17 O ATOM 166 H GLY A 858 17.721 -10.126 -28.286 1.00 0.00 H ATOM 167 N ASN A 859 20.358 -7.329 -28.455 1.00 28.27 N ATOM 168 CA ASN A 859 21.393 -7.216 -29.485 1.00 28.11 C ATOM 169 C ASN A 859 22.281 -8.468 -29.594 1.00 29.17 C ATOM 170 O ASN A 859 22.767 -8.763 -30.686 1.00 29.31 O ATOM 171 CB ASN A 859 22.254 -5.952 -29.270 1.00 28.40 C ATOM 172 CG ASN A 859 23.373 -6.103 -28.256 1.00 47.96 C ATOM 173 OD1 ASN A 859 24.563 -6.054 -28.593 1.00 47.27 O ATOM 174 ND2 ASN A 859 23.024 -6.346 -27.004 1.00 35.72 N ATOM 175 HD22 ASN A 859 22.018 -6.383 -26.742 1.00 0.00 H ATOM 176 HD21 ASN A 859 23.755 -6.500 -26.281 1.00 0.00 H ATOM 177 H ASN A 859 20.404 -6.708 -27.622 1.00 0.00 H ATOM 178 N PHE A 860 22.456 -9.223 -28.484 1.00 23.93 N ATOM 179 CA PHE A 860 23.348 -10.384 -28.457 1.00 22.35 C ATOM 180 C PHE A 860 22.664 -11.710 -28.774 1.00 23.44 C ATOM 181 O PHE A 860 23.270 -12.574 -29.405 1.00 22.96 O ATOM 182 CB PHE A 860 24.023 -10.450 -27.076 1.00 24.49 C ATOM 183 CG PHE A 860 25.132 -11.454 -26.925 1.00 25.84 C ATOM 184 CD1 PHE A 860 24.875 -12.729 -26.434 1.00 28.07 C ATOM 185 CD2 PHE A 860 26.449 -11.109 -27.217 1.00 28.59 C ATOM 186 CE1 PHE A 860 25.911 -13.655 -26.270 1.00 29.56 C ATOM 187 CE2 PHE A 860 27.482 -12.036 -27.058 1.00 31.59 C ATOM 188 CZ PHE A 860 27.204 -13.309 -26.607 1.00 29.58 C ATOM 189 H PHE A 860 21.938 -8.969 -27.619 1.00 0.00 H ATOM 190 N GLY A 861 21.452 -11.883 -28.277 1.00 21.21 N ATOM 191 CA GLY A 861 20.744 -13.141 -28.453 1.00 21.37 C ATOM 192 C GLY A 861 19.245 -13.026 -28.379 1.00 22.01 C ATOM 193 O GLY A 861 18.702 -11.950 -28.124 1.00 21.72 O ATOM 194 H GLY A 861 20.998 -11.108 -27.752 1.00 0.00 H ATOM 195 N SER A 862 18.554 -14.141 -28.625 1.00 19.91 N ATOM 196 CA SER A 862 17.103 -14.172 -28.565 1.00 17.08 C ATOM 197 C SER A 862 16.652 -15.497 -27.963 1.00 17.69 C ATOM 198 O SER A 862 17.400 -16.474 -27.991 1.00 17.15 O ATOM 199 CB SER A 862 16.484 -13.972 -29.947 1.00 22.24 C ATOM 200 OG SER A 862 16.765 -15.077 -30.787 1.00 28.72 O ATOM 201 HG SER A 862 16.355 -14.927 -31.676 1.00 0.00 H ATOM 202 H SER A 862 19.069 -15.012 -28.866 1.00 0.00 H ATOM 203 N VAL A 863 15.469 -15.504 -27.367 1.00 14.55 N ATOM 204 CA VAL A 863 14.933 -16.711 -26.743 1.00 14.22 C ATOM 205 C VAL A 863 13.529 -16.974 -27.252 1.00 15.64 C ATOM 206 O VAL A 863 12.714 -16.047 -27.353 1.00 16.04 O ATOM 207 CB VAL A 863 14.997 -16.678 -25.175 1.00 17.66 C ATOM 208 CG1 VAL A 863 14.435 -17.976 -24.587 1.00 17.00 C ATOM 209 CG2 VAL A 863 16.426 -16.455 -24.677 1.00 17.96 C ATOM 210 H VAL A 863 14.908 -14.629 -27.343 1.00 0.00 H ATOM 211 N GLU A 864 13.230 -18.237 -27.536 1.00 13.48 N ATOM 212 CA GLU A 864 11.913 -18.657 -27.995 1.00 13.92 C ATOM 213 C GLU A 864 11.462 -19.878 -27.221 1.00 14.99 C ATOM 214 O GLU A 864 12.297 -20.640 -26.708 1.00 15.37 O ATOM 215 CB GLU A 864 11.945 -19.082 -29.469 1.00 17.10 C ATOM 216 CG GLU A 864 12.409 -18.073 -30.492 1.00 23.54 C ATOM 217 CD GLU A 864 12.560 -18.701 -31.873 1.00 23.99 C ATOM 218 OE1 GLU A 864 12.690 -19.947 -31.965 1.00 28.57 O ATOM 219 OE2 GLU A 864 12.615 -17.935 -32.859 1.00 37.67 O ATOM 220 H GLU A 864 13.970 -18.959 -27.425 1.00 0.00 H ATOM 221 N MET A 865 10.155 -20.077 -27.158 1.00 12.06 N ATOM 222 CA MET A 865 9.556 -21.284 -26.622 1.00 11.28 C ATOM 223 C MET A 865 9.350 -22.232 -27.797 1.00 12.78 C ATOM 224 O MET A 865 8.786 -21.817 -28.829 1.00 11.76 O ATOM 225 CB MET A 865 8.203 -20.992 -25.992 1.00 13.52 C ATOM 226 CG MET A 865 7.592 -22.196 -25.340 1.00 14.25 C ATOM 227 SD MET A 865 5.884 -21.864 -24.962 1.00 17.49 S ATOM 228 CE MET A 865 5.615 -23.071 -23.729 1.00 15.53 C ATOM 229 H MET A 865 9.525 -19.329 -27.511 1.00 0.00 H ATOM 230 N CYS A 866 9.765 -23.478 -27.637 1.00 11.23 N ATOM 231 CA CYS A 866 9.604 -24.500 -28.678 1.00 11.41 C ATOM 232 C CYS A 866 9.047 -25.761 -28.067 1.00 12.98 C ATOM 233 O CYS A 866 9.073 -25.949 -26.832 1.00 12.53 O ATOM 234 CB CYS A 866 10.936 -24.783 -29.371 1.00 11.65 C ATOM 235 SG CYS A 866 11.551 -23.418 -30.367 1.00 16.07 S ATOM 236 H CYS A 866 10.222 -23.743 -26.741 1.00 0.00 H ATOM 237 N ARG A 867 8.565 -26.668 -28.908 1.00 14.04 N ATOM 238 CA ARG A 867 8.125 -27.985 -28.467 1.00 14.23 C ATOM 239 C ARG A 867 9.062 -28.987 -29.139 1.00 16.28 C ATOM 240 O ARG A 867 9.351 -28.844 -30.328 1.00 15.75 O ATOM 241 CB ARG A 867 6.668 -28.240 -28.882 1.00 18.47 C ATOM 242 CG ARG A 867 6.004 -29.413 -28.166 1.00 25.44 C ATOM 243 CD ARG A 867 4.569 -29.586 -28.617 1.00 32.10 C ATOM 244 NE ARG A 867 4.513 -30.216 -29.939 1.00 46.74 N ATOM 245 CZ ARG A 867 4.179 -29.584 -31.061 1.00 61.52 C ATOM 246 NH1 ARG A 867 3.805 -28.310 -31.030 1.00 44.82 N ATOM 247 NH2 ARG A 867 4.192 -30.228 -32.219 1.00 50.63 N ATOM 248 HE ARG A 867 4.751 -31.226 -30.005 1.00 0.00 H ATOM 249 HH12 ARG A 867 3.545 -27.823 -31.911 1.00 0.00 H ATOM 250 HH11 ARG A 867 3.772 -27.800 -30.124 1.00 0.00 H ATOM 251 HH22 ARG A 867 3.930 -29.730 -33.094 1.00 0.00 H ATOM 252 HH21 ARG A 867 4.464 -31.231 -32.253 1.00 0.00 H ATOM 253 H ARG A 867 8.499 -26.430 -29.918 1.00 0.00 H ATOM 254 N TYR A 868 9.619 -29.923 -28.381 1.00 15.59 N ATOM 255 CA TYR A 868 10.512 -30.907 -28.971 1.00 15.66 C ATOM 256 C TYR A 868 9.698 -32.163 -29.106 1.00 21.10 C ATOM 257 O TYR A 868 9.366 -32.809 -28.114 1.00 20.28 O ATOM 258 CB TYR A 868 11.785 -31.124 -28.141 1.00 17.45 C ATOM 259 CG TYR A 868 12.751 -31.996 -28.899 1.00 18.37 C ATOM 260 CD1 TYR A 868 13.066 -33.275 -28.450 1.00 21.58 C ATOM 261 CD2 TYR A 868 13.289 -31.578 -30.108 1.00 18.08 C ATOM 262 CE1 TYR A 868 13.928 -34.102 -29.173 1.00 22.87 C ATOM 263 CE2 TYR A 868 14.167 -32.383 -30.825 1.00 18.77 C ATOM 264 CZ TYR A 868 14.467 -33.650 -30.366 1.00 24.70 C ATOM 265 OH TYR A 868 15.322 -34.424 -31.114 1.00 27.25 O ATOM 266 HH TYR A 868 15.446 -35.300 -30.670 1.00 0.00 H ATOM 267 H TYR A 868 9.416 -29.953 -27.361 1.00 0.00 H ATOM 268 N ASP A 869 9.308 -32.425 -30.362 1.00 21.72 N ATOM 269 CA ASP A 869 8.367 -33.451 -30.805 1.00 23.98 C ATOM 270 C ASP A 869 9.026 -34.507 -31.722 1.00 29.49 C ATOM 271 O ASP A 869 8.739 -34.532 -32.926 1.00 29.40 O ATOM 272 CB ASP A 869 7.221 -32.720 -31.543 1.00 26.49 C ATOM 273 CG ASP A 869 5.998 -33.549 -31.901 1.00 36.64 C ATOM 274 OD1 ASP A 869 5.221 -33.102 -32.765 1.00 35.65 O ATOM 275 OD2 ASP A 869 5.793 -34.614 -31.272 1.00 41.38 O ATOM 276 H ASP A 869 9.723 -31.829 -31.106 1.00 0.00 H ATOM 277 N PRO A 870 9.905 -35.395 -31.201 1.00 27.26 N ATOM 278 CA PRO A 870 10.527 -36.383 -32.103 1.00 28.09 C ATOM 279 C PRO A 870 9.557 -37.442 -32.619 1.00 36.26 C ATOM 280 O PRO A 870 9.710 -37.895 -33.753 1.00 34.99 O ATOM 281 CB PRO A 870 11.676 -36.959 -31.281 1.00 29.56 C ATOM 282 CG PRO A 870 11.297 -36.741 -29.866 1.00 33.36 C ATOM 283 CD PRO A 870 10.394 -35.540 -29.812 1.00 28.25 C ATOM 284 N LEU A 871 8.520 -37.773 -31.827 1.00 36.45 N ATOM 285 CA LEU A 871 7.496 -38.755 -32.202 1.00 38.86 C ATOM 286 C LEU A 871 6.501 -38.215 -33.259 1.00 47.03 C ATOM 287 O LEU A 871 5.593 -38.944 -33.668 1.00 47.88 O ATOM 288 CB LEU A 871 6.782 -39.305 -30.949 1.00 39.59 C ATOM 289 CG LEU A 871 7.381 -40.569 -30.308 1.00 45.29 C ATOM 290 CD1 LEU A 871 8.651 -40.268 -29.519 1.00 45.76 C ATOM 291 CD2 LEU A 871 6.383 -41.223 -29.374 1.00 49.43 C ATOM 292 H LEU A 871 8.440 -37.308 -30.900 1.00 0.00 H ATOM 293 N GLN A 872 6.699 -36.945 -33.714 1.00 45.04 N ATOM 294 CA GLN A 872 5.947 -36.209 -34.749 1.00 45.61 C ATOM 295 C GLN A 872 4.409 -36.242 -34.637 1.00 50.98 C ATOM 296 O GLN A 872 3.712 -36.036 -35.637 1.00 51.64 O ATOM 297 CB GLN A 872 6.422 -36.615 -36.159 1.00 47.03 C ATOM 298 H GLN A 872 7.485 -36.426 -33.273 1.00 0.00 H ATOM 299 N ASP A 873 3.888 -36.454 -33.416 1.00 46.95 N ATOM 300 CA ASP A 873 2.455 -36.580 -33.139 1.00 46.21 C ATOM 301 C ASP A 873 1.826 -35.371 -32.410 1.00 48.32 C ATOM 302 O ASP A 873 0.819 -35.537 -31.711 1.00 47.56 O ATOM 303 CB ASP A 873 2.199 -37.894 -32.369 1.00 48.15 C ATOM 304 CG ASP A 873 2.894 -37.991 -31.020 1.00 58.79 C ATOM 305 OD1 ASP A 873 3.909 -37.287 -30.819 1.00 60.03 O ATOM 306 OD2 ASP A 873 2.444 -38.798 -30.179 1.00 64.13 O ATOM 307 H ASP A 873 4.546 -36.534 -32.615 1.00 0.00 H ATOM 308 N ASN A 874 2.406 -34.160 -32.594 1.00 43.77 N ATOM 309 CA ASN A 874 1.953 -32.903 -31.981 1.00 42.50 C ATOM 310 C ASN A 874 1.989 -32.918 -30.434 1.00 42.30 C ATOM 311 O ASN A 874 1.134 -32.313 -29.775 1.00 40.97 O ATOM 312 CB ASN A 874 0.583 -32.453 -32.547 1.00 45.47 C ATOM 313 CG ASN A 874 0.361 -30.961 -32.563 1.00 71.56 C ATOM 314 OD1 ASN A 874 1.301 -30.156 -32.617 1.00 63.76 O ATOM 315 ND2 ASN A 874 -0.901 -30.559 -32.567 1.00 66.92 N ATOM 316 HD22 ASN A 874 -1.670 -31.258 -32.521 1.00 0.00 H ATOM 317 HD21 ASN A 874 -1.123 -29.544 -32.616 1.00 0.00 H ATOM 318 H ASN A 874 3.237 -34.117 -33.218 1.00 0.00 H ATOM 319 N THR A 875 2.983 -33.629 -29.862 1.00 36.33 N ATOM 320 CA THR A 875 3.211 -33.729 -28.414 1.00 35.32 C ATOM 321 C THR A 875 4.691 -33.403 -28.128 1.00 36.43 C ATOM 322 O THR A 875 5.348 -32.777 -28.962 1.00 36.79 O ATOM 323 CB THR A 875 2.780 -35.112 -27.856 1.00 43.88 C ATOM 324 OG1 THR A 875 3.593 -36.134 -28.428 1.00 42.86 O ATOM 325 CG2 THR A 875 1.289 -35.413 -28.059 1.00 42.87 C ATOM 326 HG1 THR A 875 3.485 -36.128 -29.412 1.00 0.00 H ATOM 327 H THR A 875 3.634 -34.142 -30.490 1.00 0.00 H ATOM 328 N GLY A 876 5.198 -33.824 -26.973 1.00 29.80 N ATOM 329 CA GLY A 876 6.591 -33.600 -26.608 1.00 27.52 C ATOM 330 C GLY A 876 6.790 -32.519 -25.570 1.00 27.50 C ATOM 331 O GLY A 876 5.858 -31.775 -25.237 1.00 27.72 O ATOM 332 H GLY A 876 4.579 -34.330 -26.308 1.00 0.00 H ATOM 333 N GLU A 877 8.009 -32.427 -25.047 1.00 20.75 N ATOM 334 CA GLU A 877 8.318 -31.449 -24.017 1.00 18.58 C ATOM 335 C GLU A 877 8.410 -30.034 -24.573 1.00 16.83 C ATOM 336 O GLU A 877 8.913 -29.827 -25.676 1.00 17.51 O ATOM 337 CB GLU A 877 9.614 -31.840 -23.270 1.00 20.64 C ATOM 338 CG GLU A 877 9.973 -30.978 -22.073 1.00 27.39 C ATOM 339 CD GLU A 877 10.696 -31.675 -20.937 1.00 45.52 C ATOM 340 OE1 GLU A 877 10.358 -31.391 -19.766 1.00 45.80 O ATOM 341 OE2 GLU A 877 11.601 -32.495 -21.210 1.00 34.08 O ATOM 342 H GLU A 877 8.757 -33.068 -25.382 1.00 0.00 H ATOM 343 N VAL A 878 7.975 -29.052 -23.767 1.00 13.48 N ATOM 344 CA VAL A 878 8.127 -27.647 -24.107 1.00 11.74 C ATOM 345 C VAL A 878 9.455 -27.188 -23.524 1.00 14.76 C ATOM 346 O VAL A 878 9.764 -27.536 -22.382 1.00 16.49 O ATOM 347 CB VAL A 878 6.924 -26.845 -23.549 1.00 14.21 C ATOM 348 CG1 VAL A 878 7.126 -25.354 -23.712 1.00 13.70 C ATOM 349 CG2 VAL A 878 5.612 -27.280 -24.196 1.00 14.25 C ATOM 350 H VAL A 878 7.514 -29.305 -22.870 1.00 0.00 H ATOM 351 N VAL A 879 10.224 -26.397 -24.263 1.00 11.18 N ATOM 352 CA VAL A 879 11.540 -25.924 -23.862 1.00 10.29 C ATOM 353 C VAL A 879 11.717 -24.474 -24.207 1.00 11.49 C ATOM 354 O VAL A 879 10.995 -23.935 -25.053 1.00 12.04 O ATOM 355 CB VAL A 879 12.649 -26.773 -24.565 1.00 12.47 C ATOM 356 CG1 VAL A 879 12.641 -28.220 -24.072 1.00 14.11 C ATOM 357 CG2 VAL A 879 12.525 -26.736 -26.097 1.00 12.84 C ATOM 358 H VAL A 879 9.861 -26.096 -25.190 1.00 0.00 H ATOM 359 N ALA A 880 12.724 -23.834 -23.606 1.00 10.21 N ATOM 360 CA ALA A 880 13.156 -22.494 -23.996 1.00 10.28 C ATOM 361 C ALA A 880 14.456 -22.663 -24.784 1.00 12.29 C ATOM 362 O ALA A 880 15.311 -23.504 -24.428 1.00 13.48 O ATOM 363 CB ALA A 880 13.384 -21.615 -22.771 1.00 10.44 C ATOM 364 H ALA A 880 13.222 -24.310 -22.827 1.00 0.00 H ATOM 365 N VAL A 881 14.584 -21.902 -25.876 1.00 10.93 N ATOM 366 CA VAL A 881 15.725 -22.010 -26.800 1.00 10.88 C ATOM 367 C VAL A 881 16.384 -20.672 -26.974 1.00 11.66 C ATOM 368 O VAL A 881 15.706 -19.712 -27.377 1.00 13.27 O ATOM 369 CB VAL A 881 15.173 -22.496 -28.170 1.00 13.14 C ATOM 370 CG1 VAL A 881 16.309 -22.612 -29.189 1.00 13.38 C ATOM 371 CG2 VAL A 881 14.447 -23.829 -28.027 1.00 13.25 C ATOM 372 H VAL A 881 13.843 -21.202 -26.082 1.00 0.00 H ATOM 373 N LYS A 882 17.698 -20.598 -26.708 1.00 11.04 N ATOM 374 CA LYS A 882 18.449 -19.362 -26.887 1.00 10.83 C ATOM 375 C LYS A 882 19.285 -19.502 -28.167 1.00 13.83 C ATOM 376 O LYS A 882 19.937 -20.518 -28.371 1.00 12.96 O ATOM 377 CB LYS A 882 19.367 -19.060 -25.669 1.00 11.27 C ATOM 378 CG LYS A 882 20.244 -17.823 -25.875 1.00 15.13 C ATOM 379 CD LYS A 882 21.051 -17.451 -24.614 1.00 15.11 C ATOM 380 CE LYS A 882 21.996 -16.293 -24.854 1.00 19.55 C ATOM 381 NZ LYS A 882 22.690 -15.954 -23.572 1.00 21.13 N ATOM 382 HZ1 LYS A 882 21.984 -15.688 -22.857 1.00 0.00 H ATOM 383 HZ2 LYS A 882 23.226 -16.781 -23.240 1.00 0.00 H ATOM 384 HZ3 LYS A 882 23.341 -15.159 -23.731 1.00 0.00 H ATOM 385 H LYS A 882 18.193 -21.446 -26.365 1.00 0.00 H ATOM 386 N LYS A 883 19.249 -18.436 -28.990 1.00 14.55 N ATOM 387 CA LYS A 883 19.999 -18.317 -30.250 1.00 15.89 C ATOM 388 C LYS A 883 20.968 -17.138 -30.145 1.00 17.95 C ATOM 389 O LYS A 883 20.663 -16.171 -29.453 1.00 18.85 O ATOM 390 CB LYS A 883 19.021 -17.991 -31.414 1.00 17.77 C ATOM 391 CG LYS A 883 17.941 -19.013 -31.733 1.00 28.23 C ATOM 392 CD LYS A 883 16.952 -18.446 -32.774 1.00 29.47 C ATOM 393 CE LYS A 883 15.997 -19.517 -33.259 1.00 41.79 C ATOM 394 NZ LYS A 883 14.970 -18.979 -34.197 1.00 44.00 N ATOM 395 HZ1 LYS A 883 14.413 -18.245 -33.715 1.00 0.00 H ATOM 396 HZ2 LYS A 883 15.442 -18.568 -35.028 1.00 0.00 H ATOM 397 HZ3 LYS A 883 14.341 -19.750 -34.500 1.00 0.00 H ATOM 398 H LYS A 883 18.645 -17.636 -28.713 1.00 0.00 H ATOM 399 N LEU A 884 22.117 -17.202 -30.862 1.00 17.07 N ATOM 400 CA LEU A 884 23.079 -16.097 -30.944 1.00 19.35 C ATOM 401 C LEU A 884 22.688 -15.275 -32.138 1.00 23.97 C ATOM 402 O LEU A 884 22.470 -15.846 -33.213 1.00 24.01 O ATOM 403 CB LEU A 884 24.474 -16.645 -31.223 1.00 20.67 C ATOM 404 CG LEU A 884 25.527 -16.670 -30.172 1.00 24.95 C ATOM 405 CD1 LEU A 884 26.861 -17.030 -30.809 1.00 22.09 C ATOM 406 CD2 LEU A 884 25.654 -15.325 -29.427 1.00 27.86 C ATOM 407 H LEU A 884 22.327 -18.079 -31.380 1.00 0.00 H ATOM 408 N GLN A 885 22.625 -13.949 -31.997 1.00 19.84 N ATOM 409 CA GLN A 885 22.256 -13.119 -33.141 1.00 19.99 C ATOM 410 C GLN A 885 23.357 -13.100 -34.171 1.00 22.01 C ATOM 411 O GLN A 885 23.067 -13.046 -35.367 1.00 22.50 O ATOM 412 CB GLN A 885 21.961 -11.671 -32.713 1.00 20.88 C ATOM 413 CG GLN A 885 20.695 -11.489 -31.861 1.00 39.45 C ATOM 414 CD GLN A 885 19.378 -11.562 -32.603 1.00 63.82 C ATOM 415 OE1 GLN A 885 19.299 -11.500 -33.839 1.00 61.04 O ATOM 416 NE2 GLN A 885 18.300 -11.664 -31.845 1.00 56.63 N ATOM 417 HE22 GLN A 885 18.395 -11.714 -30.811 1.00 0.00 H ATOM 418 HE21 GLN A 885 17.357 -11.694 -32.283 1.00 0.00 H ATOM 419 H GLN A 885 22.837 -13.510 -31.079 1.00 0.00 H ATOM 420 N HIS A 886 24.617 -13.102 -33.714 1.00 18.07 N ATOM 421 CA HIS A 886 25.772 -12.979 -34.600 1.00 16.76 C ATOM 422 C HIS A 886 26.891 -13.846 -34.072 1.00 19.53 C ATOM 423 O HIS A 886 27.538 -13.491 -33.074 1.00 18.50 O ATOM 424 CB HIS A 886 26.213 -11.498 -34.655 1.00 18.89 C ATOM 425 CG HIS A 886 27.218 -11.176 -35.724 1.00 21.99 C ATOM 426 ND1 HIS A 886 27.593 -9.863 -35.979 1.00 23.79 N ATOM 427 CD2 HIS A 886 27.831 -11.985 -36.624 1.00 22.68 C ATOM 428 CE1 HIS A 886 28.442 -9.924 -36.996 1.00 22.51 C ATOM 429 NE2 HIS A 886 28.630 -11.171 -37.410 1.00 22.71 N ATOM 430 H HIS A 886 24.778 -13.195 -32.691 1.00 0.00 H ATOM 431 N SER A 887 27.158 -14.961 -34.761 1.00 16.58 N ATOM 432 CA SER A 887 28.158 -15.948 -34.377 1.00 16.42 C ATOM 433 C SER A 887 29.561 -15.554 -34.795 1.00 19.85 C ATOM 434 O SER A 887 30.210 -16.262 -35.566 1.00 20.73 O ATOM 435 CB SER A 887 27.791 -17.325 -34.923 1.00 17.97 C ATOM 436 OG SER A 887 26.689 -17.859 -34.203 1.00 21.33 O ATOM 437 HG SER A 887 25.911 -17.254 -34.297 1.00 0.00 H ATOM 438 H SER A 887 26.614 -15.135 -35.630 1.00 0.00 H ATOM 439 N THR A 888 30.062 -14.443 -34.253 1.00 18.33 N ATOM 440 CA THR A 888 31.436 -14.000 -34.498 1.00 18.76 C ATOM 441 C THR A 888 32.345 -14.915 -33.669 1.00 20.95 C ATOM 442 O THR A 888 31.853 -15.635 -32.784 1.00 19.35 O ATOM 443 CB THR A 888 31.641 -12.540 -34.021 1.00 20.75 C ATOM 444 OG1 THR A 888 31.391 -12.441 -32.615 1.00 20.95 O ATOM 445 CG2 THR A 888 30.771 -11.557 -34.744 1.00 17.75 C ATOM 446 HG1 THR A 888 31.525 -11.505 -32.322 1.00 0.00 H ATOM 447 H THR A 888 29.454 -13.870 -33.633 1.00 0.00 H ATOM 448 N GLU A 889 33.654 -14.857 -33.888 1.00 20.20 N ATOM 449 CA GLU A 889 34.541 -15.689 -33.076 1.00 20.31 C ATOM 450 C GLU A 889 34.375 -15.382 -31.582 1.00 22.05 C ATOM 451 O GLU A 889 34.239 -16.318 -30.800 1.00 19.98 O ATOM 452 CB GLU A 889 35.997 -15.581 -33.538 1.00 22.45 C ATOM 453 CG GLU A 889 36.187 -16.318 -34.863 1.00 32.71 C ATOM 454 CD GLU A 889 37.604 -16.497 -35.364 1.00 48.87 C ATOM 455 OE1 GLU A 889 37.922 -15.962 -36.451 1.00 49.15 O ATOM 456 OE2 GLU A 889 38.376 -17.232 -34.712 1.00 40.06 O ATOM 457 H GLU A 889 34.041 -14.231 -34.623 1.00 0.00 H ATOM 458 N GLU A 890 34.282 -14.090 -31.197 1.00 20.32 N ATOM 459 CA GLU A 890 34.134 -13.726 -29.787 1.00 20.02 C ATOM 460 C GLU A 890 32.766 -14.118 -29.231 1.00 19.24 C ATOM 461 O GLU A 890 32.697 -14.649 -28.118 1.00 17.38 O ATOM 462 CB GLU A 890 34.387 -12.225 -29.569 1.00 22.47 C ATOM 463 CG GLU A 890 35.860 -11.861 -29.578 1.00 36.92 C ATOM 464 H GLU A 890 34.316 -13.340 -31.916 1.00 0.00 H ATOM 465 N HIS A 891 31.687 -13.881 -29.985 1.00 16.36 N ATOM 466 CA HIS A 891 30.346 -14.215 -29.472 1.00 16.25 C ATOM 467 C HIS A 891 30.143 -15.699 -29.326 1.00 18.21 C ATOM 468 O HIS A 891 29.556 -16.155 -28.344 1.00 17.39 O ATOM 469 CB HIS A 891 29.233 -13.613 -30.319 1.00 17.92 C ATOM 470 CG HIS A 891 29.130 -12.117 -30.237 1.00 22.51 C ATOM 471 ND1 HIS A 891 28.034 -11.447 -30.752 1.00 25.26 N ATOM 472 CD2 HIS A 891 29.994 -11.204 -29.723 1.00 25.51 C ATOM 473 CE1 HIS A 891 28.255 -10.162 -30.521 1.00 25.78 C ATOM 474 NE2 HIS A 891 29.428 -9.965 -29.916 1.00 25.82 N ATOM 475 H HIS A 891 31.794 -13.462 -30.931 1.00 0.00 H ATOM 476 N LEU A 892 30.639 -16.475 -30.304 1.00 15.53 N ATOM 477 CA LEU A 892 30.515 -17.917 -30.233 1.00 15.50 C ATOM 478 C LEU A 892 31.351 -18.469 -29.074 1.00 19.03 C ATOM 479 O LEU A 892 30.866 -19.345 -28.353 1.00 17.64 O ATOM 480 CB LEU A 892 30.863 -18.569 -31.586 1.00 15.49 C ATOM 481 CG LEU A 892 30.621 -20.064 -31.664 1.00 18.42 C ATOM 482 CD1 LEU A 892 29.140 -20.405 -31.432 1.00 19.28 C ATOM 483 CD2 LEU A 892 31.096 -20.602 -33.017 1.00 20.70 C ATOM 484 H LEU A 892 31.116 -16.037 -31.118 1.00 0.00 H ATOM 485 N ARG A 893 32.582 -17.948 -28.855 1.00 15.87 N ATOM 486 CA ARG A 893 33.382 -18.377 -27.706 1.00 17.19 C ATOM 487 C ARG A 893 32.604 -18.117 -26.399 1.00 18.24 C ATOM 488 O ARG A 893 32.573 -18.972 -25.516 1.00 15.91 O ATOM 489 CB ARG A 893 34.726 -17.633 -27.668 1.00 19.18 C ATOM 490 CG ARG A 893 35.735 -18.056 -28.753 1.00 33.30 C ATOM 491 CD ARG A 893 35.896 -19.554 -28.948 1.00 40.55 C ATOM 492 NE ARG A 893 36.893 -20.133 -28.049 1.00 46.98 N ATOM 493 CZ ARG A 893 36.765 -21.319 -27.467 1.00 57.43 C ATOM 494 NH1 ARG A 893 35.672 -22.047 -27.661 1.00 32.86 N ATOM 495 NH2 ARG A 893 37.721 -21.779 -26.668 1.00 46.60 N ATOM 496 HE ARG A 893 37.754 -19.583 -27.854 1.00 0.00 H ATOM 497 HH12 ARG A 893 35.577 -22.976 -27.202 1.00 0.00 H ATOM 498 HH11 ARG A 893 34.910 -21.689 -28.272 1.00 0.00 H ATOM 499 HH22 ARG A 893 37.617 -22.709 -26.214 1.00 0.00 H ATOM 500 HH21 ARG A 893 38.574 -21.209 -26.496 1.00 0.00 H ATOM 501 H ARG A 893 32.963 -17.236 -29.510 1.00 0.00 H ATOM 502 N ASP A 894 31.982 -16.930 -26.297 1.00 16.80 N ATOM 503 CA ASP A 894 31.190 -16.559 -25.127 1.00 16.97 C ATOM 504 C ASP A 894 29.995 -17.478 -24.957 1.00 15.88 C ATOM 505 O ASP A 894 29.727 -17.924 -23.854 1.00 15.93 O ATOM 506 CB ASP A 894 30.778 -15.091 -25.192 1.00 19.25 C ATOM 507 CG ASP A 894 31.925 -14.103 -25.003 1.00 32.85 C ATOM 508 OD1 ASP A 894 31.740 -12.919 -25.326 1.00 36.71 O ATOM 509 OD2 ASP A 894 32.998 -14.520 -24.515 1.00 39.99 O ATOM 510 H ASP A 894 32.068 -16.251 -27.080 1.00 0.00 H ATOM 511 N PHE A 895 29.313 -17.811 -26.053 1.00 13.64 N ATOM 512 CA PHE A 895 28.163 -18.740 -25.988 1.00 12.77 C ATOM 513 C PHE A 895 28.589 -20.148 -25.575 1.00 15.05 C ATOM 514 O PHE A 895 27.955 -20.767 -24.733 1.00 13.53 O ATOM 515 CB PHE A 895 27.444 -18.737 -27.328 1.00 14.21 C ATOM 516 CG PHE A 895 26.066 -19.346 -27.376 1.00 13.72 C ATOM 517 CD1 PHE A 895 25.166 -19.170 -26.327 1.00 17.24 C ATOM 518 CD2 PHE A 895 25.620 -19.983 -28.525 1.00 16.12 C ATOM 519 CE1 PHE A 895 23.866 -19.669 -26.412 1.00 18.79 C ATOM 520 CE2 PHE A 895 24.316 -20.476 -28.613 1.00 18.59 C ATOM 521 CZ PHE A 895 23.440 -20.302 -27.562 1.00 18.43 C ATOM 522 H PHE A 895 29.594 -17.410 -26.971 1.00 0.00 H ATOM 523 N GLU A 896 29.732 -20.623 -26.083 1.00 13.47 N ATOM 524 CA GLU A 896 30.248 -21.918 -25.673 1.00 13.57 C ATOM 525 C GLU A 896 30.643 -21.946 -24.191 1.00 15.95 C ATOM 526 O GLU A 896 30.421 -22.948 -23.525 1.00 15.38 O ATOM 527 CB GLU A 896 31.467 -22.264 -26.522 1.00 15.17 C ATOM 528 CG GLU A 896 31.109 -22.578 -27.968 1.00 17.72 C ATOM 529 CD GLU A 896 32.317 -22.908 -28.825 1.00 35.12 C ATOM 530 OE1 GLU A 896 33.091 -21.978 -29.135 1.00 27.92 O ATOM 531 OE2 GLU A 896 32.543 -24.107 -29.097 1.00 34.86 O ATOM 532 H GLU A 896 30.258 -20.058 -26.780 1.00 0.00 H ATOM 533 N ARG A 897 31.173 -20.830 -23.672 1.00 14.32 N ATOM 534 CA ARG A 897 31.522 -20.714 -22.258 1.00 14.69 C ATOM 535 C ARG A 897 30.228 -20.763 -21.419 1.00 14.51 C ATOM 536 O ARG A 897 30.189 -21.454 -20.401 1.00 14.72 O ATOM 537 CB ARG A 897 32.251 -19.398 -22.008 1.00 15.97 C ATOM 538 CG ARG A 897 32.568 -19.102 -20.534 1.00 28.33 C ATOM 539 CD ARG A 897 33.480 -20.110 -19.854 1.00 38.91 C ATOM 540 NE ARG A 897 33.688 -19.751 -18.452 1.00 41.22 N ATOM 541 CZ ARG A 897 33.967 -20.615 -17.483 1.00 53.62 C ATOM 542 NH1 ARG A 897 34.091 -21.910 -17.751 1.00 44.97 N ATOM 543 NH2 ARG A 897 34.121 -20.194 -16.237 1.00 36.55 N ATOM 544 HE ARG A 897 33.612 -18.746 -18.195 1.00 0.00 H ATOM 545 HH12 ARG A 897 34.310 -22.581 -16.987 1.00 0.00 H ATOM 546 HH11 ARG A 897 33.969 -22.253 -18.725 1.00 0.00 H ATOM 547 HH22 ARG A 897 34.339 -20.874 -15.481 1.00 0.00 H ATOM 548 HH21 ARG A 897 34.024 -19.183 -16.014 1.00 0.00 H ATOM 549 H ARG A 897 31.342 -20.017 -24.298 1.00 0.00 H ATOM 550 N GLU A 898 29.153 -20.118 -21.903 1.00 12.62 N ATOM 551 CA GLU A 898 27.880 -20.160 -21.206 1.00 12.40 C ATOM 552 C GLU A 898 27.359 -21.597 -21.155 1.00 14.04 C ATOM 553 O GLU A 898 26.905 -22.075 -20.111 1.00 13.88 O ATOM 554 CB GLU A 898 26.890 -19.281 -21.944 1.00 12.89 C ATOM 555 CG GLU A 898 25.474 -19.354 -21.386 1.00 13.25 C ATOM 556 CD GLU A 898 24.522 -18.304 -21.911 1.00 14.94 C ATOM 557 OE1 GLU A 898 24.703 -17.794 -23.043 1.00 15.12 O ATOM 558 OE2 GLU A 898 23.519 -18.059 -21.210 1.00 13.48 O ATOM 559 H GLU A 898 29.234 -19.581 -22.790 1.00 0.00 H ATOM 560 N ILE A 899 27.437 -22.318 -22.287 1.00 13.46 N ATOM 561 CA ILE A 899 26.958 -23.697 -22.298 1.00 13.28 C ATOM 562 C ILE A 899 27.763 -24.559 -21.322 1.00 13.87 C ATOM 563 O ILE A 899 27.199 -25.396 -20.605 1.00 14.72 O ATOM 564 CB ILE A 899 27.052 -24.222 -23.745 1.00 15.92 C ATOM 565 CG1 ILE A 899 25.986 -23.518 -24.592 1.00 15.30 C ATOM 566 CG2 ILE A 899 26.914 -25.768 -23.789 1.00 16.42 C ATOM 567 CD1 ILE A 899 26.196 -23.593 -26.141 1.00 17.89 C ATOM 568 H ILE A 899 27.836 -21.896 -23.150 1.00 0.00 H ATOM 569 N GLU A 900 29.098 -24.356 -21.289 1.00 12.69 N ATOM 570 CA GLU A 900 29.950 -25.120 -20.386 1.00 14.27 C ATOM 571 C GLU A 900 29.581 -24.823 -18.923 1.00 14.89 C ATOM 572 O GLU A 900 29.573 -25.728 -18.087 1.00 15.33 O ATOM 573 CB GLU A 900 31.426 -24.821 -20.680 1.00 15.91 C ATOM 574 CG GLU A 900 31.936 -25.580 -21.901 1.00 20.41 C ATOM 575 CD GLU A 900 31.497 -27.033 -22.056 1.00 35.64 C ATOM 576 OE1 GLU A 900 31.811 -27.855 -21.164 1.00 22.23 O ATOM 577 OE2 GLU A 900 30.812 -27.344 -23.058 1.00 28.33 O ATOM 578 H GLU A 900 29.524 -23.645 -21.917 1.00 0.00 H ATOM 579 N ILE A 901 29.325 -23.545 -18.612 1.00 12.99 N ATOM 580 CA ILE A 901 28.909 -23.194 -17.243 1.00 12.91 C ATOM 581 C ILE A 901 27.607 -23.928 -16.919 1.00 14.00 C ATOM 582 O ILE A 901 27.480 -24.559 -15.865 1.00 13.93 O ATOM 583 CB ILE A 901 28.722 -21.673 -17.132 1.00 13.97 C ATOM 584 CG1 ILE A 901 30.094 -20.948 -17.132 1.00 16.14 C ATOM 585 CG2 ILE A 901 27.914 -21.298 -15.847 1.00 14.61 C ATOM 586 CD1 ILE A 901 30.011 -19.425 -17.391 1.00 19.09 C ATOM 587 H ILE A 901 29.420 -22.803 -19.335 1.00 0.00 H ATOM 588 N LEU A 902 26.632 -23.874 -17.831 1.00 12.24 N ATOM 589 CA LEU A 902 25.345 -24.498 -17.570 1.00 12.60 C ATOM 590 C LEU A 902 25.386 -25.999 -17.436 1.00 13.90 C ATOM 591 O LEU A 902 24.674 -26.559 -16.603 1.00 13.21 O ATOM 592 CB LEU A 902 24.343 -24.069 -18.637 1.00 11.95 C ATOM 593 CG LEU A 902 23.923 -22.606 -18.534 1.00 12.35 C ATOM 594 CD1 LEU A 902 23.257 -22.139 -19.840 1.00 12.85 C ATOM 595 CD2 LEU A 902 23.005 -22.391 -17.288 1.00 14.03 C ATOM 596 H LEU A 902 26.795 -23.383 -18.733 1.00 0.00 H ATOM 597 N LYS A 903 26.265 -26.657 -18.209 1.00 14.68 N ATOM 598 CA LYS A 903 26.447 -28.101 -18.098 1.00 15.06 C ATOM 599 C LYS A 903 26.959 -28.496 -16.712 1.00 17.78 C ATOM 600 O LYS A 903 26.786 -29.645 -16.298 1.00 19.92 O ATOM 601 CB LYS A 903 27.476 -28.575 -19.144 1.00 16.78 C ATOM 602 CG LYS A 903 26.938 -28.652 -20.549 1.00 22.44 C ATOM 603 CD LYS A 903 28.037 -29.224 -21.458 1.00 29.18 C ATOM 604 CE LYS A 903 27.602 -29.398 -22.887 1.00 42.78 C ATOM 605 NZ LYS A 903 28.758 -29.683 -23.782 1.00 49.11 N ATOM 606 HZ1 LYS A 903 29.432 -28.892 -23.738 1.00 0.00 H ATOM 607 HZ2 LYS A 903 29.227 -30.558 -23.472 1.00 0.00 H ATOM 608 HZ3 LYS A 903 28.419 -29.797 -24.759 1.00 0.00 H ATOM 609 H LYS A 903 26.829 -26.126 -18.903 1.00 0.00 H ATOM 610 N SER A 904 27.578 -27.544 -15.990 1.00 13.68 N ATOM 611 CA SER A 904 28.135 -27.838 -14.675 1.00 14.82 C ATOM 612 C SER A 904 27.193 -27.553 -13.522 1.00 17.12 C ATOM 613 O SER A 904 27.519 -27.884 -12.384 1.00 18.46 O ATOM 614 CB SER A 904 29.461 -27.113 -14.468 1.00 18.10 C ATOM 615 OG SER A 904 29.298 -25.720 -14.267 1.00 18.97 O ATOM 616 HG SER A 904 28.855 -25.323 -15.059 1.00 0.00 H ATOM 617 H SER A 904 27.661 -26.582 -16.377 1.00 0.00 H ATOM 618 N LEU A 905 26.008 -26.966 -13.795 1.00 13.14 N ATOM 619 CA LEU A 905 25.109 -26.552 -12.724 1.00 13.11 C ATOM 620 C LEU A 905 23.849 -27.362 -12.629 1.00 15.11 C ATOM 621 O LEU A 905 23.086 -27.441 -13.599 1.00 16.10 O ATOM 622 CB LEU A 905 24.730 -25.061 -12.895 1.00 13.04 C ATOM 623 CG LEU A 905 25.897 -24.080 -12.962 1.00 14.17 C ATOM 624 CD1 LEU A 905 25.382 -22.685 -13.294 1.00 14.18 C ATOM 625 CD2 LEU A 905 26.672 -24.003 -11.649 1.00 15.83 C ATOM 626 H LEU A 905 25.732 -26.807 -14.785 1.00 0.00 H ATOM 627 N GLN A 906 23.589 -27.947 -11.461 1.00 11.60 N ATOM 628 CA GLN A 906 22.361 -28.685 -11.222 1.00 12.61 C ATOM 629 C GLN A 906 21.921 -28.346 -9.802 1.00 13.85 C ATOM 630 O GLN A 906 22.462 -28.886 -8.844 1.00 14.49 O ATOM 631 CB GLN A 906 22.545 -30.206 -11.375 1.00 15.72 C ATOM 632 CG GLN A 906 23.001 -30.670 -12.769 1.00 18.93 C ATOM 633 CD GLN A 906 24.508 -30.690 -12.925 1.00 28.52 C ATOM 634 OE1 GLN A 906 25.267 -31.053 -12.016 1.00 28.97 O ATOM 635 NE2 GLN A 906 24.992 -30.280 -14.087 1.00 26.49 N ATOM 636 HE22 GLN A 906 24.344 -29.978 -14.843 1.00 0.00 H ATOM 637 HE21 GLN A 906 26.020 -30.260 -14.244 1.00 0.00 H ATOM 638 H GLN A 906 24.288 -27.873 -10.695 1.00 0.00 H ATOM 639 N HIS A 907 20.913 -27.465 -9.668 1.00 11.62 N ATOM 640 CA HIS A 907 20.357 -27.084 -8.376 1.00 10.96 C ATOM 641 C HIS A 907 18.935 -26.657 -8.569 1.00 11.37 C ATOM 642 O HIS A 907 18.587 -26.083 -9.608 1.00 11.81 O ATOM 643 CB HIS A 907 21.200 -25.941 -7.769 1.00 10.36 C ATOM 644 CG HIS A 907 20.847 -25.543 -6.378 1.00 10.13 C ATOM 645 ND1 HIS A 907 19.827 -24.630 -6.112 1.00 10.35 N ATOM 646 CD2 HIS A 907 21.416 -25.914 -5.205 1.00 10.63 C ATOM 647 CE1 HIS A 907 19.815 -24.484 -4.794 1.00 10.11 C ATOM 648 NE2 HIS A 907 20.754 -25.229 -4.210 1.00 10.50 N ATOM 649 H HIS A 907 20.512 -27.036 -10.526 1.00 0.00 H ATOM 650 N ASP A 908 18.114 -26.891 -7.561 1.00 10.42 N ATOM 651 CA ASP A 908 16.697 -26.534 -7.647 1.00 11.45 C ATOM 652 C ASP A 908 16.419 -25.060 -7.908 1.00 11.20 C ATOM 653 O ASP A 908 15.364 -24.722 -8.458 1.00 11.54 O ATOM 654 CB ASP A 908 15.963 -26.943 -6.371 1.00 12.81 C ATOM 655 CG ASP A 908 15.713 -28.437 -6.216 1.00 18.12 C ATOM 656 OD1 ASP A 908 15.918 -29.178 -7.204 1.00 19.56 O ATOM 657 OD2 ASP A 908 15.276 -28.844 -5.128 1.00 23.42 O ATOM 658 H ASP A 908 18.479 -27.335 -6.694 1.00 0.00 H ATOM 659 N ASN A 909 17.347 -24.175 -7.497 1.00 9.89 N ATOM 660 CA ASN A 909 17.154 -22.740 -7.666 1.00 9.57 C ATOM 661 C ASN A 909 18.091 -22.140 -8.677 1.00 9.94 C ATOM 662 O ASN A 909 18.393 -20.947 -8.616 1.00 9.66 O ATOM 663 CB ASN A 909 17.223 -22.009 -6.316 1.00 9.36 C ATOM 664 CG ASN A 909 16.303 -22.652 -5.320 1.00 11.27 C ATOM 665 OD1 ASN A 909 16.759 -23.217 -4.305 1.00 12.08 O ATOM 666 ND2 ASN A 909 15.009 -22.640 -5.619 1.00 10.86 N ATOM 667 HD22 ASN A 909 14.678 -22.155 -6.477 1.00 0.00 H ATOM 668 HD21 ASN A 909 14.327 -23.116 -4.995 1.00 0.00 H ATOM 669 H ASN A 909 18.219 -24.522 -7.050 1.00 0.00 H ATOM 670 N ILE A 910 18.513 -22.956 -9.660 1.00 9.57 N ATOM 671 CA ILE A 910 19.298 -22.502 -10.814 1.00 10.05 C ATOM 672 C ILE A 910 18.583 -23.009 -12.062 1.00 11.11 C ATOM 673 O ILE A 910 18.126 -24.167 -12.091 1.00 11.35 O ATOM 674 CB ILE A 910 20.768 -22.990 -10.787 1.00 11.56 C ATOM 675 CG1 ILE A 910 21.466 -22.500 -9.491 1.00 12.59 C ATOM 676 CG2 ILE A 910 21.525 -22.585 -12.084 1.00 12.45 C ATOM 677 CD1 ILE A 910 21.912 -21.072 -9.451 1.00 19.73 C ATOM 678 H ILE A 910 18.269 -23.965 -9.599 1.00 0.00 H ATOM 679 N VAL A 911 18.512 -22.167 -13.097 1.00 9.99 N ATOM 680 CA VAL A 911 17.873 -22.591 -14.361 1.00 10.45 C ATOM 681 C VAL A 911 18.450 -23.912 -14.842 1.00 11.92 C ATOM 682 O VAL A 911 19.646 -24.167 -14.699 1.00 13.22 O ATOM 683 CB VAL A 911 17.998 -21.513 -15.447 1.00 12.83 C ATOM 684 CG1 VAL A 911 17.109 -20.332 -15.141 1.00 12.97 C ATOM 685 CG2 VAL A 911 19.450 -21.107 -15.695 1.00 12.74 C ATOM 686 H VAL A 911 18.908 -21.209 -13.013 1.00 0.00 H ATOM 687 N LYS A 912 17.581 -24.751 -15.418 1.00 11.04 N ATOM 688 CA LYS A 912 17.961 -26.095 -15.797 1.00 10.53 C ATOM 689 C LYS A 912 18.319 -26.235 -17.272 1.00 11.73 C ATOM 690 O LYS A 912 17.465 -26.085 -18.158 1.00 11.78 O ATOM 691 CB LYS A 912 16.823 -27.033 -15.415 1.00 12.58 C ATOM 692 CG LYS A 912 17.088 -28.497 -15.702 1.00 15.22 C ATOM 693 CD LYS A 912 15.865 -29.340 -15.314 1.00 22.93 C ATOM 694 CE LYS A 912 15.821 -29.675 -13.841 1.00 40.04 C ATOM 695 NZ LYS A 912 14.664 -30.548 -13.509 1.00 57.35 N ATOM 696 HZ1 LYS A 912 13.780 -30.061 -13.761 1.00 0.00 H ATOM 697 HZ2 LYS A 912 14.736 -31.436 -14.045 1.00 0.00 H ATOM 698 HZ3 LYS A 912 14.669 -30.755 -12.490 1.00 0.00 H ATOM 699 H LYS A 912 16.608 -24.429 -15.598 1.00 0.00 H ATOM 700 N TYR A 913 19.583 -26.555 -17.533 1.00 11.40 N ATOM 701 CA TYR A 913 20.108 -26.852 -18.854 1.00 11.59 C ATOM 702 C TYR A 913 19.544 -28.196 -19.321 1.00 13.22 C ATOM 703 O TYR A 913 19.522 -29.158 -18.553 1.00 12.80 O ATOM 704 CB TYR A 913 21.637 -26.969 -18.700 1.00 13.74 C ATOM 705 CG TYR A 913 22.334 -27.526 -19.912 1.00 13.70 C ATOM 706 CD1 TYR A 913 22.650 -26.708 -20.995 1.00 15.59 C ATOM 707 CD2 TYR A 913 22.708 -28.865 -19.971 1.00 15.74 C ATOM 708 CE1 TYR A 913 23.300 -27.213 -22.112 1.00 14.91 C ATOM 709 CE2 TYR A 913 23.390 -29.374 -21.075 1.00 15.97 C ATOM 710 CZ TYR A 913 23.680 -28.542 -22.140 1.00 17.19 C ATOM 711 OH TYR A 913 24.346 -29.037 -23.238 1.00 20.19 O ATOM 712 HH TYR A 913 25.229 -29.385 -22.958 1.00 0.00 H ATOM 713 H TYR A 913 20.245 -26.596 -16.732 1.00 0.00 H ATOM 714 N LYS A 914 19.151 -28.274 -20.601 1.00 11.49 N ATOM 715 CA LYS A 914 18.699 -29.527 -21.202 1.00 11.45 C ATOM 716 C LYS A 914 19.645 -30.013 -22.290 1.00 13.86 C ATOM 717 O LYS A 914 19.804 -31.226 -22.428 1.00 17.04 O ATOM 718 CB LYS A 914 17.287 -29.415 -21.747 1.00 12.17 C ATOM 719 CG LYS A 914 16.268 -29.244 -20.617 1.00 15.51 C ATOM 720 CD LYS A 914 14.835 -29.119 -21.121 1.00 19.47 C ATOM 721 CE LYS A 914 14.182 -30.419 -21.499 1.00 28.99 C ATOM 722 NZ LYS A 914 13.990 -31.320 -20.320 1.00 36.26 N ATOM 723 HZ1 LYS A 914 14.915 -31.534 -19.895 1.00 0.00 H ATOM 724 HZ2 LYS A 914 13.386 -30.847 -19.618 1.00 0.00 H ATOM 725 HZ3 LYS A 914 13.537 -32.203 -20.630 1.00 0.00 H ATOM 726 H LYS A 914 19.169 -27.414 -21.185 1.00 0.00 H ATOM 727 N GLY A 915 20.215 -29.125 -23.101 1.00 11.74 N ATOM 728 CA GLY A 915 21.101 -29.586 -24.168 1.00 13.65 C ATOM 729 C GLY A 915 21.362 -28.521 -25.192 1.00 14.78 C ATOM 730 O GLY A 915 21.108 -27.339 -24.949 1.00 12.52 O ATOM 731 H GLY A 915 20.031 -28.109 -22.976 1.00 0.00 H ATOM 732 N VAL A 916 21.873 -28.930 -26.371 1.00 13.34 N ATOM 733 CA VAL A 916 22.146 -27.994 -27.449 1.00 13.19 C ATOM 734 C VAL A 916 21.514 -28.558 -28.721 1.00 16.37 C ATOM 735 O VAL A 916 21.234 -29.764 -28.794 1.00 17.50 O ATOM 736 CB VAL A 916 23.667 -27.766 -27.649 1.00 16.35 C ATOM 737 CG1 VAL A 916 24.287 -27.059 -26.441 1.00 16.12 C ATOM 738 CG2 VAL A 916 24.415 -29.062 -27.978 1.00 18.70 C ATOM 739 H VAL A 916 22.077 -29.940 -26.512 1.00 0.00 H ATOM 740 N CYS A 917 21.189 -27.682 -29.644 1.00 13.86 N ATOM 741 CA CYS A 917 20.659 -28.072 -30.958 1.00 14.88 C ATOM 742 C CYS A 917 21.574 -27.452 -31.995 1.00 16.97 C ATOM 743 O CYS A 917 21.778 -26.227 -31.996 1.00 15.21 O ATOM 744 CB CYS A 917 19.216 -27.615 -31.156 1.00 16.65 C ATOM 745 SG CYS A 917 18.633 -27.800 -32.874 1.00 21.97 S ATOM 746 H CYS A 917 21.312 -26.670 -29.436 1.00 0.00 H ATOM 747 N TYR A 918 22.088 -28.282 -32.923 1.00 17.14 N ATOM 748 CA TYR A 918 22.938 -27.789 -34.013 1.00 20.48 C ATOM 749 C TYR A 918 22.097 -27.645 -35.300 1.00 26.42 C ATOM 750 O TYR A 918 21.963 -28.622 -36.039 1.00 28.90 O ATOM 751 CB TYR A 918 24.136 -28.736 -34.237 1.00 23.61 C ATOM 752 CG TYR A 918 24.999 -28.954 -33.012 1.00 27.55 C ATOM 753 CD1 TYR A 918 24.775 -30.028 -32.160 1.00 30.81 C ATOM 754 CD2 TYR A 918 26.048 -28.090 -32.709 1.00 30.05 C ATOM 755 CE1 TYR A 918 25.585 -30.254 -31.049 1.00 33.59 C ATOM 756 CE2 TYR A 918 26.872 -28.312 -31.605 1.00 30.81 C ATOM 757 CZ TYR A 918 26.622 -29.382 -30.765 1.00 40.84 C ATOM 758 OH TYR A 918 27.414 -29.596 -29.658 1.00 45.75 O ATOM 759 HH TYR A 918 27.094 -30.399 -29.175 1.00 0.00 H ATOM 760 H TYR A 918 21.877 -29.299 -32.866 1.00 0.00 H ATOM 761 N SER A 919 21.527 -26.446 -35.565 1.00 19.75 N ATOM 762 CA SER A 919 20.670 -26.165 -36.708 1.00 19.17 C ATOM 763 C SER A 919 21.476 -25.649 -37.914 1.00 19.40 C ATOM 764 O SER A 919 22.723 -25.615 -37.858 1.00 17.10 O ATOM 765 CB SER A 919 19.564 -25.189 -36.314 1.00 24.64 C ATOM 766 OG SER A 919 20.128 -24.070 -35.649 1.00 32.56 O ATOM 767 HG SER A 919 19.407 -23.440 -35.396 1.00 0.00 H ATOM 768 H SER A 919 21.715 -25.667 -34.902 1.00 0.00 H ATOM 769 N ALA A 920 20.762 -25.292 -38.996 1.00 20.75 N ATOM 770 CA ALA A 920 21.355 -24.839 -40.271 1.00 19.85 C ATOM 771 C ALA A 920 22.392 -25.858 -40.767 1.00 23.19 C ATOM 772 O ALA A 920 23.530 -25.500 -41.124 1.00 20.11 O ATOM 773 CB ALA A 920 21.976 -23.451 -40.120 1.00 20.54 C ATOM 774 H ALA A 920 19.725 -25.338 -38.931 1.00 0.00 H ATOM 775 N GLY A 921 22.017 -27.137 -40.721 1.00 23.05 N ATOM 776 CA GLY A 921 22.898 -28.230 -41.125 1.00 22.89 C ATOM 777 C GLY A 921 24.171 -28.305 -40.306 1.00 24.17 C ATOM 778 O GLY A 921 25.276 -28.469 -40.841 1.00 22.71 O ATOM 779 H GLY A 921 21.060 -27.365 -40.384 1.00 0.00 H ATOM 780 N ARG A 922 24.033 -28.102 -38.982 1.00 19.84 N ATOM 781 CA ARG A 922 25.123 -28.133 -38.026 1.00 17.73 C ATOM 782 C ARG A 922 26.126 -26.977 -38.127 1.00 18.22 C ATOM 783 O ARG A 922 27.286 -27.093 -37.744 1.00 18.26 O ATOM 784 CB ARG A 922 25.777 -29.516 -37.954 1.00 21.76 C ATOM 785 CG ARG A 922 24.735 -30.546 -37.552 1.00 27.48 C ATOM 786 CD ARG A 922 25.322 -31.672 -36.795 1.00 31.49 C ATOM 787 NE ARG A 922 24.308 -32.686 -36.539 1.00 24.88 N ATOM 788 CZ ARG A 922 24.575 -33.980 -36.470 1.00 35.37 C ATOM 789 NH1 ARG A 922 25.812 -34.423 -36.677 1.00 22.70 N ATOM 790 NH2 ARG A 922 23.606 -34.849 -36.203 1.00 29.10 N ATOM 791 HE ARG A 922 23.324 -32.377 -36.404 1.00 0.00 H ATOM 792 HH12 ARG A 922 26.016 -35.441 -36.621 1.00 0.00 H ATOM 793 HH11 ARG A 922 26.575 -33.751 -36.894 1.00 0.00 H ATOM 794 HH22 ARG A 922 23.819 -35.865 -36.149 1.00 0.00 H ATOM 795 HH21 ARG A 922 22.634 -34.513 -36.048 1.00 0.00 H ATOM 796 H ARG A 922 23.077 -27.909 -38.619 1.00 0.00 H ATOM 797 N ARG A 923 25.623 -25.827 -38.582 1.00 15.10 N ATOM 798 CA ARG A 923 26.446 -24.628 -38.714 1.00 13.64 C ATOM 799 C ARG A 923 25.922 -23.498 -37.894 1.00 15.15 C ATOM 800 O ARG A 923 26.296 -22.348 -38.099 1.00 14.50 O ATOM 801 CB ARG A 923 26.633 -24.252 -40.185 1.00 13.78 C ATOM 802 CG ARG A 923 27.696 -25.118 -40.875 1.00 17.54 C ATOM 803 CD ARG A 923 27.493 -25.063 -42.417 1.00 21.00 C ATOM 804 NE ARG A 923 26.066 -25.046 -42.780 1.00 19.68 N ATOM 805 CZ ARG A 923 25.436 -24.080 -43.455 1.00 20.73 C ATOM 806 NH1 ARG A 923 26.115 -23.050 -43.956 1.00 16.48 N ATOM 807 NH2 ARG A 923 24.127 -24.134 -43.624 1.00 7.55 N ATOM 808 HE ARG A 923 25.495 -25.863 -42.483 1.00 0.00 H ATOM 809 HH12 ARG A 923 25.615 -22.303 -44.480 1.00 0.00 H ATOM 810 HH11 ARG A 923 27.145 -22.992 -43.823 1.00 0.00 H ATOM 811 HH22 ARG A 923 23.639 -23.381 -44.150 1.00 0.00 H ATOM 812 HH21 ARG A 923 23.584 -24.930 -43.231 1.00 0.00 H ATOM 813 H ARG A 923 24.619 -25.784 -38.849 1.00 0.00 H ATOM 814 N ASN A 924 25.023 -23.810 -36.951 1.00 14.65 N ATOM 815 CA ASN A 924 24.494 -22.808 -36.033 1.00 15.21 C ATOM 816 C ASN A 924 24.298 -23.572 -34.735 1.00 20.33 C ATOM 817 O ASN A 924 24.228 -24.817 -34.752 1.00 24.37 O ATOM 818 CB ASN A 924 23.201 -22.207 -36.549 1.00 15.47 C ATOM 819 CG ASN A 924 22.854 -20.848 -35.955 1.00 17.07 C ATOM 820 OD1 ASN A 924 23.690 -20.173 -35.350 1.00 20.00 O ATOM 821 ND2 ASN A 924 21.612 -20.471 -36.086 1.00 20.68 N ATOM 822 HD22 ASN A 924 20.939 -21.070 -36.604 1.00 0.00 H ATOM 823 HD21 ASN A 924 21.295 -19.571 -35.672 1.00 0.00 H ATOM 824 H ASN A 924 24.694 -24.793 -36.872 1.00 0.00 H ATOM 825 N LEU A 925 24.385 -22.873 -33.619 1.00 14.19 N ATOM 826 CA LEU A 925 24.246 -23.489 -32.301 1.00 14.43 C ATOM 827 C LEU A 925 23.119 -22.824 -31.528 1.00 14.61 C ATOM 828 O LEU A 925 23.013 -21.597 -31.525 1.00 16.49 O ATOM 829 CB LEU A 925 25.564 -23.303 -31.546 1.00 16.44 C ATOM 830 CG LEU A 925 25.687 -23.849 -30.126 1.00 21.65 C ATOM 831 CD1 LEU A 925 25.430 -25.344 -30.079 1.00 23.28 C ATOM 832 CD2 LEU A 925 27.085 -23.558 -29.610 1.00 24.04 C ATOM 833 H LEU A 925 24.558 -21.849 -33.679 1.00 0.00 H ATOM 834 N LYS A 926 22.272 -23.635 -30.905 1.00 13.06 N ATOM 835 CA LYS A 926 21.174 -23.137 -30.062 1.00 12.98 C ATOM 836 C LYS A 926 21.213 -23.880 -28.732 1.00 15.45 C ATOM 837 O LYS A 926 21.569 -25.059 -28.638 1.00 13.88 O ATOM 838 CB LYS A 926 19.815 -23.297 -30.734 1.00 15.89 C ATOM 839 CG LYS A 926 19.727 -22.534 -32.063 1.00 19.80 C ATOM 840 CD LYS A 926 18.341 -22.554 -32.665 1.00 21.22 C ATOM 841 CE LYS A 926 17.859 -23.907 -33.147 1.00 33.24 C ATOM 842 NZ LYS A 926 16.626 -23.778 -33.983 1.00 32.55 N ATOM 843 HZ1 LYS A 926 15.871 -23.339 -33.419 1.00 0.00 H ATOM 844 HZ2 LYS A 926 16.831 -23.185 -34.812 1.00 0.00 H ATOM 845 HZ3 LYS A 926 16.321 -24.721 -34.297 1.00 0.00 H ATOM 846 H LYS A 926 22.389 -24.662 -31.017 1.00 0.00 H ATOM 847 N LEU A 927 20.870 -23.150 -27.677 1.00 11.70 N ATOM 848 CA LEU A 927 20.920 -23.702 -26.325 1.00 11.30 C ATOM 849 C LEU A 927 19.505 -24.028 -25.849 1.00 11.49 C ATOM 850 O LEU A 927 18.629 -23.185 -25.963 1.00 11.86 O ATOM 851 CB LEU A 927 21.582 -22.647 -25.435 1.00 11.59 C ATOM 852 CG LEU A 927 21.472 -22.809 -23.921 1.00 13.67 C ATOM 853 CD1 LEU A 927 22.102 -24.092 -23.436 1.00 12.96 C ATOM 854 CD2 LEU A 927 22.115 -21.615 -23.239 1.00 14.46 C ATOM 855 H LEU A 927 20.560 -22.167 -27.816 1.00 0.00 H ATOM 856 N ILE A 928 19.311 -25.242 -25.314 1.00 10.24 N ATOM 857 CA ILE A 928 18.003 -25.734 -24.884 1.00 9.91 C ATOM 858 C ILE A 928 17.938 -25.763 -23.367 1.00 10.09 C ATOM 859 O ILE A 928 18.750 -26.423 -22.716 1.00 10.65 O ATOM 860 CB ILE A 928 17.683 -27.125 -25.481 1.00 11.50 C ATOM 861 CG1 ILE A 928 18.027 -27.240 -27.003 1.00 13.03 C ATOM 862 CG2 ILE A 928 16.236 -27.548 -25.169 1.00 12.71 C ATOM 863 CD1 ILE A 928 17.324 -26.265 -27.921 1.00 15.71 C ATOM 864 H ILE A 928 20.134 -25.867 -25.199 1.00 0.00 H ATOM 865 N MET A 929 16.902 -25.114 -22.827 1.00 9.79 N ATOM 866 CA MET A 929 16.684 -25.039 -21.374 1.00 9.70 C ATOM 867 C MET A 929 15.280 -25.473 -21.025 1.00 10.30 C ATOM 868 O MET A 929 14.383 -25.477 -21.868 1.00 10.12 O ATOM 869 CB MET A 929 16.771 -23.558 -20.913 1.00 11.31 C ATOM 870 CG MET A 929 18.053 -22.841 -21.296 1.00 11.92 C ATOM 871 SD MET A 929 19.542 -23.469 -20.505 1.00 12.34 S ATOM 872 CE MET A 929 19.305 -22.921 -18.783 1.00 11.63 C ATOM 873 H MET A 929 16.223 -24.643 -23.459 1.00 0.00 H ATOM 874 N GLU A 930 15.054 -25.771 -19.740 1.00 9.66 N ATOM 875 CA GLU A 930 13.687 -25.979 -19.254 1.00 9.48 C ATOM 876 C GLU A 930 12.870 -24.679 -19.478 1.00 11.74 C ATOM 877 O GLU A 930 13.382 -23.548 -19.339 1.00 13.24 O ATOM 878 CB GLU A 930 13.759 -26.262 -17.747 1.00 11.00 C ATOM 879 CG GLU A 930 13.563 -25.028 -16.871 1.00 22.35 C ATOM 880 CD GLU A 930 14.271 -24.859 -15.542 1.00 38.82 C ATOM 881 OE1 GLU A 930 14.967 -23.830 -15.353 1.00 11.39 O ATOM 882 OE2 GLU A 930 14.031 -25.698 -14.647 1.00 38.79 O ATOM 883 H GLU A 930 15.854 -25.856 -19.081 1.00 0.00 H ATOM 884 N TYR A 931 11.586 -24.826 -19.778 1.00 10.48 N ATOM 885 CA TYR A 931 10.696 -23.688 -19.918 1.00 10.10 C ATOM 886 C TYR A 931 10.050 -23.390 -18.564 1.00 12.24 C ATOM 887 O TYR A 931 9.463 -24.264 -17.938 1.00 12.45 O ATOM 888 CB TYR A 931 9.619 -23.974 -20.983 1.00 11.11 C ATOM 889 CG TYR A 931 8.633 -22.835 -21.087 1.00 10.09 C ATOM 890 CD1 TYR A 931 8.977 -21.652 -21.726 1.00 11.92 C ATOM 891 CD2 TYR A 931 7.362 -22.930 -20.521 1.00 11.07 C ATOM 892 CE1 TYR A 931 8.100 -20.569 -21.769 1.00 10.24 C ATOM 893 CE2 TYR A 931 6.460 -21.859 -20.578 1.00 10.02 C ATOM 894 CZ TYR A 931 6.831 -20.681 -21.211 1.00 10.14 C ATOM 895 OH TYR A 931 6.008 -19.573 -21.262 1.00 11.64 O ATOM 896 HH TYR A 931 6.464 -18.847 -21.758 1.00 0.00 H ATOM 897 H TYR A 931 11.206 -25.784 -19.917 1.00 0.00 H ATOM 898 N LEU A 932 10.135 -22.125 -18.154 1.00 10.69 N ATOM 899 CA LEU A 932 9.540 -21.649 -16.897 1.00 11.80 C ATOM 900 C LEU A 932 8.409 -20.718 -17.211 1.00 12.61 C ATOM 901 O LEU A 932 8.641 -19.671 -17.789 1.00 12.10 O ATOM 902 CB LEU A 932 10.589 -20.993 -15.997 1.00 12.72 C ATOM 903 CG LEU A 932 11.736 -21.939 -15.668 1.00 16.21 C ATOM 904 CD1 LEU A 932 12.875 -21.188 -14.974 1.00 17.92 C ATOM 905 CD2 LEU A 932 11.268 -23.102 -14.805 1.00 18.79 C ATOM 906 H LEU A 932 10.646 -21.443 -18.751 1.00 0.00 H ATOM 907 N PRO A 933 7.163 -21.110 -16.886 1.00 12.34 N ATOM 908 CA PRO A 933 6.015 -20.343 -17.394 1.00 12.69 C ATOM 909 C PRO A 933 5.869 -18.889 -17.025 1.00 14.43 C ATOM 910 O PRO A 933 5.342 -18.101 -17.787 1.00 13.56 O ATOM 911 CB PRO A 933 4.804 -21.158 -16.930 1.00 14.52 C ATOM 912 CG PRO A 933 5.314 -22.537 -16.858 1.00 19.01 C ATOM 913 CD PRO A 933 6.735 -22.394 -16.307 1.00 14.55 C ATOM 914 N TYR A 934 6.352 -18.519 -15.820 1.00 13.29 N ATOM 915 CA TYR A 934 6.137 -17.166 -15.340 1.00 13.70 C ATOM 916 C TYR A 934 7.178 -16.176 -15.691 1.00 14.80 C ATOM 917 O TYR A 934 7.056 -15.013 -15.314 1.00 16.99 O ATOM 918 CB TYR A 934 5.792 -17.173 -13.856 1.00 15.05 C ATOM 919 CG TYR A 934 4.456 -17.816 -13.627 1.00 15.56 C ATOM 920 CD1 TYR A 934 3.277 -17.113 -13.862 1.00 17.20 C ATOM 921 CD2 TYR A 934 4.360 -19.147 -13.269 1.00 15.46 C ATOM 922 CE1 TYR A 934 2.039 -17.709 -13.690 1.00 16.34 C ATOM 923 CE2 TYR A 934 3.122 -19.766 -13.119 1.00 17.35 C ATOM 924 CZ TYR A 934 1.964 -19.034 -13.323 1.00 19.20 C ATOM 925 OH TYR A 934 0.726 -19.612 -13.166 1.00 22.74 O ATOM 926 HH TYR A 934 0.023 -18.940 -13.353 1.00 0.00 H ATOM 927 H TYR A 934 6.877 -19.202 -15.237 1.00 0.00 H ATOM 928 N GLY A 935 8.200 -16.604 -16.430 1.00 12.81 N ATOM 929 CA GLY A 935 9.201 -15.683 -16.913 1.00 12.70 C ATOM 930 C GLY A 935 10.024 -15.050 -15.807 1.00 12.02 C ATOM 931 O GLY A 935 10.270 -15.698 -14.785 1.00 11.09 O ATOM 932 H GLY A 935 8.278 -17.615 -16.662 1.00 0.00 H ATOM 933 N SER A 936 10.440 -13.794 -15.999 1.00 11.02 N ATOM 934 CA SER A 936 11.291 -13.176 -14.979 1.00 9.57 C ATOM 935 C SER A 936 10.516 -12.846 -13.722 1.00 11.24 C ATOM 936 O SER A 936 9.306 -12.540 -13.756 1.00 11.02 O ATOM 937 CB SER A 936 11.982 -11.920 -15.483 1.00 12.33 C ATOM 938 OG SER A 936 11.048 -10.858 -15.576 1.00 13.84 O ATOM 939 HG SER A 936 11.507 -10.045 -15.905 1.00 0.00 H ATOM 940 H SER A 936 10.166 -13.268 -16.853 1.00 0.00 H ATOM 941 N LEU A 937 11.242 -12.830 -12.602 1.00 9.60 N ATOM 942 CA LEU A 937 10.665 -12.457 -11.329 1.00 10.29 C ATOM 943 C LEU A 937 10.299 -10.965 -11.365 1.00 11.65 C ATOM 944 O LEU A 937 9.287 -10.608 -10.760 1.00 11.59 O ATOM 945 CB LEU A 937 11.712 -12.771 -10.254 1.00 9.92 C ATOM 946 CG LEU A 937 11.360 -12.415 -8.823 1.00 12.10 C ATOM 947 CD1 LEU A 937 10.033 -13.028 -8.387 1.00 11.91 C ATOM 948 CD2 LEU A 937 12.476 -12.881 -7.878 1.00 12.56 C ATOM 949 H LEU A 937 12.247 -13.092 -12.646 1.00 0.00 H ATOM 950 N ARG A 938 11.043 -10.130 -12.105 1.00 11.66 N ATOM 951 CA ARG A 938 10.670 -8.722 -12.244 1.00 11.96 C ATOM 952 C ARG A 938 9.262 -8.620 -12.848 1.00 15.10 C ATOM 953 O ARG A 938 8.444 -7.853 -12.351 1.00 16.58 O ATOM 954 CB ARG A 938 11.694 -8.011 -13.134 1.00 12.39 C ATOM 955 CG ARG A 938 11.504 -6.487 -13.233 1.00 17.70 C ATOM 956 CD ARG A 938 12.529 -5.808 -14.147 1.00 21.73 C ATOM 957 NE ARG A 938 12.409 -6.210 -15.560 1.00 34.98 N ATOM 958 CZ ARG A 938 13.215 -5.810 -16.546 1.00 43.14 C ATOM 959 NH1 ARG A 938 14.218 -4.979 -16.300 1.00 26.06 N ATOM 960 NH2 ARG A 938 13.025 -6.246 -17.784 1.00 34.25 N ATOM 961 HE ARG A 938 11.634 -6.857 -15.809 1.00 0.00 H ATOM 962 HH12 ARG A 938 14.841 -4.672 -17.074 1.00 0.00 H ATOM 963 HH11 ARG A 938 14.382 -4.634 -15.333 1.00 0.00 H ATOM 964 HH22 ARG A 938 13.656 -5.931 -18.549 1.00 0.00 H ATOM 965 HH21 ARG A 938 12.245 -6.903 -17.990 1.00 0.00 H ATOM 966 H ARG A 938 11.894 -10.487 -12.585 1.00 0.00 H ATOM 967 N ASP A 939 8.975 -9.409 -13.893 1.00 11.75 N ATOM 968 CA ASP A 939 7.657 -9.369 -14.556 1.00 13.48 C ATOM 969 C ASP A 939 6.607 -9.952 -13.650 1.00 15.21 C ATOM 970 O ASP A 939 5.502 -9.384 -13.529 1.00 15.76 O ATOM 971 CB ASP A 939 7.692 -10.203 -15.849 1.00 15.44 C ATOM 972 CG ASP A 939 8.341 -9.581 -17.063 1.00 26.37 C ATOM 973 OD1 ASP A 939 8.653 -8.376 -17.019 1.00 25.52 O ATOM 974 OD2 ASP A 939 8.458 -10.283 -18.090 1.00 27.61 O ATOM 975 H ASP A 939 9.700 -10.066 -14.246 1.00 0.00 H ATOM 976 N TYR A 940 6.917 -11.094 -13.003 1.00 12.10 N ATOM 977 CA TYR A 940 5.984 -11.799 -12.145 1.00 11.76 C ATOM 978 C TYR A 940 5.504 -10.917 -10.984 1.00 14.66 C ATOM 979 O TYR A 940 4.304 -10.928 -10.675 1.00 15.20 O ATOM 980 CB TYR A 940 6.653 -13.076 -11.606 1.00 12.59 C ATOM 981 CG TYR A 940 5.731 -13.940 -10.788 1.00 12.33 C ATOM 982 CD1 TYR A 940 4.758 -14.718 -11.392 1.00 13.78 C ATOM 983 CD2 TYR A 940 5.863 -14.015 -9.403 1.00 14.05 C ATOM 984 CE1 TYR A 940 3.896 -15.509 -10.640 1.00 14.72 C ATOM 985 CE2 TYR A 940 5.024 -14.820 -8.643 1.00 14.32 C ATOM 986 CZ TYR A 940 4.022 -15.547 -9.265 1.00 16.47 C ATOM 987 OH TYR A 940 3.198 -16.369 -8.525 1.00 18.30 O ATOM 988 HH TYR A 940 2.545 -16.808 -9.126 1.00 0.00 H ATOM 989 H TYR A 940 7.872 -11.488 -13.125 1.00 0.00 H ATOM 990 N LEU A 941 6.414 -10.158 -10.355 1.00 13.26 N ATOM 991 CA LEU A 941 6.076 -9.288 -9.226 1.00 14.81 C ATOM 992 C LEU A 941 5.090 -8.228 -9.671 1.00 20.98 C ATOM 993 O LEU A 941 4.173 -7.918 -8.923 1.00 21.02 O ATOM 994 CB LEU A 941 7.340 -8.637 -8.667 1.00 14.43 C ATOM 995 CG LEU A 941 8.279 -9.532 -7.855 1.00 17.49 C ATOM 996 CD1 LEU A 941 9.653 -8.923 -7.714 1.00 17.28 C ATOM 997 CD2 LEU A 941 7.739 -9.811 -6.476 1.00 20.38 C ATOM 998 H LEU A 941 7.401 -10.189 -10.683 1.00 0.00 H ATOM 999 N GLN A 942 5.234 -7.709 -10.899 1.00 17.16 N ATOM 1000 CA GLN A 942 4.309 -6.687 -11.416 1.00 18.23 C ATOM 1001 C GLN A 942 2.989 -7.264 -11.842 1.00 20.31 C ATOM 1002 O GLN A 942 1.959 -6.606 -11.665 1.00 21.99 O ATOM 1003 CB GLN A 942 4.894 -5.997 -12.643 1.00 21.01 C ATOM 1004 CG GLN A 942 6.195 -5.287 -12.406 1.00 34.82 C ATOM 1005 H GLN A 942 6.017 -8.036 -11.500 1.00 0.00 H ATOM 1006 N LYS A 943 3.005 -8.419 -12.503 1.00 15.94 N ATOM 1007 CA LYS A 943 1.828 -9.045 -13.101 1.00 15.52 C ATOM 1008 C LYS A 943 0.977 -9.857 -12.141 1.00 18.83 C ATOM 1009 O LYS A 943 -0.208 -10.113 -12.427 1.00 20.21 O ATOM 1010 CB LYS A 943 2.241 -9.972 -14.252 1.00 17.63 C ATOM 1011 CG LYS A 943 2.769 -9.254 -15.486 1.00 21.13 C ATOM 1012 CD LYS A 943 3.188 -10.289 -16.526 1.00 30.80 C ATOM 1013 CE LYS A 943 3.806 -9.670 -17.748 1.00 43.20 C ATOM 1014 NZ LYS A 943 4.102 -10.702 -18.777 1.00 44.18 N ATOM 1015 HZ1 LYS A 943 4.765 -11.401 -18.385 1.00 0.00 H ATOM 1016 HZ2 LYS A 943 3.219 -11.177 -19.054 1.00 0.00 H ATOM 1017 HZ3 LYS A 943 4.528 -10.247 -19.610 1.00 0.00 H ATOM 1018 H LYS A 943 3.917 -8.909 -12.600 1.00 0.00 H ATOM 1019 N HIS A 944 1.575 -10.321 -11.022 1.00 15.62 N ATOM 1020 CA HIS A 944 0.923 -11.244 -10.108 1.00 14.36 C ATOM 1021 C HIS A 944 0.925 -10.828 -8.653 1.00 16.78 C ATOM 1022 O HIS A 944 0.943 -11.695 -7.787 1.00 14.99 O ATOM 1023 CB HIS A 944 1.399 -12.696 -10.356 1.00 15.35 C ATOM 1024 CG HIS A 944 0.974 -13.215 -11.700 1.00 17.66 C ATOM 1025 ND1 HIS A 944 -0.352 -13.534 -11.951 1.00 20.05 N ATOM 1026 CD2 HIS A 944 1.687 -13.382 -12.847 1.00 17.89 C ATOM 1027 CE1 HIS A 944 -0.401 -13.919 -13.219 1.00 19.19 C ATOM 1028 NE2 HIS A 944 0.800 -13.845 -13.798 1.00 18.94 N ATOM 1029 H HIS A 944 2.542 -10.005 -10.806 1.00 0.00 H ATOM 1030 N LYS A 945 0.759 -9.527 -8.395 1.00 17.57 N ATOM 1031 CA LYS A 945 0.669 -8.964 -7.036 1.00 17.27 C ATOM 1032 C LYS A 945 -0.440 -9.656 -6.214 1.00 18.43 C ATOM 1033 O LYS A 945 -0.270 -9.808 -5.015 1.00 20.14 O ATOM 1034 CB LYS A 945 0.381 -7.461 -7.095 1.00 20.30 C ATOM 1035 CG LYS A 945 1.551 -6.644 -7.600 1.00 26.00 C ATOM 1036 CD LYS A 945 1.253 -5.158 -7.611 1.00 38.30 C ATOM 1037 CE LYS A 945 2.195 -4.459 -8.559 1.00 55.09 C ATOM 1038 NZ LYS A 945 1.731 -3.087 -8.887 1.00 69.30 N ATOM 1039 HZ1 LYS A 945 0.794 -3.137 -9.335 1.00 0.00 H ATOM 1040 HZ2 LYS A 945 1.669 -2.525 -8.014 1.00 0.00 H ATOM 1041 HZ3 LYS A 945 2.406 -2.641 -9.541 1.00 0.00 H ATOM 1042 H LYS A 945 0.689 -8.873 -9.201 1.00 0.00 H ATOM 1043 N GLU A 946 -1.491 -10.166 -6.863 1.00 16.32 N ATOM 1044 CA GLU A 946 -2.608 -10.852 -6.169 1.00 16.18 C ATOM 1045 C GLU A 946 -2.169 -12.098 -5.419 1.00 18.09 C ATOM 1046 O GLU A 946 -2.835 -12.526 -4.469 1.00 17.69 O ATOM 1047 CB GLU A 946 -3.747 -11.183 -7.159 1.00 17.70 C ATOM 1048 CG GLU A 946 -3.512 -12.371 -8.104 1.00 20.83 C ATOM 1049 CD GLU A 946 -2.601 -12.144 -9.295 1.00 29.04 C ATOM 1050 OE1 GLU A 946 -2.289 -10.968 -9.579 1.00 21.72 O ATOM 1051 OE2 GLU A 946 -2.267 -13.133 -9.988 1.00 28.13 O ATOM 1052 H GLU A 946 -1.527 -10.078 -7.899 1.00 0.00 H ATOM 1053 N ARG A 947 -1.031 -12.677 -5.847 1.00 15.60 N ATOM 1054 CA ARG A 947 -0.508 -13.933 -5.346 1.00 16.26 C ATOM 1055 C ARG A 947 0.699 -13.717 -4.462 1.00 18.74 C ATOM 1056 O ARG A 947 1.352 -14.707 -4.123 1.00 18.60 O ATOM 1057 CB ARG A 947 -0.023 -14.811 -6.546 1.00 20.63 C ATOM 1058 CG ARG A 947 -1.099 -15.221 -7.536 1.00 25.31 C ATOM 1059 CD ARG A 947 -0.507 -15.999 -8.695 1.00 23.54 C ATOM 1060 NE ARG A 947 -1.409 -15.964 -9.841 1.00 28.04 N ATOM 1061 CZ ARG A 947 -1.254 -16.687 -10.943 1.00 42.81 C ATOM 1062 NH1 ARG A 947 -0.234 -17.529 -11.054 1.00 28.25 N ATOM 1063 NH2 ARG A 947 -2.127 -16.583 -11.941 1.00 29.74 N ATOM 1064 HE ARG A 947 -2.231 -15.328 -9.791 1.00 0.00 H ATOM 1065 HH12 ARG A 947 -0.117 -18.093 -11.920 1.00 0.00 H ATOM 1066 HH11 ARG A 947 0.449 -17.625 -10.275 1.00 0.00 H ATOM 1067 HH22 ARG A 947 -2.002 -17.151 -12.803 1.00 0.00 H ATOM 1068 HH21 ARG A 947 -2.935 -15.933 -11.860 1.00 0.00 H ATOM 1069 H ARG A 947 -0.489 -12.189 -6.589 1.00 0.00 H ATOM 1070 N ILE A 948 1.055 -12.464 -4.168 1.00 15.16 N ATOM 1071 CA ILE A 948 2.300 -12.246 -3.436 1.00 16.45 C ATOM 1072 C ILE A 948 2.080 -11.519 -2.125 1.00 16.92 C ATOM 1073 O ILE A 948 1.246 -10.599 -2.054 1.00 18.81 O ATOM 1074 CB ILE A 948 3.361 -11.560 -4.334 1.00 20.61 C ATOM 1075 CG1 ILE A 948 3.525 -12.301 -5.694 1.00 21.45 C ATOM 1076 CG2 ILE A 948 4.727 -11.583 -3.595 1.00 23.89 C ATOM 1077 CD1 ILE A 948 4.207 -11.509 -6.764 1.00 26.71 C ATOM 1078 H ILE A 948 0.459 -11.661 -4.454 1.00 0.00 H ATOM 1079 N ASP A 949 2.717 -12.026 -1.071 1.00 16.10 N ATOM 1080 CA ASP A 949 2.733 -11.438 0.254 1.00 15.32 C ATOM 1081 C ASP A 949 4.167 -11.525 0.776 1.00 15.18 C ATOM 1082 O ASP A 949 5.040 -12.092 0.080 1.00 12.26 O ATOM 1083 CB ASP A 949 1.724 -12.085 1.216 1.00 17.18 C ATOM 1084 CG ASP A 949 1.856 -13.572 1.381 1.00 22.68 C ATOM 1085 OD1 ASP A 949 2.979 -14.096 1.228 1.00 19.45 O ATOM 1086 OD2 ASP A 949 0.846 -14.223 1.728 1.00 28.82 O ATOM 1087 H ASP A 949 3.244 -12.912 -1.209 1.00 0.00 H ATOM 1088 N HIS A 950 4.414 -11.019 1.984 1.00 12.58 N ATOM 1089 CA HIS A 950 5.786 -11.037 2.501 1.00 12.48 C ATOM 1090 C HIS A 950 6.320 -12.405 2.736 1.00 14.15 C ATOM 1091 O HIS A 950 7.533 -12.619 2.543 1.00 12.50 O ATOM 1092 CB HIS A 950 5.924 -10.191 3.761 1.00 14.01 C ATOM 1093 CG HIS A 950 5.851 -8.717 3.506 1.00 16.96 C ATOM 1094 ND1 HIS A 950 6.043 -7.802 4.523 1.00 20.43 N ATOM 1095 CD2 HIS A 950 5.689 -8.044 2.346 1.00 19.57 C ATOM 1096 CE1 HIS A 950 5.931 -6.612 3.956 1.00 20.07 C ATOM 1097 NE2 HIS A 950 5.738 -6.704 2.651 1.00 20.67 N ATOM 1098 H HIS A 950 3.643 -10.616 2.553 1.00 0.00 H ATOM 1099 N ILE A 951 5.487 -13.365 3.124 1.00 12.49 N ATOM 1100 CA ILE A 951 5.974 -14.712 3.307 1.00 14.25 C ATOM 1101 C ILE A 951 6.514 -15.238 1.974 1.00 13.90 C ATOM 1102 O ILE A 951 7.564 -15.907 1.964 1.00 13.16 O ATOM 1103 CB ILE A 951 4.861 -15.610 3.935 1.00 18.00 C ATOM 1104 CG1 ILE A 951 4.586 -15.234 5.428 1.00 19.41 C ATOM 1105 CG2 ILE A 951 5.076 -17.137 3.735 1.00 22.00 C ATOM 1106 CD1 ILE A 951 5.762 -15.183 6.385 1.00 31.31 C ATOM 1107 H ILE A 951 4.485 -13.146 3.296 1.00 0.00 H ATOM 1108 N LYS A 952 5.802 -14.981 0.869 1.00 11.49 N ATOM 1109 CA LYS A 952 6.278 -15.440 -0.453 1.00 11.71 C ATOM 1110 C LYS A 952 7.583 -14.736 -0.808 1.00 11.04 C ATOM 1111 O LYS A 952 8.512 -15.381 -1.311 1.00 10.17 O ATOM 1112 CB LYS A 952 5.248 -15.144 -1.543 1.00 14.71 C ATOM 1113 CG LYS A 952 3.986 -15.990 -1.454 1.00 25.88 C ATOM 1114 CD LYS A 952 4.123 -17.218 -2.323 1.00 37.95 C ATOM 1115 CE LYS A 952 4.151 -18.456 -1.485 1.00 43.97 C ATOM 1116 NZ LYS A 952 4.641 -19.603 -2.267 1.00 30.26 N ATOM 1117 HZ1 LYS A 952 4.012 -19.761 -3.080 1.00 0.00 H ATOM 1118 HZ2 LYS A 952 5.604 -19.404 -2.606 1.00 0.00 H ATOM 1119 HZ3 LYS A 952 4.652 -20.452 -1.666 1.00 0.00 H ATOM 1120 H LYS A 952 4.908 -14.455 0.942 1.00 0.00 H ATOM 1121 N LEU A 953 7.670 -13.432 -0.564 1.00 9.47 N ATOM 1122 CA LEU A 953 8.919 -12.713 -0.863 1.00 8.86 C ATOM 1123 C LEU A 953 10.071 -13.331 -0.122 1.00 10.10 C ATOM 1124 O LEU A 953 11.140 -13.468 -0.710 1.00 9.31 O ATOM 1125 CB LEU A 953 8.823 -11.254 -0.495 1.00 8.82 C ATOM 1126 CG LEU A 953 7.767 -10.415 -1.234 1.00 10.56 C ATOM 1127 CD1 LEU A 953 7.886 -8.993 -0.810 1.00 11.15 C ATOM 1128 CD2 LEU A 953 7.941 -10.495 -2.770 1.00 11.63 C ATOM 1129 H LEU A 953 6.858 -12.921 -0.163 1.00 0.00 H ATOM 1130 N LEU A 954 9.888 -13.713 1.131 1.00 9.19 N ATOM 1131 CA LEU A 954 10.989 -14.335 1.882 1.00 9.73 C ATOM 1132 C LEU A 954 11.293 -15.730 1.427 1.00 9.47 C ATOM 1133 O LEU A 954 12.460 -16.136 1.464 1.00 9.48 O ATOM 1134 CB LEU A 954 10.690 -14.307 3.371 1.00 10.79 C ATOM 1135 CG LEU A 954 10.612 -12.899 3.964 1.00 14.89 C ATOM 1136 CD1 LEU A 954 10.210 -12.970 5.425 1.00 18.28 C ATOM 1137 CD2 LEU A 954 11.943 -12.133 3.766 1.00 17.25 C ATOM 1138 H LEU A 954 8.963 -13.573 1.586 1.00 0.00 H ATOM 1139 N GLN A 955 10.302 -16.474 0.918 1.00 9.06 N ATOM 1140 CA GLN A 955 10.578 -17.783 0.350 1.00 9.88 C ATOM 1141 C GLN A 955 11.460 -17.599 -0.893 1.00 9.60 C ATOM 1142 O GLN A 955 12.448 -18.310 -1.079 1.00 9.34 O ATOM 1143 CB GLN A 955 9.255 -18.465 -0.029 1.00 12.27 C ATOM 1144 CG GLN A 955 9.452 -19.849 -0.629 1.00 15.66 C ATOM 1145 CD GLN A 955 8.139 -20.542 -0.938 1.00 25.50 C ATOM 1146 OE1 GLN A 955 7.128 -19.908 -1.251 1.00 27.93 O ATOM 1147 NE2 GLN A 955 8.133 -21.854 -0.820 1.00 26.98 N ATOM 1148 HE22 GLN A 955 9.004 -22.356 -0.554 1.00 0.00 H ATOM 1149 HE21 GLN A 955 7.257 -22.388 -0.993 1.00 0.00 H ATOM 1150 H GLN A 955 9.327 -16.112 0.929 1.00 0.00 H ATOM 1151 N TYR A 956 11.138 -16.631 -1.739 1.00 8.90 N ATOM 1152 CA TYR A 956 11.953 -16.388 -2.942 1.00 9.19 C ATOM 1153 C TYR A 956 13.341 -15.929 -2.540 1.00 9.25 C ATOM 1154 O TYR A 956 14.336 -16.363 -3.133 1.00 8.99 O ATOM 1155 CB TYR A 956 11.326 -15.337 -3.849 1.00 9.93 C ATOM 1156 CG TYR A 956 9.913 -15.639 -4.293 1.00 10.99 C ATOM 1157 CD1 TYR A 956 9.450 -16.949 -4.374 1.00 11.52 C ATOM 1158 CD2 TYR A 956 9.039 -14.607 -4.638 1.00 11.89 C ATOM 1159 CE1 TYR A 956 8.136 -17.227 -4.753 1.00 13.46 C ATOM 1160 CE2 TYR A 956 7.724 -14.871 -5.009 1.00 13.33 C ATOM 1161 CZ TYR A 956 7.283 -16.182 -5.062 1.00 15.09 C ATOM 1162 OH TYR A 956 5.961 -16.455 -5.392 1.00 17.94 O ATOM 1163 HH TYR A 956 5.816 -17.434 -5.384 1.00 0.00 H ATOM 1164 H TYR A 956 10.304 -16.039 -1.552 1.00 0.00 H ATOM 1165 N THR A 957 13.428 -15.061 -1.520 1.00 8.38 N ATOM 1166 CA THR A 957 14.715 -14.599 -1.012 1.00 8.22 C ATOM 1167 C THR A 957 15.605 -15.790 -0.592 1.00 8.94 C ATOM 1168 O THR A 957 16.801 -15.861 -0.946 1.00 8.61 O ATOM 1169 CB THR A 957 14.516 -13.649 0.159 1.00 9.06 C ATOM 1170 OG1 THR A 957 13.753 -12.517 -0.266 1.00 9.59 O ATOM 1171 CG2 THR A 957 15.847 -13.136 0.690 1.00 9.44 C ATOM 1172 HG1 THR A 957 12.871 -12.821 -0.598 1.00 0.00 H ATOM 1173 H THR A 957 12.554 -14.708 -1.080 1.00 0.00 H ATOM 1174 N SER A 958 15.025 -16.723 0.156 1.00 8.45 N ATOM 1175 CA SER A 958 15.734 -17.908 0.640 1.00 9.59 C ATOM 1176 C SER A 958 16.254 -18.717 -0.538 1.00 9.48 C ATOM 1177 O SER A 958 17.418 -19.119 -0.553 1.00 8.68 O ATOM 1178 CB SER A 958 14.733 -18.768 1.406 1.00 12.02 C ATOM 1179 OG SER A 958 15.294 -20.022 1.773 1.00 12.25 O ATOM 1180 HG SER A 958 14.619 -20.552 2.267 1.00 0.00 H ATOM 1181 H SER A 958 14.023 -16.606 0.408 1.00 0.00 H ATOM 1182 N GLN A 959 15.408 -18.943 -1.538 1.00 8.62 N ATOM 1183 CA GLN A 959 15.792 -19.734 -2.717 1.00 8.04 C ATOM 1184 C GLN A 959 16.902 -19.070 -3.486 1.00 8.68 C ATOM 1185 O GLN A 959 17.820 -19.768 -3.960 1.00 8.81 O ATOM 1186 CB GLN A 959 14.558 -19.945 -3.593 1.00 8.87 C ATOM 1187 CG GLN A 959 13.552 -20.886 -2.884 1.00 9.54 C ATOM 1188 CD GLN A 959 12.279 -21.032 -3.673 1.00 11.64 C ATOM 1189 OE1 GLN A 959 12.196 -20.725 -4.864 1.00 15.85 O ATOM 1190 NE2 GLN A 959 11.252 -21.575 -3.054 1.00 12.80 N ATOM 1191 HE22 GLN A 959 11.327 -21.832 -2.049 1.00 0.00 H ATOM 1192 HE21 GLN A 959 10.365 -21.747 -3.570 1.00 0.00 H ATOM 1193 H GLN A 959 14.447 -18.549 -1.485 1.00 0.00 H ATOM 1194 N ILE A 960 16.858 -17.757 -3.634 1.00 8.12 N ATOM 1195 CA ILE A 960 17.931 -17.028 -4.312 1.00 7.83 C ATOM 1196 C ILE A 960 19.241 -17.226 -3.535 1.00 9.01 C ATOM 1197 O ILE A 960 20.301 -17.479 -4.127 1.00 8.14 O ATOM 1198 CB ILE A 960 17.545 -15.545 -4.497 1.00 8.11 C ATOM 1199 CG1 ILE A 960 16.359 -15.451 -5.484 1.00 8.31 C ATOM 1200 CG2 ILE A 960 18.749 -14.714 -5.008 1.00 8.85 C ATOM 1201 CD1 ILE A 960 15.550 -14.132 -5.284 1.00 10.55 C ATOM 1202 H ILE A 960 16.043 -17.230 -3.260 1.00 0.00 H ATOM 1203 N CYS A 961 19.197 -17.108 -2.199 1.00 7.61 N ATOM 1204 CA CYS A 961 20.430 -17.320 -1.436 1.00 7.72 C ATOM 1205 C CYS A 961 20.967 -18.714 -1.651 1.00 9.00 C ATOM 1206 O CYS A 961 22.197 -18.850 -1.741 1.00 8.76 O ATOM 1207 CB CYS A 961 20.181 -17.081 0.049 1.00 8.55 C ATOM 1208 SG CYS A 961 19.903 -15.357 0.498 1.00 11.81 S ATOM 1209 H CYS A 961 18.307 -16.871 -1.716 1.00 0.00 H ATOM 1210 N LYS A 962 20.099 -19.728 -1.661 1.00 8.20 N ATOM 1211 CA LYS A 962 20.549 -21.109 -1.823 1.00 8.29 C ATOM 1212 C LYS A 962 21.136 -21.355 -3.192 1.00 8.67 C ATOM 1213 O LYS A 962 22.212 -21.962 -3.300 1.00 8.28 O ATOM 1214 CB LYS A 962 19.436 -22.067 -1.481 1.00 10.57 C ATOM 1215 CG LYS A 962 19.090 -21.972 0.015 1.00 11.17 C ATOM 1216 CD LYS A 962 17.809 -22.710 0.382 1.00 14.36 C ATOM 1217 CE LYS A 962 17.453 -22.366 1.806 1.00 13.39 C ATOM 1218 NZ LYS A 962 16.226 -23.065 2.269 1.00 14.55 N ATOM 1219 HZ1 LYS A 962 15.425 -22.795 1.663 1.00 0.00 H ATOM 1220 HZ2 LYS A 962 16.372 -24.093 2.214 1.00 0.00 H ATOM 1221 HZ3 LYS A 962 16.025 -22.795 3.253 1.00 0.00 H ATOM 1222 H LYS A 962 19.084 -19.532 -1.551 1.00 0.00 H ATOM 1223 N GLY A 963 20.528 -20.795 -4.236 1.00 7.81 N ATOM 1224 CA GLY A 963 21.107 -20.888 -5.570 1.00 8.30 C ATOM 1225 C GLY A 963 22.485 -20.238 -5.599 1.00 8.68 C ATOM 1226 O GLY A 963 23.419 -20.757 -6.225 1.00 8.54 O ATOM 1227 H GLY A 963 19.631 -20.286 -4.098 1.00 0.00 H ATOM 1228 N MET A 964 22.637 -19.102 -4.923 1.00 7.50 N ATOM 1229 CA MET A 964 23.941 -18.422 -4.875 1.00 6.84 C ATOM 1230 C MET A 964 24.974 -19.160 -4.049 1.00 8.98 C ATOM 1231 O MET A 964 26.147 -19.188 -4.433 1.00 8.51 O ATOM 1232 CB MET A 964 23.770 -16.991 -4.363 1.00 8.09 C ATOM 1233 CG MET A 964 23.039 -16.071 -5.367 1.00 9.02 C ATOM 1234 SD MET A 964 23.810 -15.993 -7.024 1.00 9.29 S ATOM 1235 CE MET A 964 25.396 -15.291 -6.536 1.00 9.84 C ATOM 1236 H MET A 964 21.824 -18.690 -4.422 1.00 0.00 H ATOM 1237 N GLU A 965 24.556 -19.822 -2.962 1.00 7.73 N ATOM 1238 CA GLU A 965 25.467 -20.689 -2.215 1.00 7.87 C ATOM 1239 C GLU A 965 25.998 -21.764 -3.183 1.00 8.64 C ATOM 1240 O GLU A 965 27.215 -21.994 -3.268 1.00 9.09 O ATOM 1241 CB GLU A 965 24.758 -21.412 -1.079 1.00 8.52 C ATOM 1242 CG GLU A 965 24.400 -20.542 0.108 1.00 9.50 C ATOM 1243 CD GLU A 965 23.659 -21.355 1.146 1.00 11.08 C ATOM 1244 OE1 GLU A 965 24.262 -22.288 1.726 1.00 11.45 O ATOM 1245 OE2 GLU A 965 22.437 -21.133 1.334 1.00 11.03 O ATOM 1246 H GLU A 965 23.571 -19.718 -2.645 1.00 0.00 H ATOM 1247 N TYR A 966 25.097 -22.394 -3.942 1.00 8.29 N ATOM 1248 CA TYR A 966 25.510 -23.425 -4.895 1.00 8.03 C ATOM 1249 C TYR A 966 26.470 -22.863 -5.926 1.00 9.76 C ATOM 1250 O TYR A 966 27.516 -23.458 -6.229 1.00 9.17 O ATOM 1251 CB TYR A 966 24.271 -24.016 -5.548 1.00 9.64 C ATOM 1252 CG TYR A 966 24.607 -25.075 -6.555 1.00 9.75 C ATOM 1253 CD1 TYR A 966 24.807 -26.399 -6.165 1.00 11.29 C ATOM 1254 CD2 TYR A 966 24.728 -24.764 -7.905 1.00 11.34 C ATOM 1255 CE1 TYR A 966 25.105 -27.390 -7.103 1.00 13.50 C ATOM 1256 CE2 TYR A 966 25.062 -25.737 -8.839 1.00 12.27 C ATOM 1257 CZ TYR A 966 25.259 -27.035 -8.425 1.00 13.96 C ATOM 1258 OH TYR A 966 25.558 -27.986 -9.365 1.00 16.57 O ATOM 1259 HH TYR A 966 25.671 -28.863 -8.921 1.00 0.00 H ATOM 1260 H TYR A 966 24.090 -22.149 -3.855 1.00 0.00 H ATOM 1261 N LEU A 967 26.131 -21.708 -6.516 1.00 8.49 N ATOM 1262 CA LEU A 967 27.000 -21.138 -7.537 1.00 9.33 C ATOM 1263 C LEU A 967 28.394 -20.884 -7.006 1.00 10.27 C ATOM 1264 O LEU A 967 29.387 -21.100 -7.724 1.00 10.63 O ATOM 1265 CB LEU A 967 26.414 -19.806 -8.028 1.00 9.93 C ATOM 1266 CG LEU A 967 26.954 -19.210 -9.299 1.00 7.43 C ATOM 1267 CD1 LEU A 967 26.560 -20.032 -10.544 1.00 8.24 C ATOM 1268 CD2 LEU A 967 26.450 -17.797 -9.472 1.00 7.38 C ATOM 1269 H LEU A 967 25.252 -21.221 -6.246 1.00 0.00 H ATOM 1270 N GLY A 968 28.499 -20.480 -5.755 1.00 9.21 N ATOM 1271 CA GLY A 968 29.821 -20.251 -5.179 1.00 10.22 C ATOM 1272 C GLY A 968 30.613 -21.544 -5.040 1.00 10.69 C ATOM 1273 O GLY A 968 31.849 -21.497 -5.122 1.00 10.99 O ATOM 1274 H GLY A 968 27.645 -20.325 -5.182 1.00 0.00 H ATOM 1275 N THR A 969 29.953 -22.709 -4.827 1.00 10.70 N ATOM 1276 CA THR A 969 30.699 -23.976 -4.712 1.00 10.44 C ATOM 1277 C THR A 969 31.301 -24.347 -6.044 1.00 14.42 C ATOM 1278 O THR A 969 32.247 -25.143 -6.102 1.00 14.45 O ATOM 1279 CB THR A 969 29.828 -25.137 -4.218 1.00 12.29 C ATOM 1280 OG1 THR A 969 28.901 -25.568 -5.231 1.00 11.94 O ATOM 1281 CG2 THR A 969 29.173 -24.850 -2.904 1.00 12.69 C ATOM 1282 HG1 THR A 969 28.309 -24.814 -5.477 1.00 0.00 H ATOM 1283 H THR A 969 28.916 -22.709 -4.744 1.00 0.00 H ATOM 1284 N LYS A 970 30.733 -23.835 -7.121 1.00 12.14 N ATOM 1285 CA LYS A 970 31.218 -24.075 -8.476 1.00 13.58 C ATOM 1286 C LYS A 970 32.207 -22.999 -8.897 1.00 15.13 C ATOM 1287 O LYS A 970 32.716 -23.028 -10.037 1.00 16.25 O ATOM 1288 CB LYS A 970 30.024 -24.132 -9.440 1.00 16.45 C ATOM 1289 CG LYS A 970 29.028 -25.245 -9.139 1.00 20.59 C ATOM 1290 CD LYS A 970 29.598 -26.560 -9.615 1.00 26.82 C ATOM 1291 CE LYS A 970 28.758 -27.739 -9.247 1.00 31.94 C ATOM 1292 NZ LYS A 970 29.360 -28.977 -9.796 1.00 37.87 N ATOM 1293 HZ1 LYS A 970 29.416 -28.904 -10.832 1.00 0.00 H ATOM 1294 HZ2 LYS A 970 30.316 -29.100 -9.404 1.00 0.00 H ATOM 1295 HZ3 LYS A 970 28.770 -29.793 -9.536 1.00 0.00 H ATOM 1296 H LYS A 970 29.897 -23.229 -6.997 1.00 0.00 H ATOM 1297 N ARG A 971 32.529 -22.049 -7.991 1.00 12.38 N ATOM 1298 CA ARG A 971 33.530 -21.007 -8.180 1.00 12.52 C ATOM 1299 C ARG A 971 33.167 -20.040 -9.301 1.00 14.88 C ATOM 1300 O ARG A 971 34.041 -19.530 -10.009 1.00 15.75 O ATOM 1301 CB ARG A 971 34.953 -21.607 -8.370 1.00 16.47 C ATOM 1302 CG ARG A 971 35.393 -22.441 -7.155 1.00 24.49 C ATOM 1303 CD ARG A 971 36.792 -23.029 -7.334 1.00 30.61 C ATOM 1304 NE ARG A 971 36.854 -24.006 -8.427 1.00 50.39 N ATOM 1305 CZ ARG A 971 36.494 -25.283 -8.326 1.00 72.33 C ATOM 1306 NH1 ARG A 971 36.035 -25.763 -7.176 1.00 62.54 N ATOM 1307 NH2 ARG A 971 36.582 -26.087 -9.376 1.00 65.90 N ATOM 1308 HE ARG A 971 37.205 -23.676 -9.349 1.00 0.00 H ATOM 1309 HH12 ARG A 971 35.755 -26.762 -7.104 1.00 0.00 H ATOM 1310 HH11 ARG A 971 35.955 -25.140 -6.347 1.00 0.00 H ATOM 1311 HH22 ARG A 971 36.299 -27.084 -9.292 1.00 0.00 H ATOM 1312 HH21 ARG A 971 36.934 -25.720 -10.284 1.00 0.00 H ATOM 1313 H ARG A 971 32.020 -22.063 -7.084 1.00 0.00 H ATOM 1314 N TYR A 972 31.869 -19.762 -9.440 1.00 10.93 N ATOM 1315 CA TYR A 972 31.406 -18.756 -10.391 1.00 9.93 C ATOM 1316 C TYR A 972 30.983 -17.509 -9.638 1.00 10.64 C ATOM 1317 O TYR A 972 30.551 -17.587 -8.475 1.00 11.63 O ATOM 1318 CB TYR A 972 30.199 -19.245 -11.210 1.00 11.36 C ATOM 1319 CG TYR A 972 30.519 -20.410 -12.111 1.00 12.51 C ATOM 1320 CD1 TYR A 972 31.492 -20.303 -13.104 1.00 15.63 C ATOM 1321 CD2 TYR A 972 29.830 -21.608 -11.997 1.00 13.48 C ATOM 1322 CE1 TYR A 972 31.826 -21.395 -13.900 1.00 16.69 C ATOM 1323 CE2 TYR A 972 30.118 -22.687 -12.825 1.00 13.72 C ATOM 1324 CZ TYR A 972 31.145 -22.585 -13.735 1.00 15.04 C ATOM 1325 OH TYR A 972 31.395 -23.673 -14.545 1.00 18.52 O ATOM 1326 HH TYR A 972 30.589 -23.874 -15.084 1.00 0.00 H ATOM 1327 H TYR A 972 31.174 -20.272 -8.859 1.00 0.00 H ATOM 1328 N ILE A 973 31.139 -16.374 -10.307 1.00 9.12 N ATOM 1329 CA ILE A 973 30.672 -15.065 -9.850 1.00 9.06 C ATOM 1330 C ILE A 973 29.528 -14.721 -10.769 1.00 9.60 C ATOM 1331 O ILE A 973 29.686 -14.794 -11.996 1.00 10.49 O ATOM 1332 CB ILE A 973 31.786 -14.002 -9.914 1.00 11.39 C ATOM 1333 CG1 ILE A 973 32.927 -14.424 -8.975 1.00 11.96 C ATOM 1334 CG2 ILE A 973 31.237 -12.601 -9.566 1.00 10.86 C ATOM 1335 CD1 ILE A 973 34.273 -13.855 -9.307 1.00 17.35 C ATOM 1336 H ILE A 973 31.629 -16.418 -11.223 1.00 0.00 H ATOM 1337 N HIS A 974 28.354 -14.394 -10.219 1.00 9.04 N ATOM 1338 CA HIS A 974 27.242 -14.117 -11.100 1.00 9.09 C ATOM 1339 C HIS A 974 27.431 -12.834 -11.906 1.00 9.59 C ATOM 1340 O HIS A 974 27.363 -12.849 -13.152 1.00 10.39 O ATOM 1341 CB HIS A 974 25.917 -14.110 -10.314 1.00 8.70 C ATOM 1342 CG HIS A 974 24.702 -14.183 -11.199 1.00 9.65 C ATOM 1343 ND1 HIS A 974 24.346 -13.145 -12.049 1.00 10.69 N ATOM 1344 CD2 HIS A 974 23.814 -15.192 -11.334 1.00 11.01 C ATOM 1345 CE1 HIS A 974 23.238 -13.550 -12.661 1.00 10.97 C ATOM 1346 NE2 HIS A 974 22.898 -14.789 -12.282 1.00 10.79 N ATOM 1347 H HIS A 974 28.244 -14.340 -9.186 1.00 0.00 H ATOM 1348 N ARG A 975 27.615 -11.707 -11.192 1.00 8.91 N ATOM 1349 CA ARG A 975 27.789 -10.328 -11.688 1.00 9.80 C ATOM 1350 C ARG A 975 26.437 -9.658 -11.976 1.00 11.19 C ATOM 1351 O ARG A 975 26.292 -8.438 -11.777 1.00 12.21 O ATOM 1352 CB ARG A 975 28.694 -10.205 -12.955 1.00 11.24 C ATOM 1353 CG ARG A 975 30.110 -10.704 -12.781 1.00 15.04 C ATOM 1354 CD ARG A 975 30.942 -10.258 -13.957 1.00 23.21 C ATOM 1355 NE ARG A 975 32.339 -10.642 -13.767 1.00 26.57 N ATOM 1356 CZ ARG A 975 33.370 -9.948 -14.232 1.00 45.70 C ATOM 1357 NH1 ARG A 975 33.171 -8.831 -14.924 1.00 39.68 N ATOM 1358 NH2 ARG A 975 34.610 -10.357 -13.999 1.00 35.83 N ATOM 1359 HE ARG A 975 32.538 -11.513 -13.234 1.00 0.00 H ATOM 1360 HH12 ARG A 975 33.983 -8.292 -15.286 1.00 0.00 H ATOM 1361 HH11 ARG A 975 32.203 -8.496 -15.104 1.00 0.00 H ATOM 1362 HH22 ARG A 975 35.415 -9.810 -14.365 1.00 0.00 H ATOM 1363 HH21 ARG A 975 34.777 -11.224 -13.450 1.00 0.00 H ATOM 1364 H ARG A 975 27.637 -11.823 -10.159 1.00 0.00 H ATOM 1365 N ASP A 976 25.466 -10.432 -12.499 1.00 10.07 N ATOM 1366 CA ASP A 976 24.228 -9.882 -13.063 1.00 10.69 C ATOM 1367 C ASP A 976 23.000 -10.195 -12.203 1.00 10.91 C ATOM 1368 O ASP A 976 21.877 -10.228 -12.707 1.00 11.29 O ATOM 1369 CB ASP A 976 24.057 -10.461 -14.509 1.00 13.05 C ATOM 1370 CG ASP A 976 25.265 -10.262 -15.405 1.00 15.18 C ATOM 1371 OD1 ASP A 976 25.875 -9.194 -15.334 1.00 15.77 O ATOM 1372 OD2 ASP A 976 25.617 -11.203 -16.153 1.00 18.60 O ATOM 1373 H ASP A 976 25.600 -11.463 -12.503 1.00 0.00 H ATOM 1374 N LEU A 977 23.195 -10.383 -10.892 1.00 9.26 N ATOM 1375 CA LEU A 977 22.060 -10.739 -10.059 1.00 10.45 C ATOM 1376 C LEU A 977 21.108 -9.563 -9.964 1.00 11.81 C ATOM 1377 O LEU A 977 21.531 -8.432 -9.640 1.00 13.49 O ATOM 1378 CB LEU A 977 22.564 -11.279 -8.696 1.00 10.92 C ATOM 1379 CG LEU A 977 21.552 -12.034 -7.860 1.00 15.58 C ATOM 1380 CD1 LEU A 977 21.157 -13.349 -8.536 1.00 16.05 C ATOM 1381 CD2 LEU A 977 22.130 -12.328 -6.467 1.00 16.24 C ATOM 1382 H LEU A 977 24.143 -10.276 -10.477 1.00 0.00 H ATOM 1383 N ALA A 978 19.834 -9.770 -10.325 1.00 9.53 N ATOM 1384 CA ALA A 978 18.799 -8.739 -10.433 1.00 9.51 C ATOM 1385 C ALA A 978 17.515 -9.491 -10.710 1.00 9.68 C ATOM 1386 O ALA A 978 17.565 -10.609 -11.264 1.00 9.00 O ATOM 1387 CB ALA A 978 19.095 -7.801 -11.614 1.00 10.20 C ATOM 1388 H ALA A 978 19.556 -10.747 -10.548 1.00 0.00 H ATOM 1389 N THR A 979 16.350 -8.949 -10.325 1.00 8.37 N ATOM 1390 CA THR A 979 15.126 -9.741 -10.546 1.00 8.23 C ATOM 1391 C THR A 979 14.848 -9.981 -12.019 1.00 9.58 C ATOM 1392 O THR A 979 14.148 -10.962 -12.335 1.00 9.50 O ATOM 1393 CB THR A 979 13.878 -9.189 -9.839 1.00 9.96 C ATOM 1394 OG1 THR A 979 13.497 -7.942 -10.439 1.00 9.72 O ATOM 1395 CG2 THR A 979 14.048 -9.068 -8.315 1.00 10.00 C ATOM 1396 HG1 THR A 979 14.240 -7.294 -10.350 1.00 0.00 H ATOM 1397 H THR A 979 16.311 -8.006 -9.887 1.00 0.00 H ATOM 1398 N ARG A 980 15.384 -9.153 -12.914 1.00 9.14 N ATOM 1399 CA ARG A 980 15.204 -9.416 -14.359 1.00 8.66 C ATOM 1400 C ARG A 980 15.883 -10.730 -14.786 1.00 10.28 C ATOM 1401 O ARG A 980 15.530 -11.252 -15.842 1.00 10.51 O ATOM 1402 CB ARG A 980 15.737 -8.244 -15.218 1.00 10.00 C ATOM 1403 CG ARG A 980 17.246 -8.062 -15.128 1.00 11.72 C ATOM 1404 CD ARG A 980 17.699 -6.797 -15.870 1.00 13.90 C ATOM 1405 NE ARG A 980 19.155 -6.729 -15.792 1.00 15.99 N ATOM 1406 CZ ARG A 980 19.820 -6.115 -14.816 1.00 19.01 C ATOM 1407 NH1 ARG A 980 19.169 -5.379 -13.918 1.00 20.49 N ATOM 1408 NH2 ARG A 980 21.138 -6.178 -14.769 1.00 22.56 N ATOM 1409 HE ARG A 980 19.706 -7.188 -16.545 1.00 0.00 H ATOM 1410 HH12 ARG A 980 19.694 -4.902 -13.158 1.00 0.00 H ATOM 1411 HH11 ARG A 980 18.135 -5.281 -13.977 1.00 0.00 H ATOM 1412 HH22 ARG A 980 21.655 -5.697 -14.005 1.00 0.00 H ATOM 1413 HH21 ARG A 980 21.659 -6.708 -15.496 1.00 0.00 H ATOM 1414 H ARG A 980 15.927 -8.324 -12.598 1.00 0.00 H ATOM 1415 N ASN A 981 16.841 -11.234 -14.004 1.00 8.72 N ATOM 1416 CA ASN A 981 17.573 -12.447 -14.326 1.00 8.53 C ATOM 1417 C ASN A 981 17.197 -13.614 -13.470 1.00 10.35 C ATOM 1418 O ASN A 981 17.815 -14.670 -13.584 1.00 12.36 O ATOM 1419 CB ASN A 981 19.079 -12.170 -14.238 1.00 9.36 C ATOM 1420 CG ASN A 981 19.581 -11.394 -15.408 1.00 10.89 C ATOM 1421 OD1 ASN A 981 19.144 -11.628 -16.542 1.00 12.00 O ATOM 1422 ND2 ASN A 981 20.489 -10.480 -15.166 1.00 12.71 N ATOM 1423 HD22 ASN A 981 20.823 -10.323 -14.194 1.00 0.00 H ATOM 1424 HD21 ASN A 981 20.876 -9.912 -15.946 1.00 0.00 H ATOM 1425 H ASN A 981 17.074 -10.734 -13.122 1.00 0.00 H ATOM 1426 N ILE A 982 16.163 -13.483 -12.640 1.00 9.07 N ATOM 1427 CA ILE A 982 15.650 -14.598 -11.851 1.00 8.84 C ATOM 1428 C ILE A 982 14.365 -15.019 -12.503 1.00 9.03 C ATOM 1429 O ILE A 982 13.627 -14.157 -12.968 1.00 9.63 O ATOM 1430 CB ILE A 982 15.487 -14.188 -10.374 1.00 10.28 C ATOM 1431 CG1 ILE A 982 16.896 -13.819 -9.835 1.00 11.60 C ATOM 1432 CG2 ILE A 982 14.878 -15.346 -9.546 1.00 10.32 C ATOM 1433 CD1 ILE A 982 16.901 -12.968 -8.551 1.00 11.73 C ATOM 1434 H ILE A 982 15.705 -12.553 -12.551 1.00 0.00 H ATOM 1435 N LEU A 983 14.122 -16.313 -12.610 1.00 8.37 N ATOM 1436 CA LEU A 983 12.912 -16.774 -13.299 1.00 9.28 C ATOM 1437 C LEU A 983 11.986 -17.478 -12.342 1.00 10.17 C ATOM 1438 O LEU A 983 12.396 -17.967 -11.279 1.00 10.32 O ATOM 1439 CB LEU A 983 13.265 -17.698 -14.459 1.00 11.44 C ATOM 1440 CG LEU A 983 13.853 -16.950 -15.664 1.00 15.54 C ATOM 1441 CD1 LEU A 983 15.377 -16.822 -15.586 1.00 16.08 C ATOM 1442 CD2 LEU A 983 13.346 -17.502 -16.986 1.00 19.65 C ATOM 1443 H LEU A 983 14.787 -17.003 -12.207 1.00 0.00 H ATOM 1444 N VAL A 984 10.703 -17.525 -12.714 1.00 10.02 N ATOM 1445 CA VAL A 984 9.686 -18.092 -11.843 1.00 9.74 C ATOM 1446 C VAL A 984 9.079 -19.359 -12.458 1.00 10.38 C ATOM 1447 O VAL A 984 8.461 -19.295 -13.546 1.00 11.61 O ATOM 1448 CB VAL A 984 8.604 -17.030 -11.570 1.00 10.97 C ATOM 1449 CG1 VAL A 984 7.526 -17.584 -10.622 1.00 11.05 C ATOM 1450 CG2 VAL A 984 9.224 -15.772 -10.951 1.00 11.01 C ATOM 1451 H VAL A 984 10.427 -17.149 -13.644 1.00 0.00 H ATOM 1452 N GLU A 985 9.212 -20.480 -11.781 1.00 11.17 N ATOM 1453 CA GLU A 985 8.614 -21.735 -12.252 1.00 12.92 C ATOM 1454 C GLU A 985 7.121 -21.744 -11.871 1.00 16.90 C ATOM 1455 O GLU A 985 6.257 -22.119 -12.684 1.00 16.51 O ATOM 1456 CB GLU A 985 9.318 -22.918 -11.609 1.00 14.90 C ATOM 1457 CG GLU A 985 8.730 -24.220 -12.154 1.00 18.99 C ATOM 1458 CD GLU A 985 9.287 -25.525 -11.644 1.00 37.01 C ATOM 1459 OE1 GLU A 985 10.402 -25.527 -11.083 1.00 26.40 O ATOM 1460 OE2 GLU A 985 8.624 -26.563 -11.858 1.00 33.31 O ATOM 1461 H GLU A 985 9.753 -20.476 -10.893 1.00 0.00 H ATOM 1462 N ASN A 986 6.823 -21.369 -10.638 1.00 13.66 N ATOM 1463 CA ASN A 986 5.463 -21.303 -10.078 1.00 14.54 C ATOM 1464 C ASN A 986 5.486 -20.427 -8.825 1.00 18.32 C ATOM 1465 O ASN A 986 6.547 -19.914 -8.452 1.00 14.52 O ATOM 1466 CB ASN A 986 4.885 -22.716 -9.821 1.00 17.95 C ATOM 1467 CG ASN A 986 5.744 -23.543 -8.906 1.00 20.98 C ATOM 1468 OD1 ASN A 986 6.099 -23.113 -7.813 1.00 18.39 O ATOM 1469 ND2 ASN A 986 6.133 -24.714 -9.354 1.00 22.24 N ATOM 1470 HD22 ASN A 986 5.812 -25.047 -10.286 1.00 0.00 H ATOM 1471 HD21 ASN A 986 6.762 -25.309 -8.777 1.00 0.00 H ATOM 1472 H ASN A 986 7.611 -21.100 -10.015 1.00 0.00 H ATOM 1473 N GLU A 987 4.349 -20.239 -8.164 1.00 16.18 N ATOM 1474 CA GLU A 987 4.283 -19.384 -6.991 1.00 15.72 C ATOM 1475 C GLU A 987 5.219 -19.816 -5.857 1.00 16.89 C ATOM 1476 O GLU A 987 5.448 -19.008 -4.974 1.00 17.49 O ATOM 1477 CB GLU A 987 2.834 -19.230 -6.479 1.00 18.29 C ATOM 1478 CG GLU A 987 2.191 -20.521 -6.006 1.00 24.77 C ATOM 1479 CD GLU A 987 0.784 -20.354 -5.448 1.00 50.16 C ATOM 1480 OE1 GLU A 987 0.296 -19.202 -5.360 1.00 43.27 O ATOM 1481 OE2 GLU A 987 0.162 -21.384 -5.104 1.00 42.03 O ATOM 1482 H GLU A 987 3.485 -20.715 -8.494 1.00 0.00 H ATOM 1483 N ASN A 988 5.702 -21.063 -5.874 1.00 14.22 N ATOM 1484 CA ASN A 988 6.595 -21.584 -4.827 1.00 15.26 C ATOM 1485 C ASN A 988 8.041 -21.785 -5.214 1.00 15.34 C ATOM 1486 O ASN A 988 8.798 -22.309 -4.378 1.00 15.92 O ATOM 1487 CB ASN A 988 6.063 -22.927 -4.300 1.00 18.94 C ATOM 1488 CG ASN A 988 4.684 -22.848 -3.716 1.00 36.18 C ATOM 1489 OD1 ASN A 988 4.387 -21.959 -2.932 1.00 31.96 O ATOM 1490 ND2 ASN A 988 3.811 -23.759 -4.108 1.00 33.19 N ATOM 1491 HD22 ASN A 988 4.099 -24.501 -4.777 1.00 0.00 H ATOM 1492 HD21 ASN A 988 2.836 -23.734 -3.748 1.00 0.00 H ATOM 1493 H ASN A 988 5.435 -21.690 -6.660 1.00 0.00 H ATOM 1494 N ARG A 989 8.435 -21.428 -6.448 1.00 13.04 N ATOM 1495 CA ARG A 989 9.785 -21.734 -6.869 1.00 12.83 C ATOM 1496 C ARG A 989 10.328 -20.749 -7.874 1.00 12.28 C ATOM 1497 O ARG A 989 9.768 -20.539 -8.953 1.00 11.95 O ATOM 1498 CB ARG A 989 9.820 -23.151 -7.482 1.00 17.41 C ATOM 1499 CG ARG A 989 11.133 -23.558 -8.171 1.00 26.19 C ATOM 1500 CD ARG A 989 12.153 -24.115 -7.207 1.00 27.51 C ATOM 1501 NE ARG A 989 11.778 -25.474 -6.823 1.00 36.58 N ATOM 1502 CZ ARG A 989 12.202 -26.579 -7.430 1.00 48.86 C ATOM 1503 NH1 ARG A 989 13.102 -26.507 -8.408 1.00 29.22 N ATOM 1504 NH2 ARG A 989 11.772 -27.767 -7.031 1.00 37.52 N ATOM 1505 HE ARG A 989 11.132 -25.586 -6.016 1.00 0.00 H ATOM 1506 HH12 ARG A 989 13.429 -27.375 -8.878 1.00 0.00 H ATOM 1507 HH11 ARG A 989 13.478 -25.583 -8.702 1.00 0.00 H ATOM 1508 HH22 ARG A 989 12.106 -28.628 -7.509 1.00 0.00 H ATOM 1509 HH21 ARG A 989 11.100 -27.838 -6.240 1.00 0.00 H ATOM 1510 H ARG A 989 7.780 -20.939 -7.091 1.00 0.00 H ATOM 1511 N VAL A 990 11.504 -20.211 -7.543 1.00 9.88 N ATOM 1512 CA VAL A 990 12.268 -19.345 -8.429 1.00 8.83 C ATOM 1513 C VAL A 990 13.622 -19.980 -8.714 1.00 9.58 C ATOM 1514 O VAL A 990 14.110 -20.824 -7.932 1.00 9.94 O ATOM 1515 CB VAL A 990 12.417 -17.888 -7.909 1.00 10.17 C ATOM 1516 CG1 VAL A 990 11.058 -17.242 -7.665 1.00 11.14 C ATOM 1517 CG2 VAL A 990 13.291 -17.836 -6.634 1.00 11.04 C ATOM 1518 H VAL A 990 11.895 -20.422 -6.603 1.00 0.00 H ATOM 1519 N LYS A 991 14.212 -19.573 -9.851 1.00 9.27 N ATOM 1520 CA LYS A 991 15.503 -20.119 -10.280 1.00 8.71 C ATOM 1521 C LYS A 991 16.334 -18.982 -10.799 1.00 10.99 C ATOM 1522 O LYS A 991 15.876 -18.195 -11.641 1.00 10.65 O ATOM 1523 CB LYS A 991 15.313 -21.154 -11.395 1.00 10.56 C ATOM 1524 CG LYS A 991 14.469 -22.360 -10.939 1.00 13.70 C ATOM 1525 CD LYS A 991 14.573 -23.541 -11.874 1.00 11.91 C ATOM 1526 CE LYS A 991 13.567 -24.595 -11.450 1.00 13.87 C ATOM 1527 NZ LYS A 991 13.857 -25.879 -12.124 1.00 16.02 N ATOM 1528 HZ1 LYS A 991 13.800 -25.749 -13.154 1.00 0.00 H ATOM 1529 HZ2 LYS A 991 14.813 -26.197 -11.865 1.00 0.00 H ATOM 1530 HZ3 LYS A 991 13.161 -26.591 -11.825 1.00 0.00 H ATOM 1531 H LYS A 991 13.742 -18.855 -10.439 1.00 0.00 H ATOM 1532 N ILE A 992 17.586 -18.912 -10.326 1.00 8.38 N ATOM 1533 CA ILE A 992 18.499 -17.884 -10.831 1.00 8.67 C ATOM 1534 C ILE A 992 18.947 -18.246 -12.243 1.00 9.04 C ATOM 1535 O ILE A 992 19.259 -19.411 -12.523 1.00 10.10 O ATOM 1536 CB ILE A 992 19.737 -17.830 -9.918 1.00 9.79 C ATOM 1537 CG1 ILE A 992 19.329 -17.437 -8.497 1.00 10.38 C ATOM 1538 CG2 ILE A 992 20.794 -16.850 -10.494 1.00 11.00 C ATOM 1539 CD1 ILE A 992 20.478 -17.677 -7.525 1.00 12.65 C ATOM 1540 H ILE A 992 17.908 -19.586 -9.602 1.00 0.00 H ATOM 1541 N GLY A 993 18.987 -17.250 -13.098 1.00 8.65 N ATOM 1542 CA GLY A 993 19.525 -17.369 -14.449 1.00 9.83 C ATOM 1543 C GLY A 993 20.310 -16.127 -14.817 1.00 10.56 C ATOM 1544 O GLY A 993 20.732 -15.329 -13.963 1.00 9.83 O ATOM 1545 H GLY A 993 18.615 -16.327 -12.796 1.00 0.00 H ATOM 1546 N ASP A 994 20.491 -15.932 -16.116 1.00 10.52 N ATOM 1547 CA ASP A 994 21.166 -14.776 -16.666 1.00 11.05 C ATOM 1548 C ASP A 994 20.747 -14.773 -18.135 1.00 15.04 C ATOM 1549 O ASP A 994 21.242 -15.597 -18.909 1.00 15.68 O ATOM 1550 CB ASP A 994 22.694 -14.910 -16.522 1.00 12.21 C ATOM 1551 CG ASP A 994 23.405 -13.575 -16.613 1.00 16.98 C ATOM 1552 OD1 ASP A 994 22.781 -12.592 -17.085 1.00 19.14 O ATOM 1553 OD2 ASP A 994 24.597 -13.521 -16.271 1.00 17.09 O ATOM 1554 H ASP A 994 20.128 -16.649 -16.776 1.00 0.00 H ATOM 1555 N PHE A 995 19.749 -13.976 -18.477 1.00 15.43 N ATOM 1556 CA PHE A 995 19.257 -14.011 -19.863 1.00 17.08 C ATOM 1557 C PHE A 995 20.377 -13.850 -20.897 1.00 24.11 C ATOM 1558 O PHE A 995 20.520 -14.707 -21.787 1.00 21.41 O ATOM 1559 CB PHE A 995 18.131 -13.015 -20.057 1.00 18.77 C ATOM 1560 CG PHE A 995 16.783 -13.518 -19.606 1.00 18.99 C ATOM 1561 CD1 PHE A 995 15.947 -14.205 -20.484 1.00 21.74 C ATOM 1562 CD2 PHE A 995 16.354 -13.323 -18.303 1.00 16.98 C ATOM 1563 CE1 PHE A 995 14.679 -14.637 -20.075 1.00 22.74 C ATOM 1564 CE2 PHE A 995 15.082 -13.763 -17.889 1.00 20.33 C ATOM 1565 CZ PHE A 995 14.253 -14.412 -18.782 1.00 19.95 C ATOM 1566 H PHE A 995 19.320 -13.336 -17.779 1.00 0.00 H ATOM 1567 N GLY A 996 21.191 -12.812 -20.712 1.00 23.85 N ATOM 1568 CA GLY A 996 22.346 -12.500 -21.546 1.00 24.30 C ATOM 1569 C GLY A 996 21.964 -12.168 -22.965 1.00 29.54 C ATOM 1570 O GLY A 996 22.652 -12.587 -23.900 1.00 30.40 O ATOM 1571 H GLY A 996 20.988 -12.177 -19.914 1.00 0.00 H ATOM 1572 N LEU A 997 20.842 -11.457 -23.141 1.00 25.67 N ATOM 1573 CA LEU A 997 20.358 -11.103 -24.477 1.00 25.42 C ATOM 1574 C LEU A 997 20.868 -9.754 -24.912 1.00 31.67 C ATOM 1575 O LEU A 997 20.995 -9.517 -26.113 1.00 29.10 O ATOM 1576 CB LEU A 997 18.825 -11.132 -24.544 1.00 25.07 C ATOM 1577 CG LEU A 997 18.123 -12.403 -24.057 1.00 28.87 C ATOM 1578 CD1 LEU A 997 16.650 -12.316 -24.310 1.00 29.60 C ATOM 1579 CD2 LEU A 997 18.708 -13.656 -24.700 1.00 31.01 C ATOM 1580 H LEU A 997 20.301 -11.149 -22.308 1.00 0.00 H ATOM 1581 N THR A 998 21.113 -8.864 -23.934 1.00 33.37 N ATOM 1582 CA THR A 998 21.608 -7.499 -24.121 1.00 35.15 C ATOM 1583 C THR A 998 23.013 -7.388 -23.529 1.00 42.66 C ATOM 1584 O THR A 998 23.234 -6.674 -22.543 1.00 44.13 O ATOM 1585 CB THR A 998 20.597 -6.483 -23.563 1.00 44.37 C ATOM 1586 H THR A 998 20.935 -9.173 -22.957 1.00 0.00 H ATOM 1587 N LYS A 999 23.954 -8.135 -24.128 1.00 39.56 N ATOM 1588 CA LYS A 999 25.365 -8.194 -23.748 1.00 70.19 C ATOM 1589 C LYS A 999 26.180 -7.298 -24.683 1.00109.86 C ATOM 1590 O LYS A 999 26.464 -6.149 -24.351 1.00 78.79 O ATOM 1591 CB LYS A 999 25.866 -9.645 -23.836 1.00 72.53 C ATOM 1592 CG LYS A 999 27.158 -9.918 -23.072 1.00 85.05 C ATOM 1593 CD LYS A 999 27.684 -11.334 -23.316 1.00 93.89 C ATOM 1594 CE LYS A 999 27.274 -12.327 -22.250 1.00103.49 C ATOM 1595 NZ LYS A 999 25.870 -12.787 -22.419 1.00112.07 N ATOM 1596 HZ1 LYS A 999 25.230 -11.970 -22.363 1.00 0.00 H ATOM 1597 HZ2 LYS A 999 25.766 -13.247 -23.346 1.00 0.00 H ATOM 1598 HZ3 LYS A 999 25.636 -13.465 -21.666 1.00 0.00 H ATOM 1599 H LYS A 999 23.654 -8.723 -24.932 1.00 0.00 H TER 1600 LYS A 999 ATOM 1601 N PRO A1013 19.240 5.166 -18.954 1.00 28.47 N ATOM 1602 CA PRO A1013 19.489 4.944 -17.518 1.00 28.42 C ATOM 1603 C PRO A1013 18.598 3.858 -16.911 1.00 30.77 C ATOM 1604 O PRO A1013 19.084 3.028 -16.147 1.00 28.77 O ATOM 1605 CB PRO A1013 19.255 6.323 -16.887 1.00 30.56 C ATOM 1606 CG PRO A1013 19.474 7.285 -17.987 1.00 35.02 C ATOM 1607 CD PRO A1013 19.133 6.601 -19.283 1.00 30.88 C ATOM 1608 HN2 PRO A1013 18.352 4.694 -19.218 1.00 0.00 H ATOM 1609 HN1 PRO A1013 20.025 4.754 -19.498 1.00 0.00 H ATOM 1610 N GLY A1014 17.317 3.828 -17.286 1.00 27.58 N ATOM 1611 CA GLY A1014 16.394 2.812 -16.788 1.00 27.45 C ATOM 1612 C GLY A1014 16.793 1.386 -17.140 1.00 31.79 C ATOM 1613 O GLY A1014 16.372 0.444 -16.470 1.00 33.75 O ATOM 1614 H GLY A1014 16.967 4.547 -17.951 1.00 0.00 H ATOM 1615 N GLU A1015 17.628 1.217 -18.189 1.00 26.87 N ATOM 1616 CA GLU A1015 18.091 -0.081 -18.678 1.00 26.52 C ATOM 1617 C GLU A1015 19.513 -0.440 -18.222 1.00 27.06 C ATOM 1618 O GLU A1015 20.002 -1.527 -18.544 1.00 26.67 O ATOM 1619 CB GLU A1015 18.000 -0.113 -20.213 1.00 28.97 C ATOM 1620 H GLU A1015 17.964 2.068 -18.682 1.00 0.00 H ATOM 1621 N SER A1016 20.163 0.453 -17.457 1.00 21.70 N ATOM 1622 CA SER A1016 21.528 0.237 -16.995 1.00 18.41 C ATOM 1623 C SER A1016 21.701 -0.775 -15.848 1.00 18.67 C ATOM 1624 O SER A1016 21.072 -0.639 -14.793 1.00 18.65 O ATOM 1625 CB SER A1016 22.178 1.557 -16.597 1.00 17.74 C ATOM 1626 OG SER A1016 23.548 1.346 -16.321 1.00 18.51 O ATOM 1627 HG SER A1016 23.968 2.205 -16.063 1.00 0.00 H ATOM 1628 H SER A1016 19.674 1.330 -17.185 1.00 0.00 H ATOM 1629 N PRO A1017 22.697 -1.676 -15.983 1.00 15.63 N ATOM 1630 CA PRO A1017 22.964 -2.646 -14.904 1.00 15.02 C ATOM 1631 C PRO A1017 23.737 -2.041 -13.724 1.00 12.97 C ATOM 1632 O PRO A1017 23.864 -2.694 -12.691 1.00 12.37 O ATOM 1633 CB PRO A1017 23.808 -3.712 -15.620 1.00 18.21 C ATOM 1634 CG PRO A1017 24.533 -2.961 -16.701 1.00 22.78 C ATOM 1635 CD PRO A1017 23.554 -1.932 -17.170 1.00 18.66 C ATOM 1636 N ILE A1018 24.252 -0.788 -13.855 1.00 11.11 N ATOM 1637 CA ILE A1018 25.105 -0.196 -12.822 1.00 10.93 C ATOM 1638 C ILE A1018 24.444 -0.055 -11.488 1.00 10.25 C ATOM 1639 O ILE A1018 25.125 0.005 -10.477 1.00 10.23 O ATOM 1640 CB ILE A1018 25.746 1.147 -13.261 1.00 13.39 C ATOM 1641 CG1 ILE A1018 24.681 2.243 -13.432 1.00 13.13 C ATOM 1642 CG2 ILE A1018 26.572 0.945 -14.565 1.00 13.93 C ATOM 1643 CD1 ILE A1018 25.253 3.678 -13.719 1.00 17.38 C ATOM 1644 H ILE A1018 24.034 -0.237 -14.710 1.00 0.00 H ATOM 1645 N PHE A1019 23.107 0.023 -11.476 1.00 9.61 N ATOM 1646 CA PHE A1019 22.376 0.270 -10.253 1.00 9.33 C ATOM 1647 C PHE A1019 22.297 -0.919 -9.324 1.00 9.41 C ATOM 1648 O PHE A1019 21.777 -0.777 -8.224 1.00 10.38 O ATOM 1649 CB PHE A1019 20.989 0.847 -10.567 1.00 10.33 C ATOM 1650 CG PHE A1019 21.081 2.146 -11.337 1.00 10.35 C ATOM 1651 CD1 PHE A1019 21.580 3.294 -10.733 1.00 11.67 C ATOM 1652 CD2 PHE A1019 20.703 2.213 -12.677 1.00 12.81 C ATOM 1653 CE1 PHE A1019 21.670 4.497 -11.441 1.00 12.28 C ATOM 1654 CE2 PHE A1019 20.800 3.418 -13.388 1.00 15.22 C ATOM 1655 CZ PHE A1019 21.283 4.547 -12.766 1.00 13.25 C ATOM 1656 H PHE A1019 22.583 -0.097 -12.366 1.00 0.00 H ATOM 1657 N TRP A1020 22.888 -2.056 -9.728 1.00 8.55 N ATOM 1658 CA TRP A1020 23.006 -3.261 -8.902 1.00 8.62 C ATOM 1659 C TRP A1020 24.450 -3.492 -8.484 1.00 10.05 C ATOM 1660 O TRP A1020 24.706 -4.387 -7.684 1.00 10.30 O ATOM 1661 CB TRP A1020 22.498 -4.494 -9.671 1.00 9.01 C ATOM 1662 CG TRP A1020 20.998 -4.578 -9.734 1.00 8.79 C ATOM 1663 CD1 TRP A1020 20.198 -5.413 -9.003 1.00 9.95 C ATOM 1664 CD2 TRP A1020 20.119 -3.837 -10.597 1.00 9.16 C ATOM 1665 NE1 TRP A1020 18.874 -5.170 -9.288 1.00 9.47 N ATOM 1666 CE2 TRP A1020 18.792 -4.209 -10.259 1.00 9.86 C ATOM 1667 CE3 TRP A1020 20.316 -2.862 -11.591 1.00 10.25 C ATOM 1668 CZ2 TRP A1020 17.667 -3.650 -10.898 1.00 9.97 C ATOM 1669 CZ3 TRP A1020 19.206 -2.300 -12.210 1.00 10.68 C ATOM 1670 CH2 TRP A1020 17.894 -2.689 -11.847 1.00 10.53 C ATOM 1671 HE1 TRP A1020 18.064 -5.642 -8.837 1.00 0.00 H ATOM 1672 H TRP A1020 23.287 -2.083 -10.688 1.00 0.00 H ATOM 1673 N TYR A1021 25.403 -2.709 -9.007 1.00 9.50 N ATOM 1674 CA TYR A1021 26.810 -2.987 -8.783 1.00 8.83 C ATOM 1675 C TYR A1021 27.374 -2.445 -7.499 1.00 9.24 C ATOM 1676 O TYR A1021 27.084 -1.297 -7.085 1.00 9.89 O ATOM 1677 CB TYR A1021 27.659 -2.465 -9.957 1.00 10.83 C ATOM 1678 CG TYR A1021 27.473 -3.154 -11.288 1.00 10.68 C ATOM 1679 CD1 TYR A1021 26.791 -4.365 -11.388 1.00 12.42 C ATOM 1680 CD2 TYR A1021 28.065 -2.643 -12.438 1.00 13.00 C ATOM 1681 CE1 TYR A1021 26.633 -5.009 -12.616 1.00 13.34 C ATOM 1682 CE2 TYR A1021 27.939 -3.291 -13.666 1.00 13.99 C ATOM 1683 CZ TYR A1021 27.225 -4.470 -13.748 1.00 15.22 C ATOM 1684 OH TYR A1021 27.089 -5.079 -14.978 1.00 17.93 O ATOM 1685 HH TYR A1021 26.556 -5.907 -14.878 1.00 0.00 H ATOM 1686 H TYR A1021 25.130 -1.888 -9.584 1.00 0.00 H ATOM 1687 N ALA A1022 28.273 -3.234 -6.893 1.00 8.22 N ATOM 1688 CA ALA A1022 28.970 -2.802 -5.695 1.00 8.84 C ATOM 1689 C ALA A1022 29.926 -1.632 -6.036 1.00 10.07 C ATOM 1690 O ALA A1022 30.378 -1.530 -7.180 1.00 9.99 O ATOM 1691 CB ALA A1022 29.756 -3.957 -5.126 1.00 9.40 C ATOM 1692 H ALA A1022 28.475 -4.174 -7.289 1.00 0.00 H ATOM 1693 N PRO A1023 30.263 -0.779 -5.056 1.00 9.45 N ATOM 1694 CA PRO A1023 31.152 0.368 -5.339 1.00 9.47 C ATOM 1695 C PRO A1023 32.481 -0.048 -5.906 1.00 12.05 C ATOM 1696 O PRO A1023 32.967 0.617 -6.846 1.00 11.56 O ATOM 1697 CB PRO A1023 31.312 1.058 -3.989 1.00 11.61 C ATOM 1698 CG PRO A1023 30.120 0.652 -3.190 1.00 16.20 C ATOM 1699 CD PRO A1023 29.758 -0.749 -3.669 1.00 11.10 C ATOM 1700 N GLU A1024 33.078 -1.156 -5.426 1.00 10.46 N ATOM 1701 CA GLU A1024 34.382 -1.571 -5.975 1.00 10.73 C ATOM 1702 C GLU A1024 34.262 -2.137 -7.375 1.00 12.04 C ATOM 1703 O GLU A1024 35.254 -2.205 -8.125 1.00 12.20 O ATOM 1704 CB GLU A1024 35.134 -2.547 -5.043 1.00 11.83 C ATOM 1705 CG GLU A1024 34.517 -3.946 -4.884 1.00 10.89 C ATOM 1706 CD GLU A1024 33.229 -4.113 -4.076 1.00 11.59 C ATOM 1707 OE1 GLU A1024 32.735 -3.133 -3.475 1.00 10.47 O ATOM 1708 OE2 GLU A1024 32.743 -5.270 -4.024 1.00 10.74 O ATOM 1709 H GLU A1024 32.623 -1.714 -4.675 1.00 0.00 H ATOM 1710 N SER A1025 33.050 -2.604 -7.751 1.00 9.91 N ATOM 1711 CA SER A1025 32.836 -3.049 -9.120 1.00 10.21 C ATOM 1712 C SER A1025 32.775 -1.823 -10.029 1.00 13.10 C ATOM 1713 O SER A1025 33.367 -1.836 -11.114 1.00 12.69 O ATOM 1714 CB SER A1025 31.551 -3.852 -9.224 1.00 11.49 C ATOM 1715 OG SER A1025 31.604 -4.947 -8.318 1.00 11.26 O ATOM 1716 HG SER A1025 30.767 -5.471 -8.386 1.00 0.00 H ATOM 1717 H SER A1025 32.272 -2.645 -7.063 1.00 0.00 H ATOM 1718 N LEU A1026 32.102 -0.760 -9.582 1.00 10.88 N ATOM 1719 CA LEU A1026 32.015 0.492 -10.342 1.00 11.65 C ATOM 1720 C LEU A1026 33.371 1.165 -10.469 1.00 13.83 C ATOM 1721 O LEU A1026 33.671 1.685 -11.555 1.00 15.45 O ATOM 1722 CB LEU A1026 31.062 1.452 -9.642 1.00 11.29 C ATOM 1723 CG LEU A1026 29.582 1.047 -9.642 1.00 13.50 C ATOM 1724 CD1 LEU A1026 28.773 1.933 -8.733 1.00 14.91 C ATOM 1725 CD2 LEU A1026 28.990 1.107 -11.067 1.00 15.57 C ATOM 1726 H LEU A1026 31.622 -0.822 -8.661 1.00 0.00 H ATOM 1727 N THR A1027 34.167 1.209 -9.412 1.00 11.98 N ATOM 1728 CA THR A1027 35.413 1.970 -9.458 1.00 13.21 C ATOM 1729 C THR A1027 36.585 1.173 -9.956 1.00 17.57 C ATOM 1730 O THR A1027 37.521 1.799 -10.474 1.00 18.23 O ATOM 1731 CB THR A1027 35.761 2.506 -8.067 1.00 14.37 C ATOM 1732 OG1 THR A1027 35.924 1.397 -7.187 1.00 15.33 O ATOM 1733 CG2 THR A1027 34.738 3.457 -7.512 1.00 13.54 C ATOM 1734 HG1 THR A1027 36.150 1.726 -6.281 1.00 0.00 H ATOM 1735 H THR A1027 33.904 0.699 -8.545 1.00 0.00 H ATOM 1736 N GLU A1028 36.635 -0.154 -9.712 1.00 14.58 N ATOM 1737 CA GLU A1028 37.814 -0.968 -10.040 1.00 14.83 C ATOM 1738 C GLU A1028 37.520 -2.187 -10.898 1.00 16.30 C ATOM 1739 O GLU A1028 38.437 -2.972 -11.176 1.00 17.31 O ATOM 1740 CB GLU A1028 38.542 -1.385 -8.764 1.00 16.94 C ATOM 1741 CG GLU A1028 39.220 -0.246 -8.023 1.00 27.54 C ATOM 1742 CD GLU A1028 39.947 -0.727 -6.784 1.00 51.74 C ATOM 1743 OE1 GLU A1028 39.344 -0.689 -5.688 1.00 47.60 O ATOM 1744 OE2 GLU A1028 41.101 -1.196 -6.920 1.00 45.93 O ATOM 1745 H GLU A1028 35.811 -0.616 -9.277 1.00 0.00 H ATOM 1746 N SER A1029 36.253 -2.374 -11.315 1.00 14.67 N ATOM 1747 CA SER A1029 35.844 -3.534 -12.101 1.00 15.12 C ATOM 1748 C SER A1029 36.129 -4.828 -11.314 1.00 16.38 C ATOM 1749 O SER A1029 36.401 -5.870 -11.907 1.00 17.16 O ATOM 1750 CB SER A1029 36.483 -3.509 -13.495 1.00 19.39 C ATOM 1751 OG SER A1029 35.999 -2.400 -14.235 1.00 23.51 O ATOM 1752 HG SER A1029 36.418 -2.395 -15.132 1.00 0.00 H ATOM 1753 H SER A1029 35.536 -1.662 -11.067 1.00 0.00 H ATOM 1754 N LYS A1030 36.035 -4.763 -9.957 1.00 14.24 N ATOM 1755 CA LYS A1030 36.268 -5.921 -9.110 1.00 13.20 C ATOM 1756 C LYS A1030 34.946 -6.587 -8.800 1.00 14.08 C ATOM 1757 O LYS A1030 34.113 -6.027 -8.071 1.00 13.41 O ATOM 1758 CB LYS A1030 36.965 -5.546 -7.800 1.00 15.66 C ATOM 1759 CG LYS A1030 38.442 -5.218 -7.997 1.00 21.18 C ATOM 1760 CD LYS A1030 39.096 -4.884 -6.677 1.00 24.49 C ATOM 1761 CE LYS A1030 40.559 -4.506 -6.868 1.00 29.58 C ATOM 1762 NZ LYS A1030 41.213 -4.152 -5.579 1.00 46.32 N ATOM 1763 HZ1 LYS A1030 40.720 -3.342 -5.152 1.00 0.00 H ATOM 1764 HZ2 LYS A1030 41.168 -4.966 -4.934 1.00 0.00 H ATOM 1765 HZ3 LYS A1030 42.207 -3.901 -5.753 1.00 0.00 H ATOM 1766 H LYS A1030 35.789 -3.856 -9.512 1.00 0.00 H ATOM 1767 N PHE A1031 34.759 -7.756 -9.383 1.00 11.94 N ATOM 1768 CA PHE A1031 33.566 -8.560 -9.158 1.00 11.11 C ATOM 1769 C PHE A1031 33.951 -9.787 -8.384 1.00 12.71 C ATOM 1770 O PHE A1031 34.989 -10.417 -8.670 1.00 14.82 O ATOM 1771 CB PHE A1031 32.884 -8.934 -10.473 1.00 12.96 C ATOM 1772 CG PHE A1031 32.282 -7.756 -11.196 1.00 12.51 C ATOM 1773 CD1 PHE A1031 33.044 -6.989 -12.075 1.00 14.05 C ATOM 1774 CD2 PHE A1031 30.948 -7.417 -11.015 1.00 12.67 C ATOM 1775 CE1 PHE A1031 32.479 -5.901 -12.751 1.00 14.30 C ATOM 1776 CE2 PHE A1031 30.390 -6.327 -11.686 1.00 13.46 C ATOM 1777 CZ PHE A1031 31.153 -5.586 -12.560 1.00 13.44 C ATOM 1778 H PHE A1031 35.491 -8.117 -10.027 1.00 0.00 H ATOM 1779 N SER A1032 33.147 -10.149 -7.392 1.00 10.25 N ATOM 1780 CA SER A1032 33.482 -11.226 -6.497 1.00 9.46 C ATOM 1781 C SER A1032 32.204 -11.777 -5.907 1.00 10.77 C ATOM 1782 O SER A1032 31.113 -11.232 -6.113 1.00 9.49 O ATOM 1783 CB SER A1032 34.332 -10.682 -5.352 1.00 11.28 C ATOM 1784 OG SER A1032 33.590 -9.726 -4.594 1.00 11.18 O ATOM 1785 HG SER A1032 33.322 -8.976 -5.182 1.00 0.00 H ATOM 1786 H SER A1032 32.250 -9.640 -7.257 1.00 0.00 H ATOM 1787 N VAL A1033 32.337 -12.800 -5.076 1.00 9.57 N ATOM 1788 CA VAL A1033 31.185 -13.311 -4.329 1.00 9.19 C ATOM 1789 C VAL A1033 30.627 -12.150 -3.503 1.00 9.07 C ATOM 1790 O VAL A1033 29.392 -12.003 -3.395 1.00 8.71 O ATOM 1791 CB VAL A1033 31.594 -14.498 -3.437 1.00 11.57 C ATOM 1792 CG1 VAL A1033 30.489 -14.853 -2.448 1.00 12.23 C ATOM 1793 CG2 VAL A1033 31.918 -15.716 -4.293 1.00 11.53 C ATOM 1794 H VAL A1033 33.269 -13.245 -4.953 1.00 0.00 H ATOM 1795 N ALA A1034 31.499 -11.340 -2.874 1.00 9.15 N ATOM 1796 CA ALA A1034 31.024 -10.242 -2.055 1.00 8.61 C ATOM 1797 C ALA A1034 30.266 -9.189 -2.858 1.00 8.03 C ATOM 1798 O ALA A1034 29.341 -8.566 -2.321 1.00 8.22 O ATOM 1799 CB ALA A1034 32.180 -9.600 -1.306 1.00 10.25 C ATOM 1800 H ALA A1034 32.521 -11.503 -2.976 1.00 0.00 H ATOM 1801 N SER A1035 30.638 -8.950 -4.136 1.00 8.27 N ATOM 1802 CA SER A1035 29.833 -8.027 -4.915 1.00 8.29 C ATOM 1803 C SER A1035 28.518 -8.679 -5.324 1.00 8.64 C ATOM 1804 O SER A1035 27.511 -7.978 -5.465 1.00 8.27 O ATOM 1805 CB SER A1035 30.591 -7.417 -6.087 1.00 8.47 C ATOM 1806 OG SER A1035 31.018 -8.380 -7.025 1.00 9.34 O ATOM 1807 HG SER A1035 30.230 -8.856 -7.389 1.00 0.00 H ATOM 1808 H SER A1035 31.474 -9.413 -4.547 1.00 0.00 H ATOM 1809 N ASP A1036 28.485 -10.028 -5.461 1.00 7.81 N ATOM 1810 CA ASP A1036 27.186 -10.673 -5.669 1.00 6.67 C ATOM 1811 C ASP A1036 26.314 -10.490 -4.424 1.00 7.69 C ATOM 1812 O ASP A1036 25.096 -10.344 -4.564 1.00 7.28 O ATOM 1813 CB ASP A1036 27.375 -12.158 -5.947 1.00 7.46 C ATOM 1814 CG ASP A1036 27.806 -12.516 -7.349 1.00 8.47 C ATOM 1815 OD1 ASP A1036 27.673 -11.666 -8.265 1.00 8.97 O ATOM 1816 OD2 ASP A1036 28.228 -13.681 -7.551 1.00 9.26 O ATOM 1817 H ASP A1036 29.359 -10.590 -5.419 1.00 0.00 H ATOM 1818 N VAL A1037 26.899 -10.453 -3.211 1.00 6.62 N ATOM 1819 CA VAL A1037 26.104 -10.189 -2.015 1.00 6.89 C ATOM 1820 C VAL A1037 25.531 -8.769 -2.039 1.00 7.47 C ATOM 1821 O VAL A1037 24.340 -8.569 -1.724 1.00 7.02 O ATOM 1822 CB VAL A1037 26.926 -10.491 -0.751 1.00 8.00 C ATOM 1823 CG1 VAL A1037 26.241 -9.916 0.499 1.00 8.19 C ATOM 1824 CG2 VAL A1037 27.140 -12.014 -0.610 1.00 8.13 C ATOM 1825 H VAL A1037 27.923 -10.613 -3.126 1.00 0.00 H ATOM 1826 N TRP A1038 26.338 -7.802 -2.493 1.00 7.32 N ATOM 1827 CA TRP A1038 25.815 -6.443 -2.603 1.00 7.30 C ATOM 1828 C TRP A1038 24.613 -6.461 -3.575 1.00 7.77 C ATOM 1829 O TRP A1038 23.561 -5.887 -3.279 1.00 7.26 O ATOM 1830 CB TRP A1038 26.935 -5.532 -3.144 1.00 7.35 C ATOM 1831 CG TRP A1038 26.443 -4.136 -3.448 1.00 7.42 C ATOM 1832 CD1 TRP A1038 25.644 -3.755 -4.492 1.00 9.49 C ATOM 1833 CD2 TRP A1038 26.740 -2.941 -2.706 1.00 7.68 C ATOM 1834 NE1 TRP A1038 25.380 -2.396 -4.416 1.00 8.87 N ATOM 1835 CE2 TRP A1038 26.070 -1.870 -3.346 1.00 9.11 C ATOM 1836 CE3 TRP A1038 27.540 -2.672 -1.589 1.00 8.37 C ATOM 1837 CZ2 TRP A1038 26.141 -0.558 -2.863 1.00 9.00 C ATOM 1838 CZ3 TRP A1038 27.641 -1.358 -1.141 1.00 9.43 C ATOM 1839 CH2 TRP A1038 26.917 -0.336 -1.751 1.00 9.60 C ATOM 1840 HE1 TRP A1038 24.763 -1.862 -5.060 1.00 0.00 H ATOM 1841 H TRP A1038 27.320 -8.015 -2.762 1.00 0.00 H ATOM 1842 N SER A1039 24.771 -7.085 -4.754 1.00 7.43 N ATOM 1843 CA SER A1039 23.672 -7.116 -5.730 1.00 6.50 C ATOM 1844 C SER A1039 22.452 -7.846 -5.178 1.00 7.91 C ATOM 1845 O SER A1039 21.324 -7.426 -5.449 1.00 8.07 O ATOM 1846 CB SER A1039 24.135 -7.799 -7.004 1.00 8.45 C ATOM 1847 OG SER A1039 25.184 -7.046 -7.612 1.00 11.43 O ATOM 1848 HG SER A1039 24.853 -6.139 -7.831 1.00 0.00 H ATOM 1849 H SER A1039 25.675 -7.548 -4.977 1.00 0.00 H ATOM 1850 N PHE A1040 22.676 -8.913 -4.413 1.00 7.86 N ATOM 1851 CA PHE A1040 21.580 -9.595 -3.737 1.00 7.53 C ATOM 1852 C PHE A1040 20.804 -8.604 -2.844 1.00 8.21 C ATOM 1853 O PHE A1040 19.563 -8.652 -2.761 1.00 7.66 O ATOM 1854 CB PHE A1040 22.111 -10.793 -2.921 1.00 8.74 C ATOM 1855 CG PHE A1040 21.104 -11.277 -1.907 1.00 8.74 C ATOM 1856 CD1 PHE A1040 20.054 -12.114 -2.284 1.00 9.99 C ATOM 1857 CD2 PHE A1040 21.117 -10.782 -0.614 1.00 9.20 C ATOM 1858 CE1 PHE A1040 19.060 -12.451 -1.360 1.00 10.72 C ATOM 1859 CE2 PHE A1040 20.160 -11.174 0.318 1.00 10.92 C ATOM 1860 CZ PHE A1040 19.112 -11.955 -0.069 1.00 10.48 C ATOM 1861 H PHE A1040 23.648 -9.265 -4.296 1.00 0.00 H ATOM 1862 N GLY A1041 21.507 -7.710 -2.143 1.00 7.66 N ATOM 1863 CA GLY A1041 20.818 -6.714 -1.334 1.00 7.46 C ATOM 1864 C GLY A1041 19.888 -5.869 -2.196 1.00 8.12 C ATOM 1865 O GLY A1041 18.759 -5.525 -1.778 1.00 7.61 O ATOM 1866 H GLY A1041 22.546 -7.725 -2.175 1.00 0.00 H ATOM 1867 N VAL A1042 20.330 -5.517 -3.420 1.00 7.32 N ATOM 1868 CA VAL A1042 19.446 -4.796 -4.356 1.00 7.32 C ATOM 1869 C VAL A1042 18.263 -5.668 -4.800 1.00 8.42 C ATOM 1870 O VAL A1042 17.139 -5.159 -4.901 1.00 8.32 O ATOM 1871 CB VAL A1042 20.231 -4.224 -5.551 1.00 8.11 C ATOM 1872 CG1 VAL A1042 19.348 -3.321 -6.426 1.00 8.22 C ATOM 1873 CG2 VAL A1042 21.456 -3.424 -5.065 1.00 8.17 C ATOM 1874 H VAL A1042 21.301 -5.755 -3.707 1.00 0.00 H ATOM 1875 N VAL A1043 18.482 -6.976 -5.037 1.00 7.31 N ATOM 1876 CA VAL A1043 17.359 -7.874 -5.359 1.00 7.63 C ATOM 1877 C VAL A1043 16.354 -7.891 -4.193 1.00 8.59 C ATOM 1878 O VAL A1043 15.137 -7.852 -4.448 1.00 7.94 O ATOM 1879 CB VAL A1043 17.905 -9.297 -5.623 1.00 9.08 C ATOM 1880 CG1 VAL A1043 16.787 -10.348 -5.647 1.00 10.02 C ATOM 1881 CG2 VAL A1043 18.684 -9.343 -6.923 1.00 9.16 C ATOM 1882 H VAL A1043 19.450 -7.354 -4.992 1.00 0.00 H ATOM 1883 N LEU A1044 16.836 -7.951 -2.952 1.00 7.36 N ATOM 1884 CA LEU A1044 15.934 -7.976 -1.803 1.00 7.94 C ATOM 1885 C LEU A1044 15.114 -6.658 -1.768 1.00 8.80 C ATOM 1886 O LEU A1044 13.890 -6.682 -1.529 1.00 8.66 O ATOM 1887 CB LEU A1044 16.778 -8.177 -0.553 1.00 8.26 C ATOM 1888 CG LEU A1044 15.977 -8.265 0.751 1.00 9.98 C ATOM 1889 CD1 LEU A1044 14.877 -9.335 0.669 1.00 10.56 C ATOM 1890 CD2 LEU A1044 16.900 -8.568 1.897 1.00 10.64 C ATOM 1891 H LEU A1044 17.864 -7.980 -2.800 1.00 0.00 H ATOM 1892 N TYR A1045 15.752 -5.522 -2.063 1.00 7.92 N ATOM 1893 CA TYR A1045 15.052 -4.246 -2.193 1.00 7.46 C ATOM 1894 C TYR A1045 13.988 -4.352 -3.309 1.00 9.60 C ATOM 1895 O TYR A1045 12.828 -3.950 -3.100 1.00 9.07 O ATOM 1896 CB TYR A1045 16.088 -3.152 -2.530 1.00 8.31 C ATOM 1897 CG TYR A1045 15.421 -1.850 -2.907 1.00 7.97 C ATOM 1898 CD1 TYR A1045 15.072 -0.913 -1.935 1.00 8.80 C ATOM 1899 CD2 TYR A1045 15.099 -1.571 -4.232 1.00 9.55 C ATOM 1900 CE1 TYR A1045 14.407 0.264 -2.280 1.00 10.31 C ATOM 1901 CE2 TYR A1045 14.467 -0.384 -4.588 1.00 9.33 C ATOM 1902 CZ TYR A1045 14.116 0.522 -3.601 1.00 10.73 C ATOM 1903 OH TYR A1045 13.454 1.688 -3.914 1.00 13.87 O ATOM 1904 HH TYR A1045 12.590 1.470 -4.346 1.00 0.00 H ATOM 1905 H TYR A1045 16.782 -5.547 -2.205 1.00 0.00 H ATOM 1906 N GLU A1046 14.351 -4.882 -4.485 1.00 7.81 N ATOM 1907 CA GLU A1046 13.381 -5.001 -5.595 1.00 8.09 C ATOM 1908 C GLU A1046 12.174 -5.807 -5.144 1.00 9.05 C ATOM 1909 O GLU A1046 11.025 -5.442 -5.434 1.00 9.57 O ATOM 1910 CB GLU A1046 14.005 -5.709 -6.805 1.00 8.64 C ATOM 1911 CG GLU A1046 15.091 -4.935 -7.549 1.00 8.39 C ATOM 1912 CD GLU A1046 15.503 -5.771 -8.750 1.00 9.04 C ATOM 1913 OE1 GLU A1046 14.832 -5.640 -9.804 1.00 10.11 O ATOM 1914 OE2 GLU A1046 16.442 -6.597 -8.636 1.00 9.03 O ATOM 1915 H GLU A1046 15.327 -5.214 -4.619 1.00 0.00 H ATOM 1916 N LEU A1047 12.409 -6.915 -4.453 1.00 8.38 N ATOM 1917 CA LEU A1047 11.293 -7.742 -3.991 1.00 9.45 C ATOM 1918 C LEU A1047 10.359 -6.940 -3.099 1.00 10.55 C ATOM 1919 O LEU A1047 9.150 -6.980 -3.322 1.00 11.24 O ATOM 1920 CB LEU A1047 11.822 -8.948 -3.200 1.00 9.22 C ATOM 1921 CG LEU A1047 12.472 -10.026 -4.047 1.00 11.89 C ATOM 1922 CD1 LEU A1047 13.214 -11.010 -3.168 1.00 13.45 C ATOM 1923 CD2 LEU A1047 11.439 -10.785 -4.846 1.00 18.97 C ATOM 1924 H LEU A1047 13.387 -7.196 -4.239 1.00 0.00 H ATOM 1925 N PHE A1048 10.891 -6.217 -2.128 1.00 10.07 N ATOM 1926 CA PHE A1048 10.051 -5.473 -1.187 1.00 10.36 C ATOM 1927 C PHE A1048 9.436 -4.201 -1.737 1.00 14.55 C ATOM 1928 O PHE A1048 8.508 -3.675 -1.104 1.00 16.11 O ATOM 1929 CB PHE A1048 10.780 -5.309 0.148 1.00 11.09 C ATOM 1930 CG PHE A1048 10.638 -6.563 0.984 1.00 11.31 C ATOM 1931 CD1 PHE A1048 11.413 -7.692 0.721 1.00 11.27 C ATOM 1932 CD2 PHE A1048 9.627 -6.669 1.935 1.00 12.33 C ATOM 1933 CE1 PHE A1048 11.224 -8.875 1.452 1.00 11.32 C ATOM 1934 CE2 PHE A1048 9.448 -7.844 2.667 1.00 12.45 C ATOM 1935 CZ PHE A1048 10.236 -8.942 2.414 1.00 10.86 C ATOM 1936 H PHE A1048 11.926 -6.176 -2.031 1.00 0.00 H ATOM 1937 N THR A1049 9.833 -3.742 -2.934 1.00 11.98 N ATOM 1938 CA THR A1049 9.180 -2.592 -3.589 1.00 13.67 C ATOM 1939 C THR A1049 8.097 -3.012 -4.507 1.00 20.66 C ATOM 1940 O THR A1049 7.426 -2.126 -5.049 1.00 23.83 O ATOM 1941 CB THR A1049 10.082 -1.922 -4.600 1.00 21.69 C ATOM 1942 OG1 THR A1049 10.348 -2.805 -5.726 1.00 22.07 O ATOM 1943 CG2 THR A1049 11.224 -1.317 -3.997 1.00 19.27 C ATOM 1944 HG1 THR A1049 10.791 -3.629 -5.401 1.00 0.00 H ATOM 1945 H THR A1049 10.626 -4.212 -3.415 1.00 0.00 H ATOM 1946 N TYR A1050 7.898 -4.370 -4.703 1.00 15.65 N ATOM 1947 CA TYR A1050 6.934 -5.103 -5.577 1.00 15.62 C ATOM 1948 C TYR A1050 6.966 -4.679 -7.077 1.00 18.52 C ATOM 1949 O TYR A1050 5.998 -4.893 -7.827 1.00 17.70 O ATOM 1950 CB TYR A1050 5.492 -4.986 -5.025 1.00 16.51 C ATOM 1951 CG TYR A1050 5.136 -6.022 -3.979 1.00 17.60 C ATOM 1952 CD1 TYR A1050 4.668 -7.280 -4.344 1.00 19.93 C ATOM 1953 CD2 TYR A1050 5.221 -5.728 -2.622 1.00 17.50 C ATOM 1954 CE1 TYR A1050 4.324 -8.229 -3.384 1.00 20.80 C ATOM 1955 CE2 TYR A1050 4.894 -6.674 -1.653 1.00 18.06 C ATOM 1956 CZ TYR A1050 4.448 -7.924 -2.040 1.00 25.53 C ATOM 1957 OH TYR A1050 4.109 -8.853 -1.089 1.00 26.08 O ATOM 1958 HH TYR A1050 3.374 -8.497 -0.529 1.00 0.00 H ATOM 1959 H TYR A1050 8.527 -4.983 -4.146 1.00 0.00 H ATOM 1960 N ILE A1051 8.084 -4.090 -7.504 1.00 14.74 N ATOM 1961 CA ILE A1051 8.311 -3.482 -8.828 1.00 14.31 C ATOM 1962 C ILE A1051 7.264 -2.362 -9.093 1.00 17.23 C ATOM 1963 O ILE A1051 6.782 -2.199 -10.220 1.00 17.35 O ATOM 1964 CB ILE A1051 8.546 -4.442 -10.046 1.00 17.71 C ATOM 1965 CG1 ILE A1051 9.246 -5.770 -9.710 1.00 17.40 C ATOM 1966 CG2 ILE A1051 9.253 -3.732 -11.223 1.00 17.99 C ATOM 1967 CD1 ILE A1051 10.743 -5.723 -9.173 1.00 15.31 C ATOM 1968 H ILE A1051 8.878 -4.056 -6.833 1.00 0.00 H ATOM 1969 N GLU A1052 6.907 -1.609 -8.026 1.00 15.49 N ATOM 1970 CA GLU A1052 5.983 -0.470 -8.088 1.00 16.28 C ATOM 1971 C GLU A1052 6.615 0.586 -8.977 1.00 21.75 C ATOM 1972 O GLU A1052 7.842 0.787 -8.935 1.00 20.10 O ATOM 1973 CB GLU A1052 5.742 0.120 -6.675 1.00 17.72 C ATOM 1974 CG GLU A1052 4.762 1.289 -6.609 1.00 26.88 C ATOM 1975 CD GLU A1052 4.690 2.093 -5.321 1.00 47.57 C ATOM 1976 OE1 GLU A1052 4.963 1.534 -4.234 1.00 27.88 O ATOM 1977 OE2 GLU A1052 4.309 3.283 -5.397 1.00 46.05 O ATOM 1978 H GLU A1052 7.314 -1.854 -7.101 1.00 0.00 H ATOM 1979 N LYS A1053 5.775 1.271 -9.772 1.00 23.28 N ATOM 1980 CA LYS A1053 6.223 2.338 -10.649 1.00 24.58 C ATOM 1981 C LYS A1053 6.910 3.435 -9.848 1.00 31.46 C ATOM 1982 O LYS A1053 6.383 3.926 -8.845 1.00 31.72 O ATOM 1983 CB LYS A1053 5.074 2.899 -11.517 1.00 27.30 C ATOM 1984 CG LYS A1053 5.553 3.549 -12.824 1.00 39.43 C ATOM 1985 CD LYS A1053 6.090 2.531 -13.840 1.00 49.76 C ATOM 1986 CE LYS A1053 7.208 3.099 -14.680 1.00 57.25 C ATOM 1987 NZ LYS A1053 7.914 2.038 -15.444 1.00 64.09 N ATOM 1988 HZ1 LYS A1053 8.320 1.347 -14.781 1.00 0.00 H ATOM 1989 HZ2 LYS A1053 7.240 1.560 -16.075 1.00 0.00 H ATOM 1990 HZ3 LYS A1053 8.675 2.467 -16.009 1.00 0.00 H ATOM 1991 H LYS A1053 4.764 1.027 -9.758 1.00 0.00 H ATOM 1992 N SER A1054 8.145 3.724 -10.262 1.00 29.12 N ATOM 1993 CA SER A1054 9.077 4.741 -9.762 1.00 29.01 C ATOM 1994 C SER A1054 9.913 4.308 -8.548 1.00 24.80 C ATOM 1995 O SER A1054 10.713 5.109 -8.086 1.00 26.82 O ATOM 1996 CB SER A1054 8.430 6.130 -9.621 1.00 35.89 C ATOM 1997 OG SER A1054 8.747 6.783 -8.402 1.00 49.65 O ATOM 1998 HG SER A1054 9.727 6.905 -8.340 1.00 0.00 H ATOM 1999 H SER A1054 8.497 3.146 -11.052 1.00 0.00 H ATOM 2000 N LYS A1055 9.761 3.047 -8.036 1.00 17.87 N ATOM 2001 CA LYS A1055 10.547 2.601 -6.888 1.00 17.84 C ATOM 2002 C LYS A1055 11.739 1.744 -7.291 1.00 15.83 C ATOM 2003 O LYS A1055 12.535 1.370 -6.415 1.00 16.24 O ATOM 2004 CB LYS A1055 9.675 1.829 -5.880 1.00 22.05 C ATOM 2005 CG LYS A1055 8.434 2.603 -5.400 1.00 26.52 C ATOM 2006 CD LYS A1055 8.840 3.872 -4.638 1.00 30.96 C ATOM 2007 CE LYS A1055 7.688 4.587 -3.972 1.00 40.19 C ATOM 2008 NZ LYS A1055 8.161 5.781 -3.225 1.00 43.58 N ATOM 2009 HZ1 LYS A1055 8.838 5.485 -2.493 1.00 0.00 H ATOM 2010 HZ2 LYS A1055 8.626 6.438 -3.883 1.00 0.00 H ATOM 2011 HZ3 LYS A1055 7.349 6.253 -2.778 1.00 0.00 H ATOM 2012 H LYS A1055 9.076 2.397 -8.471 1.00 0.00 H ATOM 2013 N SER A1056 11.877 1.414 -8.555 1.00 12.82 N ATOM 2014 CA SER A1056 12.976 0.574 -9.017 1.00 13.79 C ATOM 2015 C SER A1056 14.337 1.156 -8.675 1.00 14.19 C ATOM 2016 O SER A1056 14.473 2.381 -8.571 1.00 13.54 O ATOM 2017 CB SER A1056 12.883 0.361 -10.527 1.00 16.30 C ATOM 2018 OG SER A1056 13.265 1.523 -11.261 1.00 22.56 O ATOM 2019 HG SER A1056 12.669 2.275 -11.019 1.00 0.00 H ATOM 2020 H SER A1056 11.182 1.762 -9.246 1.00 0.00 H ATOM 2021 N PRO A1057 15.396 0.328 -8.540 1.00 10.58 N ATOM 2022 CA PRO A1057 16.722 0.903 -8.262 1.00 9.48 C ATOM 2023 C PRO A1057 17.142 1.990 -9.269 1.00 12.15 C ATOM 2024 O PRO A1057 17.582 3.043 -8.802 1.00 11.02 O ATOM 2025 CB PRO A1057 17.648 -0.308 -8.279 1.00 10.49 C ATOM 2026 CG PRO A1057 16.740 -1.442 -7.858 1.00 10.98 C ATOM 2027 CD PRO A1057 15.422 -1.157 -8.534 1.00 10.71 C ATOM 2028 N PRO A1058 16.947 1.839 -10.603 1.00 11.31 N ATOM 2029 CA PRO A1058 17.352 2.937 -11.504 1.00 12.11 C ATOM 2030 C PRO A1058 16.548 4.199 -11.251 1.00 14.09 C ATOM 2031 O PRO A1058 17.141 5.268 -11.155 1.00 12.98 O ATOM 2032 CB PRO A1058 17.050 2.388 -12.893 1.00 13.78 C ATOM 2033 CG PRO A1058 17.134 0.895 -12.721 1.00 17.16 C ATOM 2034 CD PRO A1058 16.490 0.666 -11.383 1.00 13.14 C ATOM 2035 N ALA A1059 15.231 4.095 -11.070 1.00 12.61 N ATOM 2036 CA ALA A1059 14.424 5.280 -10.836 1.00 12.26 C ATOM 2037 C ALA A1059 14.764 5.960 -9.517 1.00 13.48 C ATOM 2038 O ALA A1059 14.857 7.185 -9.453 1.00 12.86 O ATOM 2039 CB ALA A1059 12.944 4.919 -10.877 1.00 13.47 C ATOM 2040 H ALA A1059 14.778 3.159 -11.097 1.00 0.00 H ATOM 2041 N GLU A1060 14.982 5.182 -8.457 1.00 11.25 N ATOM 2042 CA GLU A1060 15.300 5.736 -7.171 1.00 11.14 C ATOM 2043 C GLU A1060 16.668 6.379 -7.142 1.00 11.87 C ATOM 2044 O GLU A1060 16.810 7.505 -6.692 1.00 12.10 O ATOM 2045 CB GLU A1060 15.178 4.664 -6.085 1.00 13.84 C ATOM 2046 CG GLU A1060 13.763 4.365 -5.683 1.00 22.66 C ATOM 2047 CD GLU A1060 13.068 5.392 -4.816 1.00 36.15 C ATOM 2048 OE1 GLU A1060 13.737 6.338 -4.345 1.00 26.51 O ATOM 2049 OE2 GLU A1060 11.859 5.208 -4.557 1.00 39.70 O ATOM 2050 H GLU A1060 14.920 4.149 -8.564 1.00 0.00 H ATOM 2051 N PHE A1061 17.682 5.687 -7.669 1.00 10.24 N ATOM 2052 CA PHE A1061 18.990 6.298 -7.703 1.00 10.14 C ATOM 2053 C PHE A1061 18.994 7.566 -8.567 1.00 11.87 C ATOM 2054 O PHE A1061 19.640 8.548 -8.201 1.00 11.50 O ATOM 2055 CB PHE A1061 20.065 5.319 -8.198 1.00 10.42 C ATOM 2056 CG PHE A1061 20.576 4.375 -7.130 1.00 9.40 C ATOM 2057 CD1 PHE A1061 21.205 4.866 -5.989 1.00 10.56 C ATOM 2058 CD2 PHE A1061 20.512 2.994 -7.307 1.00 9.97 C ATOM 2059 CE1 PHE A1061 21.742 3.982 -5.035 1.00 10.21 C ATOM 2060 CE2 PHE A1061 21.065 2.120 -6.361 1.00 9.80 C ATOM 2061 CZ PHE A1061 21.654 2.610 -5.240 1.00 9.56 C ATOM 2062 H PHE A1061 17.533 4.729 -8.046 1.00 0.00 H ATOM 2063 N MET A1062 18.291 7.546 -9.716 1.00 11.00 N ATOM 2064 CA MET A1062 18.219 8.760 -10.561 1.00 11.43 C ATOM 2065 C MET A1062 17.547 9.897 -9.848 1.00 13.30 C ATOM 2066 O MET A1062 18.018 11.024 -9.963 1.00 14.16 O ATOM 2067 CB MET A1062 17.514 8.479 -11.884 1.00 12.89 C ATOM 2068 CG MET A1062 18.336 7.670 -12.816 1.00 13.50 C ATOM 2069 SD MET A1062 19.923 8.385 -13.288 1.00 15.48 S ATOM 2070 CE MET A1062 19.412 9.950 -14.020 1.00 15.94 C ATOM 2071 H MET A1062 17.799 6.678 -10.010 1.00 0.00 H ATOM 2072 N ARG A1063 16.496 9.625 -9.065 1.00 12.41 N ATOM 2073 CA ARG A1063 15.845 10.640 -8.241 1.00 13.10 C ATOM 2074 C ARG A1063 16.849 11.235 -7.231 1.00 15.68 C ATOM 2075 O ARG A1063 16.911 12.450 -7.036 1.00 15.45 O ATOM 2076 CB ARG A1063 14.660 10.032 -7.480 1.00 14.85 C ATOM 2077 CG ARG A1063 13.933 11.049 -6.600 1.00 22.65 C ATOM 2078 CD ARG A1063 12.930 10.431 -5.628 1.00 27.54 C ATOM 2079 NE ARG A1063 13.502 9.378 -4.782 1.00 27.68 N ATOM 2080 CZ ARG A1063 14.222 9.578 -3.680 1.00 44.98 C ATOM 2081 NH1 ARG A1063 14.509 10.811 -3.278 1.00 35.06 N ATOM 2082 NH2 ARG A1063 14.686 8.546 -2.989 1.00 35.57 N ATOM 2083 HE ARG A1063 13.331 8.393 -5.067 1.00 0.00 H ATOM 2084 HH12 ARG A1063 15.072 10.959 -2.416 1.00 0.00 H ATOM 2085 HH11 ARG A1063 14.171 11.628 -3.825 1.00 0.00 H ATOM 2086 HH22 ARG A1063 15.248 8.707 -2.129 1.00 0.00 H ATOM 2087 HH21 ARG A1063 14.488 7.576 -3.307 1.00 0.00 H ATOM 2088 H ARG A1063 16.128 8.652 -9.043 1.00 0.00 H ATOM 2089 N MET A1064 17.660 10.369 -6.599 1.00 13.20 N ATOM 2090 CA MET A1064 18.601 10.803 -5.586 1.00 13.33 C ATOM 2091 C MET A1064 19.715 11.645 -6.186 1.00 15.49 C ATOM 2092 O MET A1064 20.092 12.675 -5.604 1.00 16.90 O ATOM 2093 CB MET A1064 19.149 9.588 -4.831 1.00 15.12 C ATOM 2094 CG MET A1064 18.208 9.157 -3.737 1.00 16.95 C ATOM 2095 SD MET A1064 18.816 7.738 -2.825 1.00 19.73 S ATOM 2096 CE MET A1064 18.486 6.448 -3.967 1.00 15.41 C ATOM 2097 H MET A1064 17.611 9.359 -6.844 1.00 0.00 H ATOM 2098 N ILE A1065 20.227 11.253 -7.348 1.00 13.41 N ATOM 2099 CA ILE A1065 21.313 12.013 -7.946 1.00 13.86 C ATOM 2100 C ILE A1065 20.872 13.229 -8.735 1.00 16.19 C ATOM 2101 O ILE A1065 21.708 14.092 -8.994 1.00 15.56 O ATOM 2102 CB ILE A1065 22.307 11.165 -8.728 1.00 18.17 C ATOM 2103 CG1 ILE A1065 21.705 10.629 -9.994 1.00 17.21 C ATOM 2104 CG2 ILE A1065 22.910 10.050 -7.874 1.00 19.35 C ATOM 2105 CD1 ILE A1065 22.716 10.185 -11.024 1.00 18.77 C ATOM 2106 H ILE A1065 19.854 10.408 -7.826 1.00 0.00 H ATOM 2107 N GLY A1066 19.625 13.238 -9.174 1.00 14.68 N ATOM 2108 CA GLY A1066 19.075 14.302 -10.015 1.00 14.39 C ATOM 2109 C GLY A1066 18.639 13.708 -11.340 1.00 15.98 C ATOM 2110 O GLY A1066 19.465 13.292 -12.155 1.00 15.58 O ATOM 2111 H GLY A1066 19.003 12.448 -8.908 1.00 0.00 H ATOM 2112 N ASN A1067 17.307 13.645 -11.545 1.00 17.04 N ATOM 2113 CA ASN A1067 16.614 13.021 -12.673 1.00 18.73 C ATOM 2114 C ASN A1067 17.015 13.485 -14.038 1.00 22.41 C ATOM 2115 O ASN A1067 16.830 12.754 -15.016 1.00 22.37 O ATOM 2116 CB ASN A1067 15.094 13.231 -12.533 1.00 24.38 C ATOM 2117 CG ASN A1067 14.417 12.190 -11.720 1.00 41.61 C ATOM 2118 OD1 ASN A1067 13.535 12.474 -10.908 1.00 43.04 O ATOM 2119 ND2 ASN A1067 14.785 10.953 -11.955 1.00 29.91 N ATOM 2120 HD22 ASN A1067 15.534 10.756 -12.649 1.00 0.00 H ATOM 2121 HD21 ASN A1067 14.328 10.169 -11.447 1.00 0.00 H ATOM 2122 H ASN A1067 16.706 14.089 -10.821 1.00 0.00 H ATOM 2123 N ASP A1068 17.523 14.713 -14.106 1.00 20.15 N ATOM 2124 CA ASP A1068 17.959 15.393 -15.316 1.00 21.91 C ATOM 2125 C ASP A1068 19.359 15.004 -15.785 1.00 22.97 C ATOM 2126 O ASP A1068 19.728 15.317 -16.920 1.00 24.71 O ATOM 2127 CB ASP A1068 17.863 16.916 -15.111 1.00 24.98 C ATOM 2128 CG ASP A1068 18.545 17.502 -13.871 1.00 37.81 C ATOM 2129 OD1 ASP A1068 18.625 16.789 -12.818 1.00 34.76 O ATOM 2130 OD2 ASP A1068 18.931 18.692 -13.919 1.00 50.64 O ATOM 2131 H ASP A1068 17.617 15.235 -13.211 1.00 0.00 H ATOM 2132 N LYS A1069 20.143 14.308 -14.945 1.00 16.47 N ATOM 2133 CA LYS A1069 21.495 13.932 -15.326 1.00 15.75 C ATOM 2134 C LYS A1069 21.514 12.876 -16.415 1.00 18.12 C ATOM 2135 O LYS A1069 20.618 12.026 -16.490 1.00 18.09 O ATOM 2136 CB LYS A1069 22.292 13.473 -14.096 1.00 16.80 C ATOM 2137 CG LYS A1069 22.638 14.663 -13.207 1.00 19.69 C ATOM 2138 CD LYS A1069 23.454 14.257 -12.000 1.00 19.47 C ATOM 2139 CE LYS A1069 23.926 15.472 -11.209 1.00 16.91 C ATOM 2140 NZ LYS A1069 22.787 16.198 -10.559 1.00 15.65 N ATOM 2141 HZ1 LYS A1069 22.123 16.524 -11.290 1.00 0.00 H ATOM 2142 HZ2 LYS A1069 22.296 15.555 -9.905 1.00 0.00 H ATOM 2143 HZ3 LYS A1069 23.154 17.016 -10.033 1.00 0.00 H ATOM 2144 H LYS A1069 19.778 14.035 -14.010 1.00 0.00 H ATOM 2145 N GLN A1070 22.536 12.941 -17.266 1.00 16.69 N ATOM 2146 CA GLN A1070 22.669 12.051 -18.395 1.00 16.73 C ATOM 2147 C GLN A1070 24.115 11.648 -18.566 1.00 18.88 C ATOM 2148 O GLN A1070 25.020 12.353 -18.088 1.00 18.60 O ATOM 2149 CB GLN A1070 22.191 12.759 -19.684 1.00 19.26 C ATOM 2150 CG GLN A1070 20.681 12.968 -19.724 1.00 27.74 C ATOM 2151 CD GLN A1070 20.232 13.575 -21.025 1.00 48.57 C ATOM 2152 OE1 GLN A1070 20.724 14.623 -21.447 1.00 38.93 O ATOM 2153 NE2 GLN A1070 19.275 12.929 -21.679 1.00 45.90 N ATOM 2154 HE22 GLN A1070 18.884 12.047 -21.291 1.00 0.00 H ATOM 2155 HE21 GLN A1070 18.916 13.305 -22.580 1.00 0.00 H ATOM 2156 H GLN A1070 23.269 13.663 -17.111 1.00 0.00 H ATOM 2157 N GLY A1071 24.312 10.504 -19.216 1.00 16.74 N ATOM 2158 CA GLY A1071 25.618 9.960 -19.553 1.00 15.29 C ATOM 2159 C GLY A1071 26.521 9.744 -18.362 1.00 17.02 C ATOM 2160 O GLY A1071 26.055 9.367 -17.290 1.00 16.38 O ATOM 2161 H GLY A1071 23.473 9.961 -19.503 1.00 0.00 H ATOM 2162 N GLN A1072 27.819 9.952 -18.537 1.00 15.76 N ATOM 2163 CA GLN A1072 28.821 9.691 -17.508 1.00 15.76 C ATOM 2164 C GLN A1072 28.612 10.422 -16.214 1.00 15.77 C ATOM 2165 O GLN A1072 29.005 9.910 -15.151 1.00 14.50 O ATOM 2166 CB GLN A1072 30.240 9.952 -18.032 1.00 18.05 C ATOM 2167 CG GLN A1072 30.789 8.836 -18.929 1.00 32.26 C ATOM 2168 CD GLN A1072 30.704 7.468 -18.289 1.00 41.34 C ATOM 2169 OE1 GLN A1072 31.260 7.213 -17.214 1.00 36.34 O ATOM 2170 NE2 GLN A1072 29.975 6.573 -18.923 1.00 38.34 N ATOM 2171 HE22 GLN A1072 29.520 6.818 -19.826 1.00 0.00 H ATOM 2172 HE21 GLN A1072 29.854 5.621 -18.521 1.00 0.00 H ATOM 2173 H GLN A1072 28.140 10.320 -19.455 1.00 0.00 H ATOM 2174 N MET A1073 27.913 11.559 -16.249 1.00 13.15 N ATOM 2175 CA MET A1073 27.635 12.304 -15.017 1.00 13.09 C ATOM 2176 C MET A1073 26.829 11.422 -14.044 1.00 13.92 C ATOM 2177 O MET A1073 27.003 11.525 -12.813 1.00 12.91 O ATOM 2178 CB MET A1073 26.814 13.539 -15.363 1.00 14.82 C ATOM 2179 CG MET A1073 26.615 14.497 -14.202 1.00 16.91 C ATOM 2180 SD MET A1073 28.153 15.198 -13.578 1.00 19.44 S ATOM 2181 CE MET A1073 28.450 16.517 -14.757 1.00 18.59 C ATOM 2182 H MET A1073 27.562 11.920 -17.159 1.00 0.00 H ATOM 2183 N ILE A1074 25.951 10.554 -14.571 1.00 12.20 N ATOM 2184 CA ILE A1074 25.188 9.629 -13.727 1.00 11.10 C ATOM 2185 C ILE A1074 26.162 8.720 -12.985 1.00 13.01 C ATOM 2186 O ILE A1074 25.994 8.492 -11.777 1.00 11.90 O ATOM 2187 CB ILE A1074 24.250 8.783 -14.619 1.00 13.20 C ATOM 2188 CG1 ILE A1074 23.144 9.671 -15.188 1.00 13.82 C ATOM 2189 CG2 ILE A1074 23.674 7.575 -13.812 1.00 13.13 C ATOM 2190 CD1 ILE A1074 22.329 8.929 -16.327 1.00 16.19 C ATOM 2191 H ILE A1074 25.809 10.537 -15.601 1.00 0.00 H ATOM 2192 N VAL A1075 27.137 8.143 -13.688 1.00 10.66 N ATOM 2193 CA VAL A1075 28.109 7.247 -13.099 1.00 11.15 C ATOM 2194 C VAL A1075 28.900 7.978 -12.006 1.00 11.18 C ATOM 2195 O VAL A1075 29.134 7.446 -10.912 1.00 11.05 O ATOM 2196 CB VAL A1075 29.053 6.646 -14.175 1.00 14.96 C ATOM 2197 CG1 VAL A1075 30.096 5.724 -13.556 1.00 16.25 C ATOM 2198 CG2 VAL A1075 28.234 5.899 -15.242 1.00 15.42 C ATOM 2199 H VAL A1075 27.202 8.346 -14.706 1.00 0.00 H ATOM 2200 N PHE A1076 29.377 9.182 -12.331 1.00 11.24 N ATOM 2201 CA PHE A1076 30.175 9.946 -11.371 1.00 11.32 C ATOM 2202 C PHE A1076 29.401 10.146 -10.071 1.00 10.14 C ATOM 2203 O PHE A1076 29.961 9.920 -8.976 1.00 10.98 O ATOM 2204 CB PHE A1076 30.508 11.321 -11.957 1.00 12.37 C ATOM 2205 CG PHE A1076 31.467 11.389 -13.132 1.00 13.95 C ATOM 2206 CD1 PHE A1076 32.078 10.240 -13.626 1.00 15.01 C ATOM 2207 CD2 PHE A1076 31.799 12.615 -13.696 1.00 16.73 C ATOM 2208 CE1 PHE A1076 32.960 10.314 -14.727 1.00 17.57 C ATOM 2209 CE2 PHE A1076 32.679 12.688 -14.779 1.00 18.64 C ATOM 2210 CZ PHE A1076 33.259 11.544 -15.268 1.00 16.95 C ATOM 2211 H PHE A1076 29.180 9.579 -13.272 1.00 0.00 H ATOM 2212 N HIS A1077 28.160 10.569 -10.181 1.00 9.71 N ATOM 2213 CA HIS A1077 27.318 10.840 -9.027 1.00 9.83 C ATOM 2214 C HIS A1077 26.932 9.579 -8.281 1.00 11.23 C ATOM 2215 O HIS A1077 26.907 9.593 -7.040 1.00 10.97 O ATOM 2216 CB HIS A1077 26.124 11.702 -9.394 1.00 10.44 C ATOM 2217 CG HIS A1077 26.484 13.154 -9.545 1.00 10.78 C ATOM 2218 ND1 HIS A1077 26.200 14.078 -8.549 1.00 11.69 N ATOM 2219 CD2 HIS A1077 27.178 13.771 -10.533 1.00 13.02 C ATOM 2220 CE1 HIS A1077 26.685 15.227 -8.994 1.00 11.95 C ATOM 2221 NE2 HIS A1077 27.296 15.083 -10.164 1.00 12.53 N ATOM 2222 H HIS A1077 27.765 10.715 -11.132 1.00 0.00 H ATOM 2223 N LEU A1078 26.662 8.476 -8.995 1.00 10.44 N ATOM 2224 CA LEU A1078 26.309 7.226 -8.322 1.00 9.74 C ATOM 2225 C LEU A1078 27.471 6.740 -7.469 1.00 10.15 C ATOM 2226 O LEU A1078 27.278 6.340 -6.312 1.00 10.26 O ATOM 2227 CB LEU A1078 25.950 6.178 -9.362 1.00 9.97 C ATOM 2228 CG LEU A1078 25.629 4.780 -8.791 1.00 10.55 C ATOM 2229 CD1 LEU A1078 24.375 4.808 -7.915 1.00 10.87 C ATOM 2230 CD2 LEU A1078 25.458 3.783 -9.935 1.00 10.93 C ATOM 2231 H LEU A1078 26.704 8.510 -10.034 1.00 0.00 H ATOM 2232 N ILE A1079 28.697 6.772 -8.005 1.00 9.33 N ATOM 2233 CA ILE A1079 29.862 6.344 -7.264 1.00 8.73 C ATOM 2234 C ILE A1079 30.037 7.206 -6.019 1.00 10.69 C ATOM 2235 O ILE A1079 30.250 6.677 -4.912 1.00 11.03 O ATOM 2236 CB ILE A1079 31.113 6.388 -8.142 1.00 11.42 C ATOM 2237 CG1 ILE A1079 30.989 5.298 -9.208 1.00 11.19 C ATOM 2238 CG2 ILE A1079 32.369 6.137 -7.315 1.00 11.86 C ATOM 2239 CD1 ILE A1079 32.063 5.401 -10.327 1.00 15.33 C ATOM 2240 H ILE A1079 28.815 7.114 -8.980 1.00 0.00 H ATOM 2241 N GLU A1080 29.993 8.544 -6.199 1.00 9.56 N ATOM 2242 CA GLU A1080 30.233 9.413 -5.065 1.00 9.20 C ATOM 2243 C GLU A1080 29.150 9.219 -4.000 1.00 10.95 C ATOM 2244 O GLU A1080 29.463 9.204 -2.798 1.00 10.56 O ATOM 2245 CB GLU A1080 30.289 10.862 -5.585 1.00 10.11 C ATOM 2246 CG GLU A1080 30.721 11.867 -4.536 1.00 10.81 C ATOM 2247 CD GLU A1080 32.136 11.673 -4.023 1.00 11.96 C ATOM 2248 OE1 GLU A1080 32.974 11.115 -4.767 1.00 14.30 O ATOM 2249 OE2 GLU A1080 32.431 12.106 -2.887 1.00 10.48 O ATOM 2250 H GLU A1080 29.790 8.944 -7.137 1.00 0.00 H ATOM 2251 N LEU A1081 27.899 9.009 -4.424 1.00 9.24 N ATOM 2252 CA LEU A1081 26.787 8.773 -3.524 1.00 9.62 C ATOM 2253 C LEU A1081 27.026 7.493 -2.708 1.00 10.34 C ATOM 2254 O LEU A1081 26.918 7.527 -1.480 1.00 9.84 O ATOM 2255 CB LEU A1081 25.481 8.696 -4.351 1.00 10.26 C ATOM 2256 CG LEU A1081 24.162 8.420 -3.619 1.00 12.31 C ATOM 2257 CD1 LEU A1081 22.994 9.022 -4.409 1.00 16.20 C ATOM 2258 CD2 LEU A1081 23.918 6.898 -3.509 1.00 13.63 C ATOM 2259 H LEU A1081 27.715 9.015 -5.448 1.00 0.00 H ATOM 2260 N LEU A1082 27.411 6.386 -3.376 1.00 8.99 N ATOM 2261 CA LEU A1082 27.554 5.121 -2.671 1.00 8.73 C ATOM 2262 C LEU A1082 28.738 5.123 -1.745 1.00 11.14 C ATOM 2263 O LEU A1082 28.681 4.539 -0.658 1.00 10.75 O ATOM 2264 CB LEU A1082 27.705 3.969 -3.647 1.00 10.22 C ATOM 2265 CG LEU A1082 26.495 3.641 -4.501 1.00 11.17 C ATOM 2266 CD1 LEU A1082 26.846 2.602 -5.524 1.00 11.40 C ATOM 2267 CD2 LEU A1082 25.292 3.177 -3.648 1.00 11.54 C ATOM 2268 H LEU A1082 27.606 6.437 -4.396 1.00 0.00 H ATOM 2269 N LYS A1083 29.830 5.784 -2.137 1.00 9.98 N ATOM 2270 CA LYS A1083 31.024 5.792 -1.321 1.00 9.83 C ATOM 2271 C LYS A1083 30.798 6.500 0.000 1.00 10.56 C ATOM 2272 O LYS A1083 31.449 6.167 0.996 1.00 12.15 O ATOM 2273 CB LYS A1083 32.174 6.437 -2.106 1.00 12.37 C ATOM 2274 CG LYS A1083 32.682 5.560 -3.246 1.00 20.25 C ATOM 2275 CD LYS A1083 33.545 4.374 -2.797 1.00 35.38 C ATOM 2276 CE LYS A1083 35.002 4.723 -2.550 1.00 54.65 C ATOM 2277 NZ LYS A1083 35.235 5.200 -1.158 1.00 63.48 N ATOM 2278 HZ1 LYS A1083 34.663 6.051 -0.984 1.00 0.00 H ATOM 2279 HZ2 LYS A1083 34.961 4.454 -0.487 1.00 0.00 H ATOM 2280 HZ3 LYS A1083 36.242 5.427 -1.035 1.00 0.00 H ATOM 2281 H LYS A1083 29.822 6.299 -3.040 1.00 0.00 H ATOM 2282 N ASN A1084 29.827 7.392 0.050 1.00 9.02 N ATOM 2283 CA ASN A1084 29.566 8.175 1.238 1.00 9.11 C ATOM 2284 C ASN A1084 28.214 7.910 1.843 1.00 11.09 C ATOM 2285 O ASN A1084 27.554 8.797 2.375 1.00 11.03 O ATOM 2286 CB ASN A1084 29.804 9.666 0.959 1.00 9.59 C ATOM 2287 CG ASN A1084 31.229 9.899 0.556 1.00 11.50 C ATOM 2288 OD1 ASN A1084 32.162 9.672 1.332 1.00 10.72 O ATOM 2289 ND2 ASN A1084 31.440 10.198 -0.728 1.00 12.61 N ATOM 2290 HD22 ASN A1084 30.634 10.384 -1.358 1.00 0.00 H ATOM 2291 HD21 ASN A1084 32.411 10.245 -1.098 1.00 0.00 H ATOM 2292 H ASN A1084 29.231 7.537 -0.790 1.00 0.00 H ATOM 2293 N ASN A1085 27.813 6.622 1.789 1.00 10.03 N ATOM 2294 CA ASN A1085 26.672 6.073 2.498 1.00 9.99 C ATOM 2295 C ASN A1085 25.317 6.398 1.957 1.00 10.82 C ATOM 2296 O ASN A1085 24.305 6.188 2.644 1.00 10.72 O ATOM 2297 CB ASN A1085 26.732 6.459 3.997 1.00 10.95 C ATOM 2298 CG ASN A1085 25.900 5.561 4.864 1.00 14.81 C ATOM 2299 OD1 ASN A1085 26.077 4.339 4.809 1.00 14.61 O ATOM 2300 ND2 ASN A1085 25.039 6.135 5.699 1.00 13.24 N ATOM 2301 HD22 ASN A1085 24.930 7.169 5.703 1.00 0.00 H ATOM 2302 HD21 ASN A1085 24.475 5.550 6.348 1.00 0.00 H ATOM 2303 H ASN A1085 28.365 5.973 1.193 1.00 0.00 H ATOM 2304 N GLY A1086 25.216 6.834 0.711 1.00 9.81 N ATOM 2305 CA GLY A1086 23.906 7.035 0.108 1.00 9.64 C ATOM 2306 C GLY A1086 23.372 5.660 -0.254 1.00 9.57 C ATOM 2307 O GLY A1086 24.116 4.825 -0.778 1.00 9.93 O ATOM 2308 H GLY A1086 26.076 7.034 0.161 1.00 0.00 H ATOM 2309 N ARG A1087 22.113 5.410 0.049 1.00 9.32 N ATOM 2310 CA ARG A1087 21.511 4.086 -0.149 1.00 9.21 C ATOM 2311 C ARG A1087 20.077 4.226 -0.573 1.00 10.45 C ATOM 2312 O ARG A1087 19.402 5.222 -0.247 1.00 11.71 O ATOM 2313 CB ARG A1087 21.524 3.274 1.192 1.00 10.97 C ATOM 2314 CG ARG A1087 22.930 2.970 1.735 1.00 8.84 C ATOM 2315 CD ARG A1087 23.671 1.997 0.839 1.00 9.66 C ATOM 2316 NE ARG A1087 24.988 1.606 1.374 1.00 9.21 N ATOM 2317 CZ ARG A1087 26.171 2.106 1.001 1.00 9.06 C ATOM 2318 NH1 ARG A1087 26.234 3.137 0.164 1.00 9.30 N ATOM 2319 NH2 ARG A1087 27.296 1.593 1.479 1.00 9.50 N ATOM 2320 HE ARG A1087 24.998 0.872 2.111 1.00 0.00 H ATOM 2321 HH12 ARG A1087 27.158 3.520 -0.121 1.00 0.00 H ATOM 2322 HH11 ARG A1087 25.359 3.561 -0.206 1.00 0.00 H ATOM 2323 HH22 ARG A1087 28.213 1.986 1.185 1.00 0.00 H ATOM 2324 HH21 ARG A1087 27.262 0.797 2.148 1.00 0.00 H ATOM 2325 H ARG A1087 21.528 6.175 0.441 1.00 0.00 H ATOM 2326 N LEU A1088 19.563 3.177 -1.257 1.00 8.94 N ATOM 2327 CA LEU A1088 18.159 3.066 -1.548 1.00 9.82 C ATOM 2328 C LEU A1088 17.384 3.126 -0.244 1.00 11.47 C ATOM 2329 O LEU A1088 17.852 2.593 0.762 1.00 11.23 O ATOM 2330 CB LEU A1088 17.907 1.741 -2.260 1.00 9.51 C ATOM 2331 CG LEU A1088 18.473 1.665 -3.657 1.00 10.69 C ATOM 2332 CD1 LEU A1088 18.483 0.243 -4.162 1.00 11.20 C ATOM 2333 CD2 LEU A1088 17.704 2.601 -4.614 1.00 11.75 C ATOM 2334 H LEU A1088 20.205 2.426 -1.583 1.00 0.00 H ATOM 2335 N PRO A1089 16.217 3.776 -0.253 1.00 11.95 N ATOM 2336 CA PRO A1089 15.422 3.882 0.965 1.00 13.08 C ATOM 2337 C PRO A1089 14.725 2.594 1.352 1.00 14.03 C ATOM 2338 O PRO A1089 14.611 1.646 0.567 1.00 15.50 O ATOM 2339 CB PRO A1089 14.390 4.932 0.576 1.00 15.00 C ATOM 2340 CG PRO A1089 14.149 4.666 -0.915 1.00 18.10 C ATOM 2341 CD PRO A1089 15.542 4.372 -1.422 1.00 13.59 C ATOM 2342 N ARG A1090 14.233 2.546 2.588 1.00 12.98 N ATOM 2343 CA ARG A1090 13.450 1.393 2.996 1.00 12.48 C ATOM 2344 C ARG A1090 12.110 1.422 2.261 1.00 15.24 C ATOM 2345 O ARG A1090 11.397 2.431 2.368 1.00 15.78 O ATOM 2346 CB ARG A1090 13.242 1.406 4.516 1.00 12.66 C ATOM 2347 CG ARG A1090 12.388 0.246 4.989 1.00 14.40 C ATOM 2348 CD ARG A1090 12.235 0.219 6.509 1.00 17.96 C ATOM 2349 NE ARG A1090 11.537 1.412 7.011 1.00 18.91 N ATOM 2350 CZ ARG A1090 10.224 1.613 6.947 1.00 27.62 C ATOM 2351 NH1 ARG A1090 9.418 0.657 6.502 1.00 19.84 N ATOM 2352 NH2 ARG A1090 9.701 2.752 7.381 1.00 27.35 N ATOM 2353 HE ARG A1090 12.115 2.157 7.450 1.00 0.00 H ATOM 2354 HH12 ARG A1090 8.392 0.822 6.455 1.00 0.00 H ATOM 2355 HH11 ARG A1090 9.812 -0.257 6.200 1.00 0.00 H ATOM 2356 HH22 ARG A1090 8.674 2.906 7.329 1.00 0.00 H ATOM 2357 HH21 ARG A1090 10.318 3.492 7.773 1.00 0.00 H ATOM 2358 H ARG A1090 14.407 3.325 3.254 1.00 0.00 H ATOM 2359 N PRO A1091 11.742 0.350 1.521 1.00 12.24 N ATOM 2360 CA PRO A1091 10.454 0.369 0.803 1.00 13.71 C ATOM 2361 C PRO A1091 9.283 0.513 1.782 1.00 17.02 C ATOM 2362 O PRO A1091 9.350 0.079 2.918 1.00 16.15 O ATOM 2363 CB PRO A1091 10.399 -1.001 0.128 1.00 14.65 C ATOM 2364 CG PRO A1091 11.886 -1.370 -0.059 1.00 16.46 C ATOM 2365 CD PRO A1091 12.522 -0.877 1.212 1.00 12.89 C ATOM 2366 N ASP A1092 8.196 1.105 1.312 1.00 18.36 N ATOM 2367 CA ASP A1092 6.990 1.233 2.131 1.00 19.96 C ATOM 2368 C ASP A1092 6.539 -0.161 2.567 1.00 19.52 C ATOM 2369 O ASP A1092 6.443 -1.071 1.741 1.00 18.51 O ATOM 2370 CB ASP A1092 5.879 1.884 1.294 1.00 23.56 C ATOM 2371 CG ASP A1092 6.194 3.313 0.920 1.00 44.53 C ATOM 2372 OD1 ASP A1092 6.045 4.199 1.790 1.00 47.64 O ATOM 2373 OD2 ASP A1092 6.612 3.544 -0.234 1.00 56.80 O ATOM 2374 H ASP A1092 8.199 1.486 0.344 1.00 0.00 H ATOM 2375 N GLY A1093 6.282 -0.315 3.857 1.00 17.75 N ATOM 2376 CA GLY A1093 5.825 -1.588 4.410 1.00 17.87 C ATOM 2377 C GLY A1093 6.903 -2.621 4.651 1.00 19.66 C ATOM 2378 O GLY A1093 6.632 -3.696 5.191 1.00 18.45 O ATOM 2379 H GLY A1093 6.409 0.495 4.496 1.00 0.00 H ATOM 2380 N CYS A1094 8.151 -2.291 4.317 1.00 15.41 N ATOM 2381 CA CYS A1094 9.238 -3.236 4.536 1.00 14.36 C ATOM 2382 C CYS A1094 9.593 -3.272 6.027 1.00 15.14 C ATOM 2383 O CYS A1094 9.944 -2.237 6.592 1.00 16.47 O ATOM 2384 CB CYS A1094 10.445 -2.832 3.696 1.00 12.37 C ATOM 2385 SG CYS A1094 11.862 -3.944 3.879 1.00 13.80 S ATOM 2386 H CYS A1094 8.348 -1.359 3.900 1.00 0.00 H ATOM 2387 N PRO A1095 9.629 -4.462 6.647 1.00 14.53 N ATOM 2388 CA PRO A1095 10.053 -4.537 8.050 1.00 15.90 C ATOM 2389 C PRO A1095 11.493 -4.075 8.250 1.00 18.67 C ATOM 2390 O PRO A1095 12.357 -4.288 7.377 1.00 15.25 O ATOM 2391 CB PRO A1095 9.917 -6.022 8.408 1.00 17.94 C ATOM 2392 CG PRO A1095 9.050 -6.619 7.349 1.00 21.38 C ATOM 2393 CD PRO A1095 9.273 -5.789 6.101 1.00 16.34 C ATOM 2394 N ASP A1096 11.770 -3.426 9.382 1.00 16.58 N ATOM 2395 CA ASP A1096 13.105 -2.955 9.731 1.00 16.16 C ATOM 2396 C ASP A1096 14.147 -4.085 9.653 1.00 17.16 C ATOM 2397 O ASP A1096 15.273 -3.844 9.179 1.00 15.43 O ATOM 2398 CB ASP A1096 13.103 -2.358 11.149 1.00 18.56 C ATOM 2399 CG ASP A1096 12.416 -1.013 11.273 1.00 30.20 C ATOM 2400 OD1 ASP A1096 12.342 -0.278 10.252 1.00 31.30 O ATOM 2401 OD2 ASP A1096 12.029 -0.650 12.407 1.00 35.05 O ATOM 2402 H ASP A1096 10.994 -3.247 10.050 1.00 0.00 H ATOM 2403 N GLU A1097 13.782 -5.310 10.073 1.00 15.39 N ATOM 2404 CA GLU A1097 14.700 -6.444 10.052 1.00 15.74 C ATOM 2405 C GLU A1097 15.119 -6.821 8.636 1.00 15.00 C ATOM 2406 O GLU A1097 16.270 -7.214 8.429 1.00 15.87 O ATOM 2407 CB GLU A1097 14.168 -7.664 10.810 1.00 18.53 C ATOM 2408 H GLU A1097 12.814 -5.453 10.424 1.00 0.00 H ATOM 2409 N ILE A1098 14.224 -6.636 7.667 1.00 12.33 N ATOM 2410 CA ILE A1098 14.520 -6.914 6.262 1.00 10.43 C ATOM 2411 C ILE A1098 15.351 -5.803 5.666 1.00 11.89 C ATOM 2412 O ILE A1098 16.317 -6.075 4.952 1.00 11.35 O ATOM 2413 CB ILE A1098 13.216 -7.193 5.493 1.00 12.97 C ATOM 2414 CG1 ILE A1098 12.411 -8.373 6.108 1.00 13.72 C ATOM 2415 CG2 ILE A1098 13.522 -7.449 4.023 1.00 12.30 C ATOM 2416 CD1 ILE A1098 13.210 -9.717 6.336 1.00 18.16 C ATOM 2417 H ILE A1098 13.280 -6.281 7.919 1.00 0.00 H ATOM 2418 N TYR A1099 15.032 -4.545 5.987 1.00 11.16 N ATOM 2419 CA TYR A1099 15.872 -3.460 5.529 1.00 10.19 C ATOM 2420 C TYR A1099 17.278 -3.586 6.139 1.00 11.86 C ATOM 2421 O TYR A1099 18.262 -3.244 5.476 1.00 11.05 O ATOM 2422 CB TYR A1099 15.230 -2.087 5.836 1.00 11.59 C ATOM 2423 CG TYR A1099 15.965 -0.940 5.178 1.00 11.48 C ATOM 2424 CD1 TYR A1099 16.067 -0.857 3.793 1.00 11.64 C ATOM 2425 CD2 TYR A1099 16.575 0.053 5.941 1.00 13.85 C ATOM 2426 CE1 TYR A1099 16.736 0.194 3.181 1.00 11.74 C ATOM 2427 CE2 TYR A1099 17.233 1.120 5.338 1.00 14.05 C ATOM 2428 CZ TYR A1099 17.339 1.166 3.959 1.00 12.82 C ATOM 2429 OH TYR A1099 17.967 2.233 3.366 1.00 14.72 O ATOM 2430 HH TYR A1099 17.959 2.115 2.383 1.00 0.00 H ATOM 2431 H TYR A1099 14.187 -4.348 6.561 1.00 0.00 H ATOM 2432 N MET A1100 17.406 -4.147 7.370 1.00 10.90 N ATOM 2433 CA MET A1100 18.710 -4.329 7.973 1.00 11.69 C ATOM 2434 C MET A1100 19.538 -5.317 7.173 1.00 11.56 C ATOM 2435 O MET A1100 20.755 -5.134 7.039 1.00 10.84 O ATOM 2436 CB MET A1100 18.564 -4.848 9.402 1.00 15.95 C ATOM 2437 CG MET A1100 19.888 -4.864 10.165 1.00 24.12 C ATOM 2438 SD MET A1100 19.868 -5.790 11.734 1.00 35.51 S ATOM 2439 CE MET A1100 18.630 -4.876 12.657 1.00 33.09 C ATOM 2440 H MET A1100 16.556 -4.450 7.886 1.00 0.00 H ATOM 2441 N ILE A1101 18.889 -6.367 6.600 1.00 10.22 N ATOM 2442 CA ILE A1101 19.663 -7.315 5.776 1.00 9.40 C ATOM 2443 C ILE A1101 20.179 -6.584 4.522 1.00 9.23 C ATOM 2444 O ILE A1101 21.343 -6.721 4.151 1.00 8.92 O ATOM 2445 CB ILE A1101 18.784 -8.512 5.407 1.00 10.67 C ATOM 2446 CG1 ILE A1101 18.453 -9.344 6.656 1.00 11.67 C ATOM 2447 CG2 ILE A1101 19.469 -9.402 4.339 1.00 11.32 C ATOM 2448 CD1 ILE A1101 17.299 -10.401 6.367 1.00 16.93 C ATOM 2449 H ILE A1101 17.867 -6.499 6.740 1.00 0.00 H ATOM 2450 N MET A1102 19.311 -5.764 3.886 1.00 8.71 N ATOM 2451 CA MET A1102 19.761 -4.987 2.731 1.00 8.41 C ATOM 2452 C MET A1102 20.952 -4.100 3.099 1.00 9.28 C ATOM 2453 O MET A1102 21.983 -4.104 2.412 1.00 9.14 O ATOM 2454 CB MET A1102 18.645 -4.073 2.206 1.00 9.67 C ATOM 2455 CG MET A1102 17.402 -4.802 1.720 1.00 8.75 C ATOM 2456 SD MET A1102 16.175 -3.546 1.229 1.00 10.82 S ATOM 2457 CE MET A1102 14.667 -4.473 1.479 1.00 11.19 C ATOM 2458 H MET A1102 18.328 -5.686 4.217 1.00 0.00 H ATOM 2459 N THR A1103 20.831 -3.381 4.234 1.00 9.66 N ATOM 2460 CA THR A1103 21.889 -2.467 4.633 1.00 10.14 C ATOM 2461 C THR A1103 23.215 -3.155 4.882 1.00 11.20 C ATOM 2462 O THR A1103 24.264 -2.605 4.559 1.00 10.23 O ATOM 2463 CB THR A1103 21.424 -1.847 6.017 1.00 11.74 C ATOM 2464 OG1 THR A1103 20.168 -1.162 5.886 1.00 10.87 O ATOM 2465 CG2 THR A1103 22.475 -0.934 6.676 1.00 12.36 C ATOM 2466 HG1 THR A1103 19.905 -0.787 6.764 1.00 0.00 H ATOM 2467 H THR A1103 19.980 -3.481 4.824 1.00 0.00 H ATOM 2468 N GLU A1104 23.172 -4.366 5.487 1.00 9.32 N ATOM 2469 CA GLU A1104 24.382 -5.135 5.753 1.00 9.40 C ATOM 2470 C GLU A1104 25.008 -5.679 4.478 1.00 9.19 C ATOM 2471 O GLU A1104 26.218 -5.776 4.376 1.00 9.48 O ATOM 2472 CB GLU A1104 24.119 -6.265 6.732 1.00 12.19 C ATOM 2473 CG GLU A1104 23.833 -5.754 8.134 1.00 19.48 C ATOM 2474 CD GLU A1104 23.308 -6.777 9.124 1.00 41.66 C ATOM 2475 OE1 GLU A1104 23.293 -7.986 8.795 1.00 33.67 O ATOM 2476 OE2 GLU A1104 22.909 -6.363 10.235 1.00 39.18 O ATOM 2477 H GLU A1104 22.251 -4.758 5.769 1.00 0.00 H ATOM 2478 N CYS A1105 24.192 -6.030 3.475 1.00 8.24 N ATOM 2479 CA CYS A1105 24.725 -6.410 2.181 1.00 7.68 C ATOM 2480 C CYS A1105 25.425 -5.215 1.510 1.00 8.73 C ATOM 2481 O CYS A1105 26.431 -5.387 0.808 1.00 10.25 O ATOM 2482 CB CYS A1105 23.611 -6.951 1.303 1.00 7.98 C ATOM 2483 SG CYS A1105 22.959 -8.543 1.844 1.00 9.76 S ATOM 2484 H CYS A1105 23.163 -6.030 3.626 1.00 0.00 H ATOM 2485 N TRP A1106 24.871 -4.017 1.715 1.00 8.35 N ATOM 2486 CA TRP A1106 25.403 -2.795 1.096 1.00 8.76 C ATOM 2487 C TRP A1106 26.487 -2.167 1.971 1.00 10.46 C ATOM 2488 O TRP A1106 26.406 -0.982 2.337 1.00 12.98 O ATOM 2489 CB TRP A1106 24.293 -1.792 0.835 1.00 8.47 C ATOM 2490 CG TRP A1106 23.166 -2.285 -0.029 1.00 7.71 C ATOM 2491 CD1 TRP A1106 23.229 -3.169 -1.074 1.00 9.02 C ATOM 2492 CD2 TRP A1106 21.807 -1.868 0.072 1.00 7.02 C ATOM 2493 NE1 TRP A1106 21.976 -3.323 -1.629 1.00 8.66 N ATOM 2494 CE2 TRP A1106 21.081 -2.535 -0.941 1.00 8.61 C ATOM 2495 CE3 TRP A1106 21.128 -0.990 0.932 1.00 8.28 C ATOM 2496 CZ2 TRP A1106 19.709 -2.295 -1.151 1.00 8.77 C ATOM 2497 CZ3 TRP A1106 19.772 -0.779 0.748 1.00 8.75 C ATOM 2498 CH2 TRP A1106 19.070 -1.443 -0.277 1.00 9.09 C ATOM 2499 HE1 TRP A1106 21.745 -3.936 -2.437 1.00 0.00 H ATOM 2500 H TRP A1106 24.037 -3.947 2.332 1.00 0.00 H ATOM 2501 N ASN A1107 27.459 -2.961 2.353 1.00 10.51 N ATOM 2502 CA ASN A1107 28.566 -2.438 3.135 1.00 9.97 C ATOM 2503 C ASN A1107 29.688 -2.106 2.172 1.00 11.04 C ATOM 2504 O ASN A1107 30.062 -2.950 1.371 1.00 10.67 O ATOM 2505 CB ASN A1107 28.974 -3.526 4.145 1.00 10.12 C ATOM 2506 CG ASN A1107 29.840 -2.972 5.262 1.00 14.05 C ATOM 2507 OD1 ASN A1107 30.644 -2.047 5.052 1.00 13.29 O ATOM 2508 ND2 ASN A1107 29.704 -3.549 6.437 1.00 13.73 N ATOM 2509 HD22 ASN A1107 29.017 -4.319 6.562 1.00 0.00 H ATOM 2510 HD21 ASN A1107 30.284 -3.234 7.241 1.00 0.00 H ATOM 2511 H ASN A1107 27.437 -3.968 2.095 1.00 0.00 H ATOM 2512 N ASN A1108 30.294 -0.877 2.248 1.00 11.32 N ATOM 2513 CA ASN A1108 31.419 -0.587 1.366 1.00 11.74 C ATOM 2514 C ASN A1108 32.648 -1.417 1.743 1.00 13.02 C ATOM 2515 O ASN A1108 33.527 -1.601 0.905 1.00 13.31 O ATOM 2516 CB ASN A1108 31.789 0.888 1.403 1.00 11.15 C ATOM 2517 CG ASN A1108 30.705 1.801 0.840 1.00 13.66 C ATOM 2518 OD1 ASN A1108 29.733 1.367 0.197 1.00 13.05 O ATOM 2519 ND2 ASN A1108 30.842 3.114 1.075 1.00 13.61 N ATOM 2520 HD22 ASN A1108 31.660 3.463 1.614 1.00 0.00 H ATOM 2521 HD21 ASN A1108 30.130 3.783 0.718 1.00 0.00 H ATOM 2522 H ASN A1108 29.956 -0.163 2.924 1.00 0.00 H ATOM 2523 N ASN A1109 32.685 -1.928 3.001 1.00 11.93 N ATOM 2524 CA ASN A1109 33.767 -2.797 3.443 1.00 11.52 C ATOM 2525 C ASN A1109 33.407 -4.202 2.922 1.00 11.84 C ATOM 2526 O ASN A1109 32.509 -4.874 3.469 1.00 12.54 O ATOM 2527 CB ASN A1109 33.896 -2.756 4.942 1.00 13.04 C ATOM 2528 CG ASN A1109 35.055 -3.583 5.461 1.00 24.98 C ATOM 2529 OD1 ASN A1109 35.237 -4.756 5.112 1.00 24.83 O ATOM 2530 ND2 ASN A1109 35.838 -3.005 6.368 1.00 26.71 N ATOM 2531 HD22 ASN A1109 35.669 -2.018 6.648 1.00 0.00 H ATOM 2532 HD21 ASN A1109 36.620 -3.540 6.797 1.00 0.00 H ATOM 2533 H ASN A1109 31.921 -1.693 3.666 1.00 0.00 H ATOM 2534 N VAL A1110 34.111 -4.623 1.925 1.00 11.50 N ATOM 2535 CA VAL A1110 33.846 -5.856 1.201 1.00 11.64 C ATOM 2536 C VAL A1110 33.799 -7.067 2.121 1.00 14.73 C ATOM 2537 O VAL A1110 32.855 -7.860 2.082 1.00 13.18 O ATOM 2538 CB VAL A1110 34.851 -6.036 0.038 1.00 14.21 C ATOM 2539 CG1 VAL A1110 34.724 -7.399 -0.614 1.00 16.33 C ATOM 2540 CG2 VAL A1110 34.709 -4.935 -1.008 1.00 13.02 C ATOM 2541 H VAL A1110 34.919 -4.043 1.620 1.00 0.00 H ATOM 2542 N ASN A1111 34.790 -7.188 3.005 1.00 12.75 N ATOM 2543 CA ASN A1111 34.885 -8.346 3.865 1.00 12.75 C ATOM 2544 C ASN A1111 33.853 -8.394 4.951 1.00 15.14 C ATOM 2545 O ASN A1111 33.597 -9.473 5.491 1.00 16.12 O ATOM 2546 CB ASN A1111 36.297 -8.454 4.430 1.00 16.43 C ATOM 2547 CG ASN A1111 37.332 -8.864 3.398 1.00 39.82 C ATOM 2548 OD1 ASN A1111 37.047 -9.570 2.421 1.00 32.37 O ATOM 2549 ND2 ASN A1111 38.574 -8.458 3.606 1.00 38.73 N ATOM 2550 HD22 ASN A1111 38.796 -7.866 4.431 1.00 0.00 H ATOM 2551 HD21 ASN A1111 39.328 -8.731 2.944 1.00 0.00 H ATOM 2552 H ASN A1111 35.506 -6.437 3.077 1.00 0.00 H ATOM 2553 N GLN A1112 33.230 -7.266 5.285 1.00 11.91 N ATOM 2554 CA GLN A1112 32.207 -7.208 6.295 1.00 11.87 C ATOM 2555 C GLN A1112 30.819 -7.607 5.784 1.00 13.07 C ATOM 2556 O GLN A1112 29.889 -7.785 6.584 1.00 13.09 O ATOM 2557 CB GLN A1112 32.145 -5.837 6.957 1.00 12.98 C ATOM 2558 CG GLN A1112 33.353 -5.543 7.854 1.00 17.65 C ATOM 2559 CD GLN A1112 33.274 -4.151 8.463 1.00 33.07 C ATOM 2560 OE1 GLN A1112 32.267 -3.429 8.360 1.00 26.90 O ATOM 2561 NE2 GLN A1112 34.348 -3.736 9.115 1.00 33.55 N ATOM 2562 HE22 GLN A1112 35.181 -4.354 9.191 1.00 0.00 H ATOM 2563 HE21 GLN A1112 34.359 -2.792 9.552 1.00 0.00 H ATOM 2564 H GLN A1112 33.494 -6.388 4.794 1.00 0.00 H ATOM 2565 N ARG A1113 30.662 -7.768 4.451 1.00 10.44 N ATOM 2566 CA ARG A1113 29.367 -8.210 3.949 1.00 10.04 C ATOM 2567 C ARG A1113 29.098 -9.643 4.437 1.00 9.57 C ATOM 2568 O ARG A1113 30.047 -10.430 4.517 1.00 10.50 O ATOM 2569 CB ARG A1113 29.332 -8.163 2.412 1.00 9.44 C ATOM 2570 CG ARG A1113 29.457 -6.729 1.889 1.00 8.98 C ATOM 2571 CD ARG A1113 29.466 -6.693 0.384 1.00 10.08 C ATOM 2572 NE ARG A1113 29.885 -5.345 -0.012 1.00 8.61 N ATOM 2573 CZ ARG A1113 30.594 -5.039 -1.091 1.00 9.19 C ATOM 2574 NH1 ARG A1113 30.809 -5.944 -2.037 1.00 8.71 N ATOM 2575 NH2 ARG A1113 31.042 -3.796 -1.268 1.00 10.54 N ATOM 2576 HE ARG A1113 29.601 -4.559 0.608 1.00 0.00 H ATOM 2577 HH12 ARG A1113 31.366 -5.694 -2.879 1.00 0.00 H ATOM 2578 HH11 ARG A1113 30.420 -6.903 -1.937 1.00 0.00 H ATOM 2579 HH22 ARG A1113 31.597 -3.559 -2.115 1.00 0.00 H ATOM 2580 HH21 ARG A1113 30.836 -3.063 -0.559 1.00 0.00 H ATOM 2581 H ARG A1113 31.449 -7.580 3.797 1.00 0.00 H ATOM 2582 N PRO A1114 27.856 -10.007 4.706 1.00 9.55 N ATOM 2583 CA PRO A1114 27.579 -11.392 5.095 1.00 9.01 C ATOM 2584 C PRO A1114 27.784 -12.364 3.937 1.00 9.24 C ATOM 2585 O PRO A1114 27.878 -11.954 2.781 1.00 9.78 O ATOM 2586 CB PRO A1114 26.113 -11.335 5.513 1.00 10.83 C ATOM 2587 CG PRO A1114 25.524 -10.183 4.744 1.00 14.16 C ATOM 2588 CD PRO A1114 26.638 -9.184 4.649 1.00 10.43 C ATOM 2589 N SER A1115 27.854 -13.649 4.254 1.00 9.12 N ATOM 2590 CA SER A1115 27.959 -14.642 3.228 1.00 8.51 C ATOM 2591 C SER A1115 26.559 -15.073 2.778 1.00 8.96 C ATOM 2592 O SER A1115 25.570 -14.872 3.507 1.00 8.73 O ATOM 2593 CB SER A1115 28.727 -15.852 3.752 1.00 9.22 C ATOM 2594 OG SER A1115 27.951 -16.511 4.745 1.00 10.51 O ATOM 2595 HG SER A1115 28.450 -17.296 5.085 1.00 0.00 H ATOM 2596 H SER A1115 27.833 -13.937 5.253 1.00 0.00 H ATOM 2597 N PHE A1116 26.478 -15.788 1.641 1.00 7.83 N ATOM 2598 CA PHE A1116 25.180 -16.326 1.257 1.00 7.48 C ATOM 2599 C PHE A1116 24.689 -17.392 2.249 1.00 8.96 C ATOM 2600 O PHE A1116 23.471 -17.537 2.429 1.00 8.54 O ATOM 2601 CB PHE A1116 25.181 -16.856 -0.187 1.00 7.90 C ATOM 2602 CG PHE A1116 25.112 -15.741 -1.196 1.00 7.18 C ATOM 2603 CD1 PHE A1116 23.971 -14.971 -1.319 1.00 7.83 C ATOM 2604 CD2 PHE A1116 26.204 -15.445 -2.015 1.00 7.99 C ATOM 2605 CE1 PHE A1116 23.892 -13.949 -2.255 1.00 8.44 C ATOM 2606 CE2 PHE A1116 26.112 -14.435 -2.979 1.00 8.96 C ATOM 2607 CZ PHE A1116 24.965 -13.662 -3.063 1.00 8.82 C ATOM 2608 H PHE A1116 27.319 -15.952 1.052 1.00 0.00 H ATOM 2609 N ARG A1117 25.623 -18.121 2.891 1.00 8.15 N ATOM 2610 CA ARG A1117 25.217 -19.112 3.878 1.00 9.04 C ATOM 2611 C ARG A1117 24.588 -18.391 5.090 1.00 9.23 C ATOM 2612 O ARG A1117 23.526 -18.811 5.591 1.00 9.37 O ATOM 2613 CB ARG A1117 26.447 -19.937 4.268 1.00 10.90 C ATOM 2614 CG ARG A1117 26.151 -21.209 5.069 1.00 11.73 C ATOM 2615 CD ARG A1117 27.442 -22.016 5.362 1.00 12.80 C ATOM 2616 NE ARG A1117 28.219 -22.335 4.153 1.00 16.30 N ATOM 2617 CZ ARG A1117 29.456 -21.930 3.875 1.00 16.48 C ATOM 2618 NH1 ARG A1117 30.174 -21.266 4.784 1.00 17.37 N ATOM 2619 NH2 ARG A1117 30.018 -22.251 2.717 1.00 18.85 N ATOM 2620 HE ARG A1117 27.754 -22.938 3.444 1.00 0.00 H ATOM 2621 HH12 ARG A1117 31.140 -20.954 4.557 1.00 0.00 H ATOM 2622 HH11 ARG A1117 29.768 -21.061 5.719 1.00 0.00 H ATOM 2623 HH22 ARG A1117 30.985 -21.933 2.502 1.00 0.00 H ATOM 2624 HH21 ARG A1117 29.492 -22.820 2.024 1.00 0.00 H ATOM 2625 H ARG A1117 26.631 -17.976 2.682 1.00 0.00 H ATOM 2626 N ASP A1118 25.212 -17.294 5.546 1.00 8.70 N ATOM 2627 CA ASP A1118 24.666 -16.482 6.643 1.00 8.93 C ATOM 2628 C ASP A1118 23.279 -15.993 6.264 1.00 9.59 C ATOM 2629 O ASP A1118 22.354 -16.005 7.079 1.00 9.14 O ATOM 2630 CB ASP A1118 25.496 -15.203 6.820 1.00 11.87 C ATOM 2631 CG ASP A1118 26.904 -15.348 7.322 1.00 11.60 C ATOM 2632 OD1 ASP A1118 27.202 -16.374 7.999 1.00 12.62 O ATOM 2633 OD2 ASP A1118 27.705 -14.398 7.125 1.00 12.99 O ATOM 2634 H ASP A1118 26.112 -17.009 5.109 1.00 0.00 H ATOM 2635 N LEU A1119 23.126 -15.487 5.032 1.00 8.27 N ATOM 2636 CA LEU A1119 21.853 -14.917 4.597 1.00 8.69 C ATOM 2637 C LEU A1119 20.741 -15.920 4.493 1.00 9.73 C ATOM 2638 O LEU A1119 19.621 -15.644 4.942 1.00 9.01 O ATOM 2639 CB LEU A1119 22.042 -14.196 3.250 1.00 8.49 C ATOM 2640 CG LEU A1119 22.911 -12.923 3.306 1.00 9.80 C ATOM 2641 CD1 LEU A1119 23.438 -12.523 1.917 1.00 9.91 C ATOM 2642 CD2 LEU A1119 22.144 -11.778 3.982 1.00 11.08 C ATOM 2643 H LEU A1119 23.930 -15.500 4.372 1.00 0.00 H ATOM 2644 N ALA A1120 21.019 -17.105 3.942 1.00 8.54 N ATOM 2645 CA ALA A1120 19.989 -18.130 3.842 1.00 8.64 C ATOM 2646 C ALA A1120 19.512 -18.513 5.246 1.00 8.83 C ATOM 2647 O ALA A1120 18.297 -18.638 5.465 1.00 9.65 O ATOM 2648 CB ALA A1120 20.525 -19.345 3.138 1.00 9.95 C ATOM 2649 H ALA A1120 21.976 -17.297 3.583 1.00 0.00 H ATOM 2650 N LEU A1121 20.447 -18.682 6.197 1.00 8.39 N ATOM 2651 CA LEU A1121 20.055 -19.069 7.555 1.00 8.15 C ATOM 2652 C LEU A1121 19.220 -17.957 8.173 1.00 10.23 C ATOM 2653 O LEU A1121 18.176 -18.230 8.780 1.00 10.51 O ATOM 2654 CB LEU A1121 21.324 -19.332 8.385 1.00 9.92 C ATOM 2655 CG LEU A1121 21.991 -20.652 8.077 1.00 11.92 C ATOM 2656 CD1 LEU A1121 23.350 -20.688 8.705 1.00 12.98 C ATOM 2657 CD2 LEU A1121 21.137 -21.800 8.603 1.00 12.35 C ATOM 2658 H LEU A1121 21.451 -18.538 5.968 1.00 0.00 H ATOM 2659 N ARG A1122 19.638 -16.711 8.026 1.00 8.91 N ATOM 2660 CA ARG A1122 18.899 -15.609 8.636 1.00 10.15 C ATOM 2661 C ARG A1122 17.499 -15.519 8.079 1.00 11.80 C ATOM 2662 O ARG A1122 16.513 -15.392 8.835 1.00 10.82 O ATOM 2663 CB ARG A1122 19.688 -14.299 8.414 1.00 9.97 C ATOM 2664 CG ARG A1122 18.985 -13.010 8.914 1.00 14.15 C ATOM 2665 CD ARG A1122 18.464 -13.053 10.351 1.00 19.65 C ATOM 2666 NE ARG A1122 17.978 -11.735 10.774 1.00 20.66 N ATOM 2667 CZ ARG A1122 17.094 -11.511 11.748 1.00 22.88 C ATOM 2668 NH1 ARG A1122 16.548 -12.530 12.414 1.00 19.74 N ATOM 2669 NH2 ARG A1122 16.731 -10.270 12.049 1.00 26.50 N ATOM 2670 HE ARG A1122 18.354 -10.905 10.272 1.00 0.00 H ATOM 2671 HH12 ARG A1122 15.860 -12.347 13.172 1.00 0.00 H ATOM 2672 HH11 ARG A1122 16.811 -13.508 12.175 1.00 0.00 H ATOM 2673 HH22 ARG A1122 16.042 -10.100 12.809 1.00 0.00 H ATOM 2674 HH21 ARG A1122 17.136 -9.468 11.525 1.00 0.00 H ATOM 2675 H ARG A1122 20.497 -16.515 7.473 1.00 0.00 H ATOM 2676 N VAL A1123 17.368 -15.578 6.759 1.00 9.87 N ATOM 2677 CA VAL A1123 16.062 -15.481 6.120 1.00 10.10 C ATOM 2678 C VAL A1123 15.186 -16.678 6.500 1.00 11.53 C ATOM 2679 O VAL A1123 13.993 -16.497 6.794 1.00 12.71 O ATOM 2680 CB VAL A1123 16.230 -15.328 4.595 1.00 12.40 C ATOM 2681 CG1 VAL A1123 14.884 -15.490 3.871 1.00 13.13 C ATOM 2682 CG2 VAL A1123 16.867 -13.968 4.261 1.00 12.35 C ATOM 2683 H VAL A1123 18.216 -15.696 6.168 1.00 0.00 H ATOM 2684 N ASP A1124 15.737 -17.900 6.546 1.00 10.04 N ATOM 2685 CA ASP A1124 14.937 -19.054 6.918 1.00 10.50 C ATOM 2686 C ASP A1124 14.535 -19.005 8.374 1.00 12.73 C ATOM 2687 O ASP A1124 13.415 -19.441 8.693 1.00 12.82 O ATOM 2688 CB ASP A1124 15.649 -20.345 6.596 1.00 11.21 C ATOM 2689 CG ASP A1124 15.649 -20.671 5.118 1.00 13.68 C ATOM 2690 OD1 ASP A1124 14.903 -20.013 4.362 1.00 14.18 O ATOM 2691 OD2 ASP A1124 16.441 -21.534 4.708 1.00 17.15 O ATOM 2692 H ASP A1124 16.743 -18.022 6.314 1.00 0.00 H ATOM 2693 N GLN A1125 15.372 -18.444 9.244 1.00 11.21 N ATOM 2694 CA GLN A1125 14.991 -18.294 10.654 1.00 11.52 C ATOM 2695 C GLN A1125 13.854 -17.289 10.791 1.00 15.70 C ATOM 2696 O GLN A1125 12.893 -17.564 11.520 1.00 15.72 O ATOM 2697 CB GLN A1125 16.190 -17.904 11.490 1.00 11.80 C ATOM 2698 CG GLN A1125 17.160 -19.085 11.675 1.00 11.88 C ATOM 2699 CD GLN A1125 18.576 -18.642 11.960 1.00 13.95 C ATOM 2700 OE1 GLN A1125 18.910 -17.445 11.947 1.00 14.97 O ATOM 2701 NE2 GLN A1125 19.436 -19.610 12.172 1.00 14.50 N ATOM 2702 HE22 GLN A1125 19.115 -20.599 12.175 1.00 0.00 H ATOM 2703 HE21 GLN A1125 20.438 -19.388 12.337 1.00 0.00 H ATOM 2704 H GLN A1125 16.303 -18.109 8.923 1.00 0.00 H ATOM 2705 N ILE A1126 13.902 -16.150 10.078 1.00 12.89 N ATOM 2706 CA ILE A1126 12.818 -15.155 10.131 1.00 12.96 C ATOM 2707 C ILE A1126 11.530 -15.810 9.649 1.00 17.81 C ATOM 2708 O ILE A1126 10.481 -15.643 10.298 1.00 18.41 O ATOM 2709 CB ILE A1126 13.196 -13.908 9.280 1.00 14.75 C ATOM 2710 CG1 ILE A1126 14.328 -13.139 9.919 1.00 14.49 C ATOM 2711 CG2 ILE A1126 11.967 -12.993 9.037 1.00 16.43 C ATOM 2712 CD1 ILE A1126 14.962 -12.036 8.979 1.00 17.91 C ATOM 2713 H ILE A1126 14.727 -15.967 9.472 1.00 0.00 H ATOM 2714 N ARG A1127 11.572 -16.563 8.543 1.00 15.83 N ATOM 2715 CA ARG A1127 10.376 -17.277 8.042 1.00 17.53 C ATOM 2716 C ARG A1127 9.848 -18.278 9.091 1.00 23.31 C ATOM 2717 O ARG A1127 8.633 -18.322 9.353 1.00 24.51 O ATOM 2718 CB ARG A1127 10.758 -18.094 6.814 1.00 19.59 C ATOM 2719 CG ARG A1127 11.100 -17.221 5.636 1.00 19.17 C ATOM 2720 CD ARG A1127 11.658 -18.041 4.478 1.00 16.22 C ATOM 2721 NE ARG A1127 10.622 -18.938 3.967 1.00 18.78 N ATOM 2722 CZ ARG A1127 10.832 -20.148 3.467 1.00 21.85 C ATOM 2723 NH1 ARG A1127 12.053 -20.668 3.453 1.00 20.48 N ATOM 2724 NH2 ARG A1127 9.822 -20.866 3.022 1.00 22.85 N ATOM 2725 HE ARG A1127 9.639 -18.599 3.998 1.00 0.00 H ATOM 2726 HH12 ARG A1127 12.209 -21.618 3.059 1.00 0.00 H ATOM 2727 HH11 ARG A1127 12.854 -20.126 3.836 1.00 0.00 H ATOM 2728 HH22 ARG A1127 9.991 -21.815 2.631 1.00 0.00 H ATOM 2729 HH21 ARG A1127 8.855 -20.485 3.062 1.00 0.00 H ATOM 2730 H ARG A1127 12.468 -16.649 8.022 1.00 0.00 H ATOM 2731 N ASP A1128 10.732 -19.070 9.684 1.00 21.63 N ATOM 2732 CA ASP A1128 10.372 -20.100 10.673 1.00 21.23 C ATOM 2733 C ASP A1128 9.855 -19.546 12.008 1.00 26.31 C ATOM 2734 O ASP A1128 9.098 -20.235 12.720 1.00 26.10 O ATOM 2735 CB ASP A1128 11.534 -21.036 10.914 1.00 21.79 C ATOM 2736 CG ASP A1128 11.211 -22.129 11.902 1.00 24.37 C ATOM 2737 OD1 ASP A1128 11.730 -22.076 13.024 1.00 25.66 O ATOM 2738 OD2 ASP A1128 10.414 -23.019 11.553 1.00 28.73 O ATOM 2739 H ASP A1128 11.736 -18.957 9.436 1.00 0.00 H ATOM 2740 N ASN A1129 10.274 -18.326 12.364 1.00 22.51 N ATOM 2741 CA ASN A1129 9.806 -17.664 13.584 1.00 27.79 C ATOM 2742 C ASN A1129 8.575 -16.839 13.200 1.00 68.42 C ATOM 2743 O ASN A1129 7.578 -16.828 13.917 1.00 48.68 O ATOM 2744 CB ASN A1129 10.874 -16.734 14.150 1.00 22.17 C ATOM 2745 CG ASN A1129 12.105 -17.354 14.728 1.00 36.02 C ATOM 2746 OD1 ASN A1129 12.125 -18.491 15.209 1.00 28.63 O ATOM 2747 ND2 ASN A1129 13.154 -16.557 14.779 1.00 30.52 N ATOM 2748 HD22 ASN A1129 13.104 -15.605 14.364 1.00 0.00 H ATOM 2749 HD21 ASN A1129 14.031 -16.881 15.234 1.00 0.00 H ATOM 2750 H ASN A1129 10.955 -17.831 11.754 1.00 0.00 H TER 2751 ASN A1129 HETATM 2752 O HOH 1 32.444 -10.624 2.364 1.00 14.06 O HETATM 2753 O HOH 2 34.080 -7.126 -5.383 1.00 13.14 O HETATM 2754 O HOH 3 29.186 -9.353 -8.661 1.00 10.02 O HETATM 2755 O HOH 4 27.203 -7.496 -9.360 1.00 11.44 O HETATM 2756 O HOH 5 25.538 -10.089 -9.100 1.00 10.20 O HETATM 2757 O HOH 6 28.920 -5.522 -8.456 1.00 11.32 O HETATM 2758 O HOH 7 23.584 -0.643 -6.057 1.00 10.25 O HETATM 2759 O HOH 8 25.263 0.610 -7.758 1.00 10.56 O HETATM 2760 O HOH 9 22.733 -0.472 -3.437 1.00 11.33 O HETATM 2761 O HOH 10 21.379 1.075 -1.647 1.00 10.00 O HETATM 2762 O HOH 11 32.788 -16.554 -13.001 1.00 11.63 O HETATM 2763 O HOH 12 28.964 -16.197 -6.562 1.00 11.88 O HETATM 2764 O HOH 13 28.219 -17.319 -4.244 1.00 9.54 O HETATM 2765 O HOH 14 29.489 -18.039 -1.967 1.00 11.12 O HETATM 2766 O HOH 15 29.135 -20.844 -1.776 1.00 12.58 O HETATM 2767 O HOH 16 15.913 -6.398 -12.337 1.00 11.04 O HETATM 2768 O HOH 17 13.226 -3.482 -10.290 1.00 17.93 O HETATM 2769 O HOH 18 11.764 -2.339 -8.222 1.00 22.26 O HETATM 2770 O HOH 19 9.042 -14.411 -22.029 1.00 30.40 O HETATM 2771 O HOH 20 21.440 -25.995 -15.419 1.00 22.33 O HETATM 2772 O HOH 21 19.844 -26.443 -12.340 1.00 15.89 O HETATM 2773 O HOH 22 16.478 -26.669 -11.571 1.00 21.36 O HETATM 2774 O HOH 23 26.652 -16.234 -24.178 1.00 24.35 O HETATM 2775 O HOH 24 9.905 -0.713 -9.802 1.00 32.95 O HETATM 2776 O HOH 25 13.696 8.803 -11.391 1.00 19.43 O HETATM 2777 O HOH 26 23.805 -7.154 -11.004 1.00 14.75 O HETATM 2778 O HOH 27 23.046 -5.487 -12.963 1.00 16.84 O HETATM 2779 O HOH 28 24.781 -6.838 -15.136 1.00 22.73 O HETATM 2780 O HOH 29 14.357 -10.112 -17.994 1.00 20.15 O HETATM 2781 O HOH 30 12.175 -8.728 -16.917 1.00 23.07 O HETATM 2782 O HOH 31 9.874 -12.337 -18.447 1.00 29.21 O HETATM 2783 O HOH 32 4.772 -13.532 -14.973 1.00 23.42 O HETATM 2784 O HOH 33 23.538 -29.130 -16.125 1.00 17.81 O HETATM 2785 O HOH 34 18.676 -28.997 -12.050 1.00 35.95 O HETATM 2786 O HOH 35 20.787 -29.723 -16.114 1.00 21.91 O HETATM 2787 O HOH 36 26.398 -30.314 -8.774 1.00 34.04 O HETATM 2788 O HOH 37 21.843 -29.542 -6.122 1.00 18.80 O HETATM 2789 O HOH 38 19.058 -28.711 -5.434 1.00 19.02 O HETATM 2790 O HOH 39 13.238 -24.412 -3.836 1.00 16.72 O HETATM 2791 O HOH 40 10.780 -27.584 -19.993 1.00 18.51 O HETATM 2792 O HOH 41 7.009 -29.740 -21.076 1.00 27.12 O HETATM 2793 O HOH 42 34.560 -20.792 -25.237 1.00 24.97 O HETATM 2794 O HOH 43 23.613 -15.436 -20.301 1.00 25.99 O HETATM 2795 O HOH 44 28.068 -16.974 -19.370 1.00 31.17 O HETATM 2796 O HOH 45 30.310 -15.982 -18.075 1.00 32.27 O HETATM 2797 O HOH 46 29.666 -16.394 -21.467 1.00 36.22 O HETATM 2798 O HOH 47 15.702 -4.293 -14.178 1.00 17.11 O HETATM 2799 O HOH 48 27.856 -5.782 6.686 1.00 14.46 O HETATM 2800 O HOH 49 26.605 -2.187 5.960 1.00 17.71 O HETATM 2801 O HOH 50 24.045 0.251 3.776 1.00 15.42 O HETATM 2802 O HOH 51 29.521 1.174 4.062 1.00 15.27 O HETATM 2803 O HOH 52 28.555 3.686 3.724 1.00 23.30 O HETATM 2804 O HOH 53 27.699 0.387 5.807 1.00 22.13 O HETATM 2805 O HOH 54 30.405 5.912 3.812 1.00 14.62 O HETATM 2806 O HOH 55 33.879 -1.236 -1.772 1.00 18.54 O HETATM 2807 O HOH 56 36.762 -3.189 1.347 1.00 19.61 O HETATM 2808 O HOH 57 36.473 -7.776 -4.214 1.00 18.53 O HETATM 2809 O HOH 58 36.409 -10.073 -2.614 1.00 20.25 O HETATM 2810 O HOH 59 34.386 -12.061 -2.138 1.00 13.84 O HETATM 2811 O HOH 60 24.094 15.506 -17.082 1.00 21.36 O HETATM 2812 O HOH 61 8.307 -17.972 3.643 1.00 24.10 O HETATM 2813 O HOH 62 14.180 -22.176 0.458 1.00 17.57 O HETATM 2814 O HOH 63 16.096 -27.714 -2.834 1.00 42.34 O HETATM 2815 O HOH 64 16.648 -25.108 -2.460 1.00 21.60 O HETATM 2816 O HOH 65 6.237 -12.425 -17.877 1.00 33.28 O HETATM 2817 O HOH 66 4.908 -16.362 -19.714 1.00 22.49 O HETATM 2818 O HOH 67 15.354 -22.593 -17.746 1.00 23.70 O HETATM 2819 O HOH 68 21.376 -31.004 -33.007 1.00 22.38 O HETATM 2820 O HOH 69 17.457 -32.255 -37.935 1.00 27.40 O HETATM 2821 O HOH 70 16.557 -20.775 -18.782 1.00 20.17 O HETATM 2822 O HOH 71 12.522 -11.618 -19.718 1.00 29.38 O HETATM 2823 O HOH 72 25.357 -12.201 -31.072 1.00 21.53 O HETATM 2824 O HOH 73 30.528 -25.430 -24.984 1.00 32.65 O HETATM 2825 O HOH 74 34.163 -22.885 -23.545 1.00 29.28 O HETATM 2826 O HOH 75 31.013 -27.997 -18.106 1.00 27.92 O HETATM 2827 O HOH 76 19.056 -28.479 -2.697 1.00 27.54 O HETATM 2828 O HOH 77 12.050 -21.909 -34.185 1.00 31.87 O HETATM 2829 O HOH 78 4.956 -4.651 0.982 1.00 36.20 O HETATM 2830 O HOH 79 26.859 -22.823 1.683 1.00 11.15 O HETATM 2831 O HOH 80 27.784 -20.516 0.516 1.00 14.71 O HETATM 2832 O HOH 81 33.208 -19.247 -4.316 1.00 14.42 O HETATM 2833 O HOH 82 32.903 -18.052 -6.774 1.00 15.86 O HETATM 2834 O HOH 83 31.418 -22.325 -1.201 1.00 17.52 O HETATM 2835 O HOH 84 32.237 -18.338 -1.909 1.00 13.48 O HETATM 2836 O HOH 85 32.882 -15.769 5.361 1.00 21.09 O HETATM 2837 O HOH 86 29.033 -16.457 0.312 1.00 10.19 O HETATM 2838 O HOH 87 35.185 -16.587 -6.975 1.00 25.19 O HETATM 2839 O HOH 88 35.013 -14.155 -5.284 1.00 18.85 O HETATM 2840 O HOH 89 35.332 -14.570 -2.690 1.00 22.67 O HETATM 2841 O HOH 90 34.134 -16.468 -1.151 1.00 20.49 O HETATM 2842 O HOH 91 33.209 -13.463 -13.353 1.00 25.53 O HETATM 2843 O HOH 92 30.452 -7.542 -15.957 1.00 49.01 O HETATM 2844 O HOH 93 21.968 -8.362 -16.963 1.00 29.48 O HETATM 2845 O HOH 94 16.420 -8.777 -19.101 1.00 27.43 O HETATM 2846 O HOH 95 18.881 -9.326 -18.112 1.00 28.54 O HETATM 2847 O HOH 96 16.649 -9.674 -21.619 1.00 40.33 O HETATM 2848 O HOH 97 14.493 -2.134 -12.492 1.00 20.10 O HETATM 2849 O HOH 98 28.131 -3.869 -17.237 1.00 32.01 O HETATM 2850 O HOH 99 34.050 1.316 -1.892 1.00 36.01 O HETATM 2851 O HOH 100 36.324 1.725 -4.618 1.00 37.04 O HETATM 2852 O HOH 101 36.661 -1.729 -1.349 1.00 27.56 O HETATM 2853 O HOH 102 38.027 -3.347 -3.063 1.00 37.15 O HETATM 2854 O HOH 103 38.081 -5.853 -2.968 1.00 27.87 O HETATM 2855 O HOH 104 37.327 -5.648 2.752 1.00 28.32 O HETATM 2856 O HOH 105 38.508 -7.075 -0.077 1.00 34.94 O HETATM 2857 O HOH 106 37.900 -9.583 -0.394 1.00 30.32 O HETATM 2858 O HOH 107 39.593 -5.589 -11.704 1.00 47.55 O HETATM 2859 O HOH 108 36.666 -8.933 -11.266 1.00 21.82 O HETATM 2860 O HOH 109 38.329 -8.874 -6.023 1.00 32.13 O HETATM 2861 O HOH 110 38.084 -11.813 -3.933 1.00 32.48 O HETATM 2862 O HOH 111 37.192 -12.930 -6.106 1.00 34.08 O HETATM 2863 O HOH 112 34.279 -12.126 0.557 1.00 20.02 O HETATM 2864 O HOH 113 30.832 -14.440 1.211 1.00 13.65 O HETATM 2865 O HOH 114 28.550 -18.534 2.045 1.00 13.14 O HETATM 2866 O HOH 115 11.156 2.069 -2.237 1.00 21.42 O HETATM 2867 O HOH 116 8.307 1.335 -1.822 1.00 24.35 O HETATM 2868 O HOH 117 7.743 -3.563 1.530 1.00 21.49 O HETATM 2869 O HOH 118 6.213 -3.164 -1.764 1.00 31.66 O HETATM 2870 O HOH 119 15.834 14.127 -8.996 1.00 23.70 O HETATM 2871 O HOH 120 17.711 6.919 0.805 1.00 28.90 O HETATM 2872 O HOH 121 23.750 14.542 -7.311 1.00 13.53 O HETATM 2873 O HOH 122 21.236 17.762 -12.349 1.00 29.11 O HETATM 2874 O HOH 123 21.911 9.155 -20.161 1.00 27.03 O HETATM 2875 O HOH 124 26.161 9.857 -0.042 1.00 15.28 O HETATM 2876 O HOH 125 34.587 8.547 1.288 1.00 20.19 O HETATM 2877 O HOH 126 25.209 2.029 5.481 1.00 22.95 O HETATM 2878 O HOH 127 21.935 5.758 4.096 1.00 21.38 O HETATM 2879 O HOH 128 20.564 3.448 4.754 1.00 26.79 O HETATM 2880 O HOH 129 20.701 7.609 1.725 1.00 26.36 O HETATM 2881 O HOH 130 14.663 4.908 4.321 1.00 28.55 O HETATM 2882 O HOH 131 6.054 -0.868 -0.724 1.00 35.42 O HETATM 2883 O HOH 132 9.526 -2.707 11.126 1.00 29.91 O HETATM 2884 O HOH 133 16.650 -1.399 9.460 1.00 27.27 O HETATM 2885 O HOH 134 17.925 -8.210 10.227 1.00 29.89 O HETATM 2886 O HOH 135 20.987 1.107 3.877 1.00 23.38 O HETATM 2887 O HOH 136 19.152 -0.670 8.409 1.00 22.99 O HETATM 2888 O HOH 137 25.966 -8.807 8.614 1.00 52.30 O HETATM 2889 O HOH 138 31.324 -0.370 7.090 1.00 27.75 O HETATM 2890 O HOH 139 31.795 2.108 5.443 1.00 35.73 O HETATM 2891 O HOH 140 33.440 3.737 2.288 1.00 24.21 O HETATM 2892 O HOH 141 29.990 -17.753 6.051 1.00 15.09 O HETATM 2893 O HOH 142 29.633 -16.328 9.101 1.00 18.64 O HETATM 2894 O HOH 143 22.947 -15.954 9.819 1.00 15.22 O HETATM 2895 O HOH 144 5.474 -15.064 -30.693 1.00 22.43 O HETATM 2896 O HOH 145 25.160 -9.404 -31.900 1.00 31.87 O HETATM 2897 O HOH 146 22.603 -19.201 -32.514 1.00 28.35 O HETATM 2898 O HOH 147 2.322 -14.493 -16.308 1.00 30.80 O HETATM 2899 O HOH 148 32.224 -27.771 -6.567 1.00 33.67 O HETATM 2900 O HOH 149 32.983 -25.371 -11.579 1.00 34.08 O HETATM 2901 O HOH 150 2.084 -18.374 -10.063 1.00 37.63 O HETATM 2902 O HOH 151 1.814 -21.031 -9.464 1.00 27.80 O HETATM 2903 O HOH 152 3.352 -15.893 -5.820 1.00 24.11 O HETATM 2904 O HOH 153 12.114 -21.444 7.092 1.00 20.04 O HETATM 2905 O HOH 154 11.505 -22.710 -0.187 1.00 23.80 O HETATM 2906 O HOH 155 13.576 -23.292 5.889 1.00 20.15 O HETATM 2907 O HOH 156 21.283 -29.441 -38.231 1.00 30.35 O HETATM 2908 O HOH 157 19.865 -30.728 -35.420 1.00 31.06 O HETATM 2909 O HOH 158 21.617 -32.087 -30.095 1.00 27.38 O HETATM 2910 O HOH 159 4.806 -24.127 -13.750 1.00 24.24 O HETATM 2911 O HOH 160 -0.356 -7.511 -10.471 1.00 28.18 O HETATM 2912 O HOH 161 32.243 -11.406 4.609 1.00 13.18 O HETATM 2913 O HOH 162 31.534 -13.600 4.012 1.00 18.73 O HETATM 2914 O HOH 163 34.461 -12.415 4.656 1.00 27.75 O HETATM 2915 O HOH 164 33.446 -14.703 0.848 1.00 21.46 O HETATM 2916 O HOH 165 19.303 -34.722 -24.037 1.00 51.17 O HETATM 2917 O HOH 166 13.225 -24.410 -34.411 1.00 32.68 O HETATM 2918 O HOH 167 9.065 -24.496 -36.244 1.00 29.43 O HETATM 2919 O HOH 168 6.907 -25.757 -18.564 1.00 36.08 O HETATM 2920 O HOH 169 24.167 -17.366 -35.168 1.00 22.75 O HETATM 2921 O HOH 170 25.936 -20.311 -33.104 1.00 26.59 O HETATM 2922 O HOH 171 25.425 -15.321 -37.075 1.00 20.03 O HETATM 2923 O HOH 172 30.109 -18.400 -37.535 1.00 24.03 O HETATM 2924 O HOH 173 31.845 -9.827 -31.973 1.00 33.78 O HETATM 2925 O HOH 174 35.031 -11.830 -32.825 1.00 33.76 O HETATM 2926 O HOH 175 34.445 -13.402 -36.108 1.00 33.74 O HETATM 2927 O HOH 176 34.762 -18.948 -32.069 1.00 25.93 O HETATM 2928 O HOH 177 33.975 -21.391 -31.498 1.00 22.16 O HETATM 2929 O HOH 178 33.482 -25.245 -24.754 1.00 34.29 O HETATM 2930 O HOH 179 24.354 -31.439 -17.720 1.00 31.67 O HETATM 2931 O HOH 180 25.197 -32.681 -10.180 1.00 40.93 O HETATM 2932 O HOH 181 18.235 -29.939 -9.064 1.00 31.04 O HETATM 2933 O HOH 182 15.015 -23.663 -1.791 1.00 28.90 O HETATM 2934 O HOH 183 8.772 -25.482 -15.532 1.00 37.23 O HETATM 2935 O HOH 184 -1.379 -18.112 -14.523 1.00 27.38 O HETATM 2936 O HOH 185 0.951 -22.248 -12.667 1.00 34.15 O HETATM 2937 O HOH 186 -2.252 -9.201 -11.419 1.00 28.86 O HETATM 2938 O HOH 187 -1.595 -10.761 -15.018 1.00 44.34 O HETATM 2939 O HOH 188 -2.468 -9.204 -3.122 1.00 19.74 O HETATM 2940 O HOH 189 -2.714 -6.922 -5.046 1.00 31.05 O HETATM 2941 O HOH 190 -3.918 -13.859 -12.755 1.00 33.30 O HETATM 2942 O HOH 191 -3.001 -19.331 -10.803 1.00 47.32 O HETATM 2943 O HOH 192 2.723 -7.405 0.673 1.00 33.66 O HETATM 2944 O HOH 193 6.367 -8.759 7.061 1.00 34.88 O HETATM 2945 O HOH 194 9.334 -23.220 1.648 1.00 44.82 O HETATM 2946 O HOH 195 9.502 -21.746 6.647 1.00 27.96 O HETATM 2947 O HOH 196 30.656 -29.798 -7.415 1.00 38.20 O HETATM 2948 O HOH 197 34.608 -22.126 -12.057 1.00 32.32 O HETATM 2949 O HOH 198 20.401 -3.864 -17.104 1.00 40.06 O HETATM 2950 O HOH 199 5.065 -26.074 -11.818 1.00 35.88 O HETATM 2951 O HOH 200 6.230 -25.904 -15.215 1.00 38.46 O HETATM 2952 O HOH 201 10.624 2.412 -11.792 1.00 31.37 O HETATM 2953 O HOH 202 11.786 7.272 -7.372 1.00 31.88 O HETATM 2954 O HOH 203 20.024 15.289 -6.117 1.00 24.54 O HETATM 2955 O HOH 204 20.687 16.948 -8.412 1.00 20.45 O HETATM 2956 O HOH 205 22.027 18.675 -7.459 1.00 13.68 O HETATM 2957 O HOH 206 18.435 17.793 -9.866 1.00 31.32 O HETATM 2958 O HOH 207 18.057 11.730 -17.233 1.00 35.40 O HETATM 2959 O HOH 208 34.707 8.749 -2.019 1.00 21.74 O HETATM 2960 O HOH 209 14.693 0.530 9.154 1.00 30.42 O HETATM 2961 O HOH 210 16.542 -1.080 12.153 1.00 47.89 O HETATM 2962 O HOH 211 11.447 -5.913 11.770 1.00 29.41 O HETATM 2963 O HOH 212 20.507 -9.862 9.631 1.00 41.35 O HETATM 2964 O HOH 213 26.302 -2.980 8.564 1.00 36.92 O HETATM 2965 O HOH 214 25.582 -16.779 10.427 1.00 24.36 O HETATM 2966 O HOH 215 30.314 -14.136 6.697 1.00 18.92 O HETATM 2967 O HOH 216 28.029 -12.248 8.613 1.00 32.32 O HETATM 2968 O HOH 217 31.570 -11.557 7.077 1.00 28.53 O HETATM 2969 O HOH 218 20.959 -15.562 11.673 1.00 23.70 O HETATM 2970 O HOH 219 18.394 -0.820 -15.104 1.00 36.10 O HETATM 2971 O HOH 220 28.398 -11.362 -17.033 1.00 35.72 O HETATM 2972 O HOH 221 29.431 -13.271 -18.753 1.00 39.19 O HETATM 2973 O HOH 222 19.453 -5.206 -26.581 1.00 34.25 O HETATM 2974 O HOH 223 12.113 -14.082 -29.510 1.00 33.71 O HETATM 2975 O HOH 224 6.063 -14.369 -25.558 1.00 19.55 O HETATM 2976 O HOH 225 2.920 -12.348 -28.670 1.00 32.77 O HETATM 2977 O HOH 226 15.717 -36.817 -30.448 1.00 35.70 O HETATM 2978 O HOH 227 24.481 -34.136 -8.118 1.00 39.42 O HETATM 2979 O HOH 228 7.573 -19.295 6.070 1.00 37.27 O HETATM 2980 O HOH 229 12.238 -29.673 -18.939 1.00 36.38 O HETATM 2981 O HOH 230 29.937 -23.989 0.567 1.00 19.45 O HETATM 2982 O HOH 231 11.007 6.983 -2.772 1.00 40.04 O HETATM 2983 O HOH 232 6.942 1.833 5.901 1.00 36.65 O HETATM 2984 O HOH 233 35.183 2.401 0.410 1.00 37.26 O HETATM 2985 O HOH 234 6.222 -14.028 -19.919 1.00 30.73 O HETATM 2986 O HOH 235 5.596 -23.663 -35.336 1.00 27.05 O HETATM 2987 O HOH 236 14.567 -22.957 -32.311 1.00 33.12 O HETATM 2988 O HOH 237 7.436 -12.225 -26.019 1.00 39.60 O HETATM 2989 O HOH 238 20.601 -13.578 -36.424 1.00 34.35 O HETATM 2990 O HOH 239 32.723 -17.135 -15.781 1.00 42.76 O HETATM 2991 O HOH 240 33.104 -27.108 -16.266 1.00 45.50 O HETATM 2992 O HOH 241 30.162 -30.455 -16.358 1.00 39.80 O HETATM 2993 O HOH 242 24.986 -31.629 -22.962 1.00 38.42 O HETATM 2994 O HOH 243 -3.264 -11.103 -12.939 1.00 41.08 O HETATM 2995 O HOH 244 35.912 -19.536 -3.993 1.00 35.86 O HETATM 2996 O HOH 245 17.688 -3.227 -15.568 1.00 41.02 O HETATM 2997 O HOH 246 11.959 -27.850 -12.045 1.00 38.22 O HETATM 2998 O HOH 247 8.168 -26.750 -7.603 1.00 38.21 O HETATM 2999 O HOH 248 11.437 11.599 -9.238 1.00 36.09 O HETATM 3000 O HOH 249 37.281 -14.811 -38.758 1.00 36.60 O HETATM 3001 O HOH 250 32.543 4.291 -16.703 1.00 40.07 O HETATM 3002 O HOH 251 35.846 0.277 2.292 1.00 40.88 O HETATM 3003 O HOH 252 34.104 1.906 4.236 1.00 36.50 O HETATM 3004 O HOH 253 10.237 -13.810 12.523 1.00 32.49 O HETATM 3005 O HOH 254 6.766 -0.247 -3.242 1.00 28.22 O HETATM 3006 O HOH 255 35.557 -11.423 -11.560 1.00 48.48 O HETATM 3007 O HOH 256 8.421 -33.216 -35.340 1.00 44.25 O HETATM 3008 O HOH 257 12.054 -27.785 -37.182 1.00 37.96 O HETATM 3009 O HOH 258 24.345 -6.498 -17.911 1.00 38.64 O HETATM 3010 O HOH 259 9.501 -6.339 -15.893 1.00 44.98 O HETATM 3011 O HOH 260 2.326 -12.761 -19.177 1.00 27.64 O HETATM 3012 O HOH 261 16.404 6.561 3.156 1.00 41.26 O HETATM 3013 O HOH 262 21.393 8.988 -0.930 1.00 32.59 O HETATM 3014 O HOH 263 31.328 -1.311 9.615 1.00 45.91 O HETATM 3015 O HOH 264 22.452 -9.579 7.003 1.00 40.71 O HETATM 3016 O HOH 265 1.198 -17.344 -3.810 1.00 44.10 O HETATM 3017 O HOH 266 35.406 -18.129 2.993 1.00 33.66 O HETATM 3018 O HOH 267 36.014 -17.781 0.275 1.00 31.83 O HETATM 3019 O HOH 268 17.917 -31.133 -5.682 1.00 32.83 O HETATM 3020 O HOH 269 10.383 -24.766 -3.849 1.00 34.76 O HETATM 3021 O HOH 270 1.300 -16.852 1.688 1.00 52.34 O HETATM 3022 O HOH 271 2.842 -19.036 1.674 1.00 46.31 O HETATM 3023 O HOH 272 7.167 -36.325 -29.342 1.00 38.19 O HETATM 3024 O HOH 273 9.930 -34.382 -26.161 1.00 41.43 O HETATM 3025 O HOH 274 4.483 -3.203 -10.666 1.00 31.67 O HETATM 3026 O HOH 275 30.204 -11.746 1.167 1.00 12.98 O HETATM 3027 F1 UNN A 276 23.204 -17.820 -13.177 1.00 -0.23 F HETATM 3028 C2 UNN A 276 23.303 -18.978 -13.866 1.00 0.36 C HETATM 3029 F3 UNN A 276 24.210 -19.715 -13.205 1.00 -0.23 F HETATM 3030 F4 UNN A 276 22.143 -19.620 -13.786 1.00 -0.23 F HETATM 3031 C5 UNN A 276 23.717 -18.682 -15.291 1.00 0.04 C HETATM 3032 C6 UNN A 276 25.024 -18.299 -15.591 1.00 0.02 C HETATM 3033 C7 UNN A 276 25.339 -18.020 -16.928 1.00 -0.03 C HETATM 3034 C9 UNN A 276 24.385 -18.143 -17.946 1.00 -0.01 C HETATM 3035 C11 UNN A 276 23.097 -18.546 -17.617 1.00 0.09 C HETATM 3036 C12 UNN A 276 22.772 -18.848 -16.296 1.00 -0.02 C HETATM 3037 H UNN A 276 21.781 -19.213 -16.052 1.00 0.07 H HETATM 3038 N14 UNN A 276 22.180 -18.679 -18.696 1.00 -0.20 N HETATM 3039 C16 UNN A 276 20.836 -18.563 -18.592 1.00 0.36 C HETATM 3040 O17 UNN A 276 20.238 -18.362 -17.536 1.00 -0.36 O HETATM 3041 N18 UNN A 276 20.112 -18.756 -19.709 1.00 -0.16 N HETATM 3042 C19 UNN A 276 20.669 -19.395 -20.903 1.00 0.05 C HETATM 3043 C22 UNN A 276 19.481 -19.501 -21.882 1.00 -0.07 C HETATM 3044 C25 UNN A 276 18.312 -18.891 -21.137 1.00 -0.04 C HETATM 3045 C26 UNN A 276 18.741 -18.503 -19.878 1.00 0.09 C HETATM 3046 C27 UNN A 276 17.883 -17.880 -18.958 1.00 -0.04 C HETATM 3047 C29 UNN A 276 16.557 -17.682 -19.371 1.00 -0.04 C HETATM 3048 C31 UNN A 276 16.141 -18.093 -20.636 1.00 0.10 C HETATM 3049 C32 UNN A 276 17.015 -18.691 -21.537 1.00 -0.05 C HETATM 3050 H UNN A 276 16.682 -18.990 -22.524 1.00 0.04 H HETATM 3051 O34 UNN A 276 14.827 -17.877 -21.013 1.00 -0.25 O HETATM 3052 C35 UNN A 276 13.831 -18.602 -20.436 1.00 0.19 C HETATM 3053 N36 UNN A 276 14.070 -19.750 -19.803 1.00 -0.26 N HETATM 3054 C37 UNN A 276 13.087 -20.476 -19.261 1.00 0.06 C HETATM 3055 N39 UNN A 276 11.822 -20.016 -19.341 1.00 -0.27 N HETATM 3056 C40 UNN A 276 11.547 -18.847 -19.921 1.00 0.14 C HETATM 3057 C41 UNN A 276 12.541 -18.071 -20.499 1.00 0.04 C HETATM 3058 H UNN A 276 12.331 -17.117 -20.968 1.00 0.06 H HETATM 3059 N43 UNN A 276 10.173 -18.479 -19.814 1.00 -0.21 N HETATM 3060 C45 UNN A 276 9.647 -17.330 -20.279 1.00 0.21 C HETATM 3061 O46 UNN A 276 10.247 -16.480 -20.864 1.00 -0.38 O HETATM 3062 C47 UNN A 276 8.161 -17.171 -20.041 1.00 0.03 C HETATM 3063 H UNN A 276 7.825 -16.208 -20.453 1.00 0.05 H HETATM 3064 H UNN A 276 7.958 -17.198 -18.960 1.00 0.05 H HETATM 3065 H UNN A 276 7.620 -17.991 -20.537 1.00 0.05 H HETATM 3066 H UNN A 276 9.555 -19.121 -19.360 1.00 0.23 H HETATM 3067 H UNN A 276 13.303 -21.416 -18.767 1.00 0.10 H HETATM 3068 H UNN A 276 15.851 -17.206 -18.701 1.00 0.05 H HETATM 3069 H UNN A 276 18.227 -17.568 -17.979 1.00 0.05 H HETATM 3070 H UNN A 276 19.483 -19.922 -22.887 1.00 0.02 H HETATM 3071 H UNN A 276 21.695 -19.723 -21.064 1.00 0.09 H HETATM 3072 H UNN A 276 22.558 -18.873 -19.601 1.00 0.23 H HETATM 3073 H UNN A 276 24.648 -17.927 -18.975 1.00 0.08 H HETATM 3074 H UNN A 276 26.344 -17.702 -17.180 1.00 0.06 H HETATM 3075 C51 UNN A 276 26.094 -18.092 -14.498 1.00 0.01 C HETATM 3076 N54 UNN A 276 27.131 -17.167 -14.959 1.00 0.26 N HETATM 3077 C55 UNN A 276 28.319 -17.263 -14.102 1.00 0.01 C HETATM 3078 C58 UNN A 276 29.408 -16.299 -14.627 1.00 0.01 C HETATM 3079 N61 UNN A 276 28.890 -14.925 -14.678 1.00 0.24 N HETATM 3080 C62 UNN A 276 27.698 -14.836 -15.559 1.00 0.01 C HETATM 3081 C65 UNN A 276 26.637 -15.791 -14.994 1.00 0.01 C HETATM 3082 H UNN A 276 26.378 -15.476 -13.972 1.00 0.09 H HETATM 3083 H UNN A 276 25.740 -15.748 -15.629 1.00 0.09 H HETATM 3084 H UNN A 276 27.965 -15.134 -16.584 1.00 0.09 H HETATM 3085 H UNN A 276 27.311 -13.806 -15.566 1.00 0.09 H HETATM 3086 C68 UNN A 276 29.920 -13.970 -15.163 1.00 -0.04 C HETATM 3087 H UNN A 276 30.808 -14.028 -14.516 1.00 0.08 H HETATM 3088 H UNN A 276 29.514 -12.948 -15.137 1.00 0.08 H HETATM 3089 H UNN A 276 30.201 -14.226 -16.195 1.00 0.08 H HETATM 3090 H UNN A 276 28.620 -14.658 -13.744 1.00 0.20 H HETATM 3091 H UNN A 276 29.712 -16.610 -15.637 1.00 0.09 H HETATM 3092 H UNN A 276 30.278 -16.334 -13.955 1.00 0.09 H HETATM 3093 H UNN A 276 28.702 -18.294 -14.119 1.00 0.09 H HETATM 3094 H UNN A 276 28.051 -16.988 -13.071 1.00 0.09 H HETATM 3095 H UNN A 276 27.393 -17.430 -15.896 1.00 0.21 H HETATM 3096 H UNN A 276 26.556 -19.061 -14.256 1.00 0.10 H HETATM 3097 H UNN A 276 25.616 -17.679 -13.598 1.00 0.10 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 1601 1602 1607 1608 1609 CONECT 1608 1601 CONECT 1609 1601 CONECT 3027 3028 CONECT 3028 3027 3029 3030 3031 CONECT 3029 3028 CONECT 3030 3028 CONECT 3031 3028 3032 3036 CONECT 3032 3031 3033 3075 CONECT 3033 3032 3034 3074 CONECT 3034 3033 3035 3073 CONECT 3035 3034 3036 3038 CONECT 3036 3031 3035 3037 CONECT 3037 3036 CONECT 3038 3035 3039 3072 CONECT 3039 3038 3040 3041 CONECT 3040 3039 CONECT 3041 3039 3042 3045 CONECT 3042 3041 3043 3071 CONECT 3043 3042 3044 3070 CONECT 3044 3043 3045 3049 CONECT 3045 3041 3044 3046 CONECT 3046 3045 3047 3069 CONECT 3047 3046 3048 3068 CONECT 3048 3047 3049 3051 CONECT 3049 3044 3048 3050 CONECT 3050 3049 CONECT 3051 3048 3052 CONECT 3052 3051 3053 3057 CONECT 3053 3052 3054 CONECT 3054 3053 3055 3067 CONECT 3055 3054 3056 CONECT 3056 3055 3057 3059 CONECT 3057 3052 3056 3058 CONECT 3058 3057 CONECT 3059 3056 3060 3066 CONECT 3060 3059 3061 3062 CONECT 3061 3060 CONECT 3062 3060 3063 3064 3065 CONECT 3063 3062 CONECT 3064 3062 CONECT 3065 3062 CONECT 3066 3059 CONECT 3067 3054 CONECT 3068 3047 CONECT 3069 3046 CONECT 3070 3043 CONECT 3071 3042 CONECT 3072 3038 CONECT 3073 3034 CONECT 3074 3033 CONECT 3075 3032 3076 3096 3097 CONECT 3076 3075 3077 3081 3095 CONECT 3077 3076 3078 3093 3094 CONECT 3078 3077 3079 3091 3092 CONECT 3079 3078 3080 3086 3090 CONECT 3080 3079 3081 3084 3085 CONECT 3081 3076 3080 3082 3083 CONECT 3082 3081 CONECT 3083 3081 CONECT 3084 3080 CONECT 3085 3080 CONECT 3086 3079 3087 3088 3089 CONECT 3087 3086 CONECT 3088 3086 CONECT 3089 3086 CONECT 3090 3079 CONECT 3091 3078 CONECT 3092 3078 CONECT 3093 3077 CONECT 3094 3077 CONECT 3095 3076 CONECT 3096 3075 CONECT 3097 3075 MASTER 0 0 0 0 0 0 0 0 3095 2 78 22 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: 3ugc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2b7a
RCSB PDB
PDBbind
293aa, >2B7A_1|Chains... at 100%
2w1i
RCSB PDB
PDBbind
326aa, >2W1I_1|Chains... *
2xa4
RCSB PDB
PDBbind
298aa, >2XA4_1|Chains... at 98%
3e62
RCSB PDB
PDBbind
293aa, >3E62_1|Chain... at 99%
3e63
RCSB PDB
PDBbind
293aa, >3E63_1|Chain... at 99%
3e64
RCSB PDB
PDBbind
293aa, >3E64_1|Chain... at 99%
3fup
RCSB PDB
PDBbind
293aa, >3FUP_1|Chains... at 100%
3io7
RCSB PDB
PDBbind
313aa, >3IO7_1|Chain... at 95%
3iok
RCSB PDB
PDBbind
313aa, >3IOK_1|Chain... at 95%
3jy9
RCSB PDB
PDBbind
311aa, >3JY9_1|Chain... at 95%
3kck
RCSB PDB
PDBbind
313aa, >3KCK_1|Chain... at 95%
3krr
RCSB PDB
PDBbind
295aa, >3KRR_1|Chain... at 98%
3lpb
RCSB PDB
PDBbind
295aa, >3LPB_1|Chains... at 98%
3q32
RCSB PDB
PDBbind
301aa, >3Q32_1|Chains... at 97%
3rvg
RCSB PDB
PDBbind
303aa, >3RVG_1|Chain... at 98%
3tjc
RCSB PDB
PDBbind
298aa, >3TJC_1|Chains... at 98%
3tjd
RCSB PDB
PDBbind
298aa, >3TJD_1|Chains... at 98%
3zmm
RCSB PDB
PDBbind
298aa, >3ZMM_1|Chains... at 99%
4aqc
RCSB PDB
PDBbind
301aa, >4AQC_1|Chains... at 99%
4bbe
RCSB PDB
PDBbind
298aa, >4BBE_1|Chains... at 97%
4bbf
RCSB PDB
PDBbind
298aa, >4BBF_1|Chains... at 97%
4c61
RCSB PDB
PDBbind
298aa, >4C61_1|Chains... at 99%
4d0w
RCSB PDB
PDBbind
298aa, >4D0W_1|Chain... at 99%
4d0x
RCSB PDB
PDBbind
298aa, >4D0X_1|Chain... at 99%
4d1s
RCSB PDB
PDBbind
298aa, >4D1S_1|Chain... at 99%
4e6d
RCSB PDB
PDBbind
298aa, >4E6D_1|Chains... at 98%
4e6q
RCSB PDB
PDBbind
298aa, >4E6Q_1|Chains... at 98%
4f08
RCSB PDB
PDBbind
302aa, >4F08_1|Chains... at 98%
4f09
RCSB PDB
PDBbind
302aa, >4F09_1|Chain... at 98%
4gfm
RCSB PDB
PDBbind
302aa, >4GFM_1|Chain... at 98%
4gmy
RCSB PDB
PDBbind
302aa, >4GMY_1|Chain... at 98%
4hge
RCSB PDB
PDBbind
300aa, >4HGE_1|Chains... at 99%
4iva
RCSB PDB
PDBbind
300aa, >4IVA_1|Chain... at 99%
4jia
RCSB PDB
PDBbind
300aa, >4JIA_1|Chain... at 99%
4p7e
RCSB PDB
PDBbind
293aa, >4P7E_1|Chains... at 100%
4ytc
RCSB PDB
PDBbind
296aa, >4YTC_1|Chain... at 97%
4ytf
RCSB PDB
PDBbind
296aa, >4YTF_1|Chain... at 97%
4yth
RCSB PDB
PDBbind
296aa, >4YTH_1|Chain... at 97%
4yti
RCSB PDB
PDBbind
296aa, >4YTI_1|Chain... at 97%
4zim
RCSB PDB
PDBbind
321aa, >4ZIM_1|Chains... at 93%
5aep
RCSB PDB
PDBbind
298aa, >5AEP_1|Chain... at 99%
5cf4
RCSB PDB
PDBbind
321aa, >5CF4_1|Chains... at 93%
5cf5
RCSB PDB
PDBbind
321aa, >5CF5_1|Chains... at 93%
5cf6
RCSB PDB
PDBbind
321aa, >5CF6_1|Chains... at 93%
5cf8
RCSB PDB
PDBbind
301aa, >5CF8_1|Chains... at 97%
5l3a
RCSB PDB
PDBbind
295aa, >5L3A_1|Chain... at 98%
5tq3
RCSB PDB
PDBbind
304aa, >5TQ3_1|Chains... at 97%
5tq4
RCSB PDB
PDBbind
298aa, >5TQ4_1|Chain... at 98%
5tq5
RCSB PDB
PDBbind
298aa, >5TQ5_1|Chain... at 98%
5tq6
RCSB PDB
PDBbind
304aa, >5TQ6_1|Chains... at 98%
5tq7
RCSB PDB
PDBbind
304aa, >5TQ7_1|Chains... at 97%
5tq8
RCSB PDB
PDBbind
298aa, >5TQ8_1|Chain... at 98%
5usy
RCSB PDB
PDBbind
316aa, >5USY_1|Chains... at 99%
5wev
RCSB PDB
PDBbind
319aa, >5WEV_1|Chain... at 96%
6aaj
RCSB PDB
PDBbind
299aa, >6AAJ_1|Chains... at 98%
6bbv
RCSB PDB
PDBbind
298aa, >6BBV_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3ugc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase JAK2
Ligand Name
046
EC.Number
E.C.2.7.10.2
Resolution
1.34(Å)
Affinity (Kd/Ki/IC50)
IC50=0.947uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Cancer Discov Vol. 2: pp. 512-523
Ligand Properties
Formula
C
2
8
H
3
0
F
3
N
7
O
3
Molecular Weight
569.578
Exact Mass
569.236
No. of atoms
71
No. of bonds
75
Polar Surface Area
107.02
LOGP Value
3.45 (
Computed with XLOGP3
)
5.48 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 5
Canonical SMILES
C[N@@H+]1CC[N@H+](CC1)Cc1ccc(cc1C(F)(F)F)NC(=O)n1ccc2c1ccc(c2)Oc1ncnc(c1)NC(=O)C
InChI String
InChI=1S/C28H28F3N7O3/c1-18(39)34-25-15-26(33-17-32-25)41-22-5-6-24-19(13-22)7-8-38(24)27(40)35-21-4-3-20(23(14-21)28(29,30)31)16-37-11-9-36(2)10-12-37/h3-8,13-15,17H,9-12,16H2,1-2H3,(H,35,40)(H,32,33,34,39)/p+2
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):
O60674
Entrez Gene ID
NCBI Entrez Gene ID:
3717
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