Browse entries in the PDBbind-CN Database
HEADER 4X8O_COMPLEX COMPND 4X8O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 214 MET ARG ILE ILE LEU LEU GLY ALA PRO GLY ALA GLY LYS SEQRES 2 A 214 GLY THR GLN ALA GLN PHE ILE MET GLU LYS TYR GLY ILE SEQRES 3 A 214 PRO GLN ILE SER THR GLY ASP MET LEU ARG ALA ALA VAL SEQRES 4 A 214 LYS SER GLY SER GLU LEU GLY LYS GLN ALA LYS ASP ILE SEQRES 5 A 214 MET ASP ALA GLY LYS LEU VAL THR ASP GLU LEU VAL ILE SEQRES 6 A 214 ALA LEU VAL LYS GLU ARG ILE ALA GLN GLU ASP CYS ARG SEQRES 7 A 214 ASN GLY PHE LEU LEU ASP GLY PHE PRO ARG THR ILE PRO SEQRES 8 A 214 GLN ALA ASP ALA MET LYS GLU ALA GLY ILE ASN VAL ASP SEQRES 9 A 214 TYR VAL LEU GLU PHE ASP VAL PRO ASP GLU LEU ILE VAL SEQRES 10 A 214 ASP ARG ILE VAL GLY ARG ARG VAL HIS ALA PRO SER GLY SEQRES 11 A 214 ARG VAL TYR HIS VAL LYS PHE ASN PRO PRO LYS VAL GLU SEQRES 12 A 214 GLY LYS ASP ASP VAL THR GLY GLU GLU LEU THR THR ARG SEQRES 13 A 214 LYS ASP ASP GLN GLU GLU THR VAL ARG LYS ARG LEU VAL SEQRES 14 A 214 GLU TRP HIS GLN MET THR ALA PRO LEU ILE GLY TYR TYR SEQRES 15 A 214 SER LYS GLU ALA GLU ALA GLY ASN THR LYS TYR ALA LYS SEQRES 16 A 214 VAL ASP GLY THR LYS PRO VAL ALA GLU VAL ARG ALA ASP SEQRES 17 A 214 LEU GLU LYS ILE LEU GLY HET MG A 1 1 HET NA A 2 1 HET AP A 5 81 ATOM 1 N MET A 1 1.980 23.032 -32.772 1.00 8.71 N ATOM 2 CA MET A 1 1.378 22.346 -33.908 1.00 14.37 C ATOM 3 C MET A 1 0.008 22.929 -34.237 1.00 19.54 C ATOM 4 O MET A 1 -0.768 23.246 -33.338 1.00 14.06 O ATOM 5 CB MET A 1 1.255 20.852 -33.622 1.00 18.74 C ATOM 6 CG MET A 1 1.319 19.978 -34.858 1.00 26.41 C ATOM 7 SD MET A 1 0.680 18.327 -34.538 1.00 37.89 S ATOM 8 CE MET A 1 1.859 17.720 -33.334 1.00 45.71 C ATOM 9 HN3 MET A 1 1.365 22.928 -31.940 1.00 0.00 H ATOM 10 HN2 MET A 1 2.092 24.041 -32.998 1.00 0.00 H ATOM 11 HN1 MET A 1 2.911 22.615 -32.570 1.00 0.00 H ATOM 12 N ARG A 2 -0.280 23.071 -35.526 1.00 8.61 N ATOM 13 CA ARG A 2 -1.570 23.590 -35.971 1.00 11.71 C ATOM 14 C ARG A 2 -2.257 22.597 -36.905 1.00 18.74 C ATOM 15 O ARG A 2 -1.674 22.150 -37.896 1.00 11.22 O ATOM 16 CB ARG A 2 -1.392 24.943 -36.657 1.00 13.29 C ATOM 17 CG ARG A 2 -0.957 26.056 -35.716 1.00 12.18 C ATOM 18 CD ARG A 2 -0.446 27.246 -36.499 1.00 18.48 C ATOM 19 NE ARG A 2 -0.504 28.491 -35.741 1.00 27.22 N ATOM 20 CZ ARG A 2 -0.304 29.693 -36.274 1.00 52.79 C ATOM 21 NH1 ARG A 2 -0.032 29.810 -37.569 1.00 33.11 N ATOM 22 NH2 ARG A 2 -0.377 30.778 -35.515 1.00 36.95 N ATOM 23 HE ARG A 2 -0.714 28.435 -34.724 1.00 0.00 H ATOM 24 HH12 ARG A 2 0.124 30.750 -37.985 1.00 0.00 H ATOM 25 HH11 ARG A 2 0.025 28.961 -38.167 1.00 0.00 H ATOM 26 HH22 ARG A 2 -0.220 31.717 -35.934 1.00 0.00 H ATOM 27 HH21 ARG A 2 -0.591 30.690 -34.501 1.00 0.00 H ATOM 28 H ARG A 2 0.432 22.806 -36.236 1.00 0.00 H ATOM 29 N ILE A 3 -3.501 22.255 -36.580 1.00 5.18 N ATOM 30 CA ILE A 3 -4.211 21.180 -37.264 1.00 5.61 C ATOM 31 C ILE A 3 -5.622 21.590 -37.677 1.00 8.26 C ATOM 32 O ILE A 3 -6.339 22.244 -36.917 1.00 4.59 O ATOM 33 CB ILE A 3 -4.306 19.920 -36.369 1.00 12.90 C ATOM 34 CG1 ILE A 3 -2.915 19.462 -35.923 1.00 7.31 C ATOM 35 CG2 ILE A 3 -5.041 18.796 -37.085 1.00 6.14 C ATOM 36 CD1 ILE A 3 -2.943 18.345 -34.901 1.00 17.25 C ATOM 37 H ILE A 3 -3.982 22.770 -35.815 1.00 0.00 H ATOM 38 N ILE A 4 -6.007 21.211 -38.893 1.00 9.50 N ATOM 39 CA ILE A 4 -7.389 21.326 -39.337 1.00 4.58 C ATOM 40 C ILE A 4 -8.054 19.951 -39.367 1.00 8.21 C ATOM 41 O ILE A 4 -7.531 19.011 -39.972 1.00 3.31 O ATOM 42 CB ILE A 4 -7.491 21.960 -40.741 1.00 5.80 C ATOM 43 CG1 ILE A 4 -6.985 23.404 -40.717 1.00 8.13 C ATOM 44 CG2 ILE A 4 -8.926 21.905 -41.245 1.00 3.73 C ATOM 45 CD1 ILE A 4 -6.963 24.061 -42.081 1.00 5.62 C ATOM 46 H ILE A 4 -5.299 20.820 -39.547 1.00 0.00 H ATOM 47 N LEU A 5 -9.198 19.835 -38.700 1.00 2.43 N ATOM 48 CA LEU A 5 -10.031 18.645 -38.818 1.00 7.34 C ATOM 49 C LEU A 5 -11.111 18.902 -39.865 1.00 7.08 C ATOM 50 O LEU A 5 -11.891 19.854 -39.755 1.00 8.90 O ATOM 51 CB LEU A 5 -10.662 18.269 -37.475 1.00 4.05 C ATOM 52 CG LEU A 5 -9.706 18.006 -36.310 1.00 7.85 C ATOM 53 CD1 LEU A 5 -10.453 17.438 -35.104 1.00 4.47 C ATOM 54 CD2 LEU A 5 -8.566 17.088 -36.727 1.00 2.76 C ATOM 55 H LEU A 5 -9.506 20.611 -38.080 1.00 0.00 H ATOM 56 N LEU A 6 -11.141 18.054 -40.884 1.00 8.79 N ATOM 57 CA LEU A 6 -12.054 18.220 -42.007 1.00 7.11 C ATOM 58 C LEU A 6 -12.916 16.974 -42.173 1.00 7.72 C ATOM 59 O LEU A 6 -12.406 15.859 -42.114 1.00 4.64 O ATOM 60 CB LEU A 6 -11.261 18.501 -43.285 1.00 6.58 C ATOM 61 CG LEU A 6 -12.003 18.590 -44.617 1.00 11.95 C ATOM 62 CD1 LEU A 6 -12.937 19.793 -44.630 1.00 8.79 C ATOM 63 CD2 LEU A 6 -11.005 18.660 -45.768 1.00 9.62 C ATOM 64 H LEU A 6 -10.490 17.243 -40.881 1.00 0.00 H ATOM 65 N GLY A 7 -14.217 17.156 -42.377 1.00 10.18 N ATOM 66 CA GLY A 7 -15.100 16.015 -42.546 1.00 6.40 C ATOM 67 C GLY A 7 -16.587 16.310 -42.474 1.00 7.50 C ATOM 68 O GLY A 7 -17.014 17.313 -41.901 1.00 4.19 O ATOM 69 H GLY A 7 -14.605 18.120 -42.416 1.00 0.00 H ATOM 70 N ALA A 8 -17.374 15.416 -43.064 1.00 4.50 N ATOM 71 CA ALA A 8 -18.828 15.519 -43.072 1.00 8.69 C ATOM 72 C ALA A 8 -19.388 15.486 -41.648 1.00 7.84 C ATOM 73 O ALA A 8 -18.707 15.034 -40.732 1.00 6.19 O ATOM 74 CB ALA A 8 -19.425 14.387 -43.912 1.00 5.56 C ATOM 75 H ALA A 8 -16.932 14.605 -43.542 1.00 0.00 H ATOM 76 N PRO A 9 -20.626 15.979 -41.456 1.00 6.56 N ATOM 77 CA PRO A 9 -21.270 15.905 -40.138 1.00 10.08 C ATOM 78 C PRO A 9 -21.231 14.499 -39.534 1.00 8.74 C ATOM 79 O PRO A 9 -21.496 13.525 -40.237 1.00 7.13 O ATOM 80 CB PRO A 9 -22.713 16.325 -40.434 1.00 7.84 C ATOM 81 CG PRO A 9 -22.590 17.254 -41.589 1.00 22.11 C ATOM 82 CD PRO A 9 -21.447 16.730 -42.426 1.00 12.48 C ATOM 83 N GLY A 10 -20.882 14.403 -38.255 1.00 7.03 N ATOM 84 CA GLY A 10 -20.889 13.131 -37.553 1.00 5.15 C ATOM 85 C GLY A 10 -19.729 12.213 -37.890 1.00 7.17 C ATOM 86 O GLY A 10 -19.731 11.045 -37.509 1.00 9.18 O ATOM 87 H GLY A 10 -20.596 15.262 -37.743 1.00 0.00 H ATOM 88 N ALA A 11 -18.732 12.737 -38.597 1.00 9.18 N ATOM 89 CA ALA A 11 -17.582 11.935 -39.002 1.00 3.47 C ATOM 90 C ALA A 11 -16.680 11.581 -37.816 1.00 8.59 C ATOM 91 O ALA A 11 -15.867 10.661 -37.903 1.00 9.80 O ATOM 92 CB ALA A 11 -16.784 12.660 -40.073 1.00 6.96 C ATOM 93 H ALA A 11 -18.773 13.740 -38.867 1.00 0.00 H ATOM 94 N GLY A 12 -16.823 12.313 -36.713 1.00 9.71 N ATOM 95 CA GLY A 12 -16.106 11.997 -35.490 1.00 3.89 C ATOM 96 C GLY A 12 -15.002 12.974 -35.131 1.00 9.88 C ATOM 97 O GLY A 12 -14.115 12.652 -34.338 1.00 7.16 O ATOM 98 H GLY A 12 -17.464 13.132 -36.728 1.00 0.00 H ATOM 99 N LYS A 13 -15.064 14.172 -35.704 1.00 5.73 N ATOM 100 CA LYS A 13 -14.032 15.186 -35.506 1.00 8.06 C ATOM 101 C LYS A 13 -13.936 15.649 -34.050 1.00 11.03 C ATOM 102 O LYS A 13 -12.851 15.665 -33.469 1.00 2.20 O ATOM 103 CB LYS A 13 -14.292 16.386 -36.425 1.00 6.65 C ATOM 104 CG LYS A 13 -14.296 16.039 -37.912 1.00 3.63 C ATOM 105 CD LYS A 13 -14.389 17.284 -38.785 1.00 7.04 C ATOM 106 CE LYS A 13 -15.734 17.994 -38.632 1.00 8.98 C ATOM 107 NZ LYS A 13 -16.891 17.098 -38.923 1.00 4.84 N ATOM 108 HZ1 LYS A 13 -16.822 16.751 -39.901 1.00 0.00 H ATOM 109 HZ2 LYS A 13 -16.878 16.292 -38.266 1.00 0.00 H ATOM 110 HZ3 LYS A 13 -17.777 17.629 -38.805 1.00 0.00 H ATOM 111 H LYS A 13 -15.876 14.395 -36.315 1.00 0.00 H ATOM 112 N GLY A 14 -15.072 16.024 -33.466 1.00 7.50 N ATOM 113 CA GLY A 14 -15.106 16.500 -32.093 1.00 7.00 C ATOM 114 C GLY A 14 -14.626 15.454 -31.103 1.00 6.66 C ATOM 115 O GLY A 14 -13.924 15.768 -30.143 1.00 5.18 O ATOM 116 H GLY A 14 -15.959 15.975 -34.007 1.00 0.00 H ATOM 117 N THR A 15 -15.004 14.205 -31.348 1.00 6.27 N ATOM 118 CA THR A 15 -14.606 13.090 -30.497 1.00 6.85 C ATOM 119 C THR A 15 -13.091 12.930 -30.465 1.00 8.75 C ATOM 120 O THR A 15 -12.492 12.793 -29.399 1.00 6.79 O ATOM 121 CB THR A 15 -15.246 11.773 -30.974 1.00 5.94 C ATOM 122 OG1 THR A 15 -16.674 11.907 -30.979 1.00 9.02 O ATOM 123 CG2 THR A 15 -14.846 10.618 -30.066 1.00 3.76 C ATOM 124 HG1 THR A 15 -16.933 12.640 -31.591 1.00 0.00 H ATOM 125 H THR A 15 -15.605 14.015 -32.176 1.00 0.00 H ATOM 126 N GLN A 16 -12.475 12.962 -31.640 1.00 4.44 N ATOM 127 CA GLN A 16 -11.038 12.762 -31.749 1.00 5.65 C ATOM 128 C GLN A 16 -10.256 14.013 -31.362 1.00 5.82 C ATOM 129 O GLN A 16 -9.083 13.926 -30.997 1.00 6.05 O ATOM 130 CB GLN A 16 -10.675 12.321 -33.168 1.00 3.83 C ATOM 131 CG GLN A 16 -11.247 10.958 -33.538 1.00 4.01 C ATOM 132 CD GLN A 16 -10.757 9.853 -32.617 1.00 4.92 C ATOM 133 OE1 GLN A 16 -9.637 9.905 -32.113 1.00 7.16 O ATOM 134 NE2 GLN A 16 -11.601 8.852 -32.386 1.00 4.56 N ATOM 135 HE22 GLN A 16 -12.539 8.849 -32.834 1.00 0.00 H ATOM 136 HE21 GLN A 16 -11.323 8.072 -31.757 1.00 0.00 H ATOM 137 H GLN A 16 -13.032 13.134 -32.502 1.00 0.00 H ATOM 138 N ALA A 17 -10.908 15.170 -31.437 1.00 6.55 N ATOM 139 CA ALA A 17 -10.283 16.426 -31.031 1.00 5.56 C ATOM 140 C ALA A 17 -9.872 16.395 -29.558 1.00 11.59 C ATOM 141 O ALA A 17 -8.846 16.963 -29.185 1.00 10.10 O ATOM 142 CB ALA A 17 -11.222 17.600 -31.295 1.00 3.59 C ATOM 143 H ALA A 17 -11.885 15.180 -31.793 1.00 0.00 H ATOM 144 N GLN A 18 -10.671 15.726 -28.729 1.00 11.58 N ATOM 145 CA GLN A 18 -10.406 15.647 -27.294 1.00 13.56 C ATOM 146 C GLN A 18 -9.043 15.024 -27.002 1.00 23.18 C ATOM 147 O GLN A 18 -8.299 15.518 -26.156 1.00 15.88 O ATOM 148 CB GLN A 18 -11.500 14.843 -26.584 1.00 7.35 C ATOM 149 CG GLN A 18 -12.911 15.329 -26.858 1.00 9.16 C ATOM 150 CD GLN A 18 -13.109 16.786 -26.496 1.00 24.18 C ATOM 151 OE1 GLN A 18 -12.659 17.245 -25.446 1.00 21.34 O ATOM 152 NE2 GLN A 18 -13.787 17.525 -27.369 1.00 24.05 N ATOM 153 HE22 GLN A 18 -14.149 17.095 -28.244 1.00 0.00 H ATOM 154 HE21 GLN A 18 -13.955 18.533 -27.177 1.00 0.00 H ATOM 155 H GLN A 18 -11.509 15.245 -29.114 1.00 0.00 H ATOM 156 N PHE A 19 -8.722 13.944 -27.708 1.00 7.30 N ATOM 157 CA PHE A 19 -7.465 13.233 -27.495 1.00 14.98 C ATOM 158 C PHE A 19 -6.276 14.021 -28.030 1.00 14.96 C ATOM 159 O PHE A 19 -5.219 14.067 -27.402 1.00 16.41 O ATOM 160 CB PHE A 19 -7.506 11.850 -28.153 1.00 12.30 C ATOM 161 CG PHE A 19 -8.718 11.041 -27.788 1.00 18.13 C ATOM 162 CD1 PHE A 19 -9.006 10.756 -26.462 1.00 17.75 C ATOM 163 CD2 PHE A 19 -9.566 10.557 -28.771 1.00 13.16 C ATOM 164 CE1 PHE A 19 -10.121 10.010 -26.123 1.00 14.21 C ATOM 165 CE2 PHE A 19 -10.681 9.808 -28.439 1.00 15.40 C ATOM 166 CZ PHE A 19 -10.959 9.535 -27.114 1.00 17.93 C ATOM 167 H PHE A 19 -9.384 13.597 -28.431 1.00 0.00 H ATOM 168 N ILE A 20 -6.457 14.630 -29.198 1.00 11.10 N ATOM 169 CA ILE A 20 -5.412 15.431 -29.831 1.00 13.08 C ATOM 170 C ILE A 20 -5.044 16.626 -28.955 1.00 17.01 C ATOM 171 O ILE A 20 -3.872 16.986 -28.827 1.00 15.33 O ATOM 172 CB ILE A 20 -5.857 15.925 -31.225 1.00 19.23 C ATOM 173 CG1 ILE A 20 -5.968 14.746 -32.195 1.00 7.85 C ATOM 174 CG2 ILE A 20 -4.888 16.966 -31.770 1.00 12.54 C ATOM 175 CD1 ILE A 20 -6.627 15.103 -33.521 1.00 8.25 C ATOM 176 H ILE A 20 -7.375 14.533 -29.678 1.00 0.00 H ATOM 177 N MET A 21 -6.062 17.226 -28.347 1.00 16.60 N ATOM 178 CA MET A 21 -5.881 18.366 -27.458 1.00 20.23 C ATOM 179 C MET A 21 -5.093 17.987 -26.202 1.00 14.58 C ATOM 180 O MET A 21 -4.186 18.712 -25.792 1.00 18.53 O ATOM 181 CB MET A 21 -7.245 18.953 -27.085 1.00 14.62 C ATOM 182 CG MET A 21 -7.258 19.810 -25.833 1.00 22.75 C ATOM 183 SD MET A 21 -8.879 20.566 -25.582 1.00 37.65 S ATOM 184 CE MET A 21 -9.951 19.172 -25.922 1.00 23.01 C ATOM 185 H MET A 21 -7.024 16.868 -28.512 1.00 0.00 H ATOM 186 N GLU A 22 -5.439 16.853 -25.598 1.00 14.84 N ATOM 187 CA GLU A 22 -4.713 16.355 -24.431 1.00 17.99 C ATOM 188 C GLU A 22 -3.269 16.007 -24.770 1.00 27.48 C ATOM 189 O GLU A 22 -2.338 16.419 -24.080 1.00 25.10 O ATOM 190 CB GLU A 22 -5.396 15.116 -23.849 1.00 20.78 C ATOM 191 CG GLU A 22 -6.804 15.331 -23.340 1.00 56.84 C ATOM 192 CD GLU A 22 -7.447 14.035 -22.882 1.00 66.75 C ATOM 193 OE1 GLU A 22 -7.155 13.595 -21.749 1.00 75.45 O ATOM 194 OE2 GLU A 22 -8.236 13.451 -23.657 1.00 55.40 O ATOM 195 H GLU A 22 -6.245 16.308 -25.965 1.00 0.00 H ATOM 196 N LYS A 23 -3.099 15.244 -25.843 1.00 22.89 N ATOM 197 CA LYS A 23 -1.806 14.678 -26.203 1.00 27.85 C ATOM 198 C LYS A 23 -0.778 15.737 -26.588 1.00 24.61 C ATOM 199 O LYS A 23 0.382 15.656 -26.187 1.00 29.53 O ATOM 200 CB LYS A 23 -1.982 13.680 -27.352 1.00 34.53 C ATOM 201 CG LYS A 23 -0.688 13.094 -27.895 1.00 36.69 C ATOM 202 CD LYS A 23 -0.161 11.979 -27.013 1.00 44.29 C ATOM 203 CE LYS A 23 0.813 11.099 -27.779 1.00 47.14 C ATOM 204 NZ LYS A 23 2.178 11.135 -27.191 1.00 55.35 N ATOM 205 HZ1 LYS A 23 2.537 12.111 -27.211 1.00 0.00 H ATOM 206 HZ2 LYS A 23 2.140 10.798 -26.208 1.00 0.00 H ATOM 207 HZ3 LYS A 23 2.809 10.521 -27.745 1.00 0.00 H ATOM 208 H LYS A 23 -3.920 15.043 -26.449 1.00 0.00 H ATOM 209 N TYR A 24 -1.202 16.733 -27.356 1.00 19.91 N ATOM 210 CA TYR A 24 -0.262 17.700 -27.910 1.00 15.92 C ATOM 211 C TYR A 24 -0.410 19.085 -27.286 1.00 19.37 C ATOM 212 O TYR A 24 0.241 20.037 -27.712 1.00 21.39 O ATOM 213 CB TYR A 24 -0.425 17.763 -29.431 1.00 31.66 C ATOM 214 CG TYR A 24 -0.232 16.410 -30.079 1.00 35.66 C ATOM 215 CD1 TYR A 24 1.040 15.893 -30.284 1.00 38.55 C ATOM 216 CD2 TYR A 24 -1.323 15.635 -30.456 1.00 23.43 C ATOM 217 CE1 TYR A 24 1.223 14.649 -30.862 1.00 32.34 C ATOM 218 CE2 TYR A 24 -1.150 14.391 -31.037 1.00 29.72 C ATOM 219 CZ TYR A 24 0.126 13.903 -31.235 1.00 34.16 C ATOM 220 OH TYR A 24 0.307 12.666 -31.809 1.00 30.04 O ATOM 221 HH TYR A 24 -0.130 11.976 -31.249 1.00 0.00 H ATOM 222 H TYR A 24 -2.217 16.825 -27.565 1.00 0.00 H ATOM 223 N GLY A 25 -1.259 19.183 -26.268 1.00 16.51 N ATOM 224 CA GLY A 25 -1.360 20.385 -25.458 1.00 23.28 C ATOM 225 C GLY A 25 -1.780 21.639 -26.197 1.00 29.92 C ATOM 226 O GLY A 25 -1.273 22.727 -25.926 1.00 26.57 O ATOM 227 H GLY A 25 -1.871 18.373 -26.044 1.00 0.00 H ATOM 228 N ILE A 26 -2.708 21.490 -27.135 1.00 17.40 N ATOM 229 CA ILE A 26 -3.240 22.630 -27.870 1.00 10.12 C ATOM 230 C ILE A 26 -4.761 22.658 -27.761 1.00 21.98 C ATOM 231 O ILE A 26 -5.406 21.610 -27.750 1.00 20.11 O ATOM 232 CB ILE A 26 -2.815 22.599 -29.352 1.00 12.51 C ATOM 233 CG1 ILE A 26 -3.229 21.280 -30.006 1.00 16.31 C ATOM 234 CG2 ILE A 26 -1.310 22.796 -29.476 1.00 21.09 C ATOM 235 CD1 ILE A 26 -2.741 21.125 -31.429 1.00 26.20 C ATOM 236 H ILE A 26 -3.064 20.537 -27.350 1.00 0.00 H ATOM 237 N PRO A 27 -5.341 23.862 -27.660 1.00 15.54 N ATOM 238 CA PRO A 27 -6.789 24.003 -27.466 1.00 13.96 C ATOM 239 C PRO A 27 -7.614 23.627 -28.696 1.00 16.04 C ATOM 240 O PRO A 27 -7.198 23.865 -29.831 1.00 13.23 O ATOM 241 CB PRO A 27 -6.955 25.491 -27.141 1.00 20.40 C ATOM 242 CG PRO A 27 -5.773 26.146 -27.753 1.00 27.67 C ATOM 243 CD PRO A 27 -4.650 25.162 -27.632 1.00 20.53 C ATOM 244 N GLN A 28 -8.781 23.038 -28.454 1.00 18.83 N ATOM 245 CA GLN A 28 -9.728 22.735 -29.516 1.00 13.08 C ATOM 246 C GLN A 28 -10.519 23.984 -29.877 1.00 19.07 C ATOM 247 O GLN A 28 -11.151 24.592 -29.015 1.00 17.87 O ATOM 248 CB GLN A 28 -10.678 21.612 -29.090 1.00 14.82 C ATOM 249 CG GLN A 28 -11.758 21.291 -30.114 1.00 19.59 C ATOM 250 CD GLN A 28 -12.937 20.553 -29.509 1.00 16.10 C ATOM 251 OE1 GLN A 28 -13.068 20.460 -28.289 1.00 20.14 O ATOM 252 NE2 GLN A 28 -13.807 20.027 -30.364 1.00 25.43 N ATOM 253 HE22 GLN A 28 -13.657 20.130 -31.388 1.00 0.00 H ATOM 254 HE21 GLN A 28 -14.638 19.512 -30.009 1.00 0.00 H ATOM 255 H GLN A 28 -9.025 22.786 -27.475 1.00 0.00 H ATOM 256 N ILE A 29 -10.467 24.373 -31.148 1.00 18.36 N ATOM 257 CA ILE A 29 -11.248 25.504 -31.636 1.00 10.15 C ATOM 258 C ILE A 29 -12.402 24.999 -32.497 1.00 17.60 C ATOM 259 O ILE A 29 -12.256 24.821 -33.707 1.00 9.96 O ATOM 260 CB ILE A 29 -10.394 26.488 -32.458 1.00 10.23 C ATOM 261 CG1 ILE A 29 -9.098 26.831 -31.719 1.00 17.37 C ATOM 262 CG2 ILE A 29 -11.190 27.746 -32.778 1.00 8.28 C ATOM 263 CD1 ILE A 29 -9.310 27.372 -30.327 1.00 22.53 C ATOM 264 H ILE A 29 -9.854 23.857 -31.811 1.00 0.00 H ATOM 265 N SER A 30 -13.543 24.759 -31.858 1.00 9.50 N ATOM 266 CA SER A 30 -14.727 24.251 -32.541 1.00 10.84 C ATOM 267 C SER A 30 -15.728 25.368 -32.795 1.00 10.90 C ATOM 268 O SER A 30 -16.353 25.866 -31.861 1.00 11.78 O ATOM 269 CB SER A 30 -15.379 23.139 -31.716 1.00 11.02 C ATOM 270 OG SER A 30 -16.647 22.786 -32.239 1.00 10.95 O ATOM 271 HG SER A 30 -16.541 22.467 -33.170 1.00 0.00 H ATOM 272 H SER A 30 -13.593 24.940 -30.835 1.00 0.00 H ATOM 273 N THR A 31 -15.884 25.759 -34.058 1.00 6.17 N ATOM 274 CA THR A 31 -16.795 26.844 -34.402 1.00 8.34 C ATOM 275 C THR A 31 -18.238 26.486 -34.052 1.00 11.21 C ATOM 276 O THR A 31 -19.031 27.360 -33.710 1.00 5.73 O ATOM 277 CB THR A 31 -16.704 27.218 -35.895 1.00 9.14 C ATOM 278 OG1 THR A 31 -16.492 26.038 -36.678 1.00 9.01 O ATOM 279 CG2 THR A 31 -15.549 28.170 -36.123 1.00 1.25 C ATOM 280 HG1 THR A 31 -17.247 25.413 -36.542 1.00 0.00 H ATOM 281 H THR A 31 -15.348 25.283 -34.811 1.00 0.00 H ATOM 282 N GLY A 32 -18.567 25.199 -34.124 1.00 9.10 N ATOM 283 CA GLY A 32 -19.880 24.726 -33.721 1.00 8.31 C ATOM 284 C GLY A 32 -20.137 24.956 -32.242 1.00 8.15 C ATOM 285 O GLY A 32 -21.207 25.432 -31.854 1.00 7.08 O ATOM 286 H GLY A 32 -17.868 24.515 -34.477 1.00 0.00 H ATOM 287 N ASP A 33 -19.153 24.620 -31.412 1.00 10.48 N ATOM 288 CA ASP A 33 -19.260 24.838 -29.974 1.00 13.06 C ATOM 289 C ASP A 33 -19.308 26.329 -29.648 1.00 11.70 C ATOM 290 O ASP A 33 -20.080 26.759 -28.788 1.00 7.89 O ATOM 291 CB ASP A 33 -18.090 24.182 -29.228 1.00 6.49 C ATOM 292 CG ASP A 33 -18.185 22.666 -29.200 1.00 14.25 C ATOM 293 OD1 ASP A 33 -19.273 22.124 -29.490 1.00 13.29 O ATOM 294 OD2 ASP A 33 -17.171 22.016 -28.876 1.00 12.45 O ATOM 295 H ASP A 33 -18.287 24.192 -31.798 1.00 0.00 H ATOM 296 N MET A 34 -18.483 27.114 -30.336 1.00 8.05 N ATOM 297 CA MET A 34 -18.406 28.548 -30.084 1.00 11.57 C ATOM 298 C MET A 34 -19.708 29.255 -30.457 1.00 9.27 C ATOM 299 O MET A 34 -20.175 30.132 -29.733 1.00 10.04 O ATOM 300 CB MET A 34 -17.229 29.157 -30.849 1.00 9.13 C ATOM 301 CG MET A 34 -15.874 28.599 -30.431 1.00 12.85 C ATOM 302 SD MET A 34 -14.602 28.800 -31.695 1.00 15.92 S ATOM 303 CE MET A 34 -14.593 30.582 -31.877 1.00 9.88 C ATOM 304 H MET A 34 -17.879 26.695 -31.071 1.00 0.00 H ATOM 305 N LEU A 35 -20.289 28.871 -31.590 1.00 7.12 N ATOM 306 CA LEU A 35 -21.545 29.466 -32.039 1.00 9.80 C ATOM 307 C LEU A 35 -22.686 29.096 -31.094 1.00 12.18 C ATOM 308 O LEU A 35 -23.523 29.935 -30.758 1.00 9.58 O ATOM 309 CB LEU A 35 -21.876 29.029 -33.471 1.00 5.05 C ATOM 310 CG LEU A 35 -21.040 29.657 -34.595 1.00 9.67 C ATOM 311 CD1 LEU A 35 -21.157 28.845 -35.878 1.00 7.03 C ATOM 312 CD2 LEU A 35 -21.454 31.099 -34.840 1.00 6.84 C ATOM 313 H LEU A 35 -19.840 28.132 -32.168 1.00 0.00 H ATOM 314 N ARG A 36 -22.712 27.839 -30.662 1.00 4.98 N ATOM 315 CA ARG A 36 -23.746 27.384 -29.740 1.00 11.13 C ATOM 316 C ARG A 36 -23.616 28.068 -28.379 1.00 9.59 C ATOM 317 O ARG A 36 -24.619 28.377 -27.735 1.00 9.99 O ATOM 318 CB ARG A 36 -23.695 25.861 -29.584 1.00 11.46 C ATOM 319 CG ARG A 36 -24.368 25.109 -30.729 1.00 9.46 C ATOM 320 CD ARG A 36 -24.447 23.607 -30.470 1.00 10.88 C ATOM 321 NE ARG A 36 -23.131 22.980 -30.391 1.00 8.37 N ATOM 322 CZ ARG A 36 -22.430 22.569 -31.444 1.00 13.73 C ATOM 323 NH1 ARG A 36 -22.912 22.725 -32.670 1.00 4.51 N ATOM 324 NH2 ARG A 36 -21.241 22.007 -31.273 1.00 7.77 N ATOM 325 HE ARG A 36 -22.714 22.846 -29.448 1.00 0.00 H ATOM 326 HH12 ARG A 36 -22.361 22.402 -33.491 1.00 0.00 H ATOM 327 HH11 ARG A 36 -23.841 23.170 -32.811 1.00 0.00 H ATOM 328 HH22 ARG A 36 -20.694 21.686 -32.097 1.00 0.00 H ATOM 329 HH21 ARG A 36 -20.855 21.887 -30.315 1.00 0.00 H ATOM 330 H ARG A 36 -21.984 27.170 -30.986 1.00 0.00 H ATOM 331 N ALA A 37 -22.381 28.309 -27.948 1.00 9.27 N ATOM 332 CA ALA A 37 -22.131 29.007 -26.689 1.00 11.08 C ATOM 333 C ALA A 37 -22.561 30.473 -26.777 1.00 17.69 C ATOM 334 O ALA A 37 -23.079 31.038 -25.812 1.00 7.95 O ATOM 335 CB ALA A 37 -20.659 28.908 -26.306 1.00 7.12 C ATOM 336 H ALA A 37 -21.573 27.993 -28.521 1.00 0.00 H ATOM 337 N ALA A 38 -22.337 31.081 -27.940 1.00 5.12 N ATOM 338 CA ALA A 38 -22.745 32.461 -28.179 1.00 10.92 C ATOM 339 C ALA A 38 -24.265 32.603 -28.126 1.00 8.31 C ATOM 340 O ALA A 38 -24.787 33.547 -27.535 1.00 13.21 O ATOM 341 CB ALA A 38 -22.211 32.945 -29.519 1.00 6.54 C ATOM 342 H ALA A 38 -21.857 30.557 -28.700 1.00 0.00 H ATOM 343 N VAL A 39 -24.970 31.660 -28.742 1.00 6.54 N ATOM 344 CA VAL A 39 -26.431 31.665 -28.718 1.00 10.29 C ATOM 345 C VAL A 39 -26.946 31.512 -27.287 1.00 17.65 C ATOM 346 O VAL A 39 -27.862 32.221 -26.866 1.00 14.75 O ATOM 347 CB VAL A 39 -27.018 30.541 -29.605 1.00 11.47 C ATOM 348 CG1 VAL A 39 -28.521 30.411 -29.389 1.00 13.05 C ATOM 349 CG2 VAL A 39 -26.713 30.806 -31.076 1.00 2.76 C ATOM 350 H VAL A 39 -24.472 30.903 -29.252 1.00 0.00 H ATOM 351 N LYS A 40 -26.339 30.597 -26.537 1.00 7.90 N ATOM 352 CA LYS A 40 -26.761 30.320 -25.167 1.00 13.49 C ATOM 353 C LYS A 40 -26.556 31.520 -24.242 1.00 11.93 C ATOM 354 O LYS A 40 -27.407 31.816 -23.407 1.00 9.35 O ATOM 355 CB LYS A 40 -26.010 29.106 -24.615 1.00 8.94 C ATOM 356 CG LYS A 40 -26.400 28.722 -23.194 1.00 14.31 C ATOM 357 CD LYS A 40 -25.678 27.458 -22.752 1.00 27.02 C ATOM 358 CE LYS A 40 -25.575 27.377 -21.235 1.00 33.71 C ATOM 359 NZ LYS A 40 -26.916 27.288 -20.589 1.00 29.21 N ATOM 360 HZ1 LYS A 40 -27.474 28.131 -20.833 1.00 0.00 H ATOM 361 HZ2 LYS A 40 -27.407 26.436 -20.928 1.00 0.00 H ATOM 362 HZ3 LYS A 40 -26.799 27.235 -19.557 1.00 0.00 H ATOM 363 H LYS A 40 -25.541 30.064 -26.938 1.00 0.00 H ATOM 364 N SER A 41 -25.427 32.206 -24.395 1.00 9.76 N ATOM 365 CA SER A 41 -25.107 33.349 -23.545 1.00 21.85 C ATOM 366 C SER A 41 -25.680 34.663 -24.080 1.00 16.62 C ATOM 367 O SER A 41 -25.598 35.694 -23.417 1.00 12.94 O ATOM 368 CB SER A 41 -23.591 33.484 -23.387 1.00 13.58 C ATOM 369 OG SER A 41 -22.996 33.953 -24.586 1.00 20.81 O ATOM 370 HG SER A 41 -23.184 33.314 -25.318 1.00 0.00 H ATOM 371 H SER A 41 -24.757 31.922 -25.137 1.00 0.00 H ATOM 372 N GLY A 42 -26.254 34.627 -25.278 1.00 16.60 N ATOM 373 CA GLY A 42 -26.762 35.838 -25.902 1.00 14.98 C ATOM 374 C GLY A 42 -25.652 36.825 -26.216 1.00 14.51 C ATOM 375 O GLY A 42 -25.846 38.043 -26.164 1.00 10.40 O ATOM 376 H GLY A 42 -26.341 33.719 -25.777 1.00 0.00 H ATOM 377 N SER A 43 -24.479 36.293 -26.543 1.00 8.72 N ATOM 378 CA SER A 43 -23.317 37.112 -26.867 1.00 11.07 C ATOM 379 C SER A 43 -23.500 37.821 -28.210 1.00 16.27 C ATOM 380 O SER A 43 -23.908 37.203 -29.191 1.00 9.25 O ATOM 381 CB SER A 43 -22.054 36.246 -26.883 1.00 7.63 C ATOM 382 OG SER A 43 -20.943 36.959 -27.399 1.00 29.30 O ATOM 383 HG SER A 43 -20.145 36.372 -27.396 1.00 0.00 H ATOM 384 H SER A 43 -24.387 35.257 -26.569 1.00 0.00 H ATOM 385 N GLU A 44 -23.198 39.117 -28.247 1.00 9.27 N ATOM 386 CA GLU A 44 -23.382 39.923 -29.457 1.00 7.72 C ATOM 387 C GLU A 44 -22.643 39.343 -30.665 1.00 10.38 C ATOM 388 O GLU A 44 -23.135 39.402 -31.790 1.00 8.42 O ATOM 389 CB GLU A 44 -22.933 41.367 -29.203 1.00 11.47 C ATOM 390 CG GLU A 44 -22.758 42.228 -30.458 1.00 11.51 C ATOM 391 CD GLU A 44 -24.062 42.519 -31.190 1.00 12.65 C ATOM 392 OE1 GLU A 44 -25.148 42.364 -30.592 1.00 13.43 O ATOM 393 OE2 GLU A 44 -23.997 42.907 -32.376 1.00 12.55 O ATOM 394 H GLU A 44 -22.820 39.571 -27.391 1.00 0.00 H ATOM 395 N LEU A 45 -21.468 38.770 -30.430 1.00 9.30 N ATOM 396 CA LEU A 45 -20.731 38.118 -31.503 1.00 14.14 C ATOM 397 C LEU A 45 -21.073 36.633 -31.582 1.00 9.01 C ATOM 398 O LEU A 45 -20.408 35.799 -30.967 1.00 7.96 O ATOM 399 CB LEU A 45 -19.224 38.300 -31.314 1.00 12.45 C ATOM 400 CG LEU A 45 -18.347 37.782 -32.459 1.00 13.35 C ATOM 401 CD1 LEU A 45 -18.690 38.481 -33.768 1.00 8.82 C ATOM 402 CD2 LEU A 45 -16.873 37.953 -32.127 1.00 15.24 C ATOM 403 H LEU A 45 -21.070 38.787 -29.469 1.00 0.00 H ATOM 404 N GLY A 46 -22.119 36.306 -32.333 1.00 8.81 N ATOM 405 CA GLY A 46 -22.461 34.917 -32.573 1.00 3.86 C ATOM 406 C GLY A 46 -23.891 34.505 -32.278 1.00 12.59 C ATOM 407 O GLY A 46 -24.340 33.469 -32.768 1.00 8.28 O ATOM 408 H GLY A 46 -22.701 37.057 -32.755 1.00 0.00 H ATOM 409 N LYS A 47 -24.614 35.298 -31.488 1.00 7.65 N ATOM 410 CA LYS A 47 -25.997 34.962 -31.146 1.00 9.18 C ATOM 411 C LYS A 47 -26.885 34.915 -32.385 1.00 9.35 C ATOM 412 O LYS A 47 -27.940 34.283 -32.374 1.00 8.48 O ATOM 413 CB LYS A 47 -26.574 35.960 -30.139 1.00 10.94 C ATOM 414 CG LYS A 47 -26.854 37.342 -30.718 1.00 15.71 C ATOM 415 CD LYS A 47 -27.440 38.283 -29.673 1.00 10.42 C ATOM 416 CE LYS A 47 -27.576 39.696 -30.223 1.00 15.53 C ATOM 417 NZ LYS A 47 -28.149 40.643 -29.227 1.00 12.66 N ATOM 418 HZ1 LYS A 47 -29.095 40.316 -28.944 1.00 0.00 H ATOM 419 HZ2 LYS A 47 -27.530 40.682 -28.392 1.00 0.00 H ATOM 420 HZ3 LYS A 47 -28.220 41.590 -29.652 1.00 0.00 H ATOM 421 H LYS A 47 -24.189 36.168 -31.109 1.00 0.00 H ATOM 422 N GLN A 48 -26.450 35.580 -33.451 1.00 5.51 N ATOM 423 CA GLN A 48 -27.202 35.616 -34.703 1.00 10.75 C ATOM 424 C GLN A 48 -27.335 34.233 -35.344 1.00 7.87 C ATOM 425 O GLN A 48 -28.178 34.023 -36.216 1.00 9.11 O ATOM 426 CB GLN A 48 -26.538 36.579 -35.696 1.00 13.11 C ATOM 427 CG GLN A 48 -26.436 38.025 -35.219 1.00 14.68 C ATOM 428 CD GLN A 48 -25.257 38.262 -34.292 1.00 14.67 C ATOM 429 OE1 GLN A 48 -24.519 37.334 -33.954 1.00 8.24 O ATOM 430 NE2 GLN A 48 -25.075 39.511 -33.877 1.00 10.87 N ATOM 431 HE22 GLN A 48 -25.723 40.262 -34.188 1.00 0.00 H ATOM 432 HE21 GLN A 48 -24.284 39.738 -33.241 1.00 0.00 H ATOM 433 H GLN A 48 -25.546 36.091 -33.392 1.00 0.00 H ATOM 434 N ALA A 49 -26.505 33.293 -34.904 1.00 8.62 N ATOM 435 CA ALA A 49 -26.436 31.973 -35.520 1.00 7.93 C ATOM 436 C ALA A 49 -27.654 31.099 -35.233 1.00 8.82 C ATOM 437 O ALA A 49 -27.883 30.118 -35.937 1.00 8.23 O ATOM 438 CB ALA A 49 -25.172 31.254 -35.064 1.00 4.84 C ATOM 439 H ALA A 49 -25.886 33.505 -34.096 1.00 0.00 H ATOM 440 N LYS A 50 -28.426 31.458 -34.210 1.00 5.36 N ATOM 441 CA LYS A 50 -29.497 30.600 -33.695 1.00 10.01 C ATOM 442 C LYS A 50 -30.429 30.034 -34.770 1.00 8.85 C ATOM 443 O LYS A 50 -30.577 28.817 -34.892 1.00 12.63 O ATOM 444 CB LYS A 50 -30.330 31.359 -32.661 1.00 6.17 C ATOM 445 CG LYS A 50 -31.430 30.508 -32.051 1.00 18.65 C ATOM 446 CD LYS A 50 -32.099 31.195 -30.880 1.00 21.04 C ATOM 447 CE LYS A 50 -32.939 30.208 -30.086 1.00 29.08 C ATOM 448 NZ LYS A 50 -33.963 30.900 -29.260 1.00 38.08 N ATOM 449 HZ1 LYS A 50 -33.491 31.542 -28.592 1.00 0.00 H ATOM 450 HZ2 LYS A 50 -34.595 31.446 -29.880 1.00 0.00 H ATOM 451 HZ3 LYS A 50 -34.516 30.194 -28.733 1.00 0.00 H ATOM 452 H LYS A 50 -28.263 32.381 -33.760 1.00 0.00 H ATOM 453 N ASP A 51 -31.048 30.915 -35.551 1.00 9.55 N ATOM 454 CA ASP A 51 -31.992 30.486 -36.579 1.00 10.78 C ATOM 455 C ASP A 51 -31.302 29.755 -37.722 1.00 7.36 C ATOM 456 O ASP A 51 -31.876 28.850 -38.325 1.00 7.88 O ATOM 457 CB ASP A 51 -32.765 31.685 -37.129 1.00 9.51 C ATOM 458 CG ASP A 51 -33.761 32.240 -36.133 1.00 17.19 C ATOM 459 OD1 ASP A 51 -33.997 31.578 -35.100 1.00 13.74 O ATOM 460 OD2 ASP A 51 -34.307 33.333 -36.387 1.00 19.38 O ATOM 461 H ASP A 51 -30.856 31.930 -35.427 1.00 0.00 H ATOM 462 N ILE A 52 -30.073 30.158 -38.019 1.00 11.57 N ATOM 463 CA ILE A 52 -29.313 29.565 -39.112 1.00 8.24 C ATOM 464 C ILE A 52 -28.960 28.112 -38.812 1.00 6.66 C ATOM 465 O ILE A 52 -29.057 27.244 -39.680 1.00 8.19 O ATOM 466 CB ILE A 52 -28.022 30.363 -39.388 1.00 16.11 C ATOM 467 CG1 ILE A 52 -28.356 31.835 -39.648 1.00 11.22 C ATOM 468 CG2 ILE A 52 -27.253 29.760 -40.558 1.00 8.31 C ATOM 469 CD1 ILE A 52 -27.138 32.725 -39.792 1.00 11.27 C ATOM 470 H ILE A 52 -29.640 30.918 -37.456 1.00 0.00 H ATOM 471 N MET A 53 -28.558 27.844 -37.576 1.00 6.10 N ATOM 472 CA MET A 53 -28.184 26.490 -37.196 1.00 6.34 C ATOM 473 C MET A 53 -29.411 25.580 -37.138 1.00 9.96 C ATOM 474 O MET A 53 -29.330 24.399 -37.474 1.00 7.07 O ATOM 475 CB MET A 53 -27.443 26.497 -35.858 1.00 3.43 C ATOM 476 CG MET A 53 -26.069 27.157 -35.939 1.00 4.55 C ATOM 477 SD MET A 53 -25.068 26.942 -34.455 1.00 11.13 S ATOM 478 CE MET A 53 -26.055 27.838 -33.257 1.00 5.23 C ATOM 479 H MET A 53 -28.510 28.609 -36.873 1.00 0.00 H ATOM 480 N ASP A 54 -30.557 26.117 -36.737 1.00 8.88 N ATOM 481 CA ASP A 54 -31.759 25.288 -36.673 1.00 11.28 C ATOM 482 C ASP A 54 -32.333 25.009 -38.064 1.00 10.87 C ATOM 483 O ASP A 54 -33.110 24.070 -38.241 1.00 12.09 O ATOM 484 CB ASP A 54 -32.816 25.930 -35.774 1.00 11.42 C ATOM 485 CG ASP A 54 -32.640 25.553 -34.313 1.00 17.89 C ATOM 486 OD1 ASP A 54 -32.815 24.360 -33.977 1.00 13.41 O ATOM 487 OD2 ASP A 54 -32.330 26.448 -33.499 1.00 18.50 O ATOM 488 H ASP A 54 -30.599 27.121 -36.470 1.00 0.00 H ATOM 489 N ALA A 55 -31.944 25.815 -39.048 1.00 7.33 N ATOM 490 CA ALA A 55 -32.288 25.530 -40.437 1.00 6.32 C ATOM 491 C ALA A 55 -31.309 24.535 -41.060 1.00 9.92 C ATOM 492 O ALA A 55 -31.538 24.034 -42.162 1.00 9.42 O ATOM 493 CB ALA A 55 -32.316 26.816 -41.251 1.00 6.09 C ATOM 494 H ALA A 55 -31.385 26.663 -38.823 1.00 0.00 H ATOM 495 N GLY A 56 -30.217 24.259 -40.355 1.00 3.37 N ATOM 496 CA GLY A 56 -29.189 23.367 -40.860 1.00 7.60 C ATOM 497 C GLY A 56 -28.296 24.026 -41.897 1.00 8.97 C ATOM 498 O GLY A 56 -27.586 23.346 -42.637 1.00 9.01 O ATOM 499 H GLY A 56 -30.096 24.693 -39.418 1.00 0.00 H ATOM 500 N LYS A 57 -28.332 25.355 -41.948 1.00 8.37 N ATOM 501 CA LYS A 57 -27.536 26.114 -42.909 1.00 12.73 C ATOM 502 C LYS A 57 -26.213 26.568 -42.308 1.00 11.00 C ATOM 503 O LYS A 57 -26.058 26.616 -41.089 1.00 10.74 O ATOM 504 CB LYS A 57 -28.314 27.336 -43.407 1.00 9.66 C ATOM 505 CG LYS A 57 -29.594 27.003 -44.146 1.00 10.60 C ATOM 506 CD LYS A 57 -29.304 26.277 -45.448 1.00 39.17 C ATOM 507 CE LYS A 57 -30.589 25.945 -46.190 1.00 51.31 C ATOM 508 NZ LYS A 57 -30.317 25.214 -47.457 1.00 63.18 N ATOM 509 HZ1 LYS A 57 -29.723 25.803 -48.075 1.00 0.00 H ATOM 510 HZ2 LYS A 57 -29.822 24.325 -47.243 1.00 0.00 H ATOM 511 HZ3 LYS A 57 -31.217 25.005 -47.935 1.00 0.00 H ATOM 512 H LYS A 57 -28.945 25.869 -41.284 1.00 0.00 H ATOM 513 N LEU A 58 -25.262 26.908 -43.169 1.00 7.93 N ATOM 514 CA LEU A 58 -24.004 27.482 -42.716 1.00 6.51 C ATOM 515 C LEU A 58 -24.190 28.936 -42.301 1.00 6.45 C ATOM 516 O LEU A 58 -24.880 29.704 -42.971 1.00 8.77 O ATOM 517 CB LEU A 58 -22.937 27.388 -43.809 1.00 9.41 C ATOM 518 CG LEU A 58 -22.401 25.998 -44.152 1.00 13.89 C ATOM 519 CD1 LEU A 58 -21.330 26.098 -45.228 1.00 10.42 C ATOM 520 CD2 LEU A 58 -21.858 25.308 -42.909 1.00 11.49 C ATOM 521 H LEU A 58 -25.419 26.761 -44.187 1.00 0.00 H ATOM 522 N VAL A 59 -23.575 29.296 -41.181 1.00 4.38 N ATOM 523 CA VAL A 59 -23.482 30.679 -40.738 1.00 2.84 C ATOM 524 C VAL A 59 -22.585 31.432 -41.726 1.00 10.26 C ATOM 525 O VAL A 59 -21.719 30.819 -42.350 1.00 6.02 O ATOM 526 CB VAL A 59 -22.927 30.738 -39.293 1.00 6.43 C ATOM 527 CG1 VAL A 59 -22.502 32.138 -38.901 1.00 10.47 C ATOM 528 CG2 VAL A 59 -23.954 30.179 -38.315 1.00 3.70 C ATOM 529 H VAL A 59 -23.140 28.556 -40.594 1.00 0.00 H ATOM 530 N THR A 60 -22.805 32.736 -41.898 1.00 4.74 N ATOM 531 CA THR A 60 -22.007 33.526 -42.835 1.00 6.73 C ATOM 532 C THR A 60 -20.515 33.440 -42.522 1.00 7.99 C ATOM 533 O THR A 60 -20.120 33.317 -41.363 1.00 5.56 O ATOM 534 CB THR A 60 -22.419 35.017 -42.835 1.00 9.62 C ATOM 535 OG1 THR A 60 -22.211 35.575 -41.532 1.00 9.99 O ATOM 536 CG2 THR A 60 -23.882 35.172 -43.226 1.00 5.26 C ATOM 537 HG1 THR A 60 -22.476 36.529 -41.537 1.00 0.00 H ATOM 538 H THR A 60 -23.560 33.201 -41.354 1.00 0.00 H ATOM 539 N ASP A 61 -19.696 33.508 -43.566 1.00 7.45 N ATOM 540 CA ASP A 61 -18.243 33.455 -43.425 1.00 12.41 C ATOM 541 C ASP A 61 -17.690 34.532 -42.492 1.00 6.30 C ATOM 542 O ASP A 61 -16.874 34.238 -41.621 1.00 7.87 O ATOM 543 CB ASP A 61 -17.573 33.582 -44.793 1.00 6.18 C ATOM 544 CG ASP A 61 -17.830 32.383 -45.685 1.00 14.11 C ATOM 545 OD1 ASP A 61 -17.962 31.258 -45.156 1.00 7.30 O ATOM 546 OD2 ASP A 61 -17.896 32.569 -46.917 1.00 12.32 O ATOM 547 H ASP A 61 -20.104 33.602 -44.518 1.00 0.00 H ATOM 548 N GLU A 62 -18.128 35.775 -42.669 1.00 10.01 N ATOM 549 CA GLU A 62 -17.546 36.878 -41.905 1.00 12.58 C ATOM 550 C GLU A 62 -17.835 36.747 -40.412 1.00 5.76 C ATOM 551 O GLU A 62 -17.055 37.215 -39.585 1.00 10.88 O ATOM 552 CB GLU A 62 -18.045 38.234 -42.426 1.00 14.01 C ATOM 553 CG GLU A 62 -19.516 38.502 -42.182 1.00 13.00 C ATOM 554 CD GLU A 62 -19.916 39.944 -42.456 1.00 19.39 C ATOM 555 OE1 GLU A 62 -21.073 40.161 -42.866 1.00 12.45 O ATOM 556 OE2 GLU A 62 -19.089 40.860 -42.246 1.00 12.22 O ATOM 557 H GLU A 62 -18.888 35.964 -43.354 1.00 0.00 H ATOM 558 N LEU A 63 -18.941 36.096 -40.063 1.00 8.07 N ATOM 559 CA LEU A 63 -19.274 35.899 -38.656 1.00 11.08 C ATOM 560 C LEU A 63 -18.367 34.853 -38.003 1.00 14.05 C ATOM 561 O LEU A 63 -17.852 35.076 -36.909 1.00 7.20 O ATOM 562 CB LEU A 63 -20.743 35.497 -38.493 1.00 8.46 C ATOM 563 CG LEU A 63 -21.263 35.490 -37.050 1.00 20.86 C ATOM 564 CD1 LEU A 63 -20.981 36.819 -36.367 1.00 17.97 C ATOM 565 CD2 LEU A 63 -22.752 35.178 -36.994 1.00 18.63 C ATOM 566 H LEU A 63 -19.574 35.724 -40.799 1.00 0.00 H ATOM 567 N VAL A 64 -18.162 33.717 -38.665 1.00 10.68 N ATOM 568 CA VAL A 64 -17.315 32.679 -38.085 1.00 10.87 C ATOM 569 C VAL A 64 -15.840 33.066 -38.151 1.00 7.57 C ATOM 570 O VAL A 64 -15.071 32.715 -37.258 1.00 9.93 O ATOM 571 CB VAL A 64 -17.517 31.304 -38.768 1.00 7.06 C ATOM 572 CG1 VAL A 64 -18.878 30.732 -38.414 1.00 8.13 C ATOM 573 CG2 VAL A 64 -17.347 31.408 -40.271 1.00 10.85 C ATOM 574 H VAL A 64 -18.605 33.569 -39.594 1.00 0.00 H ATOM 575 N ILE A 65 -15.446 33.795 -39.193 1.00 4.47 N ATOM 576 CA ILE A 65 -14.062 34.249 -39.307 1.00 5.67 C ATOM 577 C ILE A 65 -13.715 35.155 -38.127 1.00 8.39 C ATOM 578 O ILE A 65 -12.645 35.029 -37.531 1.00 10.38 O ATOM 579 CB ILE A 65 -13.804 34.990 -40.636 1.00 10.66 C ATOM 580 CG1 ILE A 65 -13.753 33.996 -41.799 1.00 9.28 C ATOM 581 CG2 ILE A 65 -12.498 35.773 -40.572 1.00 7.64 C ATOM 582 CD1 ILE A 65 -13.840 34.647 -43.163 1.00 7.83 C ATOM 583 H ILE A 65 -16.131 34.044 -39.934 1.00 0.00 H ATOM 584 N ALA A 66 -14.639 36.046 -37.776 1.00 9.44 N ATOM 585 CA ALA A 66 -14.456 36.939 -36.634 1.00 8.43 C ATOM 586 C ALA A 66 -14.323 36.166 -35.321 1.00 9.05 C ATOM 587 O ALA A 66 -13.465 36.477 -34.496 1.00 11.51 O ATOM 588 CB ALA A 66 -15.608 37.926 -36.547 1.00 8.62 C ATOM 589 H ALA A 66 -15.517 36.109 -38.330 1.00 0.00 H ATOM 590 N LEU A 67 -15.178 35.165 -35.129 1.00 10.73 N ATOM 591 CA LEU A 67 -15.125 34.339 -33.926 1.00 8.99 C ATOM 592 C LEU A 67 -13.788 33.620 -33.794 1.00 9.12 C ATOM 593 O LEU A 67 -13.227 33.532 -32.702 1.00 14.38 O ATOM 594 CB LEU A 67 -16.263 33.315 -33.922 1.00 12.81 C ATOM 595 CG LEU A 67 -17.556 33.717 -33.210 1.00 23.58 C ATOM 596 CD1 LEU A 67 -18.579 32.601 -33.307 1.00 18.30 C ATOM 597 CD2 LEU A 67 -17.282 34.061 -31.753 1.00 11.93 C ATOM 598 H LEU A 67 -15.900 34.967 -35.851 1.00 0.00 H ATOM 599 N VAL A 68 -13.280 33.105 -34.910 1.00 14.38 N ATOM 600 CA VAL A 68 -12.018 32.375 -34.901 1.00 12.38 C ATOM 601 C VAL A 68 -10.845 33.315 -34.625 1.00 17.58 C ATOM 602 O VAL A 68 -9.956 32.992 -33.834 1.00 15.27 O ATOM 603 CB VAL A 68 -11.787 31.631 -36.233 1.00 7.53 C ATOM 604 CG1 VAL A 68 -10.380 31.060 -36.294 1.00 5.18 C ATOM 605 CG2 VAL A 68 -12.818 30.528 -36.407 1.00 6.27 C ATOM 606 H VAL A 68 -13.793 33.225 -35.807 1.00 0.00 H ATOM 607 N LYS A 69 -10.852 34.477 -35.274 1.00 8.11 N ATOM 608 CA LYS A 69 -9.803 35.474 -35.077 1.00 15.67 C ATOM 609 C LYS A 69 -9.713 35.894 -33.615 1.00 14.93 C ATOM 610 O LYS A 69 -8.622 35.998 -33.059 1.00 19.67 O ATOM 611 CB LYS A 69 -10.048 36.701 -35.957 1.00 14.50 C ATOM 612 CG LYS A 69 -9.526 36.560 -37.375 1.00 30.51 C ATOM 613 CD LYS A 69 -9.843 37.794 -38.204 1.00 35.32 C ATOM 614 CE LYS A 69 -9.357 37.638 -39.638 1.00 29.34 C ATOM 615 NZ LYS A 69 -9.772 38.787 -40.489 1.00 33.85 N ATOM 616 HZ1 LYS A 69 -10.810 38.852 -40.500 1.00 0.00 H ATOM 617 HZ2 LYS A 69 -9.373 39.666 -40.102 1.00 0.00 H ATOM 618 HZ3 LYS A 69 -9.422 38.643 -41.458 1.00 0.00 H ATOM 619 H LYS A 69 -11.625 34.680 -35.939 1.00 0.00 H ATOM 620 N GLU A 70 -10.866 36.129 -32.997 1.00 14.58 N ATOM 621 CA GLU A 70 -10.906 36.492 -31.586 1.00 14.31 C ATOM 622 C GLU A 70 -10.370 35.364 -30.707 1.00 17.31 C ATOM 623 O GLU A 70 -9.601 35.603 -29.776 1.00 18.51 O ATOM 624 CB GLU A 70 -12.332 36.848 -31.159 1.00 15.09 C ATOM 625 CG GLU A 70 -12.449 37.208 -29.684 1.00 26.13 C ATOM 626 CD GLU A 70 -13.880 37.447 -29.250 1.00 46.50 C ATOM 627 OE1 GLU A 70 -14.736 36.576 -29.513 1.00 56.57 O ATOM 628 OE2 GLU A 70 -14.149 38.505 -28.643 1.00 52.30 O ATOM 629 H GLU A 70 -11.756 36.052 -33.530 1.00 0.00 H ATOM 630 N ARG A 71 -10.771 34.136 -31.017 1.00 12.26 N ATOM 631 CA ARG A 71 -10.436 32.985 -30.183 1.00 10.52 C ATOM 632 C ARG A 71 -8.957 32.595 -30.252 1.00 15.28 C ATOM 633 O ARG A 71 -8.331 32.332 -29.224 1.00 13.99 O ATOM 634 CB ARG A 71 -11.304 31.788 -30.571 1.00 10.12 C ATOM 635 CG ARG A 71 -10.991 30.520 -29.794 1.00 11.46 C ATOM 636 CD ARG A 71 -11.306 30.684 -28.316 1.00 9.53 C ATOM 637 NE ARG A 71 -10.924 29.504 -27.544 1.00 19.77 N ATOM 638 CZ ARG A 71 -9.706 29.297 -27.052 1.00 19.40 C ATOM 639 NH1 ARG A 71 -8.746 30.191 -27.252 1.00 16.90 N ATOM 640 NH2 ARG A 71 -9.445 28.195 -26.360 1.00 22.91 N ATOM 641 HE ARG A 71 -11.650 28.781 -27.368 1.00 0.00 H ATOM 642 HH12 ARG A 71 -7.794 30.027 -26.866 1.00 0.00 H ATOM 643 HH11 ARG A 71 -8.945 31.056 -27.794 1.00 0.00 H ATOM 644 HH22 ARG A 71 -8.492 28.035 -25.976 1.00 0.00 H ATOM 645 HH21 ARG A 71 -10.194 27.491 -26.201 1.00 0.00 H ATOM 646 H ARG A 71 -11.338 33.991 -31.876 1.00 0.00 H ATOM 647 N ILE A 72 -8.394 32.551 -31.456 1.00 17.18 N ATOM 648 CA ILE A 72 -7.007 32.110 -31.604 1.00 22.61 C ATOM 649 C ILE A 72 -6.024 33.229 -31.265 1.00 21.13 C ATOM 650 O ILE A 72 -4.806 33.035 -31.306 1.00 20.26 O ATOM 651 CB ILE A 72 -6.714 31.590 -33.027 1.00 19.76 C ATOM 652 CG1 ILE A 72 -6.738 32.732 -34.042 1.00 23.83 C ATOM 653 CG2 ILE A 72 -7.700 30.495 -33.409 1.00 21.68 C ATOM 654 CD1 ILE A 72 -6.565 32.263 -35.474 1.00 18.60 C ATOM 655 H ILE A 72 -8.941 32.831 -32.295 1.00 0.00 H ATOM 656 N ALA A 73 -6.561 34.398 -30.931 1.00 19.70 N ATOM 657 CA ALA A 73 -5.737 35.510 -30.469 1.00 19.91 C ATOM 658 C ALA A 73 -5.421 35.363 -28.984 1.00 27.75 C ATOM 659 O ALA A 73 -4.482 35.980 -28.472 1.00 19.68 O ATOM 660 CB ALA A 73 -6.429 36.833 -30.735 1.00 17.48 C ATOM 661 H ALA A 73 -7.591 34.523 -31.000 1.00 0.00 H ATOM 662 N GLN A 74 -6.209 34.538 -28.298 1.00 19.25 N ATOM 663 CA GLN A 74 -6.003 34.281 -26.875 1.00 19.55 C ATOM 664 C GLN A 74 -4.655 33.609 -26.651 1.00 38.29 C ATOM 665 O GLN A 74 -4.066 33.051 -27.579 1.00 23.39 O ATOM 666 CB GLN A 74 -7.128 33.421 -26.308 1.00 21.76 C ATOM 667 CG GLN A 74 -8.494 34.052 -26.452 1.00 25.28 C ATOM 668 CD GLN A 74 -9.508 33.480 -25.473 1.00 50.95 C ATOM 669 OE1 GLN A 74 -9.189 33.239 -24.309 1.00 74.78 O ATOM 670 NE2 GLN A 74 -10.734 33.244 -25.946 1.00 46.95 N ATOM 671 HE22 GLN A 74 -10.960 33.463 -26.937 1.00 0.00 H ATOM 672 HE21 GLN A 74 -11.463 32.841 -25.323 1.00 0.00 H ATOM 673 H GLN A 74 -6.993 34.063 -28.789 1.00 0.00 H ATOM 674 N GLU A 75 -4.151 33.687 -25.424 1.00 27.61 N ATOM 675 CA GLU A 75 -2.784 33.253 -25.158 1.00 40.01 C ATOM 676 C GLU A 75 -2.629 31.732 -25.159 1.00 29.41 C ATOM 677 O GLU A 75 -1.530 31.217 -25.374 1.00 29.21 O ATOM 678 CB GLU A 75 -2.286 33.827 -23.831 1.00 42.50 C ATOM 679 CG GLU A 75 -0.771 33.834 -23.722 1.00 49.55 C ATOM 680 CD GLU A 75 -0.269 34.538 -22.477 1.00 67.17 C ATOM 681 OE1 GLU A 75 -1.066 35.256 -21.837 1.00 66.48 O ATOM 682 OE2 GLU A 75 0.926 34.372 -22.144 1.00 72.17 O ATOM 683 H GLU A 75 -4.735 34.060 -24.648 1.00 0.00 H ATOM 684 N ASP A 76 -3.724 31.006 -24.959 1.00 28.48 N ATOM 685 CA ASP A 76 -3.640 29.549 -24.956 1.00 28.95 C ATOM 686 C ASP A 76 -3.374 28.992 -26.369 1.00 19.97 C ATOM 687 O ASP A 76 -3.189 27.784 -26.532 1.00 24.10 O ATOM 688 CB ASP A 76 -4.913 28.928 -24.350 1.00 24.30 C ATOM 689 CG ASP A 76 -6.169 29.244 -25.145 1.00 27.54 C ATOM 690 OD1 ASP A 76 -6.147 30.183 -25.968 1.00 24.58 O ATOM 691 OD2 ASP A 76 -7.187 28.548 -24.936 1.00 31.41 O ATOM 692 H ASP A 76 -4.639 31.475 -24.805 1.00 0.00 H ATOM 693 N CYS A 77 -3.319 29.873 -27.371 1.00 23.40 N ATOM 694 CA CYS A 77 -3.160 29.466 -28.775 1.00 26.27 C ATOM 695 C CYS A 77 -1.834 29.893 -29.405 1.00 26.06 C ATOM 696 O CYS A 77 -1.610 29.717 -30.608 1.00 35.00 O ATOM 697 CB CYS A 77 -4.276 30.041 -29.638 1.00 18.39 C ATOM 698 SG CYS A 77 -5.915 29.339 -29.388 1.00 21.78 S ATOM 699 H CYS A 77 -3.391 30.887 -27.150 1.00 0.00 H ATOM 700 N ARG A 78 -0.949 30.451 -28.594 1.00 30.27 N ATOM 701 CA ARG A 78 0.346 30.961 -29.067 1.00 40.08 C ATOM 702 C ARG A 78 1.344 29.884 -29.523 1.00 30.27 C ATOM 703 O ARG A 78 2.312 30.133 -30.254 1.00 50.76 O ATOM 704 CB ARG A 78 0.973 31.763 -27.942 1.00 40.98 C ATOM 705 CG ARG A 78 1.619 30.842 -26.875 1.00 46.21 C ATOM 706 CD ARG A 78 1.930 31.479 -25.509 1.00 56.56 C ATOM 707 NE ARG A 78 2.065 30.458 -24.459 1.00 50.52 N ATOM 708 CZ ARG A 78 1.089 30.073 -23.635 1.00 57.79 C ATOM 709 NH1 ARG A 78 -0.102 30.642 -23.706 1.00 55.84 N ATOM 710 NH2 ARG A 78 1.309 29.139 -22.715 1.00 53.66 N ATOM 711 HE ARG A 78 2.993 30.001 -24.351 1.00 0.00 H ATOM 712 HH12 ARG A 78 -0.862 30.340 -23.063 1.00 0.00 H ATOM 713 HH11 ARG A 78 -0.280 31.391 -24.405 1.00 0.00 H ATOM 714 HH22 ARG A 78 0.541 28.846 -22.078 1.00 0.00 H ATOM 715 HH21 ARG A 78 2.249 28.701 -22.633 1.00 0.00 H ATOM 716 H ARG A 78 -1.179 30.532 -27.583 1.00 0.00 H ATOM 717 N ASN A 79 1.027 28.682 -29.075 1.00 30.79 N ATOM 718 CA ASN A 79 1.806 27.458 -29.184 1.00 22.58 C ATOM 719 C ASN A 79 1.190 26.396 -30.072 1.00 28.54 C ATOM 720 O ASN A 79 1.654 25.259 -30.148 1.00 31.58 O ATOM 721 CB ASN A 79 2.011 26.909 -27.737 1.00 49.50 C ATOM 722 CG ASN A 79 3.219 27.513 -27.006 1.00 48.91 C ATOM 723 OD1 ASN A 79 3.099 28.090 -25.925 1.00 60.67 O ATOM 724 ND2 ASN A 79 4.435 27.067 -27.477 1.00 67.10 N ATOM 725 HD22 ASN A 79 4.491 26.584 -28.396 1.00 0.00 H ATOM 726 HD21 ASN A 79 5.296 27.213 -26.913 1.00 0.00 H ATOM 727 H ASN A 79 0.112 28.601 -28.587 1.00 0.00 H ATOM 728 N GLY A 80 0.118 26.795 -30.723 1.00 20.47 N ATOM 729 CA GLY A 80 -0.538 25.903 -31.637 1.00 17.88 C ATOM 730 C GLY A 80 -2.021 25.848 -31.348 1.00 21.95 C ATOM 731 O GLY A 80 -2.439 26.343 -30.313 1.00 16.58 O ATOM 732 H GLY A 80 -0.253 27.755 -30.576 1.00 0.00 H ATOM 733 N PHE A 81 -2.825 25.273 -32.241 1.00 9.37 N ATOM 734 CA PHE A 81 -4.255 25.101 -31.964 1.00 12.17 C ATOM 735 C PHE A 81 -4.846 24.055 -32.887 1.00 8.28 C ATOM 736 O PHE A 81 -4.235 23.666 -33.883 1.00 12.49 O ATOM 737 CB PHE A 81 -5.009 26.427 -32.105 1.00 9.43 C ATOM 738 CG PHE A 81 -4.639 27.204 -33.332 1.00 17.03 C ATOM 739 CD1 PHE A 81 -5.175 26.872 -34.565 1.00 17.92 C ATOM 740 CD2 PHE A 81 -3.770 28.279 -33.251 1.00 12.63 C ATOM 741 CE1 PHE A 81 -4.844 27.591 -35.696 1.00 17.18 C ATOM 742 CE2 PHE A 81 -3.436 29.004 -34.379 1.00 22.81 C ATOM 743 CZ PHE A 81 -3.974 28.658 -35.604 1.00 20.11 C ATOM 744 H PHE A 81 -2.434 24.942 -33.146 1.00 0.00 H ATOM 745 N LEU A 82 -6.040 23.607 -32.533 1.00 7.84 N ATOM 746 CA LEU A 82 -6.748 22.595 -33.287 1.00 9.58 C ATOM 747 C LEU A 82 -8.044 23.172 -33.841 1.00 10.73 C ATOM 748 O LEU A 82 -8.997 23.402 -33.097 1.00 14.24 O ATOM 749 CB LEU A 82 -7.025 21.389 -32.390 1.00 9.78 C ATOM 750 CG LEU A 82 -7.857 20.217 -32.896 1.00 18.42 C ATOM 751 CD1 LEU A 82 -7.217 19.573 -34.114 1.00 12.34 C ATOM 752 CD2 LEU A 82 -8.016 19.208 -31.772 1.00 11.30 C ATOM 753 H LEU A 82 -6.487 23.998 -31.679 1.00 0.00 H ATOM 754 N LEU A 83 -8.074 23.418 -35.146 1.00 10.76 N ATOM 755 CA LEU A 83 -9.279 23.935 -35.784 1.00 9.44 C ATOM 756 C LEU A 83 -10.245 22.800 -36.107 1.00 6.39 C ATOM 757 O LEU A 83 -9.941 21.918 -36.912 1.00 10.89 O ATOM 758 CB LEU A 83 -8.925 24.717 -37.049 1.00 8.26 C ATOM 759 CG LEU A 83 -8.125 26.001 -36.816 1.00 8.88 C ATOM 760 CD1 LEU A 83 -7.625 26.561 -38.132 1.00 7.02 C ATOM 761 CD2 LEU A 83 -8.965 27.032 -36.077 1.00 10.06 C ATOM 762 H LEU A 83 -7.226 23.239 -35.721 1.00 0.00 H ATOM 763 N ASP A 84 -11.411 22.834 -35.469 1.00 9.47 N ATOM 764 CA ASP A 84 -12.399 21.765 -35.577 1.00 8.64 C ATOM 765 C ASP A 84 -13.705 22.270 -36.186 1.00 5.77 C ATOM 766 O ASP A 84 -14.524 22.880 -35.500 1.00 7.63 O ATOM 767 CB ASP A 84 -12.655 21.154 -34.196 1.00 10.74 C ATOM 768 CG ASP A 84 -13.709 20.064 -34.220 1.00 11.95 C ATOM 769 OD1 ASP A 84 -13.977 19.507 -35.305 1.00 12.67 O ATOM 770 OD2 ASP A 84 -14.266 19.756 -33.144 1.00 18.59 O ATOM 771 H ASP A 84 -11.628 23.655 -34.869 1.00 0.00 H ATOM 772 N GLY A 85 -13.900 22.005 -37.474 1.00 9.34 N ATOM 773 CA GLY A 85 -15.083 22.479 -38.172 1.00 9.92 C ATOM 774 C GLY A 85 -14.840 23.813 -38.853 1.00 15.43 C ATOM 775 O GLY A 85 -15.754 24.417 -39.418 1.00 12.25 O ATOM 776 H GLY A 85 -13.192 21.447 -37.992 1.00 0.00 H ATOM 777 N PHE A 86 -13.597 24.275 -38.787 1.00 8.35 N ATOM 778 CA PHE A 86 -13.179 25.487 -39.478 1.00 7.52 C ATOM 779 C PHE A 86 -11.826 25.226 -40.134 1.00 6.02 C ATOM 780 O PHE A 86 -10.944 24.639 -39.508 1.00 8.72 O ATOM 781 CB PHE A 86 -13.104 26.666 -38.502 1.00 2.92 C ATOM 782 CG PHE A 86 -12.699 27.969 -39.141 1.00 7.21 C ATOM 783 CD1 PHE A 86 -11.360 28.290 -39.313 1.00 3.80 C ATOM 784 CD2 PHE A 86 -13.658 28.880 -39.555 1.00 5.06 C ATOM 785 CE1 PHE A 86 -10.985 29.488 -39.899 1.00 9.96 C ATOM 786 CE2 PHE A 86 -13.290 30.083 -40.142 1.00 5.67 C ATOM 787 CZ PHE A 86 -11.952 30.386 -40.313 1.00 2.98 C ATOM 788 H PHE A 86 -12.897 23.753 -38.222 1.00 0.00 H ATOM 789 N PRO A 87 -11.652 25.649 -41.399 1.00 10.86 N ATOM 790 CA PRO A 87 -12.619 26.331 -42.266 1.00 3.21 C ATOM 791 C PRO A 87 -13.656 25.378 -42.849 1.00 12.08 C ATOM 792 O PRO A 87 -13.419 24.169 -42.910 1.00 7.74 O ATOM 793 CB PRO A 87 -11.740 26.904 -43.377 1.00 6.63 C ATOM 794 CG PRO A 87 -10.631 25.913 -43.497 1.00 5.93 C ATOM 795 CD PRO A 87 -10.359 25.448 -42.082 1.00 10.73 C ATOM 796 N ARG A 88 -14.786 25.929 -43.282 1.00 8.26 N ATOM 797 CA ARG A 88 -15.891 25.131 -43.796 1.00 10.78 C ATOM 798 C ARG A 88 -16.244 25.532 -45.222 1.00 10.67 C ATOM 799 O ARG A 88 -17.053 24.878 -45.884 1.00 5.19 O ATOM 800 CB ARG A 88 -17.112 25.283 -42.890 1.00 6.90 C ATOM 801 CG ARG A 88 -17.789 23.979 -42.536 1.00 23.05 C ATOM 802 CD ARG A 88 -18.448 24.094 -41.182 1.00 28.30 C ATOM 803 NE ARG A 88 -19.305 22.956 -40.879 1.00 27.74 N ATOM 804 CZ ARG A 88 -19.489 22.478 -39.655 1.00 18.58 C ATOM 805 NH1 ARG A 88 -20.289 21.440 -39.458 1.00 50.36 N ATOM 806 NH2 ARG A 88 -18.857 23.031 -38.629 1.00 22.03 N ATOM 807 HE ARG A 88 -19.801 22.492 -41.667 1.00 0.00 H ATOM 808 HH12 ARG A 88 -20.431 21.068 -38.497 1.00 0.00 H ATOM 809 HH11 ARG A 88 -20.775 20.998 -40.264 1.00 0.00 H ATOM 810 HH22 ARG A 88 -18.999 22.658 -37.669 1.00 0.00 H ATOM 811 HH21 ARG A 88 -18.219 23.837 -38.785 1.00 0.00 H ATOM 812 H ARG A 88 -14.884 26.964 -43.253 1.00 0.00 H ATOM 813 N THR A 89 -15.648 26.628 -45.678 1.00 7.28 N ATOM 814 CA THR A 89 -15.824 27.099 -47.046 1.00 6.71 C ATOM 815 C THR A 89 -14.481 27.560 -47.599 1.00 6.86 C ATOM 816 O THR A 89 -13.528 27.757 -46.845 1.00 5.74 O ATOM 817 CB THR A 89 -16.837 28.263 -47.142 1.00 7.86 C ATOM 818 OG1 THR A 89 -16.337 29.397 -46.425 1.00 7.06 O ATOM 819 CG2 THR A 89 -18.196 27.864 -46.580 1.00 7.94 C ATOM 820 HG1 THR A 89 -16.988 30.140 -46.489 1.00 0.00 H ATOM 821 H THR A 89 -15.034 27.169 -45.036 1.00 0.00 H ATOM 822 N ILE A 90 -14.409 27.724 -48.915 1.00 5.48 N ATOM 823 CA ILE A 90 -13.204 28.244 -49.554 1.00 8.84 C ATOM 824 C ILE A 90 -12.849 29.664 -49.072 1.00 7.51 C ATOM 825 O ILE A 90 -11.678 29.939 -48.801 1.00 9.15 O ATOM 826 CB ILE A 90 -13.338 28.235 -51.101 1.00 6.74 C ATOM 827 CG1 ILE A 90 -13.657 26.821 -51.602 1.00 16.24 C ATOM 828 CG2 ILE A 90 -12.082 28.811 -51.765 1.00 11.62 C ATOM 829 CD1 ILE A 90 -12.530 26.145 -52.347 1.00 12.39 C ATOM 830 H ILE A 90 -15.230 27.476 -49.504 1.00 0.00 H ATOM 831 N PRO A 91 -13.843 30.571 -48.961 1.00 7.00 N ATOM 832 CA PRO A 91 -13.462 31.886 -48.428 1.00 7.23 C ATOM 833 C PRO A 91 -12.917 31.839 -47.000 1.00 8.18 C ATOM 834 O PRO A 91 -12.052 32.650 -46.669 1.00 8.64 O ATOM 835 CB PRO A 91 -14.773 32.675 -48.479 1.00 7.26 C ATOM 836 CG PRO A 91 -15.533 32.043 -49.595 1.00 8.74 C ATOM 837 CD PRO A 91 -15.229 30.581 -49.471 1.00 5.49 C ATOM 838 N GLN A 92 -13.405 30.915 -46.174 1.00 3.96 N ATOM 839 CA GLN A 92 -12.870 30.774 -44.823 1.00 7.92 C ATOM 840 C GLN A 92 -11.410 30.320 -44.879 1.00 8.67 C ATOM 841 O GLN A 92 -10.576 30.792 -44.108 1.00 8.22 O ATOM 842 CB GLN A 92 -13.714 29.797 -43.996 1.00 4.59 C ATOM 843 CG GLN A 92 -15.055 30.379 -43.554 1.00 5.26 C ATOM 844 CD GLN A 92 -15.961 29.370 -42.869 1.00 8.74 C ATOM 845 OE1 GLN A 92 -15.501 28.485 -42.147 1.00 6.38 O ATOM 846 NE2 GLN A 92 -17.264 29.502 -43.095 1.00 5.84 N ATOM 847 HE22 GLN A 92 -17.610 30.264 -43.712 1.00 0.00 H ATOM 848 HE21 GLN A 92 -17.937 28.843 -42.655 1.00 0.00 H ATOM 849 H GLN A 92 -14.172 30.290 -46.494 1.00 0.00 H ATOM 850 N ALA A 93 -11.102 29.422 -45.810 1.00 8.73 N ATOM 851 CA ALA A 93 -9.740 28.915 -45.963 1.00 6.78 C ATOM 852 C ALA A 93 -8.803 29.990 -46.514 1.00 8.55 C ATOM 853 O ALA A 93 -7.663 30.121 -46.069 1.00 15.80 O ATOM 854 CB ALA A 93 -9.732 27.693 -46.862 1.00 5.29 C ATOM 855 H ALA A 93 -11.848 29.072 -46.444 1.00 0.00 H ATOM 856 N ASP A 94 -9.290 30.761 -47.481 1.00 6.88 N ATOM 857 CA ASP A 94 -8.510 31.857 -48.048 1.00 6.58 C ATOM 858 C ASP A 94 -8.285 32.965 -47.023 1.00 14.79 C ATOM 859 O ASP A 94 -7.267 33.657 -47.056 1.00 9.94 O ATOM 860 CB ASP A 94 -9.202 32.424 -49.289 1.00 7.78 C ATOM 861 CG ASP A 94 -8.999 31.557 -50.516 1.00 10.90 C ATOM 862 OD1 ASP A 94 -8.012 30.793 -50.546 1.00 14.26 O ATOM 863 OD2 ASP A 94 -9.825 31.641 -51.450 1.00 10.45 O ATOM 864 H ASP A 94 -10.248 30.579 -47.842 1.00 0.00 H ATOM 865 N ALA A 95 -9.241 33.134 -46.115 1.00 10.26 N ATOM 866 CA ALA A 95 -9.112 34.131 -45.063 1.00 9.00 C ATOM 867 C ALA A 95 -7.955 33.765 -44.137 1.00 17.39 C ATOM 868 O ALA A 95 -7.217 34.637 -43.681 1.00 13.05 O ATOM 869 CB ALA A 95 -10.405 34.256 -44.282 1.00 8.26 C ATOM 870 H ALA A 95 -10.096 32.543 -46.157 1.00 0.00 H ATOM 871 N MET A 96 -7.800 32.471 -43.869 1.00 11.46 N ATOM 872 CA MET A 96 -6.672 31.984 -43.079 1.00 11.25 C ATOM 873 C MET A 96 -5.360 32.267 -43.796 1.00 13.45 C ATOM 874 O MET A 96 -4.392 32.724 -43.189 1.00 14.85 O ATOM 875 CB MET A 96 -6.798 30.482 -42.810 1.00 10.40 C ATOM 876 CG MET A 96 -7.972 30.085 -41.935 1.00 9.05 C ATOM 877 SD MET A 96 -8.031 28.295 -41.695 1.00 14.83 S ATOM 878 CE MET A 96 -6.348 27.976 -41.159 1.00 13.04 C ATOM 879 H MET A 96 -8.498 31.790 -44.230 1.00 0.00 H ATOM 880 N LYS A 97 -5.344 31.984 -45.095 1.00 17.48 N ATOM 881 CA LYS A 97 -4.168 32.187 -45.933 1.00 14.10 C ATOM 882 C LYS A 97 -3.762 33.659 -45.973 1.00 22.20 C ATOM 883 O LYS A 97 -2.587 33.990 -45.816 1.00 28.99 O ATOM 884 CB LYS A 97 -4.440 31.669 -47.348 1.00 17.12 C ATOM 885 CG LYS A 97 -3.222 31.608 -48.247 1.00 29.03 C ATOM 886 CD LYS A 97 -3.558 30.939 -49.573 1.00 25.18 C ATOM 887 CE LYS A 97 -3.775 29.442 -49.405 1.00 28.38 C ATOM 888 NZ LYS A 97 -4.068 28.765 -50.703 1.00 26.20 N ATOM 889 HZ1 LYS A 97 -4.930 29.172 -51.118 1.00 0.00 H ATOM 890 HZ2 LYS A 97 -3.269 28.905 -51.354 1.00 0.00 H ATOM 891 HZ3 LYS A 97 -4.208 27.748 -50.538 1.00 0.00 H ATOM 892 H LYS A 97 -6.207 31.602 -45.532 1.00 0.00 H ATOM 893 N GLU A 98 -4.742 34.536 -46.175 1.00 19.48 N ATOM 894 CA GLU A 98 -4.506 35.978 -46.195 1.00 21.14 C ATOM 895 C GLU A 98 -3.995 36.455 -44.837 1.00 25.71 C ATOM 896 O GLU A 98 -3.168 37.361 -44.756 1.00 29.75 O ATOM 897 CB GLU A 98 -5.789 36.724 -46.588 1.00 32.11 C ATOM 898 CG GLU A 98 -5.654 38.247 -46.730 1.00 50.73 C ATOM 899 CD GLU A 98 -5.717 38.990 -45.403 1.00 61.01 C ATOM 900 OE1 GLU A 98 -6.308 38.450 -44.445 1.00 63.94 O ATOM 901 OE2 GLU A 98 -5.175 40.114 -45.321 1.00 53.95 O ATOM 902 H GLU A 98 -5.709 34.183 -46.324 1.00 0.00 H ATOM 903 N ALA A 99 -4.485 35.829 -43.772 1.00 21.32 N ATOM 904 CA ALA A 99 -4.071 36.184 -42.421 1.00 18.84 C ATOM 905 C ALA A 99 -2.682 35.629 -42.099 1.00 19.33 C ATOM 906 O ALA A 99 -2.094 35.962 -41.071 1.00 19.47 O ATOM 907 CB ALA A 99 -5.093 35.683 -41.411 1.00 10.81 C ATOM 908 H ALA A 99 -5.181 35.068 -43.906 1.00 0.00 H ATOM 909 N GLY A 100 -2.162 34.781 -42.980 1.00 24.00 N ATOM 910 CA GLY A 100 -0.839 34.210 -42.798 1.00 22.84 C ATOM 911 C GLY A 100 -0.805 33.061 -41.809 1.00 22.17 C ATOM 912 O GLY A 100 0.230 32.779 -41.203 1.00 13.82 O ATOM 913 H GLY A 100 -2.716 34.520 -43.821 1.00 0.00 H ATOM 914 N ILE A 101 -1.941 32.395 -41.639 1.00 16.01 N ATOM 915 CA ILE A 101 -2.024 31.252 -40.740 1.00 21.57 C ATOM 916 C ILE A 101 -1.591 29.968 -41.442 1.00 18.61 C ATOM 917 O ILE A 101 -2.309 29.442 -42.291 1.00 32.18 O ATOM 918 CB ILE A 101 -3.449 31.065 -40.188 1.00 23.05 C ATOM 919 CG1 ILE A 101 -3.941 32.357 -39.534 1.00 24.88 C ATOM 920 CG2 ILE A 101 -3.485 29.912 -39.198 1.00 18.08 C ATOM 921 CD1 ILE A 101 -5.321 32.247 -38.932 1.00 20.69 C ATOM 922 H ILE A 101 -2.790 32.696 -42.159 1.00 0.00 H ATOM 923 N ASN A 102 -0.409 29.476 -41.087 1.00 21.60 N ATOM 924 CA ASN A 102 0.077 28.200 -41.593 1.00 28.84 C ATOM 925 C ASN A 102 -0.453 27.060 -40.741 1.00 25.26 C ATOM 926 O ASN A 102 -0.677 27.234 -39.547 1.00 26.00 O ATOM 927 CB ASN A 102 1.607 28.166 -41.606 1.00 21.68 C ATOM 928 CG ASN A 102 2.211 29.324 -42.370 1.00 47.29 C ATOM 929 OD1 ASN A 102 1.806 29.620 -43.495 1.00 41.45 O ATOM 930 ND2 ASN A 102 3.186 29.991 -41.760 1.00 36.33 N ATOM 931 HD22 ASN A 102 3.496 29.705 -40.809 1.00 0.00 H ATOM 932 HD21 ASN A 102 3.639 30.799 -42.234 1.00 0.00 H ATOM 933 H ASN A 102 0.186 30.018 -40.429 1.00 0.00 H ATOM 934 N VAL A 103 -0.659 25.897 -41.348 1.00 15.34 N ATOM 935 CA VAL A 103 -1.042 24.714 -40.587 1.00 8.66 C ATOM 936 C VAL A 103 -0.092 23.568 -40.913 1.00 9.26 C ATOM 937 O VAL A 103 0.523 23.542 -41.980 1.00 7.14 O ATOM 938 CB VAL A 103 -2.501 24.286 -40.866 1.00 12.79 C ATOM 939 CG1 VAL A 103 -3.461 25.422 -40.533 1.00 7.30 C ATOM 940 CG2 VAL A 103 -2.669 23.858 -42.314 1.00 19.50 C ATOM 941 H VAL A 103 -0.546 25.829 -42.380 1.00 0.00 H ATOM 942 N ASP A 104 0.034 22.629 -39.984 1.00 6.68 N ATOM 943 CA ASP A 104 0.952 21.511 -40.156 1.00 8.33 C ATOM 944 C ASP A 104 0.242 20.288 -40.721 1.00 8.53 C ATOM 945 O ASP A 104 0.800 19.558 -41.541 1.00 5.05 O ATOM 946 CB ASP A 104 1.621 21.165 -38.826 1.00 5.01 C ATOM 947 CG ASP A 104 2.429 22.319 -38.266 1.00 11.03 C ATOM 948 OD1 ASP A 104 3.470 22.663 -38.868 1.00 11.26 O ATOM 949 OD2 ASP A 104 2.023 22.881 -37.227 1.00 6.96 O ATOM 950 H ASP A 104 -0.534 22.692 -39.115 1.00 0.00 H ATOM 951 N TYR A 105 -0.990 20.068 -40.276 1.00 5.50 N ATOM 952 CA TYR A 105 -1.765 18.924 -40.729 1.00 6.57 C ATOM 953 C TYR A 105 -3.189 19.305 -41.090 1.00 9.90 C ATOM 954 O TYR A 105 -3.810 20.139 -40.433 1.00 7.20 O ATOM 955 CB TYR A 105 -1.797 17.832 -39.657 1.00 8.20 C ATOM 956 CG TYR A 105 -0.469 17.158 -39.413 1.00 8.04 C ATOM 957 CD1 TYR A 105 -0.094 16.037 -40.142 1.00 8.92 C ATOM 958 CD2 TYR A 105 0.408 17.636 -38.446 1.00 12.92 C ATOM 959 CE1 TYR A 105 1.118 15.412 -39.919 1.00 8.75 C ATOM 960 CE2 TYR A 105 1.624 17.018 -38.216 1.00 18.32 C ATOM 961 CZ TYR A 105 1.975 15.907 -38.956 1.00 18.95 C ATOM 962 OH TYR A 105 3.186 15.289 -38.731 1.00 26.73 O ATOM 963 HH TYR A 105 3.227 14.977 -37.792 1.00 0.00 H ATOM 964 H TYR A 105 -1.409 20.727 -39.590 1.00 0.00 H ATOM 965 N VAL A 106 -3.692 18.685 -42.150 1.00 9.12 N ATOM 966 CA VAL A 106 -5.113 18.683 -42.444 1.00 6.63 C ATOM 967 C VAL A 106 -5.575 17.234 -42.400 1.00 5.56 C ATOM 968 O VAL A 106 -5.069 16.391 -43.141 1.00 8.14 O ATOM 969 CB VAL A 106 -5.431 19.302 -43.811 1.00 3.38 C ATOM 970 CG1 VAL A 106 -6.923 19.212 -44.091 1.00 3.23 C ATOM 971 CG2 VAL A 106 -4.962 20.748 -43.854 1.00 5.07 C ATOM 972 H VAL A 106 -3.046 18.183 -42.792 1.00 0.00 H ATOM 973 N LEU A 107 -6.519 16.945 -41.514 1.00 6.69 N ATOM 974 CA LEU A 107 -6.958 15.575 -41.286 1.00 5.58 C ATOM 975 C LEU A 107 -8.404 15.375 -41.726 1.00 5.77 C ATOM 976 O LEU A 107 -9.325 15.948 -41.141 1.00 9.06 O ATOM 977 CB LEU A 107 -6.798 15.209 -39.808 1.00 5.01 C ATOM 978 CG LEU A 107 -5.395 15.450 -39.246 1.00 5.35 C ATOM 979 CD1 LEU A 107 -5.358 15.196 -37.748 1.00 6.46 C ATOM 980 CD2 LEU A 107 -4.369 14.586 -39.971 1.00 4.90 C ATOM 981 H LEU A 107 -6.956 17.715 -40.969 1.00 0.00 H ATOM 982 N GLU A 108 -8.591 14.560 -42.759 1.00 4.37 N ATOM 983 CA GLU A 108 -9.917 14.277 -43.302 1.00 8.70 C ATOM 984 C GLU A 108 -10.534 13.036 -42.661 1.00 9.05 C ATOM 985 O GLU A 108 -9.939 11.958 -42.677 1.00 4.40 O ATOM 986 CB GLU A 108 -9.838 14.095 -44.819 1.00 8.85 C ATOM 987 CG GLU A 108 -11.144 13.678 -45.473 1.00 10.57 C ATOM 988 CD GLU A 108 -10.947 13.228 -46.906 1.00 12.31 C ATOM 989 OE1 GLU A 108 -9.873 13.516 -47.473 1.00 8.93 O ATOM 990 OE2 GLU A 108 -11.860 12.582 -47.462 1.00 11.43 O ATOM 991 H GLU A 108 -7.763 14.107 -43.197 1.00 0.00 H ATOM 992 N PHE A 109 -11.730 13.196 -42.100 1.00 3.03 N ATOM 993 CA PHE A 109 -12.439 12.092 -41.458 1.00 6.95 C ATOM 994 C PHE A 109 -13.492 11.521 -42.401 1.00 13.51 C ATOM 995 O PHE A 109 -14.470 12.195 -42.729 1.00 7.53 O ATOM 996 CB PHE A 109 -13.101 12.553 -40.155 1.00 4.20 C ATOM 997 CG PHE A 109 -12.128 12.876 -39.053 1.00 13.39 C ATOM 998 CD1 PHE A 109 -11.179 13.877 -39.209 1.00 6.70 C ATOM 999 CD2 PHE A 109 -12.177 12.189 -37.851 1.00 13.66 C ATOM 1000 CE1 PHE A 109 -10.291 14.176 -38.194 1.00 13.17 C ATOM 1001 CE2 PHE A 109 -11.291 12.485 -36.831 1.00 16.00 C ATOM 1002 CZ PHE A 109 -10.348 13.478 -37.003 1.00 8.78 C ATOM 1003 H PHE A 109 -12.174 14.136 -42.119 1.00 0.00 H ATOM 1004 N ASP A 110 -13.302 10.283 -42.839 1.00 7.59 N ATOM 1005 CA ASP A 110 -14.208 9.715 -43.829 1.00 13.05 C ATOM 1006 C ASP A 110 -15.226 8.746 -43.240 1.00 11.07 C ATOM 1007 O ASP A 110 -14.869 7.783 -42.560 1.00 8.43 O ATOM 1008 CB ASP A 110 -13.428 9.007 -44.933 1.00 10.51 C ATOM 1009 CG ASP A 110 -14.341 8.425 -45.998 1.00 21.18 C ATOM 1010 OD1 ASP A 110 -14.665 9.146 -46.967 1.00 13.92 O ATOM 1011 OD2 ASP A 110 -14.749 7.253 -45.857 1.00 11.67 O ATOM 1012 H ASP A 110 -12.507 9.719 -42.476 1.00 0.00 H ATOM 1013 N VAL A 111 -16.500 9.004 -43.519 1.00 10.55 N ATOM 1014 CA VAL A 111 -17.596 8.139 -43.090 1.00 8.30 C ATOM 1015 C VAL A 111 -18.690 8.149 -44.158 1.00 10.79 C ATOM 1016 O VAL A 111 -19.045 9.215 -44.659 1.00 12.91 O ATOM 1017 CB VAL A 111 -18.182 8.593 -41.728 1.00 11.48 C ATOM 1018 CG1 VAL A 111 -19.574 8.023 -41.514 1.00 11.07 C ATOM 1019 CG2 VAL A 111 -17.258 8.205 -40.578 1.00 8.70 C ATOM 1020 H VAL A 111 -16.726 9.859 -44.066 1.00 0.00 H ATOM 1021 N PRO A 112 -19.216 6.963 -44.527 1.00 13.53 N ATOM 1022 CA PRO A 112 -20.297 6.906 -45.518 1.00 7.46 C ATOM 1023 C PRO A 112 -21.493 7.752 -45.095 1.00 11.77 C ATOM 1024 O PRO A 112 -21.784 7.842 -43.901 1.00 9.47 O ATOM 1025 CB PRO A 112 -20.666 5.419 -45.558 1.00 8.46 C ATOM 1026 CG PRO A 112 -19.435 4.713 -45.106 1.00 7.03 C ATOM 1027 CD PRO A 112 -18.799 5.619 -44.088 1.00 7.15 C ATOM 1028 N ASP A 113 -22.158 8.373 -46.064 1.00 9.18 N ATOM 1029 CA ASP A 113 -23.337 9.190 -45.796 1.00 11.42 C ATOM 1030 C ASP A 113 -24.383 8.436 -44.980 1.00 9.77 C ATOM 1031 O ASP A 113 -25.052 9.016 -44.126 1.00 8.71 O ATOM 1032 CB ASP A 113 -23.960 9.671 -47.111 1.00 10.38 C ATOM 1033 CG ASP A 113 -23.223 10.854 -47.712 1.00 12.51 C ATOM 1034 OD1 ASP A 113 -22.178 11.259 -47.162 1.00 13.27 O ATOM 1035 OD2 ASP A 113 -23.694 11.379 -48.742 1.00 20.41 O ATOM 1036 H ASP A 113 -21.827 8.273 -47.045 1.00 0.00 H ATOM 1037 N GLU A 114 -24.500 7.135 -45.234 1.00 5.84 N ATOM 1038 CA GLU A 114 -25.558 6.319 -44.646 1.00 9.62 C ATOM 1039 C GLU A 114 -25.405 6.078 -43.144 1.00 11.93 C ATOM 1040 O GLU A 114 -26.316 5.549 -42.503 1.00 12.39 O ATOM 1041 CB GLU A 114 -25.637 4.971 -45.369 1.00 9.21 C ATOM 1042 CG GLU A 114 -26.059 5.065 -46.830 1.00 12.17 C ATOM 1043 CD GLU A 114 -24.891 5.300 -47.772 1.00 11.71 C ATOM 1044 OE1 GLU A 114 -23.769 5.550 -47.286 1.00 13.75 O ATOM 1045 OE2 GLU A 114 -25.098 5.232 -49.002 1.00 12.00 O ATOM 1046 H GLU A 114 -23.814 6.684 -45.873 1.00 0.00 H ATOM 1047 N LEU A 115 -24.264 6.460 -42.581 1.00 11.25 N ATOM 1048 CA LEU A 115 -24.021 6.267 -41.151 1.00 7.60 C ATOM 1049 C LEU A 115 -24.325 7.526 -40.353 1.00 6.71 C ATOM 1050 O LEU A 115 -24.483 7.479 -39.133 1.00 8.31 O ATOM 1051 CB LEU A 115 -22.568 5.848 -40.898 1.00 7.63 C ATOM 1052 CG LEU A 115 -22.223 4.357 -40.926 1.00 12.99 C ATOM 1053 CD1 LEU A 115 -22.599 3.731 -42.257 1.00 12.48 C ATOM 1054 CD2 LEU A 115 -20.745 4.153 -40.630 1.00 9.08 C ATOM 1055 H LEU A 115 -23.529 6.905 -43.168 1.00 0.00 H ATOM 1056 N ILE A 116 -24.414 8.650 -41.054 1.00 7.49 N ATOM 1057 CA ILE A 116 -24.412 9.959 -40.414 1.00 10.62 C ATOM 1058 C ILE A 116 -25.670 10.257 -39.590 1.00 10.04 C ATOM 1059 O ILE A 116 -25.571 10.775 -38.477 1.00 9.57 O ATOM 1060 CB ILE A 116 -24.197 11.059 -41.471 1.00 16.77 C ATOM 1061 CG1 ILE A 116 -22.768 10.961 -42.017 1.00 9.19 C ATOM 1062 CG2 ILE A 116 -24.445 12.434 -40.887 1.00 8.42 C ATOM 1063 CD1 ILE A 116 -22.437 11.975 -43.084 1.00 11.82 C ATOM 1064 H ILE A 116 -24.487 8.595 -42.090 1.00 0.00 H ATOM 1065 N VAL A 117 -26.843 9.916 -40.115 1.00 10.52 N ATOM 1066 CA VAL A 117 -28.091 10.181 -39.400 1.00 9.18 C ATOM 1067 C VAL A 117 -28.176 9.432 -38.062 1.00 9.04 C ATOM 1068 O VAL A 117 -28.465 10.037 -37.032 1.00 10.53 O ATOM 1069 CB VAL A 117 -29.321 9.824 -40.262 1.00 13.14 C ATOM 1070 CG1 VAL A 117 -30.557 9.634 -39.391 1.00 16.41 C ATOM 1071 CG2 VAL A 117 -29.568 10.906 -41.302 1.00 10.34 C ATOM 1072 H VAL A 117 -26.873 9.455 -41.047 1.00 0.00 H ATOM 1073 N ASP A 118 -27.912 8.128 -38.073 1.00 8.23 N ATOM 1074 CA ASP A 118 -28.017 7.326 -36.853 1.00 11.60 C ATOM 1075 C ASP A 118 -26.958 7.702 -35.823 1.00 15.38 C ATOM 1076 O ASP A 118 -27.131 7.463 -34.627 1.00 13.93 O ATOM 1077 CB ASP A 118 -27.917 5.832 -37.173 1.00 12.92 C ATOM 1078 CG ASP A 118 -29.200 5.278 -37.767 1.00 30.45 C ATOM 1079 OD1 ASP A 118 -30.234 5.979 -37.717 1.00 18.52 O ATOM 1080 OD2 ASP A 118 -29.176 4.137 -38.276 1.00 27.56 O ATOM 1081 H ASP A 118 -27.626 7.671 -38.963 1.00 0.00 H ATOM 1082 N ARG A 119 -25.862 8.288 -36.289 1.00 11.38 N ATOM 1083 CA ARG A 119 -24.837 8.786 -35.385 1.00 8.90 C ATOM 1084 C ARG A 119 -25.317 10.028 -34.647 1.00 9.08 C ATOM 1085 O ARG A 119 -25.182 10.137 -33.431 1.00 11.25 O ATOM 1086 CB ARG A 119 -23.546 9.101 -36.144 1.00 7.00 C ATOM 1087 CG ARG A 119 -22.659 7.893 -36.375 1.00 10.07 C ATOM 1088 CD ARG A 119 -21.275 8.298 -36.845 1.00 4.50 C ATOM 1089 NE ARG A 119 -20.394 7.140 -36.949 1.00 10.56 N ATOM 1090 CZ ARG A 119 -19.068 7.204 -36.995 1.00 8.87 C ATOM 1091 NH1 ARG A 119 -18.453 8.378 -36.943 1.00 10.69 N ATOM 1092 NH2 ARG A 119 -18.354 6.091 -37.088 1.00 12.74 N ATOM 1093 HE ARG A 119 -20.835 6.199 -36.990 1.00 0.00 H ATOM 1094 HH12 ARG A 119 -17.415 8.423 -36.979 1.00 0.00 H ATOM 1095 HH11 ARG A 119 -19.009 9.253 -36.866 1.00 0.00 H ATOM 1096 HH22 ARG A 119 -17.316 6.141 -37.124 1.00 0.00 H ATOM 1097 HH21 ARG A 119 -18.832 5.168 -37.125 1.00 0.00 H ATOM 1098 H ARG A 119 -25.734 8.393 -37.316 1.00 0.00 H ATOM 1099 N ILE A 120 -25.888 10.968 -35.384 1.00 5.35 N ATOM 1100 CA ILE A 120 -26.191 12.261 -34.798 1.00 9.62 C ATOM 1101 C ILE A 120 -27.483 12.227 -33.966 1.00 8.89 C ATOM 1102 O ILE A 120 -27.607 12.962 -32.986 1.00 13.98 O ATOM 1103 CB ILE A 120 -26.252 13.338 -35.896 1.00 12.57 C ATOM 1104 CG1 ILE A 120 -24.860 13.511 -36.507 1.00 11.27 C ATOM 1105 CG2 ILE A 120 -26.689 14.658 -35.337 1.00 9.74 C ATOM 1106 CD1 ILE A 120 -24.803 14.496 -37.647 1.00 15.44 C ATOM 1107 H ILE A 120 -26.119 10.780 -36.381 1.00 0.00 H ATOM 1108 N VAL A 121 -28.425 11.354 -34.317 1.00 4.37 N ATOM 1109 CA VAL A 121 -29.654 11.247 -33.526 1.00 8.40 C ATOM 1110 C VAL A 121 -29.394 10.641 -32.143 1.00 16.39 C ATOM 1111 O VAL A 121 -30.195 10.818 -31.225 1.00 16.07 O ATOM 1112 CB VAL A 121 -30.740 10.414 -34.245 1.00 19.61 C ATOM 1113 CG1 VAL A 121 -31.129 11.067 -35.567 1.00 9.51 C ATOM 1114 CG2 VAL A 121 -30.271 8.986 -34.460 1.00 23.97 C ATOM 1115 H VAL A 121 -28.289 10.749 -35.152 1.00 0.00 H ATOM 1116 N GLY A 122 -28.272 9.942 -31.992 1.00 13.95 N ATOM 1117 CA GLY A 122 -27.895 9.377 -30.706 1.00 6.17 C ATOM 1118 C GLY A 122 -26.808 10.161 -29.988 1.00 8.69 C ATOM 1119 O GLY A 122 -26.270 9.712 -28.977 1.00 7.88 O ATOM 1120 H GLY A 122 -27.650 9.796 -32.813 1.00 0.00 H ATOM 1121 N ARG A 123 -26.483 11.342 -30.505 1.00 6.45 N ATOM 1122 CA ARG A 123 -25.423 12.157 -29.919 1.00 14.30 C ATOM 1123 C ARG A 123 -25.892 12.917 -28.676 1.00 10.68 C ATOM 1124 O ARG A 123 -26.965 13.517 -28.670 1.00 10.13 O ATOM 1125 CB ARG A 123 -24.872 13.140 -30.959 1.00 11.79 C ATOM 1126 CG ARG A 123 -23.911 14.179 -30.394 1.00 3.85 C ATOM 1127 CD ARG A 123 -23.059 14.812 -31.488 1.00 3.73 C ATOM 1128 NE ARG A 123 -23.849 15.602 -32.431 1.00 8.62 N ATOM 1129 CZ ARG A 123 -23.359 16.161 -33.536 1.00 5.97 C ATOM 1130 NH1 ARG A 123 -22.075 16.019 -33.844 1.00 8.77 N ATOM 1131 NH2 ARG A 123 -24.152 16.861 -34.337 1.00 6.17 N ATOM 1132 HE ARG A 123 -24.860 15.736 -32.225 1.00 0.00 H ATOM 1133 HH12 ARG A 123 -21.696 16.457 -34.708 1.00 0.00 H ATOM 1134 HH11 ARG A 123 -21.449 15.470 -33.221 1.00 0.00 H ATOM 1135 HH22 ARG A 123 -23.767 17.296 -35.199 1.00 0.00 H ATOM 1136 HH21 ARG A 123 -25.159 16.974 -34.103 1.00 0.00 H ATOM 1137 H ARG A 123 -26.993 11.691 -31.341 1.00 0.00 H ATOM 1138 N ARG A 124 -25.080 12.868 -27.624 1.00 9.28 N ATOM 1139 CA ARG A 124 -25.302 13.653 -26.414 1.00 6.41 C ATOM 1140 C ARG A 124 -24.031 14.438 -26.104 1.00 10.71 C ATOM 1141 O ARG A 124 -22.924 13.929 -26.287 1.00 7.66 O ATOM 1142 CB ARG A 124 -25.681 12.756 -25.233 1.00 11.45 C ATOM 1143 CG ARG A 124 -26.829 11.791 -25.508 1.00 9.60 C ATOM 1144 CD ARG A 124 -28.153 12.517 -25.699 1.00 9.72 C ATOM 1145 NE ARG A 124 -29.256 11.584 -25.926 1.00 15.22 N ATOM 1146 CZ ARG A 124 -29.724 11.249 -27.126 1.00 19.92 C ATOM 1147 NH1 ARG A 124 -29.194 11.778 -28.221 1.00 17.05 N ATOM 1148 NH2 ARG A 124 -30.729 10.389 -27.232 1.00 13.72 N ATOM 1149 HE ARG A 124 -29.705 11.153 -25.093 1.00 0.00 H ATOM 1150 HH12 ARG A 124 -29.562 11.514 -29.157 1.00 0.00 H ATOM 1151 HH11 ARG A 124 -28.410 12.457 -28.144 1.00 0.00 H ATOM 1152 HH22 ARG A 124 -31.094 10.128 -28.170 1.00 0.00 H ATOM 1153 HH21 ARG A 124 -31.152 9.976 -26.377 1.00 0.00 H ATOM 1154 H ARG A 124 -24.250 12.243 -27.665 1.00 0.00 H ATOM 1155 N VAL A 125 -24.176 15.677 -25.645 1.00 5.97 N ATOM 1156 CA VAL A 125 -23.003 16.523 -25.448 1.00 9.80 C ATOM 1157 C VAL A 125 -22.908 17.124 -24.047 1.00 11.69 C ATOM 1158 O VAL A 125 -23.913 17.322 -23.363 1.00 6.87 O ATOM 1159 CB VAL A 125 -22.964 17.686 -26.474 1.00 11.69 C ATOM 1160 CG1 VAL A 125 -22.951 17.145 -27.898 1.00 8.74 C ATOM 1161 CG2 VAL A 125 -24.136 18.628 -26.271 1.00 4.02 C ATOM 1162 H VAL A 125 -25.124 16.043 -25.426 1.00 0.00 H ATOM 1163 N HIS A 126 -21.675 17.389 -23.629 1.00 11.69 N ATOM 1164 CA HIS A 126 -21.412 18.191 -22.443 1.00 12.96 C ATOM 1165 C HIS A 126 -20.998 19.581 -22.914 1.00 12.67 C ATOM 1166 O HIS A 126 -19.826 19.822 -23.205 1.00 10.43 O ATOM 1167 CB HIS A 126 -20.325 17.549 -21.576 1.00 9.58 C ATOM 1168 CG HIS A 126 -19.992 18.336 -20.342 1.00 10.33 C ATOM 1169 ND1 HIS A 126 -18.749 18.886 -20.127 1.00 9.57 N ATOM 1170 CD2 HIS A 126 -20.744 18.666 -19.268 1.00 15.08 C ATOM 1171 CE1 HIS A 126 -18.746 19.523 -18.968 1.00 11.85 C ATOM 1172 NE2 HIS A 126 -19.948 19.404 -18.427 1.00 18.52 N ATOM 1173 H HIS A 126 -20.870 17.010 -24.168 1.00 0.00 H ATOM 1174 N ALA A 127 -21.974 20.479 -23.011 1.00 16.88 N ATOM 1175 CA ALA A 127 -21.773 21.805 -23.600 1.00 11.90 C ATOM 1176 C ALA A 127 -20.618 22.633 -23.009 1.00 21.61 C ATOM 1177 O ALA A 127 -19.923 23.318 -23.760 1.00 17.73 O ATOM 1178 CB ALA A 127 -23.074 22.606 -23.519 1.00 19.83 C ATOM 1179 H ALA A 127 -22.918 20.230 -22.654 1.00 0.00 H ATOM 1180 N PRO A 128 -20.414 22.596 -21.674 1.00 14.24 N ATOM 1181 CA PRO A 128 -19.297 23.394 -21.146 1.00 16.01 C ATOM 1182 C PRO A 128 -17.912 22.998 -21.666 1.00 12.51 C ATOM 1183 O PRO A 128 -17.043 23.861 -21.779 1.00 19.25 O ATOM 1184 CB PRO A 128 -19.385 23.150 -19.636 1.00 19.72 C ATOM 1185 CG PRO A 128 -20.820 22.889 -19.394 1.00 18.32 C ATOM 1186 CD PRO A 128 -21.278 22.099 -20.586 1.00 10.71 C ATOM 1187 N SER A 129 -17.710 21.723 -21.981 1.00 20.92 N ATOM 1188 CA SER A 129 -16.402 21.260 -22.440 1.00 16.15 C ATOM 1189 C SER A 129 -16.377 20.974 -23.936 1.00 14.22 C ATOM 1190 O SER A 129 -15.330 21.060 -24.578 1.00 27.39 O ATOM 1191 CB SER A 129 -15.988 20.000 -21.684 1.00 12.95 C ATOM 1192 OG SER A 129 -16.806 18.904 -22.056 1.00 10.23 O ATOM 1193 HG SER A 129 -17.750 19.111 -21.843 1.00 0.00 H ATOM 1194 H SER A 129 -18.494 21.045 -21.900 1.00 0.00 H ATOM 1195 N GLY A 130 -17.530 20.613 -24.483 1.00 21.31 N ATOM 1196 CA GLY A 130 -17.614 20.229 -25.877 1.00 17.64 C ATOM 1197 C GLY A 130 -17.488 18.730 -26.056 1.00 24.66 C ATOM 1198 O GLY A 130 -17.546 18.231 -27.180 1.00 22.05 O ATOM 1199 H GLY A 130 -18.391 20.606 -23.899 1.00 0.00 H ATOM 1200 N ARG A 131 -17.312 18.011 -24.948 1.00 11.32 N ATOM 1201 CA ARG A 131 -17.214 16.554 -24.984 1.00 12.97 C ATOM 1202 C ARG A 131 -18.477 15.933 -25.571 1.00 10.90 C ATOM 1203 O ARG A 131 -19.584 16.425 -25.349 1.00 8.67 O ATOM 1204 CB ARG A 131 -16.945 15.992 -23.586 1.00 12.39 C ATOM 1205 CG ARG A 131 -15.468 15.956 -23.215 1.00 11.84 C ATOM 1206 CD ARG A 131 -15.233 15.256 -21.882 1.00 11.33 C ATOM 1207 NE ARG A 131 -15.840 15.986 -20.773 1.00 15.22 N ATOM 1208 CZ ARG A 131 -15.263 17.007 -20.148 1.00 16.60 C ATOM 1209 NH1 ARG A 131 -14.062 17.424 -20.524 1.00 21.04 N ATOM 1210 NH2 ARG A 131 -15.889 17.615 -19.151 1.00 18.86 N ATOM 1211 HE ARG A 131 -16.783 15.688 -20.452 1.00 0.00 H ATOM 1212 HH12 ARG A 131 -13.612 18.223 -20.034 1.00 0.00 H ATOM 1213 HH11 ARG A 131 -13.570 16.952 -21.309 1.00 0.00 H ATOM 1214 HH22 ARG A 131 -15.436 18.414 -18.663 1.00 0.00 H ATOM 1215 HH21 ARG A 131 -16.833 17.293 -18.857 1.00 0.00 H ATOM 1216 H ARG A 131 -17.243 18.500 -24.033 1.00 0.00 H ATOM 1217 N VAL A 132 -18.295 14.846 -26.316 1.00 9.48 N ATOM 1218 CA VAL A 132 -19.367 14.243 -27.099 1.00 4.74 C ATOM 1219 C VAL A 132 -19.505 12.748 -26.803 1.00 4.93 C ATOM 1220 O VAL A 132 -18.507 12.050 -26.623 1.00 11.88 O ATOM 1221 CB VAL A 132 -19.117 14.454 -28.616 1.00 15.67 C ATOM 1222 CG1 VAL A 132 -20.180 13.765 -29.450 1.00 8.98 C ATOM 1223 CG2 VAL A 132 -19.059 15.939 -28.950 1.00 18.33 C ATOM 1224 H VAL A 132 -17.351 14.409 -26.341 1.00 0.00 H ATOM 1225 N TYR A 133 -20.744 12.263 -26.749 1.00 6.41 N ATOM 1226 CA TYR A 133 -21.015 10.846 -26.515 1.00 5.30 C ATOM 1227 C TYR A 133 -22.054 10.311 -27.500 1.00 11.22 C ATOM 1228 O TYR A 133 -22.672 11.080 -28.238 1.00 7.35 O ATOM 1229 CB TYR A 133 -21.506 10.625 -25.083 1.00 10.14 C ATOM 1230 CG TYR A 133 -20.571 11.144 -24.014 1.00 9.74 C ATOM 1231 CD1 TYR A 133 -20.627 12.469 -23.597 1.00 6.34 C ATOM 1232 CD2 TYR A 133 -19.644 10.305 -23.410 1.00 9.68 C ATOM 1233 CE1 TYR A 133 -19.777 12.945 -22.617 1.00 9.98 C ATOM 1234 CE2 TYR A 133 -18.792 10.770 -22.429 1.00 15.63 C ATOM 1235 CZ TYR A 133 -18.863 12.090 -22.035 1.00 14.65 C ATOM 1236 OH TYR A 133 -18.015 12.554 -21.057 1.00 9.40 O ATOM 1237 HH TYR A 133 -18.195 13.514 -20.894 1.00 0.00 H ATOM 1238 H TYR A 133 -21.545 12.914 -26.878 1.00 0.00 H ATOM 1239 N HIS A 134 -22.244 8.993 -27.511 1.00 4.31 N ATOM 1240 CA HIS A 134 -23.323 8.387 -28.291 1.00 12.17 C ATOM 1241 C HIS A 134 -24.009 7.286 -27.492 1.00 13.34 C ATOM 1242 O HIS A 134 -23.352 6.374 -26.995 1.00 12.26 O ATOM 1243 CB HIS A 134 -22.801 7.823 -29.614 1.00 7.24 C ATOM 1244 CG HIS A 134 -23.887 7.429 -30.567 1.00 5.07 C ATOM 1245 ND1 HIS A 134 -24.585 6.245 -30.454 1.00 8.37 N ATOM 1246 CD2 HIS A 134 -24.399 8.070 -31.644 1.00 5.28 C ATOM 1247 CE1 HIS A 134 -25.482 6.176 -31.427 1.00 9.21 C ATOM 1248 NE2 HIS A 134 -25.389 7.261 -32.159 1.00 9.43 N ATOM 1249 H HIS A 134 -21.613 8.382 -26.954 1.00 0.00 H ATOM 1250 N VAL A 135 -25.334 7.358 -27.390 1.00 10.55 N ATOM 1251 CA VAL A 135 -26.084 6.466 -26.506 1.00 11.03 C ATOM 1252 C VAL A 135 -25.898 4.981 -26.831 1.00 15.86 C ATOM 1253 O VAL A 135 -26.137 4.124 -25.982 1.00 19.10 O ATOM 1254 CB VAL A 135 -27.594 6.795 -26.528 1.00 11.91 C ATOM 1255 CG1 VAL A 135 -27.842 8.190 -25.961 1.00 12.15 C ATOM 1256 CG2 VAL A 135 -28.153 6.680 -27.937 1.00 17.60 C ATOM 1257 H VAL A 135 -25.849 8.066 -27.952 1.00 0.00 H ATOM 1258 N LYS A 136 -25.457 4.679 -28.049 1.00 15.16 N ATOM 1259 CA LYS A 136 -25.235 3.294 -28.456 1.00 12.90 C ATOM 1260 C LYS A 136 -23.772 3.001 -28.787 1.00 15.46 C ATOM 1261 O LYS A 136 -23.228 1.982 -28.363 1.00 23.93 O ATOM 1262 CB LYS A 136 -26.107 2.948 -29.665 1.00 11.34 C ATOM 1263 CG LYS A 136 -27.583 2.787 -29.347 1.00 17.51 C ATOM 1264 CD LYS A 136 -28.430 2.898 -30.605 1.00 29.50 C ATOM 1265 CE LYS A 136 -29.905 2.684 -30.300 1.00 49.12 C ATOM 1266 NZ LYS A 136 -30.414 3.650 -29.286 1.00 45.90 N ATOM 1267 HZ1 LYS A 136 -29.880 3.535 -28.401 1.00 0.00 H ATOM 1268 HZ2 LYS A 136 -30.294 4.620 -29.642 1.00 0.00 H ATOM 1269 HZ3 LYS A 136 -31.422 3.467 -29.110 1.00 0.00 H ATOM 1270 H LYS A 136 -25.266 5.445 -28.726 1.00 0.00 H ATOM 1271 N PHE A 137 -23.138 3.897 -29.540 1.00 9.82 N ATOM 1272 CA PHE A 137 -21.818 3.626 -30.109 1.00 10.87 C ATOM 1273 C PHE A 137 -20.670 4.045 -29.199 1.00 13.05 C ATOM 1274 O PHE A 137 -19.565 3.517 -29.305 1.00 14.45 O ATOM 1275 CB PHE A 137 -21.665 4.331 -31.459 1.00 6.79 C ATOM 1276 CG PHE A 137 -22.767 4.031 -32.430 1.00 11.83 C ATOM 1277 CD1 PHE A 137 -23.467 2.836 -32.367 1.00 11.03 C ATOM 1278 CD2 PHE A 137 -23.105 4.948 -33.410 1.00 10.56 C ATOM 1279 CE1 PHE A 137 -24.484 2.567 -33.258 1.00 12.19 C ATOM 1280 CE2 PHE A 137 -24.120 4.684 -34.305 1.00 11.95 C ATOM 1281 CZ PHE A 137 -24.810 3.491 -34.230 1.00 14.91 C ATOM 1282 H PHE A 137 -23.593 4.813 -29.729 1.00 0.00 H ATOM 1283 N ASN A 138 -20.925 5.008 -28.322 1.00 10.43 N ATOM 1284 CA ASN A 138 -19.888 5.508 -27.430 1.00 10.39 C ATOM 1285 C ASN A 138 -20.492 6.169 -26.196 1.00 18.14 C ATOM 1286 O ASN A 138 -20.334 7.374 -25.987 1.00 12.86 O ATOM 1287 CB ASN A 138 -18.983 6.492 -28.177 1.00 4.45 C ATOM 1288 CG ASN A 138 -17.713 6.814 -27.415 1.00 4.17 C ATOM 1289 OD1 ASN A 138 -17.327 6.095 -26.496 1.00 13.27 O ATOM 1290 ND2 ASN A 138 -17.058 7.905 -27.794 1.00 5.89 N ATOM 1291 HD22 ASN A 138 -17.422 8.484 -28.578 1.00 0.00 H ATOM 1292 HD21 ASN A 138 -16.181 8.180 -27.307 1.00 0.00 H ATOM 1293 H ASN A 138 -21.882 5.412 -28.271 1.00 0.00 H ATOM 1294 N PRO A 139 -21.197 5.378 -25.370 1.00 15.65 N ATOM 1295 CA PRO A 139 -21.925 5.943 -24.230 1.00 13.06 C ATOM 1296 C PRO A 139 -21.008 6.402 -23.104 1.00 10.97 C ATOM 1297 O PRO A 139 -19.862 5.958 -23.021 1.00 16.63 O ATOM 1298 CB PRO A 139 -22.809 4.776 -23.774 1.00 14.43 C ATOM 1299 CG PRO A 139 -22.053 3.564 -24.171 1.00 17.14 C ATOM 1300 CD PRO A 139 -21.343 3.913 -25.448 1.00 9.61 C ATOM 1301 N PRO A 140 -21.507 7.299 -22.242 1.00 12.30 N ATOM 1302 CA PRO A 140 -20.764 7.679 -21.039 1.00 11.19 C ATOM 1303 C PRO A 140 -20.753 6.537 -20.029 1.00 16.94 C ATOM 1304 O PRO A 140 -21.578 5.625 -20.139 1.00 13.14 O ATOM 1305 CB PRO A 140 -21.550 8.877 -20.506 1.00 8.38 C ATOM 1306 CG PRO A 140 -22.946 8.643 -20.983 1.00 10.32 C ATOM 1307 CD PRO A 140 -22.804 7.994 -22.336 1.00 11.86 C ATOM 1308 N LYS A 141 -19.834 6.586 -19.069 1.00 12.46 N ATOM 1309 CA LYS A 141 -19.748 5.561 -18.032 1.00 19.63 C ATOM 1310 C LYS A 141 -21.062 5.444 -17.261 1.00 19.24 C ATOM 1311 O LYS A 141 -21.506 4.343 -16.935 1.00 20.78 O ATOM 1312 CB LYS A 141 -18.595 5.869 -17.075 1.00 18.64 C ATOM 1313 CG LYS A 141 -18.421 4.855 -15.955 1.00 33.39 C ATOM 1314 CD LYS A 141 -17.344 5.302 -14.978 1.00 48.75 C ATOM 1315 CE LYS A 141 -17.003 4.206 -13.981 1.00 47.05 C ATOM 1316 NZ LYS A 141 -15.806 4.554 -13.166 1.00 49.66 N ATOM 1317 HZ1 LYS A 141 -14.988 4.691 -13.794 1.00 0.00 H ATOM 1318 HZ2 LYS A 141 -15.990 5.431 -12.638 1.00 0.00 H ATOM 1319 HZ3 LYS A 141 -15.606 3.782 -12.499 1.00 0.00 H ATOM 1320 H LYS A 141 -19.158 7.376 -19.056 1.00 0.00 H ATOM 1321 N VAL A 142 -21.680 6.587 -16.977 1.00 9.88 N ATOM 1322 CA VAL A 142 -22.994 6.625 -16.341 1.00 12.57 C ATOM 1323 C VAL A 142 -23.975 7.385 -17.231 1.00 18.18 C ATOM 1324 O VAL A 142 -23.680 8.493 -17.683 1.00 13.56 O ATOM 1325 CB VAL A 142 -22.929 7.280 -14.947 1.00 11.43 C ATOM 1326 CG1 VAL A 142 -24.327 7.466 -14.371 1.00 10.11 C ATOM 1327 CG2 VAL A 142 -22.070 6.443 -14.020 1.00 13.67 C ATOM 1328 H VAL A 142 -21.211 7.484 -17.216 1.00 0.00 H ATOM 1329 N GLU A 143 -25.136 6.783 -17.477 1.00 10.21 N ATOM 1330 CA GLU A 143 -26.090 7.289 -18.463 1.00 11.07 C ATOM 1331 C GLU A 143 -26.517 8.738 -18.233 1.00 11.11 C ATOM 1332 O GLU A 143 -27.008 9.093 -17.162 1.00 13.29 O ATOM 1333 CB GLU A 143 -27.335 6.399 -18.497 1.00 12.75 C ATOM 1334 CG GLU A 143 -28.293 6.736 -19.631 1.00 20.19 C ATOM 1335 CD GLU A 143 -29.665 6.116 -19.448 1.00 33.67 C ATOM 1336 OE1 GLU A 143 -30.412 6.578 -18.559 1.00 42.99 O ATOM 1337 OE2 GLU A 143 -30.000 5.173 -20.195 1.00 29.90 O ATOM 1338 H GLU A 143 -25.374 5.920 -16.948 1.00 0.00 H ATOM 1339 N GLY A 144 -26.329 9.566 -19.256 1.00 8.36 N ATOM 1340 CA GLY A 144 -26.743 10.956 -19.209 1.00 9.85 C ATOM 1341 C GLY A 144 -25.818 11.847 -18.404 1.00 5.45 C ATOM 1342 O GLY A 144 -26.147 13.001 -18.137 1.00 14.34 O ATOM 1343 H GLY A 144 -25.871 9.206 -20.117 1.00 0.00 H ATOM 1344 N LYS A 145 -24.658 11.316 -18.028 1.00 9.34 N ATOM 1345 CA LYS A 145 -23.691 12.059 -17.223 1.00 7.84 C ATOM 1346 C LYS A 145 -22.351 12.205 -17.930 1.00 12.44 C ATOM 1347 O LYS A 145 -21.832 11.242 -18.487 1.00 13.18 O ATOM 1348 CB LYS A 145 -23.474 11.367 -15.875 1.00 15.45 C ATOM 1349 CG LYS A 145 -24.746 11.033 -15.122 1.00 9.87 C ATOM 1350 CD LYS A 145 -25.496 12.289 -14.733 1.00 16.19 C ATOM 1351 CE LYS A 145 -26.831 11.954 -14.090 1.00 24.21 C ATOM 1352 NZ LYS A 145 -27.355 13.112 -13.314 1.00 26.82 N ATOM 1353 HZ1 LYS A 145 -26.677 13.362 -12.566 1.00 0.00 H ATOM 1354 HZ2 LYS A 145 -27.485 13.924 -13.951 1.00 0.00 H ATOM 1355 HZ3 LYS A 145 -28.267 12.856 -12.885 1.00 0.00 H ATOM 1356 H LYS A 145 -24.432 10.342 -18.316 1.00 0.00 H ATOM 1357 N ASP A 146 -21.789 13.408 -17.900 1.00 14.60 N ATOM 1358 CA ASP A 146 -20.434 13.631 -18.394 1.00 8.61 C ATOM 1359 C ASP A 146 -19.441 12.854 -17.530 1.00 10.07 C ATOM 1360 O ASP A 146 -19.490 12.940 -16.305 1.00 6.00 O ATOM 1361 CB ASP A 146 -20.105 15.125 -18.387 1.00 7.22 C ATOM 1362 CG ASP A 146 -18.721 15.425 -18.932 1.00 12.14 C ATOM 1363 OD1 ASP A 146 -18.408 14.990 -20.061 1.00 13.52 O ATOM 1364 OD2 ASP A 146 -17.947 16.100 -18.225 1.00 11.61 O ATOM 1365 H ASP A 146 -22.327 14.210 -17.515 1.00 0.00 H ATOM 1366 N ASP A 147 -18.555 12.088 -18.164 1.00 4.16 N ATOM 1367 CA ASP A 147 -17.567 11.284 -17.440 1.00 14.52 C ATOM 1368 C ASP A 147 -16.665 12.119 -16.531 1.00 13.55 C ATOM 1369 O ASP A 147 -16.320 11.695 -15.428 1.00 13.57 O ATOM 1370 CB ASP A 147 -16.686 10.494 -18.418 1.00 11.15 C ATOM 1371 CG ASP A 147 -17.439 9.384 -19.126 1.00 10.24 C ATOM 1372 OD1 ASP A 147 -18.478 8.931 -18.602 1.00 19.08 O ATOM 1373 OD2 ASP A 147 -16.981 8.958 -20.206 1.00 22.96 O ATOM 1374 H ASP A 147 -18.565 12.060 -19.204 1.00 0.00 H ATOM 1375 N VAL A 148 -16.288 13.304 -16.997 1.00 11.03 N ATOM 1376 CA VAL A 148 -15.296 14.121 -16.304 1.00 11.41 C ATOM 1377 C VAL A 148 -15.891 14.969 -15.173 1.00 14.32 C ATOM 1378 O VAL A 148 -15.308 15.067 -14.092 1.00 15.71 O ATOM 1379 CB VAL A 148 -14.562 15.041 -17.302 1.00 11.65 C ATOM 1380 CG1 VAL A 148 -13.574 15.954 -16.583 1.00 13.60 C ATOM 1381 CG2 VAL A 148 -13.852 14.206 -18.360 1.00 15.94 C ATOM 1382 H VAL A 148 -16.710 13.659 -17.878 1.00 0.00 H ATOM 1383 N THR A 149 -17.049 15.576 -15.412 1.00 9.92 N ATOM 1384 CA THR A 149 -17.644 16.469 -14.418 1.00 11.80 C ATOM 1385 C THR A 149 -18.844 15.851 -13.698 1.00 10.52 C ATOM 1386 O THR A 149 -19.207 16.286 -12.608 1.00 15.61 O ATOM 1387 CB THR A 149 -18.100 17.799 -15.053 1.00 10.99 C ATOM 1388 OG1 THR A 149 -19.137 17.544 -16.008 1.00 12.40 O ATOM 1389 CG2 THR A 149 -16.933 18.499 -15.740 1.00 10.12 C ATOM 1390 HG1 THR A 149 -18.793 16.942 -16.715 1.00 0.00 H ATOM 1391 H THR A 149 -17.537 15.414 -16.316 1.00 0.00 H ATOM 1392 N GLY A 150 -19.466 14.851 -14.314 1.00 14.27 N ATOM 1393 CA GLY A 150 -20.648 14.229 -13.741 1.00 11.76 C ATOM 1394 C GLY A 150 -21.911 15.020 -14.027 1.00 14.89 C ATOM 1395 O GLY A 150 -23.002 14.637 -13.604 1.00 12.68 O ATOM 1396 H GLY A 150 -19.100 14.507 -15.224 1.00 0.00 H ATOM 1397 N GLU A 151 -21.760 16.127 -14.750 1.00 10.02 N ATOM 1398 CA GLU A 151 -22.886 16.995 -15.089 1.00 7.27 C ATOM 1399 C GLU A 151 -23.796 16.370 -16.143 1.00 9.87 C ATOM 1400 O GLU A 151 -23.360 15.544 -16.948 1.00 8.33 O ATOM 1401 CB GLU A 151 -22.374 18.353 -15.572 1.00 11.05 C ATOM 1402 CG GLU A 151 -21.822 19.220 -14.452 1.00 9.19 C ATOM 1403 CD GLU A 151 -20.953 20.355 -14.955 1.00 15.23 C ATOM 1404 OE1 GLU A 151 -20.984 20.647 -16.171 1.00 18.53 O ATOM 1405 OE2 GLU A 151 -20.232 20.951 -14.128 1.00 23.14 O ATOM 1406 H GLU A 151 -20.809 16.383 -15.085 1.00 0.00 H ATOM 1407 N GLU A 152 -25.062 16.776 -16.133 1.00 8.09 N ATOM 1408 CA GLU A 152 -26.074 16.195 -17.009 1.00 19.52 C ATOM 1409 C GLU A 152 -25.814 16.517 -18.479 1.00 17.64 C ATOM 1410 O GLU A 152 -25.669 17.680 -18.849 1.00 21.50 O ATOM 1411 CB GLU A 152 -27.467 16.690 -16.605 1.00 17.21 C ATOM 1412 CG GLU A 152 -28.616 16.013 -17.339 1.00 30.50 C ATOM 1413 CD GLU A 152 -28.849 14.587 -16.873 1.00 37.31 C ATOM 1414 OE1 GLU A 152 -28.412 14.249 -15.753 1.00 42.15 O ATOM 1415 OE2 GLU A 152 -29.467 13.803 -17.625 1.00 37.65 O ATOM 1416 H GLU A 152 -25.341 17.534 -15.478 1.00 0.00 H ATOM 1417 N LEU A 153 -25.757 15.481 -19.311 1.00 14.39 N ATOM 1418 CA LEU A 153 -25.582 15.661 -20.751 1.00 11.61 C ATOM 1419 C LEU A 153 -26.854 16.215 -21.379 1.00 8.53 C ATOM 1420 O LEU A 153 -27.941 16.059 -20.826 1.00 9.19 O ATOM 1421 CB LEU A 153 -25.203 14.338 -21.422 1.00 7.16 C ATOM 1422 CG LEU A 153 -23.925 13.661 -20.927 1.00 11.02 C ATOM 1423 CD1 LEU A 153 -23.693 12.351 -21.666 1.00 10.64 C ATOM 1424 CD2 LEU A 153 -22.736 14.595 -21.090 1.00 5.13 C ATOM 1425 H LEU A 153 -25.839 14.518 -18.927 1.00 0.00 H ATOM 1426 N THR A 154 -26.717 16.856 -22.536 1.00 13.22 N ATOM 1427 CA THR A 154 -27.870 17.403 -23.251 1.00 12.74 C ATOM 1428 C THR A 154 -27.924 16.939 -24.709 1.00 8.54 C ATOM 1429 O THR A 154 -26.979 16.338 -25.220 1.00 8.21 O ATOM 1430 CB THR A 154 -27.866 18.943 -23.228 1.00 15.00 C ATOM 1431 OG1 THR A 154 -26.581 19.425 -23.646 1.00 11.02 O ATOM 1432 CG2 THR A 154 -28.168 19.459 -21.824 1.00 15.15 C ATOM 1433 HG1 THR A 154 -25.885 19.084 -23.030 1.00 0.00 H ATOM 1434 H THR A 154 -25.767 16.971 -22.943 1.00 0.00 H ATOM 1435 N THR A 155 -29.043 17.225 -25.368 1.00 10.36 N ATOM 1436 CA THR A 155 -29.203 16.939 -26.790 1.00 10.02 C ATOM 1437 C THR A 155 -29.259 18.244 -27.581 1.00 8.50 C ATOM 1438 O THR A 155 -29.999 19.160 -27.226 1.00 12.41 O ATOM 1439 CB THR A 155 -30.480 16.114 -27.067 1.00 16.36 C ATOM 1440 OG1 THR A 155 -30.442 14.895 -26.314 1.00 8.27 O ATOM 1441 CG2 THR A 155 -30.596 15.781 -28.549 1.00 16.27 C ATOM 1442 HG1 THR A 155 -31.262 14.371 -26.495 1.00 0.00 H ATOM 1443 H THR A 155 -29.831 17.667 -24.853 1.00 0.00 H ATOM 1444 N ARG A 156 -28.468 18.330 -28.646 1.00 10.51 N ATOM 1445 CA ARG A 156 -28.445 19.523 -29.487 1.00 13.03 C ATOM 1446 C ARG A 156 -29.770 19.713 -30.224 1.00 9.42 C ATOM 1447 O ARG A 156 -30.381 18.744 -30.682 1.00 6.77 O ATOM 1448 CB ARG A 156 -27.286 19.447 -30.484 1.00 7.07 C ATOM 1449 CG ARG A 156 -25.939 19.838 -29.892 1.00 9.43 C ATOM 1450 CD ARG A 156 -24.792 19.479 -30.826 1.00 8.82 C ATOM 1451 NE ARG A 156 -25.013 19.974 -32.181 1.00 5.88 N ATOM 1452 CZ ARG A 156 -24.115 19.910 -33.159 1.00 9.21 C ATOM 1453 NH1 ARG A 156 -22.918 19.388 -32.932 1.00 7.41 N ATOM 1454 NH2 ARG A 156 -24.412 20.381 -34.362 1.00 4.65 N ATOM 1455 HE ARG A 156 -25.935 20.406 -32.396 1.00 0.00 H ATOM 1456 HH12 ARG A 156 -22.218 19.339 -33.699 1.00 0.00 H ATOM 1457 HH11 ARG A 156 -22.679 19.027 -31.986 1.00 0.00 H ATOM 1458 HH22 ARG A 156 -23.710 20.331 -35.128 1.00 0.00 H ATOM 1459 HH21 ARG A 156 -25.347 20.800 -34.540 1.00 0.00 H ATOM 1460 H ARG A 156 -27.851 17.528 -28.886 1.00 0.00 H ATOM 1461 N LYS A 157 -30.205 20.967 -30.329 1.00 8.91 N ATOM 1462 CA LYS A 157 -31.470 21.313 -30.977 1.00 12.10 C ATOM 1463 C LYS A 157 -31.486 20.943 -32.456 1.00 8.75 C ATOM 1464 O LYS A 157 -32.539 20.646 -33.017 1.00 12.79 O ATOM 1465 CB LYS A 157 -31.754 22.811 -30.839 1.00 13.71 C ATOM 1466 CG LYS A 157 -31.963 23.306 -29.420 1.00 35.11 C ATOM 1467 CD LYS A 157 -32.347 24.780 -29.433 1.00 39.77 C ATOM 1468 CE LYS A 157 -32.121 25.435 -28.080 1.00 48.95 C ATOM 1469 NZ LYS A 157 -33.068 24.922 -27.050 1.00 51.42 N ATOM 1470 HZ1 LYS A 157 -34.044 25.119 -27.349 1.00 0.00 H ATOM 1471 HZ2 LYS A 157 -32.938 23.896 -26.942 1.00 0.00 H ATOM 1472 HZ3 LYS A 157 -32.880 25.394 -26.142 1.00 0.00 H ATOM 1473 H LYS A 157 -29.621 21.732 -29.934 1.00 0.00 H ATOM 1474 N ASP A 158 -30.314 20.975 -33.083 1.00 9.80 N ATOM 1475 CA ASP A 158 -30.209 20.758 -34.522 1.00 6.00 C ATOM 1476 C ASP A 158 -29.818 19.324 -34.885 1.00 13.36 C ATOM 1477 O ASP A 158 -29.379 19.068 -36.006 1.00 8.37 O ATOM 1478 CB ASP A 158 -29.195 21.738 -35.125 1.00 10.23 C ATOM 1479 CG ASP A 158 -27.778 21.510 -34.613 1.00 13.65 C ATOM 1480 OD1 ASP A 158 -27.620 20.951 -33.506 1.00 13.05 O ATOM 1481 OD2 ASP A 158 -26.819 21.896 -35.317 1.00 9.22 O ATOM 1482 H ASP A 158 -29.450 21.159 -32.534 1.00 0.00 H ATOM 1483 N ASP A 159 -29.981 18.391 -33.949 1.00 4.50 N ATOM 1484 CA ASP A 159 -29.547 17.014 -34.181 1.00 6.87 C ATOM 1485 C ASP A 159 -30.674 16.044 -34.561 1.00 15.17 C ATOM 1486 O ASP A 159 -30.522 14.831 -34.412 1.00 19.01 O ATOM 1487 CB ASP A 159 -28.807 16.474 -32.949 1.00 6.64 C ATOM 1488 CG ASP A 159 -27.327 16.844 -32.941 1.00 12.37 C ATOM 1489 OD1 ASP A 159 -26.866 17.492 -33.905 1.00 7.92 O ATOM 1490 OD2 ASP A 159 -26.617 16.465 -31.986 1.00 11.84 O ATOM 1491 H ASP A 159 -30.422 18.645 -33.042 1.00 0.00 H ATOM 1492 N GLN A 160 -31.795 16.559 -35.058 1.00 8.87 N ATOM 1493 CA GLN A 160 -32.826 15.678 -35.606 1.00 9.29 C ATOM 1494 C GLN A 160 -32.484 15.312 -37.051 1.00 13.43 C ATOM 1495 O GLN A 160 -31.727 16.024 -37.718 1.00 7.80 O ATOM 1496 CB GLN A 160 -34.215 16.320 -35.529 1.00 9.55 C ATOM 1497 CG GLN A 160 -34.745 16.478 -34.105 1.00 8.62 C ATOM 1498 CD GLN A 160 -36.260 16.600 -34.043 1.00 15.71 C ATOM 1499 OE1 GLN A 160 -36.980 16.015 -34.855 1.00 8.84 O ATOM 1500 NE2 GLN A 160 -36.751 17.364 -33.073 1.00 14.28 N ATOM 1501 HE22 GLN A 160 -36.107 17.840 -32.409 1.00 0.00 H ATOM 1502 HE21 GLN A 160 -37.779 17.486 -32.978 1.00 0.00 H ATOM 1503 H GLN A 160 -31.939 17.589 -35.057 1.00 0.00 H ATOM 1504 N GLU A 161 -33.054 14.203 -37.518 1.00 5.82 N ATOM 1505 CA GLU A 161 -32.719 13.610 -38.812 1.00 12.88 C ATOM 1506 C GLU A 161 -32.840 14.575 -39.991 1.00 9.03 C ATOM 1507 O GLU A 161 -31.964 14.623 -40.853 1.00 9.52 O ATOM 1508 CB GLU A 161 -33.607 12.386 -39.061 1.00 7.97 C ATOM 1509 CG GLU A 161 -33.477 11.790 -40.453 1.00 16.65 C ATOM 1510 CD GLU A 161 -34.225 10.475 -40.600 1.00 14.50 C ATOM 1511 OE1 GLU A 161 -34.893 10.055 -39.633 1.00 24.55 O ATOM 1512 OE2 GLU A 161 -34.142 9.864 -41.684 1.00 19.19 O ATOM 1513 H GLU A 161 -33.774 13.734 -36.932 1.00 0.00 H ATOM 1514 N GLU A 162 -33.927 15.338 -40.024 1.00 13.88 N ATOM 1515 CA GLU A 162 -34.177 16.258 -41.126 1.00 9.88 C ATOM 1516 C GLU A 162 -33.124 17.363 -41.184 1.00 10.22 C ATOM 1517 O GLU A 162 -32.695 17.761 -42.267 1.00 10.54 O ATOM 1518 CB GLU A 162 -35.581 16.862 -41.009 1.00 11.66 C ATOM 1519 CG GLU A 162 -35.902 17.941 -42.035 1.00 22.91 C ATOM 1520 CD GLU A 162 -36.035 17.412 -43.459 1.00 38.09 C ATOM 1521 OE1 GLU A 162 -35.983 16.180 -43.664 1.00 33.56 O ATOM 1522 OE2 GLU A 162 -36.193 18.241 -44.382 1.00 31.73 O ATOM 1523 H GLU A 162 -34.615 15.277 -39.246 1.00 0.00 H ATOM 1524 N THR A 163 -32.700 17.846 -40.021 1.00 9.08 N ATOM 1525 CA THR A 163 -31.679 18.890 -39.962 1.00 8.87 C ATOM 1526 C THR A 163 -30.316 18.332 -40.383 1.00 10.90 C ATOM 1527 O THR A 163 -29.543 19.003 -41.069 1.00 9.21 O ATOM 1528 CB THR A 163 -31.578 19.506 -38.549 1.00 5.22 C ATOM 1529 OG1 THR A 163 -32.891 19.815 -38.065 1.00 7.68 O ATOM 1530 CG2 THR A 163 -30.746 20.779 -38.576 1.00 3.85 C ATOM 1531 HG1 THR A 163 -33.323 20.462 -38.677 1.00 0.00 H ATOM 1532 H THR A 163 -33.102 17.474 -39.137 1.00 0.00 H ATOM 1533 N VAL A 164 -30.037 17.096 -39.976 1.00 8.55 N ATOM 1534 CA VAL A 164 -28.802 16.410 -40.353 1.00 9.31 C ATOM 1535 C VAL A 164 -28.670 16.257 -41.869 1.00 6.56 C ATOM 1536 O VAL A 164 -27.606 16.500 -42.437 1.00 11.33 O ATOM 1537 CB VAL A 164 -28.720 15.013 -39.706 1.00 13.17 C ATOM 1538 CG1 VAL A 164 -27.485 14.272 -40.188 1.00 13.77 C ATOM 1539 CG2 VAL A 164 -28.707 15.135 -38.194 1.00 18.66 C ATOM 1540 H VAL A 164 -30.721 16.601 -39.369 1.00 0.00 H ATOM 1541 N ARG A 165 -29.756 15.856 -42.517 1.00 6.08 N ATOM 1542 CA ARG A 165 -29.756 15.676 -43.962 1.00 11.59 C ATOM 1543 C ARG A 165 -29.474 16.991 -44.689 1.00 6.94 C ATOM 1544 O ARG A 165 -28.854 16.998 -45.751 1.00 8.64 O ATOM 1545 CB ARG A 165 -31.087 15.079 -44.423 1.00 16.48 C ATOM 1546 CG ARG A 165 -31.302 13.650 -43.936 1.00 8.77 C ATOM 1547 CD ARG A 165 -32.527 12.999 -44.561 1.00 33.00 C ATOM 1548 NE ARG A 165 -32.818 11.708 -43.943 1.00 40.39 N ATOM 1549 CZ ARG A 165 -32.184 10.575 -44.235 1.00 47.70 C ATOM 1550 NH1 ARG A 165 -31.218 10.566 -45.144 1.00 42.81 N ATOM 1551 NH2 ARG A 165 -32.516 9.449 -43.617 1.00 32.64 N ATOM 1552 HE ARG A 165 -33.571 11.672 -43.227 1.00 0.00 H ATOM 1553 HH12 ARG A 165 -30.725 9.679 -45.370 1.00 0.00 H ATOM 1554 HH11 ARG A 165 -30.954 11.446 -45.631 1.00 0.00 H ATOM 1555 HH22 ARG A 165 -32.020 8.564 -43.846 1.00 0.00 H ATOM 1556 HH21 ARG A 165 -33.273 9.451 -42.903 1.00 0.00 H ATOM 1557 H ARG A 165 -30.627 15.666 -41.981 1.00 0.00 H ATOM 1558 N LYS A 166 -29.917 18.104 -44.112 1.00 7.58 N ATOM 1559 CA LYS A 166 -29.645 19.410 -44.704 1.00 10.79 C ATOM 1560 C LYS A 166 -28.191 19.840 -44.513 1.00 6.83 C ATOM 1561 O LYS A 166 -27.601 20.440 -45.411 1.00 11.78 O ATOM 1562 CB LYS A 166 -30.592 20.468 -44.132 1.00 10.81 C ATOM 1563 CG LYS A 166 -32.007 20.355 -44.680 1.00 15.99 C ATOM 1564 CD LYS A 166 -32.894 21.496 -44.223 1.00 27.15 C ATOM 1565 CE LYS A 166 -33.630 21.149 -42.940 1.00 35.76 C ATOM 1566 NZ LYS A 166 -34.730 22.116 -42.663 1.00 34.71 N ATOM 1567 HZ1 LYS A 166 -34.333 23.073 -42.567 1.00 0.00 H ATOM 1568 HZ2 LYS A 166 -35.411 22.099 -43.449 1.00 0.00 H ATOM 1569 HZ3 LYS A 166 -35.211 21.849 -41.780 1.00 0.00 H ATOM 1570 H LYS A 166 -30.463 18.043 -43.229 1.00 0.00 H ATOM 1571 N ARG A 167 -27.612 19.535 -43.354 1.00 5.35 N ATOM 1572 CA ARG A 167 -26.200 19.827 -43.121 1.00 5.64 C ATOM 1573 C ARG A 167 -25.326 19.010 -44.068 1.00 3.64 C ATOM 1574 O ARG A 167 -24.276 19.468 -44.515 1.00 6.92 O ATOM 1575 CB ARG A 167 -25.807 19.537 -41.670 1.00 5.40 C ATOM 1576 CG ARG A 167 -26.452 20.455 -40.655 1.00 7.77 C ATOM 1577 CD ARG A 167 -25.553 20.671 -39.440 1.00 12.56 C ATOM 1578 NE ARG A 167 -25.455 19.500 -38.567 1.00 11.33 N ATOM 1579 CZ ARG A 167 -26.417 19.099 -37.739 1.00 15.92 C ATOM 1580 NH1 ARG A 167 -27.566 19.758 -37.684 1.00 9.30 N ATOM 1581 NH2 ARG A 167 -26.237 18.031 -36.970 1.00 7.47 N ATOM 1582 HE ARG A 167 -24.576 18.945 -38.596 1.00 0.00 H ATOM 1583 HH12 ARG A 167 -28.316 19.443 -37.036 1.00 0.00 H ATOM 1584 HH11 ARG A 167 -27.717 20.590 -38.289 1.00 0.00 H ATOM 1585 HH22 ARG A 167 -26.992 17.722 -36.325 1.00 0.00 H ATOM 1586 HH21 ARG A 167 -25.341 17.504 -37.013 1.00 0.00 H ATOM 1587 H ARG A 167 -28.173 19.083 -42.604 1.00 0.00 H ATOM 1588 N LEU A 168 -25.772 17.796 -44.367 1.00 3.69 N ATOM 1589 CA LEU A 168 -25.038 16.903 -45.252 1.00 6.47 C ATOM 1590 C LEU A 168 -24.999 17.461 -46.673 1.00 12.18 C ATOM 1591 O LEU A 168 -23.967 17.404 -47.344 1.00 8.33 O ATOM 1592 CB LEU A 168 -25.664 15.509 -45.230 1.00 6.07 C ATOM 1593 CG LEU A 168 -24.883 14.383 -45.904 1.00 14.86 C ATOM 1594 CD1 LEU A 168 -23.410 14.467 -45.541 1.00 14.17 C ATOM 1595 CD2 LEU A 168 -25.459 13.036 -45.497 1.00 17.47 C ATOM 1596 H LEU A 168 -26.672 17.473 -43.957 1.00 0.00 H ATOM 1597 N VAL A 169 -26.124 18.006 -47.125 1.00 12.30 N ATOM 1598 CA VAL A 169 -26.187 18.662 -48.425 1.00 14.93 C ATOM 1599 C VAL A 169 -25.260 19.875 -48.449 1.00 10.06 C ATOM 1600 O VAL A 169 -24.502 20.069 -49.402 1.00 8.06 O ATOM 1601 CB VAL A 169 -27.623 19.103 -48.770 1.00 11.66 C ATOM 1602 CG1 VAL A 169 -27.635 19.923 -50.049 1.00 15.80 C ATOM 1603 CG2 VAL A 169 -28.535 17.891 -48.897 1.00 12.00 C ATOM 1604 H VAL A 169 -26.980 17.963 -46.536 1.00 0.00 H ATOM 1605 N GLU A 170 -25.319 20.677 -47.388 1.00 12.12 N ATOM 1606 CA GLU A 170 -24.447 21.838 -47.233 1.00 12.76 C ATOM 1607 C GLU A 170 -22.970 21.452 -47.290 1.00 10.51 C ATOM 1608 O GLU A 170 -22.159 22.168 -47.880 1.00 11.71 O ATOM 1609 CB GLU A 170 -24.738 22.563 -45.913 1.00 10.66 C ATOM 1610 CG GLU A 170 -25.938 23.507 -45.940 1.00 22.88 C ATOM 1611 CD GLU A 170 -25.673 24.785 -46.723 1.00 32.36 C ATOM 1612 OE1 GLU A 170 -25.710 24.743 -47.970 1.00 23.87 O ATOM 1613 OE2 GLU A 170 -25.430 25.835 -46.089 1.00 25.25 O ATOM 1614 H GLU A 170 -26.012 20.469 -46.641 1.00 0.00 H ATOM 1615 N TRP A 171 -22.622 20.319 -46.690 1.00 7.41 N ATOM 1616 CA TRP A 171 -21.227 19.893 -46.661 1.00 8.11 C ATOM 1617 C TRP A 171 -20.733 19.482 -48.047 1.00 7.97 C ATOM 1618 O TRP A 171 -19.621 19.834 -48.440 1.00 7.44 O ATOM 1619 CB TRP A 171 -21.024 18.742 -45.675 1.00 6.32 C ATOM 1620 CG TRP A 171 -19.577 18.512 -45.351 1.00 9.76 C ATOM 1621 CD1 TRP A 171 -18.870 19.069 -44.327 1.00 4.98 C ATOM 1622 CD2 TRP A 171 -18.655 17.675 -46.067 1.00 7.40 C ATOM 1623 NE1 TRP A 171 -17.570 18.628 -44.354 1.00 5.67 N ATOM 1624 CE2 TRP A 171 -17.412 17.775 -45.409 1.00 8.25 C ATOM 1625 CE3 TRP A 171 -18.764 16.852 -47.190 1.00 7.47 C ATOM 1626 CZ2 TRP A 171 -16.284 17.079 -45.845 1.00 6.72 C ATOM 1627 CZ3 TRP A 171 -17.641 16.164 -47.619 1.00 7.70 C ATOM 1628 CH2 TRP A 171 -16.418 16.283 -46.948 1.00 9.38 C ATOM 1629 HE1 TRP A 171 -16.826 18.900 -43.680 1.00 0.00 H ATOM 1630 H TRP A 171 -23.350 19.731 -46.237 1.00 0.00 H ATOM 1631 N HIS A 172 -21.554 18.739 -48.785 1.00 5.43 N ATOM 1632 CA HIS A 172 -21.161 18.291 -50.119 1.00 11.74 C ATOM 1633 C HIS A 172 -21.025 19.463 -51.088 1.00 12.02 C ATOM 1634 O HIS A 172 -20.194 19.432 -51.995 1.00 14.77 O ATOM 1635 CB HIS A 172 -22.165 17.270 -50.667 1.00 12.02 C ATOM 1636 CG HIS A 172 -22.067 15.921 -50.023 1.00 18.81 C ATOM 1637 ND1 HIS A 172 -20.920 15.158 -50.062 1.00 23.68 N ATOM 1638 CD2 HIS A 172 -22.974 15.199 -49.322 1.00 21.51 C ATOM 1639 CE1 HIS A 172 -21.124 14.026 -49.413 1.00 19.19 C ATOM 1640 NE2 HIS A 172 -22.361 14.026 -48.954 1.00 22.81 N ATOM 1641 H HIS A 172 -22.486 18.474 -48.408 1.00 0.00 H ATOM 1642 N GLN A 173 -21.831 20.499 -50.881 1.00 13.50 N ATOM 1643 CA GLN A 173 -21.856 21.643 -51.787 1.00 10.87 C ATOM 1644 C GLN A 173 -20.808 22.707 -51.468 1.00 13.85 C ATOM 1645 O GLN A 173 -20.233 23.303 -52.378 1.00 13.01 O ATOM 1646 CB GLN A 173 -23.245 22.293 -51.777 1.00 7.89 C ATOM 1647 CG GLN A 173 -24.194 21.776 -52.850 1.00 37.17 C ATOM 1648 CD GLN A 173 -25.643 22.169 -52.597 1.00 39.97 C ATOM 1649 OE1 GLN A 173 -25.924 23.165 -51.930 1.00 33.73 O ATOM 1650 NE2 GLN A 173 -26.569 21.381 -53.131 1.00 28.55 N ATOM 1651 HE22 GLN A 173 -26.286 20.549 -53.688 1.00 0.00 H ATOM 1652 HE21 GLN A 173 -27.577 21.596 -52.993 1.00 0.00 H ATOM 1653 H GLN A 173 -22.460 20.495 -50.053 1.00 0.00 H ATOM 1654 N MET A 174 -20.550 22.936 -50.182 1.00 10.65 N ATOM 1655 CA MET A 174 -19.706 24.060 -49.789 1.00 9.38 C ATOM 1656 C MET A 174 -18.381 23.662 -49.146 1.00 10.76 C ATOM 1657 O MET A 174 -17.387 24.374 -49.291 1.00 11.20 O ATOM 1658 CB MET A 174 -20.474 24.978 -48.837 1.00 13.07 C ATOM 1659 CG MET A 174 -21.767 25.515 -49.425 1.00 16.80 C ATOM 1660 SD MET A 174 -22.298 27.052 -48.654 1.00 15.90 S ATOM 1661 CE MET A 174 -23.651 27.509 -49.737 1.00 14.86 C ATOM 1662 H MET A 174 -20.952 22.311 -49.454 1.00 0.00 H ATOM 1663 N THR A 175 -18.355 22.533 -48.448 1.00 4.45 N ATOM 1664 CA THR A 175 -17.165 22.159 -47.688 1.00 6.96 C ATOM 1665 C THR A 175 -16.285 21.127 -48.390 1.00 8.00 C ATOM 1666 O THR A 175 -15.058 21.220 -48.339 1.00 11.51 O ATOM 1667 CB THR A 175 -17.556 21.624 -46.298 1.00 8.80 C ATOM 1668 OG1 THR A 175 -18.477 22.534 -45.682 1.00 7.39 O ATOM 1669 CG2 THR A 175 -16.327 21.481 -45.412 1.00 4.64 C ATOM 1670 HG1 THR A 175 -18.049 23.422 -45.588 1.00 0.00 H ATOM 1671 H THR A 175 -19.188 21.910 -48.442 1.00 0.00 H ATOM 1672 N ALA A 176 -16.913 20.158 -49.052 1.00 11.37 N ATOM 1673 CA ALA A 176 -16.192 19.130 -49.807 1.00 9.29 C ATOM 1674 C ALA A 176 -15.050 19.661 -50.696 1.00 6.91 C ATOM 1675 O ALA A 176 -14.008 19.006 -50.800 1.00 3.24 O ATOM 1676 CB ALA A 176 -17.178 18.318 -50.655 1.00 11.59 C ATOM 1677 H ALA A 176 -17.952 20.130 -49.033 1.00 0.00 H ATOM 1678 N PRO A 177 -15.227 20.838 -51.338 1.00 6.62 N ATOM 1679 CA PRO A 177 -14.094 21.365 -52.115 1.00 5.69 C ATOM 1680 C PRO A 177 -12.814 21.642 -51.314 1.00 9.87 C ATOM 1681 O PRO A 177 -11.764 21.837 -51.926 1.00 9.47 O ATOM 1682 CB PRO A 177 -14.649 22.675 -52.687 1.00 5.14 C ATOM 1683 CG PRO A 177 -16.104 22.424 -52.823 1.00 6.94 C ATOM 1684 CD PRO A 177 -16.472 21.579 -51.638 1.00 5.84 C ATOM 1685 N LEU A 178 -12.888 21.657 -49.986 1.00 7.57 N ATOM 1686 CA LEU A 178 -11.695 21.881 -49.173 1.00 3.87 C ATOM 1687 C LEU A 178 -10.750 20.682 -49.198 1.00 7.06 C ATOM 1688 O LEU A 178 -9.577 20.804 -48.844 1.00 5.24 O ATOM 1689 CB LEU A 178 -12.078 22.214 -47.730 1.00 2.92 C ATOM 1690 CG LEU A 178 -12.663 23.617 -47.543 1.00 7.43 C ATOM 1691 CD1 LEU A 178 -12.920 23.913 -46.075 1.00 7.78 C ATOM 1692 CD2 LEU A 178 -11.738 24.662 -48.147 1.00 6.64 C ATOM 1693 H LEU A 178 -13.806 21.507 -49.521 1.00 0.00 H ATOM 1694 N ILE A 179 -11.256 19.525 -49.615 1.00 5.46 N ATOM 1695 CA ILE A 179 -10.400 18.359 -49.795 1.00 4.36 C ATOM 1696 C ILE A 179 -9.346 18.667 -50.858 1.00 8.73 C ATOM 1697 O ILE A 179 -8.146 18.523 -50.618 1.00 6.14 O ATOM 1698 CB ILE A 179 -11.208 17.111 -50.194 1.00 6.15 C ATOM 1699 CG1 ILE A 179 -12.134 16.692 -49.048 1.00 7.05 C ATOM 1700 CG2 ILE A 179 -10.275 15.972 -50.577 1.00 8.08 C ATOM 1701 CD1 ILE A 179 -13.125 15.605 -49.419 1.00 6.35 C ATOM 1702 H ILE A 179 -12.274 19.451 -49.815 1.00 0.00 H ATOM 1703 N GLY A 180 -9.802 19.112 -52.024 1.00 5.78 N ATOM 1704 CA GLY A 180 -8.904 19.521 -53.089 1.00 6.23 C ATOM 1705 C GLY A 180 -8.068 20.727 -52.719 1.00 6.05 C ATOM 1706 O GLY A 180 -6.891 20.806 -53.068 1.00 4.83 O ATOM 1707 H GLY A 180 -10.829 19.169 -52.178 1.00 0.00 H ATOM 1708 N TYR A 181 -8.683 21.668 -52.008 1.00 5.46 N ATOM 1709 CA TYR A 181 -8.000 22.882 -51.578 1.00 6.35 C ATOM 1710 C TYR A 181 -6.726 22.536 -50.822 1.00 8.54 C ATOM 1711 O TYR A 181 -5.641 23.001 -51.168 1.00 9.49 O ATOM 1712 CB TYR A 181 -8.924 23.735 -50.703 1.00 4.16 C ATOM 1713 CG TYR A 181 -8.379 25.096 -50.322 1.00 5.88 C ATOM 1714 CD1 TYR A 181 -7.493 25.244 -49.261 1.00 8.75 C ATOM 1715 CD2 TYR A 181 -8.773 26.239 -51.009 1.00 6.30 C ATOM 1716 CE1 TYR A 181 -7.002 26.488 -48.906 1.00 7.20 C ATOM 1717 CE2 TYR A 181 -8.287 27.488 -50.659 1.00 7.74 C ATOM 1718 CZ TYR A 181 -7.403 27.606 -49.607 1.00 11.98 C ATOM 1719 OH TYR A 181 -6.919 28.844 -49.253 1.00 10.55 O ATOM 1720 HH TYR A 181 -7.674 29.432 -49.000 1.00 0.00 H ATOM 1721 H TYR A 181 -9.682 21.534 -51.751 1.00 0.00 H ATOM 1722 N TYR A 182 -6.854 21.697 -49.802 1.00 5.89 N ATOM 1723 CA TYR A 182 -5.715 21.414 -48.947 1.00 4.30 C ATOM 1724 C TYR A 182 -4.849 20.276 -49.480 1.00 9.36 C ATOM 1725 O TYR A 182 -3.667 20.193 -49.145 1.00 5.92 O ATOM 1726 CB TYR A 182 -6.191 21.135 -47.521 1.00 3.39 C ATOM 1727 CG TYR A 182 -6.547 22.422 -46.804 1.00 6.92 C ATOM 1728 CD1 TYR A 182 -5.560 23.349 -46.483 1.00 2.66 C ATOM 1729 CD2 TYR A 182 -7.865 22.729 -46.482 1.00 2.20 C ATOM 1730 CE1 TYR A 182 -5.872 24.538 -45.842 1.00 5.15 C ATOM 1731 CE2 TYR A 182 -8.187 23.920 -45.838 1.00 7.72 C ATOM 1732 CZ TYR A 182 -7.183 24.819 -45.522 1.00 3.32 C ATOM 1733 OH TYR A 182 -7.486 26.002 -44.885 1.00 7.34 O ATOM 1734 HH TYR A 182 -6.654 26.519 -44.738 1.00 0.00 H ATOM 1735 H TYR A 182 -7.770 21.242 -49.615 1.00 0.00 H ATOM 1736 N SER A 183 -5.416 19.419 -50.326 1.00 8.24 N ATOM 1737 CA SER A 183 -4.608 18.407 -50.999 1.00 5.47 C ATOM 1738 C SER A 183 -3.593 19.114 -51.885 1.00 10.52 C ATOM 1739 O SER A 183 -2.430 18.724 -51.955 1.00 5.59 O ATOM 1740 CB SER A 183 -5.473 17.453 -51.825 1.00 7.63 C ATOM 1741 OG SER A 183 -6.237 16.604 -50.985 1.00 10.23 O ATOM 1742 HG SER A 183 -6.828 17.154 -50.412 1.00 0.00 H ATOM 1743 H SER A 183 -6.439 19.471 -50.508 1.00 0.00 H ATOM 1744 N LYS A 184 -4.047 20.176 -52.540 1.00 6.94 N ATOM 1745 CA LYS A 184 -3.187 20.992 -53.381 1.00 8.08 C ATOM 1746 C LYS A 184 -2.153 21.745 -52.546 1.00 11.86 C ATOM 1747 O LYS A 184 -0.993 21.866 -52.940 1.00 8.24 O ATOM 1748 CB LYS A 184 -4.024 21.973 -54.199 1.00 9.35 C ATOM 1749 CG LYS A 184 -3.209 22.881 -55.088 1.00 14.30 C ATOM 1750 CD LYS A 184 -4.101 23.673 -56.018 1.00 10.88 C ATOM 1751 CE LYS A 184 -3.294 24.701 -56.783 1.00 28.76 C ATOM 1752 NZ LYS A 184 -4.030 25.175 -57.977 1.00 25.59 N ATOM 1753 HZ1 LYS A 184 -4.225 24.369 -58.605 1.00 0.00 H ATOM 1754 HZ2 LYS A 184 -4.927 25.609 -57.680 1.00 0.00 H ATOM 1755 HZ3 LYS A 184 -3.453 25.878 -58.482 1.00 0.00 H ATOM 1756 H LYS A 184 -5.051 20.432 -52.448 1.00 0.00 H ATOM 1757 N GLU A 185 -2.579 22.253 -51.393 1.00 8.88 N ATOM 1758 CA GLU A 185 -1.657 22.885 -50.454 1.00 8.14 C ATOM 1759 C GLU A 185 -0.586 21.901 -49.988 1.00 9.04 C ATOM 1760 O GLU A 185 0.580 22.266 -49.829 1.00 10.22 O ATOM 1761 CB GLU A 185 -2.415 23.439 -49.248 1.00 10.05 C ATOM 1762 CG GLU A 185 -3.103 24.762 -49.507 1.00 10.98 C ATOM 1763 CD GLU A 185 -2.121 25.911 -49.583 1.00 13.28 C ATOM 1764 OE1 GLU A 185 -1.699 26.404 -48.516 1.00 28.45 O ATOM 1765 OE2 GLU A 185 -1.770 26.317 -50.708 1.00 24.91 O ATOM 1766 H GLU A 185 -3.590 22.199 -51.155 1.00 0.00 H ATOM 1767 N ALA A 186 -0.991 20.652 -49.776 1.00 6.91 N ATOM 1768 CA ALA A 186 -0.075 19.606 -49.330 1.00 15.04 C ATOM 1769 C ALA A 186 0.982 19.308 -50.386 1.00 10.40 C ATOM 1770 O ALA A 186 2.154 19.104 -50.069 1.00 10.95 O ATOM 1771 CB ALA A 186 -0.844 18.339 -48.982 1.00 10.62 C ATOM 1772 H ALA A 186 -1.991 20.413 -49.933 1.00 0.00 H ATOM 1773 N GLU A 187 0.557 19.285 -51.644 1.00 11.83 N ATOM 1774 CA GLU A 187 1.465 19.012 -52.750 1.00 12.58 C ATOM 1775 C GLU A 187 2.469 20.148 -52.941 1.00 8.55 C ATOM 1776 O GLU A 187 3.568 19.931 -53.447 1.00 8.79 O ATOM 1777 CB GLU A 187 0.669 18.766 -54.035 1.00 9.52 C ATOM 1778 CG GLU A 187 0.027 17.384 -54.077 1.00 12.91 C ATOM 1779 CD GLU A 187 -1.137 17.290 -55.047 1.00 17.83 C ATOM 1780 OE1 GLU A 187 -1.475 18.308 -55.687 1.00 17.18 O ATOM 1781 OE2 GLU A 187 -1.718 16.192 -55.163 1.00 19.83 O ATOM 1782 H GLU A 187 -0.447 19.466 -51.844 1.00 0.00 H ATOM 1783 N ALA A 188 2.096 21.354 -52.520 1.00 8.81 N ATOM 1784 CA ALA A 188 2.999 22.501 -52.597 1.00 13.09 C ATOM 1785 C ALA A 188 3.941 22.563 -51.394 1.00 16.26 C ATOM 1786 O ALA A 188 4.802 23.439 -51.314 1.00 18.67 O ATOM 1787 CB ALA A 188 2.206 23.793 -52.709 1.00 11.53 C ATOM 1788 H ALA A 188 1.142 21.483 -52.128 1.00 0.00 H ATOM 1789 N GLY A 189 3.770 21.635 -50.457 1.00 15.45 N ATOM 1790 CA GLY A 189 4.630 21.557 -49.288 1.00 7.95 C ATOM 1791 C GLY A 189 4.228 22.477 -48.149 1.00 9.64 C ATOM 1792 O GLY A 189 5.008 22.698 -47.225 1.00 10.43 O ATOM 1793 H GLY A 189 2.999 20.945 -50.564 1.00 0.00 H ATOM 1794 N ASN A 190 3.008 23.005 -48.204 1.00 9.64 N ATOM 1795 CA ASN A 190 2.536 23.962 -47.203 1.00 8.33 C ATOM 1796 C ASN A 190 1.880 23.309 -45.991 1.00 6.94 C ATOM 1797 O ASN A 190 1.601 23.975 -44.994 1.00 9.05 O ATOM 1798 CB ASN A 190 1.558 24.946 -47.842 1.00 9.81 C ATOM 1799 CG ASN A 190 2.213 25.803 -48.897 1.00 16.73 C ATOM 1800 OD1 ASN A 190 3.438 25.914 -48.942 1.00 16.72 O ATOM 1801 ND2 ASN A 190 1.406 26.412 -49.757 1.00 16.10 N ATOM 1802 HD22 ASN A 190 0.376 26.289 -49.680 1.00 0.00 H ATOM 1803 HD21 ASN A 190 1.804 27.012 -50.508 1.00 0.00 H ATOM 1804 H ASN A 190 2.372 22.730 -48.980 1.00 0.00 H ATOM 1805 N THR A 191 1.633 22.007 -46.090 1.00 7.73 N ATOM 1806 CA THR A 191 1.015 21.244 -45.013 1.00 6.68 C ATOM 1807 C THR A 191 1.064 19.769 -45.367 1.00 8.39 C ATOM 1808 O THR A 191 1.351 19.408 -46.506 1.00 9.46 O ATOM 1809 CB THR A 191 -0.458 21.659 -44.770 1.00 10.59 C ATOM 1810 OG1 THR A 191 -0.964 21.002 -43.601 1.00 4.49 O ATOM 1811 CG2 THR A 191 -1.325 21.290 -45.969 1.00 5.18 C ATOM 1812 HG1 THR A 191 -0.917 20.021 -43.729 1.00 0.00 H ATOM 1813 H THR A 191 1.890 21.514 -46.969 1.00 0.00 H ATOM 1814 N LYS A 192 0.798 18.915 -44.387 1.00 9.81 N ATOM 1815 CA LYS A 192 0.561 17.510 -44.674 1.00 11.60 C ATOM 1816 C LYS A 192 -0.940 17.271 -44.730 1.00 12.54 C ATOM 1817 O LYS A 192 -1.710 17.953 -44.054 1.00 10.73 O ATOM 1818 CB LYS A 192 1.215 16.607 -43.626 1.00 13.69 C ATOM 1819 CG LYS A 192 2.716 16.447 -43.798 1.00 12.13 C ATOM 1820 CD LYS A 192 3.233 15.289 -42.962 1.00 48.83 C ATOM 1821 CE LYS A 192 4.508 14.711 -43.553 1.00 31.43 C ATOM 1822 NZ LYS A 192 5.663 15.604 -43.290 1.00 17.82 N ATOM 1823 HZ1 LYS A 192 5.485 16.534 -43.720 1.00 0.00 H ATOM 1824 HZ2 LYS A 192 5.788 15.713 -42.263 1.00 0.00 H ATOM 1825 HZ3 LYS A 192 6.522 15.188 -43.703 1.00 0.00 H ATOM 1826 H LYS A 192 0.759 19.254 -43.405 1.00 0.00 H ATOM 1827 N TYR A 193 -1.350 16.315 -45.553 1.00 10.80 N ATOM 1828 CA TYR A 193 -2.755 15.949 -45.668 1.00 5.96 C ATOM 1829 C TYR A 193 -2.894 14.454 -45.428 1.00 12.66 C ATOM 1830 O TYR A 193 -2.121 13.663 -45.964 1.00 10.72 O ATOM 1831 CB TYR A 193 -3.307 16.330 -47.047 1.00 7.80 C ATOM 1832 CG TYR A 193 -4.811 16.205 -47.172 1.00 8.79 C ATOM 1833 CD1 TYR A 193 -5.416 14.972 -47.394 1.00 10.13 C ATOM 1834 CD2 TYR A 193 -5.627 17.325 -47.072 1.00 7.31 C ATOM 1835 CE1 TYR A 193 -6.793 14.861 -47.508 1.00 10.60 C ATOM 1836 CE2 TYR A 193 -7.002 17.223 -47.185 1.00 12.90 C ATOM 1837 CZ TYR A 193 -7.579 15.989 -47.401 1.00 10.06 C ATOM 1838 OH TYR A 193 -8.948 15.887 -47.513 1.00 8.77 O ATOM 1839 HH TYR A 193 -9.196 14.941 -47.665 1.00 0.00 H ATOM 1840 H TYR A 193 -0.648 15.812 -46.133 1.00 0.00 H ATOM 1841 N ALA A 194 -3.872 14.066 -44.618 1.00 6.82 N ATOM 1842 CA ALA A 194 -4.104 12.653 -44.352 1.00 10.93 C ATOM 1843 C ALA A 194 -5.588 12.365 -44.189 1.00 11.83 C ATOM 1844 O ALA A 194 -6.338 13.167 -43.632 1.00 9.35 O ATOM 1845 CB ALA A 194 -3.338 12.206 -43.118 1.00 9.85 C ATOM 1846 H ALA A 194 -4.480 14.780 -44.168 1.00 0.00 H ATOM 1847 N LYS A 195 -6.001 11.209 -44.692 1.00 11.44 N ATOM 1848 CA LYS A 195 -7.383 10.768 -44.602 1.00 9.24 C ATOM 1849 C LYS A 195 -7.458 9.568 -43.663 1.00 15.93 C ATOM 1850 O LYS A 195 -6.615 8.675 -43.726 1.00 10.14 O ATOM 1851 CB LYS A 195 -7.911 10.417 -45.994 1.00 13.49 C ATOM 1852 CG LYS A 195 -9.343 9.914 -46.054 1.00 13.53 C ATOM 1853 CD LYS A 195 -9.719 9.591 -47.499 1.00 14.81 C ATOM 1854 CE LYS A 195 -11.077 8.914 -47.603 1.00 21.18 C ATOM 1855 NZ LYS A 195 -11.512 8.734 -49.020 1.00 16.05 N ATOM 1856 HZ1 LYS A 195 -11.578 9.664 -49.482 1.00 0.00 H ATOM 1857 HZ2 LYS A 195 -10.818 8.145 -49.522 1.00 0.00 H ATOM 1858 HZ3 LYS A 195 -12.442 8.269 -49.039 1.00 0.00 H ATOM 1859 H LYS A 195 -5.310 10.595 -45.169 1.00 0.00 H ATOM 1860 N VAL A 196 -8.447 9.557 -42.774 1.00 10.96 N ATOM 1861 CA VAL A 196 -8.637 8.412 -41.893 1.00 9.41 C ATOM 1862 C VAL A 196 -10.032 7.813 -42.049 1.00 14.77 C ATOM 1863 O VAL A 196 -10.989 8.506 -42.397 1.00 10.43 O ATOM 1864 CB VAL A 196 -8.407 8.778 -40.405 1.00 8.79 C ATOM 1865 CG1 VAL A 196 -6.953 9.160 -40.167 1.00 4.59 C ATOM 1866 CG2 VAL A 196 -9.339 9.894 -39.969 1.00 8.36 C ATOM 1867 H VAL A 196 -9.090 10.372 -42.707 1.00 0.00 H ATOM 1868 N ASP A 197 -10.127 6.513 -41.797 1.00 7.91 N ATOM 1869 CA ASP A 197 -11.394 5.799 -41.832 1.00 10.70 C ATOM 1870 C ASP A 197 -12.103 5.955 -40.491 1.00 8.61 C ATOM 1871 O ASP A 197 -11.745 5.305 -39.508 1.00 4.94 O ATOM 1872 CB ASP A 197 -11.154 4.322 -42.169 1.00 8.50 C ATOM 1873 CG ASP A 197 -12.411 3.478 -42.072 1.00 8.66 C ATOM 1874 OD1 ASP A 197 -13.528 4.037 -42.031 1.00 9.98 O ATOM 1875 OD2 ASP A 197 -12.275 2.235 -42.055 1.00 12.65 O ATOM 1876 H ASP A 197 -9.262 5.984 -41.566 1.00 0.00 H ATOM 1877 N GLY A 198 -13.115 6.818 -40.462 1.00 7.38 N ATOM 1878 CA GLY A 198 -13.835 7.117 -39.238 1.00 6.25 C ATOM 1879 C GLY A 198 -14.891 6.100 -38.838 1.00 8.79 C ATOM 1880 O GLY A 198 -15.643 6.332 -37.892 1.00 10.34 O ATOM 1881 H GLY A 198 -13.399 7.293 -41.343 1.00 0.00 H ATOM 1882 N THR A 199 -14.958 4.977 -39.549 1.00 5.85 N ATOM 1883 CA THR A 199 -15.910 3.925 -39.198 1.00 8.44 C ATOM 1884 C THR A 199 -15.341 2.990 -38.135 1.00 10.75 C ATOM 1885 O THR A 199 -16.091 2.311 -37.431 1.00 14.37 O ATOM 1886 CB THR A 199 -16.327 3.087 -40.426 1.00 11.30 C ATOM 1887 OG1 THR A 199 -15.190 2.389 -40.950 1.00 12.01 O ATOM 1888 CG2 THR A 199 -16.915 3.978 -41.500 1.00 8.14 C ATOM 1889 HG1 THR A 199 -14.498 3.044 -41.221 1.00 0.00 H ATOM 1890 H THR A 199 -14.325 4.846 -40.364 1.00 0.00 H ATOM 1891 N LYS A 200 -14.016 2.957 -38.024 1.00 8.12 N ATOM 1892 CA LYS A 200 -13.347 2.159 -36.996 1.00 9.81 C ATOM 1893 C LYS A 200 -13.791 2.586 -35.600 1.00 11.29 C ATOM 1894 O LYS A 200 -14.270 3.707 -35.422 1.00 6.99 O ATOM 1895 CB LYS A 200 -11.827 2.293 -37.109 1.00 7.15 C ATOM 1896 CG LYS A 200 -11.236 1.925 -38.453 1.00 10.83 C ATOM 1897 CD LYS A 200 -9.719 1.966 -38.355 1.00 21.96 C ATOM 1898 CE LYS A 200 -9.044 1.582 -39.657 1.00 11.41 C ATOM 1899 NZ LYS A 200 -7.566 1.524 -39.471 1.00 15.69 N ATOM 1900 HZ1 LYS A 200 -7.219 2.457 -39.168 1.00 0.00 H ATOM 1901 HZ2 LYS A 200 -7.337 0.815 -38.745 1.00 0.00 H ATOM 1902 HZ3 LYS A 200 -7.115 1.260 -40.370 1.00 0.00 H ATOM 1903 H LYS A 200 -13.439 3.514 -38.686 1.00 0.00 H ATOM 1904 N PRO A 201 -13.636 1.692 -34.605 1.00 9.38 N ATOM 1905 CA PRO A 201 -13.872 2.052 -33.203 1.00 10.23 C ATOM 1906 C PRO A 201 -13.096 3.300 -32.792 1.00 7.36 C ATOM 1907 O PRO A 201 -12.018 3.553 -33.332 1.00 6.56 O ATOM 1908 CB PRO A 201 -13.369 0.825 -32.440 1.00 11.19 C ATOM 1909 CG PRO A 201 -13.597 -0.300 -33.378 1.00 8.73 C ATOM 1910 CD PRO A 201 -13.337 0.255 -34.755 1.00 5.26 C ATOM 1911 N VAL A 202 -13.642 4.057 -31.845 1.00 2.69 N ATOM 1912 CA VAL A 202 -13.042 5.311 -31.398 1.00 9.89 C ATOM 1913 C VAL A 202 -11.561 5.166 -31.040 1.00 10.03 C ATOM 1914 O VAL A 202 -10.738 6.000 -31.419 1.00 4.66 O ATOM 1915 CB VAL A 202 -13.798 5.878 -30.178 1.00 9.16 C ATOM 1916 CG1 VAL A 202 -13.063 7.082 -29.596 1.00 8.95 C ATOM 1917 CG2 VAL A 202 -15.218 6.251 -30.564 1.00 8.79 C ATOM 1918 H VAL A 202 -14.531 3.744 -31.406 1.00 0.00 H ATOM 1919 N ALA A 203 -11.228 4.097 -30.325 1.00 7.10 N ATOM 1920 CA ALA A 203 -9.856 3.867 -29.888 1.00 12.12 C ATOM 1921 C ALA A 203 -8.909 3.667 -31.068 1.00 6.77 C ATOM 1922 O ALA A 203 -7.744 4.050 -31.007 1.00 8.47 O ATOM 1923 CB ALA A 203 -9.796 2.664 -28.950 1.00 10.17 C ATOM 1924 H ALA A 203 -11.964 3.407 -30.071 1.00 0.00 H ATOM 1925 N GLU A 204 -9.414 3.073 -32.144 1.00 8.77 N ATOM 1926 CA GLU A 204 -8.573 2.771 -33.299 1.00 14.90 C ATOM 1927 C GLU A 204 -8.367 3.999 -34.183 1.00 10.75 C ATOM 1928 O GLU A 204 -7.275 4.208 -34.713 1.00 12.40 O ATOM 1929 CB GLU A 204 -9.168 1.620 -34.111 1.00 6.74 C ATOM 1930 CG GLU A 204 -9.134 0.289 -33.375 1.00 16.98 C ATOM 1931 CD GLU A 204 -9.714 -0.849 -34.189 1.00 26.65 C ATOM 1932 OE1 GLU A 204 -9.633 -0.794 -35.434 1.00 19.12 O ATOM 1933 OE2 GLU A 204 -10.252 -1.799 -33.580 1.00 24.99 O ATOM 1934 H GLU A 204 -10.422 2.820 -32.164 1.00 0.00 H ATOM 1935 N VAL A 205 -9.411 4.808 -34.340 1.00 7.19 N ATOM 1936 CA VAL A 205 -9.275 6.079 -35.050 1.00 8.33 C ATOM 1937 C VAL A 205 -8.258 6.947 -34.309 1.00 9.64 C ATOM 1938 O VAL A 205 -7.419 7.608 -34.921 1.00 9.13 O ATOM 1939 CB VAL A 205 -10.625 6.823 -35.168 1.00 7.72 C ATOM 1940 CG1 VAL A 205 -10.451 8.140 -35.912 1.00 6.06 C ATOM 1941 CG2 VAL A 205 -11.658 5.948 -35.870 1.00 4.27 C ATOM 1942 H VAL A 205 -10.336 4.533 -33.953 1.00 0.00 H ATOM 1943 N ARG A 206 -8.329 6.919 -32.983 1.00 6.81 N ATOM 1944 CA ARG A 206 -7.372 7.628 -32.144 1.00 7.72 C ATOM 1945 C ARG A 206 -5.942 7.172 -32.424 1.00 15.30 C ATOM 1946 O ARG A 206 -5.035 7.994 -32.556 1.00 7.94 O ATOM 1947 CB ARG A 206 -7.707 7.425 -30.666 1.00 12.83 C ATOM 1948 CG ARG A 206 -6.728 8.094 -29.716 1.00 20.63 C ATOM 1949 CD ARG A 206 -7.111 7.845 -28.269 1.00 11.75 C ATOM 1950 NE ARG A 206 -6.275 8.608 -27.350 1.00 14.32 N ATOM 1951 CZ ARG A 206 -6.378 8.548 -26.027 1.00 20.90 C ATOM 1952 NH1 ARG A 206 -7.285 7.761 -25.469 1.00 19.72 N ATOM 1953 NH2 ARG A 206 -5.577 9.277 -25.263 1.00 32.77 N ATOM 1954 HE ARG A 206 -5.554 9.238 -27.755 1.00 0.00 H ATOM 1955 HH12 ARG A 206 -7.366 7.714 -24.433 1.00 0.00 H ATOM 1956 HH11 ARG A 206 -7.916 7.190 -26.067 1.00 0.00 H ATOM 1957 HH22 ARG A 206 -5.660 9.228 -24.227 1.00 0.00 H ATOM 1958 HH21 ARG A 206 -4.866 9.898 -25.699 1.00 0.00 H ATOM 1959 H ARG A 206 -9.091 6.375 -32.530 1.00 0.00 H ATOM 1960 N ALA A 207 -5.755 5.857 -32.515 1.00 9.62 N ATOM 1961 CA ALA A 207 -4.445 5.274 -32.785 1.00 9.31 C ATOM 1962 C ALA A 207 -3.935 5.654 -34.172 1.00 12.89 C ATOM 1963 O ALA A 207 -2.759 5.973 -34.338 1.00 16.27 O ATOM 1964 CB ALA A 207 -4.500 3.755 -32.640 1.00 9.03 C ATOM 1965 H ALA A 207 -6.570 5.224 -32.389 1.00 0.00 H ATOM 1966 N ASP A 208 -4.819 5.609 -35.166 1.00 7.71 N ATOM 1967 CA ASP A 208 -4.444 5.981 -36.526 1.00 8.31 C ATOM 1968 C ASP A 208 -4.018 7.445 -36.585 1.00 12.67 C ATOM 1969 O ASP A 208 -3.078 7.800 -37.297 1.00 15.59 O ATOM 1970 CB ASP A 208 -5.598 5.728 -37.504 1.00 11.74 C ATOM 1971 CG ASP A 208 -5.898 4.247 -37.691 1.00 15.67 C ATOM 1972 OD1 ASP A 208 -5.107 3.409 -37.209 1.00 12.73 O ATOM 1973 OD2 ASP A 208 -6.922 3.921 -38.331 1.00 13.57 O ATOM 1974 H ASP A 208 -5.794 5.303 -34.970 1.00 0.00 H ATOM 1975 N LEU A 209 -4.709 8.291 -35.829 1.00 10.70 N ATOM 1976 CA LEU A 209 -4.386 9.712 -35.796 1.00 13.11 C ATOM 1977 C LEU A 209 -3.056 9.966 -35.095 1.00 11.18 C ATOM 1978 O LEU A 209 -2.307 10.862 -35.484 1.00 11.65 O ATOM 1979 CB LEU A 209 -5.510 10.501 -35.123 1.00 9.29 C ATOM 1980 CG LEU A 209 -6.734 10.661 -36.028 1.00 11.83 C ATOM 1981 CD1 LEU A 209 -7.884 11.341 -35.305 1.00 9.73 C ATOM 1982 CD2 LEU A 209 -6.353 11.428 -37.291 1.00 4.59 C ATOM 1983 H LEU A 209 -5.495 7.933 -35.250 1.00 0.00 H ATOM 1984 N GLU A 210 -2.769 9.175 -34.066 1.00 12.19 N ATOM 1985 CA GLU A 210 -1.506 9.286 -33.347 1.00 13.99 C ATOM 1986 C GLU A 210 -0.336 8.887 -34.242 1.00 14.82 C ATOM 1987 O GLU A 210 0.732 9.498 -34.195 1.00 13.74 O ATOM 1988 CB GLU A 210 -1.529 8.423 -32.083 1.00 15.24 C ATOM 1989 CG GLU A 210 -0.186 8.297 -31.377 1.00 15.30 C ATOM 1990 CD GLU A 210 0.416 9.638 -30.999 1.00 21.01 C ATOM 1991 OE1 GLU A 210 -0.350 10.589 -30.737 1.00 20.16 O ATOM 1992 OE2 GLU A 210 1.660 9.739 -30.962 1.00 26.15 O ATOM 1993 H GLU A 210 -3.462 8.460 -33.767 1.00 0.00 H ATOM 1994 N LYS A 211 -0.553 7.865 -35.063 1.00 16.14 N ATOM 1995 CA LYS A 211 0.466 7.391 -35.992 1.00 17.36 C ATOM 1996 C LYS A 211 0.811 8.474 -37.011 1.00 23.26 C ATOM 1997 O LYS A 211 1.966 8.630 -37.402 1.00 18.08 O ATOM 1998 CB LYS A 211 -0.009 6.124 -36.707 1.00 15.11 C ATOM 1999 CG LYS A 211 1.090 5.366 -37.433 1.00 28.29 C ATOM 2000 CD LYS A 211 0.510 4.287 -38.332 1.00 35.26 C ATOM 2001 CE LYS A 211 1.585 3.324 -38.812 1.00 56.42 C ATOM 2002 NZ LYS A 211 2.857 4.018 -39.151 1.00 31.54 N ATOM 2003 HZ1 LYS A 211 2.682 4.709 -39.908 1.00 0.00 H ATOM 2004 HZ2 LYS A 211 3.218 4.509 -38.308 1.00 0.00 H ATOM 2005 HZ3 LYS A 211 3.557 3.319 -39.472 1.00 0.00 H ATOM 2006 H LYS A 211 -1.477 7.389 -35.042 1.00 0.00 H ATOM 2007 N ILE A 212 -0.200 9.228 -37.425 1.00 18.83 N ATOM 2008 CA ILE A 212 -0.010 10.316 -38.376 1.00 14.67 C ATOM 2009 C ILE A 212 0.682 11.515 -37.726 1.00 12.05 C ATOM 2010 O ILE A 212 1.597 12.101 -38.304 1.00 19.64 O ATOM 2011 CB ILE A 212 -1.355 10.765 -38.978 1.00 11.25 C ATOM 2012 CG1 ILE A 212 -1.929 9.661 -39.865 1.00 17.76 C ATOM 2013 CG2 ILE A 212 -1.190 12.047 -39.778 1.00 7.08 C ATOM 2014 CD1 ILE A 212 -3.376 9.874 -40.239 1.00 18.95 C ATOM 2015 H ILE A 212 -1.155 9.037 -37.060 1.00 0.00 H ATOM 2016 N LEU A 213 0.252 11.868 -36.519 1.00 10.48 N ATOM 2017 CA LEU A 213 0.766 13.059 -35.853 1.00 15.77 C ATOM 2018 C LEU A 213 2.103 12.809 -35.156 1.00 38.35 C ATOM 2019 O LEU A 213 2.792 13.756 -34.773 1.00 24.13 O ATOM 2020 CB LEU A 213 -0.257 13.586 -34.848 1.00 11.27 C ATOM 2021 CG LEU A 213 -1.564 14.094 -35.456 1.00 15.37 C ATOM 2022 CD1 LEU A 213 -2.532 14.524 -34.368 1.00 10.51 C ATOM 2023 CD2 LEU A 213 -1.298 15.239 -36.426 1.00 13.11 C ATOM 2024 H LEU A 213 -0.464 11.284 -36.041 1.00 0.00 H ATOM 2025 N GLY A 214 2.464 11.539 -34.993 1.00 25.63 N ATOM 2026 CA GLY A 214 3.746 11.174 -34.410 1.00 34.96 C ATOM 2027 C GLY A 214 3.919 11.585 -32.959 1.00 39.87 C ATOM 2028 O GLY A 214 5.005 11.452 -32.394 1.00 34.58 O ATOM 2029 OXT GLY A 214 2.990 12.065 -32.308 1.00 38.54 O ATOM 2030 H GLY A 214 1.811 10.786 -35.291 1.00 0.00 H TER 2031 GLY A 214 HETATM 2032 MG MG A 1 -16.728 18.994 -34.554 1.00 25.80 MG HETATM 2033 NA NA A 2 2.726 24.389 -42.950 1.00 16.66 NA HETATM 2034 O HOH 3 -20.034 11.059 -46.089 1.00 16.70 O HETATM 2035 O HOH 4 -14.339 5.233 -44.473 1.00 13.23 O HETATM 2036 O HOH 5 -10.673 1.260 -43.694 1.00 24.12 O HETATM 2037 O HOH 6 -22.565 38.106 -41.474 1.00 16.81 O HETATM 2038 O HOH 7 -28.447 4.143 -42.687 1.00 14.23 O HETATM 2039 O HOH 8 4.014 15.111 -32.976 1.00 22.05 O HETATM 2040 O HOH 9 2.421 25.380 -36.767 1.00 22.84 O HETATM 2041 O HOH 10 3.982 15.695 -36.027 1.00 27.62 O HETATM 2042 O HOH 11 4.691 21.486 -40.847 1.00 10.30 O HETATM 2043 O HOH 12 -8.045 36.936 -42.753 1.00 25.02 O HETATM 2044 O HOH 13 7.275 23.696 -46.387 1.00 9.92 O HETATM 2045 O HOH 14 -34.032 24.448 -43.679 1.00 19.87 O HETATM 2046 O HOH 15 -28.090 3.092 -40.450 1.00 14.92 O HETATM 2047 O HOH 16 -27.640 8.068 -14.797 1.00 21.50 O HETATM 2048 O HOH 17 -15.300 39.056 -40.365 1.00 10.75 O HETATM 2049 O HOH 18 -20.565 9.324 -16.987 1.00 12.29 O HETATM 2050 O HOH 19 -36.800 13.675 -36.124 1.00 8.60 O HETATM 2051 O HOH 20 -34.832 9.909 -36.959 1.00 17.43 O HETATM 2052 O HOH 21 -24.198 34.591 -39.996 1.00 14.32 O HETATM 2053 O HOH 22 -32.647 13.562 -27.121 1.00 26.79 O HETATM 2054 O HOH 23 -21.356 38.522 -45.000 1.00 21.48 O HETATM 2055 O HOH 24 -12.199 35.129 -47.763 1.00 9.46 O HETATM 2056 O HOH 25 3.506 19.339 -41.863 1.00 11.32 O HETATM 2057 O HOH 26 7.992 14.199 -43.591 1.00 12.39 O HETATM 2058 O HOH 27 -17.307 11.561 -44.161 1.00 23.89 O HETATM 2059 O HOH 28 -33.093 19.180 -35.403 1.00 8.88 O HETATM 2060 O HOH 29 -24.661 5.008 -37.937 1.00 6.89 O HETATM 2061 O HOH 30 -30.783 33.769 -35.367 1.00 16.81 O HETATM 2062 O HOH 31 -12.302 -0.386 -41.200 1.00 8.81 O HETATM 2063 O HOH 32 -21.098 8.286 -48.617 1.00 11.97 O HETATM 2064 O HOH 33 -24.371 3.230 -50.783 1.00 22.58 O HETATM 2065 O HOH 34 -27.824 6.588 -40.385 1.00 13.55 O HETATM 2066 O HOH 35 -28.024 42.816 -30.956 1.00 15.61 O HETATM 2067 O HOH 36 -14.263 17.523 -13.218 1.00 20.31 O HETATM 2068 O HOH 37 -17.286 2.484 -34.717 1.00 14.72 O HETATM 2069 O HOH 38 -12.464 39.113 -34.230 1.00 10.45 O HETATM 2070 O HOH 39 -34.677 28.438 -38.506 1.00 21.92 O HETATM 2071 O HOH 40 -34.301 21.905 -39.654 1.00 19.53 O HETATM 2072 O HOH 41 -34.797 19.043 -31.858 1.00 22.93 O HETATM 2073 O HOH 42 0.702 15.283 -47.304 1.00 9.45 O HETATM 2074 O HOH 43 2.600 16.903 -48.191 1.00 14.83 O HETATM 2075 O HOH 44 -19.637 39.462 -28.174 1.00 25.44 O HETATM 2076 O HOH 45 -21.631 5.685 -49.300 1.00 26.39 O HETATM 2077 O HOH 46 3.214 25.061 -40.567 1.00 19.51 O HETATM 2078 O HOH 47 -27.314 2.310 -36.816 1.00 12.04 O HETATM 2079 O HOH 48 -26.210 32.359 -43.320 1.00 12.15 O HETATM 2080 O HOH 49 -34.552 12.456 -35.585 1.00 11.62 O HETATM 2081 O HOH 50 -31.833 13.931 -31.813 1.00 20.66 O HETATM 2082 O HOH 51 -14.450 -0.323 -39.689 1.00 9.69 O HETATM 2083 O HOH 52 -16.731 35.592 -47.626 1.00 18.88 O HETATM 2084 O HOH 53 -12.158 4.994 -45.871 1.00 13.40 O HETATM 2085 O HOH 54 3.676 26.491 -43.735 1.00 16.28 O HETATM 2086 O HOH 55 7.069 20.477 -51.698 1.00 38.67 O HETATM 2087 O HOH 56 -25.487 32.680 -45.779 1.00 20.24 O HETATM 2088 O HOH 57 -17.336 1.016 -32.430 1.00 14.58 O HETATM 2089 O HOH 58 -11.645 40.278 -31.732 1.00 22.15 O HETATM 2090 O HOH 59 -12.477 35.137 -50.477 1.00 17.36 O HETATM 2091 O HOH 60 -27.914 1.811 -34.456 1.00 19.61 O HETATM 2092 O HOH 61 -23.819 34.344 -46.946 1.00 15.53 O HETATM 2093 O HOH 62 -27.240 23.194 -37.723 1.00 5.99 O HETATM 2094 O HOH 63 -13.206 2.171 -29.248 1.00 6.32 O HETATM 2095 O HOH 64 -17.915 10.621 -28.774 1.00 5.24 O HETATM 2096 O HOH 65 -3.605 28.768 -44.409 1.00 20.14 O HETATM 2097 O HOH 66 -14.227 33.956 -30.087 1.00 10.55 O HETATM 2098 O HOH 67 -20.952 33.587 -46.091 1.00 11.83 O HETATM 2099 O HOH 68 -20.334 30.053 -44.665 1.00 9.26 O HETATM 2100 O HOH 69 -8.662 12.561 -49.710 1.00 6.88 O HETATM 2101 O HOH 70 -16.772 26.824 -50.513 1.00 11.80 O HETATM 2102 O HOH 71 -25.550 23.740 -33.642 1.00 8.86 O HETATM 2103 O HOH 72 -30.524 14.853 -23.709 1.00 15.74 O HETATM 2104 O HOH 73 -27.455 8.932 -42.855 1.00 10.30 O HETATM 2105 O HOH 74 -7.614 11.661 -31.785 1.00 8.78 O HETATM 2106 O HOH 75 -12.320 19.625 -19.554 1.00 19.23 O HETATM 2107 O HOH 76 -0.173 26.051 -44.186 1.00 18.42 O HETATM 2108 O HOH 77 -13.670 11.893 -27.037 1.00 9.94 O HETATM 2109 O HOH 78 -24.726 20.328 -21.917 1.00 14.83 O HETATM 2110 O HOH 79 -5.301 25.329 -52.469 1.00 12.10 O HETATM 2111 O HOH 80 -24.922 23.437 -42.276 1.00 10.14 O HETATM 2112 O HOH 81 -26.139 40.871 -27.159 1.00 9.12 O HETATM 2113 O HOH 82 -15.828 13.532 -44.748 1.00 16.13 O HETATM 2114 O HOH 83 -17.620 6.923 -21.826 1.00 19.71 O HETATM 2115 O HOH 84 -31.260 18.364 -23.963 1.00 13.29 O HETATM 2116 O HOH 85 -17.393 23.028 -35.397 1.00 21.19 O HETATM 2117 O HOH 86 -27.014 21.161 -25.630 1.00 18.36 O HETATM 2118 O HOH 87 -14.893 8.825 -36.514 1.00 10.50 O HETATM 2119 O HOH 88 -29.537 7.334 -43.425 1.00 22.44 O HETATM 2120 O HOH 89 -14.505 12.246 -46.805 1.00 12.37 O HETATM 2121 O HOH 90 -16.908 10.515 -25.097 1.00 19.34 O HETATM 2122 O HOH 91 -6.978 27.106 -53.914 1.00 12.49 O HETATM 2123 O HOH 92 -26.098 8.859 -22.162 1.00 12.50 O HETATM 2124 O HOH 93 -19.282 1.245 -30.820 1.00 16.06 O HETATM 2125 O HOH 94 -28.762 14.843 -47.127 1.00 13.01 O HETATM 2126 O HOH 95 -13.745 25.517 -29.226 1.00 10.89 O HETATM 2127 O HOH 96 -2.626 6.070 -39.520 1.00 13.03 O HETATM 2128 O HOH 97 -0.636 4.838 -33.065 1.00 16.52 O HETATM 2129 O HOH 98 -16.094 12.983 -48.652 1.00 11.44 O HETATM 2130 O HOH 99 -22.446 29.921 -23.232 1.00 16.71 O HETATM 2131 O HOH 100 -25.641 4.026 -16.357 1.00 27.42 O HETATM 2132 O HOH 101 -12.342 11.472 -49.885 1.00 18.53 O HETATM 2133 O HOH 102 -29.861 24.696 -33.452 1.00 19.38 O HETATM 2134 O HOH 103 -14.110 19.754 -17.840 1.00 18.53 O HETATM 2135 O HOH 104 -6.625 36.432 -34.248 1.00 22.10 O HETATM 2136 O HOH 105 -14.739 9.439 -26.691 1.00 11.36 O HETATM 2137 O HOH 106 -22.865 21.438 -43.028 1.00 15.22 O HETATM 2138 O HOH 107 -4.129 9.829 -46.441 1.00 17.70 O HETATM 2139 O HOH 108 -6.084 29.862 -52.493 1.00 16.41 O HETATM 2140 O HOH 109 -15.804 2.533 -30.429 1.00 9.80 O HETATM 2141 O HOH 110 -13.500 21.770 -41.472 1.00 8.16 O HETATM 2142 O HOH 111 -26.996 27.029 -27.607 1.00 13.76 O HETATM 2143 O HOH 112 -21.110 24.884 -26.897 1.00 12.85 O HETATM 2144 O HOH 113 -6.954 10.568 -49.596 1.00 22.77 O HETATM 2145 O HOH 114 -18.988 35.360 -28.669 1.00 18.10 O HETATM 2146 O HOH 115 -25.857 6.171 -22.615 1.00 17.18 O HETATM 2147 O HOH 116 -16.830 19.637 -29.410 1.00 14.67 O HETATM 2148 O HOH 117 -6.913 26.163 -23.428 1.00 24.94 O HETATM 2149 O HOH 118 -18.059 4.493 -24.375 1.00 16.06 O HETATM 2150 O HOH 119 -19.424 16.072 -52.254 1.00 26.62 O HETATM 2151 O HOH 120 -5.047 10.878 -31.504 1.00 16.18 O HETATM 2152 O HOH 121 -9.673 30.495 -54.043 1.00 8.55 O HETATM 2153 O HOH 122 0.169 22.152 -55.332 1.00 13.95 O HETATM 2154 O HOH 123 -19.756 36.402 -45.249 1.00 17.67 O HETATM 2155 O HOH 124 -15.374 11.979 -23.412 1.00 16.64 O HETATM 2156 O HOH 125 0.120 14.931 -49.996 1.00 21.60 O HETATM 2157 O HOH 126 -13.549 7.325 -25.445 1.00 20.16 O HETATM 2158 O HOH 127 -25.474 22.709 -27.029 1.00 17.47 O HETATM 2159 O HOH 128 -21.913 27.324 -23.424 1.00 16.81 O HETATM 2160 O HOH 129 -23.928 30.804 -20.798 1.00 17.49 O HETATM 2161 O HOH 130 -0.559 6.428 -41.128 1.00 18.52 O HETATM 2162 O HOH 131 -7.563 4.524 -26.590 1.00 20.78 O HETATM 2163 O HOH 132 -13.917 8.550 -33.839 1.00 9.48 O HETATM 2164 O HOH 133 -11.608 20.675 -54.602 1.00 4.89 O HETATM 2165 O HOH 134 -12.484 18.520 -53.010 1.00 8.48 O HETATM 2166 O HOH 135 -28.445 23.033 -29.211 1.00 18.38 O HETATM 2167 O HOH 136 -29.939 6.542 -30.761 1.00 28.15 O HETATM 2168 O HOH 137 -16.750 3.360 -28.296 1.00 16.73 O HETATM 2169 O HOH 138 -2.413 26.261 -45.796 1.00 17.61 O HETATM 2170 O HOH 139 -22.452 22.604 -27.674 1.00 16.63 O HETATM 2171 O HOH 140 -29.169 13.559 -30.859 1.00 24.45 O HETATM 2172 O HOH 141 -33.305 17.385 -44.864 1.00 42.18 O HETATM 2173 O HOH 142 -29.712 21.644 -25.918 1.00 21.69 O HETATM 2174 O HOH 143 -22.409 40.534 -25.787 1.00 23.46 O HETATM 2175 O HOH 144 -18.983 30.965 -48.706 1.00 11.67 O HETATM 2176 O HOH 145 -27.891 26.532 -30.587 1.00 29.67 O HETATM 2177 O HOH 146 -19.411 26.690 -23.581 1.00 22.61 O HETATM 2178 O HOH 147 -21.224 31.254 -48.122 1.00 28.91 O HETATM 2179 O HOH 148 -18.901 25.341 -53.681 1.00 13.87 O HETATM 2180 O HOH 149 -24.835 18.748 -52.086 1.00 32.78 O HETATM 2181 O HOH 150 -25.211 29.807 -45.980 1.00 19.42 O HETATM 2182 O HOH 151 -7.792 -0.292 -36.701 1.00 24.78 O HETATM 2183 O HOH 152 -7.644 5.212 -40.974 1.00 5.52 O HETATM 2184 O HOH 153 -10.302 6.092 -26.812 1.00 20.14 O HETATM 2185 O HOH 154 -6.044 4.224 -29.022 1.00 11.45 O HETATM 2186 O HOH 155 -9.044 5.727 -38.829 1.00 30.03 O HETATM 2187 O HOH 156 -4.297 7.780 -43.417 1.00 22.33 O HETATM 2188 O HOH 157 -11.235 -2.003 -37.108 1.00 8.95 O HETATM 2189 O HOH 158 -21.478 18.196 -30.748 1.00 11.64 O HETATM 2190 O HOH 159 -19.051 20.966 -33.293 1.00 14.69 O HETATM 2191 O HOH 160 -19.496 17.221 -32.234 1.00 12.55 O HETATM 2192 O HOH 161 -5.994 28.030 -45.431 1.00 9.17 O HETATM 2193 O HOH 162 -25.513 24.881 -25.835 1.00 23.15 O HETATM 2194 O HOH 163 -23.308 25.946 -25.539 1.00 10.99 O HETATM 2195 O HOH 164 -26.911 24.255 -23.587 1.00 21.16 O HETATM 2196 O HOH 165 -12.216 16.190 -23.134 1.00 19.34 O HETATM 2197 O HOH 166 -30.161 27.184 -32.683 1.00 13.27 O HETATM 2198 O HOH 167 -20.236 21.733 -43.561 1.00 12.88 O HETATM 2199 O HOH 168 1.685 5.958 -33.146 1.00 26.31 O HETATM 2200 O HOH 169 -12.084 32.647 -51.394 1.00 21.40 O HETATM 2201 O HOH 170 -0.760 20.212 -56.908 1.00 20.51 O HETATM 2202 O HOH 171 -19.255 19.074 -39.961 1.00 22.69 O HETATM 2203 O HOH 172 -29.287 21.985 -47.063 1.00 22.33 O HETATM 2204 O HOH 173 -1.161 26.641 -27.750 1.00 19.75 O HETATM 2205 O HOH 174 0.718 28.935 -33.411 1.00 24.99 O HETATM 2206 O HOH 175 -30.378 16.892 -20.547 1.00 25.86 O HETATM 2207 O HOH 176 -26.936 15.965 -29.599 1.00 16.24 O HETATM 2208 O HOH 177 -16.914 29.182 -26.712 1.00 18.97 O HETATM 2209 O HOH 178 -18.664 31.581 -28.228 1.00 25.33 O HETATM 2210 O HOH 179 -15.222 19.927 -42.009 1.00 16.81 O HETATM 2211 O HOH 180 -30.294 18.747 -18.559 1.00 22.20 O HETATM 2212 O HOH 181 -17.462 20.585 -37.066 1.00 22.44 O HETATM 2213 O HOH 182 -16.941 26.326 -53.050 1.00 16.89 O HETATM 2214 O HOH 183 -30.439 27.360 -30.281 1.00 20.52 O HETATM 2215 O HOH 184 -5.937 35.730 -36.853 1.00 23.25 O HETATM 2216 O HOH 185 -16.001 30.327 -52.713 1.00 21.73 O HETATM 2217 O HOH 186 -21.821 29.749 -46.504 1.00 20.97 O HETATM 2218 O HOH 187 -27.842 23.829 -31.976 1.00 16.70 O HETATM 2219 PA AP A 5 -18.768 13.685 -33.592 1.00 0.30 P HETATM 2220 O1A AP A 5 -17.440 13.623 -32.904 1.00 -0.61 O HETATM 2221 O2A AP A 5 -19.664 14.656 -32.887 1.00 -0.61 O HETATM 2222 O3A AP A 5 -18.603 14.072 -35.105 1.00 -0.13 O HETATM 2223 PB AP A 5 -18.266 15.550 -35.694 1.00 0.34 P HETATM 2224 O1B AP A 5 -17.423 15.367 -36.947 1.00 -0.61 O HETATM 2225 O2B AP A 5 -17.518 16.375 -34.670 1.00 -0.61 O HETATM 2226 O3B AP A 5 -19.610 16.236 -36.048 1.00 -0.12 O HETATM 2227 PG AP A 5 -19.805 17.821 -36.210 1.00 0.34 P HETATM 2228 O1G AP A 5 -18.475 18.475 -36.627 1.00 -0.61 O HETATM 2229 O2G AP A 5 -20.280 18.416 -34.868 1.00 -0.61 O HETATM 2230 O3G AP A 5 -20.895 18.048 -37.396 1.00 -0.12 O HETATM 2231 PD AP A 5 -22.225 18.949 -37.275 1.00 0.34 P HETATM 2232 O1D AP A 5 -23.362 18.059 -36.890 1.00 -0.61 O HETATM 2233 O2D AP A 5 -22.504 19.583 -38.627 1.00 -0.61 O HETATM 2234 O3D AP A 5 -22.060 20.031 -36.157 1.00 -0.13 O HETATM 2235 PE AP A 5 -21.300 21.422 -36.242 1.00 0.30 P HETATM 2236 O1E AP A 5 -19.928 21.260 -36.859 1.00 -0.61 O HETATM 2237 O2E AP A 5 -21.157 21.973 -34.838 1.00 -0.61 O HETATM 2238 O5J AP A 5 -22.162 22.450 -37.096 1.00 -0.25 O HETATM 2239 C5J AP A 5 -23.415 22.858 -36.554 1.00 0.11 C HETATM 2240 C4J AP A 5 -23.805 24.266 -37.151 1.00 0.12 C HETATM 2241 O4J AP A 5 -23.013 25.189 -36.699 1.00 -0.34 O HETATM 2242 C1J AP A 5 -22.698 26.201 -37.923 1.00 0.20 C HETATM 2243 C2J AP A 5 -23.349 25.754 -38.959 1.00 0.14 C HETATM 2244 C3J AP A 5 -23.592 24.264 -38.671 1.00 0.11 C HETATM 2245 O3J AP A 5 -24.692 23.813 -39.290 1.00 -0.39 O HETATM 2246 H17 AP A 5 -24.549 23.816 -40.229 1.00 0.21 H HETATM 2247 H16 AP A 5 -22.725 23.652 -38.960 1.00 0.06 H HETATM 2248 O2J AP A 5 -24.683 26.462 -39.052 1.00 -0.38 O HETATM 2249 H19 AP A 5 -25.195 26.079 -39.754 1.00 0.21 H HETATM 2250 H18 AP A 5 -22.772 25.894 -39.885 1.00 0.07 H HETATM 2251 N9B AP A 5 -21.305 26.220 -38.110 1.00 -0.19 N HETATM 2252 C8B AP A 5 -20.389 25.594 -37.355 1.00 0.11 C HETATM 2253 N7B AP A 5 -19.150 25.870 -37.865 1.00 -0.30 N HETATM 2254 C5B AP A 5 -19.316 26.675 -38.946 1.00 0.10 C HETATM 2255 C6B AP A 5 -18.404 27.244 -39.814 1.00 0.13 C HETATM 2256 N6B AP A 5 -16.977 27.247 -39.979 1.00 -0.32 N HETATM 2257 H22 AP A 5 -16.549 27.782 -40.748 1.00 0.18 H HETATM 2258 H23 AP A 5 -16.382 26.714 -39.329 1.00 0.18 H HETATM 2259 N1B AP A 5 -18.836 28.028 -40.834 1.00 -0.27 N HETATM 2260 C2B AP A 5 -20.166 28.254 -40.996 1.00 0.05 C HETATM 2261 N3B AP A 5 -21.069 27.692 -40.132 1.00 -0.27 N HETATM 2262 C4B AP A 5 -20.643 26.902 -39.107 1.00 0.16 C HETATM 2263 H24 AP A 5 -20.513 28.880 -41.810 1.00 0.10 H HETATM 2264 H21 AP A 5 -20.596 24.973 -36.485 1.00 0.13 H HETATM 2265 H20 AP A 5 -23.046 27.217 -37.683 1.00 0.10 H HETATM 2266 H15 AP A 5 -24.852 24.497 -36.903 1.00 0.07 H HETATM 2267 H13 AP A 5 -23.336 22.932 -35.459 1.00 0.06 H HETATM 2268 H14 AP A 5 -24.187 22.120 -36.817 1.00 0.06 H HETATM 2269 O5F AP A 5 -19.430 12.211 -33.600 1.00 -0.25 O HETATM 2270 C5F AP A 5 -20.745 12.049 -34.102 1.00 0.11 C HETATM 2271 C4F AP A 5 -21.482 10.980 -33.253 1.00 0.12 C HETATM 2272 O4F AP A 5 -21.016 9.808 -33.520 1.00 -0.34 O HETATM 2273 C1F AP A 5 -20.173 9.281 -32.230 1.00 0.20 C HETATM 2274 C2F AP A 5 -20.061 10.260 -31.405 1.00 0.14 C HETATM 2275 C3F AP A 5 -21.218 11.221 -31.760 1.00 0.11 C HETATM 2276 O3F AP A 5 -22.336 10.943 -31.025 1.00 -0.39 O HETATM 2277 H5 AP A 5 -22.155 11.097 -30.105 1.00 0.21 H HETATM 2278 H4 AP A 5 -20.918 12.264 -31.584 1.00 0.06 H HETATM 2279 O2F AP A 5 -20.179 9.806 -29.996 1.00 -0.38 O HETATM 2280 H7 AP A 5 -20.145 10.559 -29.418 1.00 0.21 H HETATM 2281 H6 AP A 5 -19.091 10.761 -31.541 1.00 0.07 H HETATM 2282 N9A AP A 5 -18.908 8.828 -32.684 1.00 -0.19 N HETATM 2283 C8A AP A 5 -17.778 9.564 -32.835 1.00 0.11 C HETATM 2284 N7A AP A 5 -16.801 8.742 -33.299 1.00 -0.30 N HETATM 2285 C5A AP A 5 -17.331 7.491 -33.440 1.00 0.10 C HETATM 2286 C6A AP A 5 -16.787 6.299 -33.869 1.00 0.13 C HETATM 2287 N6A AP A 5 -15.425 5.965 -34.327 1.00 -0.32 N HETATM 2288 H10 AP A 5 -15.200 5.002 -34.614 1.00 0.18 H HETATM 2289 H11 AP A 5 -14.699 6.695 -34.360 1.00 0.18 H HETATM 2290 N1A AP A 5 -17.555 5.180 -33.913 1.00 -0.27 N HETATM 2291 C2A AP A 5 -18.865 5.226 -33.536 1.00 0.05 C HETATM 2292 N3A AP A 5 -19.405 6.399 -33.113 1.00 -0.27 N HETATM 2293 C4A AP A 5 -18.628 7.541 -33.066 1.00 0.16 C HETATM 2294 H12 AP A 5 -19.473 4.330 -33.574 1.00 0.10 H HETATM 2295 H9 AP A 5 -17.673 10.627 -32.622 1.00 0.13 H HETATM 2296 H8 AP A 5 -20.705 8.451 -31.743 1.00 0.10 H HETATM 2297 H3 AP A 5 -22.561 11.020 -33.462 1.00 0.07 H HETATM 2298 H1 AP A 5 -20.701 11.721 -35.151 1.00 0.06 H HETATM 2299 H2 AP A 5 -21.284 13.006 -34.039 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 937 936 2033 CONECT 1797 1796 2033 CONECT 2033 937 1797 CONECT 2219 2220 2221 2222 2269 CONECT 2220 2219 CONECT 2221 2219 CONECT 2222 2219 2223 CONECT 2223 2222 2224 2225 2226 CONECT 2224 2223 CONECT 2225 2223 CONECT 2226 2223 2227 CONECT 2227 2226 2228 2229 2230 CONECT 2228 2227 CONECT 2229 2227 CONECT 2230 2227 2231 CONECT 2231 2230 2232 2233 2234 CONECT 2232 2231 CONECT 2233 2231 CONECT 2234 2231 2235 CONECT 2235 2234 2236 2237 2238 CONECT 2236 2235 CONECT 2237 2235 CONECT 2238 2235 2239 CONECT 2239 2238 2240 2267 2268 CONECT 2240 2239 2241 2244 2266 CONECT 2241 2240 2242 CONECT 2242 2241 2243 2251 2265 CONECT 2243 2242 2244 2248 2250 CONECT 2244 2240 2243 2245 2247 CONECT 2245 2244 2246 CONECT 2246 2245 CONECT 2247 2244 CONECT 2248 2243 2249 CONECT 2249 2248 CONECT 2250 2243 CONECT 2251 2242 2252 2262 CONECT 2252 2251 2253 2264 CONECT 2253 2252 2254 CONECT 2254 2253 2255 2262 CONECT 2255 2254 2256 2259 CONECT 2256 2255 2257 2258 CONECT 2257 2256 CONECT 2258 2256 CONECT 2259 2255 2260 CONECT 2260 2259 2261 2263 CONECT 2261 2260 2262 CONECT 2262 2251 2254 2261 CONECT 2263 2260 CONECT 2264 2252 CONECT 2265 2242 CONECT 2266 2240 CONECT 2267 2239 CONECT 2268 2239 CONECT 2269 2219 2270 CONECT 2270 2269 2271 2298 2299 CONECT 2271 2270 2272 2275 2297 CONECT 2272 2271 2273 CONECT 2273 2272 2274 2282 2296 CONECT 2274 2273 2275 2279 2281 CONECT 2275 2271 2274 2276 2278 CONECT 2276 2275 2277 CONECT 2277 2276 CONECT 2278 2275 CONECT 2279 2274 2280 CONECT 2280 2279 CONECT 2281 2274 CONECT 2282 2273 2283 2293 CONECT 2283 2282 2284 2295 CONECT 2284 2283 2285 CONECT 2285 2284 2286 2293 CONECT 2286 2285 2287 2290 CONECT 2287 2286 2288 2289 CONECT 2288 2287 CONECT 2289 2287 CONECT 2290 2286 2291 CONECT 2291 2290 2292 2294 CONECT 2292 2291 2293 CONECT 2293 2282 2285 2292 CONECT 2294 2291 CONECT 2295 2283 CONECT 2296 2273 CONECT 2297 2271 CONECT 2298 2270 CONECT 2299 2270 MASTER 0 0 0 0 0 0 0 0 2298 1 88 17 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 4x8o
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5eje
RCSB PDB
PDBbind
214aa, >5EJE_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2bzz
RCSB PDB
PDBbind
AP5
3otx
RCSB PDB
PDBbind
AP5
4w5j
RCSB PDB
PDBbind
AP5
5eje
RCSB PDB
PDBbind
AP5
Entry Information
PDB ID
4x8o
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
E. coli Adenylate kinase Y171W mutant
Ligand Name
AP5
EC.Number
E.C.2.7.4.3
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=250nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Nat Commun Vol. 6: pp. 1-9
Ligand Properties
Formula
C
2
0
H
3
4
N
1
0
O
2
2
P
5
Molecular Weight
921.407
Exact Mass
921.054
No. of atoms
91
No. of bonds
96
Polar Surface Area
564.25
LOGP Value
-9.80 (
Computed with XLOGP3
)
-3.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 20
No. of Rotatable Bonds: 20
No. of Nitrogen and Oxygen Atoms: 32
No. of Rings: 6
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(OP(OP(OP(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)(O)O)(O)O)(O)O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C20H39N10O22P5/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(47-19)1-45-53(35,36)49-55(39,40)51-57(43,44)52-56(41,42)50-54(37,38)46-2-8-12(32)14(34)20(48-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-44,53-57H,1-2H2,(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P69441
Entrez Gene ID
NCBI Entrez Gene ID:
60903750
945097
ASD
Information of known allosteric effects of PDB entries
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