Browse entries in the PDBbind-CN Database
HEADER 3SJO_COMPLEX COMPND 3SJO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 179 LEU ASP PHE ALA LEU SER LEU LEU ARG ARG ASN ILE ARG SEQRES 2 A 179 GLN VAL GLN THR ASP GLN GLY HIS PHE THR MET LEU GLY SEQRES 3 A 179 VAL ARG ASP ARG LEU ALA VAL LEU PRO ARG HIS SER GLN SEQRES 4 A 179 PRO GLY LYS THR ILE TRP ILE GLU HIS LYS LEU VAL ASN SEQRES 5 A 179 VAL LEU ASP ALA VAL GLU LEU VAL ASP GLU GLN GLY VAL SEQRES 6 A 179 ASN LEU GLU LEU THR LEU ILE THR LEU ASP THR ASN GLU SEQRES 7 A 179 LYS PHE ARG ASP ILE THR LYS PHE ILE PRO GLU ASN ILE SEQRES 8 A 179 SER THR ALA SER ASP ALA THR LEU VAL ILE ASN THR GLU SEQRES 9 A 179 HIS MET PRO SER MET PHE VAL PRO VAL GLY ASP VAL VAL SEQRES 10 A 179 GLN TYR GLY PHE LEU ASN LEU SER GLY LYS PRO THR HIS SEQRES 11 A 179 ARG THR MET MET TYR ASN PHE PRO THR LYS ALA GLY GLN SEQRES 12 A 179 CYS GLY GLY VAL VAL THR SER VAL GLY LYS VAL ILE GLY SEQRES 13 A 179 ILE HIS ILE GLY GLY ASN GLY ARG GLN GLY PHE CYS ALA SEQRES 14 A 179 GLY LEU LYS ARG SER TYR PHE ALA SER GLU HET AG A 7 87 ATOM 1 N LEU A 4 8.018 -37.373 0.795 1.00 39.62 N ATOM 2 CA LEU A 4 7.782 -36.159 0.028 1.00 39.26 C ATOM 3 C LEU A 4 6.539 -36.340 -0.835 1.00 36.64 C ATOM 4 O LEU A 4 6.226 -35.500 -1.679 1.00 36.74 O ATOM 5 CB LEU A 4 9.005 -35.819 -0.833 1.00 38.97 C ATOM 6 CG LEU A 4 9.206 -34.367 -1.287 1.00 37.80 C ATOM 7 CD1 LEU A 4 9.371 -33.445 -0.089 1.00 35.46 C ATOM 8 CD2 LEU A 4 10.408 -34.247 -2.219 1.00 30.07 C ATOM 9 HA LEU A 4 7.618 -35.326 0.712 1.00 0.00 H ATOM 10 HB2 LEU A 4 9.889 -36.102 -0.261 1.00 0.00 H ATOM 11 HB3 LEU A 4 8.944 -36.431 -1.733 1.00 0.00 H ATOM 12 HG LEU A 4 8.315 -34.063 -1.837 1.00 0.00 H ATOM 13 HD21 LEU A 4 11.306 -34.578 -1.697 1.00 0.00 H ATOM 14 HD22 LEU A 4 10.248 -34.870 -3.099 1.00 0.00 H ATOM 15 HD23 LEU A 4 10.527 -33.208 -2.525 1.00 0.00 H ATOM 16 HD11 LEU A 4 8.479 -33.499 0.535 1.00 0.00 H ATOM 17 HD12 LEU A 4 10.240 -33.756 0.490 1.00 0.00 H ATOM 18 HD13 LEU A 4 9.512 -32.422 -0.437 1.00 0.00 H ATOM 19 HN3 LEU A 4 8.160 -38.171 0.144 1.00 0.00 H ATOM 20 HN2 LEU A 4 7.196 -37.562 1.404 1.00 0.00 H ATOM 21 HN1 LEU A 4 8.866 -37.250 1.384 1.00 0.00 H ATOM 22 N ASP A 5 5.830 -37.445 -0.618 1.00 44.19 N ATOM 23 CA ASP A 5 4.545 -37.650 -1.272 1.00 43.41 C ATOM 24 C ASP A 5 3.447 -36.970 -0.459 1.00 40.89 C ATOM 25 O ASP A 5 2.311 -36.809 -0.925 1.00 37.99 O ATOM 26 CB ASP A 5 4.242 -39.137 -1.438 1.00 48.98 C ATOM 27 CG ASP A 5 3.993 -39.830 -0.120 1.00 50.10 C ATOM 28 OD1 ASP A 5 4.968 -40.051 0.629 1.00 53.11 O ATOM 29 OD2 ASP A 5 2.823 -40.159 0.165 1.00 55.32 O ATOM 30 HA ASP A 5 4.586 -37.208 -2.267 1.00 0.00 H ATOM 31 HB2 ASP A 5 3.355 -39.245 -2.063 1.00 0.00 H ATOM 32 HB3 ASP A 5 5.091 -39.614 -1.928 1.00 0.00 H ATOM 33 H ASP A 5 6.199 -38.172 0.028 1.00 0.00 H ATOM 34 N PHE A 6 3.790 -36.591 0.769 1.00 29.71 N ATOM 35 CA PHE A 6 2.903 -35.767 1.585 1.00 25.27 C ATOM 36 C PHE A 6 2.950 -34.333 1.052 1.00 23.37 C ATOM 37 O PHE A 6 1.910 -33.716 0.808 1.00 17.14 O ATOM 38 CB PHE A 6 3.305 -35.823 3.065 1.00 19.86 C ATOM 39 CG PHE A 6 2.571 -34.837 3.934 1.00 20.82 C ATOM 40 CD1 PHE A 6 1.212 -34.966 4.160 1.00 22.90 C ATOM 41 CD2 PHE A 6 3.244 -33.783 4.526 1.00 22.63 C ATOM 42 CE1 PHE A 6 0.535 -34.062 4.958 1.00 24.48 C ATOM 43 CE2 PHE A 6 2.572 -32.872 5.330 1.00 24.19 C ATOM 44 CZ PHE A 6 1.218 -33.013 5.544 1.00 22.95 C ATOM 45 HA PHE A 6 1.884 -36.148 1.520 1.00 0.00 H ATOM 46 HB2 PHE A 6 3.103 -36.827 3.438 1.00 0.00 H ATOM 47 HB3 PHE A 6 4.373 -35.618 3.139 1.00 0.00 H ATOM 48 HD2 PHE A 6 4.315 -33.666 4.359 1.00 0.00 H ATOM 49 HE2 PHE A 6 3.115 -32.047 5.791 1.00 0.00 H ATOM 50 HZ PHE A 6 0.687 -32.299 6.174 1.00 0.00 H ATOM 51 HE1 PHE A 6 -0.536 -34.177 5.125 1.00 0.00 H ATOM 52 HD1 PHE A 6 0.667 -35.792 3.703 1.00 0.00 H ATOM 53 H PHE A 6 4.709 -36.888 1.156 1.00 0.00 H ATOM 54 N ALA A 7 4.163 -33.819 0.852 1.00 26.74 N ATOM 55 CA ALA A 7 4.348 -32.519 0.206 1.00 25.90 C ATOM 56 C ALA A 7 3.667 -32.487 -1.158 1.00 26.76 C ATOM 57 O ALA A 7 3.110 -31.467 -1.563 1.00 21.65 O ATOM 58 CB ALA A 7 5.833 -32.202 0.060 1.00 27.04 C ATOM 59 HA ALA A 7 3.887 -31.760 0.838 1.00 0.00 H ATOM 60 HB1 ALA A 7 6.297 -32.177 1.046 1.00 0.00 H ATOM 61 HB2 ALA A 7 6.309 -32.971 -0.548 1.00 0.00 H ATOM 62 HB3 ALA A 7 5.950 -31.232 -0.422 1.00 0.00 H ATOM 63 H ALA A 7 4.999 -34.355 1.163 1.00 0.00 H ATOM 64 N LEU A 8 3.719 -33.609 -1.871 1.00 22.35 N ATOM 65 CA LEU A 8 3.121 -33.690 -3.191 1.00 23.42 C ATOM 66 C LEU A 8 1.601 -33.680 -3.103 1.00 20.96 C ATOM 67 O LEU A 8 0.931 -33.021 -3.890 1.00 19.31 O ATOM 68 CB LEU A 8 3.610 -34.948 -3.909 1.00 25.93 C ATOM 69 CG LEU A 8 3.434 -34.991 -5.417 1.00 34.50 C ATOM 70 CD1 LEU A 8 4.205 -33.854 -6.079 1.00 26.98 C ATOM 71 CD2 LEU A 8 3.905 -36.342 -5.920 1.00 31.35 C ATOM 72 HA LEU A 8 3.428 -32.815 -3.764 1.00 0.00 H ATOM 73 HB2 LEU A 8 4.674 -35.055 -3.698 1.00 0.00 H ATOM 74 HB3 LEU A 8 3.071 -35.797 -3.490 1.00 0.00 H ATOM 75 HG LEU A 8 2.383 -34.859 -5.673 1.00 0.00 H ATOM 76 HD21 LEU A 8 4.956 -36.477 -5.664 1.00 0.00 H ATOM 77 HD22 LEU A 8 3.312 -37.129 -5.454 1.00 0.00 H ATOM 78 HD23 LEU A 8 3.784 -36.387 -7.002 1.00 0.00 H ATOM 79 HD11 LEU A 8 3.834 -32.899 -5.706 1.00 0.00 H ATOM 80 HD12 LEU A 8 5.265 -33.950 -5.843 1.00 0.00 H ATOM 81 HD13 LEU A 8 4.066 -33.903 -7.159 1.00 0.00 H ATOM 82 H LEU A 8 4.197 -34.444 -1.475 1.00 0.00 H ATOM 83 N SER A 9 1.062 -34.422 -2.137 1.00 37.16 N ATOM 84 CA SER A 9 -0.369 -34.427 -1.884 1.00 33.41 C ATOM 85 C SER A 9 -0.837 -33.021 -1.541 1.00 34.30 C ATOM 86 O SER A 9 -1.871 -32.565 -2.029 1.00 30.45 O ATOM 87 CB SER A 9 -0.708 -35.383 -0.738 1.00 36.11 C ATOM 88 OG SER A 9 -2.102 -35.438 -0.537 1.00 37.20 O ATOM 89 HA SER A 9 -0.881 -34.768 -2.784 1.00 0.00 H ATOM 90 HB2 SER A 9 -0.227 -35.033 0.175 1.00 0.00 H ATOM 91 HB3 SER A 9 -0.341 -36.380 -0.982 1.00 0.00 H ATOM 92 HG SER A 9 -2.541 -35.758 -1.364 1.00 0.00 H ATOM 93 H SER A 9 1.682 -35.014 -1.548 1.00 0.00 H ATOM 94 N LEU A 10 -0.066 -32.319 -0.706 1.00 18.54 N ATOM 95 CA LEU A 10 -0.411 -30.946 -0.320 1.00 15.45 C ATOM 96 C LEU A 10 -0.413 -30.083 -1.539 1.00 15.40 C ATOM 97 O LEU A 10 -1.270 -29.314 -1.730 1.00 14.15 O ATOM 98 CB LEU A 10 0.607 -30.371 0.629 1.00 17.72 C ATOM 99 CG LEU A 10 0.423 -30.133 2.117 1.00 25.26 C ATOM 100 CD1 LEU A 10 1.533 -29.282 2.731 1.00 15.99 C ATOM 101 CD2 LEU A 10 -0.921 -29.752 2.614 1.00 19.28 C ATOM 102 HA LEU A 10 -1.388 -30.972 0.162 1.00 0.00 H ATOM 103 HB2 LEU A 10 1.470 -31.032 0.553 1.00 0.00 H ATOM 104 HB3 LEU A 10 0.860 -29.395 0.215 1.00 0.00 H ATOM 105 HG LEU A 10 0.514 -31.152 2.494 1.00 0.00 H ATOM 106 HD21 LEU A 10 -1.230 -28.819 2.143 1.00 0.00 H ATOM 107 HD22 LEU A 10 -1.634 -30.539 2.368 1.00 0.00 H ATOM 108 HD23 LEU A 10 -0.883 -29.619 3.695 1.00 0.00 H ATOM 109 HD11 LEU A 10 2.491 -29.782 2.593 1.00 0.00 H ATOM 110 HD12 LEU A 10 1.556 -28.309 2.241 1.00 0.00 H ATOM 111 HD13 LEU A 10 1.341 -29.150 3.796 1.00 0.00 H ATOM 112 H LEU A 10 0.797 -32.755 -0.322 1.00 0.00 H ATOM 113 N LEU A 11 0.616 -30.230 -2.346 1.00 17.62 N ATOM 114 CA LEU A 11 0.709 -29.434 -3.560 1.00 17.73 C ATOM 115 C LEU A 11 -0.496 -29.645 -4.478 1.00 17.27 C ATOM 116 O LEU A 11 -1.085 -28.674 -4.956 1.00 20.13 O ATOM 117 CB LEU A 11 2.014 -29.746 -4.300 1.00 16.84 C ATOM 118 CG LEU A 11 2.216 -29.073 -5.652 1.00 17.83 C ATOM 119 CD1 LEU A 11 2.304 -27.565 -5.470 1.00 16.78 C ATOM 120 CD2 LEU A 11 3.473 -29.622 -6.301 1.00 16.39 C ATOM 121 HA LEU A 11 0.709 -28.384 -3.266 1.00 0.00 H ATOM 122 HB2 LEU A 11 2.839 -29.444 -3.655 1.00 0.00 H ATOM 123 HB3 LEU A 11 2.054 -30.824 -4.459 1.00 0.00 H ATOM 124 HG LEU A 11 1.368 -29.284 -6.304 1.00 0.00 H ATOM 125 HD21 LEU A 11 4.330 -29.419 -5.659 1.00 0.00 H ATOM 126 HD22 LEU A 11 3.368 -30.698 -6.440 1.00 0.00 H ATOM 127 HD23 LEU A 11 3.620 -29.142 -7.269 1.00 0.00 H ATOM 128 HD11 LEU A 11 1.381 -27.200 -5.020 1.00 0.00 H ATOM 129 HD12 LEU A 11 3.146 -27.327 -4.819 1.00 0.00 H ATOM 130 HD13 LEU A 11 2.448 -27.091 -6.441 1.00 0.00 H ATOM 131 H LEU A 11 1.363 -30.916 -2.116 1.00 0.00 H ATOM 132 N ARG A 12 -0.867 -30.904 -4.725 1.00 18.92 N ATOM 133 CA ARG A 12 -1.968 -31.208 -5.646 1.00 21.42 C ATOM 134 C ARG A 12 -3.311 -30.718 -5.136 1.00 18.18 C ATOM 135 O ARG A 12 -4.116 -30.184 -5.894 1.00 18.32 O ATOM 136 CB ARG A 12 -2.097 -32.715 -5.919 1.00 23.46 C ATOM 137 CG ARG A 12 -0.822 -33.521 -5.800 1.00 34.67 C ATOM 138 CD ARG A 12 -0.654 -34.507 -6.950 1.00 32.88 C ATOM 139 NE ARG A 12 0.035 -33.888 -8.078 1.00 40.86 N ATOM 140 CZ ARG A 12 0.492 -34.548 -9.136 1.00 40.47 C ATOM 141 NH1 ARG A 12 0.341 -35.865 -9.217 1.00 39.88 N ATOM 142 NH2 ARG A 12 1.109 -33.887 -10.110 1.00 38.46 N ATOM 143 HA ARG A 12 -1.713 -30.681 -6.565 1.00 0.00 H ATOM 144 HB2 ARG A 12 -2.817 -33.123 -5.210 1.00 0.00 H ATOM 145 HB3 ARG A 12 -2.477 -32.839 -6.933 1.00 0.00 H ATOM 146 HG2 ARG A 12 0.027 -32.837 -5.797 1.00 0.00 H ATOM 147 HG3 ARG A 12 -0.843 -34.076 -4.862 1.00 0.00 H ATOM 148 HD2 ARG A 12 -1.638 -34.845 -7.276 1.00 0.00 H ATOM 149 HD3 ARG A 12 -0.073 -35.362 -6.604 1.00 0.00 H ATOM 150 HE ARG A 12 0.178 -32.858 -8.051 1.00 0.00 H ATOM 151 HH12 ARG A 12 0.700 -36.380 -10.047 1.00 0.00 H ATOM 152 HH11 ARG A 12 -0.136 -36.382 -8.451 1.00 0.00 H ATOM 153 HH22 ARG A 12 1.468 -34.400 -10.940 1.00 0.00 H ATOM 154 HH21 ARG A 12 1.233 -32.857 -10.042 1.00 0.00 H ATOM 155 H ARG A 12 -0.365 -31.685 -4.255 1.00 0.00 H ATOM 156 N ARG A 13 -3.557 -30.914 -3.845 1.00 20.34 N ATOM 157 CA ARG A 13 -4.901 -30.737 -3.308 1.00 16.94 C ATOM 158 C ARG A 13 -5.137 -29.427 -2.560 1.00 21.35 C ATOM 159 O ARG A 13 -6.281 -29.004 -2.408 1.00 18.24 O ATOM 160 CB ARG A 13 -5.236 -31.919 -2.396 1.00 19.59 C ATOM 161 CG ARG A 13 -5.025 -33.263 -3.071 1.00 29.27 C ATOM 162 CD ARG A 13 -5.396 -34.414 -2.165 1.00 32.80 C ATOM 163 NE ARG A 13 -6.831 -34.462 -1.907 1.00 38.66 N ATOM 164 CZ ARG A 13 -7.711 -35.085 -2.686 1.00 43.38 C ATOM 165 NH1 ARG A 13 -7.309 -35.710 -3.788 1.00 40.24 N ATOM 166 NH2 ARG A 13 -8.999 -35.075 -2.364 1.00 45.54 N ATOM 167 HA ARG A 13 -5.562 -30.694 -4.173 1.00 0.00 H ATOM 168 HB2 ARG A 13 -4.599 -31.869 -1.513 1.00 0.00 H ATOM 169 HB3 ARG A 13 -6.280 -31.841 -2.094 1.00 0.00 H ATOM 170 HG2 ARG A 13 -5.642 -33.308 -3.968 1.00 0.00 H ATOM 171 HG3 ARG A 13 -3.975 -33.357 -3.349 1.00 0.00 H ATOM 172 HD2 ARG A 13 -4.871 -34.300 -1.217 1.00 0.00 H ATOM 173 HD3 ARG A 13 -5.091 -35.348 -2.638 1.00 0.00 H ATOM 174 HE ARG A 13 -7.189 -33.978 -1.059 1.00 0.00 H ATOM 175 HH12 ARG A 13 -8.002 -36.195 -4.393 1.00 0.00 H ATOM 176 HH11 ARG A 13 -6.301 -35.714 -4.045 1.00 0.00 H ATOM 177 HH22 ARG A 13 -9.690 -35.561 -2.970 1.00 0.00 H ATOM 178 HH21 ARG A 13 -9.317 -34.581 -1.505 1.00 0.00 H ATOM 179 H ARG A 13 -2.783 -31.197 -3.211 1.00 0.00 H ATOM 180 N ASN A 14 -4.067 -28.783 -2.096 1.00 17.53 N ATOM 181 CA ASN A 14 -4.231 -27.670 -1.154 1.00 14.94 C ATOM 182 C ASN A 14 -3.426 -26.402 -1.413 1.00 14.15 C ATOM 183 O ASN A 14 -3.664 -25.382 -0.771 1.00 14.94 O ATOM 184 CB ASN A 14 -3.940 -28.147 0.271 1.00 13.81 C ATOM 185 CG ASN A 14 -4.922 -29.188 0.745 1.00 15.32 C ATOM 186 OD1 ASN A 14 -4.731 -30.387 0.537 1.00 17.54 O ATOM 187 ND2 ASN A 14 -5.978 -28.736 1.406 1.00 14.74 N ATOM 188 HA ASN A 14 -5.269 -27.372 -1.303 1.00 0.00 H ATOM 189 HB2 ASN A 14 -2.937 -28.574 0.299 1.00 0.00 H ATOM 190 HB3 ASN A 14 -3.987 -27.290 0.943 1.00 0.00 H ATOM 191 HD22 ASN A 14 -6.098 -27.714 1.558 1.00 0.00 H ATOM 192 HD21 ASN A 14 -6.687 -29.403 1.773 1.00 0.00 H ATOM 193 H ASN A 14 -3.115 -29.069 -2.402 1.00 0.00 H ATOM 194 N ILE A 15 -2.471 -26.444 -2.330 1.00 11.98 N ATOM 195 CA ILE A 15 -1.612 -25.280 -2.519 1.00 11.61 C ATOM 196 C ILE A 15 -1.744 -24.713 -3.923 1.00 12.56 C ATOM 197 O ILE A 15 -1.458 -25.397 -4.902 1.00 15.33 O ATOM 198 CB ILE A 15 -0.153 -25.618 -2.210 1.00 13.32 C ATOM 199 CG1 ILE A 15 -0.047 -26.155 -0.783 1.00 13.43 C ATOM 200 CG2 ILE A 15 0.720 -24.399 -2.398 1.00 11.76 C ATOM 201 CD1 ILE A 15 1.345 -26.548 -0.382 1.00 14.20 C ATOM 202 HA ILE A 15 -1.942 -24.514 -1.817 1.00 0.00 H ATOM 203 HB ILE A 15 0.196 -26.386 -2.900 1.00 0.00 H ATOM 204 HG12 ILE A 15 -0.396 -25.382 -0.098 1.00 0.00 H ATOM 205 HG13 ILE A 15 -0.689 -27.031 -0.697 1.00 0.00 H ATOM 206 HD11 ILE A 15 1.707 -27.330 -1.049 1.00 0.00 H ATOM 207 HD12 ILE A 15 2.000 -25.679 -0.450 1.00 0.00 H ATOM 208 HD13 ILE A 15 1.336 -26.919 0.643 1.00 0.00 H ATOM 209 HG21 ILE A 15 0.645 -24.056 -3.430 1.00 0.00 H ATOM 210 HG22 ILE A 15 0.388 -23.608 -1.725 1.00 0.00 H ATOM 211 HG23 ILE A 15 1.755 -24.657 -2.174 1.00 0.00 H ATOM 212 H ILE A 15 -2.335 -27.297 -2.909 1.00 0.00 H ATOM 213 N ARG A 16 -2.178 -23.458 -3.997 1.00 14.03 N ATOM 214 CA ARG A 16 -2.615 -22.851 -5.255 1.00 15.13 C ATOM 215 C ARG A 16 -1.836 -21.588 -5.604 1.00 14.51 C ATOM 216 O ARG A 16 -1.433 -20.813 -4.739 1.00 15.66 O ATOM 217 CB ARG A 16 -4.104 -22.485 -5.195 1.00 16.74 C ATOM 218 CG ARG A 16 -5.035 -23.667 -4.985 1.00 18.24 C ATOM 219 CD ARG A 16 -5.013 -24.594 -6.176 1.00 26.17 C ATOM 220 NE ARG A 16 -5.916 -25.727 -5.997 1.00 29.55 N ATOM 221 CZ ARG A 16 -5.523 -26.958 -5.685 1.00 28.15 C ATOM 222 NH1 ARG A 16 -4.234 -27.227 -5.513 1.00 28.50 N ATOM 223 NH2 ARG A 16 -6.423 -27.922 -5.547 1.00 33.86 N ATOM 224 HA ARG A 16 -2.430 -23.601 -6.025 1.00 0.00 H ATOM 225 HB2 ARG A 16 -4.250 -21.786 -4.372 1.00 0.00 H ATOM 226 HB3 ARG A 16 -4.374 -22.001 -6.134 1.00 0.00 H ATOM 227 HG2 ARG A 16 -4.718 -24.217 -4.099 1.00 0.00 H ATOM 228 HG3 ARG A 16 -6.051 -23.299 -4.838 1.00 0.00 H ATOM 229 HD2 ARG A 16 -3.999 -24.969 -6.313 1.00 0.00 H ATOM 230 HD3 ARG A 16 -5.316 -24.037 -7.063 1.00 0.00 H ATOM 231 HE ARG A 16 -6.935 -25.560 -6.122 1.00 0.00 H ATOM 232 HH12 ARG A 16 -3.932 -28.192 -5.269 1.00 0.00 H ATOM 233 HH11 ARG A 16 -3.526 -26.473 -5.622 1.00 0.00 H ATOM 234 HH22 ARG A 16 -6.119 -28.886 -5.303 1.00 0.00 H ATOM 235 HH21 ARG A 16 -7.433 -27.714 -5.683 1.00 0.00 H ATOM 236 H ARG A 16 -2.208 -22.887 -3.129 1.00 0.00 H ATOM 237 N GLN A 17 -1.642 -21.388 -6.897 1.00 10.87 N ATOM 238 CA GLN A 17 -1.024 -20.170 -7.395 1.00 14.83 C ATOM 239 C GLN A 17 -2.065 -19.063 -7.393 1.00 13.38 C ATOM 240 O GLN A 17 -3.147 -19.219 -7.969 1.00 12.67 O ATOM 241 CB GLN A 17 -0.543 -20.391 -8.822 1.00 13.87 C ATOM 242 CG GLN A 17 0.340 -21.611 -8.983 1.00 15.69 C ATOM 243 CD GLN A 17 0.603 -21.960 -10.436 1.00 20.40 C ATOM 244 OE1 GLN A 17 0.127 -21.281 -11.355 1.00 21.63 O ATOM 245 NE2 GLN A 17 1.356 -23.033 -10.653 1.00 18.07 N ATOM 246 HA GLN A 17 -0.178 -19.899 -6.763 1.00 0.00 H ATOM 247 HB2 GLN A 17 -1.415 -20.509 -9.465 1.00 0.00 H ATOM 248 HB3 GLN A 17 0.022 -19.513 -9.135 1.00 0.00 H ATOM 249 HG2 GLN A 17 1.294 -21.418 -8.493 1.00 0.00 H ATOM 250 HG3 GLN A 17 -0.148 -22.460 -8.504 1.00 0.00 H ATOM 251 HE22 GLN A 17 1.735 -23.574 -9.849 1.00 0.00 H ATOM 252 HE21 GLN A 17 1.566 -23.332 -11.626 1.00 0.00 H ATOM 253 H GLN A 17 -1.939 -22.120 -7.574 1.00 0.00 H ATOM 254 N VAL A 18 -1.746 -17.942 -6.755 1.00 12.13 N ATOM 255 CA VAL A 18 -2.688 -16.829 -6.708 1.00 11.30 C ATOM 256 C VAL A 18 -2.017 -15.504 -7.010 1.00 10.46 C ATOM 257 O VAL A 18 -0.799 -15.417 -7.058 1.00 13.04 O ATOM 258 CB VAL A 18 -3.421 -16.734 -5.349 1.00 9.20 C ATOM 259 CG1 VAL A 18 -4.066 -18.084 -4.992 1.00 8.71 C ATOM 260 CG2 VAL A 18 -2.463 -16.243 -4.249 1.00 10.57 C ATOM 261 HA VAL A 18 -3.425 -17.036 -7.484 1.00 0.00 H ATOM 262 HB VAL A 18 -4.223 -16.000 -5.430 1.00 0.00 H ATOM 263 HG11 VAL A 18 -4.784 -18.358 -5.765 1.00 0.00 H ATOM 264 HG12 VAL A 18 -3.292 -18.849 -4.926 1.00 0.00 H ATOM 265 HG13 VAL A 18 -4.577 -17.999 -4.033 1.00 0.00 H ATOM 266 HG21 VAL A 18 -1.632 -16.942 -4.154 1.00 0.00 H ATOM 267 HG22 VAL A 18 -2.082 -15.257 -4.515 1.00 0.00 H ATOM 268 HG23 VAL A 18 -2.999 -16.184 -3.302 1.00 0.00 H ATOM 269 H VAL A 18 -0.821 -17.858 -6.287 1.00 0.00 H ATOM 270 N GLN A 19 -2.840 -14.486 -7.241 1.00 13.01 N ATOM 271 CA GLN A 19 -2.374 -13.118 -7.372 1.00 13.22 C ATOM 272 C GLN A 19 -3.333 -12.180 -6.670 1.00 12.85 C ATOM 273 O GLN A 19 -4.549 -12.403 -6.659 1.00 13.61 O ATOM 274 CB GLN A 19 -2.300 -12.708 -8.849 1.00 16.22 C ATOM 275 CG GLN A 19 -1.305 -13.496 -9.677 1.00 20.80 C ATOM 276 CD GLN A 19 -1.397 -13.146 -11.154 1.00 25.70 C ATOM 277 OE1 GLN A 19 -1.636 -14.012 -11.998 1.00 32.27 O ATOM 278 NE2 GLN A 19 -1.232 -11.867 -11.469 1.00 20.77 N ATOM 279 HA GLN A 19 -1.382 -13.057 -6.925 1.00 0.00 H ATOM 280 HB2 GLN A 19 -3.289 -12.841 -9.288 1.00 0.00 H ATOM 281 HB3 GLN A 19 -2.022 -11.655 -8.896 1.00 0.00 H ATOM 282 HG2 GLN A 19 -0.298 -13.275 -9.324 1.00 0.00 H ATOM 283 HG3 GLN A 19 -1.507 -14.560 -9.553 1.00 0.00 H ATOM 284 HE22 GLN A 19 -1.032 -11.170 -10.724 1.00 0.00 H ATOM 285 HE21 GLN A 19 -1.303 -11.562 -12.461 1.00 0.00 H ATOM 286 H GLN A 19 -3.858 -14.678 -7.331 1.00 0.00 H ATOM 287 N THR A 20 -2.780 -11.107 -6.113 1.00 11.69 N ATOM 288 CA THR A 20 -3.568 -9.999 -5.594 1.00 11.64 C ATOM 289 C THR A 20 -3.018 -8.729 -6.234 1.00 11.48 C ATOM 290 O THR A 20 -2.179 -8.793 -7.124 1.00 13.98 O ATOM 291 CB THR A 20 -3.421 -9.867 -4.068 1.00 12.17 C ATOM 292 OG1 THR A 20 -2.087 -9.456 -3.751 1.00 13.00 O ATOM 293 CG2 THR A 20 -3.710 -11.201 -3.367 1.00 10.82 C ATOM 294 HA THR A 20 -4.621 -10.165 -5.821 1.00 0.00 H ATOM 295 HB THR A 20 -4.140 -9.126 -3.720 1.00 0.00 H ATOM 296 HG1 THR A 20 -1.994 -9.371 -2.769 1.00 0.00 H ATOM 297 HG23 THR A 20 -4.725 -11.522 -3.603 1.00 0.00 H ATOM 298 HG21 THR A 20 -3.000 -11.953 -3.712 1.00 0.00 H ATOM 299 HG22 THR A 20 -3.610 -11.073 -2.289 1.00 0.00 H ATOM 300 H THR A 20 -1.743 -11.057 -6.045 1.00 0.00 H ATOM 301 N ASP A 21 -3.490 -7.574 -5.783 1.00 12.15 N ATOM 302 CA ASP A 21 -2.926 -6.318 -6.256 1.00 11.59 C ATOM 303 C ASP A 21 -1.455 -6.190 -5.874 1.00 17.64 C ATOM 304 O ASP A 21 -0.724 -5.385 -6.460 1.00 16.03 O ATOM 305 CB ASP A 21 -3.724 -5.138 -5.717 1.00 13.16 C ATOM 306 CG ASP A 21 -5.071 -4.990 -6.398 1.00 16.75 C ATOM 307 OD1 ASP A 21 -5.089 -4.554 -7.565 1.00 18.75 O ATOM 308 OD2 ASP A 21 -6.104 -5.303 -5.768 1.00 21.78 O ATOM 309 HA ASP A 21 -2.988 -6.313 -7.344 1.00 0.00 H ATOM 310 HB2 ASP A 21 -3.886 -5.283 -4.649 1.00 0.00 H ATOM 311 HB3 ASP A 21 -3.150 -4.225 -5.875 1.00 0.00 H ATOM 312 H ASP A 21 -4.265 -7.566 -5.090 1.00 0.00 H ATOM 313 N GLN A 22 -1.017 -6.991 -4.905 1.00 17.28 N ATOM 314 CA GLN A 22 0.367 -6.908 -4.427 1.00 16.71 C ATOM 315 C GLN A 22 1.305 -7.881 -5.145 1.00 19.39 C ATOM 316 O GLN A 22 2.513 -7.894 -4.886 1.00 22.68 O ATOM 317 CB GLN A 22 0.438 -7.103 -2.907 1.00 16.91 C ATOM 318 CG GLN A 22 -0.444 -6.154 -2.112 1.00 16.05 C ATOM 319 CD GLN A 22 -0.066 -4.701 -2.308 1.00 25.49 C ATOM 320 OE1 GLN A 22 -0.929 -3.828 -2.375 1.00 32.48 O ATOM 321 NE2 GLN A 22 1.228 -4.435 -2.406 1.00 26.55 N ATOM 322 HA GLN A 22 0.716 -5.904 -4.667 1.00 0.00 H ATOM 323 HB2 GLN A 22 0.133 -8.124 -2.679 1.00 0.00 H ATOM 324 HB3 GLN A 22 1.471 -6.955 -2.591 1.00 0.00 H ATOM 325 HG2 GLN A 22 -1.478 -6.291 -2.428 1.00 0.00 H ATOM 326 HG3 GLN A 22 -0.354 -6.398 -1.054 1.00 0.00 H ATOM 327 HE22 GLN A 22 1.923 -5.206 -2.344 1.00 0.00 H ATOM 328 HE21 GLN A 22 1.548 -3.455 -2.545 1.00 0.00 H ATOM 329 H GLN A 22 -1.665 -7.685 -4.481 1.00 0.00 H ATOM 330 N GLY A 23 0.756 -8.682 -6.051 1.00 12.77 N ATOM 331 CA GLY A 23 1.562 -9.560 -6.885 1.00 14.36 C ATOM 332 C GLY A 23 1.278 -11.043 -6.715 1.00 13.98 C ATOM 333 O GLY A 23 0.151 -11.445 -6.435 1.00 13.48 O ATOM 334 HA3 GLY A 23 2.611 -9.386 -6.645 1.00 0.00 H ATOM 335 HA2 GLY A 23 1.381 -9.298 -7.927 1.00 0.00 H ATOM 336 H GLY A 23 -0.277 -8.682 -6.167 1.00 0.00 H ATOM 337 N HIS A 24 2.299 -11.866 -6.924 1.00 18.09 N ATOM 338 CA HIS A 24 2.113 -13.323 -6.906 1.00 13.92 C ATOM 339 C HIS A 24 2.400 -13.915 -5.533 1.00 16.33 C ATOM 340 O HIS A 24 3.381 -13.553 -4.871 1.00 18.95 O ATOM 341 CB HIS A 24 3.003 -14.004 -7.946 1.00 17.51 C ATOM 342 CG HIS A 24 2.581 -13.760 -9.362 1.00 18.37 C ATOM 343 ND1 HIS A 24 2.897 -12.603 -10.046 1.00 25.63 N ATOM 344 CD2 HIS A 24 1.883 -14.531 -10.226 1.00 20.88 C ATOM 345 CE1 HIS A 24 2.399 -12.671 -11.269 1.00 23.54 C ATOM 346 NE2 HIS A 24 1.786 -13.831 -11.407 1.00 25.97 N ATOM 347 HA HIS A 24 1.067 -13.507 -7.150 1.00 0.00 H ATOM 348 HB2 HIS A 24 4.020 -13.633 -7.822 1.00 0.00 H ATOM 349 HB3 HIS A 24 2.984 -15.078 -7.763 1.00 0.00 H ATOM 350 HD2 HIS A 24 1.474 -15.521 -10.025 1.00 0.00 H ATOM 351 HE1 HIS A 24 2.481 -11.899 -12.034 1.00 0.00 H ATOM 352 H HIS A 24 3.245 -11.473 -7.103 1.00 0.00 H ATOM 353 N PHE A 25 1.549 -14.849 -5.121 1.00 11.59 N ATOM 354 CA PHE A 25 1.685 -15.511 -3.829 1.00 10.65 C ATOM 355 C PHE A 25 1.289 -16.973 -3.951 1.00 12.03 C ATOM 356 O PHE A 25 0.651 -17.384 -4.923 1.00 12.76 O ATOM 357 CB PHE A 25 0.796 -14.837 -2.773 1.00 10.96 C ATOM 358 CG PHE A 25 1.126 -13.391 -2.534 1.00 13.20 C ATOM 359 CD1 PHE A 25 0.534 -12.394 -3.296 1.00 15.58 C ATOM 360 CD2 PHE A 25 2.036 -13.027 -1.550 1.00 12.84 C ATOM 361 CE1 PHE A 25 0.852 -11.055 -3.078 1.00 17.83 C ATOM 362 CE2 PHE A 25 2.348 -11.698 -1.327 1.00 19.16 C ATOM 363 CZ PHE A 25 1.762 -10.709 -2.096 1.00 17.85 C ATOM 364 HA PHE A 25 2.727 -15.434 -3.517 1.00 0.00 H ATOM 365 HB2 PHE A 25 -0.241 -14.903 -3.104 1.00 0.00 H ATOM 366 HB3 PHE A 25 0.911 -15.376 -1.832 1.00 0.00 H ATOM 367 HD2 PHE A 25 2.511 -13.799 -0.945 1.00 0.00 H ATOM 368 HE2 PHE A 25 3.057 -11.430 -0.544 1.00 0.00 H ATOM 369 HZ PHE A 25 2.016 -9.662 -1.929 1.00 0.00 H ATOM 370 HE1 PHE A 25 0.383 -10.279 -3.683 1.00 0.00 H ATOM 371 HD1 PHE A 25 -0.185 -12.660 -4.071 1.00 0.00 H ATOM 372 H PHE A 25 0.759 -15.117 -5.742 1.00 0.00 H ATOM 373 N THR A 26 1.703 -17.755 -2.967 1.00 9.89 N ATOM 374 CA THR A 26 1.242 -19.130 -2.808 1.00 11.96 C ATOM 375 C THR A 26 0.131 -19.074 -1.766 1.00 11.36 C ATOM 376 O THR A 26 0.262 -18.381 -0.768 1.00 12.83 O ATOM 377 CB THR A 26 2.371 -20.011 -2.272 1.00 13.63 C ATOM 378 OG1 THR A 26 3.481 -19.991 -3.183 1.00 12.04 O ATOM 379 CG2 THR A 26 1.905 -21.441 -2.082 1.00 12.63 C ATOM 380 HA THR A 26 0.907 -19.544 -3.759 1.00 0.00 H ATOM 381 HB THR A 26 2.678 -19.613 -1.305 1.00 0.00 H ATOM 382 HG1 THR A 26 3.809 -19.062 -3.281 1.00 0.00 H ATOM 383 HG23 THR A 26 1.062 -21.458 -1.391 1.00 0.00 H ATOM 384 HG21 THR A 26 1.597 -21.852 -3.043 1.00 0.00 H ATOM 385 HG22 THR A 26 2.722 -22.037 -1.676 1.00 0.00 H ATOM 386 H THR A 26 2.384 -17.374 -2.280 1.00 0.00 H ATOM 387 N MET A 27 -0.962 -19.791 -2.006 1.00 11.54 N ATOM 388 CA MET A 27 -2.077 -19.848 -1.055 1.00 10.57 C ATOM 389 C MET A 27 -2.278 -21.272 -0.539 1.00 13.09 C ATOM 390 O MET A 27 -2.278 -22.221 -1.309 1.00 13.30 O ATOM 391 CB MET A 27 -3.367 -19.372 -1.737 1.00 13.31 C ATOM 392 CG MET A 27 -4.599 -19.377 -0.827 1.00 13.37 C ATOM 393 SD MET A 27 -6.114 -18.846 -1.669 1.00 15.90 S ATOM 394 CE MET A 27 -6.541 -20.330 -2.541 1.00 17.04 C ATOM 395 HA MET A 27 -1.841 -19.198 -0.213 1.00 0.00 H ATOM 396 HB2 MET A 27 -3.210 -18.354 -2.094 1.00 0.00 H ATOM 397 HB3 MET A 27 -3.566 -20.026 -2.586 1.00 0.00 H ATOM 398 HG2 MET A 27 -4.414 -18.704 0.010 1.00 0.00 H ATOM 399 HG3 MET A 27 -4.748 -20.389 -0.452 1.00 0.00 H ATOM 400 HE1 MET A 27 -5.732 -20.596 -3.221 1.00 0.00 H ATOM 401 HE2 MET A 27 -6.697 -21.138 -1.826 1.00 0.00 H ATOM 402 HE3 MET A 27 -7.456 -20.165 -3.110 1.00 0.00 H ATOM 403 H MET A 27 -1.029 -20.328 -2.894 1.00 0.00 H ATOM 404 N LEU A 28 -2.453 -21.420 0.769 1.00 11.74 N ATOM 405 CA LEU A 28 -2.813 -22.719 1.324 1.00 11.41 C ATOM 406 C LEU A 28 -4.316 -22.830 1.609 1.00 11.47 C ATOM 407 O LEU A 28 -4.845 -22.092 2.432 1.00 12.08 O ATOM 408 CB LEU A 28 -2.032 -22.952 2.621 1.00 10.84 C ATOM 409 CG LEU A 28 -2.351 -24.247 3.364 1.00 10.27 C ATOM 410 CD1 LEU A 28 -1.878 -25.436 2.542 1.00 11.97 C ATOM 411 CD2 LEU A 28 -1.661 -24.221 4.736 1.00 14.03 C ATOM 412 HA LEU A 28 -2.559 -23.477 0.583 1.00 0.00 H ATOM 413 HB2 LEU A 28 -0.970 -22.960 2.376 1.00 0.00 H ATOM 414 HB3 LEU A 28 -2.243 -22.120 3.293 1.00 0.00 H ATOM 415 HG LEU A 28 -3.427 -24.340 3.513 1.00 0.00 H ATOM 416 HD21 LEU A 28 -0.583 -24.132 4.598 1.00 0.00 H ATOM 417 HD22 LEU A 28 -2.026 -23.369 5.309 1.00 0.00 H ATOM 418 HD23 LEU A 28 -1.885 -25.144 5.272 1.00 0.00 H ATOM 419 HD11 LEU A 28 -2.387 -25.436 1.578 1.00 0.00 H ATOM 420 HD12 LEU A 28 -0.802 -25.363 2.386 1.00 0.00 H ATOM 421 HD13 LEU A 28 -2.107 -26.359 3.075 1.00 0.00 H ATOM 422 H LEU A 28 -2.332 -20.604 1.402 1.00 0.00 H ATOM 423 N GLY A 29 -5.000 -23.741 0.919 1.00 10.97 N ATOM 424 CA GLY A 29 -6.375 -24.070 1.272 1.00 12.25 C ATOM 425 C GLY A 29 -6.385 -25.058 2.420 1.00 11.86 C ATOM 426 O GLY A 29 -5.676 -26.059 2.387 1.00 11.05 O ATOM 427 HA3 GLY A 29 -6.875 -24.511 0.410 1.00 0.00 H ATOM 428 HA2 GLY A 29 -6.900 -23.162 1.570 1.00 0.00 H ATOM 429 H GLY A 29 -4.547 -24.224 0.117 1.00 0.00 H ATOM 430 N VAL A 30 -7.208 -24.791 3.429 1.00 13.06 N ATOM 431 CA VAL A 30 -7.155 -25.556 4.664 1.00 15.52 C ATOM 432 C VAL A 30 -8.335 -26.514 4.829 1.00 13.99 C ATOM 433 O VAL A 30 -8.163 -27.678 5.191 1.00 17.55 O ATOM 434 CB VAL A 30 -7.090 -24.609 5.869 1.00 15.73 C ATOM 435 CG1 VAL A 30 -7.197 -25.399 7.169 1.00 17.45 C ATOM 436 CG2 VAL A 30 -5.781 -23.836 5.835 1.00 18.42 C ATOM 437 HA VAL A 30 -6.253 -26.165 4.612 1.00 0.00 H ATOM 438 HB VAL A 30 -7.925 -23.910 5.819 1.00 0.00 H ATOM 439 HG11 VAL A 30 -8.145 -25.937 7.189 1.00 0.00 H ATOM 440 HG12 VAL A 30 -6.373 -26.110 7.229 1.00 0.00 H ATOM 441 HG13 VAL A 30 -7.149 -24.713 8.015 1.00 0.00 H ATOM 442 HG21 VAL A 30 -4.946 -24.536 5.876 1.00 0.00 H ATOM 443 HG22 VAL A 30 -5.726 -23.257 4.913 1.00 0.00 H ATOM 444 HG23 VAL A 30 -5.735 -23.163 6.691 1.00 0.00 H ATOM 445 H VAL A 30 -7.901 -24.022 3.333 1.00 0.00 H ATOM 446 N ARG A 31 -9.532 -26.016 4.564 1.00 10.80 N ATOM 447 CA ARG A 31 -10.731 -26.844 4.659 1.00 12.35 C ATOM 448 C ARG A 31 -11.888 -26.087 4.037 1.00 12.35 C ATOM 449 O ARG A 31 -11.914 -24.855 4.054 1.00 11.99 O ATOM 450 CB ARG A 31 -11.051 -27.157 6.125 1.00 13.06 C ATOM 451 CG ARG A 31 -11.490 -25.948 6.944 1.00 13.41 C ATOM 452 CD ARG A 31 -11.909 -26.350 8.360 1.00 15.82 C ATOM 453 NE ARG A 31 -12.176 -25.170 9.174 1.00 13.43 N ATOM 454 CZ ARG A 31 -13.228 -24.373 9.023 1.00 15.73 C ATOM 455 NH1 ARG A 31 -14.136 -24.622 8.082 1.00 17.46 N ATOM 456 NH2 ARG A 31 -13.371 -23.321 9.812 1.00 18.32 N ATOM 457 HA ARG A 31 -10.566 -27.785 4.134 1.00 0.00 H ATOM 458 HB2 ARG A 31 -11.852 -27.895 6.150 1.00 0.00 H ATOM 459 HB3 ARG A 31 -10.158 -27.577 6.588 1.00 0.00 H ATOM 460 HG2 ARG A 31 -10.661 -25.243 7.007 1.00 0.00 H ATOM 461 HG3 ARG A 31 -12.335 -25.471 6.447 1.00 0.00 H ATOM 462 HD2 ARG A 31 -11.108 -26.928 8.820 1.00 0.00 H ATOM 463 HD3 ARG A 31 -12.811 -26.960 8.307 1.00 0.00 H ATOM 464 HE ARG A 31 -11.496 -24.936 9.925 1.00 0.00 H ATOM 465 HH12 ARG A 31 -14.956 -23.992 7.971 1.00 0.00 H ATOM 466 HH11 ARG A 31 -14.025 -25.446 7.457 1.00 0.00 H ATOM 467 HH22 ARG A 31 -14.193 -22.694 9.698 1.00 0.00 H ATOM 468 HH21 ARG A 31 -12.662 -23.121 10.546 1.00 0.00 H ATOM 469 H ARG A 31 -9.620 -25.018 4.283 1.00 0.00 H ATOM 470 N ASP A 32 -12.852 -26.819 3.495 1.00 25.00 N ATOM 471 CA ASP A 32 -14.050 -26.174 2.986 1.00 26.48 C ATOM 472 C ASP A 32 -13.647 -25.001 2.088 1.00 22.17 C ATOM 473 O ASP A 32 -12.881 -25.176 1.149 1.00 21.57 O ATOM 474 CB ASP A 32 -14.907 -25.691 4.158 1.00 25.64 C ATOM 475 CG ASP A 32 -15.277 -26.823 5.112 1.00 29.38 C ATOM 476 OD1 ASP A 32 -15.938 -27.787 4.660 1.00 30.71 O ATOM 477 OD2 ASP A 32 -14.915 -26.755 6.311 1.00 28.78 O ATOM 478 HA ASP A 32 -14.635 -26.881 2.398 1.00 0.00 H ATOM 479 HB2 ASP A 32 -14.350 -24.934 4.711 1.00 0.00 H ATOM 480 HB3 ASP A 32 -15.823 -25.251 3.764 1.00 0.00 H ATOM 481 H ASP A 32 -12.751 -27.852 3.435 1.00 0.00 H ATOM 482 N ARG A 33 -14.136 -23.809 2.404 1.00 12.48 N ATOM 483 CA ARG A 33 -13.883 -22.629 1.588 1.00 12.68 C ATOM 484 C ARG A 33 -12.863 -21.712 2.269 1.00 9.51 C ATOM 485 O ARG A 33 -12.732 -20.544 1.920 1.00 11.20 O ATOM 486 CB ARG A 33 -15.188 -21.869 1.342 1.00 17.18 C ATOM 487 CG ARG A 33 -16.202 -22.630 0.477 1.00 18.44 C ATOM 488 CD ARG A 33 -17.564 -21.933 0.442 1.00 22.87 C ATOM 489 NE ARG A 33 -18.201 -21.905 1.754 1.00 22.88 N ATOM 490 CZ ARG A 33 -18.437 -20.797 2.448 1.00 24.48 C ATOM 491 NH1 ARG A 33 -18.098 -19.616 1.953 1.00 22.86 N ATOM 492 NH2 ARG A 33 -19.015 -20.869 3.639 1.00 26.64 N ATOM 493 HA ARG A 33 -13.474 -22.953 0.631 1.00 0.00 H ATOM 494 HB2 ARG A 33 -15.650 -21.659 2.307 1.00 0.00 H ATOM 495 HB3 ARG A 33 -14.949 -20.930 0.843 1.00 0.00 H ATOM 496 HG2 ARG A 33 -15.816 -22.699 -0.540 1.00 0.00 H ATOM 497 HG3 ARG A 33 -16.330 -23.633 0.885 1.00 0.00 H ATOM 498 HD2 ARG A 33 -18.214 -22.465 -0.253 1.00 0.00 H ATOM 499 HD3 ARG A 33 -17.426 -20.909 0.096 1.00 0.00 H ATOM 500 HE ARG A 33 -18.489 -22.812 2.174 1.00 0.00 H ATOM 501 HH12 ARG A 33 -18.284 -18.751 2.499 1.00 0.00 H ATOM 502 HH11 ARG A 33 -17.646 -19.554 1.019 1.00 0.00 H ATOM 503 HH22 ARG A 33 -19.199 -20.001 4.181 1.00 0.00 H ATOM 504 HH21 ARG A 33 -19.284 -21.794 4.031 1.00 0.00 H ATOM 505 H ARG A 33 -14.718 -23.714 3.261 1.00 0.00 H ATOM 506 N LEU A 34 -12.153 -22.255 3.245 1.00 11.05 N ATOM 507 CA LEU A 34 -11.251 -21.471 4.073 1.00 11.33 C ATOM 508 C LEU A 34 -9.809 -21.631 3.619 1.00 13.29 C ATOM 509 O LEU A 34 -9.316 -22.751 3.478 1.00 12.57 O ATOM 510 CB LEU A 34 -11.397 -21.902 5.537 1.00 12.03 C ATOM 511 CG LEU A 34 -10.426 -21.324 6.561 1.00 11.17 C ATOM 512 CD1 LEU A 34 -10.621 -19.841 6.697 1.00 15.60 C ATOM 513 CD2 LEU A 34 -10.630 -22.021 7.911 1.00 16.25 C ATOM 514 HA LEU A 34 -11.516 -20.418 3.974 1.00 0.00 H ATOM 515 HB2 LEU A 34 -12.403 -21.628 5.855 1.00 0.00 H ATOM 516 HB3 LEU A 34 -11.290 -22.986 5.567 1.00 0.00 H ATOM 517 HG LEU A 34 -9.405 -21.498 6.221 1.00 0.00 H ATOM 518 HD21 LEU A 34 -11.654 -21.861 8.250 1.00 0.00 H ATOM 519 HD22 LEU A 34 -10.446 -23.089 7.798 1.00 0.00 H ATOM 520 HD23 LEU A 34 -9.935 -21.606 8.641 1.00 0.00 H ATOM 521 HD11 LEU A 34 -10.445 -19.363 5.733 1.00 0.00 H ATOM 522 HD12 LEU A 34 -11.641 -19.638 7.023 1.00 0.00 H ATOM 523 HD13 LEU A 34 -9.918 -19.449 7.432 1.00 0.00 H ATOM 524 H LEU A 34 -12.243 -23.275 3.425 1.00 0.00 H ATOM 525 N ALA A 35 -9.139 -20.504 3.383 1.00 11.18 N ATOM 526 CA ALA A 35 -7.746 -20.524 2.983 1.00 14.69 C ATOM 527 C ALA A 35 -6.949 -19.486 3.772 1.00 13.24 C ATOM 528 O ALA A 35 -7.523 -18.625 4.446 1.00 12.79 O ATOM 529 CB ALA A 35 -7.621 -20.277 1.487 1.00 11.89 C ATOM 530 HA ALA A 35 -7.334 -21.509 3.203 1.00 0.00 H ATOM 531 HB1 ALA A 35 -8.158 -21.056 0.945 1.00 0.00 H ATOM 532 HB2 ALA A 35 -8.047 -19.304 1.244 1.00 0.00 H ATOM 533 HB3 ALA A 35 -6.569 -20.295 1.204 1.00 0.00 H ATOM 534 H ALA A 35 -9.626 -19.591 3.488 1.00 0.00 H ATOM 535 N VAL A 36 -5.624 -19.587 3.708 1.00 12.22 N ATOM 536 CA VAL A 36 -4.750 -18.652 4.412 1.00 10.73 C ATOM 537 C VAL A 36 -3.673 -18.069 3.486 1.00 12.63 C ATOM 538 O VAL A 36 -3.150 -18.760 2.602 1.00 11.11 O ATOM 539 CB VAL A 36 -4.129 -19.300 5.688 1.00 8.50 C ATOM 540 CG1 VAL A 36 -3.245 -20.476 5.312 1.00 11.56 C ATOM 541 CG2 VAL A 36 -3.363 -18.261 6.521 1.00 12.51 C ATOM 542 HA VAL A 36 -5.369 -17.818 4.742 1.00 0.00 H ATOM 543 HB VAL A 36 -4.941 -19.677 6.310 1.00 0.00 H ATOM 544 HG11 VAL A 36 -3.841 -21.224 4.789 1.00 0.00 H ATOM 545 HG12 VAL A 36 -2.441 -20.131 4.662 1.00 0.00 H ATOM 546 HG13 VAL A 36 -2.821 -20.914 6.216 1.00 0.00 H ATOM 547 HG21 VAL A 36 -2.559 -17.836 5.920 1.00 0.00 H ATOM 548 HG22 VAL A 36 -4.046 -17.469 6.829 1.00 0.00 H ATOM 549 HG23 VAL A 36 -2.942 -18.743 7.403 1.00 0.00 H ATOM 550 H VAL A 36 -5.200 -20.350 3.143 1.00 0.00 H ATOM 551 N LEU A 37 -3.396 -16.780 3.687 1.00 9.77 N ATOM 552 CA LEU A 37 -2.417 -15.996 2.924 1.00 13.98 C ATOM 553 C LEU A 37 -1.562 -15.152 3.872 1.00 12.19 C ATOM 554 O LEU A 37 -1.967 -14.879 5.011 1.00 10.97 O ATOM 555 CB LEU A 37 -3.130 -15.025 1.983 1.00 16.00 C ATOM 556 CG LEU A 37 -3.876 -15.527 0.747 1.00 16.17 C ATOM 557 CD1 LEU A 37 -4.711 -14.385 0.157 1.00 17.34 C ATOM 558 CD2 LEU A 37 -2.924 -16.094 -0.295 1.00 15.18 C ATOM 559 HA LEU A 37 -1.800 -16.697 2.362 1.00 0.00 H ATOM 560 HB2 LEU A 37 -3.860 -14.487 2.588 1.00 0.00 H ATOM 561 HB3 LEU A 37 -2.372 -14.328 1.625 1.00 0.00 H ATOM 562 HG LEU A 37 -4.536 -16.340 1.050 1.00 0.00 H ATOM 563 HD21 LEU A 37 -2.225 -15.318 -0.608 1.00 0.00 H ATOM 564 HD22 LEU A 37 -2.372 -16.930 0.135 1.00 0.00 H ATOM 565 HD23 LEU A 37 -3.495 -16.439 -1.157 1.00 0.00 H ATOM 566 HD11 LEU A 37 -5.429 -14.040 0.901 1.00 0.00 H ATOM 567 HD12 LEU A 37 -4.053 -13.563 -0.124 1.00 0.00 H ATOM 568 HD13 LEU A 37 -5.243 -14.743 -0.724 1.00 0.00 H ATOM 569 H LEU A 37 -3.915 -16.291 4.444 1.00 0.00 H ATOM 570 N PRO A 38 -0.378 -14.712 3.404 1.00 12.43 N ATOM 571 CA PRO A 38 0.354 -13.728 4.200 1.00 15.00 C ATOM 572 C PRO A 38 -0.406 -12.408 4.206 1.00 16.73 C ATOM 573 O PRO A 38 -0.937 -12.018 3.167 1.00 17.40 O ATOM 574 CB PRO A 38 1.677 -13.548 3.439 1.00 17.70 C ATOM 575 CG PRO A 38 1.694 -14.567 2.362 1.00 16.09 C ATOM 576 CD PRO A 38 0.262 -14.969 2.104 1.00 14.95 C ATOM 577 HA PRO A 38 0.493 -14.039 5.236 1.00 0.00 H ATOM 578 HD3 PRO A 38 -0.183 -14.360 1.318 1.00 0.00 H ATOM 579 HD2 PRO A 38 0.191 -16.022 1.830 1.00 0.00 H ATOM 580 HG3 PRO A 38 2.274 -15.434 2.677 1.00 0.00 H ATOM 581 HG2 PRO A 38 2.133 -14.147 1.457 1.00 0.00 H ATOM 582 HB2 PRO A 38 1.730 -12.547 3.010 1.00 0.00 H ATOM 583 HB3 PRO A 38 2.521 -13.699 4.112 1.00 0.00 H ATOM 584 N ARG A 39 -0.452 -11.726 5.333 1.00 10.15 N ATOM 585 CA ARG A 39 -1.238 -10.528 5.499 1.00 12.24 C ATOM 586 C ARG A 39 -0.921 -9.475 4.454 1.00 14.76 C ATOM 587 O ARG A 39 -1.790 -8.853 3.911 1.00 13.19 O ATOM 588 CB ARG A 39 -1.112 -9.944 6.896 1.00 14.67 C ATOM 589 CG ARG A 39 -2.086 -8.826 7.301 1.00 15.46 C ATOM 590 CD ARG A 39 -1.520 -7.917 8.344 1.00 18.95 C ATOM 591 NE ARG A 39 -0.210 -7.587 7.917 1.00 35.39 N ATOM 592 CZ ARG A 39 0.119 -6.585 7.117 1.00 27.30 C ATOM 593 NH1 ARG A 39 -0.750 -5.694 6.773 1.00 21.64 N ATOM 594 NH2 ARG A 39 1.310 -6.496 6.676 1.00 39.44 N ATOM 595 HA ARG A 39 -2.274 -10.835 5.356 1.00 0.00 H ATOM 596 HB2 ARG A 39 -1.246 -10.763 7.603 1.00 0.00 H ATOM 597 HB3 ARG A 39 -0.102 -9.545 6.991 1.00 0.00 H ATOM 598 HG2 ARG A 39 -2.327 -8.236 6.417 1.00 0.00 H ATOM 599 HG3 ARG A 39 -2.996 -9.281 7.691 1.00 0.00 H ATOM 600 HD2 ARG A 39 -1.486 -8.424 9.308 1.00 0.00 H ATOM 601 HD3 ARG A 39 -2.127 -7.016 8.429 1.00 0.00 H ATOM 602 HE ARG A 39 0.565 -8.188 8.264 1.00 0.00 H ATOM 603 HH12 ARG A 39 -0.473 -4.914 6.144 1.00 0.00 H ATOM 604 HH11 ARG A 39 -1.726 -5.757 7.125 1.00 0.00 H ATOM 605 HH22 ARG A 39 1.574 -5.711 6.047 1.00 0.00 H ATOM 606 HH21 ARG A 39 2.019 -7.208 6.945 1.00 0.00 H ATOM 607 H ARG A 39 0.105 -12.068 6.142 1.00 0.00 H ATOM 608 N HIS A 40 0.358 -9.319 4.204 1.00 15.03 N ATOM 609 CA HIS A 40 0.820 -8.309 3.261 1.00 19.69 C ATOM 610 C HIS A 40 0.221 -8.455 1.857 1.00 18.56 C ATOM 611 O HIS A 40 0.160 -7.484 1.100 1.00 17.41 O ATOM 612 CB HIS A 40 2.350 -8.331 3.188 1.00 17.16 C ATOM 613 CG HIS A 40 2.914 -7.496 2.083 1.00 22.92 C ATOM 614 ND1 HIS A 40 3.017 -6.123 2.166 1.00 25.91 N ATOM 615 CD2 HIS A 40 3.415 -7.839 0.871 1.00 24.10 C ATOM 616 CE1 HIS A 40 3.551 -5.657 1.049 1.00 24.43 C ATOM 617 NE2 HIS A 40 3.806 -6.678 0.250 1.00 27.32 N ATOM 618 HA HIS A 40 0.472 -7.348 3.639 1.00 0.00 H ATOM 619 HB2 HIS A 40 2.745 -7.961 4.134 1.00 0.00 H ATOM 620 HB3 HIS A 40 2.672 -9.362 3.039 1.00 0.00 H ATOM 621 HD2 HIS A 40 3.493 -8.848 0.465 1.00 0.00 H ATOM 622 HE1 HIS A 40 3.747 -4.608 0.826 1.00 0.00 H ATOM 623 H HIS A 40 1.052 -9.925 4.686 1.00 0.00 H ATOM 624 N SER A 41 -0.228 -9.656 1.500 1.00 18.32 N ATOM 625 CA SER A 41 -0.817 -9.845 0.171 1.00 13.58 C ATOM 626 C SER A 41 -2.108 -9.030 -0.019 1.00 18.74 C ATOM 627 O SER A 41 -2.540 -8.793 -1.148 1.00 15.97 O ATOM 628 CB SER A 41 -1.069 -11.338 -0.123 1.00 16.25 C ATOM 629 OG SER A 41 -2.058 -11.870 0.750 1.00 16.04 O ATOM 630 HA SER A 41 -0.088 -9.470 -0.548 1.00 0.00 H ATOM 631 HB2 SER A 41 -0.139 -11.890 0.013 1.00 0.00 H ATOM 632 HB3 SER A 41 -1.407 -11.446 -1.153 1.00 0.00 H ATOM 633 HG SER A 41 -1.753 -11.778 1.687 1.00 0.00 H ATOM 634 H SER A 41 -0.161 -10.456 2.161 1.00 0.00 H ATOM 635 N GLN A 42 -2.729 -8.626 1.087 1.00 25.06 N ATOM 636 CA GLN A 42 -3.894 -7.729 1.061 1.00 26.40 C ATOM 637 C GLN A 42 -4.911 -8.067 -0.038 1.00 30.16 C ATOM 638 O GLN A 42 -5.106 -7.296 -0.986 1.00 24.10 O ATOM 639 CB GLN A 42 -3.428 -6.275 0.932 1.00 31.03 C ATOM 640 CG GLN A 42 -2.448 -5.839 2.020 1.00 29.99 C ATOM 641 CD GLN A 42 -1.710 -4.553 1.670 1.00 33.68 C ATOM 642 OE1 GLN A 42 -0.536 -4.578 1.280 1.00 33.77 O ATOM 643 NE2 GLN A 42 -2.401 -3.424 1.793 1.00 36.00 N ATOM 644 HA GLN A 42 -4.418 -7.872 2.006 1.00 0.00 H ATOM 645 HB2 GLN A 42 -2.942 -6.155 -0.036 1.00 0.00 H ATOM 646 HB3 GLN A 42 -4.304 -5.628 0.980 1.00 0.00 H ATOM 647 HG2 GLN A 42 -3.002 -5.682 2.945 1.00 0.00 H ATOM 648 HG3 GLN A 42 -1.715 -6.632 2.167 1.00 0.00 H ATOM 649 HE22 GLN A 42 -3.386 -3.451 2.125 1.00 0.00 H ATOM 650 HE21 GLN A 42 -1.956 -2.514 1.557 1.00 0.00 H ATOM 651 H GLN A 42 -2.376 -8.958 2.007 1.00 0.00 H ATOM 652 N PRO A 43 -5.566 -9.227 0.083 1.00 27.58 N ATOM 653 CA PRO A 43 -6.476 -9.663 -0.982 1.00 29.62 C ATOM 654 C PRO A 43 -7.724 -8.797 -1.052 1.00 27.43 C ATOM 655 O PRO A 43 -8.231 -8.532 -2.136 1.00 30.30 O ATOM 656 CB PRO A 43 -6.856 -11.088 -0.557 1.00 27.67 C ATOM 657 CG PRO A 43 -6.625 -11.119 0.926 1.00 28.02 C ATOM 658 CD PRO A 43 -5.425 -10.239 1.144 1.00 31.52 C ATOM 659 HA PRO A 43 -6.015 -9.599 -1.967 1.00 0.00 H ATOM 660 HD3 PRO A 43 -5.449 -9.779 2.132 1.00 0.00 H ATOM 661 HD2 PRO A 43 -4.499 -10.802 1.030 1.00 0.00 H ATOM 662 HG3 PRO A 43 -6.423 -12.136 1.263 1.00 0.00 H ATOM 663 HG2 PRO A 43 -7.491 -10.727 1.459 1.00 0.00 H ATOM 664 HB2 PRO A 43 -7.902 -11.292 -0.788 1.00 0.00 H ATOM 665 HB3 PRO A 43 -6.225 -11.821 -1.060 1.00 0.00 H ATOM 666 N GLY A 44 -8.218 -8.358 0.094 1.00 13.04 N ATOM 667 CA GLY A 44 -9.444 -7.582 0.100 1.00 17.63 C ATOM 668 C GLY A 44 -10.637 -8.394 -0.376 1.00 14.46 C ATOM 669 O GLY A 44 -10.879 -9.491 0.121 1.00 17.03 O ATOM 670 HA3 GLY A 44 -9.319 -6.722 -0.558 1.00 0.00 H ATOM 671 HA2 GLY A 44 -9.636 -7.236 1.116 1.00 0.00 H ATOM 672 H GLY A 44 -7.729 -8.568 0.988 1.00 0.00 H ATOM 673 N LYS A 45 -11.405 -7.847 -1.313 1.00 16.74 N ATOM 674 CA LYS A 45 -12.656 -8.431 -1.754 1.00 16.31 C ATOM 675 C LYS A 45 -12.656 -9.433 -2.905 1.00 13.01 C ATOM 676 O LYS A 45 -13.641 -10.012 -3.196 1.00 15.50 O ATOM 677 CB LYS A 45 -13.610 -7.321 -2.100 1.00 18.60 C ATOM 678 CG LYS A 45 -14.013 -6.478 -0.884 1.00 23.43 C ATOM 679 CD LYS A 45 -14.353 -5.050 -1.259 1.00 34.39 C ATOM 680 CE LYS A 45 -14.140 -4.148 -0.166 1.00 29.72 C ATOM 681 NZ LYS A 45 -15.140 -3.189 -0.126 1.00 39.40 N ATOM 682 HA LYS A 45 -12.944 -9.041 -0.898 1.00 0.00 H ATOM 683 HB2 LYS A 45 -13.134 -6.669 -2.833 1.00 0.00 H ATOM 684 HB3 LYS A 45 -14.509 -7.758 -2.534 1.00 0.00 H ATOM 685 HG2 LYS A 45 -14.885 -6.934 -0.415 1.00 0.00 H ATOM 686 HG3 LYS A 45 -13.185 -6.467 -0.175 1.00 0.00 H ATOM 687 HD2 LYS A 45 -13.725 -4.745 -2.096 1.00 0.00 H ATOM 688 HD3 LYS A 45 -15.400 -5.003 -1.557 1.00 0.00 H ATOM 689 HE2 LYS A 45 -13.175 -3.656 -0.289 1.00 0.00 H ATOM 690 HE3 LYS A 45 -14.143 -4.709 0.768 1.00 0.00 H ATOM 691 HZ1 LYS A 45 -15.137 -2.650 -1.015 1.00 0.00 H ATOM 692 HZ2 LYS A 45 -16.062 -3.656 -0.005 1.00 0.00 H ATOM 693 HZ3 LYS A 45 -14.969 -2.545 0.672 1.00 0.00 H ATOM 694 H LYS A 45 -11.093 -6.957 -1.751 1.00 0.00 H ATOM 695 N THR A 46 -11.537 -9.586 -3.579 1.00 17.85 N ATOM 696 CA THR A 46 -11.408 -10.575 -4.643 1.00 16.04 C ATOM 697 C THR A 46 -9.991 -11.118 -4.664 1.00 16.53 C ATOM 698 O THR A 46 -9.106 -10.578 -4.010 1.00 19.35 O ATOM 699 CB THR A 46 -11.717 -9.986 -6.048 1.00 18.71 C ATOM 700 OG1 THR A 46 -10.821 -8.901 -6.336 1.00 19.89 O ATOM 701 CG2 THR A 46 -13.169 -9.510 -6.140 1.00 20.80 C ATOM 702 HA THR A 46 -12.134 -11.360 -4.432 1.00 0.00 H ATOM 703 HB THR A 46 -11.572 -10.775 -6.786 1.00 0.00 H ATOM 704 HG1 THR A 46 -9.888 -9.232 -6.320 1.00 0.00 H ATOM 705 HG23 THR A 46 -13.837 -10.342 -5.919 1.00 0.00 H ATOM 706 HG21 THR A 46 -13.334 -8.709 -5.419 1.00 0.00 H ATOM 707 HG22 THR A 46 -13.366 -9.141 -7.147 1.00 0.00 H ATOM 708 H THR A 46 -10.721 -8.985 -3.347 1.00 0.00 H ATOM 709 N ILE A 47 -9.777 -12.187 -5.417 1.00 15.08 N ATOM 710 CA ILE A 47 -8.438 -12.722 -5.603 1.00 14.18 C ATOM 711 C ILE A 47 -8.413 -13.516 -6.906 1.00 14.79 C ATOM 712 O ILE A 47 -9.443 -14.036 -7.326 1.00 16.26 O ATOM 713 CB ILE A 47 -8.051 -13.622 -4.407 1.00 15.75 C ATOM 714 CG1 ILE A 47 -6.594 -14.064 -4.511 1.00 18.09 C ATOM 715 CG2 ILE A 47 -8.980 -14.823 -4.319 1.00 17.04 C ATOM 716 CD1 ILE A 47 -6.075 -14.724 -3.236 1.00 19.20 C ATOM 717 HA ILE A 47 -7.714 -11.909 -5.656 1.00 0.00 H ATOM 718 HB ILE A 47 -8.160 -13.041 -3.491 1.00 0.00 H ATOM 719 HG12 ILE A 47 -6.505 -14.776 -5.331 1.00 0.00 H ATOM 720 HG13 ILE A 47 -5.980 -13.189 -4.723 1.00 0.00 H ATOM 721 HD11 ILE A 47 -6.148 -14.019 -2.408 1.00 0.00 H ATOM 722 HD12 ILE A 47 -6.674 -15.608 -3.016 1.00 0.00 H ATOM 723 HD13 ILE A 47 -5.034 -15.014 -3.377 1.00 0.00 H ATOM 724 HG21 ILE A 47 -10.005 -14.478 -4.185 1.00 0.00 H ATOM 725 HG22 ILE A 47 -8.908 -15.405 -5.238 1.00 0.00 H ATOM 726 HG23 ILE A 47 -8.690 -15.443 -3.471 1.00 0.00 H ATOM 727 H ILE A 47 -10.582 -12.652 -5.884 1.00 0.00 H ATOM 728 N TRP A 48 -7.264 -13.585 -7.570 1.00 10.22 N ATOM 729 CA TRP A 48 -7.145 -14.451 -8.739 1.00 10.91 C ATOM 730 C TRP A 48 -6.496 -15.778 -8.351 1.00 13.50 C ATOM 731 O TRP A 48 -5.353 -15.811 -7.894 1.00 14.45 O ATOM 732 CB TRP A 48 -6.328 -13.797 -9.856 1.00 14.47 C ATOM 733 CG TRP A 48 -6.944 -12.584 -10.491 1.00 11.72 C ATOM 734 CD1 TRP A 48 -7.857 -12.563 -11.511 1.00 15.32 C ATOM 735 CD2 TRP A 48 -6.654 -11.217 -10.187 1.00 12.98 C ATOM 736 NE1 TRP A 48 -8.153 -11.266 -11.851 1.00 12.58 N ATOM 737 CE2 TRP A 48 -7.425 -10.414 -11.049 1.00 9.37 C ATOM 738 CE3 TRP A 48 -5.809 -10.582 -9.266 1.00 11.50 C ATOM 739 CZ2 TRP A 48 -7.395 -9.027 -11.019 1.00 11.77 C ATOM 740 CZ3 TRP A 48 -5.773 -9.200 -9.233 1.00 11.41 C ATOM 741 CH2 TRP A 48 -6.558 -8.436 -10.111 1.00 14.25 C ATOM 742 HA TRP A 48 -8.154 -14.625 -9.113 1.00 0.00 H ATOM 743 HB2 TRP A 48 -5.365 -13.504 -9.439 1.00 0.00 H ATOM 744 HB3 TRP A 48 -6.173 -14.541 -10.637 1.00 0.00 H ATOM 745 HE1 TRP A 48 -8.819 -10.974 -12.594 1.00 0.00 H ATOM 746 HD1 TRP A 48 -8.286 -13.446 -11.984 1.00 0.00 H ATOM 747 HZ2 TRP A 48 -8.013 -8.432 -11.691 1.00 0.00 H ATOM 748 HH2 TRP A 48 -6.500 -7.348 -10.069 1.00 0.00 H ATOM 749 HZ3 TRP A 48 -5.126 -8.697 -8.515 1.00 0.00 H ATOM 750 HE3 TRP A 48 -5.190 -11.168 -8.587 1.00 0.00 H ATOM 751 H TRP A 48 -6.448 -13.021 -7.256 1.00 0.00 H ATOM 752 N ILE A 49 -7.229 -16.867 -8.534 1.00 15.36 N ATOM 753 CA ILE A 49 -6.700 -18.196 -8.260 1.00 16.85 C ATOM 754 C ILE A 49 -6.471 -18.892 -9.592 1.00 18.37 C ATOM 755 O ILE A 49 -7.425 -19.256 -10.286 1.00 19.52 O ATOM 756 CB ILE A 49 -7.659 -19.009 -7.362 1.00 18.90 C ATOM 757 CG1 ILE A 49 -7.975 -18.203 -6.098 1.00 19.17 C ATOM 758 CG2 ILE A 49 -7.053 -20.372 -7.022 1.00 18.42 C ATOM 759 CD1 ILE A 49 -9.003 -18.836 -5.163 1.00 16.92 C ATOM 760 HA ILE A 49 -5.760 -18.115 -7.715 1.00 0.00 H ATOM 761 HB ILE A 49 -8.590 -19.194 -7.897 1.00 0.00 H ATOM 762 HG12 ILE A 49 -7.047 -18.072 -5.541 1.00 0.00 H ATOM 763 HG13 ILE A 49 -8.354 -17.228 -6.405 1.00 0.00 H ATOM 764 HD11 ILE A 49 -9.946 -18.963 -5.695 1.00 0.00 H ATOM 765 HD12 ILE A 49 -8.639 -19.808 -4.829 1.00 0.00 H ATOM 766 HD13 ILE A 49 -9.155 -18.188 -4.300 1.00 0.00 H ATOM 767 HG21 ILE A 49 -6.873 -20.928 -7.942 1.00 0.00 H ATOM 768 HG22 ILE A 49 -6.111 -20.228 -6.493 1.00 0.00 H ATOM 769 HG23 ILE A 49 -7.745 -20.928 -6.389 1.00 0.00 H ATOM 770 H ILE A 49 -8.205 -16.770 -8.881 1.00 0.00 H ATOM 771 N GLU A 50 -5.203 -19.052 -9.953 1.00 14.23 N ATOM 772 CA GLU A 50 -4.841 -19.664 -11.220 1.00 16.03 C ATOM 773 C GLU A 50 -5.583 -18.930 -12.351 1.00 21.58 C ATOM 774 O GLU A 50 -6.206 -19.539 -13.226 1.00 21.52 O ATOM 775 CB GLU A 50 -5.118 -21.173 -11.158 1.00 23.95 C ATOM 776 CG GLU A 50 -4.900 -21.725 -9.732 1.00 26.14 C ATOM 777 CD GLU A 50 -4.171 -23.064 -9.669 1.00 29.79 C ATOM 778 OE1 GLU A 50 -4.672 -24.042 -10.269 1.00 26.50 O ATOM 779 OE2 GLU A 50 -3.111 -23.143 -8.990 1.00 26.30 O ATOM 780 HA GLU A 50 -3.776 -19.565 -11.427 1.00 0.00 H ATOM 781 HB2 GLU A 50 -6.150 -21.358 -11.457 1.00 0.00 H ATOM 782 HB3 GLU A 50 -4.445 -21.686 -11.845 1.00 0.00 H ATOM 783 HG2 GLU A 50 -4.317 -20.995 -9.171 1.00 0.00 H ATOM 784 HG3 GLU A 50 -5.876 -21.848 -9.263 1.00 0.00 H ATOM 785 H GLU A 50 -4.450 -18.731 -9.312 1.00 0.00 H ATOM 786 N HIS A 51 -5.502 -17.601 -12.277 1.00 18.74 N ATOM 787 CA HIS A 51 -6.091 -16.656 -13.232 1.00 25.63 C ATOM 788 C HIS A 51 -7.604 -16.456 -13.132 1.00 21.27 C ATOM 789 O HIS A 51 -8.151 -15.560 -13.778 1.00 27.26 O ATOM 790 CB HIS A 51 -5.693 -16.989 -14.674 1.00 29.76 C ATOM 791 CG HIS A 51 -4.214 -17.006 -14.900 1.00 30.64 C ATOM 792 ND1 HIS A 51 -3.404 -15.929 -14.616 1.00 30.15 N ATOM 793 CD2 HIS A 51 -3.400 -17.973 -15.386 1.00 35.16 C ATOM 794 CE1 HIS A 51 -2.155 -16.228 -14.919 1.00 31.58 C ATOM 795 NE2 HIS A 51 -2.124 -17.464 -15.389 1.00 35.24 N ATOM 796 HA HIS A 51 -5.661 -15.699 -12.938 1.00 0.00 H ATOM 797 HB2 HIS A 51 -6.091 -17.973 -14.923 1.00 0.00 H ATOM 798 HB3 HIS A 51 -6.134 -16.242 -15.334 1.00 0.00 H ATOM 799 HD2 HIS A 51 -3.701 -18.968 -15.713 1.00 0.00 H ATOM 800 HE1 HIS A 51 -1.295 -15.569 -14.802 1.00 0.00 H ATOM 801 H HIS A 51 -4.977 -17.200 -11.474 1.00 0.00 H ATOM 802 N LYS A 52 -8.279 -17.270 -12.331 1.00 16.77 N ATOM 803 CA LYS A 52 -9.722 -17.126 -12.159 1.00 17.17 C ATOM 804 C LYS A 52 -10.081 -16.077 -11.104 1.00 16.82 C ATOM 805 O LYS A 52 -9.635 -16.149 -9.957 1.00 14.07 O ATOM 806 CB LYS A 52 -10.364 -18.476 -11.811 1.00 22.47 C ATOM 807 CG LYS A 52 -11.890 -18.466 -11.806 1.00 24.60 C ATOM 808 CD LYS A 52 -12.443 -19.831 -11.413 1.00 28.83 C ATOM 809 CE LYS A 52 -13.960 -19.832 -11.362 1.00 32.55 C ATOM 810 NZ LYS A 52 -14.500 -21.134 -10.873 1.00 38.56 N ATOM 811 HA LYS A 52 -10.122 -16.777 -13.111 1.00 0.00 H ATOM 812 HB2 LYS A 52 -10.030 -19.211 -12.543 1.00 0.00 H ATOM 813 HB3 LYS A 52 -10.022 -18.771 -10.819 1.00 0.00 H ATOM 814 HG2 LYS A 52 -12.240 -17.720 -11.092 1.00 0.00 H ATOM 815 HG3 LYS A 52 -12.249 -18.209 -12.803 1.00 0.00 H ATOM 816 HD2 LYS A 52 -12.114 -20.569 -12.144 1.00 0.00 H ATOM 817 HD3 LYS A 52 -12.057 -20.099 -10.430 1.00 0.00 H ATOM 818 HE2 LYS A 52 -14.347 -19.644 -12.364 1.00 0.00 H ATOM 819 HE3 LYS A 52 -14.291 -19.039 -10.691 1.00 0.00 H ATOM 820 HZ1 LYS A 52 -14.195 -21.896 -11.511 1.00 0.00 H ATOM 821 HZ2 LYS A 52 -14.141 -21.319 -9.914 1.00 0.00 H ATOM 822 HZ3 LYS A 52 -15.539 -21.092 -10.854 1.00 0.00 H ATOM 823 H LYS A 52 -7.774 -18.021 -11.819 1.00 0.00 H ATOM 824 N LEU A 53 -10.898 -15.100 -11.486 1.00 20.18 N ATOM 825 CA LEU A 53 -11.323 -14.075 -10.531 1.00 20.15 C ATOM 826 C LEU A 53 -12.412 -14.599 -9.600 1.00 18.54 C ATOM 827 O LEU A 53 -13.505 -14.947 -10.044 1.00 19.05 O ATOM 828 CB LEU A 53 -11.793 -12.807 -11.262 1.00 17.37 C ATOM 829 CG LEU A 53 -12.163 -11.618 -10.374 1.00 17.38 C ATOM 830 CD1 LEU A 53 -10.969 -11.200 -9.503 1.00 15.80 C ATOM 831 CD2 LEU A 53 -12.643 -10.445 -11.216 1.00 16.60 C ATOM 832 HA LEU A 53 -10.460 -13.816 -9.918 1.00 0.00 H ATOM 833 HB2 LEU A 53 -10.991 -12.489 -11.928 1.00 0.00 H ATOM 834 HB3 LEU A 53 -12.671 -13.068 -11.852 1.00 0.00 H ATOM 835 HG LEU A 53 -12.977 -11.925 -9.718 1.00 0.00 H ATOM 836 HD21 LEU A 53 -11.850 -10.141 -11.899 1.00 0.00 H ATOM 837 HD22 LEU A 53 -13.521 -10.745 -11.787 1.00 0.00 H ATOM 838 HD23 LEU A 53 -12.900 -9.611 -10.562 1.00 0.00 H ATOM 839 HD11 LEU A 53 -10.673 -12.036 -8.869 1.00 0.00 H ATOM 840 HD12 LEU A 53 -10.135 -10.916 -10.144 1.00 0.00 H ATOM 841 HD13 LEU A 53 -11.255 -10.353 -8.880 1.00 0.00 H ATOM 842 H LEU A 53 -11.237 -15.064 -12.469 1.00 0.00 H ATOM 843 N VAL A 54 -12.106 -14.634 -8.304 1.00 18.53 N ATOM 844 CA VAL A 54 -12.985 -15.225 -7.295 1.00 20.54 C ATOM 845 C VAL A 54 -13.313 -14.234 -6.181 1.00 17.28 C ATOM 846 O VAL A 54 -12.442 -13.477 -5.735 1.00 18.75 O ATOM 847 CB VAL A 54 -12.325 -16.482 -6.686 1.00 19.06 C ATOM 848 CG1 VAL A 54 -13.106 -16.980 -5.469 1.00 22.80 C ATOM 849 CG2 VAL A 54 -12.187 -17.560 -7.751 1.00 21.58 C ATOM 850 HA VAL A 54 -13.916 -15.499 -7.792 1.00 0.00 H ATOM 851 HB VAL A 54 -11.327 -16.222 -6.334 1.00 0.00 H ATOM 852 HG11 VAL A 54 -13.132 -16.197 -4.711 1.00 0.00 H ATOM 853 HG12 VAL A 54 -14.123 -17.231 -5.769 1.00 0.00 H ATOM 854 HG13 VAL A 54 -12.617 -17.865 -5.063 1.00 0.00 H ATOM 855 HG21 VAL A 54 -13.174 -17.820 -8.133 1.00 0.00 H ATOM 856 HG22 VAL A 54 -11.567 -17.186 -8.566 1.00 0.00 H ATOM 857 HG23 VAL A 54 -11.721 -18.443 -7.314 1.00 0.00 H ATOM 858 H VAL A 54 -11.202 -14.223 -7.996 1.00 0.00 H ATOM 859 N ASN A 55 -14.564 -14.220 -5.718 1.00 15.58 N ATOM 860 CA ASN A 55 -14.921 -13.332 -4.614 1.00 20.13 C ATOM 861 C ASN A 55 -14.346 -13.819 -3.298 1.00 14.23 C ATOM 862 O ASN A 55 -14.326 -15.025 -3.029 1.00 18.99 O ATOM 863 CB ASN A 55 -16.441 -13.208 -4.452 1.00 22.54 C ATOM 864 CG ASN A 55 -17.097 -12.467 -5.595 1.00 22.89 C ATOM 865 OD1 ASN A 55 -17.968 -13.010 -6.271 1.00 33.12 O ATOM 866 ND2 ASN A 55 -16.695 -11.223 -5.809 1.00 23.69 N ATOM 867 HA ASN A 55 -14.499 -12.359 -4.864 1.00 0.00 H ATOM 868 HB2 ASN A 55 -16.868 -14.209 -4.396 1.00 0.00 H ATOM 869 HB3 ASN A 55 -16.650 -12.673 -3.525 1.00 0.00 H ATOM 870 HD22 ASN A 55 -15.954 -10.806 -5.210 1.00 0.00 H ATOM 871 HD21 ASN A 55 -17.120 -10.664 -6.576 1.00 0.00 H ATOM 872 H ASN A 55 -15.284 -14.840 -6.142 1.00 0.00 H ATOM 873 N VAL A 56 -13.880 -12.881 -2.486 1.00 16.59 N ATOM 874 CA VAL A 56 -13.501 -13.167 -1.100 1.00 16.05 C ATOM 875 C VAL A 56 -14.625 -12.699 -0.173 1.00 16.23 C ATOM 876 O VAL A 56 -14.923 -11.506 -0.087 1.00 17.15 O ATOM 877 CB VAL A 56 -12.177 -12.484 -0.720 1.00 15.79 C ATOM 878 CG1 VAL A 56 -11.885 -12.679 0.774 1.00 15.78 C ATOM 879 CG2 VAL A 56 -11.039 -13.046 -1.571 1.00 15.40 C ATOM 880 HA VAL A 56 -13.351 -14.241 -0.994 1.00 0.00 H ATOM 881 HB VAL A 56 -12.261 -11.415 -0.913 1.00 0.00 H ATOM 882 HG11 VAL A 56 -12.693 -12.241 1.361 1.00 0.00 H ATOM 883 HG12 VAL A 56 -11.811 -13.744 0.993 1.00 0.00 H ATOM 884 HG13 VAL A 56 -10.944 -12.189 1.026 1.00 0.00 H ATOM 885 HG21 VAL A 56 -10.953 -14.119 -1.398 1.00 0.00 H ATOM 886 HG22 VAL A 56 -11.250 -12.862 -2.624 1.00 0.00 H ATOM 887 HG23 VAL A 56 -10.105 -12.557 -1.295 1.00 0.00 H ATOM 888 H VAL A 56 -13.780 -11.910 -2.844 1.00 0.00 H ATOM 889 N LEU A 57 -15.258 -13.643 0.515 1.00 10.88 N ATOM 890 CA LEU A 57 -16.444 -13.314 1.304 1.00 17.08 C ATOM 891 C LEU A 57 -16.073 -12.649 2.623 1.00 16.28 C ATOM 892 O LEU A 57 -16.823 -11.836 3.164 1.00 20.82 O ATOM 893 CB LEU A 57 -17.293 -14.565 1.544 1.00 16.11 C ATOM 894 CG LEU A 57 -17.750 -15.248 0.254 1.00 20.23 C ATOM 895 CD1 LEU A 57 -18.501 -16.541 0.533 1.00 23.52 C ATOM 896 CD2 LEU A 57 -18.582 -14.296 -0.586 1.00 24.88 C ATOM 897 HA LEU A 57 -17.035 -12.598 0.733 1.00 0.00 H ATOM 898 HB2 LEU A 57 -16.704 -15.277 2.122 1.00 0.00 H ATOM 899 HB3 LEU A 57 -18.176 -14.279 2.115 1.00 0.00 H ATOM 900 HG LEU A 57 -16.859 -15.516 -0.314 1.00 0.00 H ATOM 901 HD21 LEU A 57 -19.460 -13.985 -0.019 1.00 0.00 H ATOM 902 HD22 LEU A 57 -17.984 -13.421 -0.841 1.00 0.00 H ATOM 903 HD23 LEU A 57 -18.898 -14.800 -1.499 1.00 0.00 H ATOM 904 HD11 LEU A 57 -17.850 -17.229 1.072 1.00 0.00 H ATOM 905 HD12 LEU A 57 -19.382 -16.325 1.137 1.00 0.00 H ATOM 906 HD13 LEU A 57 -18.807 -16.993 -0.411 1.00 0.00 H ATOM 907 H LEU A 57 -14.908 -14.622 0.492 1.00 0.00 H ATOM 908 N ASP A 58 -14.904 -12.997 3.141 1.00 16.24 N ATOM 909 CA ASP A 58 -14.438 -12.421 4.388 1.00 18.54 C ATOM 910 C ASP A 58 -12.934 -12.573 4.412 1.00 16.91 C ATOM 911 O ASP A 58 -12.399 -13.588 3.955 1.00 16.85 O ATOM 912 CB ASP A 58 -15.066 -13.152 5.575 1.00 19.54 C ATOM 913 CG ASP A 58 -14.983 -12.362 6.873 1.00 19.58 C ATOM 914 OD1 ASP A 58 -14.651 -11.154 6.838 1.00 23.95 O ATOM 915 OD2 ASP A 58 -15.256 -12.960 7.932 1.00 24.04 O ATOM 916 HA ASP A 58 -14.721 -11.371 4.461 1.00 0.00 H ATOM 917 HB2 ASP A 58 -16.116 -13.342 5.350 1.00 0.00 H ATOM 918 HB3 ASP A 58 -14.548 -14.101 5.712 1.00 0.00 H ATOM 919 H ASP A 58 -14.312 -13.694 2.646 1.00 0.00 H ATOM 920 N ALA A 59 -12.258 -11.546 4.910 1.00 21.86 N ATOM 921 CA ALA A 59 -10.827 -11.609 5.131 1.00 21.16 C ATOM 922 C ALA A 59 -10.542 -11.150 6.555 1.00 24.31 C ATOM 923 O ALA A 59 -10.844 -10.012 6.929 1.00 27.78 O ATOM 924 CB ALA A 59 -10.086 -10.753 4.119 1.00 21.79 C ATOM 925 HA ALA A 59 -10.475 -12.632 5.000 1.00 0.00 H ATOM 926 HB1 ALA A 59 -10.303 -11.112 3.113 1.00 0.00 H ATOM 927 HB2 ALA A 59 -10.411 -9.717 4.214 1.00 0.00 H ATOM 928 HB3 ALA A 59 -9.014 -10.817 4.306 1.00 0.00 H ATOM 929 H ALA A 59 -12.769 -10.672 5.148 1.00 0.00 H ATOM 930 N VAL A 60 -9.985 -12.054 7.349 1.00 14.91 N ATOM 931 CA VAL A 60 -9.678 -11.773 8.737 1.00 13.93 C ATOM 932 C VAL A 60 -8.171 -11.752 8.936 1.00 16.94 C ATOM 933 O VAL A 60 -7.502 -12.768 8.762 1.00 15.01 O ATOM 934 CB VAL A 60 -10.284 -12.825 9.677 1.00 19.30 C ATOM 935 CG1 VAL A 60 -9.988 -12.474 11.124 1.00 21.73 C ATOM 936 CG2 VAL A 60 -11.784 -12.941 9.447 1.00 22.78 C ATOM 937 HA VAL A 60 -10.110 -10.802 8.978 1.00 0.00 H ATOM 938 HB VAL A 60 -9.829 -13.791 9.459 1.00 0.00 H ATOM 939 HG11 VAL A 60 -8.909 -12.441 11.275 1.00 0.00 H ATOM 940 HG12 VAL A 60 -10.418 -11.500 11.356 1.00 0.00 H ATOM 941 HG13 VAL A 60 -10.425 -13.230 11.777 1.00 0.00 H ATOM 942 HG21 VAL A 60 -12.256 -11.978 9.641 1.00 0.00 H ATOM 943 HG22 VAL A 60 -11.970 -13.237 8.415 1.00 0.00 H ATOM 944 HG23 VAL A 60 -12.197 -13.691 10.122 1.00 0.00 H ATOM 945 H VAL A 60 -9.762 -12.994 6.964 1.00 0.00 H ATOM 946 N GLU A 61 -7.648 -10.592 9.311 1.00 16.46 N ATOM 947 CA GLU A 61 -6.229 -10.465 9.614 1.00 16.61 C ATOM 948 C GLU A 61 -5.983 -10.838 11.073 1.00 18.05 C ATOM 949 O GLU A 61 -6.454 -10.154 11.980 1.00 21.65 O ATOM 950 CB GLU A 61 -5.769 -9.035 9.345 1.00 18.48 C ATOM 951 CG GLU A 61 -5.999 -8.595 7.915 1.00 19.35 C ATOM 952 CD GLU A 61 -5.426 -7.229 7.613 1.00 24.17 C ATOM 953 OE1 GLU A 61 -5.160 -6.463 8.561 1.00 27.74 O ATOM 954 OE2 GLU A 61 -5.247 -6.920 6.417 1.00 25.32 O ATOM 955 HA GLU A 61 -5.658 -11.140 8.976 1.00 0.00 H ATOM 956 HB2 GLU A 61 -6.317 -8.364 10.007 1.00 0.00 H ATOM 957 HB3 GLU A 61 -4.703 -8.967 9.562 1.00 0.00 H ATOM 958 HG2 GLU A 61 -5.533 -9.321 7.249 1.00 0.00 H ATOM 959 HG3 GLU A 61 -7.073 -8.570 7.728 1.00 0.00 H ATOM 960 H GLU A 61 -8.263 -9.757 9.390 1.00 0.00 H ATOM 961 N LEU A 62 -5.247 -11.920 11.299 1.00 14.88 N ATOM 962 CA LEU A 62 -5.068 -12.449 12.645 1.00 13.97 C ATOM 963 C LEU A 62 -4.138 -11.611 13.514 1.00 15.44 C ATOM 964 O LEU A 62 -3.083 -11.164 13.071 1.00 16.25 O ATOM 965 CB LEU A 62 -4.549 -13.888 12.601 1.00 12.69 C ATOM 966 CG LEU A 62 -5.304 -14.902 11.752 1.00 15.12 C ATOM 967 CD1 LEU A 62 -4.775 -16.288 12.121 1.00 15.35 C ATOM 968 CD2 LEU A 62 -6.808 -14.816 11.987 1.00 20.81 C ATOM 969 HA LEU A 62 -6.057 -12.416 13.102 1.00 0.00 H ATOM 970 HB2 LEU A 62 -3.526 -13.851 12.227 1.00 0.00 H ATOM 971 HB3 LEU A 62 -4.547 -14.262 13.625 1.00 0.00 H ATOM 972 HG LEU A 62 -5.143 -14.697 10.694 1.00 0.00 H ATOM 973 HD21 LEU A 62 -7.022 -15.016 13.037 1.00 0.00 H ATOM 974 HD22 LEU A 62 -7.159 -13.817 11.727 1.00 0.00 H ATOM 975 HD23 LEU A 62 -7.314 -15.554 11.365 1.00 0.00 H ATOM 976 HD11 LEU A 62 -3.706 -16.335 11.913 1.00 0.00 H ATOM 977 HD12 LEU A 62 -4.949 -16.471 13.181 1.00 0.00 H ATOM 978 HD13 LEU A 62 -5.295 -17.043 11.531 1.00 0.00 H ATOM 979 H LEU A 62 -4.789 -12.400 10.498 1.00 0.00 H ATOM 980 N VAL A 63 -4.546 -11.411 14.763 1.00 18.12 N ATOM 981 CA VAL A 63 -3.688 -10.806 15.774 1.00 18.34 C ATOM 982 C VAL A 63 -3.716 -11.687 17.018 1.00 15.88 C ATOM 983 O VAL A 63 -4.612 -12.518 17.177 1.00 16.84 O ATOM 984 CB VAL A 63 -4.157 -9.388 16.142 1.00 18.01 C ATOM 985 CG1 VAL A 63 -3.948 -8.433 14.979 1.00 15.25 C ATOM 986 CG2 VAL A 63 -5.627 -9.407 16.584 1.00 14.04 C ATOM 987 HA VAL A 63 -2.677 -10.727 15.373 1.00 0.00 H ATOM 988 HB VAL A 63 -3.556 -9.031 16.978 1.00 0.00 H ATOM 989 HG11 VAL A 63 -2.889 -8.399 14.724 1.00 0.00 H ATOM 990 HG12 VAL A 63 -4.519 -8.781 14.118 1.00 0.00 H ATOM 991 HG13 VAL A 63 -4.287 -7.437 15.263 1.00 0.00 H ATOM 992 HG21 VAL A 63 -6.245 -9.785 15.770 1.00 0.00 H ATOM 993 HG22 VAL A 63 -5.735 -10.054 17.455 1.00 0.00 H ATOM 994 HG23 VAL A 63 -5.941 -8.395 16.840 1.00 0.00 H ATOM 995 H VAL A 63 -5.510 -11.696 15.028 1.00 0.00 H ATOM 996 N ASP A 64 -2.739 -11.529 17.904 1.00 18.50 N ATOM 997 CA ASP A 64 -2.776 -12.299 19.141 1.00 21.00 C ATOM 998 C ASP A 64 -3.592 -11.577 20.207 1.00 23.75 C ATOM 999 O ASP A 64 -4.211 -10.551 19.928 1.00 20.73 O ATOM 1000 CB ASP A 64 -1.372 -12.665 19.641 1.00 22.45 C ATOM 1001 CG ASP A 64 -0.515 -11.458 19.971 1.00 22.64 C ATOM 1002 OD1 ASP A 64 0.711 -11.655 20.120 1.00 26.39 O ATOM 1003 OD2 ASP A 64 -1.029 -10.321 20.082 1.00 22.77 O ATOM 1004 HA ASP A 64 -3.276 -13.242 18.923 1.00 0.00 H ATOM 1005 HB2 ASP A 64 -1.473 -13.273 20.540 1.00 0.00 H ATOM 1006 HB3 ASP A 64 -0.869 -13.244 18.866 1.00 0.00 H ATOM 1007 H ASP A 64 -1.960 -10.866 17.718 1.00 0.00 H ATOM 1008 N GLU A 65 -3.594 -12.116 21.423 1.00 33.68 N ATOM 1009 CA GLU A 65 -4.350 -11.519 22.522 1.00 33.63 C ATOM 1010 C GLU A 65 -4.022 -10.035 22.666 1.00 30.42 C ATOM 1011 O GLU A 65 -4.893 -9.224 22.966 1.00 34.07 O ATOM 1012 CB GLU A 65 -4.038 -12.236 23.836 1.00 34.06 C ATOM 1013 CG GLU A 65 -4.042 -13.751 23.753 1.00 47.18 C ATOM 1014 CD GLU A 65 -3.240 -14.392 24.876 1.00 51.61 C ATOM 1015 OE1 GLU A 65 -2.288 -15.146 24.571 1.00 48.78 O ATOM 1016 OE2 GLU A 65 -3.551 -14.129 26.061 1.00 53.26 O ATOM 1017 HA GLU A 65 -5.410 -11.626 22.294 1.00 0.00 H ATOM 1018 HB2 GLU A 65 -3.051 -11.917 24.170 1.00 0.00 H ATOM 1019 HB3 GLU A 65 -4.784 -11.935 24.572 1.00 0.00 H ATOM 1020 HG2 GLU A 65 -5.072 -14.103 23.812 1.00 0.00 H ATOM 1021 HG3 GLU A 65 -3.611 -14.051 22.798 1.00 0.00 H ATOM 1022 H GLU A 65 -3.045 -12.982 21.596 1.00 0.00 H ATOM 1023 N GLN A 66 -2.762 -9.685 22.443 1.00 27.36 N ATOM 1024 CA GLN A 66 -2.296 -8.320 22.647 1.00 24.77 C ATOM 1025 C GLN A 66 -2.586 -7.405 21.463 1.00 27.56 C ATOM 1026 O GLN A 66 -2.246 -6.225 21.488 1.00 28.58 O ATOM 1027 CB GLN A 66 -0.799 -8.317 22.955 1.00 29.15 C ATOM 1028 CG GLN A 66 -0.434 -9.071 24.225 1.00 32.37 C ATOM 1029 CD GLN A 66 0.462 -10.265 23.962 1.00 38.77 C ATOM 1030 OE1 GLN A 66 0.026 -11.415 24.056 1.00 43.42 O ATOM 1031 NE2 GLN A 66 1.722 -10.000 23.626 1.00 33.18 N ATOM 1032 HA GLN A 66 -2.853 -7.923 23.496 1.00 0.00 H ATOM 1033 HB2 GLN A 66 -0.274 -8.778 22.118 1.00 0.00 H ATOM 1034 HB3 GLN A 66 -0.472 -7.283 23.062 1.00 0.00 H ATOM 1035 HG2 GLN A 66 0.084 -8.388 24.899 1.00 0.00 H ATOM 1036 HG3 GLN A 66 -1.351 -9.421 24.698 1.00 0.00 H ATOM 1037 HE22 GLN A 66 2.046 -9.014 23.559 1.00 0.00 H ATOM 1038 HE21 GLN A 66 2.383 -10.779 23.430 1.00 0.00 H ATOM 1039 H GLN A 66 -2.088 -10.405 22.113 1.00 0.00 H ATOM 1040 N GLY A 67 -3.203 -7.952 20.422 1.00 32.11 N ATOM 1041 CA GLY A 67 -3.542 -7.166 19.252 1.00 29.79 C ATOM 1042 C GLY A 67 -2.368 -6.971 18.317 1.00 29.80 C ATOM 1043 O GLY A 67 -2.382 -6.087 17.458 1.00 32.27 O ATOM 1044 HA3 GLY A 67 -3.893 -6.187 19.579 1.00 0.00 H ATOM 1045 HA2 GLY A 67 -4.339 -7.674 18.709 1.00 0.00 H ATOM 1046 H GLY A 67 -3.447 -8.963 20.447 1.00 0.00 H ATOM 1047 N VAL A 68 -1.351 -7.809 18.474 1.00 22.95 N ATOM 1048 CA VAL A 68 -0.158 -7.717 17.649 1.00 24.11 C ATOM 1049 C VAL A 68 -0.279 -8.558 16.375 1.00 20.86 C ATOM 1050 O VAL A 68 -0.779 -9.682 16.409 1.00 19.95 O ATOM 1051 CB VAL A 68 1.102 -8.137 18.432 1.00 24.60 C ATOM 1052 CG1 VAL A 68 2.327 -8.057 17.531 1.00 26.45 C ATOM 1053 CG2 VAL A 68 1.279 -7.242 19.663 1.00 29.97 C ATOM 1054 HA VAL A 68 -0.060 -6.670 17.361 1.00 0.00 H ATOM 1055 HB VAL A 68 0.986 -9.167 18.768 1.00 0.00 H ATOM 1056 HG11 VAL A 68 2.194 -8.725 16.680 1.00 0.00 H ATOM 1057 HG12 VAL A 68 2.449 -7.034 17.176 1.00 0.00 H ATOM 1058 HG13 VAL A 68 3.211 -8.356 18.094 1.00 0.00 H ATOM 1059 HG21 VAL A 68 1.384 -6.205 19.345 1.00 0.00 H ATOM 1060 HG22 VAL A 68 0.407 -7.338 20.309 1.00 0.00 H ATOM 1061 HG23 VAL A 68 2.172 -7.548 20.208 1.00 0.00 H ATOM 1062 H VAL A 68 -1.409 -8.548 19.204 1.00 0.00 H ATOM 1063 N ASN A 69 0.188 -7.995 15.262 1.00 22.88 N ATOM 1064 CA ASN A 69 0.192 -8.660 13.955 1.00 22.24 C ATOM 1065 C ASN A 69 0.751 -10.082 13.992 1.00 19.27 C ATOM 1066 O ASN A 69 1.811 -10.327 14.566 1.00 19.76 O ATOM 1067 CB ASN A 69 1.014 -7.836 12.954 1.00 21.34 C ATOM 1068 CG ASN A 69 1.027 -8.442 11.545 1.00 22.33 C ATOM 1069 OD1 ASN A 69 2.081 -8.547 10.908 1.00 20.80 O ATOM 1070 ND2 ASN A 69 -0.139 -8.829 11.056 1.00 15.66 N ATOM 1071 HA ASN A 69 -0.852 -8.730 13.649 1.00 0.00 H ATOM 1072 HB2 ASN A 69 0.589 -6.834 12.897 1.00 0.00 H ATOM 1073 HB3 ASN A 69 2.041 -7.774 13.315 1.00 0.00 H ATOM 1074 HD22 ASN A 69 -1.003 -8.723 11.625 1.00 0.00 H ATOM 1075 HD21 ASN A 69 -0.192 -9.239 10.102 1.00 0.00 H ATOM 1076 H ASN A 69 0.571 -7.030 15.323 1.00 0.00 H ATOM 1077 N LEU A 70 0.035 -11.012 13.372 1.00 16.38 N ATOM 1078 CA LEU A 70 0.549 -12.364 13.183 1.00 12.57 C ATOM 1079 C LEU A 70 0.930 -12.611 11.723 1.00 14.32 C ATOM 1080 O LEU A 70 1.494 -13.660 11.390 1.00 13.08 O ATOM 1081 CB LEU A 70 -0.467 -13.398 13.662 1.00 12.39 C ATOM 1082 CG LEU A 70 -0.762 -13.356 15.166 1.00 14.56 C ATOM 1083 CD1 LEU A 70 -1.735 -14.454 15.529 1.00 16.75 C ATOM 1084 CD2 LEU A 70 0.531 -13.479 15.991 1.00 19.31 C ATOM 1085 HA LEU A 70 1.452 -12.467 13.784 1.00 0.00 H ATOM 1086 HB2 LEU A 70 -1.402 -13.229 13.127 1.00 0.00 H ATOM 1087 HB3 LEU A 70 -0.084 -14.389 13.418 1.00 0.00 H ATOM 1088 HG LEU A 70 -1.212 -12.392 15.403 1.00 0.00 H ATOM 1089 HD21 LEU A 70 1.020 -14.425 15.759 1.00 0.00 H ATOM 1090 HD22 LEU A 70 1.198 -12.653 15.744 1.00 0.00 H ATOM 1091 HD23 LEU A 70 0.287 -13.446 17.053 1.00 0.00 H ATOM 1092 HD11 LEU A 70 -2.663 -14.313 14.975 1.00 0.00 H ATOM 1093 HD12 LEU A 70 -1.302 -15.421 15.273 1.00 0.00 H ATOM 1094 HD13 LEU A 70 -1.939 -14.417 16.599 1.00 0.00 H ATOM 1095 H LEU A 70 -0.911 -10.772 13.014 1.00 0.00 H ATOM 1096 N GLU A 71 0.599 -11.642 10.867 1.00 16.16 N ATOM 1097 CA GLU A 71 0.964 -11.654 9.447 1.00 17.09 C ATOM 1098 C GLU A 71 0.270 -12.787 8.677 1.00 17.75 C ATOM 1099 O GLU A 71 0.802 -13.320 7.708 1.00 17.25 O ATOM 1100 CB GLU A 71 2.497 -11.681 9.282 1.00 18.48 C ATOM 1101 CG GLU A 71 3.019 -11.333 7.889 1.00 14.59 C ATOM 1102 CD GLU A 71 2.557 -9.967 7.386 1.00 19.65 C ATOM 1103 OE1 GLU A 71 2.168 -9.120 8.217 1.00 19.50 O ATOM 1104 OE2 GLU A 71 2.567 -9.745 6.151 1.00 19.23 O ATOM 1105 HA GLU A 71 0.601 -10.728 9.001 1.00 0.00 H ATOM 1106 HB2 GLU A 71 2.923 -10.968 9.988 1.00 0.00 H ATOM 1107 HB3 GLU A 71 2.843 -12.685 9.529 1.00 0.00 H ATOM 1108 HG2 GLU A 71 4.109 -11.339 7.918 1.00 0.00 H ATOM 1109 HG3 GLU A 71 2.671 -12.094 7.190 1.00 0.00 H ATOM 1110 H GLU A 71 0.052 -10.834 11.227 1.00 0.00 H ATOM 1111 N LEU A 72 -0.928 -13.150 9.125 1.00 12.50 N ATOM 1112 CA LEU A 72 -1.738 -14.137 8.421 1.00 10.70 C ATOM 1113 C LEU A 72 -3.098 -13.546 8.157 1.00 16.11 C ATOM 1114 O LEU A 72 -3.667 -12.876 9.029 1.00 13.36 O ATOM 1115 CB LEU A 72 -1.920 -15.395 9.269 1.00 10.53 C ATOM 1116 CG LEU A 72 -0.678 -16.237 9.554 1.00 11.17 C ATOM 1117 CD1 LEU A 72 -0.994 -17.257 10.646 1.00 11.67 C ATOM 1118 CD2 LEU A 72 -0.157 -16.930 8.308 1.00 12.93 C ATOM 1119 HA LEU A 72 -1.235 -14.402 7.491 1.00 0.00 H ATOM 1120 HB2 LEU A 72 -2.333 -15.085 10.229 1.00 0.00 H ATOM 1121 HB3 LEU A 72 -2.638 -16.035 8.756 1.00 0.00 H ATOM 1122 HG LEU A 72 0.112 -15.568 9.895 1.00 0.00 H ATOM 1123 HD21 LEU A 72 -0.929 -17.588 7.910 1.00 0.00 H ATOM 1124 HD22 LEU A 72 0.105 -16.182 7.560 1.00 0.00 H ATOM 1125 HD23 LEU A 72 0.726 -17.516 8.562 1.00 0.00 H ATOM 1126 HD11 LEU A 72 -1.295 -16.734 11.554 1.00 0.00 H ATOM 1127 HD12 LEU A 72 -1.804 -17.905 10.312 1.00 0.00 H ATOM 1128 HD13 LEU A 72 -0.107 -17.857 10.848 1.00 0.00 H ATOM 1129 H LEU A 72 -1.296 -12.720 9.998 1.00 0.00 H ATOM 1130 N THR A 73 -3.621 -13.796 6.962 1.00 11.38 N ATOM 1131 CA THR A 73 -5.005 -13.456 6.658 1.00 12.25 C ATOM 1132 C THR A 73 -5.803 -14.703 6.295 1.00 9.19 C ATOM 1133 O THR A 73 -5.425 -15.438 5.391 1.00 10.56 O ATOM 1134 CB THR A 73 -5.093 -12.412 5.534 1.00 10.11 C ATOM 1135 OG1 THR A 73 -4.473 -11.197 5.967 1.00 11.74 O ATOM 1136 CG2 THR A 73 -6.555 -12.142 5.176 1.00 12.47 C ATOM 1137 HA THR A 73 -5.440 -13.017 7.556 1.00 0.00 H ATOM 1138 HB THR A 73 -4.579 -12.794 4.652 1.00 0.00 H ATOM 1139 HG1 THR A 73 -4.529 -10.523 5.244 1.00 0.00 H ATOM 1140 HG23 THR A 73 -7.024 -13.069 4.847 1.00 0.00 H ATOM 1141 HG21 THR A 73 -7.078 -11.760 6.053 1.00 0.00 H ATOM 1142 HG22 THR A 73 -6.601 -11.405 4.374 1.00 0.00 H ATOM 1143 H THR A 73 -3.032 -14.242 6.230 1.00 0.00 H ATOM 1144 N LEU A 74 -6.881 -14.951 7.020 1.00 12.12 N ATOM 1145 CA LEU A 74 -7.821 -16.027 6.730 1.00 12.36 C ATOM 1146 C LEU A 74 -8.859 -15.559 5.746 1.00 13.64 C ATOM 1147 O LEU A 74 -9.468 -14.598 5.989 1.00 14.10 O ATOM 1148 CB LEU A 74 -8.580 -16.456 7.993 1.00 17.04 C ATOM 1149 CG LEU A 74 -7.785 -16.940 9.176 1.00 20.35 C ATOM 1150 CD1 LEU A 74 -8.563 -17.607 10.211 1.00 23.54 C ATOM 1151 CD2 LEU A 74 -6.720 -17.748 8.775 1.00 21.59 C ATOM 1152 HA LEU A 74 -7.238 -16.858 6.333 1.00 0.00 H ATOM 1153 HB2 LEU A 74 -9.163 -15.598 8.326 1.00 0.00 H ATOM 1154 HB3 LEU A 74 -9.254 -17.263 7.706 1.00 0.00 H ATOM 1155 HG LEU A 74 -7.404 -16.029 9.638 1.00 0.00 H ATOM 1156 HD21 LEU A 74 -7.105 -18.614 8.237 1.00 0.00 H ATOM 1157 HD22 LEU A 74 -6.059 -17.178 8.122 1.00 0.00 H ATOM 1158 HD23 LEU A 74 -6.167 -18.080 9.653 1.00 0.00 H ATOM 1159 HD11 LEU A 74 -9.314 -16.919 10.600 1.00 0.00 H ATOM 1160 HD12 LEU A 74 -9.055 -18.482 9.787 1.00 0.00 H ATOM 1161 HD13 LEU A 74 -7.900 -17.918 11.019 1.00 0.00 H ATOM 1162 H LEU A 74 -7.069 -14.344 7.843 1.00 0.00 H ATOM 1163 N ILE A 75 -8.997 -16.223 4.630 1.00 14.96 N ATOM 1164 CA ILE A 75 -9.987 -15.792 3.653 1.00 14.58 C ATOM 1165 C ILE A 75 -11.033 -16.869 3.466 1.00 14.19 C ATOM 1166 O ILE A 75 -10.748 -18.061 3.542 1.00 14.01 O ATOM 1167 CB ILE A 75 -9.367 -15.387 2.284 1.00 14.65 C ATOM 1168 CG1 ILE A 75 -8.643 -16.565 1.633 1.00 15.62 C ATOM 1169 CG2 ILE A 75 -8.440 -14.173 2.438 1.00 16.23 C ATOM 1170 CD1 ILE A 75 -8.198 -16.287 0.192 1.00 17.33 C ATOM 1171 HA ILE A 75 -10.453 -14.892 4.053 1.00 0.00 H ATOM 1172 HB ILE A 75 -10.182 -15.099 1.620 1.00 0.00 H ATOM 1173 HG12 ILE A 75 -7.760 -16.800 2.228 1.00 0.00 H ATOM 1174 HG13 ILE A 75 -9.315 -17.423 1.628 1.00 0.00 H ATOM 1175 HD11 ILE A 75 -9.072 -16.061 -0.420 1.00 0.00 H ATOM 1176 HD12 ILE A 75 -7.516 -15.437 0.181 1.00 0.00 H ATOM 1177 HD13 ILE A 75 -7.691 -17.166 -0.206 1.00 0.00 H ATOM 1178 HG21 ILE A 75 -9.010 -13.330 2.828 1.00 0.00 H ATOM 1179 HG22 ILE A 75 -7.634 -14.419 3.129 1.00 0.00 H ATOM 1180 HG23 ILE A 75 -8.021 -13.912 1.466 1.00 0.00 H ATOM 1181 H ILE A 75 -8.403 -17.055 4.440 1.00 0.00 H ATOM 1182 N THR A 76 -12.267 -16.435 3.255 1.00 15.76 N ATOM 1183 CA THR A 76 -13.348 -17.363 2.987 1.00 15.28 C ATOM 1184 C THR A 76 -13.748 -17.117 1.552 1.00 15.05 C ATOM 1185 O THR A 76 -14.042 -15.989 1.178 1.00 15.04 O ATOM 1186 CB THR A 76 -14.543 -17.122 3.922 1.00 15.87 C ATOM 1187 OG1 THR A 76 -14.136 -17.356 5.280 1.00 19.72 O ATOM 1188 CG2 THR A 76 -15.683 -18.074 3.559 1.00 20.66 C ATOM 1189 HA THR A 76 -13.030 -18.392 3.155 1.00 0.00 H ATOM 1190 HB THR A 76 -14.887 -16.093 3.814 1.00 0.00 H ATOM 1191 HG1 THR A 76 -13.400 -16.736 5.514 1.00 0.00 H ATOM 1192 HG23 THR A 76 -15.990 -17.895 2.529 1.00 0.00 H ATOM 1193 HG21 THR A 76 -15.342 -19.104 3.664 1.00 0.00 H ATOM 1194 HG22 THR A 76 -16.527 -17.900 4.227 1.00 0.00 H ATOM 1195 H THR A 76 -12.463 -15.414 3.282 1.00 0.00 H ATOM 1196 N LEU A 77 -13.720 -18.171 0.748 1.00 14.18 N ATOM 1197 CA LEU A 77 -13.912 -18.044 -0.699 1.00 15.93 C ATOM 1198 C LEU A 77 -15.350 -18.288 -1.142 1.00 22.81 C ATOM 1199 O LEU A 77 -16.057 -19.103 -0.560 1.00 22.60 O ATOM 1200 CB LEU A 77 -12.979 -19.004 -1.423 1.00 16.33 C ATOM 1201 CG LEU A 77 -11.508 -18.658 -1.199 1.00 13.85 C ATOM 1202 CD1 LEU A 77 -10.605 -19.791 -1.685 1.00 17.83 C ATOM 1203 CD2 LEU A 77 -11.184 -17.352 -1.903 1.00 14.26 C ATOM 1204 HA LEU A 77 -13.678 -17.012 -0.959 1.00 0.00 H ATOM 1205 HB2 LEU A 77 -13.162 -20.014 -1.057 1.00 0.00 H ATOM 1206 HB3 LEU A 77 -13.191 -18.962 -2.491 1.00 0.00 H ATOM 1207 HG LEU A 77 -11.326 -18.534 -0.132 1.00 0.00 H ATOM 1208 HD21 LEU A 77 -11.375 -17.459 -2.971 1.00 0.00 H ATOM 1209 HD22 LEU A 77 -11.811 -16.557 -1.499 1.00 0.00 H ATOM 1210 HD23 LEU A 77 -10.134 -17.105 -1.743 1.00 0.00 H ATOM 1211 HD11 LEU A 77 -10.840 -20.703 -1.136 1.00 0.00 H ATOM 1212 HD12 LEU A 77 -10.770 -19.954 -2.750 1.00 0.00 H ATOM 1213 HD13 LEU A 77 -9.563 -19.521 -1.515 1.00 0.00 H ATOM 1214 H LEU A 77 -13.557 -19.114 1.156 1.00 0.00 H ATOM 1215 N ASP A 78 -15.767 -17.560 -2.172 1.00 93.22 N ATOM 1216 CA ASP A 78 -17.101 -17.715 -2.743 1.00 94.54 C ATOM 1217 C ASP A 78 -17.016 -18.752 -3.839 1.00 98.64 C ATOM 1218 O ASP A 78 -16.860 -18.412 -5.013 1.00 95.05 O ATOM 1219 CB ASP A 78 -17.596 -16.388 -3.327 1.00 97.60 C ATOM 1220 CG ASP A 78 -19.065 -16.434 -3.741 1.00100.01 C ATOM 1221 OD1 ASP A 78 -19.722 -17.467 -3.509 1.00 98.52 O ATOM 1222 OD2 ASP A 78 -19.564 -15.423 -4.282 1.00107.03 O ATOM 1223 HA ASP A 78 -17.802 -18.025 -1.968 1.00 0.00 H ATOM 1224 HB2 ASP A 78 -17.470 -15.608 -2.576 1.00 0.00 H ATOM 1225 HB3 ASP A 78 -16.994 -16.147 -4.203 1.00 0.00 H ATOM 1226 H ASP A 78 -15.122 -16.857 -2.585 1.00 0.00 H ATOM 1227 N THR A 79 -17.101 -20.021 -3.450 1.00 19.41 N ATOM 1228 CA THR A 79 -16.987 -21.119 -4.401 1.00 23.96 C ATOM 1229 C THR A 79 -17.747 -22.342 -3.919 1.00 23.30 C ATOM 1230 O THR A 79 -18.069 -22.465 -2.737 1.00 24.63 O ATOM 1231 CB THR A 79 -15.515 -21.525 -4.623 1.00 25.11 C ATOM 1232 OG1 THR A 79 -15.444 -22.566 -5.608 1.00 25.55 O ATOM 1233 CG2 THR A 79 -14.901 -22.028 -3.319 1.00 23.99 C ATOM 1234 HA THR A 79 -17.413 -20.762 -5.339 1.00 0.00 H ATOM 1235 HB THR A 79 -14.961 -20.652 -4.967 1.00 0.00 H ATOM 1236 HG1 THR A 79 -15.827 -22.239 -6.460 1.00 0.00 H ATOM 1237 HG23 THR A 79 -14.953 -21.241 -2.567 1.00 0.00 H ATOM 1238 HG21 THR A 79 -15.454 -22.901 -2.971 1.00 0.00 H ATOM 1239 HG22 THR A 79 -13.860 -22.301 -3.491 1.00 0.00 H ATOM 1240 H THR A 79 -17.252 -20.235 -2.443 1.00 0.00 H ATOM 1241 N ASN A 80 -18.026 -23.249 -4.845 1.00 17.89 N ATOM 1242 CA ASN A 80 -18.647 -24.519 -4.510 1.00 24.41 C ATOM 1243 C ASN A 80 -17.599 -25.606 -4.284 1.00 24.20 C ATOM 1244 O ASN A 80 -17.919 -26.719 -3.851 1.00 24.89 O ATOM 1245 CB ASN A 80 -19.661 -24.937 -5.585 1.00 26.29 C ATOM 1246 CG ASN A 80 -19.401 -24.275 -6.936 1.00 23.66 C ATOM 1247 OD1 ASN A 80 -18.294 -23.812 -7.221 1.00 27.21 O ATOM 1248 ND2 ASN A 80 -20.429 -24.234 -7.777 1.00 26.01 N ATOM 1249 HA ASN A 80 -19.190 -24.387 -3.574 1.00 0.00 H ATOM 1250 HB2 ASN A 80 -19.609 -26.018 -5.711 1.00 0.00 H ATOM 1251 HB3 ASN A 80 -20.660 -24.660 -5.248 1.00 0.00 H ATOM 1252 HD22 ASN A 80 -21.346 -24.636 -7.497 1.00 0.00 H ATOM 1253 HD21 ASN A 80 -20.316 -23.800 -8.715 1.00 0.00 H ATOM 1254 H ASN A 80 -17.794 -23.046 -5.838 1.00 0.00 H ATOM 1255 N GLU A 81 -16.364 -25.255 -4.538 1.00247.70 N ATOM 1256 CA GLU A 81 -15.247 -26.149 -4.339 1.00248.95 C ATOM 1257 C GLU A 81 -14.814 -26.163 -2.870 1.00248.32 C ATOM 1258 O GLU A 81 -14.687 -25.142 -2.267 1.00247.88 O ATOM 1259 CB GLU A 81 -14.074 -25.746 -5.277 1.00250.88 C ATOM 1260 CG GLU A 81 -12.953 -26.806 -5.325 1.00254.27 C ATOM 1261 CD GLU A 81 -11.585 -26.299 -5.798 1.00257.71 C ATOM 1262 OE1 GLU A 81 -10.630 -26.403 -5.008 1.00255.78 O ATOM 1263 OE2 GLU A 81 -11.470 -25.821 -6.942 1.00260.24 O ATOM 1264 HA GLU A 81 -15.555 -27.163 -4.594 1.00 0.00 H ATOM 1265 HB2 GLU A 81 -14.466 -25.608 -6.285 1.00 0.00 H ATOM 1266 HB3 GLU A 81 -13.650 -24.807 -4.921 1.00 0.00 H ATOM 1267 HG2 GLU A 81 -12.832 -27.213 -4.321 1.00 0.00 H ATOM 1268 HG3 GLU A 81 -13.270 -27.600 -6.002 1.00 0.00 H ATOM 1269 H GLU A 81 -16.180 -24.296 -4.897 1.00 0.00 H ATOM 1270 N LYS A 82 -14.617 -27.353 -2.322 1.00121.23 N ATOM 1271 CA LYS A 82 -14.111 -27.485 -0.962 1.00115.94 C ATOM 1272 C LYS A 82 -12.681 -28.026 -0.982 1.00113.56 C ATOM 1273 O LYS A 82 -12.382 -28.983 -1.701 1.00115.48 O ATOM 1274 CB LYS A 82 -14.998 -28.437 -0.160 1.00120.33 C ATOM 1275 CG LYS A 82 -16.447 -28.007 -0.021 1.00124.34 C ATOM 1276 CD LYS A 82 -17.221 -29.036 0.795 1.00127.48 C ATOM 1277 CE LYS A 82 -18.512 -28.462 1.359 1.00129.94 C ATOM 1278 NZ LYS A 82 -18.910 -29.176 2.608 1.00127.06 N ATOM 1279 HA LYS A 82 -14.119 -26.501 -0.494 1.00 0.00 H ATOM 1280 HB2 LYS A 82 -14.980 -29.410 -0.652 1.00 0.00 H ATOM 1281 HB3 LYS A 82 -14.576 -28.529 0.841 1.00 0.00 H ATOM 1282 HG2 LYS A 82 -16.490 -27.041 0.482 1.00 0.00 H ATOM 1283 HG3 LYS A 82 -16.895 -27.920 -1.011 1.00 0.00 H ATOM 1284 HD2 LYS A 82 -17.463 -29.884 0.154 1.00 0.00 H ATOM 1285 HD3 LYS A 82 -16.595 -29.373 1.621 1.00 0.00 H ATOM 1286 HE2 LYS A 82 -19.304 -28.569 0.618 1.00 0.00 H ATOM 1287 HE3 LYS A 82 -18.366 -27.405 1.583 1.00 0.00 H ATOM 1288 HZ1 LYS A 82 -19.055 -30.184 2.398 1.00 0.00 H ATOM 1289 HZ2 LYS A 82 -18.158 -29.073 3.319 1.00 0.00 H ATOM 1290 HZ3 LYS A 82 -19.793 -28.766 2.974 1.00 0.00 H ATOM 1291 H LYS A 82 -14.828 -28.209 -2.873 1.00 0.00 H ATOM 1292 N PHE A 83 -11.792 -27.426 -0.193 1.00 21.04 N ATOM 1293 CA PHE A 83 -10.448 -27.973 -0.064 1.00 17.72 C ATOM 1294 C PHE A 83 -10.488 -29.227 0.780 1.00 18.11 C ATOM 1295 O PHE A 83 -11.242 -29.296 1.744 1.00 17.36 O ATOM 1296 CB PHE A 83 -9.510 -26.977 0.620 1.00 16.94 C ATOM 1297 CG PHE A 83 -9.315 -25.707 -0.139 1.00 18.73 C ATOM 1298 CD1 PHE A 83 -8.558 -25.689 -1.295 1.00 18.17 C ATOM 1299 CD2 PHE A 83 -9.882 -24.526 0.310 1.00 17.78 C ATOM 1300 CE1 PHE A 83 -8.372 -24.513 -1.994 1.00 16.34 C ATOM 1301 CE2 PHE A 83 -9.696 -23.349 -0.385 1.00 19.63 C ATOM 1302 CZ PHE A 83 -8.940 -23.346 -1.538 1.00 16.36 C ATOM 1303 HA PHE A 83 -10.081 -28.189 -1.067 1.00 0.00 H ATOM 1304 HB2 PHE A 83 -9.924 -26.732 1.598 1.00 0.00 H ATOM 1305 HB3 PHE A 83 -8.538 -27.453 0.747 1.00 0.00 H ATOM 1306 HD2 PHE A 83 -10.481 -24.526 1.221 1.00 0.00 H ATOM 1307 HE2 PHE A 83 -10.145 -22.424 -0.024 1.00 0.00 H ATOM 1308 HZ PHE A 83 -8.792 -22.417 -2.089 1.00 0.00 H ATOM 1309 HE1 PHE A 83 -7.776 -24.509 -2.906 1.00 0.00 H ATOM 1310 HD1 PHE A 83 -8.104 -26.611 -1.658 1.00 0.00 H ATOM 1311 H PHE A 83 -12.057 -26.567 0.331 1.00 0.00 H ATOM 1312 N ARG A 84 -9.671 -30.212 0.418 1.00 20.00 N ATOM 1313 CA ARG A 84 -9.453 -31.374 1.269 1.00 22.39 C ATOM 1314 C ARG A 84 -9.022 -30.864 2.641 1.00 23.17 C ATOM 1315 O ARG A 84 -8.136 -30.013 2.740 1.00 20.03 O ATOM 1316 CB ARG A 84 -8.378 -32.265 0.649 1.00 22.46 C ATOM 1317 CG ARG A 84 -8.040 -33.533 1.409 1.00 24.99 C ATOM 1318 CD ARG A 84 -6.867 -33.325 2.354 1.00 27.39 C ATOM 1319 NE ARG A 84 -5.665 -32.852 1.660 1.00 24.67 N ATOM 1320 CZ ARG A 84 -4.609 -33.610 1.381 1.00 28.61 C ATOM 1321 NH1 ARG A 84 -4.598 -34.893 1.725 1.00 31.26 N ATOM 1322 NH2 ARG A 84 -3.556 -33.084 0.760 1.00 28.97 N ATOM 1323 HA ARG A 84 -10.361 -31.969 1.368 1.00 0.00 H ATOM 1324 HB2 ARG A 84 -8.718 -32.554 -0.346 1.00 0.00 H ATOM 1325 HB3 ARG A 84 -7.465 -31.675 0.563 1.00 0.00 H ATOM 1326 HG2 ARG A 84 -8.911 -33.841 1.988 1.00 0.00 H ATOM 1327 HG3 ARG A 84 -7.785 -34.316 0.695 1.00 0.00 H ATOM 1328 HD2 ARG A 84 -6.639 -34.272 2.843 1.00 0.00 H ATOM 1329 HD3 ARG A 84 -7.150 -32.588 3.106 1.00 0.00 H ATOM 1330 HE ARG A 84 -5.637 -31.855 1.366 1.00 0.00 H ATOM 1331 HH12 ARG A 84 -3.770 -35.483 1.505 1.00 0.00 H ATOM 1332 HH11 ARG A 84 -5.417 -35.307 2.214 1.00 0.00 H ATOM 1333 HH22 ARG A 84 -2.731 -33.678 0.542 1.00 0.00 H ATOM 1334 HH21 ARG A 84 -3.559 -32.079 0.492 1.00 0.00 H ATOM 1335 H ARG A 84 -9.176 -30.151 -0.495 1.00 0.00 H ATOM 1336 N ASP A 85 -9.659 -31.369 3.695 1.00 17.39 N ATOM 1337 CA ASP A 85 -9.433 -30.873 5.055 1.00 16.05 C ATOM 1338 C ASP A 85 -8.080 -31.311 5.618 1.00 16.28 C ATOM 1339 O ASP A 85 -7.879 -32.484 5.930 1.00 16.31 O ATOM 1340 CB ASP A 85 -10.571 -31.359 5.961 1.00 16.23 C ATOM 1341 CG ASP A 85 -10.482 -30.818 7.377 1.00 20.37 C ATOM 1342 OD1 ASP A 85 -9.419 -30.296 7.776 1.00 14.96 O ATOM 1343 OD2 ASP A 85 -11.499 -30.922 8.102 1.00 20.81 O ATOM 1344 HA ASP A 85 -9.419 -29.784 5.020 1.00 0.00 H ATOM 1345 HB2 ASP A 85 -11.519 -31.041 5.527 1.00 0.00 H ATOM 1346 HB3 ASP A 85 -10.539 -32.448 6.003 1.00 0.00 H ATOM 1347 H ASP A 85 -10.340 -32.141 3.548 1.00 0.00 H ATOM 1348 N ILE A 86 -7.154 -30.368 5.764 1.00 16.12 N ATOM 1349 CA ILE A 86 -5.829 -30.709 6.260 1.00 14.22 C ATOM 1350 C ILE A 86 -5.590 -30.281 7.707 1.00 17.59 C ATOM 1351 O ILE A 86 -4.447 -30.184 8.161 1.00 14.97 O ATOM 1352 CB ILE A 86 -4.705 -30.160 5.329 1.00 15.07 C ATOM 1353 CG1 ILE A 86 -4.823 -28.643 5.162 1.00 14.17 C ATOM 1354 CG2 ILE A 86 -4.773 -30.826 3.971 1.00 18.90 C ATOM 1355 CD1 ILE A 86 -3.582 -28.038 4.518 1.00 17.08 C ATOM 1356 HA ILE A 86 -5.787 -31.798 6.248 1.00 0.00 H ATOM 1357 HB ILE A 86 -3.746 -30.387 5.794 1.00 0.00 H ATOM 1358 HG12 ILE A 86 -5.687 -28.425 4.534 1.00 0.00 H ATOM 1359 HG13 ILE A 86 -4.965 -28.191 6.144 1.00 0.00 H ATOM 1360 HD11 ILE A 86 -2.713 -28.244 5.143 1.00 0.00 H ATOM 1361 HD12 ILE A 86 -3.435 -28.478 3.532 1.00 0.00 H ATOM 1362 HD13 ILE A 86 -3.713 -26.960 4.421 1.00 0.00 H ATOM 1363 HG21 ILE A 86 -4.644 -31.902 4.089 1.00 0.00 H ATOM 1364 HG22 ILE A 86 -5.743 -30.623 3.516 1.00 0.00 H ATOM 1365 HG23 ILE A 86 -3.982 -30.431 3.334 1.00 0.00 H ATOM 1366 H ILE A 86 -7.378 -29.382 5.522 1.00 0.00 H ATOM 1367 N THR A 87 -6.666 -30.074 8.459 1.00 16.49 N ATOM 1368 CA THR A 87 -6.494 -29.595 9.823 1.00 13.94 C ATOM 1369 C THR A 87 -5.729 -30.584 10.701 1.00 16.28 C ATOM 1370 O THR A 87 -5.010 -30.168 11.604 1.00 17.35 O ATOM 1371 CB THR A 87 -7.848 -29.197 10.496 1.00 18.38 C ATOM 1372 OG1 THR A 87 -8.756 -30.296 10.424 1.00 18.49 O ATOM 1373 CG2 THR A 87 -8.459 -27.995 9.797 1.00 19.13 C ATOM 1374 HA THR A 87 -5.889 -28.692 9.738 1.00 0.00 H ATOM 1375 HB THR A 87 -7.657 -28.939 11.538 1.00 0.00 H ATOM 1376 HG1 THR A 87 -8.915 -30.530 9.475 1.00 0.00 H ATOM 1377 HG23 THR A 87 -7.767 -27.154 9.851 1.00 0.00 H ATOM 1378 HG21 THR A 87 -8.652 -28.242 8.753 1.00 0.00 H ATOM 1379 HG22 THR A 87 -9.395 -27.728 10.287 1.00 0.00 H ATOM 1380 H THR A 87 -7.617 -30.252 8.078 1.00 0.00 H ATOM 1381 N LYS A 88 -5.853 -31.881 10.423 1.00 15.80 N ATOM 1382 CA LYS A 88 -5.151 -32.878 11.226 1.00 18.72 C ATOM 1383 C LYS A 88 -3.623 -32.794 11.100 1.00 17.38 C ATOM 1384 O LYS A 88 -2.903 -33.280 11.975 1.00 19.72 O ATOM 1385 CB LYS A 88 -5.646 -34.298 10.921 1.00 20.61 C ATOM 1386 CG LYS A 88 -5.333 -34.809 9.526 1.00 21.31 C ATOM 1387 CD LYS A 88 -5.950 -36.201 9.317 1.00 23.46 C ATOM 1388 CE LYS A 88 -5.596 -36.779 7.959 1.00 27.52 C ATOM 1389 NZ LYS A 88 -6.050 -38.205 7.808 1.00 34.09 N ATOM 1390 HA LYS A 88 -5.390 -32.643 12.263 1.00 0.00 H ATOM 1391 HB2 LYS A 88 -5.186 -34.977 11.639 1.00 0.00 H ATOM 1392 HB3 LYS A 88 -6.728 -34.313 11.050 1.00 0.00 H ATOM 1393 HG2 LYS A 88 -5.744 -34.119 8.789 1.00 0.00 H ATOM 1394 HG3 LYS A 88 -4.252 -34.872 9.400 1.00 0.00 H ATOM 1395 HD2 LYS A 88 -5.580 -36.871 10.093 1.00 0.00 H ATOM 1396 HD3 LYS A 88 -7.034 -36.121 9.395 1.00 0.00 H ATOM 1397 HE2 LYS A 88 -4.514 -36.740 7.833 1.00 0.00 H ATOM 1398 HE3 LYS A 88 -6.072 -36.176 7.186 1.00 0.00 H ATOM 1399 HZ1 LYS A 88 -5.595 -38.791 8.536 1.00 0.00 H ATOM 1400 HZ2 LYS A 88 -7.083 -38.252 7.919 1.00 0.00 H ATOM 1401 HZ3 LYS A 88 -5.785 -38.554 6.865 1.00 0.00 H ATOM 1402 H LYS A 88 -6.453 -32.185 9.630 1.00 0.00 H ATOM 1403 N PHE A 89 -3.142 -32.150 10.033 1.00 14.74 N ATOM 1404 CA PHE A 89 -1.702 -32.006 9.800 1.00 15.71 C ATOM 1405 C PHE A 89 -1.143 -30.695 10.361 1.00 14.81 C ATOM 1406 O PHE A 89 0.076 -30.458 10.346 1.00 16.87 O ATOM 1407 CB PHE A 89 -1.387 -32.104 8.297 1.00 14.56 C ATOM 1408 CG PHE A 89 -1.950 -33.330 7.633 1.00 18.76 C ATOM 1409 CD1 PHE A 89 -1.429 -34.582 7.908 1.00 23.07 C ATOM 1410 CD2 PHE A 89 -2.986 -33.225 6.720 1.00 18.54 C ATOM 1411 CE1 PHE A 89 -1.938 -35.712 7.291 1.00 22.26 C ATOM 1412 CE2 PHE A 89 -3.501 -34.354 6.100 1.00 21.79 C ATOM 1413 CZ PHE A 89 -2.976 -35.597 6.393 1.00 23.11 C ATOM 1414 HA PHE A 89 -1.216 -32.824 10.332 1.00 0.00 H ATOM 1415 HB2 PHE A 89 -1.800 -31.225 7.802 1.00 0.00 H ATOM 1416 HB3 PHE A 89 -0.304 -32.114 8.173 1.00 0.00 H ATOM 1417 HD2 PHE A 89 -3.401 -32.245 6.486 1.00 0.00 H ATOM 1418 HE2 PHE A 89 -4.317 -34.260 5.384 1.00 0.00 H ATOM 1419 HZ PHE A 89 -3.383 -36.487 5.914 1.00 0.00 H ATOM 1420 HE1 PHE A 89 -1.518 -36.692 7.516 1.00 0.00 H ATOM 1421 HD1 PHE A 89 -0.608 -34.680 8.619 1.00 0.00 H ATOM 1422 H PHE A 89 -3.808 -31.739 9.348 1.00 0.00 H ATOM 1423 N ILE A 90 -2.025 -29.836 10.859 1.00 13.36 N ATOM 1424 CA ILE A 90 -1.580 -28.619 11.520 1.00 15.97 C ATOM 1425 C ILE A 90 -1.451 -28.857 13.022 1.00 14.65 C ATOM 1426 O ILE A 90 -2.408 -29.290 13.671 1.00 13.89 O ATOM 1427 CB ILE A 90 -2.557 -27.463 11.256 1.00 13.11 C ATOM 1428 CG1 ILE A 90 -2.753 -27.294 9.746 1.00 18.49 C ATOM 1429 CG2 ILE A 90 -2.046 -26.182 11.907 1.00 12.75 C ATOM 1430 CD1 ILE A 90 -3.630 -26.133 9.366 1.00 15.48 C ATOM 1431 HA ILE A 90 -0.606 -28.346 11.113 1.00 0.00 H ATOM 1432 HB ILE A 90 -3.526 -27.690 11.701 1.00 0.00 H ATOM 1433 HG12 ILE A 90 -1.775 -27.149 9.288 1.00 0.00 H ATOM 1434 HG13 ILE A 90 -3.204 -28.206 9.355 1.00 0.00 H ATOM 1435 HD11 ILE A 90 -4.619 -26.267 9.805 1.00 0.00 H ATOM 1436 HD12 ILE A 90 -3.188 -25.209 9.738 1.00 0.00 H ATOM 1437 HD13 ILE A 90 -3.717 -26.085 8.281 1.00 0.00 H ATOM 1438 HG21 ILE A 90 -1.955 -26.334 12.982 1.00 0.00 H ATOM 1439 HG22 ILE A 90 -1.071 -25.928 11.490 1.00 0.00 H ATOM 1440 HG23 ILE A 90 -2.748 -25.372 11.712 1.00 0.00 H ATOM 1441 H ILE A 90 -3.042 -30.035 10.776 1.00 0.00 H ATOM 1442 N PRO A 91 -0.264 -28.603 13.584 1.00 13.43 N ATOM 1443 CA PRO A 91 -0.098 -28.881 15.018 1.00 12.99 C ATOM 1444 C PRO A 91 -0.927 -27.958 15.913 1.00 12.12 C ATOM 1445 O PRO A 91 -1.242 -26.831 15.528 1.00 13.76 O ATOM 1446 CB PRO A 91 1.398 -28.643 15.254 1.00 16.16 C ATOM 1447 CG PRO A 91 1.839 -27.746 14.147 1.00 14.36 C ATOM 1448 CD PRO A 91 0.962 -28.068 12.962 1.00 14.77 C ATOM 1449 HA PRO A 91 -0.438 -29.886 15.269 1.00 0.00 H ATOM 1450 HD3 PRO A 91 0.746 -27.172 12.380 1.00 0.00 H ATOM 1451 HD2 PRO A 91 1.431 -28.813 12.319 1.00 0.00 H ATOM 1452 HG3 PRO A 91 2.885 -27.933 13.904 1.00 0.00 H ATOM 1453 HG2 PRO A 91 1.715 -26.702 14.435 1.00 0.00 H ATOM 1454 HB2 PRO A 91 1.560 -28.164 16.220 1.00 0.00 H ATOM 1455 HB3 PRO A 91 1.944 -29.586 15.221 1.00 0.00 H ATOM 1456 N GLU A 92 -1.263 -28.421 17.115 1.00 22.76 N ATOM 1457 CA GLU A 92 -2.049 -27.594 18.032 1.00 23.60 C ATOM 1458 C GLU A 92 -1.237 -26.434 18.592 1.00 26.45 C ATOM 1459 O GLU A 92 -1.783 -25.360 18.881 1.00 27.69 O ATOM 1460 CB GLU A 92 -2.678 -28.432 19.148 1.00 28.24 C ATOM 1461 CG GLU A 92 -3.963 -29.129 18.701 1.00 29.82 C ATOM 1462 CD GLU A 92 -4.821 -29.577 19.864 1.00 34.45 C ATOM 1463 OE1 GLU A 92 -5.995 -29.915 19.635 1.00 28.65 O ATOM 1464 OE2 GLU A 92 -4.321 -29.581 21.007 1.00 38.01 O ATOM 1465 HA GLU A 92 -2.863 -27.161 17.451 1.00 0.00 H ATOM 1466 HB2 GLU A 92 -1.961 -29.189 19.464 1.00 0.00 H ATOM 1467 HB3 GLU A 92 -2.909 -27.778 19.989 1.00 0.00 H ATOM 1468 HG2 GLU A 92 -4.540 -28.437 18.088 1.00 0.00 H ATOM 1469 HG3 GLU A 92 -3.697 -30.003 18.107 1.00 0.00 H ATOM 1470 H GLU A 92 -0.966 -29.375 17.404 1.00 0.00 H ATOM 1471 N ASN A 93 0.068 -26.650 18.724 1.00 22.67 N ATOM 1472 CA ASN A 93 0.982 -25.600 19.145 1.00 23.31 C ATOM 1473 C ASN A 93 2.011 -25.321 18.061 1.00 21.06 C ATOM 1474 O ASN A 93 2.453 -26.229 17.366 1.00 22.29 O ATOM 1475 CB ASN A 93 1.687 -25.997 20.438 1.00 27.61 C ATOM 1476 CG ASN A 93 0.712 -26.350 21.542 1.00 29.04 C ATOM 1477 OD1 ASN A 93 0.133 -25.470 22.180 1.00 34.74 O ATOM 1478 ND2 ASN A 93 0.511 -27.641 21.760 1.00 31.48 N ATOM 1479 HA ASN A 93 0.403 -24.694 19.321 1.00 0.00 H ATOM 1480 HB2 ASN A 93 2.321 -26.862 20.240 1.00 0.00 H ATOM 1481 HB3 ASN A 93 2.306 -25.163 20.770 1.00 0.00 H ATOM 1482 HD22 ASN A 93 1.023 -28.349 21.196 1.00 0.00 H ATOM 1483 HD21 ASN A 93 -0.159 -27.946 22.495 1.00 0.00 H ATOM 1484 H ASN A 93 0.446 -27.597 18.520 1.00 0.00 H ATOM 1485 N ILE A 94 2.385 -24.058 17.926 1.00 16.67 N ATOM 1486 CA ILE A 94 3.372 -23.673 16.938 1.00 15.69 C ATOM 1487 C ILE A 94 4.618 -24.507 17.172 1.00 18.69 C ATOM 1488 O ILE A 94 5.158 -24.542 18.286 1.00 19.72 O ATOM 1489 CB ILE A 94 3.640 -22.168 16.995 1.00 15.51 C ATOM 1490 CG1 ILE A 94 2.394 -21.439 16.476 1.00 18.97 C ATOM 1491 CG2 ILE A 94 4.860 -21.801 16.163 1.00 19.25 C ATOM 1492 CD1 ILE A 94 2.456 -19.949 16.569 1.00 19.52 C ATOM 1493 HA ILE A 94 3.008 -23.868 15.929 1.00 0.00 H ATOM 1494 HB ILE A 94 3.847 -21.870 18.023 1.00 0.00 H ATOM 1495 HG12 ILE A 94 2.255 -21.708 15.429 1.00 0.00 H ATOM 1496 HG13 ILE A 94 1.536 -21.780 17.055 1.00 0.00 H ATOM 1497 HD11 ILE A 94 2.581 -19.656 17.611 1.00 0.00 H ATOM 1498 HD12 ILE A 94 3.301 -19.585 15.984 1.00 0.00 H ATOM 1499 HD13 ILE A 94 1.532 -19.523 16.179 1.00 0.00 H ATOM 1500 HG21 ILE A 94 5.733 -22.328 16.549 1.00 0.00 H ATOM 1501 HG22 ILE A 94 4.690 -22.088 15.125 1.00 0.00 H ATOM 1502 HG23 ILE A 94 5.028 -20.726 16.221 1.00 0.00 H ATOM 1503 H ILE A 94 1.964 -23.331 18.539 1.00 0.00 H ATOM 1504 N SER A 95 5.038 -25.213 16.125 1.00 26.43 N ATOM 1505 CA SER A 95 6.079 -26.226 16.243 1.00 29.81 C ATOM 1506 C SER A 95 7.266 -25.968 15.335 1.00 26.66 C ATOM 1507 O SER A 95 7.103 -25.670 14.149 1.00 28.92 O ATOM 1508 CB SER A 95 5.513 -27.614 15.916 1.00 29.50 C ATOM 1509 OG SER A 95 4.334 -27.883 16.657 1.00 33.53 O ATOM 1510 HA SER A 95 6.426 -26.180 17.275 1.00 0.00 H ATOM 1511 HB2 SER A 95 6.262 -28.368 16.157 1.00 0.00 H ATOM 1512 HB3 SER A 95 5.281 -27.660 14.852 1.00 0.00 H ATOM 1513 HG SER A 95 3.647 -27.205 16.439 1.00 0.00 H ATOM 1514 H SER A 95 4.610 -25.036 15.194 1.00 0.00 H ATOM 1515 N THR A 96 8.465 -26.124 15.886 1.00 18.91 N ATOM 1516 CA THR A 96 9.678 -26.121 15.077 1.00 19.53 C ATOM 1517 C THR A 96 9.821 -27.454 14.346 1.00 23.18 C ATOM 1518 O THR A 96 9.079 -28.398 14.601 1.00 22.78 O ATOM 1519 CB THR A 96 10.917 -25.912 15.966 1.00 19.10 C ATOM 1520 OG1 THR A 96 10.945 -26.932 16.977 1.00 26.65 O ATOM 1521 CG2 THR A 96 10.859 -24.540 16.631 1.00 23.74 C ATOM 1522 HA THR A 96 9.605 -25.306 14.357 1.00 0.00 H ATOM 1523 HB THR A 96 11.816 -25.970 15.352 1.00 0.00 H ATOM 1524 HG1 THR A 96 10.124 -26.872 17.528 1.00 0.00 H ATOM 1525 HG23 THR A 96 10.838 -23.766 15.864 1.00 0.00 H ATOM 1526 HG21 THR A 96 9.959 -24.472 17.243 1.00 0.00 H ATOM 1527 HG22 THR A 96 11.739 -24.405 17.260 1.00 0.00 H ATOM 1528 H THR A 96 8.540 -26.251 16.916 1.00 0.00 H ATOM 1529 N ALA A 97 10.776 -27.541 13.431 1.00 18.70 N ATOM 1530 CA ALA A 97 11.011 -28.798 12.737 1.00 18.00 C ATOM 1531 C ALA A 97 12.431 -28.857 12.216 1.00 22.42 C ATOM 1532 O ALA A 97 13.061 -27.828 12.002 1.00 23.95 O ATOM 1533 CB ALA A 97 10.020 -28.970 11.595 1.00 21.67 C ATOM 1534 HA ALA A 97 10.867 -29.614 13.445 1.00 0.00 H ATOM 1535 HB1 ALA A 97 9.005 -28.969 11.993 1.00 0.00 H ATOM 1536 HB2 ALA A 97 10.135 -28.148 10.889 1.00 0.00 H ATOM 1537 HB3 ALA A 97 10.212 -29.916 11.088 1.00 0.00 H ATOM 1538 H ALA A 97 11.359 -26.709 13.209 1.00 0.00 H ATOM 1539 N SER A 98 12.937 -30.067 12.011 1.00105.47 N ATOM 1540 CA SER A 98 14.248 -30.230 11.407 1.00106.01 C ATOM 1541 C SER A 98 14.087 -30.462 9.910 1.00104.53 C ATOM 1542 O SER A 98 13.118 -31.091 9.475 1.00108.22 O ATOM 1543 CB SER A 98 14.976 -31.421 12.026 1.00107.97 C ATOM 1544 OG SER A 98 14.379 -32.633 11.606 1.00113.89 O ATOM 1545 HA SER A 98 14.833 -29.328 11.585 1.00 0.00 H ATOM 1546 HB2 SER A 98 14.922 -31.351 13.112 1.00 0.00 H ATOM 1547 HB3 SER A 98 16.020 -31.407 11.713 1.00 0.00 H ATOM 1548 HG SER A 98 14.429 -32.700 10.620 1.00 0.00 H ATOM 1549 H SER A 98 12.389 -30.907 12.286 1.00 0.00 H ATOM 1550 N ASP A 99 15.030 -29.951 9.126 1.00 24.74 N ATOM 1551 CA ASP A 99 15.106 -30.288 7.713 1.00 25.94 C ATOM 1552 C ASP A 99 13.753 -30.113 7.011 1.00 23.32 C ATOM 1553 O ASP A 99 13.254 -31.034 6.370 1.00 25.30 O ATOM 1554 CB ASP A 99 15.594 -31.736 7.572 1.00 31.52 C ATOM 1555 CG ASP A 99 15.799 -32.150 6.134 1.00 40.13 C ATOM 1556 OD1 ASP A 99 16.284 -31.323 5.332 1.00 37.86 O ATOM 1557 OD2 ASP A 99 15.479 -33.316 5.809 1.00 45.68 O ATOM 1558 HA ASP A 99 15.808 -29.607 7.232 1.00 0.00 H ATOM 1559 HB2 ASP A 99 16.541 -31.837 8.102 1.00 0.00 H ATOM 1560 HB3 ASP A 99 14.855 -32.398 8.023 1.00 0.00 H ATOM 1561 H ASP A 99 15.729 -29.296 9.531 1.00 0.00 H ATOM 1562 N ALA A 100 13.165 -28.925 7.130 1.00 19.62 N ATOM 1563 CA ALA A 100 11.839 -28.692 6.552 1.00 19.83 C ATOM 1564 C ALA A 100 11.903 -28.412 5.060 1.00 17.41 C ATOM 1565 O ALA A 100 12.955 -28.064 4.522 1.00 19.51 O ATOM 1566 CB ALA A 100 11.114 -27.559 7.279 1.00 15.97 C ATOM 1567 HA ALA A 100 11.271 -29.612 6.687 1.00 0.00 H ATOM 1568 HB1 ALA A 100 10.996 -27.821 8.331 1.00 0.00 H ATOM 1569 HB2 ALA A 100 11.698 -26.643 7.195 1.00 0.00 H ATOM 1570 HB3 ALA A 100 10.133 -27.409 6.828 1.00 0.00 H ATOM 1571 H ALA A 100 13.650 -28.157 7.637 1.00 0.00 H ATOM 1572 N THR A 101 10.762 -28.567 4.400 1.00 16.71 N ATOM 1573 CA THR A 101 10.614 -28.202 2.997 1.00 18.41 C ATOM 1574 C THR A 101 9.680 -26.989 2.890 1.00 19.15 C ATOM 1575 O THR A 101 8.635 -26.953 3.535 1.00 19.16 O ATOM 1576 CB THR A 101 10.055 -29.372 2.184 1.00 21.85 C ATOM 1577 OG1 THR A 101 10.971 -30.477 2.233 1.00 24.15 O ATOM 1578 CG2 THR A 101 9.841 -28.970 0.724 1.00 18.73 C ATOM 1579 HA THR A 101 11.594 -27.950 2.591 1.00 0.00 H ATOM 1580 HB THR A 101 9.096 -29.658 2.616 1.00 0.00 H ATOM 1581 HG1 THR A 101 11.095 -30.760 3.174 1.00 0.00 H ATOM 1582 HG23 THR A 101 9.146 -28.131 0.677 1.00 0.00 H ATOM 1583 HG21 THR A 101 10.795 -28.678 0.285 1.00 0.00 H ATOM 1584 HG22 THR A 101 9.429 -29.815 0.172 1.00 0.00 H ATOM 1585 H THR A 101 9.943 -28.964 4.903 1.00 0.00 H ATOM 1586 N LEU A 102 10.079 -25.986 2.113 1.00 17.69 N ATOM 1587 CA LEU A 102 9.217 -24.847 1.822 1.00 16.43 C ATOM 1588 C LEU A 102 8.527 -25.128 0.487 1.00 15.17 C ATOM 1589 O LEU A 102 9.191 -25.335 -0.526 1.00 13.07 O ATOM 1590 CB LEU A 102 10.037 -23.544 1.740 1.00 13.76 C ATOM 1591 CG LEU A 102 9.328 -22.229 1.376 1.00 16.76 C ATOM 1592 CD1 LEU A 102 8.195 -21.894 2.347 1.00 14.30 C ATOM 1593 CD2 LEU A 102 10.328 -21.063 1.315 1.00 16.14 C ATOM 1594 HA LEU A 102 8.482 -24.716 2.617 1.00 0.00 H ATOM 1595 HB2 LEU A 102 10.499 -23.397 2.716 1.00 0.00 H ATOM 1596 HB3 LEU A 102 10.814 -23.704 0.993 1.00 0.00 H ATOM 1597 HG LEU A 102 8.888 -22.374 0.389 1.00 0.00 H ATOM 1598 HD21 LEU A 102 10.807 -20.945 2.287 1.00 0.00 H ATOM 1599 HD22 LEU A 102 11.084 -21.274 0.559 1.00 0.00 H ATOM 1600 HD23 LEU A 102 9.799 -20.146 1.056 1.00 0.00 H ATOM 1601 HD11 LEU A 102 7.455 -22.694 2.330 1.00 0.00 H ATOM 1602 HD12 LEU A 102 8.599 -21.793 3.354 1.00 0.00 H ATOM 1603 HD13 LEU A 102 7.726 -20.957 2.047 1.00 0.00 H ATOM 1604 H LEU A 102 11.034 -26.015 1.701 1.00 0.00 H ATOM 1605 N VAL A 103 7.198 -25.175 0.480 1.00 12.62 N ATOM 1606 CA VAL A 103 6.490 -25.464 -0.763 1.00 16.53 C ATOM 1607 C VAL A 103 5.952 -24.177 -1.378 1.00 13.13 C ATOM 1608 O VAL A 103 5.108 -23.502 -0.791 1.00 10.80 O ATOM 1609 CB VAL A 103 5.336 -26.473 -0.568 1.00 11.36 C ATOM 1610 CG1 VAL A 103 4.643 -26.728 -1.893 1.00 13.77 C ATOM 1611 CG2 VAL A 103 5.849 -27.786 0.041 1.00 13.77 C ATOM 1612 HA VAL A 103 7.213 -25.922 -1.439 1.00 0.00 H ATOM 1613 HB VAL A 103 4.615 -26.045 0.129 1.00 0.00 H ATOM 1614 HG11 VAL A 103 4.241 -25.791 -2.277 1.00 0.00 H ATOM 1615 HG12 VAL A 103 5.361 -27.136 -2.605 1.00 0.00 H ATOM 1616 HG13 VAL A 103 3.831 -27.440 -1.746 1.00 0.00 H ATOM 1617 HG21 VAL A 103 6.591 -28.228 -0.624 1.00 0.00 H ATOM 1618 HG22 VAL A 103 6.303 -27.582 1.011 1.00 0.00 H ATOM 1619 HG23 VAL A 103 5.015 -28.477 0.167 1.00 0.00 H ATOM 1620 H VAL A 103 6.665 -25.006 1.357 1.00 0.00 H ATOM 1621 N ILE A 104 6.465 -23.840 -2.555 1.00 12.92 N ATOM 1622 CA ILE A 104 6.090 -22.621 -3.258 1.00 14.00 C ATOM 1623 C ILE A 104 5.345 -23.009 -4.522 1.00 13.88 C ATOM 1624 O ILE A 104 5.717 -23.964 -5.203 1.00 14.34 O ATOM 1625 CB ILE A 104 7.342 -21.798 -3.606 1.00 17.51 C ATOM 1626 CG1 ILE A 104 7.980 -21.273 -2.325 1.00 15.19 C ATOM 1627 CG2 ILE A 104 7.018 -20.636 -4.560 1.00 14.12 C ATOM 1628 CD1 ILE A 104 9.479 -21.080 -2.435 1.00 17.87 C ATOM 1629 HA ILE A 104 5.451 -22.007 -2.623 1.00 0.00 H ATOM 1630 HB ILE A 104 8.044 -22.452 -4.123 1.00 0.00 H ATOM 1631 HG12 ILE A 104 7.525 -20.313 -2.080 1.00 0.00 H ATOM 1632 HG13 ILE A 104 7.781 -21.984 -1.523 1.00 0.00 H ATOM 1633 HD11 ILE A 104 9.951 -22.034 -2.669 1.00 0.00 H ATOM 1634 HD12 ILE A 104 9.695 -20.363 -3.227 1.00 0.00 H ATOM 1635 HD13 ILE A 104 9.866 -20.705 -1.488 1.00 0.00 H ATOM 1636 HG21 ILE A 104 6.602 -21.033 -5.486 1.00 0.00 H ATOM 1637 HG22 ILE A 104 6.293 -19.972 -4.089 1.00 0.00 H ATOM 1638 HG23 ILE A 104 7.931 -20.082 -4.779 1.00 0.00 H ATOM 1639 H ILE A 104 7.164 -24.473 -2.993 1.00 0.00 H ATOM 1640 N ASN A 105 4.267 -22.295 -4.822 1.00 15.24 N ATOM 1641 CA ASN A 105 3.520 -22.559 -6.034 1.00 15.70 C ATOM 1642 C ASN A 105 2.865 -21.284 -6.537 1.00 16.94 C ATOM 1643 O ASN A 105 1.775 -20.926 -6.105 1.00 13.59 O ATOM 1644 CB ASN A 105 2.475 -23.647 -5.788 1.00 16.59 C ATOM 1645 CG ASN A 105 1.867 -24.172 -7.072 1.00 14.21 C ATOM 1646 OD1 ASN A 105 2.509 -24.156 -8.126 1.00 15.42 O ATOM 1647 ND2 ASN A 105 0.626 -24.658 -6.990 1.00 16.10 N ATOM 1648 HA ASN A 105 4.208 -22.915 -6.800 1.00 0.00 H ATOM 1649 HB2 ASN A 105 2.950 -24.475 -5.262 1.00 0.00 H ATOM 1650 HB3 ASN A 105 1.679 -23.233 -5.168 1.00 0.00 H ATOM 1651 HD22 ASN A 105 0.124 -24.651 -6.079 1.00 0.00 H ATOM 1652 HD21 ASN A 105 0.162 -25.044 -7.837 1.00 0.00 H ATOM 1653 H ASN A 105 3.956 -21.538 -4.180 1.00 0.00 H ATOM 1654 N THR A 106 3.560 -20.577 -7.419 1.00 13.73 N ATOM 1655 CA THR A 106 2.996 -19.395 -8.059 1.00 14.10 C ATOM 1656 C THR A 106 3.201 -19.534 -9.554 1.00 16.84 C ATOM 1657 O THR A 106 3.891 -20.446 -10.002 1.00 16.10 O ATOM 1658 CB THR A 106 3.660 -18.085 -7.597 1.00 15.86 C ATOM 1659 OG1 THR A 106 4.954 -17.952 -8.204 1.00 16.77 O ATOM 1660 CG2 THR A 106 3.792 -18.035 -6.071 1.00 13.94 C ATOM 1661 HA THR A 106 1.942 -19.338 -7.786 1.00 0.00 H ATOM 1662 HB THR A 106 3.024 -17.256 -7.909 1.00 0.00 H ATOM 1663 HG1 THR A 106 5.374 -17.108 -7.902 1.00 0.00 H ATOM 1664 HG23 THR A 106 2.805 -18.137 -5.619 1.00 0.00 H ATOM 1665 HG21 THR A 106 4.432 -18.851 -5.736 1.00 0.00 H ATOM 1666 HG22 THR A 106 4.232 -17.082 -5.777 1.00 0.00 H ATOM 1667 H THR A 106 4.528 -20.873 -7.659 1.00 0.00 H ATOM 1668 N GLU A 107 2.620 -18.617 -10.322 1.00 15.79 N ATOM 1669 CA GLU A 107 2.724 -18.703 -11.770 1.00 17.95 C ATOM 1670 C GLU A 107 4.189 -18.665 -12.186 1.00 16.51 C ATOM 1671 O GLU A 107 4.599 -19.390 -13.092 1.00 19.28 O ATOM 1672 CB GLU A 107 1.962 -17.565 -12.448 1.00 18.95 C ATOM 1673 CG GLU A 107 2.180 -17.544 -13.958 1.00 18.59 C ATOM 1674 CD GLU A 107 1.479 -16.401 -14.651 1.00 27.31 C ATOM 1675 OE1 GLU A 107 0.732 -15.655 -13.986 1.00 28.04 O ATOM 1676 OE2 GLU A 107 1.683 -16.245 -15.875 1.00 33.60 O ATOM 1677 HA GLU A 107 2.279 -19.646 -12.087 1.00 0.00 H ATOM 1678 HB2 GLU A 107 0.897 -17.687 -12.248 1.00 0.00 H ATOM 1679 HB3 GLU A 107 2.302 -16.617 -12.031 1.00 0.00 H ATOM 1680 HG2 GLU A 107 3.250 -17.462 -14.151 1.00 0.00 H ATOM 1681 HG3 GLU A 107 1.808 -18.480 -14.374 1.00 0.00 H ATOM 1682 H GLU A 107 2.090 -17.836 -9.886 1.00 0.00 H ATOM 1683 N HIS A 108 4.960 -17.814 -11.515 1.00 25.54 N ATOM 1684 CA HIS A 108 6.370 -17.598 -11.834 1.00 28.05 C ATOM 1685 C HIS A 108 7.265 -18.650 -11.187 1.00 30.27 C ATOM 1686 O HIS A 108 8.351 -18.944 -11.688 1.00 29.03 O ATOM 1687 CB HIS A 108 6.818 -16.194 -11.395 1.00 29.49 C ATOM 1688 CG HIS A 108 6.202 -15.084 -12.187 1.00 36.36 C ATOM 1689 ND1 HIS A 108 6.156 -13.782 -11.736 1.00 38.96 N ATOM 1690 CD2 HIS A 108 5.603 -15.082 -13.403 1.00 37.58 C ATOM 1691 CE1 HIS A 108 5.560 -13.026 -12.640 1.00 36.88 C ATOM 1692 NE2 HIS A 108 5.214 -13.789 -13.661 1.00 38.10 N ATOM 1693 HA HIS A 108 6.471 -17.686 -12.916 1.00 0.00 H ATOM 1694 HB2 HIS A 108 6.548 -16.059 -10.348 1.00 0.00 H ATOM 1695 HB3 HIS A 108 7.901 -16.131 -11.500 1.00 0.00 H ATOM 1696 HD2 HIS A 108 5.457 -15.944 -14.054 1.00 0.00 H ATOM 1697 HE1 HIS A 108 5.383 -11.954 -12.557 1.00 0.00 H ATOM 1698 H HIS A 108 4.541 -17.278 -10.728 1.00 0.00 H ATOM 1699 N MET A 109 6.812 -19.209 -10.067 1.00 16.41 N ATOM 1700 CA MET A 109 7.564 -20.257 -9.375 1.00 17.57 C ATOM 1701 C MET A 109 6.683 -21.481 -9.102 1.00 18.56 C ATOM 1702 O MET A 109 6.326 -21.761 -7.954 1.00 17.24 O ATOM 1703 CB MET A 109 8.141 -19.724 -8.061 1.00 19.29 C ATOM 1704 CG MET A 109 8.861 -18.377 -8.187 1.00 20.31 C ATOM 1705 SD MET A 109 9.657 -17.870 -6.642 1.00 27.12 S ATOM 1706 CE MET A 109 11.069 -18.960 -6.592 1.00 23.56 C ATOM 1707 HA MET A 109 8.384 -20.563 -10.025 1.00 0.00 H ATOM 1708 HB2 MET A 109 7.322 -19.608 -7.351 1.00 0.00 H ATOM 1709 HB3 MET A 109 8.852 -20.456 -7.678 1.00 0.00 H ATOM 1710 HG2 MET A 109 8.134 -17.617 -8.472 1.00 0.00 H ATOM 1711 HG3 MET A 109 9.622 -18.458 -8.963 1.00 0.00 H ATOM 1712 HE1 MET A 109 10.727 -19.995 -6.581 1.00 0.00 H ATOM 1713 HE2 MET A 109 11.689 -18.790 -7.472 1.00 0.00 H ATOM 1714 HE3 MET A 109 11.650 -18.759 -5.692 1.00 0.00 H ATOM 1715 H MET A 109 5.902 -18.894 -9.674 1.00 0.00 H ATOM 1716 N PRO A 110 6.328 -22.220 -10.161 1.00 21.97 N ATOM 1717 CA PRO A 110 5.361 -23.313 -10.048 1.00 19.96 C ATOM 1718 C PRO A 110 5.949 -24.559 -9.402 1.00 19.03 C ATOM 1719 O PRO A 110 7.105 -24.885 -9.648 1.00 20.44 O ATOM 1720 CB PRO A 110 5.008 -23.600 -11.506 1.00 22.36 C ATOM 1721 CG PRO A 110 6.252 -23.254 -12.243 1.00 24.50 C ATOM 1722 CD PRO A 110 6.778 -22.032 -11.551 1.00 23.17 C ATOM 1723 HA PRO A 110 4.514 -23.043 -9.417 1.00 0.00 H ATOM 1724 HD3 PRO A 110 7.866 -21.986 -11.608 1.00 0.00 H ATOM 1725 HD2 PRO A 110 6.354 -21.125 -11.981 1.00 0.00 H ATOM 1726 HG3 PRO A 110 6.032 -23.039 -13.289 1.00 0.00 H ATOM 1727 HG2 PRO A 110 6.973 -24.069 -12.185 1.00 0.00 H ATOM 1728 HB2 PRO A 110 4.753 -24.650 -11.645 1.00 0.00 H ATOM 1729 HB3 PRO A 110 4.175 -22.978 -11.835 1.00 0.00 H ATOM 1730 N SER A 111 5.146 -25.222 -8.571 1.00 15.46 N ATOM 1731 CA SER A 111 5.477 -26.532 -8.009 1.00 17.11 C ATOM 1732 C SER A 111 6.937 -26.652 -7.608 1.00 16.27 C ATOM 1733 O SER A 111 7.665 -27.499 -8.122 1.00 20.24 O ATOM 1734 CB SER A 111 5.117 -27.638 -9.000 1.00 17.10 C ATOM 1735 OG SER A 111 3.759 -27.546 -9.377 1.00 23.50 O ATOM 1736 HA SER A 111 4.886 -26.641 -7.100 1.00 0.00 H ATOM 1737 HB2 SER A 111 5.295 -28.608 -8.535 1.00 0.00 H ATOM 1738 HB3 SER A 111 5.743 -27.542 -9.887 1.00 0.00 H ATOM 1739 HG SER A 111 3.546 -28.270 -10.018 1.00 0.00 H ATOM 1740 H SER A 111 4.239 -24.787 -8.309 1.00 0.00 H ATOM 1741 N MET A 112 7.361 -25.801 -6.686 1.00 17.65 N ATOM 1742 CA MET A 112 8.732 -25.837 -6.202 1.00 22.25 C ATOM 1743 C MET A 112 8.826 -26.330 -4.764 1.00 24.83 C ATOM 1744 O MET A 112 8.100 -25.864 -3.890 1.00 20.51 O ATOM 1745 CB MET A 112 9.375 -24.463 -6.335 1.00 22.27 C ATOM 1746 CG MET A 112 10.110 -24.269 -7.644 1.00 29.49 C ATOM 1747 SD MET A 112 10.709 -22.586 -7.778 1.00 44.00 S ATOM 1748 CE MET A 112 10.678 -22.115 -6.054 1.00 27.12 C ATOM 1749 HA MET A 112 9.275 -26.551 -6.822 1.00 0.00 H ATOM 1750 HB2 MET A 112 8.594 -23.707 -6.261 1.00 0.00 H ATOM 1751 HB3 MET A 112 10.084 -24.332 -5.517 1.00 0.00 H ATOM 1752 HG2 MET A 112 9.432 -24.476 -8.472 1.00 0.00 H ATOM 1753 HG3 MET A 112 10.955 -24.956 -7.687 1.00 0.00 H ATOM 1754 HE1 MET A 112 9.659 -22.196 -5.675 1.00 0.00 H ATOM 1755 HE2 MET A 112 11.332 -22.777 -5.486 1.00 0.00 H ATOM 1756 HE3 MET A 112 11.024 -21.086 -5.953 1.00 0.00 H ATOM 1757 H MET A 112 6.702 -25.094 -6.301 1.00 0.00 H ATOM 1758 N PHE A 113 9.710 -27.299 -4.537 1.00 22.48 N ATOM 1759 CA PHE A 113 10.025 -27.759 -3.183 1.00 17.58 C ATOM 1760 C PHE A 113 11.426 -27.280 -2.817 1.00 22.48 C ATOM 1761 O PHE A 113 12.410 -27.674 -3.451 1.00 27.10 O ATOM 1762 CB PHE A 113 9.971 -29.289 -3.083 1.00 16.99 C ATOM 1763 CG PHE A 113 8.600 -29.882 -3.308 1.00 21.35 C ATOM 1764 CD1 PHE A 113 7.462 -29.095 -3.256 1.00 22.78 C ATOM 1765 CD2 PHE A 113 8.454 -31.244 -3.559 1.00 26.35 C ATOM 1766 CE1 PHE A 113 6.210 -29.648 -3.462 1.00 21.61 C ATOM 1767 CE2 PHE A 113 7.202 -31.798 -3.766 1.00 26.33 C ATOM 1768 CZ PHE A 113 6.079 -30.997 -3.716 1.00 22.31 C ATOM 1769 HA PHE A 113 9.284 -27.350 -2.496 1.00 0.00 H ATOM 1770 HB2 PHE A 113 10.649 -29.704 -3.829 1.00 0.00 H ATOM 1771 HB3 PHE A 113 10.308 -29.578 -2.088 1.00 0.00 H ATOM 1772 HD2 PHE A 113 9.337 -31.882 -3.593 1.00 0.00 H ATOM 1773 HE2 PHE A 113 7.103 -32.865 -3.968 1.00 0.00 H ATOM 1774 HZ PHE A 113 5.092 -31.430 -3.877 1.00 0.00 H ATOM 1775 HE1 PHE A 113 5.324 -29.014 -3.423 1.00 0.00 H ATOM 1776 HD1 PHE A 113 7.553 -28.028 -3.051 1.00 0.00 H ATOM 1777 H PHE A 113 10.191 -27.743 -5.345 1.00 0.00 H ATOM 1778 N VAL A 114 11.520 -26.434 -1.798 1.00 20.22 N ATOM 1779 CA VAL A 114 12.799 -25.856 -1.392 1.00 21.67 C ATOM 1780 C VAL A 114 13.207 -26.285 0.017 1.00 23.46 C ATOM 1781 O VAL A 114 12.557 -25.917 0.990 1.00 20.83 O ATOM 1782 CB VAL A 114 12.749 -24.318 -1.421 1.00 22.58 C ATOM 1783 CG1 VAL A 114 14.088 -23.739 -0.977 1.00 23.51 C ATOM 1784 CG2 VAL A 114 12.372 -23.810 -2.808 1.00 22.93 C ATOM 1785 HA VAL A 114 13.533 -26.226 -2.108 1.00 0.00 H ATOM 1786 HB VAL A 114 11.979 -23.986 -0.725 1.00 0.00 H ATOM 1787 HG11 VAL A 114 14.307 -24.070 0.038 1.00 0.00 H ATOM 1788 HG12 VAL A 114 14.873 -24.084 -1.650 1.00 0.00 H ATOM 1789 HG13 VAL A 114 14.038 -22.650 -1.002 1.00 0.00 H ATOM 1790 HG21 VAL A 114 13.113 -24.150 -3.532 1.00 0.00 H ATOM 1791 HG22 VAL A 114 11.391 -24.198 -3.081 1.00 0.00 H ATOM 1792 HG23 VAL A 114 12.344 -22.720 -2.799 1.00 0.00 H ATOM 1793 H VAL A 114 10.659 -26.176 -1.274 1.00 0.00 H ATOM 1794 N PRO A 115 14.293 -27.066 0.136 1.00 23.71 N ATOM 1795 CA PRO A 115 14.755 -27.441 1.476 1.00 22.89 C ATOM 1796 C PRO A 115 15.415 -26.253 2.160 1.00 22.19 C ATOM 1797 O PRO A 115 16.387 -25.698 1.647 1.00 24.29 O ATOM 1798 CB PRO A 115 15.785 -28.541 1.199 1.00 24.84 C ATOM 1799 CG PRO A 115 15.449 -29.050 -0.157 1.00 28.41 C ATOM 1800 CD PRO A 115 14.975 -27.839 -0.912 1.00 26.66 C ATOM 1801 HA PRO A 115 13.949 -27.766 2.134 1.00 0.00 H ATOM 1802 HD3 PRO A 115 15.813 -27.282 -1.332 1.00 0.00 H ATOM 1803 HD2 PRO A 115 14.287 -28.115 -1.711 1.00 0.00 H ATOM 1804 HG3 PRO A 115 14.662 -29.802 -0.102 1.00 0.00 H ATOM 1805 HG2 PRO A 115 16.328 -29.482 -0.635 1.00 0.00 H ATOM 1806 HB2 PRO A 115 16.796 -28.133 1.216 1.00 0.00 H ATOM 1807 HB3 PRO A 115 15.704 -29.338 1.939 1.00 0.00 H ATOM 1808 N VAL A 116 14.885 -25.867 3.315 1.00 21.81 N ATOM 1809 CA VAL A 116 15.334 -24.662 3.987 1.00 22.85 C ATOM 1810 C VAL A 116 16.126 -24.981 5.253 1.00 22.31 C ATOM 1811 O VAL A 116 16.572 -24.083 5.951 1.00 25.70 O ATOM 1812 CB VAL A 116 14.150 -23.735 4.340 1.00 24.11 C ATOM 1813 CG1 VAL A 116 13.537 -23.152 3.081 1.00 20.15 C ATOM 1814 CG2 VAL A 116 13.104 -24.487 5.157 1.00 21.62 C ATOM 1815 HA VAL A 116 15.990 -24.145 3.287 1.00 0.00 H ATOM 1816 HB VAL A 116 14.526 -22.912 4.948 1.00 0.00 H ATOM 1817 HG11 VAL A 116 14.291 -22.576 2.545 1.00 0.00 H ATOM 1818 HG12 VAL A 116 13.177 -23.961 2.446 1.00 0.00 H ATOM 1819 HG13 VAL A 116 12.705 -22.502 3.351 1.00 0.00 H ATOM 1820 HG21 VAL A 116 12.731 -25.332 4.578 1.00 0.00 H ATOM 1821 HG22 VAL A 116 13.557 -24.849 6.080 1.00 0.00 H ATOM 1822 HG23 VAL A 116 12.279 -23.816 5.395 1.00 0.00 H ATOM 1823 H VAL A 116 14.132 -26.440 3.747 1.00 0.00 H ATOM 1824 N GLY A 117 16.289 -26.264 5.553 1.00 26.34 N ATOM 1825 CA GLY A 117 16.979 -26.647 6.772 1.00 25.19 C ATOM 1826 C GLY A 117 16.071 -26.623 7.986 1.00 28.05 C ATOM 1827 O GLY A 117 14.846 -26.700 7.859 1.00 24.09 O ATOM 1828 HA3 GLY A 117 17.804 -25.955 6.939 1.00 0.00 H ATOM 1829 HA2 GLY A 117 17.372 -27.656 6.649 1.00 0.00 H ATOM 1830 H GLY A 117 15.921 -26.997 4.913 1.00 0.00 H ATOM 1831 N ASP A 118 16.678 -26.527 9.165 1.00 26.34 N ATOM 1832 CA ASP A 118 15.947 -26.532 10.423 1.00 24.50 C ATOM 1833 C ASP A 118 15.188 -25.220 10.608 1.00 28.21 C ATOM 1834 O ASP A 118 15.685 -24.144 10.255 1.00 25.88 O ATOM 1835 CB ASP A 118 16.905 -26.731 11.603 1.00 28.23 C ATOM 1836 CG ASP A 118 17.562 -28.093 11.603 1.00 29.18 C ATOM 1837 OD1 ASP A 118 18.551 -28.283 12.354 1.00 33.79 O ATOM 1838 OD2 ASP A 118 17.098 -28.972 10.850 1.00 28.48 O ATOM 1839 HA ASP A 118 15.236 -27.358 10.393 1.00 0.00 H ATOM 1840 HB2 ASP A 118 17.683 -25.969 11.552 1.00 0.00 H ATOM 1841 HB3 ASP A 118 16.344 -26.615 12.530 1.00 0.00 H ATOM 1842 H ASP A 118 17.715 -26.445 9.189 1.00 0.00 H ATOM 1843 N VAL A 119 13.983 -25.325 11.156 1.00 22.09 N ATOM 1844 CA VAL A 119 13.160 -24.167 11.472 1.00 19.55 C ATOM 1845 C VAL A 119 13.157 -23.961 12.984 1.00 20.31 C ATOM 1846 O VAL A 119 12.795 -24.864 13.743 1.00 22.01 O ATOM 1847 CB VAL A 119 11.715 -24.369 10.975 1.00 20.43 C ATOM 1848 CG1 VAL A 119 10.837 -23.167 11.354 1.00 19.93 C ATOM 1849 CG2 VAL A 119 11.715 -24.609 9.468 1.00 20.42 C ATOM 1850 HA VAL A 119 13.574 -23.291 10.973 1.00 0.00 H ATOM 1851 HB VAL A 119 11.290 -25.247 11.461 1.00 0.00 H ATOM 1852 HG11 VAL A 119 10.825 -23.055 12.438 1.00 0.00 H ATOM 1853 HG12 VAL A 119 11.244 -22.264 10.899 1.00 0.00 H ATOM 1854 HG13 VAL A 119 9.822 -23.332 10.993 1.00 0.00 H ATOM 1855 HG21 VAL A 119 12.153 -23.747 8.964 1.00 0.00 H ATOM 1856 HG22 VAL A 119 12.302 -25.500 9.243 1.00 0.00 H ATOM 1857 HG23 VAL A 119 10.690 -24.751 9.124 1.00 0.00 H ATOM 1858 H VAL A 119 13.612 -26.273 11.368 1.00 0.00 H ATOM 1859 N VAL A 120 13.575 -22.781 13.426 1.00 16.64 N ATOM 1860 CA VAL A 120 13.694 -22.534 14.858 1.00 22.10 C ATOM 1861 C VAL A 120 12.774 -21.434 15.355 1.00 22.99 C ATOM 1862 O VAL A 120 12.326 -20.572 14.587 1.00 19.56 O ATOM 1863 CB VAL A 120 15.139 -22.190 15.256 1.00 27.01 C ATOM 1864 CG1 VAL A 120 16.060 -23.340 14.907 1.00 27.47 C ATOM 1865 CG2 VAL A 120 15.580 -20.916 14.564 1.00 25.93 C ATOM 1866 HA VAL A 120 13.392 -23.468 15.332 1.00 0.00 H ATOM 1867 HB VAL A 120 15.185 -22.028 16.333 1.00 0.00 H ATOM 1868 HG11 VAL A 120 15.743 -24.234 15.444 1.00 0.00 H ATOM 1869 HG12 VAL A 120 16.017 -23.525 13.834 1.00 0.00 H ATOM 1870 HG13 VAL A 120 17.081 -23.086 15.193 1.00 0.00 H ATOM 1871 HG21 VAL A 120 15.529 -21.054 13.484 1.00 0.00 H ATOM 1872 HG22 VAL A 120 14.923 -20.098 14.858 1.00 0.00 H ATOM 1873 HG23 VAL A 120 16.605 -20.683 14.854 1.00 0.00 H ATOM 1874 H VAL A 120 13.818 -22.030 12.749 1.00 0.00 H ATOM 1875 N GLN A 121 12.505 -21.463 16.654 1.00 23.47 N ATOM 1876 CA GLN A 121 11.736 -20.401 17.266 1.00 24.28 C ATOM 1877 C GLN A 121 12.434 -19.067 17.069 1.00 26.22 C ATOM 1878 O GLN A 121 13.665 -18.961 17.170 1.00 23.13 O ATOM 1879 CB GLN A 121 11.495 -20.681 18.746 1.00 28.97 C ATOM 1880 CG GLN A 121 10.355 -21.652 18.986 1.00 33.77 C ATOM 1881 CD GLN A 121 9.074 -21.226 18.282 1.00 35.55 C ATOM 1882 OE1 GLN A 121 8.867 -20.041 17.996 1.00 41.16 O ATOM 1883 NE2 GLN A 121 8.209 -22.193 17.998 1.00 35.86 N ATOM 1884 HA GLN A 121 10.762 -20.355 16.778 1.00 0.00 H ATOM 1885 HB2 GLN A 121 12.406 -21.101 19.173 1.00 0.00 H ATOM 1886 HB3 GLN A 121 11.261 -19.740 19.245 1.00 0.00 H ATOM 1887 HG2 GLN A 121 10.648 -22.635 18.617 1.00 0.00 H ATOM 1888 HG3 GLN A 121 10.164 -21.710 20.057 1.00 0.00 H ATOM 1889 HE22 GLN A 121 8.425 -23.177 18.258 1.00 0.00 H ATOM 1890 HE21 GLN A 121 7.316 -21.967 17.516 1.00 0.00 H ATOM 1891 H GLN A 121 12.849 -22.254 17.236 1.00 0.00 H ATOM 1892 N TYR A 122 11.646 -18.050 16.752 1.00 19.92 N ATOM 1893 CA TYR A 122 12.188 -16.713 16.598 1.00 17.71 C ATOM 1894 C TYR A 122 11.368 -15.732 17.428 1.00 20.37 C ATOM 1895 O TYR A 122 11.904 -15.017 18.277 1.00 21.30 O ATOM 1896 CB TYR A 122 12.211 -16.312 15.123 1.00 17.24 C ATOM 1897 CG TYR A 122 13.120 -15.141 14.844 1.00 19.18 C ATOM 1898 CD1 TYR A 122 14.484 -15.329 14.665 1.00 21.73 C ATOM 1899 CD2 TYR A 122 12.616 -13.850 14.764 1.00 20.52 C ATOM 1900 CE1 TYR A 122 15.318 -14.266 14.414 1.00 16.99 C ATOM 1901 CE2 TYR A 122 13.443 -12.781 14.517 1.00 20.34 C ATOM 1902 CZ TYR A 122 14.794 -12.997 14.341 1.00 23.55 C ATOM 1903 OH TYR A 122 15.628 -11.939 14.091 1.00 25.68 O ATOM 1904 HA TYR A 122 13.216 -16.695 16.959 1.00 0.00 H ATOM 1905 HB3 TYR A 122 11.198 -16.046 14.819 1.00 0.00 H ATOM 1906 HB2 TYR A 122 12.553 -17.165 14.536 1.00 0.00 H ATOM 1907 HD2 TYR A 122 11.548 -13.682 14.899 1.00 0.00 H ATOM 1908 HE2 TYR A 122 13.035 -11.772 14.461 1.00 0.00 H ATOM 1909 HE1 TYR A 122 16.387 -14.428 14.274 1.00 0.00 H ATOM 1910 HD1 TYR A 122 14.900 -16.335 14.724 1.00 0.00 H ATOM 1911 HH TYR A 122 15.583 -11.299 14.845 1.00 0.00 H ATOM 1912 H TYR A 122 10.628 -18.212 16.612 1.00 0.00 H ATOM 1913 N GLY A 123 10.060 -15.727 17.195 1.00 20.48 N ATOM 1914 CA GLY A 123 9.132 -14.953 17.996 1.00 16.89 C ATOM 1915 C GLY A 123 8.833 -13.584 17.428 1.00 20.41 C ATOM 1916 O GLY A 123 8.094 -13.452 16.439 1.00 21.17 O ATOM 1917 HA3 GLY A 123 9.558 -14.827 18.991 1.00 0.00 H ATOM 1918 HA2 GLY A 123 8.196 -15.507 18.070 1.00 0.00 H ATOM 1919 H GLY A 123 9.688 -16.299 16.410 1.00 0.00 H ATOM 1920 N PHE A 124 9.398 -12.559 18.060 1.00 15.03 N ATOM 1921 CA PHE A 124 9.200 -11.187 17.611 1.00 16.28 C ATOM 1922 C PHE A 124 9.952 -10.911 16.324 1.00 19.01 C ATOM 1923 O PHE A 124 11.130 -11.259 16.191 1.00 21.35 O ATOM 1924 CB PHE A 124 9.643 -10.177 18.674 1.00 24.80 C ATOM 1925 CG PHE A 124 9.644 -8.757 18.187 1.00 23.56 C ATOM 1926 CD1 PHE A 124 8.486 -7.997 18.226 1.00 26.18 C ATOM 1927 CD2 PHE A 124 10.801 -8.182 17.687 1.00 25.96 C ATOM 1928 CE1 PHE A 124 8.479 -6.691 17.768 1.00 25.30 C ATOM 1929 CE2 PHE A 124 10.801 -6.877 17.227 1.00 25.34 C ATOM 1930 CZ PHE A 124 9.642 -6.129 17.270 1.00 25.88 C ATOM 1931 HA PHE A 124 8.131 -11.071 17.433 1.00 0.00 H ATOM 1932 HB2 PHE A 124 8.964 -10.250 19.524 1.00 0.00 H ATOM 1933 HB3 PHE A 124 10.653 -10.433 18.994 1.00 0.00 H ATOM 1934 HD2 PHE A 124 11.722 -8.764 17.656 1.00 0.00 H ATOM 1935 HE2 PHE A 124 11.717 -6.439 16.830 1.00 0.00 H ATOM 1936 HZ PHE A 124 9.642 -5.099 16.913 1.00 0.00 H ATOM 1937 HE1 PHE A 124 7.560 -6.106 17.799 1.00 0.00 H ATOM 1938 HD1 PHE A 124 7.569 -8.433 18.622 1.00 0.00 H ATOM 1939 H PHE A 124 9.994 -12.741 18.893 1.00 0.00 H ATOM 1940 N LEU A 125 9.269 -10.273 15.381 1.00 21.03 N ATOM 1941 CA LEU A 125 9.897 -9.857 14.134 1.00 19.42 C ATOM 1942 C LEU A 125 9.484 -8.437 13.761 1.00 22.97 C ATOM 1943 O LEU A 125 8.294 -8.125 13.643 1.00 21.51 O ATOM 1944 CB LEU A 125 9.548 -10.826 12.999 1.00 16.85 C ATOM 1945 CG LEU A 125 10.231 -10.584 11.646 1.00 20.14 C ATOM 1946 CD1 LEU A 125 11.729 -10.785 11.771 1.00 20.17 C ATOM 1947 CD2 LEU A 125 9.679 -11.504 10.570 1.00 20.48 C ATOM 1948 HA LEU A 125 10.977 -9.872 14.284 1.00 0.00 H ATOM 1949 HB2 LEU A 125 9.816 -11.830 13.329 1.00 0.00 H ATOM 1950 HB3 LEU A 125 8.471 -10.772 12.839 1.00 0.00 H ATOM 1951 HG LEU A 125 10.025 -9.555 11.352 1.00 0.00 H ATOM 1952 HD21 LEU A 125 9.846 -12.541 10.860 1.00 0.00 H ATOM 1953 HD22 LEU A 125 8.610 -11.325 10.454 1.00 0.00 H ATOM 1954 HD23 LEU A 125 10.187 -11.303 9.627 1.00 0.00 H ATOM 1955 HD11 LEU A 125 12.129 -10.083 12.503 1.00 0.00 H ATOM 1956 HD12 LEU A 125 11.932 -11.806 12.096 1.00 0.00 H ATOM 1957 HD13 LEU A 125 12.200 -10.610 10.804 1.00 0.00 H ATOM 1958 H LEU A 125 8.262 -10.065 15.536 1.00 0.00 H ATOM 1959 N ASN A 126 10.475 -7.571 13.594 1.00 27.67 N ATOM 1960 CA ASN A 126 10.222 -6.249 13.058 1.00 27.40 C ATOM 1961 C ASN A 126 10.178 -6.364 11.544 1.00 27.82 C ATOM 1962 O ASN A 126 11.190 -6.224 10.865 1.00 28.95 O ATOM 1963 CB ASN A 126 11.298 -5.262 13.516 1.00 31.87 C ATOM 1964 CG ASN A 126 10.954 -3.827 13.170 1.00 36.17 C ATOM 1965 OD1 ASN A 126 11.832 -2.956 13.122 1.00 45.73 O ATOM 1966 ND2 ASN A 126 9.675 -3.567 12.934 1.00 33.11 N ATOM 1967 HA ASN A 126 9.271 -5.864 13.425 1.00 0.00 H ATOM 1968 HB2 ASN A 126 11.411 -5.344 14.597 1.00 0.00 H ATOM 1969 HB3 ASN A 126 12.240 -5.522 13.033 1.00 0.00 H ATOM 1970 HD22 ASN A 126 8.971 -4.331 12.986 1.00 0.00 H ATOM 1971 HD21 ASN A 126 9.376 -2.599 12.697 1.00 0.00 H ATOM 1972 H ASN A 126 11.445 -7.844 13.851 1.00 0.00 H ATOM 1973 N LEU A 127 8.994 -6.656 11.017 1.00 20.11 N ATOM 1974 CA LEU A 127 8.842 -6.925 9.597 1.00 18.00 C ATOM 1975 C LEU A 127 8.530 -5.631 8.859 1.00 23.00 C ATOM 1976 O LEU A 127 7.379 -5.186 8.814 1.00 17.88 O ATOM 1977 CB LEU A 127 7.736 -7.963 9.382 1.00 19.47 C ATOM 1978 CG LEU A 127 7.435 -8.447 7.972 1.00 16.82 C ATOM 1979 CD1 LEU A 127 8.687 -8.931 7.260 1.00 19.70 C ATOM 1980 CD2 LEU A 127 6.380 -9.565 7.993 1.00 17.48 C ATOM 1981 HA LEU A 127 9.772 -7.330 9.199 1.00 0.00 H ATOM 1982 HB2 LEU A 127 8.005 -8.841 9.970 1.00 0.00 H ATOM 1983 HB3 LEU A 127 6.815 -7.533 9.774 1.00 0.00 H ATOM 1984 HG LEU A 127 7.042 -7.594 7.419 1.00 0.00 H ATOM 1985 HD21 LEU A 127 6.753 -10.404 8.581 1.00 0.00 H ATOM 1986 HD22 LEU A 127 5.460 -9.187 8.439 1.00 0.00 H ATOM 1987 HD23 LEU A 127 6.181 -9.895 6.973 1.00 0.00 H ATOM 1988 HD11 LEU A 127 9.405 -8.114 7.195 1.00 0.00 H ATOM 1989 HD12 LEU A 127 9.125 -9.758 7.819 1.00 0.00 H ATOM 1990 HD13 LEU A 127 8.426 -9.267 6.257 1.00 0.00 H ATOM 1991 H LEU A 127 8.158 -6.693 11.634 1.00 0.00 H ATOM 1992 N SER A 128 9.569 -5.026 8.289 1.00 29.13 N ATOM 1993 CA SER A 128 9.441 -3.728 7.623 1.00 30.51 C ATOM 1994 C SER A 128 8.740 -2.697 8.506 1.00 32.27 C ATOM 1995 O SER A 128 7.871 -1.958 8.042 1.00 34.82 O ATOM 1996 CB SER A 128 8.691 -3.876 6.296 1.00 33.35 C ATOM 1997 OG SER A 128 9.479 -4.557 5.331 1.00 33.78 O ATOM 1998 HA SER A 128 10.451 -3.367 7.428 1.00 0.00 H ATOM 1999 HB2 SER A 128 8.442 -2.885 5.916 1.00 0.00 H ATOM 2000 HB3 SER A 128 7.774 -4.439 6.467 1.00 0.00 H ATOM 2001 HG SER A 128 8.968 -4.637 4.487 1.00 0.00 H ATOM 2002 H SER A 128 10.500 -5.489 8.317 1.00 0.00 H ATOM 2003 N GLY A 129 9.110 -2.659 9.782 1.00 31.25 N ATOM 2004 CA GLY A 129 8.561 -1.679 10.700 1.00 33.83 C ATOM 2005 C GLY A 129 7.264 -2.110 11.359 1.00 33.78 C ATOM 2006 O GLY A 129 6.749 -1.419 12.238 1.00 37.32 O ATOM 2007 HA3 GLY A 129 8.376 -0.758 10.148 1.00 0.00 H ATOM 2008 HA2 GLY A 129 9.297 -1.491 11.482 1.00 0.00 H ATOM 2009 H GLY A 129 9.808 -3.347 10.130 1.00 0.00 H ATOM 2010 N LYS A 130 6.711 -3.257 10.949 1.00 29.08 N ATOM 2011 CA LYS A 130 5.489 -3.794 11.529 1.00 27.13 C ATOM 2012 C LYS A 130 5.780 -4.869 12.547 1.00 25.91 C ATOM 2013 O LYS A 130 6.211 -5.935 12.192 1.00 23.99 O ATOM 2014 CB LYS A 130 4.560 -4.327 10.453 1.00 26.56 C ATOM 2015 CG LYS A 130 3.162 -4.601 10.888 1.00 26.52 C ATOM 2016 CD LYS A 130 2.356 -4.930 9.696 1.00 30.48 C ATOM 2017 CE LYS A 130 1.008 -4.444 9.781 1.00 37.38 C ATOM 2018 NZ LYS A 130 0.889 -3.040 9.801 1.00 36.26 N ATOM 2019 HA LYS A 130 4.991 -2.971 12.042 1.00 0.00 H ATOM 2020 HB2 LYS A 130 4.523 -3.593 9.648 1.00 0.00 H ATOM 2021 HB3 LYS A 130 4.983 -5.258 10.076 1.00 0.00 H ATOM 2022 HG2 LYS A 130 3.151 -5.441 11.583 1.00 0.00 H ATOM 2023 HG3 LYS A 130 2.750 -3.719 11.379 1.00 0.00 H ATOM 2024 HD2 LYS A 130 2.831 -4.486 8.821 1.00 0.00 H ATOM 2025 HD3 LYS A 130 2.329 -6.014 9.583 1.00 0.00 H ATOM 2026 HE2 LYS A 130 0.562 -4.836 10.695 1.00 0.00 H ATOM 2027 HE3 LYS A 130 0.456 -4.820 8.919 1.00 0.00 H ATOM 2028 HZ1 LYS A 130 1.398 -2.662 10.625 1.00 0.00 H ATOM 2029 HZ2 LYS A 130 1.297 -2.646 8.929 1.00 0.00 H ATOM 2030 HZ3 LYS A 130 -0.116 -2.779 9.863 1.00 0.00 H ATOM 2031 H LYS A 130 7.174 -3.787 10.183 1.00 0.00 H ATOM 2032 N PRO A 131 5.549 -4.546 13.814 1.00 19.14 N ATOM 2033 CA PRO A 131 5.787 -5.498 14.899 1.00 21.51 C ATOM 2034 C PRO A 131 4.968 -6.764 14.659 1.00 16.59 C ATOM 2035 O PRO A 131 3.758 -6.668 14.463 1.00 18.74 O ATOM 2036 CB PRO A 131 5.265 -4.757 16.137 1.00 20.55 C ATOM 2037 CG PRO A 131 5.251 -3.320 15.757 1.00 25.34 C ATOM 2038 CD PRO A 131 4.956 -3.289 14.297 1.00 19.55 C ATOM 2039 HA PRO A 131 6.829 -5.803 14.991 1.00 0.00 H ATOM 2040 HD3 PRO A 131 3.882 -3.266 14.114 1.00 0.00 H ATOM 2041 HD2 PRO A 131 5.423 -2.427 13.821 1.00 0.00 H ATOM 2042 HG3 PRO A 131 6.220 -2.864 15.958 1.00 0.00 H ATOM 2043 HG2 PRO A 131 4.478 -2.788 16.312 1.00 0.00 H ATOM 2044 HB2 PRO A 131 4.260 -5.095 16.389 1.00 0.00 H ATOM 2045 HB3 PRO A 131 5.927 -4.921 16.988 1.00 0.00 H ATOM 2046 N THR A 132 5.619 -7.923 14.665 1.00 18.94 N ATOM 2047 CA THR A 132 4.953 -9.183 14.338 1.00 19.50 C ATOM 2048 C THR A 132 5.311 -10.251 15.376 1.00 21.02 C ATOM 2049 O THR A 132 6.438 -10.293 15.866 1.00 19.83 O ATOM 2050 CB THR A 132 5.331 -9.649 12.904 1.00 16.44 C ATOM 2051 OG1 THR A 132 4.992 -8.614 11.970 1.00 19.51 O ATOM 2052 CG2 THR A 132 4.588 -10.939 12.527 1.00 15.20 C ATOM 2053 HA THR A 132 3.875 -9.026 14.363 1.00 0.00 H ATOM 2054 HB THR A 132 6.402 -9.850 12.875 1.00 0.00 H ATOM 2055 HG1 THR A 132 5.492 -7.790 12.196 1.00 0.00 H ATOM 2056 HG23 THR A 132 4.845 -11.726 13.236 1.00 0.00 H ATOM 2057 HG21 THR A 132 3.513 -10.759 12.556 1.00 0.00 H ATOM 2058 HG22 THR A 132 4.880 -11.244 11.522 1.00 0.00 H ATOM 2059 H THR A 132 6.630 -7.934 14.909 1.00 0.00 H ATOM 2060 N HIS A 133 4.352 -11.103 15.726 1.00 19.63 N ATOM 2061 CA HIS A 133 4.588 -12.131 16.734 1.00 16.97 C ATOM 2062 C HIS A 133 4.486 -13.555 16.190 1.00 16.75 C ATOM 2063 O HIS A 133 3.957 -13.783 15.101 1.00 16.64 O ATOM 2064 CB HIS A 133 3.620 -11.963 17.913 1.00 20.84 C ATOM 2065 CG HIS A 133 4.037 -10.910 18.892 1.00 28.08 C ATOM 2066 ND1 HIS A 133 3.217 -10.476 19.912 1.00 28.67 N ATOM 2067 CD2 HIS A 133 5.184 -10.200 19.005 1.00 29.18 C ATOM 2068 CE1 HIS A 133 3.840 -9.543 20.610 1.00 31.87 C ATOM 2069 NE2 HIS A 133 5.036 -9.359 20.081 1.00 35.40 N ATOM 2070 HA HIS A 133 5.616 -11.990 17.068 1.00 0.00 H ATOM 2071 HB2 HIS A 133 2.640 -11.696 17.518 1.00 0.00 H ATOM 2072 HB3 HIS A 133 3.551 -12.915 18.440 1.00 0.00 H ATOM 2073 HD2 HIS A 133 6.061 -10.281 18.362 1.00 0.00 H ATOM 2074 HE1 HIS A 133 3.436 -9.016 21.474 1.00 0.00 H ATOM 2075 H HIS A 133 3.418 -11.035 15.274 1.00 0.00 H ATOM 2076 N ARG A 134 5.014 -14.501 16.956 1.00 18.86 N ATOM 2077 CA ARG A 134 4.837 -15.927 16.695 1.00 16.00 C ATOM 2078 C ARG A 134 5.531 -16.423 15.424 1.00 16.76 C ATOM 2079 O ARG A 134 5.075 -17.361 14.776 1.00 16.56 O ATOM 2080 CB ARG A 134 3.347 -16.287 16.680 1.00 20.68 C ATOM 2081 CG ARG A 134 2.636 -15.914 17.972 1.00 20.67 C ATOM 2082 CD ARG A 134 1.205 -16.424 17.983 1.00 19.57 C ATOM 2083 NE ARG A 134 0.500 -16.010 19.192 1.00 17.84 N ATOM 2084 CZ ARG A 134 -0.744 -16.370 19.489 1.00 22.31 C ATOM 2085 NH1 ARG A 134 -1.426 -17.147 18.657 1.00 20.32 N ATOM 2086 NH2 ARG A 134 -1.311 -15.944 20.615 1.00 25.99 N ATOM 2087 HA ARG A 134 5.331 -16.446 17.517 1.00 0.00 H ATOM 2088 HB2 ARG A 134 2.869 -15.759 15.855 1.00 0.00 H ATOM 2089 HB3 ARG A 134 3.250 -17.362 16.527 1.00 0.00 H ATOM 2090 HG2 ARG A 134 3.175 -16.350 18.813 1.00 0.00 H ATOM 2091 HG3 ARG A 134 2.627 -14.829 18.072 1.00 0.00 H ATOM 2092 HD2 ARG A 134 1.216 -17.513 17.934 1.00 0.00 H ATOM 2093 HD3 ARG A 134 0.681 -16.028 17.113 1.00 0.00 H ATOM 2094 HE ARG A 134 1.003 -15.395 19.863 1.00 0.00 H ATOM 2095 HH12 ARG A 134 -2.400 -17.429 18.889 1.00 0.00 H ATOM 2096 HH11 ARG A 134 -0.987 -17.474 17.773 1.00 0.00 H ATOM 2097 HH22 ARG A 134 -2.285 -16.227 20.846 1.00 0.00 H ATOM 2098 HH21 ARG A 134 -0.780 -15.328 21.264 1.00 0.00 H ATOM 2099 H ARG A 134 5.580 -14.214 17.780 1.00 0.00 H ATOM 2100 N THR A 135 6.657 -15.811 15.089 1.00 16.18 N ATOM 2101 CA THR A 135 7.377 -16.191 13.889 1.00 17.54 C ATOM 2102 C THR A 135 8.435 -17.248 14.205 1.00 18.25 C ATOM 2103 O THR A 135 8.831 -17.431 15.376 1.00 18.56 O ATOM 2104 CB THR A 135 8.049 -14.983 13.225 1.00 16.62 C ATOM 2105 OG1 THR A 135 9.116 -14.518 14.064 1.00 16.35 O ATOM 2106 CG2 THR A 135 7.042 -13.848 13.004 1.00 16.71 C ATOM 2107 HA THR A 135 6.645 -16.605 13.195 1.00 0.00 H ATOM 2108 HB THR A 135 8.439 -15.290 12.255 1.00 0.00 H ATOM 2109 HG1 THR A 135 8.750 -14.253 14.945 1.00 0.00 H ATOM 2110 HG23 THR A 135 6.232 -14.202 12.367 1.00 0.00 H ATOM 2111 HG21 THR A 135 6.638 -13.530 13.965 1.00 0.00 H ATOM 2112 HG22 THR A 135 7.543 -13.008 12.524 1.00 0.00 H ATOM 2113 H THR A 135 7.029 -15.050 15.693 1.00 0.00 H ATOM 2114 N MET A 136 8.853 -17.961 13.160 1.00 18.95 N ATOM 2115 CA MET A 136 9.980 -18.882 13.223 1.00 16.54 C ATOM 2116 C MET A 136 10.960 -18.544 12.109 1.00 18.00 C ATOM 2117 O MET A 136 10.628 -17.793 11.196 1.00 18.28 O ATOM 2118 CB MET A 136 9.513 -20.331 13.107 1.00 17.74 C ATOM 2119 CG MET A 136 8.608 -20.741 14.263 1.00 17.08 C ATOM 2120 SD MET A 136 8.292 -22.515 14.291 1.00 19.19 S ATOM 2121 CE MET A 136 7.167 -22.679 12.902 1.00 17.87 C ATOM 2122 HA MET A 136 10.474 -18.775 14.189 1.00 0.00 H ATOM 2123 HB2 MET A 136 8.964 -20.449 12.173 1.00 0.00 H ATOM 2124 HB3 MET A 136 10.387 -20.982 13.098 1.00 0.00 H ATOM 2125 HG2 MET A 136 7.657 -20.217 14.167 1.00 0.00 H ATOM 2126 HG3 MET A 136 9.085 -20.455 15.200 1.00 0.00 H ATOM 2127 HE1 MET A 136 6.278 -22.074 13.082 1.00 0.00 H ATOM 2128 HE2 MET A 136 7.662 -22.338 11.993 1.00 0.00 H ATOM 2129 HE3 MET A 136 6.880 -23.725 12.790 1.00 0.00 H ATOM 2130 H MET A 136 8.350 -17.855 12.256 1.00 0.00 H ATOM 2131 N MET A 137 12.162 -19.110 12.172 1.00 15.68 N ATOM 2132 CA MET A 137 13.220 -18.720 11.247 1.00 16.62 C ATOM 2133 C MET A 137 13.957 -19.914 10.630 1.00 16.28 C ATOM 2134 O MET A 137 14.107 -20.959 11.265 1.00 20.44 O ATOM 2135 CB MET A 137 14.210 -17.795 11.968 1.00 17.91 C ATOM 2136 CG MET A 137 15.312 -17.256 11.086 1.00 19.71 C ATOM 2137 SD MET A 137 16.749 -18.335 11.043 1.00 25.10 S ATOM 2138 CE MET A 137 17.441 -18.051 12.665 1.00 24.50 C ATOM 2139 HA MET A 137 12.746 -18.195 10.417 1.00 0.00 H ATOM 2140 HB2 MET A 137 13.654 -16.950 12.375 1.00 0.00 H ATOM 2141 HB3 MET A 137 14.668 -18.354 12.784 1.00 0.00 H ATOM 2142 HG2 MET A 137 15.618 -16.281 11.465 1.00 0.00 H ATOM 2143 HG3 MET A 137 14.927 -17.146 10.072 1.00 0.00 H ATOM 2144 HE1 MET A 137 17.693 -16.996 12.772 1.00 0.00 H ATOM 2145 HE2 MET A 137 16.710 -18.330 13.424 1.00 0.00 H ATOM 2146 HE3 MET A 137 18.341 -18.654 12.786 1.00 0.00 H ATOM 2147 H MET A 137 12.350 -19.839 12.889 1.00 0.00 H ATOM 2148 N TYR A 138 14.398 -19.759 9.386 1.00 15.27 N ATOM 2149 CA TYR A 138 15.246 -20.756 8.729 1.00 16.83 C ATOM 2150 C TYR A 138 16.450 -20.061 8.123 1.00 19.54 C ATOM 2151 O TYR A 138 16.345 -18.934 7.640 1.00 19.90 O ATOM 2152 CB TYR A 138 14.506 -21.566 7.652 1.00 19.47 C ATOM 2153 CG TYR A 138 13.181 -20.983 7.200 1.00 17.56 C ATOM 2154 CD1 TYR A 138 12.041 -21.130 7.975 1.00 16.16 C ATOM 2155 CD2 TYR A 138 13.069 -20.306 5.993 1.00 14.06 C ATOM 2156 CE1 TYR A 138 10.820 -20.604 7.569 1.00 13.79 C ATOM 2157 CE2 TYR A 138 11.844 -19.780 5.574 1.00 15.44 C ATOM 2158 CZ TYR A 138 10.728 -19.935 6.374 1.00 14.72 C ATOM 2159 OH TYR A 138 9.517 -19.419 5.982 1.00 12.52 O ATOM 2160 HA TYR A 138 15.557 -21.471 9.490 1.00 0.00 H ATOM 2161 HB3 TYR A 138 14.317 -22.563 8.050 1.00 0.00 H ATOM 2162 HB2 TYR A 138 15.156 -21.641 6.780 1.00 0.00 H ATOM 2163 HD2 TYR A 138 13.950 -20.183 5.363 1.00 0.00 H ATOM 2164 HE2 TYR A 138 11.769 -19.252 4.624 1.00 0.00 H ATOM 2165 HE1 TYR A 138 9.938 -20.723 8.198 1.00 0.00 H ATOM 2166 HD1 TYR A 138 12.103 -21.668 8.921 1.00 0.00 H ATOM 2167 HH TYR A 138 9.597 -18.438 5.874 1.00 0.00 H ATOM 2168 H TYR A 138 14.132 -18.901 8.862 1.00 0.00 H ATOM 2169 N ASN A 139 17.599 -20.724 8.175 1.00 18.12 N ATOM 2170 CA ASN A 139 18.824 -20.126 7.670 1.00 18.67 C ATOM 2171 C ASN A 139 18.940 -20.391 6.177 1.00 23.91 C ATOM 2172 O ASN A 139 19.832 -21.109 5.729 1.00 23.54 O ATOM 2173 CB ASN A 139 20.046 -20.666 8.423 1.00 20.93 C ATOM 2174 CG ASN A 139 21.303 -19.858 8.149 1.00 29.08 C ATOM 2175 OD1 ASN A 139 22.403 -20.407 8.041 1.00 35.79 O ATOM 2176 ND2 ASN A 139 21.142 -18.547 8.030 1.00 23.42 N ATOM 2177 HA ASN A 139 18.789 -19.049 7.835 1.00 0.00 H ATOM 2178 HB2 ASN A 139 19.838 -20.638 9.493 1.00 0.00 H ATOM 2179 HB3 ASN A 139 20.219 -21.697 8.115 1.00 0.00 H ATOM 2180 HD22 ASN A 139 20.195 -18.128 8.129 1.00 0.00 H ATOM 2181 HD21 ASN A 139 21.963 -17.938 7.838 1.00 0.00 H ATOM 2182 H ASN A 139 17.623 -21.681 8.581 1.00 0.00 H ATOM 2183 N PHE A 140 18.005 -19.829 5.414 1.00 25.45 N ATOM 2184 CA PHE A 140 17.972 -20.004 3.971 1.00 25.18 C ATOM 2185 C PHE A 140 17.611 -18.687 3.275 1.00 24.71 C ATOM 2186 O PHE A 140 16.733 -17.958 3.735 1.00 23.26 O ATOM 2187 CB PHE A 140 16.971 -21.102 3.583 1.00 25.18 C ATOM 2188 CG PHE A 140 16.951 -21.402 2.114 1.00 24.12 C ATOM 2189 CD1 PHE A 140 17.722 -22.429 1.593 1.00 24.70 C ATOM 2190 CD2 PHE A 140 16.187 -20.638 1.245 1.00 20.92 C ATOM 2191 CE1 PHE A 140 17.715 -22.696 0.239 1.00 27.46 C ATOM 2192 CE2 PHE A 140 16.190 -20.894 -0.108 1.00 26.00 C ATOM 2193 CZ PHE A 140 16.951 -21.926 -0.610 1.00 29.17 C ATOM 2194 HA PHE A 140 18.966 -20.308 3.643 1.00 0.00 H ATOM 2195 HB2 PHE A 140 17.235 -22.014 4.118 1.00 0.00 H ATOM 2196 HB3 PHE A 140 15.973 -20.782 3.883 1.00 0.00 H ATOM 2197 HD2 PHE A 140 15.577 -19.825 1.638 1.00 0.00 H ATOM 2198 HE2 PHE A 140 15.591 -20.281 -0.781 1.00 0.00 H ATOM 2199 HZ PHE A 140 16.949 -22.134 -1.680 1.00 0.00 H ATOM 2200 HE1 PHE A 140 18.314 -23.516 -0.158 1.00 0.00 H ATOM 2201 HD1 PHE A 140 18.340 -23.032 2.259 1.00 0.00 H ATOM 2202 H PHE A 140 17.273 -19.245 5.866 1.00 0.00 H ATOM 2203 N PRO A 141 18.285 -18.384 2.153 1.00 24.98 N ATOM 2204 CA PRO A 141 18.050 -17.117 1.451 1.00 21.48 C ATOM 2205 C PRO A 141 16.759 -17.131 0.644 1.00 22.82 C ATOM 2206 O PRO A 141 16.787 -17.259 -0.581 1.00 19.16 O ATOM 2207 CB PRO A 141 19.253 -17.019 0.509 1.00 28.09 C ATOM 2208 CG PRO A 141 19.615 -18.426 0.226 1.00 23.20 C ATOM 2209 CD PRO A 141 19.297 -19.215 1.473 1.00 26.15 C ATOM 2210 HA PRO A 141 17.949 -16.280 2.142 1.00 0.00 H ATOM 2211 HD3 PRO A 141 18.893 -20.196 1.222 1.00 0.00 H ATOM 2212 HD2 PRO A 141 20.184 -19.337 2.095 1.00 0.00 H ATOM 2213 HG3 PRO A 141 20.677 -18.502 -0.006 1.00 0.00 H ATOM 2214 HG2 PRO A 141 19.033 -18.802 -0.615 1.00 0.00 H ATOM 2215 HB2 PRO A 141 18.983 -16.498 -0.409 1.00 0.00 H ATOM 2216 HB3 PRO A 141 20.080 -16.497 0.991 1.00 0.00 H ATOM 2217 N THR A 142 15.625 -17.020 1.330 1.00 16.55 N ATOM 2218 CA THR A 142 14.357 -16.878 0.636 1.00 17.16 C ATOM 2219 C THR A 142 14.309 -15.548 -0.105 1.00 16.53 C ATOM 2220 O THR A 142 15.048 -14.608 0.212 1.00 16.62 O ATOM 2221 CB THR A 142 13.167 -16.989 1.608 1.00 13.22 C ATOM 2222 OG1 THR A 142 13.460 -16.245 2.800 1.00 17.02 O ATOM 2223 CG2 THR A 142 12.937 -18.443 1.967 1.00 15.66 C ATOM 2224 HA THR A 142 14.277 -17.692 -0.084 1.00 0.00 H ATOM 2225 HB THR A 142 12.271 -16.588 1.134 1.00 0.00 H ATOM 2226 HG1 THR A 142 13.611 -15.295 2.566 1.00 0.00 H ATOM 2227 HG23 THR A 142 12.714 -19.009 1.062 1.00 0.00 H ATOM 2228 HG21 THR A 142 13.834 -18.846 2.437 1.00 0.00 H ATOM 2229 HG22 THR A 142 12.098 -18.517 2.659 1.00 0.00 H ATOM 2230 H THR A 142 15.646 -17.035 2.370 1.00 0.00 H ATOM 2231 N LYS A 143 13.436 -15.480 -1.098 1.00 20.29 N ATOM 2232 CA LYS A 143 13.464 -14.393 -2.059 1.00 23.36 C ATOM 2233 C LYS A 143 12.074 -13.843 -2.264 1.00 24.08 C ATOM 2234 O LYS A 143 11.081 -14.468 -1.871 1.00 24.71 O ATOM 2235 CB LYS A 143 14.038 -14.907 -3.386 1.00 24.29 C ATOM 2236 CG LYS A 143 15.407 -15.551 -3.213 1.00 33.29 C ATOM 2237 CD LYS A 143 15.949 -16.147 -4.500 1.00 40.97 C ATOM 2238 CE LYS A 143 17.315 -16.781 -4.260 1.00 48.88 C ATOM 2239 NZ LYS A 143 18.280 -15.809 -3.658 1.00 41.31 N ATOM 2240 HA LYS A 143 14.096 -13.590 -1.681 1.00 0.00 H ATOM 2241 HB2 LYS A 143 13.353 -15.646 -3.802 1.00 0.00 H ATOM 2242 HB3 LYS A 143 14.129 -14.069 -4.077 1.00 0.00 H ATOM 2243 HG2 LYS A 143 16.106 -14.793 -2.860 1.00 0.00 H ATOM 2244 HG3 LYS A 143 15.327 -16.344 -2.469 1.00 0.00 H ATOM 2245 HD2 LYS A 143 15.258 -16.908 -4.862 1.00 0.00 H ATOM 2246 HD3 LYS A 143 16.045 -15.360 -5.248 1.00 0.00 H ATOM 2247 HE2 LYS A 143 17.714 -17.131 -5.212 1.00 0.00 H ATOM 2248 HE3 LYS A 143 17.198 -17.627 -3.583 1.00 0.00 H ATOM 2249 HZ1 LYS A 143 18.403 -15.001 -4.301 1.00 0.00 H ATOM 2250 HZ2 LYS A 143 17.910 -15.475 -2.746 1.00 0.00 H ATOM 2251 HZ3 LYS A 143 19.196 -16.278 -3.510 1.00 0.00 H ATOM 2252 H LYS A 143 12.714 -16.222 -1.191 1.00 0.00 H ATOM 2253 N ALA A 144 12.000 -12.660 -2.862 1.00 16.84 N ATOM 2254 CA ALA A 144 10.720 -12.098 -3.245 1.00 16.66 C ATOM 2255 C ALA A 144 9.993 -13.097 -4.147 1.00 15.00 C ATOM 2256 O ALA A 144 10.626 -13.827 -4.915 1.00 15.34 O ATOM 2257 CB ALA A 144 10.926 -10.778 -3.965 1.00 19.20 C ATOM 2258 HA ALA A 144 10.117 -11.908 -2.357 1.00 0.00 H ATOM 2259 HB1 ALA A 144 11.440 -10.081 -3.303 1.00 0.00 H ATOM 2260 HB2 ALA A 144 11.527 -10.943 -4.859 1.00 0.00 H ATOM 2261 HB3 ALA A 144 9.958 -10.365 -4.248 1.00 0.00 H ATOM 2262 H ALA A 144 12.873 -12.129 -3.058 1.00 0.00 H ATOM 2263 N GLY A 145 8.671 -13.133 -4.032 1.00 17.52 N ATOM 2264 CA GLY A 145 7.844 -14.048 -4.800 1.00 17.60 C ATOM 2265 C GLY A 145 7.567 -15.356 -4.070 1.00 18.17 C ATOM 2266 O GLY A 145 6.772 -16.180 -4.533 1.00 18.64 O ATOM 2267 HA3 GLY A 145 8.353 -14.274 -5.737 1.00 0.00 H ATOM 2268 HA2 GLY A 145 6.893 -13.561 -5.013 1.00 0.00 H ATOM 2269 H GLY A 145 8.209 -12.481 -3.366 1.00 0.00 H ATOM 2270 N GLN A 146 8.219 -15.550 -2.926 1.00 13.20 N ATOM 2271 CA GLN A 146 8.046 -16.780 -2.151 1.00 15.03 C ATOM 2272 C GLN A 146 7.100 -16.659 -0.941 1.00 13.13 C ATOM 2273 O GLN A 146 6.889 -17.632 -0.215 1.00 11.93 O ATOM 2274 CB GLN A 146 9.416 -17.339 -1.730 1.00 15.66 C ATOM 2275 CG GLN A 146 10.315 -17.687 -2.917 1.00 16.23 C ATOM 2276 CD GLN A 146 11.634 -18.330 -2.513 1.00 17.85 C ATOM 2277 OE1 GLN A 146 12.106 -18.160 -1.390 1.00 16.84 O ATOM 2278 NE2 GLN A 146 12.236 -19.075 -3.438 1.00 20.20 N ATOM 2279 HA GLN A 146 7.547 -17.481 -2.820 1.00 0.00 H ATOM 2280 HB2 GLN A 146 9.922 -16.592 -1.119 1.00 0.00 H ATOM 2281 HB3 GLN A 146 9.256 -18.241 -1.140 1.00 0.00 H ATOM 2282 HG2 GLN A 146 9.778 -18.379 -3.565 1.00 0.00 H ATOM 2283 HG3 GLN A 146 10.532 -16.771 -3.466 1.00 0.00 H ATOM 2284 HE22 GLN A 146 11.801 -19.192 -4.375 1.00 0.00 H ATOM 2285 HE21 GLN A 146 13.141 -19.540 -3.223 1.00 0.00 H ATOM 2286 H GLN A 146 8.864 -14.813 -2.576 1.00 0.00 H ATOM 2287 N CYS A 147 6.546 -15.470 -0.706 1.00 15.42 N ATOM 2288 CA CYS A 147 5.600 -15.308 0.408 1.00 13.64 C ATOM 2289 C CYS A 147 4.348 -16.141 0.184 1.00 13.45 C ATOM 2290 O CYS A 147 3.865 -16.270 -0.940 1.00 12.12 O ATOM 2291 CB CYS A 147 5.242 -13.840 0.640 1.00 17.14 C ATOM 2292 SG CYS A 147 6.579 -12.906 1.427 1.00 16.29 S ATOM 2293 HA CYS A 147 6.096 -15.670 1.309 1.00 0.00 H ATOM 2294 HB2 CYS A 147 4.361 -13.793 1.280 1.00 0.00 H ATOM 2295 HB3 CYS A 147 5.015 -13.380 -0.322 1.00 0.00 H ATOM 2296 HG CYS A 147 6.182 -11.596 1.602 1.00 0.00 H ATOM 2297 H CYS A 147 6.783 -14.657 -1.310 1.00 0.00 H ATOM 2298 N GLY A 148 3.839 -16.718 1.270 1.00 10.44 N ATOM 2299 CA GLY A 148 2.734 -17.662 1.199 1.00 12.33 C ATOM 2300 C GLY A 148 3.196 -19.106 1.097 1.00 12.83 C ATOM 2301 O GLY A 148 2.388 -20.041 1.212 1.00 9.97 O ATOM 2302 HA3 GLY A 148 2.131 -17.427 0.322 1.00 0.00 H ATOM 2303 HA2 GLY A 148 2.125 -17.554 2.097 1.00 0.00 H ATOM 2304 H GLY A 148 4.244 -16.487 2.199 1.00 0.00 H ATOM 2305 N GLY A 149 4.493 -19.295 0.855 1.00 12.23 N ATOM 2306 CA GLY A 149 5.050 -20.627 0.726 1.00 10.40 C ATOM 2307 C GLY A 149 4.740 -21.409 1.987 1.00 10.38 C ATOM 2308 O GLY A 149 4.680 -20.836 3.064 1.00 12.25 O ATOM 2309 HA3 GLY A 149 6.130 -20.562 0.591 1.00 0.00 H ATOM 2310 HA2 GLY A 149 4.607 -21.128 -0.135 1.00 0.00 H ATOM 2311 H GLY A 149 5.118 -18.470 0.757 1.00 0.00 H ATOM 2312 N VAL A 150 4.534 -22.713 1.847 1.00 11.32 N ATOM 2313 CA VAL A 150 4.069 -23.519 2.975 1.00 13.01 C ATOM 2314 C VAL A 150 5.236 -24.301 3.556 1.00 13.45 C ATOM 2315 O VAL A 150 5.889 -25.071 2.852 1.00 11.19 O ATOM 2316 CB VAL A 150 2.933 -24.447 2.530 1.00 12.65 C ATOM 2317 CG1 VAL A 150 2.395 -25.286 3.696 1.00 13.52 C ATOM 2318 CG2 VAL A 150 1.825 -23.610 1.915 1.00 14.59 C ATOM 2319 HA VAL A 150 3.674 -22.867 3.754 1.00 0.00 H ATOM 2320 HB VAL A 150 3.322 -25.146 1.790 1.00 0.00 H ATOM 2321 HG11 VAL A 150 3.200 -25.899 4.103 1.00 0.00 H ATOM 2322 HG12 VAL A 150 2.013 -24.624 4.473 1.00 0.00 H ATOM 2323 HG13 VAL A 150 1.592 -25.930 3.338 1.00 0.00 H ATOM 2324 HG21 VAL A 150 1.454 -22.901 2.655 1.00 0.00 H ATOM 2325 HG22 VAL A 150 2.216 -23.067 1.054 1.00 0.00 H ATOM 2326 HG23 VAL A 150 1.013 -24.263 1.596 1.00 0.00 H ATOM 2327 H VAL A 150 4.705 -23.166 0.926 1.00 0.00 H ATOM 2328 N VAL A 151 5.498 -24.080 4.840 1.00 11.17 N ATOM 2329 CA VAL A 151 6.589 -24.761 5.532 1.00 14.08 C ATOM 2330 C VAL A 151 6.094 -26.092 6.053 1.00 11.46 C ATOM 2331 O VAL A 151 5.143 -26.151 6.832 1.00 13.77 O ATOM 2332 CB VAL A 151 7.140 -23.906 6.678 1.00 11.24 C ATOM 2333 CG1 VAL A 151 8.364 -24.567 7.319 1.00 13.79 C ATOM 2334 CG2 VAL A 151 7.522 -22.530 6.156 1.00 14.13 C ATOM 2335 HA VAL A 151 7.404 -24.926 4.827 1.00 0.00 H ATOM 2336 HB VAL A 151 6.362 -23.811 7.436 1.00 0.00 H ATOM 2337 HG11 VAL A 151 8.083 -25.543 7.715 1.00 0.00 H ATOM 2338 HG12 VAL A 151 9.144 -24.689 6.568 1.00 0.00 H ATOM 2339 HG13 VAL A 151 8.733 -23.938 8.129 1.00 0.00 H ATOM 2340 HG21 VAL A 151 8.285 -22.634 5.384 1.00 0.00 H ATOM 2341 HG22 VAL A 151 6.641 -22.045 5.735 1.00 0.00 H ATOM 2342 HG23 VAL A 151 7.913 -21.927 6.976 1.00 0.00 H ATOM 2343 H VAL A 151 4.910 -23.403 5.367 1.00 0.00 H ATOM 2344 N THR A 152 6.716 -27.165 5.584 1.00 14.64 N ATOM 2345 CA THR A 152 6.245 -28.502 5.915 1.00 14.58 C ATOM 2346 C THR A 152 7.354 -29.364 6.497 1.00 20.08 C ATOM 2347 O THR A 152 8.528 -29.196 6.184 1.00 19.11 O ATOM 2348 CB THR A 152 5.692 -29.215 4.665 1.00 20.27 C ATOM 2349 OG1 THR A 152 6.760 -29.445 3.740 1.00 21.79 O ATOM 2350 CG2 THR A 152 4.632 -28.356 3.983 1.00 21.63 C ATOM 2351 HA THR A 152 5.458 -28.376 6.658 1.00 0.00 H ATOM 2352 HB THR A 152 5.244 -30.160 4.974 1.00 0.00 H ATOM 2353 HG1 THR A 152 7.160 -28.578 3.478 1.00 0.00 H ATOM 2354 HG23 THR A 152 3.812 -28.173 4.678 1.00 0.00 H ATOM 2355 HG21 THR A 152 5.074 -27.406 3.683 1.00 0.00 H ATOM 2356 HG22 THR A 152 4.255 -28.877 3.103 1.00 0.00 H ATOM 2357 H THR A 152 7.550 -27.050 4.973 1.00 0.00 H ATOM 2358 N SER A 153 6.972 -30.296 7.355 1.00 20.38 N ATOM 2359 CA SER A 153 7.924 -31.276 7.835 1.00 26.29 C ATOM 2360 C SER A 153 7.228 -32.618 7.851 1.00 27.40 C ATOM 2361 O SER A 153 6.140 -32.760 7.284 1.00 30.94 O ATOM 2362 CB SER A 153 8.449 -30.902 9.218 1.00 28.77 C ATOM 2363 OG SER A 153 9.560 -31.713 9.577 1.00 38.77 O ATOM 2364 HA SER A 153 8.793 -31.314 7.178 1.00 0.00 H ATOM 2365 HB2 SER A 153 7.654 -31.041 9.951 1.00 0.00 H ATOM 2366 HB3 SER A 153 8.757 -29.857 9.212 1.00 0.00 H ATOM 2367 HG SER A 153 9.881 -31.451 10.476 1.00 0.00 H ATOM 2368 H SER A 153 5.986 -30.325 7.685 1.00 0.00 H ATOM 2369 N VAL A 154 7.875 -33.599 8.463 1.00 24.49 N ATOM 2370 CA VAL A 154 7.314 -34.930 8.623 1.00 25.78 C ATOM 2371 C VAL A 154 5.822 -34.902 8.924 1.00 22.34 C ATOM 2372 O VAL A 154 5.414 -34.862 10.082 1.00 20.86 O ATOM 2373 CB VAL A 154 8.041 -35.698 9.752 1.00 32.91 C ATOM 2374 CG1 VAL A 154 9.376 -36.224 9.259 1.00 36.00 C ATOM 2375 CG2 VAL A 154 8.238 -34.799 10.963 1.00 36.51 C ATOM 2376 HA VAL A 154 7.459 -35.440 7.671 1.00 0.00 H ATOM 2377 HB VAL A 154 7.423 -36.546 10.048 1.00 0.00 H ATOM 2378 HG11 VAL A 154 9.211 -36.899 8.419 1.00 0.00 H ATOM 2379 HG12 VAL A 154 9.999 -35.388 8.939 1.00 0.00 H ATOM 2380 HG13 VAL A 154 9.874 -36.762 10.066 1.00 0.00 H ATOM 2381 HG21 VAL A 154 8.837 -33.934 10.678 1.00 0.00 H ATOM 2382 HG22 VAL A 154 7.267 -34.465 11.328 1.00 0.00 H ATOM 2383 HG23 VAL A 154 8.751 -35.356 11.747 1.00 0.00 H ATOM 2384 H VAL A 154 8.824 -33.409 8.845 1.00 0.00 H ATOM 2385 N GLY A 155 5.010 -34.925 7.874 1.00 29.68 N ATOM 2386 CA GLY A 155 3.568 -34.980 8.026 1.00 30.23 C ATOM 2387 C GLY A 155 2.945 -33.823 8.779 1.00 28.52 C ATOM 2388 O GLY A 155 1.847 -33.955 9.326 1.00 29.03 O ATOM 2389 HA3 GLY A 155 3.321 -35.899 8.558 1.00 0.00 H ATOM 2390 HA2 GLY A 155 3.126 -35.009 7.030 1.00 0.00 H ATOM 2391 H GLY A 155 5.418 -34.903 6.918 1.00 0.00 H ATOM 2392 N LYS A 156 3.633 -32.686 8.817 1.00 20.72 N ATOM 2393 CA LYS A 156 3.077 -31.507 9.476 1.00 18.40 C ATOM 2394 C LYS A 156 3.170 -30.263 8.600 1.00 19.79 C ATOM 2395 O LYS A 156 4.041 -30.166 7.738 1.00 17.28 O ATOM 2396 CB LYS A 156 3.751 -31.257 10.828 1.00 22.46 C ATOM 2397 CG LYS A 156 3.312 -32.228 11.908 1.00 25.61 C ATOM 2398 CD LYS A 156 3.698 -31.758 13.300 1.00 29.50 C ATOM 2399 CE LYS A 156 2.806 -32.421 14.350 1.00 35.18 C ATOM 2400 NZ LYS A 156 3.131 -31.998 15.745 1.00 43.32 N ATOM 2401 HA LYS A 156 2.020 -31.713 9.647 1.00 0.00 H ATOM 2402 HB2 LYS A 156 4.830 -31.348 10.699 1.00 0.00 H ATOM 2403 HB3 LYS A 156 3.509 -30.245 11.153 1.00 0.00 H ATOM 2404 HG2 LYS A 156 2.228 -32.336 11.863 1.00 0.00 H ATOM 2405 HG3 LYS A 156 3.781 -33.194 11.722 1.00 0.00 H ATOM 2406 HD2 LYS A 156 4.738 -32.021 13.493 1.00 0.00 H ATOM 2407 HD3 LYS A 156 3.581 -30.676 13.360 1.00 0.00 H ATOM 2408 HE2 LYS A 156 2.928 -33.502 14.277 1.00 0.00 H ATOM 2409 HE3 LYS A 156 1.769 -32.159 14.140 1.00 0.00 H ATOM 2410 HZ1 LYS A 156 4.116 -32.251 15.962 1.00 0.00 H ATOM 2411 HZ2 LYS A 156 3.009 -30.969 15.831 1.00 0.00 H ATOM 2412 HZ3 LYS A 156 2.493 -32.481 16.410 1.00 0.00 H ATOM 2413 H LYS A 156 4.573 -32.636 8.375 1.00 0.00 H ATOM 2414 N VAL A 157 2.247 -29.329 8.816 1.00 18.87 N ATOM 2415 CA VAL A 157 2.249 -28.039 8.129 1.00 16.03 C ATOM 2416 C VAL A 157 2.420 -27.009 9.234 1.00 17.42 C ATOM 2417 O VAL A 157 1.512 -26.822 10.047 1.00 13.86 O ATOM 2418 CB VAL A 157 0.907 -27.785 7.384 1.00 16.75 C ATOM 2419 CG1 VAL A 157 0.852 -26.344 6.851 1.00 16.91 C ATOM 2420 CG2 VAL A 157 0.696 -28.806 6.275 1.00 18.64 C ATOM 2421 HA VAL A 157 3.036 -27.995 7.377 1.00 0.00 H ATOM 2422 HB VAL A 157 0.089 -27.908 8.093 1.00 0.00 H ATOM 2423 HG11 VAL A 157 0.933 -25.646 7.685 1.00 0.00 H ATOM 2424 HG12 VAL A 157 1.678 -26.182 6.159 1.00 0.00 H ATOM 2425 HG13 VAL A 157 -0.094 -26.185 6.333 1.00 0.00 H ATOM 2426 HG21 VAL A 157 1.513 -28.735 5.557 1.00 0.00 H ATOM 2427 HG22 VAL A 157 0.674 -29.808 6.704 1.00 0.00 H ATOM 2428 HG23 VAL A 157 -0.250 -28.604 5.772 1.00 0.00 H ATOM 2429 H VAL A 157 1.492 -29.525 9.503 1.00 0.00 H ATOM 2430 N ILE A 158 3.580 -26.355 9.289 1.00 11.27 N ATOM 2431 CA ILE A 158 3.950 -25.603 10.492 1.00 11.98 C ATOM 2432 C ILE A 158 4.041 -24.090 10.313 1.00 10.98 C ATOM 2433 O ILE A 158 4.100 -23.355 11.294 1.00 11.52 O ATOM 2434 CB ILE A 158 5.296 -26.103 11.077 1.00 13.29 C ATOM 2435 CG1 ILE A 158 6.466 -25.763 10.141 1.00 12.66 C ATOM 2436 CG2 ILE A 158 5.225 -27.593 11.348 1.00 14.21 C ATOM 2437 CD1 ILE A 158 7.870 -26.038 10.749 1.00 15.12 C ATOM 2438 HA ILE A 158 3.124 -25.794 11.177 1.00 0.00 H ATOM 2439 HB ILE A 158 5.475 -25.590 12.022 1.00 0.00 H ATOM 2440 HG12 ILE A 158 6.363 -26.359 9.234 1.00 0.00 H ATOM 2441 HG13 ILE A 158 6.405 -24.705 9.887 1.00 0.00 H ATOM 2442 HD11 ILE A 158 7.997 -25.440 11.651 1.00 0.00 H ATOM 2443 HD12 ILE A 158 7.956 -27.096 10.998 1.00 0.00 H ATOM 2444 HD13 ILE A 158 8.638 -25.771 10.023 1.00 0.00 H ATOM 2445 HG21 ILE A 158 4.427 -27.793 12.063 1.00 0.00 H ATOM 2446 HG22 ILE A 158 5.021 -28.121 10.417 1.00 0.00 H ATOM 2447 HG23 ILE A 158 6.176 -27.932 11.759 1.00 0.00 H ATOM 2448 H ILE A 158 4.226 -26.378 8.474 1.00 0.00 H ATOM 2449 N GLY A 159 4.033 -23.617 9.075 1.00 12.25 N ATOM 2450 CA GLY A 159 4.211 -22.193 8.847 1.00 11.83 C ATOM 2451 C GLY A 159 3.905 -21.719 7.444 1.00 13.86 C ATOM 2452 O GLY A 159 3.810 -22.509 6.494 1.00 13.24 O ATOM 2453 HA3 GLY A 159 5.249 -21.944 9.068 1.00 0.00 H ATOM 2454 HA2 GLY A 159 3.556 -21.657 9.534 1.00 0.00 H ATOM 2455 H GLY A 159 3.900 -24.262 8.270 1.00 0.00 H ATOM 2456 N ILE A 160 3.754 -20.403 7.333 1.00 12.45 N ATOM 2457 CA ILE A 160 3.575 -19.712 6.062 1.00 10.53 C ATOM 2458 C ILE A 160 4.663 -18.649 5.896 1.00 10.67 C ATOM 2459 O ILE A 160 4.870 -17.811 6.776 1.00 11.49 O ATOM 2460 CB ILE A 160 2.200 -19.018 5.987 1.00 11.09 C ATOM 2461 CG1 ILE A 160 1.062 -20.014 6.262 1.00 12.57 C ATOM 2462 CG2 ILE A 160 2.032 -18.334 4.626 1.00 12.18 C ATOM 2463 CD1 ILE A 160 0.899 -21.076 5.188 1.00 15.97 C ATOM 2464 HA ILE A 160 3.639 -20.457 5.269 1.00 0.00 H ATOM 2465 HB ILE A 160 2.151 -18.253 6.762 1.00 0.00 H ATOM 2466 HG12 ILE A 160 1.264 -20.513 7.210 1.00 0.00 H ATOM 2467 HG13 ILE A 160 0.129 -19.456 6.338 1.00 0.00 H ATOM 2468 HD11 ILE A 160 0.684 -20.596 4.233 1.00 0.00 H ATOM 2469 HD12 ILE A 160 1.820 -21.653 5.106 1.00 0.00 H ATOM 2470 HD13 ILE A 160 0.076 -21.739 5.456 1.00 0.00 H ATOM 2471 HG21 ILE A 160 2.818 -17.590 4.495 1.00 0.00 H ATOM 2472 HG22 ILE A 160 2.101 -19.080 3.835 1.00 0.00 H ATOM 2473 HG23 ILE A 160 1.058 -17.847 4.583 1.00 0.00 H ATOM 2474 H ILE A 160 3.764 -19.834 8.203 1.00 0.00 H ATOM 2475 N HIS A 161 5.370 -18.684 4.770 1.00 11.98 N ATOM 2476 CA HIS A 161 6.477 -17.752 4.563 1.00 12.89 C ATOM 2477 C HIS A 161 6.010 -16.296 4.478 1.00 13.87 C ATOM 2478 O HIS A 161 5.061 -15.988 3.756 1.00 13.53 O ATOM 2479 CB HIS A 161 7.253 -18.104 3.295 1.00 13.31 C ATOM 2480 CG HIS A 161 8.549 -17.369 3.195 1.00 14.37 C ATOM 2481 ND1 HIS A 161 9.613 -17.638 4.024 1.00 15.12 N ATOM 2482 CD2 HIS A 161 8.932 -16.326 2.418 1.00 14.66 C ATOM 2483 CE1 HIS A 161 10.613 -16.819 3.746 1.00 14.93 C ATOM 2484 NE2 HIS A 161 10.217 -16.009 2.767 1.00 15.01 N ATOM 2485 HA HIS A 161 7.126 -17.849 5.434 1.00 0.00 H ATOM 2486 HB2 HIS A 161 7.457 -19.175 3.296 1.00 0.00 H ATOM 2487 HB3 HIS A 161 6.641 -17.853 2.429 1.00 0.00 H ATOM 2488 HD2 HIS A 161 8.329 -15.832 1.657 1.00 0.00 H ATOM 2489 HE1 HIS A 161 11.588 -16.809 4.232 1.00 0.00 H ATOM 2490 H HIS A 161 5.134 -19.378 4.033 1.00 0.00 H ATOM 2491 N ILE A 162 6.696 -15.400 5.188 1.00 9.14 N ATOM 2492 CA ILE A 162 6.264 -14.003 5.258 1.00 9.80 C ATOM 2493 C ILE A 162 7.336 -12.946 4.988 1.00 12.23 C ATOM 2494 O ILE A 162 7.009 -11.798 4.706 1.00 12.36 O ATOM 2495 CB ILE A 162 5.600 -13.659 6.612 1.00 9.79 C ATOM 2496 CG1 ILE A 162 6.580 -13.860 7.786 1.00 10.82 C ATOM 2497 CG2 ILE A 162 4.290 -14.421 6.778 1.00 11.43 C ATOM 2498 CD1 ILE A 162 5.961 -13.567 9.146 1.00 12.33 C ATOM 2499 HA ILE A 162 5.549 -13.952 4.437 1.00 0.00 H ATOM 2500 HB ILE A 162 5.345 -12.599 6.619 1.00 0.00 H ATOM 2501 HG12 ILE A 162 6.923 -14.895 7.777 1.00 0.00 H ATOM 2502 HG13 ILE A 162 7.432 -13.195 7.643 1.00 0.00 H ATOM 2503 HD11 ILE A 162 5.623 -12.531 9.174 1.00 0.00 H ATOM 2504 HD12 ILE A 162 5.113 -14.232 9.309 1.00 0.00 H ATOM 2505 HD13 ILE A 162 6.706 -13.729 9.925 1.00 0.00 H ATOM 2506 HG21 ILE A 162 3.609 -14.150 5.972 1.00 0.00 H ATOM 2507 HG22 ILE A 162 4.487 -15.492 6.744 1.00 0.00 H ATOM 2508 HG23 ILE A 162 3.841 -14.164 7.737 1.00 0.00 H ATOM 2509 H ILE A 162 7.551 -15.698 5.700 1.00 0.00 H ATOM 2510 N GLY A 163 8.605 -13.319 5.084 1.00 16.07 N ATOM 2511 CA GLY A 163 9.652 -12.324 4.957 1.00 14.77 C ATOM 2512 C GLY A 163 11.049 -12.894 5.014 1.00 17.32 C ATOM 2513 O GLY A 163 11.249 -14.086 5.224 1.00 19.25 O ATOM 2514 HA3 GLY A 163 9.542 -11.604 5.768 1.00 0.00 H ATOM 2515 HA2 GLY A 163 9.528 -11.815 4.001 1.00 0.00 H ATOM 2516 H GLY A 163 8.847 -14.317 5.249 1.00 0.00 H ATOM 2517 N GLY A 164 12.028 -12.017 4.834 1.00 20.92 N ATOM 2518 CA GLY A 164 13.414 -12.426 4.810 1.00 19.99 C ATOM 2519 C GLY A 164 14.281 -11.208 4.596 1.00 22.89 C ATOM 2520 O GLY A 164 13.795 -10.151 4.176 1.00 22.02 O ATOM 2521 HA3 GLY A 164 13.572 -13.135 3.998 1.00 0.00 H ATOM 2522 HA2 GLY A 164 13.673 -12.898 5.758 1.00 0.00 H ATOM 2523 H GLY A 164 11.793 -11.012 4.707 1.00 0.00 H ATOM 2524 N ASN A 165 15.566 -11.358 4.889 1.00 22.27 N ATOM 2525 CA ASN A 165 16.500 -10.243 4.749 1.00 21.62 C ATOM 2526 C ASN A 165 17.551 -10.484 3.666 1.00 22.02 C ATOM 2527 O ASN A 165 18.490 -9.697 3.501 1.00 23.17 O ATOM 2528 CB ASN A 165 17.165 -9.957 6.094 1.00 24.60 C ATOM 2529 CG ASN A 165 17.815 -11.181 6.689 1.00 23.01 C ATOM 2530 OD1 ASN A 165 18.131 -12.135 5.977 1.00 23.80 O ATOM 2531 ND2 ASN A 165 18.024 -11.164 7.999 1.00 26.15 N ATOM 2532 HA ASN A 165 15.926 -9.373 4.431 1.00 0.00 H ATOM 2533 HB2 ASN A 165 17.927 -9.191 5.952 1.00 0.00 H ATOM 2534 HB3 ASN A 165 16.408 -9.591 6.788 1.00 0.00 H ATOM 2535 HD22 ASN A 165 17.740 -10.336 8.560 1.00 0.00 H ATOM 2536 HD21 ASN A 165 18.472 -11.979 8.465 1.00 0.00 H ATOM 2537 H ASN A 165 15.913 -12.280 5.222 1.00 0.00 H ATOM 2538 N GLY A 166 17.392 -11.579 2.932 1.00 18.96 N ATOM 2539 CA GLY A 166 18.323 -11.934 1.881 1.00 23.30 C ATOM 2540 C GLY A 166 19.188 -13.106 2.295 1.00 19.33 C ATOM 2541 O GLY A 166 19.776 -13.787 1.456 1.00 22.72 O ATOM 2542 HA3 GLY A 166 18.962 -11.077 1.666 1.00 0.00 H ATOM 2543 HA2 GLY A 166 17.764 -12.202 0.985 1.00 0.00 H ATOM 2544 H GLY A 166 16.577 -12.198 3.117 1.00 0.00 H ATOM 2545 N ARG A 167 19.186 -13.388 3.566 1.00 21.12 N ATOM 2546 CA ARG A 167 20.049 -14.369 4.136 1.00 23.28 C ATOM 2547 C ARG A 167 19.283 -15.447 4.889 1.00 21.10 C ATOM 2548 O ARG A 167 19.607 -16.587 4.838 1.00 21.02 O ATOM 2549 CB ARG A 167 20.962 -13.637 5.100 1.00 24.82 C ATOM 2550 CG ARG A 167 21.779 -14.487 5.940 1.00 30.36 C ATOM 2551 CD ARG A 167 22.808 -13.652 6.660 1.00 34.14 C ATOM 2552 NE ARG A 167 22.561 -13.441 8.069 1.00 37.39 N ATOM 2553 CZ ARG A 167 22.171 -12.283 8.563 1.00 35.67 C ATOM 2554 NH1 ARG A 167 21.969 -11.257 7.758 1.00 28.73 N ATOM 2555 NH2 ARG A 167 21.978 -12.167 9.836 1.00 34.00 N ATOM 2556 HA ARG A 167 20.600 -14.872 3.341 1.00 0.00 H ATOM 2557 HB2 ARG A 167 21.627 -12.999 4.517 1.00 0.00 H ATOM 2558 HB3 ARG A 167 20.342 -13.018 5.748 1.00 0.00 H ATOM 2559 HG2 ARG A 167 21.146 -14.992 6.670 1.00 0.00 H ATOM 2560 HG3 ARG A 167 22.283 -15.231 5.322 1.00 0.00 H ATOM 2561 HD2 ARG A 167 22.848 -12.676 6.176 1.00 0.00 H ATOM 2562 HD3 ARG A 167 23.774 -14.147 6.558 1.00 0.00 H ATOM 2563 HE ARG A 167 22.697 -14.239 8.722 1.00 0.00 H ATOM 2564 HH12 ARG A 167 21.661 -10.343 8.148 1.00 0.00 H ATOM 2565 HH11 ARG A 167 22.118 -11.362 6.734 1.00 0.00 H ATOM 2566 HH22 ARG A 167 21.670 -11.257 10.234 1.00 0.00 H ATOM 2567 HH21 ARG A 167 22.131 -12.984 10.462 1.00 0.00 H ATOM 2568 H ARG A 167 18.529 -12.878 4.190 1.00 0.00 H ATOM 2569 N GLN A 168 18.277 -15.002 5.616 1.00 22.13 N ATOM 2570 CA GLN A 168 17.419 -15.886 6.384 1.00 20.69 C ATOM 2571 C GLN A 168 15.987 -15.665 5.951 1.00 18.02 C ATOM 2572 O GLN A 168 15.655 -14.615 5.400 1.00 19.21 O ATOM 2573 CB GLN A 168 17.515 -15.577 7.871 1.00 21.75 C ATOM 2574 CG GLN A 168 18.897 -15.712 8.488 1.00 24.19 C ATOM 2575 CD GLN A 168 19.009 -14.902 9.769 1.00 30.79 C ATOM 2576 OE1 GLN A 168 18.663 -13.717 9.800 1.00 32.50 O ATOM 2577 NE2 GLN A 168 19.479 -15.537 10.832 1.00 36.57 N ATOM 2578 HA GLN A 168 17.733 -16.915 6.210 1.00 0.00 H ATOM 2579 HB2 GLN A 168 17.180 -14.551 8.022 1.00 0.00 H ATOM 2580 HB3 GLN A 168 16.846 -16.257 8.398 1.00 0.00 H ATOM 2581 HG2 GLN A 168 19.085 -16.762 8.713 1.00 0.00 H ATOM 2582 HG3 GLN A 168 19.641 -15.356 7.776 1.00 0.00 H ATOM 2583 HE22 GLN A 168 19.758 -16.536 10.759 1.00 0.00 H ATOM 2584 HE21 GLN A 168 19.569 -15.037 11.739 1.00 0.00 H ATOM 2585 H GLN A 168 18.091 -13.979 5.640 1.00 0.00 H ATOM 2586 N GLY A 169 15.141 -16.647 6.226 1.00 17.93 N ATOM 2587 CA GLY A 169 13.721 -16.548 5.927 1.00 17.47 C ATOM 2588 C GLY A 169 12.882 -16.700 7.186 1.00 16.98 C ATOM 2589 O GLY A 169 13.306 -17.332 8.154 1.00 17.09 O ATOM 2590 HA3 GLY A 169 13.450 -17.334 5.222 1.00 0.00 H ATOM 2591 HA2 GLY A 169 13.519 -15.575 5.480 1.00 0.00 H ATOM 2592 H GLY A 169 15.503 -17.515 6.669 1.00 0.00 H ATOM 2593 N PHE A 170 11.689 -16.109 7.185 1.00 15.65 N ATOM 2594 CA PHE A 170 10.819 -16.160 8.355 1.00 12.92 C ATOM 2595 C PHE A 170 9.418 -16.569 7.962 1.00 13.52 C ATOM 2596 O PHE A 170 8.934 -16.153 6.926 1.00 14.24 O ATOM 2597 CB PHE A 170 10.741 -14.791 9.018 1.00 17.43 C ATOM 2598 CG PHE A 170 12.065 -14.285 9.492 1.00 18.12 C ATOM 2599 CD1 PHE A 170 12.898 -13.603 8.626 1.00 21.68 C ATOM 2600 CD2 PHE A 170 12.478 -14.517 10.787 1.00 20.35 C ATOM 2601 CE1 PHE A 170 14.130 -13.143 9.051 1.00 23.47 C ATOM 2602 CE2 PHE A 170 13.712 -14.070 11.224 1.00 20.46 C ATOM 2603 CZ PHE A 170 14.529 -13.377 10.358 1.00 20.38 C ATOM 2604 HA PHE A 170 11.240 -16.891 9.046 1.00 0.00 H ATOM 2605 HB2 PHE A 170 10.337 -14.080 8.297 1.00 0.00 H ATOM 2606 HB3 PHE A 170 10.070 -14.859 9.874 1.00 0.00 H ATOM 2607 HD2 PHE A 170 11.826 -15.058 11.473 1.00 0.00 H ATOM 2608 HE2 PHE A 170 14.036 -14.265 12.246 1.00 0.00 H ATOM 2609 HZ PHE A 170 15.496 -13.010 10.703 1.00 0.00 H ATOM 2610 HE1 PHE A 170 14.782 -12.601 8.365 1.00 0.00 H ATOM 2611 HD1 PHE A 170 12.581 -13.426 7.598 1.00 0.00 H ATOM 2612 H PHE A 170 11.371 -15.602 6.335 1.00 0.00 H ATOM 2613 N CYS A 171 8.788 -17.389 8.793 1.00 13.19 N ATOM 2614 CA CYS A 171 7.390 -17.759 8.586 1.00 11.15 C ATOM 2615 C CYS A 171 6.518 -17.340 9.763 1.00 13.31 C ATOM 2616 O CYS A 171 6.994 -17.187 10.886 1.00 15.49 O ATOM 2617 CB CYS A 171 7.254 -19.264 8.321 1.00 11.87 C ATOM 2618 SG CYS A 171 7.700 -20.357 9.710 1.00 14.07 S ATOM 2619 HA CYS A 171 7.038 -17.221 7.705 1.00 0.00 H ATOM 2620 HB2 CYS A 171 7.897 -19.515 7.478 1.00 0.00 H ATOM 2621 HB3 CYS A 171 6.216 -19.465 8.057 1.00 0.00 H ATOM 2622 HG CYS A 171 7.530 -21.673 9.331 1.00 0.00 H ATOM 2623 H CYS A 171 9.301 -17.777 9.610 1.00 0.00 H ATOM 2624 N ALA A 172 5.230 -17.150 9.508 1.00 11.44 N ATOM 2625 CA ALA A 172 4.258 -17.066 10.591 1.00 14.64 C ATOM 2626 C ALA A 172 3.955 -18.486 11.021 1.00 10.28 C ATOM 2627 O ALA A 172 3.612 -19.323 10.196 1.00 11.71 O ATOM 2628 CB ALA A 172 2.991 -16.410 10.105 1.00 11.88 C ATOM 2629 HA ALA A 172 4.653 -16.474 11.417 1.00 0.00 H ATOM 2630 HB1 ALA A 172 3.217 -15.405 9.749 1.00 0.00 H ATOM 2631 HB2 ALA A 172 2.568 -16.998 9.291 1.00 0.00 H ATOM 2632 HB3 ALA A 172 2.275 -16.354 10.925 1.00 0.00 H ATOM 2633 H ALA A 172 4.910 -17.060 8.523 1.00 0.00 H ATOM 2634 N GLY A 173 4.069 -18.772 12.311 1.00 13.64 N ATOM 2635 CA GLY A 173 3.741 -20.099 12.789 1.00 18.42 C ATOM 2636 C GLY A 173 2.258 -20.389 12.635 1.00 15.83 C ATOM 2637 O GLY A 173 1.426 -19.496 12.777 1.00 16.18 O ATOM 2638 HA3 GLY A 173 4.010 -20.174 13.842 1.00 0.00 H ATOM 2639 HA2 GLY A 173 4.308 -20.833 12.217 1.00 0.00 H ATOM 2640 H GLY A 173 4.394 -18.044 12.979 1.00 0.00 H ATOM 2641 N LEU A 174 1.929 -21.641 12.352 1.00 16.72 N ATOM 2642 CA LEU A 174 0.534 -22.071 12.295 1.00 14.33 C ATOM 2643 C LEU A 174 0.173 -22.908 13.515 1.00 14.92 C ATOM 2644 O LEU A 174 0.972 -23.726 13.985 1.00 15.63 O ATOM 2645 CB LEU A 174 0.261 -22.878 11.028 1.00 13.86 C ATOM 2646 CG LEU A 174 0.364 -22.134 9.692 1.00 13.51 C ATOM 2647 CD1 LEU A 174 0.051 -23.099 8.539 1.00 16.77 C ATOM 2648 CD2 LEU A 174 -0.559 -20.903 9.689 1.00 14.71 C ATOM 2649 HA LEU A 174 -0.084 -21.173 12.283 1.00 0.00 H ATOM 2650 HB2 LEU A 174 0.975 -23.701 11.002 1.00 0.00 H ATOM 2651 HB3 LEU A 174 -0.750 -23.278 11.104 1.00 0.00 H ATOM 2652 HG LEU A 174 1.381 -21.768 9.553 1.00 0.00 H ATOM 2653 HD21 LEU A 174 -1.590 -21.223 9.838 1.00 0.00 H ATOM 2654 HD22 LEU A 174 -0.266 -20.229 10.494 1.00 0.00 H ATOM 2655 HD23 LEU A 174 -0.472 -20.388 8.732 1.00 0.00 H ATOM 2656 HD11 LEU A 174 0.765 -23.922 8.552 1.00 0.00 H ATOM 2657 HD12 LEU A 174 -0.959 -23.491 8.659 1.00 0.00 H ATOM 2658 HD13 LEU A 174 0.125 -22.566 7.591 1.00 0.00 H ATOM 2659 H LEU A 174 2.682 -22.334 12.166 1.00 0.00 H ATOM 2660 N LYS A 175 -1.005 -22.674 14.052 1.00 16.21 N ATOM 2661 CA LYS A 175 -1.587 -23.562 15.027 1.00 17.00 C ATOM 2662 C LYS A 175 -3.045 -23.926 14.616 1.00 16.59 C ATOM 2663 O LYS A 175 -3.691 -23.191 13.969 1.00 16.60 O ATOM 2664 CB LYS A 175 -1.518 -22.967 16.403 1.00 20.32 C ATOM 2665 CG LYS A 175 -2.505 -21.965 16.643 1.00 22.17 C ATOM 2666 CD LYS A 175 -2.040 -20.969 17.628 1.00 29.52 C ATOM 2667 CE LYS A 175 -1.487 -21.542 18.856 1.00 29.84 C ATOM 2668 NZ LYS A 175 -1.451 -20.490 19.853 1.00 37.90 N ATOM 2669 HA LYS A 175 -1.010 -24.486 15.055 1.00 0.00 H ATOM 2670 HB2 LYS A 175 -1.654 -23.766 17.131 1.00 0.00 H ATOM 2671 HB3 LYS A 175 -0.533 -22.520 16.536 1.00 0.00 H ATOM 2672 HG2 LYS A 175 -2.729 -21.457 15.705 1.00 0.00 H ATOM 2673 HG3 LYS A 175 -3.409 -22.442 17.022 1.00 0.00 H ATOM 2674 HD2 LYS A 175 -1.268 -20.360 17.158 1.00 0.00 H ATOM 2675 HD3 LYS A 175 -2.886 -20.336 17.898 1.00 0.00 H ATOM 2676 HE2 LYS A 175 -0.479 -21.915 18.672 1.00 0.00 H ATOM 2677 HE3 LYS A 175 -2.118 -22.361 19.202 1.00 0.00 H ATOM 2678 HZ1 LYS A 175 -0.850 -19.712 19.513 1.00 0.00 H ATOM 2679 HZ2 LYS A 175 -2.415 -20.138 20.019 1.00 0.00 H ATOM 2680 HZ3 LYS A 175 -1.061 -20.868 20.740 1.00 0.00 H ATOM 2681 H LYS A 175 -1.531 -21.824 13.765 1.00 0.00 H ATOM 2682 N ARG A 176 -3.487 -25.101 14.987 1.00 12.94 N ATOM 2683 CA ARG A 176 -4.753 -25.625 14.495 1.00 13.14 C ATOM 2684 C ARG A 176 -5.928 -24.717 14.839 1.00 13.99 C ATOM 2685 O ARG A 176 -6.854 -24.553 14.038 1.00 15.30 O ATOM 2686 CB ARG A 176 -4.990 -27.033 15.047 1.00 13.32 C ATOM 2687 CG ARG A 176 -5.966 -27.849 14.221 1.00 13.23 C ATOM 2688 CD ARG A 176 -6.099 -29.284 14.747 1.00 13.24 C ATOM 2689 NE ARG A 176 -4.841 -30.013 14.684 1.00 17.75 N ATOM 2690 CZ ARG A 176 -4.543 -31.084 15.418 1.00 20.23 C ATOM 2691 NH1 ARG A 176 -5.423 -31.572 16.290 1.00 19.48 N ATOM 2692 NH2 ARG A 176 -3.354 -31.669 15.284 1.00 16.19 N ATOM 2693 HA ARG A 176 -4.687 -25.667 13.408 1.00 0.00 H ATOM 2694 HB2 ARG A 176 -4.036 -27.559 15.073 1.00 0.00 H ATOM 2695 HB3 ARG A 176 -5.383 -26.945 16.060 1.00 0.00 H ATOM 2696 HG2 ARG A 176 -6.944 -27.369 14.254 1.00 0.00 H ATOM 2697 HG3 ARG A 176 -5.614 -27.882 13.190 1.00 0.00 H ATOM 2698 HD2 ARG A 176 -6.840 -29.811 14.146 1.00 0.00 H ATOM 2699 HD3 ARG A 176 -6.432 -29.248 15.784 1.00 0.00 H ATOM 2700 HE ARG A 176 -4.121 -29.672 14.016 1.00 0.00 H ATOM 2701 HH12 ARG A 176 -5.182 -32.409 16.859 1.00 0.00 H ATOM 2702 HH11 ARG A 176 -6.351 -31.117 16.402 1.00 0.00 H ATOM 2703 HH22 ARG A 176 -3.119 -32.505 15.856 1.00 0.00 H ATOM 2704 HH21 ARG A 176 -2.661 -31.290 14.608 1.00 0.00 H ATOM 2705 H ARG A 176 -2.922 -25.672 15.647 1.00 0.00 H ATOM 2706 N SER A 177 -5.898 -24.133 16.031 1.00 17.72 N ATOM 2707 CA SER A 177 -7.014 -23.309 16.481 1.00 17.21 C ATOM 2708 C SER A 177 -7.316 -22.118 15.561 1.00 18.72 C ATOM 2709 O SER A 177 -8.432 -21.630 15.540 1.00 17.63 O ATOM 2710 CB SER A 177 -6.816 -22.852 17.935 1.00 16.38 C ATOM 2711 OG SER A 177 -5.677 -22.015 18.067 1.00 19.05 O ATOM 2712 HA SER A 177 -7.894 -23.950 16.433 1.00 0.00 H ATOM 2713 HB2 SER A 177 -6.686 -23.730 18.568 1.00 0.00 H ATOM 2714 HB3 SER A 177 -7.700 -22.301 18.257 1.00 0.00 H ATOM 2715 HG SER A 177 -5.791 -21.213 17.499 1.00 0.00 H ATOM 2716 H SER A 177 -5.072 -24.264 16.649 1.00 0.00 H ATOM 2717 N TYR A 178 -6.334 -21.649 14.793 1.00 12.75 N ATOM 2718 CA TYR A 178 -6.601 -20.537 13.877 1.00 15.02 C ATOM 2719 C TYR A 178 -7.732 -20.888 12.906 1.00 13.37 C ATOM 2720 O TYR A 178 -8.403 -20.003 12.377 1.00 15.11 O ATOM 2721 CB TYR A 178 -5.372 -20.197 13.034 1.00 13.41 C ATOM 2722 CG TYR A 178 -4.195 -19.587 13.777 1.00 11.90 C ATOM 2723 CD1 TYR A 178 -4.339 -19.022 15.041 1.00 14.43 C ATOM 2724 CD2 TYR A 178 -2.935 -19.589 13.201 1.00 14.82 C ATOM 2725 CE1 TYR A 178 -3.258 -18.458 15.702 1.00 15.36 C ATOM 2726 CE2 TYR A 178 -1.844 -19.032 13.856 1.00 13.04 C ATOM 2727 CZ TYR A 178 -2.015 -18.470 15.103 1.00 14.72 C ATOM 2728 OH TYR A 178 -0.932 -17.913 15.744 1.00 13.10 O ATOM 2729 HA TYR A 178 -6.876 -19.686 14.500 1.00 0.00 H ATOM 2730 HB3 TYR A 178 -5.682 -19.490 12.264 1.00 0.00 H ATOM 2731 HB2 TYR A 178 -5.027 -21.117 12.563 1.00 0.00 H ATOM 2732 HD2 TYR A 178 -2.797 -20.036 12.216 1.00 0.00 H ATOM 2733 HE2 TYR A 178 -0.860 -19.039 13.387 1.00 0.00 H ATOM 2734 HE1 TYR A 178 -3.389 -18.009 16.687 1.00 0.00 H ATOM 2735 HD1 TYR A 178 -5.318 -19.023 15.520 1.00 0.00 H ATOM 2736 HH TYR A 178 -0.564 -17.179 15.191 1.00 0.00 H ATOM 2737 H TYR A 178 -5.384 -22.069 14.843 1.00 0.00 H ATOM 2738 N PHE A 179 -7.936 -22.185 12.678 1.00 12.15 N ATOM 2739 CA PHE A 179 -8.778 -22.655 11.581 1.00 12.87 C ATOM 2740 C PHE A 179 -10.073 -23.284 12.073 1.00 12.36 C ATOM 2741 O PHE A 179 -10.808 -23.909 11.303 1.00 11.75 O ATOM 2742 CB PHE A 179 -7.989 -23.646 10.712 1.00 12.97 C ATOM 2743 CG PHE A 179 -6.722 -23.060 10.155 1.00 11.56 C ATOM 2744 CD1 PHE A 179 -6.778 -22.169 9.102 1.00 13.38 C ATOM 2745 CD2 PHE A 179 -5.490 -23.371 10.703 1.00 13.31 C ATOM 2746 CE1 PHE A 179 -5.625 -21.586 8.599 1.00 13.77 C ATOM 2747 CE2 PHE A 179 -4.328 -22.801 10.199 1.00 19.72 C ATOM 2748 CZ PHE A 179 -4.400 -21.909 9.142 1.00 13.75 C ATOM 2749 HA PHE A 179 -9.059 -21.788 10.983 1.00 0.00 H ATOM 2750 HB2 PHE A 179 -7.733 -24.514 11.320 1.00 0.00 H ATOM 2751 HB3 PHE A 179 -8.621 -23.960 9.881 1.00 0.00 H ATOM 2752 HD2 PHE A 179 -5.431 -24.070 11.538 1.00 0.00 H ATOM 2753 HE2 PHE A 179 -3.362 -23.055 10.634 1.00 0.00 H ATOM 2754 HZ PHE A 179 -3.490 -21.463 8.740 1.00 0.00 H ATOM 2755 HE1 PHE A 179 -5.687 -20.874 7.776 1.00 0.00 H ATOM 2756 HD1 PHE A 179 -7.743 -21.920 8.660 1.00 0.00 H ATOM 2757 H PHE A 179 -7.482 -22.884 13.300 1.00 0.00 H ATOM 2758 N ALA A 180 -10.355 -23.120 13.363 1.00 14.27 N ATOM 2759 CA ALA A 180 -11.546 -23.751 13.932 1.00 18.86 C ATOM 2760 C ALA A 180 -12.815 -23.130 13.379 1.00 21.29 C ATOM 2761 O ALA A 180 -12.814 -21.987 12.925 1.00 19.56 O ATOM 2762 CB ALA A 180 -11.535 -23.662 15.469 1.00 18.04 C ATOM 2763 HA ALA A 180 -11.528 -24.802 13.645 1.00 0.00 H ATOM 2764 HB1 ALA A 180 -10.651 -24.170 15.855 1.00 0.00 H ATOM 2765 HB2 ALA A 180 -11.515 -22.615 15.771 1.00 0.00 H ATOM 2766 HB3 ALA A 180 -12.431 -24.139 15.866 1.00 0.00 H ATOM 2767 H ALA A 180 -9.731 -22.545 13.965 1.00 0.00 H ATOM 2768 N SER A 181 -13.897 -23.899 13.407 1.00 12.27 N ATOM 2769 CA SER A 181 -15.201 -23.379 13.025 1.00 15.18 C ATOM 2770 C SER A 181 -15.811 -22.666 14.227 1.00 23.38 C ATOM 2771 O SER A 181 -16.004 -23.278 15.285 1.00 19.32 O ATOM 2772 CB SER A 181 -16.106 -24.505 12.532 1.00 16.43 C ATOM 2773 OG SER A 181 -17.373 -24.004 12.154 1.00 17.06 O ATOM 2774 HA SER A 181 -15.092 -22.671 12.204 1.00 0.00 H ATOM 2775 HB2 SER A 181 -16.234 -25.236 13.330 1.00 0.00 H ATOM 2776 HB3 SER A 181 -15.641 -24.987 11.672 1.00 0.00 H ATOM 2777 HG SER A 181 -17.261 -23.343 11.426 1.00 0.00 H ATOM 2778 H SER A 181 -13.811 -24.891 13.707 1.00 0.00 H ATOM 2779 N GLU A 182 -16.111 -21.379 14.039 1.00 33.75 N ATOM 2780 CA GLU A 182 -16.381 -20.420 15.123 1.00 35.57 C ATOM 2781 C GLU A 182 -15.390 -20.512 16.282 1.00 35.57 C ATOM 2782 O GLU A 182 -14.676 -19.549 16.573 1.00 39.22 O ATOM 2783 CB GLU A 182 -17.833 -20.495 15.623 1.00 30.11 C ATOM 2784 CG GLU A 182 -18.247 -21.827 16.217 1.00 32.18 C ATOM 2785 CD GLU A 182 -19.479 -22.402 15.548 1.00 31.19 C ATOM 2786 OE1 GLU A 182 -20.466 -22.682 16.260 1.00 31.99 O ATOM 2787 OE2 GLU A 182 -19.464 -22.572 14.309 1.00 29.43 O ATOM 2788 HA GLU A 182 -16.236 -19.437 14.674 1.00 0.00 H ATOM 2789 HB2 GLU A 182 -17.966 -19.729 16.387 1.00 0.00 H ATOM 2790 HB3 GLU A 182 -18.491 -20.283 14.780 1.00 0.00 H ATOM 2791 HG2 GLU A 182 -17.424 -22.533 16.101 1.00 0.00 H ATOM 2792 HG3 GLU A 182 -18.458 -21.687 17.277 1.00 0.00 H ATOM 2793 H GLU A 182 -16.157 -21.030 13.060 1.00 0.00 H TER 2794 GLU A 182 HETATM 2795 O HOH 1 2.832 -15.288 13.115 1.00 25.46 O HETATM 2796 O HOH 2 1.121 -17.222 14.037 1.00 25.46 O HETATM 2797 O HOH 3 4.876 -17.806 -3.091 1.00 25.46 O HETATM 2798 O HOH 4 -8.093 -11.781 17.799 1.00 25.46 O HETATM 2799 O HOH 5 5.549 -13.454 -2.894 1.00 25.46 O HETATM 2800 O HOH 6 -8.250 -9.486 -7.341 1.00 25.46 O HETATM 2801 O HOH 7 -12.830 -18.916 9.793 1.00 25.46 O HETATM 2802 O HOH 8 3.488 -24.625 13.673 1.00 25.46 O HETATM 2803 O HOH 9 -3.833 -35.170 14.103 1.00 25.46 O HETATM 2804 O HOH 10 -17.757 -23.969 8.781 1.00 25.46 O HETATM 2805 O HOH 11 17.564 -23.618 8.513 1.00 25.46 O HETATM 2806 O HOH 12 -3.979 -16.046 -10.526 1.00 25.46 O HETATM 2807 O HOH 13 -4.603 -9.093 4.304 1.00 25.46 O HETATM 2808 O HOH 14 -4.326 -25.182 18.447 1.00 25.46 O HETATM 2809 O HOH 15 -11.167 -19.965 11.769 1.00 25.46 O HETATM 2810 O HOH 16 1.688 -14.069 20.863 1.00 25.46 O HETATM 2811 O HOH 17 -8.850 -32.569 -3.099 1.00 25.46 O HETATM 2812 O HOH 18 14.550 -11.165 -3.057 1.00 25.46 O HETATM 2813 O HOH 19 4.142 -11.301 4.321 1.00 25.46 O HETATM 2814 O HOH 20 -9.489 -8.250 9.935 1.00 25.46 O HETATM 2815 O HOH 21 -12.345 -29.820 10.164 1.00 25.46 O HETATM 2816 O HOH 22 -7.264 -12.360 15.292 1.00 25.46 O HETATM 2817 O HOH 23 -5.823 -7.333 -3.687 1.00 25.46 O HETATM 2818 O HOH 24 15.783 -13.871 2.652 1.00 25.46 O HETATM 2819 O HOH 25 -7.872 -33.164 8.823 1.00 25.46 O HETATM 2820 O HOH 26 -16.470 -16.196 -6.640 1.00 25.46 O HETATM 2821 O HOH 27 15.653 -28.921 4.641 1.00 25.46 O HETATM 2822 O HOH 28 -6.944 -9.433 -4.831 1.00 25.46 O HETATM 2823 O HOH 29 -0.195 -18.877 2.231 1.00 25.46 O HETATM 2824 O HOH 30 -4.377 -5.143 -9.990 1.00 25.46 O HETATM 2825 O HOH 31 -8.806 -30.085 -2.385 1.00 25.46 O HETATM 2826 O HOH 32 -13.101 -29.614 3.917 1.00 25.46 O HETATM 2827 O HOH 33 -2.320 -10.529 10.542 1.00 25.46 O HETATM 2828 O HOH 34 -1.311 -16.998 -10.980 1.00 25.46 O HETATM 2829 O HOH 35 -20.482 -23.462 12.337 1.00 25.46 O HETATM 2830 O HOH 36 5.389 -27.038 20.088 1.00 25.46 O HETATM 2831 O HOH 37 -0.877 -25.934 -9.246 1.00 25.46 O HETATM 2832 O HOH 38 -10.302 -34.266 9.208 1.00 25.46 O HETATM 2833 O HOH 39 8.139 -26.514 18.849 1.00 25.46 O HETATM 2834 O HOH 40 4.902 -11.063 -4.123 1.00 25.46 O HETATM 2835 O HOH 41 6.611 -15.706 -7.263 1.00 25.46 O HETATM 2836 O HOH 42 1.431 -29.738 19.111 1.00 25.46 O HETATM 2837 O HOH 43 10.833 -13.079 20.489 1.00 25.46 O HETATM 2838 O HOH 44 -11.914 -33.407 3.492 1.00 25.46 O HETATM 2839 O HOH 45 -12.655 -16.668 8.948 1.00 25.46 O HETATM 2840 O HOH 46 -12.371 -15.683 6.547 1.00 25.46 O HETATM 2841 O HOH 47 3.845 -10.747 1.754 1.00 25.46 O HETATM 2842 O HOH 48 6.190 -14.268 19.812 1.00 25.46 O HETATM 2843 O HOH 49 1.613 -22.153 20.195 1.00 25.46 O HETATM 2844 O HOH 50 10.153 -34.232 5.634 1.00 25.46 O HETATM 2845 O HOH 51 15.011 -9.667 15.458 1.00 25.46 O HETATM 2846 O HOH 52 4.739 -10.628 -7.639 1.00 25.46 O HETATM 2847 O HOH 53 8.902 -4.075 2.374 1.00 25.46 O HETATM 2848 O HOH 54 8.591 -28.186 -10.735 1.00 25.46 O HETATM 2849 O HOH 55 -18.092 -29.815 4.649 1.00 25.46 O HETATM 2850 O HOH 56 12.001 -34.134 7.314 1.00 25.46 O HETATM 2851 O HOH 57 7.247 -36.665 3.387 1.00 25.46 O HETATM 2852 O HOH 58 13.685 -8.080 14.429 1.00 25.46 O HETATM 2853 O HOH 59 0.256 -10.014 -10.550 1.00 25.46 O HETATM 2854 O HOH 60 11.545 -27.753 -6.658 1.00 25.46 O HETATM 2855 O HOH 61 1.618 -5.427 14.998 1.00 25.46 O HETATM 2856 O HOH 62 -3.992 -4.594 -2.152 1.00 25.46 O HETATM 2857 O HOH 63 -15.605 -28.479 8.292 1.00 25.46 O HETATM 2858 O HOH 64 7.322 -18.002 17.795 1.00 25.46 O HETATM 2859 O HOH 65 3.217 -21.280 -14.729 1.00 25.46 O HETATM 2860 O HOH 66 -3.892 -18.441 19.740 1.00 25.46 O HETATM 2861 O HOH 67 12.670 -13.544 -6.833 1.00 25.46 O HETATM 2862 O HOH 68 -0.146 -31.154 18.051 1.00 25.46 O HETATM 2863 O HOH 69 -0.603 -32.592 13.822 1.00 25.46 O HETATM 2864 O HOH 70 12.715 -30.982 3.873 1.00 25.46 O HETATM 2865 O HOH 71 -14.273 -19.516 13.219 1.00 25.46 O HETATM 2866 O HOH 72 -12.805 -24.395 -1.774 1.00 25.46 O HETATM 2867 O HOH 73 1.312 -19.594 20.092 1.00 25.46 O HETATM 2868 O HOH 74 5.631 -37.002 5.545 1.00 25.46 O HETATM 2869 O HOH 75 19.959 -23.099 4.726 1.00 25.46 O HETATM 2870 O HOH 76 -4.990 -22.517 20.620 1.00 25.46 O HETATM 2871 O HOH 77 9.171 -35.492 2.554 1.00 25.46 O HETATM 2872 O HOH 78 -15.549 -19.210 -8.132 1.00 25.46 O HETATM 2873 O HOH 79 1.994 -17.914 22.098 1.00 25.46 O HETATM 2874 O HOH 80 -16.169 -21.800 9.998 1.00 25.46 O HETATM 2875 O HOH 81 -12.429 -9.265 9.996 1.00 25.46 O HETATM 2876 O HOH 82 17.128 -22.025 11.507 1.00 26.36 O HETATM 2877 O HOH 83 -15.577 -22.711 4.891 1.00 26.36 O HETATM 2878 O HOH 84 21.293 -9.858 5.473 1.00 26.36 O HETATM 2879 O HOH 85 -10.380 -28.494 -3.732 1.00 26.36 O HETATM 2880 O HOH 86 9.029 -23.895 -10.669 1.00 26.36 O HETATM 2881 O HOH 87 8.531 -34.523 4.472 1.00 26.36 O HETATM 2882 O HOH 88 -12.231 -32.008 -1.620 1.00 26.36 O HETATM 2883 O HOH 89 1.629 -3.188 4.025 1.00 26.36 O HETATM 2884 O HOH 90 -7.673 -30.609 -5.962 1.00 26.36 O HETATM 2885 O HOH 91 -5.460 -27.185 -3.250 1.00 26.36 O HETATM 2886 O HOH 92 8.881 -32.208 3.888 1.00 26.36 O HETATM 2887 O HOH 93 14.617 -26.906 14.875 1.00 26.36 O HETATM 2888 O HOH 94 4.083 -13.580 21.275 1.00 26.36 O HETATM 2889 O HOH 95 0.965 -21.355 -14.153 1.00 26.36 O HETATM 2890 O HOH 96 -21.925 -20.844 11.852 1.00 26.36 O HETATM 2891 O HOH 97 -6.471 -19.568 17.934 1.00 26.36 O HETATM 2892 O HOH 98 -3.187 -37.873 -2.164 1.00 26.36 O HETATM 2893 O HOH 99 -2.178 -6.353 -10.943 1.00 26.36 O HETATM 2894 O HOH 100 -10.257 -7.348 5.679 1.00 26.36 O HETATM 2895 O HOH 101 -7.159 -23.519 -9.045 1.00 26.36 O HETATM 2896 O HOH 102 -19.985 -20.133 12.605 1.00 26.36 O HETATM 2897 O HOH 103 13.799 -27.086 -6.263 1.00 26.36 O HETATM 2898 O HOH 104 -16.841 -21.426 -7.954 1.00 26.36 O HETATM 2899 O HOH 105 -3.337 -32.141 21.838 1.00 26.36 O HETATM 2900 O HOH 106 18.304 -29.935 8.107 1.00 26.36 O HETATM 2901 O HOH 107 -0.760 -3.890 4.374 1.00 26.36 O HETATM 2902 O HOH 108 20.533 -7.068 6.451 1.00 26.36 O HETATM 2903 O HOH 109 -21.214 -22.532 13.703 1.00 29.89 O HETATM 2904 O HOH 110 18.251 -11.073 15.659 1.00 29.89 O HETATM 2905 O HOH 111 7.648 -21.785 19.896 1.00 29.89 O HETATM 2906 O HOH 112 -14.748 -20.027 6.356 1.00 29.89 O HETATM 2907 O HOH 113 -3.530 -4.557 7.391 1.00 29.89 O HETATM 2908 O HOH 114 -13.219 -25.276 -3.400 1.00 29.89 O HETATM 2909 O HOH 115 18.135 -25.664 -0.716 1.00 29.89 O HETATM 2910 O HOH 116 11.902 -36.601 2.030 1.00 29.89 O HETATM 2911 O HOH 117 17.282 -18.736 -2.544 1.00 29.89 O HETATM 2912 O HOH 118 -7.210 -32.667 -3.936 1.00 29.89 O HETATM 2913 O HOH 119 -7.447 -8.748 3.579 1.00 29.89 O HETATM 2914 O HOH 120 -0.376 -23.762 21.768 1.00 29.89 O HETATM 2915 O HOH 121 9.831 -11.796 -8.403 1.00 29.89 O HETATM 2916 O HOH 122 6.487 -13.244 22.888 1.00 29.89 O HETATM 2917 O HOH 123 -7.217 -11.066 20.038 1.00 29.89 O HETATM 2918 O HOH 124 3.759 -4.707 -2.012 1.00 29.89 O HETATM 2919 C01 AG A 7 10.296 -8.198 4.165 1.00 0.13 C HETATM 2920 C02 AG A 7 8.902 -7.625 3.943 1.00 0.04 C HETATM 2921 C04 AG A 7 7.923 -8.515 3.195 1.00 0.07 C HETATM 2922 C05 AG A 7 6.646 -7.804 2.785 1.00 0.00 C HETATM 2923 C06 AG A 7 5.961 -7.057 3.900 1.00 -0.04 C HETATM 2924 C07 AG A 7 5.306 -7.818 4.986 1.00 -0.06 C HETATM 2925 C08 AG A 7 4.637 -7.088 6.090 1.00 -0.03 C HETATM 2926 C09 AG A 7 4.648 -5.689 6.107 1.00 0.12 C HETATM 2927 C10 AG A 7 5.319 -4.919 5.009 1.00 -0.03 C HETATM 2928 C11 AG A 7 5.976 -5.644 3.916 1.00 -0.06 C HETATM 2929 H AG A 7 6.475 -5.094 3.118 1.00 0.05 H HETATM 2930 H AG A 7 5.319 -3.829 5.023 1.00 0.06 H HETATM 2931 F1 AG A 7 4.029 -5.039 7.091 1.00 -0.19 F HETATM 2932 H AG A 7 4.138 -7.640 6.886 1.00 0.06 H HETATM 2933 H AG A 7 5.315 -8.908 4.975 1.00 0.05 H HETATM 2934 H AG A 7 5.951 -8.570 2.440 1.00 0.04 H HETATM 2935 H AG A 7 6.919 -7.068 2.029 1.00 0.04 H HETATM 2936 C47 AG A 7 8.563 -9.313 2.054 1.00 0.18 C HETATM 2937 N12 AG A 7 8.267 -10.740 1.950 1.00 -0.28 N HETATM 2938 C13 AG A 7 8.603 -11.473 0.724 1.00 0.04 C HETATM 2939 C14 AG A 7 9.727 -12.470 0.960 1.00 -0.02 C HETATM 2940 C15 AG A 7 11.040 -11.781 1.331 1.00 0.04 C HETATM 2941 C16 AG A 7 12.167 -12.648 1.907 1.00 0.08 C HETATM 2942 N17 AG A 7 13.473 -12.195 1.288 1.00 0.25 N HETATM 2943 C83 AG A 7 13.176 -10.856 0.668 1.00 -0.03 C HETATM 2944 C84 AG A 7 11.678 -10.836 0.340 1.00 -0.00 C HETATM 2945 H AG A 7 11.263 -9.831 0.420 1.00 0.03 H HETATM 2946 H AG A 7 11.488 -11.145 -0.688 1.00 0.03 H HETATM 2947 H AG A 7 13.770 -10.708 -0.234 1.00 0.08 H HETATM 2948 H AG A 7 13.431 -10.048 1.354 1.00 0.08 H HETATM 2949 H AG A 7 13.811 -12.863 0.595 1.00 0.20 H HETATM 2950 H AG A 7 14.216 -12.130 1.984 1.00 0.20 H HETATM 2951 O18 AG A 7 11.964 -13.977 2.131 1.00 -0.35 O HETATM 2952 H AG A 7 12.640 -14.307 2.728 1.00 0.22 H HETATM 2953 H AG A 7 12.204 -12.456 2.979 1.00 0.12 H HETATM 2954 H AG A 7 10.588 -11.188 2.126 1.00 0.04 H HETATM 2955 H AG A 7 9.885 -13.028 0.037 1.00 0.03 H HETATM 2956 H AG A 7 9.438 -13.118 1.788 1.00 0.03 H HETATM 2957 C19 AG A 7 7.376 -12.051 0.056 1.00 -0.01 C HETATM 2958 C20 AG A 7 6.445 -10.994 -0.507 1.00 0.05 C HETATM 2959 C21 AG A 7 7.076 -10.194 -1.641 1.00 0.23 C HETATM 2960 O22 AG A 7 7.108 -8.904 -1.584 1.00 -0.28 O HETATM 2961 C50 AG A 7 7.799 -8.213 -2.589 1.00 0.07 C HETATM 2962 C53 AG A 7 8.206 -6.787 -2.291 1.00 -0.04 C HETATM 2963 H AG A 7 7.316 -6.192 -2.086 1.00 0.03 H HETATM 2964 H AG A 7 8.863 -6.772 -1.421 1.00 0.03 H HETATM 2965 H AG A 7 8.731 -6.373 -3.152 1.00 0.03 H HETATM 2966 H AG A 7 7.113 -8.155 -3.434 1.00 0.06 H HETATM 2967 H AG A 7 8.729 -8.761 -2.740 1.00 0.06 H HETATM 2968 O23 AG A 7 7.853 -10.783 -2.430 1.00 -0.37 O HETATM 2969 H AG A 7 6.204 -10.299 0.297 1.00 0.05 H HETATM 2970 H AG A 7 5.566 -11.501 -0.905 1.00 0.05 H HETATM 2971 H AG A 7 6.822 -12.609 0.811 1.00 0.03 H HETATM 2972 H AG A 7 7.714 -12.669 -0.776 1.00 0.03 H HETATM 2973 H AG A 7 9.001 -10.762 -0.000 1.00 0.06 H HETATM 2974 H AG A 7 7.826 -11.227 2.730 1.00 0.19 H HETATM 2975 O48 AG A 7 9.170 -8.745 1.166 1.00 -0.40 O HETATM 2976 H AG A 7 7.614 -9.262 3.927 1.00 0.06 H HETATM 2977 H AG A 7 9.033 -6.733 3.330 1.00 0.05 H HETATM 2978 H AG A 7 8.476 -7.468 4.934 1.00 0.05 H HETATM 2979 O03 AG A 7 10.474 -9.395 4.105 1.00 -0.39 O HETATM 2980 C57 AG A 7 11.409 -7.295 4.721 1.00 0.12 C HETATM 2981 N58 AG A 7 12.365 -8.018 5.550 1.00 -0.27 N HETATM 2982 C59 AG A 7 12.469 -7.753 6.969 1.00 0.21 C HETATM 2983 O60 AG A 7 11.886 -6.796 7.459 1.00 -0.39 O HETATM 2984 C1 AG A 7 13.419 -8.597 7.802 1.00 0.11 C HETATM 2985 C2 AG A 7 13.790 -8.418 9.297 1.00 -0.02 C HETATM 2986 C3 AG A 7 14.745 -9.456 9.635 1.00 0.14 C HETATM 2987 O4 AG A 7 14.983 -10.248 8.465 1.00 -0.16 O HETATM 2988 N5 AG A 7 14.120 -9.677 7.331 1.00 -0.13 N HETATM 2989 C4 AG A 7 15.386 -9.670 10.978 1.00 0.01 C HETATM 2990 H AG A 7 15.950 -8.780 11.256 1.00 0.04 H HETATM 2991 H AG A 7 14.613 -9.859 11.723 1.00 0.04 H HETATM 2992 H AG A 7 16.058 -10.526 10.926 1.00 0.04 H HETATM 2993 H AG A 7 13.404 -7.653 9.970 1.00 0.03 H HETATM 2994 H AG A 7 12.969 -8.721 5.124 1.00 0.19 H HETATM 2995 C78 AG A 7 12.107 -6.406 3.709 1.00 -0.01 C HETATM 2996 C81 AG A 7 13.086 -5.493 4.387 1.00 -0.06 C HETATM 2997 H AG A 7 12.558 -4.864 5.103 1.00 0.02 H HETATM 2998 H AG A 7 13.835 -6.089 4.908 1.00 0.02 H HETATM 2999 H AG A 7 13.573 -4.866 3.640 1.00 0.02 H HETATM 3000 C82 AG A 7 12.724 -7.174 2.584 1.00 -0.06 C HETATM 3001 H AG A 7 13.464 -7.868 2.982 1.00 0.02 H HETATM 3002 H AG A 7 11.949 -7.731 2.058 1.00 0.02 H HETATM 3003 H AG A 7 13.207 -6.481 1.895 1.00 0.02 H HETATM 3004 H AG A 7 11.341 -5.784 3.245 1.00 0.03 H HETATM 3005 H AG A 7 10.863 -6.602 5.361 1.00 0.08 H CONECT 1 2 19 20 21 CONECT 19 1 CONECT 20 1 CONECT 21 1 CONECT 2919 2920 2979 2980 CONECT 2920 2919 2921 2977 2978 CONECT 2921 2920 2922 2936 2976 CONECT 2922 2921 2923 2934 2935 CONECT 2923 2922 2924 2928 CONECT 2924 2923 2925 2933 CONECT 2925 2924 2926 2932 CONECT 2926 2925 2927 2931 CONECT 2927 2926 2928 2930 CONECT 2928 2923 2927 2929 CONECT 2929 2928 CONECT 2930 2927 CONECT 2931 2926 CONECT 2932 2925 CONECT 2933 2924 CONECT 2934 2922 CONECT 2935 2922 CONECT 2936 2921 2937 2975 CONECT 2937 2936 2938 2974 CONECT 2938 2937 2939 2957 2973 CONECT 2939 2938 2940 2955 2956 CONECT 2940 2939 2941 2944 2954 CONECT 2941 2940 2942 2951 2953 CONECT 2942 2941 2943 2949 2950 CONECT 2943 2942 2944 2947 2948 CONECT 2944 2940 2943 2945 2946 CONECT 2945 2944 CONECT 2946 2944 CONECT 2947 2943 CONECT 2948 2943 CONECT 2949 2942 CONECT 2950 2942 CONECT 2951 2941 2952 CONECT 2952 2951 CONECT 2953 2941 CONECT 2954 2940 CONECT 2955 2939 CONECT 2956 2939 CONECT 2957 2938 2958 2971 2972 CONECT 2958 2957 2959 2969 2970 CONECT 2959 2958 2960 2968 CONECT 2960 2959 2961 CONECT 2961 2960 2962 2966 2967 CONECT 2962 2961 2963 2964 2965 CONECT 2963 2962 CONECT 2964 2962 CONECT 2965 2962 CONECT 2966 2961 CONECT 2967 2961 CONECT 2968 2959 CONECT 2969 2958 CONECT 2970 2958 CONECT 2971 2957 CONECT 2972 2957 CONECT 2973 2938 CONECT 2974 2937 CONECT 2975 2936 CONECT 2976 2921 CONECT 2977 2920 CONECT 2978 2920 CONECT 2979 2919 CONECT 2980 2919 2981 2995 3005 CONECT 2981 2980 2982 2994 CONECT 2982 2981 2983 2984 CONECT 2983 2982 CONECT 2984 2982 2985 2988 CONECT 2985 2984 2986 2993 CONECT 2986 2985 2987 2989 CONECT 2987 2986 2988 CONECT 2988 2984 2987 CONECT 2989 2986 2990 2991 2992 CONECT 2990 2989 CONECT 2991 2989 CONECT 2992 2989 CONECT 2993 2985 CONECT 2994 2981 CONECT 2995 2980 2996 3000 3004 CONECT 2996 2995 2997 2998 2999 CONECT 2997 2996 CONECT 2998 2996 CONECT 2999 2996 CONECT 3000 2995 3001 3002 3003 CONECT 3001 3000 CONECT 3002 3000 CONECT 3003 3000 CONECT 3004 2995 CONECT 3005 2980 MASTER 0 0 0 0 0 0 0 0 3004 1 91 14 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 3sjo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3qzq
RCSB PDB
PDBbind
187aa, >3QZQ_1|Chains... at 99%
3sji
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PDBbind
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4ght
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PDBbind
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5c1x
RCSB PDB
PDBbind
192aa, >5C1X_1|Chains... at 94%
5c1y
RCSB PDB
PDBbind
192aa, >5C1Y_1|Chain... at 94%
5c20
RCSB PDB
PDBbind
192aa, >5C20_1|Chain... at 94%
5dp4
RCSB PDB
PDBbind
192aa, >5DP4_1|Chains... at 94%
5dp5
RCSB PDB
PDBbind
181aa, >5DP5_1|Chain... at 98%
5dp6
RCSB PDB
PDBbind
192aa, >5DP6_1|Chains... at 94%
5dp7
RCSB PDB
PDBbind
192aa, >5DP7_1|Chain... at 94%
5dp8
RCSB PDB
PDBbind
192aa, >5DP8_1|Chain... at 94%
5dp9
RCSB PDB
PDBbind
192aa, >5DP9_1|Chain... at 94%
5dpa
RCSB PDB
PDBbind
192aa, >5DPA_1|Chain... at 94%
5gso
RCSB PDB
PDBbind
204aa, >5GSO_1|Chains... *
5gsw
RCSB PDB
PDBbind
183aa, >5GSW_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3qzq
RCSB PDB
PDBbind
AG7
3sji
RCSB PDB
PDBbind
AG7
4ght
RCSB PDB
PDBbind
AG7
Entry Information
PDB ID
3sjo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
EV71 3C protease
Ligand Name
AG7
EC.Number
E.C.3.4.22.28
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
IC50=1.65uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) J.Virol. Vol. 85: pp. 10319-10331
Ligand Properties
Formula
C
3
1
H
4
4
FN
4
O
7
Molecular Weight
603.702
Exact Mass
603.319
No. of atoms
87
No. of bonds
89
Polar Surface Area
164.44
LOGP Value
3.18 (
Computed with XLOGP3
)
4.17 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 20
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 3
Canonical SMILES
CCOC(=O)CC[C@H](C[C@@H]1CC[NH2+][C@@H]1O)NC(=O)[C@H](Cc1ccc(cc1)F)CC(=O)[C@H](C(C)C)NC(=O)c1noc(c1)C
InChI String
InChI=1S/C31H43FN4O7/c1-5-42-27(38)11-10-24(16-21-12-13-33-29(21)39)34-30(40)22(15-20-6-8-23(32)9-7-20)17-26(37)28(18(2)3)35-31(41)25-14-19(4)43-36-25/h6-9,14,18,21-22,24,28-29,33,39H,5,10-13,15-17H2,1-4H3,(H,34,40)(H,35,41)/p+1/t21-,22+,24+,28-,29+/m0/s1
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UniProtKB AC
UniProt accession number (AC):
E0WWC7
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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娌狪CP澶2021015625鍙-3
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