Browse entries in the PDBbind-CN Database
HEADER 3LBJ_COMPLEX COMPND 3LBJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 E 83 ASN GLN VAL ARG PRO LYS LEU PRO LEU LEU LYS ILE LEU SEQRES 2 E 83 HIS ALA ALA GLY ALA GLN GLY GLU MET PHE THR VAL LYS SEQRES 3 E 83 GLU VAL MET HIS TYR LEU GLY GLN TYR ILE MET VAL LYS SEQRES 4 E 83 GLN LEU TYR ASP GLN GLN GLU GLN HIS MET VAL TYR CYS SEQRES 5 E 83 GLY GLY ASP LEU LEU GLY GLU LEU LEU GLY ARG GLN SER SEQRES 6 E 83 PHE SER VAL LYS ASP PRO SER PRO LEU TYR ASP MET LEU SEQRES 7 E 83 ARG LYS ASN LEU VAL HET WW A 8 84 ATOM 1 N ASN E 25 9.008 -21.918 -5.215 1.00 20.21 N ATOM 2 CA ASN E 25 10.313 -21.956 -4.489 1.00 20.92 C ATOM 3 C ASN E 25 10.044 -21.381 -3.109 1.00 24.53 C ATOM 4 O ASN E 25 10.290 -20.193 -2.833 1.00 25.85 O ATOM 5 CB ASN E 25 11.409 -21.212 -5.271 1.00 21.06 C ATOM 6 CG ASN E 25 11.932 -22.021 -6.476 1.00 21.94 C ATOM 7 OD1 ASN E 25 12.356 -23.177 -6.336 1.00 27.48 O ATOM 8 ND2 ASN E 25 11.939 -21.395 -7.648 1.00 26.30 N ATOM 9 HA ASN E 25 10.700 -22.970 -4.391 1.00 0.00 H ATOM 10 HB2 ASN E 25 11.000 -20.269 -5.634 1.00 0.00 H ATOM 11 HB3 ASN E 25 12.242 -21.010 -4.598 1.00 0.00 H ATOM 12 HD22 ASN E 25 11.573 -20.424 -7.721 1.00 0.00 H ATOM 13 HD21 ASN E 25 12.310 -21.876 -8.492 1.00 0.00 H ATOM 14 HN3 ASN E 25 8.675 -20.935 -5.276 1.00 0.00 H ATOM 15 HN2 ASN E 25 8.309 -22.490 -4.699 1.00 0.00 H ATOM 16 HN1 ASN E 25 9.134 -22.303 -6.173 1.00 0.00 H ATOM 17 N GLN E 26 9.467 -22.243 -2.273 1.00 28.36 N ATOM 18 CA GLN E 26 9.075 -21.881 -0.917 1.00 31.37 C ATOM 19 C GLN E 26 10.143 -22.445 -0.003 1.00 30.53 C ATOM 20 O GLN E 26 10.504 -23.615 -0.093 1.00 31.12 O ATOM 21 CB GLN E 26 7.626 -22.209 -0.682 1.00 33.10 C ATOM 22 CG GLN E 26 6.777 -21.043 -1.167 1.00 36.80 C ATOM 23 CD GLN E 26 5.357 -21.128 -0.692 1.00 38.81 C ATOM 24 OE1 GLN E 26 5.078 -21.024 0.502 1.00 42.98 O ATOM 25 NE2 GLN E 26 4.437 -21.311 -1.626 1.00 43.36 N ATOM 26 HA GLN E 26 9.061 -20.813 -0.699 1.00 0.00 H ATOM 27 HB2 GLN E 26 7.360 -23.111 -1.233 1.00 0.00 H ATOM 28 HB3 GLN E 26 7.454 -22.371 0.382 1.00 0.00 H ATOM 29 HG2 GLN E 26 7.214 -20.115 -0.798 1.00 0.00 H ATOM 30 HG3 GLN E 26 6.781 -21.037 -2.257 1.00 0.00 H ATOM 31 HE22 GLN E 26 4.718 -21.394 -2.624 1.00 0.00 H ATOM 32 HE21 GLN E 26 3.433 -21.372 -1.362 1.00 0.00 H ATOM 33 H GLN E 26 9.289 -23.214 -2.601 1.00 0.00 H ATOM 34 N VAL E 27 10.627 -21.622 0.917 1.00 28.50 N ATOM 35 CA VAL E 27 10.989 -22.022 2.241 1.00 26.01 C ATOM 36 C VAL E 27 10.159 -21.834 3.484 1.00 23.92 C ATOM 37 O VAL E 27 9.196 -21.073 3.509 1.00 22.47 O ATOM 38 CB VAL E 27 12.354 -21.300 2.440 1.00 25.82 C ATOM 39 CG1 VAL E 27 13.277 -21.606 1.254 1.00 26.09 C ATOM 40 CG2 VAL E 27 12.161 -19.800 2.512 1.00 25.04 C ATOM 41 HA VAL E 27 10.898 -23.108 2.207 1.00 0.00 H ATOM 42 HB VAL E 27 12.793 -21.657 3.371 1.00 0.00 H ATOM 43 HG11 VAL E 27 13.442 -22.682 1.192 1.00 0.00 H ATOM 44 HG12 VAL E 27 12.812 -21.254 0.333 1.00 0.00 H ATOM 45 HG13 VAL E 27 14.231 -21.099 1.397 1.00 0.00 H ATOM 46 HG21 VAL E 27 11.708 -19.448 1.585 1.00 0.00 H ATOM 47 HG22 VAL E 27 11.509 -19.559 3.351 1.00 0.00 H ATOM 48 HG23 VAL E 27 13.128 -19.317 2.651 1.00 0.00 H ATOM 49 H VAL E 27 10.751 -20.622 0.659 1.00 0.00 H ATOM 50 N ARG E 28 10.578 -22.578 4.514 1.00 22.33 N ATOM 51 CA ARG E 28 9.969 -22.524 5.838 1.00 21.88 C ATOM 52 C ARG E 28 10.926 -21.877 6.814 1.00 19.96 C ATOM 53 O ARG E 28 11.933 -22.471 7.181 1.00 19.25 O ATOM 54 CB ARG E 28 9.616 -23.910 6.412 1.00 22.94 C ATOM 55 CG ARG E 28 8.816 -23.717 7.712 1.00 27.62 C ATOM 56 CD ARG E 28 8.522 -24.934 8.597 1.00 34.13 C ATOM 57 NE ARG E 28 8.764 -26.228 7.987 1.00 39.93 N ATOM 58 CZ ARG E 28 9.822 -26.985 8.254 1.00 45.78 C ATOM 59 NH1 ARG E 28 10.746 -26.555 9.102 1.00 47.08 N ATOM 60 NH2 ARG E 28 9.963 -28.164 7.660 1.00 47.21 N ATOM 61 HA ARG E 28 9.048 -21.954 5.715 1.00 0.00 H ATOM 62 HB2 ARG E 28 9.016 -24.464 5.690 1.00 0.00 H ATOM 63 HB3 ARG E 28 10.531 -24.464 6.623 1.00 0.00 H ATOM 64 HG2 ARG E 28 9.369 -23.004 8.324 1.00 0.00 H ATOM 65 HG3 ARG E 28 7.854 -23.286 7.434 1.00 0.00 H ATOM 66 HD2 ARG E 28 7.472 -24.891 8.888 1.00 0.00 H ATOM 67 HD3 ARG E 28 9.147 -24.861 9.487 1.00 0.00 H ATOM 68 HE ARG E 28 8.068 -26.583 7.301 1.00 0.00 H ATOM 69 HH12 ARG E 28 11.575 -27.147 9.312 1.00 0.00 H ATOM 70 HH11 ARG E 28 10.642 -25.626 9.557 1.00 0.00 H ATOM 71 HH22 ARG E 28 10.792 -28.756 7.870 1.00 0.00 H ATOM 72 HH21 ARG E 28 9.245 -28.495 6.985 1.00 0.00 H ATOM 73 H ARG E 28 11.377 -23.226 4.363 1.00 0.00 H ATOM 74 N PRO E 29 10.595 -20.667 7.273 1.00 18.39 N ATOM 75 CA PRO E 29 11.443 -20.058 8.291 1.00 18.05 C ATOM 76 C PRO E 29 11.388 -20.775 9.633 1.00 17.98 C ATOM 77 O PRO E 29 10.303 -21.119 10.112 1.00 18.53 O ATOM 78 CB PRO E 29 10.858 -18.655 8.443 1.00 18.11 C ATOM 79 CG PRO E 29 10.069 -18.419 7.226 1.00 18.33 C ATOM 80 CD PRO E 29 9.543 -19.759 6.811 1.00 18.50 C ATOM 81 HA PRO E 29 12.491 -20.089 7.995 1.00 0.00 H ATOM 82 HD3 PRO E 29 8.592 -19.977 7.297 1.00 0.00 H ATOM 83 HD2 PRO E 29 9.419 -19.817 5.730 1.00 0.00 H ATOM 84 HG3 PRO E 29 10.698 -17.999 6.441 1.00 0.00 H ATOM 85 HG2 PRO E 29 9.245 -17.736 7.434 1.00 0.00 H ATOM 86 HB2 PRO E 29 10.221 -18.602 9.326 1.00 0.00 H ATOM 87 HB3 PRO E 29 11.656 -17.917 8.528 1.00 0.00 H ATOM 88 N LYS E 30 12.540 -20.965 10.256 1.00 17.35 N ATOM 89 CA LYS E 30 12.570 -21.504 11.607 1.00 17.20 C ATOM 90 C LYS E 30 11.873 -20.534 12.539 1.00 16.42 C ATOM 91 O LYS E 30 11.756 -19.344 12.248 1.00 16.08 O ATOM 92 CB LYS E 30 13.996 -21.754 12.062 1.00 17.42 C ATOM 93 CG LYS E 30 14.665 -22.894 11.310 1.00 20.80 C ATOM 94 CD LYS E 30 16.078 -23.109 11.783 1.00 24.38 C ATOM 95 CE LYS E 30 16.889 -23.972 10.830 1.00 27.20 C ATOM 96 NZ LYS E 30 18.292 -23.998 11.280 1.00 28.66 N ATOM 97 HA LYS E 30 12.050 -22.462 11.622 1.00 0.00 H ATOM 98 HB2 LYS E 30 14.576 -20.845 11.904 1.00 0.00 H ATOM 99 HB3 LYS E 30 13.985 -21.997 13.125 1.00 0.00 H ATOM 100 HG2 LYS E 30 14.094 -23.808 11.470 1.00 0.00 H ATOM 101 HG3 LYS E 30 14.679 -22.658 10.246 1.00 0.00 H ATOM 102 HD2 LYS E 30 16.566 -22.139 11.877 1.00 0.00 H ATOM 103 HD3 LYS E 30 16.050 -23.596 12.758 1.00 0.00 H ATOM 104 HE2 LYS E 30 16.835 -23.555 9.824 1.00 0.00 H ATOM 105 HE3 LYS E 30 16.488 -24.986 10.824 1.00 0.00 H ATOM 106 HZ1 LYS E 30 18.671 -23.030 11.285 1.00 0.00 H ATOM 107 HZ2 LYS E 30 18.340 -24.395 12.240 1.00 0.00 H ATOM 108 HZ3 LYS E 30 18.852 -24.587 10.631 1.00 0.00 H ATOM 109 H LYS E 30 13.431 -20.727 9.776 1.00 0.00 H ATOM 110 N LEU E 31 11.390 -21.041 13.662 1.00 15.25 N ATOM 111 CA LEU E 31 10.560 -20.236 14.549 1.00 15.03 C ATOM 112 C LEU E 31 10.983 -18.772 14.745 1.00 14.40 C ATOM 113 O LEU E 31 10.148 -17.885 14.571 1.00 13.15 O ATOM 114 CB LEU E 31 10.384 -20.913 15.910 1.00 15.14 C ATOM 115 CG LEU E 31 9.591 -20.075 16.914 1.00 15.22 C ATOM 116 CD1 LEU E 31 8.160 -19.908 16.444 1.00 14.80 C ATOM 117 CD2 LEU E 31 9.637 -20.739 18.306 1.00 15.53 C ATOM 118 HA LEU E 31 9.610 -20.181 14.017 1.00 0.00 H ATOM 119 HB2 LEU E 31 9.861 -21.857 15.760 1.00 0.00 H ATOM 120 HB3 LEU E 31 11.372 -21.108 16.328 1.00 0.00 H ATOM 121 HG LEU E 31 10.042 -19.086 16.987 1.00 0.00 H ATOM 122 HD21 LEU E 31 9.201 -21.736 18.246 1.00 0.00 H ATOM 123 HD22 LEU E 31 10.673 -20.813 18.638 1.00 0.00 H ATOM 124 HD23 LEU E 31 9.070 -20.135 19.014 1.00 0.00 H ATOM 125 HD11 LEU E 31 8.153 -19.406 15.476 1.00 0.00 H ATOM 126 HD12 LEU E 31 7.693 -20.888 16.350 1.00 0.00 H ATOM 127 HD13 LEU E 31 7.608 -19.309 17.169 1.00 0.00 H ATOM 128 H LEU E 31 11.606 -22.027 13.915 1.00 0.00 H ATOM 129 N PRO E 32 12.238 -18.512 15.136 1.00 14.08 N ATOM 130 CA PRO E 32 12.541 -17.119 15.450 1.00 14.03 C ATOM 131 C PRO E 32 12.356 -16.217 14.245 1.00 13.74 C ATOM 132 O PRO E 32 11.798 -15.135 14.380 1.00 13.19 O ATOM 133 CB PRO E 32 13.989 -17.160 15.910 1.00 13.85 C ATOM 134 CG PRO E 32 14.524 -18.358 15.274 1.00 14.70 C ATOM 135 CD PRO E 32 13.432 -19.361 15.247 1.00 14.38 C ATOM 136 HA PRO E 32 11.874 -16.705 16.207 1.00 0.00 H ATOM 137 HD3 PRO E 32 13.526 -20.026 14.389 1.00 0.00 H ATOM 138 HD2 PRO E 32 13.414 -19.952 16.163 1.00 0.00 H ATOM 139 HG3 PRO E 32 15.369 -18.740 15.846 1.00 0.00 H ATOM 140 HG2 PRO E 32 14.848 -18.130 14.259 1.00 0.00 H ATOM 141 HB2 PRO E 32 14.527 -16.272 15.579 1.00 0.00 H ATOM 142 HB3 PRO E 32 14.050 -17.237 16.996 1.00 0.00 H ATOM 143 N LEU E 33 12.764 -16.651 13.058 1.00 13.24 N ATOM 144 CA LEU E 33 12.489 -15.841 11.888 1.00 12.53 C ATOM 145 C LEU E 33 11.000 -15.793 11.537 1.00 12.76 C ATOM 146 O LEU E 33 10.485 -14.772 11.074 1.00 13.09 O ATOM 147 CB LEU E 33 13.345 -16.288 10.691 1.00 12.43 C ATOM 148 CG LEU E 33 13.220 -15.450 9.407 1.00 13.20 C ATOM 149 CD1 LEU E 33 13.491 -13.963 9.593 1.00 14.68 C ATOM 150 CD2 LEU E 33 14.177 -16.004 8.350 1.00 14.26 C ATOM 151 HA LEU E 33 12.772 -14.819 12.138 1.00 0.00 H ATOM 152 HB2 LEU E 33 14.389 -16.263 11.003 1.00 0.00 H ATOM 153 HB3 LEU E 33 13.064 -17.313 10.447 1.00 0.00 H ATOM 154 HG LEU E 33 12.179 -15.532 9.094 1.00 0.00 H ATOM 155 HD21 LEU E 33 15.199 -15.951 8.724 1.00 0.00 H ATOM 156 HD22 LEU E 33 13.920 -17.042 8.137 1.00 0.00 H ATOM 157 HD23 LEU E 33 14.091 -15.413 7.438 1.00 0.00 H ATOM 158 HD11 LEU E 33 12.780 -13.552 10.310 1.00 0.00 H ATOM 159 HD12 LEU E 33 14.506 -13.824 9.965 1.00 0.00 H ATOM 160 HD13 LEU E 33 13.380 -13.452 8.636 1.00 0.00 H ATOM 161 H LEU E 33 13.271 -17.555 12.970 1.00 0.00 H ATOM 162 N LEU E 34 10.293 -16.896 11.750 1.00 13.20 N ATOM 163 CA LEU E 34 8.877 -16.927 11.490 1.00 13.60 C ATOM 164 C LEU E 34 8.135 -15.915 12.393 1.00 13.41 C ATOM 165 O LEU E 34 7.267 -15.184 11.933 1.00 13.00 O ATOM 166 CB LEU E 34 8.365 -18.345 11.723 1.00 14.19 C ATOM 167 CG LEU E 34 6.913 -18.597 11.351 1.00 16.95 C ATOM 168 CD1 LEU E 34 6.666 -18.304 9.870 1.00 17.83 C ATOM 169 CD2 LEU E 34 6.513 -20.017 11.722 1.00 18.97 C ATOM 170 HA LEU E 34 8.688 -16.641 10.455 1.00 0.00 H ATOM 171 HB2 LEU E 34 8.983 -19.024 11.136 1.00 0.00 H ATOM 172 HB3 LEU E 34 8.483 -18.573 12.782 1.00 0.00 H ATOM 173 HG LEU E 34 6.283 -17.913 11.920 1.00 0.00 H ATOM 174 HD21 LEU E 34 7.147 -20.723 11.186 1.00 0.00 H ATOM 175 HD22 LEU E 34 6.636 -20.159 12.796 1.00 0.00 H ATOM 176 HD23 LEU E 34 5.471 -20.182 11.450 1.00 0.00 H ATOM 177 HD11 LEU E 34 6.904 -17.261 9.663 1.00 0.00 H ATOM 178 HD12 LEU E 34 7.300 -18.950 9.262 1.00 0.00 H ATOM 179 HD13 LEU E 34 5.619 -18.493 9.633 1.00 0.00 H ATOM 180 H LEU E 34 10.768 -17.749 12.109 1.00 0.00 H ATOM 181 N LYS E 35 8.506 -15.862 13.669 1.00 13.72 N ATOM 182 CA LYS E 35 7.925 -14.930 14.650 1.00 14.78 C ATOM 183 C LYS E 35 8.091 -13.490 14.143 1.00 13.89 C ATOM 184 O LYS E 35 7.215 -12.624 14.272 1.00 12.62 O ATOM 185 CB LYS E 35 8.722 -15.053 15.971 1.00 16.03 C ATOM 186 CG LYS E 35 8.034 -15.499 17.250 1.00 19.69 C ATOM 187 CD LYS E 35 9.050 -16.110 18.261 1.00 19.86 C ATOM 188 CE LYS E 35 8.543 -16.189 19.716 1.00 21.40 C ATOM 189 NZ LYS E 35 9.135 -17.261 20.457 1.00 23.87 N ATOM 190 HA LYS E 35 6.871 -15.163 14.798 1.00 0.00 H ATOM 191 HB2 LYS E 35 9.527 -15.764 15.785 1.00 0.00 H ATOM 192 HB3 LYS E 35 9.147 -14.070 16.172 1.00 0.00 H ATOM 193 HG2 LYS E 35 7.549 -14.638 17.711 1.00 0.00 H ATOM 194 HG3 LYS E 35 7.282 -16.250 17.005 1.00 0.00 H ATOM 195 HD2 LYS E 35 9.293 -17.120 17.930 1.00 0.00 H ATOM 196 HD3 LYS E 35 9.952 -15.498 18.248 1.00 0.00 H ATOM 197 HE2 LYS E 35 7.463 -16.332 19.700 1.00 0.00 H ATOM 198 HE3 LYS E 35 8.776 -15.250 20.217 1.00 0.00 H ATOM 199 HZ1 LYS E 35 8.912 -18.165 19.994 1.00 0.00 H ATOM 200 HZ2 LYS E 35 10.166 -17.131 20.488 1.00 0.00 H ATOM 201 HZ3 LYS E 35 8.756 -17.263 21.425 1.00 0.00 H ATOM 202 H LYS E 35 9.248 -16.515 13.992 1.00 0.00 H ATOM 203 N ILE E 36 9.275 -13.234 13.613 1.00 12.90 N ATOM 204 CA ILE E 36 9.622 -11.916 13.112 1.00 12.21 C ATOM 205 C ILE E 36 8.720 -11.564 11.922 1.00 11.20 C ATOM 206 O ILE E 36 8.110 -10.484 11.870 1.00 10.80 O ATOM 207 CB ILE E 36 11.115 -11.849 12.759 1.00 11.61 C ATOM 208 CG1 ILE E 36 11.965 -11.720 14.036 1.00 11.43 C ATOM 209 CG2 ILE E 36 11.406 -10.713 11.788 1.00 12.16 C ATOM 210 CD1 ILE E 36 13.449 -11.869 13.786 1.00 11.31 C ATOM 211 HA ILE E 36 9.451 -11.170 13.888 1.00 0.00 H ATOM 212 HB ILE E 36 11.386 -12.779 12.260 1.00 0.00 H ATOM 213 HG12 ILE E 36 11.785 -10.738 14.474 1.00 0.00 H ATOM 214 HG13 ILE E 36 11.653 -12.493 14.739 1.00 0.00 H ATOM 215 HD11 ILE E 36 13.647 -12.851 13.357 1.00 0.00 H ATOM 216 HD12 ILE E 36 13.779 -11.095 13.092 1.00 0.00 H ATOM 217 HD13 ILE E 36 13.987 -11.767 14.729 1.00 0.00 H ATOM 218 HG21 ILE E 36 10.839 -10.868 10.870 1.00 0.00 H ATOM 219 HG22 ILE E 36 11.114 -9.766 12.241 1.00 0.00 H ATOM 220 HG23 ILE E 36 12.472 -10.695 11.560 1.00 0.00 H ATOM 221 H ILE E 36 9.978 -13.998 13.553 1.00 0.00 H ATOM 222 N LEU E 37 8.591 -12.466 10.961 1.00 11.53 N ATOM 223 CA LEU E 37 7.711 -12.194 9.823 1.00 12.75 C ATOM 224 C LEU E 37 6.263 -11.994 10.273 1.00 12.68 C ATOM 225 O LEU E 37 5.591 -11.047 9.847 1.00 11.91 O ATOM 226 CB LEU E 37 7.796 -13.304 8.794 1.00 13.38 C ATOM 227 CG LEU E 37 9.193 -13.690 8.298 1.00 14.39 C ATOM 228 CD1 LEU E 37 9.032 -14.679 7.156 1.00 16.10 C ATOM 229 CD2 LEU E 37 10.069 -12.482 7.930 1.00 14.94 C ATOM 230 HA LEU E 37 8.052 -11.268 9.361 1.00 0.00 H ATOM 231 HB2 LEU E 37 7.345 -14.194 9.233 1.00 0.00 H ATOM 232 HB3 LEU E 37 7.213 -12.993 7.927 1.00 0.00 H ATOM 233 HG LEU E 37 9.740 -14.163 9.113 1.00 0.00 H ATOM 234 HD21 LEU E 37 9.586 -11.913 7.136 1.00 0.00 H ATOM 235 HD22 LEU E 37 10.197 -11.847 8.807 1.00 0.00 H ATOM 236 HD23 LEU E 37 11.043 -12.832 7.587 1.00 0.00 H ATOM 237 HD11 LEU E 37 8.503 -15.562 7.514 1.00 0.00 H ATOM 238 HD12 LEU E 37 8.463 -14.214 6.352 1.00 0.00 H ATOM 239 HD13 LEU E 37 10.016 -14.968 6.786 1.00 0.00 H ATOM 240 H LEU E 37 9.113 -13.364 11.014 1.00 0.00 H ATOM 241 N HIS E 38 5.785 -12.861 11.155 1.00 13.23 N ATOM 242 CA HIS E 38 4.424 -12.711 11.661 1.00 13.71 C ATOM 243 C HIS E 38 4.258 -11.350 12.378 1.00 12.98 C ATOM 244 O HIS E 38 3.216 -10.705 12.306 1.00 13.41 O ATOM 245 CB HIS E 38 4.075 -13.836 12.648 1.00 14.51 C ATOM 246 CG HIS E 38 3.808 -15.185 12.039 1.00 17.55 C ATOM 247 ND1 HIS E 38 3.692 -15.431 10.686 1.00 20.83 N ATOM 248 CD2 HIS E 38 3.607 -16.376 12.650 1.00 20.07 C ATOM 249 CE1 HIS E 38 3.437 -16.717 10.493 1.00 21.77 C ATOM 250 NE2 HIS E 38 3.384 -17.309 11.670 1.00 22.36 N ATOM 251 HA HIS E 38 3.750 -12.761 10.806 1.00 0.00 H ATOM 252 HB2 HIS E 38 4.908 -13.942 13.342 1.00 0.00 H ATOM 253 HB3 HIS E 38 3.183 -13.534 13.197 1.00 0.00 H ATOM 254 HD2 HIS E 38 3.620 -16.560 13.724 1.00 0.00 H ATOM 255 HE1 HIS E 38 3.295 -17.202 9.527 1.00 0.00 H ATOM 256 H HIS E 38 6.379 -13.648 11.486 1.00 0.00 H ATOM 257 N ALA E 39 5.283 -10.907 13.093 1.00 12.06 N ATOM 258 CA ALA E 39 5.209 -9.641 13.811 1.00 11.74 C ATOM 259 C ALA E 39 5.072 -8.440 12.881 1.00 12.20 C ATOM 260 O ALA E 39 4.633 -7.365 13.313 1.00 12.00 O ATOM 261 CB ALA E 39 6.420 -9.455 14.693 1.00 11.85 C ATOM 262 HA ALA E 39 4.308 -9.691 14.423 1.00 0.00 H ATOM 263 HB1 ALA E 39 6.469 -10.268 15.417 1.00 0.00 H ATOM 264 HB2 ALA E 39 7.320 -9.459 14.078 1.00 0.00 H ATOM 265 HB3 ALA E 39 6.342 -8.503 15.219 1.00 0.00 H ATOM 266 H ALA E 39 6.154 -11.473 13.142 1.00 0.00 H ATOM 267 N ALA E 40 5.443 -8.635 11.615 1.00 12.62 N ATOM 268 CA ALA E 40 5.270 -7.617 10.583 1.00 13.53 C ATOM 269 C ALA E 40 4.035 -7.850 9.711 1.00 15.12 C ATOM 270 O ALA E 40 3.888 -7.194 8.677 1.00 16.73 O ATOM 271 CB ALA E 40 6.526 -7.548 9.715 1.00 13.41 C ATOM 272 HA ALA E 40 5.113 -6.666 11.092 1.00 0.00 H ATOM 273 HB1 ALA E 40 7.383 -7.291 10.338 1.00 0.00 H ATOM 274 HB2 ALA E 40 6.695 -8.517 9.244 1.00 0.00 H ATOM 275 HB3 ALA E 40 6.393 -6.787 8.946 1.00 0.00 H ATOM 276 H ALA E 40 5.871 -9.546 11.353 1.00 0.00 H ATOM 277 N GLY E 41 3.167 -8.769 10.114 1.00 15.67 N ATOM 278 CA GLY E 41 1.897 -8.959 9.431 1.00 16.74 C ATOM 279 C GLY E 41 1.842 -10.146 8.496 1.00 17.53 C ATOM 280 O GLY E 41 0.835 -10.356 7.830 1.00 19.06 O ATOM 281 HA3 GLY E 41 1.688 -8.061 8.849 1.00 0.00 H ATOM 282 HA2 GLY E 41 1.123 -9.089 10.187 1.00 0.00 H ATOM 283 H GLY E 41 3.399 -9.365 10.934 1.00 0.00 H ATOM 284 N ALA E 42 2.904 -10.926 8.429 1.00 17.98 N ATOM 285 CA ALA E 42 2.914 -12.095 7.579 1.00 19.24 C ATOM 286 C ALA E 42 2.003 -13.172 8.158 1.00 20.70 C ATOM 287 O ALA E 42 1.806 -13.245 9.372 1.00 20.81 O ATOM 288 CB ALA E 42 4.318 -12.620 7.428 1.00 18.95 C ATOM 289 HA ALA E 42 2.542 -11.816 6.593 1.00 0.00 H ATOM 290 HB1 ALA E 42 4.947 -11.849 6.982 1.00 0.00 H ATOM 291 HB2 ALA E 42 4.711 -12.889 8.408 1.00 0.00 H ATOM 292 HB3 ALA E 42 4.308 -13.500 6.785 1.00 0.00 H ATOM 293 H ALA E 42 3.745 -10.697 8.996 1.00 0.00 H ATOM 294 N GLN E 43 1.443 -14.008 7.287 1.00 22.49 N ATOM 295 CA GLN E 43 0.635 -15.136 7.736 1.00 24.71 C ATOM 296 C GLN E 43 1.122 -16.464 7.157 1.00 24.21 C ATOM 297 O GLN E 43 1.652 -16.509 6.048 1.00 23.87 O ATOM 298 CB GLN E 43 -0.827 -14.889 7.380 1.00 26.04 C ATOM 299 HA GLN E 43 0.736 -15.214 8.818 1.00 0.00 H ATOM 300 HB2 GLN E 43 -1.170 -13.978 7.870 1.00 0.00 H ATOM 301 HB3 GLN E 43 -0.923 -14.780 6.300 1.00 0.00 H ATOM 302 H GLN E 43 1.584 -13.854 6.268 1.00 0.00 H ATOM 303 N GLY E 44 0.969 -17.542 7.917 1.00 24.22 N ATOM 304 CA GLY E 44 1.358 -18.860 7.432 1.00 24.18 C ATOM 305 C GLY E 44 2.809 -19.216 7.692 1.00 24.28 C ATOM 306 O GLY E 44 3.506 -18.493 8.395 1.00 23.72 O ATOM 307 HA3 GLY E 44 1.185 -18.893 6.356 1.00 0.00 H ATOM 308 HA2 GLY E 44 0.730 -19.604 7.923 1.00 0.00 H ATOM 309 H GLY E 44 0.566 -17.444 8.871 1.00 0.00 H ATOM 310 N GLU E 45 3.261 -20.334 7.126 1.00 24.78 N ATOM 311 CA GLU E 45 4.605 -20.856 7.395 1.00 25.10 C ATOM 312 C GLU E 45 5.525 -20.897 6.192 1.00 23.52 C ATOM 313 O GLU E 45 6.727 -21.086 6.346 1.00 23.46 O ATOM 314 CB GLU E 45 4.548 -22.279 7.963 1.00 26.45 C ATOM 315 CG GLU E 45 3.874 -22.403 9.313 1.00 30.51 C ATOM 316 CD GLU E 45 4.236 -23.691 10.036 1.00 34.73 C ATOM 317 OE1 GLU E 45 4.156 -23.696 11.285 1.00 37.43 O ATOM 318 OE2 GLU E 45 4.595 -24.689 9.370 1.00 36.08 O ATOM 319 HA GLU E 45 5.015 -20.146 8.114 1.00 0.00 H ATOM 320 HB2 GLU E 45 4.005 -22.904 7.255 1.00 0.00 H ATOM 321 HB3 GLU E 45 5.570 -22.646 8.060 1.00 0.00 H ATOM 322 HG2 GLU E 45 4.176 -21.559 9.932 1.00 0.00 H ATOM 323 HG3 GLU E 45 2.794 -22.377 9.167 1.00 0.00 H ATOM 324 H GLU E 45 2.641 -20.853 6.472 1.00 0.00 H ATOM 325 N MET E 46 4.973 -20.767 4.998 1.00 21.72 N ATOM 326 CA MET E 46 5.773 -20.932 3.792 1.00 21.20 C ATOM 327 C MET E 46 5.845 -19.627 3.022 1.00 19.37 C ATOM 328 O MET E 46 4.840 -18.936 2.846 1.00 18.75 O ATOM 329 CB MET E 46 5.175 -22.016 2.887 1.00 21.65 C ATOM 330 CG MET E 46 5.100 -23.396 3.520 1.00 25.16 C ATOM 331 SD MET E 46 6.669 -24.036 4.113 1.00 31.12 S ATOM 332 CE MET E 46 7.533 -24.396 2.566 1.00 31.86 C ATOM 333 HA MET E 46 6.776 -21.232 4.095 1.00 0.00 H ATOM 334 HB2 MET E 46 4.165 -21.712 2.613 1.00 0.00 H ATOM 335 HB3 MET E 46 5.788 -22.086 1.989 1.00 0.00 H ATOM 336 HG2 MET E 46 4.709 -24.090 2.776 1.00 0.00 H ATOM 337 HG3 MET E 46 4.413 -23.346 4.364 1.00 0.00 H ATOM 338 HE1 MET E 46 6.961 -25.126 1.993 1.00 0.00 H ATOM 339 HE2 MET E 46 7.636 -23.478 1.987 1.00 0.00 H ATOM 340 HE3 MET E 46 8.521 -24.800 2.788 1.00 0.00 H ATOM 341 H MET E 46 3.960 -20.545 4.919 1.00 0.00 H ATOM 342 N PHE E 47 7.045 -19.301 2.560 1.00 18.16 N ATOM 343 CA PHE E 47 7.288 -18.021 1.904 1.00 17.31 C ATOM 344 C PHE E 47 8.327 -18.147 0.821 1.00 17.32 C ATOM 345 O PHE E 47 9.166 -19.032 0.854 1.00 18.86 O ATOM 346 CB PHE E 47 7.803 -16.980 2.922 1.00 16.80 C ATOM 347 CG PHE E 47 6.861 -16.741 4.064 1.00 15.20 C ATOM 348 CD1 PHE E 47 5.841 -15.821 3.968 1.00 16.27 C ATOM 349 CD2 PHE E 47 6.967 -17.489 5.214 1.00 16.03 C ATOM 350 CE1 PHE E 47 4.950 -15.633 5.025 1.00 16.43 C ATOM 351 CE2 PHE E 47 6.077 -17.320 6.266 1.00 15.44 C ATOM 352 CZ PHE E 47 5.079 -16.397 6.171 1.00 16.09 C ATOM 353 HA PHE E 47 6.339 -17.703 1.472 1.00 0.00 H ATOM 354 HB2 PHE E 47 8.752 -17.332 3.326 1.00 0.00 H ATOM 355 HB3 PHE E 47 7.960 -16.036 2.401 1.00 0.00 H ATOM 356 HD2 PHE E 47 7.764 -18.227 5.301 1.00 0.00 H ATOM 357 HE2 PHE E 47 6.176 -17.925 7.167 1.00 0.00 H ATOM 358 HZ PHE E 47 4.382 -16.261 6.998 1.00 0.00 H ATOM 359 HE1 PHE E 47 4.157 -14.889 4.948 1.00 0.00 H ATOM 360 HD1 PHE E 47 5.729 -15.234 3.057 1.00 0.00 H ATOM 361 H PHE E 47 7.831 -19.974 2.668 1.00 0.00 H ATOM 362 N THR E 48 8.290 -17.231 -0.129 1.00 17.48 N ATOM 363 CA THR E 48 9.402 -17.072 -1.035 1.00 17.56 C ATOM 364 C THR E 48 10.445 -16.238 -0.313 1.00 16.93 C ATOM 365 O THR E 48 10.122 -15.535 0.635 1.00 17.14 O ATOM 366 CB THR E 48 9.009 -16.323 -2.310 1.00 18.12 C ATOM 367 OG1 THR E 48 8.475 -15.038 -1.974 1.00 19.48 O ATOM 368 CG2 THR E 48 7.969 -17.099 -3.112 1.00 19.04 C ATOM 369 HA THR E 48 9.764 -18.059 -1.322 1.00 0.00 H ATOM 370 HB THR E 48 9.906 -16.210 -2.919 1.00 0.00 H ATOM 371 HG1 THR E 48 8.223 -14.559 -2.803 1.00 0.00 H ATOM 372 HG23 THR E 48 8.369 -18.079 -3.371 1.00 0.00 H ATOM 373 HG21 THR E 48 7.067 -17.221 -2.513 1.00 0.00 H ATOM 374 HG22 THR E 48 7.731 -16.550 -4.023 1.00 0.00 H ATOM 375 H THR E 48 7.454 -16.620 -0.225 1.00 0.00 H ATOM 376 N VAL E 49 11.685 -16.269 -0.767 1.00 16.62 N ATOM 377 CA VAL E 49 12.693 -15.404 -0.155 1.00 16.35 C ATOM 378 C VAL E 49 12.353 -13.929 -0.403 1.00 15.74 C ATOM 379 O VAL E 49 12.588 -13.087 0.454 1.00 14.85 O ATOM 380 CB VAL E 49 14.109 -15.778 -0.588 1.00 16.52 C ATOM 381 CG1 VAL E 49 15.087 -14.754 -0.087 1.00 16.33 C ATOM 382 CG2 VAL E 49 14.456 -17.166 -0.046 1.00 17.32 C ATOM 383 HA VAL E 49 12.673 -15.560 0.924 1.00 0.00 H ATOM 384 HB VAL E 49 14.164 -15.800 -1.676 1.00 0.00 H ATOM 385 HG11 VAL E 49 14.832 -13.778 -0.499 1.00 0.00 H ATOM 386 HG12 VAL E 49 15.043 -14.714 1.001 1.00 0.00 H ATOM 387 HG13 VAL E 49 16.093 -15.030 -0.401 1.00 0.00 H ATOM 388 HG21 VAL E 49 14.399 -17.154 1.042 1.00 0.00 H ATOM 389 HG22 VAL E 49 13.749 -17.896 -0.441 1.00 0.00 H ATOM 390 HG23 VAL E 49 15.467 -17.433 -0.355 1.00 0.00 H ATOM 391 H VAL E 49 11.942 -16.902 -1.551 1.00 0.00 H ATOM 392 N LYS E 50 11.766 -13.620 -1.545 1.00 15.00 N ATOM 393 CA LYS E 50 11.276 -12.273 -1.808 1.00 15.00 C ATOM 394 C LYS E 50 10.339 -11.805 -0.700 1.00 15.00 C ATOM 395 O LYS E 50 10.485 -10.697 -0.148 1.00 15.41 O ATOM 396 CB LYS E 50 10.550 -12.226 -3.154 1.00 15.00 C ATOM 397 CG LYS E 50 9.653 -11.062 -3.541 1.00 15.00 C ATOM 398 CD LYS E 50 9.386 -11.044 -5.037 1.00 15.00 C ATOM 399 CE LYS E 50 8.489 -9.879 -5.424 1.00 15.00 C ATOM 400 NZ LYS E 50 8.218 -9.849 -6.888 1.00 15.00 N ATOM 401 HA LYS E 50 12.135 -11.603 -1.839 1.00 0.00 H ATOM 402 HB2 LYS E 50 11.323 -12.285 -3.921 1.00 0.00 H ATOM 403 HB3 LYS E 50 9.928 -13.120 -3.197 1.00 0.00 H ATOM 404 HG2 LYS E 50 8.704 -11.153 -3.012 1.00 0.00 H ATOM 405 HG3 LYS E 50 10.139 -10.129 -3.255 1.00 0.00 H ATOM 406 HD2 LYS E 50 10.335 -10.953 -5.566 1.00 0.00 H ATOM 407 HD3 LYS E 50 8.900 -11.977 -5.323 1.00 0.00 H ATOM 408 HE2 LYS E 50 8.977 -8.948 -5.137 1.00 0.00 H ATOM 409 HE3 LYS E 50 7.542 -9.971 -4.892 1.00 0.00 H ATOM 410 HZ1 LYS E 50 9.116 -9.754 -7.404 1.00 0.00 H ATOM 411 HZ2 LYS E 50 7.746 -10.732 -7.170 1.00 0.00 H ATOM 412 HZ3 LYS E 50 7.603 -9.040 -7.109 1.00 0.00 H ATOM 413 H LYS E 50 11.651 -14.354 -2.273 1.00 0.00 H ATOM 414 N GLU E 51 9.388 -12.645 -0.312 1.00 15.36 N ATOM 415 CA GLU E 51 8.474 -12.341 0.773 1.00 15.44 C ATOM 416 C GLU E 51 9.197 -12.167 2.102 1.00 13.99 C ATOM 417 O GLU E 51 8.940 -11.221 2.819 1.00 13.59 O ATOM 418 CB GLU E 51 7.426 -13.433 0.901 1.00 16.11 C ATOM 419 CG GLU E 51 6.394 -13.323 -0.184 1.00 19.35 C ATOM 420 CD GLU E 51 5.431 -14.477 -0.202 1.00 23.45 C ATOM 421 OE1 GLU E 51 5.846 -15.619 0.079 1.00 22.37 O ATOM 422 OE2 GLU E 51 4.252 -14.231 -0.513 1.00 28.08 O ATOM 423 HA GLU E 51 7.992 -11.394 0.530 1.00 0.00 H ATOM 424 HB2 GLU E 51 7.914 -14.405 0.831 1.00 0.00 H ATOM 425 HB3 GLU E 51 6.935 -13.343 1.870 1.00 0.00 H ATOM 426 HG2 GLU E 51 5.830 -12.402 -0.034 1.00 0.00 H ATOM 427 HG3 GLU E 51 6.905 -13.282 -1.146 1.00 0.00 H ATOM 428 H GLU E 51 9.294 -13.556 -0.804 1.00 0.00 H ATOM 429 N VAL E 52 10.086 -13.086 2.421 1.00 12.93 N ATOM 430 CA VAL E 52 10.847 -13.023 3.652 1.00 12.54 C ATOM 431 C VAL E 52 11.543 -11.687 3.766 1.00 12.72 C ATOM 432 O VAL E 52 11.461 -11.037 4.793 1.00 12.89 O ATOM 433 CB VAL E 52 11.889 -14.159 3.717 1.00 11.88 C ATOM 434 CG1 VAL E 52 12.875 -13.955 4.895 1.00 13.66 C ATOM 435 CG2 VAL E 52 11.165 -15.509 3.821 1.00 13.56 C ATOM 436 HA VAL E 52 10.153 -13.142 4.484 1.00 0.00 H ATOM 437 HB VAL E 52 12.483 -14.146 2.803 1.00 0.00 H ATOM 438 HG11 VAL E 52 13.401 -13.009 4.767 1.00 0.00 H ATOM 439 HG12 VAL E 52 12.320 -13.940 5.833 1.00 0.00 H ATOM 440 HG13 VAL E 52 13.595 -14.773 4.911 1.00 0.00 H ATOM 441 HG21 VAL E 52 10.553 -15.523 4.723 1.00 0.00 H ATOM 442 HG22 VAL E 52 10.529 -15.647 2.947 1.00 0.00 H ATOM 443 HG23 VAL E 52 11.901 -16.312 3.867 1.00 0.00 H ATOM 444 H VAL E 52 10.246 -13.881 1.769 1.00 0.00 H ATOM 445 N MET E 53 12.201 -11.269 2.695 1.00 12.78 N ATOM 446 CA MET E 53 12.979 -10.032 2.736 1.00 11.76 C ATOM 447 C MET E 53 12.096 -8.809 2.812 1.00 11.46 C ATOM 448 O MET E 53 12.431 -7.824 3.463 1.00 10.57 O ATOM 449 CB MET E 53 13.918 -9.939 1.545 1.00 12.12 C ATOM 450 CG MET E 53 14.966 -10.976 1.563 1.00 13.96 C ATOM 451 SD MET E 53 15.987 -10.965 3.023 1.00 18.78 S ATOM 452 CE MET E 53 16.903 -9.473 2.734 1.00 19.35 C ATOM 453 HA MET E 53 13.576 -10.062 3.647 1.00 0.00 H ATOM 454 HB2 MET E 53 13.334 -10.049 0.631 1.00 0.00 H ATOM 455 HB3 MET E 53 14.396 -8.960 1.554 1.00 0.00 H ATOM 456 HG2 MET E 53 15.609 -10.826 0.696 1.00 0.00 H ATOM 457 HG3 MET E 53 14.483 -11.951 1.492 1.00 0.00 H ATOM 458 HE1 MET E 53 17.459 -9.565 1.801 1.00 0.00 H ATOM 459 HE2 MET E 53 16.213 -8.632 2.666 1.00 0.00 H ATOM 460 HE3 MET E 53 17.597 -9.309 3.558 1.00 0.00 H ATOM 461 H MET E 53 12.164 -11.826 1.817 1.00 0.00 H ATOM 462 N HIS E 54 10.960 -8.854 2.142 1.00 11.90 N ATOM 463 CA HIS E 54 10.022 -7.777 2.258 1.00 12.10 C ATOM 464 C HIS E 54 9.477 -7.665 3.673 1.00 11.90 C ATOM 465 O HIS E 54 9.443 -6.572 4.235 1.00 12.10 O ATOM 466 CB HIS E 54 8.882 -7.961 1.278 1.00 11.99 C ATOM 467 CG HIS E 54 9.183 -7.502 -0.121 1.00 14.48 C ATOM 468 ND1 HIS E 54 10.111 -6.529 -0.447 1.00 15.90 N ATOM 469 CD2 HIS E 54 8.598 -7.865 -1.280 1.00 15.65 C ATOM 470 CE1 HIS E 54 10.104 -6.347 -1.757 1.00 14.22 C ATOM 471 NE2 HIS E 54 9.189 -7.143 -2.283 1.00 16.90 N ATOM 472 HA HIS E 54 10.550 -6.853 2.024 1.00 0.00 H ATOM 473 HB2 HIS E 54 8.631 -9.021 1.242 1.00 0.00 H ATOM 474 HB3 HIS E 54 8.024 -7.398 1.644 1.00 0.00 H ATOM 475 HD2 HIS E 54 7.801 -8.599 -1.398 1.00 0.00 H ATOM 476 HE1 HIS E 54 10.744 -5.658 -2.309 1.00 0.00 H ATOM 477 H HIS E 54 10.746 -9.669 1.532 1.00 0.00 H ATOM 478 N TYR E 55 9.083 -8.779 4.277 1.00 12.69 N ATOM 479 CA TYR E 55 8.569 -8.703 5.645 1.00 12.26 C ATOM 480 C TYR E 55 9.648 -8.300 6.646 1.00 11.82 C ATOM 481 O TYR E 55 9.348 -7.644 7.616 1.00 11.31 O ATOM 482 CB TYR E 55 7.910 -10.008 6.101 1.00 13.51 C ATOM 483 CG TYR E 55 6.537 -10.212 5.540 1.00 14.78 C ATOM 484 CD1 TYR E 55 5.519 -9.337 5.860 1.00 17.57 C ATOM 485 CD2 TYR E 55 6.255 -11.285 4.701 1.00 16.43 C ATOM 486 CE1 TYR E 55 4.251 -9.492 5.355 1.00 19.60 C ATOM 487 CE2 TYR E 55 4.973 -11.458 4.186 1.00 18.66 C ATOM 488 CZ TYR E 55 3.979 -10.550 4.526 1.00 21.08 C ATOM 489 OH TYR E 55 2.694 -10.690 4.039 1.00 24.59 O ATOM 490 HA TYR E 55 7.806 -7.925 5.622 1.00 0.00 H ATOM 491 HB3 TYR E 55 7.841 -9.998 7.189 1.00 0.00 H ATOM 492 HB2 TYR E 55 8.539 -10.841 5.786 1.00 0.00 H ATOM 493 HD2 TYR E 55 7.042 -11.994 4.445 1.00 0.00 H ATOM 494 HE2 TYR E 55 4.752 -12.296 3.524 1.00 0.00 H ATOM 495 HE1 TYR E 55 3.467 -8.779 5.611 1.00 0.00 H ATOM 496 HD1 TYR E 55 5.726 -8.502 6.530 1.00 0.00 H ATOM 497 HH TYR E 55 2.324 -11.560 4.333 1.00 0.00 H ATOM 498 H TYR E 55 9.139 -9.693 3.785 1.00 0.00 H ATOM 499 N LEU E 56 10.883 -8.717 6.425 1.00 11.11 N ATOM 500 CA LEU E 56 11.987 -8.278 7.286 1.00 10.53 C ATOM 501 C LEU E 56 12.149 -6.770 7.231 1.00 10.90 C ATOM 502 O LEU E 56 12.385 -6.134 8.246 1.00 9.49 O ATOM 503 CB LEU E 56 13.310 -8.956 6.920 1.00 10.73 C ATOM 504 CG LEU E 56 13.576 -10.311 7.559 1.00 12.26 C ATOM 505 CD1 LEU E 56 14.673 -11.046 6.826 1.00 12.31 C ATOM 506 CD2 LEU E 56 13.916 -10.125 9.045 1.00 15.02 C ATOM 507 HA LEU E 56 11.729 -8.575 8.303 1.00 0.00 H ATOM 508 HB2 LEU E 56 13.326 -9.090 5.838 1.00 0.00 H ATOM 509 HB3 LEU E 56 14.118 -8.286 7.214 1.00 0.00 H ATOM 510 HG LEU E 56 12.676 -10.922 7.486 1.00 0.00 H ATOM 511 HD21 LEU E 56 14.805 -9.501 9.138 1.00 0.00 H ATOM 512 HD22 LEU E 56 13.078 -9.645 9.551 1.00 0.00 H ATOM 513 HD23 LEU E 56 14.106 -11.098 9.498 1.00 0.00 H ATOM 514 HD11 LEU E 56 14.376 -11.199 5.789 1.00 0.00 H ATOM 515 HD12 LEU E 56 15.589 -10.456 6.859 1.00 0.00 H ATOM 516 HD13 LEU E 56 14.843 -12.011 7.303 1.00 0.00 H ATOM 517 H LEU E 56 11.074 -9.363 5.633 1.00 0.00 H ATOM 518 N GLY E 57 12.085 -6.180 6.048 1.00 10.74 N ATOM 519 CA GLY E 57 12.192 -4.725 5.964 1.00 10.57 C ATOM 520 C GLY E 57 11.031 -4.047 6.674 1.00 10.25 C ATOM 521 O GLY E 57 11.207 -3.079 7.397 1.00 10.54 O ATOM 522 HA3 GLY E 57 12.190 -4.428 4.915 1.00 0.00 H ATOM 523 HA2 GLY E 57 13.126 -4.409 6.428 1.00 0.00 H ATOM 524 H GLY E 57 11.960 -6.747 5.185 1.00 0.00 H ATOM 525 N GLN E 58 9.833 -4.597 6.505 1.00 10.92 N ATOM 526 CA GLN E 58 8.654 -4.068 7.202 1.00 11.65 C ATOM 527 C GLN E 58 8.786 -4.204 8.725 1.00 10.60 C ATOM 528 O GLN E 58 8.440 -3.274 9.469 1.00 10.66 O ATOM 529 CB GLN E 58 7.388 -4.746 6.694 1.00 12.85 C ATOM 530 CG GLN E 58 7.072 -4.406 5.244 1.00 17.49 C ATOM 531 CD GLN E 58 5.832 -5.100 4.706 1.00 24.19 C ATOM 532 OE1 GLN E 58 5.086 -4.523 3.911 1.00 27.65 O ATOM 533 NE2 GLN E 58 5.606 -6.334 5.124 1.00 25.49 N ATOM 534 HA GLN E 58 8.585 -3.003 6.983 1.00 0.00 H ATOM 535 HB2 GLN E 58 7.514 -5.825 6.779 1.00 0.00 H ATOM 536 HB3 GLN E 58 6.551 -4.429 7.316 1.00 0.00 H ATOM 537 HG2 GLN E 58 6.923 -3.329 5.168 1.00 0.00 H ATOM 538 HG3 GLN E 58 7.923 -4.698 4.629 1.00 0.00 H ATOM 539 HE22 GLN E 58 6.261 -6.784 5.795 1.00 0.00 H ATOM 540 HE21 GLN E 58 4.773 -6.855 4.781 1.00 0.00 H ATOM 541 H GLN E 58 9.729 -5.414 5.870 1.00 0.00 H ATOM 542 N TYR E 59 9.327 -5.330 9.177 1.00 10.30 N ATOM 543 CA TYR E 59 9.557 -5.554 10.597 1.00 9.78 C ATOM 544 C TYR E 59 10.451 -4.487 11.198 1.00 9.05 C ATOM 545 O TYR E 59 10.163 -3.950 12.257 1.00 9.40 O ATOM 546 CB TYR E 59 10.211 -6.908 10.763 1.00 9.24 C ATOM 547 CG TYR E 59 10.608 -7.278 12.161 1.00 8.98 C ATOM 548 CD1 TYR E 59 9.679 -7.836 13.018 1.00 8.25 C ATOM 549 CD2 TYR E 59 11.890 -7.081 12.635 1.00 10.28 C ATOM 550 CE1 TYR E 59 10.033 -8.215 14.287 1.00 10.06 C ATOM 551 CE2 TYR E 59 12.240 -7.461 13.919 1.00 9.43 C ATOM 552 CZ TYR E 59 11.291 -8.012 14.742 1.00 8.87 C ATOM 553 OH TYR E 59 11.607 -8.429 16.019 1.00 9.96 O ATOM 554 HA TYR E 59 8.600 -5.513 11.117 1.00 0.00 H ATOM 555 HB3 TYR E 59 11.109 -6.923 10.146 1.00 0.00 H ATOM 556 HB2 TYR E 59 9.512 -7.663 10.403 1.00 0.00 H ATOM 557 HD2 TYR E 59 12.637 -6.620 11.989 1.00 0.00 H ATOM 558 HE2 TYR E 59 13.262 -7.324 14.273 1.00 0.00 H ATOM 559 HE1 TYR E 59 9.294 -8.685 14.936 1.00 0.00 H ATOM 560 HD1 TYR E 59 8.652 -7.977 12.681 1.00 0.00 H ATOM 561 HH TYR E 59 11.945 -7.659 16.542 1.00 0.00 H ATOM 562 H TYR E 59 9.593 -6.071 8.498 1.00 0.00 H ATOM 563 N ILE E 60 11.522 -4.156 10.500 1.00 8.77 N ATOM 564 CA ILE E 60 12.458 -3.161 10.987 1.00 8.96 C ATOM 565 C ILE E 60 11.743 -1.823 11.148 1.00 9.71 C ATOM 566 O ILE E 60 12.009 -1.094 12.104 1.00 10.65 O ATOM 567 CB ILE E 60 13.657 -3.074 10.038 1.00 8.85 C ATOM 568 CG1 ILE E 60 14.504 -4.348 10.137 1.00 9.25 C ATOM 569 CG2 ILE E 60 14.482 -1.851 10.330 1.00 8.71 C ATOM 570 CD1 ILE E 60 15.508 -4.487 8.992 1.00 10.31 C ATOM 571 HA ILE E 60 12.840 -3.447 11.967 1.00 0.00 H ATOM 572 HB ILE E 60 13.287 -2.987 9.016 1.00 0.00 H ATOM 573 HG12 ILE E 60 15.051 -4.329 11.079 1.00 0.00 H ATOM 574 HG13 ILE E 60 13.838 -5.211 10.122 1.00 0.00 H ATOM 575 HD11 ILE E 60 14.973 -4.517 8.043 1.00 0.00 H ATOM 576 HD12 ILE E 60 16.188 -3.635 9.001 1.00 0.00 H ATOM 577 HD13 ILE E 60 16.077 -5.408 9.119 1.00 0.00 H ATOM 578 HG21 ILE E 60 13.867 -0.960 10.202 1.00 0.00 H ATOM 579 HG22 ILE E 60 14.848 -1.897 11.356 1.00 0.00 H ATOM 580 HG23 ILE E 60 15.327 -1.812 9.643 1.00 0.00 H ATOM 581 H ILE E 60 11.697 -4.617 9.585 1.00 0.00 H ATOM 582 N MET E 61 10.821 -1.511 10.237 1.00 11.27 N ATOM 583 CA MET E 61 10.025 -0.300 10.350 1.00 12.73 C ATOM 584 C MET E 61 8.980 -0.368 11.463 1.00 12.49 C ATOM 585 O MET E 61 8.879 0.555 12.275 1.00 12.96 O ATOM 586 CB MET E 61 9.415 0.085 9.001 1.00 13.55 C ATOM 587 CG MET E 61 10.498 0.563 8.003 1.00 16.52 C ATOM 588 SD MET E 61 9.766 0.963 6.425 1.00 23.12 S ATOM 589 CE MET E 61 9.589 -0.632 5.620 1.00 26.04 C ATOM 590 HA MET E 61 10.707 0.498 10.645 1.00 0.00 H ATOM 591 HB2 MET E 61 8.905 -0.783 8.582 1.00 0.00 H ATOM 592 HB3 MET E 61 8.695 0.889 9.154 1.00 0.00 H ATOM 593 HG2 MET E 61 11.234 -0.229 7.866 1.00 0.00 H ATOM 594 HG3 MET E 61 10.990 1.449 8.405 1.00 0.00 H ATOM 595 HE1 MET E 61 10.570 -1.095 5.515 1.00 0.00 H ATOM 596 HE2 MET E 61 8.946 -1.273 6.223 1.00 0.00 H ATOM 597 HE3 MET E 61 9.144 -0.493 4.635 1.00 0.00 H ATOM 598 H MET E 61 10.668 -2.147 9.429 1.00 0.00 H ATOM 599 N VAL E 62 8.206 -1.445 11.501 1.00 12.63 N ATOM 600 CA VAL E 62 7.167 -1.635 12.526 1.00 13.64 C ATOM 601 C VAL E 62 7.720 -1.499 13.951 1.00 12.54 C ATOM 602 O VAL E 62 7.093 -0.916 14.843 1.00 12.13 O ATOM 603 CB VAL E 62 6.521 -3.044 12.347 1.00 14.88 C ATOM 604 CG1 VAL E 62 5.733 -3.489 13.602 1.00 16.98 C ATOM 605 CG2 VAL E 62 5.667 -3.052 11.100 1.00 17.30 C ATOM 606 HA VAL E 62 6.421 -0.851 12.392 1.00 0.00 H ATOM 607 HB VAL E 62 7.317 -3.779 12.226 1.00 0.00 H ATOM 608 HG11 VAL E 62 6.408 -3.531 14.457 1.00 0.00 H ATOM 609 HG12 VAL E 62 4.936 -2.773 13.802 1.00 0.00 H ATOM 610 HG13 VAL E 62 5.302 -4.475 13.428 1.00 0.00 H ATOM 611 HG21 VAL E 62 4.882 -2.301 11.194 1.00 0.00 H ATOM 612 HG22 VAL E 62 6.288 -2.824 10.234 1.00 0.00 H ATOM 613 HG23 VAL E 62 5.216 -4.037 10.976 1.00 0.00 H ATOM 614 H VAL E 62 8.338 -2.182 10.780 1.00 0.00 H ATOM 615 N LYS E 63 8.878 -2.092 14.166 1.00 11.87 N ATOM 616 CA LYS E 63 9.526 -2.082 15.461 1.00 12.25 C ATOM 617 C LYS E 63 10.481 -0.901 15.655 1.00 12.04 C ATOM 618 O LYS E 63 11.114 -0.780 16.682 1.00 11.65 O ATOM 619 CB LYS E 63 10.206 -3.423 15.720 1.00 12.95 C ATOM 620 CG LYS E 63 9.193 -4.562 15.856 1.00 15.00 C ATOM 621 CD LYS E 63 9.777 -5.773 16.495 1.00 15.22 C ATOM 622 CE LYS E 63 9.630 -5.717 18.014 1.00 13.05 C ATOM 623 NZ LYS E 63 10.327 -6.866 18.622 1.00 12.56 N ATOM 624 HA LYS E 63 8.747 -1.939 16.210 1.00 0.00 H ATOM 625 HB2 LYS E 63 10.876 -3.645 14.889 1.00 0.00 H ATOM 626 HB3 LYS E 63 10.783 -3.353 16.642 1.00 0.00 H ATOM 627 HG2 LYS E 63 8.357 -4.215 16.463 1.00 0.00 H ATOM 628 HG3 LYS E 63 8.833 -4.830 14.863 1.00 0.00 H ATOM 629 HD2 LYS E 63 9.262 -6.657 16.119 1.00 0.00 H ATOM 630 HD3 LYS E 63 10.835 -5.835 16.241 1.00 0.00 H ATOM 631 HE2 LYS E 63 8.573 -5.753 18.278 1.00 0.00 H ATOM 632 HE3 LYS E 63 10.065 -4.790 18.387 1.00 0.00 H ATOM 633 HZ1 LYS E 63 9.911 -7.750 18.267 1.00 0.00 H ATOM 634 HZ2 LYS E 63 11.336 -6.831 18.371 1.00 0.00 H ATOM 635 HZ3 LYS E 63 10.225 -6.824 19.656 1.00 0.00 H ATOM 636 H LYS E 63 9.343 -2.585 13.377 1.00 0.00 H ATOM 637 N GLN E 64 10.527 -0.008 14.678 1.00 11.88 N ATOM 638 CA GLN E 64 11.309 1.216 14.785 1.00 13.04 C ATOM 639 C GLN E 64 12.768 0.903 15.143 1.00 11.63 C ATOM 640 O GLN E 64 13.367 1.535 16.026 1.00 10.92 O ATOM 641 CB GLN E 64 10.696 2.159 15.817 1.00 14.13 C ATOM 642 CG GLN E 64 9.342 2.757 15.472 1.00 17.10 C ATOM 643 CD GLN E 64 8.697 3.440 16.689 1.00 19.68 C ATOM 644 OE1 GLN E 64 9.349 4.162 17.456 1.00 21.00 O ATOM 645 NE2 GLN E 64 7.398 3.211 16.859 1.00 22.78 N ATOM 646 HA GLN E 64 11.295 1.711 13.814 1.00 0.00 H ATOM 647 HB2 GLN E 64 10.585 1.604 16.748 1.00 0.00 H ATOM 648 HB3 GLN E 64 11.393 2.983 15.968 1.00 0.00 H ATOM 649 HG2 GLN E 64 9.472 3.495 14.680 1.00 0.00 H ATOM 650 HG3 GLN E 64 8.683 1.962 15.122 1.00 0.00 H ATOM 651 HE22 GLN E 64 6.886 2.598 16.192 1.00 0.00 H ATOM 652 HE21 GLN E 64 6.894 3.645 17.659 1.00 0.00 H ATOM 653 H GLN E 64 9.988 -0.186 13.807 1.00 0.00 H ATOM 654 N LEU E 65 13.348 -0.069 14.449 1.00 11.29 N ATOM 655 CA LEU E 65 14.711 -0.475 14.748 1.00 11.18 C ATOM 656 C LEU E 65 15.721 0.344 13.936 1.00 10.32 C ATOM 657 O LEU E 65 16.877 0.450 14.306 1.00 12.01 O ATOM 658 CB LEU E 65 14.918 -1.965 14.521 1.00 11.19 C ATOM 659 CG LEU E 65 14.057 -2.928 15.344 1.00 11.65 C ATOM 660 CD1 LEU E 65 14.297 -4.351 14.878 1.00 11.88 C ATOM 661 CD2 LEU E 65 14.353 -2.767 16.815 1.00 12.56 C ATOM 662 HA LEU E 65 14.882 -0.277 15.806 1.00 0.00 H ATOM 663 HB2 LEU E 65 14.720 -2.167 13.468 1.00 0.00 H ATOM 664 HB3 LEU E 65 15.962 -2.188 14.742 1.00 0.00 H ATOM 665 HG LEU E 65 13.003 -2.695 15.194 1.00 0.00 H ATOM 666 HD21 LEU E 65 15.405 -2.984 16.998 1.00 0.00 H ATOM 667 HD22 LEU E 65 14.133 -1.743 17.119 1.00 0.00 H ATOM 668 HD23 LEU E 65 13.733 -3.458 17.387 1.00 0.00 H ATOM 669 HD11 LEU E 65 14.031 -4.437 13.824 1.00 0.00 H ATOM 670 HD12 LEU E 65 15.349 -4.603 15.010 1.00 0.00 H ATOM 671 HD13 LEU E 65 13.683 -5.033 15.466 1.00 0.00 H ATOM 672 H LEU E 65 12.823 -0.543 13.686 1.00 0.00 H ATOM 673 N TYR E 66 15.263 0.932 12.839 1.00 9.82 N ATOM 674 CA TYR E 66 16.133 1.796 12.034 1.00 9.44 C ATOM 675 C TYR E 66 16.188 3.163 12.690 1.00 9.05 C ATOM 676 O TYR E 66 15.283 3.579 13.398 1.00 8.97 O ATOM 677 CB TYR E 66 15.684 1.887 10.565 1.00 9.85 C ATOM 678 CG TYR E 66 14.503 2.788 10.356 1.00 8.97 C ATOM 679 CD1 TYR E 66 14.669 4.098 9.971 1.00 10.56 C ATOM 680 CD2 TYR E 66 13.204 2.329 10.561 1.00 9.25 C ATOM 681 CE1 TYR E 66 13.584 4.941 9.810 1.00 9.90 C ATOM 682 CE2 TYR E 66 12.119 3.168 10.392 1.00 9.22 C ATOM 683 CZ TYR E 66 12.321 4.467 10.011 1.00 11.21 C ATOM 684 OH TYR E 66 11.282 5.337 9.844 1.00 12.95 O ATOM 685 HA TYR E 66 17.131 1.360 12.003 1.00 0.00 H ATOM 686 HB3 TYR E 66 15.420 0.887 10.222 1.00 0.00 H ATOM 687 HB2 TYR E 66 16.517 2.266 9.972 1.00 0.00 H ATOM 688 HD2 TYR E 66 13.041 1.293 10.859 1.00 0.00 H ATOM 689 HE2 TYR E 66 11.108 2.797 10.561 1.00 0.00 H ATOM 690 HE1 TYR E 66 13.738 5.981 9.523 1.00 0.00 H ATOM 691 HD1 TYR E 66 15.674 4.479 9.789 1.00 0.00 H ATOM 692 HH TYR E 66 11.634 6.220 9.569 1.00 0.00 H ATOM 693 H TYR E 66 14.277 0.779 12.547 1.00 0.00 H ATOM 694 N ASP E 67 17.252 3.897 12.426 1.00 9.35 N ATOM 695 CA ASP E 67 17.418 5.208 13.021 1.00 9.57 C ATOM 696 C ASP E 67 16.832 6.258 12.103 1.00 9.22 C ATOM 697 O ASP E 67 17.242 6.379 10.950 1.00 9.39 O ATOM 698 CB ASP E 67 18.902 5.462 13.219 1.00 10.12 C ATOM 699 CG ASP E 67 19.200 6.721 13.990 1.00 12.11 C ATOM 700 OD1 ASP E 67 20.342 6.799 14.486 1.00 17.33 O ATOM 701 OD2 ASP E 67 18.353 7.628 14.109 1.00 12.83 O ATOM 702 HA ASP E 67 16.904 5.255 13.981 1.00 0.00 H ATOM 703 HB2 ASP E 67 19.327 4.617 13.760 1.00 0.00 H ATOM 704 HB3 ASP E 67 19.373 5.538 12.239 1.00 0.00 H ATOM 705 H ASP E 67 17.982 3.530 11.782 1.00 0.00 H ATOM 706 N GLN E 68 15.865 7.018 12.588 1.00 9.17 N ATOM 707 CA GLN E 68 15.260 8.057 11.772 1.00 8.82 C ATOM 708 C GLN E 68 16.273 9.050 11.251 1.00 9.01 C ATOM 709 O GLN E 68 16.005 9.722 10.281 1.00 9.71 O ATOM 710 CB GLN E 68 14.163 8.776 12.553 1.00 8.94 C ATOM 711 CG GLN E 68 12.926 7.895 12.740 1.00 9.31 C ATOM 712 CD GLN E 68 12.069 8.437 13.821 1.00 11.11 C ATOM 713 OE1 GLN E 68 10.999 9.010 13.570 1.00 13.96 O ATOM 714 NE2 GLN E 68 12.552 8.337 15.019 1.00 9.83 N ATOM 715 HA GLN E 68 14.821 7.565 10.904 1.00 0.00 H ATOM 716 HB2 GLN E 68 14.551 9.052 13.533 1.00 0.00 H ATOM 717 HB3 GLN E 68 13.876 9.677 12.010 1.00 0.00 H ATOM 718 HG2 GLN E 68 12.359 7.869 11.810 1.00 0.00 H ATOM 719 HG3 GLN E 68 13.240 6.884 13.002 1.00 0.00 H ATOM 720 HE22 GLN E 68 13.455 7.845 15.176 1.00 0.00 H ATOM 721 HE21 GLN E 68 12.037 8.748 15.823 1.00 0.00 H ATOM 722 H GLN E 68 15.534 6.871 13.563 1.00 0.00 H ATOM 723 N GLN E 69 17.391 9.198 11.956 1.00 8.82 N ATOM 724 CA GLN E 69 18.463 10.125 11.569 1.00 9.41 C ATOM 725 C GLN E 69 19.527 9.477 10.699 1.00 10.01 C ATOM 726 O GLN E 69 20.381 10.179 10.154 1.00 10.51 O ATOM 727 CB GLN E 69 19.163 10.681 12.821 1.00 9.43 C ATOM 728 CG GLN E 69 18.213 11.475 13.693 1.00 10.42 C ATOM 729 CD GLN E 69 18.862 12.117 14.904 1.00 11.08 C ATOM 730 OE1 GLN E 69 18.636 13.299 15.184 1.00 16.21 O ATOM 731 NE2 GLN E 69 19.624 11.350 15.647 1.00 11.99 N ATOM 732 HA GLN E 69 17.979 10.916 10.996 1.00 0.00 H ATOM 733 HB2 GLN E 69 19.562 9.849 13.401 1.00 0.00 H ATOM 734 HB3 GLN E 69 19.981 11.330 12.509 1.00 0.00 H ATOM 735 HG2 GLN E 69 17.770 12.264 13.085 1.00 0.00 H ATOM 736 HG3 GLN E 69 17.429 10.804 14.042 1.00 0.00 H ATOM 737 HE22 GLN E 69 19.788 10.360 15.375 1.00 0.00 H ATOM 738 HE21 GLN E 69 20.064 11.732 16.508 1.00 0.00 H ATOM 739 H GLN E 69 17.512 8.632 12.820 1.00 0.00 H ATOM 740 N GLU E 70 19.547 8.149 10.629 1.00 9.93 N ATOM 741 CA GLU E 70 20.528 7.420 9.807 1.00 9.17 C ATOM 742 C GLU E 70 19.778 6.214 9.320 1.00 9.38 C ATOM 743 O GLU E 70 19.850 5.133 9.915 1.00 8.65 O ATOM 744 CB GLU E 70 21.727 6.995 10.614 1.00 9.17 C ATOM 745 CG GLU E 70 22.524 8.162 11.203 1.00 8.86 C ATOM 746 CD GLU E 70 23.113 9.109 10.138 1.00 11.05 C ATOM 747 OE1 GLU E 70 23.541 10.239 10.509 1.00 10.85 O ATOM 748 OE2 GLU E 70 23.153 8.727 8.958 1.00 9.07 O ATOM 749 HA GLU E 70 20.916 8.040 8.999 1.00 0.00 H ATOM 750 HB2 GLU E 70 21.383 6.365 11.434 1.00 0.00 H ATOM 751 HB3 GLU E 70 22.389 6.418 9.968 1.00 0.00 H ATOM 752 HG2 GLU E 70 21.863 8.739 11.850 1.00 0.00 H ATOM 753 HG3 GLU E 70 23.344 7.755 11.794 1.00 0.00 H ATOM 754 H GLU E 70 18.846 7.607 11.173 1.00 0.00 H ATOM 755 N GLN E 71 19.007 6.404 8.271 1.00 9.40 N ATOM 756 CA GLN E 71 17.914 5.494 7.987 1.00 10.00 C ATOM 757 C GLN E 71 18.352 4.158 7.401 1.00 10.10 C ATOM 758 O GLN E 71 17.555 3.230 7.326 1.00 11.90 O ATOM 759 CB GLN E 71 16.897 6.173 7.083 1.00 9.69 C ATOM 760 CG GLN E 71 16.273 7.374 7.716 1.00 10.10 C ATOM 761 CD GLN E 71 15.078 7.867 6.955 1.00 10.77 C ATOM 762 OE1 GLN E 71 14.133 7.122 6.727 1.00 11.94 O ATOM 763 NE2 GLN E 71 15.106 9.128 6.547 1.00 12.55 N ATOM 764 HA GLN E 71 17.458 5.253 8.947 1.00 0.00 H ATOM 765 HB2 GLN E 71 17.398 6.483 6.166 1.00 0.00 H ATOM 766 HB3 GLN E 71 16.111 5.457 6.843 1.00 0.00 H ATOM 767 HG2 GLN E 71 15.961 7.114 8.728 1.00 0.00 H ATOM 768 HG3 GLN E 71 17.014 8.172 7.759 1.00 0.00 H ATOM 769 HE22 GLN E 71 15.929 9.726 6.763 1.00 0.00 H ATOM 770 HE21 GLN E 71 14.305 9.519 6.011 1.00 0.00 H ATOM 771 H GLN E 71 19.183 7.213 7.641 1.00 0.00 H ATOM 772 N HIS E 72 19.612 4.039 7.020 1.00 10.15 N ATOM 773 CA HIS E 72 20.144 2.762 6.633 1.00 9.50 C ATOM 774 C HIS E 72 20.703 1.957 7.818 1.00 9.99 C ATOM 775 O HIS E 72 21.163 0.837 7.641 1.00 10.80 O ATOM 776 CB HIS E 72 21.253 2.957 5.597 1.00 9.16 C ATOM 777 CG HIS E 72 22.356 3.860 6.057 1.00 10.24 C ATOM 778 ND1 HIS E 72 23.624 3.424 6.383 1.00 12.78 N ATOM 779 CD2 HIS E 72 22.358 5.195 6.247 1.00 10.82 C ATOM 780 CE1 HIS E 72 24.361 4.468 6.737 1.00 7.31 C ATOM 781 NE2 HIS E 72 23.603 5.549 6.683 1.00 12.16 N ATOM 782 HA HIS E 72 19.315 2.193 6.214 1.00 0.00 H ATOM 783 HB2 HIS E 72 21.681 1.982 5.363 1.00 0.00 H ATOM 784 HB3 HIS E 72 20.812 3.384 4.696 1.00 0.00 H ATOM 785 HD2 HIS E 72 21.518 5.870 6.082 1.00 0.00 H ATOM 786 HE1 HIS E 72 25.412 4.439 7.024 1.00 0.00 H ATOM 787 H HIS E 72 20.225 4.879 7.000 1.00 0.00 H ATOM 788 N MET E 73 20.709 2.541 9.007 1.00 9.87 N ATOM 789 CA MET E 73 21.306 1.885 10.160 1.00 10.11 C ATOM 790 C MET E 73 20.211 1.293 10.993 1.00 10.15 C ATOM 791 O MET E 73 19.223 1.948 11.267 1.00 10.72 O ATOM 792 CB MET E 73 22.115 2.862 11.007 1.00 9.91 C ATOM 793 CG MET E 73 23.331 3.456 10.277 1.00 10.73 C ATOM 794 SD MET E 73 24.490 2.220 9.675 1.00 11.70 S ATOM 795 CE MET E 73 25.100 1.515 11.177 1.00 14.86 C ATOM 796 HA MET E 73 21.986 1.110 9.805 1.00 0.00 H ATOM 797 HB2 MET E 73 21.461 3.680 11.308 1.00 0.00 H ATOM 798 HB3 MET E 73 22.469 2.337 11.894 1.00 0.00 H ATOM 799 HG2 MET E 73 23.858 4.115 10.967 1.00 0.00 H ATOM 800 HG3 MET E 73 22.972 4.035 9.426 1.00 0.00 H ATOM 801 HE1 MET E 73 25.578 2.292 11.774 1.00 0.00 H ATOM 802 HE2 MET E 73 24.271 1.083 11.737 1.00 0.00 H ATOM 803 HE3 MET E 73 25.826 0.736 10.943 1.00 0.00 H ATOM 804 H MET E 73 20.281 3.482 9.118 1.00 0.00 H ATOM 805 N VAL E 74 20.443 0.077 11.457 1.00 9.70 N ATOM 806 CA VAL E 74 19.461 -0.656 12.218 1.00 9.83 C ATOM 807 C VAL E 74 20.130 -1.054 13.525 1.00 10.36 C ATOM 808 O VAL E 74 21.170 -1.675 13.526 1.00 11.03 O ATOM 809 CB VAL E 74 19.003 -1.915 11.475 1.00 9.54 C ATOM 810 CG1 VAL E 74 18.015 -2.691 12.350 1.00 10.61 C ATOM 811 CG2 VAL E 74 18.389 -1.553 10.160 1.00 9.84 C ATOM 812 HA VAL E 74 18.578 -0.038 12.383 1.00 0.00 H ATOM 813 HB VAL E 74 19.866 -2.550 11.273 1.00 0.00 H ATOM 814 HG11 VAL E 74 18.503 -2.975 13.282 1.00 0.00 H ATOM 815 HG12 VAL E 74 17.152 -2.062 12.567 1.00 0.00 H ATOM 816 HG13 VAL E 74 17.689 -3.587 11.821 1.00 0.00 H ATOM 817 HG21 VAL E 74 17.527 -0.907 10.328 1.00 0.00 H ATOM 818 HG22 VAL E 74 19.124 -1.028 9.549 1.00 0.00 H ATOM 819 HG23 VAL E 74 18.070 -2.460 9.647 1.00 0.00 H ATOM 820 H VAL E 74 21.365 -0.366 11.267 1.00 0.00 H ATOM 821 N TYR E 75 19.530 -0.675 14.641 1.00 11.69 N ATOM 822 CA TYR E 75 20.067 -1.027 15.942 1.00 12.96 C ATOM 823 C TYR E 75 19.157 -2.132 16.469 1.00 13.20 C ATOM 824 O TYR E 75 17.992 -1.900 16.741 1.00 14.10 O ATOM 825 CB TYR E 75 20.083 0.207 16.877 1.00 14.07 C ATOM 826 CG TYR E 75 20.671 1.497 16.259 1.00 20.12 C ATOM 827 CD1 TYR E 75 20.085 2.751 16.497 1.00 23.02 C ATOM 828 CD2 TYR E 75 21.796 1.459 15.449 1.00 25.71 C ATOM 829 CE1 TYR E 75 20.613 3.910 15.943 1.00 27.56 C ATOM 830 CE2 TYR E 75 22.329 2.616 14.889 1.00 26.53 C ATOM 831 CZ TYR E 75 21.736 3.838 15.135 1.00 26.64 C ATOM 832 OH TYR E 75 22.254 5.004 14.570 1.00 24.70 O ATOM 833 HA TYR E 75 21.101 -1.368 15.885 1.00 0.00 H ATOM 834 HB3 TYR E 75 20.674 -0.045 17.757 1.00 0.00 H ATOM 835 HB2 TYR E 75 19.056 0.415 17.178 1.00 0.00 H ATOM 836 HD2 TYR E 75 22.274 0.501 15.246 1.00 0.00 H ATOM 837 HE2 TYR E 75 23.215 2.557 14.256 1.00 0.00 H ATOM 838 HE1 TYR E 75 20.145 4.874 16.143 1.00 0.00 H ATOM 839 HD1 TYR E 75 19.199 2.816 17.129 1.00 0.00 H ATOM 840 HH TYR E 75 21.706 5.778 14.853 1.00 0.00 H ATOM 841 H TYR E 75 18.656 -0.114 14.585 1.00 0.00 H ATOM 842 N CYS E 76 19.694 -3.337 16.588 1.00 13.58 N ATOM 843 CA CYS E 76 18.860 -4.504 16.831 1.00 13.56 C ATOM 844 C CYS E 76 19.345 -5.366 17.981 1.00 12.81 C ATOM 845 O CYS E 76 18.847 -6.454 18.171 1.00 11.02 O ATOM 846 CB CYS E 76 18.802 -5.342 15.566 1.00 14.11 C ATOM 847 SG CYS E 76 20.401 -5.760 14.811 1.00 15.69 S ATOM 848 HA CYS E 76 17.873 -4.137 17.110 1.00 0.00 H ATOM 849 HB2 CYS E 76 18.218 -4.792 14.828 1.00 0.00 H ATOM 850 HB3 CYS E 76 18.293 -6.275 15.807 1.00 0.00 H ATOM 851 HG CYS E 76 21.160 -6.479 15.712 1.00 0.00 H ATOM 852 H CYS E 76 20.725 -3.450 16.507 1.00 0.00 H ATOM 853 N GLY E 77 20.260 -4.845 18.774 1.00 12.76 N ATOM 854 CA GLY E 77 20.837 -5.591 19.877 1.00 12.79 C ATOM 855 C GLY E 77 19.858 -5.976 20.965 1.00 13.01 C ATOM 856 O GLY E 77 20.113 -6.924 21.714 1.00 15.09 O ATOM 857 HA3 GLY E 77 21.621 -4.981 20.326 1.00 0.00 H ATOM 858 HA2 GLY E 77 21.275 -6.505 19.476 1.00 0.00 H ATOM 859 H GLY E 77 20.578 -3.870 18.604 1.00 0.00 H ATOM 860 N GLY E 78 18.746 -5.260 21.056 1.00 12.56 N ATOM 861 CA GLY E 78 17.746 -5.540 22.081 1.00 12.63 C ATOM 862 C GLY E 78 16.545 -6.270 21.498 1.00 12.11 C ATOM 863 O GLY E 78 15.524 -6.427 22.161 1.00 12.55 O ATOM 864 HA3 GLY E 78 17.412 -4.599 22.518 1.00 0.00 H ATOM 865 HA2 GLY E 78 18.196 -6.160 22.857 1.00 0.00 H ATOM 866 H GLY E 78 18.583 -4.483 20.384 1.00 0.00 H ATOM 867 N ASP E 79 16.689 -6.766 20.275 1.00 10.75 N ATOM 868 CA ASP E 79 15.594 -7.353 19.526 1.00 10.86 C ATOM 869 C ASP E 79 15.951 -8.755 19.080 1.00 11.05 C ATOM 870 O ASP E 79 17.125 -9.117 18.969 1.00 11.17 O ATOM 871 CB ASP E 79 15.300 -6.477 18.307 1.00 11.33 C ATOM 872 CG ASP E 79 13.992 -6.838 17.619 1.00 11.02 C ATOM 873 OD1 ASP E 79 12.956 -6.201 17.927 1.00 12.03 O ATOM 874 OD2 ASP E 79 13.968 -7.762 16.787 1.00 10.84 O ATOM 875 HA ASP E 79 14.711 -7.410 20.162 1.00 0.00 H ATOM 876 HB2 ASP E 79 15.248 -5.437 18.630 1.00 0.00 H ATOM 877 HB3 ASP E 79 16.113 -6.593 17.591 1.00 0.00 H ATOM 878 H ASP E 79 17.630 -6.732 19.834 1.00 0.00 H ATOM 879 N LEU E 80 14.928 -9.574 18.851 1.00 11.12 N ATOM 880 CA LEU E 80 15.145 -10.911 18.364 1.00 11.63 C ATOM 881 C LEU E 80 15.927 -10.870 17.055 1.00 11.43 C ATOM 882 O LEU E 80 16.696 -11.779 16.768 1.00 11.03 O ATOM 883 CB LEU E 80 13.805 -11.661 18.244 1.00 11.63 C ATOM 884 CG LEU E 80 13.855 -13.097 17.726 1.00 12.46 C ATOM 885 CD1 LEU E 80 14.649 -13.981 18.661 1.00 13.70 C ATOM 886 CD2 LEU E 80 12.430 -13.583 17.593 1.00 13.03 C ATOM 887 HA LEU E 80 15.751 -11.470 19.077 1.00 0.00 H ATOM 888 HB2 LEU E 80 13.352 -11.685 19.235 1.00 0.00 H ATOM 889 HB3 LEU E 80 13.168 -11.090 17.568 1.00 0.00 H ATOM 890 HG LEU E 80 14.356 -13.135 16.759 1.00 0.00 H ATOM 891 HD21 LEU E 80 11.942 -13.546 18.567 1.00 0.00 H ATOM 892 HD22 LEU E 80 11.893 -12.944 16.892 1.00 0.00 H ATOM 893 HD23 LEU E 80 12.430 -14.609 17.224 1.00 0.00 H ATOM 894 HD11 LEU E 80 15.668 -13.601 18.741 1.00 0.00 H ATOM 895 HD12 LEU E 80 14.181 -13.979 19.645 1.00 0.00 H ATOM 896 HD13 LEU E 80 14.669 -14.998 18.269 1.00 0.00 H ATOM 897 H LEU E 80 13.958 -9.244 19.026 1.00 0.00 H ATOM 898 N LEU E 81 15.747 -9.827 16.255 1.00 10.97 N ATOM 899 CA LEU E 81 16.483 -9.753 14.992 1.00 11.66 C ATOM 900 C LEU E 81 17.996 -9.722 15.251 1.00 12.20 C ATOM 901 O LEU E 81 18.751 -10.388 14.554 1.00 12.89 O ATOM 902 CB LEU E 81 16.005 -8.592 14.151 1.00 11.70 C ATOM 903 CG LEU E 81 16.812 -8.332 12.888 1.00 11.58 C ATOM 904 CD1 LEU E 81 16.679 -9.525 12.005 1.00 13.30 C ATOM 905 CD2 LEU E 81 16.308 -7.070 12.211 1.00 13.37 C ATOM 906 HA LEU E 81 16.280 -10.653 14.412 1.00 0.00 H ATOM 907 HB2 LEU E 81 14.974 -8.789 13.858 1.00 0.00 H ATOM 908 HB3 LEU E 81 16.041 -7.693 14.766 1.00 0.00 H ATOM 909 HG LEU E 81 17.866 -8.177 13.119 1.00 0.00 H ATOM 910 HD21 LEU E 81 15.257 -7.194 11.950 1.00 0.00 H ATOM 911 HD22 LEU E 81 16.418 -6.226 12.891 1.00 0.00 H ATOM 912 HD23 LEU E 81 16.889 -6.888 11.307 1.00 0.00 H ATOM 913 HD11 LEU E 81 17.062 -10.404 12.524 1.00 0.00 H ATOM 914 HD12 LEU E 81 15.628 -9.677 11.757 1.00 0.00 H ATOM 915 HD13 LEU E 81 17.250 -9.364 11.090 1.00 0.00 H ATOM 916 H LEU E 81 15.088 -9.068 16.523 1.00 0.00 H ATOM 917 N GLY E 82 18.442 -8.992 16.267 1.00 12.43 N ATOM 918 CA GLY E 82 19.846 -9.015 16.649 1.00 12.25 C ATOM 919 C GLY E 82 20.340 -10.377 17.067 1.00 12.89 C ATOM 920 O GLY E 82 21.424 -10.791 16.683 1.00 13.15 O ATOM 921 HA3 GLY E 82 19.987 -8.327 17.483 1.00 0.00 H ATOM 922 HA2 GLY E 82 20.440 -8.680 15.798 1.00 0.00 H ATOM 923 H GLY E 82 17.777 -8.394 16.798 1.00 0.00 H ATOM 924 N GLU E 83 19.537 -11.118 17.816 1.00 13.79 N ATOM 925 CA GLU E 83 19.958 -12.446 18.214 1.00 14.58 C ATOM 926 C GLU E 83 20.184 -13.307 16.996 1.00 14.34 C ATOM 927 O GLU E 83 21.147 -14.069 16.931 1.00 15.13 O ATOM 928 CB GLU E 83 18.910 -13.078 19.127 1.00 15.40 C ATOM 929 CG GLU E 83 18.757 -12.255 20.361 1.00 18.58 C ATOM 930 CD GLU E 83 17.634 -12.702 21.261 1.00 22.47 C ATOM 931 OE1 GLU E 83 17.541 -13.927 21.508 1.00 25.66 O ATOM 932 OE2 GLU E 83 16.871 -11.818 21.727 1.00 23.86 O ATOM 933 HA GLU E 83 20.896 -12.369 18.763 1.00 0.00 H ATOM 934 HB2 GLU E 83 17.955 -13.128 18.603 1.00 0.00 H ATOM 935 HB3 GLU E 83 19.226 -14.085 19.399 1.00 0.00 H ATOM 936 HG2 GLU E 83 19.689 -12.305 20.924 1.00 0.00 H ATOM 937 HG3 GLU E 83 18.569 -11.223 20.064 1.00 0.00 H ATOM 938 H GLU E 83 18.612 -10.749 18.116 1.00 0.00 H ATOM 939 N LEU E 84 19.293 -13.209 16.019 1.00 13.94 N ATOM 940 CA LEU E 84 19.444 -14.033 14.833 1.00 15.13 C ATOM 941 C LEU E 84 20.665 -13.639 14.020 1.00 15.01 C ATOM 942 O LEU E 84 21.336 -14.505 13.460 1.00 15.92 O ATOM 943 CB LEU E 84 18.210 -13.973 13.944 1.00 15.45 C ATOM 944 CG LEU E 84 16.942 -14.515 14.560 1.00 16.97 C ATOM 945 CD1 LEU E 84 15.884 -14.610 13.470 1.00 17.96 C ATOM 946 CD2 LEU E 84 17.235 -15.859 15.222 1.00 19.22 C ATOM 947 HA LEU E 84 19.575 -15.055 15.190 1.00 0.00 H ATOM 948 HB2 LEU E 84 18.036 -12.930 13.679 1.00 0.00 H ATOM 949 HB3 LEU E 84 18.417 -14.547 13.041 1.00 0.00 H ATOM 950 HG LEU E 84 16.562 -13.855 15.340 1.00 0.00 H ATOM 951 HD21 LEU E 84 17.605 -16.559 14.473 1.00 0.00 H ATOM 952 HD22 LEU E 84 17.989 -15.724 15.998 1.00 0.00 H ATOM 953 HD23 LEU E 84 16.320 -16.251 15.667 1.00 0.00 H ATOM 954 HD11 LEU E 84 15.704 -13.619 13.053 1.00 0.00 H ATOM 955 HD12 LEU E 84 16.234 -15.279 12.683 1.00 0.00 H ATOM 956 HD13 LEU E 84 14.959 -15.000 13.896 1.00 0.00 H ATOM 957 H LEU E 84 18.494 -12.548 16.101 1.00 0.00 H ATOM 958 N LEU E 85 20.946 -12.344 13.939 1.00 14.41 N ATOM 959 CA LEU E 85 22.098 -11.859 13.178 1.00 14.50 C ATOM 960 C LEU E 85 23.377 -12.086 13.951 1.00 14.61 C ATOM 961 O LEU E 85 24.469 -12.120 13.387 1.00 14.70 O ATOM 962 CB LEU E 85 21.965 -10.368 12.903 1.00 14.07 C ATOM 963 CG LEU E 85 20.878 -9.924 11.932 1.00 15.14 C ATOM 964 CD1 LEU E 85 20.837 -8.446 11.870 1.00 16.58 C ATOM 965 CD2 LEU E 85 21.127 -10.521 10.559 1.00 16.15 C ATOM 966 HA LEU E 85 22.129 -12.409 12.238 1.00 0.00 H ATOM 967 HB2 LEU E 85 21.772 -9.876 13.856 1.00 0.00 H ATOM 968 HB3 LEU E 85 22.919 -10.023 12.505 1.00 0.00 H ATOM 969 HG LEU E 85 19.910 -10.282 12.284 1.00 0.00 H ATOM 970 HD21 LEU E 85 22.096 -10.186 10.189 1.00 0.00 H ATOM 971 HD22 LEU E 85 21.120 -11.609 10.630 1.00 0.00 H ATOM 972 HD23 LEU E 85 20.343 -10.196 9.875 1.00 0.00 H ATOM 973 HD11 LEU E 85 20.621 -8.048 12.861 1.00 0.00 H ATOM 974 HD12 LEU E 85 21.802 -8.071 11.529 1.00 0.00 H ATOM 975 HD13 LEU E 85 20.058 -8.134 11.174 1.00 0.00 H ATOM 976 H LEU E 85 20.334 -11.659 14.427 1.00 0.00 H ATOM 977 N GLY E 86 23.252 -12.206 15.260 1.00 15.28 N ATOM 978 CA GLY E 86 24.416 -12.265 16.123 1.00 15.53 C ATOM 979 C GLY E 86 25.159 -10.944 16.210 1.00 16.33 C ATOM 980 O GLY E 86 26.347 -10.919 16.519 1.00 16.55 O ATOM 981 HA3 GLY E 86 25.098 -13.022 15.736 1.00 0.00 H ATOM 982 HA2 GLY E 86 24.092 -12.548 17.125 1.00 0.00 H ATOM 983 H GLY E 86 22.302 -12.259 15.680 1.00 0.00 H ATOM 984 N ARG E 87 24.461 -9.841 15.973 1.00 16.42 N ATOM 985 CA ARG E 87 25.101 -8.531 15.844 1.00 17.47 C ATOM 986 C ARG E 87 24.200 -7.507 16.548 1.00 16.07 C ATOM 987 O ARG E 87 22.985 -7.708 16.635 1.00 15.93 O ATOM 988 CB ARG E 87 25.240 -8.198 14.337 1.00 19.30 C ATOM 989 CG ARG E 87 26.643 -8.052 13.660 1.00 25.57 C ATOM 990 CD ARG E 87 27.769 -9.060 13.950 1.00 32.57 C ATOM 991 NE ARG E 87 28.645 -8.660 12.836 1.00 38.20 N ATOM 992 HA ARG E 87 26.093 -8.517 16.296 1.00 0.00 H ATOM 993 HB2 ARG E 87 24.718 -8.988 13.797 1.00 0.00 H ATOM 994 HB3 ARG E 87 24.723 -7.251 14.182 1.00 0.00 H ATOM 995 HG2 ARG E 87 26.473 -8.078 12.584 1.00 0.00 H ATOM 996 HG3 ARG E 87 27.024 -7.071 13.943 1.00 0.00 H ATOM 997 HD2 ARG E 87 27.436 -10.095 13.870 1.00 0.00 H ATOM 998 HD3 ARG E 87 28.232 -8.903 14.924 1.00 0.00 H ATOM 999 HE ARG E 87 28.353 -7.897 12.193 1.00 0.00 H ATOM 1000 H ARG E 87 23.428 -9.909 15.876 1.00 0.00 H ATOM 1001 N GLN E 88 24.762 -6.407 17.028 1.00 15.00 N ATOM 1002 CA GLN E 88 23.972 -5.410 17.743 1.00 14.73 C ATOM 1003 C GLN E 88 23.408 -4.340 16.811 1.00 14.16 C ATOM 1004 O GLN E 88 22.486 -3.610 17.164 1.00 13.25 O ATOM 1005 CB GLN E 88 24.793 -4.771 18.851 1.00 15.83 C ATOM 1006 CG GLN E 88 25.944 -3.897 18.407 1.00 18.99 C ATOM 1007 CD GLN E 88 26.667 -3.304 19.589 1.00 22.05 C ATOM 1008 OE1 GLN E 88 26.102 -3.190 20.677 1.00 25.10 O ATOM 1009 NE2 GLN E 88 27.915 -2.924 19.389 1.00 24.60 N ATOM 1010 HA GLN E 88 23.123 -5.932 18.185 1.00 0.00 H ATOM 1011 HB2 GLN E 88 24.122 -4.158 19.452 1.00 0.00 H ATOM 1012 HB3 GLN E 88 25.201 -5.572 19.467 1.00 0.00 H ATOM 1013 HG2 GLN E 88 26.644 -4.498 17.827 1.00 0.00 H ATOM 1014 HG3 GLN E 88 25.558 -3.090 17.785 1.00 0.00 H ATOM 1015 HE22 GLN E 88 28.350 -3.040 18.452 1.00 0.00 H ATOM 1016 HE21 GLN E 88 28.463 -2.508 20.169 1.00 0.00 H ATOM 1017 H GLN E 88 25.781 -6.252 16.893 1.00 0.00 H ATOM 1018 N SER E 89 23.991 -4.232 15.629 1.00 14.35 N ATOM 1019 CA SER E 89 23.559 -3.258 14.650 1.00 14.94 C ATOM 1020 C SER E 89 24.039 -3.738 13.320 1.00 14.00 C ATOM 1021 O SER E 89 24.899 -4.602 13.248 1.00 14.79 O ATOM 1022 CB SER E 89 24.187 -1.899 14.912 1.00 15.01 C ATOM 1023 OG SER E 89 25.595 -1.982 14.839 1.00 18.20 O ATOM 1024 HA SER E 89 22.475 -3.153 14.694 1.00 0.00 H ATOM 1025 HB2 SER E 89 23.899 -1.556 15.906 1.00 0.00 H ATOM 1026 HB3 SER E 89 23.830 -1.189 14.166 1.00 0.00 H ATOM 1027 HG SER E 89 25.860 -2.291 13.936 1.00 0.00 H ATOM 1028 H SER E 89 24.783 -4.865 15.396 1.00 0.00 H ATOM 1029 N PHE E 90 23.467 -3.203 12.256 1.00 13.29 N ATOM 1030 CA PHE E 90 24.009 -3.437 10.941 1.00 13.06 C ATOM 1031 C PHE E 90 23.586 -2.294 10.042 1.00 11.69 C ATOM 1032 O PHE E 90 22.716 -1.493 10.398 1.00 11.70 O ATOM 1033 CB PHE E 90 23.599 -4.795 10.386 1.00 13.35 C ATOM 1034 CG PHE E 90 22.158 -4.903 10.008 1.00 13.56 C ATOM 1035 CD1 PHE E 90 21.777 -4.724 8.705 1.00 15.88 C ATOM 1036 CD2 PHE E 90 21.191 -5.237 10.937 1.00 13.19 C ATOM 1037 CE1 PHE E 90 20.461 -4.833 8.339 1.00 16.78 C ATOM 1038 CE2 PHE E 90 19.866 -5.336 10.559 1.00 14.17 C ATOM 1039 CZ PHE E 90 19.507 -5.131 9.270 1.00 15.59 C ATOM 1040 HA PHE E 90 25.097 -3.467 10.995 1.00 0.00 H ATOM 1041 HB2 PHE E 90 24.199 -4.995 9.499 1.00 0.00 H ATOM 1042 HB3 PHE E 90 23.810 -5.550 11.144 1.00 0.00 H ATOM 1043 HD2 PHE E 90 21.475 -5.423 11.973 1.00 0.00 H ATOM 1044 HE2 PHE E 90 19.106 -5.580 11.302 1.00 0.00 H ATOM 1045 HZ PHE E 90 18.460 -5.204 8.976 1.00 0.00 H ATOM 1046 HE1 PHE E 90 20.174 -4.681 7.299 1.00 0.00 H ATOM 1047 HD1 PHE E 90 22.529 -4.492 7.951 1.00 0.00 H ATOM 1048 H PHE E 90 22.620 -2.609 12.368 1.00 0.00 H ATOM 1049 N SER E 91 24.268 -2.190 8.911 1.00 11.28 N ATOM 1050 CA SER E 91 24.003 -1.175 7.912 1.00 11.00 C ATOM 1051 C SER E 91 23.379 -1.816 6.715 1.00 11.06 C ATOM 1052 O SER E 91 23.930 -2.747 6.139 1.00 10.63 O ATOM 1053 CB SER E 91 25.308 -0.534 7.457 1.00 10.57 C ATOM 1054 OG SER E 91 25.079 0.319 6.362 1.00 10.09 O ATOM 1055 HA SER E 91 23.344 -0.424 8.347 1.00 0.00 H ATOM 1056 HB2 SER E 91 26.009 -1.315 7.164 1.00 0.00 H ATOM 1057 HB3 SER E 91 25.731 0.042 8.280 1.00 0.00 H ATOM 1058 HG SER E 91 25.935 0.727 6.078 1.00 0.00 H ATOM 1059 H SER E 91 25.033 -2.872 8.731 1.00 0.00 H ATOM 1060 N VAL E 92 22.250 -1.293 6.289 1.00 10.68 N ATOM 1061 CA VAL E 92 21.598 -1.819 5.111 1.00 11.71 C ATOM 1062 C VAL E 92 22.442 -1.546 3.851 1.00 11.98 C ATOM 1063 O VAL E 92 22.295 -2.217 2.843 1.00 12.58 O ATOM 1064 CB VAL E 92 20.180 -1.249 5.014 1.00 12.31 C ATOM 1065 CG1 VAL E 92 19.500 -1.741 3.764 1.00 14.11 C ATOM 1066 CG2 VAL E 92 19.381 -1.650 6.263 1.00 12.14 C ATOM 1067 HA VAL E 92 21.512 -2.903 5.189 1.00 0.00 H ATOM 1068 HB VAL E 92 20.232 -0.162 4.962 1.00 0.00 H ATOM 1069 HG11 VAL E 92 20.071 -1.423 2.892 1.00 0.00 H ATOM 1070 HG12 VAL E 92 19.445 -2.829 3.786 1.00 0.00 H ATOM 1071 HG13 VAL E 92 18.494 -1.326 3.712 1.00 0.00 H ATOM 1072 HG21 VAL E 92 19.333 -2.737 6.328 1.00 0.00 H ATOM 1073 HG22 VAL E 92 19.873 -1.253 7.151 1.00 0.00 H ATOM 1074 HG23 VAL E 92 18.372 -1.244 6.193 1.00 0.00 H ATOM 1075 H VAL E 92 21.824 -0.496 6.803 1.00 0.00 H ATOM 1076 N LYS E 93 23.328 -0.564 3.935 1.00 12.25 N ATOM 1077 CA LYS E 93 24.274 -0.277 2.874 1.00 13.05 C ATOM 1078 C LYS E 93 25.392 -1.309 2.725 1.00 13.70 C ATOM 1079 O LYS E 93 26.046 -1.376 1.678 1.00 14.69 O ATOM 1080 CB LYS E 93 24.860 1.101 3.099 1.00 13.66 C ATOM 1081 CG LYS E 93 23.905 2.219 2.728 1.00 16.32 C ATOM 1082 CD LYS E 93 24.642 3.541 2.734 1.00 19.79 C ATOM 1083 CE LYS E 93 23.714 4.697 2.643 1.00 22.43 C ATOM 1084 NZ LYS E 93 23.013 4.677 1.350 1.00 23.88 N ATOM 1085 HA LYS E 93 23.717 -0.321 1.938 1.00 0.00 H ATOM 1086 HB2 LYS E 93 25.119 1.201 4.153 1.00 0.00 H ATOM 1087 HB3 LYS E 93 25.761 1.199 2.494 1.00 0.00 H ATOM 1088 HG2 LYS E 93 23.499 2.034 1.733 1.00 0.00 H ATOM 1089 HG3 LYS E 93 23.090 2.255 3.451 1.00 0.00 H ATOM 1090 HD2 LYS E 93 25.214 3.621 3.658 1.00 0.00 H ATOM 1091 HD3 LYS E 93 25.323 3.568 1.883 1.00 0.00 H ATOM 1092 HE2 LYS E 93 24.281 5.624 2.733 1.00 0.00 H ATOM 1093 HE3 LYS E 93 22.984 4.639 3.451 1.00 0.00 H ATOM 1094 HZ1 LYS E 93 23.709 4.734 0.579 1.00 0.00 H ATOM 1095 HZ2 LYS E 93 22.471 3.794 1.265 1.00 0.00 H ATOM 1096 HZ3 LYS E 93 22.366 5.489 1.295 1.00 0.00 H ATOM 1097 H LYS E 93 23.345 0.023 4.794 1.00 0.00 H ATOM 1098 N ASP E 94 25.615 -2.115 3.754 1.00 13.43 N ATOM 1099 CA ASP E 94 26.583 -3.204 3.678 1.00 14.48 C ATOM 1100 C ASP E 94 26.121 -4.321 4.611 1.00 13.95 C ATOM 1101 O ASP E 94 26.649 -4.503 5.709 1.00 14.14 O ATOM 1102 CB ASP E 94 27.975 -2.706 4.029 1.00 15.06 C ATOM 1103 CG ASP E 94 29.047 -3.703 3.656 1.00 18.00 C ATOM 1104 OD1 ASP E 94 28.683 -4.849 3.343 1.00 19.70 O ATOM 1105 OD2 ASP E 94 30.240 -3.328 3.668 1.00 25.31 O ATOM 1106 HA ASP E 94 26.640 -3.594 2.662 1.00 0.00 H ATOM 1107 HB2 ASP E 94 28.160 -1.774 3.495 1.00 0.00 H ATOM 1108 HB3 ASP E 94 28.023 -2.523 5.103 1.00 0.00 H ATOM 1109 H ASP E 94 25.087 -1.967 4.637 1.00 0.00 H ATOM 1110 N PRO E 95 25.098 -5.042 4.180 1.00 13.77 N ATOM 1111 CA PRO E 95 24.316 -5.888 5.069 1.00 13.92 C ATOM 1112 C PRO E 95 24.845 -7.312 5.231 1.00 14.55 C ATOM 1113 O PRO E 95 24.070 -8.233 5.407 1.00 13.50 O ATOM 1114 CB PRO E 95 22.956 -5.901 4.384 1.00 14.19 C ATOM 1115 CG PRO E 95 23.308 -5.835 2.963 1.00 13.16 C ATOM 1116 CD PRO E 95 24.455 -4.916 2.861 1.00 13.46 C ATOM 1117 HA PRO E 95 24.326 -5.504 6.089 1.00 0.00 H ATOM 1118 HD3 PRO E 95 25.133 -5.221 2.064 1.00 0.00 H ATOM 1119 HD2 PRO E 95 24.123 -3.893 2.682 1.00 0.00 H ATOM 1120 HG3 PRO E 95 22.467 -5.455 2.383 1.00 0.00 H ATOM 1121 HG2 PRO E 95 23.583 -6.824 2.596 1.00 0.00 H ATOM 1122 HB2 PRO E 95 22.410 -6.817 4.612 1.00 0.00 H ATOM 1123 HB3 PRO E 95 22.358 -5.040 4.681 1.00 0.00 H ATOM 1124 N SER E 96 26.157 -7.469 5.207 1.00 15.65 N ATOM 1125 CA SER E 96 26.803 -8.793 5.320 1.00 16.25 C ATOM 1126 C SER E 96 26.229 -9.826 6.308 1.00 16.30 C ATOM 1127 O SER E 96 26.100 -10.995 5.954 1.00 15.84 O ATOM 1128 CB SER E 96 28.286 -8.594 5.629 1.00 16.44 C ATOM 1129 OG SER E 96 28.921 -7.937 4.543 1.00 19.45 O ATOM 1130 HA SER E 96 26.599 -9.243 4.349 1.00 0.00 H ATOM 1131 HB2 SER E 96 28.756 -9.564 5.789 1.00 0.00 H ATOM 1132 HB3 SER E 96 28.390 -7.988 6.529 1.00 0.00 H ATOM 1133 HG SER E 96 29.881 -7.812 4.750 1.00 0.00 H ATOM 1134 H SER E 96 26.759 -6.627 5.104 1.00 0.00 H ATOM 1135 N PRO E 97 25.924 -9.424 7.552 1.00 16.30 N ATOM 1136 CA PRO E 97 25.472 -10.436 8.516 1.00 16.71 C ATOM 1137 C PRO E 97 24.150 -11.068 8.144 1.00 16.58 C ATOM 1138 O PRO E 97 23.821 -12.138 8.613 1.00 16.34 O ATOM 1139 CB PRO E 97 25.321 -9.660 9.819 1.00 17.05 C ATOM 1140 CG PRO E 97 25.780 -8.305 9.567 1.00 17.36 C ATOM 1141 CD PRO E 97 26.027 -8.083 8.140 1.00 16.58 C ATOM 1142 HA PRO E 97 26.179 -11.264 8.566 1.00 0.00 H ATOM 1143 HD3 PRO E 97 25.278 -7.414 7.716 1.00 0.00 H ATOM 1144 HD2 PRO E 97 27.020 -7.663 7.978 1.00 0.00 H ATOM 1145 HG3 PRO E 97 26.705 -8.135 10.118 1.00 0.00 H ATOM 1146 HG2 PRO E 97 25.020 -7.603 9.909 1.00 0.00 H ATOM 1147 HB2 PRO E 97 24.276 -9.649 10.129 1.00 0.00 H ATOM 1148 HB3 PRO E 97 25.926 -10.120 10.600 1.00 0.00 H ATOM 1149 N LEU E 98 23.380 -10.420 7.293 1.00 16.34 N ATOM 1150 CA LEU E 98 22.097 -10.975 6.957 1.00 17.32 C ATOM 1151 C LEU E 98 22.219 -12.333 6.290 1.00 15.97 C ATOM 1152 O LEU E 98 21.352 -13.187 6.464 1.00 15.70 O ATOM 1153 CB LEU E 98 21.355 -10.064 5.996 1.00 18.35 C ATOM 1154 CG LEU E 98 20.117 -9.302 6.422 1.00 22.70 C ATOM 1155 CD1 LEU E 98 20.256 -8.686 7.805 1.00 25.23 C ATOM 1156 CD2 LEU E 98 19.865 -8.256 5.368 1.00 23.42 C ATOM 1157 HA LEU E 98 21.555 -11.078 7.897 1.00 0.00 H ATOM 1158 HB2 LEU E 98 22.076 -9.318 5.662 1.00 0.00 H ATOM 1159 HB3 LEU E 98 21.058 -10.685 5.151 1.00 0.00 H ATOM 1160 HG LEU E 98 19.270 -9.983 6.503 1.00 0.00 H ATOM 1161 HD21 LEU E 98 20.726 -7.591 5.305 1.00 0.00 H ATOM 1162 HD22 LEU E 98 19.708 -8.743 4.405 1.00 0.00 H ATOM 1163 HD23 LEU E 98 18.979 -7.680 5.634 1.00 0.00 H ATOM 1164 HD11 LEU E 98 20.432 -9.475 8.537 1.00 0.00 H ATOM 1165 HD12 LEU E 98 21.095 -7.991 7.809 1.00 0.00 H ATOM 1166 HD13 LEU E 98 19.340 -8.153 8.058 1.00 0.00 H ATOM 1167 H LEU E 98 23.695 -9.523 6.872 1.00 0.00 H ATOM 1168 N TYR E 99 23.253 -12.527 5.479 1.00 14.74 N ATOM 1169 CA TYR E 99 23.255 -13.645 4.561 1.00 14.77 C ATOM 1170 C TYR E 99 23.320 -14.949 5.314 1.00 15.13 C ATOM 1171 O TYR E 99 22.521 -15.854 5.069 1.00 15.27 O ATOM 1172 CB TYR E 99 24.403 -13.516 3.559 1.00 14.45 C ATOM 1173 CG TYR E 99 24.396 -12.190 2.834 1.00 14.31 C ATOM 1174 CD1 TYR E 99 25.548 -11.454 2.716 1.00 15.18 C ATOM 1175 CD2 TYR E 99 23.227 -11.664 2.313 1.00 14.46 C ATOM 1176 CE1 TYR E 99 25.552 -10.251 2.073 1.00 15.67 C ATOM 1177 CE2 TYR E 99 23.216 -10.461 1.666 1.00 13.80 C ATOM 1178 CZ TYR E 99 24.381 -9.751 1.555 1.00 14.59 C ATOM 1179 OH TYR E 99 24.386 -8.537 0.920 1.00 15.10 O ATOM 1180 HA TYR E 99 22.322 -13.636 3.997 1.00 0.00 H ATOM 1181 HB3 TYR E 99 24.317 -14.316 2.824 1.00 0.00 H ATOM 1182 HB2 TYR E 99 25.347 -13.616 4.095 1.00 0.00 H ATOM 1183 HD2 TYR E 99 22.296 -12.221 2.421 1.00 0.00 H ATOM 1184 HE2 TYR E 99 22.290 -10.071 1.243 1.00 0.00 H ATOM 1185 HE1 TYR E 99 26.480 -9.688 1.970 1.00 0.00 H ATOM 1186 HD1 TYR E 99 26.475 -11.837 3.143 1.00 0.00 H ATOM 1187 HH TYR E 99 25.303 -8.164 0.930 1.00 0.00 H ATOM 1188 H TYR E 99 24.062 -11.874 5.504 1.00 0.00 H ATOM 1189 N ASP E 100 24.235 -15.040 6.266 1.00 16.26 N ATOM 1190 CA ASP E 100 24.308 -16.264 7.049 1.00 17.92 C ATOM 1191 C ASP E 100 23.096 -16.491 7.917 1.00 17.42 C ATOM 1192 O ASP E 100 22.710 -17.645 8.155 1.00 17.64 O ATOM 1193 CB ASP E 100 25.578 -16.334 7.870 1.00 19.32 C ATOM 1194 CG ASP E 100 26.510 -17.383 7.348 1.00 25.16 C ATOM 1195 OD1 ASP E 100 27.102 -17.161 6.263 1.00 29.81 O ATOM 1196 OD2 ASP E 100 26.611 -18.445 8.001 1.00 29.82 O ATOM 1197 HA ASP E 100 24.327 -17.074 6.320 1.00 0.00 H ATOM 1198 HB2 ASP E 100 26.078 -15.366 7.834 1.00 0.00 H ATOM 1199 HB3 ASP E 100 25.320 -16.570 8.902 1.00 0.00 H ATOM 1200 H ASP E 100 24.889 -14.252 6.451 1.00 0.00 H ATOM 1201 N MET E 101 22.484 -15.409 8.385 1.00 16.17 N ATOM 1202 CA MET E 101 21.293 -15.552 9.183 1.00 16.02 C ATOM 1203 C MET E 101 20.231 -16.269 8.367 1.00 16.23 C ATOM 1204 O MET E 101 19.595 -17.197 8.859 1.00 15.85 O ATOM 1205 CB MET E 101 20.815 -14.185 9.686 1.00 15.85 C ATOM 1206 CG MET E 101 19.613 -14.224 10.612 1.00 17.04 C ATOM 1207 SD MET E 101 18.079 -14.351 9.711 1.00 19.52 S ATOM 1208 CE MET E 101 17.801 -12.611 9.511 1.00 22.41 C ATOM 1209 HA MET E 101 21.506 -16.153 10.067 1.00 0.00 H ATOM 1210 HB2 MET E 101 21.639 -13.715 10.222 1.00 0.00 H ATOM 1211 HB3 MET E 101 20.554 -13.578 8.819 1.00 0.00 H ATOM 1212 HG2 MET E 101 19.597 -13.311 11.207 1.00 0.00 H ATOM 1213 HG3 MET E 101 19.706 -15.086 11.273 1.00 0.00 H ATOM 1214 HE1 MET E 101 17.728 -12.141 10.492 1.00 0.00 H ATOM 1215 HE2 MET E 101 18.632 -12.173 8.958 1.00 0.00 H ATOM 1216 HE3 MET E 101 16.873 -12.453 8.961 1.00 0.00 H ATOM 1217 H MET E 101 22.863 -14.463 8.176 1.00 0.00 H ATOM 1218 N LEU E 102 20.029 -15.849 7.123 1.00 16.18 N ATOM 1219 CA LEU E 102 19.007 -16.431 6.287 1.00 17.19 C ATOM 1220 C LEU E 102 19.330 -17.885 6.001 1.00 18.04 C ATOM 1221 O LEU E 102 18.436 -18.727 6.039 1.00 18.17 O ATOM 1222 CB LEU E 102 18.850 -15.637 4.990 1.00 17.58 C ATOM 1223 CG LEU E 102 18.363 -14.199 5.174 1.00 19.93 C ATOM 1224 CD1 LEU E 102 18.487 -13.417 3.873 1.00 21.52 C ATOM 1225 CD2 LEU E 102 16.944 -14.195 5.662 1.00 20.94 C ATOM 1226 HA LEU E 102 18.056 -16.389 6.818 1.00 0.00 H ATOM 1227 HB2 LEU E 102 19.819 -15.606 4.491 1.00 0.00 H ATOM 1228 HB3 LEU E 102 18.133 -16.160 4.357 1.00 0.00 H ATOM 1229 HG LEU E 102 18.990 -13.712 5.920 1.00 0.00 H ATOM 1230 HD21 LEU E 102 16.309 -14.698 4.933 1.00 0.00 H ATOM 1231 HD22 LEU E 102 16.888 -14.718 6.617 1.00 0.00 H ATOM 1232 HD23 LEU E 102 16.608 -13.166 5.789 1.00 0.00 H ATOM 1233 HD11 LEU E 102 19.531 -13.398 3.560 1.00 0.00 H ATOM 1234 HD12 LEU E 102 17.884 -13.898 3.103 1.00 0.00 H ATOM 1235 HD13 LEU E 102 18.135 -12.397 4.029 1.00 0.00 H ATOM 1236 H LEU E 102 20.621 -15.083 6.743 1.00 0.00 H ATOM 1237 N ARG E 103 20.593 -18.191 5.730 1.00 19.00 N ATOM 1238 CA ARG E 103 20.996 -19.590 5.533 1.00 20.43 C ATOM 1239 C ARG E 103 20.622 -20.451 6.753 1.00 20.19 C ATOM 1240 O ARG E 103 20.140 -21.580 6.597 1.00 20.70 O ATOM 1241 CB ARG E 103 22.498 -19.716 5.221 1.00 21.50 C ATOM 1242 CG ARG E 103 22.970 -21.169 5.005 1.00 26.47 C ATOM 1243 CD ARG E 103 24.490 -21.292 4.955 1.00 33.76 C ATOM 1244 NE ARG E 103 25.136 -20.722 6.136 1.00 38.73 N ATOM 1245 CZ ARG E 103 25.714 -21.400 7.127 1.00 45.26 C ATOM 1246 NH1 ARG E 103 25.775 -22.729 7.151 1.00 47.64 N ATOM 1247 NH2 ARG E 103 26.253 -20.713 8.120 1.00 46.84 N ATOM 1248 HA ARG E 103 20.448 -19.962 4.667 1.00 0.00 H ATOM 1249 HB2 ARG E 103 22.710 -19.147 4.316 1.00 0.00 H ATOM 1250 HB3 ARG E 103 23.059 -19.292 6.054 1.00 0.00 H ATOM 1251 HG2 ARG E 103 22.597 -21.783 5.825 1.00 0.00 H ATOM 1252 HG3 ARG E 103 22.559 -21.533 4.063 1.00 0.00 H ATOM 1253 HD2 ARG E 103 24.855 -20.770 4.070 1.00 0.00 H ATOM 1254 HD3 ARG E 103 24.754 -22.347 4.887 1.00 0.00 H ATOM 1255 HE ARG E 103 25.145 -19.685 6.210 1.00 0.00 H ATOM 1256 HH12 ARG E 103 26.237 -23.214 7.947 1.00 0.00 H ATOM 1257 HH11 ARG E 103 25.361 -23.283 6.374 1.00 0.00 H ATOM 1258 HH22 ARG E 103 26.712 -21.212 8.909 1.00 0.00 H ATOM 1259 HH21 ARG E 103 26.218 -19.674 8.112 1.00 0.00 H ATOM 1260 H ARG E 103 21.303 -17.434 5.657 1.00 0.00 H ATOM 1261 N LYS E 104 20.823 -19.918 7.956 1.00 19.39 N ATOM 1262 CA LYS E 104 20.582 -20.672 9.187 1.00 19.56 C ATOM 1263 C LYS E 104 19.092 -20.775 9.535 1.00 19.12 C ATOM 1264 O LYS E 104 18.666 -21.690 10.263 1.00 19.09 O ATOM 1265 CB LYS E 104 21.337 -20.020 10.348 1.00 19.92 C ATOM 1266 CG LYS E 104 22.836 -20.190 10.270 1.00 23.13 C ATOM 1267 CD LYS E 104 23.537 -19.468 11.407 1.00 26.69 C ATOM 1268 CE LYS E 104 24.961 -19.958 11.568 1.00 29.36 C ATOM 1269 HA LYS E 104 20.946 -21.686 9.020 1.00 0.00 H ATOM 1270 HB2 LYS E 104 21.111 -18.954 10.350 1.00 0.00 H ATOM 1271 HB3 LYS E 104 20.988 -20.466 11.279 1.00 0.00 H ATOM 1272 HG2 LYS E 104 23.076 -21.252 10.323 1.00 0.00 H ATOM 1273 HG3 LYS E 104 23.190 -19.786 9.322 1.00 0.00 H ATOM 1274 HD2 LYS E 104 23.550 -18.399 11.196 1.00 0.00 H ATOM 1275 HD3 LYS E 104 22.991 -19.648 12.333 1.00 0.00 H ATOM 1276 HE2 LYS E 104 24.954 -21.026 11.784 1.00 0.00 H ATOM 1277 HE3 LYS E 104 25.513 -19.776 10.646 1.00 0.00 H ATOM 1278 H LYS E 104 21.161 -18.937 8.023 1.00 0.00 H ATOM 1279 N ASN E 105 18.295 -19.849 9.024 1.00 18.13 N ATOM 1280 CA ASN E 105 16.914 -19.756 9.468 1.00 18.44 C ATOM 1281 C ASN E 105 15.875 -20.083 8.434 1.00 19.54 C ATOM 1282 O ASN E 105 14.678 -19.996 8.689 1.00 19.13 O ATOM 1283 CB ASN E 105 16.650 -18.389 10.068 1.00 17.95 C ATOM 1284 CG ASN E 105 17.263 -18.266 11.406 1.00 17.40 C ATOM 1285 OD1 ASN E 105 16.682 -18.716 12.395 1.00 17.83 O ATOM 1286 ND2 ASN E 105 18.477 -17.757 11.460 1.00 15.67 N ATOM 1287 HA ASN E 105 16.808 -20.537 10.221 1.00 0.00 H ATOM 1288 HB2 ASN E 105 17.070 -17.626 9.413 1.00 0.00 H ATOM 1289 HB3 ASN E 105 15.574 -18.240 10.155 1.00 0.00 H ATOM 1290 HD22 ASN E 105 18.926 -17.389 10.597 1.00 0.00 H ATOM 1291 HD21 ASN E 105 18.987 -17.723 12.366 1.00 0.00 H ATOM 1292 H ASN E 105 18.657 -19.189 8.306 1.00 0.00 H ATOM 1293 N LEU E 106 16.331 -20.504 7.270 1.00 21.42 N ATOM 1294 CA LEU E 106 15.407 -20.889 6.235 1.00 23.41 C ATOM 1295 C LEU E 106 15.677 -22.329 5.864 1.00 25.20 C ATOM 1296 O LEU E 106 16.778 -22.683 5.473 1.00 25.72 O ATOM 1297 CB LEU E 106 15.549 -19.980 5.013 1.00 23.21 C ATOM 1298 CG LEU E 106 15.217 -18.491 5.177 1.00 23.37 C ATOM 1299 CD1 LEU E 106 15.546 -17.774 3.878 1.00 24.06 C ATOM 1300 CD2 LEU E 106 13.773 -18.211 5.589 1.00 22.94 C ATOM 1301 HA LEU E 106 14.385 -20.787 6.599 1.00 0.00 H ATOM 1302 HB2 LEU E 106 16.584 -20.046 4.679 1.00 0.00 H ATOM 1303 HB3 LEU E 106 14.892 -20.375 4.238 1.00 0.00 H ATOM 1304 HG LEU E 106 15.826 -18.116 5.999 1.00 0.00 H ATOM 1305 HD21 LEU E 106 13.097 -18.608 4.832 1.00 0.00 H ATOM 1306 HD22 LEU E 106 13.570 -18.691 6.546 1.00 0.00 H ATOM 1307 HD23 LEU E 106 13.625 -17.135 5.682 1.00 0.00 H ATOM 1308 HD11 LEU E 106 16.606 -17.896 3.656 1.00 0.00 H ATOM 1309 HD12 LEU E 106 14.953 -18.200 3.069 1.00 0.00 H ATOM 1310 HD13 LEU E 106 15.315 -16.714 3.981 1.00 0.00 H ATOM 1311 H LEU E 106 17.356 -20.558 7.100 1.00 0.00 H ATOM 1312 N VAL E 107 14.668 -23.165 6.071 1.00 27.26 N ATOM 1313 CA VAL E 107 14.663 -24.533 5.565 1.00 28.64 C ATOM 1314 C VAL E 107 13.952 -24.679 4.211 1.00 28.95 C ATOM 1315 O VAL E 107 12.793 -24.298 4.042 1.00 28.75 O ATOM 1316 CB VAL E 107 14.025 -25.481 6.593 1.00 28.87 C ATOM 1317 CG1 VAL E 107 14.299 -26.908 6.198 1.00 29.26 C ATOM 1318 CG2 VAL E 107 14.575 -25.200 8.004 1.00 29.64 C ATOM 1319 HA VAL E 107 15.707 -24.803 5.405 1.00 0.00 H ATOM 1320 HB VAL E 107 12.948 -25.313 6.610 1.00 0.00 H ATOM 1321 HG11 VAL E 107 13.873 -27.099 5.213 1.00 0.00 H ATOM 1322 HG12 VAL E 107 15.376 -27.075 6.168 1.00 0.00 H ATOM 1323 HG13 VAL E 107 13.846 -27.579 6.928 1.00 0.00 H ATOM 1324 HG21 VAL E 107 15.655 -25.349 8.008 1.00 0.00 H ATOM 1325 HG22 VAL E 107 14.348 -24.171 8.283 1.00 0.00 H ATOM 1326 HG23 VAL E 107 14.110 -25.882 8.716 1.00 0.00 H ATOM 1327 H VAL E 107 13.847 -22.832 6.616 1.00 0.00 H TER 1328 VAL E 107 HETATM 1329 O HOH 1 12.533 4.169 13.838 1.00 11.55 O HETATM 1330 O HOH 2 17.366 10.704 8.110 1.00 12.35 O HETATM 1331 O HOH 3 14.549 4.270 16.369 1.00 15.69 O HETATM 1332 O HOH 4 10.282 -4.210 2.998 1.00 16.68 O HETATM 1333 O HOH 5 24.553 4.963 13.037 1.00 14.69 O HETATM 1334 O HOH 6 12.639 -4.347 19.766 1.00 12.91 O HETATM 1335 O HOH 7 26.388 -4.120 8.245 1.00 17.97 O HETATM 1336 O HOH 8 12.291 12.291 12.291 1.00 13.41 O HETATM 1337 O HOH 9 26.692 -13.462 6.293 1.00 19.91 O HETATM 1338 O HOH 10 11.061 -2.090 19.093 1.00 15.11 O HETATM 1339 O HOH 11 6.637 -23.600 13.001 1.00 19.82 O HETATM 1340 O HOH 12 17.329 -3.365 19.517 1.00 17.61 O HETATM 1341 O HOH 13 15.343 11.163 15.468 1.00 22.19 O HETATM 1342 O HOH 14 13.893 -7.054 -0.917 1.00 19.88 O HETATM 1343 O HOH 15 9.139 -6.957 21.164 1.00 11.93 O HETATM 1344 O HOH 16 30.737 -6.269 5.311 1.00 26.15 O HETATM 1345 O HOH 17 7.942 0.140 -1.467 1.00 36.25 O HETATM 1346 O HOH 18 5.315 -9.821 1.465 1.00 44.27 O HETATM 1347 O HOH 19 14.954 -3.319 20.984 1.00 14.34 O HETATM 1348 O HOH 20 8.273 -0.204 3.742 1.00 38.65 O HETATM 1349 O HOH 21 28.586 -1.315 8.616 1.00 43.39 O HETATM 1350 O HOH 22 12.143 -18.329 -2.849 1.00 24.48 O HETATM 1351 O HOH 23 29.883 -14.645 12.608 1.00 44.91 O HETATM 1352 O HOH 24 5.485 -18.769 -5.374 1.00 51.34 O HETATM 1353 O HOH 25 9.392 -18.605 22.410 1.00 17.57 O HETATM 1354 O HOH 26 15.441 -25.300 1.102 1.00 59.08 O HETATM 1355 O HOH 27 13.354 -26.994 2.114 1.00 35.01 O HETATM 1356 O HOH 28 12.221 -14.948 -4.173 1.00 21.16 O HETATM 1357 O HOH 29 14.083 -11.050 21.742 1.00 25.55 O HETATM 1358 O HOH 30 0.491 -2.822 5.898 1.00 50.45 O HETATM 1359 O HOH 31 30.795 -0.551 3.511 1.00 49.11 O HETATM 1360 O HOH 32 20.375 6.563 4.510 1.00 18.68 O HETATM 1361 O HOH 33 -0.561 -10.869 5.238 1.00 51.64 O HETATM 1362 O HOH 34 26.965 -14.818 14.439 1.00 48.47 O HETATM 1363 O HOH 35 14.897 11.988 12.825 1.00 16.14 O HETATM 1364 O HOH 36 20.841 -1.842 19.913 1.00 21.63 O HETATM 1365 O HOH 37 10.393 -2.078 4.402 1.00 22.82 O HETATM 1366 O HOH 38 24.979 4.330 16.205 1.00 36.52 O HETATM 1367 O HOH 39 11.375 -24.785 9.323 1.00 33.77 O HETATM 1368 O HOH 40 10.193 -26.127 1.510 1.00 52.64 O HETATM 1369 O HOH 41 12.947 10.654 16.334 1.00 16.50 O HETATM 1370 O HOH 42 22.762 -14.377 18.806 1.00 21.38 O HETATM 1371 O HOH 43 14.160 0.859 18.594 1.00 19.03 O HETATM 1372 O HOH 44 1.436 -21.529 4.791 1.00 31.17 O HETATM 1373 O HOH 45 21.943 -15.652 20.069 1.00 44.98 O HETATM 1374 O HOH 46 27.116 2.034 6.066 1.00 20.22 O HETATM 1375 O HOH 47 6.831 -13.832 -3.685 1.00 27.37 O HETATM 1376 O HOH 48 13.099 -7.324 22.151 1.00 19.40 O HETATM 1377 O HOH 49 5.656 1.242 14.633 1.00 28.01 O HETATM 1378 O HOH 50 16.785 2.687 16.388 1.00 18.50 O HETATM 1379 O HOH 51 12.239 0.000 20.242 1.00 22.85 O HETATM 1380 O HOH 52 16.777 0.279 17.868 1.00 17.18 O HETATM 1381 O HOH 53 18.280 4.817 3.614 1.00 23.24 O HETATM 1382 O HOH 54 21.692 12.286 17.444 1.00 24.16 O HETATM 1383 O HOH 55 24.929 -13.283 10.882 1.00 19.72 O HETATM 1384 O HOH 56 20.492 1.944 1.749 1.00 23.68 O HETATM 1385 O HOH 57 15.260 -22.203 15.463 1.00 22.16 O HETATM 1386 O HOH 58 1.710 -13.316 4.336 1.00 26.94 O HETATM 1387 O HOH 59 4.121 -25.533 13.062 1.00 33.14 O HETATM 1388 O HOH 60 17.436 -20.263 14.477 1.00 24.76 O HETATM 1389 O HOH 61 29.746 -0.657 20.830 1.00 32.59 O HETATM 1390 O HOH 62 17.604 2.270 2.780 1.00 24.10 O HETATM 1391 O HOH 63 21.589 7.991 2.385 1.00 26.80 O HETATM 1392 O HOH 64 28.510 -8.752 1.798 1.00 23.24 O HETATM 1393 O HOH 65 15.277 -13.637 23.417 1.00 28.13 O HETATM 1394 O HOH 66 9.388 -14.115 -5.785 1.00 57.95 O HETATM 1395 O HOH 67 0.932 -12.145 11.709 1.00 31.07 O HETATM 1396 O HOH 68 11.980 7.637 8.569 1.00 24.14 O HETATM 1397 O HOH 69 4.901 1.159 11.512 1.00 28.90 O HETATM 1398 O HOH 70 24.780 3.277 -0.836 1.00 21.89 O HETATM 1399 O HOH 71 15.933 -24.754 15.115 1.00 35.97 O HETATM 1400 O HOH 72 24.075 -15.554 11.847 1.00 37.60 O HETATM 1401 O HOH 73 10.387 4.206 4.564 1.00 28.05 O HETATM 1402 O HOH 74 17.350 -16.104 20.330 1.00 34.17 O HETATM 1403 O HOH 75 20.531 -17.188 13.415 1.00 27.94 O HETATM 1404 O HOH 76 2.251 -4.236 11.719 1.00 42.34 O HETATM 1405 O HOH 77 12.698 2.959 -1.074 1.00 34.13 O HETATM 1406 O HOH 78 9.048 -23.193 11.217 1.00 34.14 O HETATM 1407 O HOH 79 8.439 2.658 3.681 1.00 26.27 O HETATM 1408 O HOH 80 23.246 4.758 18.020 1.00 48.16 O HETATM 1409 O HOH 81 19.525 -14.918 22.917 1.00 43.23 O HETATM 1410 O HOH 82 8.453 -3.587 1.381 1.00 31.76 O HETATM 1411 O HOH 83 11.893 5.381 16.627 1.00 29.95 O HETATM 1412 O HOH 84 5.821 -11.546 -3.275 1.00 32.66 O HETATM 1413 O HOH 85 28.448 -12.469 15.022 1.00 40.90 O HETATM 1414 O HOH 86 18.437 -0.842 20.258 1.00 38.76 O HETATM 1415 O HOH 87 -0.693 -17.034 10.524 1.00 42.17 O HETATM 1416 O HOH 88 27.178 -5.351 11.959 1.00 43.49 O HETATM 1417 O HOH 89 26.695 -1.804 12.189 1.00 30.84 O HETATM 1418 O HOH 90 6.537 -9.693 -1.039 1.00 22.19 O HETATM 1419 O HOH 91 29.302 -10.577 8.332 1.00 38.39 O HETATM 1420 O HOH 92 22.833 -0.950 18.635 1.00 39.85 O HETATM 1421 O HOH 93 6.400 -5.565 1.497 1.00 40.44 O HETATM 1422 O HOH 94 2.579 -18.008 3.980 1.00 31.95 O HETATM 1423 O HOH 95 28.484 -5.433 9.609 1.00 48.23 O HETATM 1424 O HOH 96 21.625 5.909 -1.006 1.00 39.07 O HETATM 1425 O HOH 97 32.075 -3.545 1.683 1.00 36.70 O HETATM 1426 O HOH 98 5.482 -7.453 2.531 1.00 41.50 O HETATM 1427 O HOH 99 6.295 -22.480 -5.400 1.00 71.16 O HETATM 1428 O HOH 100 7.153 3.799 9.441 1.00 49.92 O HETATM 1429 O HOH 101 3.378 -11.505 0.866 1.00 35.95 O HETATM 1430 O HOH 102 4.269 -17.733 -0.835 1.00 47.69 O HETATM 1431 O HOH 103 31.180 -8.495 8.523 1.00 46.38 O HETATM 1432 O HOH 104 22.613 7.620 0.011 1.00 33.69 O HETATM 1433 O HOH 105 2.490 -15.363 2.246 1.00 47.02 O HETATM 1434 O HOH 106 18.637 -23.466 8.049 1.00 45.77 O HETATM 1435 O HOH 107 7.748 -0.923 1.388 1.00 46.75 O HETATM 1436 O HOH 108 0.249 -7.398 11.804 1.00 37.67 O HETATM 1437 O HOH 109 21.379 -0.580 0.772 1.00 13.41 O HETATM 1438 O HOH 110 20.597 12.403 8.819 1.00 14.66 O HETATM 1439 O HOH 111 13.963 0.955 0.025 1.00 17.35 O HETATM 1440 O HOH 112 14.960 6.920 15.342 1.00 10.90 O HETATM 1441 O HOH 113 16.939 8.745 16.178 1.00 16.77 O HETATM 1442 C1 WW A 8 15.433 -6.581 4.984 1.00 -0.03 C HETATM 1443 C2 WW A 8 16.445 -6.318 5.900 1.00 0.03 C HETATM 1444 CL3 WW A 8 16.921 -7.533 7.030 1.00 -0.08 CL HETATM 1445 C4 WW A 8 17.091 -5.087 5.894 1.00 -0.06 C HETATM 1446 C5 WW A 8 16.721 -4.087 4.989 1.00 -0.07 C HETATM 1447 C6 WW A 8 15.713 -4.359 4.073 1.00 -0.00 C HETATM 1448 C7 WW A 8 15.065 -5.589 4.097 1.00 0.07 C HETATM 1449 N8 WW A 8 14.175 -5.605 3.136 1.00 -0.26 N HETATM 1450 C9 WW A 8 14.175 -4.442 2.512 1.00 0.15 C HETATM 1451 C10 WW A 8 13.214 -4.242 1.374 1.00 0.23 C HETATM 1452 O11 WW A 8 12.904 -5.248 0.727 1.00 -0.39 O HETATM 1453 N12 WW A 8 12.671 -3.085 1.060 1.00 -0.27 N HETATM 1454 C13 WW A 8 12.839 -1.829 1.812 1.00 0.08 C HETATM 1455 C14 WW A 8 11.569 -1.095 1.422 1.00 0.00 C HETATM 1456 N15 WW A 8 11.645 0.328 1.734 1.00 0.24 N HETATM 1457 C16 WW A 8 12.073 0.738 3.062 1.00 -0.03 C HETATM 1458 C17 WW A 8 12.707 2.119 3.144 1.00 0.03 C HETATM 1459 C18 WW A 8 13.053 2.250 4.617 1.00 -0.03 C HETATM 1460 N19 WW A 8 13.208 3.612 5.068 1.00 0.23 N HETATM 1461 C20 WW A 8 13.413 4.004 6.433 1.00 -0.04 C HETATM 1462 H16 WW A 8 13.498 5.099 6.491 1.00 0.08 H HETATM 1463 H17 WW A 8 14.338 3.544 6.812 1.00 0.08 H HETATM 1464 H18 WW A 8 12.561 3.670 7.043 1.00 0.08 H HETATM 1465 C21 WW A 8 14.503 4.016 4.518 1.00 -0.04 C HETATM 1466 H19 WW A 8 14.533 3.785 3.443 1.00 0.08 H HETATM 1467 H20 WW A 8 15.307 3.469 5.033 1.00 0.08 H HETATM 1468 H21 WW A 8 14.643 5.097 4.665 1.00 0.08 H HETATM 1469 H15 WW A 8 12.438 4.146 4.695 1.00 0.20 H HETATM 1470 H13 WW A 8 13.998 1.717 4.798 1.00 0.08 H HETATM 1471 H14 WW A 8 12.249 1.782 5.204 1.00 0.08 H HETATM 1472 H11 WW A 8 11.996 2.899 2.834 1.00 0.04 H HETATM 1473 H12 WW A 8 13.611 2.177 2.519 1.00 0.04 H HETATM 1474 H9 WW A 8 12.809 0.004 3.423 1.00 0.08 H HETATM 1475 H10 WW A 8 11.192 0.729 3.721 1.00 0.08 H HETATM 1476 C22 WW A 8 10.807 1.215 0.942 1.00 -0.04 C HETATM 1477 H22 WW A 8 10.585 0.742 -0.026 1.00 0.08 H HETATM 1478 H23 WW A 8 11.335 2.165 0.773 1.00 0.08 H HETATM 1479 H24 WW A 8 9.867 1.409 1.480 1.00 0.08 H HETATM 1480 H8 WW A 8 12.515 0.519 1.263 1.00 0.20 H HETATM 1481 C23 WW A 8 11.352 -1.446 -0.060 1.00 0.01 C HETATM 1482 C24 WW A 8 11.716 -2.939 -0.066 1.00 0.04 C HETATM 1483 H27 WW A 8 10.822 -3.559 0.098 1.00 0.05 H HETATM 1484 H28 WW A 8 12.189 -3.221 -1.018 1.00 0.05 H HETATM 1485 H25 WW A 8 12.019 -0.865 -0.714 1.00 0.03 H HETATM 1486 H26 WW A 8 10.307 -1.284 -0.364 1.00 0.03 H HETATM 1487 H7 WW A 8 10.727 -1.504 1.999 1.00 0.09 H HETATM 1488 H5 WW A 8 13.738 -1.282 1.492 1.00 0.06 H HETATM 1489 H6 WW A 8 12.886 -2.009 2.896 1.00 0.06 H HETATM 1490 C25 WW A 8 15.111 -3.593 3.088 1.00 0.04 C HETATM 1491 C26 WW A 8 15.583 -2.326 2.704 1.00 0.09 C HETATM 1492 C27 WW A 8 15.776 -1.158 3.441 1.00 0.03 C HETATM 1493 C28 WW A 8 15.350 -0.822 4.721 1.00 -0.03 C HETATM 1494 C29 WW A 8 16.034 0.195 5.376 1.00 -0.06 C HETATM 1495 C30 WW A 8 15.621 0.621 6.640 1.00 -0.07 C HETATM 1496 C31 WW A 8 14.521 0.006 7.257 1.00 -0.07 C HETATM 1497 C32 WW A 8 13.858 -1.016 6.580 1.00 -0.07 C HETATM 1498 C33 WW A 8 14.274 -1.448 5.327 1.00 -0.06 C HETATM 1499 H33 WW A 8 13.763 -2.265 4.830 1.00 0.06 H HETATM 1500 H32 WW A 8 12.997 -1.485 7.042 1.00 0.06 H HETATM 1501 H31 WW A 8 14.193 0.320 8.241 1.00 0.06 H HETATM 1502 H30 WW A 8 16.148 1.424 7.143 1.00 0.06 H HETATM 1503 H29 WW A 8 16.892 0.660 4.904 1.00 0.06 H HETATM 1504 N34 WW A 8 16.359 -0.248 2.645 1.00 -0.32 N HETATM 1505 C35 WW A 8 16.604 -0.821 1.476 1.00 0.10 C HETATM 1506 N36 WW A 8 16.162 -2.059 1.520 1.00 -0.23 N HETATM 1507 C37 WW A 8 16.295 -2.970 0.386 1.00 0.09 C HETATM 1508 C38 WW A 8 17.310 -4.081 0.739 1.00 -0.01 C HETATM 1509 C39 WW A 8 16.941 -5.409 0.607 1.00 -0.06 C HETATM 1510 C40 WW A 8 17.831 -6.433 0.918 1.00 -0.05 C HETATM 1511 C41 WW A 8 19.103 -6.149 1.393 1.00 0.03 C HETATM 1512 CL42 WW A 8 20.225 -7.408 1.794 1.00 -0.08 CL HETATM 1513 C43 WW A 8 19.472 -4.830 1.546 1.00 -0.05 C HETATM 1514 C44 WW A 8 18.575 -3.792 1.236 1.00 -0.06 C HETATM 1515 H40 WW A 8 18.872 -2.760 1.386 1.00 0.06 H HETATM 1516 H39 WW A 8 20.465 -4.590 1.909 1.00 0.06 H HETATM 1517 H38 WW A 8 17.526 -7.465 0.787 1.00 0.06 H HETATM 1518 H37 WW A 8 15.945 -5.655 0.257 1.00 0.06 H HETATM 1519 H35 WW A 8 16.651 -2.413 -0.493 1.00 0.08 H HETATM 1520 H36 WW A 8 15.318 -3.423 0.162 1.00 0.08 H HETATM 1521 H34 WW A 8 17.089 -0.347 0.624 1.00 0.12 H HETATM 1522 H4 WW A 8 13.568 -6.404 2.903 1.00 0.23 H HETATM 1523 H3 WW A 8 17.211 -3.120 5.002 1.00 0.06 H HETATM 1524 H2 WW A 8 17.892 -4.900 6.600 1.00 0.05 H HETATM 1525 H1 WW A 8 14.942 -7.547 4.966 1.00 0.06 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 1442 1443 1448 1525 CONECT 1443 1442 1444 1445 CONECT 1444 1443 CONECT 1445 1443 1446 1524 CONECT 1446 1445 1447 1523 CONECT 1447 1446 1448 1490 CONECT 1448 1442 1447 1449 CONECT 1449 1448 1450 1522 CONECT 1450 1449 1451 1490 CONECT 1451 1450 1452 1453 CONECT 1452 1451 CONECT 1453 1451 1454 1482 CONECT 1454 1453 1455 1488 1489 CONECT 1455 1454 1456 1481 1487 CONECT 1456 1455 1457 1476 1480 CONECT 1457 1456 1458 1474 1475 CONECT 1458 1457 1459 1472 1473 CONECT 1459 1458 1460 1470 1471 CONECT 1460 1459 1461 1465 1469 CONECT 1461 1460 1462 1463 1464 CONECT 1462 1461 CONECT 1463 1461 CONECT 1464 1461 CONECT 1465 1460 1466 1467 1468 CONECT 1466 1465 CONECT 1467 1465 CONECT 1468 1465 CONECT 1469 1460 CONECT 1470 1459 CONECT 1471 1459 CONECT 1472 1458 CONECT 1473 1458 CONECT 1474 1457 CONECT 1475 1457 CONECT 1476 1456 1477 1478 1479 CONECT 1477 1476 CONECT 1478 1476 CONECT 1479 1476 CONECT 1480 1456 CONECT 1481 1455 1482 1485 1486 CONECT 1482 1453 1481 1483 1484 CONECT 1483 1482 CONECT 1484 1482 CONECT 1485 1481 CONECT 1486 1481 CONECT 1487 1455 CONECT 1488 1454 CONECT 1489 1454 CONECT 1490 1447 1450 1491 CONECT 1491 1490 1492 1506 CONECT 1492 1491 1493 1504 CONECT 1493 1492 1494 1498 CONECT 1494 1493 1495 1503 CONECT 1495 1494 1496 1502 CONECT 1496 1495 1497 1501 CONECT 1497 1496 1498 1500 CONECT 1498 1493 1497 1499 CONECT 1499 1498 CONECT 1500 1497 CONECT 1501 1496 CONECT 1502 1495 CONECT 1503 1494 CONECT 1504 1492 1505 CONECT 1505 1504 1506 1521 CONECT 1506 1491 1505 1507 CONECT 1507 1506 1508 1519 1520 CONECT 1508 1507 1509 1514 CONECT 1509 1508 1510 1518 CONECT 1510 1509 1511 1517 CONECT 1511 1510 1512 1513 CONECT 1512 1511 CONECT 1513 1511 1514 1516 CONECT 1514 1508 1513 1515 CONECT 1515 1514 CONECT 1516 1513 CONECT 1517 1510 CONECT 1518 1509 CONECT 1519 1507 CONECT 1520 1507 CONECT 1521 1505 CONECT 1522 1449 CONECT 1523 1446 CONECT 1524 1445 CONECT 1525 1442 MASTER 0 0 0 0 0 0 0 0 1524 1 88 7 END
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6q9u
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3lbj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human MDMX protein
Ligand Name
WW8
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Ki=11uM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Cell Cycle Vol. 9:5, pp. 1104-1111
Ligand Properties
Formula
C
3
5
H
4
0
Cl
2
N
6
O
Molecular Weight
631.638
Exact Mass
630.264
No. of atoms
84
No. of bonds
89
Polar Surface Area
62.8
LOGP Value
7.29 (
Computed with XLOGP3
)
4.26 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 6
Canonical SMILES
C[NH+](CCC[N@@H+]([C@H]1CCN(C1)C(=O)c1[nH]c2c(c1c1n(cnc1c1ccccc1)Cc1ccc(cc1)Cl)ccc(c2)Cl)C)C
InChI String
InChI=1S/C35H38Cl2N6O/c1-40(2)17-7-18-41(3)28-16-19-42(22-28)35(44)33-31(29-15-14-27(37)20-30(29)39-33)34-32(25-8-5-4-6-9-25)38-23-43(34)21-24-10-12-26(36)13-11-24/h4-6,8-15,20,23,28,39H,7,16-19,21-22H2,1-3H3/p+2/t28-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O15151
Entrez Gene ID
NCBI Entrez Gene ID:
4194
ASD
Information of known allosteric effects of PDB entries
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