Browse entries in the PDBbind-CN Database
HEADER 5BTV_COMPLEX COMPND 5BTV_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 74 ALA MET GLY SER MET GLU ARG ALA SER LEU ILE GLN LYS SEQRES 2 A 74 ALA LYS LEU ALA GLU GLN ALA GLU ARG TYR GLU ASP MET SEQRES 3 A 74 ALA ALA PHE MET LYS GLY ALA VAL GLU LYS GLY GLU GLU SEQRES 4 A 74 LEU SER CSO GLU GLU ARG ASN LEU LEU SER VAL ALA TYR SEQRES 5 A 74 LYS ASN VAL VAL GLY GLY GLN ARG ALA ALA TRP ARG VAL SEQRES 6 A 74 LEU SER SER ILE GLU GLN CYS SER ASN SEQRES 1 A 154 GLY PRO GLU VAL ARG GLU TYR ARG GLU LYS VAL GLU THR SEQRES 2 A 154 GLU LEU GLN GLY VAL CYS ASP THR VAL LEU GLY LEU LEU SEQRES 3 A 154 ASP SER HIS LEU ILE LYS GLU ALA GLY ASP ALA GLU SER SEQRES 4 A 154 ARG VAL PHE TYR LEU LYS MET LYS GLY ASP TYR TYR ARG SEQRES 5 A 154 TYR LEU ALA GLU VAL ALA THR GLY ASP ASP LYS LYS ARG SEQRES 6 A 154 ILE ILE ASP SER ALA ARG SER ALA TYR GLN GLU ALA MET SEQRES 7 A 154 ASP ILE SER LYS LYS GLU MET PRO PRO THR ASN PRO ILE SEQRES 8 A 154 ARG LEU GLY LEU ALA LEU ASN PHE SER VAL PHE HIS TYR SEQRES 9 A 154 GLU ILE ALA ASN SER PRO GLU GLU ALA ILE SER LEU ALA SEQRES 10 A 154 LYS THR THR PHE ASP GLU ALA MET ALA ASP LEU HIS THR SEQRES 11 A 154 LEU SER GLU ASP SER TYR LYS ASP SER THR LEU ILE MET SEQRES 12 A 154 GLN LEU LEU ARG ASP ASN LEU THR LEU TRP THR HET CSO A 38 9 HET MG A 1 1 HET CA A 2 1 HET MG A 3 1 HET GLY A 548 50 ATOM 1 N ALA A -3 44.358 11.132 -6.018 1.00 32.67 N ATOM 2 CA ALA A -3 43.408 9.930 -6.115 1.00 32.05 C ATOM 3 C ALA A -3 42.411 10.231 -7.234 1.00 29.27 C ATOM 4 O ALA A -3 42.348 9.488 -8.265 1.00 31.38 O ATOM 5 CB ALA A -3 42.692 9.682 -4.836 1.00 31.39 C ATOM 6 HN3 ALA A -3 43.810 11.989 -5.800 1.00 0.00 H ATOM 7 HN2 ALA A -3 44.852 11.256 -6.925 1.00 0.00 H ATOM 8 HN1 ALA A -3 45.054 10.963 -5.264 1.00 0.00 H ATOM 9 N MET A -2 41.629 11.322 -7.072 1.00 22.53 N ATOM 10 CA MET A -2 40.934 11.771 -8.258 1.00 16.59 C ATOM 11 C MET A -2 41.730 12.919 -8.856 1.00 14.17 C ATOM 12 O MET A -2 41.193 13.673 -9.706 1.00 13.27 O ATOM 13 CB MET A -2 39.481 12.207 -7.919 1.00 17.36 C ATOM 14 CG MET A -2 38.671 11.154 -7.198 1.00 18.97 C ATOM 15 SD MET A -2 38.176 9.904 -8.384 1.00 22.07 S ATOM 16 CE MET A -2 37.433 8.714 -7.243 1.00 25.15 C ATOM 17 H MET A -2 41.534 11.806 -6.156 1.00 0.00 H ATOM 18 N GLY A -1 43.007 13.053 -8.459 1.00 13.22 N ATOM 19 CA GLY A -1 43.810 14.204 -8.927 1.00 14.28 C ATOM 20 C GLY A -1 43.998 14.286 -10.449 1.00 14.18 C ATOM 21 O GLY A -1 44.172 15.390 -11.011 1.00 14.12 O ATOM 22 H GLY A -1 43.431 12.348 -7.823 1.00 0.00 H ATOM 23 N SER A 0 43.964 13.125 -11.125 1.00 11.83 N ATOM 24 CA SER A 0 44.166 13.134 -12.573 1.00 10.12 C ATOM 25 C SER A 0 42.882 13.323 -13.359 1.00 10.91 C ATOM 26 O SER A 0 42.938 13.397 -14.591 1.00 10.92 O ATOM 27 CB SER A 0 44.882 11.849 -13.050 1.00 11.01 C ATOM 28 OG SER A 0 44.066 10.718 -12.772 1.00 7.66 O ATOM 29 HG SER A 0 43.903 10.662 -11.797 1.00 0.00 H ATOM 30 H SER A 0 43.796 12.230 -10.623 1.00 0.00 H ATOM 31 N MET A 1 41.713 13.348 -12.682 1.00 7.74 N ATOM 32 CA MET A 1 40.464 13.455 -13.434 1.00 9.77 C ATOM 33 C MET A 1 39.976 14.896 -13.477 1.00 10.02 C ATOM 34 O MET A 1 40.076 15.626 -12.473 1.00 11.61 O ATOM 35 CB MET A 1 39.307 12.628 -12.798 1.00 10.76 C ATOM 36 CG MET A 1 38.272 12.331 -13.894 1.00 14.16 C ATOM 37 SD MET A 1 36.855 11.362 -13.226 1.00 16.73 S ATOM 38 CE MET A 1 37.715 9.995 -12.441 1.00 16.66 C ATOM 39 H MET A 1 41.702 13.292 -11.644 1.00 0.00 H ATOM 40 N GLU A 2 39.527 15.301 -14.670 1.00 7.15 N ATOM 41 CA GLU A 2 38.959 16.698 -14.843 1.00 10.37 C ATOM 42 C GLU A 2 37.828 16.986 -13.817 1.00 8.95 C ATOM 43 O GLU A 2 36.973 16.127 -13.550 1.00 10.10 O ATOM 44 CB GLU A 2 38.326 16.891 -16.229 1.00 10.30 C ATOM 45 CG GLU A 2 39.385 16.887 -17.336 1.00 12.20 C ATOM 46 CD GLU A 2 40.067 18.267 -17.460 1.00 15.68 C ATOM 47 OE1 GLU A 2 39.964 19.116 -16.556 1.00 15.36 O ATOM 48 OE2 GLU A 2 40.630 18.531 -18.531 1.00 15.89 O ATOM 49 H GLU A 2 39.567 14.655 -15.484 1.00 0.00 H ATOM 50 N ARG A 3 37.828 18.214 -13.310 1.00 8.49 N ATOM 51 CA ARG A 3 36.686 18.602 -12.451 1.00 8.17 C ATOM 52 C ARG A 3 35.345 18.277 -13.124 1.00 10.14 C ATOM 53 O ARG A 3 34.442 17.751 -12.456 1.00 10.00 O ATOM 54 CB ARG A 3 36.734 20.116 -12.209 1.00 9.33 C ATOM 55 CG ARG A 3 35.731 20.554 -11.127 1.00 8.95 C ATOM 56 CD ARG A 3 35.927 22.110 -10.960 1.00 9.71 C ATOM 57 NE ARG A 3 35.118 22.543 -9.804 1.00 10.88 N ATOM 58 CZ ARG A 3 33.812 22.762 -9.833 1.00 10.20 C ATOM 59 NH1 ARG A 3 33.068 22.535 -10.905 1.00 11.13 N ATOM 60 NH2 ARG A 3 33.288 23.226 -8.673 1.00 12.33 N ATOM 61 HE ARG A 3 35.610 22.687 -8.899 1.00 0.00 H ATOM 62 HH12 ARG A 3 32.046 22.723 -10.878 1.00 0.00 H ATOM 63 HH11 ARG A 3 33.506 22.169 -11.774 1.00 0.00 H ATOM 64 HH22 ARG A 3 32.270 23.426 -8.606 1.00 0.00 H ATOM 65 HH21 ARG A 3 33.904 23.383 -7.850 1.00 0.00 H ATOM 66 H ARG A 3 38.602 18.879 -13.509 1.00 0.00 H ATOM 67 N ALA A 4 35.171 18.658 -14.408 1.00 8.94 N ATOM 68 CA ALA A 4 33.859 18.537 -14.986 1.00 9.48 C ATOM 69 C ALA A 4 33.502 17.028 -15.078 1.00 8.00 C ATOM 70 O ALA A 4 32.347 16.663 -15.021 1.00 9.94 O ATOM 71 CB ALA A 4 33.816 19.188 -16.340 1.00 10.76 C ATOM 72 H ALA A 4 35.966 19.030 -14.966 1.00 0.00 H ATOM 73 N SER A 5 34.536 16.194 -15.281 1.00 9.18 N ATOM 74 CA SER A 5 34.300 14.749 -15.405 1.00 8.65 C ATOM 75 C SER A 5 33.922 14.166 -14.052 1.00 8.85 C ATOM 76 O SER A 5 33.050 13.257 -14.001 1.00 8.88 O ATOM 77 CB SER A 5 35.620 14.056 -15.862 1.00 9.17 C ATOM 78 OG SER A 5 35.784 14.431 -17.245 1.00 10.69 O ATOM 79 HG SER A 5 35.847 15.417 -17.313 1.00 0.00 H ATOM 80 H SER A 5 35.503 16.571 -15.350 1.00 0.00 H ATOM 81 N LEU A 6 34.537 14.680 -12.984 1.00 7.90 N ATOM 82 CA LEU A 6 34.162 14.254 -11.625 1.00 9.12 C ATOM 83 C LEU A 6 32.677 14.590 -11.340 1.00 9.30 C ATOM 84 O LEU A 6 31.969 13.784 -10.785 1.00 8.92 O ATOM 85 CB LEU A 6 35.054 14.944 -10.570 1.00 7.39 C ATOM 86 CG LEU A 6 36.521 14.408 -10.667 1.00 8.96 C ATOM 87 CD1 LEU A 6 37.447 15.317 -9.901 1.00 10.13 C ATOM 88 CD2 LEU A 6 36.506 12.968 -10.023 1.00 8.24 C ATOM 89 H LEU A 6 35.288 15.388 -13.113 1.00 0.00 H ATOM 90 N ILE A 7 32.238 15.782 -11.729 1.00 7.94 N ATOM 91 CA ILE A 7 30.844 16.215 -11.489 1.00 8.05 C ATOM 92 C ILE A 7 29.911 15.322 -12.308 1.00 7.91 C ATOM 93 O ILE A 7 28.880 14.829 -11.812 1.00 8.40 O ATOM 94 CB ILE A 7 30.620 17.666 -11.990 1.00 6.53 C ATOM 95 CG1 ILE A 7 31.331 18.742 -11.087 1.00 10.80 C ATOM 96 CG2 ILE A 7 29.113 17.927 -12.197 1.00 7.05 C ATOM 97 CD1 ILE A 7 31.220 18.634 -9.458 1.00 3.62 C ATOM 98 H ILE A 7 32.892 16.428 -12.215 1.00 0.00 H ATOM 99 N GLN A 8 30.296 15.074 -13.584 1.00 8.25 N ATOM 100 CA GLN A 8 29.467 14.238 -14.439 1.00 8.83 C ATOM 101 C GLN A 8 29.309 12.832 -13.825 1.00 8.59 C ATOM 102 O GLN A 8 28.178 12.267 -13.767 1.00 9.09 O ATOM 103 CB GLN A 8 30.129 14.109 -15.810 1.00 10.99 C ATOM 104 CG GLN A 8 29.240 13.354 -16.789 1.00 17.20 C ATOM 105 CD GLN A 8 29.828 13.326 -18.242 1.00 20.98 C ATOM 106 OE1 GLN A 8 29.296 12.645 -19.152 1.00 28.06 O ATOM 107 NE2 GLN A 8 30.912 14.096 -18.463 1.00 19.65 N ATOM 108 HE22 GLN A 8 31.326 14.647 -17.684 1.00 0.00 H ATOM 109 HE21 GLN A 8 31.334 14.139 -19.412 1.00 0.00 H ATOM 110 H GLN A 8 31.181 15.480 -13.950 1.00 0.00 H ATOM 111 N LYS A 9 30.432 12.269 -13.352 1.00 9.02 N ATOM 112 CA LYS A 9 30.438 10.919 -12.755 1.00 8.74 C ATOM 113 C LYS A 9 29.718 10.893 -11.413 1.00 8.67 C ATOM 114 O LYS A 9 28.992 9.920 -11.110 1.00 9.59 O ATOM 115 CB LYS A 9 31.807 10.343 -12.707 1.00 7.35 C ATOM 116 CG LYS A 9 32.330 10.168 -14.154 1.00 8.50 C ATOM 117 CD LYS A 9 33.715 9.476 -13.982 1.00 9.86 C ATOM 118 CE LYS A 9 34.417 9.327 -15.380 1.00 9.90 C ATOM 119 NZ LYS A 9 35.823 8.765 -15.227 1.00 9.93 N ATOM 120 HZ1 LYS A 9 36.389 9.406 -14.636 1.00 0.00 H ATOM 121 HZ2 LYS A 9 35.774 7.829 -14.776 1.00 0.00 H ATOM 122 HZ3 LYS A 9 36.264 8.677 -16.165 1.00 0.00 H ATOM 123 H LYS A 9 31.325 12.800 -13.408 1.00 0.00 H ATOM 124 N ALA A 10 29.766 11.999 -10.663 1.00 7.95 N ATOM 125 CA ALA A 10 28.952 12.065 -9.424 1.00 8.27 C ATOM 126 C ALA A 10 27.469 11.953 -9.774 1.00 8.35 C ATOM 127 O ALA A 10 26.720 11.239 -9.047 1.00 9.20 O ATOM 128 CB ALA A 10 29.217 13.411 -8.690 1.00 8.79 C ATOM 129 H ALA A 10 30.365 12.801 -10.944 1.00 0.00 H ATOM 130 N LYS A 11 27.031 12.619 -10.869 1.00 8.00 N ATOM 131 CA LYS A 11 25.602 12.541 -11.190 1.00 8.91 C ATOM 132 C LYS A 11 25.256 11.139 -11.683 1.00 9.41 C ATOM 133 O LYS A 11 24.134 10.656 -11.430 1.00 11.57 O ATOM 134 CB LYS A 11 25.276 13.562 -12.317 1.00 8.52 C ATOM 135 CG LYS A 11 25.357 14.998 -11.766 1.00 10.09 C ATOM 136 CD LYS A 11 25.144 15.983 -12.927 1.00 15.11 C ATOM 137 CE LYS A 11 25.524 17.389 -12.556 1.00 19.66 C ATOM 138 NZ LYS A 11 25.356 18.363 -13.801 1.00 19.18 N ATOM 139 HZ1 LYS A 11 25.970 18.042 -14.576 1.00 0.00 H ATOM 140 HZ2 LYS A 11 24.365 18.354 -14.116 1.00 0.00 H ATOM 141 HZ3 LYS A 11 25.624 19.329 -13.523 1.00 0.00 H ATOM 142 H LYS A 11 27.686 13.167 -11.462 1.00 0.00 H ATOM 143 N LEU A 12 26.168 10.490 -12.402 1.00 9.77 N ATOM 144 CA LEU A 12 25.911 9.108 -12.850 1.00 9.92 C ATOM 145 C LEU A 12 25.827 8.203 -11.625 1.00 11.15 C ATOM 146 O LEU A 12 24.991 7.284 -11.560 1.00 12.13 O ATOM 147 CB LEU A 12 27.061 8.621 -13.762 1.00 10.30 C ATOM 148 CG LEU A 12 27.115 9.261 -15.152 1.00 11.80 C ATOM 149 CD1 LEU A 12 28.438 8.881 -15.843 1.00 13.97 C ATOM 150 CD2 LEU A 12 25.831 8.955 -16.051 1.00 14.82 C ATOM 151 H LEU A 12 27.064 10.958 -12.649 1.00 0.00 H ATOM 152 N ALA A 13 26.774 8.371 -10.715 1.00 10.24 N ATOM 153 CA ALA A 13 26.775 7.510 -9.478 1.00 11.03 C ATOM 154 C ALA A 13 25.481 7.747 -8.716 1.00 10.98 C ATOM 155 O ALA A 13 24.910 6.742 -8.221 1.00 12.75 O ATOM 156 CB ALA A 13 28.019 7.895 -8.595 1.00 11.12 C ATOM 157 H ALA A 13 27.511 9.091 -10.853 1.00 0.00 H ATOM 158 N GLU A 14 24.963 8.986 -8.620 1.00 11.37 N ATOM 159 CA GLU A 14 23.686 9.196 -7.945 1.00 11.02 C ATOM 160 C GLU A 14 22.589 8.335 -8.695 1.00 12.28 C ATOM 161 O GLU A 14 21.734 7.679 -8.049 1.00 14.24 O ATOM 162 CB GLU A 14 23.322 10.676 -7.957 1.00 10.95 C ATOM 163 CG GLU A 14 22.043 10.871 -7.204 1.00 14.76 C ATOM 164 CD GLU A 14 21.583 12.333 -7.129 1.00 19.29 C ATOM 165 OE1 GLU A 14 21.937 13.140 -8.012 1.00 20.80 O ATOM 166 OE2 GLU A 14 20.777 12.609 -6.195 1.00 23.73 O ATOM 167 H GLU A 14 25.474 9.795 -9.028 1.00 0.00 H ATOM 168 N GLN A 15 22.561 8.394 -10.022 1.00 13.61 N ATOM 169 CA GLN A 15 21.509 7.651 -10.766 1.00 14.96 C ATOM 170 C GLN A 15 21.585 6.154 -10.497 1.00 14.30 C ATOM 171 O GLN A 15 20.540 5.418 -10.455 1.00 16.40 O ATOM 172 CB GLN A 15 21.682 7.918 -12.270 1.00 14.64 C ATOM 173 CG GLN A 15 21.309 9.344 -12.593 1.00 18.03 C ATOM 174 CD GLN A 15 21.379 9.620 -14.067 1.00 27.83 C ATOM 175 OE1 GLN A 15 22.408 10.090 -14.566 1.00 32.76 O ATOM 176 NE2 GLN A 15 20.351 9.246 -14.784 1.00 25.17 N ATOM 177 HE22 GLN A 15 19.507 8.856 -14.319 1.00 0.00 H ATOM 178 HE21 GLN A 15 20.378 9.339 -15.820 1.00 0.00 H ATOM 179 H GLN A 15 23.269 8.955 -10.537 1.00 0.00 H ATOM 180 N ALA A 16 22.811 5.666 -10.334 1.00 12.33 N ATOM 181 CA ALA A 16 23.096 4.255 -10.079 1.00 12.46 C ATOM 182 C ALA A 16 22.960 3.894 -8.604 1.00 14.04 C ATOM 183 O ALA A 16 23.255 2.746 -8.276 1.00 13.99 O ATOM 184 CB ALA A 16 24.468 3.890 -10.625 1.00 14.34 C ATOM 185 H ALA A 16 23.613 6.326 -10.391 1.00 0.00 H ATOM 186 N GLU A 17 22.628 4.869 -7.743 1.00 12.45 N ATOM 187 CA GLU A 17 22.621 4.676 -6.269 1.00 13.90 C ATOM 188 C GLU A 17 23.959 4.178 -5.720 1.00 13.39 C ATOM 189 O GLU A 17 24.020 3.390 -4.779 1.00 14.46 O ATOM 190 CB GLU A 17 21.399 3.811 -5.832 1.00 14.40 C ATOM 191 CG GLU A 17 20.115 4.574 -6.172 1.00 21.62 C ATOM 192 CD GLU A 17 18.853 3.754 -5.927 1.00 28.53 C ATOM 193 OE1 GLU A 17 18.544 3.519 -4.777 1.00 30.77 O ATOM 194 OE2 GLU A 17 18.187 3.328 -6.884 1.00 35.71 O ATOM 195 H GLU A 17 22.364 5.800 -8.124 1.00 0.00 H ATOM 196 N ARG A 18 25.051 4.646 -6.297 1.00 11.05 N ATOM 197 CA ARG A 18 26.382 4.307 -5.853 1.00 11.00 C ATOM 198 C ARG A 18 26.942 5.460 -5.052 1.00 10.46 C ATOM 199 O ARG A 18 27.751 6.234 -5.554 1.00 11.10 O ATOM 200 CB ARG A 18 27.293 4.022 -7.033 1.00 12.57 C ATOM 201 CG ARG A 18 26.846 2.721 -7.766 1.00 12.97 C ATOM 202 CD ARG A 18 27.557 1.474 -7.258 1.00 14.73 C ATOM 203 NE ARG A 18 28.977 1.620 -7.512 1.00 14.48 N ATOM 204 CZ ARG A 18 29.841 0.616 -7.469 1.00 16.97 C ATOM 205 NH1 ARG A 18 29.410 -0.597 -7.180 1.00 18.31 N ATOM 206 NH2 ARG A 18 31.069 0.828 -7.753 1.00 14.85 N ATOM 207 HE ARG A 18 29.339 2.568 -7.741 1.00 0.00 H ATOM 208 HH12 ARG A 18 30.080 -1.392 -7.144 1.00 0.00 H ATOM 209 HH11 ARG A 18 28.401 -0.758 -6.989 1.00 0.00 H ATOM 210 HH22 ARG A 18 31.753 0.045 -7.721 1.00 0.00 H ATOM 211 HH21 ARG A 18 31.385 1.784 -8.016 1.00 0.00 H ATOM 212 H ARG A 18 24.947 5.288 -7.108 1.00 0.00 H ATOM 213 N TYR A 19 26.468 5.572 -3.804 1.00 10.46 N ATOM 214 CA TYR A 19 26.749 6.812 -3.081 1.00 10.36 C ATOM 215 C TYR A 19 28.190 6.928 -2.579 1.00 11.27 C ATOM 216 O TYR A 19 28.680 8.047 -2.442 1.00 10.33 O ATOM 217 CB TYR A 19 25.788 6.999 -1.912 1.00 11.77 C ATOM 218 CG TYR A 19 24.375 7.192 -2.464 1.00 12.97 C ATOM 219 CD1 TYR A 19 24.024 8.386 -3.092 1.00 12.99 C ATOM 220 CD2 TYR A 19 23.430 6.128 -2.439 1.00 16.80 C ATOM 221 CE1 TYR A 19 22.749 8.577 -3.612 1.00 17.79 C ATOM 222 CE2 TYR A 19 22.148 6.350 -2.986 1.00 22.33 C ATOM 223 CZ TYR A 19 21.834 7.564 -3.513 1.00 20.49 C ATOM 224 OH TYR A 19 20.597 7.799 -4.052 1.00 24.84 O ATOM 225 HH TYR A 19 19.904 7.662 -3.358 1.00 0.00 H ATOM 226 H TYR A 19 25.920 4.805 -3.365 1.00 0.00 H ATOM 227 N GLU A 20 28.856 5.835 -2.243 1.00 10.47 N ATOM 228 CA GLU A 20 30.296 5.889 -1.887 1.00 11.04 C ATOM 229 C GLU A 20 31.095 6.453 -3.089 1.00 10.50 C ATOM 230 O GLU A 20 31.950 7.294 -2.928 1.00 9.31 O ATOM 231 CB GLU A 20 30.827 4.504 -1.520 1.00 11.70 C ATOM 232 CG GLU A 20 32.269 4.575 -1.183 1.00 13.06 C ATOM 233 CD GLU A 20 32.927 3.249 -0.778 1.00 23.56 C ATOM 234 OE1 GLU A 20 32.836 2.207 -1.495 1.00 26.04 O ATOM 235 OE2 GLU A 20 33.551 3.284 0.282 1.00 26.42 O ATOM 236 H GLU A 20 28.361 4.921 -2.228 1.00 0.00 H ATOM 237 N ASP A 21 30.799 5.947 -4.290 1.00 9.84 N ATOM 238 CA ASP A 21 31.441 6.493 -5.499 1.00 9.66 C ATOM 239 C ASP A 21 31.097 7.982 -5.678 1.00 10.37 C ATOM 240 O ASP A 21 31.979 8.781 -6.038 1.00 10.03 O ATOM 241 CB ASP A 21 31.031 5.794 -6.776 1.00 9.21 C ATOM 242 CG ASP A 21 31.568 4.370 -6.914 1.00 11.23 C ATOM 243 OD1 ASP A 21 32.492 3.998 -6.149 1.00 12.83 O ATOM 244 OD2 ASP A 21 31.009 3.695 -7.832 1.00 13.60 O ATOM 245 H ASP A 21 30.115 5.168 -4.371 1.00 0.00 H ATOM 246 N MET A 22 29.854 8.351 -5.448 1.00 8.90 N ATOM 247 CA MET A 22 29.449 9.717 -5.713 1.00 7.76 C ATOM 248 C MET A 22 30.227 10.613 -4.751 1.00 9.04 C ATOM 249 O MET A 22 30.620 11.715 -5.129 1.00 9.40 O ATOM 250 CB MET A 22 27.978 9.825 -5.336 1.00 8.45 C ATOM 251 CG MET A 22 27.310 11.178 -5.741 1.00 8.40 C ATOM 252 SD MET A 22 25.608 11.187 -5.190 1.00 10.20 S ATOM 253 CE MET A 22 25.187 12.921 -5.735 1.00 9.13 C ATOM 254 H MET A 22 29.166 7.665 -5.078 1.00 0.00 H ATOM 255 N ALA A 23 30.367 10.140 -3.505 1.00 8.17 N ATOM 256 CA ALA A 23 31.057 10.974 -2.509 1.00 8.85 C ATOM 257 C ALA A 23 32.528 11.124 -2.863 1.00 8.85 C ATOM 258 O ALA A 23 33.107 12.215 -2.757 1.00 8.64 O ATOM 259 CB ALA A 23 30.876 10.347 -1.072 1.00 10.28 C ATOM 260 H ALA A 23 29.996 9.203 -3.248 1.00 0.00 H ATOM 261 N ALA A 24 33.160 10.038 -3.316 1.00 7.66 N ATOM 262 CA ALA A 24 34.554 10.132 -3.700 1.00 8.85 C ATOM 263 C ALA A 24 34.733 11.068 -4.929 1.00 8.51 C ATOM 264 O ALA A 24 35.778 11.789 -4.975 1.00 8.70 O ATOM 265 CB ALA A 24 35.108 8.704 -4.054 1.00 9.21 C ATOM 266 H ALA A 24 32.655 9.132 -3.393 1.00 0.00 H ATOM 267 N PHE A 25 33.770 11.037 -5.865 1.00 7.59 N ATOM 268 CA PHE A 25 33.865 11.944 -7.037 1.00 9.14 C ATOM 269 C PHE A 25 33.722 13.375 -6.546 1.00 9.42 C ATOM 270 O PHE A 25 34.485 14.255 -6.975 1.00 8.78 O ATOM 271 CB PHE A 25 32.786 11.625 -8.079 1.00 7.95 C ATOM 272 CG PHE A 25 33.012 10.321 -8.755 1.00 9.34 C ATOM 273 CD1 PHE A 25 31.908 9.509 -9.017 1.00 7.89 C ATOM 274 CD2 PHE A 25 34.277 9.986 -9.246 1.00 12.46 C ATOM 275 CE1 PHE A 25 32.080 8.268 -9.726 1.00 9.32 C ATOM 276 CE2 PHE A 25 34.459 8.780 -9.974 1.00 10.72 C ATOM 277 CZ PHE A 25 33.379 7.937 -10.209 1.00 11.68 C ATOM 278 H PHE A 25 32.966 10.384 -5.770 1.00 0.00 H ATOM 279 N MET A 26 32.772 13.583 -5.623 1.00 8.23 N ATOM 280 CA MET A 26 32.594 14.969 -5.163 1.00 7.14 C ATOM 281 C MET A 26 33.740 15.471 -4.273 1.00 9.28 C ATOM 282 O MET A 26 34.086 16.674 -4.324 1.00 8.67 O ATOM 283 CB MET A 26 31.284 15.134 -4.393 1.00 8.39 C ATOM 284 CG MET A 26 30.029 15.042 -5.373 1.00 8.86 C ATOM 285 SD MET A 26 30.154 16.147 -6.833 1.00 10.89 S ATOM 286 CE MET A 26 30.328 17.792 -6.042 1.00 10.49 C ATOM 287 H MET A 26 32.191 12.805 -5.251 1.00 0.00 H ATOM 288 N LYS A 27 34.358 14.584 -3.495 1.00 6.50 N ATOM 289 CA LYS A 27 35.556 14.952 -2.733 1.00 8.02 C ATOM 290 C LYS A 27 36.624 15.384 -3.743 1.00 9.73 C ATOM 291 O LYS A 27 37.301 16.393 -3.515 1.00 7.99 O ATOM 292 CB LYS A 27 36.015 13.756 -1.886 1.00 7.97 C ATOM 293 CG LYS A 27 37.340 14.070 -1.092 1.00 8.41 C ATOM 294 CD LYS A 27 37.636 12.906 -0.094 1.00 11.40 C ATOM 295 CE LYS A 27 38.872 13.192 0.791 1.00 15.27 C ATOM 296 NZ LYS A 27 40.150 13.134 -0.003 1.00 20.62 N ATOM 297 HZ1 LYS A 27 40.256 12.186 -0.418 1.00 0.00 H ATOM 298 HZ2 LYS A 27 40.118 13.845 -0.762 1.00 0.00 H ATOM 299 HZ3 LYS A 27 40.956 13.331 0.624 1.00 0.00 H ATOM 300 H LYS A 27 33.985 13.615 -3.427 1.00 0.00 H ATOM 301 N GLY A 28 36.824 14.574 -4.809 1.00 9.46 N ATOM 302 CA GLY A 28 37.812 14.954 -5.831 1.00 9.39 C ATOM 303 C GLY A 28 37.478 16.344 -6.387 1.00 9.59 C ATOM 304 O GLY A 28 38.375 17.167 -6.596 1.00 7.42 O ATOM 305 H GLY A 28 36.284 13.690 -4.905 1.00 0.00 H ATOM 306 N ALA A 29 36.204 16.593 -6.677 1.00 8.54 N ATOM 307 CA ALA A 29 35.813 17.883 -7.246 1.00 8.89 C ATOM 308 C ALA A 29 36.145 19.039 -6.270 1.00 8.64 C ATOM 309 O ALA A 29 36.668 20.096 -6.663 1.00 9.87 O ATOM 310 CB ALA A 29 34.314 17.886 -7.655 1.00 8.11 C ATOM 311 H ALA A 29 35.482 15.867 -6.498 1.00 0.00 H ATOM 312 N VAL A 30 35.807 18.838 -5.031 1.00 7.99 N ATOM 313 CA VAL A 30 36.103 19.896 -4.051 1.00 7.98 C ATOM 314 C VAL A 30 37.609 20.155 -4.029 1.00 9.46 C ATOM 315 O VAL A 30 38.054 21.314 -3.919 1.00 8.88 O ATOM 316 CB VAL A 30 35.615 19.468 -2.647 1.00 6.26 C ATOM 317 CG1 VAL A 30 36.164 20.442 -1.571 1.00 6.46 C ATOM 318 CG2 VAL A 30 34.100 19.542 -2.608 1.00 8.61 C ATOM 319 H VAL A 30 35.341 17.955 -4.740 1.00 0.00 H ATOM 320 N GLU A 31 38.385 19.075 -4.038 1.00 7.38 N ATOM 321 CA GLU A 31 39.849 19.220 -3.868 1.00 9.03 C ATOM 322 C GLU A 31 40.518 19.840 -5.105 1.00 7.91 C ATOM 323 O GLU A 31 41.668 20.240 -5.024 1.00 9.38 O ATOM 324 CB GLU A 31 40.504 17.869 -3.605 1.00 9.91 C ATOM 325 CG GLU A 31 40.128 17.477 -2.154 1.00 10.17 C ATOM 326 CD GLU A 31 40.594 16.076 -1.727 1.00 14.16 C ATOM 327 OE1 GLU A 31 41.077 15.323 -2.546 1.00 21.39 O ATOM 328 OE2 GLU A 31 40.399 15.814 -0.544 1.00 17.17 O ATOM 329 H GLU A 31 37.965 18.132 -4.164 1.00 0.00 H ATOM 330 N LYS A 32 39.745 20.054 -6.166 1.00 8.10 N ATOM 331 CA LYS A 32 40.266 20.908 -7.233 1.00 9.61 C ATOM 332 C LYS A 32 40.485 22.355 -6.817 1.00 9.43 C ATOM 333 O LYS A 32 41.232 23.074 -7.524 1.00 9.12 O ATOM 334 CB LYS A 32 39.419 20.865 -8.468 1.00 10.88 C ATOM 335 CG LYS A 32 39.181 19.461 -9.074 1.00 11.21 C ATOM 336 CD LYS A 32 40.551 18.918 -9.522 1.00 10.44 C ATOM 337 CE LYS A 32 40.229 17.496 -10.130 1.00 12.01 C ATOM 338 NZ LYS A 32 41.574 16.841 -10.527 1.00 13.46 N ATOM 339 HZ1 LYS A 32 42.054 17.437 -11.232 1.00 0.00 H ATOM 340 HZ2 LYS A 32 42.175 16.747 -9.683 1.00 0.00 H ATOM 341 HZ3 LYS A 32 41.394 15.900 -10.932 1.00 0.00 H ATOM 342 H LYS A 32 38.799 19.627 -6.235 1.00 0.00 H ATOM 343 N GLY A 33 39.820 22.789 -5.732 1.00 9.97 N ATOM 344 CA GLY A 33 40.181 24.097 -5.134 1.00 10.31 C ATOM 345 C GLY A 33 39.224 25.215 -5.568 1.00 12.07 C ATOM 346 O GLY A 33 39.298 26.366 -5.011 1.00 13.73 O ATOM 347 H GLY A 33 39.060 22.213 -5.316 1.00 0.00 H ATOM 348 N GLU A 34 38.395 24.957 -6.588 1.00 10.60 N ATOM 349 CA GLU A 34 37.426 25.949 -7.050 1.00 11.30 C ATOM 350 C GLU A 34 36.162 25.927 -6.134 1.00 12.21 C ATOM 351 O GLU A 34 35.822 24.907 -5.574 1.00 13.18 O ATOM 352 CB GLU A 34 36.972 25.730 -8.510 1.00 13.46 C ATOM 353 CG GLU A 34 38.132 25.792 -9.514 1.00 17.62 C ATOM 354 CD GLU A 34 38.821 27.237 -9.685 1.00 31.00 C ATOM 355 OE2 GLU A 34 38.202 28.324 -9.391 1.00 31.98 O ATOM 356 H GLU A 34 38.442 24.032 -7.061 1.00 0.00 H ATOM 357 N GLU A 35 35.506 27.071 -5.989 1.00 11.64 N ATOM 358 CA GLU A 35 34.213 27.083 -5.237 1.00 12.75 C ATOM 359 C GLU A 35 33.165 26.205 -5.954 1.00 12.20 C ATOM 360 O GLU A 35 33.289 25.898 -7.155 1.00 13.18 O ATOM 361 CB GLU A 35 33.656 28.523 -5.135 1.00 12.38 C ATOM 362 CG GLU A 35 34.750 29.377 -4.275 1.00 12.55 C ATOM 363 CD GLU A 35 34.348 30.799 -3.915 1.00 20.18 C ATOM 364 OE1 GLU A 35 33.186 31.081 -3.751 1.00 24.10 O ATOM 365 OE2 GLU A 35 35.201 31.668 -3.728 1.00 18.69 O ATOM 366 H GLU A 35 35.887 27.950 -6.394 1.00 0.00 H ATOM 367 N LEU A 36 32.140 25.735 -5.223 1.00 8.80 N ATOM 368 CA LEU A 36 31.111 24.878 -5.789 1.00 8.53 C ATOM 369 C LEU A 36 29.865 25.691 -6.103 1.00 8.23 C ATOM 370 O LEU A 36 29.491 26.599 -5.306 1.00 10.27 O ATOM 371 CB LEU A 36 30.710 23.815 -4.740 1.00 9.77 C ATOM 372 CG LEU A 36 31.795 22.828 -4.243 1.00 9.62 C ATOM 373 CD1 LEU A 36 31.190 21.813 -3.275 1.00 7.63 C ATOM 374 CD2 LEU A 36 32.435 22.084 -5.422 1.00 14.52 C ATOM 375 H LEU A 36 32.081 25.993 -4.217 1.00 0.00 H ATOM 376 N SER A 37 29.265 25.394 -7.235 1.00 9.46 N ATOM 377 CA SER A 37 27.957 25.999 -7.558 1.00 8.66 C ATOM 378 C SER A 37 26.807 25.445 -6.644 1.00 9.61 C ATOM 379 O SER A 37 26.996 24.487 -5.895 1.00 9.27 O ATOM 380 CB SER A 37 27.642 25.693 -8.995 1.00 10.40 C ATOM 381 OG SER A 37 27.308 24.294 -9.149 1.00 11.44 O ATOM 382 HG SER A 37 27.103 24.108 -10.099 1.00 0.00 H ATOM 383 H SER A 37 29.712 24.733 -7.903 1.00 0.00 H HETATM 384 N CSO A 38 25.604 26.024 -6.701 1.00 9.43 N HETATM 385 CA CSO A 38 24.480 25.495 -5.934 1.00 9.71 C HETATM 386 C CSO A 38 24.244 23.992 -6.238 1.00 10.05 C HETATM 387 O CSO A 38 24.113 23.147 -5.303 1.00 11.43 O HETATM 388 CB CSO A 38 23.224 26.397 -6.278 1.00 15.08 C HETATM 389 SG CSO A 38 21.873 25.835 -5.326 1.00 21.01 S HETATM 390 OD CSO A 38 20.997 24.593 -6.291 1.00 21.95 O HETATM 391 HD CSO A 38 20.224 24.258 -5.771 1.00 0.00 H HETATM 392 H CSO A 38 25.467 26.863 -7.300 1.00 0.00 H ATOM 393 N GLU A 39 24.228 23.638 -7.507 1.00 9.91 N ATOM 394 CA GLU A 39 23.956 22.269 -7.914 1.00 11.28 C ATOM 395 C GLU A 39 25.053 21.362 -7.342 1.00 10.95 C ATOM 396 O GLU A 39 24.792 20.272 -6.844 1.00 10.26 O ATOM 397 CB GLU A 39 23.958 22.139 -9.435 1.00 14.50 C ATOM 398 CG GLU A 39 23.635 20.713 -9.854 1.00 13.77 C ATOM 399 CD GLU A 39 23.376 20.589 -11.405 1.00 28.06 C ATOM 400 OE1 GLU A 39 23.654 21.586 -12.141 1.00 28.51 O ATOM 401 OE2 GLU A 39 22.866 19.503 -11.855 1.00 30.09 O ATOM 402 H GLU A 39 24.415 24.356 -8.236 1.00 0.00 H ATOM 403 N GLU A 40 26.283 21.800 -7.475 1.00 8.13 N ATOM 404 CA GLU A 40 27.439 20.988 -6.974 1.00 8.10 C ATOM 405 C GLU A 40 27.441 20.836 -5.432 1.00 9.27 C ATOM 406 O GLU A 40 27.751 19.736 -4.916 1.00 9.30 O ATOM 407 CB GLU A 40 28.747 21.691 -7.351 1.00 8.38 C ATOM 408 CG GLU A 40 28.921 21.611 -8.898 1.00 9.42 C ATOM 409 CD GLU A 40 29.949 22.524 -9.434 1.00 9.50 C ATOM 410 OE1 GLU A 40 30.507 23.346 -8.696 1.00 10.42 O ATOM 411 OE2 GLU A 40 30.202 22.512 -10.674 1.00 13.48 O ATOM 412 H GLU A 40 26.457 22.718 -7.932 1.00 0.00 H ATOM 413 N ARG A 41 27.077 21.920 -4.693 1.00 8.45 N ATOM 414 CA ARG A 41 26.949 21.761 -3.236 1.00 10.05 C ATOM 415 C ARG A 41 25.872 20.708 -2.922 1.00 9.46 C ATOM 416 O ARG A 41 26.055 19.887 -2.021 1.00 9.13 O ATOM 417 CB ARG A 41 26.515 23.092 -2.572 1.00 9.15 C ATOM 418 CG ARG A 41 27.563 24.039 -2.714 1.00 10.07 C ATOM 419 CD ARG A 41 27.249 25.286 -1.869 1.00 10.23 C ATOM 420 NE ARG A 41 26.001 26.050 -2.201 1.00 10.42 N ATOM 421 CZ ARG A 41 26.028 27.104 -3.067 1.00 11.15 C ATOM 422 NH1 ARG A 41 27.138 27.400 -3.780 1.00 11.70 N ATOM 423 NH2 ARG A 41 24.900 27.835 -3.252 1.00 12.77 N ATOM 424 HE ARG A 41 25.100 25.771 -1.763 1.00 0.00 H ATOM 425 HH12 ARG A 41 27.136 28.208 -4.434 1.00 0.00 H ATOM 426 HH11 ARG A 41 27.994 26.819 -3.674 1.00 0.00 H ATOM 427 HH22 ARG A 41 24.905 28.641 -3.909 1.00 0.00 H ATOM 428 HH21 ARG A 41 24.031 27.589 -2.737 1.00 0.00 H ATOM 429 H ARG A 41 26.894 22.838 -5.147 1.00 0.00 H ATOM 430 N ASN A 42 24.774 20.728 -3.659 1.00 8.83 N ATOM 431 CA ASN A 42 23.780 19.703 -3.408 1.00 11.68 C ATOM 432 C ASN A 42 24.265 18.301 -3.697 1.00 10.18 C ATOM 433 O ASN A 42 23.916 17.389 -2.937 1.00 10.09 O ATOM 434 CB ASN A 42 22.467 20.136 -4.093 1.00 12.90 C ATOM 435 CG ASN A 42 21.815 21.292 -3.233 1.00 18.77 C ATOM 436 OD1 ASN A 42 21.296 21.014 -2.131 1.00 27.71 O ATOM 437 ND2 ASN A 42 21.979 22.554 -3.634 1.00 29.78 N ATOM 438 HD22 ASN A 42 22.414 22.754 -4.557 1.00 0.00 H ATOM 439 HD21 ASN A 42 21.671 23.338 -3.023 1.00 0.00 H ATOM 440 H ASN A 42 24.629 21.452 -4.391 1.00 0.00 H ATOM 441 N LEU A 43 25.091 18.126 -4.741 1.00 10.25 N ATOM 442 CA LEU A 43 25.645 16.814 -5.042 1.00 9.13 C ATOM 443 C LEU A 43 26.522 16.345 -3.877 1.00 11.33 C ATOM 444 O LEU A 43 26.455 15.173 -3.458 1.00 10.06 O ATOM 445 CB LEU A 43 26.511 16.829 -6.343 1.00 9.82 C ATOM 446 CG LEU A 43 25.598 16.984 -7.555 1.00 10.11 C ATOM 447 CD1 LEU A 43 26.527 17.251 -8.782 1.00 10.39 C ATOM 448 CD2 LEU A 43 24.735 15.814 -7.830 1.00 12.83 C ATOM 449 H LEU A 43 25.338 18.938 -5.342 1.00 0.00 H ATOM 450 N LEU A 44 27.348 17.244 -3.390 1.00 9.76 N ATOM 451 CA LEU A 44 28.267 16.918 -2.257 1.00 10.34 C ATOM 452 C LEU A 44 27.436 16.461 -1.038 1.00 11.96 C ATOM 453 O LEU A 44 27.738 15.457 -0.405 1.00 10.47 O ATOM 454 CB LEU A 44 29.071 18.200 -1.919 1.00 9.89 C ATOM 455 CG LEU A 44 30.039 17.997 -0.699 1.00 11.62 C ATOM 456 CD1 LEU A 44 31.172 17.003 -1.017 1.00 8.72 C ATOM 457 CD2 LEU A 44 30.533 19.369 -0.199 1.00 10.62 C ATOM 458 H LEU A 44 27.362 18.199 -3.800 1.00 0.00 H ATOM 459 N SER A 45 26.386 17.211 -0.714 1.00 10.65 N ATOM 460 CA SER A 45 25.561 16.918 0.459 1.00 10.82 C ATOM 461 C SER A 45 24.817 15.628 0.298 1.00 11.00 C ATOM 462 O SER A 45 24.833 14.790 1.175 1.00 11.79 O ATOM 463 CB SER A 45 24.559 18.042 0.634 1.00 12.50 C ATOM 464 OG SER A 45 23.688 17.773 1.733 1.00 9.43 O ATOM 465 HG SER A 45 23.198 16.929 1.565 1.00 0.00 H ATOM 466 H SER A 45 26.145 18.028 -1.311 1.00 0.00 H ATOM 467 N VAL A 46 24.183 15.435 -0.851 1.00 8.58 N ATOM 468 CA VAL A 46 23.476 14.141 -1.091 1.00 9.72 C ATOM 469 C VAL A 46 24.416 12.929 -0.952 1.00 10.12 C ATOM 470 O VAL A 46 24.008 11.927 -0.335 1.00 10.96 O ATOM 471 CB VAL A 46 22.880 14.127 -2.499 1.00 10.94 C ATOM 472 CG1 VAL A 46 22.421 12.686 -2.994 1.00 13.95 C ATOM 473 CG2 VAL A 46 21.731 15.124 -2.552 1.00 13.98 C ATOM 474 H VAL A 46 24.178 16.178 -1.579 1.00 0.00 H ATOM 475 N ALA A 47 25.624 13.027 -1.512 1.00 9.78 N ATOM 476 CA ALA A 47 26.555 11.881 -1.531 1.00 9.75 C ATOM 477 C ALA A 47 26.865 11.500 -0.089 1.00 9.21 C ATOM 478 O ALA A 47 26.693 10.320 0.313 1.00 9.12 O ATOM 479 CB ALA A 47 27.858 12.206 -2.290 1.00 7.81 C ATOM 480 H ALA A 47 25.915 13.928 -1.943 1.00 0.00 H ATOM 481 N TYR A 48 27.345 12.458 0.660 1.00 8.65 N ATOM 482 CA TYR A 48 27.786 12.107 2.025 1.00 9.22 C ATOM 483 C TYR A 48 26.625 11.841 2.961 1.00 9.82 C ATOM 484 O TYR A 48 26.764 11.014 3.867 1.00 9.86 O ATOM 485 CB TYR A 48 28.691 13.223 2.570 1.00 9.56 C ATOM 486 CG TYR A 48 30.115 13.051 2.044 1.00 6.81 C ATOM 487 CD1 TYR A 48 30.993 12.007 2.526 1.00 6.45 C ATOM 488 CD2 TYR A 48 30.616 13.914 1.098 1.00 10.29 C ATOM 489 CE1 TYR A 48 32.287 11.892 2.012 1.00 9.27 C ATOM 490 CE2 TYR A 48 31.973 13.779 0.610 1.00 11.64 C ATOM 491 CZ TYR A 48 32.757 12.775 1.092 1.00 9.88 C ATOM 492 OH TYR A 48 34.013 12.591 0.670 1.00 11.30 O ATOM 493 HH TYR A 48 34.407 11.814 1.140 1.00 0.00 H ATOM 494 H TYR A 48 27.414 13.434 0.307 1.00 0.00 H ATOM 495 N LYS A 49 25.454 12.442 2.717 1.00 9.09 N ATOM 496 CA LYS A 49 24.334 12.158 3.591 1.00 9.53 C ATOM 497 C LYS A 49 23.919 10.696 3.426 1.00 10.79 C ATOM 498 O LYS A 49 23.627 10.046 4.413 1.00 11.32 O ATOM 499 CB LYS A 49 23.174 13.123 3.363 1.00 9.17 C ATOM 500 CG LYS A 49 22.107 13.050 4.417 1.00 6.79 C ATOM 501 CD LYS A 49 22.599 13.476 5.772 1.00 2.00 C ATOM 502 CE LYS A 49 21.428 13.794 6.652 1.00 4.38 C ATOM 503 NZ LYS A 49 20.406 12.730 6.585 1.00 2.00 N ATOM 504 HZ1 LYS A 49 20.070 12.635 5.605 1.00 0.00 H ATOM 505 HZ2 LYS A 49 20.823 11.830 6.898 1.00 0.00 H ATOM 506 HZ3 LYS A 49 19.608 12.978 7.204 1.00 0.00 H ATOM 507 H LYS A 49 25.350 13.099 1.917 1.00 0.00 H ATOM 508 N ASN A 50 23.929 10.192 2.197 1.00 10.13 N ATOM 509 CA ASN A 50 23.615 8.789 1.988 1.00 9.41 C ATOM 510 C ASN A 50 24.672 7.897 2.569 1.00 10.18 C ATOM 511 O ASN A 50 24.303 6.856 3.176 1.00 11.10 O ATOM 512 CB ASN A 50 23.434 8.493 0.508 1.00 9.32 C ATOM 513 CG ASN A 50 22.085 8.861 0.035 1.00 15.94 C ATOM 514 OD1 ASN A 50 21.153 8.047 0.096 1.00 17.54 O ATOM 515 ND2 ASN A 50 21.934 10.074 -0.520 1.00 14.81 N ATOM 516 HD22 ASN A 50 22.737 10.734 -0.555 1.00 0.00 H ATOM 517 HD21 ASN A 50 21.014 10.354 -0.915 1.00 0.00 H ATOM 518 H ASN A 50 24.161 10.800 1.386 1.00 0.00 H ATOM 519 N VAL A 51 25.968 8.247 2.418 1.00 9.33 N ATOM 520 CA VAL A 51 27.008 7.375 2.932 1.00 9.45 C ATOM 521 C VAL A 51 26.920 7.311 4.474 1.00 11.13 C ATOM 522 O VAL A 51 26.866 6.210 5.050 1.00 10.58 O ATOM 523 CB VAL A 51 28.390 7.848 2.546 1.00 9.31 C ATOM 524 CG1 VAL A 51 29.502 7.091 3.348 1.00 12.58 C ATOM 525 CG2 VAL A 51 28.562 7.551 1.010 1.00 10.18 C ATOM 526 H VAL A 51 26.219 9.134 1.937 1.00 0.00 H ATOM 527 N VAL A 52 26.940 8.461 5.128 1.00 9.63 N ATOM 528 CA VAL A 52 26.859 8.458 6.593 1.00 9.63 C ATOM 529 C VAL A 52 25.526 7.965 7.060 1.00 9.14 C ATOM 530 O VAL A 52 25.463 7.373 8.163 1.00 11.19 O ATOM 531 CB VAL A 52 27.166 9.823 7.275 1.00 8.98 C ATOM 532 CG1 VAL A 52 27.178 9.660 8.782 1.00 10.67 C ATOM 533 CG2 VAL A 52 28.510 10.301 6.868 1.00 9.82 C ATOM 534 H VAL A 52 27.012 9.359 4.608 1.00 0.00 H ATOM 535 N GLY A 53 24.425 8.112 6.243 1.00 10.03 N ATOM 536 CA GLY A 53 23.130 7.616 6.710 1.00 12.02 C ATOM 537 C GLY A 53 23.151 6.088 6.878 1.00 13.89 C ATOM 538 O GLY A 53 22.611 5.557 7.858 1.00 12.91 O ATOM 539 H GLY A 53 24.513 8.567 5.312 1.00 0.00 H ATOM 540 N GLY A 54 23.733 5.420 5.899 1.00 12.69 N ATOM 541 CA GLY A 54 23.956 4.002 5.997 1.00 12.70 C ATOM 542 C GLY A 54 24.772 3.622 7.238 1.00 12.15 C ATOM 543 O GLY A 54 24.402 2.604 7.901 1.00 12.01 O ATOM 544 H GLY A 54 24.035 5.927 5.043 1.00 0.00 H ATOM 545 N GLN A 55 25.860 4.350 7.496 1.00 10.50 N ATOM 546 CA GLN A 55 26.725 4.017 8.595 1.00 11.01 C ATOM 547 C GLN A 55 25.963 4.231 9.900 1.00 10.88 C ATOM 548 O GLN A 55 26.097 3.401 10.837 1.00 11.42 O ATOM 549 CB GLN A 55 28.004 4.833 8.622 1.00 10.60 C ATOM 550 CG GLN A 55 28.856 4.613 7.328 1.00 12.82 C ATOM 551 CD GLN A 55 29.972 5.585 7.267 1.00 14.77 C ATOM 552 OE1 GLN A 55 29.766 6.789 7.462 1.00 13.77 O ATOM 553 NE2 GLN A 55 31.173 5.098 7.024 1.00 15.03 N ATOM 554 HE22 GLN A 55 31.298 4.078 6.866 1.00 0.00 H ATOM 555 HE21 GLN A 55 31.995 5.734 6.990 1.00 0.00 H ATOM 556 H GLN A 55 26.085 5.168 6.895 1.00 0.00 H ATOM 557 N ARG A 56 25.198 5.320 9.983 1.00 9.43 N ATOM 558 CA ARG A 56 24.425 5.628 11.201 1.00 9.48 C ATOM 559 C ARG A 56 23.393 4.537 11.463 1.00 9.76 C ATOM 560 O ARG A 56 23.264 4.084 12.584 1.00 11.64 O ATOM 561 CB ARG A 56 23.722 6.979 11.130 1.00 9.91 C ATOM 562 CG ARG A 56 24.780 8.114 11.111 1.00 11.54 C ATOM 563 CD ARG A 56 24.124 9.426 10.652 1.00 12.23 C ATOM 564 NE ARG A 56 23.159 9.935 11.630 1.00 11.98 N ATOM 565 CZ ARG A 56 22.107 10.674 11.284 1.00 14.18 C ATOM 566 NH1 ARG A 56 21.816 10.889 9.995 1.00 13.96 N ATOM 567 NH2 ARG A 56 21.373 11.215 12.249 1.00 13.86 N ATOM 568 HE ARG A 56 23.302 9.710 12.635 1.00 0.00 H ATOM 569 HH12 ARG A 56 20.991 11.468 9.738 1.00 0.00 H ATOM 570 HH11 ARG A 56 22.415 10.477 9.251 1.00 0.00 H ATOM 571 HH22 ARG A 56 20.545 11.797 12.009 1.00 0.00 H ATOM 572 HH21 ARG A 56 21.626 11.057 13.245 1.00 0.00 H ATOM 573 H ARG A 56 25.145 5.967 9.170 1.00 0.00 H ATOM 574 N ALA A 57 22.717 4.083 10.429 1.00 12.08 N ATOM 575 CA ALA A 57 21.665 3.093 10.657 1.00 11.24 C ATOM 576 C ALA A 57 22.329 1.802 11.114 1.00 10.35 C ATOM 577 O ALA A 57 21.814 1.095 11.991 1.00 11.16 O ATOM 578 CB ALA A 57 20.927 2.840 9.325 1.00 12.41 C ATOM 579 H ALA A 57 22.927 4.422 9.468 1.00 0.00 H ATOM 580 N ALA A 58 23.467 1.444 10.517 1.00 9.58 N ATOM 581 CA ALA A 58 24.167 0.237 10.949 1.00 11.77 C ATOM 582 C ALA A 58 24.688 0.342 12.380 1.00 11.11 C ATOM 583 O ALA A 58 24.592 -0.598 13.187 1.00 11.86 O ATOM 584 CB ALA A 58 25.341 -0.093 9.998 1.00 12.64 C ATOM 585 H ALA A 58 23.855 2.023 9.745 1.00 0.00 H ATOM 586 N TRP A 59 25.276 1.501 12.705 1.00 10.61 N ATOM 587 CA TRP A 59 25.778 1.703 14.053 1.00 11.28 C ATOM 588 C TRP A 59 24.620 1.563 15.069 1.00 12.22 C ATOM 589 O TRP A 59 24.831 0.982 16.162 1.00 12.08 O ATOM 590 CB TRP A 59 26.426 3.096 14.154 1.00 10.40 C ATOM 591 CG TRP A 59 27.050 3.364 15.517 1.00 7.62 C ATOM 592 CD1 TRP A 59 28.348 3.213 15.868 1.00 9.50 C ATOM 593 CD2 TRP A 59 26.378 3.923 16.660 1.00 8.46 C ATOM 594 NE1 TRP A 59 28.514 3.565 17.208 1.00 9.55 N ATOM 595 CE2 TRP A 59 27.341 4.034 17.699 1.00 10.51 C ATOM 596 CE3 TRP A 59 25.065 4.361 16.886 1.00 10.60 C ATOM 597 CZ2 TRP A 59 27.037 4.554 18.969 1.00 13.63 C ATOM 598 CZ3 TRP A 59 24.725 4.862 18.185 1.00 11.52 C ATOM 599 CH2 TRP A 59 25.721 4.930 19.199 1.00 14.09 C ATOM 600 HE1 TRP A 59 29.400 3.481 17.746 1.00 0.00 H ATOM 601 H TRP A 59 25.373 2.254 11.994 1.00 0.00 H ATOM 602 N ARG A 60 23.420 2.044 14.709 1.00 12.39 N ATOM 603 CA ARG A 60 22.295 1.960 15.646 1.00 12.65 C ATOM 604 C ARG A 60 21.893 0.526 15.885 1.00 13.27 C ATOM 605 O ARG A 60 21.651 0.122 17.036 1.00 13.96 O ATOM 606 CB ARG A 60 21.093 2.766 15.125 1.00 11.65 C ATOM 607 CG ARG A 60 21.471 4.244 15.005 1.00 9.52 C ATOM 608 CD ARG A 60 20.189 5.094 14.798 1.00 8.20 C ATOM 609 NE ARG A 60 19.582 4.916 13.493 1.00 13.30 N ATOM 610 CZ ARG A 60 19.828 5.715 12.448 1.00 16.79 C ATOM 611 NH1 ARG A 60 20.665 6.735 12.598 1.00 21.12 N ATOM 612 NH2 ARG A 60 19.228 5.537 11.277 1.00 15.02 N ATOM 613 HE ARG A 60 18.920 4.125 13.362 1.00 0.00 H ATOM 614 HH12 ARG A 60 20.866 7.365 11.795 1.00 0.00 H ATOM 615 HH11 ARG A 60 21.119 6.904 13.518 1.00 0.00 H ATOM 616 HH22 ARG A 60 19.439 6.174 10.482 1.00 0.00 H ATOM 617 HH21 ARG A 60 18.547 4.761 11.154 1.00 0.00 H ATOM 618 H ARG A 60 23.289 2.474 13.771 1.00 0.00 H ATOM 619 N VAL A 61 21.850 -0.243 14.802 1.00 12.85 N ATOM 620 CA VAL A 61 21.544 -1.719 14.933 1.00 11.69 C ATOM 621 C VAL A 61 22.545 -2.387 15.852 1.00 13.46 C ATOM 622 O VAL A 61 22.152 -3.125 16.829 1.00 14.52 O ATOM 623 CB VAL A 61 21.552 -2.396 13.535 1.00 12.28 C ATOM 624 CG1 VAL A 61 21.549 -3.988 13.719 1.00 13.12 C ATOM 625 CG2 VAL A 61 20.350 -1.891 12.751 1.00 14.18 C ATOM 626 H VAL A 61 22.027 0.170 13.864 1.00 0.00 H ATOM 627 N LEU A 62 23.847 -2.148 15.617 1.00 10.68 N ATOM 628 CA LEU A 62 24.918 -2.794 16.386 1.00 11.90 C ATOM 629 C LEU A 62 24.927 -2.318 17.841 1.00 14.45 C ATOM 630 O LEU A 62 25.160 -3.122 18.775 1.00 15.96 O ATOM 631 CB LEU A 62 26.323 -2.571 15.756 1.00 11.60 C ATOM 632 CG LEU A 62 26.305 -3.147 14.314 1.00 11.39 C ATOM 633 CD1 LEU A 62 27.581 -2.690 13.653 1.00 13.81 C ATOM 634 CD2 LEU A 62 26.302 -4.739 14.292 1.00 11.18 C ATOM 635 H LEU A 62 24.105 -1.481 14.862 1.00 0.00 H ATOM 636 N SER A 63 24.689 -1.020 18.052 1.00 13.85 N ATOM 637 CA SER A 63 24.694 -0.502 19.435 1.00 14.97 C ATOM 638 C SER A 63 23.528 -1.110 20.232 1.00 15.76 C ATOM 639 O SER A 63 23.680 -1.394 21.462 1.00 17.74 O ATOM 640 CB SER A 63 24.645 1.038 19.411 1.00 14.16 C ATOM 641 OG SER A 63 24.667 1.597 20.726 1.00 12.00 O ATOM 642 HG SER A 63 25.499 1.322 21.187 1.00 0.00 H ATOM 643 H SER A 63 24.503 -0.382 17.252 1.00 0.00 H ATOM 644 N SER A 64 22.388 -1.307 19.579 1.00 17.34 N ATOM 645 CA SER A 64 21.195 -1.904 20.203 1.00 17.86 C ATOM 646 C SER A 64 21.524 -3.315 20.629 1.00 18.76 C ATOM 647 O SER A 64 21.199 -3.725 21.735 1.00 19.82 O ATOM 648 CB SER A 64 20.027 -2.002 19.236 1.00 17.49 C ATOM 649 OG SER A 64 18.886 -2.565 19.875 1.00 16.29 O ATOM 650 HG SER A 64 19.107 -3.473 20.202 1.00 0.00 H ATOM 651 H SER A 64 22.335 -1.026 18.579 1.00 0.00 H ATOM 652 N ILE A 65 22.154 -4.047 19.721 1.00 18.18 N ATOM 653 CA ILE A 65 22.563 -5.456 20.032 1.00 18.52 C ATOM 654 C ILE A 65 23.561 -5.472 21.166 1.00 20.16 C ATOM 655 O ILE A 65 23.466 -6.341 22.083 1.00 22.62 O ATOM 656 CB ILE A 65 23.073 -6.205 18.794 1.00 17.37 C ATOM 657 CG1 ILE A 65 22.009 -6.316 17.719 1.00 15.08 C ATOM 658 CG2 ILE A 65 23.782 -7.559 19.177 1.00 17.82 C ATOM 659 CD1 ILE A 65 22.576 -6.708 16.306 1.00 16.54 C ATOM 660 H ILE A 65 22.366 -3.642 18.787 1.00 0.00 H ATOM 661 N GLU A 66 24.517 -4.541 21.161 1.00 18.64 N ATOM 662 CA GLU A 66 25.555 -4.510 22.168 1.00 20.42 C ATOM 663 C GLU A 66 24.908 -4.206 23.532 1.00 24.11 C ATOM 664 O GLU A 66 25.261 -4.851 24.566 1.00 24.65 O ATOM 665 CB GLU A 66 26.624 -3.487 21.779 1.00 19.92 C ATOM 666 CG GLU A 66 27.779 -3.403 22.734 1.00 19.95 C ATOM 667 CD GLU A 66 28.730 -2.287 22.353 1.00 16.70 C ATOM 668 OE1 GLU A 66 28.290 -1.447 21.499 1.00 20.75 O ATOM 669 OE2 GLU A 66 29.859 -2.255 22.892 1.00 17.27 O ATOM 670 H GLU A 66 24.516 -3.818 20.413 1.00 0.00 H ATOM 671 N GLN A 67 23.939 -3.291 23.533 1.00 25.60 N ATOM 672 CA GLN A 67 23.263 -2.927 24.796 1.00 30.69 C ATOM 673 C GLN A 67 22.502 -4.103 25.378 1.00 32.81 C ATOM 674 O GLN A 67 22.632 -4.357 26.609 1.00 33.56 O ATOM 675 CB GLN A 67 22.308 -1.736 24.621 1.00 30.63 C ATOM 676 CG GLN A 67 23.052 -0.385 24.366 1.00 35.86 C ATOM 677 CD GLN A 67 24.380 -0.221 25.166 1.00 47.68 C ATOM 678 OE1 GLN A 67 24.389 -0.281 26.421 1.00 52.54 O ATOM 679 NE2 GLN A 67 25.501 0.008 24.447 1.00 50.11 N ATOM 680 HE22 GLN A 67 25.453 0.051 23.409 1.00 0.00 H ATOM 681 HE21 GLN A 67 26.411 0.142 24.932 1.00 0.00 H ATOM 682 H GLN A 67 23.658 -2.832 22.643 1.00 0.00 H ATOM 683 N CYS A 68 21.722 -4.799 24.546 1.00 34.95 N ATOM 684 CA CYS A 68 21.068 -6.082 24.919 1.00 40.21 C ATOM 685 C CYS A 68 22.057 -7.049 25.591 1.00 41.64 C ATOM 686 O CYS A 68 21.752 -7.624 26.658 1.00 42.32 O ATOM 687 CB CYS A 68 20.437 -6.792 23.715 1.00 38.76 C ATOM 688 SG CYS A 68 18.802 -6.156 23.122 1.00 53.63 S ATOM 689 H CYS A 68 21.564 -4.425 23.589 1.00 0.00 H ATOM 690 N SER A 69 23.231 -7.231 24.993 1.00 42.54 N ATOM 691 CA SER A 69 24.278 -8.115 25.530 1.00 43.57 C ATOM 692 C SER A 69 24.846 -7.648 26.877 1.00 44.61 C ATOM 693 O SER A 69 25.453 -8.434 27.617 1.00 45.21 O ATOM 694 CB SER A 69 25.425 -8.276 24.525 1.00 43.37 C ATOM 695 OG SER A 69 26.371 -7.233 24.667 1.00 40.63 O ATOM 696 HG SER A 69 25.927 -6.363 24.508 1.00 0.00 H ATOM 697 H SER A 69 23.418 -6.725 24.104 1.00 0.00 H ATOM 698 N ASN A 70 24.679 -6.360 27.194 1.00 45.68 N ATOM 699 CA ASN A 70 25.155 -5.803 28.462 1.00 46.88 C ATOM 700 C ASN A 70 24.066 -5.716 29.535 1.00 46.81 C ATOM 701 O ASN A 70 23.159 -6.556 29.587 1.00 47.97 O ATOM 702 CB ASN A 70 25.808 -4.421 28.246 1.00 47.10 C ATOM 703 CG ASN A 70 27.163 -4.508 27.514 1.00 49.33 C ATOM 704 OD1 ASN A 70 27.880 -5.502 27.632 1.00 51.92 O ATOM 705 ND2 ASN A 70 27.528 -3.440 26.790 1.00 46.69 N ATOM 706 HD22 ASN A 70 26.892 -2.620 26.716 1.00 0.00 H ATOM 707 HD21 ASN A 70 28.447 -3.432 26.303 1.00 0.00 H ATOM 708 H ASN A 70 24.196 -5.734 26.519 1.00 0.00 H TER 709 ASN A 70 ATOM 710 N GLY A 78 31.306 -12.621 24.178 1.00 25.94 N ATOM 711 CA GLY A 78 32.710 -12.304 23.858 1.00 22.61 C ATOM 712 C GLY A 78 32.761 -10.900 23.297 1.00 20.35 C ATOM 713 O GLY A 78 31.779 -10.188 23.363 1.00 21.79 O ATOM 714 HN3 GLY A 78 30.732 -12.560 23.313 1.00 0.00 H ATOM 715 HN2 GLY A 78 30.950 -11.942 24.880 1.00 0.00 H ATOM 716 HN1 GLY A 78 31.249 -13.584 24.566 1.00 0.00 H ATOM 717 N PRO A 79 33.910 -10.532 22.722 1.00 18.98 N ATOM 718 CA PRO A 79 34.172 -9.173 22.359 1.00 17.30 C ATOM 719 C PRO A 79 33.634 -8.798 20.983 1.00 17.10 C ATOM 720 O PRO A 79 33.795 -7.647 20.601 1.00 15.21 O ATOM 721 CB PRO A 79 35.720 -9.101 22.355 1.00 18.48 C ATOM 722 CG PRO A 79 36.110 -10.518 21.897 1.00 20.78 C ATOM 723 CD PRO A 79 35.055 -11.408 22.506 1.00 19.68 C ATOM 724 N GLU A 80 33.033 -9.739 20.259 1.00 14.99 N ATOM 725 CA GLU A 80 32.784 -9.481 18.841 1.00 14.19 C ATOM 726 C GLU A 80 31.788 -8.342 18.557 1.00 12.77 C ATOM 727 O GLU A 80 31.956 -7.569 17.594 1.00 12.85 O ATOM 728 CB GLU A 80 32.240 -10.771 18.168 1.00 13.39 C ATOM 729 CG GLU A 80 33.303 -11.901 17.999 1.00 16.26 C ATOM 730 CD GLU A 80 33.466 -12.778 19.240 1.00 22.20 C ATOM 731 OE1 GLU A 80 32.805 -12.558 20.301 1.00 20.26 O ATOM 732 OE2 GLU A 80 34.234 -13.740 19.144 1.00 18.41 O ATOM 733 H GLU A 80 32.746 -10.640 20.693 1.00 0.00 H ATOM 734 N VAL A 81 30.695 -8.258 19.323 1.00 13.55 N ATOM 735 CA VAL A 81 29.694 -7.242 19.014 1.00 14.54 C ATOM 736 C VAL A 81 30.350 -5.891 19.250 1.00 13.99 C ATOM 737 O VAL A 81 30.168 -4.936 18.432 1.00 14.09 O ATOM 738 CB VAL A 81 28.412 -7.365 19.943 1.00 17.75 C ATOM 739 CG1 VAL A 81 27.459 -6.263 19.514 1.00 22.08 C ATOM 740 CG2 VAL A 81 27.687 -8.732 19.667 1.00 19.24 C ATOM 741 H VAL A 81 30.561 -8.906 20.125 1.00 0.00 H ATOM 742 N ARG A 82 31.030 -5.756 20.381 1.00 13.14 N ATOM 743 CA ARG A 82 31.742 -4.492 20.666 1.00 13.72 C ATOM 744 C ARG A 82 32.764 -4.194 19.578 1.00 12.29 C ATOM 745 O ARG A 82 32.849 -3.066 19.067 1.00 13.09 O ATOM 746 CB ARG A 82 32.404 -4.499 22.065 1.00 13.86 C ATOM 747 CG ARG A 82 33.239 -3.252 22.307 1.00 19.11 C ATOM 748 CD ARG A 82 34.101 -3.286 23.586 1.00 22.93 C ATOM 749 NE ARG A 82 34.976 -4.456 23.587 1.00 30.49 N ATOM 750 CZ ARG A 82 36.118 -4.642 22.886 1.00 33.44 C ATOM 751 NH1 ARG A 82 36.653 -3.723 22.080 1.00 35.56 N ATOM 752 NH2 ARG A 82 36.762 -5.807 23.002 1.00 35.81 N ATOM 753 HE ARG A 82 34.685 -5.242 24.202 1.00 0.00 H ATOM 754 HH12 ARG A 82 37.535 -3.930 21.569 1.00 0.00 H ATOM 755 HH11 ARG A 82 36.188 -2.800 21.963 1.00 0.00 H ATOM 756 HH22 ARG A 82 37.642 -5.970 22.472 1.00 0.00 H ATOM 757 HH21 ARG A 82 36.384 -6.551 23.623 1.00 0.00 H ATOM 758 H ARG A 82 31.062 -6.538 21.066 1.00 0.00 H ATOM 759 N GLU A 83 33.558 -5.203 19.184 1.00 11.19 N ATOM 760 CA GLU A 83 34.584 -5.003 18.131 1.00 10.72 C ATOM 761 C GLU A 83 33.952 -4.481 16.815 1.00 10.34 C ATOM 762 O GLU A 83 34.481 -3.504 16.234 1.00 11.89 O ATOM 763 CB GLU A 83 35.304 -6.326 17.860 1.00 11.21 C ATOM 764 CG GLU A 83 36.301 -6.589 18.998 1.00 10.52 C ATOM 765 CD GLU A 83 36.901 -8.003 18.884 1.00 17.23 C ATOM 766 OE1 GLU A 83 36.482 -8.710 17.972 1.00 13.32 O ATOM 767 OE2 GLU A 83 37.799 -8.335 19.698 1.00 16.85 O ATOM 768 H GLU A 83 33.452 -6.139 19.624 1.00 0.00 H ATOM 769 N TYR A 84 32.840 -5.077 16.420 1.00 10.31 N ATOM 770 CA TYR A 84 32.324 -4.748 15.108 1.00 10.91 C ATOM 771 C TYR A 84 31.551 -3.402 15.185 1.00 11.90 C ATOM 772 O TYR A 84 31.657 -2.588 14.257 1.00 10.68 O ATOM 773 CB TYR A 84 31.418 -5.867 14.644 1.00 10.99 C ATOM 774 CG TYR A 84 30.886 -5.631 13.239 1.00 8.99 C ATOM 775 CD1 TYR A 84 31.745 -5.269 12.212 1.00 10.29 C ATOM 776 CD2 TYR A 84 29.499 -5.778 13.018 1.00 8.61 C ATOM 777 CE1 TYR A 84 31.219 -5.027 10.935 1.00 9.61 C ATOM 778 CE2 TYR A 84 28.942 -5.550 11.776 1.00 12.73 C ATOM 779 CZ TYR A 84 29.860 -5.144 10.767 1.00 10.68 C ATOM 780 OH TYR A 84 29.343 -4.879 9.555 1.00 13.61 O ATOM 781 HH TYR A 84 30.070 -4.608 8.940 1.00 0.00 H ATOM 782 H TYR A 84 32.351 -5.761 17.033 1.00 0.00 H ATOM 783 N ARG A 85 30.861 -3.177 16.324 1.00 10.38 N ATOM 784 CA ARG A 85 30.285 -1.797 16.517 1.00 9.18 C ATOM 785 C ARG A 85 31.413 -0.722 16.469 1.00 10.00 C ATOM 786 O ARG A 85 31.273 0.337 15.825 1.00 10.17 O ATOM 787 CB ARG A 85 29.516 -1.760 17.851 1.00 12.21 C ATOM 788 CG ARG A 85 28.725 -0.410 18.049 1.00 11.42 C ATOM 789 CD ARG A 85 29.571 0.615 18.745 1.00 12.09 C ATOM 790 NE ARG A 85 30.021 0.164 20.091 1.00 12.14 N ATOM 791 CZ ARG A 85 31.065 0.616 20.764 1.00 17.18 C ATOM 792 NH1 ARG A 85 31.835 1.641 20.315 1.00 17.25 N ATOM 793 NH2 ARG A 85 31.361 0.019 21.956 1.00 18.04 N ATOM 794 HE ARG A 85 29.457 -0.581 20.547 1.00 0.00 H ATOM 795 HH12 ARG A 85 32.648 1.965 20.877 1.00 0.00 H ATOM 796 HH11 ARG A 85 31.612 2.101 19.410 1.00 0.00 H ATOM 797 HH22 ARG A 85 32.175 0.347 22.514 1.00 0.00 H ATOM 798 HH21 ARG A 85 30.773 -0.764 22.306 1.00 0.00 H ATOM 799 H ARG A 85 30.733 -3.923 17.037 1.00 0.00 H ATOM 800 N GLU A 86 32.563 -0.968 17.096 1.00 9.57 N ATOM 801 CA GLU A 86 33.699 -0.065 17.008 1.00 10.49 C ATOM 802 C GLU A 86 34.258 0.102 15.589 1.00 10.85 C ATOM 803 O GLU A 86 34.644 1.173 15.235 1.00 12.80 O ATOM 804 CB GLU A 86 34.822 -0.471 17.954 1.00 11.40 C ATOM 805 CG GLU A 86 34.446 -0.523 19.447 1.00 10.16 C ATOM 806 CD GLU A 86 35.626 -1.017 20.330 1.00 16.81 C ATOM 807 OE1 GLU A 86 35.788 -0.570 21.498 1.00 19.12 O ATOM 808 OE2 GLU A 86 36.385 -1.877 19.855 1.00 18.67 O ATOM 809 H GLU A 86 32.651 -1.833 17.666 1.00 0.00 H ATOM 810 N LYS A 87 34.261 -0.967 14.794 1.00 11.17 N ATOM 811 CA LYS A 87 34.760 -0.858 13.396 1.00 11.05 C ATOM 812 C LYS A 87 33.835 0.091 12.605 1.00 12.58 C ATOM 813 O LYS A 87 34.333 1.020 11.944 1.00 12.45 O ATOM 814 CB LYS A 87 34.623 -2.243 12.779 1.00 11.70 C ATOM 815 CG LYS A 87 35.057 -2.251 11.259 1.00 16.48 C ATOM 816 CD LYS A 87 34.744 -3.685 10.620 1.00 22.16 C ATOM 817 CE LYS A 87 34.759 -3.723 9.077 1.00 28.16 C ATOM 818 NZ LYS A 87 36.226 -3.507 8.789 1.00 33.05 N ATOM 819 HZ1 LYS A 87 36.524 -2.592 9.183 1.00 0.00 H ATOM 820 HZ2 LYS A 87 36.780 -4.271 9.226 1.00 0.00 H ATOM 821 HZ3 LYS A 87 36.380 -3.510 7.761 1.00 0.00 H ATOM 822 H LYS A 87 33.914 -1.880 15.151 1.00 0.00 H ATOM 823 N VAL A 88 32.526 -0.155 12.725 1.00 10.54 N ATOM 824 CA VAL A 88 31.510 0.640 11.997 1.00 11.11 C ATOM 825 C VAL A 88 31.597 2.083 12.540 1.00 9.69 C ATOM 826 O VAL A 88 31.613 3.043 11.729 1.00 10.07 O ATOM 827 CB VAL A 88 30.120 0.132 12.164 1.00 9.58 C ATOM 828 CG1 VAL A 88 29.129 1.114 11.524 1.00 12.49 C ATOM 829 CG2 VAL A 88 29.974 -1.262 11.420 1.00 11.05 C ATOM 830 H VAL A 88 32.212 -0.927 13.347 1.00 0.00 H ATOM 831 N GLU A 89 31.716 2.242 13.847 1.00 9.27 N ATOM 832 CA GLU A 89 31.864 3.582 14.467 1.00 9.91 C ATOM 833 C GLU A 89 33.083 4.364 13.939 1.00 11.14 C ATOM 834 O GLU A 89 33.021 5.563 13.633 1.00 11.85 O ATOM 835 CB GLU A 89 31.885 3.396 15.984 1.00 9.67 C ATOM 836 CG GLU A 89 31.994 4.745 16.752 1.00 10.22 C ATOM 837 CD GLU A 89 31.892 4.475 18.234 1.00 11.02 C ATOM 838 OE1 GLU A 89 30.913 3.908 18.664 1.00 11.71 O ATOM 839 OE2 GLU A 89 32.841 4.910 18.919 1.00 14.24 O ATOM 840 H GLU A 89 31.706 1.402 14.460 1.00 0.00 H ATOM 841 N THR A 90 34.197 3.660 13.808 1.00 11.00 N ATOM 842 CA THR A 90 35.447 4.284 13.343 1.00 9.14 C ATOM 843 C THR A 90 35.268 4.751 11.896 1.00 7.67 C ATOM 844 O THR A 90 35.821 5.827 11.508 1.00 11.03 O ATOM 845 CB THR A 90 36.629 3.268 13.543 1.00 11.50 C ATOM 846 OG1 THR A 90 36.796 3.128 14.985 1.00 14.08 O ATOM 847 CG2 THR A 90 37.898 3.896 13.000 1.00 15.74 C ATOM 848 HG1 THR A 90 37.011 4.011 15.378 1.00 0.00 H ATOM 849 H THR A 90 34.189 2.646 14.038 1.00 0.00 H ATOM 850 N GLU A 91 34.588 3.920 11.088 1.00 8.62 N ATOM 851 CA GLU A 91 34.456 4.235 9.678 1.00 8.75 C ATOM 852 C GLU A 91 33.495 5.437 9.565 1.00 10.21 C ATOM 853 O GLU A 91 33.745 6.328 8.760 1.00 9.52 O ATOM 854 CB GLU A 91 33.948 3.044 8.844 1.00 10.92 C ATOM 855 CG GLU A 91 34.952 1.914 8.816 1.00 9.43 C ATOM 856 CD GLU A 91 34.519 0.725 7.990 1.00 17.50 C ATOM 857 OE1 GLU A 91 35.264 -0.294 8.016 1.00 17.52 O ATOM 858 OE2 GLU A 91 33.477 0.792 7.337 1.00 14.09 O ATOM 859 H GLU A 91 34.158 3.054 11.472 1.00 0.00 H ATOM 860 N LEU A 92 32.453 5.443 10.392 1.00 10.26 N ATOM 861 CA LEU A 92 31.545 6.604 10.457 1.00 12.29 C ATOM 862 C LEU A 92 32.303 7.890 10.829 1.00 12.11 C ATOM 863 O LEU A 92 32.136 8.956 10.190 1.00 11.18 O ATOM 864 CB LEU A 92 30.443 6.301 11.475 1.00 11.85 C ATOM 865 CG LEU A 92 29.458 7.412 11.803 1.00 14.49 C ATOM 866 CD1 LEU A 92 28.989 8.049 10.524 1.00 15.29 C ATOM 867 CD2 LEU A 92 28.332 6.841 12.622 1.00 15.51 C ATOM 868 H LEU A 92 32.276 4.618 11.001 1.00 0.00 H ATOM 869 N GLN A 93 33.131 7.830 11.876 1.00 11.34 N ATOM 870 CA GLN A 93 33.910 8.990 12.318 1.00 11.67 C ATOM 871 C GLN A 93 34.819 9.419 11.223 1.00 9.43 C ATOM 872 O GLN A 93 35.030 10.611 11.005 1.00 12.46 O ATOM 873 CB GLN A 93 34.670 8.655 13.575 1.00 10.56 C ATOM 874 CG GLN A 93 33.694 8.487 14.766 1.00 9.93 C ATOM 875 CD GLN A 93 34.431 7.895 15.978 1.00 17.99 C ATOM 876 OE1 GLN A 93 35.286 6.981 15.828 1.00 12.44 O ATOM 877 NE2 GLN A 93 34.053 8.340 17.182 1.00 14.23 N ATOM 878 HE22 GLN A 93 33.344 9.097 17.258 1.00 0.00 H ATOM 879 HE21 GLN A 93 34.469 7.929 18.042 1.00 0.00 H ATOM 880 H GLN A 93 33.226 6.933 12.393 1.00 0.00 H ATOM 881 N GLY A 94 35.378 8.446 10.491 1.00 9.12 N ATOM 882 CA GLY A 94 36.232 8.823 9.355 1.00 10.04 C ATOM 883 C GLY A 94 35.536 9.617 8.295 1.00 10.29 C ATOM 884 O GLY A 94 36.117 10.538 7.730 1.00 10.31 O ATOM 885 H GLY A 94 35.211 7.446 10.721 1.00 0.00 H ATOM 886 N VAL A 95 34.329 9.229 7.960 1.00 8.69 N ATOM 887 CA VAL A 95 33.498 9.926 6.927 1.00 9.42 C ATOM 888 C VAL A 95 33.155 11.306 7.456 1.00 9.07 C ATOM 889 O VAL A 95 33.353 12.277 6.719 1.00 9.49 O ATOM 890 CB VAL A 95 32.218 9.151 6.586 1.00 9.31 C ATOM 891 CG1 VAL A 95 31.314 10.027 5.688 1.00 11.96 C ATOM 892 CG2 VAL A 95 32.618 7.882 5.804 1.00 11.22 C ATOM 893 H VAL A 95 33.929 8.395 8.436 1.00 0.00 H ATOM 894 N CYS A 96 32.786 11.401 8.749 1.00 8.79 N ATOM 895 CA CYS A 96 32.511 12.759 9.289 1.00 8.10 C ATOM 896 C CYS A 96 33.784 13.622 9.246 1.00 9.12 C ATOM 897 O CYS A 96 33.710 14.825 8.897 1.00 9.19 O ATOM 898 CB CYS A 96 31.931 12.738 10.716 1.00 9.47 C ATOM 899 SG CYS A 96 30.386 11.897 10.804 1.00 10.70 S ATOM 900 H CYS A 96 32.697 10.555 9.347 1.00 0.00 H ATOM 901 N ASP A 97 34.932 13.068 9.686 1.00 7.76 N ATOM 902 CA ASP A 97 36.202 13.822 9.647 1.00 10.09 C ATOM 903 C ASP A 97 36.570 14.261 8.229 1.00 9.63 C ATOM 904 O ASP A 97 37.039 15.373 8.042 1.00 9.07 O ATOM 905 CB ASP A 97 37.319 12.988 10.252 1.00 10.64 C ATOM 906 CG ASP A 97 37.202 12.827 11.757 1.00 17.16 C ATOM 907 OD1 ASP A 97 36.453 13.537 12.439 1.00 19.35 O ATOM 908 OD2 ASP A 97 37.974 11.944 12.257 1.00 19.39 O ATOM 909 H ASP A 97 34.923 12.097 10.058 1.00 0.00 H ATOM 910 N THR A 98 36.235 13.434 7.234 1.00 9.48 N ATOM 911 CA THR A 98 36.532 13.790 5.833 1.00 9.23 C ATOM 912 C THR A 98 35.661 15.003 5.397 1.00 7.60 C ATOM 913 O THR A 98 36.204 15.938 4.805 1.00 8.18 O ATOM 914 CB THR A 98 36.231 12.604 4.911 1.00 11.34 C ATOM 915 OG1 THR A 98 37.242 11.582 5.148 1.00 12.64 O ATOM 916 CG2 THR A 98 36.214 13.041 3.385 1.00 8.95 C ATOM 917 HG1 THR A 98 38.138 11.953 4.948 1.00 0.00 H ATOM 918 H THR A 98 35.762 12.533 7.449 1.00 0.00 H ATOM 919 N VAL A 99 34.370 14.927 5.717 1.00 9.14 N ATOM 920 CA VAL A 99 33.523 16.027 5.309 1.00 7.77 C ATOM 921 C VAL A 99 33.942 17.288 6.036 1.00 7.69 C ATOM 922 O VAL A 99 34.052 18.385 5.433 1.00 9.03 O ATOM 923 CB VAL A 99 32.035 15.689 5.677 1.00 6.52 C ATOM 924 CG1 VAL A 99 31.187 17.010 5.485 1.00 10.44 C ATOM 925 CG2 VAL A 99 31.516 14.519 4.728 1.00 6.66 C ATOM 926 H VAL A 99 33.987 14.112 6.238 1.00 0.00 H ATOM 927 N LEU A 100 34.154 17.196 7.362 1.00 6.81 N ATOM 928 CA LEU A 100 34.601 18.378 8.151 1.00 7.52 C ATOM 929 C LEU A 100 35.896 18.956 7.590 1.00 8.13 C ATOM 930 O LEU A 100 36.108 20.188 7.550 1.00 9.73 O ATOM 931 CB LEU A 100 34.760 18.083 9.663 1.00 6.14 C ATOM 932 CG LEU A 100 33.375 17.747 10.258 1.00 8.74 C ATOM 933 CD1 LEU A 100 33.566 17.125 11.637 1.00 9.56 C ATOM 934 CD2 LEU A 100 32.422 19.034 10.389 1.00 8.56 C ATOM 935 H LEU A 100 34.004 16.286 7.843 1.00 0.00 H ATOM 936 N GLY A 101 36.748 18.049 7.144 1.00 9.53 N ATOM 937 CA GLY A 101 38.020 18.475 6.507 1.00 10.32 C ATOM 938 C GLY A 101 37.825 19.225 5.197 1.00 11.57 C ATOM 939 O GLY A 101 38.532 20.215 4.977 1.00 10.62 O ATOM 940 H GLY A 101 36.527 17.037 7.239 1.00 0.00 H ATOM 941 N LEU A 102 36.846 18.839 4.387 1.00 9.28 N ATOM 942 CA LEU A 102 36.611 19.550 3.173 1.00 8.76 C ATOM 943 C LEU A 102 36.045 20.928 3.504 1.00 8.24 C ATOM 944 O LEU A 102 36.344 21.933 2.820 1.00 9.43 O ATOM 945 CB LEU A 102 35.608 18.808 2.311 1.00 9.62 C ATOM 946 CG LEU A 102 36.181 17.457 1.790 1.00 9.37 C ATOM 947 CD1 LEU A 102 35.004 16.785 1.109 1.00 12.86 C ATOM 948 CD2 LEU A 102 37.312 17.653 0.758 1.00 14.04 C ATOM 949 H LEU A 102 36.253 18.022 4.637 1.00 0.00 H ATOM 950 N LEU A 103 35.168 20.986 4.513 1.00 8.73 N ATOM 951 CA LEU A 103 34.608 22.296 4.849 1.00 8.01 C ATOM 952 C LEU A 103 35.682 23.211 5.400 1.00 9.77 C ATOM 953 O LEU A 103 35.651 24.403 5.111 1.00 11.34 O ATOM 954 CB LEU A 103 33.473 22.092 5.939 1.00 7.91 C ATOM 955 CG LEU A 103 32.325 21.285 5.384 1.00 8.78 C ATOM 956 CD1 LEU A 103 31.380 20.914 6.601 1.00 10.27 C ATOM 957 CD2 LEU A 103 31.470 22.067 4.334 1.00 10.91 C ATOM 958 H LEU A 103 34.894 20.132 5.039 1.00 0.00 H ATOM 959 N ASP A 104 36.640 22.680 6.180 1.00 9.35 N ATOM 960 CA ASP A 104 37.699 23.516 6.773 1.00 10.27 C ATOM 961 C ASP A 104 38.847 23.843 5.809 1.00 11.54 C ATOM 962 O ASP A 104 39.598 24.854 5.995 1.00 14.62 O ATOM 963 CB ASP A 104 38.261 22.810 8.063 1.00 12.48 C ATOM 964 CG ASP A 104 39.018 23.799 8.952 1.00 20.17 C ATOM 965 OD1 ASP A 104 38.456 24.914 9.300 1.00 26.35 O ATOM 966 OD2 ASP A 104 40.199 23.459 9.280 1.00 26.77 O ATOM 967 H ASP A 104 36.633 21.657 6.369 1.00 0.00 H ATOM 968 N SER A 105 38.959 23.028 4.770 1.00 11.59 N ATOM 969 CA SER A 105 40.015 23.181 3.747 1.00 12.82 C ATOM 970 C SER A 105 39.504 23.025 2.327 1.00 12.55 C ATOM 971 O SER A 105 39.721 21.963 1.730 1.00 14.60 O ATOM 972 CB SER A 105 41.112 22.141 4.062 1.00 14.11 C ATOM 973 OG SER A 105 41.618 22.315 5.411 1.00 19.22 O ATOM 974 HG SER A 105 42.003 23.222 5.503 1.00 0.00 H ATOM 975 H SER A 105 38.277 22.250 4.670 1.00 0.00 H ATOM 976 N HIS A 106 38.834 24.016 1.694 1.00 12.49 N ATOM 977 CA HIS A 106 38.713 25.358 2.245 1.00 12.80 C ATOM 978 C HIS A 106 37.349 25.918 1.928 1.00 11.64 C ATOM 979 O HIS A 106 37.182 27.133 1.689 1.00 11.87 O ATOM 980 CB HIS A 106 39.846 26.247 1.660 1.00 11.42 C ATOM 981 CG HIS A 106 41.174 25.829 2.146 1.00 12.86 C ATOM 982 ND1 HIS A 106 42.041 25.040 1.411 1.00 18.28 N ATOM 983 CD2 HIS A 106 41.792 26.092 3.335 1.00 9.69 C ATOM 984 CE1 HIS A 106 43.132 24.790 2.146 1.00 11.71 C ATOM 985 NE2 HIS A 106 43.004 25.428 3.309 1.00 16.67 N ATOM 986 H HIS A 106 38.388 23.811 0.777 1.00 0.00 H ATOM 987 N LEU A 107 36.321 25.044 1.994 1.00 10.86 N ATOM 988 CA LEU A 107 35.015 25.475 1.473 1.00 9.31 C ATOM 989 C LEU A 107 34.445 26.687 2.251 1.00 9.58 C ATOM 990 O LEU A 107 33.969 27.673 1.629 1.00 11.73 O ATOM 991 CB LEU A 107 33.984 24.311 1.516 1.00 8.64 C ATOM 992 CG LEU A 107 34.215 23.230 0.428 1.00 9.01 C ATOM 993 CD1 LEU A 107 33.388 22.076 0.754 1.00 10.75 C ATOM 994 CD2 LEU A 107 33.970 23.850 -1.024 1.00 9.81 C ATOM 995 H LEU A 107 36.449 24.095 2.401 1.00 0.00 H ATOM 996 N ILE A 108 34.430 26.623 3.553 1.00 10.37 N ATOM 997 CA ILE A 108 33.751 27.625 4.343 1.00 10.80 C ATOM 998 C ILE A 108 34.487 28.969 4.196 1.00 9.78 C ATOM 999 O ILE A 108 33.845 30.010 3.991 1.00 11.00 O ATOM 1000 CB ILE A 108 33.685 27.216 5.823 1.00 10.81 C ATOM 1001 CG1 ILE A 108 32.604 26.114 6.013 1.00 10.87 C ATOM 1002 CG2 ILE A 108 33.298 28.446 6.702 1.00 11.65 C ATOM 1003 CD1 ILE A 108 32.633 25.379 7.443 1.00 12.27 C ATOM 1004 H ILE A 108 34.915 25.837 4.032 1.00 0.00 H ATOM 1005 N LYS A 109 35.803 28.936 4.258 1.00 11.95 N ATOM 1006 CA LYS A 109 36.499 30.218 4.241 1.00 11.99 C ATOM 1007 C LYS A 109 36.342 30.950 2.926 1.00 13.24 C ATOM 1008 O LYS A 109 36.482 32.224 2.939 1.00 14.76 O ATOM 1009 CB LYS A 109 37.973 30.109 4.676 1.00 11.85 C ATOM 1010 CG LYS A 109 38.849 29.546 3.605 1.00 13.79 C ATOM 1011 CD LYS A 109 40.361 29.449 4.092 1.00 15.46 C ATOM 1012 CE LYS A 109 40.603 28.868 5.455 1.00 18.03 C ATOM 1013 NZ LYS A 109 40.385 27.369 5.428 1.00 17.04 N ATOM 1014 HZ1 LYS A 109 39.406 27.167 5.139 1.00 0.00 H ATOM 1015 HZ2 LYS A 109 41.044 26.936 4.750 1.00 0.00 H ATOM 1016 HZ3 LYS A 109 40.555 26.978 6.377 1.00 0.00 H ATOM 1017 H LYS A 109 36.322 28.037 4.316 1.00 0.00 H ATOM 1018 N GLU A 110 36.114 30.231 1.799 1.00 10.00 N ATOM 1019 CA GLU A 110 35.910 30.890 0.495 1.00 10.99 C ATOM 1020 C GLU A 110 34.431 31.283 0.263 1.00 13.50 C ATOM 1021 O GLU A 110 34.131 31.978 -0.738 1.00 14.15 O ATOM 1022 CB GLU A 110 36.489 30.074 -0.673 1.00 11.29 C ATOM 1023 CG GLU A 110 38.102 29.969 -0.533 1.00 13.97 C ATOM 1024 CD GLU A 110 38.756 31.407 -0.502 1.00 27.17 C ATOM 1025 OE1 GLU A 110 38.133 32.467 -0.918 1.00 26.78 O ATOM 1026 OE2 GLU A 110 39.940 31.511 -0.053 1.00 35.09 O ATOM 1027 H GLU A 110 36.082 29.193 1.855 1.00 0.00 H ATOM 1028 N ALA A 111 33.533 30.862 1.179 1.00 12.01 N ATOM 1029 CA ALA A 111 32.084 30.991 0.863 1.00 12.99 C ATOM 1030 C ALA A 111 31.641 32.340 1.410 1.00 13.03 C ATOM 1031 O ALA A 111 31.519 32.507 2.637 1.00 16.58 O ATOM 1032 CB ALA A 111 31.239 29.871 1.605 1.00 13.15 C ATOM 1033 H ALA A 111 33.846 30.457 2.084 1.00 0.00 H ATOM 1034 N GLY A 112 31.368 33.236 0.511 1.00 14.82 N ATOM 1035 CA GLY A 112 30.944 34.636 0.892 1.00 16.22 C ATOM 1036 C GLY A 112 29.465 34.928 0.760 1.00 17.08 C ATOM 1037 O GLY A 112 28.915 35.839 1.430 1.00 20.31 O ATOM 1038 H GLY A 112 31.443 32.985 -0.495 1.00 0.00 H ATOM 1039 N ASP A 113 28.797 34.237 -0.124 1.00 13.68 N ATOM 1040 CA ASP A 113 27.381 34.494 -0.296 1.00 13.69 C ATOM 1041 C ASP A 113 26.607 33.759 0.760 1.00 14.07 C ATOM 1042 O ASP A 113 27.016 32.694 1.215 1.00 14.34 O ATOM 1043 CB ASP A 113 26.908 34.032 -1.670 1.00 12.74 C ATOM 1044 CG ASP A 113 27.472 34.876 -2.783 1.00 14.09 C ATOM 1045 OD1 ASP A 113 28.170 35.871 -2.488 1.00 16.77 O ATOM 1046 OD2 ASP A 113 27.211 34.493 -3.967 1.00 13.98 O ATOM 1047 H ASP A 113 29.275 33.512 -0.697 1.00 0.00 H ATOM 1048 N ALA A 114 25.470 34.306 1.179 1.00 15.14 N ATOM 1049 CA ALA A 114 24.708 33.640 2.218 1.00 14.22 C ATOM 1050 C ALA A 114 24.291 32.232 1.855 1.00 14.69 C ATOM 1051 O ALA A 114 24.406 31.379 2.724 1.00 14.58 O ATOM 1052 CB ALA A 114 23.471 34.500 2.548 1.00 15.80 C ATOM 1053 H ALA A 114 25.132 35.199 0.767 1.00 0.00 H ATOM 1054 N GLU A 115 23.874 31.951 0.604 1.00 12.38 N ATOM 1055 CA GLU A 115 23.410 30.612 0.240 1.00 14.93 C ATOM 1056 C GLU A 115 24.531 29.603 0.395 1.00 13.32 C ATOM 1057 O GLU A 115 24.246 28.515 0.915 1.00 16.49 O ATOM 1058 CB GLU A 115 22.902 30.535 -1.197 1.00 16.37 C ATOM 1059 CG GLU A 115 21.649 31.441 -1.368 1.00 24.36 C ATOM 1060 CD GLU A 115 21.855 33.000 -1.088 1.00 34.54 C ATOM 1061 OE1 GLU A 115 20.830 33.567 -0.542 1.00 40.63 O ATOM 1062 OE2 GLU A 115 22.951 33.657 -1.385 1.00 28.36 O ATOM 1063 H GLU A 115 23.882 32.701 -0.117 1.00 0.00 H ATOM 1064 N SER A 116 25.765 29.982 0.083 1.00 12.24 N ATOM 1065 CA SER A 116 26.866 29.005 0.214 1.00 10.22 C ATOM 1066 C SER A 116 27.314 28.877 1.657 1.00 11.05 C ATOM 1067 O SER A 116 27.506 27.788 2.161 1.00 11.42 O ATOM 1068 CB SER A 116 28.051 29.311 -0.690 1.00 10.31 C ATOM 1069 OG SER A 116 28.543 30.623 -0.467 1.00 6.24 O ATOM 1070 HG SER A 116 27.826 31.279 -0.654 1.00 0.00 H ATOM 1071 H SER A 116 25.953 30.950 -0.248 1.00 0.00 H ATOM 1072 N ARG A 117 27.467 30.016 2.315 1.00 10.31 N ATOM 1073 CA ARG A 117 27.993 30.021 3.696 1.00 12.34 C ATOM 1074 C ARG A 117 27.052 29.323 4.664 1.00 12.92 C ATOM 1075 O ARG A 117 27.492 28.450 5.476 1.00 10.50 O ATOM 1076 CB ARG A 117 28.350 31.420 4.111 1.00 11.99 C ATOM 1077 CG ARG A 117 29.065 31.438 5.411 1.00 17.55 C ATOM 1078 CD ARG A 117 29.812 32.830 5.601 1.00 20.51 C ATOM 1079 NE ARG A 117 30.667 32.591 6.752 1.00 21.77 N ATOM 1080 CZ ARG A 117 31.923 32.155 6.683 1.00 22.49 C ATOM 1081 NH1 ARG A 117 32.541 32.013 5.474 1.00 19.73 N ATOM 1082 NH2 ARG A 117 32.583 31.921 7.849 1.00 26.76 N ATOM 1083 HE ARG A 117 30.270 32.773 7.696 1.00 0.00 H ATOM 1084 HH12 ARG A 117 33.522 31.672 5.429 1.00 0.00 H ATOM 1085 HH11 ARG A 117 32.030 32.246 4.598 1.00 0.00 H ATOM 1086 HH22 ARG A 117 33.565 31.580 7.831 1.00 0.00 H ATOM 1087 HH21 ARG A 117 32.105 32.083 8.758 1.00 0.00 H ATOM 1088 H ARG A 117 27.215 30.915 1.856 1.00 0.00 H ATOM 1089 N VAL A 118 25.736 29.624 4.556 1.00 7.84 N ATOM 1090 CA VAL A 118 24.775 28.932 5.420 1.00 7.36 C ATOM 1091 C VAL A 118 24.750 27.418 5.135 1.00 7.34 C ATOM 1092 O VAL A 118 24.728 26.615 6.053 1.00 8.90 O ATOM 1093 CB VAL A 118 23.368 29.561 5.261 1.00 8.98 C ATOM 1094 CG1 VAL A 118 22.365 28.689 6.056 1.00 8.90 C ATOM 1095 CG2 VAL A 118 23.378 31.023 5.776 1.00 11.31 C ATOM 1096 H VAL A 118 25.412 30.336 3.870 1.00 0.00 H ATOM 1097 N PHE A 119 24.794 27.041 3.840 1.00 8.32 N ATOM 1098 CA PHE A 119 24.778 25.630 3.464 1.00 8.49 C ATOM 1099 C PHE A 119 25.980 24.926 4.118 1.00 9.06 C ATOM 1100 O PHE A 119 25.783 23.843 4.724 1.00 9.44 O ATOM 1101 CB PHE A 119 24.945 25.547 1.964 1.00 9.20 C ATOM 1102 CG PHE A 119 24.790 24.146 1.428 1.00 12.76 C ATOM 1103 CD1 PHE A 119 25.895 23.308 1.304 1.00 17.25 C ATOM 1104 CD2 PHE A 119 23.510 23.715 1.044 1.00 17.23 C ATOM 1105 CE1 PHE A 119 25.719 21.949 0.790 1.00 14.03 C ATOM 1106 CE2 PHE A 119 23.366 22.423 0.486 1.00 19.18 C ATOM 1107 CZ PHE A 119 24.475 21.598 0.428 1.00 14.18 C ATOM 1108 H PHE A 119 24.840 27.768 3.097 1.00 0.00 H ATOM 1109 N TYR A 120 27.189 25.517 4.008 1.00 8.59 N ATOM 1110 CA TYR A 120 28.364 24.799 4.504 1.00 8.94 C ATOM 1111 C TYR A 120 28.364 24.783 6.016 1.00 7.97 C ATOM 1112 O TYR A 120 28.757 23.798 6.641 1.00 8.27 O ATOM 1113 CB TYR A 120 29.647 25.414 4.019 1.00 8.60 C ATOM 1114 CG TYR A 120 29.877 25.253 2.522 1.00 8.65 C ATOM 1115 CD1 TYR A 120 29.688 24.009 1.909 1.00 7.41 C ATOM 1116 CD2 TYR A 120 30.312 26.345 1.737 1.00 7.81 C ATOM 1117 CE1 TYR A 120 29.951 23.862 0.553 1.00 8.88 C ATOM 1118 CE2 TYR A 120 30.531 26.190 0.362 1.00 8.18 C ATOM 1119 CZ TYR A 120 30.350 24.982 -0.187 1.00 11.45 C ATOM 1120 OH TYR A 120 30.566 24.833 -1.539 1.00 10.07 O ATOM 1121 HH TYR A 120 31.504 25.068 -1.750 1.00 0.00 H ATOM 1122 H TYR A 120 27.283 26.461 3.581 1.00 0.00 H ATOM 1123 N LEU A 121 27.926 25.874 6.657 1.00 7.46 N ATOM 1124 CA LEU A 121 27.953 25.857 8.137 1.00 8.48 C ATOM 1125 C LEU A 121 26.877 24.895 8.677 1.00 8.69 C ATOM 1126 O LEU A 121 27.095 24.268 9.694 1.00 9.09 O ATOM 1127 CB LEU A 121 27.714 27.243 8.751 1.00 8.13 C ATOM 1128 CG LEU A 121 28.909 28.168 8.438 1.00 9.25 C ATOM 1129 CD1 LEU A 121 28.403 29.629 8.736 1.00 11.04 C ATOM 1130 CD2 LEU A 121 29.950 27.788 9.473 1.00 9.11 C ATOM 1131 H LEU A 121 27.579 26.703 6.134 1.00 0.00 H ATOM 1132 N LYS A 122 25.733 24.817 8.011 1.00 6.63 N ATOM 1133 CA LYS A 122 24.742 23.763 8.394 1.00 7.25 C ATOM 1134 C LYS A 122 25.372 22.393 8.274 1.00 9.62 C ATOM 1135 O LYS A 122 25.197 21.529 9.159 1.00 7.74 O ATOM 1136 CB LYS A 122 23.523 23.850 7.481 1.00 9.11 C ATOM 1137 CG LYS A 122 22.482 22.732 7.767 1.00 8.80 C ATOM 1138 CD LYS A 122 21.434 22.821 6.648 1.00 10.55 C ATOM 1139 CE LYS A 122 20.683 21.448 6.588 1.00 15.63 C ATOM 1140 NZ LYS A 122 21.542 20.279 6.045 1.00 14.48 N ATOM 1141 HZ1 LYS A 122 21.854 20.500 5.078 1.00 0.00 H ATOM 1142 HZ2 LYS A 122 22.373 20.147 6.657 1.00 0.00 H ATOM 1143 HZ3 LYS A 122 20.974 19.408 6.037 1.00 0.00 H ATOM 1144 H LYS A 122 25.528 25.478 7.235 1.00 0.00 H ATOM 1145 N MET A 123 26.080 22.159 7.166 1.00 8.25 N ATOM 1146 CA MET A 123 26.782 20.851 7.019 1.00 8.39 C ATOM 1147 C MET A 123 27.775 20.593 8.160 1.00 7.25 C ATOM 1148 O MET A 123 27.836 19.495 8.671 1.00 7.79 O ATOM 1149 CB MET A 123 27.526 20.848 5.676 1.00 8.55 C ATOM 1150 CG MET A 123 26.634 20.450 4.526 1.00 6.56 C ATOM 1151 SD MET A 123 27.584 19.936 3.032 1.00 12.14 S ATOM 1152 CE MET A 123 28.052 18.246 3.267 1.00 5.93 C ATOM 1153 H MET A 123 26.141 22.878 6.417 1.00 0.00 H ATOM 1154 N LYS A 124 28.576 21.600 8.540 1.00 7.16 N ATOM 1155 CA LYS A 124 29.515 21.464 9.630 1.00 6.92 C ATOM 1156 C LYS A 124 28.733 21.064 10.893 1.00 7.81 C ATOM 1157 O LYS A 124 29.126 20.163 11.601 1.00 7.56 O ATOM 1158 CB LYS A 124 30.241 22.816 9.806 1.00 6.52 C ATOM 1159 CG LYS A 124 31.270 22.779 10.979 1.00 6.90 C ATOM 1160 CD LYS A 124 32.170 24.007 10.935 1.00 11.87 C ATOM 1161 CE LYS A 124 33.218 24.000 12.046 1.00 17.23 C ATOM 1162 NZ LYS A 124 34.146 25.247 11.750 1.00 18.44 N ATOM 1163 HZ1 LYS A 124 34.582 25.138 10.812 1.00 0.00 H ATOM 1164 HZ2 LYS A 124 33.574 26.115 11.769 1.00 0.00 H ATOM 1165 HZ3 LYS A 124 34.890 25.304 12.475 1.00 0.00 H ATOM 1166 H LYS A 124 28.519 22.507 8.034 1.00 0.00 H ATOM 1167 N GLY A 125 27.622 21.723 11.148 1.00 8.23 N ATOM 1168 CA GLY A 125 26.767 21.372 12.336 1.00 7.58 C ATOM 1169 C GLY A 125 26.321 19.930 12.239 1.00 8.33 C ATOM 1170 O GLY A 125 26.339 19.191 13.220 1.00 7.90 O ATOM 1171 H GLY A 125 27.331 22.498 10.519 1.00 0.00 H ATOM 1172 N ASP A 126 25.812 19.520 11.052 1.00 6.83 N ATOM 1173 CA ASP A 126 25.257 18.173 10.906 1.00 7.18 C ATOM 1174 C ASP A 126 26.377 17.124 11.131 1.00 8.54 C ATOM 1175 O ASP A 126 26.113 16.089 11.802 1.00 6.76 O ATOM 1176 CB ASP A 126 24.793 18.016 9.450 1.00 5.63 C ATOM 1177 CG ASP A 126 23.488 18.764 9.119 1.00 9.06 C ATOM 1178 OD1 ASP A 126 22.740 19.091 10.080 1.00 10.40 O ATOM 1179 OD2 ASP A 126 23.257 18.970 7.895 1.00 10.12 O ATOM 1180 H ASP A 126 25.816 20.167 10.238 1.00 0.00 H ATOM 1181 N TYR A 127 27.586 17.346 10.597 1.00 9.18 N ATOM 1182 CA TYR A 127 28.588 16.264 10.729 1.00 8.21 C ATOM 1183 C TYR A 127 29.198 16.219 12.146 1.00 8.76 C ATOM 1184 O TYR A 127 29.542 15.148 12.609 1.00 9.02 O ATOM 1185 CB TYR A 127 29.666 16.239 9.576 1.00 9.36 C ATOM 1186 CG TYR A 127 28.986 15.729 8.347 1.00 6.99 C ATOM 1187 CD1 TYR A 127 28.170 16.574 7.533 1.00 7.57 C ATOM 1188 CD2 TYR A 127 29.055 14.369 8.040 1.00 8.37 C ATOM 1189 CE1 TYR A 127 27.461 16.080 6.444 1.00 6.79 C ATOM 1190 CE2 TYR A 127 28.340 13.867 6.917 1.00 8.98 C ATOM 1191 CZ TYR A 127 27.535 14.665 6.196 1.00 8.64 C ATOM 1192 OH TYR A 127 26.840 14.166 5.141 1.00 9.63 O ATOM 1193 HH TYR A 127 26.303 14.889 4.729 1.00 0.00 H ATOM 1194 H TYR A 127 27.810 18.238 10.112 1.00 0.00 H ATOM 1195 N TYR A 128 29.222 17.355 12.825 1.00 8.75 N ATOM 1196 CA TYR A 128 29.596 17.264 14.243 1.00 8.43 C ATOM 1197 C TYR A 128 28.466 16.591 15.007 1.00 7.81 C ATOM 1198 O TYR A 128 28.717 15.898 15.998 1.00 8.48 O ATOM 1199 CB TYR A 128 29.868 18.681 14.832 1.00 7.27 C ATOM 1200 CG TYR A 128 31.293 19.105 14.647 1.00 8.30 C ATOM 1201 CD1 TYR A 128 32.330 18.451 15.324 1.00 10.87 C ATOM 1202 CD2 TYR A 128 31.618 20.172 13.805 1.00 10.66 C ATOM 1203 CE1 TYR A 128 33.632 18.849 15.178 1.00 11.92 C ATOM 1204 CE2 TYR A 128 33.001 20.585 13.667 1.00 13.07 C ATOM 1205 CZ TYR A 128 33.954 19.876 14.338 1.00 12.51 C ATOM 1206 OH TYR A 128 35.331 20.219 14.244 1.00 15.87 O ATOM 1207 HH TYR A 128 35.622 20.156 13.300 1.00 0.00 H ATOM 1208 H TYR A 128 28.988 18.265 12.378 1.00 0.00 H ATOM 1209 N ARG A 129 27.204 16.853 14.604 1.00 7.45 N ATOM 1210 CA ARG A 129 26.091 16.195 15.250 1.00 8.06 C ATOM 1211 C ARG A 129 26.189 14.662 15.080 1.00 8.81 C ATOM 1212 O ARG A 129 25.967 13.931 16.035 1.00 7.68 O ATOM 1213 CB ARG A 129 24.730 16.720 14.744 1.00 8.96 C ATOM 1214 CG ARG A 129 23.501 15.814 15.182 1.00 7.77 C ATOM 1215 CD ARG A 129 22.233 16.663 15.050 1.00 8.35 C ATOM 1216 NE ARG A 129 22.006 17.080 13.643 1.00 8.46 N ATOM 1217 CZ ARG A 129 21.358 16.352 12.749 1.00 11.20 C ATOM 1218 NH1 ARG A 129 20.854 15.155 13.084 1.00 8.97 N ATOM 1219 NH2 ARG A 129 21.188 16.777 11.488 1.00 10.92 N ATOM 1220 HE ARG A 129 22.380 18.002 13.342 1.00 0.00 H ATOM 1221 HH12 ARG A 129 20.346 14.588 12.376 1.00 0.00 H ATOM 1222 HH11 ARG A 129 20.972 14.794 14.052 1.00 0.00 H ATOM 1223 HH22 ARG A 129 20.674 16.185 10.804 1.00 0.00 H ATOM 1224 HH21 ARG A 129 21.570 17.699 11.194 1.00 0.00 H ATOM 1225 H ARG A 129 27.033 17.527 13.830 1.00 0.00 H ATOM 1226 N TYR A 130 26.591 14.209 13.902 1.00 7.79 N ATOM 1227 CA TYR A 130 26.762 12.718 13.787 1.00 7.65 C ATOM 1228 C TYR A 130 27.911 12.207 14.618 1.00 9.26 C ATOM 1229 O TYR A 130 27.829 11.051 15.147 1.00 10.00 O ATOM 1230 CB TYR A 130 26.951 12.356 12.290 1.00 8.88 C ATOM 1231 CG TYR A 130 25.893 12.955 11.353 1.00 8.17 C ATOM 1232 CD1 TYR A 130 24.533 13.106 11.750 1.00 8.78 C ATOM 1233 CD2 TYR A 130 26.230 13.272 10.027 1.00 7.89 C ATOM 1234 CE1 TYR A 130 23.560 13.662 10.859 1.00 9.76 C ATOM 1235 CE2 TYR A 130 25.299 13.852 9.157 1.00 10.49 C ATOM 1236 CZ TYR A 130 23.952 14.019 9.587 1.00 10.93 C ATOM 1237 OH TYR A 130 23.076 14.624 8.742 1.00 12.62 O ATOM 1238 HH TYR A 130 22.185 14.671 9.171 1.00 0.00 H ATOM 1239 H TYR A 130 26.778 14.847 13.102 1.00 0.00 H ATOM 1240 N LEU A 131 29.002 12.955 14.714 1.00 8.53 N ATOM 1241 CA LEU A 131 30.053 12.615 15.667 1.00 9.09 C ATOM 1242 C LEU A 131 29.506 12.564 17.061 1.00 11.37 C ATOM 1243 O LEU A 131 29.893 11.676 17.865 1.00 11.16 O ATOM 1244 CB LEU A 131 31.232 13.565 15.624 1.00 8.45 C ATOM 1245 CG LEU A 131 32.094 13.476 14.323 1.00 8.58 C ATOM 1246 CD1 LEU A 131 33.165 14.558 14.314 1.00 9.42 C ATOM 1247 CD2 LEU A 131 32.763 12.046 14.222 1.00 10.36 C ATOM 1248 H LEU A 131 29.109 13.791 14.105 1.00 0.00 H ATOM 1249 N ALA A 132 28.664 13.523 17.403 1.00 9.80 N ATOM 1250 CA ALA A 132 28.174 13.519 18.835 1.00 11.09 C ATOM 1251 C ALA A 132 27.317 12.287 19.097 1.00 12.14 C ATOM 1252 O ALA A 132 27.248 11.848 20.255 1.00 11.39 O ATOM 1253 CB ALA A 132 27.344 14.861 19.153 1.00 12.71 C ATOM 1254 H ALA A 132 28.353 14.245 16.722 1.00 0.00 H ATOM 1255 N GLU A 133 26.549 11.798 18.096 1.00 11.87 N ATOM 1256 CA GLU A 133 25.652 10.661 18.291 1.00 11.46 C ATOM 1257 C GLU A 133 26.440 9.415 18.795 1.00 12.05 C ATOM 1258 O GLU A 133 25.832 8.567 19.487 1.00 12.12 O ATOM 1259 CB GLU A 133 24.931 10.277 17.017 1.00 11.96 C ATOM 1260 CG GLU A 133 23.861 11.328 16.561 1.00 9.88 C ATOM 1261 CD GLU A 133 23.196 10.953 15.251 1.00 19.15 C ATOM 1262 OE1 GLU A 133 23.782 10.226 14.423 1.00 16.29 O ATOM 1263 OE2 GLU A 133 22.048 11.326 15.090 1.00 17.60 O ATOM 1264 H GLU A 133 26.599 12.245 17.158 1.00 0.00 H ATOM 1265 N VAL A 134 27.711 9.305 18.443 1.00 11.11 N ATOM 1266 CA VAL A 134 28.502 8.115 18.821 1.00 11.40 C ATOM 1267 C VAL A 134 29.534 8.434 19.902 1.00 14.32 C ATOM 1268 O VAL A 134 30.300 7.532 20.355 1.00 15.93 O ATOM 1269 CB VAL A 134 29.153 7.450 17.569 1.00 10.39 C ATOM 1270 CG1 VAL A 134 28.087 7.193 16.535 1.00 11.23 C ATOM 1271 CG2 VAL A 134 30.286 8.303 17.032 1.00 12.12 C ATOM 1272 H VAL A 134 28.159 10.066 17.893 1.00 0.00 H ATOM 1273 N ALA A 135 29.615 9.703 20.306 1.00 14.46 N ATOM 1274 CA ALA A 135 30.632 10.142 21.262 1.00 16.58 C ATOM 1275 C ALA A 135 30.197 9.859 22.666 1.00 19.14 C ATOM 1276 O ALA A 135 29.012 9.838 22.999 1.00 18.69 O ATOM 1277 CB ALA A 135 30.902 11.615 21.117 1.00 15.24 C ATOM 1278 H ALA A 135 28.938 10.398 19.932 1.00 0.00 H ATOM 1279 N THR A 136 31.172 9.607 23.526 1.00 25.69 N ATOM 1280 CA THR A 136 30.847 9.438 24.937 1.00 29.42 C ATOM 1281 C THR A 136 31.670 10.426 25.815 1.00 32.36 C ATOM 1282 O THR A 136 32.893 10.617 25.560 1.00 34.67 O ATOM 1283 CB THR A 136 31.121 7.985 25.338 1.00 28.99 C ATOM 1284 OG1 THR A 136 32.492 7.675 25.049 1.00 31.12 O ATOM 1285 CG2 THR A 136 30.204 7.037 24.531 1.00 27.79 C ATOM 1286 HG1 THR A 136 32.659 7.793 24.080 1.00 0.00 H ATOM 1287 H THR A 136 32.156 9.531 23.199 1.00 0.00 H ATOM 1288 N GLY A 137 31.015 10.964 26.860 1.00 34.23 N ATOM 1289 CA GLY A 137 31.706 11.623 27.998 1.00 36.06 C ATOM 1290 C GLY A 137 31.991 13.084 27.713 1.00 38.16 C ATOM 1291 O GLY A 137 31.121 13.811 27.166 1.00 38.40 O ATOM 1292 H GLY A 137 29.976 10.916 26.872 1.00 0.00 H ATOM 1293 N ASP A 138 33.212 13.496 28.072 1.00 38.75 N ATOM 1294 CA ASP A 138 33.668 14.887 27.943 1.00 38.92 C ATOM 1295 C ASP A 138 33.929 15.171 26.494 1.00 38.39 C ATOM 1296 O ASP A 138 33.587 16.242 25.936 1.00 38.61 O ATOM 1297 CB ASP A 138 35.001 15.101 28.728 1.00 39.52 C ATOM 1298 CG ASP A 138 34.817 14.993 30.240 1.00 39.72 C ATOM 1299 OD1 ASP A 138 33.665 15.145 30.717 1.00 39.65 O ATOM 1300 OD2 ASP A 138 35.821 14.726 30.940 1.00 40.02 O ATOM 1301 H ASP A 138 33.873 12.795 28.463 1.00 0.00 H ATOM 1302 N ASP A 139 34.612 14.234 25.872 1.00 36.44 N ATOM 1303 CA ASP A 139 34.726 14.290 24.456 1.00 34.14 C ATOM 1304 C ASP A 139 33.375 14.734 23.769 1.00 30.93 C ATOM 1305 O ASP A 139 33.349 15.670 22.876 1.00 27.86 O ATOM 1306 CB ASP A 139 35.133 12.874 24.159 1.00 36.28 C ATOM 1307 CG ASP A 139 34.932 12.512 22.795 1.00 37.18 C ATOM 1308 OD1 ASP A 139 35.396 13.297 21.916 1.00 45.03 O ATOM 1309 OD2 ASP A 139 34.321 11.440 22.628 1.00 37.65 O ATOM 1310 H ASP A 139 35.061 13.464 26.408 1.00 0.00 H ATOM 1311 N LYS A 140 32.283 14.058 24.165 1.00 27.73 N ATOM 1312 CA LYS A 140 30.949 14.370 23.716 1.00 25.99 C ATOM 1313 C LYS A 140 30.665 15.904 23.893 1.00 24.92 C ATOM 1314 O LYS A 140 30.090 16.561 22.992 1.00 21.39 O ATOM 1315 CB LYS A 140 29.897 13.490 24.416 1.00 25.99 C ATOM 1316 CG LYS A 140 28.554 13.405 23.717 1.00 28.99 C ATOM 1317 CD LYS A 140 27.504 12.794 24.730 1.00 37.28 C ATOM 1318 CE LYS A 140 26.284 12.196 24.081 1.00 42.25 C ATOM 1319 NZ LYS A 140 25.810 12.967 22.902 1.00 45.70 N ATOM 1320 HZ1 LYS A 140 25.567 13.934 23.197 1.00 0.00 H ATOM 1321 HZ2 LYS A 140 26.563 13.000 22.185 1.00 0.00 H ATOM 1322 HZ3 LYS A 140 24.969 12.504 22.502 1.00 0.00 H ATOM 1323 H LYS A 140 32.407 13.268 24.830 1.00 0.00 H ATOM 1324 N LYS A 141 31.068 16.466 25.034 1.00 23.18 N ATOM 1325 CA LYS A 141 30.782 17.925 25.246 1.00 21.91 C ATOM 1326 C LYS A 141 31.379 18.841 24.244 1.00 19.02 C ATOM 1327 O LYS A 141 30.692 19.712 23.786 1.00 19.07 O ATOM 1328 CB LYS A 141 31.208 18.406 26.651 1.00 21.50 C ATOM 1329 CG LYS A 141 30.478 17.726 27.720 1.00 27.80 C ATOM 1330 CD LYS A 141 30.916 18.397 29.086 1.00 33.01 C ATOM 1331 CE LYS A 141 30.503 17.548 30.299 1.00 41.35 C ATOM 1332 NZ LYS A 141 31.553 16.481 30.495 1.00 43.13 N ATOM 1333 HZ1 LYS A 141 31.608 15.889 29.642 1.00 0.00 H ATOM 1334 HZ2 LYS A 141 32.475 16.931 30.666 1.00 0.00 H ATOM 1335 HZ3 LYS A 141 31.297 15.891 31.312 1.00 0.00 H ATOM 1336 H LYS A 141 31.567 15.909 25.757 1.00 0.00 H ATOM 1337 N ARG A 142 32.686 18.716 23.970 1.00 18.74 N ATOM 1338 CA ARG A 142 33.356 19.574 23.039 1.00 17.47 C ATOM 1339 C ARG A 142 32.747 19.365 21.627 1.00 15.35 C ATOM 1340 O ARG A 142 32.661 20.308 20.875 1.00 14.00 O ATOM 1341 CB ARG A 142 34.817 19.144 22.939 1.00 20.22 C ATOM 1342 CG ARG A 142 35.786 20.069 23.535 1.00 26.88 C ATOM 1343 CD ARG A 142 37.143 19.311 23.716 1.00 32.76 C ATOM 1344 NE ARG A 142 37.696 20.098 24.743 1.00 34.58 N ATOM 1345 CZ ARG A 142 37.953 19.724 25.982 1.00 34.37 C ATOM 1346 NH1 ARG A 142 37.898 18.447 26.431 1.00 38.64 N ATOM 1347 NH2 ARG A 142 38.330 20.695 26.759 1.00 30.32 N ATOM 1348 HE ARG A 142 37.927 21.082 24.499 1.00 0.00 H ATOM 1349 HH12 ARG A 142 38.116 18.236 27.426 1.00 0.00 H ATOM 1350 HH11 ARG A 142 37.638 17.678 25.781 1.00 0.00 H ATOM 1351 HH22 ARG A 142 38.557 20.505 27.756 1.00 0.00 H ATOM 1352 HH21 ARG A 142 38.405 21.662 26.384 1.00 0.00 H ATOM 1353 H ARG A 142 33.231 17.971 24.449 1.00 0.00 H ATOM 1354 N ILE A 143 32.332 18.137 21.279 1.00 15.01 N ATOM 1355 CA ILE A 143 31.810 17.912 19.905 1.00 13.64 C ATOM 1356 C ILE A 143 30.411 18.600 19.802 1.00 13.54 C ATOM 1357 O ILE A 143 30.034 19.209 18.768 1.00 12.32 O ATOM 1358 CB ILE A 143 31.736 16.403 19.632 1.00 14.33 C ATOM 1359 CG1 ILE A 143 33.154 15.829 19.520 1.00 17.73 C ATOM 1360 CG2 ILE A 143 30.859 16.088 18.384 1.00 13.85 C ATOM 1361 CD1 ILE A 143 33.143 14.276 19.624 1.00 21.21 C ATOM 1362 H ILE A 143 32.375 17.353 21.961 1.00 0.00 H ATOM 1363 N ILE A 144 29.611 18.476 20.860 1.00 12.42 N ATOM 1364 CA ILE A 144 28.305 19.080 20.914 1.00 13.46 C ATOM 1365 C ILE A 144 28.452 20.581 20.745 1.00 12.54 C ATOM 1366 O ILE A 144 27.687 21.260 20.018 1.00 12.50 O ATOM 1367 CB ILE A 144 27.563 18.677 22.217 1.00 14.47 C ATOM 1368 CG1 ILE A 144 27.175 17.163 22.101 1.00 17.90 C ATOM 1369 CG2 ILE A 144 26.313 19.673 22.514 1.00 14.28 C ATOM 1370 CD1 ILE A 144 26.507 16.555 23.424 1.00 19.64 C ATOM 1371 H ILE A 144 29.942 17.923 21.676 1.00 0.00 H ATOM 1372 N ASP A 145 29.422 21.147 21.460 1.00 11.48 N ATOM 1373 CA ASP A 145 29.600 22.577 21.358 1.00 12.39 C ATOM 1374 C ASP A 145 30.052 23.018 19.942 1.00 11.51 C ATOM 1375 O ASP A 145 29.657 24.118 19.473 1.00 11.48 O ATOM 1376 CB ASP A 145 30.513 23.128 22.487 1.00 11.65 C ATOM 1377 CG ASP A 145 30.287 24.638 22.760 1.00 14.17 C ATOM 1378 OD1 ASP A 145 29.132 25.040 23.059 1.00 13.18 O ATOM 1379 OD2 ASP A 145 31.293 25.403 22.698 1.00 20.90 O ATOM 1380 H ASP A 145 30.035 20.575 22.075 1.00 0.00 H ATOM 1381 N SER A 146 30.885 22.206 19.293 1.00 10.21 N ATOM 1382 CA SER A 146 31.241 22.473 17.894 1.00 10.75 C ATOM 1383 C SER A 146 30.020 22.458 17.017 1.00 9.50 C ATOM 1384 O SER A 146 29.894 23.327 16.139 1.00 10.70 O ATOM 1385 CB SER A 146 32.234 21.426 17.435 1.00 11.41 C ATOM 1386 OG SER A 146 33.482 21.779 18.032 1.00 14.32 O ATOM 1387 HG SER A 146 33.388 21.776 19.017 1.00 0.00 H ATOM 1388 H SER A 146 31.285 21.379 19.780 1.00 0.00 H ATOM 1389 N ALA A 147 29.181 21.463 17.241 1.00 8.10 N ATOM 1390 CA ALA A 147 27.918 21.411 16.383 1.00 9.01 C ATOM 1391 C ALA A 147 27.105 22.677 16.641 1.00 10.37 C ATOM 1392 O ALA A 147 26.623 23.357 15.712 1.00 9.96 O ATOM 1393 CB ALA A 147 27.070 20.132 16.675 1.00 10.36 C ATOM 1394 H ALA A 147 29.372 20.746 17.970 1.00 0.00 H ATOM 1395 N ARG A 148 26.906 22.983 17.926 1.00 9.52 N ATOM 1396 CA ARG A 148 26.030 24.138 18.261 1.00 10.33 C ATOM 1397 C ARG A 148 26.574 25.442 17.663 1.00 9.98 C ATOM 1398 O ARG A 148 25.816 26.254 17.154 1.00 10.50 O ATOM 1399 CB ARG A 148 25.911 24.290 19.800 1.00 10.94 C ATOM 1400 CG ARG A 148 24.826 25.275 20.261 1.00 10.80 C ATOM 1401 CD ARG A 148 25.071 25.679 21.763 1.00 9.29 C ATOM 1402 NE ARG A 148 25.188 24.444 22.515 1.00 13.14 N ATOM 1403 CZ ARG A 148 24.134 23.787 22.966 1.00 11.19 C ATOM 1404 NH1 ARG A 148 22.930 24.323 22.748 1.00 8.35 N ATOM 1405 NH2 ARG A 148 24.302 22.596 23.563 1.00 10.52 N ATOM 1406 HE ARG A 148 26.136 24.062 22.706 1.00 0.00 H ATOM 1407 HH12 ARG A 148 22.075 23.837 23.087 1.00 0.00 H ATOM 1408 HH11 ARG A 148 22.847 25.226 22.239 1.00 0.00 H ATOM 1409 HH22 ARG A 148 23.477 22.073 23.921 1.00 0.00 H ATOM 1410 HH21 ARG A 148 25.257 22.197 23.668 1.00 0.00 H ATOM 1411 H ARG A 148 27.355 22.424 18.679 1.00 0.00 H ATOM 1412 N SER A 149 27.882 25.642 17.766 1.00 11.20 N ATOM 1413 CA SER A 149 28.521 26.839 17.256 1.00 11.34 C ATOM 1414 C SER A 149 28.305 26.975 15.761 1.00 11.22 C ATOM 1415 O SER A 149 28.034 28.076 15.259 1.00 11.20 O ATOM 1416 CB SER A 149 30.028 26.801 17.594 1.00 13.60 C ATOM 1417 OG SER A 149 30.617 28.059 17.330 1.00 16.69 O ATOM 1418 HG SER A 149 31.582 28.023 17.550 1.00 0.00 H ATOM 1419 H SER A 149 28.467 24.917 18.227 1.00 0.00 H ATOM 1420 N ALA A 150 28.473 25.872 15.047 1.00 9.66 N ATOM 1421 CA ALA A 150 28.321 25.909 13.604 1.00 8.67 C ATOM 1422 C ALA A 150 26.863 26.265 13.234 1.00 8.97 C ATOM 1423 O ALA A 150 26.578 27.138 12.364 1.00 8.94 O ATOM 1424 CB ALA A 150 28.737 24.543 12.984 1.00 9.28 C ATOM 1425 H ALA A 150 28.714 24.978 15.521 1.00 0.00 H ATOM 1426 N TYR A 151 25.923 25.559 13.860 1.00 9.05 N ATOM 1427 CA TYR A 151 24.502 25.825 13.632 1.00 9.06 C ATOM 1428 C TYR A 151 24.117 27.236 13.996 1.00 10.57 C ATOM 1429 O TYR A 151 23.402 27.914 13.225 1.00 10.28 O ATOM 1430 CB TYR A 151 23.612 24.906 14.446 1.00 7.08 C ATOM 1431 CG TYR A 151 23.498 23.499 13.899 1.00 6.89 C ATOM 1432 CD1 TYR A 151 23.230 23.247 12.510 1.00 6.65 C ATOM 1433 CD2 TYR A 151 23.632 22.428 14.789 1.00 7.18 C ATOM 1434 CE1 TYR A 151 23.034 21.837 12.076 1.00 7.00 C ATOM 1435 CE2 TYR A 151 23.398 21.070 14.354 1.00 7.19 C ATOM 1436 CZ TYR A 151 23.135 20.827 12.986 1.00 9.26 C ATOM 1437 OH TYR A 151 22.937 19.552 12.550 1.00 10.33 O ATOM 1438 HH TYR A 151 22.767 19.561 11.575 1.00 0.00 H ATOM 1439 H TYR A 151 26.203 24.807 14.521 1.00 0.00 H ATOM 1440 N GLN A 152 24.706 27.729 15.088 1.00 10.16 N ATOM 1441 CA GLN A 152 24.346 29.128 15.507 1.00 12.25 C ATOM 1442 C GLN A 152 24.856 30.139 14.509 1.00 12.14 C ATOM 1443 O GLN A 152 24.121 31.136 14.178 1.00 12.45 O ATOM 1444 CB GLN A 152 24.964 29.464 16.904 1.00 13.13 C ATOM 1445 CG GLN A 152 24.438 30.874 17.466 1.00 16.30 C ATOM 1446 CD GLN A 152 22.951 30.813 17.601 1.00 17.27 C ATOM 1447 OE1 GLN A 152 22.424 29.904 18.350 1.00 23.78 O ATOM 1448 NE2 GLN A 152 22.215 31.701 16.866 1.00 19.31 N ATOM 1449 HE22 GLN A 152 22.694 32.413 16.279 1.00 0.00 H ATOM 1450 HE21 GLN A 152 21.176 31.664 16.894 1.00 0.00 H ATOM 1451 H GLN A 152 25.391 27.165 15.631 1.00 0.00 H ATOM 1452 N GLU A 153 26.121 29.980 14.045 1.00 11.40 N ATOM 1453 CA GLU A 153 26.631 30.939 13.034 1.00 11.10 C ATOM 1454 C GLU A 153 25.755 30.903 11.784 1.00 11.23 C ATOM 1455 O GLU A 153 25.392 31.962 11.244 1.00 11.32 O ATOM 1456 CB GLU A 153 28.110 30.731 12.678 1.00 11.27 C ATOM 1457 CG GLU A 153 28.569 31.757 11.644 1.00 10.51 C ATOM 1458 CD GLU A 153 30.030 31.669 11.203 1.00 18.29 C ATOM 1459 OE1 GLU A 153 30.795 30.870 11.726 1.00 16.70 O ATOM 1460 OE2 GLU A 153 30.404 32.401 10.266 1.00 18.03 O ATOM 1461 H GLU A 153 26.720 29.203 14.390 1.00 0.00 H ATOM 1462 N ALA A 154 25.379 29.694 11.337 1.00 8.58 N ATOM 1463 CA ALA A 154 24.527 29.553 10.173 1.00 10.07 C ATOM 1464 C ALA A 154 23.161 30.223 10.432 1.00 9.33 C ATOM 1465 O ALA A 154 22.637 30.881 9.515 1.00 11.43 O ATOM 1466 CB ALA A 154 24.324 28.038 9.873 1.00 10.39 C ATOM 1467 H ALA A 154 25.706 28.842 11.836 1.00 0.00 H ATOM 1468 N MET A 155 22.610 30.039 11.638 1.00 8.80 N ATOM 1469 CA MET A 155 21.260 30.633 11.941 1.00 9.39 C ATOM 1470 C MET A 155 21.429 32.171 11.857 1.00 9.61 C ATOM 1471 O MET A 155 20.499 32.862 11.327 1.00 11.27 O ATOM 1472 CB MET A 155 20.739 30.282 13.339 1.00 10.44 C ATOM 1473 CG MET A 155 20.351 28.774 13.478 1.00 14.33 C ATOM 1474 SD MET A 155 18.786 28.408 12.648 1.00 17.82 S ATOM 1475 CE MET A 155 17.983 29.984 13.069 1.00 18.89 C ATOM 1476 H MET A 155 23.112 29.488 12.363 1.00 0.00 H ATOM 1477 N ASP A 156 22.511 32.675 12.476 1.00 12.08 N ATOM 1478 CA ASP A 156 22.654 34.158 12.537 1.00 11.98 C ATOM 1479 C ASP A 156 22.702 34.763 11.103 1.00 13.10 C ATOM 1480 O ASP A 156 22.019 35.744 10.827 1.00 13.35 O ATOM 1481 CB ASP A 156 23.860 34.603 13.317 1.00 13.98 C ATOM 1482 CG ASP A 156 23.828 34.232 14.801 1.00 17.08 C ATOM 1483 OD1 ASP A 156 22.792 33.936 15.350 1.00 20.61 O ATOM 1484 OD2 ASP A 156 24.956 34.243 15.372 1.00 24.61 O ATOM 1485 H ASP A 156 23.226 32.050 12.899 1.00 0.00 H ATOM 1486 N ILE A 157 23.474 34.147 10.182 1.00 10.45 N ATOM 1487 CA ILE A 157 23.535 34.640 8.800 1.00 9.57 C ATOM 1488 C ILE A 157 22.199 34.466 8.107 1.00 11.38 C ATOM 1489 O ILE A 157 21.751 35.353 7.409 1.00 11.57 O ATOM 1490 CB ILE A 157 24.614 33.852 8.034 1.00 10.24 C ATOM 1491 CG1 ILE A 157 25.990 34.143 8.682 1.00 11.43 C ATOM 1492 CG2 ILE A 157 24.568 34.281 6.586 1.00 9.49 C ATOM 1493 CD1 ILE A 157 27.077 33.095 8.130 1.00 14.94 C ATOM 1494 H ILE A 157 24.032 33.313 10.455 1.00 0.00 H ATOM 1495 N SER A 158 21.522 33.316 8.320 1.00 11.31 N ATOM 1496 CA SER A 158 20.267 33.041 7.590 1.00 12.20 C ATOM 1497 C SER A 158 19.163 34.044 7.999 1.00 12.30 C ATOM 1498 O SER A 158 18.332 34.425 7.147 1.00 12.14 O ATOM 1499 CB SER A 158 19.767 31.546 7.782 1.00 11.71 C ATOM 1500 OG SER A 158 19.303 31.404 9.121 1.00 16.46 O ATOM 1501 HG SER A 158 20.043 31.600 9.748 1.00 0.00 H ATOM 1502 H SER A 158 21.886 32.620 9.002 1.00 0.00 H ATOM 1503 N LYS A 159 19.184 34.443 9.275 1.00 13.38 N ATOM 1504 CA LYS A 159 18.113 35.345 9.760 1.00 14.84 C ATOM 1505 C LYS A 159 18.367 36.741 9.226 1.00 16.20 C ATOM 1506 O LYS A 159 17.392 37.485 8.976 1.00 16.58 O ATOM 1507 CB LYS A 159 18.081 35.306 11.294 1.00 17.35 C ATOM 1508 CG LYS A 159 17.276 34.055 11.797 1.00 23.37 C ATOM 1509 CD LYS A 159 17.108 34.073 13.387 1.00 27.70 C ATOM 1510 CE LYS A 159 18.169 33.246 14.128 1.00 34.61 C ATOM 1511 NZ LYS A 159 18.356 33.565 15.622 1.00 43.15 N ATOM 1512 HZ1 LYS A 159 18.639 34.560 15.730 1.00 0.00 H ATOM 1513 HZ2 LYS A 159 17.460 33.402 16.125 1.00 0.00 H ATOM 1514 HZ3 LYS A 159 19.094 32.948 16.017 1.00 0.00 H ATOM 1515 H LYS A 159 19.939 34.126 9.916 1.00 0.00 H ATOM 1516 N LYS A 160 19.617 37.090 8.999 1.00 14.44 N ATOM 1517 CA LYS A 160 19.951 38.410 8.494 1.00 15.71 C ATOM 1518 C LYS A 160 19.810 38.475 6.958 1.00 17.17 C ATOM 1519 O LYS A 160 19.491 39.517 6.393 1.00 18.35 O ATOM 1520 CB LYS A 160 21.366 38.764 8.947 1.00 16.31 C ATOM 1521 CG LYS A 160 21.892 40.149 8.583 1.00 15.41 C ATOM 1522 CD LYS A 160 23.285 40.355 9.105 1.00 21.50 C ATOM 1523 H LYS A 160 20.379 36.407 9.185 1.00 0.00 H ATOM 1524 N GLU A 161 20.098 37.356 6.272 1.00 14.41 N ATOM 1525 CA GLU A 161 20.275 37.375 4.829 1.00 13.58 C ATOM 1526 C GLU A 161 19.279 36.677 3.966 1.00 15.73 C ATOM 1527 O GLU A 161 19.358 36.800 2.734 1.00 17.90 O ATOM 1528 CB GLU A 161 21.686 36.865 4.467 1.00 14.74 C ATOM 1529 CG GLU A 161 22.834 37.602 5.151 1.00 19.41 C ATOM 1530 CD GLU A 161 22.911 39.027 4.786 1.00 31.84 C ATOM 1531 OE1 GLU A 161 22.491 39.371 3.664 1.00 31.51 O ATOM 1532 OE2 GLU A 161 23.384 39.807 5.660 1.00 38.68 O ATOM 1533 H GLU A 161 20.196 36.456 6.785 1.00 0.00 H ATOM 1534 N MET A 162 18.376 35.884 4.532 1.00 12.94 N ATOM 1535 CA MET A 162 17.480 35.080 3.694 1.00 14.43 C ATOM 1536 C MET A 162 16.084 35.288 4.239 1.00 14.18 C ATOM 1537 O MET A 162 15.929 35.526 5.426 1.00 14.42 O ATOM 1538 CB MET A 162 17.795 33.570 3.925 1.00 16.16 C ATOM 1539 CG MET A 162 19.135 33.222 3.322 1.00 18.07 C ATOM 1540 SD MET A 162 19.538 31.571 3.947 1.00 17.78 S ATOM 1541 CE MET A 162 20.820 31.189 2.805 1.00 18.05 C ATOM 1542 H MET A 162 18.304 35.833 5.568 1.00 0.00 H ATOM 1543 N PRO A 163 15.058 35.140 3.364 1.00 15.46 N ATOM 1544 CA PRO A 163 13.667 35.248 3.819 1.00 16.26 C ATOM 1545 C PRO A 163 13.310 34.026 4.653 1.00 15.98 C ATOM 1546 O PRO A 163 13.996 32.953 4.508 1.00 14.19 O ATOM 1547 CB PRO A 163 12.859 35.179 2.514 1.00 15.94 C ATOM 1548 CG PRO A 163 13.693 34.635 1.529 1.00 18.60 C ATOM 1549 CD PRO A 163 15.158 35.023 1.904 1.00 16.56 C ATOM 1550 N PRO A 164 12.250 34.143 5.481 1.00 15.69 N ATOM 1551 CA PRO A 164 11.930 33.028 6.377 1.00 14.03 C ATOM 1552 C PRO A 164 11.469 31.790 5.660 1.00 13.76 C ATOM 1553 O PRO A 164 11.439 30.694 6.244 1.00 13.08 O ATOM 1554 CB PRO A 164 10.821 33.565 7.299 1.00 14.39 C ATOM 1555 CG PRO A 164 10.517 34.995 6.802 1.00 16.15 C ATOM 1556 CD PRO A 164 11.452 35.367 5.723 1.00 14.78 C ATOM 1557 N THR A 165 11.078 31.914 4.375 1.00 12.71 N ATOM 1558 CA THR A 165 10.710 30.747 3.632 1.00 10.68 C ATOM 1559 C THR A 165 11.863 30.089 2.827 1.00 10.53 C ATOM 1560 O THR A 165 11.662 29.090 2.134 1.00 10.86 O ATOM 1561 CB THR A 165 9.615 31.071 2.559 1.00 13.43 C ATOM 1562 OG1 THR A 165 10.077 32.181 1.868 1.00 14.33 O ATOM 1563 CG2 THR A 165 8.294 31.389 3.264 1.00 15.51 C ATOM 1564 HG1 THR A 165 10.196 32.935 2.499 1.00 0.00 H ATOM 1565 H THR A 165 11.044 32.852 3.927 1.00 0.00 H ATOM 1566 N ASN A 166 13.060 30.679 2.888 1.00 10.83 N ATOM 1567 CA ASN A 166 14.160 30.115 2.078 1.00 12.02 C ATOM 1568 C ASN A 166 14.432 28.655 2.461 1.00 12.76 C ATOM 1569 O ASN A 166 14.532 28.354 3.637 1.00 11.67 O ATOM 1570 CB ASN A 166 15.401 30.993 2.317 1.00 12.83 C ATOM 1571 CG ASN A 166 16.556 30.472 1.589 1.00 19.47 C ATOM 1572 OD1 ASN A 166 17.155 29.451 1.985 1.00 17.14 O ATOM 1573 ND2 ASN A 166 16.928 31.173 0.493 1.00 21.12 N ATOM 1574 HD22 ASN A 166 16.391 32.017 0.209 1.00 0.00 H ATOM 1575 HD21 ASN A 166 17.751 30.867 -0.065 1.00 0.00 H ATOM 1576 H ASN A 166 13.214 31.513 3.490 1.00 0.00 H ATOM 1577 N PRO A 167 14.415 27.709 1.505 1.00 11.36 N ATOM 1578 CA PRO A 167 14.564 26.303 1.920 1.00 10.95 C ATOM 1579 C PRO A 167 15.829 25.958 2.636 1.00 11.78 C ATOM 1580 O PRO A 167 15.805 25.071 3.484 1.00 10.95 O ATOM 1581 CB PRO A 167 14.551 25.541 0.607 1.00 12.83 C ATOM 1582 CG PRO A 167 13.600 26.464 -0.261 1.00 13.18 C ATOM 1583 CD PRO A 167 14.034 27.798 0.078 1.00 17.03 C ATOM 1584 N ILE A 168 16.920 26.643 2.301 1.00 10.65 N ATOM 1585 CA ILE A 168 18.184 26.475 3.039 1.00 11.18 C ATOM 1586 C ILE A 168 17.955 26.817 4.500 1.00 10.97 C ATOM 1587 O ILE A 168 18.345 26.088 5.439 1.00 10.23 O ATOM 1588 CB ILE A 168 19.296 27.397 2.412 1.00 11.22 C ATOM 1589 CG1 ILE A 168 19.475 27.052 0.924 1.00 13.89 C ATOM 1590 CG2 ILE A 168 20.623 27.315 3.225 1.00 10.01 C ATOM 1591 CD1 ILE A 168 20.757 27.503 0.292 1.00 15.21 C ATOM 1592 H ILE A 168 16.879 27.309 1.503 1.00 0.00 H ATOM 1593 N ARG A 169 17.387 28.010 4.685 1.00 10.08 N ATOM 1594 CA ARG A 169 17.106 28.480 6.076 1.00 9.47 C ATOM 1595 C ARG A 169 16.153 27.547 6.806 1.00 9.48 C ATOM 1596 O ARG A 169 16.407 27.228 7.978 1.00 8.35 O ATOM 1597 CB ARG A 169 16.549 29.889 5.995 1.00 9.72 C ATOM 1598 CG ARG A 169 16.187 30.450 7.388 1.00 10.50 C ATOM 1599 CD ARG A 169 15.795 31.993 7.273 1.00 14.26 C ATOM 1600 NE ARG A 169 15.166 32.353 8.542 1.00 13.05 N ATOM 1601 CZ ARG A 169 14.699 33.600 8.799 1.00 14.57 C ATOM 1602 NH1 ARG A 169 14.842 34.550 7.877 1.00 13.17 N ATOM 1603 NH2 ARG A 169 14.072 33.903 9.963 1.00 13.80 N ATOM 1604 HE ARG A 169 15.073 31.624 9.278 1.00 0.00 H ATOM 1605 HH12 ARG A 169 14.488 35.511 8.061 1.00 0.00 H ATOM 1606 HH11 ARG A 169 15.307 34.331 6.973 1.00 0.00 H ATOM 1607 HH22 ARG A 169 13.725 34.869 10.131 1.00 0.00 H ATOM 1608 HH21 ARG A 169 13.938 33.169 10.688 1.00 0.00 H ATOM 1609 H ARG A 169 17.142 28.607 3.869 1.00 0.00 H ATOM 1610 N LEU A 170 15.157 27.039 6.108 1.00 9.73 N ATOM 1611 CA LEU A 170 14.192 26.147 6.758 1.00 8.05 C ATOM 1612 C LEU A 170 14.837 24.835 7.093 1.00 9.19 C ATOM 1613 O LEU A 170 14.601 24.261 8.179 1.00 10.36 O ATOM 1614 CB LEU A 170 12.964 25.866 5.853 1.00 8.95 C ATOM 1615 CG LEU A 170 12.076 27.051 5.601 1.00 9.21 C ATOM 1616 CD1 LEU A 170 10.985 26.654 4.535 1.00 11.70 C ATOM 1617 CD2 LEU A 170 11.350 27.485 6.880 1.00 11.45 C ATOM 1618 H LEU A 170 15.056 27.270 5.099 1.00 0.00 H ATOM 1619 N GLY A 171 15.652 24.309 6.194 1.00 9.11 N ATOM 1620 CA GLY A 171 16.370 23.048 6.541 1.00 9.42 C ATOM 1621 C GLY A 171 17.407 23.150 7.645 1.00 8.83 C ATOM 1622 O GLY A 171 17.563 22.196 8.424 1.00 9.94 O ATOM 1623 H GLY A 171 15.789 24.763 5.268 1.00 0.00 H ATOM 1624 N LEU A 172 18.075 24.289 7.732 1.00 7.55 N ATOM 1625 CA LEU A 172 18.983 24.550 8.850 1.00 8.90 C ATOM 1626 C LEU A 172 18.192 24.564 10.162 1.00 9.40 C ATOM 1627 O LEU A 172 18.603 23.946 11.137 1.00 7.84 O ATOM 1628 CB LEU A 172 19.609 25.904 8.609 1.00 8.10 C ATOM 1629 CG LEU A 172 20.301 26.509 9.849 1.00 8.29 C ATOM 1630 CD1 LEU A 172 21.437 25.602 10.400 1.00 7.21 C ATOM 1631 CD2 LEU A 172 20.917 27.792 9.417 1.00 9.54 C ATOM 1632 H LEU A 172 17.953 25.011 6.993 1.00 0.00 H ATOM 1633 N ALA A 173 17.074 25.280 10.169 1.00 9.44 N ATOM 1634 CA ALA A 173 16.302 25.352 11.410 1.00 9.84 C ATOM 1635 C ALA A 173 15.757 23.978 11.788 1.00 8.90 C ATOM 1636 O ALA A 173 15.755 23.614 12.982 1.00 7.52 O ATOM 1637 CB ALA A 173 15.175 26.432 11.270 1.00 9.50 C ATOM 1638 H ALA A 173 16.755 25.778 9.313 1.00 0.00 H ATOM 1639 N LEU A 174 15.323 23.210 10.801 1.00 8.07 N ATOM 1640 CA LEU A 174 14.840 21.811 11.071 1.00 9.68 C ATOM 1641 C LEU A 174 15.970 21.019 11.757 1.00 9.06 C ATOM 1642 O LEU A 174 15.717 20.399 12.826 1.00 7.79 O ATOM 1643 CB LEU A 174 14.446 21.135 9.727 1.00 8.26 C ATOM 1644 CG LEU A 174 14.064 19.635 9.840 1.00 10.97 C ATOM 1645 CD1 LEU A 174 12.694 19.496 10.567 1.00 13.77 C ATOM 1646 CD2 LEU A 174 13.889 19.149 8.398 1.00 12.38 C ATOM 1647 H LEU A 174 15.316 23.578 9.828 1.00 0.00 H ATOM 1648 N ASN A 175 17.172 21.052 11.160 1.00 8.85 N ATOM 1649 CA ASN A 175 18.264 20.235 11.760 1.00 8.44 C ATOM 1650 C ASN A 175 18.739 20.788 13.081 1.00 7.46 C ATOM 1651 O ASN A 175 19.071 19.977 13.973 1.00 8.72 O ATOM 1652 CB ASN A 175 19.398 20.158 10.753 1.00 9.60 C ATOM 1653 CG ASN A 175 19.054 19.207 9.613 1.00 10.24 C ATOM 1654 OD1 ASN A 175 17.884 18.783 9.472 1.00 13.07 O ATOM 1655 ND2 ASN A 175 20.096 18.771 8.806 1.00 10.69 N ATOM 1656 HD22 ASN A 175 21.056 19.144 8.950 1.00 0.00 H ATOM 1657 HD21 ASN A 175 19.916 18.072 8.057 1.00 0.00 H ATOM 1658 H ASN A 175 17.335 21.627 10.309 1.00 0.00 H ATOM 1659 N PHE A 176 18.773 22.140 13.259 1.00 6.30 N ATOM 1660 CA PHE A 176 19.216 22.632 14.558 1.00 7.13 C ATOM 1661 C PHE A 176 18.159 22.227 15.591 1.00 8.06 C ATOM 1662 O PHE A 176 18.521 21.956 16.735 1.00 8.49 O ATOM 1663 CB PHE A 176 19.407 24.163 14.403 1.00 7.54 C ATOM 1664 CG PHE A 176 20.124 24.832 15.553 1.00 9.13 C ATOM 1665 CD1 PHE A 176 20.965 24.110 16.424 1.00 7.88 C ATOM 1666 CD2 PHE A 176 20.024 26.231 15.700 1.00 11.24 C ATOM 1667 CE1 PHE A 176 21.663 24.795 17.476 1.00 9.23 C ATOM 1668 CE2 PHE A 176 20.682 26.901 16.736 1.00 12.66 C ATOM 1669 CZ PHE A 176 21.534 26.183 17.622 1.00 9.71 C ATOM 1670 H PHE A 176 18.494 22.793 12.499 1.00 0.00 H ATOM 1671 N SER A 177 16.852 22.224 15.206 1.00 8.66 N ATOM 1672 CA SER A 177 15.802 21.814 16.154 1.00 10.27 C ATOM 1673 C SER A 177 16.018 20.348 16.547 1.00 11.33 C ATOM 1674 O SER A 177 15.895 19.963 17.717 1.00 9.26 O ATOM 1675 CB SER A 177 14.427 22.078 15.551 1.00 10.35 C ATOM 1676 OG SER A 177 13.441 21.539 16.369 1.00 15.23 O ATOM 1677 HG SER A 177 13.492 21.958 17.265 1.00 0.00 H ATOM 1678 H SER A 177 16.595 22.512 14.240 1.00 0.00 H ATOM 1679 N VAL A 178 16.396 19.521 15.567 1.00 10.46 N ATOM 1680 CA VAL A 178 16.683 18.094 15.913 1.00 10.82 C ATOM 1681 C VAL A 178 17.916 17.970 16.817 1.00 10.09 C ATOM 1682 O VAL A 178 17.938 17.154 17.759 1.00 11.37 O ATOM 1683 CB VAL A 178 16.895 17.274 14.589 1.00 10.64 C ATOM 1684 CG1 VAL A 178 17.520 15.880 14.870 1.00 13.74 C ATOM 1685 CG2 VAL A 178 15.530 17.064 13.908 1.00 13.79 C ATOM 1686 H VAL A 178 16.488 19.861 14.589 1.00 0.00 H ATOM 1687 N PHE A 179 18.929 18.815 16.586 1.00 9.21 N ATOM 1688 CA PHE A 179 20.118 18.862 17.425 1.00 8.68 C ATOM 1689 C PHE A 179 19.639 19.145 18.878 1.00 10.59 C ATOM 1690 O PHE A 179 20.045 18.473 19.826 1.00 10.51 O ATOM 1691 CB PHE A 179 21.058 19.958 16.918 1.00 8.91 C ATOM 1692 CG PHE A 179 22.138 20.334 17.948 1.00 9.19 C ATOM 1693 CD1 PHE A 179 23.314 19.520 18.109 1.00 9.51 C ATOM 1694 CD2 PHE A 179 21.932 21.454 18.782 1.00 9.70 C ATOM 1695 CE1 PHE A 179 24.271 19.917 19.076 1.00 10.62 C ATOM 1696 CE2 PHE A 179 22.898 21.830 19.760 1.00 10.12 C ATOM 1697 CZ PHE A 179 24.074 21.028 19.885 1.00 12.78 C ATOM 1698 H PHE A 179 18.864 19.463 15.775 1.00 0.00 H ATOM 1699 N HIS A 180 18.814 20.192 19.039 1.00 9.09 N ATOM 1700 CA HIS A 180 18.360 20.485 20.381 1.00 9.92 C ATOM 1701 C HIS A 180 17.642 19.303 21.030 1.00 9.26 C ATOM 1702 O HIS A 180 17.874 19.030 22.223 1.00 11.66 O ATOM 1703 CB HIS A 180 17.412 21.746 20.368 1.00 8.96 C ATOM 1704 CG HIS A 180 18.175 23.027 20.191 1.00 10.15 C ATOM 1705 ND1 HIS A 180 17.884 23.966 19.214 1.00 15.44 N ATOM 1706 CD2 HIS A 180 19.275 23.472 20.838 1.00 7.19 C ATOM 1707 CE1 HIS A 180 18.750 24.979 19.323 1.00 5.81 C ATOM 1708 NE2 HIS A 180 19.603 24.664 20.292 1.00 12.53 N ATOM 1709 H HIS A 180 18.513 20.771 18.229 1.00 0.00 H ATOM 1710 N TYR A 181 16.766 18.660 20.278 1.00 9.32 N ATOM 1711 CA TYR A 181 15.909 17.611 20.909 1.00 10.55 C ATOM 1712 C TYR A 181 16.716 16.337 21.158 1.00 12.39 C ATOM 1713 O TYR A 181 16.588 15.703 22.224 1.00 13.09 O ATOM 1714 CB TYR A 181 14.805 17.262 19.902 1.00 10.43 C ATOM 1715 CG TYR A 181 13.741 16.459 20.559 1.00 11.25 C ATOM 1716 CD1 TYR A 181 13.847 15.066 20.613 1.00 14.46 C ATOM 1717 CD2 TYR A 181 12.672 17.091 21.188 1.00 14.94 C ATOM 1718 CE1 TYR A 181 12.856 14.298 21.232 1.00 18.15 C ATOM 1719 CE2 TYR A 181 11.681 16.308 21.833 1.00 17.84 C ATOM 1720 CZ TYR A 181 11.804 14.921 21.810 1.00 20.15 C ATOM 1721 OH TYR A 181 10.819 14.141 22.437 1.00 23.57 O ATOM 1722 HH TYR A 181 10.780 14.372 23.399 1.00 0.00 H ATOM 1723 H TYR A 181 16.675 18.880 19.266 1.00 0.00 H ATOM 1724 N GLU A 182 17.570 15.984 20.198 1.00 13.77 N ATOM 1725 CA GLU A 182 18.206 14.634 20.274 1.00 15.02 C ATOM 1726 C GLU A 182 19.586 14.653 20.857 1.00 15.39 C ATOM 1727 O GLU A 182 20.069 13.599 21.387 1.00 15.23 O ATOM 1728 CB GLU A 182 18.308 14.030 18.816 1.00 16.01 C ATOM 1729 CG GLU A 182 16.996 13.669 18.207 1.00 18.63 C ATOM 1730 CD GLU A 182 17.100 12.997 16.829 1.00 27.38 C ATOM 1731 OE1 GLU A 182 16.002 12.831 16.221 1.00 27.72 O ATOM 1732 OE2 GLU A 182 18.266 12.711 16.324 1.00 22.30 O ATOM 1733 H GLU A 182 17.789 16.632 19.415 1.00 0.00 H ATOM 1734 N ILE A 183 20.299 15.757 20.784 1.00 13.14 N ATOM 1735 CA ILE A 183 21.697 15.757 21.218 1.00 13.00 C ATOM 1736 C ILE A 183 21.883 16.591 22.438 1.00 15.00 C ATOM 1737 O ILE A 183 22.610 16.209 23.408 1.00 14.60 O ATOM 1738 CB ILE A 183 22.654 16.338 20.091 1.00 12.25 C ATOM 1739 CG1 ILE A 183 22.373 15.647 18.754 1.00 16.88 C ATOM 1740 CG2 ILE A 183 24.160 16.370 20.522 1.00 14.27 C ATOM 1741 CD1 ILE A 183 22.609 14.123 18.797 1.00 16.62 C ATOM 1742 H ILE A 183 19.869 16.630 20.418 1.00 0.00 H ATOM 1743 N ALA A 184 21.259 17.785 22.431 1.00 12.78 N ATOM 1744 CA ALA A 184 21.525 18.755 23.499 1.00 13.14 C ATOM 1745 C ALA A 184 20.585 18.659 24.674 1.00 11.71 C ATOM 1746 O ALA A 184 20.738 19.454 25.580 1.00 15.97 O ATOM 1747 CB ALA A 184 21.554 20.201 22.972 1.00 13.57 C ATOM 1748 H ALA A 184 20.590 18.019 21.670 1.00 0.00 H ATOM 1749 N ASN A 185 19.737 17.676 24.689 1.00 12.04 N ATOM 1750 CA ASN A 185 18.779 17.466 25.796 1.00 16.04 C ATOM 1751 C ASN A 185 17.973 18.740 26.068 1.00 15.48 C ATOM 1752 O ASN A 185 17.767 19.165 27.267 1.00 14.64 O ATOM 1753 CB ASN A 185 19.521 17.019 27.084 1.00 17.35 C ATOM 1754 CG ASN A 185 18.530 16.536 28.159 1.00 25.58 C ATOM 1755 OD1 ASN A 185 17.424 16.042 27.815 1.00 32.60 O ATOM 1756 ND2 ASN A 185 18.898 16.700 29.467 1.00 29.35 N ATOM 1757 HD22 ASN A 185 19.824 17.113 29.699 1.00 0.00 H ATOM 1758 HD21 ASN A 185 18.252 16.411 30.229 1.00 0.00 H ATOM 1759 H ASN A 185 19.731 17.010 23.891 1.00 0.00 H ATOM 1760 N SER A 186 17.559 19.408 24.994 1.00 12.25 N ATOM 1761 CA SER A 186 16.836 20.707 25.127 1.00 11.52 C ATOM 1762 C SER A 186 15.548 20.631 24.325 1.00 10.92 C ATOM 1763 O SER A 186 15.396 21.330 23.317 1.00 10.84 O ATOM 1764 CB SER A 186 17.722 21.868 24.602 1.00 12.34 C ATOM 1765 OG SER A 186 18.840 22.108 25.470 1.00 11.41 O ATOM 1766 HG SER A 186 18.510 22.347 26.372 1.00 0.00 H ATOM 1767 H SER A 186 17.742 19.019 24.047 1.00 0.00 H ATOM 1768 N PRO A 187 14.626 19.757 24.722 1.00 11.16 N ATOM 1769 CA PRO A 187 13.431 19.586 23.905 1.00 11.79 C ATOM 1770 C PRO A 187 12.602 20.884 23.852 1.00 10.90 C ATOM 1771 O PRO A 187 11.949 21.170 22.811 1.00 11.34 O ATOM 1772 CB PRO A 187 12.680 18.448 24.617 1.00 10.52 C ATOM 1773 CG PRO A 187 13.204 18.497 26.061 1.00 12.16 C ATOM 1774 CD PRO A 187 14.639 18.830 25.895 1.00 12.74 C ATOM 1775 N GLU A 188 12.648 21.714 24.890 1.00 11.91 N ATOM 1776 CA GLU A 188 11.861 22.948 24.757 1.00 11.44 C ATOM 1777 C GLU A 188 12.419 23.903 23.731 1.00 11.33 C ATOM 1778 O GLU A 188 11.647 24.532 22.974 1.00 10.34 O ATOM 1779 CB GLU A 188 11.752 23.687 26.110 1.00 11.57 C ATOM 1780 CG GLU A 188 10.815 22.870 27.028 1.00 12.43 C ATOM 1781 CD GLU A 188 10.731 23.382 28.503 1.00 13.58 C ATOM 1782 OE1 GLU A 188 11.738 23.952 28.971 1.00 17.25 O ATOM 1783 OE2 GLU A 188 9.688 23.111 29.202 1.00 19.72 O ATOM 1784 H GLU A 188 13.206 21.503 25.742 1.00 0.00 H ATOM 1785 N GLU A 189 13.755 23.961 23.659 1.00 10.67 N ATOM 1786 CA GLU A 189 14.385 24.814 22.666 1.00 8.86 C ATOM 1787 C GLU A 189 14.046 24.263 21.246 1.00 8.51 C ATOM 1788 O GLU A 189 13.788 25.020 20.299 1.00 9.41 O ATOM 1789 CB GLU A 189 15.873 24.850 22.894 1.00 9.39 C ATOM 1790 CG GLU A 189 16.541 25.796 21.934 1.00 10.86 C ATOM 1791 CD GLU A 189 16.270 27.314 22.211 1.00 13.91 C ATOM 1792 OE1 GLU A 189 15.787 27.587 23.334 1.00 11.10 O ATOM 1793 OE2 GLU A 189 16.650 28.180 21.395 1.00 17.23 O ATOM 1794 H GLU A 189 14.338 23.398 24.311 1.00 0.00 H ATOM 1795 N ALA A 190 14.066 22.944 21.136 1.00 9.30 N ATOM 1796 CA ALA A 190 13.681 22.302 19.860 1.00 8.73 C ATOM 1797 C ALA A 190 12.295 22.626 19.386 1.00 11.13 C ATOM 1798 O ALA A 190 12.072 23.011 18.260 1.00 9.76 O ATOM 1799 CB ALA A 190 13.809 20.723 19.998 1.00 10.37 C ATOM 1800 H ALA A 190 14.352 22.359 21.947 1.00 0.00 H ATOM 1801 N ILE A 191 11.329 22.536 20.296 1.00 10.20 N ATOM 1802 CA ILE A 191 9.933 22.856 19.955 1.00 12.09 C ATOM 1803 C ILE A 191 9.758 24.349 19.665 1.00 9.47 C ATOM 1804 O ILE A 191 9.094 24.695 18.689 1.00 10.51 O ATOM 1805 CB ILE A 191 9.063 22.431 21.145 1.00 11.50 C ATOM 1806 CG1 ILE A 191 9.083 20.906 21.196 1.00 13.43 C ATOM 1807 CG2 ILE A 191 7.588 22.897 20.957 1.00 12.32 C ATOM 1808 CD1 ILE A 191 8.612 20.359 22.644 1.00 15.56 C ATOM 1809 H ILE A 191 11.564 22.235 21.263 1.00 0.00 H ATOM 1810 N SER A 192 10.393 25.218 20.445 1.00 10.14 N ATOM 1811 CA SER A 192 10.281 26.645 20.220 1.00 10.18 C ATOM 1812 C SER A 192 10.865 27.026 18.871 1.00 11.85 C ATOM 1813 O SER A 192 10.243 27.792 18.083 1.00 10.81 O ATOM 1814 CB SER A 192 11.043 27.424 21.284 1.00 11.02 C ATOM 1815 OG SER A 192 10.761 28.798 21.142 1.00 8.45 O ATOM 1816 HG SER A 192 11.042 29.100 20.242 1.00 0.00 H ATOM 1817 H SER A 192 10.980 24.868 21.229 1.00 0.00 H ATOM 1818 N LEU A 193 12.039 26.444 18.568 1.00 10.24 N ATOM 1819 CA LEU A 193 12.631 26.769 17.276 1.00 9.86 C ATOM 1820 C LEU A 193 11.766 26.288 16.147 1.00 10.78 C ATOM 1821 O LEU A 193 11.556 26.998 15.130 1.00 10.27 O ATOM 1822 CB LEU A 193 14.062 26.211 17.174 1.00 10.31 C ATOM 1823 CG LEU A 193 14.694 26.435 15.798 1.00 10.69 C ATOM 1824 CD1 LEU A 193 14.874 27.910 15.453 1.00 12.18 C ATOM 1825 CD2 LEU A 193 16.159 25.863 15.915 1.00 11.26 C ATOM 1826 H LEU A 193 12.505 25.789 19.228 1.00 0.00 H ATOM 1827 N ALA A 194 11.270 25.054 16.268 1.00 9.86 N ATOM 1828 CA ALA A 194 10.520 24.527 15.108 1.00 10.04 C ATOM 1829 C ALA A 194 9.180 25.314 14.906 1.00 11.20 C ATOM 1830 O ALA A 194 8.789 25.597 13.760 1.00 11.00 O ATOM 1831 CB ALA A 194 10.252 23.028 15.355 1.00 11.25 C ATOM 1832 H ALA A 194 11.404 24.493 17.133 1.00 0.00 H ATOM 1833 N LYS A 195 8.554 25.663 16.021 1.00 9.77 N ATOM 1834 CA LYS A 195 7.306 26.465 16.032 1.00 10.75 C ATOM 1835 C LYS A 195 7.506 27.836 15.438 1.00 10.21 C ATOM 1836 O LYS A 195 6.773 28.255 14.524 1.00 11.35 O ATOM 1837 CB LYS A 195 6.822 26.642 17.486 1.00 10.28 C ATOM 1838 CG LYS A 195 6.005 25.500 17.943 1.00 10.73 C ATOM 1839 CD LYS A 195 5.466 25.745 19.379 1.00 16.89 C ATOM 1840 CE LYS A 195 4.301 24.835 19.721 1.00 16.24 C ATOM 1841 NZ LYS A 195 4.259 24.447 21.142 1.00 19.92 N ATOM 1842 HZ1 LYS A 195 5.134 23.941 21.388 1.00 0.00 H ATOM 1843 HZ2 LYS A 195 4.173 25.300 21.731 1.00 0.00 H ATOM 1844 HZ3 LYS A 195 3.441 23.827 21.307 1.00 0.00 H ATOM 1845 H LYS A 195 8.957 25.360 16.931 1.00 0.00 H ATOM 1846 N THR A 196 8.492 28.581 15.934 1.00 10.58 N ATOM 1847 CA THR A 196 8.749 29.917 15.412 1.00 10.91 C ATOM 1848 C THR A 196 9.123 29.893 13.910 1.00 10.97 C ATOM 1849 O THR A 196 8.723 30.773 13.113 1.00 11.68 O ATOM 1850 CB THR A 196 9.837 30.559 16.229 1.00 12.52 C ATOM 1851 OG1 THR A 196 9.277 30.912 17.519 1.00 14.44 O ATOM 1852 CG2 THR A 196 10.465 31.820 15.510 1.00 10.96 C ATOM 1853 HG1 THR A 196 9.976 31.337 18.076 1.00 0.00 H ATOM 1854 H THR A 196 9.085 28.206 16.702 1.00 0.00 H ATOM 1855 N THR A 197 9.916 28.893 13.570 1.00 9.05 N ATOM 1856 CA THR A 197 10.349 28.775 12.165 1.00 7.87 C ATOM 1857 C THR A 197 9.149 28.500 11.267 1.00 10.04 C ATOM 1858 O THR A 197 8.985 29.134 10.190 1.00 10.42 O ATOM 1859 CB THR A 197 11.346 27.621 12.014 1.00 8.14 C ATOM 1860 OG1 THR A 197 12.504 27.896 12.824 1.00 9.76 O ATOM 1861 CG2 THR A 197 11.820 27.517 10.529 1.00 9.27 C ATOM 1862 HG1 THR A 197 12.230 27.980 13.772 1.00 0.00 H ATOM 1863 H THR A 197 10.230 28.201 14.280 1.00 0.00 H ATOM 1864 N PHE A 198 8.285 27.591 11.725 1.00 9.79 N ATOM 1865 CA PHE A 198 7.087 27.276 10.914 1.00 9.58 C ATOM 1866 C PHE A 198 6.202 28.527 10.754 1.00 10.42 C ATOM 1867 O PHE A 198 5.764 28.859 9.659 1.00 10.81 O ATOM 1868 CB PHE A 198 6.378 26.068 11.547 1.00 9.77 C ATOM 1869 CG PHE A 198 5.136 25.651 10.795 1.00 9.86 C ATOM 1870 CD1 PHE A 198 5.157 24.578 9.953 1.00 11.86 C ATOM 1871 CD2 PHE A 198 3.912 26.383 10.941 1.00 13.95 C ATOM 1872 CE1 PHE A 198 3.984 24.170 9.249 1.00 13.27 C ATOM 1873 CE2 PHE A 198 2.762 25.968 10.238 1.00 16.22 C ATOM 1874 CZ PHE A 198 2.821 24.850 9.401 1.00 18.02 C ATOM 1875 H PHE A 198 8.450 27.113 12.634 1.00 0.00 H ATOM 1876 N ASP A 199 5.940 29.203 11.849 1.00 11.05 N ATOM 1877 CA ASP A 199 4.967 30.354 11.859 1.00 13.38 C ATOM 1878 C ASP A 199 5.553 31.481 11.024 1.00 12.40 C ATOM 1879 O ASP A 199 4.775 32.100 10.273 1.00 13.61 O ATOM 1880 CB ASP A 199 4.658 30.792 13.317 1.00 13.21 C ATOM 1881 CG ASP A 199 3.856 29.753 14.086 1.00 17.19 C ATOM 1882 OD1 ASP A 199 3.251 28.805 13.450 1.00 23.83 O ATOM 1883 OD2 ASP A 199 3.856 29.800 15.333 1.00 22.74 O ATOM 1884 H ASP A 199 6.417 28.937 12.734 1.00 0.00 H ATOM 1885 N GLU A 200 6.851 31.752 11.098 1.00 11.22 N ATOM 1886 CA GLU A 200 7.484 32.793 10.299 1.00 10.03 C ATOM 1887 C GLU A 200 7.431 32.468 8.805 1.00 12.17 C ATOM 1888 O GLU A 200 7.187 33.365 7.961 1.00 12.84 O ATOM 1889 CB GLU A 200 8.886 33.087 10.866 1.00 10.93 C ATOM 1890 CG GLU A 200 8.690 33.677 12.263 1.00 10.59 C ATOM 1891 CD GLU A 200 9.927 34.158 12.964 1.00 18.56 C ATOM 1892 OE1 GLU A 200 9.771 34.435 14.190 1.00 23.27 O ATOM 1893 OE2 GLU A 200 11.018 34.237 12.340 1.00 16.87 O ATOM 1894 H GLU A 200 7.440 31.199 11.753 1.00 0.00 H ATOM 1895 N ALA A 201 7.589 31.188 8.476 1.00 9.27 N ATOM 1896 CA ALA A 201 7.551 30.831 7.051 1.00 9.77 C ATOM 1897 C ALA A 201 6.069 30.960 6.569 1.00 10.74 C ATOM 1898 O ALA A 201 5.807 31.456 5.457 1.00 11.45 O ATOM 1899 CB ALA A 201 8.062 29.356 6.857 1.00 10.59 C ATOM 1900 H ALA A 201 7.735 30.462 9.206 1.00 0.00 H ATOM 1901 N MET A 202 5.126 30.475 7.365 1.00 11.25 N ATOM 1902 CA MET A 202 3.689 30.533 7.001 1.00 10.88 C ATOM 1903 C MET A 202 3.320 31.940 6.550 1.00 11.72 C ATOM 1904 O MET A 202 2.638 32.143 5.503 1.00 11.06 O ATOM 1905 CB MET A 202 2.846 30.163 8.226 1.00 9.74 C ATOM 1906 CG MET A 202 1.389 30.193 7.915 1.00 11.80 C ATOM 1907 SD MET A 202 0.836 28.990 6.726 1.00 20.97 S ATOM 1908 CE MET A 202 1.843 27.579 7.008 1.00 8.39 C ATOM 1909 H MET A 202 5.401 30.042 8.270 1.00 0.00 H ATOM 1910 N ALA A 203 3.788 32.903 7.327 1.00 10.19 N ATOM 1911 CA ALA A 203 3.446 34.312 7.110 1.00 11.11 C ATOM 1912 C ALA A 203 4.041 34.904 5.845 1.00 12.18 C ATOM 1913 O ALA A 203 3.628 35.965 5.425 1.00 12.65 O ATOM 1914 CB ALA A 203 3.842 35.189 8.337 1.00 14.76 C ATOM 1915 H ALA A 203 4.418 32.653 8.116 1.00 0.00 H ATOM 1916 N ASP A 204 5.078 34.250 5.295 1.00 10.71 N ATOM 1917 CA ASP A 204 5.863 34.725 4.145 1.00 11.58 C ATOM 1918 C ASP A 204 5.416 33.988 2.841 1.00 11.24 C ATOM 1919 O ASP A 204 5.930 34.262 1.742 1.00 12.56 O ATOM 1920 CB ASP A 204 7.375 34.425 4.431 1.00 12.16 C ATOM 1921 CG ASP A 204 8.354 35.133 3.431 1.00 12.05 C ATOM 1922 OD1 ASP A 204 9.357 34.507 2.918 1.00 13.19 O ATOM 1923 OD2 ASP A 204 8.155 36.335 3.203 1.00 9.10 O ATOM 1924 H ASP A 204 5.347 33.337 5.715 1.00 0.00 H ATOM 1925 N LEU A 205 4.580 32.936 2.956 1.00 10.16 N ATOM 1926 CA LEU A 205 4.244 32.088 1.815 1.00 11.24 C ATOM 1927 C LEU A 205 3.578 32.877 0.693 1.00 10.78 C ATOM 1928 O LEU A 205 3.706 32.498 -0.436 1.00 12.02 O ATOM 1929 CB LEU A 205 3.363 30.868 2.165 1.00 10.93 C ATOM 1930 CG LEU A 205 4.088 29.819 3.054 1.00 12.83 C ATOM 1931 CD1 LEU A 205 2.956 28.816 3.464 1.00 12.86 C ATOM 1932 CD2 LEU A 205 5.137 29.063 2.183 1.00 12.65 C ATOM 1933 H LEU A 205 4.162 32.722 3.884 1.00 0.00 H ATOM 1934 N HIS A 206 2.889 33.934 1.069 1.00 11.54 N ATOM 1935 CA HIS A 206 2.087 34.723 0.105 1.00 13.26 C ATOM 1936 C HIS A 206 3.024 35.353 -0.960 1.00 15.89 C ATOM 1937 O HIS A 206 2.562 35.665 -2.045 1.00 15.79 O ATOM 1938 CB HIS A 206 1.220 35.749 0.870 1.00 13.63 C ATOM 1939 CG HIS A 206 2.012 36.905 1.361 1.00 15.09 C ATOM 1940 ND1 HIS A 206 2.588 36.964 2.612 1.00 20.38 N ATOM 1941 CD2 HIS A 206 2.362 38.054 0.727 1.00 13.51 C ATOM 1942 CE1 HIS A 206 3.246 38.102 2.745 1.00 19.95 C ATOM 1943 NE2 HIS A 206 3.120 38.782 1.617 1.00 23.25 N ATOM 1944 H HIS A 206 2.908 34.222 2.068 1.00 0.00 H ATOM 1945 N THR A 207 4.308 35.521 -0.629 1.00 15.80 N ATOM 1946 CA THR A 207 5.289 36.129 -1.517 1.00 17.50 C ATOM 1947 C THR A 207 5.810 35.213 -2.608 1.00 16.67 C ATOM 1948 O THR A 207 6.497 35.689 -3.553 1.00 17.31 O ATOM 1949 CB THR A 207 6.545 36.654 -0.657 1.00 16.10 C ATOM 1950 OG1 THR A 207 7.279 35.532 -0.115 1.00 16.03 O ATOM 1951 CG2 THR A 207 6.144 37.575 0.433 1.00 14.98 C ATOM 1952 HG1 THR A 207 6.683 35.001 0.470 1.00 0.00 H ATOM 1953 H THR A 207 4.622 35.202 0.310 1.00 0.00 H ATOM 1954 N LEU A 208 5.512 33.920 -2.514 1.00 15.94 N ATOM 1955 CA LEU A 208 6.173 32.939 -3.321 1.00 15.54 C ATOM 1956 C LEU A 208 5.411 32.567 -4.594 1.00 16.94 C ATOM 1957 O LEU A 208 4.196 32.532 -4.601 1.00 16.93 O ATOM 1958 CB LEU A 208 6.398 31.713 -2.513 1.00 15.78 C ATOM 1959 CG LEU A 208 7.236 31.925 -1.209 1.00 13.30 C ATOM 1960 CD1 LEU A 208 7.457 30.511 -0.670 1.00 13.06 C ATOM 1961 CD2 LEU A 208 8.571 32.626 -1.536 1.00 12.96 C ATOM 1962 H LEU A 208 4.782 33.615 -1.839 1.00 0.00 H ATOM 1963 N SER A 209 6.140 32.225 -5.661 1.00 17.04 N ATOM 1964 CA SER A 209 5.581 31.480 -6.790 1.00 19.16 C ATOM 1965 C SER A 209 5.082 30.085 -6.419 1.00 18.91 C ATOM 1966 O SER A 209 5.403 29.568 -5.333 1.00 18.84 O ATOM 1967 CB SER A 209 6.683 31.362 -7.874 1.00 17.07 C ATOM 1968 OG SER A 209 7.641 30.375 -7.441 1.00 19.90 O ATOM 1969 HG SER A 209 8.040 30.659 -6.581 1.00 0.00 H ATOM 1970 H SER A 209 7.143 32.499 -5.690 1.00 0.00 H ATOM 1971 N GLU A 210 4.282 29.476 -7.283 1.00 18.71 N ATOM 1972 CA GLU A 210 3.831 28.132 -7.080 1.00 21.04 C ATOM 1973 C GLU A 210 4.999 27.159 -6.823 1.00 21.87 C ATOM 1974 O GLU A 210 4.920 26.337 -5.931 1.00 19.09 O ATOM 1975 CB GLU A 210 3.013 27.704 -8.299 1.00 23.36 C ATOM 1976 CG GLU A 210 2.441 26.316 -8.171 1.00 31.63 C ATOM 1977 CD GLU A 210 1.372 26.139 -9.205 1.00 41.16 C ATOM 1978 OE1 GLU A 210 0.731 27.174 -9.557 1.00 41.53 O ATOM 1979 OE2 GLU A 210 1.184 24.986 -9.646 1.00 45.13 O ATOM 1980 H GLU A 210 3.973 29.989 -8.133 1.00 0.00 H ATOM 1981 N ASP A 211 6.109 27.272 -7.576 1.00 20.25 N ATOM 1982 CA ASP A 211 7.188 26.290 -7.371 1.00 21.55 C ATOM 1983 C ASP A 211 7.940 26.592 -6.054 1.00 18.48 C ATOM 1984 O ASP A 211 8.256 25.648 -5.342 1.00 19.23 O ATOM 1985 CB ASP A 211 8.189 26.317 -8.522 1.00 23.43 C ATOM 1986 CG ASP A 211 7.598 25.770 -9.827 1.00 31.74 C ATOM 1987 OD1 ASP A 211 6.436 25.284 -9.856 1.00 31.34 O ATOM 1988 OD2 ASP A 211 8.335 25.821 -10.830 1.00 37.94 O ATOM 1989 H ASP A 211 6.202 28.030 -8.282 1.00 0.00 H ATOM 1990 N SER A 212 8.151 27.853 -5.727 1.00 17.39 N ATOM 1991 CA SER A 212 8.851 28.175 -4.454 1.00 15.82 C ATOM 1992 C SER A 212 7.960 27.747 -3.284 1.00 17.49 C ATOM 1993 O SER A 212 8.442 27.248 -2.252 1.00 14.83 O ATOM 1994 CB SER A 212 9.165 29.666 -4.336 1.00 18.00 C ATOM 1995 OG SER A 212 10.183 29.948 -5.345 1.00 19.22 O ATOM 1996 HG SER A 212 10.423 30.908 -5.310 1.00 0.00 H ATOM 1997 H SER A 212 7.830 28.617 -6.355 1.00 0.00 H ATOM 1998 N TYR A 213 6.638 27.956 -3.470 1.00 15.74 N ATOM 1999 CA TYR A 213 5.695 27.525 -2.427 1.00 15.65 C ATOM 2000 C TYR A 213 5.779 26.045 -2.133 1.00 16.46 C ATOM 2001 O TYR A 213 5.836 25.658 -0.952 1.00 14.42 O ATOM 2002 CB TYR A 213 4.291 27.906 -2.896 1.00 14.16 C ATOM 2003 CG TYR A 213 3.165 27.488 -2.002 1.00 13.16 C ATOM 2004 CD1 TYR A 213 2.655 28.380 -1.068 1.00 14.16 C ATOM 2005 CD2 TYR A 213 2.596 26.202 -2.154 1.00 15.04 C ATOM 2006 CE1 TYR A 213 1.584 27.998 -0.248 1.00 21.63 C ATOM 2007 CE2 TYR A 213 1.522 25.819 -1.362 1.00 19.54 C ATOM 2008 CZ TYR A 213 1.060 26.725 -0.435 1.00 15.63 C ATOM 2009 OH TYR A 213 -0.010 26.294 0.326 1.00 26.29 O ATOM 2010 HH TYR A 213 -0.271 27.008 0.960 1.00 0.00 H ATOM 2011 H TYR A 213 6.293 28.415 -4.337 1.00 0.00 H ATOM 2012 N LYS A 214 5.838 25.206 -3.180 1.00 15.86 N ATOM 2013 CA LYS A 214 5.957 23.775 -2.973 1.00 16.53 C ATOM 2014 C LYS A 214 7.285 23.427 -2.232 1.00 16.56 C ATOM 2015 O LYS A 214 7.248 22.594 -1.303 1.00 17.04 O ATOM 2016 CB LYS A 214 5.811 23.046 -4.317 1.00 17.93 C ATOM 2017 CG LYS A 214 4.444 23.241 -4.957 1.00 18.06 C ATOM 2018 H LYS A 214 5.798 25.585 -4.148 1.00 0.00 H ATOM 2019 N ASP A 215 8.402 24.071 -2.625 1.00 15.89 N ATOM 2020 CA ASP A 215 9.755 23.789 -1.994 1.00 16.50 C ATOM 2021 C ASP A 215 9.683 24.105 -0.487 1.00 16.66 C ATOM 2022 O ASP A 215 10.104 23.329 0.377 1.00 16.54 O ATOM 2023 CB ASP A 215 10.822 24.706 -2.601 1.00 18.08 C ATOM 2024 CG ASP A 215 11.171 24.365 -4.082 1.00 21.79 C ATOM 2025 OD1 ASP A 215 11.004 23.190 -4.517 1.00 25.45 O ATOM 2026 OD2 ASP A 215 11.635 25.296 -4.762 1.00 26.23 O ATOM 2027 H ASP A 215 8.336 24.781 -3.382 1.00 0.00 H ATOM 2028 N SER A 216 9.134 25.269 -0.172 1.00 14.96 N ATOM 2029 CA SER A 216 9.051 25.720 1.261 1.00 12.26 C ATOM 2030 C SER A 216 8.057 24.921 2.070 1.00 13.51 C ATOM 2031 O SER A 216 8.337 24.492 3.185 1.00 12.52 O ATOM 2032 CB SER A 216 8.657 27.170 1.309 1.00 12.50 C ATOM 2033 OG SER A 216 9.689 27.944 0.794 1.00 14.92 O ATOM 2034 HG SER A 216 10.506 27.804 1.335 1.00 0.00 H ATOM 2035 H SER A 216 8.756 25.879 -0.925 1.00 0.00 H ATOM 2036 N THR A 217 6.863 24.672 1.503 1.00 12.60 N ATOM 2037 CA THR A 217 5.885 23.920 2.298 1.00 11.97 C ATOM 2038 C THR A 217 6.343 22.461 2.583 1.00 13.46 C ATOM 2039 O THR A 217 6.014 21.903 3.625 1.00 13.46 O ATOM 2040 CB THR A 217 4.439 23.967 1.680 1.00 13.08 C ATOM 2041 OG1 THR A 217 4.463 23.420 0.360 1.00 14.32 O ATOM 2042 CG2 THR A 217 3.914 25.455 1.697 1.00 11.85 C ATOM 2043 HG1 THR A 217 5.080 23.950 -0.204 1.00 0.00 H ATOM 2044 H THR A 217 6.642 24.999 0.541 1.00 0.00 H ATOM 2045 N LEU A 218 7.097 21.869 1.660 1.00 13.81 N ATOM 2046 CA LEU A 218 7.630 20.552 1.880 1.00 14.71 C ATOM 2047 C LEU A 218 8.452 20.515 3.195 1.00 12.83 C ATOM 2048 O LEU A 218 8.266 19.612 4.034 1.00 13.55 O ATOM 2049 CB LEU A 218 8.458 20.140 0.675 1.00 14.61 C ATOM 2050 CG LEU A 218 8.918 18.663 0.645 1.00 24.70 C ATOM 2051 CD1 LEU A 218 9.497 18.299 -0.709 1.00 29.37 C ATOM 2052 CD2 LEU A 218 9.961 18.431 1.681 1.00 29.48 C ATOM 2053 H LEU A 218 7.303 22.365 0.769 1.00 0.00 H ATOM 2054 N ILE A 219 9.318 21.499 3.361 1.00 12.81 N ATOM 2055 CA ILE A 219 10.188 21.507 4.603 1.00 13.73 C ATOM 2056 C ILE A 219 9.402 21.915 5.816 1.00 14.12 C ATOM 2057 O ILE A 219 9.576 21.429 6.913 1.00 13.26 O ATOM 2058 CB ILE A 219 11.408 22.416 4.395 1.00 14.55 C ATOM 2059 CG1 ILE A 219 12.171 21.950 3.143 1.00 18.33 C ATOM 2060 CG2 ILE A 219 12.303 22.341 5.706 1.00 12.95 C ATOM 2061 CD1 ILE A 219 13.281 22.848 2.816 1.00 19.88 C ATOM 2062 H ILE A 219 9.402 22.255 2.652 1.00 0.00 H ATOM 2063 N MET A 220 8.464 22.839 5.618 1.00 12.28 N ATOM 2064 CA MET A 220 7.520 23.178 6.753 1.00 11.39 C ATOM 2065 C MET A 220 6.791 21.943 7.249 1.00 12.33 C ATOM 2066 O MET A 220 6.557 21.837 8.485 1.00 11.26 O ATOM 2067 CB MET A 220 6.517 24.262 6.311 1.00 11.05 C ATOM 2068 CG MET A 220 7.227 25.611 6.077 1.00 10.74 C ATOM 2069 SD MET A 220 5.996 26.763 5.261 1.00 13.87 S ATOM 2070 CE MET A 220 4.857 26.882 6.530 1.00 15.82 C ATOM 2071 H MET A 220 8.381 23.320 4.700 1.00 0.00 H ATOM 2072 N GLN A 221 6.380 21.058 6.325 1.00 11.83 N ATOM 2073 CA GLN A 221 5.710 19.834 6.804 1.00 12.83 C ATOM 2074 C GLN A 221 6.613 18.980 7.678 1.00 13.15 C ATOM 2075 O GLN A 221 6.114 18.326 8.652 1.00 14.30 O ATOM 2076 CB GLN A 221 5.136 19.050 5.618 1.00 14.37 C ATOM 2077 CG GLN A 221 4.444 17.767 6.075 1.00 18.85 C ATOM 2078 CD GLN A 221 3.177 18.068 6.818 1.00 26.76 C ATOM 2079 OE1 GLN A 221 2.384 18.893 6.363 1.00 28.86 O ATOM 2080 NE2 GLN A 221 2.961 17.413 7.969 1.00 28.36 N ATOM 2081 HE22 GLN A 221 3.660 16.724 8.314 1.00 0.00 H ATOM 2082 HE21 GLN A 221 2.095 17.594 8.516 1.00 0.00 H ATOM 2083 H GLN A 221 6.529 21.230 5.310 1.00 0.00 H ATOM 2084 N LEU A 222 7.905 18.917 7.331 1.00 12.08 N ATOM 2085 CA LEU A 222 8.884 18.239 8.209 1.00 11.94 C ATOM 2086 C LEU A 222 8.990 18.867 9.612 1.00 13.14 C ATOM 2087 O LEU A 222 9.060 18.136 10.627 1.00 13.72 O ATOM 2088 CB LEU A 222 10.296 18.207 7.609 1.00 12.48 C ATOM 2089 CG LEU A 222 10.344 17.560 6.191 1.00 16.08 C ATOM 2090 CD1 LEU A 222 11.724 17.771 5.678 1.00 15.01 C ATOM 2091 CD2 LEU A 222 9.957 16.086 6.162 1.00 18.19 C ATOM 2092 H LEU A 222 8.222 19.347 6.439 1.00 0.00 H ATOM 2093 N LEU A 223 8.952 20.208 9.718 1.00 11.13 N ATOM 2094 CA LEU A 223 8.929 20.831 11.038 1.00 11.63 C ATOM 2095 C LEU A 223 7.670 20.437 11.780 1.00 13.13 C ATOM 2096 O LEU A 223 7.697 20.107 12.960 1.00 12.88 O ATOM 2097 CB LEU A 223 8.917 22.355 10.875 1.00 10.46 C ATOM 2098 CG LEU A 223 10.244 22.890 10.319 1.00 12.23 C ATOM 2099 CD1 LEU A 223 10.027 24.355 9.767 1.00 14.06 C ATOM 2100 CD2 LEU A 223 11.305 23.033 11.455 1.00 11.91 C ATOM 2101 H LEU A 223 8.939 20.799 8.862 1.00 0.00 H ATOM 2102 N ARG A 224 6.544 20.483 11.049 1.00 12.49 N ATOM 2103 CA ARG A 224 5.238 20.081 11.669 1.00 15.17 C ATOM 2104 C ARG A 224 5.234 18.620 12.141 1.00 15.73 C ATOM 2105 O ARG A 224 4.730 18.323 13.228 1.00 17.89 O ATOM 2106 CB ARG A 224 4.105 20.318 10.677 1.00 17.85 C ATOM 2107 CG ARG A 224 2.701 19.853 11.122 1.00 21.45 C ATOM 2108 CD ARG A 224 2.224 20.586 12.355 1.00 32.24 C ATOM 2109 NE ARG A 224 2.371 22.049 12.329 1.00 39.17 N ATOM 2110 CZ ARG A 224 2.247 22.843 13.406 1.00 43.57 C ATOM 2111 NH1 ARG A 224 1.948 22.327 14.625 1.00 42.69 N ATOM 2112 NH2 ARG A 224 2.404 24.168 13.269 1.00 41.99 N ATOM 2113 HE ARG A 224 2.585 22.499 11.416 1.00 0.00 H ATOM 2114 HH12 ARG A 224 1.856 22.956 15.448 1.00 0.00 H ATOM 2115 HH11 ARG A 224 1.811 21.302 14.736 1.00 0.00 H ATOM 2116 HH22 ARG A 224 2.310 24.791 14.096 1.00 0.00 H ATOM 2117 HH21 ARG A 224 2.620 24.572 12.335 1.00 0.00 H ATOM 2118 H ARG A 224 6.577 20.796 10.058 1.00 0.00 H ATOM 2119 N ASP A 225 5.808 17.739 11.352 1.00 16.72 N ATOM 2120 CA ASP A 225 5.834 16.289 11.699 1.00 16.14 C ATOM 2121 C ASP A 225 6.643 16.123 12.987 1.00 15.87 C ATOM 2122 O ASP A 225 6.303 15.311 13.896 1.00 16.72 O ATOM 2123 CB ASP A 225 6.550 15.519 10.626 1.00 18.94 C ATOM 2124 CG ASP A 225 5.751 15.361 9.337 1.00 24.21 C ATOM 2125 OD1 ASP A 225 4.535 15.624 9.355 1.00 24.70 O ATOM 2126 OD2 ASP A 225 6.413 14.977 8.343 1.00 27.89 O ATOM 2127 H ASP A 225 6.253 18.060 10.468 1.00 0.00 H ATOM 2128 N ASN A 226 7.758 16.864 13.091 1.00 14.69 N ATOM 2129 CA ASN A 226 8.506 16.809 14.361 1.00 14.66 C ATOM 2130 C ASN A 226 7.718 17.370 15.526 1.00 14.73 C ATOM 2131 O ASN A 226 7.754 16.755 16.637 1.00 15.95 O ATOM 2132 CB ASN A 226 9.865 17.497 14.255 1.00 12.95 C ATOM 2133 CG ASN A 226 10.849 16.689 13.446 1.00 18.53 C ATOM 2134 OD1 ASN A 226 10.714 15.442 13.347 1.00 19.77 O ATOM 2135 ND2 ASN A 226 11.933 17.362 12.960 1.00 16.90 N ATOM 2136 HD22 ASN A 226 11.996 18.394 13.068 1.00 0.00 H ATOM 2137 HD21 ASN A 226 12.696 16.842 12.482 1.00 0.00 H ATOM 2138 H ASN A 226 8.084 17.458 12.302 1.00 0.00 H ATOM 2139 N LEU A 227 7.082 18.518 15.331 1.00 13.63 N ATOM 2140 CA LEU A 227 6.277 19.084 16.403 1.00 14.93 C ATOM 2141 C LEU A 227 5.182 18.156 16.856 1.00 16.56 C ATOM 2142 O LEU A 227 4.936 18.122 18.052 1.00 18.86 O ATOM 2143 CB LEU A 227 5.657 20.382 16.033 1.00 15.39 C ATOM 2144 CG LEU A 227 6.697 21.497 15.973 1.00 14.07 C ATOM 2145 CD1 LEU A 227 6.167 22.589 15.068 1.00 16.58 C ATOM 2146 CD2 LEU A 227 7.083 21.967 17.385 1.00 14.95 C ATOM 2147 H LEU A 227 7.158 19.010 14.418 1.00 0.00 H ATOM 2148 N THR A 228 4.619 17.408 15.921 1.00 17.52 N ATOM 2149 CA THR A 228 3.612 16.358 16.293 1.00 21.83 C ATOM 2150 C THR A 228 4.205 15.229 17.120 1.00 23.37 C ATOM 2151 O THR A 228 3.553 14.742 18.082 1.00 25.41 O ATOM 2152 CB THR A 228 2.938 15.848 15.040 1.00 21.72 C ATOM 2153 OG1 THR A 228 2.304 16.977 14.456 1.00 25.24 O ATOM 2154 CG2 THR A 228 1.886 14.688 15.397 1.00 25.24 C ATOM 2155 HG1 THR A 228 1.842 16.701 13.625 1.00 0.00 H ATOM 2156 H THR A 228 4.875 17.548 14.923 1.00 0.00 H ATOM 2157 N LEU A 229 5.438 14.839 16.798 1.00 23.38 N ATOM 2158 CA LEU A 229 6.146 13.792 17.484 1.00 25.11 C ATOM 2159 C LEU A 229 6.490 14.287 18.896 1.00 26.04 C ATOM 2160 O LEU A 229 6.363 13.534 19.885 1.00 25.46 O ATOM 2161 CB LEU A 229 7.362 13.366 16.661 1.00 26.40 C ATOM 2162 CG LEU A 229 8.274 12.155 16.933 1.00 31.52 C ATOM 2163 CD1 LEU A 229 7.455 10.839 17.225 1.00 35.98 C ATOM 2164 CD2 LEU A 229 9.147 12.000 15.676 1.00 33.64 C ATOM 2165 H LEU A 229 5.914 15.318 16.007 1.00 0.00 H ATOM 2166 N TRP A 230 6.848 15.572 19.027 1.00 23.78 N ATOM 2167 CA TRP A 230 7.458 16.068 20.269 1.00 23.93 C ATOM 2168 C TRP A 230 6.445 16.674 21.252 1.00 25.88 C ATOM 2169 O TRP A 230 6.804 17.010 22.380 1.00 25.16 O ATOM 2170 CB TRP A 230 8.485 17.172 19.891 1.00 21.99 C ATOM 2171 CG TRP A 230 9.606 16.707 19.088 1.00 21.47 C ATOM 2172 CD1 TRP A 230 10.054 15.444 18.953 1.00 17.99 C ATOM 2173 CD2 TRP A 230 10.508 17.547 18.328 1.00 17.74 C ATOM 2174 NE1 TRP A 230 11.161 15.391 18.156 1.00 18.16 N ATOM 2175 CE2 TRP A 230 11.463 16.682 17.737 1.00 17.36 C ATOM 2176 CE3 TRP A 230 10.547 18.921 18.057 1.00 15.50 C ATOM 2177 CZ2 TRP A 230 12.528 17.145 16.910 1.00 16.50 C ATOM 2178 CZ3 TRP A 230 11.622 19.404 17.241 1.00 15.34 C ATOM 2179 CH2 TRP A 230 12.589 18.501 16.680 1.00 16.36 C ATOM 2180 HE1 TRP A 230 11.689 14.531 17.905 1.00 0.00 H ATOM 2181 H TRP A 230 6.692 16.229 18.236 1.00 0.00 H ATOM 2182 N THR A 231 5.214 16.898 20.795 1.00 26.74 N ATOM 2183 CA THR A 231 4.236 17.510 21.656 1.00 29.64 C ATOM 2184 C THR A 231 3.000 16.618 21.843 1.00 32.59 C ATOM 2185 O THR A 231 3.080 15.399 21.521 1.00 34.15 O ATOM 2186 CB THR A 231 3.887 18.947 21.208 1.00 29.43 C ATOM 2187 OG1 THR A 231 3.272 18.928 19.902 1.00 30.57 O ATOM 2188 CG2 THR A 231 5.119 19.798 21.187 1.00 28.57 C ATOM 2189 OXT THR A 231 1.923 17.068 22.298 1.00 34.27 O ATOM 2190 HG1 THR A 231 3.899 18.528 19.249 1.00 0.00 H ATOM 2191 H THR A 231 4.961 16.632 19.822 1.00 0.00 H TER 2192 THR A 231 HETATM 2193 MG MG A 1 7.360 22.913 28.731 1.00 8.56 MG HETATM 2194 CA CA A 2 35.422 6.187 -13.504 1.00 19.05 CA HETATM 2195 MG MG A 3 41.275 20.899 -15.643 1.00 8.05 MG HETATM 2196 O HOH 4 33.626 9.319 22.592 1.00 34.61 O HETATM 2197 O HOH 5 19.162 37.614 0.661 1.00 19.55 O HETATM 2198 O HOH 6 37.971 -2.909 18.637 1.00 29.75 O HETATM 2199 O HOH 7 31.746 26.936 13.298 1.00 31.01 O HETATM 2200 O HOH 8 3.306 25.946 14.515 1.00 43.15 O HETATM 2201 O HOH 9 34.920 18.158 26.366 1.00 33.93 O HETATM 2202 O HOH 10 43.365 10.194 -10.312 1.00 28.53 O HETATM 2203 O HOH 11 38.026 9.784 13.321 1.00 43.01 O HETATM 2204 O HOH 12 20.889 15.269 -8.452 1.00 32.21 O HETATM 2205 O HOH 13 43.206 23.960 6.288 1.00 31.62 O HETATM 2206 O HOH 14 4.600 36.715 12.801 1.00 29.30 O HETATM 2207 O HOH 15 19.307 31.709 16.932 1.00 33.97 O HETATM 2208 O HOH 16 22.835 7.436 15.030 1.00 23.21 O HETATM 2209 O HOH 17 34.303 1.072 22.598 1.00 33.40 O HETATM 2210 O HOH 18 32.097 -14.899 20.740 1.00 25.51 O HETATM 2211 O HOH 19 23.225 19.425 3.531 1.00 40.45 O HETATM 2212 O HOH 20 19.778 14.865 -5.855 1.00 36.74 O HETATM 2213 O HOH 21 1.351 14.575 19.247 1.00 25.01 O HETATM 2214 O HOH 22 15.032 16.120 28.543 1.00 42.56 O HETATM 2215 O HOH 23 20.047 8.299 4.045 1.00 49.23 O HETATM 2216 O HOH 24 11.090 30.826 19.701 1.00 23.03 O HETATM 2217 O HOH 25 23.606 12.167 -15.341 1.00 26.42 O HETATM 2218 O HOH 26 18.579 6.366 -3.508 1.00 46.01 O HETATM 2219 O HOH 27 17.144 30.668 21.565 1.00 13.29 O HETATM 2220 O HOH 28 30.064 -3.749 24.940 1.00 27.84 O HETATM 2221 O HOH 29 18.018 23.705 27.277 1.00 22.12 O HETATM 2222 O HOH 30 40.395 16.846 1.789 1.00 26.44 O HETATM 2223 O HOH 31 23.477 13.739 23.635 1.00 34.29 O HETATM 2224 O HOH 32 -0.527 17.454 21.641 1.00 41.49 O HETATM 2225 O HOH 33 27.217 38.032 -1.472 1.00 25.36 O HETATM 2226 O HOH 34 24.491 18.337 5.725 1.00 22.09 O HETATM 2227 O HOH 35 38.746 -6.807 21.549 1.00 20.55 O HETATM 2228 O HOH 36 41.991 25.110 10.156 1.00 40.45 O HETATM 2229 O HOH 37 5.198 31.376 16.895 1.00 30.60 O HETATM 2230 O HOH 38 8.670 13.747 8.686 1.00 29.81 O HETATM 2231 O HOH 39 26.958 3.816 4.046 1.00 20.20 O HETATM 2232 O HOH 40 21.242 18.878 -0.579 1.00 50.59 O HETATM 2233 O HOH 41 13.566 13.496 16.874 1.00 37.56 O HETATM 2234 O HOH 42 42.480 20.200 -17.757 1.00 16.05 O HETATM 2235 O HOH 43 30.092 37.131 3.370 1.00 43.49 O HETATM 2236 O HOH 44 6.423 18.135 24.712 1.00 42.88 O HETATM 2237 O HOH 45 30.323 27.785 23.406 1.00 36.48 O HETATM 2238 O HOH 46 39.509 11.083 3.923 1.00 36.50 O HETATM 2239 O HOH 47 22.907 2.172 -2.737 1.00 33.54 O HETATM 2240 O HOH 48 19.175 3.195 -9.319 1.00 41.56 O HETATM 2241 O HOH 49 27.022 1.161 21.824 1.00 30.20 O HETATM 2242 O HOH 50 7.397 35.969 8.308 1.00 25.50 O HETATM 2243 O HOH 51 22.434 17.616 -10.061 1.00 28.43 O HETATM 2244 O HOH 52 23.276 16.601 25.932 1.00 29.05 O HETATM 2245 O HOH 53 30.226 4.898 21.013 1.00 15.85 O HETATM 2246 O HOH 54 21.404 16.495 1.036 1.00 26.85 O HETATM 2247 O HOH 55 11.611 20.270 13.868 1.00 24.94 O HETATM 2248 O HOH 56 18.808 -5.126 19.178 1.00 29.88 O HETATM 2249 O HOH 57 20.663 2.022 18.954 1.00 31.55 O HETATM 2250 O HOH 58 26.189 9.179 13.985 1.00 10.00 O HETATM 2251 O HOH 59 33.000 0.007 -0.005 1.00 54.11 O HETATM 2252 O HOH 60 32.374 0.756 2.171 1.00 51.70 O HETATM 2253 O HOH 61 28.980 -13.056 25.400 1.00 39.77 O HETATM 2254 O HOH 62 32.896 7.352 20.935 1.00 26.73 O HETATM 2255 O HOH 63 22.709 0.739 7.012 1.00 24.47 O HETATM 2256 O HOH 64 28.747 20.876 25.200 1.00 17.85 O HETATM 2257 O HOH 65 30.755 36.518 -2.262 1.00 27.77 O HETATM 2258 O HOH 66 25.940 32.359 -4.959 1.00 15.18 O HETATM 2259 O HOH 67 29.939 29.167 -5.907 1.00 24.37 O HETATM 2260 O HOH 68 1.538 33.817 3.727 1.00 11.26 O HETATM 2261 O HOH 69 41.915 14.828 -5.041 1.00 28.86 O HETATM 2262 O HOH 70 10.322 35.298 16.666 1.00 17.14 O HETATM 2263 O HOH 71 26.289 23.958 -11.605 1.00 22.00 O HETATM 2264 O HOH 72 25.326 15.975 3.865 1.00 17.09 O HETATM 2265 O HOH 73 36.288 22.705 -7.157 1.00 10.47 O HETATM 2266 O HOH 74 39.029 20.105 -20.000 1.00 21.89 O HETATM 2267 O HOH 75 28.869 21.691 -12.854 1.00 16.80 O HETATM 2268 O HOH 76 19.868 21.951 -5.178 1.00 58.78 O HETATM 2269 O HOH 77 4.967 13.091 13.188 1.00 27.36 O HETATM 2270 O HOH 78 2.124 24.592 16.062 1.00 60.36 O HETATM 2271 O HOH 79 20.666 13.684 15.587 1.00 12.80 O HETATM 2272 O HOH 80 22.576 -8.874 22.313 1.00 34.64 O HETATM 2273 O HOH 81 33.784 27.727 -1.059 1.00 11.62 O HETATM 2274 O HOH 82 34.178 10.451 20.125 1.00 25.98 O HETATM 2275 O HOH 83 29.978 -10.396 21.368 1.00 26.69 O HETATM 2276 O HOH 84 33.235 26.865 -9.672 1.00 21.60 O HETATM 2277 O HOH 85 36.421 29.316 -7.623 1.00 17.87 O HETATM 2278 O HOH 86 19.695 10.636 -4.699 1.00 27.43 O HETATM 2279 O HOH 87 33.638 1.580 -5.772 1.00 32.95 O HETATM 2280 O HOH 88 9.947 35.540 0.334 1.00 25.01 O HETATM 2281 O HOH 89 37.120 -2.919 16.117 1.00 19.81 O HETATM 2282 O HOH 90 23.171 8.075 19.463 1.00 22.05 O HETATM 2283 O HOH 91 31.739 27.019 -2.623 1.00 11.99 O HETATM 2284 O HOH 92 28.975 -6.762 24.094 1.00 38.66 O HETATM 2285 O HOH 93 34.941 10.054 0.477 1.00 18.99 O HETATM 2286 O HOH 94 36.961 23.707 -3.274 1.00 15.46 O HETATM 2287 O HOH 95 32.497 16.293 -18.437 1.00 44.19 O HETATM 2288 O HOH 96 27.330 23.193 23.885 1.00 21.89 O HETATM 2289 O HOH 97 12.415 27.666 -3.679 1.00 25.97 O HETATM 2290 O HOH 98 30.773 3.047 3.785 1.00 49.46 O HETATM 2291 O HOH 99 21.226 5.387 0.682 1.00 29.17 O HETATM 2292 O HOH 100 36.086 21.321 11.863 1.00 22.00 O HETATM 2293 O HOH 101 6.393 15.070 5.613 1.00 29.04 O HETATM 2294 O HOH 102 8.873 15.580 23.705 1.00 27.78 O HETATM 2295 O HOH 103 38.721 4.688 16.138 1.00 38.91 O HETATM 2296 O HOH 104 34.194 22.622 20.824 1.00 25.29 O HETATM 2297 O HOH 105 35.740 6.082 6.903 1.00 18.88 O HETATM 2298 O HOH 106 11.728 25.965 -7.415 1.00 28.68 O HETATM 2299 O HOH 107 11.085 20.772 -3.227 1.00 32.67 O HETATM 2300 O HOH 108 38.099 7.239 12.090 1.00 22.65 O HETATM 2301 O HOH 109 31.981 24.767 15.092 1.00 17.98 O HETATM 2302 O HOH 110 30.233 18.337 -15.532 1.00 15.32 O HETATM 2303 O HOH 111 7.326 17.050 3.729 1.00 22.77 O HETATM 2304 O HOH 112 37.991 10.920 -3.593 1.00 16.85 O HETATM 2305 O HOH 113 41.910 22.987 -10.188 1.00 22.15 O HETATM 2306 O HOH 114 11.999 21.535 -0.492 1.00 21.22 O HETATM 2307 O HOH 115 18.407 10.692 14.438 1.00 37.27 O HETATM 2308 O HOH 116 18.328 5.643 -12.079 1.00 31.44 O HETATM 2309 O HOH 117 11.050 28.936 -1.388 1.00 17.18 O HETATM 2310 O HOH 118 5.388 26.352 -12.177 1.00 39.56 O HETATM 2311 O HOH 119 38.153 28.375 -3.501 1.00 32.01 O HETATM 2312 O HOH 120 21.467 0.748 -8.943 1.00 23.17 O HETATM 2313 O HOH 121 33.162 29.899 10.674 1.00 40.04 O HETATM 2314 O HOH 122 14.867 15.529 24.387 1.00 25.21 O HETATM 2315 O HOH 123 33.537 7.668 -0.687 1.00 13.23 O HETATM 2316 O HOH 124 22.060 12.413 -10.881 1.00 15.13 O HETATM 2317 O HOH 125 35.113 -14.790 21.556 1.00 25.81 O HETATM 2318 O HOH 126 14.534 26.608 25.612 1.00 18.81 O HETATM 2319 O HOH 127 34.050 4.256 -3.855 1.00 34.39 O HETATM 2320 O HOH 128 26.292 20.698 -12.597 1.00 36.99 O HETATM 2321 O HOH 129 41.907 32.921 -1.447 1.00 43.70 O HETATM 2322 O HOH 130 18.116 27.783 19.049 1.00 17.62 O HETATM 2323 O HOH 131 41.110 16.676 -6.917 1.00 12.88 O HETATM 2324 O HOH 132 27.557 17.553 -15.327 1.00 17.80 O HETATM 2325 O HOH 133 37.253 26.692 5.310 1.00 14.22 O HETATM 2326 O HOH 134 23.863 28.653 20.403 1.00 22.20 O HETATM 2327 O HOH 135 23.345 26.255 -1.332 1.00 20.07 O HETATM 2328 O HOH 136 42.895 13.827 -1.025 1.00 32.08 O HETATM 2329 O HOH 137 1.711 19.671 15.495 1.00 43.95 O HETATM 2330 O HOH 138 15.564 33.667 15.371 1.00 48.88 O HETATM 2331 O HOH 139 19.048 1.420 12.330 1.00 19.24 O HETATM 2332 O HOH 140 13.792 30.388 12.932 1.00 15.19 O HETATM 2333 O HOH 141 6.235 28.565 -10.067 1.00 19.96 O HETATM 2334 O HOH 142 36.443 12.275 14.949 1.00 37.44 O HETATM 2335 O HOH 143 11.894 31.823 -0.249 1.00 18.35 O HETATM 2336 O HOH 144 20.723 37.298 12.782 1.00 22.94 O HETATM 2337 O HOH 145 2.772 21.518 7.299 1.00 32.99 O HETATM 2338 O HOH 146 38.885 15.767 3.950 1.00 16.85 O HETATM 2339 O HOH 147 20.290 23.565 23.388 1.00 17.03 O HETATM 2340 O HOH 148 17.449 28.916 9.995 1.00 20.67 O HETATM 2341 O HOH 149 41.247 20.146 7.191 1.00 33.83 O HETATM 2342 O HOH 150 19.002 15.067 23.865 1.00 22.94 O HETATM 2343 O HOH 151 36.070 34.008 -2.107 1.00 24.71 O HETATM 2344 O HOH 152 8.053 20.807 29.464 1.00 24.11 O HETATM 2345 O HOH 153 19.087 23.492 4.560 1.00 19.48 O HETATM 2346 O HOH 154 16.726 22.465 2.822 1.00 26.03 O HETATM 2347 O HOH 155 32.600 10.810 17.790 1.00 12.75 O HETATM 2348 O HOH 156 18.879 -2.661 22.996 1.00 40.33 O HETATM 2349 O HOH 157 42.020 25.999 7.314 1.00 40.59 O HETATM 2350 O HOH 158 39.621 21.641 -1.100 1.00 20.61 O HETATM 2351 O HOH 159 2.012 37.929 6.715 1.00 14.13 O HETATM 2352 O HOH 160 35.937 24.434 13.818 1.00 48.21 O HETATM 2353 O HOH 161 12.320 31.933 11.269 1.00 13.55 O HETATM 2354 O HOH 162 37.244 16.261 12.773 1.00 38.81 O HETATM 2355 O HOH 163 2.668 33.643 11.431 1.00 27.23 O HETATM 2356 O HOH 164 19.475 -4.101 16.571 1.00 24.42 O HETATM 2357 O HOH 165 20.067 9.899 6.338 1.00 42.49 O HETATM 2358 O HOH 166 40.882 19.394 2.229 1.00 21.44 O HETATM 2359 O HOH 167 38.507 17.033 9.863 1.00 33.85 O HETATM 2360 O HOH 168 35.907 16.802 -18.859 1.00 16.95 O HETATM 2361 O HOH 169 33.583 21.497 -13.533 1.00 15.67 O HETATM 2362 O HOH 170 24.670 36.926 0.307 1.00 28.30 O HETATM 2363 O HOH 171 7.652 39.190 11.444 1.00 40.56 O HETATM 2364 O HOH 172 30.873 29.500 -3.099 1.00 23.34 O HETATM 2365 O HOH 173 36.955 0.844 10.767 1.00 22.60 O HETATM 2366 O HOH 174 43.955 17.864 -9.269 1.00 19.41 O HETATM 2367 O HOH 175 40.159 13.292 13.566 1.00 41.45 O HETATM 2368 O HOH 176 11.108 30.765 9.122 1.00 12.11 O HETATM 2369 O HOH 177 26.953 7.899 22.061 1.00 27.83 O HETATM 2370 O HOH 178 15.516 30.663 10.856 1.00 23.59 O HETATM 2371 O HOH 179 23.670 21.956 4.166 1.00 17.58 O HETATM 2372 O HOH 180 14.115 27.996 20.015 1.00 43.23 O HETATM 2373 O HOH 181 31.157 -7.398 22.759 1.00 20.14 O HETATM 2374 O HOH 182 35.006 21.971 9.547 1.00 19.68 O HETATM 2375 O HOH 183 22.412 18.724 -7.426 1.00 20.50 O HETATM 2376 O HOH 184 27.117 -10.625 22.461 1.00 48.58 O HETATM 2377 O HOH 185 31.570 1.611 -4.035 1.00 28.27 O HETATM 2378 O HOH 186 14.635 32.447 -0.745 1.00 27.58 O HETATM 2379 O HOH 187 26.646 11.786 -18.327 1.00 29.89 O HETATM 2380 O HOH 188 20.189 10.793 17.365 1.00 33.80 O HETATM 2381 O HOH 189 37.009 20.333 -15.923 1.00 13.58 O HETATM 2382 O HOH 190 35.562 24.582 9.280 1.00 17.96 O HETATM 2383 O HOH 191 28.544 30.560 16.696 1.00 26.00 O HETATM 2384 O HOH 192 19.969 41.632 4.443 1.00 41.26 O HETATM 2385 O HOH 193 22.459 10.701 7.004 1.00 16.63 O HETATM 2386 O HOH 194 18.495 7.707 -1.067 1.00 43.81 O HETATM 2387 O HOH 195 28.126 30.461 19.127 1.00 31.71 O HETATM 2388 O HOH 196 40.372 26.268 -2.294 1.00 19.14 O HETATM 2389 O HOH 197 1.780 16.228 11.677 1.00 40.27 O HETATM 2390 O HOH 198 9.098 32.650 -5.669 1.00 18.89 O HETATM 2391 O HOH 199 21.365 24.679 -1.704 1.00 35.05 O HETATM 2392 O HOH 200 35.486 31.537 7.574 1.00 27.52 O HETATM 2393 O HOH 201 20.680 17.523 5.480 1.00 22.53 O HETATM 2394 O HOH 202 3.371 31.124 -9.547 1.00 29.19 O HETATM 2395 O HOH 203 26.106 12.819 -15.794 1.00 17.14 O HETATM 2396 O HOH 204 10.371 15.510 10.169 1.00 21.76 O HETATM 2397 O HOH 205 19.238 30.649 -1.312 1.00 46.44 O HETATM 2398 O HOH 206 39.093 10.620 7.654 1.00 29.30 O HETATM 2399 O HOH 207 19.313 10.956 -1.631 1.00 24.52 O HETATM 2400 O HOH 208 27.484 32.753 15.953 1.00 41.14 O HETATM 2401 O HOH 209 7.416 26.775 22.322 1.00 26.20 O HETATM 2402 O HOH 210 6.786 30.258 19.051 1.00 33.92 O HETATM 2403 O HOH 211 12.975 34.376 14.610 1.00 39.00 O HETATM 2404 O HOH 212 35.490 19.607 18.557 1.00 29.42 O HETATM 2405 O HOH 213 22.047 26.938 21.554 1.00 22.52 O HETATM 2406 O HOH 214 37.948 24.928 -1.033 1.00 25.94 O HETATM 2407 O HOH 215 26.900 -1.438 -5.739 1.00 17.45 O HETATM 2408 O HOH 216 12.981 29.973 18.586 1.00 30.02 O HETATM 2409 O HOH 217 33.334 -6.489 25.104 1.00 31.23 O HETATM 2410 O HOH 218 23.026 29.714 -4.718 1.00 35.40 O HETATM 2411 O HOH 219 43.410 9.461 -15.452 1.00 31.87 O HETATM 2412 O HOH 220 24.737 0.505 -5.385 1.00 37.73 O HETATM 2413 O HOH 221 40.397 12.452 -3.256 1.00 28.54 O HETATM 2414 O HOH 222 29.381 3.267 -4.447 1.00 11.30 O HETATM 2415 O HOH 223 18.410 35.317 0.104 1.00 32.62 O HETATM 2416 O HOH 224 5.105 38.842 9.618 1.00 31.89 O HETATM 2417 O HOH 225 35.722 -7.328 25.463 1.00 48.71 O HETATM 2418 O HOH 226 23.277 16.331 6.186 1.00 42.98 O HETATM 2419 O HOH 227 24.349 20.267 25.580 1.00 31.41 O HETATM 2420 O HOH 228 27.629 2.978 -1.979 1.00 32.57 O HETATM 2421 O HOH 229 22.118 7.535 17.338 1.00 39.24 O HETATM 2422 O HOH 230 39.169 21.894 -15.341 1.00 30.88 O HETATM 2423 O HOH 231 3.287 22.676 4.977 1.00 37.73 O HETATM 2424 O HOH 232 33.859 34.325 -4.804 1.00 16.41 O HETATM 2425 O HOH 233 35.142 5.378 -1.481 1.00 36.64 O HETATM 2426 O HOH 234 0.739 21.848 9.623 1.00 48.53 O HETATM 2427 O HOH 235 34.531 23.865 15.891 1.00 33.60 O HETATM 2428 O HOH 236 26.992 35.919 3.960 1.00 45.69 O HETATM 2429 O HOH 237 39.809 10.411 10.141 1.00 41.24 O HETATM 2430 O HOH 238 35.597 6.559 19.359 1.00 42.14 O HETATM 2431 O HOH 239 15.648 12.663 22.698 1.00 40.76 O HETATM 2432 O HOH 240 41.285 9.797 -11.404 1.00 25.70 O HETATM 2433 O HOH 241 34.532 -9.646 25.787 1.00 45.46 O HETATM 2434 O HOH 242 36.947 31.741 -6.475 1.00 31.47 O HETATM 2435 O HOH 243 17.114 41.019 8.037 1.00 41.52 O HETATM 2436 O HOH 244 34.477 7.022 -7.191 1.00 23.83 O HETATM 2437 O HOH 245 17.115 6.095 -8.250 1.00 40.05 O HETATM 2438 O HOH 246 23.918 25.891 25.445 1.00 36.73 O HETATM 2439 O HOH 247 36.672 8.328 5.188 1.00 34.30 O HETATM 2440 O HOH 248 37.802 27.717 7.677 1.00 35.49 O HETATM 2441 O HOH 249 19.808 27.905 22.340 1.00 36.90 O HETATM 2442 O HOH 250 40.988 17.978 4.773 1.00 39.51 O HETATM 2443 O HOH 251 35.519 5.330 -5.729 1.00 35.59 O HETATM 2444 O HOH 252 0.086 32.268 1.800 1.00 16.01 O HETATM 2445 O HOH 253 40.029 13.314 4.353 1.00 31.85 O HETATM 2446 O HOH 254 17.629 40.347 10.797 1.00 44.77 O HETATM 2447 O HOH 255 21.583 17.252 -5.414 1.00 35.60 O HETATM 2448 O HOH 256 12.494 14.786 25.335 1.00 32.94 O HETATM 2449 O HOH 257 34.774 35.082 2.078 1.00 35.83 O HETATM 2450 O HOH 258 16.373 38.382 2.074 1.00 42.00 O HETATM 2451 O HOH 259 32.512 4.987 3.090 1.00 32.24 O HETATM 2452 O HOH 260 39.887 22.481 -17.352 1.00 31.10 O HETATM 2453 O HOH 261 37.889 -0.138 15.340 1.00 27.34 O HETATM 2454 O HOH 262 18.443 0.367 15.034 1.00 27.95 O HETATM 2455 O HOH 263 22.765 11.307 -17.804 1.00 40.09 O HETATM 2456 O HOH 264 38.241 14.988 23.015 1.00 41.65 O HETATM 2457 O HOH 265 4.041 19.812 1.600 1.00 41.69 O HETATM 2458 O HOH 266 14.128 31.419 15.386 1.00 23.22 O HETATM 2459 O HOH 267 19.559 17.068 3.085 1.00 31.39 O HETATM 2460 O HOH 268 42.547 10.803 -1.467 1.00 50.53 O HETATM 2461 O HOH 269 38.479 19.563 10.268 1.00 36.64 O HETATM 2462 O HOH 270 34.392 4.308 4.989 1.00 42.68 O HETATM 2463 O HOH 271 6.204 33.466 15.766 1.00 25.86 O HETATM 2464 O HOH 272 2.935 32.292 17.959 1.00 44.57 O HETATM 2465 O HOH 273 21.513 10.540 19.795 1.00 30.62 O HETATM 2466 O HOH 274 32.453 4.638 22.645 1.00 35.05 O HETATM 2467 O HOH 275 25.913 24.198 26.568 1.00 41.78 O HETATM 2468 O HOH 276 37.128 -6.568 10.948 1.00 19.77 O HETATM 2469 O HOH 277 25.309 6.684 14.594 1.00 14.48 O HETATM 2470 O HOH 278 17.171 23.979 -0.498 1.00 46.34 O HETATM 2471 O HOH 279 19.728 31.593 20.563 1.00 35.32 O HETATM 2472 O HOH 280 32.475 -16.055 22.717 1.00 42.01 O HETATM 2473 O HOH 281 36.313 26.802 -2.140 1.00 20.06 O HETATM 2474 O HOH 282 22.196 14.091 -14.969 1.00 38.80 O HETATM 2475 O HOH 283 20.282 20.753 -7.305 1.00 35.80 O HETATM 2476 O HOH 284 26.185 15.509 -16.536 1.00 25.20 O HETATM 2477 O HOH 285 19.433 26.170 24.343 1.00 23.23 O HETATM 2478 O HOH 286 37.871 -4.692 14.328 1.00 24.08 O HETATM 2479 O HOH 287 34.696 9.164 3.034 1.00 24.84 O HETATM 2480 O HOH 288 17.817 29.733 17.019 1.00 29.25 O HETATM 2481 O HOH 289 11.172 33.793 -4.168 1.00 27.80 O HETATM 2482 O HOH 290 19.229 26.528 -3.083 1.00 33.83 O HETATM 2483 O HOH 291 19.456 39.541 12.348 1.00 42.68 O HETATM 2484 O HOH 292 17.001 27.112 -1.860 1.00 38.17 O HETATM 2485 O HOH 293 41.578 35.324 -0.635 1.00 37.14 O HETATM 2486 O HOH 294 28.526 3.302 22.495 1.00 26.10 O HETATM 2487 O HOH 295 28.380 36.084 6.045 1.00 40.17 O HETATM 2488 O HOH 296 26.049 18.910 -17.950 1.00 42.10 O HETATM 2489 O HOH 297 34.893 12.523 17.112 1.00 22.40 O HETATM 2490 O HOH 298 9.333 19.420 26.292 1.00 28.10 O HETATM 2491 O HOH 299 11.565 34.395 -1.530 1.00 22.79 O HETATM 2492 O HOH 300 20.742 1.673 5.619 1.00 35.08 O HETATM 2493 O HOH 301 19.576 17.432 -4.094 1.00 39.04 O HETATM 2494 O HOH 302 22.660 5.982 21.239 1.00 34.69 O HETATM 2495 O HOH 303 20.536 28.708 -2.908 1.00 45.95 O HETATM 2496 O HOH 304 42.889 22.238 -19.624 1.00 12.55 O HETATM 2497 O HOH 305 4.926 17.223 2.216 1.00 38.36 O HETATM 2498 O HOH 306 21.496 14.753 -12.190 1.00 36.36 O HETATM 2499 O HOH 307 9.622 15.598 2.422 1.00 39.04 O HETATM 2500 O HOH 308 39.405 8.492 -4.276 1.00 36.40 O HETATM 2501 O HOH 309 26.435 5.282 22.986 1.00 28.90 O HETATM 2502 O HOH 310 27.090 18.917 26.653 1.00 24.05 O HETATM 2503 O HOH 311 37.114 9.290 -0.936 1.00 24.28 O HETATM 2504 O HOH 312 19.247 -7.946 19.511 1.00 44.20 O HETATM 2505 O HOH 313 24.587 11.352 -19.804 1.00 37.74 O HETATM 2506 O HOH 314 14.002 35.787 -2.022 1.00 28.71 O HETATM 2507 O HOH 315 17.213 12.788 12.613 1.00 34.44 O HETATM 2508 O HOH 316 12.449 15.338 8.588 1.00 40.87 O HETATM 2509 O HOH 317 19.763 16.278 7.216 1.00 18.17 O HETATM 2510 O HOH 318 16.756 12.307 7.235 1.00 48.81 O HETATM 2511 O HOH 319 11.961 14.556 3.421 1.00 46.29 O HETATM 2512 N GLY A 320 14.438 12.601 12.257 1.00 0.24 N HETATM 2513 CA GLY A 320 13.579 13.799 12.120 1.00 0.05 C HETATM 2514 C GLY A 320 14.299 14.914 11.339 1.00 0.22 C HETATM 2515 O GLY A 320 13.717 15.909 11.013 1.00 -0.39 O HETATM 2516 N GLY A 320 15.589 14.757 11.017 1.00 -0.26 N HETATM 2517 CA GLY A 320 16.309 15.841 10.257 1.00 0.16 C HETATM 2518 CB GLY A 320 17.807 15.555 10.383 1.00 0.12 C HETATM 2519 OG GLY A 320 18.019 14.303 9.745 1.00 -0.27 O HETATM 2520 P GLY A 320 19.570 13.734 9.939 1.00 0.20 P HETATM 2521 O1P GLY A 320 19.481 12.491 8.930 1.00 -0.55 O HETATM 2522 O2P GLY A 320 20.572 14.840 9.467 1.00 -0.55 O HETATM 2523 O3P GLY A 320 19.469 13.260 11.450 1.00 -0.55 O HETATM 2524 H8 GLY A 320 18.098 15.499 11.442 1.00 0.07 H HETATM 2525 H9 GLY A 320 18.390 16.343 9.884 1.00 0.07 H HETATM 2526 C GLY A 320 15.924 15.852 8.764 1.00 0.21 C HETATM 2527 O GLY A 320 15.179 14.994 8.269 1.00 -0.39 O HETATM 2528 N GLY A 320 16.487 16.814 8.033 1.00 -0.26 N HETATM 2529 CA GLY A 320 16.171 17.056 6.629 1.00 0.13 C HETATM 2530 C GLY A 320 16.489 15.829 5.805 1.00 0.20 C HETATM 2531 O GLY A 320 17.439 15.056 6.103 1.00 -0.39 O HETATM 2532 N GLY A 320 15.707 15.639 4.753 1.00 -0.27 N HETATM 2533 CA GLY A 320 15.856 14.409 3.964 1.00 0.08 C HETATM 2534 C GLY A 320 15.222 13.278 4.752 1.00 0.06 C HETATM 2535 O GLY A 320 15.603 12.113 4.616 1.00 -0.57 O HETATM 2536 OXT GLY A 320 14.307 13.491 5.551 1.00 -0.57 O HETATM 2537 H22 GLY A 320 16.922 14.198 3.797 1.00 0.07 H HETATM 2538 H23 GLY A 320 15.348 14.521 2.995 1.00 0.07 H HETATM 2539 H21 GLY A 320 15.024 16.324 4.499 1.00 0.19 H HETATM 2540 CB GLY A 320 16.958 18.279 6.115 1.00 -0.01 C HETATM 2541 CG GLY A 320 16.624 18.835 4.704 1.00 -0.04 C HETATM 2542 CD1 GLY A 320 15.261 19.615 4.697 1.00 -0.06 C HETATM 2543 H15 GLY A 320 15.060 19.992 3.683 1.00 0.02 H HETATM 2544 H16 GLY A 320 15.319 20.460 5.398 1.00 0.02 H HETATM 2545 H17 GLY A 320 14.450 18.939 5.004 1.00 0.02 H HETATM 2546 CD2 GLY A 320 17.682 19.872 4.302 1.00 -0.06 C HETATM 2547 H18 GLY A 320 18.674 19.396 4.284 1.00 0.02 H HETATM 2548 H19 GLY A 320 17.684 20.696 5.031 1.00 0.02 H HETATM 2549 H20 GLY A 320 17.447 20.267 3.303 1.00 0.02 H HETATM 2550 H14 GLY A 320 16.594 18.007 3.981 1.00 0.03 H HETATM 2551 H12 GLY A 320 18.023 18.002 6.111 1.00 0.03 H HETATM 2552 H13 GLY A 320 16.794 19.096 6.833 1.00 0.03 H HETATM 2553 H11 GLY A 320 15.095 17.268 6.540 1.00 0.08 H HETATM 2554 H10 GLY A 320 17.165 17.404 8.472 1.00 0.19 H HETATM 2555 H7 GLY A 320 16.071 16.820 10.698 1.00 0.08 H HETATM 2556 H6 GLY A 320 16.073 13.923 11.280 1.00 0.19 H HETATM 2557 H4 GLY A 320 13.321 14.172 13.122 1.00 0.11 H HETATM 2558 H5 GLY A 320 12.659 13.522 11.584 1.00 0.11 H HETATM 2559 H1 GLY A 320 13.943 11.889 12.771 1.00 0.20 H HETATM 2560 H2 GLY A 320 15.281 12.847 12.752 1.00 0.20 H HETATM 2561 H3 GLY A 320 14.675 12.251 11.342 1.00 0.20 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 47 46 2195 CONECT 384 378 385 392 CONECT 385 384 386 388 CONECT 386 385 387 393 CONECT 387 386 CONECT 388 385 389 CONECT 389 388 390 CONECT 390 389 391 CONECT 391 390 CONECT 392 384 CONECT 710 711 714 715 716 CONECT 714 710 CONECT 715 710 CONECT 716 710 CONECT 1783 1781 2193 CONECT 2193 1783 CONECT 2195 47 CONECT 2512 2513 2559 2560 2561 CONECT 2513 2512 2514 2557 2558 CONECT 2514 2513 2515 2516 CONECT 2515 2514 CONECT 2516 2514 2517 2556 CONECT 2517 2516 2518 2526 2555 CONECT 2518 2517 2519 2524 2525 CONECT 2519 2518 2520 CONECT 2520 2519 2521 2522 2523 CONECT 2521 2520 CONECT 2522 2520 CONECT 2523 2520 CONECT 2524 2518 CONECT 2525 2518 CONECT 2526 2517 2527 2528 CONECT 2527 2526 CONECT 2528 2526 2529 2554 CONECT 2529 2528 2530 2540 2553 CONECT 2530 2529 2531 2532 CONECT 2531 2530 CONECT 2532 2530 2533 2539 CONECT 2533 2532 2534 2537 2538 CONECT 2534 2533 2535 2536 CONECT 2535 2534 CONECT 2536 2534 CONECT 2537 2533 CONECT 2538 2533 CONECT 2539 2532 CONECT 2540 2529 2541 2551 2552 CONECT 2541 2540 2542 2546 2550 CONECT 2542 2541 2543 2544 2545 CONECT 2543 2542 CONECT 2544 2542 CONECT 2545 2542 CONECT 2546 2541 2547 2548 2549 CONECT 2547 2546 CONECT 2548 2546 CONECT 2549 2546 CONECT 2550 2541 CONECT 2551 2540 CONECT 2552 2540 CONECT 2553 2529 CONECT 2554 2528 CONECT 2555 2517 CONECT 2556 2516 CONECT 2557 2513 CONECT 2558 2513 CONECT 2559 2512 CONECT 2560 2512 CONECT 2561 2512 MASTER 0 0 0 0 0 0 0 0 2559 2 71 18 END
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Related entries of code: 5btv
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3iqj
RCSB PDB
PDBbind
236aa, >3IQJ_1|Chain... at 100%
3iqu
RCSB PDB
PDBbind
236aa, >3IQU_1|Chain... at 100%
3iqv
RCSB PDB
PDBbind
236aa, >3IQV_1|Chain... at 100%
3t0l
RCSB PDB
PDBbind
235aa, >3T0L_1|Chain... at 100%
3t0m
RCSB PDB
PDBbind
235aa, >3T0M_1|Chain... at 100%
3ux0
RCSB PDB
PDBbind
235aa, >3UX0_1|Chain... at 100%
4dhm
RCSB PDB
PDBbind
235aa, >4DHM_1|Chain... at 100%
4dhn
RCSB PDB
PDBbind
235aa, >4DHN_1|Chain... at 100%
4dho
RCSB PDB
PDBbind
235aa, >4DHO_1|Chain... at 100%
4dhp
RCSB PDB
PDBbind
235aa, >4DHP_1|Chain... at 100%
4dhq
RCSB PDB
PDBbind
235aa, >4DHQ_1|Chain... at 100%
4dhr
RCSB PDB
PDBbind
235aa, >4DHR_1|Chain... at 100%
4dhs
RCSB PDB
PDBbind
235aa, >4DHS_1|Chain... at 100%
4dht
RCSB PDB
PDBbind
235aa, >4DHT_1|Chain... at 100%
4dhu
RCSB PDB
PDBbind
235aa, >4DHU_1|Chain... at 100%
4fr3
RCSB PDB
PDBbind
234aa, >4FR3_1|Chain... at 100%
4y32
RCSB PDB
PDBbind
236aa, >4Y32_1|Chains... at 100%
4y3b
RCSB PDB
PDBbind
236aa, >4Y3B_1|Chains... at 100%
4y5i
RCSB PDB
PDBbind
236aa, >4Y5I_1|Chains... at 100%
5mxo
RCSB PDB
PDBbind
236aa, >5MXO_1|Chain... at 100%
6fau
RCSB PDB
PDBbind
236aa, >6FAU_1|Chains... at 100%
6fav
RCSB PDB
PDBbind
236aa, >6FAV_1|Chains... at 100%
6faw
RCSB PDB
PDBbind
236aa, >6FAW_1|Chains... at 100%
6fbw
RCSB PDB
PDBbind
236aa, >6FBW_1|Chains... at 100%
6fby
RCSB PDB
PDBbind
236aa, >6FBY_1|Chains... at 100%
6fi4
RCSB PDB
PDBbind
236aa, >6FI4_1|Chain... at 100%
6fi5
RCSB PDB
PDBbind
236aa, >6FI5_1|Chain... at 100%
6ghp
RCSB PDB
PDBbind
236aa, >6GHP_1|Chain... at 100%
6hmt
RCSB PDB
PDBbind
236aa, >6HMT_1|Chain... at 99%
6hhp
RCSB PDB
PDBbind
236aa, >6HHP_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a07
RCSB PDB
PDBbind
4-mer
1a08
RCSB PDB
PDBbind
4-mer
1a09
RCSB PDB
PDBbind
4-mer
1a1e
RCSB PDB
PDBbind
4-mer
1a2c
RCSB PDB
PDBbind
4-mer
1aq7
RCSB PDB
PDBbind
4-mer
1e5j
RCSB PDB
PDBbind
4-mer
1ez9
RCSB PDB
PDBbind
4-mer
1gvk
RCSB PDB
PDBbind
4-mer
1ibc
RCSB PDB
PDBbind
4-mer
1is0
RCSB PDB
PDBbind
4-mer
1jyq
RCSB PDB
PDBbind
4-mer
1lkk
RCSB PDB
PDBbind
4-mer
1lkl
RCSB PDB
PDBbind
4-mer
1m21
RCSB PDB
PDBbind
4-mer
1n51
RCSB PDB
PDBbind
4-mer
1pop
RCSB PDB
PDBbind
4-mer
1ppi
RCSB PDB
PDBbind
4-mer
1s3k
RCSB PDB
PDBbind
4-mer
1tl9
RCSB PDB
PDBbind
4-mer
1ukt
RCSB PDB
PDBbind
4-mer
1y3p
RCSB PDB
PDBbind
4-mer
2i3h
RCSB PDB
PDBbind
4-mer
2n7b
RCSB PDB
PDBbind
4-mer
2psx
RCSB PDB
PDBbind
4-mer
2vsl
RCSB PDB
PDBbind
4-mer
2x6w
RCSB PDB
PDBbind
4-mer
2x6y
RCSB PDB
PDBbind
4-mer
2x85
RCSB PDB
PDBbind
4-mer
2xe4
RCSB PDB
PDBbind
4-mer
3che
RCSB PDB
PDBbind
4-mer
3d3x
RCSB PDB
PDBbind
4-mer
3jzg
RCSB PDB
PDBbind
4-mer
3k0k
RCSB PDB
PDBbind
4-mer
3k16
RCSB PDB
PDBbind
4-mer
3mp6
RCSB PDB
PDBbind
4-mer
3nii
RCSB PDB
PDBbind
4-mer
3nij
RCSB PDB
PDBbind
4-mer
3nik
RCSB PDB
PDBbind
4-mer
3nil
RCSB PDB
PDBbind
4-mer
3nim
RCSB PDB
PDBbind
4-mer
3ny3
RCSB PDB
PDBbind
4-mer
3qmk
RCSB PDB
PDBbind
4-mer
3t1n
RCSB PDB
PDBbind
4-mer
3t4p
RCSB PDB
PDBbind
4-mer
3u3z
RCSB PDB
PDBbind
4-mer
3uec
RCSB PDB
PDBbind
4-mer
3ut5
RCSB PDB
PDBbind
4-mer
3uw4
RCSB PDB
PDBbind
4-mer
3uw5
RCSB PDB
PDBbind
4-mer
3zyb
RCSB PDB
PDBbind
4-mer
4b9h
RCSB PDB
PDBbind
4-mer
4c16
RCSB PDB
PDBbind
4-mer
4c1t
RCSB PDB
PDBbind
4-mer
4dxg
RCSB PDB
PDBbind
4-mer
4fgt
RCSB PDB
PDBbind
4-mer
4fzc
RCSB PDB
PDBbind
4-mer
4fzg
RCSB PDB
PDBbind
4-mer
4gk7
RCSB PDB
PDBbind
4-mer
4hp0
RCSB PDB
PDBbind
4-mer
4i67
RCSB PDB
PDBbind
4-mer
4imq
RCSB PDB
PDBbind
4-mer
4imz
RCSB PDB
PDBbind
4-mer
4in9
RCSB PDB
PDBbind
4-mer
4inh
RCSB PDB
PDBbind
4-mer
4j44
RCSB PDB
PDBbind
4-mer
4j45
RCSB PDB
PDBbind
4-mer
4j46
RCSB PDB
PDBbind
4-mer
4j47
RCSB PDB
PDBbind
4-mer
4j48
RCSB PDB
PDBbind
4-mer
4k63
RCSB PDB
PDBbind
4-mer
4k66
RCSB PDB
PDBbind
4-mer
4kom
RCSB PDB
PDBbind
4-mer
4kx8
RCSB PDB
PDBbind
4-mer
4lkd
RCSB PDB
PDBbind
4-mer
4lke
RCSB PDB
PDBbind
4-mer
4lkf
RCSB PDB
PDBbind
4-mer
4mbp
RCSB PDB
PDBbind
4-mer
4q4i
RCSB PDB
PDBbind
4-mer
4trw
RCSB PDB
PDBbind
4-mer
4trz
RCSB PDB
PDBbind
4-mer
4x0z
RCSB PDB
PDBbind
4-mer
4x14
RCSB PDB
PDBbind
4-mer
4z7n
RCSB PDB
PDBbind
4-mer
4z7o
RCSB PDB
PDBbind
4-mer
5ab1
RCSB PDB
PDBbind
4-mer
5ajc
RCSB PDB
PDBbind
4-mer
5azf
RCSB PDB
PDBbind
4-mer
5e6o
RCSB PDB
PDBbind
4-mer
5efj
RCSB PDB
PDBbind
4-mer
5f2u
RCSB PDB
PDBbind
4-mer
5f90
RCSB PDB
PDBbind
4-mer
5izj
RCSB PDB
PDBbind
4-mer
5jop
RCSB PDB
PDBbind
4-mer
5jy0
RCSB PDB
PDBbind
4-mer
5tdb
RCSB PDB
PDBbind
4-mer
5vi6
RCSB PDB
PDBbind
4-mer
5wxp
RCSB PDB
PDBbind
4-mer
5yzd
RCSB PDB
PDBbind
4-mer
5zmq
RCSB PDB
PDBbind
4-mer
5zms
RCSB PDB
PDBbind
4-mer
6cct
RCSB PDB
PDBbind
4-mer
6ccu
RCSB PDB
PDBbind
4-mer
6cd8
RCSB PDB
PDBbind
4-mer
6cd9
RCSB PDB
PDBbind
4-mer
6cdc
RCSB PDB
PDBbind
4-mer
6m8w
RCSB PDB
PDBbind
4-mer
6m8y
RCSB PDB
PDBbind
4-mer
6m9f
RCSB PDB
PDBbind
4-mer
6msy
RCSB PDB
PDBbind
4-mer
6mu3
RCSB PDB
PDBbind
4-mer
6pu3
RCSB PDB
PDBbind
4-mer
6prg
RCSB PDB
PDBbind
4-mer
6n3f
RCSB PDB
PDBbind
4-mer
6jjn
RCSB PDB
PDBbind
4-mer
6jjm
RCSB PDB
PDBbind
4-mer
6hop
RCSB PDB
PDBbind
4-mer
Entry Information
PDB ID
5btv
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
human 14-3-3 protein sigma
Ligand Name
4-mer
EC.Number
E.C.-.-.-.-
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Kd=140uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Faseb J. Vol. 29: pp. 4133-4144
Ligand Properties
Formula
C
1
3
H
2
7
N
4
O
9
P
Molecular Weight
414.349
Exact Mass
414.152
No. of atoms
54
No. of bonds
53
Polar Surface Area
235.75
LOGP Value
-4.66 (
Computed with XLOGP3
)
-2.71 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 13
No. of Rings: 0
Canonical SMILES
[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)COP(O)(O)O
InChI String
InChI=1S/C13H27N4O9P/c1-7(2)3-8(12(21)15-5-11(19)20)17-13(22)9(16-10(18)4-14)6-26-27(23,24)25/h7-9,23-25,27H,3-6,14H2,1-2H3,(H,15,21)(H,16,18)(H,17,22)(H,19,20)/p+1/t8-,9-/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):
P31947
Entrez Gene ID
NCBI Entrez Gene ID:
2810
ASD
Information of known allosteric effects of PDB entries
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