Browse entries in the PDBbind-CN Database
HEADER 6I41_COMPLEX COMPND 6I41_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 1 ALA SEQRES 1 A 21 SER GLY LYS VAL VAL LYS PHE SER TYR MET TRP THR ILE SEQRES 2 A 21 ASN ASN PHE SER PHE CYS ARG GLU SEQRES 1 A 118 GLY GLU VAL ILE LYS SER SER THR PHE SER SER GLY ALA SEQRES 2 A 118 ASN ASP LYS LEU LYS TRP CYS LEU ARG VAL ASN PRO LYS SEQRES 3 A 118 GLY LEU ASP GLU GLU SER LYS ASP TYR LEU SER LEU TYR SEQRES 4 A 118 LEU LEU LEU VAL SER CYS PRO LYS SER GLU VAL ARG ALA SEQRES 5 A 118 LYS PHE LYS PHE SER ILE LEU ASN ALA LYS GLY GLU GLU SEQRES 6 A 118 THR LYS ALA MET GLU SER GLN ARG ALA TYR ARG PHE VAL SEQRES 7 A 118 GLN GLY LYS ASP TRP GLY PHE LYS LYS PHE ILE ARG ARG SEQRES 8 A 118 ASP PHE LEU LEU ASP GLU ALA ASN GLY LEU LEU PRO ASP SEQRES 9 A 118 ASP LYS LEU THR LEU PHE CYS GLU VAL SER VAL VAL GLN SEQRES 10 A 118 ASP HET LYS A 228 91 ATOM 1 CB ALA A 25 6.257 -7.680 17.218 1.00 72.65 C TER 2 ALA A 25 ATOM 3 N SER A 26 6.243 -8.872 13.616 1.00 59.80 N ATOM 4 CA SER A 26 6.086 -8.587 12.198 1.00 50.53 C ATOM 5 C SER A 26 5.526 -7.181 11.997 1.00 42.28 C ATOM 6 O SER A 26 4.630 -6.743 12.731 1.00 51.84 O ATOM 7 CB SER A 26 5.177 -9.622 11.530 1.00 47.04 C ATOM 8 OG SER A 26 4.700 -9.162 10.279 1.00 36.92 O ATOM 9 HG SER A 26 4.183 -8.328 10.411 1.00 0.00 H ATOM 10 H SER A 26 5.403 -9.135 14.170 1.00 0.00 H ATOM 11 N GLY A 27 6.069 -6.477 11.004 1.00 35.15 N ATOM 12 CA GLY A 27 5.520 -5.206 10.583 1.00 31.11 C ATOM 13 C GLY A 27 4.241 -5.410 9.789 1.00 28.84 C ATOM 14 O GLY A 27 3.778 -6.530 9.584 1.00 34.04 O ATOM 15 H GLY A 27 6.909 -6.851 10.519 1.00 0.00 H ATOM 16 N LYS A 28 3.665 -4.291 9.339 1.00 27.83 N ATOM 17 CA LYS A 28 2.358 -4.279 8.676 1.00 28.47 C ATOM 18 C LYS A 28 2.347 -3.300 7.515 1.00 27.92 C ATOM 19 O LYS A 28 2.860 -2.185 7.633 1.00 29.47 O ATOM 20 CB LYS A 28 1.238 -3.856 9.637 1.00 26.29 C ATOM 21 CG LYS A 28 1.097 -4.713 10.880 1.00 28.47 C ATOM 22 CD LYS A 28 -0.027 -4.183 11.795 1.00 37.03 C ATOM 23 CE LYS A 28 -0.341 -5.181 12.918 1.00 54.18 C ATOM 24 NZ LYS A 28 -1.516 -4.796 13.757 1.00 57.04 N ATOM 25 HZ1 LYS A 28 -1.334 -3.875 14.204 1.00 0.00 H ATOM 26 HZ2 LYS A 28 -2.363 -4.730 13.156 1.00 0.00 H ATOM 27 HZ3 LYS A 28 -1.666 -5.516 14.492 1.00 0.00 H ATOM 28 H LYS A 28 4.167 -3.389 9.465 1.00 0.00 H ATOM 29 N VAL A 29 1.741 -3.705 6.399 1.00 25.15 N ATOM 30 CA VAL A 29 1.362 -2.763 5.353 1.00 22.29 C ATOM 31 C VAL A 29 0.105 -2.059 5.854 1.00 28.84 C ATOM 32 O VAL A 29 -0.964 -2.675 5.923 1.00 30.56 O ATOM 33 CB VAL A 29 1.103 -3.476 4.019 1.00 21.11 C ATOM 34 CG1 VAL A 29 0.434 -2.519 2.981 1.00 22.11 C ATOM 35 CG2 VAL A 29 2.379 -4.067 3.454 1.00 21.86 C ATOM 36 H VAL A 29 1.534 -4.716 6.272 1.00 0.00 H ATOM 37 N VAL A 30 0.230 -0.784 6.236 1.00 22.41 N ATOM 38 CA VAL A 30 -0.887 -0.065 6.846 1.00 22.47 C ATOM 39 C VAL A 30 -1.599 0.908 5.902 1.00 26.52 C ATOM 40 O VAL A 30 -2.715 1.346 6.217 1.00 27.26 O ATOM 41 CB VAL A 30 -0.425 0.684 8.109 1.00 28.19 C ATOM 42 CG1 VAL A 30 0.283 -0.291 9.058 1.00 25.57 C ATOM 43 CG2 VAL A 30 0.493 1.827 7.724 1.00 35.56 C ATOM 44 H VAL A 30 1.137 -0.295 6.097 1.00 0.00 H ATOM 45 N LYS A 31 -0.996 1.263 4.768 1.00 27.00 N ATOM 46 CA LYS A 31 -1.713 1.994 3.721 1.00 22.43 C ATOM 47 C LYS A 31 -1.367 1.374 2.383 1.00 24.53 C ATOM 48 O LYS A 31 -0.278 0.833 2.199 1.00 19.56 O ATOM 49 CB LYS A 31 -1.368 3.492 3.693 1.00 35.73 C ATOM 50 CG LYS A 31 -1.200 4.140 5.033 1.00 41.19 C ATOM 51 CD LYS A 31 -1.161 5.663 4.935 1.00 53.57 C ATOM 52 CE LYS A 31 -0.488 6.288 6.161 1.00 69.18 C ATOM 53 NZ LYS A 31 -1.284 6.091 7.416 1.00 79.07 N ATOM 54 HZ1 LYS A 31 -2.220 6.531 7.304 1.00 0.00 H ATOM 55 HZ2 LYS A 31 -1.398 5.073 7.597 1.00 0.00 H ATOM 56 HZ3 LYS A 31 -0.785 6.532 8.215 1.00 0.00 H ATOM 57 H LYS A 31 0.004 1.016 4.624 1.00 0.00 H ATOM 58 N PHE A 32 -2.294 1.444 1.433 1.00 18.63 N ATOM 59 CA PHE A 32 -2.011 0.762 0.183 1.00 18.10 C ATOM 60 C PHE A 32 -2.945 1.321 -0.867 1.00 25.66 C ATOM 61 O PHE A 32 -4.066 1.724 -0.542 1.00 25.68 O ATOM 62 CB PHE A 32 -2.148 -0.764 0.281 1.00 32.70 C ATOM 63 CG PHE A 32 -3.383 -1.242 1.023 1.00 34.91 C ATOM 64 CD1 PHE A 32 -3.403 -1.285 2.422 1.00 31.48 C ATOM 65 CD2 PHE A 32 -4.485 -1.685 0.330 1.00 39.08 C ATOM 66 CE1 PHE A 32 -4.531 -1.725 3.101 1.00 39.41 C ATOM 67 CE2 PHE A 32 -5.607 -2.136 0.996 1.00 41.63 C ATOM 68 CZ PHE A 32 -5.633 -2.159 2.380 1.00 38.60 C ATOM 69 H PHE A 32 -3.183 1.964 1.579 1.00 0.00 H ATOM 70 N SER A 33 -2.478 1.330 -2.124 1.00 24.65 N ATOM 71 CA SER A 33 -3.298 1.775 -3.254 1.00 22.45 C ATOM 72 C SER A 33 -3.400 0.704 -4.335 1.00 26.01 C ATOM 73 O SER A 33 -2.382 0.250 -4.881 1.00 27.09 O ATOM 74 CB SER A 33 -2.767 3.076 -3.849 1.00 25.78 C ATOM 75 OG SER A 33 -2.359 3.967 -2.823 1.00 31.97 O ATOM 76 HG SER A 33 -1.643 3.544 -2.286 1.00 0.00 H ATOM 77 H SER A 33 -1.504 1.011 -2.302 1.00 0.00 H ATOM 78 N TYR A 34 -4.636 0.378 -4.696 1.00 27.55 N ATOM 79 CA TYR A 34 -4.957 -0.692 -5.630 1.00 16.57 C ATOM 80 C TYR A 34 -5.530 -0.059 -6.883 1.00 29.94 C ATOM 81 O TYR A 34 -6.481 0.723 -6.789 1.00 24.93 O ATOM 82 CB TYR A 34 -5.959 -1.645 -4.984 1.00 16.46 C ATOM 83 CG TYR A 34 -6.350 -2.834 -5.818 1.00 24.07 C ATOM 84 CD1 TYR A 34 -5.482 -3.898 -6.005 1.00 27.94 C ATOM 85 CD2 TYR A 34 -7.594 -2.882 -6.446 1.00 29.99 C ATOM 86 CE1 TYR A 34 -5.847 -4.996 -6.773 1.00 30.03 C ATOM 87 CE2 TYR A 34 -7.965 -3.970 -7.219 1.00 24.64 C ATOM 88 CZ TYR A 34 -7.094 -5.023 -7.380 1.00 28.68 C ATOM 89 OH TYR A 34 -7.471 -6.108 -8.153 1.00 27.81 O ATOM 90 HH TYR A 34 -6.737 -6.773 -8.167 1.00 0.00 H ATOM 91 H TYR A 34 -5.423 0.920 -4.286 1.00 0.00 H ATOM 92 N MET A 35 -4.934 -0.381 -8.030 1.00 24.19 N ATOM 93 CA MET A 35 -5.337 0.112 -9.340 1.00 25.93 C ATOM 94 C MET A 35 -5.925 -1.058 -10.110 1.00 27.08 C ATOM 95 O MET A 35 -5.326 -2.134 -10.151 1.00 22.74 O ATOM 96 CB MET A 35 -4.139 0.694 -10.091 1.00 26.69 C ATOM 97 CG MET A 35 -4.438 1.225 -11.475 1.00 38.99 C ATOM 98 SD MET A 35 -2.981 1.968 -12.252 1.00 42.10 S ATOM 99 CE MET A 35 -2.508 3.175 -11.023 1.00 48.25 C ATOM 100 H MET A 35 -4.123 -1.031 -7.987 1.00 0.00 H ATOM 101 N TRP A 36 -7.102 -0.861 -10.701 1.00 23.94 N ATOM 102 CA TRP A 36 -7.849 -1.957 -11.310 1.00 20.24 C ATOM 103 C TRP A 36 -8.395 -1.473 -12.639 1.00 31.88 C ATOM 104 O TRP A 36 -9.148 -0.500 -12.659 1.00 27.58 O ATOM 105 CB TRP A 36 -9.012 -2.385 -10.409 1.00 23.05 C ATOM 106 CG TRP A 36 -9.777 -3.554 -10.909 1.00 29.07 C ATOM 107 CD1 TRP A 36 -9.342 -4.512 -11.764 1.00 33.09 C ATOM 108 CD2 TRP A 36 -11.126 -3.890 -10.574 1.00 31.24 C ATOM 109 NE1 TRP A 36 -10.336 -5.444 -11.977 1.00 38.05 N ATOM 110 CE2 TRP A 36 -11.444 -5.074 -11.259 1.00 37.64 C ATOM 111 CE3 TRP A 36 -12.094 -3.299 -9.761 1.00 34.68 C ATOM 112 CZ2 TRP A 36 -12.694 -5.683 -11.155 1.00 38.62 C ATOM 113 CZ3 TRP A 36 -13.329 -3.907 -9.652 1.00 40.77 C ATOM 114 CH2 TRP A 36 -13.619 -5.084 -10.346 1.00 42.29 C ATOM 115 HE1 TRP A 36 -10.258 -6.287 -12.581 1.00 0.00 H ATOM 116 H TRP A 36 -7.500 0.100 -10.729 1.00 0.00 H ATOM 117 N THR A 37 -8.035 -2.140 -13.728 1.00 37.28 N ATOM 118 CA THR A 37 -8.533 -1.794 -15.053 1.00 37.00 C ATOM 119 C THR A 37 -9.516 -2.859 -15.525 1.00 40.14 C ATOM 120 O THR A 37 -9.213 -4.058 -15.489 1.00 36.97 O ATOM 121 CB THR A 37 -7.390 -1.629 -16.057 1.00 37.89 C ATOM 122 OG1 THR A 37 -6.684 -0.416 -15.764 1.00 34.01 O ATOM 123 CG2 THR A 37 -7.945 -1.531 -17.482 1.00 41.50 C ATOM 124 HG1 THR A 37 -7.305 0.351 -15.835 1.00 0.00 H ATOM 125 H THR A 37 -7.374 -2.938 -13.633 1.00 0.00 H ATOM 126 N ILE A 38 -10.698 -2.409 -15.939 1.00 35.79 N ATOM 127 CA ILE A 38 -11.765 -3.256 -16.459 1.00 34.02 C ATOM 128 C ILE A 38 -11.859 -2.983 -17.947 1.00 35.11 C ATOM 129 O ILE A 38 -12.294 -1.902 -18.356 1.00 38.55 O ATOM 130 CB ILE A 38 -13.106 -2.973 -15.777 1.00 37.91 C ATOM 131 CG1 ILE A 38 -12.980 -3.102 -14.268 1.00 36.13 C ATOM 132 CG2 ILE A 38 -14.197 -3.892 -16.320 1.00 38.44 C ATOM 133 CD1 ILE A 38 -14.257 -2.753 -13.549 1.00 42.05 C ATOM 134 H ILE A 38 -10.872 -1.385 -15.888 1.00 0.00 H ATOM 135 N ASN A 39 -11.456 -3.955 -18.753 1.00 37.48 N ATOM 136 CA ASN A 39 -11.473 -3.792 -20.195 1.00 45.12 C ATOM 137 C ASN A 39 -12.867 -4.056 -20.746 1.00 53.72 C ATOM 138 O ASN A 39 -13.651 -4.816 -20.169 1.00 56.94 O ATOM 139 CB ASN A 39 -10.457 -4.732 -20.837 1.00 51.39 C ATOM 140 CG ASN A 39 -9.097 -4.620 -20.204 1.00 63.13 C ATOM 141 OD1 ASN A 39 -8.294 -3.768 -20.583 1.00 62.78 O ATOM 142 ND2 ASN A 39 -8.831 -5.469 -19.214 1.00 74.40 N ATOM 143 HD22 ASN A 39 -9.541 -6.173 -18.928 1.00 0.00 H ATOM 144 HD21 ASN A 39 -7.913 -5.428 -18.727 1.00 0.00 H ATOM 145 H ASN A 39 -11.121 -4.851 -18.345 1.00 0.00 H ATOM 146 N ASN A 40 -13.173 -3.408 -21.872 1.00 52.82 N ATOM 147 CA ASN A 40 -14.464 -3.556 -22.540 1.00 53.84 C ATOM 148 C ASN A 40 -15.612 -3.256 -21.579 1.00 57.08 C ATOM 149 O ASN A 40 -16.563 -4.029 -21.443 1.00 55.75 O ATOM 150 CB ASN A 40 -14.599 -4.949 -23.149 1.00 54.88 C ATOM 151 CG ASN A 40 -13.598 -5.185 -24.255 1.00 65.73 C ATOM 152 OD1 ASN A 40 -13.446 -4.356 -25.153 1.00 69.75 O ATOM 153 ND2 ASN A 40 -12.892 -6.306 -24.187 1.00 70.37 N ATOM 154 HD22 ASN A 40 -13.055 -6.977 -23.409 1.00 0.00 H ATOM 155 HD21 ASN A 40 -12.175 -6.514 -24.911 1.00 0.00 H ATOM 156 H ASN A 40 -12.464 -2.772 -22.291 1.00 0.00 H ATOM 157 N PHE A 41 -15.506 -2.114 -20.896 1.00 49.16 N ATOM 158 CA PHE A 41 -16.492 -1.777 -19.879 1.00 52.03 C ATOM 159 C PHE A 41 -17.866 -1.531 -20.496 1.00 64.40 C ATOM 160 O PHE A 41 -18.888 -1.892 -19.901 1.00 66.85 O ATOM 161 CB PHE A 41 -16.032 -0.561 -19.079 1.00 54.35 C ATOM 162 CG PHE A 41 -17.047 -0.088 -18.088 1.00 54.99 C ATOM 163 CD1 PHE A 41 -17.192 -0.726 -16.872 1.00 52.87 C ATOM 164 CD2 PHE A 41 -17.883 0.971 -18.390 1.00 55.35 C ATOM 165 CE1 PHE A 41 -18.136 -0.308 -15.964 1.00 48.22 C ATOM 166 CE2 PHE A 41 -18.833 1.396 -17.488 1.00 52.78 C ATOM 167 CZ PHE A 41 -18.959 0.752 -16.270 1.00 54.55 C ATOM 168 H PHE A 41 -14.718 -1.464 -21.091 1.00 0.00 H ATOM 169 N SER A 42 -17.911 -0.921 -21.688 1.00 66.52 N ATOM 170 CA SER A 42 -19.189 -0.700 -22.366 1.00 76.21 C ATOM 171 C SER A 42 -19.940 -2.006 -22.583 1.00 83.89 C ATOM 172 O SER A 42 -21.177 -2.026 -22.536 1.00 89.17 O ATOM 173 CB SER A 42 -18.974 0.001 -23.715 1.00 72.02 C ATOM 174 OG SER A 42 -18.929 1.407 -23.558 1.00 75.59 O ATOM 175 HG SER A 42 -18.790 1.832 -24.441 1.00 0.00 H ATOM 176 H SER A 42 -17.029 -0.601 -22.136 1.00 0.00 H ATOM 177 N PHE A 43 -19.214 -3.097 -22.830 1.00 87.39 N ATOM 178 CA PHE A 43 -19.798 -4.412 -23.083 1.00 88.78 C ATOM 179 C PHE A 43 -19.850 -5.267 -21.821 1.00 90.97 C ATOM 180 O PHE A 43 -19.567 -6.469 -21.866 1.00 94.05 O ATOM 181 CB PHE A 43 -19.021 -5.126 -24.184 1.00 88.26 C ATOM 182 H PHE A 43 -18.178 -3.007 -22.843 1.00 0.00 H ATOM 183 N CYS A 44 -20.204 -4.672 -20.680 1.00 94.34 N ATOM 184 CA CYS A 44 -20.313 -5.392 -19.409 1.00101.00 C ATOM 185 C CYS A 44 -21.789 -5.713 -19.191 1.00107.01 C ATOM 186 O CYS A 44 -22.514 -4.971 -18.527 1.00112.29 O ATOM 187 CB CYS A 44 -19.734 -4.570 -18.262 1.00 96.85 C ATOM 188 SG CYS A 44 -18.025 -4.982 -17.844 1.00 98.99 S ATOM 189 H CYS A 44 -20.411 -3.653 -20.694 1.00 0.00 H ATOM 190 N ARG A 45 -22.235 -6.838 -19.753 1.00107.20 N ATOM 191 CA ARG A 45 -23.641 -7.223 -19.703 1.00105.78 C ATOM 192 C ARG A 45 -24.071 -7.599 -18.288 1.00106.19 C ATOM 193 O ARG A 45 -24.601 -8.692 -18.064 1.00115.46 O ATOM 194 CB ARG A 45 -23.906 -8.384 -20.666 1.00107.64 C ATOM 195 H ARG A 45 -21.559 -7.459 -20.242 1.00 0.00 H ATOM 196 N GLU A 46 -23.860 -6.699 -17.333 1.00101.91 N ATOM 197 CA GLU A 46 -24.218 -6.946 -15.941 1.00 96.36 C ATOM 198 C GLU A 46 -25.319 -5.994 -15.481 1.00 95.24 C ATOM 199 O GLU A 46 -25.203 -4.778 -15.626 1.00 90.46 O ATOM 200 CB GLU A 46 -22.992 -6.808 -15.037 1.00 93.42 C ATOM 201 H GLU A 46 -23.425 -5.789 -17.587 1.00 0.00 H TER 202 GLU A 46 ATOM 203 N GLY A 49 -27.673 -5.043 -10.473 1.00 85.11 N ATOM 204 CA GLY A 49 -27.452 -5.857 -9.291 1.00 84.91 C ATOM 205 C GLY A 49 -26.341 -6.886 -9.436 1.00 85.57 C ATOM 206 O GLY A 49 -25.856 -7.425 -8.437 1.00 84.16 O ATOM 207 HN3 GLY A 49 -27.930 -5.657 -11.272 1.00 0.00 H ATOM 208 HN2 GLY A 49 -26.803 -4.521 -10.701 1.00 0.00 H ATOM 209 HN1 GLY A 49 -28.444 -4.370 -10.290 1.00 0.00 H ATOM 210 N GLU A 50 -25.945 -7.169 -10.678 1.00 81.81 N ATOM 211 CA GLU A 50 -24.850 -8.099 -10.930 1.00 77.52 C ATOM 212 C GLU A 50 -23.514 -7.446 -10.594 1.00 66.35 C ATOM 213 O GLU A 50 -23.312 -6.254 -10.841 1.00 66.06 O ATOM 214 CB GLU A 50 -24.861 -8.555 -12.388 1.00 78.08 C ATOM 215 CG GLU A 50 -25.844 -9.672 -12.687 1.00 86.07 C ATOM 216 CD GLU A 50 -25.984 -9.932 -14.172 1.00 92.72 C ATOM 217 OE1 GLU A 50 -26.383 -8.997 -14.897 1.00 92.76 O ATOM 218 OE2 GLU A 50 -25.693 -11.065 -14.615 1.00 97.65 O ATOM 219 H GLU A 50 -26.426 -6.718 -11.482 1.00 0.00 H ATOM 220 N VAL A 51 -22.596 -8.239 -10.041 1.00 57.69 N ATOM 221 CA VAL A 51 -21.352 -7.734 -9.467 1.00 58.09 C ATOM 222 C VAL A 51 -20.174 -8.160 -10.330 1.00 53.25 C ATOM 223 O VAL A 51 -20.133 -9.284 -10.844 1.00 61.21 O ATOM 224 CB VAL A 51 -21.148 -8.224 -8.020 1.00 62.90 C ATOM 225 CG1 VAL A 51 -22.152 -7.570 -7.090 1.00 72.83 C ATOM 226 CG2 VAL A 51 -21.245 -9.744 -7.951 1.00 65.76 C ATOM 227 H VAL A 51 -22.774 -9.263 -10.017 1.00 0.00 H ATOM 228 N ILE A 52 -19.220 -7.245 -10.491 1.00 42.88 N ATOM 229 CA ILE A 52 -17.882 -7.540 -10.990 1.00 44.09 C ATOM 230 C ILE A 52 -16.957 -7.493 -9.782 1.00 41.32 C ATOM 231 O ILE A 52 -16.973 -6.513 -9.029 1.00 43.25 O ATOM 232 CB ILE A 52 -17.434 -6.525 -12.052 1.00 52.81 C ATOM 233 CG1 ILE A 52 -18.457 -6.408 -13.179 1.00 62.50 C ATOM 234 CG2 ILE A 52 -16.073 -6.908 -12.616 1.00 49.06 C ATOM 235 CD1 ILE A 52 -18.005 -5.466 -14.285 1.00 60.35 C ATOM 236 H ILE A 52 -19.443 -6.259 -10.246 1.00 0.00 H ATOM 237 N LYS A 53 -16.148 -8.535 -9.600 1.00 41.92 N ATOM 238 CA LYS A 53 -15.277 -8.653 -8.441 1.00 45.84 C ATOM 239 C LYS A 53 -13.817 -8.558 -8.875 1.00 37.79 C ATOM 240 O LYS A 53 -13.408 -9.197 -9.848 1.00 34.56 O ATOM 241 CB LYS A 53 -15.533 -9.976 -7.714 1.00 55.25 C ATOM 242 CG LYS A 53 -15.553 -9.874 -6.198 1.00 55.90 C ATOM 243 CD LYS A 53 -16.099 -11.157 -5.588 1.00 62.38 C ATOM 244 H LYS A 53 -16.139 -9.292 -10.313 1.00 0.00 H ATOM 245 N SER A 54 -13.033 -7.763 -8.156 1.00 29.78 N ATOM 246 CA SER A 54 -11.622 -7.650 -8.489 1.00 29.75 C ATOM 247 C SER A 54 -10.848 -8.854 -7.953 1.00 33.23 C ATOM 248 O SER A 54 -11.381 -9.706 -7.239 1.00 31.98 O ATOM 249 CB SER A 54 -11.030 -6.373 -7.903 1.00 34.43 C ATOM 250 OG SER A 54 -10.670 -6.605 -6.550 1.00 28.20 O ATOM 251 HG SER A 54 -10.000 -7.333 -6.508 1.00 0.00 H ATOM 252 H SER A 54 -13.426 -7.224 -7.358 1.00 0.00 H ATOM 253 N SER A 55 -9.565 -8.923 -8.311 1.00 30.70 N ATOM 254 CA SER A 55 -8.691 -9.887 -7.668 1.00 33.57 C ATOM 255 C SER A 55 -8.552 -9.516 -6.201 1.00 28.48 C ATOM 256 O SER A 55 -8.784 -8.373 -5.812 1.00 24.87 O ATOM 257 CB SER A 55 -7.312 -9.918 -8.347 1.00 40.41 C ATOM 258 OG SER A 55 -6.551 -8.757 -8.019 1.00 36.03 O ATOM 259 HG SER A 55 -7.036 -7.949 -8.323 1.00 0.00 H ATOM 260 H SER A 55 -9.193 -8.289 -9.047 1.00 0.00 H ATOM 261 N THR A 56 -8.157 -10.488 -5.382 1.00 34.64 N ATOM 262 CA THR A 56 -7.895 -10.217 -3.976 1.00 25.64 C ATOM 263 C THR A 56 -6.500 -9.639 -3.788 1.00 33.95 C ATOM 264 O THR A 56 -5.538 -10.105 -4.398 1.00 31.64 O ATOM 265 CB THR A 56 -8.037 -11.500 -3.158 1.00 35.89 C ATOM 266 OG1 THR A 56 -9.396 -11.957 -3.225 1.00 41.53 O ATOM 267 CG2 THR A 56 -7.659 -11.258 -1.713 1.00 34.90 C ATOM 268 HG1 THR A 56 -9.490 -12.788 -2.696 1.00 0.00 H ATOM 269 H THR A 56 -8.034 -11.453 -5.751 1.00 0.00 H ATOM 270 N PHE A 57 -6.390 -8.620 -2.937 1.00 29.69 N ATOM 271 CA PHE A 57 -5.098 -8.055 -2.576 1.00 26.35 C ATOM 272 C PHE A 57 -4.949 -8.054 -1.061 1.00 24.90 C ATOM 273 O PHE A 57 -5.933 -8.104 -0.323 1.00 28.39 O ATOM 274 CB PHE A 57 -4.902 -6.641 -3.138 1.00 25.24 C ATOM 275 CG PHE A 57 -6.098 -5.727 -2.957 1.00 31.06 C ATOM 276 CD1 PHE A 57 -7.195 -5.817 -3.808 1.00 30.52 C ATOM 277 CD2 PHE A 57 -6.098 -4.754 -1.972 1.00 32.69 C ATOM 278 CE1 PHE A 57 -8.284 -4.956 -3.658 1.00 26.81 C ATOM 279 CE2 PHE A 57 -7.179 -3.903 -1.811 1.00 35.97 C ATOM 280 CZ PHE A 57 -8.279 -4.008 -2.657 1.00 31.15 C ATOM 281 H PHE A 57 -7.252 -8.216 -2.518 1.00 0.00 H ATOM 282 N SER A 58 -3.697 -7.980 -0.597 1.00 29.11 N ATOM 283 CA SER A 58 -3.412 -8.231 0.808 1.00 25.67 C ATOM 284 C SER A 58 -2.784 -7.024 1.496 1.00 29.25 C ATOM 285 O SER A 58 -2.181 -6.151 0.865 1.00 30.52 O ATOM 286 CB SER A 58 -2.497 -9.452 0.973 1.00 34.21 C ATOM 287 OG SER A 58 -3.006 -10.563 0.249 1.00 42.91 O ATOM 288 HG SER A 58 -2.402 -11.338 0.369 1.00 0.00 H ATOM 289 H SER A 58 -2.920 -7.741 -1.246 1.00 0.00 H ATOM 290 N SER A 59 -2.901 -7.033 2.821 1.00 32.05 N ATOM 291 CA SER A 59 -2.583 -5.913 3.693 1.00 27.93 C ATOM 292 C SER A 59 -2.263 -6.484 5.072 1.00 29.11 C ATOM 293 O SER A 59 -2.435 -7.682 5.325 1.00 29.51 O ATOM 294 CB SER A 59 -3.771 -4.946 3.738 1.00 36.90 C ATOM 295 OG SER A 59 -3.771 -4.111 4.870 1.00 46.34 O ATOM 296 HG SER A 59 -2.944 -3.567 4.877 1.00 0.00 H ATOM 297 H SER A 59 -3.246 -7.907 3.267 1.00 0.00 H ATOM 298 N GLY A 60 -1.819 -5.611 5.975 1.00 24.84 N ATOM 299 CA GLY A 60 -1.606 -6.013 7.361 1.00 29.77 C ATOM 300 C GLY A 60 -0.281 -6.731 7.571 1.00 35.82 C ATOM 301 O GLY A 60 0.687 -6.534 6.840 1.00 34.49 O ATOM 302 H GLY A 60 -1.622 -4.631 5.688 1.00 0.00 H ATOM 303 N ALA A 61 -0.249 -7.571 8.603 1.00 34.34 N ATOM 304 CA ALA A 61 0.932 -8.347 8.946 1.00 34.32 C ATOM 305 C ALA A 61 0.884 -9.689 8.231 1.00 41.82 C ATOM 306 O ALA A 61 -0.116 -10.407 8.325 1.00 41.31 O ATOM 307 CB ALA A 61 1.013 -8.567 10.455 1.00 35.22 C ATOM 308 H ALA A 61 -1.103 -7.677 9.187 1.00 0.00 H ATOM 309 N ASN A 62 1.968 -10.028 7.532 1.00 45.19 N ATOM 310 CA ASN A 62 2.065 -11.296 6.805 1.00 36.84 C ATOM 311 C ASN A 62 0.877 -11.484 5.854 1.00 34.53 C ATOM 312 O ASN A 62 0.282 -12.562 5.777 1.00 37.75 O ATOM 313 CB ASN A 62 2.168 -12.484 7.770 1.00 33.43 C ATOM 314 CG ASN A 62 3.318 -12.351 8.762 1.00 48.16 C ATOM 315 OD1 ASN A 62 4.481 -12.481 8.386 1.00 40.74 O ATOM 316 ND2 ASN A 62 2.994 -12.134 10.038 1.00 55.46 N ATOM 317 HD22 ASN A 62 1.996 -12.030 10.311 1.00 0.00 H ATOM 318 HD21 ASN A 62 3.740 -12.069 10.760 1.00 0.00 H ATOM 319 H ASN A 62 2.772 -9.369 7.502 1.00 0.00 H ATOM 320 N ASP A 63 0.499 -10.412 5.154 1.00 32.04 N ATOM 321 CA ASP A 63 -0.518 -10.481 4.094 1.00 36.24 C ATOM 322 C ASP A 63 -1.851 -11.014 4.610 1.00 30.25 C ATOM 323 O ASP A 63 -2.653 -11.543 3.829 1.00 30.79 O ATOM 324 CB ASP A 63 -0.038 -11.351 2.925 1.00 41.57 C ATOM 325 CG ASP A 63 1.196 -10.788 2.233 1.00 45.93 C ATOM 326 OD1 ASP A 63 1.323 -9.553 2.154 1.00 43.90 O ATOM 327 OD2 ASP A 63 2.044 -11.591 1.779 1.00 50.50 O ATOM 328 H ASP A 63 0.940 -9.494 5.366 1.00 0.00 H ATOM 329 N LYS A 64 -2.079 -10.915 5.927 1.00 31.03 N ATOM 330 CA LYS A 64 -3.223 -11.570 6.551 1.00 32.93 C ATOM 331 C LYS A 64 -4.543 -10.812 6.376 1.00 27.62 C ATOM 332 O LYS A 64 -5.610 -11.382 6.641 1.00 28.65 O ATOM 333 CB LYS A 64 -2.960 -11.787 8.042 1.00 39.33 C ATOM 334 CG LYS A 64 -2.026 -12.962 8.356 1.00 46.39 C ATOM 335 CD LYS A 64 -2.051 -13.289 9.846 1.00 61.25 C ATOM 336 CE LYS A 64 -1.612 -12.093 10.684 1.00 65.29 C ATOM 337 NZ LYS A 64 -1.873 -12.301 12.139 1.00 68.61 N ATOM 338 HZ1 LYS A 64 -2.892 -12.447 12.290 1.00 0.00 H ATOM 339 HZ2 LYS A 64 -1.350 -13.137 12.468 1.00 0.00 H ATOM 340 HZ3 LYS A 64 -1.559 -11.463 12.669 1.00 0.00 H ATOM 341 H LYS A 64 -1.427 -10.360 6.516 1.00 0.00 H ATOM 342 N LEU A 65 -4.519 -9.551 5.979 1.00 25.30 N ATOM 343 CA LEU A 65 -5.773 -8.856 5.678 1.00 26.49 C ATOM 344 C LEU A 65 -6.001 -8.914 4.178 1.00 32.22 C ATOM 345 O LEU A 65 -5.168 -8.424 3.414 1.00 31.65 O ATOM 346 CB LEU A 65 -5.742 -7.407 6.138 1.00 24.92 C ATOM 347 CG LEU A 65 -5.627 -7.151 7.632 1.00 28.37 C ATOM 348 CD1 LEU A 65 -5.722 -5.646 7.862 1.00 31.12 C ATOM 349 CD2 LEU A 65 -6.719 -7.889 8.391 1.00 32.17 C ATOM 350 H LEU A 65 -3.611 -9.053 5.881 1.00 0.00 H ATOM 351 N LYS A 66 -7.127 -9.493 3.755 1.00 31.57 N ATOM 352 CA LYS A 66 -7.400 -9.717 2.341 1.00 21.75 C ATOM 353 C LYS A 66 -8.648 -8.949 1.923 1.00 22.92 C ATOM 354 O LYS A 66 -9.702 -9.061 2.572 1.00 25.49 O ATOM 355 CB LYS A 66 -7.545 -11.207 2.055 1.00 24.70 C ATOM 356 CG LYS A 66 -6.238 -11.961 2.415 1.00 33.29 C ATOM 357 CD LYS A 66 -6.249 -13.408 1.997 1.00 41.49 C ATOM 358 CE LYS A 66 -4.901 -14.079 2.318 1.00 41.00 C ATOM 359 NZ LYS A 66 -3.716 -13.315 1.821 1.00 35.72 N ATOM 360 HZ1 LYS A 66 -3.776 -13.218 0.787 1.00 0.00 H ATOM 361 HZ2 LYS A 66 -3.705 -12.372 2.259 1.00 0.00 H ATOM 362 HZ3 LYS A 66 -2.846 -13.825 2.073 1.00 0.00 H ATOM 363 H LYS A 66 -7.832 -9.794 4.457 1.00 0.00 H ATOM 364 N TRP A 67 -8.529 -8.214 0.816 1.00 22.50 N ATOM 365 CA TRP A 67 -9.550 -7.286 0.331 1.00 25.42 C ATOM 366 C TRP A 67 -9.858 -7.567 -1.130 1.00 33.65 C ATOM 367 O TRP A 67 -9.073 -8.182 -1.843 1.00 27.08 O ATOM 368 CB TRP A 67 -9.093 -5.832 0.424 1.00 19.91 C ATOM 369 CG TRP A 67 -8.486 -5.406 1.749 1.00 25.41 C ATOM 370 CD1 TRP A 67 -7.188 -5.566 2.157 1.00 29.12 C ATOM 371 CD2 TRP A 67 -9.153 -4.705 2.797 1.00 24.71 C ATOM 372 NE1 TRP A 67 -7.016 -5.020 3.413 1.00 29.14 N ATOM 373 CE2 TRP A 67 -8.214 -4.486 3.825 1.00 27.31 C ATOM 374 CE3 TRP A 67 -10.466 -4.241 2.970 1.00 24.70 C ATOM 375 CZ2 TRP A 67 -8.546 -3.824 5.008 1.00 25.12 C ATOM 376 CZ3 TRP A 67 -10.793 -3.593 4.138 1.00 24.96 C ATOM 377 CH2 TRP A 67 -9.840 -3.382 5.143 1.00 31.29 C ATOM 378 HE1 TRP A 67 -6.129 -5.014 3.956 1.00 0.00 H ATOM 379 H TRP A 67 -7.654 -8.307 0.262 1.00 0.00 H ATOM 380 N CYS A 68 -11.006 -7.068 -1.590 1.00 32.31 N ATOM 381 CA CYS A 68 -11.230 -6.921 -3.022 1.00 32.51 C ATOM 382 C CYS A 68 -12.201 -5.771 -3.263 1.00 31.89 C ATOM 383 O CYS A 68 -12.824 -5.253 -2.337 1.00 26.96 O ATOM 384 CB CYS A 68 -11.746 -8.223 -3.649 1.00 28.25 C ATOM 385 SG CYS A 68 -13.540 -8.513 -3.335 1.00 36.53 S ATOM 386 H CYS A 68 -11.748 -6.781 -0.920 1.00 0.00 H ATOM 387 N LEU A 69 -12.268 -5.341 -4.515 1.00 28.69 N ATOM 388 CA LEU A 69 -13.242 -4.353 -4.958 1.00 26.39 C ATOM 389 C LEU A 69 -14.398 -5.062 -5.641 1.00 34.22 C ATOM 390 O LEU A 69 -14.212 -6.084 -6.304 1.00 30.70 O ATOM 391 CB LEU A 69 -12.623 -3.372 -5.947 1.00 29.69 C ATOM 392 CG LEU A 69 -11.498 -2.484 -5.437 1.00 33.06 C ATOM 393 CD1 LEU A 69 -11.221 -1.415 -6.464 1.00 24.52 C ATOM 394 CD2 LEU A 69 -11.887 -1.859 -4.112 1.00 34.86 C ATOM 395 H LEU A 69 -11.597 -5.725 -5.210 1.00 0.00 H ATOM 396 N ARG A 70 -15.592 -4.484 -5.511 1.00 30.14 N ATOM 397 CA ARG A 70 -16.784 -5.026 -6.138 1.00 33.12 C ATOM 398 C ARG A 70 -17.502 -3.863 -6.802 1.00 35.15 C ATOM 399 O ARG A 70 -17.647 -2.800 -6.187 1.00 26.68 O ATOM 400 CB ARG A 70 -17.692 -5.717 -5.118 1.00 39.41 C ATOM 401 H ARG A 70 -15.672 -3.617 -4.942 1.00 0.00 H ATOM 402 N VAL A 71 -17.920 -4.065 -8.053 1.00 34.65 N ATOM 403 CA VAL A 71 -18.502 -3.032 -8.907 1.00 36.21 C ATOM 404 C VAL A 71 -19.873 -3.501 -9.380 1.00 35.93 C ATOM 405 O VAL A 71 -20.000 -4.607 -9.914 1.00 38.96 O ATOM 406 CB VAL A 71 -17.609 -2.735 -10.127 1.00 38.73 C ATOM 407 CG1 VAL A 71 -18.300 -1.787 -11.076 1.00 47.36 C ATOM 408 CG2 VAL A 71 -16.272 -2.167 -9.688 1.00 43.15 C ATOM 409 H VAL A 71 -17.825 -5.023 -8.447 1.00 0.00 H ATOM 410 N ASN A 72 -20.890 -2.651 -9.198 1.00 38.64 N ATOM 411 CA ASN A 72 -22.194 -2.835 -9.822 1.00 47.98 C ATOM 412 C ASN A 72 -22.275 -1.879 -11.005 1.00 42.80 C ATOM 413 O ASN A 72 -22.570 -0.691 -10.813 1.00 43.63 O ATOM 414 CB ASN A 72 -23.322 -2.556 -8.826 1.00 57.70 C ATOM 415 CG ASN A 72 -23.346 -3.549 -7.692 1.00 63.33 C ATOM 416 OD1 ASN A 72 -23.365 -4.758 -7.916 1.00 64.81 O ATOM 417 ND2 ASN A 72 -23.305 -3.047 -6.464 1.00 65.06 N ATOM 418 HD22 ASN A 72 -23.290 -2.017 -6.324 1.00 0.00 H ATOM 419 HD21 ASN A 72 -23.288 -3.684 -5.642 1.00 0.00 H ATOM 420 H ASN A 72 -20.744 -1.824 -8.585 1.00 0.00 H ATOM 421 N PRO A 73 -22.021 -2.332 -12.236 1.00 40.38 N ATOM 422 CA PRO A 73 -21.949 -1.388 -13.365 1.00 41.16 C ATOM 423 C PRO A 73 -23.259 -0.689 -13.664 1.00 49.44 C ATOM 424 O PRO A 73 -23.239 0.435 -14.182 1.00 47.56 O ATOM 425 CB PRO A 73 -21.517 -2.277 -14.543 1.00 53.68 C ATOM 426 CG PRO A 73 -20.926 -3.501 -13.911 1.00 54.57 C ATOM 427 CD PRO A 73 -21.691 -3.708 -12.641 1.00 44.96 C ATOM 428 N LYS A 74 -24.394 -1.320 -13.363 1.00 58.34 N ATOM 429 CA LYS A 74 -25.711 -0.758 -13.633 1.00 57.75 C ATOM 430 C LYS A 74 -26.464 -0.414 -12.357 1.00 56.08 C ATOM 431 O LYS A 74 -27.694 -0.272 -12.386 1.00 51.58 O ATOM 432 CB LYS A 74 -26.541 -1.729 -14.487 1.00 59.29 C ATOM 433 H LYS A 74 -24.337 -2.257 -12.915 1.00 0.00 H ATOM 434 N GLY A 75 -25.762 -0.301 -11.239 1.00 51.61 N ATOM 435 CA GLY A 75 -26.369 0.052 -9.980 1.00 58.40 C ATOM 436 C GLY A 75 -26.619 -1.158 -9.096 1.00 72.12 C ATOM 437 O GLY A 75 -26.562 -2.317 -9.524 1.00 66.41 O ATOM 438 H GLY A 75 -24.737 -0.473 -11.271 1.00 0.00 H ATOM 439 N LEU A 76 -26.902 -0.854 -7.833 1.00 98.02 N ATOM 440 CA LEU A 76 -27.162 -1.859 -6.810 1.00103.44 C ATOM 441 C LEU A 76 -28.642 -2.193 -6.672 1.00101.09 C ATOM 442 O LEU A 76 -29.045 -3.341 -6.870 1.00105.42 O ATOM 443 CB LEU A 76 -26.610 -1.376 -5.465 1.00104.95 C ATOM 444 CG LEU A 76 -26.782 -2.307 -4.266 1.00111.61 C ATOM 445 CD1 LEU A 76 -26.000 -3.595 -4.455 1.00111.12 C ATOM 446 CD2 LEU A 76 -26.382 -1.579 -3.012 1.00111.55 C ATOM 447 H LEU A 76 -26.940 0.149 -7.562 1.00 0.00 H ATOM 448 N ASP A 77 -29.455 -1.204 -6.349 1.00 93.81 N ATOM 449 CA ASP A 77 -30.895 -1.337 -6.262 1.00 88.13 C ATOM 450 C ASP A 77 -31.544 -0.447 -7.319 1.00 82.91 C ATOM 451 O ASP A 77 -30.878 0.069 -8.227 1.00 75.11 O ATOM 452 CB ASP A 77 -31.397 -0.982 -4.865 1.00 90.12 C ATOM 453 CG ASP A 77 -30.814 0.318 -4.344 1.00 83.39 C ATOM 454 OD1 ASP A 77 -30.943 1.352 -5.039 1.00 79.87 O ATOM 455 OD2 ASP A 77 -30.261 0.312 -3.230 1.00 80.17 O ATOM 456 H ASP A 77 -29.037 -0.274 -6.145 1.00 0.00 H ATOM 457 N GLU A 78 -32.862 -0.257 -7.197 1.00 79.76 N ATOM 458 CA GLU A 78 -33.591 0.555 -8.165 1.00 81.87 C ATOM 459 C GLU A 78 -33.267 2.037 -8.012 1.00 81.02 C ATOM 460 O GLU A 78 -33.308 2.781 -8.997 1.00 82.97 O ATOM 461 CB GLU A 78 -35.091 0.298 -8.010 1.00 82.70 C ATOM 462 CG GLU A 78 -35.986 1.051 -8.983 1.00 86.36 C ATOM 463 CD GLU A 78 -36.435 2.393 -8.436 1.00 90.23 C ATOM 464 OE1 GLU A 78 -36.211 2.639 -7.230 1.00 92.22 O ATOM 465 OE2 GLU A 78 -37.010 3.196 -9.203 1.00 87.08 O ATOM 466 H GLU A 78 -33.373 -0.693 -6.403 1.00 0.00 H ATOM 467 N GLU A 79 -32.936 2.482 -6.797 1.00 77.84 N ATOM 468 CA GLU A 79 -32.650 3.893 -6.540 1.00 81.21 C ATOM 469 C GLU A 79 -31.299 4.344 -7.085 1.00 76.80 C ATOM 470 O GLU A 79 -30.984 5.536 -6.999 1.00 75.09 O ATOM 471 CB GLU A 79 -32.709 4.176 -5.037 1.00 85.00 C ATOM 472 H GLU A 79 -32.880 1.805 -6.010 1.00 0.00 H ATOM 473 N SER A 80 -30.494 3.433 -7.631 1.00 67.58 N ATOM 474 CA SER A 80 -29.178 3.763 -8.163 1.00 55.88 C ATOM 475 C SER A 80 -28.986 3.174 -9.556 1.00 50.80 C ATOM 476 O SER A 80 -27.853 2.974 -10.004 1.00 44.43 O ATOM 477 CB SER A 80 -28.075 3.290 -7.215 1.00 61.36 C ATOM 478 OG SER A 80 -28.151 1.895 -6.991 1.00 63.42 O ATOM 479 HG SER A 80 -29.028 1.674 -6.589 1.00 0.00 H ATOM 480 H SER A 80 -30.818 2.446 -7.679 1.00 0.00 H ATOM 481 N LYS A 81 -30.096 2.921 -10.265 1.00 47.77 N ATOM 482 CA LYS A 81 -30.017 2.335 -11.600 1.00 51.86 C ATOM 483 C LYS A 81 -29.200 3.198 -12.550 1.00 52.87 C ATOM 484 O LYS A 81 -28.573 2.677 -13.478 1.00 62.65 O ATOM 485 CB LYS A 81 -31.425 2.125 -12.164 1.00 54.07 C ATOM 486 H LYS A 81 -31.026 3.145 -9.858 1.00 0.00 H ATOM 487 N ASP A 82 -29.190 4.510 -12.335 1.00 54.54 N ATOM 488 CA ASP A 82 -28.469 5.430 -13.203 1.00 49.45 C ATOM 489 C ASP A 82 -26.990 5.534 -12.861 1.00 45.92 C ATOM 490 O ASP A 82 -26.281 6.319 -13.499 1.00 37.52 O ATOM 491 CB ASP A 82 -29.090 6.822 -13.123 1.00 47.13 C ATOM 492 CG ASP A 82 -30.555 6.826 -13.487 1.00 61.30 C ATOM 493 OD1 ASP A 82 -30.971 5.938 -14.261 1.00 65.15 O ATOM 494 OD2 ASP A 82 -31.279 7.715 -12.990 1.00 56.94 O ATOM 495 H ASP A 82 -29.714 4.891 -11.521 1.00 0.00 H ATOM 496 N TYR A 83 -26.514 4.776 -11.883 1.00 40.89 N ATOM 497 CA TYR A 83 -25.169 4.942 -11.365 1.00 34.63 C ATOM 498 C TYR A 83 -24.381 3.645 -11.458 1.00 38.87 C ATOM 499 O TYR A 83 -24.938 2.547 -11.524 1.00 41.62 O ATOM 500 CB TYR A 83 -25.185 5.395 -9.907 1.00 33.61 C ATOM 501 CG TYR A 83 -25.647 6.806 -9.654 1.00 48.45 C ATOM 502 CD1 TYR A 83 -27.001 7.116 -9.601 1.00 50.42 C ATOM 503 CD2 TYR A 83 -24.726 7.836 -9.457 1.00 41.25 C ATOM 504 CE1 TYR A 83 -27.426 8.407 -9.355 1.00 52.53 C ATOM 505 CE2 TYR A 83 -25.150 9.136 -9.216 1.00 47.80 C ATOM 506 CZ TYR A 83 -26.500 9.412 -9.164 1.00 50.72 C ATOM 507 OH TYR A 83 -26.930 10.705 -8.928 1.00 60.16 O ATOM 508 HH TYR A 83 -27.920 10.727 -8.923 1.00 0.00 H ATOM 509 H TYR A 83 -27.124 4.039 -11.474 1.00 0.00 H ATOM 510 N LEU A 84 -23.066 3.795 -11.473 1.00 34.14 N ATOM 511 CA LEU A 84 -22.152 2.701 -11.156 1.00 40.16 C ATOM 512 C LEU A 84 -21.856 2.736 -9.662 1.00 36.80 C ATOM 513 O LEU A 84 -21.497 3.791 -9.134 1.00 38.09 O ATOM 514 CB LEU A 84 -20.857 2.820 -11.963 1.00 36.86 C ATOM 515 CG LEU A 84 -19.746 1.830 -11.598 1.00 33.92 C ATOM 516 CD1 LEU A 84 -19.039 1.360 -12.847 1.00 39.16 C ATOM 517 CD2 LEU A 84 -18.752 2.471 -10.636 1.00 31.39 C ATOM 518 H LEU A 84 -22.670 4.725 -11.719 1.00 0.00 H ATOM 519 N SER A 85 -22.027 1.595 -8.983 1.00 33.74 N ATOM 520 CA SER A 85 -21.728 1.466 -7.560 1.00 28.37 C ATOM 521 C SER A 85 -20.393 0.743 -7.386 1.00 31.06 C ATOM 522 O SER A 85 -20.063 -0.170 -8.160 1.00 26.90 O ATOM 523 CB SER A 85 -22.824 0.701 -6.805 1.00 31.74 C ATOM 524 OG SER A 85 -24.152 0.976 -7.291 1.00 37.95 O ATOM 525 HG SER A 85 -24.344 1.943 -7.195 1.00 0.00 H ATOM 526 H SER A 85 -22.389 0.763 -9.492 1.00 0.00 H ATOM 527 N LEU A 86 -19.644 1.129 -6.345 1.00 33.99 N ATOM 528 CA LEU A 86 -18.306 0.585 -6.123 1.00 28.36 C ATOM 529 C LEU A 86 -18.090 0.382 -4.625 1.00 32.40 C ATOM 530 O LEU A 86 -18.386 1.271 -3.820 1.00 29.00 O ATOM 531 CB LEU A 86 -17.245 1.528 -6.711 1.00 32.07 C ATOM 532 CG LEU A 86 -15.758 1.282 -6.429 1.00 32.69 C ATOM 533 CD1 LEU A 86 -15.283 -0.017 -7.051 1.00 35.16 C ATOM 534 CD2 LEU A 86 -14.905 2.442 -6.916 1.00 32.84 C ATOM 535 H LEU A 86 -20.023 1.832 -5.679 1.00 0.00 H ATOM 536 N TYR A 87 -17.572 -0.790 -4.256 1.00 30.81 N ATOM 537 CA TYR A 87 -17.448 -1.172 -2.859 1.00 23.16 C ATOM 538 C TYR A 87 -16.083 -1.783 -2.612 1.00 27.12 C ATOM 539 O TYR A 87 -15.546 -2.463 -3.487 1.00 30.49 O ATOM 540 CB TYR A 87 -18.502 -2.188 -2.447 1.00 27.67 C ATOM 541 CG TYR A 87 -19.875 -1.579 -2.495 1.00 30.65 C ATOM 542 CD1 TYR A 87 -20.403 -0.941 -1.388 1.00 30.43 C ATOM 543 CD2 TYR A 87 -20.603 -1.590 -3.667 1.00 39.41 C ATOM 544 CE1 TYR A 87 -21.669 -0.352 -1.440 1.00 33.05 C ATOM 545 CE2 TYR A 87 -21.862 -1.010 -3.733 1.00 35.40 C ATOM 546 CZ TYR A 87 -22.378 -0.392 -2.618 1.00 35.30 C ATOM 547 OH TYR A 87 -23.617 0.185 -2.697 1.00 36.29 O ATOM 548 HH TYR A 87 -23.849 0.586 -1.822 1.00 0.00 H ATOM 549 H TYR A 87 -17.247 -1.451 -4.990 1.00 0.00 H ATOM 550 N LEU A 88 -15.564 -1.537 -1.406 1.00 27.37 N ATOM 551 CA LEU A 88 -14.413 -2.227 -0.832 1.00 29.89 C ATOM 552 C LEU A 88 -14.915 -3.305 0.120 1.00 34.79 C ATOM 553 O LEU A 88 -15.699 -3.013 1.029 1.00 37.16 O ATOM 554 CB LEU A 88 -13.527 -1.240 -0.074 1.00 26.66 C ATOM 555 CG LEU A 88 -12.319 -1.814 0.677 1.00 26.01 C ATOM 556 CD1 LEU A 88 -11.371 -2.502 -0.286 1.00 28.06 C ATOM 557 CD2 LEU A 88 -11.634 -0.707 1.441 1.00 20.83 C ATOM 558 H LEU A 88 -16.015 -0.797 -0.832 1.00 0.00 H ATOM 559 N LEU A 89 -14.483 -4.546 -0.101 1.00 28.66 N ATOM 560 CA LEU A 89 -14.926 -5.695 0.678 1.00 29.73 C ATOM 561 C LEU A 89 -13.747 -6.297 1.434 1.00 28.77 C ATOM 562 O LEU A 89 -12.676 -6.516 0.851 1.00 28.63 O ATOM 563 CB LEU A 89 -15.551 -6.757 -0.227 1.00 34.95 C ATOM 564 CG LEU A 89 -15.887 -8.092 0.442 1.00 43.07 C ATOM 565 CD1 LEU A 89 -17.019 -7.940 1.460 1.00 46.83 C ATOM 566 CD2 LEU A 89 -16.223 -9.150 -0.597 1.00 44.66 C ATOM 567 H LEU A 89 -13.796 -4.702 -0.866 1.00 0.00 H ATOM 568 N LEU A 90 -13.947 -6.588 2.718 1.00 25.69 N ATOM 569 CA LEU A 90 -12.948 -7.321 3.496 1.00 30.87 C ATOM 570 C LEU A 90 -13.249 -8.809 3.351 1.00 34.05 C ATOM 571 O LEU A 90 -14.286 -9.291 3.826 1.00 39.96 O ATOM 572 CB LEU A 90 -12.963 -6.886 4.957 1.00 30.37 C ATOM 573 CG LEU A 90 -11.917 -7.549 5.862 1.00 26.94 C ATOM 574 CD1 LEU A 90 -10.471 -7.196 5.421 1.00 27.05 C ATOM 575 CD2 LEU A 90 -12.156 -7.138 7.304 1.00 30.81 C ATOM 576 H LEU A 90 -14.831 -6.288 3.177 1.00 0.00 H ATOM 577 N VAL A 91 -12.348 -9.530 2.676 1.00 25.29 N ATOM 578 CA VAL A 91 -12.571 -10.936 2.345 1.00 26.80 C ATOM 579 C VAL A 91 -12.194 -11.833 3.514 1.00 36.38 C ATOM 580 O VAL A 91 -12.879 -12.818 3.813 1.00 34.35 O ATOM 581 CB VAL A 91 -11.774 -11.302 1.077 1.00 31.66 C ATOM 582 CG1 VAL A 91 -11.777 -12.793 0.844 1.00 31.22 C ATOM 583 CG2 VAL A 91 -12.322 -10.543 -0.127 1.00 31.02 C ATOM 584 H VAL A 91 -11.461 -9.076 2.377 1.00 0.00 H ATOM 585 N SER A 92 -11.089 -11.525 4.187 1.00 26.93 N ATOM 586 CA SER A 92 -10.742 -12.303 5.364 1.00 28.24 C ATOM 587 C SER A 92 -9.834 -11.483 6.268 1.00 27.31 C ATOM 588 O SER A 92 -9.130 -10.577 5.821 1.00 25.57 O ATOM 589 CB SER A 92 -10.093 -13.637 4.986 1.00 39.45 C ATOM 590 OG SER A 92 -8.894 -13.428 4.280 1.00 42.55 O ATOM 591 HG SER A 92 -8.264 -12.915 4.846 1.00 0.00 H ATOM 592 H SER A 92 -10.483 -10.739 3.876 1.00 0.00 H ATOM 593 N CYS A 93 -9.894 -11.789 7.556 1.00 34.92 N ATOM 594 CA CYS A 93 -9.041 -11.110 8.512 1.00 34.35 C ATOM 595 C CYS A 93 -8.797 -12.046 9.667 1.00 31.32 C ATOM 596 O CYS A 93 -9.645 -12.905 9.979 1.00 32.34 O ATOM 597 CB CYS A 93 -9.656 -9.777 8.976 1.00 34.44 C ATOM 598 SG CYS A 93 -11.215 -9.903 9.864 1.00 34.46 S ATOM 599 H CYS A 93 -10.557 -12.521 7.883 1.00 0.00 H ATOM 600 N PRO A 94 -7.636 -11.964 10.314 1.00 36.95 N ATOM 601 CA PRO A 94 -7.310 -12.945 11.355 1.00 32.36 C ATOM 602 C PRO A 94 -8.105 -12.764 12.637 1.00 37.64 C ATOM 603 O PRO A 94 -8.448 -13.754 13.302 1.00 39.34 O ATOM 604 CB PRO A 94 -5.805 -12.726 11.576 1.00 47.16 C ATOM 605 CG PRO A 94 -5.537 -11.324 11.100 1.00 38.36 C ATOM 606 CD PRO A 94 -6.490 -11.097 9.959 1.00 37.99 C ATOM 607 N LYS A 95 -8.396 -11.523 13.016 1.00 34.91 N ATOM 608 CA LYS A 95 -9.078 -11.264 14.274 1.00 42.06 C ATOM 609 C LYS A 95 -10.528 -10.897 14.006 1.00 50.19 C ATOM 610 O LYS A 95 -11.171 -11.477 13.124 1.00 41.51 O ATOM 611 CB LYS A 95 -8.364 -10.156 15.063 1.00 48.93 C ATOM 612 CG LYS A 95 -6.938 -10.518 15.492 1.00 47.53 C ATOM 613 H LYS A 95 -8.132 -10.725 12.403 1.00 0.00 H ATOM 614 N SER A 96 -11.045 -9.927 14.748 1.00 50.45 N ATOM 615 CA SER A 96 -12.475 -9.630 14.711 1.00 55.98 C ATOM 616 C SER A 96 -12.764 -8.498 13.703 1.00 56.02 C ATOM 617 O SER A 96 -13.387 -8.718 12.684 1.00 61.98 O ATOM 618 CB SER A 96 -12.976 -9.284 16.110 1.00 62.03 C ATOM 619 OG SER A 96 -14.387 -9.202 16.143 1.00 69.68 O ATOM 620 HG SER A 96 -14.682 -8.977 17.061 1.00 0.00 H ATOM 621 H SER A 96 -10.422 -9.369 15.366 1.00 0.00 H ATOM 622 N GLU A 97 -12.279 -7.300 14.014 1.00 57.73 N ATOM 623 CA GLU A 97 -12.635 -6.102 13.264 1.00 53.42 C ATOM 624 C GLU A 97 -11.393 -5.466 12.652 1.00 53.06 C ATOM 625 O GLU A 97 -10.265 -5.674 13.105 1.00 48.09 O ATOM 626 CB GLU A 97 -13.328 -5.073 14.172 1.00 60.30 C ATOM 627 CG GLU A 97 -12.440 -4.618 15.323 1.00 71.10 C ATOM 628 CD GLU A 97 -13.211 -3.930 16.428 1.00 84.08 C ATOM 629 OE1 GLU A 97 -14.398 -3.600 16.214 1.00 80.16 O ATOM 630 OE2 GLU A 97 -12.626 -3.746 17.519 1.00 89.75 O ATOM 631 H GLU A 97 -11.625 -7.215 14.818 1.00 0.00 H ATOM 632 N VAL A 98 -11.625 -4.706 11.585 1.00 40.06 N ATOM 633 CA VAL A 98 -10.640 -3.831 10.964 1.00 37.29 C ATOM 634 C VAL A 98 -11.316 -2.488 10.737 1.00 41.65 C ATOM 635 O VAL A 98 -12.405 -2.435 10.159 1.00 41.71 O ATOM 636 CB VAL A 98 -10.121 -4.395 9.624 1.00 38.34 C ATOM 637 CG1 VAL A 98 -9.210 -3.395 8.947 1.00 39.89 C ATOM 638 CG2 VAL A 98 -9.394 -5.727 9.824 1.00 37.74 C ATOM 639 H VAL A 98 -12.576 -4.739 11.165 1.00 0.00 H ATOM 640 N ARG A 99 -10.695 -1.412 11.203 1.00 40.40 N ATOM 641 CA ARG A 99 -11.184 -0.067 10.934 1.00 41.83 C ATOM 642 C ARG A 99 -10.269 0.589 9.910 1.00 37.43 C ATOM 643 O ARG A 99 -9.044 0.587 10.079 1.00 34.04 O ATOM 644 CB ARG A 99 -11.251 0.755 12.224 1.00 43.43 C ATOM 645 CG ARG A 99 -12.251 0.197 13.238 1.00 53.16 C ATOM 646 CD ARG A 99 -12.154 0.913 14.576 1.00 61.73 C ATOM 647 NE ARG A 99 -12.162 2.358 14.385 1.00 65.43 N ATOM 648 CZ ARG A 99 -11.197 3.171 14.798 1.00 68.84 C ATOM 649 NH1 ARG A 99 -10.149 2.682 15.447 1.00 69.74 N ATOM 650 NH2 ARG A 99 -11.284 4.476 14.569 1.00 69.52 N ATOM 651 HE ARG A 99 -12.976 2.779 13.894 1.00 0.00 H ATOM 652 HH12 ARG A 99 -9.394 3.320 15.770 1.00 0.00 H ATOM 653 HH11 ARG A 99 -10.083 1.661 15.633 1.00 0.00 H ATOM 654 HH22 ARG A 99 -10.528 5.112 14.893 1.00 0.00 H ATOM 655 HH21 ARG A 99 -12.108 4.862 14.066 1.00 0.00 H ATOM 656 H ARG A 99 -9.836 -1.533 11.776 1.00 0.00 H ATOM 657 N ALA A 100 -10.853 1.130 8.842 1.00 34.61 N ATOM 658 CA ALA A 100 -10.044 1.633 7.742 1.00 29.98 C ATOM 659 C ALA A 100 -10.765 2.778 7.040 1.00 40.77 C ATOM 660 O ALA A 100 -11.991 2.764 6.910 1.00 32.83 O ATOM 661 CB ALA A 100 -9.729 0.525 6.731 1.00 32.07 C ATOM 662 H ALA A 100 -11.890 1.193 8.794 1.00 0.00 H ATOM 663 N LYS A 101 -9.994 3.772 6.610 1.00 36.65 N ATOM 664 CA LYS A 101 -10.483 4.806 5.714 1.00 32.48 C ATOM 665 C LYS A 101 -10.220 4.369 4.282 1.00 26.76 C ATOM 666 O LYS A 101 -9.297 3.597 4.011 1.00 30.90 O ATOM 667 CB LYS A 101 -9.783 6.138 5.989 1.00 44.63 C ATOM 668 CG LYS A 101 -9.964 6.664 7.401 1.00 51.24 C ATOM 669 CD LYS A 101 -9.260 8.003 7.596 1.00 53.91 C ATOM 670 H LYS A 101 -9.004 3.811 6.927 1.00 0.00 H ATOM 671 N PHE A 102 -11.026 4.870 3.354 1.00 29.20 N ATOM 672 CA PHE A 102 -10.809 4.467 1.978 1.00 20.52 C ATOM 673 C PHE A 102 -11.255 5.583 1.036 1.00 28.91 C ATOM 674 O PHE A 102 -12.145 6.376 1.358 1.00 28.02 O ATOM 675 CB PHE A 102 -11.547 3.157 1.660 1.00 25.97 C ATOM 676 CG PHE A 102 -13.036 3.217 1.913 1.00 28.80 C ATOM 677 CD1 PHE A 102 -13.904 3.660 0.928 1.00 34.90 C ATOM 678 CD2 PHE A 102 -13.562 2.814 3.131 1.00 28.10 C ATOM 679 CE1 PHE A 102 -15.271 3.715 1.160 1.00 32.59 C ATOM 680 CE2 PHE A 102 -14.926 2.864 3.366 1.00 37.03 C ATOM 681 CZ PHE A 102 -15.782 3.318 2.373 1.00 36.61 C ATOM 682 H PHE A 102 -11.789 5.531 3.606 1.00 0.00 H ATOM 683 N LYS A 103 -10.623 5.630 -0.132 1.00 24.07 N ATOM 684 CA LYS A 103 -10.924 6.638 -1.143 1.00 25.37 C ATOM 685 C LYS A 103 -10.975 5.956 -2.497 1.00 27.42 C ATOM 686 O LYS A 103 -10.088 5.155 -2.816 1.00 23.39 O ATOM 687 CB LYS A 103 -9.868 7.749 -1.157 1.00 31.52 C ATOM 688 CG LYS A 103 -10.071 8.760 -2.269 1.00 37.32 C ATOM 689 CD LYS A 103 -9.159 9.952 -2.107 1.00 41.42 C ATOM 690 CE LYS A 103 -7.855 9.781 -2.860 1.00 52.94 C ATOM 691 NZ LYS A 103 -7.299 11.122 -3.238 1.00 60.75 N ATOM 692 HZ1 LYS A 103 -7.981 11.620 -3.844 1.00 0.00 H ATOM 693 HZ2 LYS A 103 -7.126 11.680 -2.377 1.00 0.00 H ATOM 694 HZ3 LYS A 103 -6.405 10.992 -3.754 1.00 0.00 H ATOM 695 H LYS A 103 -9.887 4.923 -0.333 1.00 0.00 H ATOM 696 N PHE A 104 -12.011 6.261 -3.289 1.00 24.89 N ATOM 697 CA PHE A 104 -12.143 5.728 -4.640 1.00 20.84 C ATOM 698 C PHE A 104 -12.006 6.861 -5.643 1.00 30.32 C ATOM 699 O PHE A 104 -12.532 7.961 -5.427 1.00 31.61 O ATOM 700 CB PHE A 104 -13.511 5.070 -4.879 1.00 26.50 C ATOM 701 CG PHE A 104 -13.805 3.909 -3.994 1.00 33.86 C ATOM 702 CD1 PHE A 104 -12.894 2.888 -3.820 1.00 40.39 C ATOM 703 CD2 PHE A 104 -15.021 3.824 -3.347 1.00 39.58 C ATOM 704 CE1 PHE A 104 -13.194 1.815 -3.001 1.00 42.68 C ATOM 705 CE2 PHE A 104 -15.317 2.762 -2.531 1.00 39.75 C ATOM 706 CZ PHE A 104 -14.400 1.755 -2.359 1.00 37.43 C ATOM 707 H PHE A 104 -12.747 6.901 -2.928 1.00 0.00 H ATOM 708 N SER A 105 -11.343 6.579 -6.759 1.00 25.27 N ATOM 709 CA SER A 105 -11.263 7.557 -7.836 1.00 23.88 C ATOM 710 C SER A 105 -11.103 6.835 -9.167 1.00 26.94 C ATOM 711 O SER A 105 -10.819 5.635 -9.218 1.00 31.04 O ATOM 712 CB SER A 105 -10.105 8.539 -7.604 1.00 34.80 C ATOM 713 OG SER A 105 -8.863 7.872 -7.688 1.00 37.27 O ATOM 714 HG SER A 105 -8.824 7.161 -7.000 1.00 0.00 H ATOM 715 H SER A 105 -10.878 5.655 -6.865 1.00 0.00 H ATOM 716 N ILE A 106 -11.308 7.589 -10.249 1.00 26.33 N ATOM 717 CA ILE A 106 -11.161 7.108 -11.616 1.00 22.98 C ATOM 718 C ILE A 106 -9.934 7.780 -12.210 1.00 29.73 C ATOM 719 O ILE A 106 -9.698 8.974 -11.986 1.00 36.44 O ATOM 720 CB ILE A 106 -12.432 7.431 -12.439 1.00 31.56 C ATOM 721 CG1 ILE A 106 -13.656 6.763 -11.808 1.00 24.72 C ATOM 722 CG2 ILE A 106 -12.294 6.990 -13.894 1.00 26.06 C ATOM 723 CD1 ILE A 106 -14.960 7.115 -12.521 1.00 37.48 C ATOM 724 H ILE A 106 -11.590 8.580 -10.108 1.00 0.00 H ATOM 725 N LEU A 107 -9.143 7.018 -12.952 1.00 27.88 N ATOM 726 CA LEU A 107 -7.990 7.579 -13.640 1.00 31.69 C ATOM 727 C LEU A 107 -8.359 7.857 -15.090 1.00 33.01 C ATOM 728 O LEU A 107 -8.863 6.970 -15.787 1.00 38.21 O ATOM 729 CB LEU A 107 -6.793 6.631 -13.552 1.00 33.48 C ATOM 730 CG LEU A 107 -6.408 6.309 -12.100 1.00 35.49 C ATOM 731 CD1 LEU A 107 -5.157 5.422 -12.027 1.00 42.05 C ATOM 732 CD2 LEU A 107 -6.233 7.585 -11.285 1.00 36.98 C ATOM 733 H LEU A 107 -9.350 6.003 -13.044 1.00 0.00 H ATOM 734 N ASN A 108 -8.120 9.088 -15.537 1.00 42.36 N ATOM 735 CA ASN A 108 -8.433 9.456 -16.914 1.00 53.92 C ATOM 736 C ASN A 108 -7.335 8.931 -17.836 1.00 58.18 C ATOM 737 O ASN A 108 -6.467 8.152 -17.432 1.00 46.23 O ATOM 738 CB ASN A 108 -8.615 10.969 -17.042 1.00 57.60 C ATOM 739 CG ASN A 108 -7.430 11.760 -16.508 1.00 59.48 C ATOM 740 OD1 ASN A 108 -6.300 11.269 -16.448 1.00 61.74 O ATOM 741 ND2 ASN A 108 -7.689 12.998 -16.112 1.00 60.81 N ATOM 742 HD22 ASN A 108 -8.656 13.374 -16.180 1.00 0.00 H ATOM 743 HD21 ASN A 108 -6.925 13.594 -15.734 1.00 0.00 H ATOM 744 H ASN A 108 -7.705 9.796 -14.897 1.00 0.00 H ATOM 745 N ALA A 109 -7.357 9.364 -19.096 1.00 70.17 N ATOM 746 CA ALA A 109 -6.314 8.954 -20.029 1.00 81.40 C ATOM 747 C ALA A 109 -4.939 9.426 -19.565 1.00 83.76 C ATOM 748 O ALA A 109 -3.944 8.708 -19.720 1.00 85.21 O ATOM 749 CB ALA A 109 -6.627 9.488 -21.426 1.00 88.59 C ATOM 750 H ALA A 109 -8.119 9.996 -19.415 1.00 0.00 H ATOM 751 N LYS A 110 -4.863 10.623 -18.985 1.00 78.55 N ATOM 752 CA LYS A 110 -3.596 11.192 -18.542 1.00 70.92 C ATOM 753 C LYS A 110 -3.123 10.630 -17.211 1.00 68.18 C ATOM 754 O LYS A 110 -2.119 11.117 -16.676 1.00 71.46 O ATOM 755 CB LYS A 110 -3.705 12.716 -18.450 1.00 70.56 C ATOM 756 H LYS A 110 -5.736 11.170 -18.844 1.00 0.00 H ATOM 757 N GLY A 111 -3.817 9.630 -16.666 1.00 57.37 N ATOM 758 CA GLY A 111 -3.472 9.055 -15.383 1.00 49.73 C ATOM 759 C GLY A 111 -3.890 9.869 -14.183 1.00 48.10 C ATOM 760 O GLY A 111 -3.642 9.445 -13.050 1.00 50.00 O ATOM 761 H GLY A 111 -4.636 9.249 -17.182 1.00 0.00 H ATOM 762 N GLU A 112 -4.524 11.015 -14.395 1.00 42.10 N ATOM 763 CA GLU A 112 -4.958 11.883 -13.310 1.00 47.23 C ATOM 764 C GLU A 112 -6.141 11.278 -12.567 1.00 41.73 C ATOM 765 O GLU A 112 -7.025 10.680 -13.175 1.00 41.32 O ATOM 766 CB GLU A 112 -5.352 13.243 -13.882 1.00 49.85 C ATOM 767 CG GLU A 112 -4.333 13.780 -14.870 1.00 62.95 C ATOM 768 CD GLU A 112 -4.572 15.231 -15.212 1.00 75.45 C ATOM 769 OE1 GLU A 112 -5.760 15.594 -15.363 1.00 81.93 O ATOM 770 OE2 GLU A 112 -3.591 15.996 -15.363 1.00 82.79 O ATOM 771 H GLU A 112 -4.719 11.305 -15.375 1.00 0.00 H ATOM 772 N GLU A 113 -6.168 11.448 -11.247 1.00 36.45 N ATOM 773 CA GLU A 113 -7.347 11.061 -10.479 1.00 30.42 C ATOM 774 C GLU A 113 -8.483 12.026 -10.761 1.00 37.09 C ATOM 775 O GLU A 113 -8.287 13.244 -10.806 1.00 33.51 O ATOM 776 CB GLU A 113 -7.082 11.072 -8.975 1.00 34.48 C ATOM 777 CG GLU A 113 -5.977 10.178 -8.495 1.00 38.44 C ATOM 778 CD GLU A 113 -5.924 10.141 -6.973 1.00 56.51 C ATOM 779 OE1 GLU A 113 -6.997 10.254 -6.333 1.00 60.89 O ATOM 780 OE2 GLU A 113 -4.817 10.006 -6.417 1.00 61.10 O ATOM 781 H GLU A 113 -5.345 11.858 -10.761 1.00 0.00 H ATOM 782 N THR A 114 -9.681 11.481 -10.924 1.00 30.03 N ATOM 783 CA THR A 114 -10.848 12.323 -11.117 1.00 31.85 C ATOM 784 C THR A 114 -12.038 11.639 -10.457 1.00 31.22 C ATOM 785 O THR A 114 -12.000 10.442 -10.169 1.00 25.10 O ATOM 786 CB THR A 114 -11.096 12.582 -12.605 1.00 34.88 C ATOM 787 OG1 THR A 114 -12.107 13.590 -12.755 1.00 52.39 O ATOM 788 CG2 THR A 114 -11.554 11.309 -13.289 1.00 31.51 C ATOM 789 HG1 THR A 114 -12.266 13.756 -13.718 1.00 0.00 H ATOM 790 H THR A 114 -9.785 10.446 -10.914 1.00 0.00 H ATOM 791 N LYS A 115 -13.083 12.424 -10.192 1.00 28.02 N ATOM 792 CA LYS A 115 -14.329 11.927 -9.598 1.00 26.07 C ATOM 793 C LYS A 115 -14.077 11.132 -8.311 1.00 22.79 C ATOM 794 O LYS A 115 -14.648 10.058 -8.086 1.00 24.22 O ATOM 795 CB LYS A 115 -15.111 11.098 -10.614 1.00 27.70 C ATOM 796 CG LYS A 115 -15.845 11.952 -11.644 1.00 26.84 C ATOM 797 CD LYS A 115 -16.941 12.789 -10.952 1.00 31.55 C ATOM 798 CE LYS A 115 -17.738 13.624 -11.938 1.00 41.56 C ATOM 799 NZ LYS A 115 -18.836 14.341 -11.243 1.00 40.26 N ATOM 800 HZ1 LYS A 115 -19.470 13.650 -10.794 1.00 0.00 H ATOM 801 HZ2 LYS A 115 -18.434 14.967 -10.516 1.00 0.00 H ATOM 802 HZ3 LYS A 115 -19.370 14.907 -11.933 1.00 0.00 H ATOM 803 H LYS A 115 -13.011 13.437 -10.417 1.00 0.00 H ATOM 804 N ALA A 116 -13.249 11.701 -7.433 1.00 25.70 N ATOM 805 CA ALA A 116 -12.897 11.049 -6.175 1.00 24.98 C ATOM 806 C ALA A 116 -14.061 11.106 -5.191 1.00 25.68 C ATOM 807 O ALA A 116 -14.812 12.087 -5.136 1.00 27.98 O ATOM 808 CB ALA A 116 -11.669 11.716 -5.546 1.00 25.64 C ATOM 809 H ALA A 116 -12.844 12.634 -7.651 1.00 0.00 H ATOM 810 N MET A 117 -14.204 10.033 -4.416 1.00 26.19 N ATOM 811 CA MET A 117 -15.144 9.948 -3.306 1.00 28.55 C ATOM 812 C MET A 117 -14.433 9.203 -2.186 1.00 29.92 C ATOM 813 O MET A 117 -13.822 8.160 -2.436 1.00 32.11 O ATOM 814 CB MET A 117 -16.419 9.208 -3.721 1.00 31.79 C ATOM 815 CG MET A 117 -17.677 9.677 -3.038 1.00 48.01 C ATOM 816 SD MET A 117 -19.142 9.080 -3.927 1.00 37.58 S ATOM 817 CE MET A 117 -19.354 10.330 -5.197 1.00 38.00 C ATOM 818 H MET A 117 -13.608 9.204 -4.615 1.00 0.00 H ATOM 819 N GLU A 118 -14.488 9.725 -0.965 1.00 32.62 N ATOM 820 CA GLU A 118 -13.763 9.086 0.126 1.00 37.24 C ATOM 821 C GLU A 118 -14.606 9.063 1.387 1.00 36.91 C ATOM 822 O GLU A 118 -15.441 9.940 1.608 1.00 33.88 O ATOM 823 CB GLU A 118 -12.421 9.784 0.406 1.00 48.60 C ATOM 824 CG GLU A 118 -12.527 11.252 0.735 1.00 51.47 C ATOM 825 CD GLU A 118 -11.240 11.793 1.315 1.00 60.85 C ATOM 826 OE1 GLU A 118 -11.300 12.752 2.114 1.00 68.95 O ATOM 827 OE2 GLU A 118 -10.171 11.246 0.986 1.00 63.23 O ATOM 828 H GLU A 118 -15.046 10.585 -0.789 1.00 0.00 H ATOM 829 N SER A 119 -14.388 8.039 2.212 1.00 31.18 N ATOM 830 CA SER A 119 -15.095 7.978 3.479 1.00 33.13 C ATOM 831 C SER A 119 -14.747 9.211 4.298 1.00 41.31 C ATOM 832 O SER A 119 -13.613 9.686 4.274 1.00 44.65 O ATOM 833 CB SER A 119 -14.725 6.699 4.236 1.00 39.40 C ATOM 834 OG SER A 119 -13.322 6.586 4.406 1.00 33.66 O ATOM 835 HG SER A 119 -12.884 6.564 3.518 1.00 0.00 H ATOM 836 H SER A 119 -13.717 7.289 1.950 1.00 0.00 H ATOM 837 N GLN A 120 -15.732 9.765 4.995 1.00 50.96 N ATOM 838 CA GLN A 120 -15.398 10.915 5.826 1.00 66.74 C ATOM 839 C GLN A 120 -14.677 10.502 7.102 1.00 72.22 C ATOM 840 O GLN A 120 -14.128 11.363 7.802 1.00 81.62 O ATOM 841 CB GLN A 120 -16.660 11.716 6.160 1.00 77.33 C ATOM 842 H GLN A 120 -16.702 9.394 4.950 1.00 0.00 H ATOM 843 N ARG A 121 -14.635 9.204 7.387 1.00 60.72 N ATOM 844 CA ARG A 121 -14.107 8.661 8.626 1.00 54.98 C ATOM 845 C ARG A 121 -13.682 7.221 8.366 1.00 44.66 C ATOM 846 O ARG A 121 -13.954 6.657 7.304 1.00 40.34 O ATOM 847 CB ARG A 121 -15.154 8.729 9.742 1.00 54.85 C ATOM 848 CG ARG A 121 -16.450 7.975 9.426 1.00 57.12 C ATOM 849 CD ARG A 121 -17.353 7.893 10.654 1.00 64.63 C ATOM 850 NE ARG A 121 -18.623 7.204 10.409 1.00 69.44 N ATOM 851 CZ ARG A 121 -18.775 5.880 10.401 1.00 74.00 C ATOM 852 NH1 ARG A 121 -17.733 5.088 10.606 1.00 71.82 N ATOM 853 NH2 ARG A 121 -19.970 5.343 10.184 1.00 78.39 N ATOM 854 HE ARG A 121 -19.464 7.789 10.229 1.00 0.00 H ATOM 855 HH12 ARG A 121 -17.855 4.055 10.599 1.00 0.00 H ATOM 856 HH11 ARG A 121 -16.793 5.499 10.774 1.00 0.00 H ATOM 857 HH22 ARG A 121 -20.082 4.309 10.179 1.00 0.00 H ATOM 858 HH21 ARG A 121 -20.794 5.956 10.019 1.00 0.00 H ATOM 859 H ARG A 121 -15.003 8.537 6.679 1.00 0.00 H ATOM 860 N ALA A 122 -13.019 6.619 9.353 1.00 46.35 N ATOM 861 CA ALA A 122 -12.730 5.193 9.303 1.00 45.16 C ATOM 862 C ALA A 122 -14.020 4.413 9.512 1.00 49.06 C ATOM 863 O ALA A 122 -14.801 4.720 10.421 1.00 50.52 O ATOM 864 CB ALA A 122 -11.698 4.805 10.367 1.00 46.67 C ATOM 865 H ALA A 122 -12.703 7.177 10.172 1.00 0.00 H ATOM 866 N TYR A 123 -14.254 3.421 8.661 1.00 40.92 N ATOM 867 CA TYR A 123 -15.392 2.531 8.807 1.00 37.29 C ATOM 868 C TYR A 123 -14.956 1.199 9.403 1.00 36.39 C ATOM 869 O TYR A 123 -13.823 0.746 9.215 1.00 37.69 O ATOM 870 CB TYR A 123 -16.096 2.314 7.467 1.00 38.23 C ATOM 871 CG TYR A 123 -17.047 3.447 7.139 1.00 36.44 C ATOM 872 CD1 TYR A 123 -16.579 4.634 6.580 1.00 42.16 C ATOM 873 CD2 TYR A 123 -18.399 3.353 7.442 1.00 41.78 C ATOM 874 CE1 TYR A 123 -17.450 5.691 6.290 1.00 38.69 C ATOM 875 CE2 TYR A 123 -19.265 4.392 7.164 1.00 45.01 C ATOM 876 CZ TYR A 123 -18.787 5.560 6.590 1.00 45.47 C ATOM 877 OH TYR A 123 -19.651 6.597 6.315 1.00 44.24 O ATOM 878 HH TYR A 123 -19.147 7.347 5.911 1.00 0.00 H ATOM 879 H TYR A 123 -13.601 3.277 7.864 1.00 0.00 H ATOM 880 N ARG A 124 -15.870 0.580 10.139 1.00 39.95 N ATOM 881 CA ARG A 124 -15.606 -0.688 10.805 1.00 47.67 C ATOM 882 C ARG A 124 -15.921 -1.825 9.839 1.00 43.54 C ATOM 883 O ARG A 124 -17.067 -1.984 9.410 1.00 38.85 O ATOM 884 CB ARG A 124 -16.434 -0.801 12.082 1.00 53.14 C ATOM 885 CG ARG A 124 -15.921 -1.832 13.062 1.00 63.74 C ATOM 886 CD ARG A 124 -16.803 -1.873 14.305 1.00 74.23 C ATOM 887 NE ARG A 124 -16.522 -3.049 15.125 1.00 80.75 N ATOM 888 CZ ARG A 124 -17.225 -4.178 15.081 1.00 85.99 C ATOM 889 NH1 ARG A 124 -18.258 -4.288 14.255 1.00 85.39 N ATOM 890 NH2 ARG A 124 -16.894 -5.198 15.866 1.00 88.77 N ATOM 891 HE ARG A 124 -15.721 -3.001 15.786 1.00 0.00 H ATOM 892 HH12 ARG A 124 -18.806 -5.171 14.222 1.00 0.00 H ATOM 893 HH11 ARG A 124 -18.520 -3.491 13.640 1.00 0.00 H ATOM 894 HH22 ARG A 124 -17.443 -6.080 15.832 1.00 0.00 H ATOM 895 HH21 ARG A 124 -16.086 -5.114 16.515 1.00 0.00 H ATOM 896 H ARG A 124 -16.808 1.016 10.244 1.00 0.00 H ATOM 897 N PHE A 125 -14.900 -2.606 9.492 1.00 36.45 N ATOM 898 CA PHE A 125 -15.042 -3.778 8.636 1.00 36.31 C ATOM 899 C PHE A 125 -14.938 -5.038 9.481 1.00 42.98 C ATOM 900 O PHE A 125 -14.139 -5.105 10.420 1.00 48.15 O ATOM 901 CB PHE A 125 -13.948 -3.852 7.559 1.00 32.94 C ATOM 902 CG PHE A 125 -14.047 -2.808 6.476 1.00 27.15 C ATOM 903 CD1 PHE A 125 -13.553 -1.523 6.688 1.00 26.95 C ATOM 904 CD2 PHE A 125 -14.552 -3.129 5.231 1.00 30.07 C ATOM 905 CE1 PHE A 125 -13.633 -0.559 5.697 1.00 30.91 C ATOM 906 CE2 PHE A 125 -14.622 -2.169 4.228 1.00 31.26 C ATOM 907 CZ PHE A 125 -14.158 -0.888 4.460 1.00 28.34 C ATOM 908 H PHE A 125 -13.953 -2.368 9.850 1.00 0.00 H ATOM 909 N VAL A 126 -15.740 -6.039 9.139 1.00 44.28 N ATOM 910 CA VAL A 126 -15.522 -7.395 9.612 1.00 49.66 C ATOM 911 C VAL A 126 -15.492 -8.288 8.387 1.00 49.68 C ATOM 912 O VAL A 126 -15.908 -7.895 7.294 1.00 41.95 O ATOM 913 CB VAL A 126 -16.588 -7.882 10.612 1.00 48.98 C ATOM 914 CG1 VAL A 126 -16.523 -7.066 11.888 1.00 51.94 C ATOM 915 CG2 VAL A 126 -17.967 -7.828 9.978 1.00 48.14 C ATOM 916 H VAL A 126 -16.549 -5.847 8.514 1.00 0.00 H ATOM 917 N GLN A 127 -14.982 -9.499 8.583 1.00 48.24 N ATOM 918 CA GLN A 127 -14.836 -10.438 7.484 1.00 48.75 C ATOM 919 C GLN A 127 -16.172 -10.637 6.783 1.00 39.69 C ATOM 920 O GLN A 127 -17.166 -11.013 7.412 1.00 44.61 O ATOM 921 CB GLN A 127 -14.287 -11.766 8.013 1.00 47.82 C ATOM 922 CG GLN A 127 -13.868 -12.720 6.933 1.00 40.16 C ATOM 923 CD GLN A 127 -13.215 -13.964 7.467 1.00 39.79 C ATOM 924 OE1 GLN A 127 -12.137 -13.919 8.088 1.00 33.93 O ATOM 925 NE2 GLN A 127 -13.858 -15.094 7.232 1.00 36.83 N ATOM 926 HE22 GLN A 127 -14.756 -15.082 6.708 1.00 0.00 H ATOM 927 HE21 GLN A 127 -13.466 -15.996 7.571 1.00 0.00 H ATOM 928 H GLN A 127 -14.682 -9.779 9.539 1.00 0.00 H ATOM 929 N GLY A 128 -16.207 -10.323 5.488 1.00 37.57 N ATOM 930 CA GLY A 128 -17.403 -10.468 4.687 1.00 44.72 C ATOM 931 C GLY A 128 -18.212 -9.204 4.470 1.00 50.90 C ATOM 932 O GLY A 128 -19.219 -9.256 3.751 1.00 50.02 O ATOM 933 H GLY A 128 -15.343 -9.960 5.037 1.00 0.00 H ATOM 934 N LYS A 129 -17.814 -8.074 5.053 1.00 49.35 N ATOM 935 CA LYS A 129 -18.594 -6.851 4.951 1.00 48.85 C ATOM 936 C LYS A 129 -17.918 -5.861 4.018 1.00 47.15 C ATOM 937 O LYS A 129 -16.684 -5.766 3.979 1.00 43.71 O ATOM 938 CB LYS A 129 -18.815 -6.192 6.315 1.00 60.60 C ATOM 939 CG LYS A 129 -19.780 -5.000 6.236 1.00 67.77 C ATOM 940 CD LYS A 129 -19.859 -4.206 7.522 1.00 71.06 C ATOM 941 CE LYS A 129 -21.020 -3.223 7.471 1.00 71.65 C ATOM 942 NZ LYS A 129 -22.354 -3.882 7.552 1.00 76.48 N ATOM 943 HZ1 LYS A 129 -22.464 -4.539 6.753 1.00 0.00 H ATOM 944 HZ2 LYS A 129 -22.426 -4.407 8.447 1.00 0.00 H ATOM 945 HZ3 LYS A 129 -23.100 -3.158 7.512 1.00 0.00 H ATOM 946 H LYS A 129 -16.925 -8.066 5.593 1.00 0.00 H ATOM 947 N ASP A 130 -18.739 -5.127 3.273 1.00 43.84 N ATOM 948 CA ASP A 130 -18.271 -4.104 2.357 1.00 43.63 C ATOM 949 C ASP A 130 -18.737 -2.725 2.805 1.00 40.47 C ATOM 950 O ASP A 130 -19.691 -2.578 3.574 1.00 44.72 O ATOM 951 CB ASP A 130 -18.740 -4.390 0.922 1.00 37.90 C ATOM 952 CG ASP A 130 -20.264 -4.419 0.781 1.00 47.08 C ATOM 953 OD1 ASP A 130 -20.978 -4.285 1.797 1.00 55.14 O ATOM 954 OD2 ASP A 130 -20.747 -4.631 -0.350 1.00 46.94 O ATOM 955 H ASP A 130 -19.763 -5.294 3.350 1.00 0.00 H ATOM 956 N TRP A 131 -18.017 -1.718 2.322 1.00 35.57 N ATOM 957 CA TRP A 131 -18.397 -0.318 2.426 1.00 39.95 C ATOM 958 C TRP A 131 -18.049 0.342 1.103 1.00 36.80 C ATOM 959 O TRP A 131 -17.066 -0.033 0.454 1.00 29.80 O ATOM 960 CB TRP A 131 -17.673 0.389 3.575 1.00 35.02 C ATOM 961 CG TRP A 131 -18.173 0.035 4.938 1.00 38.20 C ATOM 962 CD1 TRP A 131 -17.520 -0.702 5.888 1.00 37.30 C ATOM 963 CD2 TRP A 131 -19.422 0.421 5.518 1.00 40.95 C ATOM 964 NE1 TRP A 131 -18.287 -0.802 7.020 1.00 39.69 N ATOM 965 CE2 TRP A 131 -19.466 -0.122 6.816 1.00 44.42 C ATOM 966 CE3 TRP A 131 -20.515 1.171 5.057 1.00 46.73 C ATOM 967 CZ2 TRP A 131 -20.560 0.064 7.669 1.00 48.64 C ATOM 968 CZ3 TRP A 131 -21.610 1.353 5.906 1.00 38.84 C ATOM 969 CH2 TRP A 131 -21.620 0.799 7.198 1.00 45.84 C ATOM 970 HE1 TRP A 131 -18.022 -1.308 7.889 1.00 0.00 H ATOM 971 H TRP A 131 -17.125 -1.946 1.839 1.00 0.00 H ATOM 972 N GLY A 132 -18.852 1.317 0.697 1.00 31.89 N ATOM 973 CA GLY A 132 -18.631 1.934 -0.594 1.00 30.55 C ATOM 974 C GLY A 132 -19.648 3.005 -0.934 1.00 31.72 C ATOM 975 O GLY A 132 -20.227 3.630 -0.039 1.00 33.14 O ATOM 976 H GLY A 132 -19.635 1.636 1.302 1.00 0.00 H ATOM 977 N PHE A 133 -19.881 3.233 -2.221 1.00 31.38 N ATOM 978 CA PHE A 133 -20.790 4.293 -2.654 1.00 32.47 C ATOM 979 C PHE A 133 -21.752 3.754 -3.702 1.00 34.70 C ATOM 980 O PHE A 133 -21.372 3.536 -4.857 1.00 31.43 O ATOM 981 CB PHE A 133 -19.999 5.489 -3.176 1.00 29.99 C ATOM 982 CG PHE A 133 -19.046 6.059 -2.158 1.00 36.07 C ATOM 983 CD1 PHE A 133 -19.514 6.798 -1.084 1.00 39.46 C ATOM 984 CD2 PHE A 133 -17.687 5.824 -2.262 1.00 34.74 C ATOM 985 CE1 PHE A 133 -18.632 7.310 -0.139 1.00 37.94 C ATOM 986 CE2 PHE A 133 -16.803 6.338 -1.317 1.00 36.36 C ATOM 987 CZ PHE A 133 -17.276 7.076 -0.263 1.00 38.08 C ATOM 988 H PHE A 133 -19.407 2.645 -2.936 1.00 0.00 H ATOM 989 N LYS A 134 -23.006 3.560 -3.289 1.00 35.65 N ATOM 990 CA LYS A 134 -24.063 3.181 -4.215 1.00 40.09 C ATOM 991 C LYS A 134 -24.084 4.093 -5.437 1.00 38.41 C ATOM 992 O LYS A 134 -24.220 3.626 -6.575 1.00 39.74 O ATOM 993 CB LYS A 134 -25.407 3.227 -3.475 1.00 36.25 C ATOM 994 CG LYS A 134 -26.515 2.410 -4.106 1.00 49.60 C ATOM 995 CD LYS A 134 -27.830 2.593 -3.351 1.00 48.86 C ATOM 996 H LYS A 134 -23.233 3.683 -2.282 1.00 0.00 H ATOM 997 N LYS A 135 -23.953 5.403 -5.217 1.00 38.52 N ATOM 998 CA LYS A 135 -23.981 6.382 -6.294 1.00 30.36 C ATOM 999 C LYS A 135 -22.588 6.936 -6.554 1.00 33.34 C ATOM 1000 O LYS A 135 -22.373 8.149 -6.485 1.00 35.44 O ATOM 1001 CB LYS A 135 -24.959 7.515 -5.957 1.00 34.63 C ATOM 1002 CG LYS A 135 -26.404 7.069 -5.945 1.00 39.48 C ATOM 1003 CD LYS A 135 -27.343 8.175 -5.459 1.00 36.72 C ATOM 1004 CE LYS A 135 -28.749 7.635 -5.236 1.00 53.50 C ATOM 1005 NZ LYS A 135 -29.715 8.702 -4.824 1.00 62.15 N ATOM 1006 HZ1 LYS A 135 -29.393 9.135 -3.935 1.00 0.00 H ATOM 1007 HZ2 LYS A 135 -29.765 9.428 -5.567 1.00 0.00 H ATOM 1008 HZ3 LYS A 135 -30.656 8.281 -4.685 1.00 0.00 H ATOM 1009 H LYS A 135 -23.826 5.737 -4.240 1.00 0.00 H ATOM 1010 N PHE A 136 -21.631 6.057 -6.855 1.00 30.01 N ATOM 1011 CA PHE A 136 -20.264 6.531 -7.059 1.00 27.19 C ATOM 1012 C PHE A 136 -20.179 7.484 -8.245 1.00 31.86 C ATOM 1013 O PHE A 136 -19.628 8.589 -8.132 1.00 28.84 O ATOM 1014 CB PHE A 136 -19.314 5.355 -7.245 1.00 32.43 C ATOM 1015 CG PHE A 136 -17.891 5.781 -7.497 1.00 31.26 C ATOM 1016 CD1 PHE A 136 -17.226 6.595 -6.582 1.00 28.10 C ATOM 1017 CD2 PHE A 136 -17.230 5.395 -8.653 1.00 34.64 C ATOM 1018 CE1 PHE A 136 -15.897 7.000 -6.811 1.00 25.38 C ATOM 1019 CE2 PHE A 136 -15.909 5.803 -8.889 1.00 33.04 C ATOM 1020 CZ PHE A 136 -15.254 6.612 -7.963 1.00 31.67 C ATOM 1021 H PHE A 136 -21.855 5.045 -6.944 1.00 0.00 H ATOM 1022 N ILE A 137 -20.724 7.088 -9.393 1.00 29.29 N ATOM 1023 CA ILE A 137 -20.686 7.973 -10.553 1.00 35.71 C ATOM 1024 C ILE A 137 -21.865 7.644 -11.457 1.00 40.06 C ATOM 1025 O ILE A 137 -22.275 6.486 -11.567 1.00 34.06 O ATOM 1026 CB ILE A 137 -19.336 7.851 -11.300 1.00 30.04 C ATOM 1027 CG1 ILE A 137 -19.253 8.906 -12.397 1.00 34.11 C ATOM 1028 CG2 ILE A 137 -19.182 6.474 -11.916 1.00 30.59 C ATOM 1029 CD1 ILE A 137 -17.883 9.063 -12.956 1.00 39.67 C ATOM 1030 H ILE A 137 -21.174 6.153 -9.463 1.00 0.00 H ATOM 1031 N ARG A 138 -22.406 8.681 -12.100 1.00 40.93 N ATOM 1032 CA ARG A 138 -23.483 8.507 -13.065 1.00 39.26 C ATOM 1033 C ARG A 138 -22.992 7.750 -14.292 1.00 38.08 C ATOM 1034 O ARG A 138 -21.919 8.037 -14.834 1.00 35.91 O ATOM 1035 CB ARG A 138 -24.040 9.864 -13.503 1.00 40.49 C ATOM 1036 CG ARG A 138 -24.556 10.747 -12.394 1.00 48.84 C ATOM 1037 CD ARG A 138 -26.052 10.607 -12.235 1.00 56.29 C ATOM 1038 NE ARG A 138 -26.790 10.916 -13.456 1.00 60.04 N ATOM 1039 CZ ARG A 138 -28.115 10.984 -13.510 1.00 72.17 C ATOM 1040 NH1 ARG A 138 -28.829 10.773 -12.412 1.00 78.04 N ATOM 1041 NH2 ARG A 138 -28.727 11.266 -14.652 1.00 76.31 N ATOM 1042 HE ARG A 138 -26.251 11.092 -14.328 1.00 0.00 H ATOM 1043 HH12 ARG A 138 -29.867 10.825 -12.449 1.00 0.00 H ATOM 1044 HH11 ARG A 138 -28.351 10.556 -11.514 1.00 0.00 H ATOM 1045 HH22 ARG A 138 -29.765 11.318 -14.687 1.00 0.00 H ATOM 1046 HH21 ARG A 138 -28.169 11.436 -15.513 1.00 0.00 H ATOM 1047 H ARG A 138 -22.049 9.639 -11.907 1.00 0.00 H ATOM 1048 N ARG A 139 -23.803 6.789 -14.739 1.00 42.13 N ATOM 1049 CA ARG A 139 -23.494 6.063 -15.963 1.00 45.52 C ATOM 1050 C ARG A 139 -23.391 7.006 -17.162 1.00 45.70 C ATOM 1051 O ARG A 139 -22.416 6.940 -17.920 1.00 48.56 O ATOM 1052 CB ARG A 139 -24.552 4.983 -16.205 1.00 57.23 C ATOM 1053 CG ARG A 139 -24.462 3.814 -15.232 1.00 61.69 C ATOM 1054 CD ARG A 139 -25.290 2.616 -15.690 1.00 68.67 C ATOM 1055 NE ARG A 139 -24.940 2.178 -17.040 1.00 74.21 N ATOM 1056 CZ ARG A 139 -23.939 1.346 -17.327 1.00 78.65 C ATOM 1057 NH1 ARG A 139 -23.174 0.856 -16.363 1.00 74.14 N ATOM 1058 NH2 ARG A 139 -23.694 1.004 -18.586 1.00 83.99 N ATOM 1059 HE ARG A 139 -25.511 2.540 -17.830 1.00 0.00 H ATOM 1060 HH12 ARG A 139 -22.395 0.207 -16.596 1.00 0.00 H ATOM 1061 HH11 ARG A 139 -23.352 1.120 -15.373 1.00 0.00 H ATOM 1062 HH22 ARG A 139 -22.912 0.355 -18.806 1.00 0.00 H ATOM 1063 HH21 ARG A 139 -24.284 1.386 -19.353 1.00 0.00 H ATOM 1064 H ARG A 139 -24.666 6.556 -14.207 1.00 0.00 H ATOM 1065 N ASP A 140 -24.369 7.905 -17.347 1.00 37.36 N ATOM 1066 CA ASP A 140 -24.330 8.759 -18.536 1.00 44.57 C ATOM 1067 C ASP A 140 -23.064 9.613 -18.564 1.00 47.07 C ATOM 1068 O ASP A 140 -22.455 9.797 -19.624 1.00 45.10 O ATOM 1069 CB ASP A 140 -25.592 9.625 -18.638 1.00 54.89 C ATOM 1070 CG ASP A 140 -25.950 10.311 -17.340 1.00 61.20 C ATOM 1071 OD1 ASP A 140 -25.113 10.344 -16.412 1.00 61.17 O ATOM 1072 OD2 ASP A 140 -27.083 10.824 -17.251 1.00 63.68 O ATOM 1073 H ASP A 140 -25.142 7.994 -16.657 1.00 0.00 H ATOM 1074 N PHE A 141 -22.614 10.096 -17.403 1.00 43.51 N ATOM 1075 CA PHE A 141 -21.368 10.853 -17.393 1.00 32.91 C ATOM 1076 C PHE A 141 -20.192 9.956 -17.754 1.00 42.58 C ATOM 1077 O PHE A 141 -19.318 10.345 -18.538 1.00 37.10 O ATOM 1078 CB PHE A 141 -21.159 11.505 -16.025 1.00 45.19 C ATOM 1079 CG PHE A 141 -19.950 12.403 -15.955 1.00 30.06 C ATOM 1080 CD1 PHE A 141 -20.023 13.717 -16.389 1.00 40.52 C ATOM 1081 CD2 PHE A 141 -18.744 11.925 -15.477 1.00 35.26 C ATOM 1082 CE1 PHE A 141 -18.920 14.542 -16.323 1.00 37.22 C ATOM 1083 CE2 PHE A 141 -17.637 12.745 -15.411 1.00 34.90 C ATOM 1084 CZ PHE A 141 -17.719 14.045 -15.832 1.00 36.49 C ATOM 1085 H PHE A 141 -23.143 9.935 -16.522 1.00 0.00 H ATOM 1086 N LEU A 142 -20.170 8.740 -17.205 1.00 37.76 N ATOM 1087 CA LEU A 142 -19.086 7.804 -17.482 1.00 39.66 C ATOM 1088 C LEU A 142 -19.059 7.406 -18.955 1.00 44.69 C ATOM 1089 O LEU A 142 -17.984 7.235 -19.541 1.00 40.75 O ATOM 1090 CB LEU A 142 -19.249 6.579 -16.585 1.00 43.02 C ATOM 1091 CG LEU A 142 -18.102 5.591 -16.452 1.00 48.42 C ATOM 1092 CD1 LEU A 142 -16.864 6.325 -16.005 1.00 37.99 C ATOM 1093 CD2 LEU A 142 -18.477 4.516 -15.445 1.00 47.75 C ATOM 1094 H LEU A 142 -20.940 8.454 -16.567 1.00 0.00 H ATOM 1095 N LEU A 143 -20.232 7.277 -19.580 1.00 44.39 N ATOM 1096 CA LEU A 143 -20.292 6.798 -20.956 1.00 52.39 C ATOM 1097 C LEU A 143 -20.047 7.897 -21.982 1.00 57.73 C ATOM 1098 O LEU A 143 -19.773 7.590 -23.147 1.00 61.52 O ATOM 1099 CB LEU A 143 -21.645 6.135 -21.231 1.00 48.09 C ATOM 1100 CG LEU A 143 -21.976 4.854 -20.461 1.00 52.05 C ATOM 1101 CD1 LEU A 143 -23.444 4.494 -20.648 1.00 58.93 C ATOM 1102 CD2 LEU A 143 -21.077 3.708 -20.913 1.00 54.56 C ATOM 1103 H LEU A 143 -21.111 7.520 -19.081 1.00 0.00 H ATOM 1104 N ASP A 144 -20.140 9.161 -21.588 1.00 57.07 N ATOM 1105 CA ASP A 144 -19.898 10.247 -22.527 1.00 55.65 C ATOM 1106 C ASP A 144 -18.403 10.349 -22.811 1.00 55.46 C ATOM 1107 O ASP A 144 -17.604 10.608 -21.905 1.00 47.60 O ATOM 1108 CB ASP A 144 -20.452 11.556 -21.966 1.00 50.07 C ATOM 1109 CG ASP A 144 -20.331 12.716 -22.943 1.00 55.91 C ATOM 1110 OD1 ASP A 144 -19.910 12.493 -24.094 1.00 52.31 O ATOM 1111 OD2 ASP A 144 -20.675 13.855 -22.559 1.00 57.39 O ATOM 1112 H ASP A 144 -20.388 9.377 -20.601 1.00 0.00 H ATOM 1113 N GLU A 145 -18.031 10.141 -24.076 1.00 55.12 N ATOM 1114 CA GLU A 145 -16.626 10.104 -24.462 1.00 61.83 C ATOM 1115 C GLU A 145 -15.918 11.436 -24.239 1.00 56.33 C ATOM 1116 O GLU A 145 -14.690 11.453 -24.115 1.00 58.38 O ATOM 1117 CB GLU A 145 -16.499 9.683 -25.931 1.00 75.82 C ATOM 1118 CG GLU A 145 -17.481 8.589 -26.387 1.00 86.93 C ATOM 1119 CD GLU A 145 -18.901 9.105 -26.627 1.00 96.05 C ATOM 1120 OE1 GLU A 145 -19.848 8.288 -26.637 1.00 98.27 O ATOM 1121 OE2 GLU A 145 -19.070 10.333 -26.802 1.00 97.55 O ATOM 1122 H GLU A 145 -18.761 10.002 -24.803 1.00 0.00 H ATOM 1123 N ALA A 146 -16.660 12.548 -24.192 1.00 55.04 N ATOM 1124 CA ALA A 146 -16.049 13.857 -23.976 1.00 56.30 C ATOM 1125 C ALA A 146 -15.371 13.968 -22.618 1.00 50.79 C ATOM 1126 O ALA A 146 -14.478 14.807 -22.450 1.00 49.83 O ATOM 1127 CB ALA A 146 -17.100 14.963 -24.114 1.00 57.58 C ATOM 1128 H ALA A 146 -17.691 12.479 -24.311 1.00 0.00 H ATOM 1129 N ASN A 147 -15.775 13.150 -21.647 1.00 38.59 N ATOM 1130 CA ASN A 147 -15.171 13.177 -20.327 1.00 38.94 C ATOM 1131 C ASN A 147 -13.929 12.301 -20.238 1.00 43.40 C ATOM 1132 O ASN A 147 -13.193 12.397 -19.249 1.00 51.00 O ATOM 1133 CB ASN A 147 -16.205 12.754 -19.286 1.00 36.75 C ATOM 1134 CG ASN A 147 -17.474 13.581 -19.367 1.00 45.50 C ATOM 1135 OD1 ASN A 147 -17.425 14.809 -19.343 1.00 55.23 O ATOM 1136 ND2 ASN A 147 -18.615 12.913 -19.484 1.00 38.62 N ATOM 1137 HD22 ASN A 147 -18.609 11.873 -19.500 1.00 0.00 H ATOM 1138 HD21 ASN A 147 -19.515 13.429 -19.560 1.00 0.00 H ATOM 1139 H ASN A 147 -16.542 12.475 -21.839 1.00 0.00 H ATOM 1140 N GLY A 148 -13.683 11.464 -21.241 1.00 46.40 N ATOM 1141 CA GLY A 148 -12.429 10.729 -21.332 1.00 50.18 C ATOM 1142 C GLY A 148 -12.165 9.792 -20.178 1.00 48.62 C ATOM 1143 O GLY A 148 -11.007 9.618 -19.773 1.00 51.54 O ATOM 1144 H GLY A 148 -14.404 11.331 -21.979 1.00 0.00 H ATOM 1145 N LEU A 149 -13.214 9.177 -19.633 1.00 46.09 N ATOM 1146 CA LEU A 149 -13.070 8.234 -18.535 1.00 45.19 C ATOM 1147 C LEU A 149 -13.059 6.784 -18.992 1.00 42.15 C ATOM 1148 O LEU A 149 -12.769 5.899 -18.181 1.00 38.36 O ATOM 1149 CB LEU A 149 -14.190 8.443 -17.505 1.00 40.29 C ATOM 1150 CG LEU A 149 -14.249 9.850 -16.910 1.00 42.86 C ATOM 1151 CD1 LEU A 149 -15.250 9.927 -15.772 1.00 43.97 C ATOM 1152 CD2 LEU A 149 -12.862 10.291 -16.453 1.00 39.49 C ATOM 1153 H LEU A 149 -14.165 9.377 -20.004 1.00 0.00 H ATOM 1154 N LEU A 150 -13.352 6.514 -20.264 1.00 36.36 N ATOM 1155 CA LEU A 150 -13.283 5.160 -20.815 1.00 41.81 C ATOM 1156 C LEU A 150 -12.408 5.134 -22.071 1.00 46.18 C ATOM 1157 O LEU A 150 -12.859 4.744 -23.153 1.00 42.00 O ATOM 1158 CB LEU A 150 -14.684 4.630 -21.125 1.00 38.33 C ATOM 1159 CG LEU A 150 -15.609 4.488 -19.912 1.00 35.93 C ATOM 1160 CD1 LEU A 150 -17.048 4.199 -20.350 1.00 37.82 C ATOM 1161 CD2 LEU A 150 -15.120 3.411 -18.992 1.00 31.75 C ATOM 1162 H LEU A 150 -13.640 7.294 -20.888 1.00 0.00 H ATOM 1163 N PRO A 151 -11.134 5.523 -21.947 1.00 44.25 N ATOM 1164 CA PRO A 151 -10.243 5.433 -23.116 1.00 48.74 C ATOM 1165 C PRO A 151 -10.140 3.993 -23.589 1.00 53.29 C ATOM 1166 O PRO A 151 -9.834 3.090 -22.806 1.00 54.84 O ATOM 1167 CB PRO A 151 -8.903 5.950 -22.578 1.00 46.39 C ATOM 1168 CG PRO A 151 -8.951 5.671 -21.125 1.00 38.73 C ATOM 1169 CD PRO A 151 -10.389 5.850 -20.719 1.00 34.78 C ATOM 1170 N ASP A 152 -10.429 3.784 -24.875 1.00 54.49 N ATOM 1171 CA ASP A 152 -10.439 2.456 -25.487 1.00 63.48 C ATOM 1172 C ASP A 152 -11.383 1.496 -24.769 1.00 60.20 C ATOM 1173 O ASP A 152 -11.139 0.286 -24.735 1.00 63.78 O ATOM 1174 CB ASP A 152 -9.028 1.865 -25.551 1.00 71.60 C ATOM 1175 CG ASP A 152 -8.069 2.748 -26.309 1.00 79.00 C ATOM 1176 OD1 ASP A 152 -8.420 3.175 -27.430 1.00 81.77 O ATOM 1177 OD2 ASP A 152 -6.974 3.027 -25.780 1.00 81.12 O ATOM 1178 H ASP A 152 -10.658 4.605 -25.471 1.00 0.00 H ATOM 1179 N ASP A 153 -12.460 2.032 -24.191 1.00 49.86 N ATOM 1180 CA ASP A 153 -13.469 1.236 -23.490 1.00 51.29 C ATOM 1181 C ASP A 153 -12.903 0.585 -22.227 1.00 48.34 C ATOM 1182 O ASP A 153 -13.344 -0.490 -21.815 1.00 47.54 O ATOM 1183 CB ASP A 153 -14.081 0.179 -24.417 1.00 53.08 C ATOM 1184 CG ASP A 153 -15.491 -0.202 -24.018 1.00 64.43 C ATOM 1185 OD1 ASP A 153 -15.940 0.224 -22.929 1.00 63.66 O ATOM 1186 OD2 ASP A 153 -16.151 -0.922 -24.800 1.00 73.48 O ATOM 1187 H ASP A 153 -12.588 3.063 -24.241 1.00 0.00 H ATOM 1188 N LYS A 154 -11.934 1.239 -21.591 1.00 42.36 N ATOM 1189 CA LYS A 154 -11.283 0.716 -20.396 1.00 37.87 C ATOM 1190 C LYS A 154 -11.565 1.629 -19.218 1.00 37.72 C ATOM 1191 O LYS A 154 -11.330 2.839 -19.297 1.00 42.09 O ATOM 1192 CB LYS A 154 -9.772 0.579 -20.604 1.00 44.11 C ATOM 1193 CG LYS A 154 -9.406 -0.323 -21.777 1.00 51.41 C ATOM 1194 CD LYS A 154 -7.907 -0.344 -22.031 1.00 51.82 C ATOM 1195 CE LYS A 154 -7.583 -1.164 -23.275 1.00 56.74 C ATOM 1196 NZ LYS A 154 -8.225 -2.514 -23.253 1.00 56.43 N ATOM 1197 HZ1 LYS A 154 -7.889 -3.043 -22.423 1.00 0.00 H ATOM 1198 HZ2 LYS A 154 -9.258 -2.405 -23.201 1.00 0.00 H ATOM 1199 HZ3 LYS A 154 -7.973 -3.030 -24.120 1.00 0.00 H ATOM 1200 H LYS A 154 -11.629 2.161 -21.962 1.00 0.00 H ATOM 1201 N LEU A 155 -12.053 1.043 -18.127 1.00 32.39 N ATOM 1202 CA LEU A 155 -12.347 1.766 -16.898 1.00 29.30 C ATOM 1203 C LEU A 155 -11.256 1.430 -15.901 1.00 33.60 C ATOM 1204 O LEU A 155 -11.056 0.254 -15.580 1.00 32.67 O ATOM 1205 CB LEU A 155 -13.711 1.385 -16.326 1.00 30.69 C ATOM 1206 CG LEU A 155 -14.015 1.986 -14.951 1.00 36.45 C ATOM 1207 CD1 LEU A 155 -14.144 3.503 -15.048 1.00 31.47 C ATOM 1208 CD2 LEU A 155 -15.281 1.361 -14.378 1.00 39.75 C ATOM 1209 H LEU A 155 -12.233 0.019 -18.154 1.00 0.00 H ATOM 1210 N THR A 156 -10.548 2.450 -15.428 1.00 30.51 N ATOM 1211 CA THR A 156 -9.469 2.258 -14.458 1.00 23.65 C ATOM 1212 C THR A 156 -9.880 2.891 -13.141 1.00 23.22 C ATOM 1213 O THR A 156 -9.973 4.120 -13.033 1.00 35.02 O ATOM 1214 CB THR A 156 -8.148 2.837 -14.960 1.00 31.38 C ATOM 1215 OG1 THR A 156 -7.738 2.120 -16.129 1.00 34.17 O ATOM 1216 CG2 THR A 156 -7.073 2.692 -13.899 1.00 32.79 C ATOM 1217 HG1 THR A 156 -7.619 1.163 -15.903 1.00 0.00 H ATOM 1218 H THR A 156 -10.767 3.412 -15.756 1.00 0.00 H ATOM 1219 N LEU A 157 -10.117 2.043 -12.147 1.00 26.07 N ATOM 1220 CA LEU A 157 -10.474 2.450 -10.800 1.00 23.77 C ATOM 1221 C LEU A 157 -9.227 2.474 -9.923 1.00 26.88 C ATOM 1222 O LEU A 157 -8.276 1.725 -10.153 1.00 26.13 O ATOM 1223 CB LEU A 157 -11.499 1.493 -10.219 1.00 20.68 C ATOM 1224 CG LEU A 157 -12.802 1.462 -11.005 1.00 28.45 C ATOM 1225 CD1 LEU A 157 -13.671 0.360 -10.429 1.00 28.02 C ATOM 1226 CD2 LEU A 157 -13.472 2.816 -10.914 1.00 32.39 C ATOM 1227 H LEU A 157 -10.042 1.025 -12.346 1.00 0.00 H ATOM 1228 N PHE A 158 -9.253 3.337 -8.905 1.00 28.75 N ATOM 1229 CA PHE A 158 -8.125 3.541 -8.002 1.00 33.14 C ATOM 1230 C PHE A 158 -8.670 3.585 -6.584 1.00 32.47 C ATOM 1231 O PHE A 158 -9.547 4.400 -6.288 1.00 28.18 O ATOM 1232 CB PHE A 158 -7.399 4.841 -8.356 1.00 32.07 C ATOM 1233 CG PHE A 158 -6.027 4.953 -7.769 1.00 27.93 C ATOM 1234 CD1 PHE A 158 -5.052 4.006 -8.055 1.00 32.53 C ATOM 1235 CD2 PHE A 158 -5.695 6.029 -6.957 1.00 36.64 C ATOM 1236 CE1 PHE A 158 -3.771 4.121 -7.509 1.00 34.85 C ATOM 1237 CE2 PHE A 158 -4.421 6.155 -6.411 1.00 34.29 C ATOM 1238 CZ PHE A 158 -3.456 5.197 -6.693 1.00 31.21 C ATOM 1239 H PHE A 158 -10.119 3.891 -8.748 1.00 0.00 H ATOM 1240 N CYS A 159 -8.177 2.709 -5.714 1.00 24.25 N ATOM 1241 CA CYS A 159 -8.681 2.617 -4.351 1.00 19.11 C ATOM 1242 C CYS A 159 -7.509 2.738 -3.386 1.00 29.74 C ATOM 1243 O CYS A 159 -6.587 1.915 -3.429 1.00 23.57 O ATOM 1244 CB CYS A 159 -9.426 1.305 -4.136 1.00 23.03 C ATOM 1245 SG CYS A 159 -9.897 0.991 -2.400 1.00 30.50 S ATOM 1246 H CYS A 159 -7.411 2.073 -6.015 1.00 0.00 H ATOM 1247 N GLU A 160 -7.534 3.775 -2.549 1.00 32.07 N ATOM 1248 CA GLU A 160 -6.492 4.019 -1.559 1.00 30.43 C ATOM 1249 C GLU A 160 -7.086 3.782 -0.179 1.00 31.86 C ATOM 1250 O GLU A 160 -8.120 4.365 0.158 1.00 32.43 O ATOM 1251 CB GLU A 160 -5.916 5.434 -1.708 1.00 23.91 C ATOM 1252 CG GLU A 160 -5.240 5.657 -3.076 1.00 34.54 C ATOM 1253 CD GLU A 160 -4.350 6.906 -3.161 1.00 43.21 C ATOM 1254 OE1 GLU A 160 -4.885 8.033 -3.155 1.00 43.86 O ATOM 1255 OE2 GLU A 160 -3.108 6.748 -3.252 1.00 40.40 O ATOM 1256 H GLU A 160 -8.332 4.439 -2.605 1.00 0.00 H ATOM 1257 N VAL A 161 -6.442 2.910 0.603 1.00 23.83 N ATOM 1258 CA VAL A 161 -6.949 2.455 1.895 1.00 24.68 C ATOM 1259 C VAL A 161 -5.943 2.806 2.979 1.00 27.15 C ATOM 1260 O VAL A 161 -4.731 2.737 2.756 1.00 22.83 O ATOM 1261 CB VAL A 161 -7.215 0.937 1.886 1.00 27.02 C ATOM 1262 CG1 VAL A 161 -7.874 0.491 3.194 1.00 23.66 C ATOM 1263 CG2 VAL A 161 -8.055 0.553 0.679 1.00 30.48 C ATOM 1264 H VAL A 161 -5.530 2.535 0.273 1.00 0.00 H ATOM 1265 N SER A 162 -6.442 3.204 4.145 1.00 28.82 N ATOM 1266 CA SER A 162 -5.600 3.497 5.302 1.00 26.60 C ATOM 1267 C SER A 162 -6.192 2.753 6.493 1.00 27.95 C ATOM 1268 O SER A 162 -7.275 3.101 6.969 1.00 31.33 O ATOM 1269 CB SER A 162 -5.510 4.996 5.565 1.00 30.20 C ATOM 1270 OG SER A 162 -4.954 5.671 4.453 1.00 32.77 O ATOM 1271 HG SER A 162 -5.524 5.520 3.658 1.00 0.00 H ATOM 1272 H SER A 162 -7.472 3.311 4.237 1.00 0.00 H ATOM 1273 N VAL A 163 -5.485 1.733 6.968 1.00 27.28 N ATOM 1274 CA VAL A 163 -5.983 0.926 8.076 1.00 26.43 C ATOM 1275 C VAL A 163 -5.531 1.564 9.383 1.00 37.47 C ATOM 1276 O VAL A 163 -4.332 1.683 9.646 1.00 42.34 O ATOM 1277 CB VAL A 163 -5.486 -0.522 7.973 1.00 25.76 C ATOM 1278 CG1 VAL A 163 -5.872 -1.313 9.226 1.00 30.20 C ATOM 1279 CG2 VAL A 163 -6.038 -1.183 6.734 1.00 29.03 C ATOM 1280 H VAL A 163 -4.563 1.507 6.543 1.00 0.00 H ATOM 1281 N VAL A 164 -6.495 1.968 10.206 1.00 28.00 N ATOM 1282 CA VAL A 164 -6.179 2.643 11.458 1.00 34.61 C ATOM 1283 C VAL A 164 -6.169 1.679 12.640 1.00 44.87 C ATOM 1284 O VAL A 164 -5.574 2.004 13.680 1.00 56.10 O ATOM 1285 CB VAL A 164 -7.155 3.812 11.711 1.00 50.29 C ATOM 1286 CG1 VAL A 164 -7.276 4.673 10.455 1.00 53.96 C ATOM 1287 CG2 VAL A 164 -8.519 3.302 12.143 1.00 49.91 C ATOM 1288 H VAL A 164 -7.489 1.799 9.952 1.00 0.00 H ATOM 1289 N GLN A 165 -6.770 0.498 12.501 1.00 47.55 N ATOM 1290 CA GLN A 165 -6.897 -0.478 13.576 1.00 62.11 C ATOM 1291 C GLN A 165 -6.906 -1.878 12.982 1.00 64.92 C ATOM 1292 O GLN A 165 -7.688 -2.153 12.065 1.00 56.12 O ATOM 1293 CB GLN A 165 -8.178 -0.248 14.388 1.00 64.71 C ATOM 1294 H GLN A 165 -7.172 0.259 11.572 1.00 0.00 H ATOM 1295 N ASP A 166 -6.042 -2.747 13.514 1.00 68.45 N ATOM 1296 CA ASP A 166 -5.866 -4.136 13.065 1.00 73.67 C ATOM 1297 C ASP A 166 -5.223 -4.222 11.678 1.00 69.32 C ATOM 1298 O ASP A 166 -4.168 -4.846 11.506 1.00 60.01 O ATOM 1299 CB ASP A 166 -7.205 -4.885 13.075 1.00 80.95 C ATOM 1300 CG ASP A 166 -7.037 -6.393 13.191 1.00 83.50 C ATOM 1301 OD1 ASP A 166 -6.311 -6.987 12.362 1.00 79.82 O ATOM 1302 OD2 ASP A 166 -7.634 -6.984 14.118 1.00 85.70 O ATOM 1303 H ASP A 166 -5.451 -2.417 14.303 1.00 0.00 H TER 1304 ASP A 166 HETATM 1305 C UNK A 1 7.419 -8.809 14.229 1.00 74.86 C HETATM 1306 O UNK A 1 8.101 -7.786 14.251 1.00 82.23 O HETATM 1307 O HOH 1 -3.545 -3.123 6.779 1.00 35.66 O HETATM 1308 O HOH 2 -6.874 3.735 -28.970 1.00 57.98 O HETATM 1309 O HOH 3 -9.532 0.937 16.897 1.00 61.62 O HETATM 1310 O HOH 4 0.077 -5.482 1.237 1.00 46.47 O HETATM 1311 O HOH 5 -9.062 3.306 -18.561 1.00 47.33 O HETATM 1312 O HOH 6 -14.151 -10.589 11.314 1.00 49.28 O HETATM 1313 O HOH 7 -14.243 5.385 -25.088 1.00 68.77 O HETATM 1314 O HOH 8 -15.089 -13.710 3.161 1.00 39.75 O HETATM 1315 O HOH 9 10.423 -7.243 15.099 1.00 63.29 O HETATM 1316 O HOH 10 3.941 -12.454 3.247 1.00 52.66 O HETATM 1317 O HOH 11 -5.584 2.290 -23.770 1.00 56.32 O HETATM 1318 O HOH 12 -10.741 5.176 -16.794 1.00 35.68 O HETATM 1319 O HOH 13 -1.473 -14.542 2.100 1.00 52.29 O HETATM 1320 O HOH 14 -17.459 9.980 -7.916 1.00 32.99 O HETATM 1321 O HOH 15 -14.646 -2.439 -26.413 1.00 81.01 O HETATM 1322 O HOH 16 -23.614 -2.782 -17.628 1.00 64.25 O HETATM 1323 O HOH 17 -4.433 -8.665 -6.456 1.00 42.04 O HETATM 1324 O HOH 18 -8.943 -7.927 -10.687 1.00 39.42 O HETATM 1325 O HOH 19 -18.689 -13.192 7.559 1.00 51.60 O HETATM 1326 O HOH 20 1.294 -6.952 2.726 1.00 41.93 O HETATM 1327 O HOH 21 -26.917 7.848 -15.586 1.00 49.77 O HETATM 1328 O HOH 22 -1.193 4.254 -0.443 1.00 24.45 O HETATM 1329 O HOH 23 -2.895 -3.534 9.557 1.00 36.56 O HETATM 1330 O HOH 24 -7.024 -13.770 6.175 1.00 58.83 O HETATM 1331 O HOH 25 -18.519 8.532 4.800 1.00 43.27 O HETATM 1332 O HOH 26 -6.306 -4.230 -13.749 1.00 53.47 O HETATM 1333 O HOH 27 -14.243 13.987 -14.411 1.00 48.44 O HETATM 1334 O HOH 28 -16.033 9.218 -20.131 1.00 45.81 O HETATM 1335 O HOH 29 -2.705 3.906 8.308 1.00 40.18 O HETATM 1336 O HOH 30 -7.856 5.229 -17.672 1.00 75.90 O HETATM 1337 O HOH 31 -8.522 7.032 -5.056 1.00 30.85 O HETATM 1338 O HOH 32 -8.424 -8.769 12.002 1.00 45.72 O HETATM 1339 O HOH 33 -24.724 -3.720 -11.949 1.00 67.29 O HETATM 1340 O HOH 34 2.087 -7.826 4.778 1.00 31.54 O HETATM 1341 O HOH 35 -10.629 -16.098 9.033 1.00 37.16 O HETATM 1342 O HOH 36 -14.028 8.106 -22.514 1.00 53.18 O HETATM 1343 O HOH 37 4.917 -12.678 5.584 1.00 61.02 O HETATM 1344 O HOH 38 -23.430 6.881 -2.839 1.00 41.63 O HETATM 1345 O HOH 39 -21.631 11.322 -11.328 1.00 33.53 O HETATM 1346 O HOH 40 -11.359 -2.497 -24.081 1.00 62.04 O HETATM 1347 O HOH 41 -4.482 -13.955 -0.898 1.00 53.53 O HETATM 1348 O HOH 42 -20.689 -4.955 -3.246 1.00 68.12 O HETATM 1349 O HOH 43 -3.853 12.678 -9.920 1.00 55.25 O HETATM 1350 O HOH 44 -12.202 -1.027 -27.162 1.00 78.85 O HETATM 1351 O HOH 45 -12.374 8.035 11.872 1.00 65.13 O HETATM 1352 O HOH 46 -9.993 -7.527 16.227 1.00 57.49 O HETATM 1353 O HOH 47 -17.485 -12.220 10.179 1.00 49.20 O HETATM 1354 O HOH 48 -2.840 -0.483 11.166 1.00 50.52 O HETATM 1355 O HOH 49 -14.616 6.145 13.103 1.00 71.42 O HETATM 1356 O HOH 50 -16.485 12.014 -0.737 1.00 40.99 O HETATM 1357 O HOH 51 -2.721 -8.100 10.311 1.00 33.45 O HETATM 1358 O HOH 52 -21.603 -1.490 -18.548 1.00 62.74 O HETATM 1359 O HOH 53 -11.024 -6.689 -17.431 1.00 48.16 O HETATM 1360 O HOH 54 -13.067 14.337 -16.868 1.00 53.79 O HETATM 1361 O HOH 55 -3.236 4.922 1.121 1.00 38.04 O HETATM 1362 O HOH 56 -23.113 11.066 -5.605 1.00 48.10 O HETATM 1363 O HOH 57 -19.956 -6.892 13.822 1.00 64.16 O HETATM 1364 O HOH 58 -24.289 12.454 -8.655 1.00 57.14 O HETATM 1365 O HOH 59 -7.139 6.886 2.449 1.00 54.15 O HETATM 1366 O HOH 60 -18.724 1.915 10.859 1.00 56.34 O HETATM 1367 O HOH 61 -22.647 9.045 -25.140 1.00 72.33 O HETATM 1368 O HOH 62 -8.731 8.505 2.785 1.00 53.09 O HETATM 1369 O HOH 63 -9.122 -9.011 -18.676 1.00 76.56 O HETATM 1370 O HOH 64 -3.595 -2.339 -13.355 1.00 63.57 O HETATM 1371 O HOH 65 -16.207 -11.049 13.298 1.00 60.75 O HETATM 1372 O HOH 66 -23.541 10.004 -3.466 1.00 47.37 O HETATM 1373 O HOH 67 -5.627 8.368 8.539 1.00 81.53 O HETATM 1374 O HOH 68 -13.100 -13.140 -7.809 1.00 79.09 O HETATM 1375 O HOH 69 -16.365 -7.926 -24.982 1.00 70.36 O HETATM 1376 O HOH 70 -1.821 0.927 12.720 1.00 73.79 O HETATM 1377 O HOH 71 -13.445 2.465 -28.086 1.00 73.82 O HETATM 1378 O HOH 72 -22.368 -12.374 -9.420 1.00 79.43 O HETATM 1379 O HOH 73 -15.108 14.021 0.727 1.00 70.94 O HETATM 1380 O HOH 74 -24.462 13.363 -20.813 1.00 84.08 O HETATM 1381 O HOH 75 -16.450 -7.226 -17.614 1.00 77.05 O HETATM 1382 O HOH 76 -1.269 7.590 -9.692 1.00 69.87 O HETATM 1383 O HOH 77 0.003 7.778 -0.004 1.00 81.47 O HETATM 1384 O HOH 78 -37.827 -1.654 -9.139 1.00 83.04 O HETATM 1385 O HOH 79 -10.482 -9.654 -15.740 1.00 73.48 O HETATM 1386 O HOH 80 -20.193 11.650 -33.366 1.00 95.85 O HETATM 1387 O HOH 81 -23.707 5.682 -0.229 1.00 48.04 O HETATM 1388 O HOH 82 -20.645 10.751 0.485 1.00 70.42 O HETATM 1389 O HOH 83 -20.678 12.812 2.551 1.00 82.27 O HETATM 1390 O HOH 84 -26.110 1.116 4.110 1.00 67.35 O HETATM 1391 O HOH 85 -27.312 -4.437 5.186 1.00 82.97 O HETATM 1392 O HOH 86 -24.044 -8.329 -2.320 1.00 79.21 O HETATM 1393 N LYS A 88 -21.735 10.047 2.592 1.00 0.24 N HETATM 1394 CA LYS A 88 -21.746 8.907 3.502 1.00 0.06 C HETATM 1395 C LYS A 88 -21.641 7.603 2.720 1.00 0.23 C HETATM 1396 O LYS A 88 -22.240 7.462 1.655 1.00 -0.39 O HETATM 1397 N LYS A 88 -20.866 6.658 3.243 1.00 -0.26 N HETATM 1398 CA LYS A 88 -20.743 5.357 2.612 1.00 0.13 C HETATM 1399 C LYS A 88 -21.916 4.467 2.996 1.00 0.20 C HETATM 1400 O LYS A 88 -22.524 4.628 4.058 1.00 -0.39 O HETATM 1401 N LYS A 88 -22.229 3.518 2.120 1.00 -0.26 N HETATM 1402 CA LYS A 88 -23.248 2.515 2.391 1.00 0.14 C HETATM 1403 C LYS A 88 -22.641 1.120 2.283 1.00 0.21 C HETATM 1404 O LYS A 88 -21.591 0.921 1.665 1.00 -0.39 O HETATM 1405 N LYS A 88 -23.325 0.156 2.894 1.00 -0.26 N HETATM 1406 CA LYS A 88 -22.916 -1.240 2.907 1.00 0.16 C HETATM 1407 C LYS A 88 -24.040 -2.095 2.342 1.00 0.21 C HETATM 1408 O LYS A 88 -25.221 -1.764 2.481 1.00 -0.39 O HETATM 1409 N LYS A 88 -23.669 -3.202 1.701 1.00 -0.26 N HETATM 1410 CA LYS A 88 -24.649 -4.102 1.105 1.00 0.16 C HETATM 1411 C LYS A 88 -24.868 -5.374 1.914 1.00 0.21 C HETATM 1412 O LYS A 88 -25.592 -6.260 1.457 1.00 -0.39 O HETATM 1413 N LYS A 88 -24.264 -5.491 3.096 1.00 -0.26 N HETATM 1414 CA LYS A 88 -24.344 -6.700 3.900 1.00 0.16 C HETATM 1415 C LYS A 88 -24.801 -6.361 5.315 1.00 0.21 C HETATM 1416 O LYS A 88 -24.312 -5.394 5.910 1.00 -0.39 O HETATM 1417 N LYS A 88 -25.742 -7.136 5.880 1.00 -0.26 N HETATM 1418 CA LYS A 88 -26.246 -6.871 7.234 1.00 0.10 C HETATM 1419 C LYS A 88 -25.218 -7.176 8.321 1.00 0.06 C HETATM 1420 O LYS A 88 -25.154 -6.442 9.309 1.00 -0.57 O HETATM 1421 OXT LYS A 88 -24.474 -8.150 8.187 1.00 -0.57 O HETATM 1422 CB LYS A 88 -27.453 -7.808 7.347 1.00 -0.02 C HETATM 1423 CG LYS A 88 -27.136 -8.928 6.423 1.00 -0.03 C HETATM 1424 CD LYS A 88 -26.402 -8.302 5.266 1.00 0.04 C HETATM 1425 H43 LYS A 88 -25.662 -8.998 4.845 1.00 0.05 H HETATM 1426 H44 LYS A 88 -27.102 -7.989 4.477 1.00 0.05 H HETATM 1427 H41 LYS A 88 -28.060 -9.412 6.075 1.00 0.03 H HETATM 1428 H42 LYS A 88 -26.499 -9.671 6.925 1.00 0.03 H HETATM 1429 H39 LYS A 88 -28.375 -7.295 7.036 1.00 0.03 H HETATM 1430 H40 LYS A 88 -27.567 -8.174 8.378 1.00 0.03 H HETATM 1431 H38 LYS A 88 -26.559 -5.820 7.326 1.00 0.07 H HETATM 1432 CB LYS A 88 -22.982 -7.413 3.946 1.00 0.09 C HETATM 1433 OG1 LYS A 88 -21.952 -6.469 4.269 1.00 -0.39 O HETATM 1434 H34 LYS A 88 -22.134 -6.082 5.117 1.00 0.21 H HETATM 1435 CG2 LYS A 88 -22.665 -8.042 2.601 1.00 -0.03 C HETATM 1436 H35 LYS A 88 -21.689 -8.546 2.653 1.00 0.03 H HETATM 1437 H36 LYS A 88 -22.633 -7.259 1.829 1.00 0.03 H HETATM 1438 H37 LYS A 88 -23.444 -8.776 2.347 1.00 0.03 H HETATM 1439 H33 LYS A 88 -23.013 -8.198 4.716 1.00 0.06 H HETATM 1440 H32 LYS A 88 -25.081 -7.377 3.443 1.00 0.08 H HETATM 1441 H31 LYS A 88 -23.735 -4.717 3.444 1.00 0.19 H HETATM 1442 CB LYS A 88 -24.239 -4.472 -0.326 1.00 0.09 C HETATM 1443 OG1 LYS A 88 -23.118 -5.367 -0.290 1.00 -0.39 O HETATM 1444 H27 LYS A 88 -22.389 -4.943 0.148 1.00 0.21 H HETATM 1445 CG2 LYS A 88 -23.859 -3.229 -1.109 1.00 -0.03 C HETATM 1446 H28 LYS A 88 -23.568 -3.514 -2.131 1.00 0.03 H HETATM 1447 H29 LYS A 88 -23.014 -2.728 -0.614 1.00 0.03 H HETATM 1448 H30 LYS A 88 -24.719 -2.544 -1.150 1.00 0.03 H HETATM 1449 H26 LYS A 88 -25.085 -4.968 -0.825 1.00 0.06 H HETATM 1450 H25 LYS A 88 -25.608 -3.564 1.061 1.00 0.08 H HETATM 1451 H24 LYS A 88 -22.696 -3.421 1.627 1.00 0.19 H HETATM 1452 CB LYS A 88 -22.570 -1.707 4.328 1.00 0.09 C HETATM 1453 OG1 LYS A 88 -22.110 -3.062 4.293 1.00 -0.39 O HETATM 1454 H20 LYS A 88 -21.336 -3.118 3.745 1.00 0.21 H HETATM 1455 CG2 LYS A 88 -23.804 -1.626 5.249 1.00 -0.03 C HETATM 1456 H21 LYS A 88 -23.530 -1.965 6.259 1.00 0.03 H HETATM 1457 H22 LYS A 88 -24.602 -2.269 4.850 1.00 0.03 H HETATM 1458 H23 LYS A 88 -24.160 -0.586 5.295 1.00 0.03 H HETATM 1459 H19 LYS A 88 -21.776 -1.062 4.732 1.00 0.06 H HETATM 1460 H18 LYS A 88 -22.024 -1.354 2.273 1.00 0.08 H HETATM 1461 H17 LYS A 88 -24.168 0.405 3.371 1.00 0.19 H HETATM 1462 CB LYS A 88 -24.435 2.646 1.435 1.00 0.04 C HETATM 1463 CG LYS A 88 -24.042 2.437 -0.009 1.00 0.04 C HETATM 1464 OD1 LYS A 88 -23.427 3.350 -0.612 1.00 -0.57 O HETATM 1465 OD2 LYS A 88 -24.316 1.340 -0.529 1.00 -0.57 O HETATM 1466 H15 LYS A 88 -24.864 3.653 1.541 1.00 0.05 H HETATM 1467 H16 LYS A 88 -25.191 1.895 1.707 1.00 0.05 H HETATM 1468 H14 LYS A 88 -23.614 2.661 3.418 1.00 0.08 H HETATM 1469 H13 LYS A 88 -21.747 3.492 1.244 1.00 0.19 H HETATM 1470 CB LYS A 88 -19.436 4.681 3.021 1.00 -0.02 C HETATM 1471 H10 LYS A 88 -19.363 3.698 2.533 1.00 0.03 H HETATM 1472 H11 LYS A 88 -19.417 4.550 4.113 1.00 0.03 H HETATM 1473 H12 LYS A 88 -18.587 5.308 2.712 1.00 0.03 H HETATM 1474 H9 LYS A 88 -20.744 5.495 1.521 1.00 0.08 H HETATM 1475 H8 LYS A 88 -20.360 6.847 4.085 1.00 0.19 H HETATM 1476 CB LYS A 88 -23.014 8.912 4.364 1.00 -0.00 C HETATM 1477 H5 LYS A 88 -23.000 8.045 5.041 1.00 0.03 H HETATM 1478 H6 LYS A 88 -23.900 8.856 3.714 1.00 0.03 H HETATM 1479 H7 LYS A 88 -23.052 9.839 4.955 1.00 0.03 H HETATM 1480 H4 LYS A 88 -20.874 8.986 4.168 1.00 0.11 H HETATM 1481 H1 LYS A 88 -21.805 10.901 3.123 1.00 0.20 H HETATM 1482 H2 LYS A 88 -22.517 9.979 1.959 1.00 0.20 H HETATM 1483 H3 LYS A 88 -20.876 10.048 2.065 1.00 0.20 H CONECT 203 204 207 208 209 CONECT 207 203 CONECT 208 203 CONECT 209 203 CONECT 1305 1306 CONECT 1306 1305 CONECT 1393 1394 1481 1482 1483 CONECT 1394 1393 1395 1476 1480 CONECT 1395 1394 1396 1397 CONECT 1396 1395 CONECT 1397 1395 1398 1475 CONECT 1398 1397 1399 1470 1474 CONECT 1399 1398 1400 1401 CONECT 1400 1399 CONECT 1401 1399 1402 1469 CONECT 1402 1401 1403 1462 1468 CONECT 1403 1402 1404 1405 CONECT 1404 1403 CONECT 1405 1403 1406 1461 CONECT 1406 1405 1407 1452 1460 CONECT 1407 1406 1408 1409 CONECT 1408 1407 CONECT 1409 1407 1410 1451 CONECT 1410 1409 1411 1442 1450 CONECT 1411 1410 1412 1413 CONECT 1412 1411 CONECT 1413 1411 1414 1441 CONECT 1414 1413 1415 1432 1440 CONECT 1415 1414 1416 1417 CONECT 1416 1415 CONECT 1417 1415 1418 1424 CONECT 1418 1417 1419 1422 1431 CONECT 1419 1418 1420 1421 CONECT 1420 1419 CONECT 1421 1419 CONECT 1422 1418 1423 1429 1430 CONECT 1423 1422 1424 1427 1428 CONECT 1424 1417 1423 1425 1426 CONECT 1425 1424 CONECT 1426 1424 CONECT 1427 1423 CONECT 1428 1423 CONECT 1429 1422 CONECT 1430 1422 CONECT 1431 1418 CONECT 1432 1414 1433 1435 1439 CONECT 1433 1432 1434 CONECT 1434 1433 CONECT 1435 1432 1436 1437 1438 CONECT 1436 1435 CONECT 1437 1435 CONECT 1438 1435 CONECT 1439 1432 CONECT 1440 1414 CONECT 1441 1413 CONECT 1442 1410 1443 1445 1449 CONECT 1443 1442 1444 CONECT 1444 1443 CONECT 1445 1442 1446 1447 1448 CONECT 1446 1445 CONECT 1447 1445 CONECT 1448 1445 CONECT 1449 1442 CONECT 1450 1410 CONECT 1451 1409 CONECT 1452 1406 1453 1455 1459 CONECT 1453 1452 1454 CONECT 1454 1453 CONECT 1455 1452 1456 1457 1458 CONECT 1456 1455 CONECT 1457 1455 CONECT 1458 1455 CONECT 1459 1452 CONECT 1460 1406 CONECT 1461 1405 CONECT 1462 1402 1463 1466 1467 CONECT 1463 1462 1464 1465 CONECT 1464 1463 CONECT 1465 1463 CONECT 1466 1462 CONECT 1467 1462 CONECT 1468 1402 CONECT 1469 1401 CONECT 1470 1398 1471 1472 1473 CONECT 1471 1470 CONECT 1472 1470 CONECT 1473 1470 CONECT 1474 1398 CONECT 1475 1397 CONECT 1476 1394 1477 1478 1479 CONECT 1477 1476 CONECT 1478 1476 CONECT 1479 1476 CONECT 1480 1394 CONECT 1481 1393 CONECT 1482 1393 CONECT 1483 1393 MASTER 0 0 0 0 0 0 0 0 1480 3 97 13 END
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PDBbind
9-mer
1zea
RCSB PDB
PDBbind
9-mer
2bgn
RCSB PDB
PDBbind
9-mer
2bgr
RCSB PDB
PDBbind
9-mer
2e7l
RCSB PDB
PDBbind
9-mer
2gv2
RCSB PDB
PDBbind
9-mer
2h6q
RCSB PDB
PDBbind
9-mer
2hkf
RCSB PDB
PDBbind
9-mer
2jo9
RCSB PDB
PDBbind
9-mer
2jup
RCSB PDB
PDBbind
9-mer
2kgi
RCSB PDB
PDBbind
9-mer
2khh
RCSB PDB
PDBbind
9-mer
2lnw
RCSB PDB
PDBbind
9-mer
2lsv
RCSB PDB
PDBbind
9-mer
2mpa
RCSB PDB
PDBbind
9-mer
2ms4
RCSB PDB
PDBbind
9-mer
2oei
RCSB PDB
PDBbind
9-mer
2oi9
RCSB PDB
PDBbind
9-mer
2q8y
RCSB PDB
PDBbind
9-mer
2qt5
RCSB PDB
PDBbind
9-mer
2rm0
RCSB PDB
PDBbind
9-mer
2v83
RCSB PDB
PDBbind
9-mer
2v86
RCSB PDB
PDBbind
9-mer
2vpe
RCSB PDB
PDBbind
9-mer
2w0z
RCSB PDB
PDBbind
9-mer
2x3t
RCSB PDB
PDBbind
9-mer
2x4o
RCSB PDB
PDBbind
9-mer
2x4r
RCSB PDB
PDBbind
9-mer
2x4s
RCSB PDB
PDBbind
9-mer
2x4t
RCSB PDB
PDBbind
9-mer
2x4u
RCSB PDB
PDBbind
9-mer
2xhs
RCSB PDB
PDBbind
9-mer
2ymt
RCSB PDB
PDBbind
9-mer
3ah8
RCSB PDB
PDBbind
9-mer
3bgm
RCSB PDB
PDBbind
9-mer
3bze
RCSB PDB
PDBbind
9-mer
3bzf
RCSB PDB
PDBbind
9-mer
3bzi
RCSB PDB
PDBbind
9-mer
3cii
RCSB PDB
PDBbind
9-mer
3cyy
RCSB PDB
PDBbind
9-mer
3d1f
RCSB PDB
PDBbind
9-mer
3d25
RCSB PDB
PDBbind
9-mer
3drg
RCSB PDB
PDBbind
9-mer
3ery
RCSB PDB
PDBbind
9-mer
3fbr
RCSB PDB
PDBbind
9-mer
3fn0
RCSB PDB
PDBbind
9-mer
3ft2
RCSB PDB
PDBbind
9-mer
3ft3
RCSB PDB
PDBbind
9-mer
3ft4
RCSB PDB
PDBbind
9-mer
3gl6
RCSB PDB
PDBbind
9-mer
3iet
RCSB PDB
PDBbind
9-mer
3k27
RCSB PDB
PDBbind
9-mer
3lqi
RCSB PDB
PDBbind
9-mer
3lqj
RCSB PDB
PDBbind
9-mer
3mxc
RCSB PDB
PDBbind
9-mer
3mxy
RCSB PDB
PDBbind
9-mer
3o4l
RCSB PDB
PDBbind
9-mer
3o6m
RCSB PDB
PDBbind
9-mer
3obq
RCSB PDB
PDBbind
9-mer
3obu
RCSB PDB
PDBbind
9-mer
3obx
RCSB PDB
PDBbind
9-mer
3qfd
RCSB PDB
PDBbind
9-mer
3r0h
RCSB PDB
PDBbind
9-mer
3r42
RCSB PDB
PDBbind
9-mer
3rwc
RCSB PDB
PDBbind
9-mer
3rwe
RCSB PDB
PDBbind
9-mer
3rwf
RCSB PDB
PDBbind
9-mer
3rwg
RCSB PDB
PDBbind
9-mer
3soq
RCSB PDB
PDBbind
9-mer
3sou
RCSB PDB
PDBbind
9-mer
3sov
RCSB PDB
PDBbind
9-mer
3sow
RCSB PDB
PDBbind
9-mer
3t5i
RCSB PDB
PDBbind
9-mer
3tf7
RCSB PDB
PDBbind
9-mer
3tfk
RCSB PDB
PDBbind
9-mer
3tjh
RCSB PDB
PDBbind
9-mer
3tpu
RCSB PDB
PDBbind
9-mer
3zhf
RCSB PDB
PDBbind
9-mer
4bt9
RCSB PDB
PDBbind
9-mer
4btb
RCSB PDB
PDBbind
9-mer
4cdr
RCSB PDB
PDBbind
9-mer
4ezq
RCSB PDB
PDBbind
9-mer
4ezt
RCSB PDB
PDBbind
9-mer
4fcm
RCSB PDB
PDBbind
9-mer
4fmn
RCSB PDB
PDBbind
9-mer
4i80
RCSB PDB
PDBbind
9-mer
4iho
RCSB PDB
PDBbind
9-mer
4j3u
RCSB PDB
PDBbind
9-mer
4mex
RCSB PDB
PDBbind
9-mer
4mnq
RCSB PDB
PDBbind
9-mer
4mzf
RCSB PDB
PDBbind
9-mer
4mzh
RCSB PDB
PDBbind
9-mer
4o2e
RCSB PDB
PDBbind
9-mer
4od7
RCSB PDB
PDBbind
9-mer
4pg9
RCSB PDB
PDBbind
9-mer
4pgb
RCSB PDB
PDBbind
9-mer
4pgc
RCSB PDB
PDBbind
9-mer
4pgd
RCSB PDB
PDBbind
9-mer
4pge
RCSB PDB
PDBbind
9-mer
4qbm
RCSB PDB
PDBbind
9-mer
4rh5
RCSB PDB
PDBbind
9-mer
4utn
RCSB PDB
PDBbind
9-mer
4utr
RCSB PDB
PDBbind
9-mer
4utv
RCSB PDB
PDBbind
9-mer
4utx
RCSB PDB
PDBbind
9-mer
4uu7
RCSB PDB
PDBbind
9-mer
4uu8
RCSB PDB
PDBbind
9-mer
4uua
RCSB PDB
PDBbind
9-mer
4uub
RCSB PDB
PDBbind
9-mer
4x3h
RCSB PDB
PDBbind
9-mer
4y5i
RCSB PDB
PDBbind
9-mer
4yoz
RCSB PDB
PDBbind
9-mer
5apr
RCSB PDB
PDBbind
9-mer
5brz
RCSB PDB
PDBbind
9-mer
5bs0
RCSB PDB
PDBbind
9-mer
5cvd
RCSB PDB
PDBbind
9-mer
5d0j
RCSB PDB
PDBbind
9-mer
5dms
RCSB PDB
PDBbind
9-mer
5e4w
RCSB PDB
PDBbind
9-mer
5eel
RCSB PDB
PDBbind
9-mer
5eok
RCSB PDB
PDBbind
9-mer
5fjw
RCSB PDB
PDBbind
9-mer
5gu4
RCSB PDB
PDBbind
9-mer
5hda
RCSB PDB
PDBbind
9-mer
5heb
RCSB PDB
PDBbind
9-mer
5hed
RCSB PDB
PDBbind
9-mer
5hey
RCSB PDB
PDBbind
9-mer
5hf1
RCSB PDB
PDBbind
9-mer
5hfb
RCSB PDB
PDBbind
9-mer
5hfc
RCSB PDB
PDBbind
9-mer
5hff
RCSB PDB
PDBbind
9-mer
5hjc
RCSB PDB
PDBbind
9-mer
5hkh
RCSB PDB
PDBbind
9-mer
5i8c
RCSB PDB
PDBbind
9-mer
5isz
RCSB PDB
PDBbind
9-mer
5jhd
RCSB PDB
PDBbind
9-mer
5lb7
RCSB PDB
PDBbind
9-mer
5lgs
RCSB PDB
PDBbind
9-mer
5nme
RCSB PDB
PDBbind
9-mer
5nmf
RCSB PDB
PDBbind
9-mer
5nmg
RCSB PDB
PDBbind
9-mer
5npr
RCSB PDB
PDBbind
9-mer
5nps
RCSB PDB
PDBbind
9-mer
5swf
RCSB PDB
PDBbind
9-mer
5u98
RCSB PDB
PDBbind
9-mer
5w1v
RCSB PDB
PDBbind
9-mer
5w1w
RCSB PDB
PDBbind
9-mer
5w7x
RCSB PDB
PDBbind
9-mer
5yc3
RCSB PDB
PDBbind
9-mer
5yc4
RCSB PDB
PDBbind
9-mer
5ygf
RCSB PDB
PDBbind
9-mer
5yvx
RCSB PDB
PDBbind
9-mer
5yy4
RCSB PDB
PDBbind
9-mer
5zia
RCSB PDB
PDBbind
9-mer
6bj2
RCSB PDB
PDBbind
9-mer
6bj3
RCSB PDB
PDBbind
9-mer
6c4u
RCSB PDB
PDBbind
9-mer
6evm
RCSB PDB
PDBbind
9-mer
6evn
RCSB PDB
PDBbind
9-mer
6evo
RCSB PDB
PDBbind
9-mer
6evp
RCSB PDB
PDBbind
9-mer
6fdp
RCSB PDB
PDBbind
9-mer
6fdt
RCSB PDB
PDBbind
9-mer
6qts
RCSB PDB
PDBbind
9-mer
6qtq
RCSB PDB
PDBbind
9-mer
6q38
RCSB PDB
PDBbind
9-mer
6o9c
RCSB PDB
PDBbind
9-mer
6o9b
RCSB PDB
PDBbind
9-mer
6ncp
RCSB PDB
PDBbind
9-mer
6mt6
RCSB PDB
PDBbind
9-mer
6mt5
RCSB PDB
PDBbind
9-mer
6mt4
RCSB PDB
PDBbind
9-mer
6i7a
RCSB PDB
PDBbind
9-mer
6i68
RCSB PDB
PDBbind
9-mer
6i5p
RCSB PDB
PDBbind
9-mer
6hlb
RCSB PDB
PDBbind
9-mer
6eqa
RCSB PDB
PDBbind
9-mer
6d78
RCSB PDB
PDBbind
9-mer
6aee
RCSB PDB
PDBbind
9-mer
5y5w
RCSB PDB
PDBbind
9-mer
5wlg
RCSB PDB
PDBbind
9-mer
5u1q
RCSB PDB
PDBbind
9-mer
5u06
RCSB PDB
PDBbind
9-mer
5tyi
RCSB PDB
PDBbind
9-mer
5iza
RCSB PDB
PDBbind
9-mer
5iz9
RCSB PDB
PDBbind
9-mer
5iz6
RCSB PDB
PDBbind
9-mer
6a9c
RCSB PDB
PDBbind
9-mer
5b6g
RCSB PDB
PDBbind
9-mer
Entry Information
PDB ID
6i41
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
SPOP(wt)
Ligand Name
9-mer
EC.Number
E.C.-.-.-.-
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
Kd=61uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Mol.Biol. Vol. 431: pp. 2213-2221
Ligand Properties
Formula
C
2
7
H
4
6
N
7
O
1
3
Molecular Weight
676.693
Exact Mass
676.315
No. of atoms
93
No. of bonds
93
Polar Surface Area
328.74
LOGP Value
-4.61 (
Computed with XLOGP3
)
-4.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 9
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 24
No. of Nitrogen and Oxygen Atoms: 20
No. of Rings: 1
Canonical SMILES
OC(=O)C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@H](O)C)[C@H](O)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)C
InChI String
InChI=1S/C27H45N7O13/c1-10(28)21(40)29-11(2)22(41)30-15(9-17(38)39)23(42)31-18(12(3)35)24(43)32-19(13(4)36)25(44)33-20(14(5)37)26(45)34-8-6-7-16(34)27(46)47/h10-16,18-20,35-37H,6-9,28H2,1-5H3,(H,29,40)(H,30,41)(H,31,42)(H,32,43)(H,33,44)(H,38,39)(H,46,47)/p+1/t10-,11-,12+,13+,14+,15-,16-,18-,19-,20-/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):
Q15059
O43791
Entrez Gene ID
NCBI Entrez Gene ID:
8019
8405
ASD
Information of known allosteric effects of PDB entries
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