Browse entries in the PDBbind-CN Database
HEADER 6P9E_COMPLEX COMPND 6P9E_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 148 LYS PRO ILE THR GLY THR ILE ASN ASP LEU ASN GLN GLN SEQRES 2 A 148 VAL TRP THR LEU GLN GLY GLN ASN LEU VAL ALA VAL PRO SEQRES 3 A 148 ARG SER ASP SER VAL THR PRO VAL THR VAL ALA VAL ILE SEQRES 4 A 148 THR CYS LYS TYR PRO GLU ALA LEU GLU GLN GLY ARG GLY SEQRES 5 A 148 ASP PRO ILE TYR LEU GLY ILE GLN ASN PRO GLU MET CYS SEQRES 6 A 148 LEU TYR CYS GLU LYS VAL GLY GLU GLN PRO THR LEU GLN SEQRES 7 A 148 LEU LYS GLU GLN LYS ILE MET ASP LEU TYR GLY GLN PRO SEQRES 8 A 148 GLU PRO VAL LYS PRO PHE LEU PHE TYR ARG ALA LYS THR SEQRES 9 A 148 GLY ARG THR SER THR LEU GLU SER VAL ALA PHE PRO ASP SEQRES 10 A 148 TRP PHE ILE ALA SER SER LYS ARG ASP GLN PRO ILE ILE SEQRES 11 A 148 LEU THR SER GLU LEU GLY LYS SER TYR ASN THR ALA PHE SEQRES 12 A 148 GLU LEU ASN ILE ASN HET O A 6D 61 ATOM 1 N LYS A 21 -45.385 1.508 -28.905 1.00 62.71 N ATOM 2 CA LYS A 21 -45.120 0.983 -27.561 1.00 60.27 C ATOM 3 C LYS A 21 -43.712 1.452 -27.163 1.00 57.67 C ATOM 4 O LYS A 21 -42.881 1.670 -28.053 1.00 56.35 O ATOM 5 CB LYS A 21 -45.193 -0.553 -27.555 1.00 63.03 C ATOM 6 HN3 LYS A 21 -44.674 1.138 -29.567 1.00 0.00 H ATOM 7 HN2 LYS A 21 -45.335 2.547 -28.886 1.00 0.00 H ATOM 8 HN1 LYS A 21 -46.333 1.211 -29.211 1.00 0.00 H ATOM 9 N PRO A 22 -43.398 1.643 -25.866 1.00 49.67 N ATOM 10 CA PRO A 22 -42.063 2.149 -25.533 1.00 47.75 C ATOM 11 C PRO A 22 -41.004 1.064 -25.426 1.00 47.53 C ATOM 12 O PRO A 22 -41.330 -0.122 -25.315 1.00 46.80 O ATOM 13 CB PRO A 22 -42.292 2.851 -24.193 1.00 49.48 C ATOM 14 CG PRO A 22 -43.352 2.034 -23.536 1.00 54.34 C ATOM 15 CD PRO A 22 -44.219 1.467 -24.648 1.00 50.23 C ATOM 16 N ILE A 23 -39.726 1.482 -25.446 1.00 41.15 N ATOM 17 CA ILE A 23 -38.604 0.591 -25.230 1.00 39.97 C ATOM 18 C ILE A 23 -38.506 0.440 -23.715 1.00 42.40 C ATOM 19 O ILE A 23 -38.557 1.435 -22.992 1.00 42.45 O ATOM 20 CB ILE A 23 -37.294 1.134 -25.871 1.00 43.02 C ATOM 21 CG1 ILE A 23 -37.385 1.116 -27.419 1.00 43.77 C ATOM 22 CG2 ILE A 23 -36.105 0.317 -25.399 1.00 44.26 C ATOM 23 CD1 ILE A 23 -36.440 2.079 -28.167 1.00 47.37 C ATOM 24 H ILE A 23 -39.535 2.489 -25.624 1.00 0.00 H ATOM 25 N THR A 24 -38.380 -0.781 -23.220 1.00 36.92 N ATOM 26 CA THR A 24 -38.278 -0.955 -21.782 1.00 36.60 C ATOM 27 C THR A 24 -37.005 -1.655 -21.414 1.00 42.29 C ATOM 28 O THR A 24 -36.403 -2.333 -22.244 1.00 44.28 O ATOM 29 CB THR A 24 -39.514 -1.675 -21.197 1.00 45.99 C ATOM 30 OG1 THR A 24 -39.516 -3.031 -21.643 1.00 49.22 O ATOM 31 CG2 THR A 24 -40.846 -0.969 -21.512 1.00 40.59 C ATOM 32 HG1 THR A 24 -40.306 -3.498 -21.272 1.00 0.00 H ATOM 33 H THR A 24 -38.354 -1.606 -23.853 1.00 0.00 H ATOM 34 N GLY A 25 -36.619 -1.495 -20.169 1.00 38.93 N ATOM 35 CA GLY A 25 -35.456 -2.138 -19.590 1.00 39.33 C ATOM 36 C GLY A 25 -35.041 -1.510 -18.287 1.00 43.27 C ATOM 37 O GLY A 25 -35.714 -0.607 -17.795 1.00 43.96 O ATOM 38 H GLY A 25 -37.183 -0.868 -19.560 1.00 0.00 H ATOM 39 N THR A 26 -33.948 -2.015 -17.699 1.00 38.16 N ATOM 40 CA THR A 26 -33.410 -1.466 -16.460 1.00 36.80 C ATOM 41 C THR A 26 -32.337 -0.433 -16.854 1.00 39.06 C ATOM 42 O THR A 26 -31.911 -0.392 -18.020 1.00 37.54 O ATOM 43 CB THR A 26 -32.864 -2.581 -15.533 1.00 42.87 C ATOM 44 OG1 THR A 26 -31.798 -3.262 -16.187 1.00 40.80 O ATOM 45 CG2 THR A 26 -33.940 -3.587 -15.099 1.00 42.18 C ATOM 46 HG1 THR A 26 -31.450 -3.974 -15.594 1.00 0.00 H ATOM 47 H THR A 26 -33.468 -2.825 -18.141 1.00 0.00 H ATOM 48 N ILE A 27 -31.921 0.416 -15.909 1.00 33.34 N ATOM 49 CA ILE A 27 -30.871 1.388 -16.198 1.00 32.27 C ATOM 50 C ILE A 27 -29.818 1.231 -15.135 1.00 36.66 C ATOM 51 O ILE A 27 -30.165 1.145 -13.962 1.00 37.18 O ATOM 52 CB ILE A 27 -31.419 2.857 -16.283 1.00 35.36 C ATOM 53 CG1 ILE A 27 -32.112 3.123 -17.632 1.00 36.03 C ATOM 54 CG2 ILE A 27 -30.301 3.890 -16.049 1.00 35.70 C ATOM 55 CD1 ILE A 27 -32.818 4.498 -17.742 1.00 44.02 C ATOM 56 H ILE A 27 -32.348 0.384 -14.961 1.00 0.00 H ATOM 57 N ASN A 28 -28.532 1.156 -15.527 1.00 31.76 N ATOM 58 CA ASN A 28 -27.446 1.152 -14.559 1.00 31.28 C ATOM 59 C ASN A 28 -26.446 2.235 -14.939 1.00 35.03 C ATOM 60 O ASN A 28 -26.427 2.682 -16.088 1.00 34.31 O ATOM 61 CB ASN A 28 -26.748 -0.230 -14.404 1.00 30.36 C ATOM 62 CG ASN A 28 -26.039 -0.710 -15.651 1.00 37.22 C ATOM 63 OD1 ASN A 28 -26.630 -1.343 -16.516 1.00 37.09 O ATOM 64 ND2 ASN A 28 -24.762 -0.414 -15.772 1.00 34.29 N ATOM 65 HD22 ASN A 28 -24.280 0.125 -15.024 1.00 0.00 H ATOM 66 HD21 ASN A 28 -24.235 -0.719 -16.615 1.00 0.00 H ATOM 67 H ASN A 28 -28.311 1.100 -16.542 1.00 0.00 H ATOM 68 N ASP A 29 -25.637 2.653 -13.981 1.00 32.33 N ATOM 69 CA ASP A 29 -24.555 3.604 -14.216 1.00 32.51 C ATOM 70 C ASP A 29 -23.232 2.809 -14.364 1.00 38.67 C ATOM 71 O ASP A 29 -23.254 1.568 -14.318 1.00 38.69 O ATOM 72 CB ASP A 29 -24.487 4.643 -13.081 1.00 33.07 C ATOM 73 CG ASP A 29 -24.309 4.072 -11.682 1.00 41.82 C ATOM 74 OD1 ASP A 29 -23.645 3.008 -11.546 1.00 40.78 O ATOM 75 OD2 ASP A 29 -24.781 4.719 -10.714 1.00 39.62 O ATOM 76 H ASP A 29 -25.778 2.288 -13.017 1.00 0.00 H ATOM 77 N LEU A 30 -22.094 3.501 -14.497 1.00 36.29 N ATOM 78 CA LEU A 30 -20.799 2.832 -14.706 1.00 37.82 C ATOM 79 C LEU A 30 -20.217 2.167 -13.420 1.00 41.08 C ATOM 80 O LEU A 30 -19.200 1.475 -13.499 1.00 39.17 O ATOM 81 CB LEU A 30 -19.774 3.771 -15.388 1.00 37.95 C ATOM 82 CG LEU A 30 -20.042 4.081 -16.888 1.00 42.56 C ATOM 83 CD1 LEU A 30 -19.135 5.198 -17.398 1.00 43.37 C ATOM 84 CD2 LEU A 30 -19.858 2.864 -17.762 1.00 44.19 C ATOM 85 H LEU A 30 -22.125 4.540 -14.451 1.00 0.00 H ATOM 86 N ASN A 31 -20.898 2.317 -12.272 1.00 37.63 N ATOM 87 CA ASN A 31 -20.502 1.644 -11.027 1.00 37.56 C ATOM 88 C ASN A 31 -21.414 0.434 -10.810 1.00 42.87 C ATOM 89 O ASN A 31 -21.475 -0.115 -9.717 1.00 43.93 O ATOM 90 CB ASN A 31 -20.548 2.602 -9.837 1.00 36.10 C ATOM 91 CG ASN A 31 -19.401 3.573 -9.792 1.00 65.54 C ATOM 92 OD1 ASN A 31 -18.235 3.210 -9.980 1.00 69.08 O ATOM 93 ND2 ASN A 31 -19.703 4.830 -9.530 1.00 57.26 N ATOM 94 HD22 ASN A 31 -20.694 5.106 -9.376 1.00 0.00 H ATOM 95 HD21 ASN A 31 -18.950 5.546 -9.477 1.00 0.00 H ATOM 96 H ASN A 31 -21.737 2.932 -12.264 1.00 0.00 H ATOM 97 N GLN A 32 -22.143 0.038 -11.861 1.00 39.99 N ATOM 98 CA GLN A 32 -23.090 -1.087 -11.866 1.00 40.57 C ATOM 99 C GLN A 32 -24.188 -0.894 -10.823 1.00 43.81 C ATOM 100 O GLN A 32 -24.519 -1.803 -10.065 1.00 42.37 O ATOM 101 CB GLN A 32 -22.362 -2.457 -11.743 1.00 42.53 C ATOM 102 CG GLN A 32 -21.294 -2.702 -12.830 1.00 66.91 C ATOM 103 CD GLN A 32 -21.820 -2.680 -14.257 1.00 92.23 C ATOM 104 OE1 GLN A 32 -22.928 -3.148 -14.555 1.00 91.93 O ATOM 105 NE2 GLN A 32 -21.026 -2.140 -15.178 1.00 80.04 N ATOM 106 HE22 GLN A 32 -20.100 -1.753 -14.904 1.00 0.00 H ATOM 107 HE21 GLN A 32 -21.331 -2.105 -16.172 1.00 0.00 H ATOM 108 H GLN A 32 -22.030 0.570 -12.747 1.00 0.00 H ATOM 109 N GLN A 33 -24.711 0.332 -10.751 1.00 39.87 N ATOM 110 CA GLN A 33 -25.764 0.662 -9.806 1.00 38.95 C ATOM 111 C GLN A 33 -26.991 0.835 -10.613 1.00 39.49 C ATOM 112 O GLN A 33 -26.986 1.634 -11.549 1.00 37.72 O ATOM 113 CB GLN A 33 -25.445 1.935 -9.039 1.00 40.38 C ATOM 114 CG GLN A 33 -24.132 1.881 -8.296 1.00 45.29 C ATOM 115 CD GLN A 33 -23.989 3.094 -7.432 1.00 53.34 C ATOM 116 OE1 GLN A 33 -23.703 2.998 -6.243 1.00 46.15 O ATOM 117 NE2 GLN A 33 -24.197 4.267 -8.007 1.00 41.53 N ATOM 118 HE22 GLN A 33 -24.438 4.315 -9.018 1.00 0.00 H ATOM 119 HE21 GLN A 33 -24.120 5.141 -7.449 1.00 0.00 H ATOM 120 H GLN A 33 -24.355 1.072 -11.389 1.00 0.00 H ATOM 121 N VAL A 34 -28.033 0.067 -10.278 1.00 34.75 N ATOM 122 CA VAL A 34 -29.291 0.021 -10.997 1.00 35.92 C ATOM 123 C VAL A 34 -30.347 0.958 -10.388 1.00 39.94 C ATOM 124 O VAL A 34 -30.408 1.102 -9.162 1.00 39.94 O ATOM 125 CB VAL A 34 -29.761 -1.461 -11.122 1.00 42.01 C ATOM 126 CG1 VAL A 34 -30.287 -2.030 -9.793 1.00 42.34 C ATOM 127 CG2 VAL A 34 -30.760 -1.652 -12.252 1.00 42.43 C ATOM 128 H VAL A 34 -27.934 -0.542 -9.441 1.00 0.00 H ATOM 129 N TRP A 35 -31.191 1.576 -11.244 1.00 35.15 N ATOM 130 CA TRP A 35 -32.246 2.444 -10.751 1.00 34.70 C ATOM 131 C TRP A 35 -33.330 1.624 -10.070 1.00 41.56 C ATOM 132 O TRP A 35 -33.818 0.637 -10.635 1.00 40.65 O ATOM 133 CB TRP A 35 -32.872 3.318 -11.857 1.00 32.16 C ATOM 134 CG TRP A 35 -32.025 4.434 -12.431 1.00 31.70 C ATOM 135 CD1 TRP A 35 -30.682 4.623 -12.269 1.00 34.81 C ATOM 136 CD2 TRP A 35 -32.456 5.424 -13.375 1.00 30.77 C ATOM 137 NE1 TRP A 35 -30.265 5.714 -12.994 1.00 33.18 N ATOM 138 CE2 TRP A 35 -31.335 6.225 -13.685 1.00 33.96 C ATOM 139 CE3 TRP A 35 -33.702 5.754 -13.945 1.00 31.48 C ATOM 140 CZ2 TRP A 35 -31.405 7.294 -14.588 1.00 32.49 C ATOM 141 CZ3 TRP A 35 -33.780 6.848 -14.789 1.00 32.60 C ATOM 142 CH2 TRP A 35 -32.634 7.580 -15.134 1.00 32.87 C ATOM 143 HE1 TRP A 35 -29.296 6.091 -13.015 1.00 0.00 H ATOM 144 H TRP A 35 -31.084 1.428 -12.268 1.00 0.00 H ATOM 145 N THR A 36 -33.728 2.052 -8.871 1.00 39.69 N ATOM 146 CA THR A 36 -34.814 1.401 -8.120 1.00 39.57 C ATOM 147 C THR A 36 -35.663 2.458 -7.393 1.00 42.30 C ATOM 148 O THR A 36 -35.166 3.541 -7.081 1.00 38.14 O ATOM 149 CB THR A 36 -34.266 0.279 -7.215 1.00 51.70 C ATOM 150 OG1 THR A 36 -35.355 -0.521 -6.741 1.00 51.04 O ATOM 151 CG2 THR A 36 -33.432 0.807 -6.049 1.00 47.78 C ATOM 152 HG1 THR A 36 -35.831 -0.919 -7.513 1.00 0.00 H ATOM 153 H THR A 36 -33.253 2.877 -8.451 1.00 0.00 H ATOM 154 N LEU A 37 -36.942 2.164 -7.162 1.00 40.41 N ATOM 155 CA LEU A 37 -37.783 3.135 -6.484 1.00 41.94 C ATOM 156 C LEU A 37 -37.737 2.871 -4.996 1.00 48.87 C ATOM 157 O LEU A 37 -37.981 1.745 -4.559 1.00 50.37 O ATOM 158 CB LEU A 37 -39.220 3.107 -7.013 1.00 42.13 C ATOM 159 CG LEU A 37 -40.176 4.217 -6.532 1.00 47.19 C ATOM 160 CD1 LEU A 37 -39.778 5.593 -7.078 1.00 47.67 C ATOM 161 CD2 LEU A 37 -41.581 3.913 -6.952 1.00 50.88 C ATOM 162 H LEU A 37 -37.334 1.249 -7.464 1.00 0.00 H ATOM 163 N GLN A 38 -37.383 3.902 -4.230 1.00 44.70 N ATOM 164 CA GLN A 38 -37.307 3.863 -2.782 1.00 44.86 C ATOM 165 C GLN A 38 -38.246 4.952 -2.292 1.00 50.60 C ATOM 166 O GLN A 38 -37.903 6.136 -2.344 1.00 49.53 O ATOM 167 CB GLN A 38 -35.866 4.126 -2.330 1.00 46.11 C ATOM 168 CG GLN A 38 -35.671 4.024 -0.828 1.00 52.61 C ATOM 169 CD GLN A 38 -34.228 4.199 -0.479 1.00 65.38 C ATOM 170 OE1 GLN A 38 -33.771 5.300 -0.132 1.00 58.84 O ATOM 171 NE2 GLN A 38 -33.480 3.110 -0.567 1.00 48.58 N ATOM 172 HE22 GLN A 38 -33.907 2.209 -0.862 1.00 0.00 H ATOM 173 HE21 GLN A 38 -32.466 3.156 -0.341 1.00 0.00 H ATOM 174 H GLN A 38 -37.145 4.797 -4.703 1.00 0.00 H ATOM 175 N GLY A 39 -39.447 4.546 -1.888 1.00 50.23 N ATOM 176 CA GLY A 39 -40.487 5.460 -1.440 1.00 50.63 C ATOM 177 C GLY A 39 -41.020 6.285 -2.599 1.00 56.01 C ATOM 178 O GLY A 39 -41.662 5.745 -3.506 1.00 55.25 O ATOM 179 H GLY A 39 -39.652 3.526 -1.893 1.00 0.00 H ATOM 180 N GLN A 40 -40.710 7.592 -2.592 1.00 53.95 N ATOM 181 CA GLN A 40 -41.148 8.551 -3.612 1.00 54.19 C ATOM 182 C GLN A 40 -39.998 9.064 -4.516 1.00 56.97 C ATOM 183 O GLN A 40 -40.216 9.953 -5.351 1.00 57.64 O ATOM 184 CB GLN A 40 -41.885 9.726 -2.945 1.00 55.78 C ATOM 185 H GLN A 40 -40.121 7.947 -1.812 1.00 0.00 H ATOM 186 N ASN A 41 -38.787 8.494 -4.361 1.00 50.73 N ATOM 187 CA ASN A 41 -37.619 8.868 -5.162 1.00 49.06 C ATOM 188 C ASN A 41 -36.982 7.659 -5.818 1.00 47.61 C ATOM 189 O ASN A 41 -37.039 6.554 -5.260 1.00 47.13 O ATOM 190 CB ASN A 41 -36.553 9.545 -4.276 1.00 52.96 C ATOM 191 CG ASN A 41 -36.588 11.058 -4.215 1.00 90.22 C ATOM 192 OD1 ASN A 41 -37.320 11.740 -4.949 1.00 88.80 O ATOM 193 ND2 ASN A 41 -35.765 11.618 -3.335 1.00 82.18 N ATOM 194 HD22 ASN A 41 -35.163 11.021 -2.733 1.00 0.00 H ATOM 195 HD21 ASN A 41 -35.723 12.654 -3.248 1.00 0.00 H ATOM 196 H ASN A 41 -38.676 7.754 -3.639 1.00 0.00 H ATOM 197 N LEU A 42 -36.281 7.888 -6.956 1.00 40.40 N ATOM 198 CA LEU A 42 -35.479 6.848 -7.595 1.00 38.80 C ATOM 199 C LEU A 42 -34.119 6.922 -6.939 1.00 37.35 C ATOM 200 O LEU A 42 -33.614 8.021 -6.662 1.00 35.04 O ATOM 201 CB LEU A 42 -35.299 7.068 -9.122 1.00 39.04 C ATOM 202 CG LEU A 42 -36.517 7.004 -10.054 1.00 43.62 C ATOM 203 CD1 LEU A 42 -36.137 7.481 -11.455 1.00 42.92 C ATOM 204 CD2 LEU A 42 -37.091 5.590 -10.134 1.00 46.51 C ATOM 205 H LEU A 42 -36.316 8.834 -7.387 1.00 0.00 H ATOM 206 N VAL A 43 -33.520 5.762 -6.675 1.00 33.58 N ATOM 207 CA VAL A 43 -32.177 5.685 -6.099 1.00 34.00 C ATOM 208 C VAL A 43 -31.378 4.716 -6.951 1.00 37.48 C ATOM 209 O VAL A 43 -31.965 4.008 -7.773 1.00 38.97 O ATOM 210 CB VAL A 43 -32.106 5.332 -4.565 1.00 38.08 C ATOM 211 CG1 VAL A 43 -32.813 6.374 -3.697 1.00 37.56 C ATOM 212 CG2 VAL A 43 -32.637 3.924 -4.276 1.00 38.57 C ATOM 213 H VAL A 43 -34.026 4.878 -6.886 1.00 0.00 H ATOM 214 N ALA A 44 -30.055 4.705 -6.800 1.00 34.25 N ATOM 215 CA ALA A 44 -29.211 3.774 -7.552 1.00 35.06 C ATOM 216 C ALA A 44 -28.531 2.845 -6.544 1.00 40.05 C ATOM 217 O ALA A 44 -27.909 3.330 -5.612 1.00 37.97 O ATOM 218 CB ALA A 44 -28.180 4.523 -8.381 1.00 35.50 C ATOM 219 H ALA A 44 -29.612 5.371 -6.135 1.00 0.00 H ATOM 220 N VAL A 45 -28.707 1.516 -6.706 1.00 40.56 N ATOM 221 CA VAL A 45 -28.159 0.483 -5.806 1.00 42.41 C ATOM 222 C VAL A 45 -27.470 -0.654 -6.584 1.00 49.66 C ATOM 223 O VAL A 45 -27.934 -0.970 -7.676 1.00 48.89 O ATOM 224 CB VAL A 45 -29.262 -0.107 -4.863 1.00 46.86 C ATOM 225 CG1 VAL A 45 -30.018 0.977 -4.108 1.00 46.68 C ATOM 226 CG2 VAL A 45 -30.235 -1.027 -5.602 1.00 47.02 C ATOM 227 H VAL A 45 -29.268 1.198 -7.522 1.00 0.00 H ATOM 228 N PRO A 46 -26.474 -1.380 -6.008 1.00 49.73 N ATOM 229 CA PRO A 46 -25.913 -2.547 -6.723 1.00 50.65 C ATOM 230 C PRO A 46 -26.970 -3.642 -6.823 1.00 57.65 C ATOM 231 O PRO A 46 -27.887 -3.677 -5.994 1.00 56.63 O ATOM 232 CB PRO A 46 -24.757 -3.006 -5.824 1.00 52.37 C ATOM 233 CG PRO A 46 -24.514 -1.899 -4.869 1.00 56.22 C ATOM 234 CD PRO A 46 -25.827 -1.205 -4.696 1.00 51.60 C ATOM 235 N ARG A 47 -26.856 -4.529 -7.831 1.00 57.19 N ATOM 236 CA ARG A 47 -27.807 -5.630 -8.035 1.00 58.27 C ATOM 237 C ARG A 47 -27.762 -6.688 -6.912 1.00 63.92 C ATOM 238 O ARG A 47 -28.609 -7.582 -6.884 1.00 63.69 O ATOM 239 CB ARG A 47 -27.620 -6.258 -9.425 1.00 60.14 C ATOM 240 H ARG A 47 -26.060 -4.430 -8.493 1.00 0.00 H ATOM 241 N SER A 48 -26.799 -6.555 -5.967 1.00 62.72 N ATOM 242 CA SER A 48 -26.624 -7.439 -4.800 1.00 63.83 C ATOM 243 C SER A 48 -27.777 -7.267 -3.797 1.00 69.28 C ATOM 244 O SER A 48 -28.132 -8.212 -3.086 1.00 68.66 O ATOM 245 CB SER A 48 -25.294 -7.148 -4.102 1.00 67.39 C ATOM 246 OG SER A 48 -25.258 -5.869 -3.483 1.00 73.84 O ATOM 247 HG SER A 48 -24.377 -5.738 -3.050 1.00 0.00 H ATOM 248 H SER A 48 -26.130 -5.766 -6.074 1.00 0.00 H ATOM 249 N ASP A 49 -28.348 -6.045 -3.757 1.00 66.88 N ATOM 250 CA ASP A 49 -29.441 -5.604 -2.888 1.00 66.96 C ATOM 251 C ASP A 49 -30.728 -6.442 -2.976 1.00 72.30 C ATOM 252 O ASP A 49 -31.513 -6.443 -2.027 1.00 71.61 O ATOM 253 CB ASP A 49 -29.743 -4.118 -3.158 1.00 68.18 C ATOM 254 CG ASP A 49 -28.805 -3.167 -2.432 1.00 73.76 C ATOM 255 OD1 ASP A 49 -27.634 -3.547 -2.191 1.00 70.84 O ATOM 256 OD2 ASP A 49 -29.251 -2.052 -2.075 1.00 82.82 O ATOM 257 H ASP A 49 -27.969 -5.337 -4.418 1.00 0.00 H ATOM 258 N SER A 50 -30.929 -7.153 -4.110 1.00 69.75 N ATOM 259 CA SER A 50 -32.087 -8.006 -4.414 1.00 69.67 C ATOM 260 C SER A 50 -33.435 -7.278 -4.197 1.00 73.49 C ATOM 261 O SER A 50 -34.373 -7.813 -3.593 1.00 73.44 O ATOM 262 CB SER A 50 -32.016 -9.344 -3.679 1.00 73.07 C ATOM 263 OG SER A 50 -32.696 -10.347 -4.418 1.00 81.00 O ATOM 264 HG SER A 50 -33.645 -10.088 -4.528 1.00 0.00 H ATOM 265 H SER A 50 -30.190 -7.090 -4.839 1.00 0.00 H ATOM 266 N VAL A 51 -33.497 -6.031 -4.698 1.00 69.13 N ATOM 267 CA VAL A 51 -34.692 -5.189 -4.704 1.00 68.23 C ATOM 268 C VAL A 51 -35.122 -5.216 -6.173 1.00 68.57 C ATOM 269 O VAL A 51 -34.276 -5.440 -7.038 1.00 68.27 O ATOM 270 CB VAL A 51 -34.410 -3.735 -4.212 1.00 72.74 C ATOM 271 CG1 VAL A 51 -35.709 -2.967 -3.972 1.00 72.68 C ATOM 272 CG2 VAL A 51 -33.551 -3.724 -2.948 1.00 72.68 C ATOM 273 H VAL A 51 -32.629 -5.636 -5.113 1.00 0.00 H ATOM 274 N THR A 52 -36.412 -5.042 -6.464 1.00 63.24 N ATOM 275 CA THR A 52 -36.861 -5.041 -7.851 1.00 62.57 C ATOM 276 C THR A 52 -36.405 -3.724 -8.536 1.00 64.32 C ATOM 277 O THR A 52 -36.745 -2.631 -8.061 1.00 63.84 O ATOM 278 CB THR A 52 -38.367 -5.385 -7.998 1.00 74.80 C ATOM 279 OG1 THR A 52 -38.729 -5.348 -9.382 1.00 73.84 O ATOM 280 CG2 THR A 52 -39.293 -4.467 -7.183 1.00 75.80 C ATOM 281 HG1 THR A 52 -39.690 -5.567 -9.477 1.00 0.00 H ATOM 282 H THR A 52 -37.101 -4.906 -5.697 1.00 0.00 H ATOM 283 N PRO A 53 -35.568 -3.803 -9.604 1.00 58.15 N ATOM 284 CA PRO A 53 -35.145 -2.558 -10.275 1.00 55.78 C ATOM 285 C PRO A 53 -36.343 -1.971 -10.997 1.00 54.73 C ATOM 286 O PRO A 53 -37.219 -2.729 -11.421 1.00 55.96 O ATOM 287 CB PRO A 53 -34.070 -3.022 -11.273 1.00 57.64 C ATOM 288 CG PRO A 53 -33.829 -4.482 -10.995 1.00 62.96 C ATOM 289 CD PRO A 53 -35.052 -4.998 -10.307 1.00 58.96 C ATOM 290 N VAL A 54 -36.427 -0.646 -11.117 1.00 45.42 N ATOM 291 CA VAL A 54 -37.549 -0.094 -11.856 1.00 43.53 C ATOM 292 C VAL A 54 -37.410 -0.515 -13.306 1.00 45.53 C ATOM 293 O VAL A 54 -36.282 -0.668 -13.809 1.00 43.79 O ATOM 294 CB VAL A 54 -37.722 1.455 -11.745 1.00 47.91 C ATOM 295 CG1 VAL A 54 -38.217 1.872 -10.373 1.00 47.26 C ATOM 296 CG2 VAL A 54 -36.452 2.223 -12.126 1.00 47.74 C ATOM 297 H VAL A 54 -35.709 -0.025 -10.693 1.00 0.00 H ATOM 298 N THR A 55 -38.548 -0.730 -13.962 1.00 41.05 N ATOM 299 CA THR A 55 -38.567 -0.994 -15.379 1.00 41.17 C ATOM 300 C THR A 55 -38.811 0.377 -15.956 1.00 44.55 C ATOM 301 O THR A 55 -39.839 1.016 -15.686 1.00 44.17 O ATOM 302 CB THR A 55 -39.609 -2.047 -15.774 1.00 46.88 C ATOM 303 OG1 THR A 55 -39.208 -3.286 -15.215 1.00 51.29 O ATOM 304 CG2 THR A 55 -39.720 -2.217 -17.266 1.00 45.61 C ATOM 305 HG1 THR A 55 -39.867 -3.984 -15.457 1.00 0.00 H ATOM 306 H THR A 55 -39.447 -0.707 -13.439 1.00 0.00 H ATOM 307 N VAL A 56 -37.841 0.842 -16.713 1.00 39.64 N ATOM 308 CA VAL A 56 -37.908 2.144 -17.325 1.00 39.29 C ATOM 309 C VAL A 56 -38.508 2.037 -18.707 1.00 44.07 C ATOM 310 O VAL A 56 -38.212 1.102 -19.443 1.00 45.59 O ATOM 311 CB VAL A 56 -36.512 2.821 -17.328 1.00 42.32 C ATOM 312 CG1 VAL A 56 -36.503 4.069 -18.193 1.00 41.04 C ATOM 313 CG2 VAL A 56 -36.061 3.146 -15.904 1.00 41.87 C ATOM 314 H VAL A 56 -37.000 0.252 -16.874 1.00 0.00 H ATOM 315 N ALA A 57 -39.323 3.011 -19.063 1.00 38.32 N ATOM 316 CA ALA A 57 -39.889 3.102 -20.381 1.00 37.53 C ATOM 317 C ALA A 57 -39.301 4.338 -21.003 1.00 38.52 C ATOM 318 O ALA A 57 -39.120 5.356 -20.326 1.00 36.77 O ATOM 319 CB ALA A 57 -41.403 3.214 -20.298 1.00 38.57 C ATOM 320 H ALA A 57 -39.565 3.741 -18.363 1.00 0.00 H ATOM 321 N VAL A 58 -38.914 4.227 -22.272 1.00 34.25 N ATOM 322 CA VAL A 58 -38.356 5.328 -23.026 1.00 33.70 C ATOM 323 C VAL A 58 -39.026 5.343 -24.372 1.00 38.99 C ATOM 324 O VAL A 58 -39.269 4.284 -24.950 1.00 40.51 O ATOM 325 CB VAL A 58 -36.793 5.312 -23.150 1.00 37.92 C ATOM 326 CG1 VAL A 58 -36.120 5.406 -21.793 1.00 37.46 C ATOM 327 CG2 VAL A 58 -36.277 4.087 -23.908 1.00 37.63 C ATOM 328 H VAL A 58 -39.018 3.306 -22.743 1.00 0.00 H ATOM 329 N ILE A 59 -39.319 6.530 -24.877 1.00 34.25 N ATOM 330 CA ILE A 59 -39.891 6.702 -26.204 1.00 34.29 C ATOM 331 C ILE A 59 -39.426 8.019 -26.781 1.00 38.17 C ATOM 332 O ILE A 59 -39.331 9.013 -26.060 1.00 37.29 O ATOM 333 CB ILE A 59 -41.438 6.489 -26.260 1.00 38.03 C ATOM 334 CG1 ILE A 59 -41.908 6.252 -27.725 1.00 38.54 C ATOM 335 CG2 ILE A 59 -42.226 7.629 -25.585 1.00 38.19 C ATOM 336 CD1 ILE A 59 -43.068 5.363 -27.850 1.00 44.65 C ATOM 337 H ILE A 59 -39.133 7.376 -24.301 1.00 0.00 H ATOM 338 N THR A 60 -39.057 8.010 -28.059 1.00 35.89 N ATOM 339 CA THR A 60 -38.619 9.196 -28.771 1.00 37.47 C ATOM 340 C THR A 60 -39.841 10.093 -29.046 1.00 46.36 C ATOM 341 O THR A 60 -40.933 9.591 -29.317 1.00 43.86 O ATOM 342 CB THR A 60 -37.822 8.799 -30.026 1.00 45.77 C ATOM 343 OG1 THR A 60 -36.721 7.989 -29.604 1.00 46.25 O ATOM 344 CG2 THR A 60 -37.267 9.985 -30.766 1.00 46.21 C ATOM 345 HG1 THR A 60 -37.064 7.182 -29.144 1.00 0.00 H ATOM 346 H THR A 60 -39.084 7.107 -28.574 1.00 0.00 H ATOM 347 N CYS A 61 -39.647 11.409 -28.913 1.00 46.71 N ATOM 348 CA CYS A 61 -40.674 12.405 -29.138 1.00 48.66 C ATOM 349 C CYS A 61 -40.760 12.694 -30.637 1.00 55.32 C ATOM 350 O CYS A 61 -39.739 12.907 -31.289 1.00 54.17 O ATOM 351 CB CYS A 61 -40.369 13.670 -28.346 1.00 49.30 C ATOM 352 SG CYS A 61 -41.550 15.015 -28.625 1.00 53.46 S ATOM 353 H CYS A 61 -38.701 11.737 -28.631 1.00 0.00 H ATOM 354 N LYS A 62 -41.988 12.759 -31.161 1.00 53.79 N ATOM 355 CA LYS A 62 -42.278 13.007 -32.577 1.00 54.82 C ATOM 356 C LYS A 62 -41.858 14.395 -33.099 1.00 64.82 C ATOM 357 O LYS A 62 -41.864 14.601 -34.318 1.00 65.59 O ATOM 358 CB LYS A 62 -43.781 12.807 -32.858 1.00 55.27 C ATOM 359 CG LYS A 62 -44.426 11.638 -32.138 1.00 53.27 C ATOM 360 CD LYS A 62 -45.941 11.652 -32.337 1.00 64.16 C ATOM 361 CE LYS A 62 -46.643 10.546 -31.595 1.00 72.93 C ATOM 362 NZ LYS A 62 -48.096 10.519 -31.902 1.00 86.46 N ATOM 363 HZ1 LYS A 62 -48.525 11.425 -31.625 1.00 0.00 H ATOM 364 HZ2 LYS A 62 -48.231 10.368 -32.922 1.00 0.00 H ATOM 365 HZ3 LYS A 62 -48.546 9.745 -31.373 1.00 0.00 H ATOM 366 H LYS A 62 -42.795 12.624 -30.519 1.00 0.00 H ATOM 367 N TYR A 63 -41.512 15.348 -32.207 1.00 64.21 N ATOM 368 CA TYR A 63 -41.200 16.721 -32.617 1.00 65.63 C ATOM 369 C TYR A 63 -39.772 17.175 -32.231 1.00 71.41 C ATOM 370 O TYR A 63 -39.629 18.025 -31.346 1.00 71.49 O ATOM 371 CB TYR A 63 -42.288 17.695 -32.082 1.00 67.84 C ATOM 372 CG TYR A 63 -43.668 17.068 -31.998 1.00 71.15 C ATOM 373 CD1 TYR A 63 -44.508 17.028 -33.108 1.00 73.47 C ATOM 374 CD2 TYR A 63 -44.106 16.450 -30.828 1.00 72.16 C ATOM 375 CE1 TYR A 63 -45.759 16.410 -33.050 1.00 74.13 C ATOM 376 CE2 TYR A 63 -45.350 15.822 -30.760 1.00 73.08 C ATOM 377 CZ TYR A 63 -46.175 15.809 -31.872 1.00 80.67 C ATOM 378 OH TYR A 63 -47.404 15.196 -31.801 1.00 82.64 O ATOM 379 HH TYR A 63 -47.949 15.633 -31.099 1.00 0.00 H ATOM 380 H TYR A 63 -41.465 15.101 -31.198 1.00 0.00 H ATOM 381 N PRO A 64 -38.699 16.664 -32.899 1.00 68.96 N ATOM 382 CA PRO A 64 -37.333 17.085 -32.521 1.00 68.80 C ATOM 383 C PRO A 64 -36.881 18.426 -33.092 1.00 72.56 C ATOM 384 O PRO A 64 -36.153 19.154 -32.415 1.00 71.96 O ATOM 385 CB PRO A 64 -36.440 15.934 -33.026 1.00 70.23 C ATOM 386 CG PRO A 64 -37.365 14.936 -33.677 1.00 74.57 C ATOM 387 CD PRO A 64 -38.650 15.640 -33.960 1.00 70.39 C ATOM 388 N GLU A 65 -37.300 18.744 -34.338 1.00 69.42 N ATOM 389 CA GLU A 65 -36.946 19.950 -35.105 1.00 68.76 C ATOM 390 C GLU A 65 -37.189 21.285 -34.358 1.00 71.12 C ATOM 391 O GLU A 65 -36.454 22.246 -34.595 1.00 70.55 O ATOM 392 CB GLU A 65 -37.632 19.954 -36.497 1.00 70.20 C ATOM 393 CG GLU A 65 -39.151 20.117 -36.507 1.00 83.39 C ATOM 394 CD GLU A 65 -39.990 18.958 -35.996 1.00105.53 C ATOM 395 OE1 GLU A 65 -39.728 17.801 -36.397 1.00 90.27 O ATOM 396 OE2 GLU A 65 -40.922 19.215 -35.200 1.00105.12 O ATOM 397 H GLU A 65 -37.938 18.067 -34.802 1.00 0.00 H ATOM 398 N ALA A 66 -38.190 21.327 -33.453 1.00 66.41 N ATOM 399 CA ALA A 66 -38.537 22.512 -32.662 1.00 65.50 C ATOM 400 C ALA A 66 -37.535 22.814 -31.515 1.00 66.67 C ATOM 401 O ALA A 66 -37.500 23.948 -31.023 1.00 66.18 O ATOM 402 CB ALA A 66 -39.948 22.364 -32.105 1.00 66.39 C ATOM 403 H ALA A 66 -38.751 20.463 -33.308 1.00 0.00 H ATOM 404 N LEU A 67 -36.712 21.815 -31.111 1.00 60.46 N ATOM 405 CA LEU A 67 -35.741 21.966 -30.012 1.00 58.19 C ATOM 406 C LEU A 67 -34.285 22.177 -30.494 1.00 58.87 C ATOM 407 O LEU A 67 -34.054 22.354 -31.694 1.00 57.75 O ATOM 408 CB LEU A 67 -35.831 20.779 -29.023 1.00 57.60 C ATOM 409 CG LEU A 67 -37.201 20.129 -28.730 1.00 60.95 C ATOM 410 CD1 LEU A 67 -37.013 18.896 -27.918 1.00 60.72 C ATOM 411 CD2 LEU A 67 -38.138 21.055 -27.975 1.00 61.31 C ATOM 412 H LEU A 67 -36.768 20.899 -31.600 1.00 0.00 H ATOM 413 N GLU A 68 -33.306 22.169 -29.556 1.00 53.53 N ATOM 414 CA GLU A 68 -31.890 22.341 -29.903 1.00 52.51 C ATOM 415 C GLU A 68 -31.428 21.127 -30.698 1.00 54.22 C ATOM 416 O GLU A 68 -31.914 20.020 -30.458 1.00 54.07 O ATOM 417 CB GLU A 68 -31.009 22.572 -28.657 1.00 53.79 C ATOM 418 CG GLU A 68 -31.326 23.861 -27.905 1.00 62.33 C ATOM 419 CD GLU A 68 -30.574 24.121 -26.610 1.00 90.26 C ATOM 420 OE1 GLU A 68 -30.427 25.312 -26.251 1.00 90.66 O ATOM 421 OE2 GLU A 68 -30.142 23.147 -25.948 1.00 84.39 O ATOM 422 H GLU A 68 -33.567 22.037 -28.558 1.00 0.00 H ATOM 423 N GLN A 69 -30.545 21.351 -31.681 1.00 48.85 N ATOM 424 CA GLN A 69 -30.007 20.337 -32.595 1.00 46.50 C ATOM 425 C GLN A 69 -28.562 19.992 -32.225 1.00 45.57 C ATOM 426 O GLN A 69 -27.845 20.843 -31.699 1.00 43.68 O ATOM 427 CB GLN A 69 -30.051 20.872 -34.044 1.00 48.16 C ATOM 428 CG GLN A 69 -31.435 21.372 -34.531 1.00 62.13 C ATOM 429 CD GLN A 69 -32.509 20.305 -34.533 1.00 77.93 C ATOM 430 OE1 GLN A 69 -32.453 19.321 -35.281 1.00 74.92 O ATOM 431 NE2 GLN A 69 -33.516 20.479 -33.692 1.00 68.68 N ATOM 432 HE22 GLN A 69 -33.539 21.315 -33.074 1.00 0.00 H ATOM 433 HE21 GLN A 69 -34.284 19.780 -33.649 1.00 0.00 H ATOM 434 H GLN A 69 -30.212 22.328 -31.807 1.00 0.00 H ATOM 435 N GLY A 70 -28.144 18.762 -32.533 1.00 39.93 N ATOM 436 CA GLY A 70 -26.799 18.277 -32.237 1.00 38.21 C ATOM 437 C GLY A 70 -26.585 17.974 -30.767 1.00 42.34 C ATOM 438 O GLY A 70 -25.448 18.042 -30.278 1.00 41.87 O ATOM 439 H GLY A 70 -28.809 18.118 -33.007 1.00 0.00 H ATOM 440 N ARG A 71 -27.682 17.630 -30.042 1.00 37.83 N ATOM 441 CA ARG A 71 -27.630 17.344 -28.589 1.00 37.69 C ATOM 442 C ARG A 71 -28.182 15.968 -28.252 1.00 40.93 C ATOM 443 O ARG A 71 -28.292 15.618 -27.079 1.00 39.09 O ATOM 444 CB ARG A 71 -28.374 18.437 -27.765 1.00 37.19 C ATOM 445 CG ARG A 71 -27.872 19.857 -27.998 1.00 49.18 C ATOM 446 CD ARG A 71 -27.923 20.728 -26.751 1.00 56.29 C ATOM 447 NE ARG A 71 -26.837 20.409 -25.822 1.00 72.94 N ATOM 448 CZ ARG A 71 -25.625 20.958 -25.856 1.00 88.70 C ATOM 449 NH1 ARG A 71 -24.699 20.589 -24.979 1.00 79.82 N ATOM 450 NH2 ARG A 71 -25.330 21.882 -26.767 1.00 65.09 N ATOM 451 HE ARG A 71 -27.026 19.703 -25.082 1.00 0.00 H ATOM 452 HH12 ARG A 71 -23.753 21.020 -25.009 1.00 0.00 H ATOM 453 HH11 ARG A 71 -24.919 19.869 -24.262 1.00 0.00 H ATOM 454 HH22 ARG A 71 -24.381 22.307 -26.788 1.00 0.00 H ATOM 455 HH21 ARG A 71 -26.048 22.179 -27.458 1.00 0.00 H ATOM 456 H ARG A 71 -28.599 17.565 -30.529 1.00 0.00 H ATOM 457 N GLY A 72 -28.538 15.208 -29.280 1.00 40.03 N ATOM 458 CA GLY A 72 -29.097 13.874 -29.129 1.00 40.50 C ATOM 459 C GLY A 72 -30.595 13.912 -29.305 1.00 46.34 C ATOM 460 O GLY A 72 -31.178 14.991 -29.346 1.00 47.27 O ATOM 461 H GLY A 72 -28.411 15.585 -30.241 1.00 0.00 H ATOM 462 N ASP A 73 -31.216 12.743 -29.386 1.00 43.60 N ATOM 463 CA ASP A 73 -32.648 12.553 -29.593 1.00 43.02 C ATOM 464 C ASP A 73 -33.495 12.902 -28.360 1.00 43.19 C ATOM 465 O ASP A 73 -33.275 12.305 -27.315 1.00 41.73 O ATOM 466 CB ASP A 73 -32.930 11.108 -30.083 1.00 45.31 C ATOM 467 CG ASP A 73 -32.204 9.999 -29.306 1.00 59.82 C ATOM 468 OD1 ASP A 73 -30.955 9.927 -29.393 1.00 60.20 O ATOM 469 OD2 ASP A 73 -32.889 9.190 -28.637 1.00 64.18 O ATOM 470 H ASP A 73 -30.632 11.888 -29.294 1.00 0.00 H ATOM 471 N PRO A 74 -34.505 13.813 -28.453 1.00 40.19 N ATOM 472 CA PRO A 74 -35.341 14.096 -27.260 1.00 38.23 C ATOM 473 C PRO A 74 -36.282 12.944 -26.957 1.00 36.99 C ATOM 474 O PRO A 74 -37.012 12.485 -27.844 1.00 35.22 O ATOM 475 CB PRO A 74 -36.091 15.386 -27.628 1.00 40.73 C ATOM 476 CG PRO A 74 -36.096 15.426 -29.108 1.00 45.54 C ATOM 477 CD PRO A 74 -34.928 14.619 -29.619 1.00 41.49 C ATOM 478 N ILE A 75 -36.218 12.419 -25.714 1.00 30.24 N ATOM 479 CA ILE A 75 -37.045 11.279 -25.315 1.00 28.54 C ATOM 480 C ILE A 75 -37.896 11.617 -24.084 1.00 32.03 C ATOM 481 O ILE A 75 -37.513 12.501 -23.301 1.00 30.07 O ATOM 482 CB ILE A 75 -36.140 10.031 -25.009 1.00 31.01 C ATOM 483 CG1 ILE A 75 -35.191 10.249 -23.789 1.00 30.32 C ATOM 484 CG2 ILE A 75 -35.355 9.571 -26.238 1.00 33.69 C ATOM 485 CD1 ILE A 75 -34.558 8.895 -23.197 1.00 31.88 C ATOM 486 H ILE A 75 -35.563 12.836 -25.022 1.00 0.00 H ATOM 487 N TYR A 76 -38.997 10.865 -23.883 1.00 29.32 N ATOM 488 CA TYR A 76 -39.789 10.853 -22.656 1.00 29.00 C ATOM 489 C TYR A 76 -39.245 9.718 -21.882 1.00 30.93 C ATOM 490 O TYR A 76 -38.777 8.732 -22.457 1.00 29.20 O ATOM 491 CB TYR A 76 -41.305 10.683 -22.867 1.00 30.44 C ATOM 492 CG TYR A 76 -41.939 11.869 -23.538 1.00 31.72 C ATOM 493 CD1 TYR A 76 -41.999 13.106 -22.901 1.00 33.29 C ATOM 494 CD2 TYR A 76 -42.462 11.769 -24.820 1.00 33.79 C ATOM 495 CE1 TYR A 76 -42.572 14.210 -23.517 1.00 31.84 C ATOM 496 CE2 TYR A 76 -43.033 12.870 -25.455 1.00 35.05 C ATOM 497 CZ TYR A 76 -43.103 14.085 -24.792 1.00 43.09 C ATOM 498 OH TYR A 76 -43.649 15.178 -25.420 1.00 44.18 O ATOM 499 HH TYR A 76 -44.588 14.982 -25.663 1.00 0.00 H ATOM 500 H TYR A 76 -39.306 10.247 -24.660 1.00 0.00 H ATOM 501 N LEU A 77 -39.259 9.844 -20.569 1.00 29.45 N ATOM 502 CA LEU A 77 -38.641 8.870 -19.696 1.00 31.51 C ATOM 503 C LEU A 77 -39.536 8.595 -18.507 1.00 38.48 C ATOM 504 O LEU A 77 -39.880 9.504 -17.743 1.00 38.41 O ATOM 505 CB LEU A 77 -37.278 9.477 -19.286 1.00 32.76 C ATOM 506 CG LEU A 77 -36.333 8.732 -18.349 1.00 39.25 C ATOM 507 CD1 LEU A 77 -35.879 7.420 -18.939 1.00 39.93 C ATOM 508 CD2 LEU A 77 -35.062 9.580 -18.108 1.00 38.77 C ATOM 509 H LEU A 77 -39.730 10.670 -20.148 1.00 0.00 H ATOM 510 N GLY A 78 -39.950 7.353 -18.377 1.00 37.37 N ATOM 511 CA GLY A 78 -40.840 6.997 -17.283 1.00 38.61 C ATOM 512 C GLY A 78 -40.526 5.667 -16.660 1.00 45.21 C ATOM 513 O GLY A 78 -39.508 5.049 -16.971 1.00 46.20 O ATOM 514 H GLY A 78 -39.642 6.627 -19.055 1.00 0.00 H ATOM 515 N ILE A 79 -41.384 5.249 -15.750 1.00 41.31 N ATOM 516 CA ILE A 79 -41.299 3.981 -15.043 1.00 42.35 C ATOM 517 C ILE A 79 -42.681 3.299 -15.098 1.00 48.89 C ATOM 518 O ILE A 79 -43.704 3.979 -15.256 1.00 46.12 O ATOM 519 CB ILE A 79 -40.703 4.064 -13.607 1.00 45.59 C ATOM 520 CG1 ILE A 79 -41.533 4.998 -12.684 1.00 46.26 C ATOM 521 CG2 ILE A 79 -39.197 4.437 -13.627 1.00 46.40 C ATOM 522 CD1 ILE A 79 -41.092 5.029 -11.179 1.00 52.16 C ATOM 523 H ILE A 79 -42.183 5.874 -15.520 1.00 0.00 H ATOM 524 N GLN A 80 -42.679 1.957 -15.053 1.00 48.78 N ATOM 525 CA GLN A 80 -43.860 1.097 -15.060 1.00 49.84 C ATOM 526 C GLN A 80 -43.949 0.515 -13.669 1.00 58.79 C ATOM 527 O GLN A 80 -42.912 0.130 -13.110 1.00 60.78 O ATOM 528 CB GLN A 80 -43.682 -0.084 -16.035 1.00 50.64 C ATOM 529 CG GLN A 80 -43.519 0.280 -17.500 1.00 59.12 C ATOM 530 CD GLN A 80 -43.502 -0.952 -18.379 1.00 68.90 C ATOM 531 OE1 GLN A 80 -43.191 -2.074 -17.943 1.00 57.49 O ATOM 532 NE2 GLN A 80 -43.836 -0.765 -19.646 1.00 62.46 N ATOM 533 HE22 GLN A 80 -44.091 0.186 -19.982 1.00 0.00 H ATOM 534 HE21 GLN A 80 -43.843 -1.569 -20.306 1.00 0.00 H ATOM 535 H GLN A 80 -41.752 1.487 -15.009 1.00 0.00 H ATOM 536 N ASN A 81 -45.181 0.389 -13.142 1.00 56.41 N ATOM 537 CA ASN A 81 -45.514 -0.164 -11.820 1.00 56.84 C ATOM 538 C ASN A 81 -44.644 0.432 -10.689 1.00 61.37 C ATOM 539 O ASN A 81 -43.664 -0.196 -10.283 1.00 62.05 O ATOM 540 CB ASN A 81 -45.509 -1.705 -11.812 1.00 57.43 C ATOM 541 H ASN A 81 -45.976 0.715 -13.727 1.00 0.00 H ATOM 542 N PRO A 82 -44.975 1.638 -10.167 1.00 56.82 N ATOM 543 CA PRO A 82 -46.106 2.506 -10.539 1.00 56.27 C ATOM 544 C PRO A 82 -45.838 3.333 -11.797 1.00 59.64 C ATOM 545 O PRO A 82 -44.700 3.747 -12.028 1.00 60.17 O ATOM 546 CB PRO A 82 -46.318 3.353 -9.279 1.00 57.93 C ATOM 547 CG PRO A 82 -44.947 3.478 -8.678 1.00 62.74 C ATOM 548 CD PRO A 82 -44.179 2.227 -9.073 1.00 58.46 C ATOM 549 N GLU A 83 -46.894 3.559 -12.608 1.00 53.58 N ATOM 550 CA GLU A 83 -46.842 4.305 -13.856 1.00 52.07 C ATOM 551 C GLU A 83 -46.597 5.794 -13.610 1.00 53.88 C ATOM 552 O GLU A 83 -47.534 6.571 -13.402 1.00 52.52 O ATOM 553 CB GLU A 83 -48.097 4.049 -14.708 1.00 53.35 C ATOM 554 H GLU A 83 -47.814 3.170 -12.318 1.00 0.00 H ATOM 555 N MET A 84 -45.310 6.185 -13.625 1.00 48.87 N ATOM 556 CA MET A 84 -44.879 7.569 -13.387 1.00 47.45 C ATOM 557 C MET A 84 -43.876 8.014 -14.450 1.00 48.02 C ATOM 558 O MET A 84 -43.114 7.186 -14.933 1.00 47.17 O ATOM 559 CB MET A 84 -44.221 7.687 -12.006 1.00 49.85 C ATOM 560 CG MET A 84 -45.137 7.344 -10.849 1.00 54.37 C ATOM 561 SD MET A 84 -44.298 7.566 -9.275 1.00 59.86 S ATOM 562 CE MET A 84 -44.932 9.163 -8.838 1.00 56.74 C ATOM 563 H MET A 84 -44.581 5.469 -13.815 1.00 0.00 H ATOM 564 N CYS A 85 -43.859 9.311 -14.787 1.00 41.71 N ATOM 565 CA CYS A 85 -42.905 9.902 -15.722 1.00 40.07 C ATOM 566 C CYS A 85 -42.024 10.919 -15.020 1.00 40.39 C ATOM 567 O CYS A 85 -42.492 11.654 -14.143 1.00 36.51 O ATOM 568 CB CYS A 85 -43.610 10.514 -16.922 1.00 40.86 C ATOM 569 SG CYS A 85 -44.307 9.292 -18.061 1.00 45.71 S ATOM 570 H CYS A 85 -44.570 9.936 -14.356 1.00 0.00 H ATOM 571 N LEU A 86 -40.755 10.997 -15.449 1.00 35.55 N ATOM 572 CA LEU A 86 -39.808 11.942 -14.892 1.00 33.54 C ATOM 573 C LEU A 86 -39.964 13.276 -15.580 1.00 32.67 C ATOM 574 O LEU A 86 -40.205 13.334 -16.774 1.00 30.27 O ATOM 575 CB LEU A 86 -38.358 11.431 -15.058 1.00 33.26 C ATOM 576 CG LEU A 86 -37.909 10.301 -14.127 1.00 37.53 C ATOM 577 CD1 LEU A 86 -36.635 9.628 -14.644 1.00 36.59 C ATOM 578 CD2 LEU A 86 -37.665 10.816 -12.696 1.00 39.78 C ATOM 579 H LEU A 86 -40.440 10.358 -16.207 1.00 0.00 H ATOM 580 N TYR A 87 -39.810 14.365 -14.830 1.00 29.73 N ATOM 581 CA TYR A 87 -39.838 15.690 -15.423 1.00 28.13 C ATOM 582 C TYR A 87 -38.942 16.612 -14.591 1.00 30.67 C ATOM 583 O TYR A 87 -38.562 16.263 -13.493 1.00 30.46 O ATOM 584 CB TYR A 87 -41.286 16.244 -15.593 1.00 28.66 C ATOM 585 CG TYR A 87 -41.943 16.637 -14.289 1.00 29.74 C ATOM 586 CD1 TYR A 87 -42.488 15.678 -13.447 1.00 31.57 C ATOM 587 CD2 TYR A 87 -42.038 17.971 -13.908 1.00 30.72 C ATOM 588 CE1 TYR A 87 -43.079 16.031 -12.234 1.00 32.99 C ATOM 589 CE2 TYR A 87 -42.595 18.336 -12.682 1.00 31.61 C ATOM 590 CZ TYR A 87 -43.142 17.363 -11.865 1.00 36.91 C ATOM 591 OH TYR A 87 -43.701 17.705 -10.667 1.00 40.39 O ATOM 592 HH TYR A 87 -44.450 18.334 -10.821 1.00 0.00 H ATOM 593 H TYR A 87 -39.668 14.265 -13.805 1.00 0.00 H ATOM 594 N CYS A 88 -38.663 17.788 -15.111 1.00 27.37 N ATOM 595 CA CYS A 88 -37.824 18.791 -14.504 1.00 27.46 C ATOM 596 C CYS A 88 -38.680 19.991 -14.139 1.00 33.87 C ATOM 597 O CYS A 88 -39.401 20.542 -14.984 1.00 31.64 O ATOM 598 CB CYS A 88 -36.696 19.174 -15.456 1.00 28.35 C ATOM 599 SG CYS A 88 -35.757 17.744 -16.064 1.00 33.78 S ATOM 600 H CYS A 88 -39.082 18.012 -16.036 1.00 0.00 H ATOM 601 N GLU A 89 -38.568 20.395 -12.876 1.00 34.59 N ATOM 602 CA GLU A 89 -39.301 21.531 -12.315 1.00 36.04 C ATOM 603 C GLU A 89 -38.319 22.379 -11.515 1.00 37.52 C ATOM 604 O GLU A 89 -37.557 21.849 -10.706 1.00 36.11 O ATOM 605 CB GLU A 89 -40.419 21.011 -11.381 1.00 38.22 C ATOM 606 CG GLU A 89 -41.341 22.099 -10.829 1.00 56.79 C ATOM 607 CD GLU A 89 -41.915 21.887 -9.436 1.00 85.61 C ATOM 608 OE1 GLU A 89 -42.177 22.904 -8.752 1.00 92.70 O ATOM 609 OE2 GLU A 89 -42.103 20.719 -9.023 1.00 74.12 O ATOM 610 H GLU A 89 -37.922 19.873 -12.251 1.00 0.00 H ATOM 611 N LYS A 90 -38.387 23.679 -11.694 1.00 35.80 N ATOM 612 CA LYS A 90 -37.596 24.642 -10.938 1.00 36.98 C ATOM 613 C LYS A 90 -38.183 24.763 -9.499 1.00 41.91 C ATOM 614 O LYS A 90 -39.366 25.088 -9.333 1.00 42.49 O ATOM 615 CB LYS A 90 -37.636 26.001 -11.656 1.00 40.06 C ATOM 616 CG LYS A 90 -36.497 26.937 -11.300 1.00 54.14 C ATOM 617 CD LYS A 90 -36.386 28.095 -12.294 1.00 71.31 C ATOM 618 CE LYS A 90 -37.033 29.383 -11.832 1.00 88.29 C ATOM 619 NZ LYS A 90 -36.071 30.254 -11.101 1.00100.10 N ATOM 620 HZ1 LYS A 90 -35.714 29.749 -10.265 1.00 0.00 H ATOM 621 HZ2 LYS A 90 -35.277 30.494 -11.728 1.00 0.00 H ATOM 622 HZ3 LYS A 90 -36.553 31.126 -10.802 1.00 0.00 H ATOM 623 H LYS A 90 -39.042 24.041 -12.416 1.00 0.00 H ATOM 624 N VAL A 91 -37.380 24.431 -8.484 1.00 36.55 N ATOM 625 CA VAL A 91 -37.753 24.557 -7.059 1.00 36.47 C ATOM 626 C VAL A 91 -36.800 25.647 -6.522 1.00 38.95 C ATOM 627 O VAL A 91 -35.624 25.382 -6.268 1.00 37.09 O ATOM 628 CB VAL A 91 -37.690 23.211 -6.289 1.00 40.37 C ATOM 629 CG1 VAL A 91 -37.893 23.400 -4.788 1.00 40.32 C ATOM 630 CG2 VAL A 91 -38.705 22.212 -6.833 1.00 40.63 C ATOM 631 H VAL A 91 -36.435 24.061 -8.710 1.00 0.00 H ATOM 632 N GLY A 92 -37.297 26.876 -6.493 1.00 37.70 N ATOM 633 CA GLY A 92 -36.529 28.061 -6.130 1.00 38.43 C ATOM 634 C GLY A 92 -35.531 28.343 -7.234 1.00 43.90 C ATOM 635 O GLY A 92 -35.924 28.528 -8.392 1.00 43.35 O ATOM 636 H GLY A 92 -38.298 27.003 -6.745 1.00 0.00 H ATOM 637 N GLU A 93 -34.229 28.297 -6.910 1.00 40.95 N ATOM 638 CA GLU A 93 -33.220 28.456 -7.966 1.00 41.24 C ATOM 639 C GLU A 93 -32.696 27.096 -8.417 1.00 45.68 C ATOM 640 O GLU A 93 -31.788 27.039 -9.239 1.00 46.65 O ATOM 641 CB GLU A 93 -32.081 29.414 -7.557 1.00 43.09 C ATOM 642 CG GLU A 93 -32.512 30.876 -7.477 1.00 56.64 C ATOM 643 CD GLU A 93 -33.355 31.394 -8.629 1.00 84.52 C ATOM 644 OE1 GLU A 93 -34.494 31.847 -8.371 1.00 89.39 O ATOM 645 OE2 GLU A 93 -32.888 31.330 -9.790 1.00 82.27 O ATOM 646 H GLU A 93 -33.938 28.150 -5.922 1.00 0.00 H ATOM 647 N GLN A 94 -33.280 25.996 -7.926 1.00 40.97 N ATOM 648 CA GLN A 94 -32.770 24.720 -8.396 1.00 41.32 C ATOM 649 C GLN A 94 -33.725 23.892 -9.258 1.00 43.00 C ATOM 650 O GLN A 94 -34.802 23.525 -8.788 1.00 40.85 O ATOM 651 CB GLN A 94 -32.239 23.845 -7.267 1.00 42.67 C ATOM 652 CG GLN A 94 -31.237 22.824 -7.823 1.00 48.62 C ATOM 653 CD GLN A 94 -30.585 22.043 -6.759 1.00 53.93 C ATOM 654 OE1 GLN A 94 -30.134 22.592 -5.766 1.00 42.00 O ATOM 655 NE2 GLN A 94 -30.529 20.734 -6.939 1.00 61.67 N ATOM 656 HE22 GLN A 94 -30.927 20.310 -7.801 1.00 0.00 H ATOM 657 HE21 GLN A 94 -30.087 20.128 -6.218 1.00 0.00 H ATOM 658 H GLN A 94 -34.061 26.052 -7.241 1.00 0.00 H ATOM 659 N PRO A 95 -33.265 23.469 -10.463 1.00 39.07 N ATOM 660 CA PRO A 95 -34.041 22.520 -11.261 1.00 37.42 C ATOM 661 C PRO A 95 -33.971 21.198 -10.516 1.00 38.61 C ATOM 662 O PRO A 95 -32.910 20.797 -9.956 1.00 35.48 O ATOM 663 CB PRO A 95 -33.248 22.438 -12.578 1.00 39.13 C ATOM 664 CG PRO A 95 -32.414 23.649 -12.601 1.00 44.19 C ATOM 665 CD PRO A 95 -32.012 23.795 -11.165 1.00 40.95 C ATOM 666 N THR A 96 -35.135 20.562 -10.395 1.00 32.60 N ATOM 667 CA THR A 96 -35.177 19.302 -9.674 1.00 32.45 C ATOM 668 C THR A 96 -35.817 18.239 -10.547 1.00 36.42 C ATOM 669 O THR A 96 -36.681 18.548 -11.367 1.00 36.97 O ATOM 670 CB THR A 96 -35.926 19.447 -8.332 1.00 41.13 C ATOM 671 OG1 THR A 96 -37.307 19.650 -8.623 1.00 41.12 O ATOM 672 CG2 THR A 96 -35.376 20.588 -7.451 1.00 32.85 C ATOM 673 HG1 THR A 96 -37.411 20.471 -9.166 1.00 0.00 H ATOM 674 H THR A 96 -36.001 20.962 -10.810 1.00 0.00 H ATOM 675 N LEU A 97 -35.407 16.995 -10.340 1.00 32.98 N ATOM 676 CA LEU A 97 -35.954 15.866 -11.044 1.00 32.70 C ATOM 677 C LEU A 97 -37.131 15.376 -10.233 1.00 36.76 C ATOM 678 O LEU A 97 -37.008 15.160 -9.015 1.00 35.70 O ATOM 679 CB LEU A 97 -34.901 14.765 -11.202 1.00 31.98 C ATOM 680 CG LEU A 97 -35.263 13.650 -12.171 1.00 35.80 C ATOM 681 CD1 LEU A 97 -35.343 14.186 -13.639 1.00 34.28 C ATOM 682 CD2 LEU A 97 -34.268 12.518 -12.058 1.00 37.46 C ATOM 683 H LEU A 97 -34.658 16.828 -9.638 1.00 0.00 H ATOM 684 N GLN A 98 -38.283 15.222 -10.887 1.00 30.56 N ATOM 685 CA GLN A 98 -39.475 14.783 -10.156 1.00 29.94 C ATOM 686 C GLN A 98 -40.167 13.663 -10.890 1.00 35.63 C ATOM 687 O GLN A 98 -39.956 13.474 -12.086 1.00 33.52 O ATOM 688 CB GLN A 98 -40.487 15.950 -10.007 1.00 30.83 C ATOM 689 CG GLN A 98 -39.957 17.256 -9.379 1.00 41.03 C ATOM 690 CD GLN A 98 -39.754 17.146 -7.879 1.00 51.30 C ATOM 691 OE1 GLN A 98 -40.083 16.148 -7.240 1.00 44.36 O ATOM 692 NE2 GLN A 98 -39.207 18.172 -7.275 1.00 46.42 N ATOM 693 HE22 GLN A 98 -38.932 19.012 -7.823 1.00 0.00 H ATOM 694 HE21 GLN A 98 -39.048 18.146 -6.248 1.00 0.00 H ATOM 695 H GLN A 98 -38.335 15.412 -11.908 1.00 0.00 H ATOM 696 N LEU A 99 -41.023 12.957 -10.173 1.00 34.09 N ATOM 697 CA LEU A 99 -41.871 11.906 -10.720 1.00 36.52 C ATOM 698 C LEU A 99 -43.337 12.365 -10.636 1.00 41.85 C ATOM 699 O LEU A 99 -43.756 12.945 -9.630 1.00 41.37 O ATOM 700 CB LEU A 99 -41.660 10.604 -9.927 1.00 36.95 C ATOM 701 CG LEU A 99 -40.425 9.776 -10.287 1.00 40.45 C ATOM 702 CD1 LEU A 99 -40.210 8.686 -9.264 1.00 40.09 C ATOM 703 CD2 LEU A 99 -40.590 9.128 -11.667 1.00 41.66 C ATOM 704 H LEU A 99 -41.096 13.164 -9.156 1.00 0.00 H ATOM 705 N LYS A 100 -44.092 12.166 -11.714 1.00 38.44 N ATOM 706 CA LYS A 100 -45.497 12.550 -11.766 1.00 37.73 C ATOM 707 C LYS A 100 -46.303 11.324 -12.165 1.00 43.56 C ATOM 708 O LYS A 100 -45.862 10.588 -13.055 1.00 41.60 O ATOM 709 CB LYS A 100 -45.696 13.657 -12.799 1.00 39.79 C ATOM 710 CG LYS A 100 -46.944 14.494 -12.595 1.00 46.89 C ATOM 711 CD LYS A 100 -47.306 15.213 -13.888 1.00 50.54 C ATOM 712 CE LYS A 100 -48.269 16.360 -13.712 1.00 49.61 C ATOM 713 NZ LYS A 100 -49.603 15.911 -13.239 1.00 64.98 N ATOM 714 HZ1 LYS A 100 -50.011 15.251 -13.932 1.00 0.00 H ATOM 715 HZ2 LYS A 100 -49.501 15.433 -12.321 1.00 0.00 H ATOM 716 HZ3 LYS A 100 -50.228 16.736 -13.134 1.00 0.00 H ATOM 717 H LYS A 100 -43.663 11.720 -12.550 1.00 0.00 H ATOM 718 N GLU A 101 -47.481 11.103 -11.520 1.00 40.55 N ATOM 719 CA GLU A 101 -48.385 10.001 -11.886 1.00 41.16 C ATOM 720 C GLU A 101 -48.781 10.311 -13.308 1.00 46.71 C ATOM 721 O GLU A 101 -49.451 11.312 -13.575 1.00 47.76 O ATOM 722 CB GLU A 101 -49.610 9.953 -10.948 1.00 42.57 C ATOM 723 H GLU A 101 -47.752 11.736 -10.740 1.00 0.00 H ATOM 724 N GLN A 102 -48.214 9.555 -14.242 1.00 42.57 N ATOM 725 CA GLN A 102 -48.373 9.826 -15.661 1.00 41.63 C ATOM 726 C GLN A 102 -47.966 8.583 -16.424 1.00 45.69 C ATOM 727 O GLN A 102 -46.988 7.921 -16.068 1.00 45.40 O ATOM 728 CB GLN A 102 -47.457 11.014 -16.041 1.00 42.35 C ATOM 729 CG GLN A 102 -47.483 11.451 -17.501 1.00 40.48 C ATOM 730 CD GLN A 102 -48.716 12.195 -17.920 1.00 57.12 C ATOM 731 OE1 GLN A 102 -49.276 13.012 -17.180 1.00 49.99 O ATOM 732 NE2 GLN A 102 -49.142 11.949 -19.149 1.00 49.47 N ATOM 733 HE22 GLN A 102 -48.645 11.254 -19.742 1.00 0.00 H ATOM 734 HE21 GLN A 102 -49.974 12.450 -19.521 1.00 0.00 H ATOM 735 H GLN A 102 -47.637 8.742 -13.948 1.00 0.00 H ATOM 736 N LYS A 103 -48.734 8.254 -17.445 1.00 42.82 N ATOM 737 CA LYS A 103 -48.459 7.108 -18.289 1.00 42.53 C ATOM 738 C LYS A 103 -47.626 7.667 -19.433 1.00 44.31 C ATOM 739 O LYS A 103 -48.040 8.641 -20.071 1.00 43.14 O ATOM 740 CB LYS A 103 -49.772 6.464 -18.783 1.00 44.77 C ATOM 741 H LYS A 103 -49.568 8.839 -17.652 1.00 0.00 H ATOM 742 N ILE A 104 -46.423 7.107 -19.657 1.00 39.51 N ATOM 743 CA ILE A 104 -45.533 7.585 -20.743 1.00 39.93 C ATOM 744 C ILE A 104 -46.249 7.614 -22.086 1.00 44.67 C ATOM 745 O ILE A 104 -46.022 8.517 -22.898 1.00 42.67 O ATOM 746 CB ILE A 104 -44.187 6.790 -20.801 1.00 43.07 C ATOM 747 CG1 ILE A 104 -43.127 7.573 -21.628 1.00 42.62 C ATOM 748 CG2 ILE A 104 -44.387 5.329 -21.318 1.00 44.30 C ATOM 749 CD1 ILE A 104 -41.747 7.031 -21.541 1.00 47.05 C ATOM 750 H ILE A 104 -46.110 6.320 -19.054 1.00 0.00 H ATOM 751 N MET A 105 -47.159 6.634 -22.293 1.00 43.00 N ATOM 752 CA MET A 105 -47.925 6.531 -23.517 1.00 43.64 C ATOM 753 C MET A 105 -48.853 7.730 -23.714 1.00 47.86 C ATOM 754 O MET A 105 -48.976 8.220 -24.836 1.00 47.84 O ATOM 755 CB MET A 105 -48.648 5.185 -23.590 1.00 46.04 C ATOM 756 CG MET A 105 -48.237 4.387 -24.809 1.00 49.07 C ATOM 757 SD MET A 105 -46.434 4.294 -25.045 1.00 51.72 S ATOM 758 CE MET A 105 -46.277 5.123 -26.574 1.00 46.81 C ATOM 759 H MET A 105 -47.314 5.928 -21.545 1.00 0.00 H ATOM 760 N ASP A 106 -49.396 8.271 -22.611 1.00 44.82 N ATOM 761 CA ASP A 106 -50.228 9.476 -22.634 1.00 43.85 C ATOM 762 C ASP A 106 -49.426 10.677 -23.129 1.00 47.76 C ATOM 763 O ASP A 106 -49.906 11.387 -24.000 1.00 48.89 O ATOM 764 CB ASP A 106 -50.868 9.718 -21.256 1.00 45.67 C ATOM 765 CG ASP A 106 -51.997 8.743 -20.950 1.00 54.56 C ATOM 766 OD1 ASP A 106 -52.326 7.912 -21.837 1.00 52.96 O ATOM 767 OD2 ASP A 106 -52.563 8.815 -19.832 1.00 59.11 O ATOM 768 H ASP A 106 -49.217 7.811 -21.695 1.00 0.00 H ATOM 769 N LEU A 107 -48.151 10.831 -22.670 1.00 42.01 N ATOM 770 CA LEU A 107 -47.244 11.908 -23.120 1.00 39.36 C ATOM 771 C LEU A 107 -46.907 11.784 -24.572 1.00 44.93 C ATOM 772 O LEU A 107 -46.882 12.793 -25.262 1.00 43.80 O ATOM 773 CB LEU A 107 -45.919 11.894 -22.346 1.00 37.85 C ATOM 774 CG LEU A 107 -45.939 12.203 -20.871 1.00 41.64 C ATOM 775 CD1 LEU A 107 -44.529 12.122 -20.321 1.00 40.28 C ATOM 776 CD2 LEU A 107 -46.495 13.583 -20.610 1.00 45.36 C ATOM 777 H LEU A 107 -47.797 10.153 -21.965 1.00 0.00 H ATOM 778 N TYR A 108 -46.526 10.557 -25.027 1.00 43.97 N ATOM 779 CA TYR A 108 -46.196 10.326 -26.437 1.00 44.97 C ATOM 780 C TYR A 108 -47.456 10.578 -27.273 1.00 49.16 C ATOM 781 O TYR A 108 -47.368 11.182 -28.344 1.00 47.53 O ATOM 782 CB TYR A 108 -45.667 8.890 -26.647 1.00 46.82 C ATOM 783 CG TYR A 108 -45.355 8.521 -28.088 1.00 49.92 C ATOM 784 CD1 TYR A 108 -44.248 9.055 -28.744 1.00 51.92 C ATOM 785 CD2 TYR A 108 -46.134 7.590 -28.774 1.00 51.14 C ATOM 786 CE1 TYR A 108 -43.926 8.676 -30.049 1.00 54.79 C ATOM 787 CE2 TYR A 108 -45.813 7.190 -30.071 1.00 52.41 C ATOM 788 CZ TYR A 108 -44.714 7.744 -30.711 1.00 64.26 C ATOM 789 OH TYR A 108 -44.409 7.370 -32.001 1.00 67.19 O ATOM 790 HH TYR A 108 -43.602 7.857 -32.302 1.00 0.00 H ATOM 791 H TYR A 108 -46.468 9.764 -24.357 1.00 0.00 H ATOM 792 N GLY A 109 -48.604 10.165 -26.721 1.00 47.82 N ATOM 793 CA GLY A 109 -49.932 10.330 -27.307 1.00 49.68 C ATOM 794 C GLY A 109 -50.466 11.751 -27.294 1.00 56.74 C ATOM 795 O GLY A 109 -51.535 12.008 -27.860 1.00 56.55 O ATOM 796 H GLY A 109 -48.545 9.687 -25.799 1.00 0.00 H ATOM 797 N GLN A 110 -49.751 12.687 -26.615 1.00 54.18 N ATOM 798 CA GLN A 110 -50.133 14.102 -26.582 1.00 53.78 C ATOM 799 C GLN A 110 -49.775 14.727 -27.954 1.00 56.44 C ATOM 800 O GLN A 110 -48.814 14.270 -28.561 1.00 54.01 O ATOM 801 CB GLN A 110 -49.404 14.824 -25.429 1.00 55.13 C ATOM 802 CG GLN A 110 -50.305 15.665 -24.505 1.00 65.88 C ATOM 803 CD GLN A 110 -51.433 14.992 -23.729 1.00 71.13 C ATOM 804 OE1 GLN A 110 -52.291 15.672 -23.183 1.00 73.23 O ATOM 805 NE2 GLN A 110 -51.488 13.670 -23.627 1.00 52.71 N ATOM 806 HE22 GLN A 110 -50.764 13.082 -24.087 1.00 0.00 H ATOM 807 HE21 GLN A 110 -52.255 13.222 -23.087 1.00 0.00 H ATOM 808 H GLN A 110 -48.899 12.387 -26.099 1.00 0.00 H ATOM 809 N PRO A 111 -50.515 15.752 -28.462 1.00 54.46 N ATOM 810 CA PRO A 111 -50.198 16.305 -29.797 1.00 54.35 C ATOM 811 C PRO A 111 -49.006 17.253 -29.914 1.00 58.45 C ATOM 812 O PRO A 111 -48.705 17.682 -31.027 1.00 59.61 O ATOM 813 CB PRO A 111 -51.490 17.045 -30.170 1.00 56.18 C ATOM 814 CG PRO A 111 -52.014 17.524 -28.866 1.00 59.99 C ATOM 815 CD PRO A 111 -51.736 16.382 -27.906 1.00 55.31 C ATOM 816 N GLU A 112 -48.379 17.643 -28.807 1.00 55.44 N ATOM 817 CA GLU A 112 -47.263 18.602 -28.842 1.00 56.02 C ATOM 818 C GLU A 112 -46.068 18.162 -27.943 1.00 57.35 C ATOM 819 O GLU A 112 -46.278 17.347 -27.036 1.00 57.23 O ATOM 820 CB GLU A 112 -47.775 20.010 -28.438 1.00 58.03 C ATOM 821 CG GLU A 112 -48.084 20.937 -29.608 1.00 70.94 C ATOM 822 CD GLU A 112 -49.519 21.434 -29.716 1.00 88.39 C ATOM 823 OE1 GLU A 112 -49.804 22.575 -29.274 1.00 47.08 O ATOM 824 OE2 GLU A 112 -50.355 20.680 -30.265 1.00 89.28 O ATOM 825 H GLU A 112 -48.686 17.259 -27.891 1.00 0.00 H ATOM 826 N PRO A 113 -44.820 18.663 -28.159 1.00 51.57 N ATOM 827 CA PRO A 113 -43.711 18.256 -27.263 1.00 51.50 C ATOM 828 C PRO A 113 -43.848 18.865 -25.858 1.00 51.80 C ATOM 829 O PRO A 113 -43.865 20.086 -25.707 1.00 52.41 O ATOM 830 CB PRO A 113 -42.450 18.731 -27.991 1.00 53.10 C ATOM 831 CG PRO A 113 -42.909 19.809 -28.900 1.00 57.39 C ATOM 832 CD PRO A 113 -44.371 19.639 -29.172 1.00 52.52 C ATOM 833 N VAL A 114 -43.971 18.003 -24.841 1.00 44.88 N ATOM 834 CA VAL A 114 -44.154 18.400 -23.445 1.00 41.56 C ATOM 835 C VAL A 114 -42.777 18.529 -22.800 1.00 41.75 C ATOM 836 O VAL A 114 -42.271 17.580 -22.187 1.00 38.39 O ATOM 837 CB VAL A 114 -45.088 17.434 -22.689 1.00 43.95 C ATOM 838 CG1 VAL A 114 -45.583 18.077 -21.403 1.00 42.66 C ATOM 839 CG2 VAL A 114 -46.269 16.994 -23.560 1.00 44.00 C ATOM 840 H VAL A 114 -43.934 16.986 -25.057 1.00 0.00 H ATOM 841 N LYS A 115 -42.191 19.736 -22.941 1.00 37.34 N ATOM 842 CA LYS A 115 -40.837 20.127 -22.553 1.00 36.10 C ATOM 843 C LYS A 115 -40.387 19.733 -21.139 1.00 37.94 C ATOM 844 O LYS A 115 -39.266 19.241 -21.041 1.00 35.37 O ATOM 845 CB LYS A 115 -40.611 21.620 -22.771 1.00 38.97 C ATOM 846 CG LYS A 115 -40.135 21.950 -24.182 1.00 48.51 C ATOM 847 CD LYS A 115 -39.779 23.426 -24.345 1.00 61.16 C ATOM 848 CE LYS A 115 -38.425 23.814 -23.777 1.00 70.10 C ATOM 849 NZ LYS A 115 -38.200 25.282 -23.849 1.00 76.74 N ATOM 850 HZ1 LYS A 115 -38.240 25.589 -24.842 1.00 0.00 H ATOM 851 HZ2 LYS A 115 -38.938 25.772 -23.303 1.00 0.00 H ATOM 852 HZ3 LYS A 115 -37.266 25.508 -23.452 1.00 0.00 H ATOM 853 H LYS A 115 -42.773 20.478 -23.379 1.00 0.00 H ATOM 854 N PRO A 116 -41.176 19.905 -20.045 1.00 34.59 N ATOM 855 CA PRO A 116 -40.666 19.487 -18.721 1.00 33.32 C ATOM 856 C PRO A 116 -40.303 18.012 -18.659 1.00 32.71 C ATOM 857 O PRO A 116 -39.414 17.665 -17.900 1.00 30.61 O ATOM 858 CB PRO A 116 -41.830 19.788 -17.771 1.00 35.18 C ATOM 859 CG PRO A 116 -42.657 20.795 -18.475 1.00 39.01 C ATOM 860 CD PRO A 116 -42.530 20.496 -19.930 1.00 35.51 C ATOM 861 N PHE A 117 -40.971 17.159 -19.467 1.00 29.61 N ATOM 862 CA PHE A 117 -40.788 15.702 -19.519 1.00 28.66 C ATOM 863 C PHE A 117 -39.684 15.189 -20.479 1.00 29.91 C ATOM 864 O PHE A 117 -39.374 13.996 -20.499 1.00 29.47 O ATOM 865 CB PHE A 117 -42.135 15.037 -19.892 1.00 30.98 C ATOM 866 CG PHE A 117 -43.201 15.081 -18.832 1.00 32.66 C ATOM 867 CD1 PHE A 117 -43.187 14.185 -17.770 1.00 35.73 C ATOM 868 CD2 PHE A 117 -44.256 15.969 -18.927 1.00 36.35 C ATOM 869 CE1 PHE A 117 -44.174 14.227 -16.784 1.00 36.82 C ATOM 870 CE2 PHE A 117 -45.266 15.976 -17.967 1.00 39.12 C ATOM 871 CZ PHE A 117 -45.204 15.124 -16.889 1.00 36.79 C ATOM 872 H PHE A 117 -41.678 17.571 -20.109 1.00 0.00 H ATOM 873 N LEU A 118 -39.111 16.077 -21.268 1.00 27.28 N ATOM 874 CA LEU A 118 -38.165 15.744 -22.312 1.00 26.38 C ATOM 875 C LEU A 118 -36.723 15.843 -21.885 1.00 28.39 C ATOM 876 O LEU A 118 -36.363 16.715 -21.097 1.00 27.06 O ATOM 877 CB LEU A 118 -38.407 16.619 -23.557 1.00 26.74 C ATOM 878 CG LEU A 118 -39.659 16.303 -24.421 1.00 33.97 C ATOM 879 CD1 LEU A 118 -39.828 17.363 -25.531 1.00 35.12 C ATOM 880 CD2 LEU A 118 -39.575 14.914 -25.067 1.00 34.54 C ATOM 881 H LEU A 118 -39.354 17.079 -21.132 1.00 0.00 H ATOM 882 N PHE A 119 -35.904 14.907 -22.394 1.00 24.04 N ATOM 883 CA PHE A 119 -34.474 14.839 -22.126 1.00 24.05 C ATOM 884 C PHE A 119 -33.769 14.521 -23.450 1.00 30.53 C ATOM 885 O PHE A 119 -34.235 13.648 -24.187 1.00 30.75 O ATOM 886 CB PHE A 119 -34.168 13.712 -21.105 1.00 25.42 C ATOM 887 CG PHE A 119 -34.809 13.927 -19.754 1.00 26.85 C ATOM 888 CD1 PHE A 119 -36.097 13.463 -19.494 1.00 30.40 C ATOM 889 CD2 PHE A 119 -34.154 14.641 -18.767 1.00 28.30 C ATOM 890 CE1 PHE A 119 -36.713 13.702 -18.262 1.00 31.04 C ATOM 891 CE2 PHE A 119 -34.774 14.891 -17.537 1.00 31.37 C ATOM 892 CZ PHE A 119 -36.038 14.395 -17.280 1.00 29.59 C ATOM 893 H PHE A 119 -36.317 14.186 -23.019 1.00 0.00 H ATOM 894 N TYR A 120 -32.663 15.194 -23.746 1.00 27.23 N ATOM 895 CA TYR A 120 -31.872 14.858 -24.941 1.00 27.52 C ATOM 896 C TYR A 120 -31.033 13.678 -24.525 1.00 30.60 C ATOM 897 O TYR A 120 -30.381 13.737 -23.476 1.00 30.11 O ATOM 898 CB TYR A 120 -30.923 15.986 -25.339 1.00 28.31 C ATOM 899 CG TYR A 120 -31.572 17.309 -25.663 1.00 31.86 C ATOM 900 CD1 TYR A 120 -32.393 17.452 -26.778 1.00 34.97 C ATOM 901 CD2 TYR A 120 -31.298 18.442 -24.902 1.00 33.03 C ATOM 902 CE1 TYR A 120 -32.960 18.683 -27.103 1.00 38.01 C ATOM 903 CE2 TYR A 120 -31.882 19.667 -25.197 1.00 35.02 C ATOM 904 CZ TYR A 120 -32.704 19.785 -26.306 1.00 44.71 C ATOM 905 OH TYR A 120 -33.257 20.996 -26.602 1.00 50.77 O ATOM 906 HH TYR A 120 -33.821 21.294 -25.845 1.00 0.00 H ATOM 907 H TYR A 120 -32.352 15.968 -23.125 1.00 0.00 H ATOM 908 N ARG A 121 -31.071 12.601 -25.303 1.00 25.15 N ATOM 909 CA ARG A 121 -30.333 11.386 -24.981 1.00 24.13 C ATOM 910 C ARG A 121 -29.122 11.386 -25.894 1.00 27.19 C ATOM 911 O ARG A 121 -29.274 11.295 -27.117 1.00 27.47 O ATOM 912 CB ARG A 121 -31.251 10.177 -25.239 1.00 24.96 C ATOM 913 CG ARG A 121 -30.743 8.842 -24.721 1.00 32.73 C ATOM 914 CD ARG A 121 -29.754 8.190 -25.655 1.00 34.08 C ATOM 915 NE ARG A 121 -30.335 7.805 -26.939 1.00 33.40 N ATOM 916 CZ ARG A 121 -30.009 6.698 -27.595 1.00 39.01 C ATOM 917 NH1 ARG A 121 -29.138 5.848 -27.078 1.00 25.40 N ATOM 918 NH2 ARG A 121 -30.582 6.416 -28.758 1.00 30.42 N ATOM 919 HE ARG A 121 -31.045 8.435 -27.364 1.00 0.00 H ATOM 920 HH12 ARG A 121 -28.886 4.982 -27.596 1.00 0.00 H ATOM 921 HH11 ARG A 121 -28.705 6.045 -26.153 1.00 0.00 H ATOM 922 HH22 ARG A 121 -30.323 5.547 -29.268 1.00 0.00 H ATOM 923 HH21 ARG A 121 -31.290 7.064 -29.159 1.00 0.00 H ATOM 924 H ARG A 121 -31.646 12.626 -26.169 1.00 0.00 H ATOM 925 N ALA A 122 -27.928 11.556 -25.311 1.00 22.01 N ATOM 926 CA ALA A 122 -26.706 11.678 -26.094 1.00 22.61 C ATOM 927 C ALA A 122 -25.896 10.436 -25.933 1.00 27.39 C ATOM 928 O ALA A 122 -25.252 10.211 -24.896 1.00 26.11 O ATOM 929 CB ALA A 122 -25.909 12.912 -25.652 1.00 23.50 C ATOM 930 H ALA A 122 -27.872 11.602 -24.274 1.00 0.00 H ATOM 931 N LYS A 123 -25.927 9.620 -26.985 1.00 24.63 N ATOM 932 CA LYS A 123 -25.259 8.331 -27.030 1.00 25.51 C ATOM 933 C LYS A 123 -23.761 8.424 -27.288 1.00 30.01 C ATOM 934 O LYS A 123 -23.336 9.134 -28.202 1.00 28.73 O ATOM 935 CB LYS A 123 -25.908 7.506 -28.160 1.00 28.86 C ATOM 936 CG LYS A 123 -25.433 6.060 -28.246 1.00 28.56 C ATOM 937 CD LYS A 123 -26.260 5.332 -29.315 1.00 27.83 C ATOM 938 CE LYS A 123 -25.814 3.897 -29.511 1.00 31.34 C ATOM 939 NZ LYS A 123 -26.108 3.064 -28.319 1.00 43.39 N ATOM 940 HZ1 LYS A 123 -25.609 3.453 -27.494 1.00 0.00 H ATOM 941 HZ2 LYS A 123 -27.132 3.068 -28.139 1.00 0.00 H ATOM 942 HZ3 LYS A 123 -25.789 2.089 -28.491 1.00 0.00 H ATOM 943 H LYS A 123 -26.461 9.924 -27.824 1.00 0.00 H ATOM 944 N THR A 124 -22.979 7.665 -26.508 1.00 26.99 N ATOM 945 CA THR A 124 -21.546 7.411 -26.698 1.00 28.43 C ATOM 946 C THR A 124 -21.386 5.901 -26.430 1.00 33.84 C ATOM 947 O THR A 124 -21.253 5.481 -25.282 1.00 32.01 O ATOM 948 CB THR A 124 -20.623 8.236 -25.778 1.00 30.81 C ATOM 949 OG1 THR A 124 -20.861 9.610 -26.011 1.00 31.50 O ATOM 950 CG2 THR A 124 -19.124 7.918 -26.030 1.00 29.84 C ATOM 951 HG1 THR A 124 -20.273 10.150 -25.425 1.00 0.00 H ATOM 952 H THR A 124 -23.432 7.212 -25.688 1.00 0.00 H ATOM 953 N GLY A 125 -21.491 5.110 -27.482 1.00 30.80 N ATOM 954 CA GLY A 125 -21.363 3.660 -27.378 1.00 30.88 C ATOM 955 C GLY A 125 -22.516 3.039 -26.623 1.00 34.50 C ATOM 956 O GLY A 125 -23.684 3.415 -26.823 1.00 31.96 O ATOM 957 H GLY A 125 -21.671 5.534 -28.415 1.00 0.00 H ATOM 958 N ARG A 126 -22.172 2.165 -25.661 1.00 32.15 N ATOM 959 CA ARG A 126 -23.162 1.465 -24.852 1.00 33.54 C ATOM 960 C ARG A 126 -23.876 2.382 -23.860 1.00 37.24 C ATOM 961 O ARG A 126 -24.910 1.987 -23.334 1.00 37.95 O ATOM 962 CB ARG A 126 -22.525 0.299 -24.060 1.00 39.07 C ATOM 963 CG ARG A 126 -21.482 -0.541 -24.802 1.00 60.53 C ATOM 964 CD ARG A 126 -20.676 -1.408 -23.837 1.00 78.24 C ATOM 965 NE ARG A 126 -20.288 -0.674 -22.626 1.00 90.80 N ATOM 966 CZ ARG A 126 -19.151 -0.003 -22.480 1.00103.68 C ATOM 967 NH1 ARG A 126 -18.249 0.010 -23.453 1.00 89.76 N ATOM 968 NH2 ARG A 126 -18.898 0.645 -21.349 1.00 88.08 N ATOM 969 HE ARG A 126 -20.951 -0.680 -21.825 1.00 0.00 H ATOM 970 HH12 ARG A 126 -17.361 0.538 -23.332 1.00 0.00 H ATOM 971 HH11 ARG A 126 -18.430 -0.507 -24.337 1.00 0.00 H ATOM 972 HH22 ARG A 126 -18.007 1.169 -21.238 1.00 0.00 H ATOM 973 HH21 ARG A 126 -19.591 0.628 -20.574 1.00 0.00 H ATOM 974 H ARG A 126 -21.163 1.982 -25.488 1.00 0.00 H ATOM 975 N THR A 127 -23.289 3.543 -23.513 1.00 31.49 N ATOM 976 CA THR A 127 -23.929 4.451 -22.553 1.00 29.78 C ATOM 977 C THR A 127 -24.445 5.746 -23.220 1.00 30.43 C ATOM 978 O THR A 127 -24.083 6.071 -24.369 1.00 27.94 O ATOM 979 CB THR A 127 -22.993 4.755 -21.384 1.00 38.63 C ATOM 980 OG1 THR A 127 -21.777 5.306 -21.893 1.00 32.72 O ATOM 981 CG2 THR A 127 -22.669 3.517 -20.544 1.00 41.20 C ATOM 982 HG1 THR A 127 -21.166 5.505 -21.140 1.00 0.00 H ATOM 983 H THR A 127 -22.371 3.800 -23.930 1.00 0.00 H ATOM 984 N SER A 128 -25.327 6.456 -22.494 1.00 25.17 N ATOM 985 CA SER A 128 -25.866 7.745 -22.907 1.00 24.69 C ATOM 986 C SER A 128 -26.009 8.669 -21.710 1.00 27.51 C ATOM 987 O SER A 128 -26.213 8.194 -20.602 1.00 28.02 O ATOM 988 CB SER A 128 -27.235 7.557 -23.536 1.00 26.55 C ATOM 989 OG SER A 128 -27.210 6.570 -24.556 1.00 31.26 O ATOM 990 HG SER A 128 -26.921 5.705 -24.170 1.00 0.00 H ATOM 991 H SER A 128 -25.643 6.062 -21.585 1.00 0.00 H ATOM 992 N THR A 129 -25.963 9.972 -21.946 1.00 24.55 N ATOM 993 CA THR A 129 -26.241 10.996 -20.935 1.00 24.56 C ATOM 994 C THR A 129 -27.672 11.481 -21.198 1.00 27.43 C ATOM 995 O THR A 129 -28.189 11.333 -22.298 1.00 27.00 O ATOM 996 CB THR A 129 -25.225 12.136 -21.009 1.00 28.17 C ATOM 997 OG1 THR A 129 -25.333 12.771 -22.288 1.00 28.09 O ATOM 998 CG2 THR A 129 -23.787 11.673 -20.745 1.00 28.67 C ATOM 999 HG1 THR A 129 -26.249 13.130 -22.401 1.00 0.00 H ATOM 1000 H THR A 129 -25.715 10.287 -22.906 1.00 0.00 H ATOM 1001 N LEU A 130 -28.315 12.048 -20.198 1.00 23.07 N ATOM 1002 CA LEU A 130 -29.690 12.512 -20.295 1.00 22.35 C ATOM 1003 C LEU A 130 -29.722 13.955 -19.846 1.00 28.20 C ATOM 1004 O LEU A 130 -29.558 14.234 -18.664 1.00 28.94 O ATOM 1005 CB LEU A 130 -30.570 11.622 -19.401 1.00 22.15 C ATOM 1006 CG LEU A 130 -30.701 10.162 -19.875 1.00 26.88 C ATOM 1007 CD1 LEU A 130 -31.262 9.285 -18.782 1.00 26.29 C ATOM 1008 CD2 LEU A 130 -31.560 10.073 -21.161 1.00 26.76 C ATOM 1009 H LEU A 130 -27.815 12.170 -19.294 1.00 0.00 H ATOM 1010 N GLU A 131 -29.883 14.874 -20.791 1.00 25.70 N ATOM 1011 CA GLU A 131 -29.847 16.319 -20.504 1.00 25.46 C ATOM 1012 C GLU A 131 -31.251 16.857 -20.478 1.00 30.88 C ATOM 1013 O GLU A 131 -31.988 16.627 -21.435 1.00 30.27 O ATOM 1014 CB GLU A 131 -29.099 17.046 -21.639 1.00 25.70 C ATOM 1015 CG GLU A 131 -28.903 18.546 -21.412 1.00 29.18 C ATOM 1016 CD GLU A 131 -28.223 19.224 -22.583 1.00 47.89 C ATOM 1017 OE1 GLU A 131 -28.147 18.609 -23.672 1.00 38.04 O ATOM 1018 OE2 GLU A 131 -27.763 20.374 -22.413 1.00 37.93 O ATOM 1019 H GLU A 131 -30.040 14.562 -21.771 1.00 0.00 H ATOM 1020 N SER A 132 -31.605 17.632 -19.441 1.00 27.16 N ATOM 1021 CA SER A 132 -32.924 18.249 -19.376 1.00 27.15 C ATOM 1022 C SER A 132 -33.091 19.183 -20.565 1.00 33.40 C ATOM 1023 O SER A 132 -32.211 20.005 -20.826 1.00 35.08 O ATOM 1024 CB SER A 132 -33.085 19.066 -18.090 1.00 27.18 C ATOM 1025 OG SER A 132 -34.338 19.733 -18.107 1.00 33.11 O ATOM 1026 HG SER A 132 -35.066 19.064 -18.167 1.00 0.00 H ATOM 1027 H SER A 132 -30.926 17.795 -18.670 1.00 0.00 H ATOM 1028 N VAL A 133 -34.189 19.042 -21.298 1.00 29.58 N ATOM 1029 CA VAL A 133 -34.535 19.953 -22.389 1.00 30.52 C ATOM 1030 C VAL A 133 -34.948 21.356 -21.800 1.00 35.36 C ATOM 1031 O VAL A 133 -34.611 22.395 -22.365 1.00 35.77 O ATOM 1032 CB VAL A 133 -35.638 19.307 -23.277 1.00 33.42 C ATOM 1033 CG1 VAL A 133 -36.309 20.322 -24.190 1.00 34.59 C ATOM 1034 CG2 VAL A 133 -35.076 18.135 -24.084 1.00 32.24 C ATOM 1035 H VAL A 133 -34.830 18.251 -21.088 1.00 0.00 H ATOM 1036 N ALA A 134 -35.653 21.364 -20.673 1.00 33.24 N ATOM 1037 CA ALA A 134 -36.089 22.584 -19.981 1.00 34.29 C ATOM 1038 C ALA A 134 -34.883 23.301 -19.300 1.00 36.84 C ATOM 1039 O ALA A 134 -34.843 24.538 -19.214 1.00 35.75 O ATOM 1040 CB ALA A 134 -37.141 22.224 -18.923 1.00 34.62 C ATOM 1041 H ALA A 134 -35.912 20.448 -20.255 1.00 0.00 H ATOM 1042 N PHE A 135 -33.909 22.507 -18.814 1.00 31.00 N ATOM 1043 CA PHE A 135 -32.732 23.004 -18.099 1.00 29.40 C ATOM 1044 C PHE A 135 -31.426 22.401 -18.718 1.00 33.51 C ATOM 1045 O PHE A 135 -30.796 21.518 -18.122 1.00 31.37 O ATOM 1046 CB PHE A 135 -32.907 22.653 -16.608 1.00 29.96 C ATOM 1047 CG PHE A 135 -34.146 23.299 -15.995 1.00 31.04 C ATOM 1048 CD1 PHE A 135 -34.120 24.624 -15.567 1.00 33.63 C ATOM 1049 CD2 PHE A 135 -35.308 22.562 -15.793 1.00 31.10 C ATOM 1050 CE1 PHE A 135 -35.255 25.210 -14.982 1.00 35.33 C ATOM 1051 CE2 PHE A 135 -36.455 23.154 -15.239 1.00 34.82 C ATOM 1052 CZ PHE A 135 -36.419 24.466 -14.825 1.00 33.97 C ATOM 1053 H PHE A 135 -33.999 21.481 -18.955 1.00 0.00 H ATOM 1054 N PRO A 136 -31.041 22.847 -19.934 1.00 32.95 N ATOM 1055 CA PRO A 136 -29.883 22.236 -20.627 1.00 33.65 C ATOM 1056 C PRO A 136 -28.539 22.201 -19.864 1.00 37.52 C ATOM 1057 O PRO A 136 -27.698 21.379 -20.197 1.00 36.29 O ATOM 1058 CB PRO A 136 -29.788 23.039 -21.937 1.00 35.83 C ATOM 1059 CG PRO A 136 -31.202 23.491 -22.179 1.00 40.46 C ATOM 1060 CD PRO A 136 -31.706 23.843 -20.799 1.00 35.36 C ATOM 1061 N ASP A 137 -28.338 23.014 -18.820 1.00 34.44 N ATOM 1062 CA ASP A 137 -27.081 22.870 -18.074 1.00 33.84 C ATOM 1063 C ASP A 137 -27.144 21.681 -17.104 1.00 34.81 C ATOM 1064 O ASP A 137 -26.132 21.350 -16.504 1.00 34.81 O ATOM 1065 CB ASP A 137 -26.703 24.159 -17.314 1.00 35.59 C ATOM 1066 CG ASP A 137 -25.221 24.184 -16.951 1.00 54.41 C ATOM 1067 OD1 ASP A 137 -24.391 24.437 -17.856 1.00 56.40 O ATOM 1068 OD2 ASP A 137 -24.891 23.913 -15.768 1.00 56.80 O ATOM 1069 H ASP A 137 -29.048 23.723 -18.546 1.00 0.00 H ATOM 1070 N TRP A 138 -28.332 21.066 -16.910 1.00 29.88 N ATOM 1071 CA TRP A 138 -28.465 19.948 -15.961 1.00 28.43 C ATOM 1072 C TRP A 138 -28.683 18.609 -16.632 1.00 28.86 C ATOM 1073 O TRP A 138 -29.377 18.502 -17.632 1.00 25.87 O ATOM 1074 CB TRP A 138 -29.556 20.172 -14.910 1.00 27.11 C ATOM 1075 CG TRP A 138 -29.234 21.178 -13.831 1.00 27.49 C ATOM 1076 CD1 TRP A 138 -28.955 20.916 -12.519 1.00 29.79 C ATOM 1077 CD2 TRP A 138 -29.299 22.598 -13.953 1.00 26.86 C ATOM 1078 NE1 TRP A 138 -28.857 22.095 -11.814 1.00 29.38 N ATOM 1079 CE2 TRP A 138 -28.989 23.144 -12.684 1.00 29.70 C ATOM 1080 CE3 TRP A 138 -29.511 23.473 -15.034 1.00 27.74 C ATOM 1081 CZ2 TRP A 138 -28.955 24.516 -12.451 1.00 27.58 C ATOM 1082 CZ3 TRP A 138 -29.452 24.837 -14.803 1.00 28.25 C ATOM 1083 CH2 TRP A 138 -29.218 25.348 -13.520 1.00 28.42 C ATOM 1084 HE1 TRP A 138 -28.707 22.175 -10.788 1.00 0.00 H ATOM 1085 H TRP A 138 -29.167 21.388 -17.440 1.00 0.00 H ATOM 1086 N PHE A 139 -28.118 17.580 -16.011 1.00 27.37 N ATOM 1087 CA PHE A 139 -28.137 16.226 -16.512 1.00 26.92 C ATOM 1088 C PHE A 139 -28.620 15.325 -15.436 1.00 29.74 C ATOM 1089 O PHE A 139 -28.343 15.573 -14.257 1.00 29.42 O ATOM 1090 CB PHE A 139 -26.705 15.808 -16.921 1.00 28.07 C ATOM 1091 CG PHE A 139 -26.224 16.483 -18.188 1.00 29.28 C ATOM 1092 CD1 PHE A 139 -25.740 17.785 -18.162 1.00 31.76 C ATOM 1093 CD2 PHE A 139 -26.255 15.816 -19.400 1.00 29.81 C ATOM 1094 CE1 PHE A 139 -25.291 18.403 -19.327 1.00 32.59 C ATOM 1095 CE2 PHE A 139 -25.814 16.433 -20.566 1.00 33.00 C ATOM 1096 CZ PHE A 139 -25.347 17.725 -20.527 1.00 31.85 C ATOM 1097 H PHE A 139 -27.632 17.760 -15.109 1.00 0.00 H ATOM 1098 N ILE A 140 -29.292 14.239 -15.829 1.00 25.60 N ATOM 1099 CA ILE A 140 -29.700 13.239 -14.828 1.00 24.01 C ATOM 1100 C ILE A 140 -28.392 12.599 -14.329 1.00 28.23 C ATOM 1101 O ILE A 140 -27.508 12.264 -15.137 1.00 24.75 O ATOM 1102 CB ILE A 140 -30.675 12.195 -15.408 1.00 26.17 C ATOM 1103 CG1 ILE A 140 -31.981 12.893 -15.889 1.00 25.09 C ATOM 1104 CG2 ILE A 140 -30.958 11.075 -14.360 1.00 27.14 C ATOM 1105 CD1 ILE A 140 -33.052 11.992 -16.415 1.00 29.77 C ATOM 1106 H ILE A 140 -29.525 14.101 -16.833 1.00 0.00 H ATOM 1107 N ALA A 141 -28.277 12.445 -13.000 1.00 26.31 N ATOM 1108 CA ALA A 141 -27.126 11.837 -12.368 1.00 27.65 C ATOM 1109 C ALA A 141 -27.469 10.992 -11.158 1.00 33.28 C ATOM 1110 O ALA A 141 -28.426 11.282 -10.450 1.00 32.47 O ATOM 1111 CB ALA A 141 -26.152 12.917 -11.935 1.00 29.00 C ATOM 1112 H ALA A 141 -29.054 12.779 -12.395 1.00 0.00 H ATOM 1113 N SER A 142 -26.621 9.994 -10.891 1.00 30.67 N ATOM 1114 CA SER A 142 -26.645 9.184 -9.687 1.00 30.59 C ATOM 1115 C SER A 142 -25.336 9.570 -8.982 1.00 36.34 C ATOM 1116 O SER A 142 -24.512 10.297 -9.556 1.00 37.04 O ATOM 1117 CB SER A 142 -26.643 7.689 -10.037 1.00 31.60 C ATOM 1118 OG SER A 142 -25.436 7.273 -10.661 1.00 38.83 O ATOM 1119 HG SER A 142 -25.487 6.306 -10.864 1.00 0.00 H ATOM 1120 H SER A 142 -25.889 9.782 -11.599 1.00 0.00 H ATOM 1121 N SER A 143 -25.129 9.094 -7.760 1.00 34.27 N ATOM 1122 CA SER A 143 -23.862 9.303 -7.063 1.00 35.66 C ATOM 1123 C SER A 143 -23.477 8.028 -6.297 1.00 41.88 C ATOM 1124 O SER A 143 -23.422 6.956 -6.910 1.00 41.43 O ATOM 1125 CB SER A 143 -23.888 10.568 -6.199 1.00 39.11 C ATOM 1126 OG SER A 143 -24.798 10.438 -5.125 1.00 41.34 O ATOM 1127 HG SER A 143 -25.708 10.281 -5.482 1.00 0.00 H ATOM 1128 H SER A 143 -25.886 8.560 -7.288 1.00 0.00 H ATOM 1129 N LYS A 144 -23.257 8.127 -4.974 1.00 42.30 N ATOM 1130 CA LYS A 144 -22.897 7.014 -4.082 1.00 43.28 C ATOM 1131 C LYS A 144 -24.045 6.022 -3.923 1.00 46.89 C ATOM 1132 O LYS A 144 -25.187 6.330 -4.285 1.00 46.05 O ATOM 1133 CB LYS A 144 -22.444 7.546 -2.712 1.00 46.86 C ATOM 1134 H LYS A 144 -23.349 9.070 -4.545 1.00 0.00 H ATOM 1135 N ARG A 145 -23.730 4.810 -3.420 1.00 43.29 N ATOM 1136 CA ARG A 145 -24.692 3.720 -3.215 1.00 42.85 C ATOM 1137 C ARG A 145 -25.945 4.204 -2.474 1.00 44.38 C ATOM 1138 O ARG A 145 -25.833 4.954 -1.503 1.00 44.04 O ATOM 1139 CB ARG A 145 -23.997 2.556 -2.472 1.00 45.12 C ATOM 1140 CG ARG A 145 -24.832 1.303 -2.356 1.00 57.04 C ATOM 1141 CD ARG A 145 -24.002 0.151 -1.825 1.00 67.39 C ATOM 1142 NE ARG A 145 -24.847 -0.977 -1.421 1.00 64.81 N ATOM 1143 CZ ARG A 145 -24.394 -2.194 -1.135 1.00 72.04 C ATOM 1144 NH1 ARG A 145 -23.095 -2.458 -1.194 1.00 55.35 N ATOM 1145 NH2 ARG A 145 -25.235 -3.156 -0.783 1.00 59.23 N ATOM 1146 HE ARG A 145 -25.872 -0.814 -1.353 1.00 0.00 H ATOM 1147 HH12 ARG A 145 -22.748 -3.412 -0.969 1.00 0.00 H ATOM 1148 HH11 ARG A 145 -22.424 -1.711 -1.465 1.00 0.00 H ATOM 1149 HH22 ARG A 145 -24.875 -4.106 -0.560 1.00 0.00 H ATOM 1150 HH21 ARG A 145 -26.255 -2.961 -0.729 1.00 0.00 H ATOM 1151 H ARG A 145 -22.738 4.636 -3.160 1.00 0.00 H ATOM 1152 N ASP A 146 -27.125 3.838 -2.994 1.00 40.20 N ATOM 1153 CA ASP A 146 -28.456 4.172 -2.467 1.00 40.87 C ATOM 1154 C ASP A 146 -28.759 5.698 -2.441 1.00 44.78 C ATOM 1155 O ASP A 146 -29.746 6.109 -1.838 1.00 44.66 O ATOM 1156 CB ASP A 146 -28.718 3.514 -1.075 1.00 43.22 C ATOM 1157 CG ASP A 146 -30.204 3.436 -0.751 1.00 50.25 C ATOM 1158 OD1 ASP A 146 -30.922 2.682 -1.433 1.00 47.67 O ATOM 1159 OD2 ASP A 146 -30.657 4.186 0.130 1.00 57.12 O ATOM 1160 H ASP A 146 -27.096 3.259 -3.858 1.00 0.00 H ATOM 1161 N GLN A 147 -27.966 6.529 -3.137 1.00 39.98 N ATOM 1162 CA GLN A 147 -28.275 7.956 -3.169 1.00 38.47 C ATOM 1163 C GLN A 147 -29.320 8.272 -4.263 1.00 40.98 C ATOM 1164 O GLN A 147 -29.436 7.514 -5.226 1.00 38.82 O ATOM 1165 CB GLN A 147 -27.010 8.826 -3.253 1.00 39.27 C ATOM 1166 CG GLN A 147 -26.096 8.713 -2.019 1.00 53.53 C ATOM 1167 CD GLN A 147 -26.850 8.619 -0.701 1.00 72.92 C ATOM 1168 OE1 GLN A 147 -26.833 7.585 -0.013 1.00 66.52 O ATOM 1169 NE2 GLN A 147 -27.553 9.684 -0.335 1.00 60.23 N ATOM 1170 HE22 GLN A 147 -27.551 10.538 -0.929 1.00 0.00 H ATOM 1171 HE21 GLN A 147 -28.106 9.665 0.546 1.00 0.00 H ATOM 1172 H GLN A 147 -27.139 6.160 -3.649 1.00 0.00 H ATOM 1173 N PRO A 148 -30.155 9.324 -4.099 1.00 37.81 N ATOM 1174 CA PRO A 148 -31.188 9.577 -5.108 1.00 37.38 C ATOM 1175 C PRO A 148 -30.660 9.930 -6.490 1.00 38.64 C ATOM 1176 O PRO A 148 -29.546 10.414 -6.632 1.00 39.15 O ATOM 1177 CB PRO A 148 -32.023 10.715 -4.494 1.00 39.50 C ATOM 1178 CG PRO A 148 -31.089 11.418 -3.564 1.00 44.66 C ATOM 1179 CD PRO A 148 -30.214 10.316 -2.999 1.00 40.02 C ATOM 1180 N ILE A 149 -31.486 9.699 -7.505 1.00 34.32 N ATOM 1181 CA ILE A 149 -31.208 10.094 -8.885 1.00 33.73 C ATOM 1182 C ILE A 149 -31.660 11.553 -8.902 1.00 35.80 C ATOM 1183 O ILE A 149 -32.772 11.851 -8.457 1.00 35.22 O ATOM 1184 CB ILE A 149 -31.989 9.187 -9.873 1.00 36.05 C ATOM 1185 CG1 ILE A 149 -31.591 7.696 -9.738 1.00 36.33 C ATOM 1186 CG2 ILE A 149 -31.892 9.679 -11.318 1.00 38.50 C ATOM 1187 CD1 ILE A 149 -30.134 7.351 -9.882 1.00 39.08 C ATOM 1188 H ILE A 149 -32.382 9.209 -7.306 1.00 0.00 H ATOM 1189 N ILE A 150 -30.773 12.469 -9.313 1.00 30.17 N ATOM 1190 CA ILE A 150 -31.049 13.905 -9.267 1.00 29.43 C ATOM 1191 C ILE A 150 -30.720 14.552 -10.597 1.00 32.52 C ATOM 1192 O ILE A 150 -30.298 13.862 -11.527 1.00 31.95 O ATOM 1193 CB ILE A 150 -30.186 14.568 -8.130 1.00 32.89 C ATOM 1194 CG1 ILE A 150 -28.647 14.421 -8.394 1.00 34.38 C ATOM 1195 CG2 ILE A 150 -30.577 14.035 -6.712 1.00 32.83 C ATOM 1196 CD1 ILE A 150 -27.766 15.613 -7.824 1.00 40.30 C ATOM 1197 H ILE A 150 -29.854 12.147 -9.678 1.00 0.00 H ATOM 1198 N LEU A 151 -30.895 15.873 -10.669 1.00 27.84 N ATOM 1199 CA LEU A 151 -30.439 16.689 -11.791 1.00 28.61 C ATOM 1200 C LEU A 151 -29.149 17.339 -11.287 1.00 32.60 C ATOM 1201 O LEU A 151 -29.136 17.808 -10.160 1.00 30.38 O ATOM 1202 CB LEU A 151 -31.421 17.796 -12.128 1.00 28.21 C ATOM 1203 CG LEU A 151 -32.546 17.449 -13.090 1.00 33.05 C ATOM 1204 CD1 LEU A 151 -33.350 18.671 -13.394 1.00 33.05 C ATOM 1205 CD2 LEU A 151 -32.030 16.842 -14.405 1.00 34.45 C ATOM 1206 H LEU A 151 -31.383 16.348 -9.883 1.00 0.00 H ATOM 1207 N THR A 152 -28.058 17.296 -12.066 1.00 29.16 N ATOM 1208 CA THR A 152 -26.773 17.902 -11.651 1.00 28.60 C ATOM 1209 C THR A 152 -26.235 18.814 -12.735 1.00 31.96 C ATOM 1210 O THR A 152 -26.423 18.550 -13.921 1.00 31.38 O ATOM 1211 CB THR A 152 -25.726 16.812 -11.300 1.00 35.84 C ATOM 1212 OG1 THR A 152 -24.563 17.438 -10.742 1.00 35.96 O ATOM 1213 CG2 THR A 152 -25.291 15.989 -12.520 1.00 33.85 C ATOM 1214 HG1 THR A 152 -23.893 16.745 -10.517 1.00 0.00 H ATOM 1215 H THR A 152 -28.117 16.822 -12.990 1.00 0.00 H ATOM 1216 N SER A 153 -25.541 19.867 -12.320 1.00 30.53 N ATOM 1217 CA SER A 153 -24.871 20.809 -13.209 1.00 30.49 C ATOM 1218 C SER A 153 -23.381 20.510 -13.072 1.00 35.23 C ATOM 1219 O SER A 153 -22.567 21.106 -13.775 1.00 35.28 O ATOM 1220 CB SER A 153 -25.149 22.246 -12.766 1.00 35.19 C ATOM 1221 OG SER A 153 -24.750 22.501 -11.420 1.00 37.14 O ATOM 1222 HG SER A 153 -24.953 23.442 -11.189 1.00 0.00 H ATOM 1223 H SER A 153 -25.471 20.031 -11.295 1.00 0.00 H ATOM 1224 N GLU A 154 -23.029 19.558 -12.176 1.00 32.53 N ATOM 1225 CA GLU A 154 -21.644 19.178 -11.878 1.00 32.73 C ATOM 1226 C GLU A 154 -21.260 17.825 -12.457 1.00 38.65 C ATOM 1227 O GLU A 154 -21.744 16.777 -12.014 1.00 37.35 O ATOM 1228 CB GLU A 154 -21.424 19.229 -10.377 1.00 34.43 C ATOM 1229 CG GLU A 154 -21.693 20.618 -9.849 1.00 41.72 C ATOM 1230 CD GLU A 154 -21.873 20.762 -8.364 1.00 49.53 C ATOM 1231 OE1 GLU A 154 -22.086 21.919 -7.949 1.00 35.70 O ATOM 1232 OE2 GLU A 154 -21.795 19.756 -7.618 1.00 43.91 O ATOM 1233 H GLU A 154 -23.789 19.064 -11.666 1.00 0.00 H ATOM 1234 N LEU A 155 -20.393 17.858 -13.462 1.00 38.35 N ATOM 1235 CA LEU A 155 -19.981 16.688 -14.246 1.00 39.81 C ATOM 1236 C LEU A 155 -18.581 16.178 -14.024 1.00 46.36 C ATOM 1237 O LEU A 155 -17.656 16.960 -13.789 1.00 45.94 O ATOM 1238 CB LEU A 155 -20.127 17.025 -15.747 1.00 39.62 C ATOM 1239 CG LEU A 155 -21.372 17.830 -16.111 1.00 44.26 C ATOM 1240 CD1 LEU A 155 -21.243 18.466 -17.498 1.00 45.36 C ATOM 1241 CD2 LEU A 155 -22.653 16.989 -15.943 1.00 44.21 C ATOM 1242 H LEU A 155 -19.977 18.778 -13.711 1.00 0.00 H ATOM 1243 N GLY A 156 -18.439 14.864 -14.212 1.00 44.33 N ATOM 1244 CA GLY A 156 -17.170 14.155 -14.209 1.00 44.20 C ATOM 1245 C GLY A 156 -16.515 13.807 -12.895 1.00 47.73 C ATOM 1246 O GLY A 156 -15.371 13.343 -12.915 1.00 48.81 O ATOM 1247 H GLY A 156 -19.301 14.305 -14.373 1.00 0.00 H ATOM 1248 N LYS A 157 -17.193 13.990 -11.748 1.00 42.32 N ATOM 1249 CA LYS A 157 -16.533 13.642 -10.483 1.00 41.72 C ATOM 1250 C LYS A 157 -17.364 12.648 -9.645 1.00 45.27 C ATOM 1251 O LYS A 157 -17.493 11.485 -10.049 1.00 44.92 O ATOM 1252 CB LYS A 157 -16.133 14.909 -9.699 1.00 43.96 C ATOM 1253 CG LYS A 157 -14.926 15.622 -10.297 1.00 48.90 C ATOM 1254 CD LYS A 157 -14.380 16.679 -9.369 1.00 51.55 C ATOM 1255 CE LYS A 157 -13.026 17.169 -9.832 1.00 63.96 C ATOM 1256 NZ LYS A 157 -13.135 18.139 -10.953 1.00 74.53 N ATOM 1257 HZ1 LYS A 157 -13.608 17.683 -11.759 1.00 0.00 H ATOM 1258 HZ2 LYS A 157 -13.690 18.963 -10.644 1.00 0.00 H ATOM 1259 HZ3 LYS A 157 -12.183 18.447 -11.237 1.00 0.00 H ATOM 1260 H LYS A 157 -18.161 14.369 -11.757 1.00 0.00 H ATOM 1261 N SER A 158 -17.931 13.104 -8.509 1.00 40.68 N ATOM 1262 CA SER A 158 -18.802 12.304 -7.629 1.00 40.64 C ATOM 1263 C SER A 158 -20.113 11.869 -8.365 1.00 39.05 C ATOM 1264 O SER A 158 -20.654 10.807 -8.068 1.00 38.91 O ATOM 1265 CB SER A 158 -19.136 13.109 -6.377 1.00 45.64 C ATOM 1266 OG SER A 158 -20.056 12.447 -5.522 1.00 65.67 O ATOM 1267 HG SER A 158 -20.901 12.285 -6.011 1.00 0.00 H ATOM 1268 H SER A 158 -17.740 14.089 -8.235 1.00 0.00 H ATOM 1269 N TYR A 159 -20.610 12.691 -9.307 1.00 31.59 N ATOM 1270 CA TYR A 159 -21.829 12.396 -10.080 1.00 31.58 C ATOM 1271 C TYR A 159 -21.563 11.548 -11.308 1.00 34.77 C ATOM 1272 O TYR A 159 -20.630 11.819 -12.055 1.00 35.92 O ATOM 1273 CB TYR A 159 -22.611 13.677 -10.447 1.00 34.06 C ATOM 1274 CG TYR A 159 -23.101 14.417 -9.222 1.00 37.01 C ATOM 1275 CD1 TYR A 159 -24.058 13.857 -8.386 1.00 38.48 C ATOM 1276 CD2 TYR A 159 -22.540 15.641 -8.848 1.00 38.05 C ATOM 1277 CE1 TYR A 159 -24.438 14.482 -7.198 1.00 40.66 C ATOM 1278 CE2 TYR A 159 -22.956 16.306 -7.689 1.00 38.02 C ATOM 1279 CZ TYR A 159 -23.900 15.714 -6.861 1.00 47.13 C ATOM 1280 OH TYR A 159 -24.347 16.339 -5.716 1.00 45.23 O ATOM 1281 HH TYR A 159 -25.013 15.762 -5.265 1.00 0.00 H ATOM 1282 H TYR A 159 -20.108 13.581 -9.500 1.00 0.00 H ATOM 1283 N ASN A 160 -22.386 10.516 -11.499 1.00 30.76 N ATOM 1284 CA ASN A 160 -22.350 9.564 -12.611 1.00 31.05 C ATOM 1285 C ASN A 160 -23.481 9.942 -13.552 1.00 34.53 C ATOM 1286 O ASN A 160 -24.645 9.923 -13.149 1.00 31.80 O ATOM 1287 CB ASN A 160 -22.586 8.144 -12.084 1.00 33.10 C ATOM 1288 CG ASN A 160 -21.641 7.729 -10.985 1.00 50.38 C ATOM 1289 OD1 ASN A 160 -20.418 7.831 -11.116 1.00 40.95 O ATOM 1290 ND2 ASN A 160 -22.199 7.253 -9.874 1.00 40.92 N ATOM 1291 HD22 ASN A 160 -23.234 7.182 -9.801 1.00 0.00 H ATOM 1292 HD21 ASN A 160 -21.600 6.952 -9.079 1.00 0.00 H ATOM 1293 H ASN A 160 -23.129 10.373 -10.785 1.00 0.00 H ATOM 1294 N THR A 161 -23.126 10.339 -14.782 1.00 30.52 N ATOM 1295 CA THR A 161 -24.071 10.826 -15.791 1.00 29.87 C ATOM 1296 C THR A 161 -24.204 9.917 -17.009 1.00 30.27 C ATOM 1297 O THR A 161 -25.091 10.160 -17.822 1.00 29.43 O ATOM 1298 CB THR A 161 -23.726 12.270 -16.225 1.00 33.03 C ATOM 1299 OG1 THR A 161 -22.334 12.347 -16.513 1.00 33.96 O ATOM 1300 CG2 THR A 161 -24.118 13.313 -15.188 1.00 28.38 C ATOM 1301 HG1 THR A 161 -22.106 13.269 -16.792 1.00 0.00 H ATOM 1302 H THR A 161 -22.118 10.299 -15.036 1.00 0.00 H ATOM 1303 N ALA A 162 -23.361 8.868 -17.109 1.00 25.04 N ATOM 1304 CA ALA A 162 -23.366 7.889 -18.203 1.00 25.41 C ATOM 1305 C ALA A 162 -24.189 6.685 -17.766 1.00 30.86 C ATOM 1306 O ALA A 162 -23.839 6.016 -16.797 1.00 33.59 O ATOM 1307 CB ALA A 162 -21.933 7.458 -18.554 1.00 25.40 C ATOM 1308 H ALA A 162 -22.655 8.744 -16.355 1.00 0.00 H ATOM 1309 N PHE A 163 -25.297 6.433 -18.452 1.00 26.00 N ATOM 1310 CA PHE A 163 -26.184 5.330 -18.118 1.00 27.05 C ATOM 1311 C PHE A 163 -26.359 4.322 -19.243 1.00 29.43 C ATOM 1312 O PHE A 163 -26.366 4.681 -20.422 1.00 26.05 O ATOM 1313 CB PHE A 163 -27.551 5.872 -17.654 1.00 28.89 C ATOM 1314 CG PHE A 163 -27.499 6.822 -16.475 1.00 30.67 C ATOM 1315 CD1 PHE A 163 -27.289 6.345 -15.183 1.00 33.73 C ATOM 1316 CD2 PHE A 163 -27.668 8.188 -16.655 1.00 30.91 C ATOM 1317 CE1 PHE A 163 -27.282 7.218 -14.084 1.00 33.32 C ATOM 1318 CE2 PHE A 163 -27.628 9.062 -15.562 1.00 33.03 C ATOM 1319 CZ PHE A 163 -27.436 8.569 -14.281 1.00 31.24 C ATOM 1320 H PHE A 163 -25.539 7.046 -19.257 1.00 0.00 H ATOM 1321 N GLU A 164 -26.599 3.068 -18.866 1.00 28.65 N ATOM 1322 CA GLU A 164 -26.833 1.986 -19.811 1.00 29.37 C ATOM 1323 C GLU A 164 -28.260 1.551 -19.691 1.00 31.69 C ATOM 1324 O GLU A 164 -28.710 1.325 -18.578 1.00 31.81 O ATOM 1325 CB GLU A 164 -25.950 0.794 -19.441 1.00 32.16 C ATOM 1326 CG GLU A 164 -24.799 0.514 -20.377 1.00 49.37 C ATOM 1327 CD GLU A 164 -23.926 -0.610 -19.857 1.00 75.93 C ATOM 1328 OE1 GLU A 164 -24.395 -1.771 -19.848 1.00 65.41 O ATOM 1329 OE2 GLU A 164 -22.783 -0.325 -19.433 1.00 75.42 O ATOM 1330 H GLU A 164 -26.620 2.851 -17.849 1.00 0.00 H ATOM 1331 N LEU A 165 -28.984 1.446 -20.812 1.00 29.93 N ATOM 1332 CA LEU A 165 -30.360 0.933 -20.853 1.00 30.37 C ATOM 1333 C LEU A 165 -30.222 -0.545 -21.192 1.00 35.81 C ATOM 1334 O LEU A 165 -29.650 -0.880 -22.247 1.00 35.69 O ATOM 1335 CB LEU A 165 -31.220 1.632 -21.919 1.00 30.46 C ATOM 1336 CG LEU A 165 -32.657 1.103 -22.108 1.00 34.85 C ATOM 1337 CD1 LEU A 165 -33.480 1.216 -20.837 1.00 34.53 C ATOM 1338 CD2 LEU A 165 -33.351 1.779 -23.272 1.00 38.12 C ATOM 1339 H LEU A 165 -28.547 1.745 -21.707 1.00 0.00 H ATOM 1340 N ASN A 166 -30.743 -1.421 -20.307 1.00 31.13 N ATOM 1341 CA ASN A 166 -30.664 -2.883 -20.446 1.00 31.39 C ATOM 1342 C ASN A 166 -32.013 -3.434 -20.826 1.00 34.01 C ATOM 1343 O ASN A 166 -32.814 -3.715 -19.953 1.00 33.70 O ATOM 1344 CB ASN A 166 -30.186 -3.509 -19.136 1.00 32.31 C ATOM 1345 CG ASN A 166 -28.938 -2.918 -18.572 1.00 43.14 C ATOM 1346 OD1 ASN A 166 -27.872 -2.954 -19.181 1.00 39.24 O ATOM 1347 ND2 ASN A 166 -29.040 -2.376 -17.379 1.00 43.02 N ATOM 1348 HD22 ASN A 166 -29.958 -2.362 -16.891 1.00 0.00 H ATOM 1349 HD21 ASN A 166 -28.202 -1.961 -16.923 1.00 0.00 H ATOM 1350 H ASN A 166 -31.232 -1.037 -19.473 1.00 0.00 H ATOM 1351 N ILE A 167 -32.290 -3.559 -22.126 1.00 31.55 N ATOM 1352 CA ILE A 167 -33.603 -3.997 -22.613 1.00 32.59 C ATOM 1353 C ILE A 167 -33.954 -5.485 -22.248 1.00 38.11 C ATOM 1354 O ILE A 167 -35.135 -5.835 -22.124 1.00 39.02 O ATOM 1355 CB ILE A 167 -33.756 -3.712 -24.134 1.00 35.96 C ATOM 1356 CG1 ILE A 167 -32.868 -4.659 -25.018 1.00 35.01 C ATOM 1357 CG2 ILE A 167 -33.506 -2.200 -24.465 1.00 35.28 C ATOM 1358 CD1 ILE A 167 -33.476 -4.904 -26.383 1.00 38.66 C ATOM 1359 H ILE A 167 -31.547 -3.338 -22.820 1.00 0.00 H ATOM 1360 N ASN A 168 -32.922 -6.300 -22.013 1.00 35.88 N ATOM 1361 CA ASN A 168 -32.931 -7.749 -21.803 1.00 67.13 C ATOM 1362 C ASN A 168 -33.392 -8.483 -23.056 1.00 79.90 C ATOM 1363 O ASN A 168 -32.690 -8.462 -24.066 1.00 44.44 O ATOM 1364 CB ASN A 168 -33.718 -8.168 -20.575 1.00 68.21 C ATOM 1365 CG ASN A 168 -32.820 -8.398 -19.410 1.00 79.18 C ATOM 1366 OD1 ASN A 168 -32.287 -9.491 -19.239 1.00 73.34 O ATOM 1367 ND2 ASN A 168 -32.617 -7.368 -18.604 1.00 69.70 N ATOM 1368 HD22 ASN A 168 -33.091 -6.461 -18.790 1.00 0.00 H ATOM 1369 HD21 ASN A 168 -31.983 -7.466 -17.785 1.00 0.00 H ATOM 1370 H ASN A 168 -31.988 -5.845 -21.974 1.00 0.00 H TER 1371 ASN A 168 HETATM 1372 O HOH 1 -45.782 14.226 -27.130 1.00 45.08 O HETATM 1373 O HOH 2 -27.080 11.962 -17.712 1.00 25.01 O HETATM 1374 O HOH 3 -40.445 12.011 -19.131 1.00 34.52 O HETATM 1375 O HOH 4 -22.067 6.253 -14.845 1.00 34.77 O HETATM 1376 O HOH 5 -29.527 4.176 -30.582 1.00 38.44 O HETATM 1377 O HOH 6 -22.420 23.576 -14.775 1.00 38.30 O HETATM 1378 O HOH 7 -33.477 22.908 -24.752 1.00 38.05 O HETATM 1379 O HOH 8 -29.457 27.323 -10.526 1.00 33.44 O HETATM 1380 O HOH 9 -27.577 14.104 -22.941 1.00 33.62 O HETATM 1381 O HOH 10 -27.105 11.662 -5.821 1.00 44.26 O HETATM 1382 O HOH 11 -26.610 4.055 -25.359 1.00 36.13 O HETATM 1383 O HOH 12 -27.230 16.182 -24.653 1.00 39.00 O HETATM 1384 O HOH 13 -19.018 5.285 -23.731 1.00 49.32 O HETATM 1385 O HOH 14 -52.698 15.505 -20.488 1.00 32.43 O HETATM 1386 O HOH 15 -25.990 -2.372 -21.993 1.00 66.07 O HETATM 1387 O HOH 16 -20.696 -1.064 -1.407 1.00 55.85 O HETATM 1388 O HOH 17 -26.864 7.282 -6.530 1.00 41.43 O HETATM 1389 O HOH 18 -38.319 -0.201 -7.742 1.00 47.50 O HETATM 1390 O HOH 19 -33.493 0.128 -13.408 1.00 37.87 O HETATM 1391 O HOH 20 -36.869 18.870 -19.314 1.00 29.93 O HETATM 1392 O HOH 21 -33.944 13.917 -6.863 1.00 49.24 O HETATM 1393 O HOH 22 -19.560 15.195 -10.656 1.00 43.42 O HETATM 1394 O HOH 23 -30.003 16.957 -33.784 1.00 47.29 O HETATM 1395 O HOH 24 -29.888 -3.322 -23.774 1.00 49.41 O HETATM 1396 O HOH 25 -48.271 13.154 -9.631 1.00 43.40 O HETATM 1397 O HOH 26 -38.112 -3.053 -25.034 1.00 55.47 O HETATM 1398 O HOH 27 -33.054 16.901 -8.425 1.00 26.22 O HETATM 1399 O HOH 28 -51.641 9.596 -17.044 1.00 52.08 O HETATM 1400 O HOH 29 -21.735 21.103 -24.399 1.00 59.24 O HETATM 1401 O HOH 30 -45.340 20.324 -10.806 1.00 44.59 O HETATM 1402 O HOH 31 -52.349 16.879 -12.097 1.00 50.75 O HETATM 1403 O HOH 32 -40.763 -0.201 -8.956 1.00 61.78 O HETATM 1404 O HOH 33 -18.827 20.611 -13.887 1.00 50.76 O HETATM 1405 O HOH 34 -29.715 24.446 -31.544 1.00 52.99 O HETATM 1406 O HOH 35 -29.745 -5.838 -22.140 1.00 47.17 O HETATM 1407 O HOH 36 -42.410 -3.368 -14.952 1.00 50.23 O HETATM 1408 O HOH 37 -20.639 3.938 -3.047 1.00 43.64 O HETATM 1409 O HOH 38 -38.518 5.216 -29.602 1.00 32.15 O HETATM 1410 O HOH 39 -20.305 8.926 -15.544 1.00 20.97 O HETATM 1411 O HOH 40 -28.125 15.056 -32.497 1.00 38.42 O HETATM 1412 O HOH 41 -25.888 -3.887 -13.381 1.00 59.99 O HETATM 1413 O HOH 42 -18.604 16.181 -7.394 1.00 57.98 O HETATM 1414 O HOH 43 -44.026 22.561 -23.021 1.00 42.71 O HETATM 1415 O HOH 44 -37.394 11.509 -8.333 1.00 53.22 O HETATM 1416 O HOH 45 -48.092 3.849 -20.391 1.00 49.67 O HETATM 1417 O HOH 46 -49.463 18.678 -25.643 1.00 46.11 O HETATM 1418 O HOH 47 -34.898 25.896 -22.598 1.00 57.12 O HETATM 1419 O HOH 48 -51.605 17.903 -33.506 1.00 54.66 O HETATM 1420 O HOH 49 -35.452 24.167 -26.660 1.00 49.49 O HETATM 1421 O HOH 50 -40.551 23.754 -19.439 1.00 30.71 O HETATM 1422 O HOH 51 -18.412 17.621 -9.598 1.00 50.44 O HETATM 1423 O HOH 52 -27.718 13.496 -3.920 1.00 51.63 O HETATM 1424 O HOH 53 -43.262 24.205 -20.701 1.00 45.66 O HETATM 1425 C4 O A 6 -29.717 4.758 -22.832 1.00 0.04 C HETATM 1426 C5 O A 6 -30.322 4.514 -24.065 1.00 -0.04 C HETATM 1427 C6 O A 6 -31.609 4.974 -24.353 1.00 -0.02 C HETATM 1428 C7 O A 6 -32.238 4.601 -25.643 1.00 0.04 C HETATM 1429 C8 O A 6 -33.267 5.326 -26.231 1.00 -0.02 C HETATM 1430 C9 O A 6 -33.656 4.971 -27.514 1.00 0.03 C HETATM 1431 C33 O A 6 -34.708 5.726 -28.262 1.00 -0.01 C HETATM 1432 H19 O A 6 -34.852 5.270 -29.253 1.00 0.04 H HETATM 1433 H20 O A 6 -34.392 6.773 -28.383 1.00 0.04 H HETATM 1434 H21 O A 6 -35.654 5.691 -27.701 1.00 0.04 H HETATM 1435 N10 O A 6 -33.063 3.951 -28.167 1.00 -0.25 N HETATM 1436 C11 O A 6 -32.102 3.311 -27.503 1.00 0.24 C HETATM 1437 N12 O A 6 -31.664 3.568 -26.272 1.00 -0.25 N HETATM 1438 O13 O A 6 -31.538 2.299 -28.179 1.00 -0.27 O HETATM 1439 C14 O A 6 -30.530 1.504 -27.555 1.00 0.14 C HETATM 1440 C15 O A 6 -30.362 0.115 -28.412 1.00 0.10 C HETATM 1441 C21 O A 6 -31.633 -0.743 -28.601 1.00 -0.04 C HETATM 1442 C22 O A 6 -31.561 -1.979 -29.245 1.00 -0.05 C HETATM 1443 C23 O A 6 -32.700 -2.746 -29.439 1.00 -0.04 C HETATM 1444 C24 O A 6 -33.926 -2.300 -28.986 1.00 -0.04 C HETATM 1445 C25 O A 6 -34.016 -1.083 -28.338 1.00 -0.04 C HETATM 1446 C26 O A 6 -32.880 -0.309 -28.145 1.00 -0.05 C HETATM 1447 H12 O A 6 -32.962 0.644 -27.634 1.00 0.08 H HETATM 1448 H7 O A 6 -34.977 -0.732 -27.979 1.00 0.07 H HETATM 1449 H4 O A 6 -34.814 -2.902 -29.138 1.00 0.08 H HETATM 1450 H6 O A 6 -32.628 -3.700 -29.949 1.00 0.07 H HETATM 1451 H11 O A 6 -30.603 -2.344 -29.598 1.00 0.08 H HETATM 1452 C20 O A 6 -29.702 0.453 -29.764 1.00 -0.04 C HETATM 1453 C27 O A 6 -30.469 0.778 -30.880 1.00 -0.05 C HETATM 1454 C28 O A 6 -29.867 1.076 -32.093 1.00 -0.04 C HETATM 1455 C29 O A 6 -28.490 1.091 -32.202 1.00 -0.04 C HETATM 1456 C30 O A 6 -27.714 0.787 -31.101 1.00 -0.04 C HETATM 1457 C31 O A 6 -28.313 0.456 -29.894 1.00 -0.05 C HETATM 1458 H14 O A 6 -27.695 0.197 -29.042 1.00 0.08 H HETATM 1459 H9 O A 6 -26.633 0.807 -31.180 1.00 0.07 H HETATM 1460 H5 O A 6 -28.021 1.340 -33.147 1.00 0.08 H HETATM 1461 H8 O A 6 -30.480 1.298 -32.959 1.00 0.07 H HETATM 1462 H13 O A 6 -31.550 0.798 -30.799 1.00 0.08 H HETATM 1463 O19 O A 6 -29.401 -0.666 -27.657 1.00 -0.42 O HETATM 1464 C32 O A 6 -29.817 -1.227 -26.398 1.00 0.02 C HETATM 1465 H22 O A 6 -28.982 -1.787 -25.952 1.00 0.05 H HETATM 1466 H23 O A 6 -30.667 -1.906 -26.562 1.00 0.05 H HETATM 1467 H24 O A 6 -30.120 -0.417 -25.718 1.00 0.05 H HETATM 1468 C16 O A 6 -29.215 2.260 -27.424 1.00 0.06 C HETATM 1469 O17 O A 6 -28.898 3.137 -28.210 1.00 -0.57 O HETATM 1470 O18 O A 6 -28.482 1.893 -26.386 1.00 -0.57 O HETATM 1471 H3 O A 6 -30.869 1.246 -26.541 1.00 0.07 H HETATM 1472 H2 O A 6 -33.749 6.142 -25.705 1.00 0.06 H HETATM 1473 C1 O A 6 -32.288 5.694 -23.371 1.00 -0.07 C HETATM 1474 C2 O A 6 -31.703 5.936 -22.139 1.00 -0.07 C HETATM 1475 C3 O A 6 -30.420 5.478 -21.843 1.00 -0.02 C HETATM 1476 C34 O A 6 -29.768 5.807 -20.528 1.00 -0.03 C HETATM 1477 H16 O A 6 -28.766 5.355 -20.492 1.00 0.04 H HETATM 1478 H17 O A 6 -30.380 5.408 -19.705 1.00 0.04 H HETATM 1479 H18 O A 6 -29.682 6.899 -20.424 1.00 0.04 H HETATM 1480 H15 O A 6 -32.254 6.493 -21.390 1.00 0.05 H HETATM 1481 H10 O A 6 -33.285 6.069 -23.574 1.00 0.05 H HETATM 1482 H1 O A 6 -29.780 3.954 -24.818 1.00 0.05 H HETATM 1483 N35 O A 6 -28.422 4.319 -22.608 1.00 -0.34 N HETATM 1484 H25 O A 6 -27.922 3.795 -23.340 1.00 0.17 H HETATM 1485 H26 O A 6 -27.959 4.517 -21.709 1.00 0.17 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1425 1426 1475 1483 CONECT 1426 1425 1427 1482 CONECT 1427 1426 1428 1473 CONECT 1428 1427 1429 1437 CONECT 1429 1428 1430 1472 CONECT 1430 1429 1431 1435 CONECT 1431 1430 1432 1433 1434 CONECT 1432 1431 CONECT 1433 1431 CONECT 1434 1431 CONECT 1435 1430 1436 CONECT 1436 1435 1437 1438 CONECT 1437 1428 1436 CONECT 1438 1436 1439 CONECT 1439 1438 1440 1468 1471 CONECT 1440 1439 1441 1452 1463 CONECT 1441 1440 1442 1446 CONECT 1442 1441 1443 1451 CONECT 1443 1442 1444 1450 CONECT 1444 1443 1445 1449 CONECT 1445 1444 1446 1448 CONECT 1446 1441 1445 1447 CONECT 1447 1446 CONECT 1448 1445 CONECT 1449 1444 CONECT 1450 1443 CONECT 1451 1442 CONECT 1452 1440 1453 1457 CONECT 1453 1452 1454 1462 CONECT 1454 1453 1455 1461 CONECT 1455 1454 1456 1460 CONECT 1456 1455 1457 1459 CONECT 1457 1452 1456 1458 CONECT 1458 1457 CONECT 1459 1456 CONECT 1460 1455 CONECT 1461 1454 CONECT 1462 1453 CONECT 1463 1440 1464 CONECT 1464 1463 1465 1466 1467 CONECT 1465 1464 CONECT 1466 1464 CONECT 1467 1464 CONECT 1468 1439 1469 1470 CONECT 1469 1468 CONECT 1470 1468 CONECT 1471 1439 CONECT 1472 1429 CONECT 1473 1427 1474 1481 CONECT 1474 1473 1475 1480 CONECT 1475 1425 1474 1476 CONECT 1476 1475 1477 1478 1479 CONECT 1477 1476 CONECT 1478 1476 CONECT 1479 1476 CONECT 1480 1474 CONECT 1481 1473 CONECT 1482 1426 CONECT 1483 1425 1484 1485 CONECT 1484 1483 CONECT 1485 1483 MASTER 0 0 0 0 0 0 0 0 1484 1 65 12 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6p9e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6p9e
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Interleukin-36 gamma
Ligand Name
O6D
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=67.6nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Sci Rep Vol. 9: pp. 9089-9089
Ligand Properties
Formula
C
2
8
H
2
7
N
3
O
4
Molecular Weight
469.532
Exact Mass
469.200
No. of atoms
62
No. of bonds
65
Polar Surface Area
107.56
LOGP Value
5.63 (
Computed with XLOGP3
)
5.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
COC([C@@H](C(=O)O)Oc1nc(C)cc(n1)c1ccc(c(c1)N)C)(c1ccccc1)c1ccccc1
InChI String
InChI=1S/C28H27N3O4/c1-18-14-15-20(17-23(18)29)24-16-19(2)30-27(31-24)35-25(26(32)33)28(34-3,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,25H,29H2,1-3H3,(H,32,33)/t25-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9NZH8
Entrez Gene ID
NCBI Entrez Gene ID:
56300
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓