Browse entries in the PDBbind-CN Database
HEADER 3AX5_COMPLEX COMPND 3AX5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 69 SER ASP LEU LYS ASP ALA GLU ALA VAL GLN LYS PHE PHE SEQRES 2 A 69 LEU GLU GLU ILE GLN LEU GLY GLU GLU LEU LEU ALA GLN SEQRES 3 A 69 GLY ASP TYR GLU LYS GLY VAL ASP HIS LEU THR ASN ALA SEQRES 4 A 69 ILE ALA VAL CYS GLY GLN PRO GLN GLN LEU LEU GLN VAL SEQRES 5 A 69 LEU GLN GLN THR LEU PRO PRO PRO VAL PHE GLN MET LEU SEQRES 6 A 69 LEU THR LYS LEU SEQRES 1 C 72 GLY PRO LEU GLY SER ASP LEU LYS ASP ALA GLU ALA VAL SEQRES 2 C 72 GLN LYS PHE PHE LEU GLU GLU ILE GLN LEU GLY GLU GLU SEQRES 3 C 72 LEU LEU ALA GLN GLY ASP TYR GLU LYS GLY VAL ASP HIS SEQRES 4 C 72 LEU THR ASN ALA ILE ALA VAL CYS GLY GLN PRO GLN GLN SEQRES 5 C 72 LEU LEU GLN VAL LEU GLN GLN THR LEU PRO PRO PRO VAL SEQRES 6 C 72 PHE GLN MET LEU LEU THR LYS HET GLY A 165 177 ATOM 1 N SER A 58 13.460 22.263 22.372 1.00 53.14 N ATOM 2 CA SER A 58 12.874 23.372 21.535 1.00 53.18 C ATOM 3 C SER A 58 13.917 24.258 20.906 1.00 52.93 C ATOM 4 O SER A 58 14.677 24.954 21.599 1.00 52.77 O ATOM 5 CB SER A 58 11.889 24.271 22.309 1.00 53.62 C ATOM 6 OG SER A 58 10.674 23.591 22.592 1.00 54.40 O ATOM 7 HA SER A 58 12.333 22.839 20.753 1.00 0.00 H ATOM 8 HB2 SER A 58 11.669 25.154 21.709 1.00 0.00 H ATOM 9 HB3 SER A 58 12.351 24.577 23.248 1.00 0.00 H ATOM 10 HG SER A 58 10.067 24.195 23.088 1.00 0.00 H ATOM 11 HN3 SER A 58 14.028 22.673 23.140 1.00 0.00 H ATOM 12 HN2 SER A 58 14.064 21.662 21.775 1.00 0.00 H ATOM 13 HN1 SER A 58 12.691 21.691 22.775 1.00 0.00 H ATOM 14 N ASP A 59 13.938 24.199 19.577 1.00 52.26 N ATOM 15 CA ASP A 59 14.567 25.208 18.751 1.00 51.41 C ATOM 16 C ASP A 59 13.478 26.167 18.186 1.00 50.34 C ATOM 17 O ASP A 59 12.307 26.113 18.598 1.00 50.17 O ATOM 18 CB ASP A 59 15.446 24.563 17.638 1.00 51.46 C ATOM 19 CG ASP A 59 14.628 23.765 16.593 1.00 52.69 C ATOM 20 OD1 ASP A 59 13.367 23.743 16.639 1.00 53.65 O ATOM 21 OD2 ASP A 59 15.266 23.132 15.716 1.00 54.54 O ATOM 22 HA ASP A 59 15.250 25.802 19.359 1.00 0.00 H ATOM 23 HB2 ASP A 59 15.987 25.356 17.121 1.00 0.00 H ATOM 24 HB3 ASP A 59 16.159 23.886 18.109 1.00 0.00 H ATOM 25 H ASP A 59 13.481 23.390 19.110 1.00 0.00 H ATOM 26 N LEU A 60 13.887 27.016 17.238 1.00 48.74 N ATOM 27 CA LEU A 60 13.048 28.043 16.649 1.00 47.27 C ATOM 28 C LEU A 60 11.968 27.428 15.736 1.00 45.50 C ATOM 29 O LEU A 60 10.829 27.902 15.696 1.00 43.92 O ATOM 30 CB LEU A 60 13.949 29.063 15.914 1.00 47.44 C ATOM 31 CG LEU A 60 13.859 30.580 16.198 1.00 49.03 C ATOM 32 CD1 LEU A 60 13.690 30.944 17.678 1.00 47.98 C ATOM 33 CD2 LEU A 60 15.070 31.360 15.580 1.00 49.64 C ATOM 34 HA LEU A 60 12.503 28.572 17.431 1.00 0.00 H ATOM 35 HB2 LEU A 60 14.978 28.772 16.126 1.00 0.00 H ATOM 36 HB3 LEU A 60 13.749 28.938 14.850 1.00 0.00 H ATOM 37 HG LEU A 60 12.940 30.894 15.704 1.00 0.00 H ATOM 38 HD21 LEU A 60 15.999 30.985 16.009 1.00 0.00 H ATOM 39 HD22 LEU A 60 15.082 31.213 14.500 1.00 0.00 H ATOM 40 HD23 LEU A 60 14.968 32.422 15.803 1.00 0.00 H ATOM 41 HD11 LEU A 60 12.772 30.496 18.059 1.00 0.00 H ATOM 42 HD12 LEU A 60 14.542 30.566 18.243 1.00 0.00 H ATOM 43 HD13 LEU A 60 13.636 32.028 17.780 1.00 0.00 H ATOM 44 H LEU A 60 14.868 26.935 16.902 1.00 0.00 H ATOM 45 N LYS A 61 12.317 26.345 15.043 1.00 43.64 N ATOM 46 CA LYS A 61 11.331 25.609 14.251 1.00 42.09 C ATOM 47 C LYS A 61 10.152 25.071 15.091 1.00 39.57 C ATOM 48 O LYS A 61 9.002 25.140 14.649 1.00 37.47 O ATOM 49 CB LYS A 61 12.000 24.463 13.475 1.00 43.57 C ATOM 50 CG LYS A 61 12.719 24.871 12.132 1.00 48.15 C ATOM 51 CD LYS A 61 11.788 24.722 10.888 1.00 56.18 C ATOM 52 CE LYS A 61 12.550 24.252 9.590 1.00 60.74 C ATOM 53 NZ LYS A 61 12.562 22.741 9.316 1.00 62.17 N ATOM 54 HA LYS A 61 10.911 26.327 13.546 1.00 0.00 H ATOM 55 HB2 LYS A 61 12.744 24.007 14.128 1.00 0.00 H ATOM 56 HB3 LYS A 61 11.231 23.729 13.233 1.00 0.00 H ATOM 57 HG2 LYS A 61 13.039 25.910 12.208 1.00 0.00 H ATOM 58 HG3 LYS A 61 13.592 24.233 11.994 1.00 0.00 H ATOM 59 HD2 LYS A 61 11.015 23.989 11.120 1.00 0.00 H ATOM 60 HD3 LYS A 61 11.323 25.687 10.686 1.00 0.00 H ATOM 61 HE2 LYS A 61 13.585 24.582 9.675 1.00 0.00 H ATOM 62 HE3 LYS A 61 12.083 24.741 8.735 1.00 0.00 H ATOM 63 HZ1 LYS A 61 13.020 22.250 10.110 1.00 0.00 H ATOM 64 HZ2 LYS A 61 11.585 22.401 9.213 1.00 0.00 H ATOM 65 HZ3 LYS A 61 13.090 22.553 8.440 1.00 0.00 H ATOM 66 H LYS A 61 13.304 26.018 15.065 1.00 0.00 H ATOM 67 N ASP A 62 10.463 24.501 16.257 1.00 37.03 N ATOM 68 CA ASP A 62 9.455 23.944 17.164 1.00 36.37 C ATOM 69 C ASP A 62 8.482 25.004 17.661 1.00 34.30 C ATOM 70 O ASP A 62 7.295 24.743 17.730 1.00 32.24 O ATOM 71 CB ASP A 62 10.093 23.309 18.416 1.00 36.50 C ATOM 72 CG ASP A 62 10.932 22.037 18.098 1.00 42.39 C ATOM 73 OD1 ASP A 62 12.105 21.942 18.600 1.00 45.05 O ATOM 74 OD2 ASP A 62 10.411 21.162 17.337 1.00 42.69 O ATOM 75 HA ASP A 62 8.931 23.191 16.575 1.00 0.00 H ATOM 76 HB2 ASP A 62 10.745 24.046 18.885 1.00 0.00 H ATOM 77 HB3 ASP A 62 9.298 23.036 19.110 1.00 0.00 H ATOM 78 H ASP A 62 11.464 24.450 16.534 1.00 0.00 H ATOM 79 N ALA A 63 9.006 26.170 18.071 1.00 32.15 N ATOM 80 CA ALA A 63 8.162 27.246 18.619 1.00 30.67 C ATOM 81 C ALA A 63 7.414 27.878 17.470 1.00 29.47 C ATOM 82 O ALA A 63 6.245 28.281 17.612 1.00 29.19 O ATOM 83 CB ALA A 63 9.010 28.312 19.332 1.00 30.64 C ATOM 84 HA ALA A 63 7.473 26.828 19.353 1.00 0.00 H ATOM 85 HB1 ALA A 63 9.559 27.849 20.152 1.00 0.00 H ATOM 86 HB2 ALA A 63 9.713 28.749 18.623 1.00 0.00 H ATOM 87 HB3 ALA A 63 8.357 29.091 19.725 1.00 0.00 H ATOM 88 H ALA A 63 10.033 26.317 18.000 1.00 0.00 H ATOM 89 N GLU A 64 8.092 27.991 16.332 1.00 27.88 N ATOM 90 CA GLU A 64 7.456 28.597 15.188 1.00 27.92 C ATOM 91 C GLU A 64 6.255 27.743 14.725 1.00 27.04 C ATOM 92 O GLU A 64 5.231 28.292 14.415 1.00 28.25 O ATOM 93 CB GLU A 64 8.479 28.949 14.069 1.00 28.66 C ATOM 94 CG GLU A 64 9.301 30.267 14.335 1.00 30.11 C ATOM 95 CD GLU A 64 10.232 30.688 13.150 1.00 34.30 C ATOM 96 OE1 GLU A 64 9.956 30.303 11.993 1.00 35.93 O ATOM 97 OE2 GLU A 64 11.228 31.423 13.369 1.00 33.87 O ATOM 98 HA GLU A 64 7.042 29.562 15.479 1.00 0.00 H ATOM 99 HB2 GLU A 64 9.182 28.121 13.975 1.00 0.00 H ATOM 100 HB3 GLU A 64 7.934 29.069 13.133 1.00 0.00 H ATOM 101 HG2 GLU A 64 8.597 31.078 14.523 1.00 0.00 H ATOM 102 HG3 GLU A 64 9.920 30.113 15.219 1.00 0.00 H ATOM 103 H GLU A 64 9.071 27.646 16.267 1.00 0.00 H ATOM 104 N ALA A 65 6.361 26.416 14.731 1.00 24.45 N ATOM 105 CA ALA A 65 5.222 25.605 14.301 1.00 23.37 C ATOM 106 C ALA A 65 4.024 25.760 15.287 1.00 22.88 C ATOM 107 O ALA A 65 2.852 25.898 14.885 1.00 22.39 O ATOM 108 CB ALA A 65 5.673 24.163 14.129 1.00 22.25 C ATOM 109 HA ALA A 65 4.857 25.955 13.335 1.00 0.00 H ATOM 110 HB1 ALA A 65 6.461 24.117 13.377 1.00 0.00 H ATOM 111 HB2 ALA A 65 6.053 23.787 15.079 1.00 0.00 H ATOM 112 HB3 ALA A 65 4.827 23.555 13.809 1.00 0.00 H ATOM 113 H ALA A 65 7.244 25.961 15.038 1.00 0.00 H ATOM 114 N VAL A 66 4.330 25.866 16.576 1.00 22.05 N ATOM 115 CA VAL A 66 3.280 26.072 17.570 1.00 22.79 C ATOM 116 C VAL A 66 2.619 27.451 17.435 1.00 23.59 C ATOM 117 O VAL A 66 1.377 27.562 17.437 1.00 23.74 O ATOM 118 CB VAL A 66 3.834 25.867 19.023 1.00 22.51 C ATOM 119 CG1 VAL A 66 2.789 26.311 20.066 1.00 23.96 C ATOM 120 CG2 VAL A 66 4.212 24.367 19.209 1.00 20.66 C ATOM 121 HA VAL A 66 2.512 25.322 17.381 1.00 0.00 H ATOM 122 HB VAL A 66 4.723 26.480 19.170 1.00 0.00 H ATOM 123 HG11 VAL A 66 2.557 27.366 19.920 1.00 0.00 H ATOM 124 HG12 VAL A 66 1.882 25.718 19.945 1.00 0.00 H ATOM 125 HG13 VAL A 66 3.191 26.161 21.068 1.00 0.00 H ATOM 126 HG21 VAL A 66 3.326 23.749 19.060 1.00 0.00 H ATOM 127 HG22 VAL A 66 4.975 24.093 18.480 1.00 0.00 H ATOM 128 HG23 VAL A 66 4.599 24.213 20.216 1.00 0.00 H ATOM 129 H VAL A 66 5.323 25.802 16.879 1.00 0.00 H ATOM 130 N GLN A 67 3.429 28.495 17.274 1.00 23.10 N ATOM 131 CA GLN A 67 2.885 29.827 17.053 1.00 23.79 C ATOM 132 C GLN A 67 1.968 29.869 15.830 1.00 23.67 C ATOM 133 O GLN A 67 0.924 30.551 15.800 1.00 22.04 O ATOM 134 CB GLN A 67 4.025 30.841 16.877 1.00 23.77 C ATOM 135 CG GLN A 67 4.900 30.941 18.091 1.00 26.48 C ATOM 136 CD GLN A 67 6.292 31.520 17.827 1.00 31.49 C ATOM 137 OE1 GLN A 67 7.146 31.464 18.719 1.00 35.95 O ATOM 138 NE2 GLN A 67 6.528 32.087 16.628 1.00 28.58 N ATOM 139 HA GLN A 67 2.292 30.088 17.929 1.00 0.00 H ATOM 140 HB2 GLN A 67 4.637 30.535 16.029 1.00 0.00 H ATOM 141 HB3 GLN A 67 3.593 31.821 16.676 1.00 0.00 H ATOM 142 HG2 GLN A 67 4.399 31.578 18.820 1.00 0.00 H ATOM 143 HG3 GLN A 67 5.021 29.941 18.507 1.00 0.00 H ATOM 144 HE22 GLN A 67 5.778 32.111 15.908 1.00 0.00 H ATOM 145 HE21 GLN A 67 7.460 32.501 16.423 1.00 0.00 H ATOM 146 H GLN A 67 4.459 28.358 17.306 1.00 0.00 H ATOM 147 N LYS A 68 2.403 29.188 14.783 1.00 24.32 N ATOM 148 CA LYS A 68 1.654 29.179 13.534 1.00 24.98 C ATOM 149 C LYS A 68 0.323 28.439 13.634 1.00 23.63 C ATOM 150 O LYS A 68 -0.719 28.922 13.108 1.00 23.54 O ATOM 151 CB LYS A 68 2.514 28.515 12.488 1.00 27.59 C ATOM 152 CG LYS A 68 1.831 28.233 11.154 1.00 31.72 C ATOM 153 CD LYS A 68 2.929 27.714 10.142 1.00 39.88 C ATOM 154 CE LYS A 68 2.395 26.679 9.174 1.00 42.89 C ATOM 155 NZ LYS A 68 1.415 27.266 8.235 1.00 44.86 N ATOM 156 HA LYS A 68 1.416 30.211 13.276 1.00 0.00 H ATOM 157 HB2 LYS A 68 3.370 29.163 12.297 1.00 0.00 H ATOM 158 HB3 LYS A 68 2.863 27.565 12.894 1.00 0.00 H ATOM 159 HG2 LYS A 68 1.061 27.473 11.286 1.00 0.00 H ATOM 160 HG3 LYS A 68 1.377 29.147 10.771 1.00 0.00 H ATOM 161 HD2 LYS A 68 3.306 28.563 9.571 1.00 0.00 H ATOM 162 HD3 LYS A 68 3.745 27.270 10.712 1.00 0.00 H ATOM 163 HE2 LYS A 68 1.911 25.883 9.739 1.00 0.00 H ATOM 164 HE3 LYS A 68 3.227 26.265 8.604 1.00 0.00 H ATOM 165 HZ1 LYS A 68 0.615 27.658 8.771 1.00 0.00 H ATOM 166 HZ2 LYS A 68 1.872 28.023 7.688 1.00 0.00 H ATOM 167 HZ3 LYS A 68 1.072 26.528 7.588 1.00 0.00 H ATOM 168 H LYS A 68 3.291 28.652 14.853 1.00 0.00 H ATOM 169 N PHE A 69 0.355 27.261 14.276 1.00 20.85 N ATOM 170 CA PHE A 69 -0.862 26.529 14.547 1.00 19.81 C ATOM 171 C PHE A 69 -1.808 27.384 15.421 1.00 20.31 C ATOM 172 O PHE A 69 -2.995 27.539 15.129 1.00 20.45 O ATOM 173 CB PHE A 69 -0.527 25.196 15.211 1.00 18.95 C ATOM 174 CG PHE A 69 -1.719 24.434 15.662 1.00 21.47 C ATOM 175 CD1 PHE A 69 -2.042 24.361 17.018 1.00 17.43 C ATOM 176 CD2 PHE A 69 -2.552 23.797 14.724 1.00 18.17 C ATOM 177 CE1 PHE A 69 -3.157 23.643 17.421 1.00 17.51 C ATOM 178 CE2 PHE A 69 -3.678 23.080 15.124 1.00 16.94 C ATOM 179 CZ PHE A 69 -3.972 22.979 16.504 1.00 14.14 C ATOM 180 HA PHE A 69 -1.379 26.315 13.612 1.00 0.00 H ATOM 181 HB2 PHE A 69 0.022 24.584 14.495 1.00 0.00 H ATOM 182 HB3 PHE A 69 0.104 25.393 16.078 1.00 0.00 H ATOM 183 HD2 PHE A 69 -2.312 23.866 13.663 1.00 0.00 H ATOM 184 HE2 PHE A 69 -4.322 22.604 14.385 1.00 0.00 H ATOM 185 HZ PHE A 69 -4.823 22.391 16.846 1.00 0.00 H ATOM 186 HE1 PHE A 69 -3.403 23.596 18.482 1.00 0.00 H ATOM 187 HD1 PHE A 69 -1.420 24.866 17.757 1.00 0.00 H ATOM 188 H PHE A 69 1.268 26.869 14.583 1.00 0.00 H ATOM 189 N PHE A 70 -1.267 27.990 16.477 1.00 21.38 N ATOM 190 CA PHE A 70 -2.036 28.817 17.388 1.00 21.40 C ATOM 191 C PHE A 70 -2.758 29.905 16.575 1.00 23.03 C ATOM 192 O PHE A 70 -3.975 30.103 16.710 1.00 22.82 O ATOM 193 CB PHE A 70 -1.096 29.441 18.419 1.00 19.80 C ATOM 194 CG PHE A 70 -1.751 30.465 19.321 1.00 20.75 C ATOM 195 CD1 PHE A 70 -2.565 30.062 20.420 1.00 17.55 C ATOM 196 CD2 PHE A 70 -1.535 31.819 19.113 1.00 17.68 C ATOM 197 CE1 PHE A 70 -3.111 31.007 21.299 1.00 20.02 C ATOM 198 CE2 PHE A 70 -2.143 32.771 19.914 1.00 17.01 C ATOM 199 CZ PHE A 70 -2.911 32.386 21.061 1.00 17.74 C ATOM 200 HA PHE A 70 -2.778 28.218 17.917 1.00 0.00 H ATOM 201 HB2 PHE A 70 -0.695 28.642 19.043 1.00 0.00 H ATOM 202 HB3 PHE A 70 -0.279 29.928 17.886 1.00 0.00 H ATOM 203 HD2 PHE A 70 -0.876 32.139 18.306 1.00 0.00 H ATOM 204 HE2 PHE A 70 -2.036 33.828 19.669 1.00 0.00 H ATOM 205 HZ PHE A 70 -3.330 33.136 21.732 1.00 0.00 H ATOM 206 HE1 PHE A 70 -3.688 30.680 22.164 1.00 0.00 H ATOM 207 HD1 PHE A 70 -2.766 29.002 20.579 1.00 0.00 H ATOM 208 H PHE A 70 -0.250 27.865 16.656 1.00 0.00 H ATOM 209 N LEU A 71 -2.005 30.589 15.719 1.00 24.72 N ATOM 210 CA LEU A 71 -2.559 31.715 14.926 1.00 26.02 C ATOM 211 C LEU A 71 -3.599 31.254 13.907 1.00 25.82 C ATOM 212 O LEU A 71 -4.657 31.879 13.782 1.00 24.78 O ATOM 213 CB LEU A 71 -1.435 32.478 14.224 1.00 26.35 C ATOM 214 CG LEU A 71 -0.534 33.258 15.182 1.00 28.97 C ATOM 215 CD1 LEU A 71 0.798 33.620 14.485 1.00 31.21 C ATOM 216 CD2 LEU A 71 -1.251 34.473 15.746 1.00 29.92 C ATOM 217 HA LEU A 71 -3.065 32.379 15.627 1.00 0.00 H ATOM 218 HB2 LEU A 71 -0.820 31.762 13.678 1.00 0.00 H ATOM 219 HB3 LEU A 71 -1.882 33.181 13.521 1.00 0.00 H ATOM 220 HG LEU A 71 -0.292 32.625 16.036 1.00 0.00 H ATOM 221 HD21 LEU A 71 -1.543 35.132 14.929 1.00 0.00 H ATOM 222 HD22 LEU A 71 -2.139 34.150 16.289 1.00 0.00 H ATOM 223 HD23 LEU A 71 -0.583 35.006 16.423 1.00 0.00 H ATOM 224 HD11 LEU A 71 1.307 32.706 14.180 1.00 0.00 H ATOM 225 HD12 LEU A 71 0.593 34.233 13.608 1.00 0.00 H ATOM 226 HD13 LEU A 71 1.430 34.175 15.178 1.00 0.00 H ATOM 227 H LEU A 71 -1.005 30.329 15.602 1.00 0.00 H ATOM 228 N GLU A 72 -3.331 30.141 13.216 1.00 26.40 N ATOM 229 CA GLU A 72 -4.337 29.552 12.291 1.00 26.94 C ATOM 230 C GLU A 72 -5.636 29.214 13.002 1.00 25.58 C ATOM 231 O GLU A 72 -6.730 29.365 12.433 1.00 24.89 O ATOM 232 CB GLU A 72 -3.854 28.258 11.621 1.00 26.82 C ATOM 233 CG GLU A 72 -2.694 28.406 10.680 1.00 35.53 C ATOM 234 CD GLU A 72 -1.952 27.062 10.377 1.00 44.84 C ATOM 235 OE1 GLU A 72 -0.970 27.113 9.586 1.00 47.96 O ATOM 236 OE2 GLU A 72 -2.315 25.974 10.941 1.00 49.17 O ATOM 237 HA GLU A 72 -4.493 30.324 11.538 1.00 0.00 H ATOM 238 HB2 GLU A 72 -3.561 27.563 12.407 1.00 0.00 H ATOM 239 HB3 GLU A 72 -4.689 27.839 11.060 1.00 0.00 H ATOM 240 HG2 GLU A 72 -3.064 28.814 9.740 1.00 0.00 H ATOM 241 HG3 GLU A 72 -1.980 29.101 11.121 1.00 0.00 H ATOM 242 H GLU A 72 -2.405 29.680 13.327 1.00 0.00 H ATOM 243 N GLU A 73 -5.541 28.696 14.225 1.00 25.14 N ATOM 244 CA GLU A 73 -6.763 28.173 14.900 1.00 24.37 C ATOM 245 C GLU A 73 -7.590 29.323 15.364 1.00 24.90 C ATOM 246 O GLU A 73 -8.800 29.245 15.274 1.00 25.70 O ATOM 247 CB GLU A 73 -6.486 27.214 16.052 1.00 23.54 C ATOM 248 CG GLU A 73 -5.886 25.908 15.651 1.00 23.88 C ATOM 249 CD GLU A 73 -6.736 25.141 14.648 1.00 27.00 C ATOM 250 OE1 GLU A 73 -6.350 25.076 13.452 1.00 26.81 O ATOM 251 OE2 GLU A 73 -7.786 24.612 15.064 1.00 25.60 O ATOM 252 HA GLU A 73 -7.301 27.579 14.161 1.00 0.00 H ATOM 253 HB2 GLU A 73 -5.801 27.704 16.744 1.00 0.00 H ATOM 254 HB3 GLU A 73 -7.429 27.012 16.559 1.00 0.00 H ATOM 255 HG2 GLU A 73 -4.910 26.097 15.205 1.00 0.00 H ATOM 256 HG3 GLU A 73 -5.764 25.294 16.543 1.00 0.00 H ATOM 257 H GLU A 73 -4.620 28.657 14.706 1.00 0.00 H ATOM 258 N ILE A 74 -6.932 30.402 15.810 1.00 23.63 N ATOM 259 CA ILE A 74 -7.617 31.595 16.266 1.00 23.66 C ATOM 260 C ILE A 74 -8.383 32.264 15.125 1.00 24.44 C ATOM 261 O ILE A 74 -9.540 32.669 15.286 1.00 23.63 O ATOM 262 CB ILE A 74 -6.614 32.656 16.863 1.00 24.24 C ATOM 263 CG1 ILE A 74 -6.041 32.198 18.221 1.00 24.93 C ATOM 264 CG2 ILE A 74 -7.295 33.977 17.004 1.00 22.27 C ATOM 265 CD1 ILE A 74 -6.993 32.411 19.475 1.00 26.25 C ATOM 266 HA ILE A 74 -8.308 31.268 17.043 1.00 0.00 H ATOM 267 HB ILE A 74 -5.777 32.754 16.171 1.00 0.00 H ATOM 268 HG12 ILE A 74 -5.815 31.134 18.148 1.00 0.00 H ATOM 269 HG13 ILE A 74 -5.120 32.753 18.401 1.00 0.00 H ATOM 270 HD11 ILE A 74 -7.222 33.472 19.580 1.00 0.00 H ATOM 271 HD12 ILE A 74 -7.917 31.852 19.327 1.00 0.00 H ATOM 272 HD13 ILE A 74 -6.491 32.055 20.375 1.00 0.00 H ATOM 273 HG21 ILE A 74 -7.636 34.315 16.025 1.00 0.00 H ATOM 274 HG22 ILE A 74 -8.150 33.874 17.672 1.00 0.00 H ATOM 275 HG23 ILE A 74 -6.595 34.703 17.417 1.00 0.00 H ATOM 276 H ILE A 74 -5.892 30.383 15.830 1.00 0.00 H ATOM 277 N GLN A 75 -7.704 32.431 13.994 1.00 25.19 N ATOM 278 CA GLN A 75 -8.322 32.886 12.753 1.00 26.87 C ATOM 279 C GLN A 75 -9.568 32.057 12.319 1.00 28.06 C ATOM 280 O GLN A 75 -10.638 32.604 12.078 1.00 30.30 O ATOM 281 CB GLN A 75 -7.280 32.923 11.617 1.00 24.74 C ATOM 282 CG GLN A 75 -7.660 33.921 10.585 1.00 30.22 C ATOM 283 CD GLN A 75 -6.849 33.816 9.302 1.00 35.63 C ATOM 284 OE1 GLN A 75 -5.804 34.433 9.180 1.00 37.05 O ATOM 285 NE2 GLN A 75 -7.340 33.039 8.344 1.00 37.32 N ATOM 286 HA GLN A 75 -8.690 33.892 12.955 1.00 0.00 H ATOM 287 HB2 GLN A 75 -6.308 33.190 12.032 1.00 0.00 H ATOM 288 HB3 GLN A 75 -7.219 31.937 11.156 1.00 0.00 H ATOM 289 HG2 GLN A 75 -8.712 33.778 10.339 1.00 0.00 H ATOM 290 HG3 GLN A 75 -7.517 34.918 11.002 1.00 0.00 H ATOM 291 HE22 GLN A 75 -8.236 32.532 8.494 1.00 0.00 H ATOM 292 HE21 GLN A 75 -6.829 32.937 7.444 1.00 0.00 H ATOM 293 H GLN A 75 -6.684 32.228 13.994 1.00 0.00 H ATOM 294 N LEU A 76 -9.429 30.745 12.208 1.00 28.35 N ATOM 295 CA LEU A 76 -10.560 29.891 11.916 1.00 28.30 C ATOM 296 C LEU A 76 -11.659 30.002 12.927 1.00 27.79 C ATOM 297 O LEU A 76 -12.858 29.977 12.567 1.00 26.05 O ATOM 298 CB LEU A 76 -10.091 28.448 11.842 1.00 27.77 C ATOM 299 CG LEU A 76 -9.910 27.753 10.488 1.00 32.76 C ATOM 300 CD1 LEU A 76 -9.501 28.698 9.375 1.00 36.54 C ATOM 301 CD2 LEU A 76 -8.967 26.519 10.611 1.00 33.16 C ATOM 302 HA LEU A 76 -10.971 30.220 10.962 1.00 0.00 H ATOM 303 HB2 LEU A 76 -9.125 28.408 12.344 1.00 0.00 H ATOM 304 HB3 LEU A 76 -10.815 27.856 12.402 1.00 0.00 H ATOM 305 HG LEU A 76 -10.892 27.384 10.192 1.00 0.00 H ATOM 306 HD21 LEU A 76 -7.990 26.844 10.970 1.00 0.00 H ATOM 307 HD22 LEU A 76 -9.395 25.805 11.315 1.00 0.00 H ATOM 308 HD23 LEU A 76 -8.858 26.047 9.634 1.00 0.00 H ATOM 309 HD11 LEU A 76 -10.267 29.464 9.251 1.00 0.00 H ATOM 310 HD12 LEU A 76 -8.552 29.169 9.631 1.00 0.00 H ATOM 311 HD13 LEU A 76 -9.391 28.138 8.446 1.00 0.00 H ATOM 312 H LEU A 76 -8.488 30.320 12.333 1.00 0.00 H ATOM 313 N GLY A 77 -11.256 30.082 14.199 1.00 27.01 N ATOM 314 CA GLY A 77 -12.192 30.224 15.308 1.00 26.14 C ATOM 315 C GLY A 77 -13.046 31.454 15.062 1.00 27.26 C ATOM 316 O GLY A 77 -14.294 31.387 15.102 1.00 26.96 O ATOM 317 HA3 GLY A 77 -11.642 30.339 16.242 1.00 0.00 H ATOM 318 HA2 GLY A 77 -12.828 29.341 15.369 1.00 0.00 H ATOM 319 H GLY A 77 -10.237 30.041 14.405 1.00 0.00 H ATOM 320 N GLU A 78 -12.377 32.567 14.779 1.00 27.76 N ATOM 321 CA GLU A 78 -13.019 33.852 14.614 1.00 30.61 C ATOM 322 C GLU A 78 -13.954 33.873 13.377 1.00 32.35 C ATOM 323 O GLU A 78 -15.082 34.318 13.493 1.00 32.16 O ATOM 324 CB GLU A 78 -11.980 34.956 14.487 1.00 30.59 C ATOM 325 CG GLU A 78 -12.622 36.307 14.118 1.00 37.71 C ATOM 326 CD GLU A 78 -11.650 37.468 14.095 1.00 46.36 C ATOM 327 OE1 GLU A 78 -10.499 37.289 13.588 1.00 48.82 O ATOM 328 OE2 GLU A 78 -12.065 38.558 14.576 1.00 49.29 O ATOM 329 HA GLU A 78 -13.626 34.025 15.503 1.00 0.00 H ATOM 330 HB2 GLU A 78 -11.458 35.061 15.438 1.00 0.00 H ATOM 331 HB3 GLU A 78 -11.266 34.681 13.711 1.00 0.00 H ATOM 332 HG2 GLU A 78 -13.069 36.215 13.128 1.00 0.00 H ATOM 333 HG3 GLU A 78 -13.401 36.527 14.848 1.00 0.00 H ATOM 334 H GLU A 78 -11.344 32.511 14.671 1.00 0.00 H ATOM 335 N GLU A 79 -13.471 33.406 12.226 1.00 33.32 N ATOM 336 CA GLU A 79 -14.322 33.277 11.033 1.00 37.10 C ATOM 337 C GLU A 79 -15.561 32.400 11.235 1.00 38.44 C ATOM 338 O GLU A 79 -16.672 32.867 10.987 1.00 40.07 O ATOM 339 CB GLU A 79 -13.513 32.755 9.858 1.00 36.59 C ATOM 340 CG GLU A 79 -12.335 33.671 9.473 1.00 37.60 C ATOM 341 CD GLU A 79 -11.378 32.984 8.525 1.00 40.60 C ATOM 342 OE1 GLU A 79 -11.648 31.828 8.163 1.00 45.17 O ATOM 343 OE2 GLU A 79 -10.362 33.570 8.115 1.00 45.42 O ATOM 344 HA GLU A 79 -14.688 34.283 10.827 1.00 0.00 H ATOM 345 HB2 GLU A 79 -13.117 31.773 10.119 1.00 0.00 H ATOM 346 HB3 GLU A 79 -14.174 32.661 8.997 1.00 0.00 H ATOM 347 HG2 GLU A 79 -12.727 34.567 8.992 1.00 0.00 H ATOM 348 HG3 GLU A 79 -11.796 33.952 10.378 1.00 0.00 H ATOM 349 H GLU A 79 -12.471 33.127 12.170 1.00 0.00 H ATOM 350 N LEU A 80 -15.381 31.164 11.717 1.00 39.63 N ATOM 351 CA LEU A 80 -16.505 30.286 12.009 1.00 40.53 C ATOM 352 C LEU A 80 -17.540 30.879 12.924 1.00 42.66 C ATOM 353 O LEU A 80 -18.752 30.625 12.738 1.00 42.51 O ATOM 354 CB LEU A 80 -16.078 28.944 12.572 1.00 39.68 C ATOM 355 CG LEU A 80 -15.664 27.927 11.524 1.00 40.44 C ATOM 356 CD1 LEU A 80 -14.642 26.980 12.098 1.00 35.34 C ATOM 357 CD2 LEU A 80 -16.914 27.183 10.974 1.00 37.69 C ATOM 358 HA LEU A 80 -16.964 30.144 11.030 1.00 0.00 H ATOM 359 HB2 LEU A 80 -15.233 29.108 13.241 1.00 0.00 H ATOM 360 HB3 LEU A 80 -16.913 28.530 13.138 1.00 0.00 H ATOM 361 HG LEU A 80 -15.197 28.439 10.683 1.00 0.00 H ATOM 362 HD21 LEU A 80 -17.418 26.668 11.792 1.00 0.00 H ATOM 363 HD22 LEU A 80 -17.595 27.904 10.522 1.00 0.00 H ATOM 364 HD23 LEU A 80 -16.602 26.457 10.223 1.00 0.00 H ATOM 365 HD11 LEU A 80 -13.765 27.543 12.417 1.00 0.00 H ATOM 366 HD12 LEU A 80 -15.072 26.459 12.954 1.00 0.00 H ATOM 367 HD13 LEU A 80 -14.353 26.255 11.337 1.00 0.00 H ATOM 368 H LEU A 80 -14.414 30.822 11.887 1.00 0.00 H ATOM 369 N LEU A 81 -17.099 31.662 13.906 1.00 43.70 N ATOM 370 CA LEU A 81 -18.056 32.251 14.820 1.00 45.88 C ATOM 371 C LEU A 81 -18.786 33.403 14.155 1.00 47.45 C ATOM 372 O LEU A 81 -19.945 33.698 14.493 1.00 48.21 O ATOM 373 CB LEU A 81 -17.411 32.747 16.117 1.00 45.97 C ATOM 374 CG LEU A 81 -16.837 31.751 17.130 1.00 46.63 C ATOM 375 CD1 LEU A 81 -16.018 32.551 18.145 1.00 48.02 C ATOM 376 CD2 LEU A 81 -17.884 30.901 17.818 1.00 44.53 C ATOM 377 HA LEU A 81 -18.759 31.459 15.080 1.00 0.00 H ATOM 378 HB2 LEU A 81 -16.592 33.405 15.827 1.00 0.00 H ATOM 379 HB3 LEU A 81 -18.171 33.325 16.643 1.00 0.00 H ATOM 380 HG LEU A 81 -16.215 31.034 16.595 1.00 0.00 H ATOM 381 HD21 LEU A 81 -18.577 31.547 18.357 1.00 0.00 H ATOM 382 HD22 LEU A 81 -18.429 30.324 17.071 1.00 0.00 H ATOM 383 HD23 LEU A 81 -17.397 30.223 18.519 1.00 0.00 H ATOM 384 HD11 LEU A 81 -15.215 33.076 17.628 1.00 0.00 H ATOM 385 HD12 LEU A 81 -16.665 33.273 18.643 1.00 0.00 H ATOM 386 HD13 LEU A 81 -15.593 31.871 18.884 1.00 0.00 H ATOM 387 H LEU A 81 -16.082 31.848 14.015 1.00 0.00 H ATOM 388 N ALA A 82 -18.090 34.084 13.249 1.00 49.00 N ATOM 389 CA ALA A 82 -18.689 35.203 12.536 1.00 49.85 C ATOM 390 C ALA A 82 -19.830 34.586 11.716 1.00 50.48 C ATOM 391 O ALA A 82 -20.969 35.065 11.759 1.00 50.91 O ATOM 392 CB ALA A 82 -17.671 35.892 11.647 1.00 49.47 C ATOM 393 HA ALA A 82 -19.054 35.974 13.215 1.00 0.00 H ATOM 394 HB1 ALA A 82 -16.851 36.267 12.259 1.00 0.00 H ATOM 395 HB2 ALA A 82 -17.286 35.179 10.918 1.00 0.00 H ATOM 396 HB3 ALA A 82 -18.148 36.723 11.128 1.00 0.00 H ATOM 397 H ALA A 82 -17.106 33.814 13.048 1.00 0.00 H ATOM 398 N GLN A 83 -19.525 33.490 11.023 1.00 50.25 N ATOM 399 CA GLN A 83 -20.553 32.744 10.326 1.00 50.94 C ATOM 400 C GLN A 83 -21.571 32.048 11.214 1.00 50.50 C ATOM 401 O GLN A 83 -22.460 31.381 10.703 1.00 51.36 O ATOM 402 CB GLN A 83 -19.930 31.754 9.354 1.00 50.40 C ATOM 403 CG GLN A 83 -18.945 32.437 8.488 1.00 51.20 C ATOM 404 CD GLN A 83 -18.015 31.484 7.836 1.00 54.84 C ATOM 405 OE1 GLN A 83 -18.209 30.259 7.893 1.00 54.42 O ATOM 406 NE2 GLN A 83 -16.974 32.027 7.199 1.00 57.35 N ATOM 407 HA GLN A 83 -21.124 33.499 9.785 1.00 0.00 H ATOM 408 HB2 GLN A 83 -19.430 30.965 9.915 1.00 0.00 H ATOM 409 HB3 GLN A 83 -20.713 31.317 8.734 1.00 0.00 H ATOM 410 HG2 GLN A 83 -19.480 32.990 7.716 1.00 0.00 H ATOM 411 HG3 GLN A 83 -18.366 33.133 9.096 1.00 0.00 H ATOM 412 HE22 GLN A 83 -16.857 33.060 7.181 1.00 0.00 H ATOM 413 HE21 GLN A 83 -16.281 31.417 6.721 1.00 0.00 H ATOM 414 H GLN A 83 -18.538 33.166 10.982 1.00 0.00 H ATOM 415 N GLY A 84 -21.489 32.220 12.525 1.00 50.85 N ATOM 416 CA GLY A 84 -22.446 31.570 13.419 1.00 50.13 C ATOM 417 C GLY A 84 -22.347 30.036 13.505 1.00 49.88 C ATOM 418 O GLY A 84 -23.254 29.400 14.063 1.00 50.24 O ATOM 419 HA3 GLY A 84 -23.449 31.822 13.076 1.00 0.00 H ATOM 420 HA2 GLY A 84 -22.295 31.972 14.421 1.00 0.00 H ATOM 421 H GLY A 84 -20.739 32.822 12.921 1.00 0.00 H ATOM 422 N ASP A 85 -21.287 29.411 12.976 1.00 49.11 N ATOM 423 CA ASP A 85 -21.020 27.980 13.332 1.00 48.25 C ATOM 424 C ASP A 85 -20.313 27.960 14.691 1.00 47.95 C ATOM 425 O ASP A 85 -19.089 27.803 14.787 1.00 47.83 O ATOM 426 CB ASP A 85 -20.227 27.202 12.249 1.00 47.88 C ATOM 427 CG ASP A 85 -20.181 25.628 12.493 1.00 48.97 C ATOM 428 OD1 ASP A 85 -19.869 24.929 11.496 1.00 53.18 O ATOM 429 OD2 ASP A 85 -20.425 25.074 13.623 1.00 44.52 O ATOM 430 HA ASP A 85 -21.972 27.452 13.390 1.00 0.00 H ATOM 431 HB2 ASP A 85 -20.694 27.387 11.282 1.00 0.00 H ATOM 432 HB3 ASP A 85 -19.204 27.578 12.235 1.00 0.00 H ATOM 433 H ASP A 85 -20.654 29.915 12.323 1.00 0.00 H ATOM 434 N TYR A 86 -21.106 28.142 15.742 1.00 47.55 N ATOM 435 CA TYR A 86 -20.602 28.250 17.092 1.00 47.17 C ATOM 436 C TYR A 86 -19.845 27.013 17.542 1.00 45.93 C ATOM 437 O TYR A 86 -18.937 27.090 18.371 1.00 45.46 O ATOM 438 CB TYR A 86 -21.758 28.493 18.060 1.00 47.94 C ATOM 439 CG TYR A 86 -22.358 29.890 18.065 1.00 49.93 C ATOM 440 CD1 TYR A 86 -23.625 30.109 18.628 1.00 52.12 C ATOM 441 CD2 TYR A 86 -21.686 30.985 17.503 1.00 51.60 C ATOM 442 CE1 TYR A 86 -24.201 31.397 18.661 1.00 54.22 C ATOM 443 CE2 TYR A 86 -22.262 32.276 17.507 1.00 53.41 C ATOM 444 CZ TYR A 86 -23.520 32.471 18.093 1.00 54.69 C ATOM 445 OH TYR A 86 -24.107 33.726 18.135 1.00 55.54 O ATOM 446 HA TYR A 86 -19.905 29.088 17.097 1.00 0.00 H ATOM 447 HB3 TYR A 86 -21.396 28.284 19.067 1.00 0.00 H ATOM 448 HB2 TYR A 86 -22.554 27.792 17.808 1.00 0.00 H ATOM 449 HD2 TYR A 86 -20.703 30.838 17.056 1.00 0.00 H ATOM 450 HE2 TYR A 86 -21.731 33.115 17.057 1.00 0.00 H ATOM 451 HE1 TYR A 86 -25.174 31.550 19.129 1.00 0.00 H ATOM 452 HD1 TYR A 86 -24.175 29.267 19.048 1.00 0.00 H ATOM 453 HH TYR A 86 -24.987 33.663 18.585 1.00 0.00 H ATOM 454 H TYR A 86 -22.132 28.210 15.586 1.00 0.00 H ATOM 455 N GLU A 87 -20.209 25.869 16.992 1.00 44.43 N ATOM 456 CA GLU A 87 -19.659 24.644 17.493 1.00 42.91 C ATOM 457 C GLU A 87 -18.250 24.449 16.956 1.00 40.16 C ATOM 458 O GLU A 87 -17.322 24.193 17.726 1.00 39.10 O ATOM 459 CB GLU A 87 -20.569 23.454 17.195 1.00 43.54 C ATOM 460 CG GLU A 87 -20.710 22.517 18.389 1.00 49.00 C ATOM 461 CD GLU A 87 -21.582 21.280 18.087 1.00 56.63 C ATOM 462 OE1 GLU A 87 -21.800 20.975 16.873 1.00 57.92 O ATOM 463 OE2 GLU A 87 -22.051 20.626 19.067 1.00 57.92 O ATOM 464 HA GLU A 87 -19.595 24.708 18.579 1.00 0.00 H ATOM 465 HB2 GLU A 87 -21.557 23.827 16.924 1.00 0.00 H ATOM 466 HB3 GLU A 87 -20.151 22.895 16.358 1.00 0.00 H ATOM 467 HG2 GLU A 87 -19.717 22.178 18.684 1.00 0.00 H ATOM 468 HG3 GLU A 87 -21.164 23.069 19.212 1.00 0.00 H ATOM 469 H GLU A 87 -20.887 25.857 16.204 1.00 0.00 H ATOM 470 N LYS A 88 -18.077 24.594 15.656 1.00 36.71 N ATOM 471 CA LYS A 88 -16.746 24.485 15.093 1.00 34.51 C ATOM 472 C LYS A 88 -15.823 25.665 15.454 1.00 32.22 C ATOM 473 O LYS A 88 -14.618 25.478 15.575 1.00 31.12 O ATOM 474 CB LYS A 88 -16.780 24.304 13.578 1.00 35.34 C ATOM 475 CG LYS A 88 -17.216 22.915 13.110 1.00 40.44 C ATOM 476 CD LYS A 88 -17.526 22.930 11.632 1.00 45.35 C ATOM 477 CE LYS A 88 -17.727 21.530 11.070 1.00 51.11 C ATOM 478 NZ LYS A 88 -17.667 21.659 9.567 1.00 52.47 N ATOM 479 HA LYS A 88 -16.323 23.591 15.551 1.00 0.00 H ATOM 480 HB2 LYS A 88 -17.474 25.035 13.164 1.00 0.00 H ATOM 481 HB3 LYS A 88 -15.779 24.495 13.190 1.00 0.00 H ATOM 482 HG2 LYS A 88 -16.413 22.203 13.302 1.00 0.00 H ATOM 483 HG3 LYS A 88 -18.107 22.613 13.661 1.00 0.00 H ATOM 484 HD2 LYS A 88 -18.436 23.507 11.470 1.00 0.00 H ATOM 485 HD3 LYS A 88 -16.698 23.404 11.105 1.00 0.00 H ATOM 486 HE2 LYS A 88 -18.696 21.137 11.376 1.00 0.00 H ATOM 487 HE3 LYS A 88 -16.939 20.865 11.423 1.00 0.00 H ATOM 488 HZ1 LYS A 88 -18.419 22.301 9.245 1.00 0.00 H ATOM 489 HZ2 LYS A 88 -16.741 22.042 9.290 1.00 0.00 H ATOM 490 HZ3 LYS A 88 -17.800 20.723 9.134 1.00 0.00 H ATOM 491 H LYS A 88 -18.892 24.786 15.038 1.00 0.00 H ATOM 492 N GLY A 89 -16.374 26.870 15.588 1.00 29.93 N ATOM 493 CA GLY A 89 -15.563 28.016 15.985 1.00 28.97 C ATOM 494 C GLY A 89 -14.926 27.769 17.370 1.00 28.01 C ATOM 495 O GLY A 89 -13.757 28.008 17.562 1.00 28.08 O ATOM 496 HA3 GLY A 89 -16.194 28.904 16.032 1.00 0.00 H ATOM 497 HA2 GLY A 89 -14.774 28.171 15.249 1.00 0.00 H ATOM 498 H GLY A 89 -17.391 26.995 15.408 1.00 0.00 H ATOM 499 N VAL A 90 -15.716 27.265 18.303 1.00 27.31 N ATOM 500 CA VAL A 90 -15.290 26.927 19.659 1.00 27.20 C ATOM 501 C VAL A 90 -14.271 25.806 19.702 1.00 26.18 C ATOM 502 O VAL A 90 -13.344 25.843 20.542 1.00 24.11 O ATOM 503 CB VAL A 90 -16.535 26.661 20.534 1.00 27.20 C ATOM 504 CG1 VAL A 90 -16.218 26.039 21.918 1.00 27.54 C ATOM 505 CG2 VAL A 90 -17.195 27.996 20.759 1.00 29.53 C ATOM 506 HA VAL A 90 -14.757 27.781 20.077 1.00 0.00 H ATOM 507 HB VAL A 90 -17.163 25.939 20.012 1.00 0.00 H ATOM 508 HG11 VAL A 90 -15.714 25.083 21.778 1.00 0.00 H ATOM 509 HG12 VAL A 90 -15.571 26.714 22.478 1.00 0.00 H ATOM 510 HG13 VAL A 90 -17.147 25.885 22.467 1.00 0.00 H ATOM 511 HG21 VAL A 90 -16.498 28.664 21.266 1.00 0.00 H ATOM 512 HG22 VAL A 90 -17.479 28.426 19.798 1.00 0.00 H ATOM 513 HG23 VAL A 90 -18.084 27.861 21.375 1.00 0.00 H ATOM 514 H VAL A 90 -16.712 27.097 18.054 1.00 0.00 H ATOM 515 N ASP A 91 -14.392 24.857 18.762 1.00 26.28 N ATOM 516 CA ASP A 91 -13.443 23.728 18.626 1.00 26.53 C ATOM 517 C ASP A 91 -12.081 24.269 18.276 1.00 24.60 C ATOM 518 O ASP A 91 -11.126 23.931 18.892 1.00 25.64 O ATOM 519 CB ASP A 91 -13.910 22.754 17.519 1.00 27.64 C ATOM 520 CG ASP A 91 -15.039 21.823 17.996 1.00 36.46 C ATOM 521 OD1 ASP A 91 -15.398 21.844 19.243 1.00 41.01 O ATOM 522 OD2 ASP A 91 -15.564 21.052 17.137 1.00 40.54 O ATOM 523 HA ASP A 91 -13.400 23.186 19.571 1.00 0.00 H ATOM 524 HB2 ASP A 91 -14.270 23.335 16.670 1.00 0.00 H ATOM 525 HB3 ASP A 91 -13.062 22.145 17.207 1.00 0.00 H ATOM 526 H ASP A 91 -15.190 24.917 18.097 1.00 0.00 H ATOM 527 N HIS A 92 -12.022 25.144 17.286 1.00 23.78 N ATOM 528 CA HIS A 92 -10.772 25.820 16.860 1.00 23.86 C ATOM 529 C HIS A 92 -10.134 26.684 18.008 1.00 22.50 C ATOM 530 O HIS A 92 -8.959 26.487 18.374 1.00 22.58 O ATOM 531 CB HIS A 92 -11.004 26.595 15.540 1.00 22.84 C ATOM 532 CG HIS A 92 -11.210 25.691 14.348 1.00 28.22 C ATOM 533 ND1 HIS A 92 -10.228 24.834 13.874 1.00 30.64 N ATOM 534 CD2 HIS A 92 -12.308 25.462 13.575 1.00 27.81 C ATOM 535 CE1 HIS A 92 -10.703 24.142 12.851 1.00 34.47 C ATOM 536 NE2 HIS A 92 -11.965 24.500 12.652 1.00 34.37 N ATOM 537 HA HIS A 92 -10.021 25.059 16.649 1.00 0.00 H ATOM 538 HB2 HIS A 92 -11.888 27.222 15.657 1.00 0.00 H ATOM 539 HB3 HIS A 92 -10.135 27.226 15.351 1.00 0.00 H ATOM 540 HD2 HIS A 92 -13.278 25.950 13.670 1.00 0.00 H ATOM 541 HE1 HIS A 92 -10.151 23.403 12.270 1.00 0.00 H ATOM 542 H HIS A 92 -12.901 25.371 16.778 1.00 0.00 H ATOM 543 N LEU A 93 -10.937 27.553 18.631 1.00 21.81 N ATOM 544 CA LEU A 93 -10.498 28.321 19.832 1.00 21.71 C ATOM 545 C LEU A 93 -9.963 27.389 20.924 1.00 21.19 C ATOM 546 O LEU A 93 -8.955 27.702 21.527 1.00 22.15 O ATOM 547 CB LEU A 93 -11.593 29.264 20.393 1.00 19.77 C ATOM 548 CG LEU A 93 -12.030 30.396 19.407 1.00 19.82 C ATOM 549 CD1 LEU A 93 -13.241 31.196 19.948 1.00 18.11 C ATOM 550 CD2 LEU A 93 -10.878 31.326 18.924 1.00 19.12 C ATOM 551 HA LEU A 93 -9.685 28.964 19.496 1.00 0.00 H ATOM 552 HB2 LEU A 93 -12.470 28.664 20.635 1.00 0.00 H ATOM 553 HB3 LEU A 93 -11.211 29.730 21.301 1.00 0.00 H ATOM 554 HG LEU A 93 -12.349 29.872 18.506 1.00 0.00 H ATOM 555 HD21 LEU A 93 -10.424 31.817 19.785 1.00 0.00 H ATOM 556 HD22 LEU A 93 -10.126 30.731 18.405 1.00 0.00 H ATOM 557 HD23 LEU A 93 -11.280 32.078 18.245 1.00 0.00 H ATOM 558 HD11 LEU A 93 -14.085 30.522 20.091 1.00 0.00 H ATOM 559 HD12 LEU A 93 -12.975 31.655 20.900 1.00 0.00 H ATOM 560 HD13 LEU A 93 -13.511 31.972 19.232 1.00 0.00 H ATOM 561 H LEU A 93 -11.900 27.698 18.266 1.00 0.00 H ATOM 562 N THR A 94 -10.599 26.248 21.127 1.00 19.49 N ATOM 563 CA THR A 94 -10.152 25.280 22.142 1.00 21.47 C ATOM 564 C THR A 94 -8.741 24.725 21.832 1.00 20.25 C ATOM 565 O THR A 94 -7.908 24.571 22.722 1.00 20.86 O ATOM 566 CB THR A 94 -11.226 24.111 22.236 1.00 22.48 C ATOM 567 OG1 THR A 94 -12.411 24.663 22.823 1.00 24.15 O ATOM 568 CG2 THR A 94 -10.795 23.057 23.094 1.00 25.02 C ATOM 569 HA THR A 94 -10.074 25.785 23.105 1.00 0.00 H ATOM 570 HB THR A 94 -11.384 23.710 21.235 1.00 0.00 H ATOM 571 HG1 THR A 94 -12.748 25.399 22.253 1.00 0.00 H ATOM 572 HG23 THR A 94 -9.891 22.605 22.686 1.00 0.00 H ATOM 573 HG21 THR A 94 -10.586 23.460 24.085 1.00 0.00 H ATOM 574 HG22 THR A 94 -11.580 22.304 23.165 1.00 0.00 H ATOM 575 H THR A 94 -11.438 26.028 20.554 1.00 0.00 H ATOM 576 N ASN A 95 -8.497 24.398 20.566 1.00 18.87 N ATOM 577 CA ASN A 95 -7.156 24.029 20.095 1.00 18.17 C ATOM 578 C ASN A 95 -6.101 25.119 20.362 1.00 16.10 C ATOM 579 O ASN A 95 -5.015 24.798 20.771 1.00 17.71 O ATOM 580 CB ASN A 95 -7.139 23.735 18.591 1.00 17.85 C ATOM 581 CG ASN A 95 -7.921 22.516 18.212 1.00 21.00 C ATOM 582 OD1 ASN A 95 -8.230 21.720 19.056 1.00 21.79 O ATOM 583 ND2 ASN A 95 -8.262 22.364 16.896 1.00 18.47 N ATOM 584 HA ASN A 95 -6.903 23.134 20.663 1.00 0.00 H ATOM 585 HB2 ASN A 95 -7.561 24.593 18.067 1.00 0.00 H ATOM 586 HB3 ASN A 95 -6.104 23.593 18.279 1.00 0.00 H ATOM 587 HD22 ASN A 95 -7.973 23.079 16.198 1.00 0.00 H ATOM 588 HD21 ASN A 95 -8.810 21.534 16.593 1.00 0.00 H ATOM 589 H ASN A 95 -9.284 24.404 19.886 1.00 0.00 H ATOM 590 N ALA A 96 -6.412 26.385 20.142 1.00 14.80 N ATOM 591 CA ALA A 96 -5.467 27.440 20.393 1.00 15.30 C ATOM 592 C ALA A 96 -5.204 27.559 21.911 1.00 15.88 C ATOM 593 O ALA A 96 -4.059 27.677 22.341 1.00 14.64 O ATOM 594 CB ALA A 96 -5.970 28.777 19.780 1.00 15.16 C ATOM 595 HA ALA A 96 -4.520 27.202 19.909 1.00 0.00 H ATOM 596 HB1 ALA A 96 -6.092 28.658 18.703 1.00 0.00 H ATOM 597 HB2 ALA A 96 -6.927 29.043 20.228 1.00 0.00 H ATOM 598 HB3 ALA A 96 -5.242 29.563 19.980 1.00 0.00 H ATOM 599 H ALA A 96 -7.358 26.623 19.781 1.00 0.00 H ATOM 600 N ILE A 97 -6.255 27.423 22.720 1.00 16.33 N ATOM 601 CA ILE A 97 -6.118 27.503 24.190 1.00 16.59 C ATOM 602 C ILE A 97 -5.274 26.318 24.659 1.00 17.84 C ATOM 603 O ILE A 97 -4.301 26.502 25.364 1.00 17.89 O ATOM 604 CB ILE A 97 -7.511 27.555 24.868 1.00 17.93 C ATOM 605 CG1 ILE A 97 -8.222 28.865 24.461 1.00 15.29 C ATOM 606 CG2 ILE A 97 -7.388 27.249 26.454 1.00 17.11 C ATOM 607 CD1 ILE A 97 -9.863 28.777 24.623 1.00 20.14 C ATOM 608 HA ILE A 97 -5.610 28.423 24.479 1.00 0.00 H ATOM 609 HB ILE A 97 -8.166 26.759 24.514 1.00 0.00 H ATOM 610 HG12 ILE A 97 -7.852 29.673 25.092 1.00 0.00 H ATOM 611 HG13 ILE A 97 -7.985 29.081 23.419 1.00 0.00 H ATOM 612 HD11 ILE A 97 -10.247 27.977 23.989 1.00 0.00 H ATOM 613 HD12 ILE A 97 -10.114 28.570 25.663 1.00 0.00 H ATOM 614 HD13 ILE A 97 -10.308 29.726 24.323 1.00 0.00 H ATOM 615 HG21 ILE A 97 -6.962 26.256 26.599 1.00 0.00 H ATOM 616 HG22 ILE A 97 -6.742 27.995 26.918 1.00 0.00 H ATOM 617 HG23 ILE A 97 -8.378 27.291 26.909 1.00 0.00 H ATOM 618 H ILE A 97 -7.195 27.256 22.307 1.00 0.00 H ATOM 619 N ALA A 98 -5.525 25.136 24.096 1.00 19.27 N ATOM 620 CA ALA A 98 -4.795 23.904 24.501 1.00 19.03 C ATOM 621 C ALA A 98 -3.261 23.969 24.366 1.00 19.50 C ATOM 622 O ALA A 98 -2.513 23.233 25.105 1.00 21.53 O ATOM 623 CB ALA A 98 -5.332 22.700 23.699 1.00 18.02 C ATOM 624 HA ALA A 98 -4.985 23.795 25.569 1.00 0.00 H ATOM 625 HB1 ALA A 98 -6.396 22.576 23.901 1.00 0.00 H ATOM 626 HB2 ALA A 98 -5.182 22.878 22.634 1.00 0.00 H ATOM 627 HB3 ALA A 98 -4.796 21.799 23.997 1.00 0.00 H ATOM 628 H ALA A 98 -6.251 25.073 23.354 1.00 0.00 H ATOM 629 N VAL A 99 -2.768 24.770 23.421 1.00 17.95 N ATOM 630 CA VAL A 99 -1.347 24.861 23.224 1.00 18.14 C ATOM 631 C VAL A 99 -0.626 25.962 24.040 1.00 20.40 C ATOM 632 O VAL A 99 0.577 26.140 23.897 1.00 20.47 O ATOM 633 CB VAL A 99 -0.891 24.850 21.689 1.00 17.67 C ATOM 634 CG1 VAL A 99 -1.277 23.489 21.022 1.00 15.73 C ATOM 635 CG2 VAL A 99 -1.414 26.052 20.900 1.00 13.36 C ATOM 636 HA VAL A 99 -0.998 23.923 23.655 1.00 0.00 H ATOM 637 HB VAL A 99 0.195 24.947 21.669 1.00 0.00 H ATOM 638 HG11 VAL A 99 -0.781 22.674 21.549 1.00 0.00 H ATOM 639 HG12 VAL A 99 -2.357 23.353 21.075 1.00 0.00 H ATOM 640 HG13 VAL A 99 -0.961 23.495 19.979 1.00 0.00 H ATOM 641 HG21 VAL A 99 -2.504 26.053 20.922 1.00 0.00 H ATOM 642 HG22 VAL A 99 -1.039 26.971 21.350 1.00 0.00 H ATOM 643 HG23 VAL A 99 -1.070 25.985 19.868 1.00 0.00 H ATOM 644 H VAL A 99 -3.412 25.329 22.826 1.00 0.00 H ATOM 645 N CYS A 100 -1.372 26.697 24.866 1.00 21.62 N ATOM 646 CA CYS A 100 -0.808 27.764 25.693 1.00 23.01 C ATOM 647 C CYS A 100 -0.637 27.246 27.096 1.00 22.89 C ATOM 648 O CYS A 100 -1.583 26.762 27.691 1.00 20.95 O ATOM 649 CB CYS A 100 -1.786 28.953 25.752 1.00 22.80 C ATOM 650 SG CYS A 100 -2.176 29.563 24.117 1.00 27.76 S ATOM 651 HA CYS A 100 0.144 28.081 25.268 1.00 0.00 H ATOM 652 HB2 CYS A 100 -1.332 29.757 26.331 1.00 0.00 H ATOM 653 HB3 CYS A 100 -2.706 28.631 26.239 1.00 0.00 H ATOM 654 HG CYS A 100 -2.759 28.554 23.378 1.00 0.00 H ATOM 655 H CYS A 100 -2.392 26.505 24.924 1.00 0.00 H ATOM 656 N GLY A 101 0.552 27.438 27.666 1.00 23.79 N ATOM 657 CA GLY A 101 0.750 27.007 29.024 1.00 24.36 C ATOM 658 C GLY A 101 -0.018 27.822 30.022 1.00 25.47 C ATOM 659 O GLY A 101 -0.355 27.340 31.098 1.00 26.09 O ATOM 660 HA3 GLY A 101 1.812 27.081 29.260 1.00 0.00 H ATOM 661 HA2 GLY A 101 0.432 25.968 29.107 1.00 0.00 H ATOM 662 H GLY A 101 1.324 27.892 27.138 1.00 0.00 H ATOM 663 N GLN A 102 -0.283 29.072 29.675 1.00 26.82 N ATOM 664 CA GLN A 102 -0.994 29.975 30.565 1.00 28.46 C ATOM 665 C GLN A 102 -2.059 30.729 29.744 1.00 27.64 C ATOM 666 O GLN A 102 -1.803 31.853 29.282 1.00 27.44 O ATOM 667 CB GLN A 102 -0.009 30.932 31.230 1.00 29.67 C ATOM 668 CG GLN A 102 0.891 30.242 32.279 1.00 35.77 C ATOM 669 CD GLN A 102 1.844 31.233 32.956 1.00 45.00 C ATOM 670 OE1 GLN A 102 2.802 31.771 32.329 1.00 45.77 O ATOM 671 NE2 GLN A 102 1.593 31.480 34.244 1.00 48.38 N ATOM 672 HA GLN A 102 -1.492 29.420 31.360 1.00 0.00 H ATOM 673 HB2 GLN A 102 0.627 31.367 30.459 1.00 0.00 H ATOM 674 HB3 GLN A 102 -0.573 31.724 31.723 1.00 0.00 H ATOM 675 HG2 GLN A 102 0.259 29.785 33.040 1.00 0.00 H ATOM 676 HG3 GLN A 102 1.479 29.469 31.785 1.00 0.00 H ATOM 677 HE22 GLN A 102 0.793 31.013 34.717 1.00 0.00 H ATOM 678 HE21 GLN A 102 2.198 32.139 34.774 1.00 0.00 H ATOM 679 H GLN A 102 0.025 29.416 28.743 1.00 0.00 H ATOM 680 N PRO A 103 -3.230 30.099 29.528 1.00 26.52 N ATOM 681 CA PRO A 103 -4.243 30.699 28.644 1.00 27.11 C ATOM 682 C PRO A 103 -5.102 31.817 29.297 1.00 27.32 C ATOM 683 O PRO A 103 -6.047 32.246 28.685 1.00 27.47 O ATOM 684 CB PRO A 103 -5.119 29.514 28.313 1.00 25.48 C ATOM 685 CG PRO A 103 -5.151 28.729 29.548 1.00 26.31 C ATOM 686 CD PRO A 103 -3.737 28.862 30.147 1.00 26.43 C ATOM 687 HA PRO A 103 -3.773 31.198 27.797 1.00 0.00 H ATOM 688 HD3 PRO A 103 -3.778 28.955 31.232 1.00 0.00 H ATOM 689 HD2 PRO A 103 -3.116 28.007 29.880 1.00 0.00 H ATOM 690 HG3 PRO A 103 -5.379 27.685 29.332 1.00 0.00 H ATOM 691 HG2 PRO A 103 -5.897 29.128 30.236 1.00 0.00 H ATOM 692 HB2 PRO A 103 -6.122 29.840 28.037 1.00 0.00 H ATOM 693 HB3 PRO A 103 -4.690 28.933 27.497 1.00 0.00 H ATOM 694 N GLN A 104 -4.769 32.283 30.506 1.00 28.55 N ATOM 695 CA GLN A 104 -5.643 33.234 31.296 1.00 29.67 C ATOM 696 C GLN A 104 -5.917 34.518 30.561 1.00 30.07 C ATOM 697 O GLN A 104 -7.071 34.961 30.521 1.00 30.53 O ATOM 698 CB GLN A 104 -5.060 33.636 32.630 1.00 30.35 C ATOM 699 CG GLN A 104 -4.847 32.491 33.591 1.00 34.03 C ATOM 700 CD GLN A 104 -3.478 31.726 33.376 1.00 39.91 C ATOM 701 OE1 GLN A 104 -2.827 31.786 32.303 1.00 41.27 O ATOM 702 NE2 GLN A 104 -3.061 31.015 34.413 1.00 40.67 N ATOM 703 HA GLN A 104 -6.557 32.659 31.445 1.00 0.00 H ATOM 704 HB2 GLN A 104 -4.097 34.114 32.451 1.00 0.00 H ATOM 705 HB3 GLN A 104 -5.738 34.351 33.097 1.00 0.00 H ATOM 706 HG2 GLN A 104 -4.865 32.886 34.607 1.00 0.00 H ATOM 707 HG3 GLN A 104 -5.663 31.779 33.465 1.00 0.00 H ATOM 708 HE22 GLN A 104 -3.626 30.988 35.286 1.00 0.00 H ATOM 709 HE21 GLN A 104 -2.169 30.484 34.354 1.00 0.00 H ATOM 710 H GLN A 104 -3.867 31.977 30.923 1.00 0.00 H ATOM 711 N GLN A 105 -4.877 35.121 29.985 1.00 28.39 N ATOM 712 CA GLN A 105 -5.069 36.342 29.245 1.00 28.38 C ATOM 713 C GLN A 105 -5.891 36.166 27.965 1.00 26.57 C ATOM 714 O GLN A 105 -6.704 37.051 27.609 1.00 24.42 O ATOM 715 CB GLN A 105 -3.745 36.943 28.828 1.00 29.97 C ATOM 716 CG GLN A 105 -3.967 38.325 28.171 1.00 37.95 C ATOM 717 CD GLN A 105 -3.789 39.489 29.169 1.00 45.94 C ATOM 718 OE1 GLN A 105 -2.659 39.826 29.541 1.00 50.73 O ATOM 719 NE2 GLN A 105 -4.892 40.116 29.570 1.00 47.89 N ATOM 720 HA GLN A 105 -5.611 36.992 29.932 1.00 0.00 H ATOM 721 HB2 GLN A 105 -3.110 37.060 29.706 1.00 0.00 H ATOM 722 HB3 GLN A 105 -3.257 36.279 28.114 1.00 0.00 H ATOM 723 HG2 GLN A 105 -3.249 38.446 27.360 1.00 0.00 H ATOM 724 HG3 GLN A 105 -4.979 38.362 27.767 1.00 0.00 H ATOM 725 HE22 GLN A 105 -5.823 39.799 29.232 1.00 0.00 H ATOM 726 HE21 GLN A 105 -4.823 40.924 30.222 1.00 0.00 H ATOM 727 H GLN A 105 -3.926 34.709 30.070 1.00 0.00 H ATOM 728 N LEU A 106 -5.655 35.056 27.253 1.00 23.93 N ATOM 729 CA LEU A 106 -6.392 34.784 26.042 1.00 23.40 C ATOM 730 C LEU A 106 -7.850 34.610 26.426 1.00 21.87 C ATOM 731 O LEU A 106 -8.742 35.044 25.712 1.00 20.78 O ATOM 732 CB LEU A 106 -5.874 33.508 25.372 1.00 23.16 C ATOM 733 CG LEU A 106 -6.690 32.852 24.282 1.00 22.66 C ATOM 734 CD1 LEU A 106 -6.870 33.752 23.104 1.00 26.05 C ATOM 735 CD2 LEU A 106 -5.999 31.598 23.831 1.00 21.82 C ATOM 736 HA LEU A 106 -6.271 35.605 25.335 1.00 0.00 H ATOM 737 HB2 LEU A 106 -4.903 33.749 24.939 1.00 0.00 H ATOM 738 HB3 LEU A 106 -5.745 32.767 26.160 1.00 0.00 H ATOM 739 HG LEU A 106 -7.674 32.627 24.694 1.00 0.00 H ATOM 740 HD21 LEU A 106 -5.010 31.848 23.447 1.00 0.00 H ATOM 741 HD22 LEU A 106 -5.901 30.915 24.675 1.00 0.00 H ATOM 742 HD23 LEU A 106 -6.586 31.124 23.045 1.00 0.00 H ATOM 743 HD11 LEU A 106 -7.385 34.660 23.418 1.00 0.00 H ATOM 744 HD12 LEU A 106 -5.894 34.010 22.693 1.00 0.00 H ATOM 745 HD13 LEU A 106 -7.462 33.241 22.345 1.00 0.00 H ATOM 746 H LEU A 106 -4.932 34.382 27.577 1.00 0.00 H ATOM 747 N LEU A 107 -8.086 33.965 27.550 1.00 19.95 N ATOM 748 CA LEU A 107 -9.463 33.711 27.994 1.00 21.15 C ATOM 749 C LEU A 107 -10.206 34.995 28.430 1.00 21.20 C ATOM 750 O LEU A 107 -11.396 35.207 28.114 1.00 21.52 O ATOM 751 CB LEU A 107 -9.499 32.632 29.104 1.00 20.29 C ATOM 752 CG LEU A 107 -9.292 31.205 28.568 1.00 20.34 C ATOM 753 CD1 LEU A 107 -9.000 30.296 29.783 1.00 19.69 C ATOM 754 CD2 LEU A 107 -10.569 30.761 27.899 1.00 13.31 C ATOM 755 HA LEU A 107 -10.003 33.330 27.127 1.00 0.00 H ATOM 756 HB2 LEU A 107 -8.711 32.849 29.825 1.00 0.00 H ATOM 757 HB3 LEU A 107 -10.468 32.678 29.602 1.00 0.00 H ATOM 758 HG LEU A 107 -8.471 31.158 27.852 1.00 0.00 H ATOM 759 HD21 LEU A 107 -11.382 30.774 28.625 1.00 0.00 H ATOM 760 HD22 LEU A 107 -10.803 31.439 27.078 1.00 0.00 H ATOM 761 HD23 LEU A 107 -10.442 29.750 27.512 1.00 0.00 H ATOM 762 HD11 LEU A 107 -8.103 30.648 30.291 1.00 0.00 H ATOM 763 HD12 LEU A 107 -9.845 30.328 30.471 1.00 0.00 H ATOM 764 HD13 LEU A 107 -8.847 29.272 29.441 1.00 0.00 H ATOM 765 H LEU A 107 -7.289 33.632 28.129 1.00 0.00 H ATOM 766 N GLN A 108 -9.504 35.851 29.132 1.00 20.99 N ATOM 767 CA GLN A 108 -10.039 37.158 29.448 1.00 23.55 C ATOM 768 C GLN A 108 -10.365 37.976 28.193 1.00 22.85 C ATOM 769 O GLN A 108 -11.429 38.623 28.146 1.00 22.66 O ATOM 770 CB GLN A 108 -9.124 37.938 30.389 1.00 24.41 C ATOM 771 CG GLN A 108 -9.498 39.470 30.515 1.00 32.05 C ATOM 772 CD GLN A 108 -8.442 40.303 31.279 1.00 40.10 C ATOM 773 OE1 GLN A 108 -7.882 41.286 30.753 1.00 46.90 O ATOM 774 NE2 GLN A 108 -8.164 39.902 32.505 1.00 41.97 N ATOM 775 HA GLN A 108 -10.979 36.982 29.971 1.00 0.00 H ATOM 776 HB2 GLN A 108 -9.183 37.487 31.379 1.00 0.00 H ATOM 777 HB3 GLN A 108 -8.102 37.862 30.017 1.00 0.00 H ATOM 778 HG2 GLN A 108 -9.604 39.883 29.512 1.00 0.00 H ATOM 779 HG3 GLN A 108 -10.449 39.551 31.042 1.00 0.00 H ATOM 780 HE22 GLN A 108 -8.654 39.077 32.906 1.00 0.00 H ATOM 781 HE21 GLN A 108 -7.455 40.411 33.070 1.00 0.00 H ATOM 782 H GLN A 108 -8.554 35.589 29.465 1.00 0.00 H ATOM 783 N VAL A 109 -9.514 37.931 27.166 1.00 23.42 N ATOM 784 CA VAL A 109 -9.798 38.631 25.876 1.00 22.81 C ATOM 785 C VAL A 109 -11.036 37.992 25.212 1.00 22.76 C ATOM 786 O VAL A 109 -11.981 38.650 24.829 1.00 23.68 O ATOM 787 CB VAL A 109 -8.560 38.544 24.952 1.00 23.63 C ATOM 788 CG1 VAL A 109 -8.851 38.982 23.557 1.00 24.16 C ATOM 789 CG2 VAL A 109 -7.426 39.395 25.544 1.00 23.32 C ATOM 790 HA VAL A 109 -10.009 39.684 26.061 1.00 0.00 H ATOM 791 HB VAL A 109 -8.262 37.497 24.898 1.00 0.00 H ATOM 792 HG11 VAL A 109 -9.630 38.348 23.133 1.00 0.00 H ATOM 793 HG12 VAL A 109 -9.189 40.018 23.566 1.00 0.00 H ATOM 794 HG13 VAL A 109 -7.946 38.899 22.955 1.00 0.00 H ATOM 795 HG21 VAL A 109 -7.754 40.432 25.621 1.00 0.00 H ATOM 796 HG22 VAL A 109 -7.171 39.019 26.535 1.00 0.00 H ATOM 797 HG23 VAL A 109 -6.552 39.336 24.895 1.00 0.00 H ATOM 798 H VAL A 109 -8.629 37.394 27.266 1.00 0.00 H ATOM 799 N LEU A 110 -11.057 36.685 25.099 1.00 22.18 N ATOM 800 CA LEU A 110 -12.241 36.008 24.592 1.00 20.06 C ATOM 801 C LEU A 110 -13.535 36.296 25.392 1.00 20.08 C ATOM 802 O LEU A 110 -14.623 36.442 24.826 1.00 19.33 O ATOM 803 CB LEU A 110 -11.963 34.504 24.474 1.00 19.90 C ATOM 804 CG LEU A 110 -10.956 34.064 23.398 1.00 21.64 C ATOM 805 CD1 LEU A 110 -10.660 32.554 23.540 1.00 20.63 C ATOM 806 CD2 LEU A 110 -11.488 34.390 21.996 1.00 19.84 C ATOM 807 HA LEU A 110 -12.441 36.421 23.603 1.00 0.00 H ATOM 808 HB2 LEU A 110 -11.586 34.162 25.438 1.00 0.00 H ATOM 809 HB3 LEU A 110 -12.911 34.010 24.260 1.00 0.00 H ATOM 810 HG LEU A 110 -10.025 34.614 23.538 1.00 0.00 H ATOM 811 HD21 LEU A 110 -12.430 33.865 21.835 1.00 0.00 H ATOM 812 HD22 LEU A 110 -11.650 35.465 21.911 1.00 0.00 H ATOM 813 HD23 LEU A 110 -10.761 34.071 21.250 1.00 0.00 H ATOM 814 HD11 LEU A 110 -10.241 32.358 24.527 1.00 0.00 H ATOM 815 HD12 LEU A 110 -11.585 31.991 23.419 1.00 0.00 H ATOM 816 HD13 LEU A 110 -9.946 32.251 22.774 1.00 0.00 H ATOM 817 H LEU A 110 -10.222 36.129 25.374 1.00 0.00 H ATOM 818 N GLN A 111 -13.444 36.408 26.698 1.00 20.31 N ATOM 819 CA GLN A 111 -14.654 36.718 27.482 1.00 21.56 C ATOM 820 C GLN A 111 -15.204 38.121 27.076 1.00 22.79 C ATOM 821 O GLN A 111 -16.433 38.340 27.124 1.00 21.42 O ATOM 822 CB GLN A 111 -14.380 36.632 28.985 1.00 21.19 C ATOM 823 CG GLN A 111 -15.628 36.808 29.928 1.00 26.00 C ATOM 824 CD GLN A 111 -15.803 38.252 30.412 1.00 30.90 C ATOM 825 OE1 GLN A 111 -14.828 39.009 30.485 1.00 30.52 O ATOM 826 NE2 GLN A 111 -17.054 38.630 30.777 1.00 30.21 N ATOM 827 HA GLN A 111 -15.417 35.972 27.257 1.00 0.00 H ATOM 828 HB2 GLN A 111 -13.944 35.654 29.189 1.00 0.00 H ATOM 829 HB3 GLN A 111 -13.659 37.410 29.237 1.00 0.00 H ATOM 830 HG2 GLN A 111 -16.523 36.512 29.381 1.00 0.00 H ATOM 831 HG3 GLN A 111 -15.504 36.161 30.796 1.00 0.00 H ATOM 832 HE22 GLN A 111 -17.844 37.958 30.698 1.00 0.00 H ATOM 833 HE21 GLN A 111 -17.223 39.591 31.136 1.00 0.00 H ATOM 834 H GLN A 111 -12.528 36.279 27.174 1.00 0.00 H ATOM 835 N GLN A 112 -14.306 39.035 26.642 1.00 22.59 N ATOM 836 CA GLN A 112 -14.712 40.412 26.308 1.00 23.83 C ATOM 837 C GLN A 112 -15.287 40.522 24.878 1.00 24.68 C ATOM 838 O GLN A 112 -15.905 41.500 24.510 1.00 26.51 O ATOM 839 CB GLN A 112 -13.555 41.391 26.545 1.00 23.05 C ATOM 840 CG GLN A 112 -13.202 41.453 28.006 1.00 24.71 C ATOM 841 CD GLN A 112 -14.317 42.160 28.820 1.00 26.47 C ATOM 842 OE1 GLN A 112 -14.498 43.351 28.722 1.00 26.77 O ATOM 843 NE2 GLN A 112 -15.046 41.411 29.610 1.00 29.15 N ATOM 844 HA GLN A 112 -15.524 40.690 26.980 1.00 0.00 H ATOM 845 HB2 GLN A 112 -12.684 41.060 25.980 1.00 0.00 H ATOM 846 HB3 GLN A 112 -13.851 42.384 26.206 1.00 0.00 H ATOM 847 HG2 GLN A 112 -13.073 40.439 28.385 1.00 0.00 H ATOM 848 HG3 GLN A 112 -12.270 42.005 28.124 1.00 0.00 H ATOM 849 HE22 GLN A 112 -14.864 40.389 29.671 1.00 0.00 H ATOM 850 HE21 GLN A 112 -15.807 41.839 30.176 1.00 0.00 H ATOM 851 H GLN A 112 -13.308 38.760 26.542 1.00 0.00 H ATOM 852 N THR A 113 -15.120 39.472 24.111 1.00 25.11 N ATOM 853 CA THR A 113 -15.296 39.439 22.671 1.00 26.02 C ATOM 854 C THR A 113 -16.484 38.535 22.300 1.00 25.06 C ATOM 855 O THR A 113 -17.040 38.652 21.237 1.00 26.22 O ATOM 856 CB THR A 113 -13.918 38.837 22.109 1.00 26.50 C ATOM 857 OG1 THR A 113 -13.046 39.926 21.736 1.00 33.68 O ATOM 858 CG2 THR A 113 -14.091 37.965 20.931 1.00 31.57 C ATOM 859 HA THR A 113 -15.513 40.422 22.252 1.00 0.00 H ATOM 860 HB THR A 113 -13.497 38.228 22.909 1.00 0.00 H ATOM 861 HG1 THR A 113 -12.194 39.561 21.388 1.00 0.00 H ATOM 862 HG23 THR A 113 -14.747 37.134 21.189 1.00 0.00 H ATOM 863 HG21 THR A 113 -14.533 38.540 20.117 1.00 0.00 H ATOM 864 HG22 THR A 113 -13.120 37.580 20.620 1.00 0.00 H ATOM 865 H THR A 113 -14.837 38.585 24.575 1.00 0.00 H ATOM 866 N LEU A 114 -16.848 37.593 23.158 1.00 23.79 N ATOM 867 CA LEU A 114 -17.878 36.617 22.838 1.00 23.74 C ATOM 868 C LEU A 114 -19.126 36.892 23.609 1.00 22.92 C ATOM 869 O LEU A 114 -19.046 37.395 24.746 1.00 23.24 O ATOM 870 CB LEU A 114 -17.439 35.181 23.212 1.00 22.24 C ATOM 871 CG LEU A 114 -16.195 34.731 22.444 1.00 24.52 C ATOM 872 CD1 LEU A 114 -15.641 33.473 23.025 1.00 19.44 C ATOM 873 CD2 LEU A 114 -16.509 34.593 20.956 1.00 24.77 C ATOM 874 HA LEU A 114 -18.049 36.697 21.764 1.00 0.00 H ATOM 875 HB2 LEU A 114 -17.222 35.148 24.280 1.00 0.00 H ATOM 876 HB3 LEU A 114 -18.256 34.495 22.987 1.00 0.00 H ATOM 877 HG LEU A 114 -15.422 35.493 22.543 1.00 0.00 H ATOM 878 HD21 LEU A 114 -17.298 33.853 20.820 1.00 0.00 H ATOM 879 HD22 LEU A 114 -16.840 35.555 20.565 1.00 0.00 H ATOM 880 HD23 LEU A 114 -15.613 34.272 20.425 1.00 0.00 H ATOM 881 HD11 LEU A 114 -15.369 33.644 24.067 1.00 0.00 H ATOM 882 HD12 LEU A 114 -16.393 32.686 22.969 1.00 0.00 H ATOM 883 HD13 LEU A 114 -14.757 33.173 22.462 1.00 0.00 H ATOM 884 H LEU A 114 -16.384 37.550 24.088 1.00 0.00 H ATOM 885 N PRO A 115 -20.270 36.446 23.068 1.00 23.23 N ATOM 886 CA PRO A 115 -21.493 36.476 23.940 1.00 23.39 C ATOM 887 C PRO A 115 -21.354 35.524 25.130 1.00 23.60 C ATOM 888 O PRO A 115 -20.715 34.477 24.996 1.00 24.49 O ATOM 889 CB PRO A 115 -22.600 36.038 23.008 1.00 23.38 C ATOM 890 CG PRO A 115 -22.012 36.324 21.539 1.00 23.76 C ATOM 891 CD PRO A 115 -20.555 36.137 21.652 1.00 22.26 C ATOM 892 HA PRO A 115 -21.675 37.456 24.381 1.00 0.00 H ATOM 893 HD3 PRO A 115 -20.275 35.111 21.414 1.00 0.00 H ATOM 894 HD2 PRO A 115 -20.023 36.820 20.990 1.00 0.00 H ATOM 895 HG3 PRO A 115 -22.242 37.343 21.228 1.00 0.00 H ATOM 896 HG2 PRO A 115 -22.431 35.622 20.818 1.00 0.00 H ATOM 897 HB2 PRO A 115 -22.819 34.978 23.138 1.00 0.00 H ATOM 898 HB3 PRO A 115 -23.506 36.619 23.182 1.00 0.00 H ATOM 899 N PRO A 116 -21.893 35.905 26.304 1.00 23.53 N ATOM 900 CA PRO A 116 -21.732 35.051 27.466 1.00 24.37 C ATOM 901 C PRO A 116 -22.027 33.590 27.276 1.00 25.58 C ATOM 902 O PRO A 116 -21.202 32.793 27.724 1.00 26.28 O ATOM 903 CB PRO A 116 -22.672 35.684 28.508 1.00 23.99 C ATOM 904 CG PRO A 116 -22.543 37.202 28.171 1.00 23.09 C ATOM 905 CD PRO A 116 -22.516 37.205 26.656 1.00 22.25 C ATOM 906 HA PRO A 116 -20.681 35.020 27.753 1.00 0.00 H ATOM 907 HD3 PRO A 116 -23.525 37.273 26.251 1.00 0.00 H ATOM 908 HD2 PRO A 116 -21.918 38.036 26.281 1.00 0.00 H ATOM 909 HG3 PRO A 116 -21.624 37.620 28.582 1.00 0.00 H ATOM 910 HG2 PRO A 116 -23.397 37.763 28.550 1.00 0.00 H ATOM 911 HB2 PRO A 116 -23.697 35.335 28.383 1.00 0.00 H ATOM 912 HB3 PRO A 116 -22.339 35.473 29.524 1.00 0.00 H ATOM 913 N PRO A 117 -23.175 33.215 26.643 1.00 27.10 N ATOM 914 CA PRO A 117 -23.413 31.736 26.559 1.00 27.26 C ATOM 915 C PRO A 117 -22.359 31.066 25.653 1.00 27.19 C ATOM 916 O PRO A 117 -22.035 29.904 25.853 1.00 28.06 O ATOM 917 CB PRO A 117 -24.794 31.603 25.895 1.00 28.40 C ATOM 918 CG PRO A 117 -25.160 33.025 25.349 1.00 28.97 C ATOM 919 CD PRO A 117 -24.070 34.008 25.768 1.00 25.95 C ATOM 920 HA PRO A 117 -23.356 31.263 27.539 1.00 0.00 H ATOM 921 HD3 PRO A 117 -23.529 34.379 24.897 1.00 0.00 H ATOM 922 HD2 PRO A 117 -24.498 34.849 26.314 1.00 0.00 H ATOM 923 HG3 PRO A 117 -26.118 33.341 25.762 1.00 0.00 H ATOM 924 HG2 PRO A 117 -25.228 32.994 24.262 1.00 0.00 H ATOM 925 HB2 PRO A 117 -24.752 30.884 25.077 1.00 0.00 H ATOM 926 HB3 PRO A 117 -25.534 31.277 26.626 1.00 0.00 H ATOM 927 N VAL A 118 -21.851 31.785 24.658 1.00 25.69 N ATOM 928 CA VAL A 118 -20.798 31.238 23.790 1.00 24.84 C ATOM 929 C VAL A 118 -19.463 31.043 24.553 1.00 25.36 C ATOM 930 O VAL A 118 -18.807 30.034 24.368 1.00 25.16 O ATOM 931 CB VAL A 118 -20.571 32.089 22.535 1.00 24.79 C ATOM 932 CG1 VAL A 118 -19.534 31.403 21.625 1.00 21.97 C ATOM 933 CG2 VAL A 118 -21.929 32.277 21.771 1.00 24.52 C ATOM 934 HA VAL A 118 -21.156 30.260 23.468 1.00 0.00 H ATOM 935 HB VAL A 118 -20.192 33.070 22.823 1.00 0.00 H ATOM 936 HG11 VAL A 118 -18.593 31.295 22.165 1.00 0.00 H ATOM 937 HG12 VAL A 118 -19.902 30.419 21.334 1.00 0.00 H ATOM 938 HG13 VAL A 118 -19.376 32.011 20.734 1.00 0.00 H ATOM 939 HG21 VAL A 118 -22.319 31.301 21.481 1.00 0.00 H ATOM 940 HG22 VAL A 118 -22.645 32.777 22.423 1.00 0.00 H ATOM 941 HG23 VAL A 118 -21.762 32.882 20.880 1.00 0.00 H ATOM 942 H VAL A 118 -22.203 32.749 24.491 1.00 0.00 H ATOM 943 N PHE A 119 -19.100 31.999 25.417 1.00 23.70 N ATOM 944 CA PHE A 119 -17.937 31.875 26.231 1.00 23.14 C ATOM 945 C PHE A 119 -18.066 30.733 27.229 1.00 24.24 C ATOM 946 O PHE A 119 -17.099 30.017 27.474 1.00 22.37 O ATOM 947 CB PHE A 119 -17.678 33.157 26.969 1.00 20.55 C ATOM 948 CG PHE A 119 -16.461 33.093 27.875 1.00 23.43 C ATOM 949 CD1 PHE A 119 -15.175 33.044 27.341 1.00 21.82 C ATOM 950 CD2 PHE A 119 -16.599 33.148 29.245 1.00 23.82 C ATOM 951 CE1 PHE A 119 -14.096 33.019 28.152 1.00 23.40 C ATOM 952 CE2 PHE A 119 -15.451 33.106 30.082 1.00 25.40 C ATOM 953 CZ PHE A 119 -14.238 33.025 29.534 1.00 21.78 C ATOM 954 HA PHE A 119 -17.099 31.656 25.569 1.00 0.00 H ATOM 955 HB2 PHE A 119 -17.525 33.952 26.239 1.00 0.00 H ATOM 956 HB3 PHE A 119 -18.552 33.388 27.578 1.00 0.00 H ATOM 957 HD2 PHE A 119 -17.592 33.224 29.688 1.00 0.00 H ATOM 958 HE2 PHE A 119 -15.562 33.140 31.166 1.00 0.00 H ATOM 959 HZ PHE A 119 -13.356 32.963 30.172 1.00 0.00 H ATOM 960 HE1 PHE A 119 -13.098 32.994 27.716 1.00 0.00 H ATOM 961 HD1 PHE A 119 -15.039 33.026 26.260 1.00 0.00 H ATOM 962 H PHE A 119 -19.683 32.856 25.496 1.00 0.00 H ATOM 963 N GLN A 120 -19.234 30.634 27.871 1.00 25.51 N ATOM 964 CA GLN A 120 -19.621 29.514 28.726 1.00 27.34 C ATOM 965 C GLN A 120 -19.311 28.189 28.108 1.00 27.35 C ATOM 966 O GLN A 120 -18.749 27.298 28.715 1.00 28.98 O ATOM 967 CB GLN A 120 -21.154 29.492 28.859 1.00 27.22 C ATOM 968 CG GLN A 120 -21.639 29.820 30.193 1.00 29.18 C ATOM 969 CD GLN A 120 -21.342 31.231 30.520 1.00 32.86 C ATOM 970 OE1 GLN A 120 -20.257 31.558 31.060 1.00 34.65 O ATOM 971 NE2 GLN A 120 -22.282 32.107 30.181 1.00 30.88 N ATOM 972 HA GLN A 120 -19.083 29.652 29.664 1.00 0.00 H ATOM 973 HB2 GLN A 120 -21.569 30.214 28.156 1.00 0.00 H ATOM 974 HB3 GLN A 120 -21.506 28.493 28.602 1.00 0.00 H ATOM 975 HG2 GLN A 120 -22.717 29.662 30.232 1.00 0.00 H ATOM 976 HG3 GLN A 120 -21.151 29.172 30.922 1.00 0.00 H ATOM 977 HE22 GLN A 120 -23.163 31.779 29.736 1.00 0.00 H ATOM 978 HE21 GLN A 120 -22.137 33.121 30.361 1.00 0.00 H ATOM 979 H GLN A 120 -19.917 31.410 27.754 1.00 0.00 H ATOM 980 N MET A 121 -19.810 28.048 26.890 1.00 27.90 N ATOM 981 CA MET A 121 -19.699 26.821 26.180 1.00 29.35 C ATOM 982 C MET A 121 -18.218 26.515 26.047 1.00 29.38 C ATOM 983 O MET A 121 -17.788 25.358 26.244 1.00 30.49 O ATOM 984 CB MET A 121 -20.286 26.996 24.788 1.00 31.23 C ATOM 985 CG MET A 121 -20.387 25.699 23.957 1.00 35.89 C ATOM 986 SD MET A 121 -20.983 25.986 22.262 1.00 47.23 S ATOM 987 CE MET A 121 -21.769 27.599 22.380 1.00 49.61 C ATOM 988 HA MET A 121 -20.226 26.021 26.699 1.00 0.00 H ATOM 989 HB2 MET A 121 -21.289 27.410 24.893 1.00 0.00 H ATOM 990 HB3 MET A 121 -19.659 27.700 24.242 1.00 0.00 H ATOM 991 HG2 MET A 121 -21.076 25.018 24.457 1.00 0.00 H ATOM 992 HG3 MET A 121 -19.399 25.241 23.905 1.00 0.00 H ATOM 993 HE1 MET A 121 -22.579 27.555 23.108 1.00 0.00 H ATOM 994 HE2 MET A 121 -21.033 28.338 22.697 1.00 0.00 H ATOM 995 HE3 MET A 121 -22.170 27.879 21.406 1.00 0.00 H ATOM 996 H MET A 121 -20.294 28.852 26.442 1.00 0.00 H ATOM 997 N LEU A 122 -17.438 27.545 25.701 1.00 27.66 N ATOM 998 CA LEU A 122 -16.024 27.403 25.476 1.00 25.21 C ATOM 999 C LEU A 122 -15.345 26.881 26.733 1.00 25.02 C ATOM 1000 O LEU A 122 -14.536 25.982 26.629 1.00 24.93 O ATOM 1001 CB LEU A 122 -15.448 28.723 25.051 1.00 25.59 C ATOM 1002 CG LEU A 122 -13.971 28.773 24.681 1.00 26.65 C ATOM 1003 CD1 LEU A 122 -13.805 30.145 24.086 1.00 27.89 C ATOM 1004 CD2 LEU A 122 -13.293 28.680 25.985 1.00 27.71 C ATOM 1005 HA LEU A 122 -15.850 26.680 24.679 1.00 0.00 H ATOM 1006 HB2 LEU A 122 -16.012 29.058 24.180 1.00 0.00 H ATOM 1007 HB3 LEU A 122 -15.601 29.423 25.872 1.00 0.00 H ATOM 1008 HG LEU A 122 -13.599 28.011 23.996 1.00 0.00 H ATOM 1009 HD21 LEU A 122 -13.595 29.520 26.611 1.00 0.00 H ATOM 1010 HD22 LEU A 122 -13.570 27.745 26.471 1.00 0.00 H ATOM 1011 HD23 LEU A 122 -12.214 28.707 25.835 1.00 0.00 H ATOM 1012 HD11 LEU A 122 -14.455 30.244 23.216 1.00 0.00 H ATOM 1013 HD12 LEU A 122 -14.073 30.897 24.829 1.00 0.00 H ATOM 1014 HD13 LEU A 122 -12.767 30.285 23.783 1.00 0.00 H ATOM 1015 H LEU A 122 -17.870 28.484 25.590 1.00 0.00 H ATOM 1016 N LEU A 123 -15.751 27.368 27.914 1.00 23.81 N ATOM 1017 CA LEU A 123 -15.250 26.857 29.189 1.00 24.59 C ATOM 1018 C LEU A 123 -15.532 25.372 29.462 1.00 25.52 C ATOM 1019 O LEU A 123 -14.721 24.731 30.092 1.00 23.86 O ATOM 1020 CB LEU A 123 -15.761 27.673 30.377 1.00 24.93 C ATOM 1021 CG LEU A 123 -15.462 29.184 30.398 1.00 24.72 C ATOM 1022 CD1 LEU A 123 -16.228 29.823 31.495 1.00 23.70 C ATOM 1023 CD2 LEU A 123 -13.962 29.372 30.602 1.00 25.15 C ATOM 1024 HA LEU A 123 -14.170 26.962 29.085 1.00 0.00 H ATOM 1025 HB2 LEU A 123 -16.844 27.556 30.409 1.00 0.00 H ATOM 1026 HB3 LEU A 123 -15.324 27.243 31.278 1.00 0.00 H ATOM 1027 HG LEU A 123 -15.760 29.650 29.459 1.00 0.00 H ATOM 1028 HD21 LEU A 123 -13.666 28.918 31.548 1.00 0.00 H ATOM 1029 HD22 LEU A 123 -13.423 28.895 29.784 1.00 0.00 H ATOM 1030 HD23 LEU A 123 -13.730 30.437 30.620 1.00 0.00 H ATOM 1031 HD11 LEU A 123 -17.294 29.665 31.332 1.00 0.00 H ATOM 1032 HD12 LEU A 123 -15.935 29.380 32.447 1.00 0.00 H ATOM 1033 HD13 LEU A 123 -16.016 30.892 31.510 1.00 0.00 H ATOM 1034 H LEU A 123 -16.449 28.139 27.924 1.00 0.00 H ATOM 1035 N THR A 124 -16.654 24.827 28.960 1.00 27.23 N ATOM 1036 CA THR A 124 -17.004 23.443 29.257 1.00 28.25 C ATOM 1037 C THR A 124 -16.047 22.490 28.489 1.00 30.56 C ATOM 1038 O THR A 124 -15.747 21.368 28.943 1.00 30.64 O ATOM 1039 CB THR A 124 -18.480 23.111 28.942 1.00 27.67 C ATOM 1040 OG1 THR A 124 -18.714 23.186 27.547 1.00 28.30 O ATOM 1041 CG2 THR A 124 -19.481 24.020 29.677 1.00 29.87 C ATOM 1042 HA THR A 124 -16.886 23.299 30.331 1.00 0.00 H ATOM 1043 HB THR A 124 -18.645 22.095 29.301 1.00 0.00 H ATOM 1044 HG1 THR A 124 -18.513 24.102 27.229 1.00 0.00 H ATOM 1045 HG23 THR A 124 -19.301 23.963 30.751 1.00 0.00 H ATOM 1046 HG21 THR A 124 -19.351 25.048 29.340 1.00 0.00 H ATOM 1047 HG22 THR A 124 -20.497 23.690 29.459 1.00 0.00 H ATOM 1048 H THR A 124 -17.278 25.398 28.354 1.00 0.00 H ATOM 1049 N LYS A 125 -15.534 22.967 27.353 1.00 31.76 N ATOM 1050 CA LYS A 125 -14.648 22.195 26.519 1.00 33.32 C ATOM 1051 C LYS A 125 -13.207 22.320 26.966 1.00 35.47 C ATOM 1052 O LYS A 125 -12.331 21.676 26.385 1.00 36.49 O ATOM 1053 CB LYS A 125 -14.846 22.584 25.047 1.00 32.77 C ATOM 1054 CG LYS A 125 -16.227 22.175 24.593 1.00 34.76 C ATOM 1055 CD LYS A 125 -16.535 22.591 23.172 1.00 42.87 C ATOM 1056 CE LYS A 125 -18.026 22.383 22.824 1.00 42.26 C ATOM 1057 NZ LYS A 125 -18.555 21.122 23.407 1.00 46.70 N ATOM 1058 HA LYS A 125 -14.900 21.139 26.622 1.00 0.00 H ATOM 1059 HB2 LYS A 125 -14.734 23.663 24.939 1.00 0.00 H ATOM 1060 HB3 LYS A 125 -14.099 22.079 24.435 1.00 0.00 H ATOM 1061 HG2 LYS A 125 -16.307 21.090 24.662 1.00 0.00 H ATOM 1062 HG3 LYS A 125 -16.960 22.635 25.256 1.00 0.00 H ATOM 1063 HD2 LYS A 125 -16.288 23.646 23.051 1.00 0.00 H ATOM 1064 HD3 LYS A 125 -15.927 21.996 22.490 1.00 0.00 H ATOM 1065 HE2 LYS A 125 -18.134 22.344 21.740 1.00 0.00 H ATOM 1066 HE3 LYS A 125 -18.601 23.222 23.215 1.00 0.00 H ATOM 1067 HZ1 LYS A 125 -18.015 20.315 23.033 1.00 0.00 H ATOM 1068 HZ2 LYS A 125 -18.461 21.154 24.442 1.00 0.00 H ATOM 1069 HZ3 LYS A 125 -19.558 21.017 23.152 1.00 0.00 H ATOM 1070 H LYS A 125 -15.783 23.933 27.058 1.00 0.00 H ATOM 1071 N LEU A 126 -13.002 23.074 28.054 1.00 38.85 N ATOM 1072 CA LEU A 126 -11.690 23.574 28.613 1.00 40.84 C ATOM 1073 C LEU A 126 -11.157 25.016 28.252 1.00 43.10 C ATOM 1074 O LEU A 126 -10.626 25.266 27.130 1.00 43.59 O ATOM 1075 CB LEU A 126 -10.606 22.531 28.417 1.00 42.10 C ATOM 1076 CG LEU A 126 -10.421 21.707 29.675 1.00 42.27 C ATOM 1077 CD1 LEU A 126 -11.444 20.626 29.697 1.00 38.11 C ATOM 1078 CD2 LEU A 126 -8.971 21.192 29.713 1.00 46.62 C ATOM 1079 HA LEU A 126 -11.954 23.725 29.660 1.00 0.00 H ATOM 1080 OXT LEU A 126 -11.200 25.999 29.060 1.00 42.98 O ATOM 1081 HB2 LEU A 126 -10.888 21.872 27.596 1.00 0.00 H ATOM 1082 HB3 LEU A 126 -9.668 23.031 28.175 1.00 0.00 H ATOM 1083 HG LEU A 126 -10.573 22.298 30.578 1.00 0.00 H ATOM 1084 HD21 LEU A 126 -8.782 20.577 28.833 1.00 0.00 H ATOM 1085 HD22 LEU A 126 -8.286 22.040 29.719 1.00 0.00 H ATOM 1086 HD23 LEU A 126 -8.822 20.596 30.614 1.00 0.00 H ATOM 1087 HD11 LEU A 126 -12.440 21.070 29.689 1.00 0.00 H ATOM 1088 HD12 LEU A 126 -11.320 19.992 28.819 1.00 0.00 H ATOM 1089 HD13 LEU A 126 -11.319 20.027 30.599 1.00 0.00 H ATOM 1090 H LEU A 126 -13.855 23.351 28.581 1.00 0.00 H TER 1091 LEU A 126 ATOM 1092 N GLY C 54 8.860 34.298 35.784 1.00 31.14 N ATOM 1093 CA GLY C 54 7.962 33.876 34.729 1.00 31.93 C ATOM 1094 C GLY C 54 8.672 33.197 33.545 1.00 30.66 C ATOM 1095 O GLY C 54 8.187 32.199 33.096 1.00 31.38 O ATOM 1096 HA3 GLY C 54 7.433 34.753 34.356 1.00 0.00 H ATOM 1097 HA2 GLY C 54 7.244 33.172 35.149 1.00 0.00 H ATOM 1098 HN3 GLY C 54 9.546 34.980 35.402 1.00 0.00 H ATOM 1099 HN2 GLY C 54 9.365 33.470 36.159 1.00 0.00 H ATOM 1100 HN1 GLY C 54 8.312 34.746 36.546 1.00 0.00 H ATOM 1101 N PRO C 55 9.826 33.707 33.045 1.00 30.51 N ATOM 1102 CA PRO C 55 10.136 33.291 31.664 1.00 28.99 C ATOM 1103 C PRO C 55 10.450 31.798 31.467 1.00 28.28 C ATOM 1104 O PRO C 55 9.874 31.169 30.557 1.00 27.49 O ATOM 1105 CB PRO C 55 11.283 34.203 31.265 1.00 28.23 C ATOM 1106 CG PRO C 55 11.953 34.540 32.522 1.00 29.29 C ATOM 1107 CD PRO C 55 10.846 34.663 33.533 1.00 32.15 C ATOM 1108 HA PRO C 55 9.259 33.394 31.025 1.00 0.00 H ATOM 1109 HD3 PRO C 55 11.194 34.387 34.528 1.00 0.00 H ATOM 1110 HD2 PRO C 55 10.450 35.678 33.556 1.00 0.00 H ATOM 1111 HG3 PRO C 55 12.493 35.482 32.428 1.00 0.00 H ATOM 1112 HG2 PRO C 55 12.649 33.751 32.809 1.00 0.00 H ATOM 1113 HB2 PRO C 55 11.967 33.687 30.592 1.00 0.00 H ATOM 1114 HB3 PRO C 55 10.906 35.102 30.778 1.00 0.00 H ATOM 1115 N LEU C 56 11.309 31.223 32.306 1.00 26.19 N ATOM 1116 CA LEU C 56 11.564 29.810 32.207 1.00 25.34 C ATOM 1117 C LEU C 56 10.312 29.082 32.631 1.00 23.80 C ATOM 1118 O LEU C 56 9.889 28.138 31.963 1.00 22.89 O ATOM 1119 CB LEU C 56 12.768 29.372 33.076 1.00 25.22 C ATOM 1120 CG LEU C 56 13.044 27.866 33.095 1.00 28.11 C ATOM 1121 CD1 LEU C 56 13.439 27.291 31.655 1.00 27.54 C ATOM 1122 CD2 LEU C 56 14.213 27.573 34.112 1.00 32.60 C ATOM 1123 HA LEU C 56 11.823 29.565 31.177 1.00 0.00 H ATOM 1124 HB2 LEU C 56 13.658 29.874 32.697 1.00 0.00 H ATOM 1125 HB3 LEU C 56 12.580 29.694 34.100 1.00 0.00 H ATOM 1126 HG LEU C 56 12.124 27.367 33.400 1.00 0.00 H ATOM 1127 HD21 LEU C 56 15.109 28.108 33.798 1.00 0.00 H ATOM 1128 HD22 LEU C 56 13.919 27.907 35.107 1.00 0.00 H ATOM 1129 HD23 LEU C 56 14.416 26.502 34.132 1.00 0.00 H ATOM 1130 HD11 LEU C 56 12.622 27.472 30.956 1.00 0.00 H ATOM 1131 HD12 LEU C 56 14.340 27.791 31.300 1.00 0.00 H ATOM 1132 HD13 LEU C 56 13.623 26.219 31.731 1.00 0.00 H ATOM 1133 H LEU C 56 11.793 31.792 33.029 1.00 0.00 H ATOM 1134 N GLY C 57 9.737 29.463 33.764 1.00 21.59 N ATOM 1135 CA GLY C 57 8.509 28.818 34.191 1.00 22.16 C ATOM 1136 C GLY C 57 7.407 28.872 33.099 1.00 24.52 C ATOM 1137 O GLY C 57 6.692 27.846 32.883 1.00 23.07 O ATOM 1138 HA3 GLY C 57 8.141 29.320 35.086 1.00 0.00 H ATOM 1139 HA2 GLY C 57 8.723 27.775 34.423 1.00 0.00 H ATOM 1140 H GLY C 57 10.162 30.217 34.341 1.00 0.00 H ATOM 1141 N SER C 58 7.243 30.016 32.395 1.00 23.45 N ATOM 1142 CA SER C 58 6.211 30.005 31.386 1.00 25.42 C ATOM 1143 C SER C 58 6.580 29.164 30.198 1.00 25.32 C ATOM 1144 O SER C 58 5.698 28.636 29.524 1.00 25.07 O ATOM 1145 CB SER C 58 5.625 31.378 30.983 1.00 25.84 C ATOM 1146 OG SER C 58 6.481 32.426 31.165 1.00 29.94 O ATOM 1147 HA SER C 58 5.375 29.523 31.893 1.00 0.00 H ATOM 1148 HB2 SER C 58 4.732 31.558 31.581 1.00 0.00 H ATOM 1149 HB3 SER C 58 5.353 31.338 29.928 1.00 0.00 H ATOM 1150 HG SER C 58 6.730 32.485 32.121 1.00 0.00 H ATOM 1151 H SER C 58 7.829 30.857 32.571 1.00 0.00 H ATOM 1152 N ASP C 59 7.867 29.043 29.920 1.00 24.93 N ATOM 1153 CA ASP C 59 8.253 28.296 28.736 1.00 26.89 C ATOM 1154 C ASP C 59 8.016 26.826 28.982 1.00 25.62 C ATOM 1155 O ASP C 59 7.749 26.089 28.038 1.00 25.51 O ATOM 1156 CB ASP C 59 9.754 28.452 28.384 1.00 27.93 C ATOM 1157 CG ASP C 59 10.091 29.805 27.739 1.00 34.60 C ATOM 1158 OD1 ASP C 59 9.180 30.625 27.437 1.00 38.55 O ATOM 1159 OD2 ASP C 59 11.307 30.046 27.560 1.00 40.62 O ATOM 1160 HA ASP C 59 7.655 28.689 27.914 1.00 0.00 H ATOM 1161 HB2 ASP C 59 10.336 28.351 29.300 1.00 0.00 H ATOM 1162 HB3 ASP C 59 10.031 27.659 27.689 1.00 0.00 H ATOM 1163 H ASP C 59 8.587 29.473 30.535 1.00 0.00 H ATOM 1164 N LEU C 60 8.225 26.390 30.221 1.00 23.58 N ATOM 1165 CA LEU C 60 7.975 24.978 30.583 1.00 23.90 C ATOM 1166 C LEU C 60 6.491 24.640 30.582 1.00 22.55 C ATOM 1167 O LEU C 60 6.148 23.557 30.224 1.00 22.92 O ATOM 1168 CB LEU C 60 8.560 24.589 31.949 1.00 23.14 C ATOM 1169 CG LEU C 60 10.047 24.919 32.119 1.00 27.13 C ATOM 1170 CD1 LEU C 60 10.398 24.950 33.604 1.00 29.12 C ATOM 1171 CD2 LEU C 60 10.979 23.982 31.384 1.00 28.25 C ATOM 1172 HA LEU C 60 8.485 24.403 29.810 1.00 0.00 H ATOM 1173 HB2 LEU C 60 8.003 25.118 32.722 1.00 0.00 H ATOM 1174 HB3 LEU C 60 8.432 23.515 32.082 1.00 0.00 H ATOM 1175 HG LEU C 60 10.196 25.899 31.666 1.00 0.00 H ATOM 1176 HD21 LEU C 60 10.833 22.966 31.750 1.00 0.00 H ATOM 1177 HD22 LEU C 60 10.763 24.020 30.316 1.00 0.00 H ATOM 1178 HD23 LEU C 60 12.011 24.287 31.558 1.00 0.00 H ATOM 1179 HD11 LEU C 60 9.798 25.712 34.102 1.00 0.00 H ATOM 1180 HD12 LEU C 60 10.190 23.975 34.046 1.00 0.00 H ATOM 1181 HD13 LEU C 60 11.456 25.185 33.721 1.00 0.00 H ATOM 1182 H LEU C 60 8.569 27.052 30.946 1.00 0.00 H ATOM 1183 N LYS C 61 5.618 25.544 31.021 1.00 22.50 N ATOM 1184 CA LYS C 61 4.166 25.318 30.901 1.00 22.43 C ATOM 1185 C LYS C 61 3.675 25.205 29.445 1.00 20.96 C ATOM 1186 O LYS C 61 2.893 24.335 29.138 1.00 19.70 O ATOM 1187 CB LYS C 61 3.424 26.413 31.644 1.00 23.32 C ATOM 1188 CG LYS C 61 3.560 26.200 33.159 1.00 30.28 C ATOM 1189 CD LYS C 61 2.818 27.236 33.975 1.00 42.10 C ATOM 1190 CE LYS C 61 3.655 28.464 34.224 1.00 51.09 C ATOM 1191 NZ LYS C 61 3.927 29.283 32.981 1.00 54.55 N ATOM 1192 HA LYS C 61 3.952 24.349 31.353 1.00 0.00 H ATOM 1193 HB2 LYS C 61 3.845 27.382 31.376 1.00 0.00 H ATOM 1194 HB3 LYS C 61 2.370 26.387 31.368 1.00 0.00 H ATOM 1195 HG2 LYS C 61 3.165 25.215 33.408 1.00 0.00 H ATOM 1196 HG3 LYS C 61 4.617 26.243 33.422 1.00 0.00 H ATOM 1197 HD2 LYS C 61 1.916 27.528 33.437 1.00 0.00 H ATOM 1198 HD3 LYS C 61 2.542 26.797 34.934 1.00 0.00 H ATOM 1199 HE2 LYS C 61 4.610 28.149 34.644 1.00 0.00 H ATOM 1200 HE3 LYS C 61 3.134 29.095 34.944 1.00 0.00 H ATOM 1201 HZ1 LYS C 61 4.435 28.699 32.287 1.00 0.00 H ATOM 1202 HZ2 LYS C 61 3.025 29.602 32.573 1.00 0.00 H ATOM 1203 HZ3 LYS C 61 4.507 30.109 33.232 1.00 0.00 H ATOM 1204 H LYS C 61 5.965 26.423 31.455 1.00 0.00 H ATOM 1205 N ASP C 62 4.169 26.095 28.576 1.00 18.83 N ATOM 1206 CA ASP C 62 3.999 25.990 27.139 1.00 19.36 C ATOM 1207 C ASP C 62 4.418 24.612 26.644 1.00 19.14 C ATOM 1208 O ASP C 62 3.679 24.009 25.941 1.00 18.90 O ATOM 1209 CB ASP C 62 4.825 27.077 26.433 1.00 17.12 C ATOM 1210 CG ASP C 62 4.227 28.444 26.618 1.00 21.63 C ATOM 1211 OD1 ASP C 62 4.857 29.443 26.313 1.00 29.39 O ATOM 1212 OD2 ASP C 62 3.106 28.538 27.098 1.00 22.70 O ATOM 1213 HA ASP C 62 2.944 26.132 26.905 1.00 0.00 H ATOM 1214 HB2 ASP C 62 5.835 27.075 26.844 1.00 0.00 H ATOM 1215 HB3 ASP C 62 4.867 26.852 25.367 1.00 0.00 H ATOM 1216 H ASP C 62 4.703 26.905 28.951 1.00 0.00 H ATOM 1217 N ALA C 63 5.618 24.130 27.008 1.00 19.86 N ATOM 1218 CA ALA C 63 6.171 22.943 26.408 1.00 19.83 C ATOM 1219 C ALA C 63 5.339 21.747 26.864 1.00 20.49 C ATOM 1220 O ALA C 63 5.039 20.865 26.082 1.00 22.06 O ATOM 1221 CB ALA C 63 7.686 22.771 26.788 1.00 19.95 C ATOM 1222 HA ALA C 63 6.131 23.021 25.322 1.00 0.00 H ATOM 1223 HB1 ALA C 63 8.248 23.635 26.435 1.00 0.00 H ATOM 1224 HB2 ALA C 63 7.781 22.692 27.871 1.00 0.00 H ATOM 1225 HB3 ALA C 63 8.076 21.867 26.321 1.00 0.00 H ATOM 1226 H ALA C 63 6.162 24.627 27.742 1.00 0.00 H ATOM 1227 N GLU C 64 4.888 21.752 28.105 1.00 20.80 N ATOM 1228 CA GLU C 64 4.027 20.693 28.620 1.00 21.40 C ATOM 1229 C GLU C 64 2.593 20.743 28.048 1.00 22.20 C ATOM 1230 O GLU C 64 2.016 19.665 27.707 1.00 21.09 O ATOM 1231 CB GLU C 64 3.968 20.799 30.126 1.00 21.42 C ATOM 1232 CG GLU C 64 3.091 19.751 30.795 1.00 27.04 C ATOM 1233 CD GLU C 64 3.056 19.872 32.346 1.00 35.51 C ATOM 1234 OE1 GLU C 64 2.035 19.445 32.962 1.00 38.95 O ATOM 1235 OE2 GLU C 64 4.037 20.402 32.949 1.00 40.19 O ATOM 1236 HA GLU C 64 4.460 19.743 28.306 1.00 0.00 H ATOM 1237 HB2 GLU C 64 4.981 20.696 30.515 1.00 0.00 H ATOM 1238 HB3 GLU C 64 3.580 21.784 30.384 1.00 0.00 H ATOM 1239 HG2 GLU C 64 2.074 19.859 30.417 1.00 0.00 H ATOM 1240 HG3 GLU C 64 3.472 18.764 30.534 1.00 0.00 H ATOM 1241 H GLU C 64 5.155 22.535 28.735 1.00 0.00 H ATOM 1242 N ALA C 65 2.015 21.959 27.920 1.00 20.61 N ATOM 1243 CA ALA C 65 0.707 22.080 27.199 1.00 20.67 C ATOM 1244 C ALA C 65 0.765 21.499 25.743 1.00 20.65 C ATOM 1245 O ALA C 65 -0.109 20.781 25.309 1.00 20.91 O ATOM 1246 CB ALA C 65 0.226 23.525 27.191 1.00 18.66 C ATOM 1247 HA ALA C 65 -0.015 21.475 27.748 1.00 0.00 H ATOM 1248 HB1 ALA C 65 0.096 23.869 28.217 1.00 0.00 H ATOM 1249 HB2 ALA C 65 0.964 24.150 26.688 1.00 0.00 H ATOM 1250 HB3 ALA C 65 -0.725 23.587 26.662 1.00 0.00 H ATOM 1251 H ALA C 65 2.474 22.803 28.318 1.00 0.00 H ATOM 1252 N VAL C 66 1.848 21.779 25.020 1.00 21.66 N ATOM 1253 CA VAL C 66 2.022 21.382 23.621 1.00 20.05 C ATOM 1254 C VAL C 66 2.195 19.847 23.509 1.00 21.16 C ATOM 1255 O VAL C 66 1.541 19.185 22.704 1.00 21.04 O ATOM 1256 CB VAL C 66 3.252 22.128 23.036 1.00 21.35 C ATOM 1257 CG1 VAL C 66 3.758 21.481 21.728 1.00 22.27 C ATOM 1258 CG2 VAL C 66 2.979 23.677 22.836 1.00 20.62 C ATOM 1259 HA VAL C 66 1.135 21.653 23.049 1.00 0.00 H ATOM 1260 HB VAL C 66 4.044 22.031 23.778 1.00 0.00 H ATOM 1261 HG11 VAL C 66 4.048 20.449 21.923 1.00 0.00 H ATOM 1262 HG12 VAL C 66 2.963 21.501 20.983 1.00 0.00 H ATOM 1263 HG13 VAL C 66 4.619 22.038 21.358 1.00 0.00 H ATOM 1264 HG21 VAL C 66 2.144 23.812 22.148 1.00 0.00 H ATOM 1265 HG22 VAL C 66 2.736 24.129 23.798 1.00 0.00 H ATOM 1266 HG23 VAL C 66 3.870 24.152 22.425 1.00 0.00 H ATOM 1267 H VAL C 66 2.616 22.311 25.476 1.00 0.00 H ATOM 1268 N GLN C 67 3.033 19.277 24.370 1.00 19.65 N ATOM 1269 CA GLN C 67 3.210 17.825 24.461 1.00 20.08 C ATOM 1270 C GLN C 67 1.957 17.043 24.767 1.00 19.56 C ATOM 1271 O GLN C 67 1.676 15.988 24.176 1.00 17.08 O ATOM 1272 CB GLN C 67 4.313 17.518 25.484 1.00 19.61 C ATOM 1273 CG GLN C 67 5.638 17.910 24.847 1.00 20.48 C ATOM 1274 CD GLN C 67 6.877 17.765 25.753 1.00 27.71 C ATOM 1275 OE1 GLN C 67 7.951 18.103 25.300 1.00 31.77 O ATOM 1276 NE2 GLN C 67 6.738 17.213 26.996 1.00 23.69 N ATOM 1277 HA GLN C 67 3.498 17.489 23.465 1.00 0.00 H ATOM 1278 HB2 GLN C 67 4.150 18.096 26.394 1.00 0.00 H ATOM 1279 HB3 GLN C 67 4.314 16.455 25.725 1.00 0.00 H ATOM 1280 HG2 GLN C 67 5.788 17.282 23.969 1.00 0.00 H ATOM 1281 HG3 GLN C 67 5.567 18.953 24.538 1.00 0.00 H ATOM 1282 HE22 GLN C 67 5.796 16.939 27.341 1.00 0.00 H ATOM 1283 HE21 GLN C 67 7.574 17.067 27.597 1.00 0.00 H ATOM 1284 H GLN C 67 3.586 19.887 25.005 1.00 0.00 H ATOM 1285 N LYS C 68 1.184 17.587 25.691 1.00 18.18 N ATOM 1286 CA LYS C 68 -0.010 16.954 26.092 1.00 18.63 C ATOM 1287 C LYS C 68 -1.016 17.003 24.931 1.00 19.10 C ATOM 1288 O LYS C 68 -1.696 16.039 24.661 1.00 20.47 O ATOM 1289 CB LYS C 68 -0.565 17.692 27.317 1.00 17.11 C ATOM 1290 CG LYS C 68 -1.882 17.123 27.783 1.00 21.66 C ATOM 1291 CD LYS C 68 -2.513 17.932 28.926 1.00 27.28 C ATOM 1292 CE LYS C 68 -3.592 17.095 29.582 1.00 30.97 C ATOM 1293 NZ LYS C 68 -4.876 17.806 29.655 1.00 36.18 N ATOM 1294 HA LYS C 68 0.173 15.912 26.353 1.00 0.00 H ATOM 1295 HB2 LYS C 68 0.157 17.615 28.130 1.00 0.00 H ATOM 1296 HB3 LYS C 68 -0.708 18.741 27.059 1.00 0.00 H ATOM 1297 HG2 LYS C 68 -2.574 17.113 26.941 1.00 0.00 H ATOM 1298 HG3 LYS C 68 -1.717 16.103 28.129 1.00 0.00 H ATOM 1299 HD2 LYS C 68 -1.749 18.185 29.661 1.00 0.00 H ATOM 1300 HD3 LYS C 68 -2.951 18.848 28.528 1.00 0.00 H ATOM 1301 HE2 LYS C 68 -3.273 16.840 30.593 1.00 0.00 H ATOM 1302 HE3 LYS C 68 -3.728 16.181 29.004 1.00 0.00 H ATOM 1303 HZ1 LYS C 68 -4.758 18.677 30.211 1.00 0.00 H ATOM 1304 HZ2 LYS C 68 -5.192 18.048 28.694 1.00 0.00 H ATOM 1305 HZ3 LYS C 68 -5.584 17.195 30.111 1.00 0.00 H ATOM 1306 H LYS C 68 1.459 18.491 26.126 1.00 0.00 H ATOM 1307 N PHE C 69 -1.117 18.156 24.277 1.00 19.03 N ATOM 1308 CA PHE C 69 -1.984 18.300 23.127 1.00 18.53 C ATOM 1309 C PHE C 69 -1.502 17.371 22.048 1.00 18.58 C ATOM 1310 O PHE C 69 -2.281 16.612 21.471 1.00 19.31 O ATOM 1311 CB PHE C 69 -1.891 19.758 22.618 1.00 17.79 C ATOM 1312 CG PHE C 69 -2.704 20.022 21.371 1.00 17.75 C ATOM 1313 CD1 PHE C 69 -2.080 20.144 20.109 1.00 19.77 C ATOM 1314 CD2 PHE C 69 -4.097 20.131 21.459 1.00 13.82 C ATOM 1315 CE1 PHE C 69 -2.828 20.426 18.957 1.00 18.46 C ATOM 1316 CE2 PHE C 69 -4.880 20.357 20.309 1.00 21.45 C ATOM 1317 CZ PHE C 69 -4.225 20.525 19.047 1.00 18.25 C ATOM 1318 HA PHE C 69 -3.014 18.063 23.392 1.00 0.00 H ATOM 1319 HB2 PHE C 69 -2.246 20.421 23.407 1.00 0.00 H ATOM 1320 HB3 PHE C 69 -0.846 19.981 22.401 1.00 0.00 H ATOM 1321 HD2 PHE C 69 -4.583 20.040 22.430 1.00 0.00 H ATOM 1322 HE2 PHE C 69 -5.967 20.403 20.379 1.00 0.00 H ATOM 1323 HZ PHE C 69 -4.814 20.731 18.153 1.00 0.00 H ATOM 1324 HE1 PHE C 69 -2.328 20.567 17.999 1.00 0.00 H ATOM 1325 HD1 PHE C 69 -1.000 20.017 20.030 1.00 0.00 H ATOM 1326 H PHE C 69 -0.560 18.973 24.599 1.00 0.00 H ATOM 1327 N PHE C 70 -0.210 17.417 21.752 1.00 18.54 N ATOM 1328 CA PHE C 70 0.313 16.510 20.728 1.00 19.22 C ATOM 1329 C PHE C 70 -0.031 15.028 21.023 1.00 18.60 C ATOM 1330 O PHE C 70 -0.601 14.340 20.205 1.00 19.15 O ATOM 1331 CB PHE C 70 1.785 16.731 20.623 1.00 19.63 C ATOM 1332 CG PHE C 70 2.502 15.739 19.747 1.00 23.80 C ATOM 1333 CD1 PHE C 70 2.554 15.932 18.381 1.00 21.07 C ATOM 1334 CD2 PHE C 70 3.220 14.665 20.324 1.00 24.51 C ATOM 1335 CE1 PHE C 70 3.285 15.037 17.529 1.00 25.34 C ATOM 1336 CE2 PHE C 70 3.954 13.754 19.503 1.00 28.85 C ATOM 1337 CZ PHE C 70 3.970 13.958 18.085 1.00 29.65 C ATOM 1338 HA PHE C 70 -0.162 16.730 19.772 1.00 0.00 H ATOM 1339 HB2 PHE C 70 1.952 17.728 20.216 1.00 0.00 H ATOM 1340 HB3 PHE C 70 2.211 16.672 21.625 1.00 0.00 H ATOM 1341 HD2 PHE C 70 3.213 14.531 21.406 1.00 0.00 H ATOM 1342 HE2 PHE C 70 4.493 12.918 19.948 1.00 0.00 H ATOM 1343 HZ PHE C 70 4.518 13.270 17.441 1.00 0.00 H ATOM 1344 HE1 PHE C 70 3.304 15.201 16.452 1.00 0.00 H ATOM 1345 HD1 PHE C 70 2.030 16.780 17.941 1.00 0.00 H ATOM 1346 H PHE C 70 0.421 18.086 22.239 1.00 0.00 H ATOM 1347 N LEU C 71 0.263 14.543 22.210 1.00 19.46 N ATOM 1348 CA LEU C 71 0.010 13.130 22.513 1.00 20.92 C ATOM 1349 C LEU C 71 -1.495 12.805 22.507 1.00 20.75 C ATOM 1350 O LEU C 71 -1.888 11.744 22.043 1.00 18.97 O ATOM 1351 CB LEU C 71 0.613 12.745 23.860 1.00 20.52 C ATOM 1352 CG LEU C 71 2.026 12.120 24.072 1.00 26.19 C ATOM 1353 CD1 LEU C 71 2.952 12.046 22.867 1.00 26.25 C ATOM 1354 CD2 LEU C 71 2.702 12.729 25.258 1.00 22.57 C ATOM 1355 HA LEU C 71 0.489 12.546 21.727 1.00 0.00 H ATOM 1356 HB2 LEU C 71 0.611 13.662 24.450 1.00 0.00 H ATOM 1357 HB3 LEU C 71 -0.087 12.032 24.296 1.00 0.00 H ATOM 1358 HG LEU C 71 1.812 11.068 24.258 1.00 0.00 H ATOM 1359 HD21 LEU C 71 2.811 13.802 25.101 1.00 0.00 H ATOM 1360 HD22 LEU C 71 2.100 12.550 26.149 1.00 0.00 H ATOM 1361 HD23 LEU C 71 3.686 12.277 25.386 1.00 0.00 H ATOM 1362 HD11 LEU C 71 2.485 11.444 22.088 1.00 0.00 H ATOM 1363 HD12 LEU C 71 3.136 13.052 22.489 1.00 0.00 H ATOM 1364 HD13 LEU C 71 3.896 11.590 23.164 1.00 0.00 H ATOM 1365 H LEU C 71 0.676 15.163 22.936 1.00 0.00 H ATOM 1366 N GLU C 72 -2.321 13.701 23.051 1.00 21.22 N ATOM 1367 CA GLU C 72 -3.759 13.485 22.970 1.00 22.19 C ATOM 1368 C GLU C 72 -4.273 13.511 21.546 1.00 21.37 C ATOM 1369 O GLU C 72 -5.156 12.789 21.245 1.00 21.81 O ATOM 1370 CB GLU C 72 -4.538 14.504 23.824 1.00 22.30 C ATOM 1371 CG GLU C 72 -4.044 14.478 25.243 1.00 26.50 C ATOM 1372 CD GLU C 72 -4.965 15.151 26.271 1.00 32.03 C ATOM 1373 OE1 GLU C 72 -4.939 14.701 27.445 1.00 34.25 O ATOM 1374 OE2 GLU C 72 -5.671 16.129 25.943 1.00 32.83 O ATOM 1375 HA GLU C 72 -3.931 12.486 23.370 1.00 0.00 H ATOM 1376 HB2 GLU C 72 -4.396 15.503 23.411 1.00 0.00 H ATOM 1377 HB3 GLU C 72 -5.598 14.252 23.807 1.00 0.00 H ATOM 1378 HG2 GLU C 72 -3.916 13.436 25.536 1.00 0.00 H ATOM 1379 HG3 GLU C 72 -3.079 14.984 25.273 1.00 0.00 H ATOM 1380 H GLU C 72 -1.942 14.544 23.528 1.00 0.00 H ATOM 1381 N GLU C 73 -3.771 14.379 20.678 1.00 21.60 N ATOM 1382 CA GLU C 73 -4.266 14.410 19.296 1.00 22.23 C ATOM 1383 C GLU C 73 -3.924 13.094 18.540 1.00 22.32 C ATOM 1384 O GLU C 73 -4.710 12.585 17.747 1.00 23.17 O ATOM 1385 CB GLU C 73 -3.715 15.654 18.550 1.00 22.20 C ATOM 1386 CG GLU C 73 -4.400 17.018 19.010 1.00 25.23 C ATOM 1387 CD GLU C 73 -5.946 17.006 18.840 1.00 28.26 C ATOM 1388 OE1 GLU C 73 -6.663 16.878 19.833 1.00 36.60 O ATOM 1389 OE2 GLU C 73 -6.471 17.133 17.734 1.00 33.35 O ATOM 1390 HA GLU C 73 -5.353 14.488 19.326 1.00 0.00 H ATOM 1391 HB2 GLU C 73 -2.643 15.724 18.737 1.00 0.00 H ATOM 1392 HB3 GLU C 73 -3.888 15.522 17.482 1.00 0.00 H ATOM 1393 HG2 GLU C 73 -4.167 17.188 20.061 1.00 0.00 H ATOM 1394 HG3 GLU C 73 -3.990 17.832 18.412 1.00 0.00 H ATOM 1395 H GLU C 73 -3.025 15.039 20.977 1.00 0.00 H ATOM 1396 N ILE C 74 -2.786 12.507 18.845 1.00 22.50 N ATOM 1397 CA ILE C 74 -2.356 11.266 18.196 1.00 23.71 C ATOM 1398 C ILE C 74 -3.257 10.140 18.691 1.00 23.83 C ATOM 1399 O ILE C 74 -3.894 9.440 17.873 1.00 23.94 O ATOM 1400 CB ILE C 74 -0.865 10.988 18.454 1.00 22.95 C ATOM 1401 CG1 ILE C 74 -0.026 11.707 17.415 1.00 24.66 C ATOM 1402 CG2 ILE C 74 -0.532 9.472 18.307 1.00 24.60 C ATOM 1403 CD1 ILE C 74 1.258 11.988 17.923 1.00 27.23 C ATOM 1404 HA ILE C 74 -2.454 11.349 17.114 1.00 0.00 H ATOM 1405 HB ILE C 74 -0.649 11.328 19.467 1.00 0.00 H ATOM 1406 HG12 ILE C 74 0.068 11.076 16.531 1.00 0.00 H ATOM 1407 HG13 ILE C 74 -0.516 12.642 17.142 1.00 0.00 H ATOM 1408 HD11 ILE C 74 1.168 12.622 18.805 1.00 0.00 H ATOM 1409 HD12 ILE C 74 1.753 11.055 18.193 1.00 0.00 H ATOM 1410 HD13 ILE C 74 1.844 12.504 17.162 1.00 0.00 H ATOM 1411 HG21 ILE C 74 -1.119 8.901 19.026 1.00 0.00 H ATOM 1412 HG22 ILE C 74 -0.775 9.144 17.296 1.00 0.00 H ATOM 1413 HG23 ILE C 74 0.530 9.315 18.496 1.00 0.00 H ATOM 1414 H ILE C 74 -2.174 12.937 19.568 1.00 0.00 H ATOM 1415 N GLN C 75 -3.409 10.060 20.022 1.00 24.29 N ATOM 1416 CA GLN C 75 -4.269 9.059 20.679 1.00 24.12 C ATOM 1417 C GLN C 75 -5.705 9.117 20.203 1.00 24.01 C ATOM 1418 O GLN C 75 -6.274 8.114 19.791 1.00 24.30 O ATOM 1419 CB GLN C 75 -4.195 9.205 22.202 1.00 24.07 C ATOM 1420 CG GLN C 75 -5.048 8.159 22.938 1.00 28.95 C ATOM 1421 CD GLN C 75 -4.717 7.969 24.462 1.00 34.49 C ATOM 1422 OE1 GLN C 75 -3.929 8.722 25.076 1.00 38.30 O ATOM 1423 NE2 GLN C 75 -5.358 6.971 25.065 1.00 35.77 N ATOM 1424 HA GLN C 75 -3.887 8.078 20.396 1.00 0.00 H ATOM 1425 HB2 GLN C 75 -3.157 9.091 22.514 1.00 0.00 H ATOM 1426 HB3 GLN C 75 -4.548 10.199 22.475 1.00 0.00 H ATOM 1427 HG2 GLN C 75 -6.093 8.459 22.856 1.00 0.00 H ATOM 1428 HG3 GLN C 75 -4.906 7.199 22.441 1.00 0.00 H ATOM 1429 HE22 GLN C 75 -6.006 6.365 24.522 1.00 0.00 H ATOM 1430 HE21 GLN C 75 -5.211 6.796 26.080 1.00 0.00 H ATOM 1431 H GLN C 75 -2.894 10.738 20.620 1.00 0.00 H ATOM 1432 N LEU C 76 -6.307 10.293 20.232 1.00 23.24 N ATOM 1433 CA LEU C 76 -7.665 10.451 19.776 1.00 25.27 C ATOM 1434 C LEU C 76 -7.826 10.180 18.238 1.00 27.09 C ATOM 1435 O LEU C 76 -8.821 9.553 17.804 1.00 28.69 O ATOM 1436 CB LEU C 76 -8.110 11.857 20.130 1.00 25.10 C ATOM 1437 CG LEU C 76 -9.564 12.213 20.248 1.00 29.21 C ATOM 1438 CD1 LEU C 76 -10.338 11.178 21.081 1.00 32.38 C ATOM 1439 CD2 LEU C 76 -9.584 13.571 20.923 1.00 32.52 C ATOM 1440 HA LEU C 76 -8.293 9.710 20.270 1.00 0.00 H ATOM 1441 HB2 LEU C 76 -7.657 12.090 21.094 1.00 0.00 H ATOM 1442 HB3 LEU C 76 -7.693 12.513 19.366 1.00 0.00 H ATOM 1443 HG LEU C 76 -10.049 12.229 19.272 1.00 0.00 H ATOM 1444 HD21 LEU C 76 -9.108 13.497 21.901 1.00 0.00 H ATOM 1445 HD22 LEU C 76 -9.043 14.289 20.307 1.00 0.00 H ATOM 1446 HD23 LEU C 76 -10.616 13.900 21.045 1.00 0.00 H ATOM 1447 HD11 LEU C 76 -10.261 10.200 20.606 1.00 0.00 H ATOM 1448 HD12 LEU C 76 -9.914 11.130 22.084 1.00 0.00 H ATOM 1449 HD13 LEU C 76 -11.386 11.473 21.142 1.00 0.00 H ATOM 1450 H LEU C 76 -5.790 11.121 20.591 1.00 0.00 H ATOM 1451 N GLY C 77 -6.862 10.620 17.432 1.00 27.25 N ATOM 1452 CA GLY C 77 -6.832 10.300 15.991 1.00 30.01 C ATOM 1453 C GLY C 77 -6.787 8.776 15.812 1.00 30.98 C ATOM 1454 O GLY C 77 -7.590 8.212 15.093 1.00 31.11 O ATOM 1455 HA3 GLY C 77 -5.948 10.747 15.537 1.00 0.00 H ATOM 1456 HA2 GLY C 77 -7.726 10.697 15.511 1.00 0.00 H ATOM 1457 H GLY C 77 -6.104 11.209 17.831 1.00 0.00 H ATOM 1458 N GLU C 78 -5.919 8.090 16.549 1.00 32.80 N ATOM 1459 CA GLU C 78 -5.903 6.632 16.429 1.00 34.12 C ATOM 1460 C GLU C 78 -7.156 5.936 16.954 1.00 33.51 C ATOM 1461 O GLU C 78 -7.585 4.963 16.362 1.00 35.21 O ATOM 1462 CB GLU C 78 -4.571 5.993 16.865 1.00 34.34 C ATOM 1463 CG GLU C 78 -4.094 6.299 18.269 1.00 42.44 C ATOM 1464 CD GLU C 78 -2.645 5.788 18.590 1.00 48.52 C ATOM 1465 OE1 GLU C 78 -2.344 5.608 19.812 1.00 51.73 O ATOM 1466 OE2 GLU C 78 -1.817 5.591 17.643 1.00 50.01 O ATOM 1467 HA GLU C 78 -5.953 6.442 15.357 1.00 0.00 H ATOM 1468 HB2 GLU C 78 -4.681 4.912 16.782 1.00 0.00 H ATOM 1469 HB3 GLU C 78 -3.800 6.333 16.173 1.00 0.00 H ATOM 1470 HG2 GLU C 78 -4.112 7.380 18.407 1.00 0.00 H ATOM 1471 HG3 GLU C 78 -4.784 5.832 18.972 1.00 0.00 H ATOM 1472 H GLU C 78 -5.267 8.578 17.196 1.00 0.00 H ATOM 1473 N GLU C 79 -7.786 6.434 18.017 1.00 33.39 N ATOM 1474 CA GLU C 79 -9.095 5.898 18.465 1.00 32.94 C ATOM 1475 C GLU C 79 -10.179 6.081 17.406 1.00 33.89 C ATOM 1476 O GLU C 79 -10.996 5.184 17.225 1.00 33.85 O ATOM 1477 CB GLU C 79 -9.571 6.523 19.791 1.00 32.02 C ATOM 1478 CG GLU C 79 -8.620 6.187 20.983 1.00 32.24 C ATOM 1479 CD GLU C 79 -9.060 6.749 22.357 1.00 32.62 C ATOM 1480 OE1 GLU C 79 -10.062 7.497 22.450 1.00 30.69 O ATOM 1481 OE2 GLU C 79 -8.378 6.406 23.352 1.00 29.35 O ATOM 1482 HA GLU C 79 -8.931 4.833 18.628 1.00 0.00 H ATOM 1483 HB2 GLU C 79 -9.615 7.606 19.672 1.00 0.00 H ATOM 1484 HB3 GLU C 79 -10.567 6.143 20.020 1.00 0.00 H ATOM 1485 HG2 GLU C 79 -8.555 5.102 21.067 1.00 0.00 H ATOM 1486 HG3 GLU C 79 -7.635 6.592 20.753 1.00 0.00 H ATOM 1487 H GLU C 79 -7.350 7.217 18.545 1.00 0.00 H ATOM 1488 N LEU C 80 -10.202 7.235 16.739 1.00 33.83 N ATOM 1489 CA LEU C 80 -11.228 7.508 15.766 1.00 36.07 C ATOM 1490 C LEU C 80 -11.039 6.631 14.515 1.00 37.73 C ATOM 1491 O LEU C 80 -11.997 6.073 13.993 1.00 37.97 O ATOM 1492 CB LEU C 80 -11.291 8.992 15.420 1.00 35.93 C ATOM 1493 CG LEU C 80 -11.838 9.805 16.599 1.00 37.46 C ATOM 1494 CD1 LEU C 80 -11.509 11.327 16.471 1.00 34.74 C ATOM 1495 CD2 LEU C 80 -13.341 9.524 16.764 1.00 35.47 C ATOM 1496 HA LEU C 80 -12.190 7.249 16.207 1.00 0.00 H ATOM 1497 HB2 LEU C 80 -10.289 9.345 15.177 1.00 0.00 H ATOM 1498 HB3 LEU C 80 -11.943 9.130 14.557 1.00 0.00 H ATOM 1499 HG LEU C 80 -11.335 9.485 17.511 1.00 0.00 H ATOM 1500 HD21 LEU C 80 -13.865 9.809 15.852 1.00 0.00 H ATOM 1501 HD22 LEU C 80 -13.492 8.461 16.954 1.00 0.00 H ATOM 1502 HD23 LEU C 80 -13.728 10.103 17.603 1.00 0.00 H ATOM 1503 HD11 LEU C 80 -10.428 11.462 16.439 1.00 0.00 H ATOM 1504 HD12 LEU C 80 -11.953 11.718 15.555 1.00 0.00 H ATOM 1505 HD13 LEU C 80 -11.918 11.859 17.330 1.00 0.00 H ATOM 1506 H LEU C 80 -9.468 7.949 16.924 1.00 0.00 H ATOM 1507 N LEU C 81 -9.795 6.484 14.075 1.00 38.99 N ATOM 1508 CA LEU C 81 -9.496 5.563 12.996 1.00 40.86 C ATOM 1509 C LEU C 81 -9.958 4.119 13.293 1.00 42.12 C ATOM 1510 O LEU C 81 -10.688 3.570 12.483 1.00 42.76 O ATOM 1511 CB LEU C 81 -8.029 5.630 12.612 1.00 39.75 C ATOM 1512 CG LEU C 81 -7.602 7.012 12.134 1.00 40.29 C ATOM 1513 CD1 LEU C 81 -6.179 6.904 11.736 1.00 41.74 C ATOM 1514 CD2 LEU C 81 -8.443 7.585 11.005 1.00 41.89 C ATOM 1515 HA LEU C 81 -10.078 5.885 12.133 1.00 0.00 H ATOM 1516 HB2 LEU C 81 -7.429 5.362 13.482 1.00 0.00 H ATOM 1517 HB3 LEU C 81 -7.846 4.913 11.811 1.00 0.00 H ATOM 1518 HG LEU C 81 -7.751 7.718 12.951 1.00 0.00 H ATOM 1519 HD21 LEU C 81 -8.389 6.923 10.141 1.00 0.00 H ATOM 1520 HD22 LEU C 81 -9.479 7.672 11.333 1.00 0.00 H ATOM 1521 HD23 LEU C 81 -8.063 8.570 10.734 1.00 0.00 H ATOM 1522 HD11 LEU C 81 -5.586 6.590 12.595 1.00 0.00 H ATOM 1523 HD12 LEU C 81 -6.081 6.169 10.937 1.00 0.00 H ATOM 1524 HD13 LEU C 81 -5.827 7.874 11.385 1.00 0.00 H ATOM 1525 H LEU C 81 -9.027 7.035 14.509 1.00 0.00 H ATOM 1526 N ALA C 82 -9.564 3.559 14.445 1.00 42.72 N ATOM 1527 CA ALA C 82 -9.967 2.218 14.905 1.00 44.44 C ATOM 1528 C ALA C 82 -11.477 1.981 14.920 1.00 45.43 C ATOM 1529 O ALA C 82 -11.921 0.847 15.011 1.00 46.55 O ATOM 1530 CB ALA C 82 -9.389 1.924 16.290 1.00 43.07 C ATOM 1531 HA ALA C 82 -9.555 1.530 14.167 1.00 0.00 H ATOM 1532 HB1 ALA C 82 -8.301 1.969 16.245 1.00 0.00 H ATOM 1533 HB2 ALA C 82 -9.756 2.665 17.000 1.00 0.00 H ATOM 1534 HB3 ALA C 82 -9.700 0.929 16.608 1.00 0.00 H ATOM 1535 H ALA C 82 -8.929 4.110 15.058 1.00 0.00 H ATOM 1536 N GLN C 83 -12.259 3.045 14.827 1.00 46.50 N ATOM 1537 CA GLN C 83 -13.695 2.912 14.851 1.00 47.70 C ATOM 1538 C GLN C 83 -14.394 3.460 13.576 1.00 48.25 C ATOM 1539 O GLN C 83 -15.616 3.609 13.525 1.00 47.90 O ATOM 1540 CB GLN C 83 -14.222 3.503 16.158 1.00 47.11 C ATOM 1541 CG GLN C 83 -14.662 4.933 16.133 1.00 47.92 C ATOM 1542 CD GLN C 83 -15.053 5.405 17.529 1.00 50.80 C ATOM 1543 OE1 GLN C 83 -14.874 4.672 18.520 1.00 50.83 O ATOM 1544 NE2 GLN C 83 -15.593 6.632 17.618 1.00 51.54 N ATOM 1545 HA GLN C 83 -13.951 1.853 14.828 1.00 0.00 H ATOM 1546 HB2 GLN C 83 -15.076 2.902 16.469 1.00 0.00 H ATOM 1547 HB3 GLN C 83 -13.429 3.416 16.901 1.00 0.00 H ATOM 1548 HG2 GLN C 83 -13.845 5.552 15.762 1.00 0.00 H ATOM 1549 HG3 GLN C 83 -15.521 5.031 15.469 1.00 0.00 H ATOM 1550 HE22 GLN C 83 -15.722 7.207 16.761 1.00 0.00 H ATOM 1551 HE21 GLN C 83 -15.882 7.007 18.544 1.00 0.00 H ATOM 1552 H GLN C 83 -11.832 3.989 14.735 1.00 0.00 H ATOM 1553 N GLY C 84 -13.600 3.755 12.556 1.00 49.36 N ATOM 1554 CA GLY C 84 -14.143 4.120 11.262 1.00 51.61 C ATOM 1555 C GLY C 84 -14.242 5.578 10.840 1.00 53.89 C ATOM 1556 O GLY C 84 -14.489 5.818 9.646 1.00 54.81 O ATOM 1557 HA3 GLY C 84 -15.155 3.716 11.224 1.00 0.00 H ATOM 1558 HA2 GLY C 84 -13.526 3.621 10.514 1.00 0.00 H ATOM 1559 H GLY C 84 -12.569 3.724 12.686 1.00 0.00 H ATOM 1560 N ASP C 85 -14.074 6.565 11.749 1.00 55.09 N ATOM 1561 CA ASP C 85 -14.228 7.991 11.323 1.00 56.35 C ATOM 1562 C ASP C 85 -12.915 8.459 10.813 1.00 56.62 C ATOM 1563 O ASP C 85 -12.174 9.137 11.526 1.00 56.59 O ATOM 1564 CB ASP C 85 -14.628 8.992 12.407 1.00 56.90 C ATOM 1565 CG ASP C 85 -15.544 8.428 13.424 1.00 59.81 C ATOM 1566 OD1 ASP C 85 -15.516 7.194 13.621 1.00 65.49 O ATOM 1567 OD2 ASP C 85 -16.284 9.233 14.051 1.00 63.45 O ATOM 1568 HA ASP C 85 -15.040 7.972 10.596 1.00 0.00 H ATOM 1569 HB2 ASP C 85 -13.724 9.336 12.910 1.00 0.00 H ATOM 1570 HB3 ASP C 85 -15.121 9.839 11.930 1.00 0.00 H ATOM 1571 H ASP C 85 -13.840 6.335 12.736 1.00 0.00 H ATOM 1572 N TYR C 86 -12.629 8.085 9.581 1.00 56.67 N ATOM 1573 CA TYR C 86 -11.473 8.553 8.889 1.00 57.07 C ATOM 1574 C TYR C 86 -11.405 10.086 8.839 1.00 55.88 C ATOM 1575 O TYR C 86 -10.310 10.643 8.931 1.00 55.37 O ATOM 1576 CB TYR C 86 -11.474 7.971 7.483 1.00 57.82 C ATOM 1577 CG TYR C 86 -11.580 6.471 7.447 1.00 62.17 C ATOM 1578 CD1 TYR C 86 -12.758 5.854 7.024 1.00 66.98 C ATOM 1579 CD2 TYR C 86 -10.498 5.667 7.812 1.00 65.59 C ATOM 1580 CE1 TYR C 86 -12.855 4.463 6.965 1.00 70.59 C ATOM 1581 CE2 TYR C 86 -10.570 4.275 7.756 1.00 68.97 C ATOM 1582 CZ TYR C 86 -11.751 3.679 7.331 1.00 71.47 C ATOM 1583 OH TYR C 86 -11.851 2.302 7.282 1.00 73.49 O ATOM 1584 HA TYR C 86 -10.589 8.221 9.433 1.00 0.00 H ATOM 1585 HB3 TYR C 86 -10.547 8.262 6.990 1.00 0.00 H ATOM 1586 HB2 TYR C 86 -12.321 8.389 6.938 1.00 0.00 H ATOM 1587 HD2 TYR C 86 -9.575 6.139 8.149 1.00 0.00 H ATOM 1588 HE2 TYR C 86 -9.713 3.664 8.041 1.00 0.00 H ATOM 1589 HE1 TYR C 86 -13.781 3.990 6.637 1.00 0.00 H ATOM 1590 HD1 TYR C 86 -13.613 6.466 6.736 1.00 0.00 H ATOM 1591 HH TYR C 86 -12.752 2.049 6.960 1.00 0.00 H ATOM 1592 H TYR C 86 -13.270 7.425 9.096 1.00 0.00 H ATOM 1593 N GLU C 87 -12.571 10.735 8.705 1.00 55.24 N ATOM 1594 CA GLU C 87 -12.715 12.203 8.626 1.00 54.61 C ATOM 1595 C GLU C 87 -12.101 12.870 9.859 1.00 52.49 C ATOM 1596 O GLU C 87 -11.090 13.592 9.760 1.00 51.19 O ATOM 1597 CB GLU C 87 -14.218 12.588 8.552 1.00 55.96 C ATOM 1598 CG GLU C 87 -14.610 13.771 7.620 1.00 60.75 C ATOM 1599 CD GLU C 87 -14.638 15.176 8.304 1.00 68.61 C ATOM 1600 OE1 GLU C 87 -14.195 16.162 7.642 1.00 71.05 O ATOM 1601 OE2 GLU C 87 -15.109 15.311 9.478 1.00 70.72 O ATOM 1602 HA GLU C 87 -12.197 12.545 7.730 1.00 0.00 H ATOM 1603 HB2 GLU C 87 -14.765 11.708 8.212 1.00 0.00 H ATOM 1604 HB3 GLU C 87 -14.540 12.846 9.561 1.00 0.00 H ATOM 1605 HG2 GLU C 87 -13.891 13.808 6.802 1.00 0.00 H ATOM 1606 HG3 GLU C 87 -15.604 13.570 7.220 1.00 0.00 H ATOM 1607 H GLU C 87 -13.438 10.163 8.653 1.00 0.00 H ATOM 1608 N LYS C 88 -12.723 12.608 11.013 1.00 50.37 N ATOM 1609 CA LYS C 88 -12.330 13.217 12.284 1.00 48.42 C ATOM 1610 C LYS C 88 -10.913 12.783 12.758 1.00 46.09 C ATOM 1611 O LYS C 88 -10.119 13.612 13.212 1.00 45.70 O ATOM 1612 CB LYS C 88 -13.424 12.986 13.334 1.00 49.12 C ATOM 1613 CG LYS C 88 -14.428 14.135 13.396 1.00 51.31 C ATOM 1614 CD LYS C 88 -15.881 13.672 13.479 1.00 57.98 C ATOM 1615 CE LYS C 88 -16.205 12.986 14.818 1.00 60.39 C ATOM 1616 NZ LYS C 88 -17.149 11.835 14.598 1.00 62.98 N ATOM 1617 HA LYS C 88 -12.240 14.292 12.131 1.00 0.00 H ATOM 1618 HB2 LYS C 88 -13.958 12.068 13.087 1.00 0.00 H ATOM 1619 HB3 LYS C 88 -12.954 12.879 14.312 1.00 0.00 H ATOM 1620 HG2 LYS C 88 -14.207 14.739 14.276 1.00 0.00 H ATOM 1621 HG3 LYS C 88 -14.311 14.745 12.500 1.00 0.00 H ATOM 1622 HD2 LYS C 88 -16.532 14.539 13.363 1.00 0.00 H ATOM 1623 HD3 LYS C 88 -16.070 12.967 12.670 1.00 0.00 H ATOM 1624 HE2 LYS C 88 -16.668 13.708 15.490 1.00 0.00 H ATOM 1625 HE3 LYS C 88 -15.283 12.615 15.265 1.00 0.00 H ATOM 1626 HZ1 LYS C 88 -18.031 12.188 14.174 1.00 0.00 H ATOM 1627 HZ2 LYS C 88 -16.708 11.143 13.959 1.00 0.00 H ATOM 1628 HZ3 LYS C 88 -17.359 11.381 15.510 1.00 0.00 H ATOM 1629 H LYS C 88 -13.522 11.942 11.007 1.00 0.00 H ATOM 1630 N GLY C 89 -10.578 11.506 12.571 1.00 43.26 N ATOM 1631 CA GLY C 89 -9.270 10.978 12.949 1.00 39.92 C ATOM 1632 C GLY C 89 -8.090 11.640 12.275 1.00 37.61 C ATOM 1633 O GLY C 89 -7.073 11.943 12.903 1.00 35.73 O ATOM 1634 HA3 GLY C 89 -9.249 9.917 12.700 1.00 0.00 H ATOM 1635 HA2 GLY C 89 -9.155 11.099 14.026 1.00 0.00 H ATOM 1636 H GLY C 89 -11.273 10.863 12.141 1.00 0.00 H ATOM 1637 N VAL C 90 -8.227 11.859 10.980 1.00 36.85 N ATOM 1638 CA VAL C 90 -7.184 12.492 10.204 1.00 36.10 C ATOM 1639 C VAL C 90 -7.079 13.969 10.608 1.00 34.59 C ATOM 1640 O VAL C 90 -5.976 14.502 10.695 1.00 35.56 O ATOM 1641 CB VAL C 90 -7.441 12.290 8.656 1.00 37.10 C ATOM 1642 CG1 VAL C 90 -6.508 13.189 7.791 1.00 38.53 C ATOM 1643 CG2 VAL C 90 -7.251 10.819 8.265 1.00 37.43 C ATOM 1644 HA VAL C 90 -6.222 12.024 10.415 1.00 0.00 H ATOM 1645 HB VAL C 90 -8.472 12.586 8.460 1.00 0.00 H ATOM 1646 HG11 VAL C 90 -6.687 14.236 8.034 1.00 0.00 H ATOM 1647 HG12 VAL C 90 -5.468 12.939 8.001 1.00 0.00 H ATOM 1648 HG13 VAL C 90 -6.718 13.019 6.735 1.00 0.00 H ATOM 1649 HG21 VAL C 90 -6.232 10.511 8.498 1.00 0.00 H ATOM 1650 HG22 VAL C 90 -7.955 10.202 8.824 1.00 0.00 H ATOM 1651 HG23 VAL C 90 -7.432 10.702 7.197 1.00 0.00 H ATOM 1652 H VAL C 90 -9.107 11.569 10.507 1.00 0.00 H ATOM 1653 N ASP C 91 -8.219 14.610 10.860 1.00 33.17 N ATOM 1654 CA ASP C 91 -8.267 15.958 11.447 1.00 33.42 C ATOM 1655 C ASP C 91 -7.344 16.072 12.671 1.00 31.32 C ATOM 1656 O ASP C 91 -6.491 16.930 12.746 1.00 31.14 O ATOM 1657 CB ASP C 91 -9.664 16.247 11.942 1.00 34.87 C ATOM 1658 CG ASP C 91 -10.612 16.778 10.843 1.00 42.82 C ATOM 1659 OD1 ASP C 91 -10.140 17.105 9.713 1.00 47.86 O ATOM 1660 OD2 ASP C 91 -11.858 16.859 11.142 1.00 49.31 O ATOM 1661 HA ASP C 91 -7.954 16.655 10.670 1.00 0.00 H ATOM 1662 HB2 ASP C 91 -10.085 15.326 12.345 1.00 0.00 H ATOM 1663 HB3 ASP C 91 -9.602 16.993 12.734 1.00 0.00 H ATOM 1664 H ASP C 91 -9.116 14.136 10.631 1.00 0.00 H ATOM 1665 N HIS C 92 -7.540 15.185 13.630 1.00 29.43 N ATOM 1666 CA HIS C 92 -6.726 15.163 14.825 1.00 28.90 C ATOM 1667 C HIS C 92 -5.253 14.985 14.535 1.00 28.08 C ATOM 1668 O HIS C 92 -4.455 15.762 15.035 1.00 27.07 O ATOM 1669 CB HIS C 92 -7.249 14.123 15.782 1.00 28.64 C ATOM 1670 CG HIS C 92 -8.514 14.551 16.413 1.00 29.84 C ATOM 1671 ND1 HIS C 92 -8.557 15.583 17.323 1.00 26.92 N ATOM 1672 CD2 HIS C 92 -9.796 14.181 16.190 1.00 33.09 C ATOM 1673 CE1 HIS C 92 -9.816 15.786 17.685 1.00 32.98 C ATOM 1674 NE2 HIS C 92 -10.589 14.957 17.002 1.00 35.14 N ATOM 1675 HA HIS C 92 -6.805 16.142 15.298 1.00 0.00 H ATOM 1676 HB2 HIS C 92 -7.422 13.195 15.237 1.00 0.00 H ATOM 1677 HB3 HIS C 92 -6.505 13.952 16.560 1.00 0.00 H ATOM 1678 HD2 HIS C 92 -10.136 13.412 15.497 1.00 0.00 H ATOM 1679 HE1 HIS C 92 -10.157 16.514 18.421 1.00 0.00 H ATOM 1680 H HIS C 92 -8.300 14.484 13.523 1.00 0.00 H ATOM 1681 N LEU C 93 -4.907 14.030 13.660 1.00 27.85 N ATOM 1682 CA LEU C 93 -3.512 13.783 13.310 1.00 27.41 C ATOM 1683 C LEU C 93 -2.863 15.002 12.624 1.00 26.95 C ATOM 1684 O LEU C 93 -1.713 15.268 12.859 1.00 25.91 O ATOM 1685 CB LEU C 93 -3.394 12.511 12.430 1.00 28.72 C ATOM 1686 CG LEU C 93 -3.795 11.186 13.067 1.00 28.78 C ATOM 1687 CD1 LEU C 93 -3.720 10.035 12.053 1.00 35.51 C ATOM 1688 CD2 LEU C 93 -2.975 10.814 14.323 1.00 28.41 C ATOM 1689 HA LEU C 93 -2.962 13.615 14.236 1.00 0.00 H ATOM 1690 HB2 LEU C 93 -4.025 12.658 11.553 1.00 0.00 H ATOM 1691 HB3 LEU C 93 -2.354 12.423 12.117 1.00 0.00 H ATOM 1692 HG LEU C 93 -4.825 11.334 13.392 1.00 0.00 H ATOM 1693 HD21 LEU C 93 -1.921 10.736 14.057 1.00 0.00 H ATOM 1694 HD22 LEU C 93 -3.104 11.586 15.081 1.00 0.00 H ATOM 1695 HD23 LEU C 93 -3.324 9.858 14.713 1.00 0.00 H ATOM 1696 HD11 LEU C 93 -4.395 10.240 11.222 1.00 0.00 H ATOM 1697 HD12 LEU C 93 -2.700 9.947 11.680 1.00 0.00 H ATOM 1698 HD13 LEU C 93 -4.012 9.104 12.539 1.00 0.00 H ATOM 1699 H LEU C 93 -5.651 13.451 13.220 1.00 0.00 H ATOM 1700 N THR C 94 -3.605 15.682 11.756 1.00 27.25 N ATOM 1701 CA THR C 94 -3.241 16.975 11.185 1.00 29.99 C ATOM 1702 C THR C 94 -2.886 18.027 12.282 1.00 27.91 C ATOM 1703 O THR C 94 -1.907 18.807 12.161 1.00 28.87 O ATOM 1704 CB THR C 94 -4.467 17.463 10.366 1.00 31.15 C ATOM 1705 OG1 THR C 94 -4.454 16.809 9.085 1.00 39.00 O ATOM 1706 CG2 THR C 94 -4.456 18.893 10.148 1.00 34.45 C ATOM 1707 HA THR C 94 -2.352 16.863 10.564 1.00 0.00 H ATOM 1708 HB THR C 94 -5.363 17.219 10.937 1.00 0.00 H ATOM 1709 HG1 THR C 94 -4.504 15.829 9.216 1.00 0.00 H ATOM 1710 HG23 THR C 94 -4.466 19.406 11.110 1.00 0.00 H ATOM 1711 HG21 THR C 94 -3.557 19.168 9.597 1.00 0.00 H ATOM 1712 HG22 THR C 94 -5.337 19.178 9.574 1.00 0.00 H ATOM 1713 H THR C 94 -4.510 15.263 11.462 1.00 0.00 H ATOM 1714 N ASN C 95 -3.671 18.061 13.363 1.00 26.14 N ATOM 1715 CA ASN C 95 -3.321 18.960 14.496 1.00 24.10 C ATOM 1716 C ASN C 95 -1.996 18.539 15.142 1.00 22.93 C ATOM 1717 O ASN C 95 -1.179 19.379 15.534 1.00 21.47 O ATOM 1718 CB ASN C 95 -4.413 18.966 15.512 1.00 22.33 C ATOM 1719 CG ASN C 95 -5.640 19.697 15.016 1.00 22.94 C ATOM 1720 OD1 ASN C 95 -5.603 20.413 14.030 1.00 22.22 O ATOM 1721 ND2 ASN C 95 -6.743 19.473 15.676 1.00 21.52 N ATOM 1722 HA ASN C 95 -3.202 19.969 14.102 1.00 0.00 H ATOM 1723 HB2 ASN C 95 -4.685 17.936 15.743 1.00 0.00 H ATOM 1724 HB3 ASN C 95 -4.051 19.457 16.416 1.00 0.00 H ATOM 1725 HD22 ASN C 95 -6.732 18.855 16.513 1.00 0.00 H ATOM 1726 HD21 ASN C 95 -7.633 19.912 15.365 1.00 0.00 H ATOM 1727 H ASN C 95 -4.521 17.463 13.412 1.00 0.00 H ATOM 1728 N ALA C 96 -1.759 17.240 15.248 1.00 23.20 N ATOM 1729 CA ALA C 96 -0.496 16.797 15.857 1.00 24.49 C ATOM 1730 C ALA C 96 0.666 17.154 14.939 1.00 25.66 C ATOM 1731 O ALA C 96 1.710 17.605 15.394 1.00 25.93 O ATOM 1732 CB ALA C 96 -0.526 15.298 16.125 1.00 23.94 C ATOM 1733 HA ALA C 96 -0.365 17.306 16.812 1.00 0.00 H ATOM 1734 HB1 ALA C 96 -1.346 15.068 16.805 1.00 0.00 H ATOM 1735 HB2 ALA C 96 -0.671 14.765 15.185 1.00 0.00 H ATOM 1736 HB3 ALA C 96 0.418 14.992 16.576 1.00 0.00 H ATOM 1737 H ALA C 96 -2.454 16.546 14.907 1.00 0.00 H ATOM 1738 N ILE C 97 0.519 16.923 13.640 1.00 26.70 N ATOM 1739 CA ILE C 97 1.641 17.277 12.763 1.00 28.12 C ATOM 1740 C ILE C 97 1.869 18.786 12.783 1.00 28.30 C ATOM 1741 O ILE C 97 3.035 19.200 12.857 1.00 29.67 O ATOM 1742 CB ILE C 97 1.496 16.706 11.292 1.00 29.47 C ATOM 1743 CG1 ILE C 97 1.545 15.175 11.296 1.00 28.10 C ATOM 1744 CG2 ILE C 97 2.624 17.229 10.374 1.00 28.69 C ATOM 1745 CD1 ILE C 97 0.369 14.639 10.624 1.00 28.23 C ATOM 1746 HA ILE C 97 2.530 16.790 13.163 1.00 0.00 H ATOM 1747 HB ILE C 97 0.533 17.046 10.912 1.00 0.00 H ATOM 1748 HG12 ILE C 97 2.443 14.841 10.776 1.00 0.00 H ATOM 1749 HG13 ILE C 97 1.568 14.817 12.325 1.00 0.00 H ATOM 1750 HD11 ILE C 97 -0.529 14.972 11.145 1.00 0.00 H ATOM 1751 HD12 ILE C 97 0.346 14.996 9.594 1.00 0.00 H ATOM 1752 HD13 ILE C 97 0.413 13.550 10.632 1.00 0.00 H ATOM 1753 HG21 ILE C 97 2.580 18.317 10.331 1.00 0.00 H ATOM 1754 HG22 ILE C 97 3.589 16.919 10.774 1.00 0.00 H ATOM 1755 HG23 ILE C 97 2.495 16.819 9.372 1.00 0.00 H ATOM 1756 H ILE C 97 -0.355 16.508 13.260 1.00 0.00 H ATOM 1757 N ALA C 98 0.783 19.589 12.814 1.00 27.67 N ATOM 1758 CA ALA C 98 0.916 21.079 12.793 1.00 28.39 C ATOM 1759 C ALA C 98 1.654 21.654 13.968 1.00 29.05 C ATOM 1760 O ALA C 98 2.225 22.732 13.829 1.00 31.23 O ATOM 1761 CB ALA C 98 -0.407 21.808 12.592 1.00 27.71 C ATOM 1762 HA ALA C 98 1.533 21.258 11.912 1.00 0.00 H ATOM 1763 HB1 ALA C 98 -0.845 21.507 11.641 1.00 0.00 H ATOM 1764 HB2 ALA C 98 -1.088 21.553 13.404 1.00 0.00 H ATOM 1765 HB3 ALA C 98 -0.231 22.884 12.588 1.00 0.00 H ATOM 1766 H ALA C 98 -0.165 19.163 12.853 1.00 0.00 H ATOM 1767 N VAL C 99 1.708 20.959 15.109 1.00 27.69 N ATOM 1768 CA VAL C 99 2.574 21.461 16.173 1.00 26.56 C ATOM 1769 C VAL C 99 4.020 20.988 16.124 1.00 28.85 C ATOM 1770 O VAL C 99 4.825 21.436 16.948 1.00 27.64 O ATOM 1771 CB VAL C 99 1.943 21.352 17.642 1.00 25.92 C ATOM 1772 CG1 VAL C 99 0.659 22.173 17.678 1.00 22.41 C ATOM 1773 CG2 VAL C 99 1.626 19.894 18.040 1.00 19.30 C ATOM 1774 HA VAL C 99 2.628 22.525 15.943 1.00 0.00 H ATOM 1775 HB VAL C 99 2.676 21.731 18.354 1.00 0.00 H ATOM 1776 HG11 VAL C 99 0.888 23.213 17.447 1.00 0.00 H ATOM 1777 HG12 VAL C 99 -0.042 21.781 16.941 1.00 0.00 H ATOM 1778 HG13 VAL C 99 0.216 22.109 18.672 1.00 0.00 H ATOM 1779 HG21 VAL C 99 0.910 19.473 17.334 1.00 0.00 H ATOM 1780 HG22 VAL C 99 2.544 19.306 18.023 1.00 0.00 H ATOM 1781 HG23 VAL C 99 1.201 19.877 19.044 1.00 0.00 H ATOM 1782 H VAL C 99 1.152 20.089 15.235 1.00 0.00 H ATOM 1783 N CYS C 100 4.378 20.113 15.169 1.00 31.05 N ATOM 1784 CA CYS C 100 5.759 19.596 15.172 1.00 33.99 C ATOM 1785 C CYS C 100 6.744 20.475 14.354 1.00 35.25 C ATOM 1786 O CYS C 100 6.438 20.965 13.248 1.00 33.08 O ATOM 1787 CB CYS C 100 5.806 18.109 14.766 1.00 35.21 C ATOM 1788 SG CYS C 100 7.524 17.423 14.505 1.00 42.73 S ATOM 1789 HA CYS C 100 6.112 19.658 16.201 1.00 0.00 H ATOM 1790 HB2 CYS C 100 5.249 17.993 13.836 1.00 0.00 H ATOM 1791 HB3 CYS C 100 5.324 17.527 15.552 1.00 0.00 H ATOM 1792 HG CYS C 100 8.153 18.131 13.501 1.00 0.00 H ATOM 1793 H CYS C 100 3.697 19.808 14.445 1.00 0.00 H ATOM 1794 N GLY C 101 7.934 20.667 14.921 1.00 37.33 N ATOM 1795 CA GLY C 101 8.971 21.428 14.233 1.00 40.74 C ATOM 1796 C GLY C 101 9.530 20.790 12.964 1.00 42.74 C ATOM 1797 O GLY C 101 9.822 21.502 11.952 1.00 42.71 O ATOM 1798 HA3 GLY C 101 9.798 21.571 14.928 1.00 0.00 H ATOM 1799 HA2 GLY C 101 8.552 22.398 13.964 1.00 0.00 H ATOM 1800 H GLY C 101 8.126 20.271 15.863 1.00 0.00 H ATOM 1801 N GLN C 102 9.696 19.471 13.006 1.00 43.94 N ATOM 1802 CA GLN C 102 10.224 18.731 11.862 1.00 46.88 C ATOM 1803 C GLN C 102 9.162 17.756 11.399 1.00 46.37 C ATOM 1804 O GLN C 102 9.227 16.600 11.758 1.00 46.22 O ATOM 1805 CB GLN C 102 11.540 18.007 12.221 1.00 47.60 C ATOM 1806 CG GLN C 102 12.360 17.480 11.005 1.00 53.31 C ATOM 1807 CD GLN C 102 12.721 18.582 9.975 1.00 59.47 C ATOM 1808 OE1 GLN C 102 12.358 18.480 8.784 1.00 60.80 O ATOM 1809 NE2 GLN C 102 13.413 19.646 10.439 1.00 60.77 N ATOM 1810 HA GLN C 102 10.464 19.422 11.054 1.00 0.00 H ATOM 1811 HB2 GLN C 102 12.168 18.704 12.775 1.00 0.00 H ATOM 1812 HB3 GLN C 102 11.295 17.156 12.857 1.00 0.00 H ATOM 1813 HG2 GLN C 102 13.285 17.040 11.378 1.00 0.00 H ATOM 1814 HG3 GLN C 102 11.773 16.714 10.499 1.00 0.00 H ATOM 1815 HE22 GLN C 102 13.694 19.687 11.439 1.00 0.00 H ATOM 1816 HE21 GLN C 102 13.664 20.423 9.796 1.00 0.00 H ATOM 1817 H GLN C 102 9.444 18.955 13.873 1.00 0.00 H ATOM 1818 N PRO C 103 8.164 18.245 10.626 1.00 46.75 N ATOM 1819 CA PRO C 103 6.998 17.449 10.237 1.00 47.84 C ATOM 1820 C PRO C 103 7.233 16.334 9.215 1.00 49.75 C ATOM 1821 O PRO C 103 6.414 15.391 9.149 1.00 48.83 O ATOM 1822 CB PRO C 103 6.007 18.484 9.684 1.00 47.59 C ATOM 1823 CG PRO C 103 6.770 19.722 9.476 1.00 46.56 C ATOM 1824 CD PRO C 103 8.047 19.661 10.213 1.00 46.05 C ATOM 1825 HA PRO C 103 6.651 16.891 11.107 1.00 0.00 H ATOM 1826 HD3 PRO C 103 8.879 19.946 9.569 1.00 0.00 H ATOM 1827 HD2 PRO C 103 8.022 20.317 11.083 1.00 0.00 H ATOM 1828 HG3 PRO C 103 6.187 20.570 9.835 1.00 0.00 H ATOM 1829 HG2 PRO C 103 6.973 19.846 8.412 1.00 0.00 H ATOM 1830 HB2 PRO C 103 5.587 18.137 8.740 1.00 0.00 H ATOM 1831 HB3 PRO C 103 5.201 18.653 10.398 1.00 0.00 H ATOM 1832 N GLN C 104 8.312 16.454 8.428 1.00 51.72 N ATOM 1833 CA GLN C 104 8.734 15.391 7.507 1.00 54.06 C ATOM 1834 C GLN C 104 9.337 14.219 8.283 1.00 54.86 C ATOM 1835 O GLN C 104 8.991 13.058 8.037 1.00 55.20 O ATOM 1836 CB GLN C 104 9.724 15.908 6.452 1.00 54.31 C ATOM 1837 CG GLN C 104 9.088 16.685 5.292 1.00 57.32 C ATOM 1838 CD GLN C 104 8.071 15.859 4.462 1.00 62.58 C ATOM 1839 OE1 GLN C 104 6.978 16.351 4.107 1.00 63.45 O ATOM 1840 NE2 GLN C 104 8.432 14.608 4.147 1.00 64.72 N ATOM 1841 HA GLN C 104 7.847 15.044 6.978 1.00 0.00 H ATOM 1842 HB2 GLN C 104 10.436 16.566 6.950 1.00 0.00 H ATOM 1843 HB3 GLN C 104 10.253 15.051 6.035 1.00 0.00 H ATOM 1844 HG2 GLN C 104 8.571 17.553 5.703 1.00 0.00 H ATOM 1845 HG3 GLN C 104 9.883 17.019 4.626 1.00 0.00 H ATOM 1846 HE22 GLN C 104 9.351 14.237 4.462 1.00 0.00 H ATOM 1847 HE21 GLN C 104 7.793 14.008 3.587 1.00 0.00 H ATOM 1848 H GLN C 104 8.870 17.331 8.471 1.00 0.00 H ATOM 1849 N GLN C 105 10.223 14.527 9.220 1.00 55.66 N ATOM 1850 CA GLN C 105 10.787 13.528 10.104 1.00 57.84 C ATOM 1851 C GLN C 105 9.694 12.716 10.864 1.00 59.04 C ATOM 1852 O GLN C 105 9.918 11.541 11.221 1.00 59.04 O ATOM 1853 CB GLN C 105 11.733 14.225 11.064 1.00 57.72 C ATOM 1854 CG GLN C 105 12.414 13.335 12.074 1.00 60.94 C ATOM 1855 CD GLN C 105 13.474 14.082 12.884 1.00 64.49 C ATOM 1856 OE1 GLN C 105 14.055 15.083 12.427 1.00 66.88 O ATOM 1857 NE2 GLN C 105 13.738 13.592 14.091 1.00 65.93 N ATOM 1858 HA GLN C 105 11.332 12.795 9.509 1.00 0.00 H ATOM 1859 HB2 GLN C 105 12.507 14.716 10.474 1.00 0.00 H ATOM 1860 HB3 GLN C 105 11.163 14.976 11.610 1.00 0.00 H ATOM 1861 HG2 GLN C 105 11.662 12.942 12.758 1.00 0.00 H ATOM 1862 HG3 GLN C 105 12.892 12.509 11.548 1.00 0.00 H ATOM 1863 HE22 GLN C 105 13.229 12.753 14.434 1.00 0.00 H ATOM 1864 HE21 GLN C 105 14.454 14.048 14.692 1.00 0.00 H ATOM 1865 H GLN C 105 10.523 15.518 9.324 1.00 0.00 H ATOM 1866 N LEU C 106 8.522 13.347 11.077 1.00 59.77 N ATOM 1867 CA LEU C 106 7.387 12.777 11.827 1.00 59.80 C ATOM 1868 C LEU C 106 6.408 12.059 10.910 1.00 60.40 C ATOM 1869 O LEU C 106 5.853 11.024 11.291 1.00 59.88 O ATOM 1870 CB LEU C 106 6.664 13.882 12.638 1.00 59.74 C ATOM 1871 CG LEU C 106 5.208 13.748 13.170 1.00 59.30 C ATOM 1872 CD1 LEU C 106 4.978 12.479 14.004 1.00 59.88 C ATOM 1873 CD2 LEU C 106 4.749 14.960 13.989 1.00 55.55 C ATOM 1874 HA LEU C 106 7.788 12.037 12.520 1.00 0.00 H ATOM 1875 HB2 LEU C 106 7.286 14.062 13.515 1.00 0.00 H ATOM 1876 HB3 LEU C 106 6.668 14.768 12.003 1.00 0.00 H ATOM 1877 HG LEU C 106 4.607 13.686 12.263 1.00 0.00 H ATOM 1878 HD21 LEU C 106 5.405 15.084 14.851 1.00 0.00 H ATOM 1879 HD22 LEU C 106 4.792 15.854 13.367 1.00 0.00 H ATOM 1880 HD23 LEU C 106 3.726 14.801 14.329 1.00 0.00 H ATOM 1881 HD11 LEU C 106 5.186 11.601 13.392 1.00 0.00 H ATOM 1882 HD12 LEU C 106 5.643 12.488 14.867 1.00 0.00 H ATOM 1883 HD13 LEU C 106 3.942 12.451 14.342 1.00 0.00 H ATOM 1884 H LEU C 106 8.410 14.304 10.685 1.00 0.00 H ATOM 1885 N LEU C 107 6.180 12.612 9.713 1.00 61.25 N ATOM 1886 CA LEU C 107 5.381 11.919 8.680 1.00 62.91 C ATOM 1887 C LEU C 107 6.030 10.594 8.254 1.00 64.51 C ATOM 1888 O LEU C 107 5.396 9.760 7.590 1.00 65.08 O ATOM 1889 CB LEU C 107 5.188 12.794 7.442 1.00 61.96 C ATOM 1890 CG LEU C 107 4.186 13.935 7.530 1.00 60.62 C ATOM 1891 CD1 LEU C 107 4.457 14.918 6.401 1.00 60.50 C ATOM 1892 CD2 LEU C 107 2.756 13.434 7.492 1.00 57.47 C ATOM 1893 HA LEU C 107 4.410 11.712 9.131 1.00 0.00 H ATOM 1894 HB2 LEU C 107 6.157 13.230 7.197 1.00 0.00 H ATOM 1895 HB3 LEU C 107 4.868 12.142 6.629 1.00 0.00 H ATOM 1896 HG LEU C 107 4.310 14.440 8.488 1.00 0.00 H ATOM 1897 HD21 LEU C 107 2.585 12.899 6.558 1.00 0.00 H ATOM 1898 HD22 LEU C 107 2.585 12.763 8.333 1.00 0.00 H ATOM 1899 HD23 LEU C 107 2.074 14.281 7.557 1.00 0.00 H ATOM 1900 HD11 LEU C 107 5.470 15.309 6.496 1.00 0.00 H ATOM 1901 HD12 LEU C 107 4.352 14.408 5.444 1.00 0.00 H ATOM 1902 HD13 LEU C 107 3.743 15.739 6.457 1.00 0.00 H ATOM 1903 H LEU C 107 6.574 13.552 9.504 1.00 0.00 H ATOM 1904 N GLN C 108 7.303 10.459 8.634 1.00 66.15 N ATOM 1905 CA GLN C 108 8.146 9.278 8.449 1.00 67.85 C ATOM 1906 C GLN C 108 7.582 8.089 9.198 1.00 68.12 C ATOM 1907 O GLN C 108 7.458 6.995 8.640 1.00 68.30 O ATOM 1908 CB GLN C 108 9.561 9.579 8.999 1.00 68.28 C ATOM 1909 CG GLN C 108 10.723 8.950 8.235 1.00 69.38 C ATOM 1910 CD GLN C 108 11.129 9.746 6.994 1.00 71.61 C ATOM 1911 OE1 GLN C 108 12.311 10.010 6.791 1.00 71.40 O ATOM 1912 NE2 GLN C 108 10.152 10.131 6.161 1.00 71.62 N ATOM 1913 HA GLN C 108 8.184 9.042 7.386 1.00 0.00 H ATOM 1914 HB2 GLN C 108 9.700 10.660 8.988 1.00 0.00 H ATOM 1915 HB3 GLN C 108 9.603 9.219 10.027 1.00 0.00 H ATOM 1916 HG2 GLN C 108 11.582 8.886 8.902 1.00 0.00 H ATOM 1917 HG3 GLN C 108 10.431 7.947 7.923 1.00 0.00 H ATOM 1918 HE22 GLN C 108 9.163 9.886 6.371 1.00 0.00 H ATOM 1919 HE21 GLN C 108 10.383 10.675 5.305 1.00 0.00 H ATOM 1920 H GLN C 108 7.739 11.275 9.109 1.00 0.00 H ATOM 1921 N VAL C 109 7.262 8.333 10.472 1.00 68.63 N ATOM 1922 CA VAL C 109 6.727 7.342 11.394 1.00 68.56 C ATOM 1923 C VAL C 109 5.275 7.015 11.028 1.00 68.74 C ATOM 1924 O VAL C 109 4.830 5.866 11.127 1.00 68.52 O ATOM 1925 CB VAL C 109 6.828 7.870 12.839 1.00 68.59 C ATOM 1926 CG1 VAL C 109 6.283 6.853 13.859 1.00 68.97 C ATOM 1927 CG2 VAL C 109 8.282 8.285 13.162 1.00 68.45 C ATOM 1928 HA VAL C 109 7.310 6.424 11.320 1.00 0.00 H ATOM 1929 HB VAL C 109 6.199 8.757 12.919 1.00 0.00 H ATOM 1930 HG11 VAL C 109 5.235 6.648 13.641 1.00 0.00 H ATOM 1931 HG12 VAL C 109 6.857 5.929 13.791 1.00 0.00 H ATOM 1932 HG13 VAL C 109 6.373 7.265 14.864 1.00 0.00 H ATOM 1933 HG21 VAL C 109 8.938 7.421 13.053 1.00 0.00 H ATOM 1934 HG22 VAL C 109 8.596 9.070 12.474 1.00 0.00 H ATOM 1935 HG23 VAL C 109 8.334 8.655 14.186 1.00 0.00 H ATOM 1936 H VAL C 109 7.405 9.299 10.830 1.00 0.00 H ATOM 1937 N LEU C 110 4.535 8.017 10.580 1.00 69.16 N ATOM 1938 CA LEU C 110 3.124 7.785 10.242 1.00 69.73 C ATOM 1939 C LEU C 110 2.905 7.111 8.869 1.00 70.29 C ATOM 1940 O LEU C 110 1.905 6.416 8.675 1.00 70.81 O ATOM 1941 CB LEU C 110 2.282 9.059 10.443 1.00 69.32 C ATOM 1942 CG LEU C 110 2.643 9.843 11.729 1.00 69.11 C ATOM 1943 CD1 LEU C 110 1.916 11.177 11.791 1.00 68.39 C ATOM 1944 CD2 LEU C 110 2.453 9.051 13.053 1.00 67.84 C ATOM 1945 HA LEU C 110 2.758 7.045 10.954 1.00 0.00 H ATOM 1946 HB2 LEU C 110 2.436 9.713 9.585 1.00 0.00 H ATOM 1947 HB3 LEU C 110 1.231 8.773 10.496 1.00 0.00 H ATOM 1948 HG LEU C 110 3.715 10.021 11.649 1.00 0.00 H ATOM 1949 HD21 LEU C 110 1.409 8.753 13.150 1.00 0.00 H ATOM 1950 HD22 LEU C 110 3.086 8.164 13.038 1.00 0.00 H ATOM 1951 HD23 LEU C 110 2.731 9.683 13.896 1.00 0.00 H ATOM 1952 HD11 LEU C 110 2.195 11.782 10.928 1.00 0.00 H ATOM 1953 HD12 LEU C 110 0.840 11.004 11.783 1.00 0.00 H ATOM 1954 HD13 LEU C 110 2.194 11.699 12.707 1.00 0.00 H ATOM 1955 H LEU C 110 4.950 8.964 10.468 1.00 0.00 H ATOM 1956 N GLN C 111 3.834 7.308 7.931 1.00 70.64 N ATOM 1957 CA GLN C 111 3.841 6.559 6.657 1.00 70.88 C ATOM 1958 C GLN C 111 4.011 5.069 6.945 1.00 70.70 C ATOM 1959 O GLN C 111 3.338 4.216 6.362 1.00 70.25 O ATOM 1960 CB GLN C 111 5.008 7.030 5.785 1.00 71.04 C ATOM 1961 CG GLN C 111 5.143 6.330 4.429 1.00 71.52 C ATOM 1962 CD GLN C 111 6.323 6.860 3.633 1.00 72.16 C ATOM 1963 OE1 GLN C 111 7.477 6.596 3.984 1.00 71.35 O ATOM 1964 NE2 GLN C 111 6.040 7.631 2.567 1.00 71.06 N ATOM 1965 HA GLN C 111 2.900 6.734 6.136 1.00 0.00 H ATOM 1966 HB2 GLN C 111 4.881 8.097 5.601 1.00 0.00 H ATOM 1967 HB3 GLN C 111 5.931 6.866 6.341 1.00 0.00 H ATOM 1968 HG2 GLN C 111 5.281 5.262 4.596 1.00 0.00 H ATOM 1969 HG3 GLN C 111 4.230 6.492 3.856 1.00 0.00 H ATOM 1970 HE22 GLN C 111 5.050 7.824 2.313 1.00 0.00 H ATOM 1971 HE21 GLN C 111 6.811 8.034 1.997 1.00 0.00 H ATOM 1972 H GLN C 111 4.579 8.013 8.103 1.00 0.00 H ATOM 1973 N GLN C 112 4.937 4.797 7.863 1.00 70.67 N ATOM 1974 CA GLN C 112 5.292 3.467 8.332 1.00 70.70 C ATOM 1975 C GLN C 112 4.442 3.166 9.588 1.00 70.12 C ATOM 1976 O GLN C 112 4.991 2.743 10.603 1.00 70.45 O ATOM 1977 CB GLN C 112 6.803 3.480 8.664 1.00 70.92 C ATOM 1978 CG GLN C 112 7.583 2.144 8.682 1.00 72.35 C ATOM 1979 CD GLN C 112 8.882 2.252 9.523 1.00 74.82 C ATOM 1980 OE1 GLN C 112 9.497 3.328 9.609 1.00 75.06 O ATOM 1981 NE2 GLN C 112 9.286 1.140 10.158 1.00 73.80 N ATOM 1982 HA GLN C 112 5.098 2.696 7.586 1.00 0.00 H ATOM 1983 HB2 GLN C 112 7.286 4.121 7.927 1.00 0.00 H ATOM 1984 HB3 GLN C 112 6.908 3.924 9.654 1.00 0.00 H ATOM 1985 HG2 GLN C 112 6.948 1.369 9.110 1.00 0.00 H ATOM 1986 HG3 GLN C 112 7.845 1.873 7.659 1.00 0.00 H ATOM 1987 HE22 GLN C 112 8.743 0.259 10.060 1.00 0.00 H ATOM 1988 HE21 GLN C 112 10.142 1.160 10.748 1.00 0.00 H ATOM 1989 H GLN C 112 5.448 5.602 8.278 1.00 0.00 H ATOM 1990 N THR C 113 3.121 3.424 9.518 1.00 69.08 N ATOM 1991 CA THR C 113 2.149 3.115 10.599 1.00 67.72 C ATOM 1992 C THR C 113 0.662 3.133 10.162 1.00 67.04 C ATOM 1993 O THR C 113 -0.154 2.410 10.706 1.00 66.75 O ATOM 1994 CB THR C 113 2.364 4.017 11.868 1.00 67.73 C ATOM 1995 OG1 THR C 113 2.307 3.223 13.062 1.00 66.66 O ATOM 1996 CG2 THR C 113 1.334 5.155 11.951 1.00 68.55 C ATOM 1997 HA THR C 113 2.369 2.080 10.862 1.00 0.00 H ATOM 1998 HB THR C 113 3.352 4.468 11.776 1.00 0.00 H ATOM 1999 HG1 THR C 113 2.444 3.805 13.851 1.00 0.00 H ATOM 2000 HG23 THR C 113 1.382 5.754 11.042 1.00 0.00 H ATOM 2001 HG21 THR C 113 0.335 4.732 12.056 1.00 0.00 H ATOM 2002 HG22 THR C 113 1.557 5.783 12.814 1.00 0.00 H ATOM 2003 H THR C 113 2.758 3.868 8.651 1.00 0.00 H ATOM 2004 N LEU C 114 0.314 3.956 9.181 1.00 66.68 N ATOM 2005 CA LEU C 114 -1.087 4.124 8.770 1.00 66.19 C ATOM 2006 C LEU C 114 -1.418 3.282 7.560 1.00 65.73 C ATOM 2007 O LEU C 114 -0.517 2.920 6.819 1.00 65.82 O ATOM 2008 CB LEU C 114 -1.387 5.603 8.435 1.00 66.36 C ATOM 2009 CG LEU C 114 -1.397 6.600 9.601 1.00 66.27 C ATOM 2010 CD1 LEU C 114 -1.326 8.051 9.124 1.00 64.13 C ATOM 2011 CD2 LEU C 114 -2.621 6.358 10.479 1.00 65.32 C ATOM 2012 HA LEU C 114 -1.702 3.800 9.610 1.00 0.00 H ATOM 2013 HB2 LEU C 114 -0.632 5.938 7.724 1.00 0.00 H ATOM 2014 HB3 LEU C 114 -2.369 5.640 7.964 1.00 0.00 H ATOM 2015 HG LEU C 114 -0.499 6.432 10.196 1.00 0.00 H ATOM 2016 HD21 LEU C 114 -3.525 6.490 9.884 1.00 0.00 H ATOM 2017 HD22 LEU C 114 -2.589 5.342 10.873 1.00 0.00 H ATOM 2018 HD23 LEU C 114 -2.621 7.070 11.305 1.00 0.00 H ATOM 2019 HD11 LEU C 114 -0.407 8.202 8.558 1.00 0.00 H ATOM 2020 HD12 LEU C 114 -2.185 8.266 8.488 1.00 0.00 H ATOM 2021 HD13 LEU C 114 -1.336 8.717 9.987 1.00 0.00 H ATOM 2022 H LEU C 114 1.053 4.497 8.689 1.00 0.00 H ATOM 2023 N PRO C 115 -2.719 2.973 7.342 1.00 65.89 N ATOM 2024 CA PRO C 115 -3.078 2.437 6.025 1.00 65.76 C ATOM 2025 C PRO C 115 -2.679 3.467 4.979 1.00 65.82 C ATOM 2026 O PRO C 115 -2.694 4.658 5.279 1.00 65.54 O ATOM 2027 CB PRO C 115 -4.606 2.326 6.088 1.00 65.67 C ATOM 2028 CG PRO C 115 -4.921 2.256 7.549 1.00 65.71 C ATOM 2029 CD PRO C 115 -3.901 3.116 8.216 1.00 65.60 C ATOM 2030 HA PRO C 115 -2.600 1.489 5.779 1.00 0.00 H ATOM 2031 HD3 PRO C 115 -4.232 4.154 8.260 1.00 0.00 H ATOM 2032 HD2 PRO C 115 -3.688 2.761 9.224 1.00 0.00 H ATOM 2033 HG3 PRO C 115 -4.847 1.229 7.907 1.00 0.00 H ATOM 2034 HG2 PRO C 115 -5.925 2.635 7.742 1.00 0.00 H ATOM 2035 HB2 PRO C 115 -5.074 3.200 5.635 1.00 0.00 H ATOM 2036 HB3 PRO C 115 -4.948 1.426 5.577 1.00 0.00 H ATOM 2037 N PRO C 116 -2.275 3.019 3.774 1.00 66.02 N ATOM 2038 CA PRO C 116 -2.027 4.017 2.737 1.00 65.37 C ATOM 2039 C PRO C 116 -3.210 4.986 2.444 1.00 64.59 C ATOM 2040 O PRO C 116 -2.948 6.193 2.338 1.00 64.53 O ATOM 2041 CB PRO C 116 -1.607 3.169 1.519 1.00 65.58 C ATOM 2042 CG PRO C 116 -0.902 1.997 2.127 1.00 66.05 C ATOM 2043 CD PRO C 116 -1.710 1.697 3.402 1.00 66.44 C ATOM 2044 HA PRO C 116 -1.262 4.728 3.049 1.00 0.00 H ATOM 2045 HD3 PRO C 116 -2.503 0.977 3.201 1.00 0.00 H ATOM 2046 HD2 PRO C 116 -1.064 1.313 4.192 1.00 0.00 H ATOM 2047 HG3 PRO C 116 0.130 2.249 2.372 1.00 0.00 H ATOM 2048 HG2 PRO C 116 -0.915 1.143 1.450 1.00 0.00 H ATOM 2049 HB2 PRO C 116 -2.479 2.846 0.951 1.00 0.00 H ATOM 2050 HB3 PRO C 116 -0.937 3.730 0.867 1.00 0.00 H ATOM 2051 N PRO C 117 -4.480 4.492 2.358 1.00 63.63 N ATOM 2052 CA PRO C 117 -5.598 5.399 1.991 1.00 63.01 C ATOM 2053 C PRO C 117 -5.736 6.650 2.866 1.00 62.53 C ATOM 2054 O PRO C 117 -5.963 7.757 2.345 1.00 62.43 O ATOM 2055 CB PRO C 117 -6.860 4.519 2.140 1.00 62.82 C ATOM 2056 CG PRO C 117 -6.396 3.136 1.998 1.00 63.27 C ATOM 2057 CD PRO C 117 -4.946 3.092 2.484 1.00 64.09 C ATOM 2058 HA PRO C 117 -5.429 5.797 0.990 1.00 0.00 H ATOM 2059 HD3 PRO C 117 -4.895 2.759 3.521 1.00 0.00 H ATOM 2060 HD2 PRO C 117 -4.348 2.427 1.860 1.00 0.00 H ATOM 2061 HG3 PRO C 117 -6.449 2.829 0.953 1.00 0.00 H ATOM 2062 HG2 PRO C 117 -7.013 2.471 2.602 1.00 0.00 H ATOM 2063 HB2 PRO C 117 -7.315 4.669 3.119 1.00 0.00 H ATOM 2064 HB3 PRO C 117 -7.585 4.759 1.363 1.00 0.00 H ATOM 2065 N VAL C 118 -5.610 6.458 4.179 1.00 61.58 N ATOM 2066 CA VAL C 118 -5.772 7.543 5.144 1.00 60.61 C ATOM 2067 C VAL C 118 -4.484 8.367 5.282 1.00 59.87 C ATOM 2068 O VAL C 118 -4.556 9.582 5.431 1.00 59.68 O ATOM 2069 CB VAL C 118 -6.359 7.059 6.551 1.00 60.69 C ATOM 2070 CG1 VAL C 118 -7.601 6.182 6.365 1.00 60.38 C ATOM 2071 CG2 VAL C 118 -5.313 6.355 7.402 1.00 60.00 C ATOM 2072 HA VAL C 118 -6.535 8.208 4.740 1.00 0.00 H ATOM 2073 HB VAL C 118 -6.658 7.957 7.092 1.00 0.00 H ATOM 2074 HG11 VAL C 118 -8.371 6.751 5.845 1.00 0.00 H ATOM 2075 HG12 VAL C 118 -7.338 5.302 5.777 1.00 0.00 H ATOM 2076 HG13 VAL C 118 -7.974 5.871 7.341 1.00 0.00 H ATOM 2077 HG21 VAL C 118 -4.944 5.478 6.870 1.00 0.00 H ATOM 2078 HG22 VAL C 118 -4.486 7.038 7.598 1.00 0.00 H ATOM 2079 HG23 VAL C 118 -5.762 6.046 8.346 1.00 0.00 H ATOM 2080 H VAL C 118 -5.389 5.504 4.528 1.00 0.00 H ATOM 2081 N PHE C 119 -3.316 7.715 5.234 1.00 59.47 N ATOM 2082 CA PHE C 119 -2.020 8.436 5.168 1.00 59.12 C ATOM 2083 C PHE C 119 -2.024 9.407 3.983 1.00 58.97 C ATOM 2084 O PHE C 119 -1.431 10.492 4.040 1.00 58.22 O ATOM 2085 CB PHE C 119 -0.814 7.493 5.077 1.00 57.85 C ATOM 2086 CG PHE C 119 0.499 8.213 5.001 1.00 58.44 C ATOM 2087 CD1 PHE C 119 0.923 9.045 6.049 1.00 58.72 C ATOM 2088 CD2 PHE C 119 1.324 8.081 3.875 1.00 59.67 C ATOM 2089 CE1 PHE C 119 2.165 9.743 6.002 1.00 59.15 C ATOM 2090 CE2 PHE C 119 2.572 8.779 3.789 1.00 60.68 C ATOM 2091 CZ PHE C 119 2.994 9.620 4.873 1.00 61.28 C ATOM 2092 HA PHE C 119 -1.914 8.989 6.102 1.00 0.00 H ATOM 2093 HB2 PHE C 119 -0.807 6.854 5.960 1.00 0.00 H ATOM 2094 HB3 PHE C 119 -0.923 6.877 4.184 1.00 0.00 H ATOM 2095 HD2 PHE C 119 1.011 7.438 3.053 1.00 0.00 H ATOM 2096 HE2 PHE C 119 3.199 8.672 2.904 1.00 0.00 H ATOM 2097 HZ PHE C 119 3.942 10.155 4.822 1.00 0.00 H ATOM 2098 HE1 PHE C 119 2.471 10.370 6.839 1.00 0.00 H ATOM 2099 HD1 PHE C 119 0.284 9.161 6.924 1.00 0.00 H ATOM 2100 H PHE C 119 -3.316 6.675 5.243 1.00 0.00 H ATOM 2101 N GLN C 120 -2.720 8.983 2.929 1.00 59.42 N ATOM 2102 CA GLN C 120 -2.939 9.780 1.730 1.00 59.94 C ATOM 2103 C GLN C 120 -3.995 10.879 1.992 1.00 61.40 C ATOM 2104 O GLN C 120 -3.845 12.033 1.539 1.00 61.16 O ATOM 2105 CB GLN C 120 -3.298 8.858 0.538 1.00 59.68 C ATOM 2106 CG GLN C 120 -2.051 8.125 -0.063 1.00 55.30 C ATOM 2107 CD GLN C 120 -2.340 6.784 -0.725 1.00 49.98 C ATOM 2108 OE1 GLN C 120 -1.450 5.926 -0.795 1.00 49.07 O ATOM 2109 NE2 GLN C 120 -3.546 6.608 -1.249 1.00 47.38 N ATOM 2110 HA GLN C 120 -2.019 10.300 1.461 1.00 0.00 H ATOM 2111 HB2 GLN C 120 -4.011 8.108 0.880 1.00 0.00 H ATOM 2112 HB3 GLN C 120 -3.757 9.463 -0.244 1.00 0.00 H ATOM 2113 HG2 GLN C 120 -1.603 8.780 -0.810 1.00 0.00 H ATOM 2114 HG3 GLN C 120 -1.338 7.956 0.744 1.00 0.00 H ATOM 2115 HE22 GLN C 120 -4.263 7.357 -1.166 1.00 0.00 H ATOM 2116 HE21 GLN C 120 -3.774 5.721 -1.743 1.00 0.00 H ATOM 2117 H GLN C 120 -3.130 8.028 2.965 1.00 0.00 H ATOM 2118 N MET C 121 -5.035 10.530 2.754 1.00 62.39 N ATOM 2119 CA MET C 121 -6.019 11.516 3.200 1.00 63.58 C ATOM 2120 C MET C 121 -5.330 12.623 4.005 1.00 63.26 C ATOM 2121 O MET C 121 -5.510 13.814 3.741 1.00 63.41 O ATOM 2122 CB MET C 121 -7.087 10.835 4.038 1.00 64.40 C ATOM 2123 CG MET C 121 -8.497 11.349 3.801 1.00 67.87 C ATOM 2124 SD MET C 121 -9.732 10.207 4.486 1.00 75.89 S ATOM 2125 CE MET C 121 -9.200 8.605 3.838 1.00 74.34 C ATOM 2126 HA MET C 121 -6.492 11.968 2.328 1.00 0.00 H ATOM 2127 HB2 MET C 121 -7.070 9.769 3.811 1.00 0.00 H ATOM 2128 HB3 MET C 121 -6.842 10.985 5.089 1.00 0.00 H ATOM 2129 HG2 MET C 121 -8.663 11.452 2.729 1.00 0.00 H ATOM 2130 HG3 MET C 121 -8.607 12.322 4.280 1.00 0.00 H ATOM 2131 HE1 MET C 121 -9.211 8.633 2.748 1.00 0.00 H ATOM 2132 HE2 MET C 121 -8.190 8.391 4.187 1.00 0.00 H ATOM 2133 HE3 MET C 121 -9.879 7.828 4.190 1.00 0.00 H ATOM 2134 H MET C 121 -5.148 9.535 3.036 1.00 0.00 H ATOM 2135 N LEU C 122 -4.524 12.211 4.976 1.00 62.98 N ATOM 2136 CA LEU C 122 -3.663 13.109 5.740 1.00 62.93 C ATOM 2137 C LEU C 122 -2.767 14.036 4.886 1.00 63.55 C ATOM 2138 O LEU C 122 -2.617 15.226 5.203 1.00 63.31 O ATOM 2139 CB LEU C 122 -2.817 12.271 6.707 1.00 62.51 C ATOM 2140 CG LEU C 122 -1.729 12.942 7.530 1.00 62.06 C ATOM 2141 CD1 LEU C 122 -2.366 14.009 8.429 1.00 62.21 C ATOM 2142 CD2 LEU C 122 -0.962 11.903 8.327 1.00 61.27 C ATOM 2143 HA LEU C 122 -4.320 13.791 6.280 1.00 0.00 H ATOM 2144 HB2 LEU C 122 -3.507 11.808 7.412 1.00 0.00 H ATOM 2145 HB3 LEU C 122 -2.332 11.496 6.113 1.00 0.00 H ATOM 2146 HG LEU C 122 -1.011 13.436 6.876 1.00 0.00 H ATOM 2147 HD21 LEU C 122 -1.647 11.382 8.996 1.00 0.00 H ATOM 2148 HD22 LEU C 122 -0.504 11.188 7.644 1.00 0.00 H ATOM 2149 HD23 LEU C 122 -0.186 12.396 8.912 1.00 0.00 H ATOM 2150 HD11 LEU C 122 -2.868 14.752 7.809 1.00 0.00 H ATOM 2151 HD12 LEU C 122 -3.091 13.538 9.093 1.00 0.00 H ATOM 2152 HD13 LEU C 122 -1.590 14.493 9.022 1.00 0.00 H ATOM 2153 H LEU C 122 -4.505 11.197 5.204 1.00 0.00 H ATOM 2154 N LEU C 123 -2.161 13.492 3.825 1.00 64.52 N ATOM 2155 CA LEU C 123 -1.257 14.263 2.944 1.00 65.10 C ATOM 2156 C LEU C 123 -1.944 15.406 2.211 1.00 65.74 C ATOM 2157 O LEU C 123 -1.292 16.393 1.868 1.00 65.50 O ATOM 2158 CB LEU C 123 -0.559 13.352 1.946 1.00 65.03 C ATOM 2159 CG LEU C 123 0.783 12.725 2.344 1.00 65.50 C ATOM 2160 CD1 LEU C 123 0.960 12.593 3.839 1.00 66.35 C ATOM 2161 CD2 LEU C 123 0.924 11.360 1.680 1.00 65.06 C ATOM 2162 HA LEU C 123 -0.519 14.714 3.607 1.00 0.00 H ATOM 2163 HB2 LEU C 123 -1.244 12.534 1.723 1.00 0.00 H ATOM 2164 HB3 LEU C 123 -0.386 13.936 1.042 1.00 0.00 H ATOM 2165 HG LEU C 123 1.566 13.400 1.998 1.00 0.00 H ATOM 2166 HD21 LEU C 123 0.109 10.713 2.006 1.00 0.00 H ATOM 2167 HD22 LEU C 123 0.885 11.478 0.597 1.00 0.00 H ATOM 2168 HD23 LEU C 123 1.878 10.916 1.964 1.00 0.00 H ATOM 2169 HD11 LEU C 123 0.909 13.580 4.298 1.00 0.00 H ATOM 2170 HD12 LEU C 123 0.169 11.961 4.243 1.00 0.00 H ATOM 2171 HD13 LEU C 123 1.930 12.143 4.050 1.00 0.00 H ATOM 2172 H LEU C 123 -2.332 12.489 3.611 1.00 0.00 H ATOM 2173 N THR C 124 -3.251 15.242 1.982 1.00 66.79 N ATOM 2174 CA THR C 124 -4.163 16.265 1.432 1.00 68.26 C ATOM 2175 C THR C 124 -4.218 17.591 2.221 1.00 69.25 C ATOM 2176 O THR C 124 -4.486 18.649 1.638 1.00 69.30 O ATOM 2177 CB THR C 124 -5.617 15.715 1.376 1.00 68.02 C ATOM 2178 OG1 THR C 124 -5.653 14.520 0.597 1.00 68.24 O ATOM 2179 CG2 THR C 124 -6.613 16.735 0.795 1.00 69.70 C ATOM 2180 HA THR C 124 -3.753 16.483 0.446 1.00 0.00 H ATOM 2181 HB THR C 124 -5.921 15.508 2.402 1.00 0.00 H ATOM 2182 HG1 THR C 124 -5.062 13.841 1.009 1.00 0.00 H ATOM 2183 HG23 THR C 124 -6.585 17.648 1.390 1.00 0.00 H ATOM 2184 HG21 THR C 124 -6.338 16.963 -0.235 1.00 0.00 H ATOM 2185 HG22 THR C 124 -7.618 16.314 0.820 1.00 0.00 H ATOM 2186 H THR C 124 -3.661 14.314 2.211 1.00 0.00 H ATOM 2187 N LYS C 125 -4.006 17.531 3.544 1.00 70.35 N ATOM 2188 CA LYS C 125 -4.265 18.692 4.412 1.00 70.79 C ATOM 2189 C LYS C 125 -3.289 18.825 5.562 1.00 70.88 C ATOM 2190 O LYS C 125 -2.340 19.598 5.472 1.00 71.32 O ATOM 2191 CB LYS C 125 -5.717 18.697 4.913 1.00 71.00 C ATOM 2192 CG LYS C 125 -6.388 17.313 4.962 1.00 72.07 C ATOM 2193 CD LYS C 125 -7.875 17.415 5.284 1.00 72.77 C ATOM 2194 CE LYS C 125 -8.456 16.050 5.576 1.00 73.72 C ATOM 2195 NZ LYS C 125 -9.332 16.120 6.784 1.00 75.08 N ATOM 2196 HA LYS C 125 -4.108 19.571 3.787 1.00 0.00 H ATOM 2197 HB2 LYS C 125 -5.727 19.115 5.920 1.00 0.00 H ATOM 2198 HB3 LYS C 125 -6.302 19.335 4.250 1.00 0.00 H ATOM 2199 HG2 LYS C 125 -6.269 16.829 3.993 1.00 0.00 H ATOM 2200 HG3 LYS C 125 -5.901 16.712 5.730 1.00 0.00 H ATOM 2201 HD2 LYS C 125 -8.009 18.055 6.156 1.00 0.00 H ATOM 2202 HD3 LYS C 125 -8.396 17.851 4.432 1.00 0.00 H ATOM 2203 HE2 LYS C 125 -7.646 15.343 5.756 1.00 0.00 H ATOM 2204 HE3 LYS C 125 -9.044 15.716 4.721 1.00 0.00 H ATOM 2205 HZ1 LYS C 125 -8.770 16.437 7.600 1.00 0.00 H ATOM 2206 HZ2 LYS C 125 -10.105 16.794 6.611 1.00 0.00 H ATOM 2207 HZ3 LYS C 125 -9.728 15.178 6.979 1.00 0.00 H ATOM 2208 H LYS C 125 -3.652 16.648 3.965 1.00 0.00 H TER 2209 LYS C 125 HETATM 2210 O HOH 1 -2.629 20.979 26.245 1.00 17.68 O HETATM 2211 O HOH 2 -17.560 22.779 19.998 1.00 44.13 O HETATM 2212 O HOH 3 -20.014 33.925 30.375 1.00 37.24 O HETATM 2213 O HOH 4 3.021 30.061 29.770 1.00 31.45 O HETATM 2214 O HOH 5 -1.992 34.287 30.889 1.00 34.70 O HETATM 2215 O HOH 6 8.501 19.816 17.663 1.00 48.34 O HETATM 2216 O HOH 7 -13.462 21.059 22.000 1.00 54.17 O HETATM 2217 O HOH 8 -17.981 40.880 31.886 1.00 42.36 O HETATM 2218 O HOH 9 7.465 33.176 13.057 1.00 47.51 O HETATM 2219 O HOH 10 -19.256 36.403 29.921 1.00 22.53 O HETATM 2220 O HOH 11 -14.366 36.896 18.615 1.00 44.96 O HETATM 2221 O HOH 12 -4.609 24.819 11.765 1.00 36.49 O HETATM 2222 O HOH 13 -8.435 23.550 25.505 1.00 38.20 O HETATM 2223 O HOH 14 -7.284 23.199 27.680 1.00 41.84 O HETATM 2224 O HOH 15 -18.556 36.648 27.334 1.00 17.94 O HETATM 2225 O HOH 16 -10.031 19.551 16.290 1.00 42.38 O HETATM 2226 O HOH 17 10.046 19.037 7.422 1.00 47.71 O HETATM 2227 O HOH 18 13.474 29.995 29.193 1.00 41.52 O HETATM 2228 O HOH 19 -1.085 2.837 19.893 1.00 48.84 O HETATM 2229 O HOH 20 4.687 21.504 11.435 1.00 43.79 O HETATM 2230 O HOH 21 0.291 17.215 32.066 1.00 45.00 O HETATM 2231 O HOH 22 1.894 24.798 12.096 1.00 42.33 O HETATM 2232 O HOH 23 -4.492 21.642 11.454 1.00 33.64 O HETATM 2233 N GLY A 24 -10.957 37.230 8.518 1.00 0.24 N HETATM 2234 CA GLY A 24 -10.413 36.825 9.868 1.00 0.05 C HETATM 2235 C GLY A 24 -9.001 37.333 10.117 1.00 0.22 C HETATM 2236 O GLY A 24 -8.219 37.457 9.167 1.00 -0.39 O HETATM 2237 N GLY A 24 -8.651 37.617 11.377 1.00 -0.26 N HETATM 2238 CA GLY A 24 -7.321 38.148 11.682 1.00 0.14 C HETATM 2239 C GLY A 24 -7.329 39.176 12.820 1.00 0.20 C HETATM 2240 O GLY A 24 -6.367 39.284 13.565 1.00 -0.39 O HETATM 2241 N GLY A 24 -8.407 39.941 12.956 1.00 -0.26 N HETATM 2242 CA GLY A 24 -8.466 40.981 13.999 1.00 0.13 C HETATM 2243 C GLY A 24 -8.212 40.437 15.412 1.00 0.20 C HETATM 2244 O GLY A 24 -7.608 41.104 16.242 1.00 -0.39 O HETATM 2245 N GLY A 24 -8.713 39.231 15.682 1.00 -0.26 N HETATM 2246 CA GLY A 24 -8.426 38.511 16.933 1.00 0.13 C HETATM 2247 C GLY A 24 -6.935 38.266 17.162 1.00 0.20 C HETATM 2248 O GLY A 24 -6.461 38.549 18.246 1.00 -0.39 O HETATM 2249 N GLY A 24 -6.199 37.795 16.169 1.00 -0.26 N HETATM 2250 CA GLY A 24 -4.741 37.622 16.335 1.00 0.14 C HETATM 2251 C GLY A 24 -4.013 38.919 16.724 1.00 0.20 C HETATM 2252 O GLY A 24 -3.094 38.884 17.549 1.00 -0.39 O HETATM 2253 N GLY A 24 -4.453 40.018 16.098 1.00 -0.26 N HETATM 2254 CA GLY A 24 -3.884 41.396 16.195 1.00 0.13 C HETATM 2255 C GLY A 24 -4.146 41.865 17.614 1.00 0.20 C HETATM 2256 O GLY A 24 -3.262 42.362 18.336 1.00 -0.39 O HETATM 2257 N GLY A 24 -5.393 41.673 18.025 1.00 -0.26 N HETATM 2258 CA GLY A 24 -5.772 42.025 19.361 1.00 0.13 C HETATM 2259 C GLY A 24 -4.960 41.266 20.406 1.00 0.20 C HETATM 2260 O GLY A 24 -4.519 41.857 21.417 1.00 -0.39 O HETATM 2261 N GLY A 24 -4.742 39.971 20.166 1.00 -0.26 N HETATM 2262 CA GLY A 24 -3.934 39.162 21.099 1.00 0.13 C HETATM 2263 C GLY A 24 -2.477 39.634 21.212 1.00 0.20 C HETATM 2264 O GLY A 24 -1.949 39.669 22.319 1.00 -0.39 O HETATM 2265 N GLY A 24 -1.842 40.020 20.093 1.00 -0.26 N HETATM 2266 CA GLY A 24 -0.427 40.521 20.155 1.00 0.15 C HETATM 2267 C GLY A 24 -0.237 41.762 20.960 1.00 0.21 C HETATM 2268 O GLY A 24 0.802 41.952 21.557 1.00 -0.39 O HETATM 2269 N GLY A 24 -1.208 42.665 20.862 1.00 -0.26 N HETATM 2270 CA GLY A 24 -1.139 43.989 21.490 1.00 0.14 C HETATM 2271 C GLY A 24 -0.978 43.894 23.022 1.00 0.21 C HETATM 2272 O GLY A 24 -1.886 43.461 23.700 1.00 -0.39 O HETATM 2273 N GLY A 24 0.213 44.233 23.531 1.00 -0.27 N HETATM 2274 CA GLY A 24 0.635 43.952 24.951 1.00 0.09 C HETATM 2275 C GLY A 24 2.085 44.335 25.337 1.00 0.06 C HETATM 2276 O GLY A 24 2.616 43.911 26.418 1.00 -0.57 O HETATM 2277 O1 GLY A 24 2.753 45.079 24.570 1.00 -0.57 O HETATM 2278 CB GLY A 24 0.326 42.421 25.383 1.00 -0.03 C HETATM 2279 H GLY A 24 -0.744 42.230 25.301 1.00 0.03 H HETATM 2280 H GLY A 24 0.869 41.742 24.725 1.00 0.03 H HETATM 2281 H GLY A 24 0.646 42.264 26.413 1.00 0.03 H HETATM 2282 H GLY A 24 0.010 44.638 25.523 1.00 0.07 H HETATM 2283 H GLY A 24 0.876 44.711 22.921 1.00 0.19 H HETATM 2284 CB GLY A 24 -2.369 44.797 21.092 1.00 0.02 C HETATM 2285 CG GLY A 24 -2.443 46.154 21.757 1.00 -0.05 C HETATM 2286 CD1 GLY A 24 -1.405 47.082 21.628 1.00 -0.07 C HETATM 2287 CE1 GLY A 24 -1.452 48.338 22.239 1.00 -0.04 C HETATM 2288 CZ GLY A 24 -2.559 48.671 22.964 1.00 0.08 C HETATM 2289 CE2 GLY A 24 -3.623 47.762 23.096 1.00 -0.04 C HETATM 2290 CD2 GLY A 24 -3.548 46.506 22.521 1.00 -0.07 C HETATM 2291 H GLY A 24 -4.358 45.791 22.668 1.00 0.05 H HETATM 2292 H GLY A 24 -4.513 48.049 23.655 1.00 0.05 H HETATM 2293 OH GLY A 24 -2.645 49.892 23.579 1.00 -0.34 O HETATM 2294 H GLY A 24 -1.849 50.397 23.398 1.00 0.25 H HETATM 2295 H GLY A 24 -0.622 49.037 22.139 1.00 0.05 H HETATM 2296 H GLY A 24 -0.532 46.817 21.032 1.00 0.05 H HETATM 2297 H GLY A 24 -3.247 44.231 21.404 1.00 0.05 H HETATM 2298 H GLY A 24 -2.317 44.963 20.016 1.00 0.05 H HETATM 2299 H GLY A 24 -0.249 44.505 21.130 1.00 0.08 H HETATM 2300 H GLY A 24 -2.041 42.426 20.324 1.00 0.19 H HETATM 2301 CB GLY A 24 0.099 40.867 18.767 1.00 0.08 C HETATM 2302 OG GLY A 24 -0.299 39.844 17.903 1.00 -0.39 O HETATM 2303 H GLY A 24 -1.257 39.788 17.896 1.00 0.21 H HETATM 2304 H GLY A 24 1.185 40.955 18.781 1.00 0.06 H HETATM 2305 H GLY A 24 -0.301 41.825 18.435 1.00 0.06 H HETATM 2306 H GLY A 24 0.107 39.695 20.624 1.00 0.08 H HETATM 2307 H GLY A 24 -2.324 39.973 19.195 1.00 0.19 H HETATM 2308 CB GLY A 24 -4.017 37.650 20.779 1.00 -0.01 C HETATM 2309 CG GLY A 24 -5.420 37.074 20.975 1.00 -0.04 C HETATM 2310 CD1 GLY A 24 -5.519 35.662 20.453 1.00 -0.06 C HETATM 2311 H GLY A 24 -5.288 35.653 19.388 1.00 0.02 H HETATM 2312 H GLY A 24 -4.809 35.029 20.985 1.00 0.02 H HETATM 2313 H GLY A 24 -6.531 35.288 20.610 1.00 0.02 H HETATM 2314 CD2 GLY A 24 -5.823 37.106 22.431 1.00 -0.06 C HETATM 2315 H GLY A 24 -5.118 36.514 23.015 1.00 0.02 H HETATM 2316 H GLY A 24 -5.816 38.136 22.786 1.00 0.02 H HETATM 2317 H GLY A 24 -6.825 36.690 22.539 1.00 0.02 H HETATM 2318 H GLY A 24 -6.103 37.702 20.404 1.00 0.03 H HETATM 2319 H GLY A 24 -3.346 37.129 21.462 1.00 0.03 H HETATM 2320 H GLY A 24 -3.747 37.517 19.732 1.00 0.03 H HETATM 2321 H GLY A 24 -4.380 39.318 22.081 1.00 0.08 H HETATM 2322 H GLY A 24 -5.137 39.537 19.331 1.00 0.19 H HETATM 2323 CB GLY A 24 -7.244 41.772 19.539 1.00 -0.01 C HETATM 2324 CG GLY A 24 -7.819 41.939 20.918 1.00 -0.04 C HETATM 2325 CD1 GLY A 24 -7.552 43.352 21.455 1.00 -0.06 C HETATM 2326 H GLY A 24 -6.477 43.525 21.500 1.00 0.02 H HETATM 2327 H GLY A 24 -8.012 44.084 20.792 1.00 0.02 H HETATM 2328 H GLY A 24 -7.978 43.446 22.454 1.00 0.02 H HETATM 2329 CD2 GLY A 24 -9.296 41.653 20.743 1.00 -0.06 C HETATM 2330 H GLY A 24 -9.721 42.363 20.034 1.00 0.02 H HETATM 2331 H GLY A 24 -9.426 40.639 20.366 1.00 0.02 H HETATM 2332 H GLY A 24 -9.800 41.752 21.704 1.00 0.02 H HETATM 2333 H GLY A 24 -7.369 41.272 21.653 1.00 0.03 H HETATM 2334 H GLY A 24 -7.393 40.722 19.286 1.00 0.03 H HETATM 2335 H GLY A 24 -7.745 42.517 18.921 1.00 0.03 H HETATM 2336 H GLY A 24 -5.561 43.084 19.511 1.00 0.08 H HETATM 2337 H GLY A 24 -6.083 41.274 17.389 1.00 0.19 H HETATM 2338 CB GLY A 24 -4.677 42.326 15.247 1.00 -0.01 C HETATM 2339 CG GLY A 24 -3.935 43.184 14.227 1.00 -0.02 C HETATM 2340 CD GLY A 24 -3.970 42.602 12.769 1.00 0.06 C HETATM 2341 NE GLY A 24 -5.307 42.710 12.152 1.00 -0.27 N HETATM 2342 CZ GLY A 24 -5.689 42.151 10.994 1.00 0.29 C HETATM 2343 NH1 GLY A 24 -4.838 41.414 10.276 1.00 -0.28 N HETATM 2344 H GLY A 24 -3.884 41.270 10.606 1.00 0.26 H HETATM 2345 H GLY A 24 -5.142 40.995 9.397 1.00 0.26 H HETATM 2346 NH2 GLY A 24 -6.940 42.329 10.555 1.00 -0.28 N HETATM 2347 H GLY A 24 -7.597 42.887 11.100 1.00 0.26 H HETATM 2348 H GLY A 24 -7.237 41.907 9.675 1.00 0.26 H HETATM 2349 H GLY A 24 -6.005 43.261 12.653 1.00 0.26 H HETATM 2350 H GLY A 24 -3.707 41.545 12.821 1.00 0.07 H HETATM 2351 H GLY A 24 -3.270 43.175 12.160 1.00 0.07 H HETATM 2352 H GLY A 24 -2.891 43.228 14.536 1.00 0.03 H HETATM 2353 H GLY A 24 -4.425 44.157 14.201 1.00 0.03 H HETATM 2354 H GLY A 24 -5.159 43.045 15.910 1.00 0.03 H HETATM 2355 H GLY A 24 -5.284 41.650 14.645 1.00 0.03 H HETATM 2356 H GLY A 24 -2.825 41.408 15.939 1.00 0.08 H HETATM 2357 H GLY A 24 -5.263 39.902 15.490 1.00 0.19 H HETATM 2358 CB GLY A 24 -4.089 37.080 15.068 1.00 0.04 C HETATM 2359 SG GLY A 24 -4.782 35.474 14.462 1.00 -0.09 S HETATM 2360 SG GLY A 24 -6.512 36.175 13.566 1.00 -0.09 S HETATM 2361 CB GLY A 24 -6.304 37.011 11.954 1.00 0.04 C HETATM 2362 H GLY A 24 -5.313 37.464 11.956 1.00 0.04 H HETATM 2363 H GLY A 24 -6.456 36.257 11.182 1.00 0.04 H HETATM 2364 H GLY A 24 -3.040 36.902 15.304 1.00 0.04 H HETATM 2365 H GLY A 24 -4.264 37.816 14.283 1.00 0.04 H HETATM 2366 H GLY A 24 -4.640 36.907 17.151 1.00 0.08 H HETATM 2367 H GLY A 24 -6.641 37.550 15.283 1.00 0.19 H HETATM 2368 CB GLY A 24 -9.229 37.206 17.041 1.00 -0.01 C HETATM 2369 CG GLY A 24 -9.257 36.551 18.414 1.00 -0.04 C HETATM 2370 CD1 GLY A 24 -9.326 37.550 19.621 1.00 -0.06 C HETATM 2371 H GLY A 24 -8.453 38.202 19.602 1.00 0.02 H HETATM 2372 H GLY A 24 -10.232 38.152 19.542 1.00 0.02 H HETATM 2373 H GLY A 24 -9.342 36.989 20.555 1.00 0.02 H HETATM 2374 CD2 GLY A 24 -10.430 35.493 18.469 1.00 -0.06 C HETATM 2375 H GLY A 24 -11.380 35.996 18.286 1.00 0.02 H HETATM 2376 H GLY A 24 -10.267 34.732 17.706 1.00 0.02 H HETATM 2377 H GLY A 24 -10.449 35.024 19.453 1.00 0.02 H HETATM 2378 H GLY A 24 -8.296 36.052 18.537 1.00 0.03 H HETATM 2379 H GLY A 24 -8.746 36.494 16.372 1.00 0.03 H HETATM 2380 H GLY A 24 -10.261 37.462 16.803 1.00 0.03 H HETATM 2381 H GLY A 24 -8.754 39.173 17.734 1.00 0.08 H HETATM 2382 H GLY A 24 -9.321 38.789 14.992 1.00 0.19 H HETATM 2383 CB GLY A 24 -9.810 41.726 13.908 1.00 -0.01 C HETATM 2384 CG GLY A 24 -10.494 41.943 15.223 1.00 -0.02 C HETATM 2385 CD GLY A 24 -12.014 41.606 15.141 1.00 0.06 C HETATM 2386 NE GLY A 24 -12.694 41.597 16.454 1.00 -0.27 N HETATM 2387 CZ GLY A 24 -12.449 42.447 17.469 1.00 0.29 C HETATM 2388 NH1 GLY A 24 -11.541 43.426 17.350 1.00 -0.28 N HETATM 2389 H GLY A 24 -11.022 43.537 16.479 1.00 0.26 H HETATM 2390 H GLY A 24 -11.370 44.060 18.130 1.00 0.26 H HETATM 2391 NH2 GLY A 24 -13.134 42.338 18.607 1.00 -0.28 N HETATM 2392 H GLY A 24 -13.843 41.611 18.708 1.00 0.26 H HETATM 2393 H GLY A 24 -12.950 42.981 19.377 1.00 0.26 H HETATM 2394 H GLY A 24 -13.410 40.886 16.604 1.00 0.26 H HETATM 2395 H GLY A 24 -12.103 40.604 14.722 1.00 0.07 H HETATM 2396 H GLY A 24 -12.486 42.379 14.535 1.00 0.07 H HETATM 2397 H GLY A 24 -10.388 42.992 15.498 1.00 0.03 H HETATM 2398 H GLY A 24 -10.035 41.287 15.963 1.00 0.03 H HETATM 2399 H GLY A 24 -10.474 41.110 13.302 1.00 0.03 H HETATM 2400 H GLY A 24 -9.600 42.712 13.493 1.00 0.03 H HETATM 2401 H GLY A 24 -7.653 41.682 13.812 1.00 0.08 H HETATM 2402 H GLY A 24 -9.203 39.807 12.332 1.00 0.19 H HETATM 2403 H GLY A 24 -6.997 38.684 10.790 1.00 0.08 H HETATM 2404 H GLY A 24 -9.318 37.462 12.133 1.00 0.19 H HETATM 2405 H GLY A 24 -10.385 35.736 9.901 1.00 0.11 H HETATM 2406 H GLY A 24 -11.061 37.258 10.630 1.00 0.11 H HETATM 2407 H GLY A 24 -11.902 36.862 8.409 1.00 0.20 H HETATM 2408 H GLY A 24 -10.977 38.248 8.452 1.00 0.20 H HETATM 2409 H GLY A 24 -10.357 36.853 7.784 1.00 0.20 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 1092 1093 1098 1099 1100 CONECT 1098 1092 CONECT 1099 1092 CONECT 1100 1092 CONECT 2233 2234 2407 2408 2409 CONECT 2234 2233 2235 2405 2406 CONECT 2235 2234 2236 2237 CONECT 2236 2235 CONECT 2237 2235 2238 2404 CONECT 2238 2237 2239 2361 2403 CONECT 2239 2238 2240 2241 CONECT 2240 2239 CONECT 2241 2239 2242 2402 CONECT 2242 2241 2243 2383 2401 CONECT 2243 2242 2244 2245 CONECT 2244 2243 CONECT 2245 2243 2246 2382 CONECT 2246 2245 2247 2368 2381 CONECT 2247 2246 2248 2249 CONECT 2248 2247 CONECT 2249 2247 2250 2367 CONECT 2250 2249 2251 2358 2366 CONECT 2251 2250 2252 2253 CONECT 2252 2251 CONECT 2253 2251 2254 2357 CONECT 2254 2253 2255 2338 2356 CONECT 2255 2254 2256 2257 CONECT 2256 2255 CONECT 2257 2255 2258 2337 CONECT 2258 2257 2259 2323 2336 CONECT 2259 2258 2260 2261 CONECT 2260 2259 CONECT 2261 2259 2262 2322 CONECT 2262 2261 2263 2308 2321 CONECT 2263 2262 2264 2265 CONECT 2264 2263 CONECT 2265 2263 2266 2307 CONECT 2266 2265 2267 2301 2306 CONECT 2267 2266 2268 2269 CONECT 2268 2267 CONECT 2269 2267 2270 2300 CONECT 2270 2269 2271 2284 2299 CONECT 2271 2270 2272 2273 CONECT 2272 2271 CONECT 2273 2271 2274 2283 CONECT 2274 2273 2275 2278 2282 CONECT 2275 2274 2276 2277 CONECT 2276 2275 CONECT 2277 2275 CONECT 2278 2274 2279 2280 2281 CONECT 2279 2278 CONECT 2280 2278 CONECT 2281 2278 CONECT 2282 2274 CONECT 2283 2273 CONECT 2284 2270 2285 2297 2298 CONECT 2285 2284 2286 2290 CONECT 2286 2285 2287 2296 CONECT 2287 2286 2288 2295 CONECT 2288 2287 2289 2293 CONECT 2289 2288 2290 2292 CONECT 2290 2285 2289 2291 CONECT 2291 2290 CONECT 2292 2289 CONECT 2293 2288 2294 CONECT 2294 2293 CONECT 2295 2287 CONECT 2296 2286 CONECT 2297 2284 CONECT 2298 2284 CONECT 2299 2270 CONECT 2300 2269 CONECT 2301 2266 2302 2304 2305 CONECT 2302 2301 2303 CONECT 2303 2302 CONECT 2304 2301 CONECT 2305 2301 CONECT 2306 2266 CONECT 2307 2265 CONECT 2308 2262 2309 2319 2320 CONECT 2309 2308 2310 2314 2318 CONECT 2310 2309 2311 2312 2313 CONECT 2311 2310 CONECT 2312 2310 CONECT 2313 2310 CONECT 2314 2309 2315 2316 2317 CONECT 2315 2314 CONECT 2316 2314 CONECT 2317 2314 CONECT 2318 2309 CONECT 2319 2308 CONECT 2320 2308 CONECT 2321 2262 CONECT 2322 2261 CONECT 2323 2258 2324 2334 2335 CONECT 2324 2323 2325 2329 2333 CONECT 2325 2324 2326 2327 2328 CONECT 2326 2325 CONECT 2327 2325 CONECT 2328 2325 CONECT 2329 2324 2330 2331 2332 CONECT 2330 2329 CONECT 2331 2329 CONECT 2332 2329 CONECT 2333 2324 CONECT 2334 2323 CONECT 2335 2323 CONECT 2336 2258 CONECT 2337 2257 CONECT 2338 2254 2339 2354 2355 CONECT 2339 2338 2340 2352 2353 CONECT 2340 2339 2341 2350 2351 CONECT 2341 2340 2342 2349 CONECT 2342 2341 2343 2346 CONECT 2343 2342 2344 2345 CONECT 2344 2343 CONECT 2345 2343 CONECT 2346 2342 2347 2348 CONECT 2347 2346 CONECT 2348 2346 CONECT 2349 2341 CONECT 2350 2340 CONECT 2351 2340 CONECT 2352 2339 CONECT 2353 2339 CONECT 2354 2338 CONECT 2355 2338 CONECT 2356 2254 CONECT 2357 2253 CONECT 2358 2250 2359 2364 2365 CONECT 2359 2358 2360 CONECT 2360 2359 2361 CONECT 2361 2238 2360 2362 2363 CONECT 2362 2361 CONECT 2363 2361 CONECT 2364 2358 CONECT 2365 2358 CONECT 2366 2250 CONECT 2367 2249 CONECT 2368 2246 2369 2379 2380 CONECT 2369 2368 2370 2374 2378 CONECT 2370 2369 2371 2372 2373 CONECT 2371 2370 CONECT 2372 2370 CONECT 2373 2370 CONECT 2374 2369 2375 2376 2377 CONECT 2375 2374 CONECT 2376 2374 CONECT 2377 2374 CONECT 2378 2369 CONECT 2379 2368 CONECT 2380 2368 CONECT 2381 2246 CONECT 2382 2245 CONECT 2383 2242 2384 2399 2400 CONECT 2384 2383 2385 2397 2398 CONECT 2385 2384 2386 2395 2396 CONECT 2386 2385 2387 2394 CONECT 2387 2386 2388 2391 CONECT 2388 2387 2389 2390 CONECT 2389 2388 CONECT 2390 2388 CONECT 2391 2387 2392 2393 CONECT 2392 2391 CONECT 2393 2391 CONECT 2394 2386 CONECT 2395 2385 CONECT 2396 2385 CONECT 2397 2384 CONECT 2398 2384 CONECT 2399 2383 CONECT 2400 2383 CONECT 2401 2242 CONECT 2402 2241 CONECT 2403 2238 CONECT 2404 2237 CONECT 2405 2234 CONECT 2406 2234 CONECT 2407 2233 CONECT 2408 2233 CONECT 2409 2233 MASTER 0 0 0 0 0 0 0 0 2407 2 185 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: 3ax5
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
1avp
RCSB PDB
PDBbind
11-mer
1bbz
RCSB PDB
PDBbind
11-mer
1c5f
RCSB PDB
PDBbind
11-mer
1cwb
RCSB PDB
PDBbind
11-mer
1cwc
RCSB PDB
PDBbind
11-mer
1cyn
RCSB PDB
PDBbind
11-mer
1d4t
RCSB PDB
PDBbind
11-mer
1d4w
RCSB PDB
PDBbind
11-mer
1d8e
RCSB PDB
PDBbind
11-mer
1ddm
RCSB PDB
PDBbind
11-mer
1ff1
RCSB PDB
PDBbind
11-mer
1h25
RCSB PDB
PDBbind
11-mer
1h26
RCSB PDB
PDBbind
11-mer
1h27
RCSB PDB
PDBbind
11-mer
1h28
RCSB PDB
PDBbind
11-mer
1h3h
RCSB PDB
PDBbind
11-mer
1h6e
RCSB PDB
PDBbind
11-mer
1iq1
RCSB PDB
PDBbind
11-mer
1irs
RCSB PDB
PDBbind
11-mer
1jm4
RCSB PDB
PDBbind
11-mer
1l2z
RCSB PDB
PDBbind
11-mer
1lcj
RCSB PDB
PDBbind
11-mer
1mik
RCSB PDB
PDBbind
11-mer
1om2
RCSB PDB
PDBbind
11-mer
1ox9
RCSB PDB
PDBbind
11-mer
1qng
RCSB PDB
PDBbind
11-mer
1qnh
RCSB PDB
PDBbind
11-mer
1s9v
RCSB PDB
PDBbind
11-mer
1sps
RCSB PDB
PDBbind
11-mer
1ths
RCSB PDB
PDBbind
11-mer
1uj0
RCSB PDB
PDBbind
11-mer
1ukh
RCSB PDB
PDBbind
11-mer
1xn2
RCSB PDB
PDBbind
11-mer
1zh7
RCSB PDB
PDBbind
11-mer
1zub
RCSB PDB
PDBbind
11-mer
2aof
RCSB PDB
PDBbind
11-mer
2aoi
RCSB PDB
PDBbind
11-mer
2bj4
RCSB PDB
PDBbind
11-mer
2bz8
RCSB PDB
PDBbind
11-mer
2cia
RCSB PDB
PDBbind
11-mer
2cv3
RCSB PDB
PDBbind
11-mer
2eh8
RCSB PDB
PDBbind
11-mer
2ez5
RCSB PDB
PDBbind
11-mer
2h2g
RCSB PDB
PDBbind
11-mer
2h2h
RCSB PDB
PDBbind
11-mer
2h9m
RCSB PDB
PDBbind
11-mer
2h9n
RCSB PDB
PDBbind
11-mer
2h9p
RCSB PDB
PDBbind
11-mer
2hdx
RCSB PDB
PDBbind
11-mer
2hmh
RCSB PDB
PDBbind
11-mer
2jdl
RCSB PDB
PDBbind
11-mer
2jkr
RCSB PDB
PDBbind
11-mer
2jkt
RCSB PDB
PDBbind
11-mer
2kpl
RCSB PDB
PDBbind
11-mer
2ks9
RCSB PDB
PDBbind
11-mer
2ksa
RCSB PDB
PDBbind
11-mer
2ksb
RCSB PDB
PDBbind
11-mer
2l3r
RCSB PDB
PDBbind
11-mer
2m0o
RCSB PDB
PDBbind
11-mer
2m3m
RCSB PDB
PDBbind
11-mer
2m3o
RCSB PDB
PDBbind
11-mer
2o9k
RCSB PDB
PDBbind
11-mer
2or9
RCSB PDB
PDBbind
11-mer
2qhr
RCSB PDB
PDBbind
11-mer
2r02
RCSB PDB
PDBbind
11-mer
2r05
RCSB PDB
PDBbind
11-mer
2w9r
RCSB PDB
PDBbind
11-mer
2wfj
RCSB PDB
PDBbind
11-mer
2x2c
RCSB PDB
PDBbind
11-mer
2z6w
RCSB PDB
PDBbind
11-mer
3asl
RCSB PDB
PDBbind
11-mer
3dpo
RCSB PDB
PDBbind
11-mer
3e8u
RCSB PDB
PDBbind
11-mer
3eov
RCSB PDB
PDBbind
11-mer
3eyf
RCSB PDB
PDBbind
11-mer
3gxz
RCSB PDB
PDBbind
11-mer
3i90
RCSB PDB
PDBbind
11-mer
3iiw
RCSB PDB
PDBbind
11-mer
3iiy
RCSB PDB
PDBbind
11-mer
3ij0
RCSB PDB
PDBbind
11-mer
3ij1
RCSB PDB
PDBbind
11-mer
3lgl
RCSB PDB
PDBbind
11-mer
3ll8
RCSB PDB
PDBbind
11-mer
3m53
RCSB PDB
PDBbind
11-mer
3m54
RCSB PDB
PDBbind
11-mer
3m55
RCSB PDB
PDBbind
11-mer
3m56
RCSB PDB
PDBbind
11-mer
3m57
RCSB PDB
PDBbind
11-mer
3m58
RCSB PDB
PDBbind
11-mer
3m59
RCSB PDB
PDBbind
11-mer
3m5a
RCSB PDB
PDBbind
11-mer
3me9
RCSB PDB
PDBbind
11-mer
3mea
RCSB PDB
PDBbind
11-mer
3met
RCSB PDB
PDBbind
11-mer
3oap
RCSB PDB
PDBbind
11-mer
3odi
RCSB PDB
PDBbind
11-mer
3odl
RCSB PDB
PDBbind
11-mer
3p4f
RCSB PDB
PDBbind
11-mer
3p9h
RCSB PDB
PDBbind
11-mer
3pqz
RCSB PDB
PDBbind
11-mer
3qzv
RCSB PDB
PDBbind
11-mer
3rbq
RCSB PDB
PDBbind
11-mer
3rl7
RCSB PDB
PDBbind
11-mer
3rl8
RCSB PDB
PDBbind
11-mer
3rwd
RCSB PDB
PDBbind
11-mer
3tg5
RCSB PDB
PDBbind
11-mer
3u0t
RCSB PDB
PDBbind
11-mer
3uvk
RCSB PDB
PDBbind
11-mer
3uvl
RCSB PDB
PDBbind
11-mer
3uvn
RCSB PDB
PDBbind
11-mer
3uvo
RCSB PDB
PDBbind
11-mer
3uvx
RCSB PDB
PDBbind
11-mer
3uw9
RCSB PDB
PDBbind
11-mer
3v2x
RCSB PDB
PDBbind
11-mer
3va4
RCSB PDB
PDBbind
11-mer
3zke
RCSB PDB
PDBbind
11-mer
3zkf
RCSB PDB
PDBbind
11-mer
4aa2
RCSB PDB
PDBbind
11-mer
4b8o
RCSB PDB
PDBbind
11-mer
4bd3
RCSB PDB
PDBbind
11-mer
4ds1
RCSB PDB
PDBbind
11-mer
4e9c
RCSB PDB
PDBbind
11-mer
4fgy
RCSB PDB
PDBbind
11-mer
4g69
RCSB PDB
PDBbind
11-mer
4ht6
RCSB PDB
PDBbind
11-mer
4htp
RCSB PDB
PDBbind
11-mer
4hyb
RCSB PDB
PDBbind
11-mer
4j7i
RCSB PDB
PDBbind
11-mer
4j8g
RCSB PDB
PDBbind
11-mer
4jjm
RCSB PDB
PDBbind
11-mer
4ln2
RCSB PDB
PDBbind
11-mer
4n7g
RCSB PDB
PDBbind
11-mer
4n7y
RCSB PDB
PDBbind
11-mer
4o3t
RCSB PDB
PDBbind
11-mer
4o62
RCSB PDB
PDBbind
11-mer
4pl6
RCSB PDB
PDBbind
11-mer
4pli
RCSB PDB
PDBbind
11-mer
4pr5
RCSB PDB
PDBbind
11-mer
4pra
RCSB PDB
PDBbind
11-mer
4prb
RCSB PDB
PDBbind
11-mer
4prd
RCSB PDB
PDBbind
11-mer
4pre
RCSB PDB
PDBbind
11-mer
4prh
RCSB PDB
PDBbind
11-mer
4pri
RCSB PDB
PDBbind
11-mer
4prn
RCSB PDB
PDBbind
11-mer
4prp
RCSB PDB
PDBbind
11-mer
4pxf
RCSB PDB
PDBbind
11-mer
4qc1
RCSB PDB
PDBbind
11-mer
4qyo
RCSB PDB
PDBbind
11-mer
4tk1
RCSB PDB
PDBbind
11-mer
4tk2
RCSB PDB
PDBbind
11-mer
4tk3
RCSB PDB
PDBbind
11-mer
4tk4
RCSB PDB
PDBbind
11-mer
4tmp
RCSB PDB
PDBbind
11-mer
4u68
RCSB PDB
PDBbind
11-mer
4u91
RCSB PDB
PDBbind
11-mer
4w5a
RCSB PDB
PDBbind
11-mer
4wph
RCSB PDB
PDBbind
11-mer
4x6s
RCSB PDB
PDBbind
11-mer
4xc2
RCSB PDB
PDBbind
11-mer
4yje
RCSB PDB
PDBbind
11-mer
4yk6
RCSB PDB
PDBbind
11-mer
4yv9
RCSB PDB
PDBbind
11-mer
4yy6
RCSB PDB
PDBbind
11-mer
4yyi
RCSB PDB
PDBbind
11-mer
4yym
RCSB PDB
PDBbind
11-mer
4yyn
RCSB PDB
PDBbind
11-mer
5a0e
RCSB PDB
PDBbind
11-mer
5agu
RCSB PDB
PDBbind
11-mer
5agv
RCSB PDB
PDBbind
11-mer
5ah2
RCSB PDB
PDBbind
11-mer
5awt
RCSB PDB
PDBbind
11-mer
5awu
RCSB PDB
PDBbind
11-mer
5b6c
RCSB PDB
PDBbind
11-mer
5c6v
RCSB PDB
PDBbind
11-mer
5c7e
RCSB PDB
PDBbind
11-mer
5c7f
RCSB PDB
PDBbind
11-mer
5csz
RCSB PDB
PDBbind
11-mer
5dah
RCSB PDB
PDBbind
11-mer
5ewz
RCSB PDB
PDBbind
11-mer
5ez0
RCSB PDB
PDBbind
11-mer
5hpm
RCSB PDB
PDBbind
11-mer
5ick
RCSB PDB
PDBbind
11-mer
5id0
RCSB PDB
PDBbind
11-mer
5igq
RCSB PDB
PDBbind
11-mer
5jin
RCSB PDB
PDBbind
11-mer
5jiy
RCSB PDB
PDBbind
11-mer
5jm4
RCSB PDB
PDBbind
11-mer
5kez
RCSB PDB
PDBbind
11-mer
5l3f
RCSB PDB
PDBbind
11-mer
5l3g
RCSB PDB
PDBbind
11-mer
5lgq
RCSB PDB
PDBbind
11-mer
5mlw
RCSB PDB
PDBbind
11-mer
5nne
RCSB PDB
PDBbind
11-mer
5svx
RCSB PDB
PDBbind
11-mer
5svy
RCSB PDB
PDBbind
11-mer
5tdr
RCSB PDB
PDBbind
11-mer
5tdw
RCSB PDB
PDBbind
11-mer
5tq1
RCSB PDB
PDBbind
11-mer
5tqs
RCSB PDB
PDBbind
11-mer
5vlk
RCSB PDB
PDBbind
11-mer
5xhz
RCSB PDB
PDBbind
11-mer
5ygd
RCSB PDB
PDBbind
11-mer
6au5
RCSB PDB
PDBbind
11-mer
6axj
RCSB PDB
PDBbind
11-mer
6axp
RCSB PDB
PDBbind
11-mer
6ayn
RCSB PDB
PDBbind
11-mer
6azk
RCSB PDB
PDBbind
11-mer
6azl
RCSB PDB
PDBbind
11-mer
6ct7
RCSB PDB
PDBbind
11-mer
6g0q
RCSB PDB
PDBbind
11-mer
6qzr
RCSB PDB
PDBbind
11-mer
6qtw
RCSB PDB
PDBbind
11-mer
6qs1
RCSB PDB
PDBbind
11-mer
6om2
RCSB PDB
PDBbind
11-mer
6i5n
RCSB PDB
PDBbind
11-mer
6i5j
RCSB PDB
PDBbind
11-mer
6i4x
RCSB PDB
PDBbind
11-mer
6hks
RCSB PDB
PDBbind
11-mer
6gy5
RCSB PDB
PDBbind
11-mer
6g8q
RCSB PDB
PDBbind
11-mer
6g8p
RCSB PDB
PDBbind
11-mer
6g8l
RCSB PDB
PDBbind
11-mer
6g8k
RCSB PDB
PDBbind
11-mer
6g8j
RCSB PDB
PDBbind
11-mer
6g8i
RCSB PDB
PDBbind
11-mer
6g6x
RCSB PDB
PDBbind
11-mer
Entry Information
PDB ID
3ax5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Mitochondrial import receptor subunit TOM20 homolog
Ligand Name
11-mer
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=1.4uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Biochemistry Vol. 50: pp. 5487-5496
Ligand Properties
Formula
C
5
3
H
9
2
N
1
7
O
1
4
S
2
Molecular Weight
1255.530
Exact Mass
1254.650
No. of atoms
178
No. of bonds
179
Polar Surface Area
579.02
LOGP Value
0.64 (
Computed with XLOGP3
)
-2.55 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 14
No. of Rotatable Bonds: 40
No. of Nitrogen and Oxygen Atoms: 31
No. of Rings: 2
Canonical SMILES
[NH3+]CC(=O)N[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC[NH+]=C(N)N)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)Cc1ccc(cc1)O)CO)CC(C)C)CC(C)C)CCC[NH+]=C(N)N
InChI String
InChI=1S/C53H89N17O14S2/c1-26(2)18-34(45(77)67-35(19-27(3)4)46(78)69-38(23-71)48(80)68-37(44(76)61-29(7)51(83)84)21-30-12-14-31(72)15-13-30)65-43(75)33(11-9-17-60-53(57)58)64-50(82)40-25-86-85-24-39(62-41(73)22-54)49(81)63-32(10-8-16-59-52(55)56)42(74)66-36(20-28(5)6)47(79)70-40/h12-15,26-29,32-40,71-72H,8-11,16-25,54H2,1-7H3,(H,61,76)(H,62,73)(H,63,81)(H,64,82)(H,65,75)(H,66,74)(H,67,77)(H,68,80)(H,69,78)(H,70,79)(H,83,84)(H4,55,56,59)(H4,57,58,60)/p+3/t29-,32-,33-,34-,35-,36-,37-,38-,39+,40-/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):
P11884
Q62760
Entrez Gene ID
NCBI Entrez Gene ID:
29539
266601
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