Browse entries in the PDBbind-CN Database
HEADER 4KIL_COMPLEX COMPND 4KIL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 200 GLY PRO LEU GLY SER MET GLU ASP PHE VAL ARG GLN CYS SEQRES 2 A 200 PHE ASN PRO MET ILE VAL GLU LEU ALA GLU LYS ALA MET SEQRES 3 A 200 LYS GLU TYR GLY GLU ASP PRO LYS ILE GLU THR ASN LYS SEQRES 4 A 200 PHE ALA ALA ILE CYS THR HIS LEU GLU VAL CYS PHE MET SEQRES 5 A 200 TYR SER ASP PHE HIS PHE ILE ASP GLU ARG GLY GLU SER SEQRES 6 A 200 ILE ILE VAL GLU SER GLY ASP PRO ASN ALA LEU LEU LYS SEQRES 7 A 200 HIS ARG PHE GLU ILE ILE GLU GLY ARG ASP ARG ILE MET SEQRES 8 A 200 ALA TRP THR VAL VAL ASN SER ILE CYS ASN THR THR GLY SEQRES 9 A 200 VAL GLU LYS PRO LYS PHE LEU PRO ASP LEU TYR ASP TYR SEQRES 10 A 200 LYS GLU ASN ARG PHE ILE GLU ILE GLY VAL THR ARG ARG SEQRES 11 A 200 GLU VAL HIS ILE TYR TYR LEU GLU LYS ALA ASN LYS ILE SEQRES 12 A 200 LYS SER GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR SEQRES 13 A 200 GLY GLU GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP SEQRES 14 A 200 GLU GLU SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR SEQRES 15 A 200 ILE ARG GLN GLU MET ALA SER ARG SER LEU TRP ASP SER SEQRES 16 A 200 PHE ARG GLN SER GLU HET MN A 1 1 HET MN A 2 1 HET UNN A 319 29 ATOM 1 N GLY A -4 37.715 33.866 -14.508 1.00 71.55 N ATOM 2 CA GLY A -4 38.634 33.640 -15.651 1.00 71.27 C ATOM 3 C GLY A -4 37.829 33.289 -16.890 1.00 66.78 C ATOM 4 O GLY A -4 36.942 34.060 -17.265 1.00 68.29 O ATOM 5 HA3 GLY A -4 39.313 32.820 -15.415 1.00 0.00 H ATOM 6 HA2 GLY A -4 39.211 34.546 -15.837 1.00 0.00 H ATOM 7 HN3 GLY A -4 37.165 33.001 -14.330 1.00 0.00 H ATOM 8 HN2 GLY A -4 37.068 34.649 -14.734 1.00 0.00 H ATOM 9 HN1 GLY A -4 38.269 34.106 -13.661 1.00 0.00 H ATOM 10 N PRO A -3 38.121 32.131 -17.519 1.00 60.46 N ATOM 11 CA PRO A -3 37.447 31.720 -18.768 1.00 55.90 C ATOM 12 C PRO A -3 36.021 31.291 -18.493 1.00 50.74 C ATOM 13 O PRO A -3 35.763 30.770 -17.400 1.00 48.57 O ATOM 14 CB PRO A -3 38.249 30.499 -19.209 1.00 56.79 C ATOM 15 CG PRO A -3 38.747 29.912 -17.894 1.00 56.70 C ATOM 16 CD PRO A -3 39.053 31.096 -17.035 1.00 58.66 C ATOM 17 HA PRO A -3 37.407 32.523 -19.504 1.00 0.00 H ATOM 18 HD3 PRO A -3 38.872 30.871 -15.984 1.00 0.00 H ATOM 19 HD2 PRO A -3 40.088 31.413 -17.165 1.00 0.00 H ATOM 20 HG3 PRO A -3 39.643 29.314 -18.056 1.00 0.00 H ATOM 21 HG2 PRO A -3 37.977 29.293 -17.434 1.00 0.00 H ATOM 22 HB2 PRO A -3 37.617 29.787 -19.740 1.00 0.00 H ATOM 23 HB3 PRO A -3 39.083 30.789 -19.848 1.00 0.00 H ATOM 24 N LEU A -2 35.117 31.479 -19.451 1.00 48.26 N ATOM 25 CA LEU A -2 33.735 31.049 -19.264 1.00 45.65 C ATOM 26 C LEU A -2 33.606 29.611 -19.674 1.00 44.66 C ATOM 27 O LEU A -2 33.994 29.219 -20.783 1.00 46.62 O ATOM 28 CB LEU A -2 32.753 31.926 -20.056 1.00 46.85 C ATOM 29 CG LEU A -2 32.326 33.229 -19.383 1.00 47.32 C ATOM 30 CD1 LEU A -2 33.535 34.136 -19.092 1.00 49.59 C ATOM 31 CD2 LEU A -2 31.278 33.967 -20.216 1.00 48.71 C ATOM 32 HA LEU A -2 33.480 31.156 -18.210 1.00 0.00 H ATOM 33 HB2 LEU A -2 33.223 32.180 -21.006 1.00 0.00 H ATOM 34 HB3 LEU A -2 31.855 31.337 -20.243 1.00 0.00 H ATOM 35 HG LEU A -2 31.871 32.966 -18.428 1.00 0.00 H ATOM 36 HD21 LEU A -2 31.694 34.202 -21.196 1.00 0.00 H ATOM 37 HD22 LEU A -2 30.399 33.334 -20.336 1.00 0.00 H ATOM 38 HD23 LEU A -2 30.996 34.890 -19.709 1.00 0.00 H ATOM 39 HD11 LEU A -2 34.227 33.616 -18.430 1.00 0.00 H ATOM 40 HD12 LEU A -2 34.039 34.379 -20.028 1.00 0.00 H ATOM 41 HD13 LEU A -2 33.192 35.053 -18.613 1.00 0.00 H ATOM 42 H LEU A -2 35.398 31.937 -20.342 1.00 0.00 H ATOM 43 N GLY A -1 33.064 28.824 -18.764 1.00 43.44 N ATOM 44 CA GLY A -1 32.817 27.431 -19.021 1.00 45.92 C ATOM 45 C GLY A -1 31.484 27.225 -19.729 1.00 45.57 C ATOM 46 O GLY A -1 30.744 28.175 -20.038 1.00 45.89 O ATOM 47 HA3 GLY A -1 32.803 26.892 -18.074 1.00 0.00 H ATOM 48 HA2 GLY A -1 33.617 27.038 -19.649 1.00 0.00 H ATOM 49 H GLY A -1 32.809 29.221 -17.837 1.00 0.00 H ATOM 50 N SER A 0 31.220 25.963 -20.027 1.00 42.97 N ATOM 51 CA SER A 0 29.941 25.538 -20.569 1.00 41.51 C ATOM 52 C SER A 0 29.087 25.006 -19.446 1.00 40.32 C ATOM 53 O SER A 0 29.551 24.221 -18.627 1.00 39.45 O ATOM 54 CB SER A 0 30.191 24.415 -21.575 1.00 42.98 C ATOM 55 OG SER A 0 29.072 23.578 -21.676 1.00 48.06 O ATOM 56 HA SER A 0 29.438 26.375 -21.053 1.00 0.00 H ATOM 57 HB2 SER A 0 31.049 23.827 -21.249 1.00 0.00 H ATOM 58 HB3 SER A 0 30.401 24.850 -22.552 1.00 0.00 H ATOM 59 HG SER A 0 29.257 22.860 -22.332 1.00 0.00 H ATOM 60 H SER A 0 31.957 25.247 -19.867 1.00 0.00 H ATOM 61 N MET A 1 27.830 25.416 -19.387 1.00 38.94 N ATOM 62 CA MET A 1 26.957 24.859 -18.359 1.00 36.02 C ATOM 63 C MET A 1 26.743 23.347 -18.579 1.00 36.26 C ATOM 64 O MET A 1 26.582 22.613 -17.605 1.00 35.54 O ATOM 65 CB MET A 1 25.619 25.600 -18.304 1.00 36.26 C ATOM 66 CG MET A 1 24.683 25.023 -17.220 1.00 35.32 C ATOM 67 SD MET A 1 25.300 25.225 -15.542 1.00 33.77 S ATOM 68 CE MET A 1 24.741 26.900 -15.245 1.00 34.46 C ATOM 69 HA MET A 1 27.449 24.994 -17.396 1.00 0.00 H ATOM 70 HB2 MET A 1 25.807 26.651 -18.084 1.00 0.00 H ATOM 71 HB3 MET A 1 25.129 25.515 -19.274 1.00 0.00 H ATOM 72 HG2 MET A 1 24.551 23.958 -17.412 1.00 0.00 H ATOM 73 HG3 MET A 1 23.719 25.527 -17.295 1.00 0.00 H ATOM 74 HE1 MET A 1 25.194 27.568 -15.977 1.00 0.00 H ATOM 75 HE2 MET A 1 23.656 26.941 -15.336 1.00 0.00 H ATOM 76 HE3 MET A 1 25.034 27.207 -14.241 1.00 0.00 H ATOM 77 H MET A 1 27.471 26.122 -20.061 1.00 0.00 H ATOM 78 N GLU A 2 26.725 22.889 -19.843 1.00 39.53 N ATOM 79 CA GLU A 2 26.643 21.432 -20.118 1.00 40.65 C ATOM 80 C GLU A 2 27.821 20.666 -19.492 1.00 40.88 C ATOM 81 O GLU A 2 27.607 19.656 -18.836 1.00 41.73 O ATOM 82 CB GLU A 2 26.523 21.068 -21.625 1.00 44.12 C ATOM 83 CG GLU A 2 25.609 19.813 -21.759 1.00 58.80 C ATOM 84 CD GLU A 2 25.789 19.074 -23.050 1.00 67.75 C ATOM 85 OE1 GLU A 2 26.061 19.730 -24.088 1.00 71.83 O ATOM 86 OE2 GLU A 2 25.650 17.833 -23.029 1.00 71.71 O ATOM 87 HA GLU A 2 25.711 21.120 -19.646 1.00 0.00 H ATOM 88 HB2 GLU A 2 26.084 21.903 -22.171 1.00 0.00 H ATOM 89 HB3 GLU A 2 27.511 20.849 -22.031 1.00 0.00 H ATOM 90 HG2 GLU A 2 25.835 19.133 -20.938 1.00 0.00 H ATOM 91 HG3 GLU A 2 24.570 20.134 -21.688 1.00 0.00 H ATOM 92 H GLU A 2 26.769 23.561 -20.635 1.00 0.00 H ATOM 93 N ASP A 3 29.040 21.165 -19.679 1.00 40.75 N ATOM 94 CA ASP A 3 30.225 20.557 -19.064 1.00 41.20 C ATOM 95 C ASP A 3 30.061 20.494 -17.545 1.00 40.18 C ATOM 96 O ASP A 3 30.388 19.488 -16.919 1.00 41.17 O ATOM 97 CB ASP A 3 31.501 21.363 -19.371 1.00 42.82 C ATOM 98 CG ASP A 3 31.934 21.285 -20.821 1.00 50.17 C ATOM 99 OD1 ASP A 3 31.299 20.546 -21.613 1.00 55.61 O ATOM 100 OD2 ASP A 3 32.938 21.974 -21.151 1.00 49.93 O ATOM 101 HA ASP A 3 30.322 19.555 -19.483 1.00 0.00 H ATOM 102 HB2 ASP A 3 31.317 22.408 -19.122 1.00 0.00 H ATOM 103 HB3 ASP A 3 32.309 20.979 -18.749 1.00 0.00 H ATOM 104 H ASP A 3 29.156 22.008 -20.277 1.00 0.00 H ATOM 105 N PHE A 4 29.572 21.576 -16.947 1.00 37.72 N ATOM 106 CA PHE A 4 29.434 21.618 -15.510 1.00 36.52 C ATOM 107 C PHE A 4 28.453 20.534 -15.041 1.00 36.89 C ATOM 108 O PHE A 4 28.734 19.795 -14.105 1.00 35.42 O ATOM 109 CB PHE A 4 28.927 22.967 -15.032 1.00 35.63 C ATOM 110 CG PHE A 4 28.493 22.952 -13.595 1.00 36.42 C ATOM 111 CD1 PHE A 4 29.430 22.928 -12.584 1.00 39.59 C ATOM 112 CD2 PHE A 4 27.150 22.928 -13.254 1.00 34.58 C ATOM 113 CE1 PHE A 4 29.040 22.889 -11.268 1.00 40.44 C ATOM 114 CE2 PHE A 4 26.759 22.886 -11.930 1.00 36.38 C ATOM 115 CZ PHE A 4 27.719 22.865 -10.942 1.00 38.33 C ATOM 116 HA PHE A 4 30.424 21.445 -15.087 1.00 0.00 H ATOM 117 HB2 PHE A 4 29.726 23.700 -15.147 1.00 0.00 H ATOM 118 HB3 PHE A 4 28.077 23.258 -15.649 1.00 0.00 H ATOM 119 HD2 PHE A 4 26.394 22.942 -14.039 1.00 0.00 H ATOM 120 HE2 PHE A 4 25.701 22.870 -11.669 1.00 0.00 H ATOM 121 HZ PHE A 4 27.419 22.829 -9.895 1.00 0.00 H ATOM 122 HE1 PHE A 4 29.793 22.877 -10.480 1.00 0.00 H ATOM 123 HD1 PHE A 4 30.491 22.940 -12.832 1.00 0.00 H ATOM 124 H PHE A 4 29.287 22.397 -17.518 1.00 0.00 H ATOM 125 N VAL A 5 27.298 20.460 -15.694 1.00 36.53 N ATOM 126 CA VAL A 5 26.306 19.481 -15.299 1.00 35.20 C ATOM 127 C VAL A 5 26.842 18.049 -15.382 1.00 36.88 C ATOM 128 O VAL A 5 26.650 17.241 -14.468 1.00 36.07 O ATOM 129 CB VAL A 5 25.025 19.631 -16.159 1.00 37.26 C ATOM 130 CG1 VAL A 5 24.078 18.418 -15.982 1.00 35.76 C ATOM 131 CG2 VAL A 5 24.314 20.939 -15.774 1.00 36.02 C ATOM 132 HA VAL A 5 26.059 19.674 -14.255 1.00 0.00 H ATOM 133 HB VAL A 5 25.308 19.664 -17.211 1.00 0.00 H ATOM 134 HG11 VAL A 5 24.595 17.508 -16.287 1.00 0.00 H ATOM 135 HG12 VAL A 5 23.784 18.338 -14.935 1.00 0.00 H ATOM 136 HG13 VAL A 5 23.191 18.558 -16.600 1.00 0.00 H ATOM 137 HG21 VAL A 5 24.047 20.909 -14.718 1.00 0.00 H ATOM 138 HG22 VAL A 5 24.981 21.781 -15.957 1.00 0.00 H ATOM 139 HG23 VAL A 5 23.412 21.051 -16.375 1.00 0.00 H ATOM 140 H VAL A 5 27.106 21.104 -16.488 1.00 0.00 H ATOM 141 N ARG A 6 27.473 17.721 -16.498 1.00 38.69 N ATOM 142 CA ARG A 6 27.954 16.363 -16.710 1.00 43.02 C ATOM 143 C ARG A 6 29.124 16.030 -15.787 1.00 43.32 C ATOM 144 O ARG A 6 29.339 14.875 -15.459 1.00 45.21 O ATOM 145 CB ARG A 6 28.320 16.146 -18.191 1.00 49.28 C ATOM 146 CG ARG A 6 27.079 16.156 -19.050 1.00 51.62 C ATOM 147 CD ARG A 6 27.311 15.711 -20.489 1.00 55.34 C ATOM 148 NE ARG A 6 26.090 15.934 -21.257 1.00 55.27 N ATOM 149 CZ ARG A 6 25.002 15.172 -21.192 1.00 55.80 C ATOM 150 NH1 ARG A 6 24.972 14.093 -20.414 1.00 53.34 N ATOM 151 NH2 ARG A 6 23.944 15.477 -21.931 1.00 59.63 N ATOM 152 HA ARG A 6 27.147 15.675 -16.457 1.00 0.00 H ATOM 153 HB2 ARG A 6 28.988 16.944 -18.516 1.00 0.00 H ATOM 154 HB3 ARG A 6 28.824 15.185 -18.299 1.00 0.00 H ATOM 155 HG2 ARG A 6 26.346 15.487 -18.599 1.00 0.00 H ATOM 156 HG3 ARG A 6 26.682 17.171 -19.066 1.00 0.00 H ATOM 157 HD2 ARG A 6 27.567 14.652 -20.508 1.00 0.00 H ATOM 158 HD3 ARG A 6 28.127 16.288 -20.923 1.00 0.00 H ATOM 159 HE ARG A 6 26.069 16.749 -21.903 1.00 0.00 H ATOM 160 HH12 ARG A 6 24.115 13.506 -20.372 1.00 0.00 H ATOM 161 HH11 ARG A 6 25.806 13.837 -19.848 1.00 0.00 H ATOM 162 HH22 ARG A 6 23.090 14.886 -21.885 1.00 0.00 H ATOM 163 HH21 ARG A 6 23.968 16.308 -22.556 1.00 0.00 H ATOM 164 H ARG A 6 27.627 18.441 -17.232 1.00 0.00 H ATOM 165 N GLN A 7 29.874 17.043 -15.373 1.00 42.22 N ATOM 166 CA GLN A 7 30.998 16.838 -14.467 1.00 45.22 C ATOM 167 C GLN A 7 30.606 16.755 -12.985 1.00 43.91 C ATOM 168 O GLN A 7 31.222 16.001 -12.231 1.00 46.38 O ATOM 169 CB GLN A 7 32.064 17.919 -14.714 1.00 48.99 C ATOM 170 CG GLN A 7 32.812 17.671 -16.046 1.00 54.61 C ATOM 171 CD GLN A 7 33.565 18.884 -16.612 1.00 54.02 C ATOM 172 OE1 GLN A 7 33.853 19.870 -15.916 1.00 51.03 O ATOM 173 NE2 GLN A 7 33.885 18.802 -17.897 1.00 55.58 N ATOM 174 HA GLN A 7 31.412 15.856 -14.695 1.00 0.00 H ATOM 175 HB2 GLN A 7 31.579 18.895 -14.754 1.00 0.00 H ATOM 176 HB3 GLN A 7 32.782 17.905 -13.894 1.00 0.00 H ATOM 177 HG2 GLN A 7 33.535 16.872 -15.883 1.00 0.00 H ATOM 178 HG3 GLN A 7 32.081 17.352 -16.789 1.00 0.00 H ATOM 179 HE22 GLN A 7 33.625 17.957 -18.445 1.00 0.00 H ATOM 180 HE21 GLN A 7 34.396 19.583 -18.356 1.00 0.00 H ATOM 181 H GLN A 7 29.655 18.005 -15.702 1.00 0.00 H ATOM 182 N CYS A 8 29.658 17.585 -12.549 1.00 41.02 N ATOM 183 CA CYS A 8 29.358 17.690 -11.127 1.00 44.18 C ATOM 184 C CYS A 8 28.090 16.985 -10.623 1.00 38.81 C ATOM 185 O CYS A 8 27.861 16.946 -9.412 1.00 38.28 O ATOM 186 CB CYS A 8 29.418 19.154 -10.688 1.00 50.31 C ATOM 187 SG CYS A 8 31.193 19.717 -10.378 1.00 74.38 S ATOM 188 HA CYS A 8 30.144 17.113 -10.639 1.00 0.00 H ATOM 189 HB2 CYS A 8 28.844 19.271 -9.769 1.00 0.00 H ATOM 190 HB3 CYS A 8 28.981 19.776 -11.469 1.00 0.00 H ATOM 191 HG CYS A 8 31.753 18.941 -9.384 1.00 0.00 H ATOM 192 H CYS A 8 29.127 18.164 -13.231 1.00 0.00 H ATOM 193 N PHE A 9 27.289 16.409 -11.525 1.00 35.73 N ATOM 194 CA PHE A 9 26.148 15.565 -11.126 1.00 34.80 C ATOM 195 C PHE A 9 26.305 14.105 -11.512 1.00 37.47 C ATOM 196 O PHE A 9 26.903 13.778 -12.526 1.00 38.46 O ATOM 197 CB PHE A 9 24.838 16.085 -11.692 1.00 33.87 C ATOM 198 CG PHE A 9 24.428 17.391 -11.143 1.00 32.40 C ATOM 199 CD1 PHE A 9 23.733 17.468 -9.952 1.00 30.83 C ATOM 200 CD2 PHE A 9 24.737 18.549 -11.804 1.00 34.46 C ATOM 201 CE1 PHE A 9 23.350 18.670 -9.440 1.00 29.96 C ATOM 202 CE2 PHE A 9 24.344 19.769 -11.285 1.00 33.51 C ATOM 203 CZ PHE A 9 23.656 19.831 -10.122 1.00 30.11 C ATOM 204 HA PHE A 9 26.130 15.622 -10.038 1.00 0.00 H ATOM 205 HB2 PHE A 9 24.946 16.185 -12.772 1.00 0.00 H ATOM 206 HB3 PHE A 9 24.056 15.359 -11.472 1.00 0.00 H ATOM 207 HD2 PHE A 9 25.293 18.510 -12.740 1.00 0.00 H ATOM 208 HE2 PHE A 9 24.591 20.688 -11.817 1.00 0.00 H ATOM 209 HZ PHE A 9 23.344 20.796 -9.724 1.00 0.00 H ATOM 210 HE1 PHE A 9 22.805 18.716 -8.497 1.00 0.00 H ATOM 211 HD1 PHE A 9 23.487 16.553 -9.414 1.00 0.00 H ATOM 212 H PHE A 9 27.476 16.561 -12.537 1.00 0.00 H ATOM 213 N ASN A 10 25.767 13.233 -10.656 1.00 38.77 N ATOM 214 CA ASN A 10 25.793 11.800 -10.887 1.00 42.99 C ATOM 215 C ASN A 10 25.097 11.502 -12.223 1.00 41.10 C ATOM 216 O ASN A 10 24.103 12.153 -12.567 1.00 39.47 O ATOM 217 CB ASN A 10 25.095 11.073 -9.725 1.00 50.27 C ATOM 218 CG ASN A 10 25.041 9.586 -9.920 1.00 65.28 C ATOM 219 OD1 ASN A 10 24.311 9.088 -10.769 1.00 70.65 O ATOM 220 ND2 ASN A 10 25.809 8.857 -9.121 1.00 73.27 N ATOM 221 HA ASN A 10 26.822 11.444 -10.937 1.00 0.00 H ATOM 222 HB2 ASN A 10 25.639 11.285 -8.804 1.00 0.00 H ATOM 223 HB3 ASN A 10 24.076 11.451 -9.639 1.00 0.00 H ATOM 224 HD22 ASN A 10 26.413 9.322 -8.414 1.00 0.00 H ATOM 225 HD21 ASN A 10 25.807 7.820 -9.202 1.00 0.00 H ATOM 226 H ASN A 10 25.313 13.593 -9.793 1.00 0.00 H ATOM 227 N PRO A 11 25.621 10.534 -12.984 1.00 41.66 N ATOM 228 CA PRO A 11 25.019 10.268 -14.294 1.00 43.39 C ATOM 229 C PRO A 11 23.536 9.891 -14.231 1.00 43.66 C ATOM 230 O PRO A 11 22.778 10.209 -15.150 1.00 43.69 O ATOM 231 CB PRO A 11 25.860 9.098 -14.819 1.00 47.58 C ATOM 232 CG PRO A 11 27.190 9.317 -14.207 1.00 47.90 C ATOM 233 CD PRO A 11 26.886 9.800 -12.811 1.00 44.69 C ATOM 234 HA PRO A 11 25.029 11.154 -14.928 1.00 0.00 H ATOM 235 HD3 PRO A 11 26.763 8.963 -12.124 1.00 0.00 H ATOM 236 HD2 PRO A 11 27.674 10.457 -12.443 1.00 0.00 H ATOM 237 HG3 PRO A 11 27.751 10.069 -14.762 1.00 0.00 H ATOM 238 HG2 PRO A 11 27.759 8.388 -14.179 1.00 0.00 H ATOM 239 HB2 PRO A 11 25.439 8.144 -14.503 1.00 0.00 H ATOM 240 HB3 PRO A 11 25.924 9.123 -15.907 1.00 0.00 H ATOM 241 N MET A 12 23.130 9.240 -13.150 1.00 45.19 N ATOM 242 CA MET A 12 21.731 8.832 -12.982 1.00 48.12 C ATOM 243 C MET A 12 20.850 10.069 -12.959 1.00 44.58 C ATOM 244 O MET A 12 19.810 10.106 -13.630 1.00 45.11 O ATOM 245 CB MET A 12 21.537 8.019 -11.705 1.00 55.43 C ATOM 246 CG MET A 12 22.359 6.717 -11.654 1.00 66.65 C ATOM 247 SD MET A 12 21.968 5.510 -12.958 1.00140.07 S ATOM 248 CE MET A 12 23.401 5.621 -14.049 1.00 71.95 C ATOM 249 HA MET A 12 21.451 8.195 -13.821 1.00 0.00 H ATOM 250 HB2 MET A 12 21.826 8.640 -10.857 1.00 0.00 H ATOM 251 HB3 MET A 12 20.481 7.761 -11.621 1.00 0.00 H ATOM 252 HG2 MET A 12 22.182 6.242 -10.689 1.00 0.00 H ATOM 253 HG3 MET A 12 23.414 6.979 -11.740 1.00 0.00 H ATOM 254 HE1 MET A 12 23.488 6.639 -14.430 1.00 0.00 H ATOM 255 HE2 MET A 12 24.301 5.362 -13.492 1.00 0.00 H ATOM 256 HE3 MET A 12 23.276 4.929 -14.882 1.00 0.00 H ATOM 257 H MET A 12 23.819 9.013 -12.404 1.00 0.00 H ATOM 258 N ILE A 13 21.309 11.091 -12.231 1.00 40.74 N ATOM 259 CA ILE A 13 20.597 12.361 -12.104 1.00 35.66 C ATOM 260 C ILE A 13 20.520 13.073 -13.450 1.00 34.27 C ATOM 261 O ILE A 13 19.457 13.529 -13.860 1.00 34.27 O ATOM 262 CB ILE A 13 21.272 13.317 -11.054 1.00 37.24 C ATOM 263 CG1 ILE A 13 21.169 12.759 -9.628 1.00 40.68 C ATOM 264 CG2 ILE A 13 20.687 14.694 -11.121 1.00 34.00 C ATOM 265 CD1 ILE A 13 19.804 12.737 -9.063 1.00 42.24 C ATOM 266 HA ILE A 13 19.593 12.122 -11.754 1.00 0.00 H ATOM 267 HB ILE A 13 22.329 13.379 -11.312 1.00 0.00 H ATOM 268 HG12 ILE A 13 21.548 11.737 -9.636 1.00 0.00 H ATOM 269 HG13 ILE A 13 21.794 13.372 -8.979 1.00 0.00 H ATOM 270 HD11 ILE A 13 19.409 13.752 -9.031 1.00 0.00 H ATOM 271 HD12 ILE A 13 19.163 12.116 -9.689 1.00 0.00 H ATOM 272 HD13 ILE A 13 19.836 12.326 -8.054 1.00 0.00 H ATOM 273 HG21 ILE A 13 20.843 15.106 -12.118 1.00 0.00 H ATOM 274 HG22 ILE A 13 19.619 14.644 -10.911 1.00 0.00 H ATOM 275 HG23 ILE A 13 21.175 15.331 -10.383 1.00 0.00 H ATOM 276 H ILE A 13 22.214 10.978 -11.732 1.00 0.00 H ATOM 277 N VAL A 14 21.661 13.200 -14.124 1.00 33.67 N ATOM 278 CA VAL A 14 21.697 13.824 -15.448 1.00 33.99 C ATOM 279 C VAL A 14 20.727 13.145 -16.432 1.00 36.80 C ATOM 280 O VAL A 14 19.999 13.803 -17.176 1.00 37.41 O ATOM 281 CB VAL A 14 23.141 13.807 -16.017 1.00 41.79 C ATOM 282 CG1 VAL A 14 23.177 14.346 -17.424 1.00 44.89 C ATOM 283 CG2 VAL A 14 24.071 14.590 -15.131 1.00 39.41 C ATOM 284 HA VAL A 14 21.373 14.858 -15.329 1.00 0.00 H ATOM 285 HB VAL A 14 23.477 12.770 -16.043 1.00 0.00 H ATOM 286 HG11 VAL A 14 22.543 13.732 -18.063 1.00 0.00 H ATOM 287 HG12 VAL A 14 22.813 15.373 -17.428 1.00 0.00 H ATOM 288 HG13 VAL A 14 24.202 14.321 -17.795 1.00 0.00 H ATOM 289 HG21 VAL A 14 23.728 15.623 -15.069 1.00 0.00 H ATOM 290 HG22 VAL A 14 24.079 14.148 -14.135 1.00 0.00 H ATOM 291 HG23 VAL A 14 25.077 14.564 -15.550 1.00 0.00 H ATOM 292 H VAL A 14 22.544 12.849 -13.702 1.00 0.00 H ATOM 293 N GLU A 15 20.736 11.827 -16.440 1.00 40.78 N ATOM 294 CA GLU A 15 19.875 11.044 -17.307 1.00 45.82 C ATOM 295 C GLU A 15 18.398 11.293 -17.015 1.00 41.58 C ATOM 296 O GLU A 15 17.607 11.502 -17.941 1.00 41.86 O ATOM 297 CB GLU A 15 20.198 9.571 -17.117 1.00 57.05 C ATOM 298 CG GLU A 15 19.390 8.646 -18.005 1.00 71.37 C ATOM 299 CD GLU A 15 19.975 7.253 -18.055 1.00 85.62 C ATOM 300 OE1 GLU A 15 20.831 6.931 -17.195 1.00 87.70 O ATOM 301 OE2 GLU A 15 19.578 6.483 -18.957 1.00 94.32 O ATOM 302 HA GLU A 15 20.058 11.345 -18.339 1.00 0.00 H ATOM 303 HB2 GLU A 15 21.255 9.420 -17.335 1.00 0.00 H ATOM 304 HB3 GLU A 15 20.002 9.308 -16.078 1.00 0.00 H ATOM 305 HG2 GLU A 15 18.373 8.587 -17.618 1.00 0.00 H ATOM 306 HG3 GLU A 15 19.370 9.056 -19.015 1.00 0.00 H ATOM 307 H GLU A 15 21.386 11.328 -15.799 1.00 0.00 H ATOM 308 N LEU A 16 18.026 11.282 -15.729 1.00 38.13 N ATOM 309 CA LEU A 16 16.634 11.520 -15.336 1.00 37.04 C ATOM 310 C LEU A 16 16.202 12.919 -15.740 1.00 35.82 C ATOM 311 O LEU A 16 15.065 13.135 -16.139 1.00 35.67 O ATOM 312 CB LEU A 16 16.450 11.341 -13.815 1.00 36.38 C ATOM 313 CG LEU A 16 16.535 9.910 -13.323 1.00 40.17 C ATOM 314 CD1 LEU A 16 16.493 9.889 -11.791 1.00 41.30 C ATOM 315 CD2 LEU A 16 15.402 9.038 -13.886 1.00 42.80 C ATOM 316 HA LEU A 16 16.012 10.788 -15.851 1.00 0.00 H ATOM 317 HB2 LEU A 16 17.224 11.919 -13.310 1.00 0.00 H ATOM 318 HB3 LEU A 16 15.470 11.734 -13.544 1.00 0.00 H ATOM 319 HG LEU A 16 17.478 9.493 -13.677 1.00 0.00 H ATOM 320 HD21 LEU A 16 14.441 9.448 -13.576 1.00 0.00 H ATOM 321 HD22 LEU A 16 15.460 9.028 -14.974 1.00 0.00 H ATOM 322 HD23 LEU A 16 15.504 8.022 -13.506 1.00 0.00 H ATOM 323 HD11 LEU A 16 17.335 10.458 -11.398 1.00 0.00 H ATOM 324 HD12 LEU A 16 15.560 10.335 -11.448 1.00 0.00 H ATOM 325 HD13 LEU A 16 16.554 8.858 -11.441 1.00 0.00 H ATOM 326 H LEU A 16 18.739 11.101 -14.994 1.00 0.00 H ATOM 327 N ALA A 17 17.122 13.877 -15.639 1.00 35.01 N ATOM 328 CA ALA A 17 16.833 15.241 -16.037 1.00 35.37 C ATOM 329 C ALA A 17 16.676 15.400 -17.556 1.00 35.76 C ATOM 330 O ALA A 17 15.763 16.104 -18.020 1.00 35.88 O ATOM 331 CB ALA A 17 17.929 16.178 -15.526 1.00 35.72 C ATOM 332 HA ALA A 17 15.875 15.505 -15.589 1.00 0.00 H ATOM 333 HB1 ALA A 17 17.974 16.123 -14.438 1.00 0.00 H ATOM 334 HB2 ALA A 17 18.888 15.876 -15.947 1.00 0.00 H ATOM 335 HB3 ALA A 17 17.703 17.200 -15.830 1.00 0.00 H ATOM 336 H ALA A 17 18.065 13.642 -15.268 1.00 0.00 H ATOM 337 N GLU A 18 17.590 14.794 -18.315 1.00 35.98 N ATOM 338 CA GLU A 18 17.473 14.751 -19.787 1.00 41.01 C ATOM 339 C GLU A 18 16.138 14.155 -20.229 1.00 43.03 C ATOM 340 O GLU A 18 15.491 14.674 -21.134 1.00 45.12 O ATOM 341 CB GLU A 18 18.598 13.915 -20.397 1.00 46.97 C ATOM 342 CG GLU A 18 19.959 14.580 -20.362 1.00 53.12 C ATOM 343 CD GLU A 18 21.008 13.860 -21.235 1.00 65.48 C ATOM 344 OE1 GLU A 18 21.843 13.089 -20.698 1.00 63.38 O ATOM 345 OE2 GLU A 18 20.992 14.074 -22.467 1.00 77.61 O ATOM 346 HA GLU A 18 17.540 15.781 -20.136 1.00 0.00 H ATOM 347 HB2 GLU A 18 18.662 12.976 -19.847 1.00 0.00 H ATOM 348 HB3 GLU A 18 18.345 13.709 -21.437 1.00 0.00 H ATOM 349 HG2 GLU A 18 19.854 15.604 -20.719 1.00 0.00 H ATOM 350 HG3 GLU A 18 20.314 14.591 -19.331 1.00 0.00 H ATOM 351 H GLU A 18 18.407 14.340 -17.859 1.00 0.00 H ATOM 352 N LYS A 19 15.744 13.042 -19.610 1.00 43.99 N ATOM 353 CA LYS A 19 14.463 12.391 -19.922 1.00 46.66 C ATOM 354 C LYS A 19 13.281 13.284 -19.577 1.00 43.62 C ATOM 355 O LYS A 19 12.332 13.370 -20.334 1.00 43.97 O ATOM 356 CB LYS A 19 14.319 11.088 -19.153 1.00 51.83 C ATOM 357 CG LYS A 19 15.172 9.967 -19.658 1.00 59.96 C ATOM 358 CD LYS A 19 14.522 8.636 -19.347 1.00 70.62 C ATOM 359 CE LYS A 19 15.184 7.527 -20.139 1.00 82.85 C ATOM 360 NZ LYS A 19 16.616 7.354 -19.748 1.00 87.71 N ATOM 361 HA LYS A 19 14.464 12.195 -20.994 1.00 0.00 H ATOM 362 HB2 LYS A 19 14.585 11.276 -18.113 1.00 0.00 H ATOM 363 HB3 LYS A 19 13.277 10.774 -19.209 1.00 0.00 H ATOM 364 HG2 LYS A 19 15.295 10.065 -20.737 1.00 0.00 H ATOM 365 HG3 LYS A 19 16.149 10.012 -19.177 1.00 0.00 H ATOM 366 HD2 LYS A 19 14.623 8.427 -18.282 1.00 0.00 H ATOM 367 HD3 LYS A 19 13.465 8.683 -19.608 1.00 0.00 H ATOM 368 HE2 LYS A 19 15.133 7.770 -21.200 1.00 0.00 H ATOM 369 HE3 LYS A 19 14.651 6.594 -19.956 1.00 0.00 H ATOM 370 HZ1 LYS A 19 17.132 8.239 -19.926 1.00 0.00 H ATOM 371 HZ2 LYS A 19 16.672 7.116 -18.737 1.00 0.00 H ATOM 372 HZ3 LYS A 19 17.037 6.587 -20.310 1.00 0.00 H ATOM 373 H LYS A 19 16.361 12.622 -18.885 1.00 0.00 H ATOM 374 N ALA A 20 13.334 13.928 -18.407 1.00 40.85 N ATOM 375 CA ALA A 20 12.300 14.887 -18.002 1.00 41.63 C ATOM 376 C ALA A 20 12.156 16.010 -19.056 1.00 41.41 C ATOM 377 O ALA A 20 11.059 16.304 -19.519 1.00 42.48 O ATOM 378 CB ALA A 20 12.615 15.473 -16.639 1.00 40.48 C ATOM 379 HA ALA A 20 11.351 14.356 -17.934 1.00 0.00 H ATOM 380 HB1 ALA A 20 12.660 14.671 -15.902 1.00 0.00 H ATOM 381 HB2 ALA A 20 13.576 15.986 -16.679 1.00 0.00 H ATOM 382 HB3 ALA A 20 11.835 16.181 -16.360 1.00 0.00 H ATOM 383 H ALA A 20 14.131 13.744 -17.765 1.00 0.00 H ATOM 384 N MET A 21 13.269 16.606 -19.465 1.00 39.42 N ATOM 385 CA MET A 21 13.218 17.683 -20.428 1.00 40.81 C ATOM 386 C MET A 21 12.610 17.231 -21.789 1.00 44.24 C ATOM 387 O MET A 21 11.754 17.921 -22.342 1.00 46.41 O ATOM 388 CB MET A 21 14.618 18.309 -20.582 1.00 39.42 C ATOM 389 CG MET A 21 15.001 19.051 -19.340 1.00 36.92 C ATOM 390 SD MET A 21 16.502 19.997 -19.459 1.00 36.18 S ATOM 391 CE MET A 21 15.883 21.483 -20.245 1.00 37.83 C ATOM 392 HA MET A 21 12.542 18.451 -20.052 1.00 0.00 H ATOM 393 HB2 MET A 21 15.346 17.519 -20.767 1.00 0.00 H ATOM 394 HB3 MET A 21 14.611 19.000 -21.425 1.00 0.00 H ATOM 395 HG2 MET A 21 15.122 18.325 -18.536 1.00 0.00 H ATOM 396 HG3 MET A 21 14.189 19.735 -19.091 1.00 0.00 H ATOM 397 HE1 MET A 21 15.446 21.227 -21.210 1.00 0.00 H ATOM 398 HE2 MET A 21 15.124 21.939 -19.610 1.00 0.00 H ATOM 399 HE3 MET A 21 16.705 22.184 -20.392 1.00 0.00 H ATOM 400 H MET A 21 14.187 16.295 -19.089 1.00 0.00 H ATOM 401 N LYS A 22 13.011 16.060 -22.281 1.00 45.17 N ATOM 402 CA LYS A 22 12.458 15.526 -23.533 1.00 48.94 C ATOM 403 C LYS A 22 10.974 15.288 -23.396 1.00 50.76 C ATOM 404 O LYS A 22 10.217 15.536 -24.316 1.00 53.85 O ATOM 405 CB LYS A 22 13.124 14.208 -23.916 1.00 49.86 C ATOM 406 CG LYS A 22 12.500 13.558 -25.137 1.00 55.04 C ATOM 407 CD LYS A 22 13.458 12.575 -25.780 1.00 60.17 C ATOM 408 CE LYS A 22 12.890 11.992 -27.097 1.00 70.68 C ATOM 409 NZ LYS A 22 11.722 11.100 -26.841 1.00 77.19 N ATOM 410 HA LYS A 22 12.649 16.266 -24.310 1.00 0.00 H ATOM 411 HB2 LYS A 22 14.177 14.399 -24.124 1.00 0.00 H ATOM 412 HB3 LYS A 22 13.040 13.519 -23.075 1.00 0.00 H ATOM 413 HG2 LYS A 22 11.595 13.029 -24.836 1.00 0.00 H ATOM 414 HG3 LYS A 22 12.244 14.332 -25.861 1.00 0.00 H ATOM 415 HD2 LYS A 22 14.396 13.087 -25.996 1.00 0.00 H ATOM 416 HD3 LYS A 22 13.644 11.757 -25.084 1.00 0.00 H ATOM 417 HE2 LYS A 22 13.671 11.419 -27.597 1.00 0.00 H ATOM 418 HE3 LYS A 22 12.575 12.813 -27.741 1.00 0.00 H ATOM 419 HZ1 LYS A 22 12.017 10.311 -26.231 1.00 0.00 H ATOM 420 HZ2 LYS A 22 10.970 11.642 -26.369 1.00 0.00 H ATOM 421 HZ3 LYS A 22 11.367 10.727 -27.745 1.00 0.00 H ATOM 422 H LYS A 22 13.731 15.512 -21.768 1.00 0.00 H ATOM 423 N GLU A 23 10.564 14.794 -22.229 1.00 48.94 N ATOM 424 CA GLU A 23 9.168 14.452 -22.004 1.00 50.85 C ATOM 425 C GLU A 23 8.308 15.707 -22.205 1.00 52.24 C ATOM 426 O GLU A 23 7.218 15.635 -22.755 1.00 55.55 O ATOM 427 CB GLU A 23 8.998 13.862 -20.585 1.00 48.71 C ATOM 428 CG GLU A 23 7.613 13.452 -20.249 1.00 50.79 C ATOM 429 CD GLU A 23 7.490 12.772 -18.856 1.00 49.27 C ATOM 430 OE1 GLU A 23 8.331 13.004 -17.966 1.00 47.45 O ATOM 431 OE2 GLU A 23 6.553 12.002 -18.672 1.00 51.22 O ATOM 432 HA GLU A 23 8.842 13.695 -22.717 1.00 0.00 H ATOM 433 HB2 GLU A 23 9.642 12.987 -20.501 1.00 0.00 H ATOM 434 HB3 GLU A 23 9.315 14.615 -19.863 1.00 0.00 H ATOM 435 HG2 GLU A 23 6.978 14.338 -20.258 1.00 0.00 H ATOM 436 HG3 GLU A 23 7.266 12.750 -21.008 1.00 0.00 H ATOM 437 H GLU A 23 11.254 14.650 -21.465 1.00 0.00 H ATOM 438 N TYR A 24 8.825 16.860 -21.779 1.00 50.17 N ATOM 439 CA TYR A 24 8.097 18.131 -21.875 1.00 54.18 C ATOM 440 C TYR A 24 8.488 18.992 -23.096 1.00 56.60 C ATOM 441 O TYR A 24 8.013 20.115 -23.239 1.00 60.51 O ATOM 442 CB TYR A 24 8.181 18.898 -20.544 1.00 56.09 C ATOM 443 CG TYR A 24 7.548 18.108 -19.373 1.00 62.76 C ATOM 444 CD1 TYR A 24 6.178 18.171 -19.113 1.00 69.91 C ATOM 445 CD2 TYR A 24 8.325 17.282 -18.556 1.00 62.07 C ATOM 446 CE1 TYR A 24 5.605 17.442 -18.062 1.00 71.44 C ATOM 447 CE2 TYR A 24 7.771 16.558 -17.510 1.00 63.85 C ATOM 448 CZ TYR A 24 6.411 16.639 -17.266 1.00 69.47 C ATOM 449 OH TYR A 24 5.862 15.907 -16.225 1.00 73.40 O ATOM 450 HA TYR A 24 7.051 17.884 -22.057 1.00 0.00 H ATOM 451 HB3 TYR A 24 7.656 19.847 -20.652 1.00 0.00 H ATOM 452 HB2 TYR A 24 9.229 19.088 -20.314 1.00 0.00 H ATOM 453 HD2 TYR A 24 9.396 17.204 -18.746 1.00 0.00 H ATOM 454 HE2 TYR A 24 8.403 15.929 -16.884 1.00 0.00 H ATOM 455 HE1 TYR A 24 4.534 17.505 -17.871 1.00 0.00 H ATOM 456 HD1 TYR A 24 5.543 18.798 -19.738 1.00 0.00 H ATOM 457 HH TYR A 24 4.887 16.074 -16.184 1.00 0.00 H ATOM 458 H TYR A 24 9.778 16.859 -21.364 1.00 0.00 H ATOM 459 N GLY A 25 9.338 18.461 -23.974 1.00 56.60 N ATOM 460 CA GLY A 25 9.642 19.114 -25.244 1.00 60.98 C ATOM 461 C GLY A 25 10.692 20.213 -25.126 1.00 59.51 C ATOM 462 O GLY A 25 10.740 21.123 -25.940 1.00 64.28 O ATOM 463 HA3 GLY A 25 8.724 19.554 -25.635 1.00 0.00 H ATOM 464 HA2 GLY A 25 10.008 18.360 -25.941 1.00 0.00 H ATOM 465 H GLY A 25 9.798 17.556 -23.748 1.00 0.00 H ATOM 466 N GLU A 26 11.570 20.138 -24.133 1.00 51.11 N ATOM 467 CA GLU A 26 12.601 21.170 -23.994 1.00 52.34 C ATOM 468 C GLU A 26 13.983 20.574 -24.186 1.00 52.41 C ATOM 469 O GLU A 26 14.225 19.452 -23.788 1.00 52.43 O ATOM 470 CB GLU A 26 12.493 21.835 -22.613 1.00 54.83 C ATOM 471 CG GLU A 26 11.092 22.347 -22.342 1.00 65.05 C ATOM 472 CD GLU A 26 11.059 23.488 -21.375 1.00 73.57 C ATOM 473 OE1 GLU A 26 12.130 23.856 -20.855 1.00 74.72 O ATOM 474 OE2 GLU A 26 9.960 24.028 -21.133 1.00 79.39 O ATOM 475 HA GLU A 26 12.445 21.925 -24.764 1.00 0.00 H ATOM 476 HB2 GLU A 26 12.756 21.105 -21.848 1.00 0.00 H ATOM 477 HB3 GLU A 26 13.190 22.672 -22.569 1.00 0.00 H ATOM 478 HG2 GLU A 26 10.655 22.678 -23.284 1.00 0.00 H ATOM 479 HG3 GLU A 26 10.497 21.530 -21.935 1.00 0.00 H ATOM 480 H GLU A 26 11.526 19.350 -23.456 1.00 0.00 H ATOM 481 N ASP A 27 14.915 21.325 -24.772 1.00 53.14 N ATOM 482 CA ASP A 27 16.194 20.732 -25.149 1.00 49.19 C ATOM 483 C ASP A 27 17.274 21.129 -24.163 1.00 47.10 C ATOM 484 O ASP A 27 17.555 22.320 -24.023 1.00 48.42 O ATOM 485 CB ASP A 27 16.568 21.182 -26.577 1.00 53.63 C ATOM 486 CG ASP A 27 17.777 20.428 -27.139 1.00 57.11 C ATOM 487 OD1 ASP A 27 18.696 20.026 -26.390 1.00 53.06 O ATOM 488 OD2 ASP A 27 17.827 20.242 -28.360 1.00 65.49 O ATOM 489 HA ASP A 27 16.105 19.646 -25.131 1.00 0.00 H ATOM 490 HB2 ASP A 27 15.714 21.009 -27.232 1.00 0.00 H ATOM 491 HB3 ASP A 27 16.800 22.247 -26.558 1.00 0.00 H ATOM 492 H ASP A 27 14.731 22.331 -24.960 1.00 0.00 H ATOM 493 N PRO A 28 17.898 20.139 -23.487 1.00 46.09 N ATOM 494 CA PRO A 28 18.916 20.434 -22.486 1.00 45.70 C ATOM 495 C PRO A 28 20.139 21.116 -23.069 1.00 48.12 C ATOM 496 O PRO A 28 20.896 21.673 -22.274 1.00 46.81 O ATOM 497 CB PRO A 28 19.308 19.053 -21.948 1.00 45.65 C ATOM 498 CG PRO A 28 18.828 18.102 -22.899 1.00 48.84 C ATOM 499 CD PRO A 28 17.679 18.690 -23.618 1.00 49.16 C ATOM 500 HA PRO A 28 18.534 21.120 -21.730 1.00 0.00 H ATOM 501 HD3 PRO A 28 17.679 18.389 -24.666 1.00 0.00 H ATOM 502 HD2 PRO A 28 16.737 18.395 -23.156 1.00 0.00 H ATOM 503 HG3 PRO A 28 18.513 17.194 -22.384 1.00 0.00 H ATOM 504 HG2 PRO A 28 19.620 17.860 -23.608 1.00 0.00 H ATOM 505 HB2 PRO A 28 20.391 18.978 -21.853 1.00 0.00 H ATOM 506 HB3 PRO A 28 18.846 18.881 -20.976 1.00 0.00 H ATOM 507 N LYS A 29 20.339 21.028 -24.383 1.00 50.51 N ATOM 508 CA LYS A 29 21.483 21.686 -25.035 1.00 54.56 C ATOM 509 C LYS A 29 21.209 23.159 -25.282 1.00 54.70 C ATOM 510 O LYS A 29 22.115 23.952 -25.517 1.00 59.03 O ATOM 511 CB LYS A 29 21.764 21.022 -26.358 1.00 63.68 C ATOM 512 CG LYS A 29 22.166 19.595 -26.253 1.00 71.37 C ATOM 513 CD LYS A 29 23.572 19.487 -25.722 1.00 75.45 C ATOM 514 CE LYS A 29 24.024 18.045 -25.701 1.00 77.38 C ATOM 515 NZ LYS A 29 23.746 17.356 -26.996 1.00 80.57 N ATOM 516 HA LYS A 29 22.341 21.594 -24.370 1.00 0.00 H ATOM 517 HB2 LYS A 29 20.862 21.079 -26.967 1.00 0.00 H ATOM 518 HB3 LYS A 29 22.569 21.568 -26.850 1.00 0.00 H ATOM 519 HG2 LYS A 29 21.485 19.078 -25.577 1.00 0.00 H ATOM 520 HG3 LYS A 29 22.117 19.134 -27.239 1.00 0.00 H ATOM 521 HD2 LYS A 29 24.242 20.063 -26.361 1.00 0.00 H ATOM 522 HD3 LYS A 29 23.604 19.888 -24.709 1.00 0.00 H ATOM 523 HE2 LYS A 29 23.497 17.522 -24.903 1.00 0.00 H ATOM 524 HE3 LYS A 29 25.096 18.014 -25.508 1.00 0.00 H ATOM 525 HZ1 LYS A 29 22.723 17.375 -27.185 1.00 0.00 H ATOM 526 HZ2 LYS A 29 24.250 17.845 -27.763 1.00 0.00 H ATOM 527 HZ3 LYS A 29 24.071 16.370 -26.939 1.00 0.00 H ATOM 528 H LYS A 29 19.671 20.481 -24.962 1.00 0.00 H ATOM 529 N ILE A 30 19.944 23.525 -25.210 1.00 52.91 N ATOM 530 CA ILE A 30 19.499 24.902 -25.391 1.00 52.84 C ATOM 531 C ILE A 30 19.116 25.546 -24.046 1.00 50.79 C ATOM 532 O ILE A 30 19.622 26.648 -23.720 1.00 53.21 O ATOM 533 CB ILE A 30 18.431 24.990 -26.448 1.00 56.03 C ATOM 534 CG1 ILE A 30 19.116 24.698 -27.782 1.00 59.77 C ATOM 535 CG2 ILE A 30 17.791 26.380 -26.472 1.00 57.57 C ATOM 536 CD1 ILE A 30 18.250 24.817 -28.972 1.00 65.05 C ATOM 537 HA ILE A 30 20.331 25.497 -25.767 1.00 0.00 H ATOM 538 HB ILE A 30 17.631 24.278 -26.246 1.00 0.00 H ATOM 539 HG12 ILE A 30 19.945 25.397 -27.896 1.00 0.00 H ATOM 540 HG13 ILE A 30 19.503 23.680 -27.747 1.00 0.00 H ATOM 541 HD11 ILE A 30 17.421 24.115 -28.888 1.00 0.00 H ATOM 542 HD12 ILE A 30 17.862 25.834 -29.037 1.00 0.00 H ATOM 543 HD13 ILE A 30 18.830 24.590 -29.866 1.00 0.00 H ATOM 544 HG21 ILE A 30 17.340 26.588 -25.502 1.00 0.00 H ATOM 545 HG22 ILE A 30 18.556 27.127 -26.686 1.00 0.00 H ATOM 546 HG23 ILE A 30 17.024 26.412 -27.246 1.00 0.00 H ATOM 547 H ILE A 30 19.229 22.796 -25.015 1.00 0.00 H ATOM 548 N GLU A 31 18.227 24.907 -23.278 1.00 44.82 N ATOM 549 CA GLU A 31 17.839 25.499 -22.009 1.00 43.65 C ATOM 550 C GLU A 31 18.791 24.914 -20.954 1.00 40.91 C ATOM 551 O GLU A 31 18.446 24.068 -20.146 1.00 37.05 O ATOM 552 CB GLU A 31 16.397 25.057 -21.675 1.00 45.84 C ATOM 553 CG GLU A 31 15.312 25.585 -22.603 1.00 56.58 C ATOM 554 CD GLU A 31 15.157 27.081 -22.491 1.00 63.70 C ATOM 555 OE1 GLU A 31 15.552 27.659 -21.443 1.00 62.73 O ATOM 556 OE2 GLU A 31 14.653 27.683 -23.452 1.00 69.88 O ATOM 557 HA GLU A 31 17.887 26.588 -22.039 1.00 0.00 H ATOM 558 HB2 GLU A 31 16.365 23.968 -21.707 1.00 0.00 H ATOM 559 HB3 GLU A 31 16.168 25.396 -20.665 1.00 0.00 H ATOM 560 HG2 GLU A 31 15.573 25.333 -23.631 1.00 0.00 H ATOM 561 HG3 GLU A 31 14.365 25.112 -22.344 1.00 0.00 H ATOM 562 H GLU A 31 17.820 24.000 -23.584 1.00 0.00 H ATOM 563 N THR A 32 19.958 25.521 -20.869 1.00 43.13 N ATOM 564 CA THR A 32 21.052 24.908 -20.134 1.00 44.24 C ATOM 565 C THR A 32 20.991 25.278 -18.675 1.00 40.27 C ATOM 566 O THR A 32 21.234 24.437 -17.818 1.00 38.50 O ATOM 567 CB THR A 32 22.382 25.272 -20.751 1.00 48.35 C ATOM 568 OG1 THR A 32 22.567 26.678 -20.609 1.00 48.02 O ATOM 569 CG2 THR A 32 22.355 24.926 -22.223 1.00 52.25 C ATOM 570 HA THR A 32 20.948 23.825 -20.199 1.00 0.00 H ATOM 571 HB THR A 32 23.190 24.728 -20.262 1.00 0.00 H ATOM 572 HG1 THR A 32 23.435 26.937 -21.008 1.00 0.00 H ATOM 573 HG23 THR A 32 22.214 23.852 -22.340 1.00 0.00 H ATOM 574 HG21 THR A 32 21.533 25.456 -22.705 1.00 0.00 H ATOM 575 HG22 THR A 32 23.298 25.222 -22.682 1.00 0.00 H ATOM 576 H THR A 32 20.097 26.443 -21.330 1.00 0.00 H ATOM 577 N ASN A 33 20.642 26.532 -18.397 1.00 39.99 N ATOM 578 CA ASN A 33 20.446 26.960 -17.028 1.00 40.96 C ATOM 579 C ASN A 33 19.280 26.134 -16.469 1.00 37.96 C ATOM 580 O ASN A 33 19.308 25.683 -15.325 1.00 37.08 O ATOM 581 CB ASN A 33 20.162 28.470 -16.915 1.00 44.42 C ATOM 582 CG ASN A 33 21.404 29.339 -17.148 1.00 49.18 C ATOM 583 OD1 ASN A 33 22.535 28.913 -16.919 1.00 48.12 O ATOM 584 ND2 ASN A 33 21.185 30.555 -17.650 1.00 54.68 N ATOM 585 HA ASN A 33 21.358 26.795 -16.455 1.00 0.00 H ATOM 586 HB2 ASN A 33 19.408 28.737 -17.656 1.00 0.00 H ATOM 587 HB3 ASN A 33 19.777 28.676 -15.916 1.00 0.00 H ATOM 588 HD22 ASN A 33 20.212 30.876 -17.829 1.00 0.00 H ATOM 589 HD21 ASN A 33 21.987 31.182 -17.863 1.00 0.00 H ATOM 590 H ASN A 33 20.509 27.212 -19.172 1.00 0.00 H ATOM 591 N LYS A 34 18.271 25.886 -17.294 1.00 36.82 N ATOM 592 CA LYS A 34 17.135 25.100 -16.805 1.00 34.59 C ATOM 593 C LYS A 34 17.528 23.645 -16.504 1.00 32.72 C ATOM 594 O LYS A 34 17.087 23.049 -15.500 1.00 30.97 O ATOM 595 CB LYS A 34 15.997 25.095 -17.819 1.00 38.89 C ATOM 596 CG LYS A 34 14.693 24.710 -17.178 1.00 43.41 C ATOM 597 CD LYS A 34 13.577 24.579 -18.170 1.00 50.80 C ATOM 598 CE LYS A 34 12.975 25.918 -18.508 1.00 58.98 C ATOM 599 NZ LYS A 34 11.594 25.676 -18.997 1.00 65.16 N ATOM 600 HA LYS A 34 16.808 25.576 -15.881 1.00 0.00 H ATOM 601 HB2 LYS A 34 15.900 26.092 -18.249 1.00 0.00 H ATOM 602 HB3 LYS A 34 16.229 24.381 -18.609 1.00 0.00 H ATOM 603 HG2 LYS A 34 14.823 23.754 -16.670 1.00 0.00 H ATOM 604 HG3 LYS A 34 14.424 25.474 -16.449 1.00 0.00 H ATOM 605 HD2 LYS A 34 13.965 24.125 -19.082 1.00 0.00 H ATOM 606 HD3 LYS A 34 12.802 23.939 -17.749 1.00 0.00 H ATOM 607 HE2 LYS A 34 13.565 26.406 -19.284 1.00 0.00 H ATOM 608 HE3 LYS A 34 12.950 26.550 -17.620 1.00 0.00 H ATOM 609 HZ1 LYS A 34 11.628 25.069 -19.841 1.00 0.00 H ATOM 610 HZ2 LYS A 34 11.041 25.206 -18.252 1.00 0.00 H ATOM 611 HZ3 LYS A 34 11.149 26.584 -19.240 1.00 0.00 H ATOM 612 H LYS A 34 18.286 26.243 -18.271 1.00 0.00 H ATOM 613 N PHE A 35 18.333 23.080 -17.395 1.00 33.20 N ATOM 614 CA PHE A 35 18.906 21.757 -17.211 1.00 33.33 C ATOM 615 C PHE A 35 19.627 21.641 -15.853 1.00 32.50 C ATOM 616 O PHE A 35 19.397 20.703 -15.087 1.00 31.17 O ATOM 617 CB PHE A 35 19.868 21.560 -18.352 1.00 35.55 C ATOM 618 CG PHE A 35 20.472 20.201 -18.464 1.00 35.88 C ATOM 619 CD1 PHE A 35 19.823 19.059 -18.016 1.00 34.68 C ATOM 620 CD2 PHE A 35 21.696 20.068 -19.073 1.00 40.69 C ATOM 621 CE1 PHE A 35 20.415 17.811 -18.180 1.00 38.48 C ATOM 622 CE2 PHE A 35 22.279 18.826 -19.263 1.00 45.40 C ATOM 623 CZ PHE A 35 21.646 17.702 -18.801 1.00 44.26 C ATOM 624 HA PHE A 35 18.131 20.991 -17.207 1.00 0.00 H ATOM 625 HB2 PHE A 35 19.334 21.767 -19.280 1.00 0.00 H ATOM 626 HB3 PHE A 35 20.679 22.278 -18.234 1.00 0.00 H ATOM 627 HD2 PHE A 35 22.221 20.960 -19.415 1.00 0.00 H ATOM 628 HE2 PHE A 35 23.236 18.743 -19.777 1.00 0.00 H ATOM 629 HZ PHE A 35 22.112 16.724 -18.923 1.00 0.00 H ATOM 630 HE1 PHE A 35 19.908 16.917 -17.818 1.00 0.00 H ATOM 631 HD1 PHE A 35 18.848 19.140 -17.535 1.00 0.00 H ATOM 632 H PHE A 35 18.564 23.606 -18.262 1.00 0.00 H ATOM 633 N ALA A 36 20.522 22.600 -15.565 1.00 32.62 N ATOM 634 CA ALA A 36 21.181 22.642 -14.257 1.00 30.30 C ATOM 635 C ALA A 36 20.233 22.787 -13.074 1.00 28.45 C ATOM 636 O ALA A 36 20.441 22.154 -12.035 1.00 27.37 O ATOM 637 CB ALA A 36 22.266 23.730 -14.243 1.00 31.34 C ATOM 638 HA ALA A 36 21.643 21.664 -14.122 1.00 0.00 H ATOM 639 HB1 ALA A 36 23.009 23.511 -15.010 1.00 0.00 H ATOM 640 HB2 ALA A 36 21.810 24.699 -14.444 1.00 0.00 H ATOM 641 HB3 ALA A 36 22.747 23.749 -13.265 1.00 0.00 H ATOM 642 H ALA A 36 20.750 23.321 -16.279 1.00 0.00 H ATOM 643 N ALA A 37 19.172 23.571 -13.218 1.00 28.41 N ATOM 644 CA ALA A 37 18.210 23.757 -12.154 1.00 29.28 C ATOM 645 C ALA A 37 17.473 22.441 -11.903 1.00 29.85 C ATOM 646 O ALA A 37 17.187 22.074 -10.755 1.00 27.11 O ATOM 647 CB ALA A 37 17.203 24.830 -12.535 1.00 31.77 C ATOM 648 HA ALA A 37 18.736 24.068 -11.252 1.00 0.00 H ATOM 649 HB1 ALA A 37 17.725 25.770 -12.712 1.00 0.00 H ATOM 650 HB2 ALA A 37 16.678 24.528 -13.441 1.00 0.00 H ATOM 651 HB3 ALA A 37 16.486 24.958 -11.724 1.00 0.00 H ATOM 652 H ALA A 37 19.028 24.066 -14.121 1.00 0.00 H ATOM 653 N ILE A 38 17.163 21.735 -12.981 1.00 30.32 N ATOM 654 CA ILE A 38 16.406 20.479 -12.892 1.00 28.74 C ATOM 655 C ILE A 38 17.248 19.420 -12.197 1.00 27.39 C ATOM 656 O ILE A 38 16.754 18.703 -11.304 1.00 26.78 O ATOM 657 CB ILE A 38 15.955 19.999 -14.277 1.00 30.26 C ATOM 658 CG1 ILE A 38 14.839 20.927 -14.800 1.00 32.01 C ATOM 659 CG2 ILE A 38 15.486 18.552 -14.263 1.00 29.63 C ATOM 660 CD1 ILE A 38 14.557 20.747 -16.284 1.00 35.76 C ATOM 661 HA ILE A 38 15.506 20.658 -12.303 1.00 0.00 H ATOM 662 HB ILE A 38 16.815 20.042 -14.945 1.00 0.00 H ATOM 663 HG12 ILE A 38 13.925 20.717 -14.245 1.00 0.00 H ATOM 664 HG13 ILE A 38 15.138 21.961 -14.627 1.00 0.00 H ATOM 665 HD11 ILE A 38 15.461 20.964 -16.853 1.00 0.00 H ATOM 666 HD12 ILE A 38 14.246 19.719 -16.471 1.00 0.00 H ATOM 667 HD13 ILE A 38 13.762 21.429 -16.587 1.00 0.00 H ATOM 668 HG21 ILE A 38 16.302 17.910 -13.932 1.00 0.00 H ATOM 669 HG22 ILE A 38 14.643 18.451 -13.579 1.00 0.00 H ATOM 670 HG23 ILE A 38 15.178 18.262 -15.267 1.00 0.00 H ATOM 671 H ILE A 38 17.464 22.079 -13.915 1.00 0.00 H ATOM 672 N CYS A 39 18.517 19.339 -12.584 1.00 24.86 N ATOM 673 CA CYS A 39 19.450 18.433 -11.939 1.00 26.11 C ATOM 674 C CYS A 39 19.607 18.748 -10.450 1.00 27.09 C ATOM 675 O CYS A 39 19.648 17.840 -9.599 1.00 26.92 O ATOM 676 CB CYS A 39 20.829 18.512 -12.570 1.00 26.42 C ATOM 677 SG CYS A 39 20.913 17.719 -14.205 1.00 31.93 S ATOM 678 HA CYS A 39 19.033 17.434 -12.067 1.00 0.00 H ATOM 679 HB2 CYS A 39 21.542 18.020 -11.909 1.00 0.00 H ATOM 680 HB3 CYS A 39 21.101 19.562 -12.679 1.00 0.00 H ATOM 681 HG CYS A 39 20.025 18.338 -15.061 1.00 0.00 H ATOM 682 H CYS A 39 18.849 19.938 -13.367 1.00 0.00 H ATOM 683 N THR A 40 19.754 20.034 -10.151 1.00 27.98 N ATOM 684 CA THR A 40 19.888 20.487 -8.774 1.00 28.30 C ATOM 685 C THR A 40 18.687 20.099 -7.906 1.00 27.62 C ATOM 686 O THR A 40 18.881 19.499 -6.828 1.00 26.63 O ATOM 687 CB THR A 40 20.113 21.969 -8.714 1.00 29.61 C ATOM 688 OG1 THR A 40 21.337 22.285 -9.403 1.00 29.75 O ATOM 689 CG2 THR A 40 20.246 22.457 -7.254 1.00 31.04 C ATOM 690 HA THR A 40 20.761 19.978 -8.366 1.00 0.00 H ATOM 691 HB THR A 40 19.258 22.461 -9.178 1.00 0.00 H ATOM 692 HG1 THR A 40 21.267 21.995 -10.347 1.00 0.00 H ATOM 693 HG23 THR A 40 19.329 22.228 -6.711 1.00 0.00 H ATOM 694 HG21 THR A 40 21.087 21.952 -6.779 1.00 0.00 H ATOM 695 HG22 THR A 40 20.415 23.534 -7.246 1.00 0.00 H ATOM 696 H THR A 40 19.774 20.734 -10.920 1.00 0.00 H ATOM 697 N HIS A 41 17.480 20.370 -8.401 1.00 26.13 N ATOM 698 CA HIS A 41 16.249 20.043 -7.706 1.00 26.18 C ATOM 699 C HIS A 41 16.087 18.529 -7.524 1.00 26.01 C ATOM 700 O HIS A 41 15.718 18.073 -6.425 1.00 26.38 O ATOM 701 CB HIS A 41 15.063 20.703 -8.409 1.00 28.80 C ATOM 702 CG HIS A 41 13.708 20.288 -7.902 1.00 27.69 C ATOM 703 ND1 HIS A 41 13.067 19.162 -8.373 1.00 26.97 N ATOM 704 CD2 HIS A 41 12.860 20.848 -7.006 1.00 28.03 C ATOM 705 CE1 HIS A 41 11.884 19.047 -7.795 1.00 28.99 C ATOM 706 NE2 HIS A 41 11.719 20.066 -6.974 1.00 27.34 N ATOM 707 HA HIS A 41 16.290 20.450 -6.696 1.00 0.00 H ATOM 708 HB2 HIS A 41 15.154 21.782 -8.285 1.00 0.00 H ATOM 709 HB3 HIS A 41 15.118 20.455 -9.469 1.00 0.00 H ATOM 710 HD2 HIS A 41 13.043 21.748 -6.419 1.00 0.00 H ATOM 711 HE1 HIS A 41 11.166 18.245 -7.968 1.00 0.00 H ATOM 712 H HIS A 41 17.417 20.837 -9.328 1.00 0.00 H ATOM 713 N LEU A 42 16.417 17.732 -8.551 1.00 25.02 N ATOM 714 CA LEU A 42 16.354 16.289 -8.433 1.00 26.98 C ATOM 715 C LEU A 42 17.307 15.796 -7.339 1.00 27.37 C ATOM 716 O LEU A 42 16.973 14.920 -6.515 1.00 26.18 O ATOM 717 CB LEU A 42 16.702 15.629 -9.754 1.00 33.15 C ATOM 718 CG LEU A 42 16.260 14.196 -9.995 1.00 42.29 C ATOM 719 CD1 LEU A 42 14.798 13.965 -9.698 1.00 47.02 C ATOM 720 CD2 LEU A 42 16.569 13.802 -11.446 1.00 44.63 C ATOM 721 HA LEU A 42 15.334 16.017 -8.161 1.00 0.00 H ATOM 722 HB2 LEU A 42 16.260 16.238 -10.543 1.00 0.00 H ATOM 723 HB3 LEU A 42 17.788 15.649 -9.846 1.00 0.00 H ATOM 724 HG LEU A 42 16.820 13.568 -9.301 1.00 0.00 H ATOM 725 HD21 LEU A 42 16.033 14.467 -12.124 1.00 0.00 H ATOM 726 HD22 LEU A 42 17.641 13.887 -11.624 1.00 0.00 H ATOM 727 HD23 LEU A 42 16.251 12.774 -11.617 1.00 0.00 H ATOM 728 HD11 LEU A 42 14.600 14.199 -8.652 1.00 0.00 H ATOM 729 HD12 LEU A 42 14.193 14.608 -10.337 1.00 0.00 H ATOM 730 HD13 LEU A 42 14.550 12.921 -9.891 1.00 0.00 H ATOM 731 H LEU A 42 16.724 18.158 -9.449 1.00 0.00 H ATOM 732 N GLU A 43 18.514 16.338 -7.348 1.00 25.92 N ATOM 733 CA GLU A 43 19.497 15.913 -6.395 1.00 26.27 C ATOM 734 C GLU A 43 19.026 16.243 -4.946 1.00 28.32 C ATOM 735 O GLU A 43 19.235 15.447 -4.015 1.00 26.58 O ATOM 736 CB GLU A 43 20.833 16.575 -6.661 1.00 29.20 C ATOM 737 CG GLU A 43 21.934 15.946 -5.840 1.00 35.64 C ATOM 738 CD GLU A 43 23.295 16.504 -6.139 1.00 45.29 C ATOM 739 OE1 GLU A 43 23.415 17.736 -6.263 1.00 43.70 O ATOM 740 OE2 GLU A 43 24.256 15.716 -6.210 1.00 54.89 O ATOM 741 HA GLU A 43 19.618 14.834 -6.497 1.00 0.00 H ATOM 742 HB2 GLU A 43 21.076 16.472 -7.719 1.00 0.00 H ATOM 743 HB3 GLU A 43 20.762 17.633 -6.408 1.00 0.00 H ATOM 744 HG2 GLU A 43 21.716 16.112 -4.785 1.00 0.00 H ATOM 745 HG3 GLU A 43 21.947 14.875 -6.043 1.00 0.00 H ATOM 746 H GLU A 43 18.749 17.072 -8.046 1.00 0.00 H ATOM 747 N VAL A 44 18.401 17.416 -4.786 1.00 26.36 N ATOM 748 CA VAL A 44 17.883 17.813 -3.485 1.00 25.51 C ATOM 749 C VAL A 44 16.804 16.815 -3.049 1.00 24.45 C ATOM 750 O VAL A 44 16.785 16.388 -1.859 1.00 25.91 O ATOM 751 CB VAL A 44 17.386 19.264 -3.478 1.00 24.25 C ATOM 752 CG1 VAL A 44 16.658 19.575 -2.196 1.00 28.19 C ATOM 753 CG2 VAL A 44 18.597 20.177 -3.586 1.00 26.15 C ATOM 754 HA VAL A 44 18.693 17.786 -2.756 1.00 0.00 H ATOM 755 HB VAL A 44 16.700 19.414 -4.312 1.00 0.00 H ATOM 756 HG11 VAL A 44 15.801 18.909 -2.096 1.00 0.00 H ATOM 757 HG12 VAL A 44 17.333 19.430 -1.352 1.00 0.00 H ATOM 758 HG13 VAL A 44 16.316 20.610 -2.216 1.00 0.00 H ATOM 759 HG21 VAL A 44 19.259 20.002 -2.738 1.00 0.00 H ATOM 760 HG22 VAL A 44 19.128 19.965 -4.514 1.00 0.00 H ATOM 761 HG23 VAL A 44 18.268 21.216 -3.583 1.00 0.00 H ATOM 762 H VAL A 44 18.284 18.051 -5.601 1.00 0.00 H ATOM 763 N CYS A 45 15.937 16.426 -3.970 1.00 23.68 N ATOM 764 CA CYS A 45 14.896 15.443 -3.661 1.00 25.00 C ATOM 765 C CYS A 45 15.496 14.120 -3.189 1.00 26.83 C ATOM 766 O CYS A 45 15.037 13.548 -2.179 1.00 25.68 O ATOM 767 CB CYS A 45 13.992 15.193 -4.826 1.00 25.31 C ATOM 768 SG CYS A 45 12.907 16.593 -5.280 1.00 27.45 S ATOM 769 HA CYS A 45 14.304 15.873 -2.853 1.00 0.00 H ATOM 770 HB2 CYS A 45 13.359 14.339 -4.585 1.00 0.00 H ATOM 771 HB3 CYS A 45 14.612 14.952 -5.689 1.00 0.00 H ATOM 772 HG CYS A 45 13.683 17.686 -5.609 1.00 0.00 H ATOM 773 H CYS A 45 15.996 16.825 -4.929 1.00 0.00 H ATOM 774 N PHE A 46 16.505 13.628 -3.910 1.00 25.08 N ATOM 775 CA PHE A 46 17.197 12.422 -3.478 1.00 28.18 C ATOM 776 C PHE A 46 17.885 12.589 -2.106 1.00 29.62 C ATOM 777 O PHE A 46 17.836 11.676 -1.270 1.00 31.59 O ATOM 778 CB PHE A 46 18.188 11.932 -4.538 1.00 31.35 C ATOM 779 CG PHE A 46 17.515 11.258 -5.721 1.00 39.08 C ATOM 780 CD1 PHE A 46 17.096 9.958 -5.649 1.00 46.12 C ATOM 781 CD2 PHE A 46 17.305 11.927 -6.884 1.00 41.94 C ATOM 782 CE1 PHE A 46 16.474 9.351 -6.736 1.00 48.98 C ATOM 783 CE2 PHE A 46 16.693 11.290 -7.993 1.00 43.79 C ATOM 784 CZ PHE A 46 16.288 10.039 -7.903 1.00 45.94 C ATOM 785 HA PHE A 46 16.431 11.657 -3.354 1.00 0.00 H ATOM 786 HB2 PHE A 46 18.756 12.788 -4.904 1.00 0.00 H ATOM 787 HB3 PHE A 46 18.868 11.218 -4.073 1.00 0.00 H ATOM 788 HD2 PHE A 46 17.612 12.970 -6.966 1.00 0.00 H ATOM 789 HE2 PHE A 46 16.557 11.838 -8.925 1.00 0.00 H ATOM 790 HZ PHE A 46 15.808 9.556 -8.754 1.00 0.00 H ATOM 791 HE1 PHE A 46 16.132 8.319 -6.656 1.00 0.00 H ATOM 792 HD1 PHE A 46 17.251 9.392 -4.731 1.00 0.00 H ATOM 793 H PHE A 46 16.799 14.108 -4.785 1.00 0.00 H ATOM 794 N MET A 47 18.533 13.730 -1.890 1.00 28.41 N ATOM 795 CA MET A 47 19.284 13.961 -0.677 1.00 31.56 C ATOM 796 C MET A 47 18.343 14.074 0.530 1.00 29.92 C ATOM 797 O MET A 47 18.687 13.651 1.631 1.00 30.95 O ATOM 798 CB MET A 47 20.139 15.209 -0.802 1.00 33.10 C ATOM 799 CG MET A 47 21.347 15.016 -1.690 1.00 35.12 C ATOM 800 SD MET A 47 22.441 16.439 -1.680 1.00 34.97 S ATOM 801 CE MET A 47 23.007 16.422 -0.035 1.00 37.51 C ATOM 802 HA MET A 47 19.944 13.108 -0.520 1.00 0.00 H ATOM 803 HB2 MET A 47 19.527 16.009 -1.218 1.00 0.00 H ATOM 804 HB3 MET A 47 20.482 15.496 0.192 1.00 0.00 H ATOM 805 HG2 MET A 47 21.007 14.843 -2.711 1.00 0.00 H ATOM 806 HG3 MET A 47 21.902 14.145 -1.341 1.00 0.00 H ATOM 807 HE1 MET A 47 22.158 16.523 0.641 1.00 0.00 H ATOM 808 HE2 MET A 47 23.519 15.480 0.162 1.00 0.00 H ATOM 809 HE3 MET A 47 23.697 17.252 0.119 1.00 0.00 H ATOM 810 H MET A 47 18.498 14.476 -2.614 1.00 0.00 H ATOM 811 N TYR A 48 17.160 14.620 0.278 1.00 27.32 N ATOM 812 CA TYR A 48 16.120 14.757 1.296 1.00 27.93 C ATOM 813 C TYR A 48 15.728 13.377 1.831 1.00 28.75 C ATOM 814 O TYR A 48 15.505 13.205 3.020 1.00 30.22 O ATOM 815 CB TYR A 48 14.923 15.498 0.689 1.00 27.48 C ATOM 816 CG TYR A 48 13.998 16.212 1.685 1.00 28.37 C ATOM 817 CD1 TYR A 48 12.977 15.531 2.349 1.00 28.18 C ATOM 818 CD2 TYR A 48 14.130 17.573 1.929 1.00 28.45 C ATOM 819 CE1 TYR A 48 12.144 16.187 3.223 1.00 28.75 C ATOM 820 CE2 TYR A 48 13.291 18.236 2.795 1.00 28.73 C ATOM 821 CZ TYR A 48 12.282 17.537 3.419 1.00 28.69 C ATOM 822 OH TYR A 48 11.468 18.215 4.266 1.00 30.51 O ATOM 823 HA TYR A 48 16.490 15.339 2.140 1.00 0.00 H ATOM 824 HB3 TYR A 48 14.324 14.772 0.139 1.00 0.00 H ATOM 825 HB2 TYR A 48 15.310 16.246 -0.003 1.00 0.00 H ATOM 826 HD2 TYR A 48 14.918 18.130 1.422 1.00 0.00 H ATOM 827 HE2 TYR A 48 13.423 19.301 2.985 1.00 0.00 H ATOM 828 HE1 TYR A 48 11.374 15.634 3.760 1.00 0.00 H ATOM 829 HD1 TYR A 48 12.838 14.464 2.172 1.00 0.00 H ATOM 830 HH TYR A 48 11.012 18.942 3.772 1.00 0.00 H ATOM 831 H TYR A 48 16.965 14.965 -0.684 1.00 0.00 H ATOM 832 N SER A 49 15.614 12.387 0.948 1.00 28.36 N ATOM 833 CA SER A 49 15.162 11.075 1.348 1.00 33.44 C ATOM 834 C SER A 49 16.276 10.153 1.739 1.00 34.33 C ATOM 835 O SER A 49 16.034 9.163 2.422 1.00 36.60 O ATOM 836 CB SER A 49 14.410 10.420 0.195 1.00 41.98 C ATOM 837 OG SER A 49 15.139 10.625 -0.990 1.00 50.27 O ATOM 838 HA SER A 49 14.526 11.229 2.220 1.00 0.00 H ATOM 839 HB2 SER A 49 13.421 10.868 0.100 1.00 0.00 H ATOM 840 HB3 SER A 49 14.307 9.351 0.383 1.00 0.00 H ATOM 841 HG SER A 49 16.037 10.218 -0.898 1.00 0.00 H ATOM 842 H SER A 49 15.855 12.562 -0.048 1.00 0.00 H ATOM 843 N ASP A 50 17.504 10.481 1.362 1.00 34.80 N ATOM 844 CA ASP A 50 18.645 9.623 1.708 1.00 38.61 C ATOM 845 C ASP A 50 18.770 9.332 3.192 1.00 40.02 C ATOM 846 O ASP A 50 18.744 10.260 4.004 1.00 39.95 O ATOM 847 CB ASP A 50 19.963 10.291 1.307 1.00 43.24 C ATOM 848 CG ASP A 50 20.328 10.078 -0.149 1.00 48.74 C ATOM 849 OD1 ASP A 50 19.753 9.167 -0.811 1.00 52.28 O ATOM 850 OD2 ASP A 50 21.215 10.837 -0.616 1.00 49.78 O ATOM 851 HA ASP A 50 18.458 8.694 1.169 1.00 0.00 H ATOM 852 HB2 ASP A 50 19.877 11.362 1.489 1.00 0.00 H ATOM 853 HB3 ASP A 50 20.761 9.882 1.927 1.00 0.00 H ATOM 854 H ASP A 50 17.661 11.353 0.817 1.00 0.00 H ATOM 855 N PHE A 51 18.977 8.052 3.514 1.00 43.03 N ATOM 856 CA PHE A 51 19.368 7.586 4.841 1.00 46.93 C ATOM 857 C PHE A 51 18.208 7.483 5.808 1.00 44.22 C ATOM 858 O PHE A 51 18.407 7.033 6.922 1.00 47.48 O ATOM 859 CB PHE A 51 20.450 8.478 5.462 1.00 51.75 C ATOM 860 CG PHE A 51 21.630 8.708 4.571 1.00 56.47 C ATOM 861 CD1 PHE A 51 22.207 7.656 3.880 1.00 62.44 C ATOM 862 CD2 PHE A 51 22.161 9.984 4.409 1.00 56.10 C ATOM 863 CE1 PHE A 51 23.298 7.864 3.058 1.00 65.35 C ATOM 864 CE2 PHE A 51 23.253 10.195 3.591 1.00 58.58 C ATOM 865 CZ PHE A 51 23.816 9.135 2.911 1.00 63.04 C ATOM 866 HA PHE A 51 19.764 6.583 4.679 1.00 0.00 H ATOM 867 HB2 PHE A 51 20.005 9.444 5.699 1.00 0.00 H ATOM 868 HB3 PHE A 51 20.800 8.006 6.380 1.00 0.00 H ATOM 869 HD2 PHE A 51 21.710 10.826 4.934 1.00 0.00 H ATOM 870 HE2 PHE A 51 23.669 11.197 3.483 1.00 0.00 H ATOM 871 HZ PHE A 51 24.672 9.301 2.256 1.00 0.00 H ATOM 872 HE1 PHE A 51 23.749 7.026 2.527 1.00 0.00 H ATOM 873 HD1 PHE A 51 21.796 6.652 3.986 1.00 0.00 H ATOM 874 H PHE A 51 18.851 7.339 2.768 1.00 0.00 H ATOM 875 N HIS A 52 17.002 7.893 5.405 1.00 38.52 N ATOM 876 CA HIS A 52 15.876 7.934 6.349 1.00 37.71 C ATOM 877 C HIS A 52 14.991 6.719 6.235 1.00 39.75 C ATOM 878 O HIS A 52 14.472 6.441 5.142 1.00 39.78 O ATOM 879 CB HIS A 52 15.054 9.187 6.103 1.00 35.13 C ATOM 880 CG HIS A 52 15.760 10.437 6.476 1.00 34.68 C ATOM 881 ND1 HIS A 52 15.841 10.874 7.777 1.00 39.02 N ATOM 882 CD2 HIS A 52 16.428 11.350 5.730 1.00 35.75 C ATOM 883 CE1 HIS A 52 16.550 11.989 7.822 1.00 40.53 C ATOM 884 NE2 HIS A 52 16.914 12.301 6.594 1.00 38.51 N ATOM 885 HA HIS A 52 16.291 7.944 7.357 1.00 0.00 H ATOM 886 HB2 HIS A 52 14.804 9.234 5.043 1.00 0.00 H ATOM 887 HB3 HIS A 52 14.137 9.120 6.689 1.00 0.00 H ATOM 888 HD2 HIS A 52 16.556 11.333 4.648 1.00 0.00 H ATOM 889 HE1 HIS A 52 16.792 12.554 8.722 1.00 0.00 H ATOM 890 H HIS A 52 16.859 8.185 4.417 1.00 0.00 H ATOM 891 N PHE A 53 14.788 6.025 7.348 1.00 41.88 N ATOM 892 CA PHE A 53 13.982 4.818 7.385 1.00 45.21 C ATOM 893 C PHE A 53 12.992 4.879 8.508 1.00 49.27 C ATOM 894 O PHE A 53 13.069 5.739 9.401 1.00 50.55 O ATOM 895 CB PHE A 53 14.843 3.550 7.545 1.00 47.75 C ATOM 896 CG PHE A 53 15.861 3.387 6.467 1.00 49.71 C ATOM 897 CD1 PHE A 53 17.038 4.124 6.492 1.00 51.39 C ATOM 898 CD2 PHE A 53 15.644 2.521 5.415 1.00 52.44 C ATOM 899 CE1 PHE A 53 17.976 3.992 5.499 1.00 54.19 C ATOM 900 CE2 PHE A 53 16.582 2.393 4.410 1.00 54.24 C ATOM 901 CZ PHE A 53 17.745 3.129 4.446 1.00 55.43 C ATOM 902 HA PHE A 53 13.459 4.761 6.430 1.00 0.00 H ATOM 903 HB2 PHE A 53 15.359 3.601 8.504 1.00 0.00 H ATOM 904 HB3 PHE A 53 14.185 2.681 7.534 1.00 0.00 H ATOM 905 HD2 PHE A 53 14.726 1.934 5.377 1.00 0.00 H ATOM 906 HE2 PHE A 53 16.401 1.706 3.584 1.00 0.00 H ATOM 907 HZ PHE A 53 18.480 3.031 3.647 1.00 0.00 H ATOM 908 HE1 PHE A 53 18.901 4.567 5.541 1.00 0.00 H ATOM 909 HD1 PHE A 53 17.219 4.818 7.313 1.00 0.00 H ATOM 910 H PHE A 53 15.225 6.360 8.231 1.00 0.00 H ATOM 911 N ILE A 54 12.058 3.948 8.463 1.00 54.56 N ATOM 912 CA ILE A 54 11.192 3.721 9.576 1.00 60.04 C ATOM 913 C ILE A 54 11.574 2.325 10.084 1.00 63.54 C ATOM 914 O ILE A 54 11.701 1.380 9.291 1.00 64.70 O ATOM 915 CB ILE A 54 9.732 3.862 9.172 1.00 61.75 C ATOM 916 CG1 ILE A 54 9.500 5.289 8.663 1.00 60.07 C ATOM 917 CG2 ILE A 54 8.863 3.575 10.364 1.00 65.33 C ATOM 918 CD1 ILE A 54 8.063 5.609 8.322 1.00 60.73 C ATOM 919 HA ILE A 54 11.308 4.456 10.372 1.00 0.00 H ATOM 920 HB ILE A 54 9.481 3.156 8.380 1.00 0.00 H ATOM 921 HG12 ILE A 54 9.829 5.984 9.436 1.00 0.00 H ATOM 922 HG13 ILE A 54 10.103 5.433 7.766 1.00 0.00 H ATOM 923 HD11 ILE A 54 7.717 4.933 7.540 1.00 0.00 H ATOM 924 HD12 ILE A 54 7.444 5.485 9.210 1.00 0.00 H ATOM 925 HD13 ILE A 54 7.995 6.639 7.971 1.00 0.00 H ATOM 926 HG21 ILE A 54 9.051 2.560 10.713 1.00 0.00 H ATOM 927 HG22 ILE A 54 9.094 4.283 11.160 1.00 0.00 H ATOM 928 HG23 ILE A 54 7.815 3.675 10.081 1.00 0.00 H ATOM 929 H ILE A 54 11.951 3.371 7.604 1.00 0.00 H ATOM 930 N ASP A 55 11.840 2.238 11.389 1.00 64.84 N ATOM 931 CA ASP A 55 12.514 1.070 11.973 1.00 70.29 C ATOM 932 C ASP A 55 11.593 -0.151 12.101 1.00 75.81 C ATOM 933 O ASP A 55 10.449 -0.123 11.636 1.00 69.62 O ATOM 934 CB ASP A 55 13.195 1.422 13.329 1.00 78.04 C ATOM 935 CG ASP A 55 12.214 1.940 14.389 1.00 80.29 C ATOM 936 OD1 ASP A 55 10.988 1.761 14.220 1.00 87.20 O ATOM 937 OD2 ASP A 55 12.674 2.527 15.397 1.00 75.83 O ATOM 938 HA ASP A 55 13.298 0.786 11.271 1.00 0.00 H ATOM 939 HB2 ASP A 55 13.679 0.525 13.715 1.00 0.00 H ATOM 940 HB3 ASP A 55 13.947 2.191 13.149 1.00 0.00 H ATOM 941 H ASP A 55 11.561 3.022 12.013 1.00 0.00 H ATOM 942 N GLU A 56 12.109 -1.212 12.732 1.00 90.84 N ATOM 943 CA GLU A 56 11.407 -2.490 12.843 1.00 99.50 C ATOM 944 C GLU A 56 10.290 -2.386 13.884 1.00100.22 C ATOM 945 O GLU A 56 9.366 -3.203 13.902 1.00102.48 O ATOM 946 CB GLU A 56 12.387 -3.608 13.224 1.00108.06 C ATOM 947 CG GLU A 56 13.749 -3.522 12.529 1.00108.90 C ATOM 948 CD GLU A 56 14.756 -4.508 13.094 1.00114.61 C ATOM 949 OE1 GLU A 56 14.348 -5.423 13.844 1.00115.19 O ATOM 950 OE2 GLU A 56 15.960 -4.357 12.791 1.00118.76 O ATOM 951 HA GLU A 56 10.966 -2.732 11.876 1.00 0.00 H ATOM 952 HB2 GLU A 56 12.551 -3.566 14.301 1.00 0.00 H ATOM 953 HB3 GLU A 56 11.932 -4.564 12.964 1.00 0.00 H ATOM 954 HG2 GLU A 56 13.614 -3.730 11.468 1.00 0.00 H ATOM 955 HG3 GLU A 56 14.141 -2.513 12.653 1.00 0.00 H ATOM 956 H GLU A 56 13.051 -1.124 13.163 1.00 0.00 H ATOM 957 N ARG A 57 10.401 -1.388 14.760 1.00 96.50 N ATOM 958 CA ARG A 57 9.308 -0.999 15.644 1.00 96.51 C ATOM 959 C ARG A 57 8.540 0.182 15.038 1.00 84.44 C ATOM 960 O ARG A 57 7.634 0.728 15.661 1.00 80.30 O ATOM 961 CB ARG A 57 9.829 -0.667 17.055 1.00104.74 C ATOM 962 CG ARG A 57 8.730 -0.648 18.150 1.00109.20 C ATOM 963 CD ARG A 57 9.187 -0.092 19.519 1.00112.42 C ATOM 964 NE ARG A 57 10.192 0.984 19.468 1.00110.89 N ATOM 965 CZ ARG A 57 10.101 2.122 18.769 1.00107.41 C ATOM 966 NH1 ARG A 57 9.047 2.387 17.998 1.00103.65 N ATOM 967 NH2 ARG A 57 11.097 3.000 18.829 1.00107.67 N ATOM 968 HA ARG A 57 8.622 -1.840 15.744 1.00 0.00 H ATOM 969 HB2 ARG A 57 10.573 -1.415 17.330 1.00 0.00 H ATOM 970 HB3 ARG A 57 10.298 0.316 17.024 1.00 0.00 H ATOM 971 HG2 ARG A 57 7.905 -0.032 17.792 1.00 0.00 H ATOM 972 HG3 ARG A 57 8.381 -1.670 18.298 1.00 0.00 H ATOM 973 HD2 ARG A 57 9.609 -0.918 20.092 1.00 0.00 H ATOM 974 HD3 ARG A 57 8.308 0.295 20.034 1.00 0.00 H ATOM 975 HE ARG A 57 11.056 0.846 20.030 1.00 0.00 H ATOM 976 HH12 ARG A 57 9.003 3.280 17.466 1.00 0.00 H ATOM 977 HH11 ARG A 57 8.268 1.701 17.928 1.00 0.00 H ATOM 978 HH22 ARG A 57 11.040 3.888 18.291 1.00 0.00 H ATOM 979 HH21 ARG A 57 11.933 2.799 19.414 1.00 0.00 H ATOM 980 H ARG A 57 11.300 -0.868 14.815 1.00 0.00 H ATOM 981 N GLY A 58 8.920 0.593 13.823 1.00 81.59 N ATOM 982 CA GLY A 58 8.132 1.542 13.068 1.00 81.14 C ATOM 983 C GLY A 58 8.197 3.010 13.466 1.00 89.55 C ATOM 984 O GLY A 58 7.156 3.662 13.577 1.00101.50 O ATOM 985 HA3 GLY A 58 7.090 1.232 13.146 1.00 0.00 H ATOM 986 HA2 GLY A 58 8.453 1.474 12.029 1.00 0.00 H ATOM 987 H GLY A 58 9.801 0.222 13.413 1.00 0.00 H ATOM 988 N GLU A 59 9.403 3.540 13.662 1.00 83.56 N ATOM 989 CA GLU A 59 9.594 4.956 13.970 1.00 79.40 C ATOM 990 C GLU A 59 10.831 5.426 13.200 1.00 69.31 C ATOM 991 O GLU A 59 11.552 4.595 12.659 1.00 66.37 O ATOM 992 CB GLU A 59 9.797 5.124 15.468 1.00 88.79 C ATOM 993 CG GLU A 59 9.716 6.552 15.968 1.00 94.45 C ATOM 994 CD GLU A 59 9.474 6.618 17.469 1.00103.67 C ATOM 995 OE1 GLU A 59 9.597 5.571 18.141 1.00107.82 O ATOM 996 OE2 GLU A 59 9.162 7.714 17.978 1.00106.03 O ATOM 997 HA GLU A 59 8.725 5.547 13.679 1.00 0.00 H ATOM 998 HB2 GLU A 59 9.031 4.542 15.981 1.00 0.00 H ATOM 999 HB3 GLU A 59 10.782 4.731 15.722 1.00 0.00 H ATOM 1000 HG2 GLU A 59 10.654 7.059 15.740 1.00 0.00 H ATOM 1001 HG3 GLU A 59 8.897 7.058 15.457 1.00 0.00 H ATOM 1002 H GLU A 59 10.239 2.924 13.593 1.00 0.00 H ATOM 1003 N SER A 60 11.120 6.725 13.217 1.00 68.36 N ATOM 1004 CA SER A 60 12.024 7.318 12.223 1.00 67.66 C ATOM 1005 C SER A 60 13.500 7.319 12.635 1.00 64.78 C ATOM 1006 O SER A 60 13.854 7.823 13.701 1.00 69.10 O ATOM 1007 CB SER A 60 11.571 8.739 11.903 1.00 73.45 C ATOM 1008 OG SER A 60 12.338 9.277 10.843 1.00 79.26 O ATOM 1009 HA SER A 60 11.963 6.683 11.339 1.00 0.00 H ATOM 1010 HB2 SER A 60 11.694 9.363 12.788 1.00 0.00 H ATOM 1011 HB3 SER A 60 10.520 8.724 11.614 1.00 0.00 H ATOM 1012 HG SER A 60 13.293 9.294 11.104 1.00 0.00 H ATOM 1013 H SER A 60 10.698 7.332 13.948 1.00 0.00 H ATOM 1014 N ILE A 61 14.355 6.758 11.782 1.00 55.19 N ATOM 1015 CA ILE A 61 15.779 6.625 12.080 1.00 53.31 C ATOM 1016 C ILE A 61 16.662 6.916 10.864 1.00 50.95 C ATOM 1017 O ILE A 61 16.198 6.958 9.719 1.00 47.88 O ATOM 1018 CB ILE A 61 16.131 5.231 12.609 1.00 56.52 C ATOM 1019 CG1 ILE A 61 15.819 4.155 11.569 1.00 60.03 C ATOM 1020 CG2 ILE A 61 15.391 4.958 13.915 1.00 60.69 C ATOM 1021 CD1 ILE A 61 16.678 2.926 11.733 1.00 69.61 C ATOM 1022 HA ILE A 61 15.978 7.368 12.852 1.00 0.00 H ATOM 1023 HB ILE A 61 17.202 5.199 12.807 1.00 0.00 H ATOM 1024 HG12 ILE A 61 14.773 3.866 11.668 1.00 0.00 H ATOM 1025 HG13 ILE A 61 15.988 4.570 10.575 1.00 0.00 H ATOM 1026 HD11 ILE A 61 17.727 3.201 11.627 1.00 0.00 H ATOM 1027 HD12 ILE A 61 16.511 2.497 12.721 1.00 0.00 H ATOM 1028 HD13 ILE A 61 16.414 2.195 10.969 1.00 0.00 H ATOM 1029 HG21 ILE A 61 15.678 5.704 14.656 1.00 0.00 H ATOM 1030 HG22 ILE A 61 14.316 5.012 13.740 1.00 0.00 H ATOM 1031 HG23 ILE A 61 15.652 3.964 14.278 1.00 0.00 H ATOM 1032 H ILE A 61 13.997 6.402 10.873 1.00 0.00 H ATOM 1033 N ILE A 62 17.946 7.135 11.137 1.00 54.28 N ATOM 1034 CA ILE A 62 18.890 7.493 10.083 1.00 53.36 C ATOM 1035 C ILE A 62 19.935 6.402 10.063 1.00 55.72 C ATOM 1036 O ILE A 62 20.445 6.017 11.116 1.00 59.14 O ATOM 1037 CB ILE A 62 19.524 8.876 10.353 1.00 57.82 C ATOM 1038 CG1 ILE A 62 18.442 9.962 10.338 1.00 61.28 C ATOM 1039 CG2 ILE A 62 20.576 9.197 9.315 1.00 56.78 C ATOM 1040 CD1 ILE A 62 18.833 11.270 11.037 1.00 63.80 C ATOM 1041 HA ILE A 62 18.392 7.572 9.117 1.00 0.00 H ATOM 1042 HB ILE A 62 19.998 8.847 11.334 1.00 0.00 H ATOM 1043 HG12 ILE A 62 18.205 10.190 9.299 1.00 0.00 H ATOM 1044 HG13 ILE A 62 17.556 9.565 10.833 1.00 0.00 H ATOM 1045 HD11 ILE A 62 19.061 11.067 12.083 1.00 0.00 H ATOM 1046 HD12 ILE A 62 19.711 11.693 10.548 1.00 0.00 H ATOM 1047 HD13 ILE A 62 18.005 11.976 10.974 1.00 0.00 H ATOM 1048 HG21 ILE A 62 21.359 8.439 9.346 1.00 0.00 H ATOM 1049 HG22 ILE A 62 20.118 9.207 8.326 1.00 0.00 H ATOM 1050 HG23 ILE A 62 21.007 10.175 9.527 1.00 0.00 H ATOM 1051 H ILE A 62 18.282 7.050 12.117 1.00 0.00 H ATOM 1052 N VAL A 63 20.183 5.840 8.891 1.00 57.02 N ATOM 1053 CA VAL A 63 21.224 4.838 8.720 1.00 65.00 C ATOM 1054 C VAL A 63 22.085 5.226 7.530 1.00 67.43 C ATOM 1055 O VAL A 63 21.630 5.132 6.389 1.00 63.35 O ATOM 1056 CB VAL A 63 20.595 3.472 8.428 1.00 68.49 C ATOM 1057 CG1 VAL A 63 21.673 2.405 8.265 1.00 73.72 C ATOM 1058 CG2 VAL A 63 19.617 3.093 9.534 1.00 70.61 C ATOM 1059 HA VAL A 63 21.819 4.782 9.631 1.00 0.00 H ATOM 1060 HB VAL A 63 20.044 3.537 7.490 1.00 0.00 H ATOM 1061 HG11 VAL A 63 22.328 2.676 7.437 1.00 0.00 H ATOM 1062 HG12 VAL A 63 22.256 2.336 9.184 1.00 0.00 H ATOM 1063 HG13 VAL A 63 21.203 1.444 8.058 1.00 0.00 H ATOM 1064 HG21 VAL A 63 20.147 3.046 10.485 1.00 0.00 H ATOM 1065 HG22 VAL A 63 18.829 3.843 9.593 1.00 0.00 H ATOM 1066 HG23 VAL A 63 19.179 2.120 9.312 1.00 0.00 H ATOM 1067 H VAL A 63 19.616 6.123 8.066 1.00 0.00 H ATOM 1068 N GLU A 64 23.331 5.626 7.787 1.00 76.80 N ATOM 1069 CA GLU A 64 24.218 6.102 6.715 1.00 83.05 C ATOM 1070 C GLU A 64 25.130 4.991 6.219 1.00 91.78 C ATOM 1071 O GLU A 64 25.879 5.177 5.259 1.00 92.06 O ATOM 1072 CB GLU A 64 25.042 7.334 7.149 1.00 85.76 C ATOM 1073 CG GLU A 64 24.198 8.593 7.393 1.00 85.17 C ATOM 1074 CD GLU A 64 25.009 9.879 7.459 1.00 87.74 C ATOM 1075 OE1 GLU A 64 25.545 10.315 6.415 1.00 88.78 O ATOM 1076 OE2 GLU A 64 25.091 10.469 8.558 1.00 88.82 O ATOM 1077 HA GLU A 64 23.578 6.412 5.889 1.00 0.00 H ATOM 1078 HB2 GLU A 64 25.567 7.088 8.072 1.00 0.00 H ATOM 1079 HB3 GLU A 64 25.769 7.554 6.367 1.00 0.00 H ATOM 1080 HG2 GLU A 64 23.476 8.684 6.582 1.00 0.00 H ATOM 1081 HG3 GLU A 64 23.668 8.473 8.338 1.00 0.00 H ATOM 1082 H GLU A 64 23.683 5.601 8.765 1.00 0.00 H ATOM 1083 N SER A 65 25.046 3.832 6.863 1.00 99.79 N ATOM 1084 CA SER A 65 25.773 2.651 6.419 1.00105.42 C ATOM 1085 C SER A 65 25.258 2.266 5.032 1.00108.31 C ATOM 1086 O SER A 65 24.128 2.597 4.663 1.00102.63 O ATOM 1087 CB SER A 65 25.576 1.496 7.412 1.00105.03 C ATOM 1088 OG SER A 65 26.342 0.354 7.059 1.00106.31 O ATOM 1089 HA SER A 65 26.841 2.864 6.370 1.00 0.00 H ATOM 1090 HB2 SER A 65 24.521 1.221 7.428 1.00 0.00 H ATOM 1091 HB3 SER A 65 25.878 1.830 8.405 1.00 0.00 H ATOM 1092 HG SER A 65 26.186 -0.364 7.722 1.00 0.00 H ATOM 1093 H SER A 65 24.444 3.766 7.708 1.00 0.00 H ATOM 1094 N GLY A 66 26.103 1.594 4.255 1.00117.46 N ATOM 1095 CA GLY A 66 25.699 1.074 2.960 1.00118.80 C ATOM 1096 C GLY A 66 25.020 -0.275 3.108 1.00120.90 C ATOM 1097 O GLY A 66 24.814 -0.987 2.120 1.00121.82 O ATOM 1098 HA3 GLY A 66 26.580 0.963 2.328 1.00 0.00 H ATOM 1099 HA2 GLY A 66 25.006 1.774 2.494 1.00 0.00 H ATOM 1100 H GLY A 66 27.077 1.437 4.583 1.00 0.00 H ATOM 1101 N ASP A 67 24.670 -0.616 4.350 1.00120.38 N ATOM 1102 CA ASP A 67 23.984 -1.862 4.677 1.00120.18 C ATOM 1103 C ASP A 67 22.667 -1.562 5.406 1.00116.44 C ATOM 1104 O ASP A 67 22.595 -1.685 6.636 1.00118.45 O ATOM 1105 CB ASP A 67 24.889 -2.739 5.548 1.00123.60 C ATOM 1106 CG ASP A 67 24.225 -4.046 5.968 1.00126.31 C ATOM 1107 OD1 ASP A 67 23.132 -4.361 5.455 1.00125.78 O ATOM 1108 OD2 ASP A 67 24.807 -4.769 6.806 1.00130.09 O ATOM 1109 HA ASP A 67 23.756 -2.398 3.756 1.00 0.00 H ATOM 1110 HB2 ASP A 67 25.793 -2.973 4.985 1.00 0.00 H ATOM 1111 HB3 ASP A 67 25.156 -2.180 6.445 1.00 0.00 H ATOM 1112 H ASP A 67 24.898 0.040 5.124 1.00 0.00 H ATOM 1113 N PRO A 68 21.620 -1.169 4.644 1.00110.39 N ATOM 1114 CA PRO A 68 20.271 -0.930 5.181 1.00106.68 C ATOM 1115 C PRO A 68 19.536 -2.243 5.506 1.00108.81 C ATOM 1116 O PRO A 68 18.826 -2.759 4.633 1.00112.57 O ATOM 1117 CB PRO A 68 19.561 -0.156 4.048 1.00 99.94 C ATOM 1118 CG PRO A 68 20.615 0.213 3.077 1.00 98.24 C ATOM 1119 CD PRO A 68 21.683 -0.815 3.214 1.00105.08 C ATOM 1120 HA PRO A 68 20.293 -0.383 6.124 1.00 0.00 H ATOM 1121 HD3 PRO A 68 21.476 -1.682 2.586 1.00 0.00 H ATOM 1122 HD2 PRO A 68 22.659 -0.404 2.954 1.00 0.00 H ATOM 1123 HG3 PRO A 68 21.011 1.202 3.306 1.00 0.00 H ATOM 1124 HG2 PRO A 68 20.214 0.209 2.064 1.00 0.00 H ATOM 1125 HB2 PRO A 68 18.811 -0.787 3.571 1.00 0.00 H ATOM 1126 HB3 PRO A 68 19.082 0.739 4.444 1.00 0.00 H ATOM 1127 N ASN A 69 19.723 -2.779 6.719 1.00104.82 N ATOM 1128 CA ASN A 69 19.174 -4.095 7.081 1.00102.52 C ATOM 1129 C ASN A 69 17.704 -4.200 6.680 1.00 95.75 C ATOM 1130 O ASN A 69 16.934 -3.242 6.821 1.00 92.00 O ATOM 1131 CB ASN A 69 19.339 -4.376 8.580 1.00105.38 C ATOM 1132 CG ASN A 69 18.482 -3.473 9.441 1.00101.05 C ATOM 1133 OD1 ASN A 69 18.753 -2.271 9.546 1.00107.22 O ATOM 1134 ND2 ASN A 69 17.442 -4.038 10.063 1.00 92.11 N ATOM 1135 HA ASN A 69 19.739 -4.848 6.532 1.00 0.00 H ATOM 1136 HB2 ASN A 69 19.059 -5.412 8.774 1.00 0.00 H ATOM 1137 HB3 ASN A 69 20.384 -4.227 8.850 1.00 0.00 H ATOM 1138 HD22 ASN A 69 17.254 -5.054 9.944 1.00 0.00 H ATOM 1139 HD21 ASN A 69 16.821 -3.462 10.666 1.00 0.00 H ATOM 1140 H ASN A 69 20.272 -2.249 7.426 1.00 0.00 H ATOM 1141 N ALA A 70 17.332 -5.361 6.149 1.00 93.41 N ATOM 1142 CA ALA A 70 16.212 -5.430 5.212 1.00 87.48 C ATOM 1143 C ALA A 70 14.807 -5.225 5.802 1.00 78.35 C ATOM 1144 O ALA A 70 13.846 -5.023 5.041 1.00 74.35 O ATOM 1145 CB ALA A 70 16.283 -6.722 4.418 1.00 93.26 C ATOM 1146 HA ALA A 70 16.342 -4.563 4.564 1.00 0.00 H ATOM 1147 HB1 ALA A 70 17.220 -6.755 3.863 1.00 0.00 H ATOM 1148 HB2 ALA A 70 16.234 -7.570 5.101 1.00 0.00 H ATOM 1149 HB3 ALA A 70 15.445 -6.766 3.722 1.00 0.00 H ATOM 1150 H ALA A 70 17.844 -6.230 6.403 1.00 0.00 H ATOM 1151 N LEU A 71 14.686 -5.237 7.133 1.00 71.32 N ATOM 1152 CA LEU A 71 13.383 -5.019 7.770 1.00 70.24 C ATOM 1153 C LEU A 71 12.995 -3.538 7.883 1.00 65.29 C ATOM 1154 O LEU A 71 11.870 -3.213 8.247 1.00 64.44 O ATOM 1155 CB LEU A 71 13.341 -5.678 9.148 1.00 74.75 C ATOM 1156 CG LEU A 71 13.582 -7.184 9.129 1.00 80.33 C ATOM 1157 CD1 LEU A 71 13.655 -7.682 10.553 1.00 84.82 C ATOM 1158 CD2 LEU A 71 12.503 -7.915 8.369 1.00 81.19 C ATOM 1159 HA LEU A 71 12.647 -5.485 7.115 1.00 0.00 H ATOM 1160 HB2 LEU A 71 14.107 -5.217 9.771 1.00 0.00 H ATOM 1161 HB3 LEU A 71 12.360 -5.494 9.585 1.00 0.00 H ATOM 1162 HG LEU A 71 14.522 -7.381 8.614 1.00 0.00 H ATOM 1163 HD21 LEU A 71 11.538 -7.728 8.841 1.00 0.00 H ATOM 1164 HD22 LEU A 71 12.481 -7.559 7.339 1.00 0.00 H ATOM 1165 HD23 LEU A 71 12.713 -8.984 8.380 1.00 0.00 H ATOM 1166 HD11 LEU A 71 14.474 -7.182 11.070 1.00 0.00 H ATOM 1167 HD12 LEU A 71 12.716 -7.464 11.062 1.00 0.00 H ATOM 1168 HD13 LEU A 71 13.827 -8.758 10.552 1.00 0.00 H ATOM 1169 H LEU A 71 15.526 -5.403 7.724 1.00 0.00 H ATOM 1170 N LEU A 72 13.933 -2.655 7.575 1.00 65.48 N ATOM 1171 CA LEU A 72 13.687 -1.222 7.585 1.00 63.26 C ATOM 1172 C LEU A 72 12.901 -0.771 6.344 1.00 62.44 C ATOM 1173 O LEU A 72 13.212 -1.172 5.223 1.00 66.24 O ATOM 1174 CB LEU A 72 15.016 -0.453 7.623 1.00 62.74 C ATOM 1175 CG LEU A 72 15.910 -0.647 8.858 1.00 67.62 C ATOM 1176 CD1 LEU A 72 17.171 0.191 8.729 1.00 67.43 C ATOM 1177 CD2 LEU A 72 15.158 -0.269 10.101 1.00 68.20 C ATOM 1178 HA LEU A 72 13.097 -1.006 8.476 1.00 0.00 H ATOM 1179 HB2 LEU A 72 15.594 -0.755 6.750 1.00 0.00 H ATOM 1180 HB3 LEU A 72 14.782 0.609 7.552 1.00 0.00 H ATOM 1181 HG LEU A 72 16.195 -1.697 8.926 1.00 0.00 H ATOM 1182 HD21 LEU A 72 14.855 0.776 10.037 1.00 0.00 H ATOM 1183 HD22 LEU A 72 14.274 -0.899 10.195 1.00 0.00 H ATOM 1184 HD23 LEU A 72 15.801 -0.410 10.970 1.00 0.00 H ATOM 1185 HD11 LEU A 72 17.720 -0.115 7.838 1.00 0.00 H ATOM 1186 HD12 LEU A 72 16.899 1.243 8.646 1.00 0.00 H ATOM 1187 HD13 LEU A 72 17.795 0.044 9.610 1.00 0.00 H ATOM 1188 H LEU A 72 14.880 -2.999 7.317 1.00 0.00 H ATOM 1189 N LYS A 73 11.902 0.079 6.577 1.00 58.75 N ATOM 1190 CA LYS A 73 11.098 0.716 5.520 1.00 59.28 C ATOM 1191 C LYS A 73 11.687 2.088 5.177 1.00 53.52 C ATOM 1192 O LYS A 73 11.904 2.909 6.067 1.00 53.71 O ATOM 1193 CB LYS A 73 9.654 0.869 6.043 1.00 67.85 C ATOM 1194 CG LYS A 73 8.616 1.543 5.115 1.00 71.75 C ATOM 1195 CD LYS A 73 7.228 1.624 5.816 1.00 78.99 C ATOM 1196 CE LYS A 73 6.114 2.207 4.929 1.00 77.99 C ATOM 1197 NZ LYS A 73 5.890 1.465 3.654 1.00 78.78 N ATOM 1198 HA LYS A 73 11.104 0.106 4.617 1.00 0.00 H ATOM 1199 HB2 LYS A 73 9.284 -0.130 6.273 1.00 0.00 H ATOM 1200 HB3 LYS A 73 9.701 1.457 6.959 1.00 0.00 H ATOM 1201 HG2 LYS A 73 8.954 2.550 4.870 1.00 0.00 H ATOM 1202 HG3 LYS A 73 8.522 0.960 4.199 1.00 0.00 H ATOM 1203 HD2 LYS A 73 6.936 0.618 6.117 1.00 0.00 H ATOM 1204 HD3 LYS A 73 7.326 2.252 6.701 1.00 0.00 H ATOM 1205 HE2 LYS A 73 6.377 3.236 4.683 1.00 0.00 H ATOM 1206 HE3 LYS A 73 5.184 2.197 5.498 1.00 0.00 H ATOM 1207 HZ1 LYS A 73 6.764 1.475 3.090 1.00 0.00 H ATOM 1208 HZ2 LYS A 73 5.625 0.482 3.868 1.00 0.00 H ATOM 1209 HZ3 LYS A 73 5.125 1.922 3.118 1.00 0.00 H ATOM 1210 H LYS A 73 11.676 0.307 7.566 1.00 0.00 H ATOM 1211 N HIS A 74 11.959 2.329 3.898 1.00 49.50 N ATOM 1212 CA HIS A 74 12.322 3.654 3.439 1.00 48.36 C ATOM 1213 C HIS A 74 11.252 4.625 3.881 1.00 42.65 C ATOM 1214 O HIS A 74 10.054 4.338 3.775 1.00 42.78 O ATOM 1215 CB HIS A 74 12.455 3.688 1.930 1.00 53.43 C ATOM 1216 CG HIS A 74 13.798 3.262 1.443 1.00 62.20 C ATOM 1217 ND1 HIS A 74 14.835 4.152 1.259 1.00 67.34 N ATOM 1218 CD2 HIS A 74 14.280 2.044 1.107 1.00 66.18 C ATOM 1219 CE1 HIS A 74 15.896 3.500 0.823 1.00 71.26 C ATOM 1220 NE2 HIS A 74 15.586 2.220 0.722 1.00 70.66 N ATOM 1221 HA HIS A 74 13.286 3.930 3.867 1.00 0.00 H ATOM 1222 HB2 HIS A 74 11.705 3.023 1.502 1.00 0.00 H ATOM 1223 HB3 HIS A 74 12.271 4.707 1.590 1.00 0.00 H ATOM 1224 HD2 HIS A 74 13.735 1.101 1.136 1.00 0.00 H ATOM 1225 HE1 HIS A 74 16.864 3.942 0.586 1.00 0.00 H ATOM 1226 H HIS A 74 11.910 1.549 3.212 1.00 0.00 H ATOM 1227 N ARG A 75 11.678 5.761 4.408 1.00 37.02 N ATOM 1228 CA ARG A 75 10.741 6.709 4.967 1.00 36.97 C ATOM 1229 C ARG A 75 10.000 7.502 3.892 1.00 33.86 C ATOM 1230 O ARG A 75 8.851 7.869 4.100 1.00 34.13 O ATOM 1231 CB ARG A 75 11.443 7.695 5.903 1.00 38.63 C ATOM 1232 CG ARG A 75 10.578 8.877 6.231 1.00 37.62 C ATOM 1233 CD ARG A 75 11.073 9.648 7.431 1.00 38.91 C ATOM 1234 NE ARG A 75 10.281 10.844 7.616 1.00 40.56 N ATOM 1235 CZ ARG A 75 10.532 11.801 8.500 1.00 43.33 C ATOM 1236 NH1 ARG A 75 11.561 11.697 9.347 1.00 45.49 N ATOM 1237 NH2 ARG A 75 9.717 12.845 8.557 1.00 43.63 N ATOM 1238 HA ARG A 75 10.016 6.117 5.525 1.00 0.00 H ATOM 1239 HB2 ARG A 75 11.700 7.179 6.828 1.00 0.00 H ATOM 1240 HB3 ARG A 75 12.354 8.049 5.421 1.00 0.00 H ATOM 1241 HG2 ARG A 75 10.560 9.545 5.370 1.00 0.00 H ATOM 1242 HG3 ARG A 75 9.568 8.523 6.436 1.00 0.00 H ATOM 1243 HD2 ARG A 75 12.115 9.926 7.276 1.00 0.00 H ATOM 1244 HD3 ARG A 75 10.994 9.022 8.320 1.00 0.00 H ATOM 1245 HE ARG A 75 9.447 10.964 7.006 1.00 0.00 H ATOM 1246 HH12 ARG A 75 11.747 12.454 10.035 1.00 0.00 H ATOM 1247 HH11 ARG A 75 12.176 10.859 9.318 1.00 0.00 H ATOM 1248 HH22 ARG A 75 9.895 13.607 9.242 1.00 0.00 H ATOM 1249 HH21 ARG A 75 8.900 12.902 7.916 1.00 0.00 H ATOM 1250 H ARG A 75 12.696 5.974 4.420 1.00 0.00 H ATOM 1251 N PHE A 76 10.675 7.786 2.778 1.00 31.98 N ATOM 1252 CA PHE A 76 10.086 8.595 1.715 1.00 30.82 C ATOM 1253 C PHE A 76 9.883 7.792 0.430 1.00 33.86 C ATOM 1254 O PHE A 76 10.685 6.919 0.090 1.00 35.10 O ATOM 1255 CB PHE A 76 10.954 9.809 1.390 1.00 28.63 C ATOM 1256 CG PHE A 76 11.122 10.763 2.533 1.00 28.91 C ATOM 1257 CD1 PHE A 76 10.176 11.727 2.784 1.00 30.78 C ATOM 1258 CD2 PHE A 76 12.222 10.671 3.394 1.00 30.72 C ATOM 1259 CE1 PHE A 76 10.315 12.605 3.837 1.00 33.34 C ATOM 1260 CE2 PHE A 76 12.377 11.544 4.419 1.00 31.54 C ATOM 1261 CZ PHE A 76 11.420 12.504 4.667 1.00 34.29 C ATOM 1262 HA PHE A 76 9.117 8.924 2.091 1.00 0.00 H ATOM 1263 HB2 PHE A 76 11.941 9.455 1.091 1.00 0.00 H ATOM 1264 HB3 PHE A 76 10.495 10.346 0.560 1.00 0.00 H ATOM 1265 HD2 PHE A 76 12.963 9.887 3.238 1.00 0.00 H ATOM 1266 HE2 PHE A 76 13.263 11.486 5.051 1.00 0.00 H ATOM 1267 HZ PHE A 76 11.532 13.182 5.513 1.00 0.00 H ATOM 1268 HE1 PHE A 76 9.562 13.373 4.016 1.00 0.00 H ATOM 1269 HD1 PHE A 76 9.300 11.799 2.139 1.00 0.00 H ATOM 1270 H PHE A 76 11.643 7.423 2.664 1.00 0.00 H ATOM 1271 N GLU A 77 8.794 8.105 -0.258 1.00 32.44 N ATOM 1272 CA GLU A 77 8.608 7.701 -1.665 1.00 34.54 C ATOM 1273 C GLU A 77 9.041 8.888 -2.504 1.00 31.27 C ATOM 1274 O GLU A 77 8.743 10.032 -2.170 1.00 30.31 O ATOM 1275 CB GLU A 77 7.142 7.340 -1.883 1.00 40.85 C ATOM 1276 CG GLU A 77 6.894 6.435 -3.074 1.00 48.93 C ATOM 1277 CD GLU A 77 7.251 5.003 -2.766 1.00 53.16 C ATOM 1278 OE1 GLU A 77 6.579 4.347 -1.915 1.00 51.97 O ATOM 1279 OE2 GLU A 77 8.231 4.558 -3.385 1.00 55.64 O ATOM 1280 HA GLU A 77 9.195 6.825 -1.940 1.00 0.00 H ATOM 1281 HB2 GLU A 77 6.777 6.835 -0.988 1.00 0.00 H ATOM 1282 HB3 GLU A 77 6.581 8.263 -2.032 1.00 0.00 H ATOM 1283 HG2 GLU A 77 5.839 6.487 -3.345 1.00 0.00 H ATOM 1284 HG3 GLU A 77 7.500 6.779 -3.912 1.00 0.00 H ATOM 1285 H GLU A 77 8.045 8.654 0.210 1.00 0.00 H ATOM 1286 N ILE A 78 9.818 8.635 -3.557 1.00 31.23 N ATOM 1287 CA ILE A 78 10.247 9.685 -4.455 1.00 30.80 C ATOM 1288 C ILE A 78 9.366 9.688 -5.701 1.00 29.77 C ATOM 1289 O ILE A 78 9.183 8.657 -6.364 1.00 30.90 O ATOM 1290 CB ILE A 78 11.708 9.549 -4.836 1.00 33.81 C ATOM 1291 CG1 ILE A 78 12.597 9.562 -3.579 1.00 38.68 C ATOM 1292 CG2 ILE A 78 12.122 10.724 -5.682 1.00 32.13 C ATOM 1293 CD1 ILE A 78 14.045 9.171 -3.867 1.00 44.56 C ATOM 1294 HA ILE A 78 10.142 10.636 -3.932 1.00 0.00 H ATOM 1295 HB ILE A 78 11.827 8.610 -5.377 1.00 0.00 H ATOM 1296 HG12 ILE A 78 12.586 10.566 -3.156 1.00 0.00 H ATOM 1297 HG13 ILE A 78 12.185 8.859 -2.855 1.00 0.00 H ATOM 1298 HD11 ILE A 78 14.072 8.163 -4.282 1.00 0.00 H ATOM 1299 HD12 ILE A 78 14.474 9.872 -4.583 1.00 0.00 H ATOM 1300 HD13 ILE A 78 14.619 9.200 -2.941 1.00 0.00 H ATOM 1301 HG21 ILE A 78 11.513 10.752 -6.586 1.00 0.00 H ATOM 1302 HG22 ILE A 78 11.979 11.645 -5.117 1.00 0.00 H ATOM 1303 HG23 ILE A 78 13.173 10.622 -5.954 1.00 0.00 H ATOM 1304 H ILE A 78 10.124 7.658 -3.738 1.00 0.00 H ATOM 1305 N ILE A 79 8.709 10.822 -5.905 1.00 27.15 N ATOM 1306 CA ILE A 79 7.846 11.030 -7.080 1.00 27.10 C ATOM 1307 C ILE A 79 8.565 11.742 -8.261 1.00 27.55 C ATOM 1308 O ILE A 79 8.438 11.340 -9.405 1.00 30.13 O ATOM 1309 CB ILE A 79 6.580 11.751 -6.641 1.00 30.41 C ATOM 1310 CG1 ILE A 79 5.877 10.913 -5.561 1.00 37.72 C ATOM 1311 CG2 ILE A 79 5.644 11.939 -7.810 1.00 29.23 C ATOM 1312 CD1 ILE A 79 4.917 11.679 -4.776 1.00 44.27 C ATOM 1313 HA ILE A 79 7.579 10.054 -7.484 1.00 0.00 H ATOM 1314 HB ILE A 79 6.849 12.731 -6.246 1.00 0.00 H ATOM 1315 HG12 ILE A 79 5.351 10.091 -6.047 1.00 0.00 H ATOM 1316 HG13 ILE A 79 6.633 10.510 -4.887 1.00 0.00 H ATOM 1317 HD11 ILE A 79 5.431 12.499 -4.275 1.00 0.00 H ATOM 1318 HD12 ILE A 79 4.148 12.080 -5.436 1.00 0.00 H ATOM 1319 HD13 ILE A 79 4.457 11.029 -4.032 1.00 0.00 H ATOM 1320 HG21 ILE A 79 6.140 12.531 -8.579 1.00 0.00 H ATOM 1321 HG22 ILE A 79 5.373 10.965 -8.217 1.00 0.00 H ATOM 1322 HG23 ILE A 79 4.745 12.456 -7.475 1.00 0.00 H ATOM 1323 H ILE A 79 8.807 11.591 -5.211 1.00 0.00 H ATOM 1324 N GLU A 80 9.325 12.785 -7.956 1.00 27.43 N ATOM 1325 CA GLU A 80 10.090 13.527 -8.962 1.00 28.69 C ATOM 1326 C GLU A 80 11.059 12.573 -9.622 1.00 32.37 C ATOM 1327 O GLU A 80 11.570 11.641 -8.990 1.00 32.11 O ATOM 1328 CB GLU A 80 10.837 14.668 -8.309 1.00 29.20 C ATOM 1329 CG GLU A 80 11.566 15.595 -9.225 1.00 29.09 C ATOM 1330 CD GLU A 80 10.633 16.297 -10.217 1.00 31.20 C ATOM 1331 OE1 GLU A 80 10.006 17.320 -9.850 1.00 29.84 O ATOM 1332 OE2 GLU A 80 10.483 15.750 -11.336 1.00 32.86 O ATOM 1333 HA GLU A 80 9.417 13.947 -9.710 1.00 0.00 H ATOM 1334 HB2 GLU A 80 10.114 15.258 -7.746 1.00 0.00 H ATOM 1335 HB3 GLU A 80 11.567 14.238 -7.623 1.00 0.00 H ATOM 1336 HG2 GLU A 80 12.072 16.352 -8.626 1.00 0.00 H ATOM 1337 HG3 GLU A 80 12.305 15.023 -9.785 1.00 0.00 H ATOM 1338 H GLU A 80 9.380 13.089 -6.963 1.00 0.00 H ATOM 1339 N GLY A 81 11.260 12.751 -10.930 1.00 33.17 N ATOM 1340 CA GLY A 81 12.191 11.915 -11.666 1.00 33.47 C ATOM 1341 C GLY A 81 11.547 10.785 -12.416 1.00 34.03 C ATOM 1342 O GLY A 81 12.130 10.183 -13.332 1.00 36.83 O ATOM 1343 HA3 GLY A 81 12.904 11.493 -10.958 1.00 0.00 H ATOM 1344 HA2 GLY A 81 12.721 12.543 -12.383 1.00 0.00 H ATOM 1345 H GLY A 81 10.741 13.501 -11.430 1.00 0.00 H ATOM 1346 N ARG A 82 10.336 10.456 -12.022 1.00 33.64 N ATOM 1347 CA ARG A 82 9.539 9.484 -12.755 1.00 33.24 C ATOM 1348 C ARG A 82 8.807 10.148 -13.933 1.00 33.79 C ATOM 1349 O ARG A 82 8.470 11.328 -13.850 1.00 34.44 O ATOM 1350 CB ARG A 82 8.523 8.882 -11.803 1.00 34.44 C ATOM 1351 CG ARG A 82 9.154 8.139 -10.618 1.00 33.85 C ATOM 1352 CD ARG A 82 8.130 7.550 -9.710 1.00 34.30 C ATOM 1353 NE ARG A 82 8.753 7.064 -8.485 1.00 34.30 N ATOM 1354 CZ ARG A 82 9.243 5.844 -8.313 1.00 37.43 C ATOM 1355 NH1 ARG A 82 9.201 4.941 -9.292 1.00 39.72 N ATOM 1356 NH2 ARG A 82 9.820 5.534 -7.148 1.00 38.74 N ATOM 1357 HA ARG A 82 10.196 8.712 -13.156 1.00 0.00 H ATOM 1358 HB2 ARG A 82 7.898 9.685 -11.413 1.00 0.00 H ATOM 1359 HB3 ARG A 82 7.903 8.179 -12.360 1.00 0.00 H ATOM 1360 HG2 ARG A 82 9.785 7.337 -11.002 1.00 0.00 H ATOM 1361 HG3 ARG A 82 9.765 8.840 -10.050 1.00 0.00 H ATOM 1362 HD2 ARG A 82 7.637 6.720 -10.216 1.00 0.00 H ATOM 1363 HD3 ARG A 82 7.392 8.312 -9.460 1.00 0.00 H ATOM 1364 HE ARG A 82 8.818 7.725 -7.685 1.00 0.00 H ATOM 1365 HH12 ARG A 82 9.590 3.989 -9.138 1.00 0.00 H ATOM 1366 HH11 ARG A 82 8.779 5.188 -10.210 1.00 0.00 H ATOM 1367 HH22 ARG A 82 10.209 4.581 -6.998 1.00 0.00 H ATOM 1368 HH21 ARG A 82 9.880 6.245 -6.392 1.00 0.00 H ATOM 1369 H ARG A 82 9.940 10.900 -11.169 1.00 0.00 H ATOM 1370 N ASP A 83 8.598 9.414 -15.021 1.00 34.44 N ATOM 1371 CA ASP A 83 7.762 9.922 -16.130 1.00 38.64 C ATOM 1372 C ASP A 83 6.319 10.065 -15.682 1.00 37.56 C ATOM 1373 O ASP A 83 5.942 9.530 -14.644 1.00 34.84 O ATOM 1374 CB ASP A 83 7.882 9.049 -17.381 1.00 46.88 C ATOM 1375 CG ASP A 83 7.264 7.669 -17.214 1.00 57.31 C ATOM 1376 OD1 ASP A 83 6.094 7.558 -16.799 1.00 54.40 O ATOM 1377 OD2 ASP A 83 7.958 6.679 -17.523 1.00 69.23 O ATOM 1378 HA ASP A 83 8.132 10.910 -16.404 1.00 0.00 H ATOM 1379 HB2 ASP A 83 7.381 9.555 -18.206 1.00 0.00 H ATOM 1380 HB3 ASP A 83 8.939 8.929 -17.619 1.00 0.00 H ATOM 1381 H ASP A 83 9.028 8.470 -15.093 1.00 0.00 H ATOM 1382 N ARG A 84 5.506 10.789 -16.448 1.00 37.32 N ATOM 1383 CA ARG A 84 4.169 11.130 -15.974 1.00 38.16 C ATOM 1384 C ARG A 84 3.323 9.934 -15.573 1.00 35.77 C ATOM 1385 O ARG A 84 2.648 9.958 -14.565 1.00 37.91 O ATOM 1386 CB ARG A 84 3.391 11.849 -17.045 1.00 44.31 C ATOM 1387 CG ARG A 84 3.436 13.323 -16.999 1.00 48.91 C ATOM 1388 CD ARG A 84 2.468 13.803 -18.086 1.00 52.29 C ATOM 1389 NE ARG A 84 2.967 14.890 -18.907 1.00 52.82 N ATOM 1390 CZ ARG A 84 3.646 14.742 -20.036 1.00 57.91 C ATOM 1391 NH1 ARG A 84 3.974 13.534 -20.489 1.00 66.63 N ATOM 1392 NH2 ARG A 84 4.007 15.806 -20.716 1.00 54.83 N ATOM 1393 HA ARG A 84 4.348 11.749 -15.095 1.00 0.00 H ATOM 1394 HB2 ARG A 84 3.784 11.533 -18.012 1.00 0.00 H ATOM 1395 HB3 ARG A 84 2.348 11.544 -16.961 1.00 0.00 H ATOM 1396 HG2 ARG A 84 3.118 13.683 -16.021 1.00 0.00 H ATOM 1397 HG3 ARG A 84 4.445 13.679 -17.205 1.00 0.00 H ATOM 1398 HD2 ARG A 84 1.551 14.137 -17.601 1.00 0.00 H ATOM 1399 HD3 ARG A 84 2.245 12.959 -18.739 1.00 0.00 H ATOM 1400 HE ARG A 84 2.777 15.861 -18.585 1.00 0.00 H ATOM 1401 HH12 ARG A 84 4.507 13.439 -21.377 1.00 0.00 H ATOM 1402 HH11 ARG A 84 3.697 12.686 -19.955 1.00 0.00 H ATOM 1403 HH22 ARG A 84 4.540 15.700 -21.603 1.00 0.00 H ATOM 1404 HH21 ARG A 84 3.760 16.754 -20.368 1.00 0.00 H ATOM 1405 H ARG A 84 5.824 11.112 -17.384 1.00 0.00 H ATOM 1406 N ILE A 85 3.335 8.907 -16.402 1.00 33.27 N ATOM 1407 CA ILE A 85 2.496 7.741 -16.188 1.00 33.43 C ATOM 1408 C ILE A 85 2.894 7.073 -14.882 1.00 35.09 C ATOM 1409 O ILE A 85 2.045 6.767 -14.027 1.00 37.62 O ATOM 1410 CB ILE A 85 2.641 6.788 -17.352 1.00 34.19 C ATOM 1411 CG1 ILE A 85 1.919 7.349 -18.597 1.00 35.85 C ATOM 1412 CG2 ILE A 85 2.028 5.446 -17.030 1.00 39.06 C ATOM 1413 CD1 ILE A 85 2.080 6.526 -19.836 1.00 39.24 C ATOM 1414 HA ILE A 85 1.450 8.040 -16.123 1.00 0.00 H ATOM 1415 HB ILE A 85 3.707 6.672 -17.547 1.00 0.00 H ATOM 1416 HG12 ILE A 85 0.855 7.418 -18.371 1.00 0.00 H ATOM 1417 HG13 ILE A 85 2.312 8.346 -18.798 1.00 0.00 H ATOM 1418 HD11 ILE A 85 3.138 6.456 -20.089 1.00 0.00 H ATOM 1419 HD12 ILE A 85 1.680 5.527 -19.662 1.00 0.00 H ATOM 1420 HD13 ILE A 85 1.539 6.998 -20.657 1.00 0.00 H ATOM 1421 HG21 ILE A 85 2.529 5.018 -16.162 1.00 0.00 H ATOM 1422 HG22 ILE A 85 0.968 5.575 -16.812 1.00 0.00 H ATOM 1423 HG23 ILE A 85 2.146 4.780 -17.884 1.00 0.00 H ATOM 1424 H ILE A 85 3.962 8.933 -17.231 1.00 0.00 H ATOM 1425 N MET A 86 4.188 6.849 -14.703 1.00 35.36 N ATOM 1426 CA MET A 86 4.672 6.175 -13.482 1.00 36.13 C ATOM 1427 C MET A 86 4.489 7.040 -12.223 1.00 35.13 C ATOM 1428 O MET A 86 4.168 6.539 -11.135 1.00 37.47 O ATOM 1429 CB MET A 86 6.154 5.765 -13.634 1.00 37.11 C ATOM 1430 CG MET A 86 6.373 4.688 -14.698 1.00 44.01 C ATOM 1431 SD MET A 86 5.353 3.201 -14.472 1.00 67.54 S ATOM 1432 CE MET A 86 5.645 2.824 -12.739 1.00 62.50 C ATOM 1433 HA MET A 86 4.063 5.280 -13.355 1.00 0.00 H ATOM 1434 HB2 MET A 86 6.732 6.647 -13.909 1.00 0.00 H ATOM 1435 HB3 MET A 86 6.509 5.384 -12.676 1.00 0.00 H ATOM 1436 HG2 MET A 86 7.421 4.391 -14.674 1.00 0.00 H ATOM 1437 HG3 MET A 86 6.141 5.117 -15.673 1.00 0.00 H ATOM 1438 HE1 MET A 86 6.709 2.645 -12.582 1.00 0.00 H ATOM 1439 HE2 MET A 86 5.322 3.665 -12.126 1.00 0.00 H ATOM 1440 HE3 MET A 86 5.081 1.934 -12.462 1.00 0.00 H ATOM 1441 H MET A 86 4.869 7.151 -15.429 1.00 0.00 H ATOM 1442 N ALA A 87 4.687 8.337 -12.369 1.00 31.84 N ATOM 1443 CA ALA A 87 4.539 9.242 -11.249 1.00 30.76 C ATOM 1444 C ALA A 87 3.090 9.234 -10.722 1.00 31.40 C ATOM 1445 O ALA A 87 2.880 9.110 -9.502 1.00 31.67 O ATOM 1446 CB ALA A 87 4.972 10.611 -11.642 1.00 32.35 C ATOM 1447 HA ALA A 87 5.179 8.903 -10.434 1.00 0.00 H ATOM 1448 HB1 ALA A 87 6.018 10.586 -11.949 1.00 0.00 H ATOM 1449 HB2 ALA A 87 4.357 10.961 -12.471 1.00 0.00 H ATOM 1450 HB3 ALA A 87 4.857 11.285 -10.793 1.00 0.00 H ATOM 1451 H ALA A 87 4.953 8.714 -13.301 1.00 0.00 H ATOM 1452 N TRP A 88 2.107 9.306 -11.621 1.00 33.39 N ATOM 1453 CA TRP A 88 0.709 9.268 -11.202 1.00 34.74 C ATOM 1454 C TRP A 88 0.321 7.885 -10.710 1.00 36.59 C ATOM 1455 O TRP A 88 -0.495 7.768 -9.784 1.00 37.73 O ATOM 1456 CB TRP A 88 -0.226 9.768 -12.291 1.00 36.87 C ATOM 1457 CG TRP A 88 -0.231 11.220 -12.361 1.00 37.44 C ATOM 1458 CD1 TRP A 88 0.257 11.989 -13.358 1.00 38.03 C ATOM 1459 CD2 TRP A 88 -0.748 12.116 -11.370 1.00 38.79 C ATOM 1460 NE1 TRP A 88 0.096 13.313 -13.062 1.00 39.56 N ATOM 1461 CE2 TRP A 88 -0.520 13.426 -11.845 1.00 39.75 C ATOM 1462 CE3 TRP A 88 -1.384 11.939 -10.142 1.00 38.80 C ATOM 1463 CZ2 TRP A 88 -0.905 14.558 -11.132 1.00 40.15 C ATOM 1464 CZ3 TRP A 88 -1.754 13.063 -9.422 1.00 40.07 C ATOM 1465 CH2 TRP A 88 -1.525 14.358 -9.928 1.00 41.13 C ATOM 1466 HA TRP A 88 0.602 9.955 -10.362 1.00 0.00 H ATOM 1467 HB2 TRP A 88 0.101 9.368 -13.251 1.00 0.00 H ATOM 1468 HB3 TRP A 88 -1.237 9.419 -12.079 1.00 0.00 H ATOM 1469 HE1 TRP A 88 0.394 14.107 -13.664 1.00 0.00 H ATOM 1470 HD1 TRP A 88 0.715 11.607 -14.270 1.00 0.00 H ATOM 1471 HZ2 TRP A 88 -0.721 15.561 -11.516 1.00 0.00 H ATOM 1472 HH2 TRP A 88 -1.849 15.221 -9.347 1.00 0.00 H ATOM 1473 HZ3 TRP A 88 -2.230 12.944 -8.449 1.00 0.00 H ATOM 1474 HE3 TRP A 88 -1.585 10.939 -9.757 1.00 0.00 H ATOM 1475 H TRP A 88 2.339 9.390 -12.631 1.00 0.00 H ATOM 1476 N THR A 89 0.934 6.845 -11.276 1.00 37.03 N ATOM 1477 CA THR A 89 0.714 5.484 -10.785 1.00 38.90 C ATOM 1478 C THR A 89 1.105 5.394 -9.275 1.00 35.40 C ATOM 1479 O THR A 89 0.332 4.864 -8.465 1.00 37.41 O ATOM 1480 CB THR A 89 1.453 4.427 -11.635 1.00 37.07 C ATOM 1481 OG1 THR A 89 0.949 4.460 -12.972 1.00 35.88 O ATOM 1482 CG2 THR A 89 1.226 3.051 -11.080 1.00 39.28 C ATOM 1483 HA THR A 89 -0.348 5.257 -10.882 1.00 0.00 H ATOM 1484 HB THR A 89 2.519 4.654 -11.618 1.00 0.00 H ATOM 1485 HG1 THR A 89 1.098 5.360 -13.358 1.00 0.00 H ATOM 1486 HG23 THR A 89 1.604 3.006 -10.059 1.00 0.00 H ATOM 1487 HG21 THR A 89 0.158 2.831 -11.083 1.00 0.00 H ATOM 1488 HG22 THR A 89 1.751 2.321 -11.696 1.00 0.00 H ATOM 1489 H THR A 89 1.577 7.003 -12.078 1.00 0.00 H ATOM 1490 N VAL A 90 2.273 5.910 -8.939 1.00 34.40 N ATOM 1491 CA VAL A 90 2.792 5.912 -7.567 1.00 37.42 C ATOM 1492 C VAL A 90 1.915 6.764 -6.643 1.00 37.37 C ATOM 1493 O VAL A 90 1.536 6.320 -5.579 1.00 38.38 O ATOM 1494 CB VAL A 90 4.259 6.351 -7.509 1.00 38.28 C ATOM 1495 CG1 VAL A 90 4.732 6.541 -6.047 1.00 41.14 C ATOM 1496 CG2 VAL A 90 5.106 5.318 -8.207 1.00 39.10 C ATOM 1497 HA VAL A 90 2.754 4.884 -7.207 1.00 0.00 H ATOM 1498 HB VAL A 90 4.361 7.313 -8.011 1.00 0.00 H ATOM 1499 HG11 VAL A 90 4.122 7.305 -5.565 1.00 0.00 H ATOM 1500 HG12 VAL A 90 4.630 5.599 -5.508 1.00 0.00 H ATOM 1501 HG13 VAL A 90 5.777 6.852 -6.042 1.00 0.00 H ATOM 1502 HG21 VAL A 90 4.989 4.356 -7.708 1.00 0.00 H ATOM 1503 HG22 VAL A 90 4.788 5.231 -9.246 1.00 0.00 H ATOM 1504 HG23 VAL A 90 6.152 5.623 -8.170 1.00 0.00 H ATOM 1505 H VAL A 90 2.856 6.338 -9.687 1.00 0.00 H ATOM 1506 N VAL A 91 1.546 7.950 -7.091 1.00 35.63 N ATOM 1507 CA VAL A 91 0.702 8.836 -6.312 1.00 36.88 C ATOM 1508 C VAL A 91 -0.660 8.184 -6.026 1.00 39.23 C ATOM 1509 O VAL A 91 -1.095 8.164 -4.882 1.00 39.40 O ATOM 1510 CB VAL A 91 0.551 10.190 -7.019 1.00 36.65 C ATOM 1511 CG1 VAL A 91 -0.572 11.009 -6.437 1.00 39.98 C ATOM 1512 CG2 VAL A 91 1.863 10.964 -6.925 1.00 33.42 C ATOM 1513 HA VAL A 91 1.180 9.017 -5.349 1.00 0.00 H ATOM 1514 HB VAL A 91 0.306 9.996 -8.063 1.00 0.00 H ATOM 1515 HG11 VAL A 91 -1.510 10.463 -6.542 1.00 0.00 H ATOM 1516 HG12 VAL A 91 -0.375 11.196 -5.381 1.00 0.00 H ATOM 1517 HG13 VAL A 91 -0.641 11.958 -6.969 1.00 0.00 H ATOM 1518 HG21 VAL A 91 2.113 11.127 -5.877 1.00 0.00 H ATOM 1519 HG22 VAL A 91 2.657 10.391 -7.404 1.00 0.00 H ATOM 1520 HG23 VAL A 91 1.753 11.925 -7.428 1.00 0.00 H ATOM 1521 H VAL A 91 1.870 8.258 -8.030 1.00 0.00 H ATOM 1522 N ASN A 92 -1.298 7.612 -7.046 1.00 38.49 N ATOM 1523 CA ASN A 92 -2.594 6.965 -6.858 1.00 42.70 C ATOM 1524 C ASN A 92 -2.511 5.828 -5.877 1.00 44.68 C ATOM 1525 O ASN A 92 -3.404 5.622 -5.063 1.00 48.73 O ATOM 1526 CB ASN A 92 -3.153 6.412 -8.193 1.00 45.91 C ATOM 1527 CG ASN A 92 -3.593 7.496 -9.125 1.00 49.73 C ATOM 1528 OD1 ASN A 92 -3.754 8.643 -8.711 1.00 51.45 O ATOM 1529 ND2 ASN A 92 -3.792 7.151 -10.407 1.00 51.67 N ATOM 1530 HA ASN A 92 -3.262 7.734 -6.470 1.00 0.00 H ATOM 1531 HB2 ASN A 92 -2.375 5.826 -8.682 1.00 0.00 H ATOM 1532 HB3 ASN A 92 -4.007 5.770 -7.975 1.00 0.00 H ATOM 1533 HD22 ASN A 92 -3.643 6.167 -10.710 1.00 0.00 H ATOM 1534 HD21 ASN A 92 -4.095 7.867 -11.097 1.00 0.00 H ATOM 1535 H ASN A 92 -0.866 7.626 -7.992 1.00 0.00 H ATOM 1536 N SER A 93 -1.464 5.040 -6.014 1.00 45.40 N ATOM 1537 CA SER A 93 -1.243 3.927 -5.120 1.00 48.52 C ATOM 1538 C SER A 93 -1.165 4.393 -3.664 1.00 47.40 C ATOM 1539 O SER A 93 -1.766 3.806 -2.766 1.00 50.83 O ATOM 1540 CB SER A 93 0.062 3.238 -5.503 1.00 49.83 C ATOM 1541 OG SER A 93 0.280 2.132 -4.652 1.00 54.24 O ATOM 1542 HA SER A 93 -2.080 3.235 -5.210 1.00 0.00 H ATOM 1543 HB2 SER A 93 0.888 3.942 -5.402 1.00 0.00 H ATOM 1544 HB3 SER A 93 0.002 2.895 -6.536 1.00 0.00 H ATOM 1545 HG SER A 93 1.128 1.686 -4.903 1.00 0.00 H ATOM 1546 H SER A 93 -0.784 5.223 -6.780 1.00 0.00 H ATOM 1547 N ILE A 94 -0.413 5.455 -3.424 1.00 41.60 N ATOM 1548 CA ILE A 94 -0.269 5.982 -2.074 1.00 41.52 C ATOM 1549 C ILE A 94 -1.607 6.455 -1.554 1.00 44.03 C ATOM 1550 O ILE A 94 -1.994 6.131 -0.423 1.00 46.35 O ATOM 1551 CB ILE A 94 0.768 7.125 -2.024 1.00 38.62 C ATOM 1552 CG1 ILE A 94 2.146 6.565 -2.336 1.00 38.17 C ATOM 1553 CG2 ILE A 94 0.772 7.804 -0.627 1.00 42.10 C ATOM 1554 CD1 ILE A 94 3.201 7.634 -2.641 1.00 36.73 C ATOM 1555 HA ILE A 94 0.094 5.178 -1.434 1.00 0.00 H ATOM 1556 HB ILE A 94 0.502 7.878 -2.766 1.00 0.00 H ATOM 1557 HG12 ILE A 94 2.483 5.986 -1.476 1.00 0.00 H ATOM 1558 HG13 ILE A 94 2.061 5.910 -3.203 1.00 0.00 H ATOM 1559 HD11 ILE A 94 2.887 8.216 -3.507 1.00 0.00 H ATOM 1560 HD12 ILE A 94 3.309 8.292 -1.779 1.00 0.00 H ATOM 1561 HD13 ILE A 94 4.155 7.151 -2.853 1.00 0.00 H ATOM 1562 HG21 ILE A 94 -0.216 8.216 -0.422 1.00 0.00 H ATOM 1563 HG22 ILE A 94 1.025 7.065 0.134 1.00 0.00 H ATOM 1564 HG23 ILE A 94 1.510 8.606 -0.616 1.00 0.00 H ATOM 1565 H ILE A 94 0.083 5.920 -4.211 1.00 0.00 H ATOM 1566 N CYS A 95 -2.312 7.221 -2.378 1.00 45.07 N ATOM 1567 CA CYS A 95 -3.578 7.791 -1.970 1.00 50.91 C ATOM 1568 C CYS A 95 -4.598 6.728 -1.653 1.00 59.16 C ATOM 1569 O CYS A 95 -5.256 6.777 -0.602 1.00 59.07 O ATOM 1570 CB CYS A 95 -4.129 8.657 -3.080 1.00 49.95 C ATOM 1571 SG CYS A 95 -3.247 10.180 -3.234 1.00 54.06 S ATOM 1572 HA CYS A 95 -3.392 8.378 -1.071 1.00 0.00 H ATOM 1573 HB2 CYS A 95 -5.176 8.876 -2.869 1.00 0.00 H ATOM 1574 HB3 CYS A 95 -4.056 8.112 -4.021 1.00 0.00 H ATOM 1575 HG CYS A 95 -1.921 9.916 -3.511 1.00 0.00 H ATOM 1576 H CYS A 95 -1.948 7.415 -3.333 1.00 0.00 H ATOM 1577 N ASN A 96 -4.760 5.787 -2.581 1.00 68.51 N ATOM 1578 CA ASN A 96 -5.742 4.713 -2.402 1.00 74.53 C ATOM 1579 C ASN A 96 -5.400 3.904 -1.156 1.00 78.13 C ATOM 1580 O ASN A 96 -6.289 3.405 -0.473 1.00 86.75 O ATOM 1581 CB ASN A 96 -5.819 3.817 -3.653 1.00 77.09 C ATOM 1582 CG ASN A 96 -6.235 4.590 -4.905 1.00 81.59 C ATOM 1583 OD1 ASN A 96 -6.798 5.684 -4.810 1.00 86.31 O ATOM 1584 ND2 ASN A 96 -5.966 4.020 -6.085 1.00 82.01 N ATOM 1585 HA ASN A 96 -6.728 5.157 -2.266 1.00 0.00 H ATOM 1586 HB2 ASN A 96 -4.839 3.373 -3.826 1.00 0.00 H ATOM 1587 HB3 ASN A 96 -6.547 3.026 -3.472 1.00 0.00 H ATOM 1588 HD22 ASN A 96 -5.490 3.096 -6.120 1.00 0.00 H ATOM 1589 HD21 ASN A 96 -6.233 4.501 -6.968 1.00 0.00 H ATOM 1590 H ASN A 96 -4.182 5.814 -3.445 1.00 0.00 H ATOM 1591 N THR A 97 -4.109 3.818 -0.845 1.00 72.12 N ATOM 1592 CA THR A 97 -3.633 3.036 0.297 1.00 74.46 C ATOM 1593 C THR A 97 -3.778 3.782 1.629 1.00 74.67 C ATOM 1594 O THR A 97 -4.588 3.411 2.473 1.00 80.89 O ATOM 1595 CB THR A 97 -2.138 2.658 0.117 1.00 65.84 C ATOM 1596 OG1 THR A 97 -2.029 1.653 -0.889 1.00 66.41 O ATOM 1597 CG2 THR A 97 -1.539 2.102 1.399 1.00 68.60 C ATOM 1598 HA THR A 97 -4.257 2.143 0.329 1.00 0.00 H ATOM 1599 HB THR A 97 -1.599 3.564 -0.161 1.00 0.00 H ATOM 1600 HG1 THR A 97 -2.390 2.001 -1.742 1.00 0.00 H ATOM 1601 HG23 THR A 97 -1.610 2.852 2.187 1.00 0.00 H ATOM 1602 HG21 THR A 97 -2.087 1.208 1.697 1.00 0.00 H ATOM 1603 HG22 THR A 97 -0.492 1.849 1.230 1.00 0.00 H ATOM 1604 H THR A 97 -3.415 4.323 -1.433 1.00 0.00 H ATOM 1605 N THR A 98 -2.967 4.822 1.803 1.00 66.29 N ATOM 1606 CA THR A 98 -2.867 5.555 3.060 1.00 63.72 C ATOM 1607 C THR A 98 -4.135 6.332 3.391 1.00 64.34 C ATOM 1608 O THR A 98 -4.310 6.768 4.534 1.00 68.25 O ATOM 1609 CB THR A 98 -1.753 6.591 2.989 1.00 58.22 C ATOM 1610 OG1 THR A 98 -2.078 7.530 1.967 1.00 57.50 O ATOM 1611 CG2 THR A 98 -0.423 5.964 2.650 1.00 53.84 C ATOM 1612 HA THR A 98 -2.680 4.798 3.821 1.00 0.00 H ATOM 1613 HB THR A 98 -1.668 7.068 3.965 1.00 0.00 H ATOM 1614 HG1 THR A 98 -2.159 7.058 1.100 1.00 0.00 H ATOM 1615 HG23 THR A 98 -0.156 5.241 3.421 1.00 0.00 H ATOM 1616 HG21 THR A 98 -0.496 5.459 1.687 1.00 0.00 H ATOM 1617 HG22 THR A 98 0.340 6.740 2.598 1.00 0.00 H ATOM 1618 H THR A 98 -2.376 5.127 1.004 1.00 0.00 H ATOM 1619 N GLY A 99 -5.001 6.528 2.398 1.00 59.92 N ATOM 1620 CA GLY A 99 -6.193 7.339 2.578 1.00 61.75 C ATOM 1621 C GLY A 99 -6.001 8.842 2.367 1.00 62.87 C ATOM 1622 O GLY A 99 -6.973 9.593 2.332 1.00 67.01 O ATOM 1623 HA3 GLY A 99 -6.555 7.185 3.595 1.00 0.00 H ATOM 1624 HA2 GLY A 99 -6.946 6.993 1.870 1.00 0.00 H ATOM 1625 H GLY A 99 -4.820 6.090 1.472 1.00 0.00 H ATOM 1626 N VAL A 100 -4.761 9.298 2.222 1.00 61.97 N ATOM 1627 CA VAL A 100 -4.500 10.726 2.017 1.00 62.17 C ATOM 1628 C VAL A 100 -5.117 11.194 0.707 1.00 63.44 C ATOM 1629 O VAL A 100 -5.250 10.419 -0.238 1.00 62.48 O ATOM 1630 CB VAL A 100 -2.979 11.072 2.031 1.00 68.86 C ATOM 1631 CG1 VAL A 100 -2.342 10.620 3.345 1.00 69.70 C ATOM 1632 CG2 VAL A 100 -2.264 10.479 0.822 1.00 65.91 C ATOM 1633 HA VAL A 100 -4.961 11.249 2.855 1.00 0.00 H ATOM 1634 HB VAL A 100 -2.872 12.155 1.962 1.00 0.00 H ATOM 1635 HG11 VAL A 100 -2.830 11.127 4.177 1.00 0.00 H ATOM 1636 HG12 VAL A 100 -2.463 9.542 3.454 1.00 0.00 H ATOM 1637 HG13 VAL A 100 -1.281 10.869 3.338 1.00 0.00 H ATOM 1638 HG21 VAL A 100 -2.373 9.395 0.833 1.00 0.00 H ATOM 1639 HG22 VAL A 100 -2.703 10.881 -0.091 1.00 0.00 H ATOM 1640 HG23 VAL A 100 -1.206 10.739 0.863 1.00 0.00 H ATOM 1641 H VAL A 100 -3.963 8.631 2.254 1.00 0.00 H ATOM 1642 N GLU A 101 -5.488 12.468 0.656 1.00 65.97 N ATOM 1643 CA GLU A 101 -6.187 13.017 -0.502 1.00 67.75 C ATOM 1644 C GLU A 101 -5.258 13.147 -1.725 1.00 59.71 C ATOM 1645 O GLU A 101 -4.055 13.382 -1.604 1.00 53.87 O ATOM 1646 CB GLU A 101 -6.819 14.375 -0.156 1.00 75.24 C ATOM 1647 CG GLU A 101 -7.659 14.991 -1.290 1.00 81.72 C ATOM 1648 CD GLU A 101 -8.711 14.039 -1.854 1.00 88.19 C ATOM 1649 OE1 GLU A 101 -9.773 13.874 -1.209 1.00 93.10 O ATOM 1650 OE2 GLU A 101 -8.482 13.459 -2.944 1.00 88.60 O ATOM 1651 HA GLU A 101 -6.980 12.318 -0.768 1.00 0.00 H ATOM 1652 HB2 GLU A 101 -7.464 14.240 0.712 1.00 0.00 H ATOM 1653 HB3 GLU A 101 -6.018 15.071 0.093 1.00 0.00 H ATOM 1654 HG2 GLU A 101 -8.165 15.876 -0.904 1.00 0.00 H ATOM 1655 HG3 GLU A 101 -6.988 15.282 -2.098 1.00 0.00 H ATOM 1656 H GLU A 101 -5.275 13.090 1.462 1.00 0.00 H ATOM 1657 N LYS A 102 -5.840 13.003 -2.904 1.00 59.85 N ATOM 1658 CA LYS A 102 -5.061 13.014 -4.127 1.00 56.93 C ATOM 1659 C LYS A 102 -4.673 14.436 -4.490 1.00 55.80 C ATOM 1660 O LYS A 102 -5.528 15.299 -4.593 1.00 60.64 O ATOM 1661 CB LYS A 102 -5.869 12.359 -5.245 1.00 59.59 C ATOM 1662 CG LYS A 102 -5.057 11.959 -6.469 1.00 59.08 C ATOM 1663 CD LYS A 102 -5.916 11.150 -7.437 1.00 68.09 C ATOM 1664 CE LYS A 102 -5.371 11.164 -8.880 1.00 75.70 C ATOM 1665 NZ LYS A 102 -5.463 12.494 -9.583 1.00 82.41 N ATOM 1666 HA LYS A 102 -4.142 12.447 -3.982 1.00 0.00 H ATOM 1667 HB2 LYS A 102 -6.340 11.462 -4.843 1.00 0.00 H ATOM 1668 HB3 LYS A 102 -6.639 13.061 -5.563 1.00 0.00 H ATOM 1669 HG2 LYS A 102 -4.698 12.857 -6.971 1.00 0.00 H ATOM 1670 HG3 LYS A 102 -4.206 11.356 -6.154 1.00 0.00 H ATOM 1671 HD2 LYS A 102 -5.954 10.118 -7.089 1.00 0.00 H ATOM 1672 HD3 LYS A 102 -6.923 11.568 -7.441 1.00 0.00 H ATOM 1673 HE2 LYS A 102 -5.934 10.434 -9.462 1.00 0.00 H ATOM 1674 HE3 LYS A 102 -4.322 10.870 -8.848 1.00 0.00 H ATOM 1675 HZ1 LYS A 102 -6.459 12.788 -9.637 1.00 0.00 H ATOM 1676 HZ2 LYS A 102 -4.919 13.204 -9.052 1.00 0.00 H ATOM 1677 HZ3 LYS A 102 -5.074 12.405 -10.543 1.00 0.00 H ATOM 1678 H LYS A 102 -6.871 12.880 -2.955 1.00 0.00 H ATOM 1679 N PRO A 103 -3.372 14.695 -4.681 1.00 48.29 N ATOM 1680 CA PRO A 103 -2.994 16.050 -5.095 1.00 46.34 C ATOM 1681 C PRO A 103 -3.414 16.361 -6.536 1.00 45.54 C ATOM 1682 O PRO A 103 -3.614 15.451 -7.356 1.00 44.61 O ATOM 1683 CB PRO A 103 -1.470 16.044 -4.946 1.00 44.62 C ATOM 1684 CG PRO A 103 -1.092 14.637 -5.159 1.00 43.85 C ATOM 1685 CD PRO A 103 -2.215 13.792 -4.626 1.00 45.53 C ATOM 1686 HA PRO A 103 -3.486 16.820 -4.500 1.00 0.00 H ATOM 1687 HD3 PRO A 103 -2.374 12.914 -5.252 1.00 0.00 H ATOM 1688 HD2 PRO A 103 -2.014 13.476 -3.602 1.00 0.00 H ATOM 1689 HG3 PRO A 103 -0.169 14.413 -4.625 1.00 0.00 H ATOM 1690 HG2 PRO A 103 -0.951 14.444 -6.223 1.00 0.00 H ATOM 1691 HB2 PRO A 103 -1.006 16.687 -5.694 1.00 0.00 H ATOM 1692 HB3 PRO A 103 -1.177 16.377 -3.950 1.00 0.00 H ATOM 1693 N LYS A 104 -3.548 17.654 -6.824 1.00 46.81 N ATOM 1694 CA LYS A 104 -3.894 18.164 -8.153 1.00 50.16 C ATOM 1695 C LYS A 104 -2.710 18.208 -9.125 1.00 47.06 C ATOM 1696 O LYS A 104 -2.899 18.057 -10.319 1.00 48.66 O ATOM 1697 CB LYS A 104 -4.441 19.577 -8.025 1.00 58.00 C ATOM 1698 CG LYS A 104 -5.587 19.715 -7.025 1.00 68.00 C ATOM 1699 CD LYS A 104 -6.287 21.080 -7.131 1.00 78.13 C ATOM 1700 CE LYS A 104 -5.320 22.257 -6.987 1.00 81.59 C ATOM 1701 NZ LYS A 104 -5.236 23.057 -8.248 1.00 85.74 N ATOM 1702 HA LYS A 104 -4.631 17.471 -8.559 1.00 0.00 H ATOM 1703 HB2 LYS A 104 -3.629 20.231 -7.708 1.00 0.00 H ATOM 1704 HB3 LYS A 104 -4.800 19.895 -9.004 1.00 0.00 H ATOM 1705 HG2 LYS A 104 -6.318 18.929 -7.217 1.00 0.00 H ATOM 1706 HG3 LYS A 104 -5.189 19.601 -6.017 1.00 0.00 H ATOM 1707 HD2 LYS A 104 -6.774 21.147 -8.104 1.00 0.00 H ATOM 1708 HD3 LYS A 104 -7.038 21.148 -6.344 1.00 0.00 H ATOM 1709 HE2 LYS A 104 -4.329 21.874 -6.744 1.00 0.00 H ATOM 1710 HE3 LYS A 104 -5.666 22.903 -6.180 1.00 0.00 H ATOM 1711 HZ1 LYS A 104 -4.901 22.448 -9.022 1.00 0.00 H ATOM 1712 HZ2 LYS A 104 -6.177 23.431 -8.483 1.00 0.00 H ATOM 1713 HZ3 LYS A 104 -4.572 23.846 -8.113 1.00 0.00 H ATOM 1714 H LYS A 104 -3.398 18.343 -6.060 1.00 0.00 H ATOM 1715 N PHE A 105 -1.504 18.456 -8.605 1.00 44.11 N ATOM 1716 CA PHE A 105 -0.275 18.464 -9.395 1.00 43.30 C ATOM 1717 C PHE A 105 0.669 17.469 -8.738 1.00 36.83 C ATOM 1718 O PHE A 105 0.571 17.235 -7.540 1.00 36.44 O ATOM 1719 CB PHE A 105 0.394 19.844 -9.377 1.00 50.28 C ATOM 1720 CG PHE A 105 -0.448 20.937 -9.973 1.00 59.35 C ATOM 1721 CD1 PHE A 105 -0.499 21.119 -11.347 1.00 62.12 C ATOM 1722 CD2 PHE A 105 -1.194 21.779 -9.161 1.00 64.10 C ATOM 1723 CE1 PHE A 105 -1.281 22.131 -11.906 1.00 65.62 C ATOM 1724 CE2 PHE A 105 -1.979 22.786 -9.708 1.00 67.79 C ATOM 1725 CZ PHE A 105 -2.022 22.961 -11.079 1.00 68.52 C ATOM 1726 HA PHE A 105 -0.502 18.211 -10.431 1.00 0.00 H ATOM 1727 HB2 PHE A 105 0.614 20.106 -8.342 1.00 0.00 H ATOM 1728 HB3 PHE A 105 1.325 19.782 -9.940 1.00 0.00 H ATOM 1729 HD2 PHE A 105 -1.164 21.649 -8.079 1.00 0.00 H ATOM 1730 HE2 PHE A 105 -2.561 23.438 -9.057 1.00 0.00 H ATOM 1731 HZ PHE A 105 -2.638 23.751 -11.509 1.00 0.00 H ATOM 1732 HE1 PHE A 105 -1.309 22.268 -12.987 1.00 0.00 H ATOM 1733 HD1 PHE A 105 0.079 20.463 -11.998 1.00 0.00 H ATOM 1734 H PHE A 105 -1.437 18.653 -7.586 1.00 0.00 H ATOM 1735 N LEU A 106 1.584 16.887 -9.507 1.00 32.10 N ATOM 1736 CA LEU A 106 2.539 15.954 -8.920 1.00 31.35 C ATOM 1737 C LEU A 106 3.433 16.664 -7.887 1.00 32.78 C ATOM 1738 O LEU A 106 4.068 17.673 -8.224 1.00 32.58 O ATOM 1739 CB LEU A 106 3.431 15.360 -9.997 1.00 30.76 C ATOM 1740 CG LEU A 106 2.739 14.394 -10.949 1.00 33.40 C ATOM 1741 CD1 LEU A 106 3.659 14.026 -12.107 1.00 34.73 C ATOM 1742 CD2 LEU A 106 2.320 13.163 -10.222 1.00 32.04 C ATOM 1743 HA LEU A 106 1.969 15.165 -8.430 1.00 0.00 H ATOM 1744 HB2 LEU A 106 3.841 16.180 -10.587 1.00 0.00 H ATOM 1745 HB3 LEU A 106 4.244 14.826 -9.506 1.00 0.00 H ATOM 1746 HG LEU A 106 1.854 14.887 -11.351 1.00 0.00 H ATOM 1747 HD21 LEU A 106 3.198 12.677 -9.797 1.00 0.00 H ATOM 1748 HD22 LEU A 106 1.629 13.432 -9.423 1.00 0.00 H ATOM 1749 HD23 LEU A 106 1.827 12.483 -10.916 1.00 0.00 H ATOM 1750 HD11 LEU A 106 3.930 14.928 -12.655 1.00 0.00 H ATOM 1751 HD12 LEU A 106 4.560 13.552 -11.717 1.00 0.00 H ATOM 1752 HD13 LEU A 106 3.143 13.335 -12.774 1.00 0.00 H ATOM 1753 H LEU A 106 1.619 17.097 -10.525 1.00 0.00 H ATOM 1754 N PRO A 107 3.501 16.128 -6.649 1.00 31.87 N ATOM 1755 CA PRO A 107 4.470 16.578 -5.645 1.00 31.53 C ATOM 1756 C PRO A 107 5.795 15.872 -5.862 1.00 29.22 C ATOM 1757 O PRO A 107 5.927 15.149 -6.850 1.00 28.71 O ATOM 1758 CB PRO A 107 3.830 16.166 -4.317 1.00 33.53 C ATOM 1759 CG PRO A 107 2.975 14.991 -4.650 1.00 35.03 C ATOM 1760 CD PRO A 107 2.666 15.038 -6.145 1.00 34.29 C ATOM 1761 HA PRO A 107 4.681 17.647 -5.686 1.00 0.00 H ATOM 1762 HD3 PRO A 107 2.929 14.095 -6.624 1.00 0.00 H ATOM 1763 HD2 PRO A 107 1.610 15.249 -6.316 1.00 0.00 H ATOM 1764 HG3 PRO A 107 2.048 15.035 -4.079 1.00 0.00 H ATOM 1765 HG2 PRO A 107 3.504 14.069 -4.411 1.00 0.00 H ATOM 1766 HB2 PRO A 107 4.595 15.890 -3.592 1.00 0.00 H ATOM 1767 HB3 PRO A 107 3.225 16.979 -3.914 1.00 0.00 H ATOM 1768 N ASP A 108 6.770 16.180 -5.026 1.00 27.51 N ATOM 1769 CA ASP A 108 8.096 15.587 -5.106 1.00 25.34 C ATOM 1770 C ASP A 108 8.337 14.296 -4.351 1.00 26.12 C ATOM 1771 O ASP A 108 9.054 13.422 -4.845 1.00 26.14 O ATOM 1772 CB ASP A 108 9.133 16.631 -4.777 1.00 24.60 C ATOM 1773 CG ASP A 108 9.146 17.734 -5.750 1.00 25.09 C ATOM 1774 OD1 ASP A 108 9.118 17.408 -6.974 1.00 24.54 O ATOM 1775 OD2 ASP A 108 9.198 18.918 -5.331 1.00 26.57 O ATOM 1776 HA ASP A 108 8.183 15.255 -6.141 1.00 0.00 H ATOM 1777 HB2 ASP A 108 8.919 17.038 -3.789 1.00 0.00 H ATOM 1778 HB3 ASP A 108 10.115 16.159 -4.769 1.00 0.00 H ATOM 1779 H ASP A 108 6.582 16.877 -4.278 1.00 0.00 H ATOM 1780 N LEU A 109 7.783 14.207 -3.130 1.00 26.23 N ATOM 1781 CA LEU A 109 8.010 13.102 -2.221 1.00 26.11 C ATOM 1782 C LEU A 109 6.713 12.790 -1.476 1.00 27.99 C ATOM 1783 O LEU A 109 5.788 13.607 -1.447 1.00 29.02 O ATOM 1784 CB LEU A 109 9.088 13.467 -1.188 1.00 26.58 C ATOM 1785 CG LEU A 109 10.406 14.034 -1.664 1.00 27.53 C ATOM 1786 CD1 LEU A 109 11.148 14.629 -0.467 1.00 33.34 C ATOM 1787 CD2 LEU A 109 11.176 12.900 -2.226 1.00 27.93 C ATOM 1788 HA LEU A 109 8.340 12.238 -2.798 1.00 0.00 H ATOM 1789 HB2 LEU A 109 8.648 14.204 -0.516 1.00 0.00 H ATOM 1790 HB3 LEU A 109 9.315 12.558 -0.630 1.00 0.00 H ATOM 1791 HG LEU A 109 10.267 14.815 -2.411 1.00 0.00 H ATOM 1792 HD21 LEU A 109 11.332 12.149 -1.451 1.00 0.00 H ATOM 1793 HD22 LEU A 109 10.620 12.460 -3.054 1.00 0.00 H ATOM 1794 HD23 LEU A 109 12.140 13.260 -2.585 1.00 0.00 H ATOM 1795 HD11 LEU A 109 10.544 15.420 -0.023 1.00 0.00 H ATOM 1796 HD12 LEU A 109 11.327 13.849 0.273 1.00 0.00 H ATOM 1797 HD13 LEU A 109 12.101 15.041 -0.800 1.00 0.00 H ATOM 1798 H LEU A 109 7.155 14.976 -2.820 1.00 0.00 H ATOM 1799 N TYR A 110 6.650 11.598 -0.918 1.00 29.54 N ATOM 1800 CA TYR A 110 5.672 11.266 0.109 1.00 31.34 C ATOM 1801 C TYR A 110 6.418 10.821 1.348 1.00 31.52 C ATOM 1802 O TYR A 110 7.331 9.994 1.287 1.00 32.54 O ATOM 1803 CB TYR A 110 4.717 10.149 -0.326 1.00 31.57 C ATOM 1804 CG TYR A 110 3.643 9.895 0.696 1.00 32.86 C ATOM 1805 CD1 TYR A 110 2.574 10.767 0.832 1.00 34.01 C ATOM 1806 CD2 TYR A 110 3.708 8.804 1.555 1.00 34.16 C ATOM 1807 CE1 TYR A 110 1.604 10.550 1.797 1.00 36.32 C ATOM 1808 CE2 TYR A 110 2.726 8.571 2.504 1.00 37.22 C ATOM 1809 CZ TYR A 110 1.699 9.458 2.629 1.00 38.46 C ATOM 1810 OH TYR A 110 0.751 9.255 3.590 1.00 42.66 O ATOM 1811 HA TYR A 110 5.068 12.153 0.299 1.00 0.00 H ATOM 1812 HB3 TYR A 110 5.289 9.233 -0.470 1.00 0.00 H ATOM 1813 HB2 TYR A 110 4.247 10.434 -1.267 1.00 0.00 H ATOM 1814 HD2 TYR A 110 4.550 8.116 1.480 1.00 0.00 H ATOM 1815 HE2 TYR A 110 2.774 7.689 3.143 1.00 0.00 H ATOM 1816 HE1 TYR A 110 0.768 11.242 1.897 1.00 0.00 H ATOM 1817 HD1 TYR A 110 2.496 11.632 0.173 1.00 0.00 H ATOM 1818 HH TYR A 110 1.182 9.251 4.481 1.00 0.00 H ATOM 1819 H TYR A 110 7.324 10.867 -1.222 1.00 0.00 H ATOM 1820 N ASP A 111 5.982 11.339 2.487 1.00 30.92 N ATOM 1821 CA ASP A 111 6.612 11.048 3.774 1.00 33.01 C ATOM 1822 C ASP A 111 5.707 10.068 4.505 1.00 35.21 C ATOM 1823 O ASP A 111 4.630 10.431 4.933 1.00 38.10 O ATOM 1824 CB ASP A 111 6.761 12.347 4.563 1.00 34.39 C ATOM 1825 CG ASP A 111 7.528 12.180 5.884 1.00 36.83 C ATOM 1826 OD1 ASP A 111 7.667 11.051 6.408 1.00 37.31 O ATOM 1827 OD2 ASP A 111 7.977 13.242 6.387 1.00 35.32 O ATOM 1828 HA ASP A 111 7.604 10.615 3.649 1.00 0.00 H ATOM 1829 HB2 ASP A 111 7.294 13.068 3.943 1.00 0.00 H ATOM 1830 HB3 ASP A 111 5.766 12.730 4.788 1.00 0.00 H ATOM 1831 H ASP A 111 5.161 11.977 2.465 1.00 0.00 H ATOM 1832 N TYR A 112 6.155 8.828 4.658 1.00 37.67 N ATOM 1833 CA TYR A 112 5.378 7.820 5.375 1.00 41.55 C ATOM 1834 C TYR A 112 5.331 8.024 6.882 1.00 43.92 C ATOM 1835 O TYR A 112 4.492 7.421 7.534 1.00 46.96 O ATOM 1836 CB TYR A 112 5.910 6.423 5.106 1.00 42.80 C ATOM 1837 CG TYR A 112 5.576 5.926 3.754 1.00 44.45 C ATOM 1838 CD1 TYR A 112 4.271 5.553 3.436 1.00 48.63 C ATOM 1839 CD2 TYR A 112 6.551 5.809 2.776 1.00 43.73 C ATOM 1840 CE1 TYR A 112 3.950 5.098 2.173 1.00 49.76 C ATOM 1841 CE2 TYR A 112 6.238 5.358 1.513 1.00 46.35 C ATOM 1842 CZ TYR A 112 4.938 4.998 1.219 1.00 49.30 C ATOM 1843 OH TYR A 112 4.637 4.536 -0.042 1.00 50.98 O ATOM 1844 HA TYR A 112 4.364 7.934 4.991 1.00 0.00 H ATOM 1845 HB3 TYR A 112 5.483 5.741 5.842 1.00 0.00 H ATOM 1846 HB2 TYR A 112 6.995 6.438 5.212 1.00 0.00 H ATOM 1847 HD2 TYR A 112 7.581 6.078 3.010 1.00 0.00 H ATOM 1848 HE2 TYR A 112 7.013 5.286 0.749 1.00 0.00 H ATOM 1849 HE1 TYR A 112 2.924 4.820 1.933 1.00 0.00 H ATOM 1850 HD1 TYR A 112 3.493 5.622 4.196 1.00 0.00 H ATOM 1851 HH TYR A 112 4.857 5.234 -0.709 1.00 0.00 H ATOM 1852 H TYR A 112 7.080 8.568 4.259 1.00 0.00 H ATOM 1853 N LYS A 113 6.250 8.807 7.459 1.00 40.97 N ATOM 1854 CA LYS A 113 6.199 9.056 8.893 1.00 42.85 C ATOM 1855 C LYS A 113 5.161 10.129 9.180 1.00 43.38 C ATOM 1856 O LYS A 113 4.308 9.947 10.045 1.00 46.15 O ATOM 1857 CB LYS A 113 7.573 9.480 9.457 1.00 42.68 C ATOM 1858 CG LYS A 113 7.616 9.699 10.996 1.00 48.84 C ATOM 1859 CD LYS A 113 8.695 10.762 11.302 1.00 51.15 C ATOM 1860 CE LYS A 113 8.921 11.076 12.824 1.00 61.64 C ATOM 1861 NZ LYS A 113 9.915 12.237 12.995 1.00 59.12 N ATOM 1862 HA LYS A 113 5.921 8.126 9.388 1.00 0.00 H ATOM 1863 HB2 LYS A 113 8.295 8.703 9.206 1.00 0.00 H ATOM 1864 HB3 LYS A 113 7.863 10.414 8.975 1.00 0.00 H ATOM 1865 HG2 LYS A 113 6.645 10.047 11.347 1.00 0.00 H ATOM 1866 HG3 LYS A 113 7.867 8.763 11.495 1.00 0.00 H ATOM 1867 HD2 LYS A 113 9.640 10.411 10.887 1.00 0.00 H ATOM 1868 HD3 LYS A 113 8.404 11.689 10.807 1.00 0.00 H ATOM 1869 HE2 LYS A 113 9.317 10.189 13.318 1.00 0.00 H ATOM 1870 HE3 LYS A 113 7.969 11.349 13.279 1.00 0.00 H ATOM 1871 HZ1 LYS A 113 10.826 11.978 12.565 1.00 0.00 H ATOM 1872 HZ2 LYS A 113 9.538 13.086 12.527 1.00 0.00 H ATOM 1873 HZ3 LYS A 113 10.051 12.429 14.008 1.00 0.00 H ATOM 1874 H LYS A 113 7.001 9.238 6.883 1.00 0.00 H ATOM 1875 N GLU A 114 5.227 11.234 8.445 1.00 39.98 N ATOM 1876 CA GLU A 114 4.342 12.372 8.678 1.00 42.36 C ATOM 1877 C GLU A 114 3.029 12.229 7.908 1.00 41.94 C ATOM 1878 O GLU A 114 2.126 13.036 8.062 1.00 43.45 O ATOM 1879 CB GLU A 114 5.015 13.687 8.265 1.00 41.71 C ATOM 1880 CG GLU A 114 6.252 14.049 9.087 1.00 43.60 C ATOM 1881 CD GLU A 114 5.932 14.680 10.448 1.00 52.29 C ATOM 1882 OE1 GLU A 114 4.734 14.820 10.787 1.00 56.31 O ATOM 1883 OE2 GLU A 114 6.899 15.055 11.178 1.00 54.53 O ATOM 1884 HA GLU A 114 4.129 12.390 9.747 1.00 0.00 H ATOM 1885 HB2 GLU A 114 5.312 13.604 7.220 1.00 0.00 H ATOM 1886 HB3 GLU A 114 4.287 14.491 8.372 1.00 0.00 H ATOM 1887 HG2 GLU A 114 6.829 13.140 9.257 1.00 0.00 H ATOM 1888 HG3 GLU A 114 6.851 14.756 8.513 1.00 0.00 H ATOM 1889 H GLU A 114 5.930 11.290 7.681 1.00 0.00 H ATOM 1890 N ASN A 115 2.946 11.209 7.070 1.00 41.57 N ATOM 1891 CA ASN A 115 1.748 10.916 6.281 1.00 41.68 C ATOM 1892 C ASN A 115 1.284 12.093 5.398 1.00 40.54 C ATOM 1893 O ASN A 115 0.111 12.469 5.402 1.00 44.35 O ATOM 1894 CB ASN A 115 0.604 10.455 7.188 1.00 47.51 C ATOM 1895 CG ASN A 115 1.051 9.453 8.276 1.00 54.59 C ATOM 1896 OD1 ASN A 115 0.979 9.745 9.492 1.00 60.80 O ATOM 1897 ND2 ASN A 115 1.468 8.258 7.852 1.00 54.81 N ATOM 1898 HA ASN A 115 2.027 10.111 5.601 1.00 0.00 H ATOM 1899 HB2 ASN A 115 0.177 11.330 7.678 1.00 0.00 H ATOM 1900 HB3 ASN A 115 -0.157 9.978 6.570 1.00 0.00 H ATOM 1901 HD22 ASN A 115 1.514 8.055 6.833 1.00 0.00 H ATOM 1902 HD21 ASN A 115 1.747 7.530 8.541 1.00 0.00 H ATOM 1903 H ASN A 115 3.772 10.585 6.967 1.00 0.00 H ATOM 1904 N ARG A 116 2.202 12.649 4.623 1.00 36.50 N ATOM 1905 CA ARG A 116 1.891 13.769 3.725 1.00 37.05 C ATOM 1906 C ARG A 116 2.808 13.811 2.511 1.00 34.37 C ATOM 1907 O ARG A 116 3.950 13.374 2.573 1.00 32.51 O ATOM 1908 CB ARG A 116 1.998 15.102 4.487 1.00 38.17 C ATOM 1909 CG ARG A 116 3.379 15.399 5.012 1.00 37.36 C ATOM 1910 CD ARG A 116 3.324 16.368 6.170 1.00 40.61 C ATOM 1911 NE ARG A 116 4.662 16.740 6.618 1.00 39.31 N ATOM 1912 CZ ARG A 116 4.908 17.413 7.743 1.00 41.23 C ATOM 1913 NH1 ARG A 116 3.906 17.800 8.520 1.00 44.60 N ATOM 1914 NH2 ARG A 116 6.165 17.715 8.078 1.00 39.54 N ATOM 1915 HA ARG A 116 0.872 13.618 3.369 1.00 0.00 H ATOM 1916 HB2 ARG A 116 1.707 15.907 3.812 1.00 0.00 H ATOM 1917 HB3 ARG A 116 1.309 15.071 5.331 1.00 0.00 H ATOM 1918 HG2 ARG A 116 3.840 14.470 5.347 1.00 0.00 H ATOM 1919 HG3 ARG A 116 3.978 15.833 4.212 1.00 0.00 H ATOM 1920 HD2 ARG A 116 2.790 15.902 6.998 1.00 0.00 H ATOM 1921 HD3 ARG A 116 2.792 17.266 5.856 1.00 0.00 H ATOM 1922 HE ARG A 116 5.471 16.464 6.026 1.00 0.00 H ATOM 1923 HH12 ARG A 116 4.100 18.325 9.397 1.00 0.00 H ATOM 1924 HH11 ARG A 116 2.925 17.579 8.253 1.00 0.00 H ATOM 1925 HH22 ARG A 116 6.358 18.240 8.955 1.00 0.00 H ATOM 1926 HH21 ARG A 116 6.951 17.425 7.462 1.00 0.00 H ATOM 1927 H ARG A 116 3.174 12.281 4.651 1.00 0.00 H ATOM 1928 N PHE A 117 2.311 14.381 1.424 1.00 33.36 N ATOM 1929 CA PHE A 117 3.143 14.681 0.264 1.00 33.64 C ATOM 1930 C PHE A 117 3.954 15.915 0.601 1.00 33.75 C ATOM 1931 O PHE A 117 3.536 16.721 1.434 1.00 33.25 O ATOM 1932 CB PHE A 117 2.282 14.931 -0.946 1.00 33.95 C ATOM 1933 CG PHE A 117 1.651 13.682 -1.477 1.00 33.30 C ATOM 1934 CD1 PHE A 117 2.407 12.774 -2.196 1.00 30.42 C ATOM 1935 CD2 PHE A 117 0.327 13.389 -1.215 1.00 35.54 C ATOM 1936 CE1 PHE A 117 1.846 11.596 -2.679 1.00 32.25 C ATOM 1937 CE2 PHE A 117 -0.246 12.209 -1.712 1.00 36.29 C ATOM 1938 CZ PHE A 117 0.522 11.317 -2.426 1.00 35.37 C ATOM 1939 HA PHE A 117 3.799 13.842 0.032 1.00 0.00 H ATOM 1940 HB2 PHE A 117 1.493 15.632 -0.673 1.00 0.00 H ATOM 1941 HB3 PHE A 117 2.900 15.369 -1.729 1.00 0.00 H ATOM 1942 HD2 PHE A 117 -0.274 14.077 -0.620 1.00 0.00 H ATOM 1943 HE2 PHE A 117 -1.300 11.998 -1.533 1.00 0.00 H ATOM 1944 HZ PHE A 117 0.081 10.389 -2.791 1.00 0.00 H ATOM 1945 HE1 PHE A 117 2.452 10.897 -3.255 1.00 0.00 H ATOM 1946 HD1 PHE A 117 3.459 12.985 -2.387 1.00 0.00 H ATOM 1947 H PHE A 117 1.300 14.621 1.397 1.00 0.00 H ATOM 1948 N ILE A 118 5.114 16.011 -0.034 1.00 31.81 N ATOM 1949 CA ILE A 118 6.007 17.159 0.083 1.00 31.70 C ATOM 1950 C ILE A 118 6.350 17.704 -1.281 1.00 29.41 C ATOM 1951 O ILE A 118 6.657 16.948 -2.218 1.00 29.68 O ATOM 1952 CB ILE A 118 7.340 16.779 0.727 1.00 31.47 C ATOM 1953 CG1 ILE A 118 7.110 16.159 2.092 1.00 33.27 C ATOM 1954 CG2 ILE A 118 8.262 18.011 0.826 1.00 32.62 C ATOM 1955 CD1 ILE A 118 8.347 15.493 2.632 1.00 33.50 C ATOM 1956 HA ILE A 118 5.478 17.890 0.694 1.00 0.00 H ATOM 1957 HB ILE A 118 7.834 16.038 0.098 1.00 0.00 H ATOM 1958 HG12 ILE A 118 6.802 16.941 2.785 1.00 0.00 H ATOM 1959 HG13 ILE A 118 6.318 15.415 2.010 1.00 0.00 H ATOM 1960 HD11 ILE A 118 8.660 14.703 1.950 1.00 0.00 H ATOM 1961 HD12 ILE A 118 9.144 16.231 2.725 1.00 0.00 H ATOM 1962 HD13 ILE A 118 8.130 15.065 3.611 1.00 0.00 H ATOM 1963 HG21 ILE A 118 8.450 18.404 -0.173 1.00 0.00 H ATOM 1964 HG22 ILE A 118 7.780 18.776 1.434 1.00 0.00 H ATOM 1965 HG23 ILE A 118 9.206 17.721 1.287 1.00 0.00 H ATOM 1966 H ILE A 118 5.403 15.224 -0.650 1.00 0.00 H ATOM 1967 N GLU A 119 6.279 19.023 -1.393 1.00 28.04 N ATOM 1968 CA GLU A 119 6.788 19.772 -2.524 1.00 27.39 C ATOM 1969 C GLU A 119 8.104 20.426 -2.122 1.00 28.10 C ATOM 1970 O GLU A 119 8.120 21.267 -1.238 1.00 29.20 O ATOM 1971 CB GLU A 119 5.807 20.854 -2.948 1.00 28.76 C ATOM 1972 CG GLU A 119 6.287 21.774 -4.070 1.00 32.46 C ATOM 1973 CD GLU A 119 6.674 21.009 -5.350 1.00 33.65 C ATOM 1974 OE1 GLU A 119 6.009 19.992 -5.655 1.00 33.85 O ATOM 1975 OE2 GLU A 119 7.653 21.409 -6.014 1.00 32.62 O ATOM 1976 HA GLU A 119 6.933 19.090 -3.362 1.00 0.00 H ATOM 1977 HB2 GLU A 119 4.892 20.366 -3.282 1.00 0.00 H ATOM 1978 HB3 GLU A 119 5.590 21.472 -2.076 1.00 0.00 H ATOM 1979 HG2 GLU A 119 5.487 22.474 -4.312 1.00 0.00 H ATOM 1980 HG3 GLU A 119 7.158 22.326 -3.718 1.00 0.00 H ATOM 1981 H GLU A 119 5.829 19.554 -0.620 1.00 0.00 H ATOM 1982 N ILE A 120 9.163 20.090 -2.839 1.00 26.56 N ATOM 1983 CA ILE A 120 10.495 20.644 -2.591 1.00 27.60 C ATOM 1984 C ILE A 120 10.735 21.782 -3.531 1.00 29.26 C ATOM 1985 O ILE A 120 10.517 21.656 -4.722 1.00 27.94 O ATOM 1986 CB ILE A 120 11.596 19.580 -2.861 1.00 28.62 C ATOM 1987 CG1 ILE A 120 11.524 18.432 -1.864 1.00 30.37 C ATOM 1988 CG2 ILE A 120 13.009 20.217 -2.901 1.00 30.15 C ATOM 1989 CD1 ILE A 120 11.895 18.769 -0.487 1.00 34.18 C ATOM 1990 HA ILE A 120 10.539 20.967 -1.551 1.00 0.00 H ATOM 1991 HB ILE A 120 11.404 19.160 -3.849 1.00 0.00 H ATOM 1992 HG12 ILE A 120 10.500 18.059 -1.855 1.00 0.00 H ATOM 1993 HG13 ILE A 120 12.193 17.644 -2.209 1.00 0.00 H ATOM 1994 HD11 ILE A 120 12.923 19.131 -0.467 1.00 0.00 H ATOM 1995 HD12 ILE A 120 11.228 19.545 -0.112 1.00 0.00 H ATOM 1996 HD13 ILE A 120 11.809 17.881 0.139 1.00 0.00 H ATOM 1997 HG21 ILE A 120 13.048 20.962 -3.696 1.00 0.00 H ATOM 1998 HG22 ILE A 120 13.218 20.694 -1.943 1.00 0.00 H ATOM 1999 HG23 ILE A 120 13.751 19.441 -3.092 1.00 0.00 H ATOM 2000 H ILE A 120 9.045 19.404 -3.611 1.00 0.00 H ATOM 2001 N GLY A 121 11.075 22.952 -3.013 1.00 28.00 N ATOM 2002 CA GLY A 121 11.545 24.027 -3.858 1.00 27.99 C ATOM 2003 C GLY A 121 13.024 24.312 -3.700 1.00 30.06 C ATOM 2004 O GLY A 121 13.534 24.291 -2.565 1.00 30.07 O ATOM 2005 HA3 GLY A 121 10.990 24.931 -3.609 1.00 0.00 H ATOM 2006 HA2 GLY A 121 11.353 23.759 -4.897 1.00 0.00 H ATOM 2007 H GLY A 121 11.003 23.100 -1.986 1.00 0.00 H ATOM 2008 N VAL A 122 13.656 24.712 -4.800 1.00 28.68 N ATOM 2009 CA VAL A 122 15.029 25.199 -4.803 1.00 29.69 C ATOM 2010 C VAL A 122 15.031 26.492 -5.584 1.00 32.73 C ATOM 2011 O VAL A 122 14.559 26.539 -6.728 1.00 34.65 O ATOM 2012 CB VAL A 122 16.044 24.227 -5.416 1.00 29.93 C ATOM 2013 CG1 VAL A 122 17.451 24.792 -5.332 1.00 32.87 C ATOM 2014 CG2 VAL A 122 16.019 22.952 -4.698 1.00 30.80 C ATOM 2015 HA VAL A 122 15.345 25.326 -3.768 1.00 0.00 H ATOM 2016 HB VAL A 122 15.771 24.078 -6.461 1.00 0.00 H ATOM 2017 HG11 VAL A 122 17.495 25.736 -5.875 1.00 0.00 H ATOM 2018 HG12 VAL A 122 17.712 24.960 -4.287 1.00 0.00 H ATOM 2019 HG13 VAL A 122 18.152 24.084 -5.773 1.00 0.00 H ATOM 2020 HG21 VAL A 122 16.272 23.121 -3.651 1.00 0.00 H ATOM 2021 HG22 VAL A 122 15.022 22.518 -4.766 1.00 0.00 H ATOM 2022 HG23 VAL A 122 16.744 22.271 -5.144 1.00 0.00 H ATOM 2023 H VAL A 122 13.144 24.675 -5.704 1.00 0.00 H ATOM 2024 N THR A 123 15.516 27.557 -4.936 1.00 34.37 N ATOM 2025 CA THR A 123 15.416 28.893 -5.498 1.00 37.92 C ATOM 2026 C THR A 123 16.699 29.675 -5.360 1.00 41.43 C ATOM 2027 O THR A 123 17.428 29.551 -4.353 1.00 39.79 O ATOM 2028 CB THR A 123 14.257 29.706 -4.850 1.00 42.49 C ATOM 2029 OG1 THR A 123 14.075 30.925 -5.573 1.00 45.71 O ATOM 2030 CG2 THR A 123 14.520 30.041 -3.385 1.00 44.24 C ATOM 2031 HA THR A 123 15.209 28.750 -6.558 1.00 0.00 H ATOM 2032 HB THR A 123 13.364 29.083 -4.893 1.00 0.00 H ATOM 2033 HG1 THR A 123 13.850 30.718 -6.515 1.00 0.00 H ATOM 2034 HG23 THR A 123 14.661 29.118 -2.822 1.00 0.00 H ATOM 2035 HG21 THR A 123 15.418 30.655 -3.309 1.00 0.00 H ATOM 2036 HG22 THR A 123 13.669 30.589 -2.980 1.00 0.00 H ATOM 2037 H THR A 123 15.974 27.426 -4.011 1.00 0.00 H ATOM 2038 N ARG A 124 16.917 30.497 -6.387 1.00 44.53 N ATOM 2039 CA ARG A 124 17.976 31.495 -6.462 1.00 50.03 C ATOM 2040 C ARG A 124 17.489 32.847 -5.936 1.00 50.79 C ATOM 2041 O ARG A 124 18.250 33.808 -5.904 1.00 52.69 O ATOM 2042 CB ARG A 124 18.410 31.651 -7.934 1.00 57.07 C ATOM 2043 CG ARG A 124 19.051 30.396 -8.547 1.00 60.44 C ATOM 2044 CD ARG A 124 18.764 30.233 -10.055 1.00 66.52 C ATOM 2045 NE ARG A 124 17.694 29.277 -10.274 1.00 65.68 N ATOM 2046 CZ ARG A 124 17.215 28.916 -11.460 1.00 63.08 C ATOM 2047 NH1 ARG A 124 17.711 29.441 -12.588 1.00 59.30 N ATOM 2048 NH2 ARG A 124 16.224 28.027 -11.502 1.00 63.02 N ATOM 2049 HA ARG A 124 18.814 31.166 -5.848 1.00 0.00 H ATOM 2050 HB2 ARG A 124 17.529 31.906 -8.523 1.00 0.00 H ATOM 2051 HB3 ARG A 124 19.132 32.465 -7.992 1.00 0.00 H ATOM 2052 HG2 ARG A 124 20.130 30.455 -8.405 1.00 0.00 H ATOM 2053 HG3 ARG A 124 18.664 29.521 -8.025 1.00 0.00 H ATOM 2054 HD2 ARG A 124 19.666 29.881 -10.555 1.00 0.00 H ATOM 2055 HD3 ARG A 124 18.473 31.198 -10.470 1.00 0.00 H ATOM 2056 HE ARG A 124 17.267 28.838 -9.433 1.00 0.00 H ATOM 2057 HH12 ARG A 124 17.327 29.150 -13.510 1.00 0.00 H ATOM 2058 HH11 ARG A 124 18.480 30.140 -12.542 1.00 0.00 H ATOM 2059 HH22 ARG A 124 15.832 27.728 -12.418 1.00 0.00 H ATOM 2060 HH21 ARG A 124 15.842 27.632 -10.619 1.00 0.00 H ATOM 2061 H ARG A 124 16.277 30.419 -7.203 1.00 0.00 H ATOM 2062 N ARG A 125 16.220 32.910 -5.527 1.00 52.30 N ATOM 2063 CA ARG A 125 15.603 34.143 -5.012 1.00 57.00 C ATOM 2064 C ARG A 125 15.252 34.019 -3.527 1.00 56.78 C ATOM 2065 O ARG A 125 15.632 33.063 -2.887 1.00 56.09 O ATOM 2066 CB ARG A 125 14.340 34.441 -5.801 1.00 61.84 C ATOM 2067 CG ARG A 125 14.560 34.431 -7.305 1.00 68.18 C ATOM 2068 CD ARG A 125 13.272 34.713 -8.050 1.00 74.77 C ATOM 2069 NE ARG A 125 12.462 33.509 -8.190 1.00 73.75 N ATOM 2070 CZ ARG A 125 11.131 33.478 -8.164 1.00 73.58 C ATOM 2071 NH1 ARG A 125 10.430 34.591 -7.988 1.00 73.55 N ATOM 2072 NH2 ARG A 125 10.499 32.318 -8.306 1.00 73.21 N ATOM 2073 HA ARG A 125 16.323 34.954 -5.125 1.00 0.00 H ATOM 2074 HB2 ARG A 125 13.591 33.688 -5.555 1.00 0.00 H ATOM 2075 HB3 ARG A 125 13.973 35.425 -5.510 1.00 0.00 H ATOM 2076 HG2 ARG A 125 15.294 35.195 -7.562 1.00 0.00 H ATOM 2077 HG3 ARG A 125 14.936 33.452 -7.603 1.00 0.00 H ATOM 2078 HD2 ARG A 125 13.513 35.096 -9.042 1.00 0.00 H ATOM 2079 HD3 ARG A 125 12.702 35.462 -7.501 1.00 0.00 H ATOM 2080 HE ARG A 125 12.961 32.606 -8.320 1.00 0.00 H ATOM 2081 HH12 ARG A 125 9.391 34.554 -7.970 1.00 0.00 H ATOM 2082 HH11 ARG A 125 10.920 35.501 -7.868 1.00 0.00 H ATOM 2083 HH22 ARG A 125 9.460 32.286 -8.287 1.00 0.00 H ATOM 2084 HH21 ARG A 125 11.044 31.442 -8.436 1.00 0.00 H ATOM 2085 H ARG A 125 15.640 32.048 -5.574 1.00 0.00 H ATOM 2086 N GLU A 126 14.552 35.007 -2.986 1.00 58.70 N ATOM 2087 CA GLU A 126 14.120 34.997 -1.587 1.00 59.13 C ATOM 2088 C GLU A 126 13.172 33.843 -1.319 1.00 54.27 C ATOM 2089 O GLU A 126 12.216 33.645 -2.063 1.00 52.96 O ATOM 2090 CB GLU A 126 13.404 36.308 -1.250 1.00 67.25 C ATOM 2091 CG GLU A 126 14.303 37.555 -1.179 1.00 76.93 C ATOM 2092 CD GLU A 126 14.935 37.751 0.196 1.00 83.76 C ATOM 2093 OE1 GLU A 126 14.931 36.785 0.995 1.00 86.00 O ATOM 2094 OE2 GLU A 126 15.424 38.871 0.483 1.00 87.57 O ATOM 2095 HA GLU A 126 15.008 34.883 -0.965 1.00 0.00 H ATOM 2096 HB2 GLU A 126 12.646 36.483 -2.014 1.00 0.00 H ATOM 2097 HB3 GLU A 126 12.920 36.187 -0.281 1.00 0.00 H ATOM 2098 HG2 GLU A 126 15.099 37.454 -1.917 1.00 0.00 H ATOM 2099 HG3 GLU A 126 13.701 38.433 -1.414 1.00 0.00 H ATOM 2100 H GLU A 126 14.299 35.823 -3.580 1.00 0.00 H ATOM 2101 N VAL A 127 13.413 33.084 -0.252 1.00 52.25 N ATOM 2102 CA VAL A 127 12.599 31.897 -0.003 1.00 50.17 C ATOM 2103 C VAL A 127 11.126 32.230 0.229 1.00 52.24 C ATOM 2104 O VAL A 127 10.261 31.455 -0.148 1.00 50.41 O ATOM 2105 CB VAL A 127 13.116 31.009 1.175 1.00 53.74 C ATOM 2106 CG1 VAL A 127 14.443 30.371 0.806 1.00 51.62 C ATOM 2107 CG2 VAL A 127 13.210 31.796 2.487 1.00 56.85 C ATOM 2108 HA VAL A 127 12.694 31.319 -0.922 1.00 0.00 H ATOM 2109 HB VAL A 127 12.389 30.214 1.344 1.00 0.00 H ATOM 2110 HG11 VAL A 127 14.312 29.749 -0.080 1.00 0.00 H ATOM 2111 HG12 VAL A 127 15.175 31.152 0.599 1.00 0.00 H ATOM 2112 HG13 VAL A 127 14.792 29.755 1.635 1.00 0.00 H ATOM 2113 HG21 VAL A 127 13.900 32.630 2.360 1.00 0.00 H ATOM 2114 HG22 VAL A 127 12.223 32.176 2.753 1.00 0.00 H ATOM 2115 HG23 VAL A 127 13.573 31.140 3.278 1.00 0.00 H ATOM 2116 H VAL A 127 14.180 33.336 0.404 1.00 0.00 H ATOM 2117 N HIS A 128 10.835 33.382 0.825 1.00 57.26 N ATOM 2118 CA HIS A 128 9.442 33.706 1.126 1.00 59.79 C ATOM 2119 C HIS A 128 8.637 33.960 -0.146 1.00 59.11 C ATOM 2120 O HIS A 128 7.462 33.587 -0.234 1.00 59.30 O ATOM 2121 CB HIS A 128 9.323 34.876 2.109 1.00 66.43 C ATOM 2122 CG HIS A 128 9.853 36.170 1.586 1.00 74.99 C ATOM 2123 ND1 HIS A 128 9.033 37.190 1.153 1.00 81.65 N ATOM 2124 CD2 HIS A 128 11.121 36.620 1.447 1.00 78.55 C ATOM 2125 CE1 HIS A 128 9.774 38.214 0.765 1.00 87.08 C ATOM 2126 NE2 HIS A 128 11.045 37.894 0.933 1.00 85.25 N ATOM 2127 HA HIS A 128 9.013 32.833 1.617 1.00 0.00 H ATOM 2128 HB2 HIS A 128 8.270 35.012 2.354 1.00 0.00 H ATOM 2129 HB3 HIS A 128 9.875 34.621 3.014 1.00 0.00 H ATOM 2130 HD2 HIS A 128 12.032 36.076 1.696 1.00 0.00 H ATOM 2131 HE1 HIS A 128 9.400 39.160 0.374 1.00 0.00 H ATOM 2132 H HIS A 128 11.593 34.048 1.075 1.00 0.00 H ATOM 2133 N ILE A 129 9.282 34.557 -1.137 1.00 57.67 N ATOM 2134 CA ILE A 129 8.636 34.817 -2.414 1.00 59.80 C ATOM 2135 C ILE A 129 8.308 33.514 -3.123 1.00 54.81 C ATOM 2136 O ILE A 129 7.195 33.317 -3.623 1.00 55.41 O ATOM 2137 CB ILE A 129 9.540 35.671 -3.312 1.00 65.17 C ATOM 2138 CG1 ILE A 129 9.745 37.047 -2.669 1.00 73.40 C ATOM 2139 CG2 ILE A 129 8.931 35.817 -4.706 1.00 66.75 C ATOM 2140 CD1 ILE A 129 10.747 37.937 -3.392 1.00 78.37 C ATOM 2141 HA ILE A 129 7.711 35.360 -2.217 1.00 0.00 H ATOM 2142 HB ILE A 129 10.506 35.177 -3.417 1.00 0.00 H ATOM 2143 HG12 ILE A 129 8.784 37.561 -2.650 1.00 0.00 H ATOM 2144 HG13 ILE A 129 10.096 36.897 -1.648 1.00 0.00 H ATOM 2145 HD11 ILE A 129 11.720 37.446 -3.410 1.00 0.00 H ATOM 2146 HD12 ILE A 129 10.407 38.110 -4.413 1.00 0.00 H ATOM 2147 HD13 ILE A 129 10.829 38.889 -2.868 1.00 0.00 H ATOM 2148 HG21 ILE A 129 8.816 34.831 -5.156 1.00 0.00 H ATOM 2149 HG22 ILE A 129 7.956 36.298 -4.627 1.00 0.00 H ATOM 2150 HG23 ILE A 129 9.588 36.426 -5.326 1.00 0.00 H ATOM 2151 H ILE A 129 10.271 34.846 -0.999 1.00 0.00 H ATOM 2152 N TYR A 130 9.282 32.617 -3.176 1.00 50.15 N ATOM 2153 CA TYR A 130 9.078 31.353 -3.842 1.00 48.13 C ATOM 2154 C TYR A 130 8.104 30.465 -3.063 1.00 46.80 C ATOM 2155 O TYR A 130 7.357 29.691 -3.660 1.00 44.51 O ATOM 2156 CB TYR A 130 10.418 30.641 -4.025 1.00 45.68 C ATOM 2157 CG TYR A 130 10.395 29.517 -5.024 1.00 44.38 C ATOM 2158 CD1 TYR A 130 10.040 29.730 -6.344 1.00 48.32 C ATOM 2159 CD2 TYR A 130 10.762 28.252 -4.657 1.00 39.44 C ATOM 2160 CE1 TYR A 130 10.026 28.681 -7.259 1.00 45.89 C ATOM 2161 CE2 TYR A 130 10.767 27.222 -5.552 1.00 38.92 C ATOM 2162 CZ TYR A 130 10.400 27.432 -6.847 1.00 41.16 C ATOM 2163 OH TYR A 130 10.410 26.367 -7.694 1.00 38.78 O ATOM 2164 HA TYR A 130 8.639 31.549 -4.820 1.00 0.00 H ATOM 2165 HB3 TYR A 130 10.722 30.234 -3.061 1.00 0.00 H ATOM 2166 HB2 TYR A 130 11.152 31.376 -4.356 1.00 0.00 H ATOM 2167 HD2 TYR A 130 11.058 28.062 -3.625 1.00 0.00 H ATOM 2168 HE2 TYR A 130 11.066 26.225 -5.229 1.00 0.00 H ATOM 2169 HE1 TYR A 130 9.721 28.853 -8.291 1.00 0.00 H ATOM 2170 HD1 TYR A 130 9.767 30.733 -6.672 1.00 0.00 H ATOM 2171 HH TYR A 130 10.124 26.661 -8.595 1.00 0.00 H ATOM 2172 H TYR A 130 10.200 32.825 -2.734 1.00 0.00 H ATOM 2173 N TYR A 131 8.136 30.541 -1.733 1.00 47.53 N ATOM 2174 CA TYR A 131 7.181 29.778 -0.929 1.00 46.26 C ATOM 2175 C TYR A 131 5.754 30.146 -1.345 1.00 49.07 C ATOM 2176 O TYR A 131 4.910 29.282 -1.601 1.00 48.44 O ATOM 2177 CB TYR A 131 7.339 30.061 0.573 1.00 46.83 C ATOM 2178 CG TYR A 131 6.364 29.241 1.382 1.00 46.84 C ATOM 2179 CD1 TYR A 131 5.057 29.684 1.612 1.00 52.46 C ATOM 2180 CD2 TYR A 131 6.735 28.010 1.889 1.00 41.77 C ATOM 2181 CE1 TYR A 131 4.161 28.913 2.341 1.00 53.52 C ATOM 2182 CE2 TYR A 131 5.860 27.242 2.616 1.00 43.27 C ATOM 2183 CZ TYR A 131 4.577 27.692 2.848 1.00 50.00 C ATOM 2184 OH TYR A 131 3.721 26.893 3.576 1.00 52.95 O ATOM 2185 HA TYR A 131 7.378 28.720 -1.104 1.00 0.00 H ATOM 2186 HB3 TYR A 131 7.155 31.119 0.758 1.00 0.00 H ATOM 2187 HB2 TYR A 131 8.355 29.811 0.878 1.00 0.00 H ATOM 2188 HD2 TYR A 131 7.744 27.641 1.708 1.00 0.00 H ATOM 2189 HE2 TYR A 131 6.179 26.277 3.010 1.00 0.00 H ATOM 2190 HE1 TYR A 131 3.143 29.264 2.512 1.00 0.00 H ATOM 2191 HD1 TYR A 131 4.738 30.647 1.214 1.00 0.00 H ATOM 2192 HH TYR A 131 3.605 26.026 3.112 1.00 0.00 H ATOM 2193 H TYR A 131 8.842 31.145 -1.265 1.00 0.00 H ATOM 2194 N LEU A 132 5.493 31.442 -1.404 1.00 54.59 N ATOM 2195 CA LEU A 132 4.168 31.939 -1.769 1.00 59.95 C ATOM 2196 C LEU A 132 3.697 31.444 -3.129 1.00 64.48 C ATOM 2197 O LEU A 132 2.531 31.082 -3.297 1.00 67.82 O ATOM 2198 CB LEU A 132 4.160 33.460 -1.767 1.00 64.23 C ATOM 2199 CG LEU A 132 3.916 34.135 -0.429 1.00 69.21 C ATOM 2200 CD1 LEU A 132 4.284 35.614 -0.529 1.00 72.91 C ATOM 2201 CD2 LEU A 132 2.459 33.981 -0.005 1.00 75.26 C ATOM 2202 HA LEU A 132 3.478 31.549 -1.020 1.00 0.00 H ATOM 2203 HB2 LEU A 132 5.129 33.797 -2.136 1.00 0.00 H ATOM 2204 HB3 LEU A 132 3.378 33.788 -2.451 1.00 0.00 H ATOM 2205 HG LEU A 132 4.541 33.658 0.326 1.00 0.00 H ATOM 2206 HD21 LEU A 132 1.813 34.439 -0.754 1.00 0.00 H ATOM 2207 HD22 LEU A 132 2.218 32.922 0.085 1.00 0.00 H ATOM 2208 HD23 LEU A 132 2.308 34.472 0.956 1.00 0.00 H ATOM 2209 HD11 LEU A 132 5.336 35.708 -0.797 1.00 0.00 H ATOM 2210 HD12 LEU A 132 3.669 36.089 -1.293 1.00 0.00 H ATOM 2211 HD13 LEU A 132 4.108 36.097 0.432 1.00 0.00 H ATOM 2212 H LEU A 132 6.248 32.123 -1.186 1.00 0.00 H ATOM 2213 N GLU A 133 4.600 31.439 -4.100 1.00 65.29 N ATOM 2214 CA GLU A 133 4.260 31.002 -5.446 1.00 65.35 C ATOM 2215 C GLU A 133 3.846 29.547 -5.468 1.00 59.90 C ATOM 2216 O GLU A 133 2.841 29.182 -6.066 1.00 63.19 O ATOM 2217 CB GLU A 133 5.456 31.169 -6.353 1.00 65.46 C ATOM 2218 CG GLU A 133 5.779 32.605 -6.674 1.00 71.94 C ATOM 2219 CD GLU A 133 6.909 32.697 -7.668 1.00 74.31 C ATOM 2220 OE1 GLU A 133 7.379 31.617 -8.114 1.00 72.56 O ATOM 2221 OE2 GLU A 133 7.321 33.833 -7.996 1.00 78.90 O ATOM 2222 HA GLU A 133 3.426 31.613 -5.790 1.00 0.00 H ATOM 2223 HB2 GLU A 133 6.323 30.722 -5.866 1.00 0.00 H ATOM 2224 HB3 GLU A 133 5.255 30.644 -7.287 1.00 0.00 H ATOM 2225 HG2 GLU A 133 4.895 33.084 -7.094 1.00 0.00 H ATOM 2226 HG3 GLU A 133 6.068 33.119 -5.757 1.00 0.00 H ATOM 2227 H GLU A 133 5.570 31.753 -3.896 1.00 0.00 H ATOM 2228 N LYS A 134 4.649 28.715 -4.821 1.00 51.05 N ATOM 2229 CA LYS A 134 4.372 27.303 -4.729 1.00 49.57 C ATOM 2230 C LYS A 134 3.011 27.075 -4.076 1.00 50.69 C ATOM 2231 O LYS A 134 2.222 26.239 -4.525 1.00 53.14 O ATOM 2232 CB LYS A 134 5.464 26.644 -3.888 1.00 50.04 C ATOM 2233 CG LYS A 134 6.069 25.424 -4.491 1.00 50.20 C ATOM 2234 CD LYS A 134 6.802 25.693 -5.779 1.00 48.19 C ATOM 2235 CE LYS A 134 7.913 24.681 -5.973 1.00 41.70 C ATOM 2236 NZ LYS A 134 7.964 24.190 -7.356 1.00 39.54 N ATOM 2237 HA LYS A 134 4.355 26.867 -5.728 1.00 0.00 H ATOM 2238 HB2 LYS A 134 6.258 27.374 -3.731 1.00 0.00 H ATOM 2239 HB3 LYS A 134 5.031 26.368 -2.927 1.00 0.00 H ATOM 2240 HG2 LYS A 134 6.772 24.997 -3.776 1.00 0.00 H ATOM 2241 HG3 LYS A 134 5.274 24.706 -4.689 1.00 0.00 H ATOM 2242 HD2 LYS A 134 6.103 25.624 -6.612 1.00 0.00 H ATOM 2243 HD3 LYS A 134 7.230 26.695 -5.747 1.00 0.00 H ATOM 2244 HE2 LYS A 134 7.744 23.837 -5.304 1.00 0.00 H ATOM 2245 HE3 LYS A 134 8.866 25.151 -5.729 1.00 0.00 H ATOM 2246 HZ1 LYS A 134 7.060 23.735 -7.594 1.00 0.00 H ATOM 2247 HZ2 LYS A 134 8.132 24.989 -8.000 1.00 0.00 H ATOM 2248 HZ3 LYS A 134 8.736 23.500 -7.449 1.00 0.00 H ATOM 2249 H LYS A 134 5.505 29.092 -4.366 1.00 0.00 H ATOM 2250 N ALA A 135 2.764 27.808 -2.994 1.00 49.71 N ATOM 2251 CA ALA A 135 1.543 27.664 -2.216 1.00 53.06 C ATOM 2252 C ALA A 135 0.320 28.005 -3.062 1.00 59.53 C ATOM 2253 O ALA A 135 -0.725 27.361 -2.947 1.00 63.11 O ATOM 2254 CB ALA A 135 1.599 28.576 -1.001 1.00 54.90 C ATOM 2255 HA ALA A 135 1.459 26.627 -1.890 1.00 0.00 H ATOM 2256 HB1 ALA A 135 2.456 28.305 -0.384 1.00 0.00 H ATOM 2257 HB2 ALA A 135 1.699 29.611 -1.329 1.00 0.00 H ATOM 2258 HB3 ALA A 135 0.682 28.464 -0.422 1.00 0.00 H ATOM 2259 H ALA A 135 3.470 28.510 -2.693 1.00 0.00 H ATOM 2260 N ASN A 136 0.467 29.025 -3.904 1.00 62.76 N ATOM 2261 CA ASN A 136 -0.598 29.472 -4.802 1.00 67.09 C ATOM 2262 C ASN A 136 -1.080 28.412 -5.776 1.00 67.41 C ATOM 2263 O ASN A 136 -2.258 28.401 -6.124 1.00 70.64 O ATOM 2264 CB ASN A 136 -0.149 30.697 -5.594 1.00 73.38 C ATOM 2265 CG ASN A 136 -0.155 31.966 -4.763 1.00 85.47 C ATOM 2266 OD1 ASN A 136 -0.734 32.010 -3.677 1.00 88.00 O ATOM 2267 ND2 ASN A 136 0.487 33.014 -5.277 1.00 93.59 N ATOM 2268 HA ASN A 136 -1.438 29.712 -4.150 1.00 0.00 H ATOM 2269 HB2 ASN A 136 0.863 30.524 -5.960 1.00 0.00 H ATOM 2270 HB3 ASN A 136 -0.822 30.831 -6.441 1.00 0.00 H ATOM 2271 HD22 ASN A 136 0.963 32.932 -6.198 1.00 0.00 H ATOM 2272 HD21 ASN A 136 0.513 33.914 -4.757 1.00 0.00 H ATOM 2273 H ASN A 136 1.378 29.526 -3.925 1.00 0.00 H ATOM 2274 N LYS A 137 -0.181 27.542 -6.233 1.00 70.73 N ATOM 2275 CA LYS A 137 -0.568 26.433 -7.108 1.00 79.19 C ATOM 2276 C LYS A 137 -1.209 25.277 -6.313 1.00 82.23 C ATOM 2277 O LYS A 137 -2.110 24.604 -6.802 1.00 89.26 O ATOM 2278 CB LYS A 137 0.636 25.927 -7.914 1.00 84.17 C ATOM 2279 CG LYS A 137 1.331 24.705 -7.307 1.00 91.19 C ATOM 2280 CD LYS A 137 2.655 24.367 -8.018 1.00 97.60 C ATOM 2281 CE LYS A 137 3.523 23.387 -7.199 1.00 97.22 C ATOM 2282 NZ LYS A 137 4.687 22.822 -7.971 1.00 94.76 N ATOM 2283 HA LYS A 137 -1.317 26.814 -7.803 1.00 0.00 H ATOM 2284 HB2 LYS A 137 0.291 25.663 -8.914 1.00 0.00 H ATOM 2285 HB3 LYS A 137 1.364 26.735 -7.984 1.00 0.00 H ATOM 2286 HG2 LYS A 137 1.539 24.907 -6.256 1.00 0.00 H ATOM 2287 HG3 LYS A 137 0.663 23.847 -7.385 1.00 0.00 H ATOM 2288 HD2 LYS A 137 2.430 23.914 -8.984 1.00 0.00 H ATOM 2289 HD3 LYS A 137 3.216 25.289 -8.172 1.00 0.00 H ATOM 2290 HE2 LYS A 137 2.893 22.560 -6.871 1.00 0.00 H ATOM 2291 HE3 LYS A 137 3.911 23.915 -6.328 1.00 0.00 H ATOM 2292 HZ1 LYS A 137 4.333 22.305 -8.801 1.00 0.00 H ATOM 2293 HZ2 LYS A 137 5.304 23.599 -8.283 1.00 0.00 H ATOM 2294 HZ3 LYS A 137 5.224 22.174 -7.361 1.00 0.00 H ATOM 2295 H LYS A 137 0.817 27.652 -5.963 1.00 0.00 H ATOM 2296 N ILE A 138 -0.737 25.059 -5.091 1.00 74.76 N ATOM 2297 CA ILE A 138 -1.216 23.972 -4.227 1.00 74.08 C ATOM 2298 C ILE A 138 -2.552 24.280 -3.515 1.00 81.48 C ATOM 2299 O ILE A 138 -3.316 23.364 -3.191 1.00 79.52 O ATOM 2300 CB ILE A 138 -0.116 23.614 -3.184 1.00 70.40 C ATOM 2301 CG1 ILE A 138 1.013 22.855 -3.882 1.00 62.59 C ATOM 2302 CG2 ILE A 138 -0.673 22.798 -2.011 1.00 73.18 C ATOM 2303 CD1 ILE A 138 2.242 22.642 -3.016 1.00 57.00 C ATOM 2304 HA ILE A 138 -1.417 23.121 -4.878 1.00 0.00 H ATOM 2305 HB ILE A 138 0.269 24.543 -2.764 1.00 0.00 H ATOM 2306 HG12 ILE A 138 0.634 21.879 -4.185 1.00 0.00 H ATOM 2307 HG13 ILE A 138 1.310 23.419 -4.766 1.00 0.00 H ATOM 2308 HD11 ILE A 138 2.643 23.609 -2.713 1.00 0.00 H ATOM 2309 HD12 ILE A 138 1.966 22.068 -2.131 1.00 0.00 H ATOM 2310 HD13 ILE A 138 2.995 22.097 -3.584 1.00 0.00 H ATOM 2311 HG21 ILE A 138 -1.446 23.375 -1.504 1.00 0.00 H ATOM 2312 HG22 ILE A 138 -1.099 21.868 -2.387 1.00 0.00 H ATOM 2313 HG23 ILE A 138 0.132 22.573 -1.311 1.00 0.00 H ATOM 2314 H ILE A 138 0.008 25.688 -4.728 1.00 0.00 H ATOM 2315 N LYS A 139 -2.798 25.564 -3.251 1.00 94.59 N ATOM 2316 CA LYS A 139 -4.084 26.057 -2.729 1.00105.03 C ATOM 2317 C LYS A 139 -4.542 25.356 -1.445 1.00107.29 C ATOM 2318 O LYS A 139 -3.857 25.426 -0.418 1.00106.94 O ATOM 2319 CB LYS A 139 -5.175 25.942 -3.797 1.00109.86 C ATOM 2320 CG LYS A 139 -4.945 26.767 -5.048 1.00110.49 C ATOM 2321 CD LYS A 139 -6.223 26.848 -5.875 1.00112.64 C ATOM 2322 CE LYS A 139 -6.773 25.462 -6.197 1.00108.90 C ATOM 2323 NZ LYS A 139 -7.995 25.517 -7.036 1.00112.19 N ATOM 2324 HA LYS A 139 -3.917 27.103 -2.471 1.00 0.00 H ATOM 2325 HB2 LYS A 139 -5.249 24.895 -4.092 1.00 0.00 H ATOM 2326 HB3 LYS A 139 -6.118 26.260 -3.352 1.00 0.00 H ATOM 2327 HG2 LYS A 139 -4.637 27.773 -4.763 1.00 0.00 H ATOM 2328 HG3 LYS A 139 -4.160 26.303 -5.645 1.00 0.00 H ATOM 2329 HD2 LYS A 139 -6.973 27.405 -5.314 1.00 0.00 H ATOM 2330 HD3 LYS A 139 -6.008 27.369 -6.808 1.00 0.00 H ATOM 2331 HE2 LYS A 139 -7.013 24.955 -5.262 1.00 0.00 H ATOM 2332 HE3 LYS A 139 -6.008 24.897 -6.730 1.00 0.00 H ATOM 2333 HZ1 LYS A 139 -8.735 26.047 -6.534 1.00 0.00 H ATOM 2334 HZ2 LYS A 139 -7.776 25.992 -7.935 1.00 0.00 H ATOM 2335 HZ3 LYS A 139 -8.328 24.550 -7.226 1.00 0.00 H ATOM 2336 H LYS A 139 -2.040 26.255 -3.423 1.00 0.00 H ATOM 2337 N SER A 140 -5.716 24.722 -1.491 1.00109.20 N ATOM 2338 CA SER A 140 -6.116 23.835 -0.416 1.00110.76 C ATOM 2339 C SER A 140 -5.027 22.781 -0.389 1.00113.62 C ATOM 2340 O SER A 140 -4.777 22.070 -1.370 1.00109.45 O ATOM 2341 CB SER A 140 -7.497 23.228 -0.674 1.00107.74 C ATOM 2342 OG SER A 140 -8.509 24.225 -0.619 1.00109.20 O ATOM 2343 HA SER A 140 -6.215 24.350 0.540 1.00 0.00 H ATOM 2344 HB2 SER A 140 -7.701 22.470 0.083 1.00 0.00 H ATOM 2345 HB3 SER A 140 -7.505 22.765 -1.661 1.00 0.00 H ATOM 2346 HG SER A 140 -9.391 23.808 -0.789 1.00 0.00 H ATOM 2347 H SER A 140 -6.348 24.865 -2.304 1.00 0.00 H ATOM 2348 N GLU A 141 -4.384 22.689 0.761 1.00122.28 N ATOM 2349 CA GLU A 141 -3.062 22.121 0.827 1.00118.34 C ATOM 2350 C GLU A 141 -2.986 21.148 1.969 1.00106.59 C ATOM 2351 O GLU A 141 -3.027 21.555 3.135 1.00116.73 O ATOM 2352 CB GLU A 141 -2.097 23.280 1.083 1.00124.63 C ATOM 2353 CG GLU A 141 -0.685 22.904 1.440 1.00123.90 C ATOM 2354 CD GLU A 141 0.199 24.125 1.641 1.00124.65 C ATOM 2355 OE1 GLU A 141 -0.156 25.215 1.138 1.00126.24 O ATOM 2356 OE2 GLU A 141 1.246 23.997 2.308 1.00123.53 O ATOM 2357 HA GLU A 141 -2.815 21.594 -0.095 1.00 0.00 H ATOM 2358 HB2 GLU A 141 -2.061 23.888 0.179 1.00 0.00 H ATOM 2359 HB3 GLU A 141 -2.501 23.874 1.903 1.00 0.00 H ATOM 2360 HG2 GLU A 141 -0.698 22.324 2.363 1.00 0.00 H ATOM 2361 HG3 GLU A 141 -0.269 22.297 0.636 1.00 0.00 H ATOM 2362 H GLU A 141 -4.839 23.032 1.631 1.00 0.00 H ATOM 2363 N LYS A 142 -2.878 19.865 1.655 1.00 81.92 N ATOM 2364 CA LYS A 142 -2.353 18.940 2.639 1.00 66.33 C ATOM 2365 C LYS A 142 -0.907 18.690 2.309 1.00 55.34 C ATOM 2366 O LYS A 142 -0.204 18.069 3.076 1.00 58.41 O ATOM 2367 CB LYS A 142 -3.151 17.639 2.710 1.00 69.11 C ATOM 2368 CG LYS A 142 -4.217 17.669 3.806 1.00 78.21 C ATOM 2369 CD LYS A 142 -5.230 16.546 3.665 1.00 86.14 C ATOM 2370 CE LYS A 142 -4.649 15.165 4.002 1.00 88.48 C ATOM 2371 NZ LYS A 142 -5.627 14.077 3.667 1.00 92.08 N ATOM 2372 HA LYS A 142 -2.442 19.382 3.631 1.00 0.00 H ATOM 2373 HB2 LYS A 142 -3.640 17.475 1.750 1.00 0.00 H ATOM 2374 HB3 LYS A 142 -2.464 16.817 2.912 1.00 0.00 H ATOM 2375 HG2 LYS A 142 -3.725 17.577 4.774 1.00 0.00 H ATOM 2376 HG3 LYS A 142 -4.743 18.622 3.756 1.00 0.00 H ATOM 2377 HD2 LYS A 142 -6.065 16.745 4.337 1.00 0.00 H ATOM 2378 HD3 LYS A 142 -5.589 16.530 2.636 1.00 0.00 H ATOM 2379 HE2 LYS A 142 -4.420 15.124 5.067 1.00 0.00 H ATOM 2380 HE3 LYS A 142 -3.735 15.012 3.429 1.00 0.00 H ATOM 2381 HZ1 LYS A 142 -6.500 14.216 4.215 1.00 0.00 H ATOM 2382 HZ2 LYS A 142 -5.845 14.110 2.651 1.00 0.00 H ATOM 2383 HZ3 LYS A 142 -5.211 13.154 3.904 1.00 0.00 H ATOM 2384 H LYS A 142 -3.166 19.527 0.715 1.00 0.00 H ATOM 2385 N THR A 143 -0.468 19.232 1.178 1.00 45.19 N ATOM 2386 CA THR A 143 0.892 19.041 0.684 1.00 42.79 C ATOM 2387 C THR A 143 1.831 19.997 1.421 1.00 41.66 C ATOM 2388 O THR A 143 1.629 21.203 1.426 1.00 44.87 O ATOM 2389 CB THR A 143 0.976 19.288 -0.825 1.00 44.20 C ATOM 2390 OG1 THR A 143 0.229 18.280 -1.500 1.00 46.92 O ATOM 2391 CG2 THR A 143 2.398 19.230 -1.349 1.00 40.19 C ATOM 2392 HA THR A 143 1.188 18.009 0.870 1.00 0.00 H ATOM 2393 HB THR A 143 0.581 20.287 -1.008 1.00 0.00 H ATOM 2394 HG1 THR A 143 0.278 18.433 -2.477 1.00 0.00 H ATOM 2395 HG23 THR A 143 2.999 19.991 -0.851 1.00 0.00 H ATOM 2396 HG21 THR A 143 2.818 18.245 -1.147 1.00 0.00 H ATOM 2397 HG22 THR A 143 2.396 19.412 -2.424 1.00 0.00 H ATOM 2398 H THR A 143 -1.122 19.818 0.621 1.00 0.00 H ATOM 2399 N HIS A 144 2.862 19.438 2.033 1.00 35.76 N ATOM 2400 CA HIS A 144 3.812 20.242 2.784 1.00 33.47 C ATOM 2401 C HIS A 144 4.833 20.840 1.830 1.00 32.86 C ATOM 2402 O HIS A 144 5.314 20.149 0.953 1.00 34.56 O ATOM 2403 CB HIS A 144 4.490 19.333 3.786 1.00 32.24 C ATOM 2404 CG HIS A 144 4.928 20.029 5.031 1.00 35.63 C ATOM 2405 ND1 HIS A 144 4.052 20.382 6.025 1.00 38.48 N ATOM 2406 CD2 HIS A 144 6.148 20.464 5.427 1.00 36.85 C ATOM 2407 CE1 HIS A 144 4.713 20.981 6.997 1.00 43.02 C ATOM 2408 NE2 HIS A 144 5.985 21.052 6.651 1.00 40.55 N ATOM 2409 HA HIS A 144 3.311 21.059 3.302 1.00 0.00 H ATOM 2410 HB2 HIS A 144 3.791 18.543 4.061 1.00 0.00 H ATOM 2411 HB3 HIS A 144 5.367 18.892 3.312 1.00 0.00 H ATOM 2412 HD2 HIS A 144 7.083 20.364 4.875 1.00 0.00 H ATOM 2413 HE1 HIS A 144 4.283 21.353 7.927 1.00 0.00 H ATOM 2414 H HIS A 144 2.995 18.408 1.976 1.00 0.00 H ATOM 2415 N ILE A 145 5.213 22.103 2.013 1.00 31.89 N ATOM 2416 CA ILE A 145 6.198 22.721 1.158 1.00 30.64 C ATOM 2417 C ILE A 145 7.474 22.962 1.937 1.00 30.56 C ATOM 2418 O ILE A 145 7.407 23.456 3.068 1.00 31.52 O ATOM 2419 CB ILE A 145 5.676 24.074 0.663 1.00 35.58 C ATOM 2420 CG1 ILE A 145 4.401 23.851 -0.146 1.00 37.93 C ATOM 2421 CG2 ILE A 145 6.711 24.777 -0.186 1.00 36.52 C ATOM 2422 CD1 ILE A 145 3.610 25.098 -0.321 1.00 44.15 C ATOM 2423 HA ILE A 145 6.392 22.060 0.314 1.00 0.00 H ATOM 2424 HB ILE A 145 5.463 24.707 1.525 1.00 0.00 H ATOM 2425 HG12 ILE A 145 4.674 23.469 -1.130 1.00 0.00 H ATOM 2426 HG13 ILE A 145 3.784 23.115 0.370 1.00 0.00 H ATOM 2427 HD11 ILE A 145 3.324 25.485 0.657 1.00 0.00 H ATOM 2428 HD12 ILE A 145 4.214 25.839 -0.844 1.00 0.00 H ATOM 2429 HD13 ILE A 145 2.715 24.880 -0.903 1.00 0.00 H ATOM 2430 HG21 ILE A 145 7.611 24.944 0.405 1.00 0.00 H ATOM 2431 HG22 ILE A 145 6.952 24.158 -1.050 1.00 0.00 H ATOM 2432 HG23 ILE A 145 6.313 25.734 -0.523 1.00 0.00 H ATOM 2433 H ILE A 145 4.792 22.655 2.787 1.00 0.00 H ATOM 2434 N HIS A 146 8.615 22.650 1.329 1.00 28.38 N ATOM 2435 CA HIS A 146 9.913 22.958 1.911 1.00 29.61 C ATOM 2436 C HIS A 146 10.838 23.568 0.851 1.00 29.49 C ATOM 2437 O HIS A 146 11.163 22.922 -0.151 1.00 30.00 O ATOM 2438 CB HIS A 146 10.519 21.673 2.477 1.00 29.26 C ATOM 2439 CG HIS A 146 11.647 21.895 3.429 1.00 30.65 C ATOM 2440 ND1 HIS A 146 11.861 21.077 4.519 1.00 31.69 N ATOM 2441 CD2 HIS A 146 12.609 22.847 3.474 1.00 32.30 C ATOM 2442 CE1 HIS A 146 12.914 21.508 5.191 1.00 33.33 C ATOM 2443 NE2 HIS A 146 13.387 22.580 4.578 1.00 33.27 N ATOM 2444 HA HIS A 146 9.793 23.686 2.713 1.00 0.00 H ATOM 2445 HB2 HIS A 146 9.734 21.126 2.999 1.00 0.00 H ATOM 2446 HB3 HIS A 146 10.887 21.073 1.645 1.00 0.00 H ATOM 2447 HD2 HIS A 146 12.742 23.668 2.770 1.00 0.00 H ATOM 2448 HE1 HIS A 146 13.323 21.057 6.095 1.00 0.00 H ATOM 2449 H HIS A 146 8.579 22.170 0.407 1.00 0.00 H ATOM 2450 N ILE A 147 11.223 24.826 1.079 1.00 32.02 N ATOM 2451 CA ILE A 147 12.022 25.612 0.151 1.00 32.52 C ATOM 2452 C ILE A 147 13.457 25.775 0.691 1.00 33.18 C ATOM 2453 O ILE A 147 13.640 26.100 1.871 1.00 32.60 O ATOM 2454 CB ILE A 147 11.444 27.017 -0.012 1.00 35.09 C ATOM 2455 CG1 ILE A 147 9.943 26.997 -0.338 1.00 39.23 C ATOM 2456 CG2 ILE A 147 12.198 27.799 -1.070 1.00 33.50 C ATOM 2457 CD1 ILE A 147 9.582 26.267 -1.619 1.00 40.36 C ATOM 2458 HA ILE A 147 12.018 25.086 -0.804 1.00 0.00 H ATOM 2459 HB ILE A 147 11.566 27.516 0.949 1.00 0.00 H ATOM 2460 HG12 ILE A 147 9.422 26.512 0.488 1.00 0.00 H ATOM 2461 HG13 ILE A 147 9.601 28.028 -0.426 1.00 0.00 H ATOM 2462 HD11 ILE A 147 10.082 26.745 -2.461 1.00 0.00 H ATOM 2463 HD12 ILE A 147 9.903 25.228 -1.546 1.00 0.00 H ATOM 2464 HD13 ILE A 147 8.503 26.305 -1.766 1.00 0.00 H ATOM 2465 HG21 ILE A 147 13.245 27.884 -0.780 1.00 0.00 H ATOM 2466 HG22 ILE A 147 12.125 27.279 -2.025 1.00 0.00 H ATOM 2467 HG23 ILE A 147 11.763 28.794 -1.163 1.00 0.00 H ATOM 2468 H ILE A 147 10.934 25.271 1.974 1.00 0.00 H ATOM 2469 N PHE A 148 14.439 25.504 -0.164 1.00 30.75 N ATOM 2470 CA PHE A 148 15.843 25.797 0.088 1.00 30.82 C ATOM 2471 C PHE A 148 16.314 26.852 -0.903 1.00 32.56 C ATOM 2472 O PHE A 148 15.954 26.793 -2.074 1.00 33.21 O ATOM 2473 CB PHE A 148 16.688 24.540 -0.151 1.00 29.68 C ATOM 2474 CG PHE A 148 16.347 23.377 0.744 1.00 29.95 C ATOM 2475 CD1 PHE A 148 15.396 22.449 0.373 1.00 29.54 C ATOM 2476 CD2 PHE A 148 16.999 23.203 1.948 1.00 31.16 C ATOM 2477 CE1 PHE A 148 15.095 21.385 1.201 1.00 29.35 C ATOM 2478 CE2 PHE A 148 16.701 22.142 2.758 1.00 29.52 C ATOM 2479 CZ PHE A 148 15.760 21.235 2.378 1.00 28.69 C ATOM 2480 HA PHE A 148 15.952 26.141 1.117 1.00 0.00 H ATOM 2481 HB2 PHE A 148 16.547 24.226 -1.185 1.00 0.00 H ATOM 2482 HB3 PHE A 148 17.735 24.798 0.010 1.00 0.00 H ATOM 2483 HD2 PHE A 148 17.760 23.919 2.257 1.00 0.00 H ATOM 2484 HE2 PHE A 148 17.218 22.023 3.710 1.00 0.00 H ATOM 2485 HZ PHE A 148 15.538 20.383 3.021 1.00 0.00 H ATOM 2486 HE1 PHE A 148 14.327 20.668 0.912 1.00 0.00 H ATOM 2487 HD1 PHE A 148 14.878 22.556 -0.580 1.00 0.00 H ATOM 2488 H PHE A 148 14.189 25.055 -1.068 1.00 0.00 H ATOM 2489 N SER A 149 17.146 27.787 -0.469 1.00 36.28 N ATOM 2490 CA SER A 149 17.826 28.681 -1.388 1.00 40.39 C ATOM 2491 C SER A 149 19.273 28.262 -1.494 1.00 42.81 C ATOM 2492 O SER A 149 19.753 27.459 -0.699 1.00 48.19 O ATOM 2493 CB SER A 149 17.743 30.132 -0.913 1.00 46.12 C ATOM 2494 OG SER A 149 18.738 30.421 0.053 1.00 48.03 O ATOM 2495 HA SER A 149 17.341 28.619 -2.362 1.00 0.00 H ATOM 2496 HB2 SER A 149 16.761 30.305 -0.473 1.00 0.00 H ATOM 2497 HB3 SER A 149 17.878 30.793 -1.769 1.00 0.00 H ATOM 2498 HG SER A 149 18.655 31.366 0.338 1.00 0.00 H ATOM 2499 H SER A 149 17.316 27.882 0.553 1.00 0.00 H ATOM 2500 N PHE A 150 20.009 28.894 -2.392 1.00 39.26 N ATOM 2501 CA PHE A 150 21.434 28.594 -2.533 1.00 39.56 C ATOM 2502 C PHE A 150 22.327 29.253 -1.450 1.00 44.64 C ATOM 2503 O PHE A 150 23.507 28.929 -1.343 1.00 47.81 O ATOM 2504 CB PHE A 150 21.945 28.981 -3.938 1.00 38.66 C ATOM 2505 CG PHE A 150 21.577 27.993 -5.014 1.00 36.10 C ATOM 2506 CD1 PHE A 150 20.342 28.055 -5.656 1.00 36.68 C ATOM 2507 CD2 PHE A 150 22.488 27.022 -5.437 1.00 33.80 C ATOM 2508 CE1 PHE A 150 20.026 27.142 -6.667 1.00 37.03 C ATOM 2509 CE2 PHE A 150 22.171 26.135 -6.441 1.00 32.37 C ATOM 2510 CZ PHE A 150 20.950 26.191 -7.062 1.00 33.44 C ATOM 2511 HA PHE A 150 21.516 27.516 -2.392 1.00 0.00 H ATOM 2512 HB2 PHE A 150 21.522 29.950 -4.202 1.00 0.00 H ATOM 2513 HB3 PHE A 150 23.032 29.058 -3.899 1.00 0.00 H ATOM 2514 HD2 PHE A 150 23.468 26.966 -4.963 1.00 0.00 H ATOM 2515 HE2 PHE A 150 22.897 25.381 -6.745 1.00 0.00 H ATOM 2516 HZ PHE A 150 20.709 25.491 -7.862 1.00 0.00 H ATOM 2517 HE1 PHE A 150 19.048 27.180 -7.146 1.00 0.00 H ATOM 2518 HD1 PHE A 150 19.619 28.818 -5.369 1.00 0.00 H ATOM 2519 H PHE A 150 19.571 29.611 -3.004 1.00 0.00 H ATOM 2520 N THR A 151 21.759 30.196 -0.704 1.00 43.89 N ATOM 2521 CA THR A 151 22.462 30.921 0.353 1.00 48.53 C ATOM 2522 C THR A 151 22.182 30.364 1.775 1.00 42.84 C ATOM 2523 O THR A 151 22.553 30.963 2.790 1.00 43.22 O ATOM 2524 CB THR A 151 22.195 32.428 0.223 1.00 56.47 C ATOM 2525 OG1 THR A 151 20.794 32.695 0.290 1.00 59.32 O ATOM 2526 CG2 THR A 151 22.706 32.919 -1.108 1.00 58.92 C ATOM 2527 HA THR A 151 23.531 30.759 0.215 1.00 0.00 H ATOM 2528 HB THR A 151 22.705 32.938 1.040 1.00 0.00 H ATOM 2529 HG1 THR A 151 20.440 32.379 1.159 1.00 0.00 H ATOM 2530 HG23 THR A 151 23.776 32.724 -1.179 1.00 0.00 H ATOM 2531 HG21 THR A 151 22.186 32.396 -1.911 1.00 0.00 H ATOM 2532 HG22 THR A 151 22.524 33.990 -1.193 1.00 0.00 H ATOM 2533 H THR A 151 20.761 30.430 -0.882 1.00 0.00 H ATOM 2534 N GLY A 152 21.478 29.245 1.850 1.00 42.07 N ATOM 2535 CA GLY A 152 21.252 28.586 3.126 1.00 45.73 C ATOM 2536 C GLY A 152 19.937 28.880 3.823 1.00 47.58 C ATOM 2537 O GLY A 152 19.661 28.280 4.875 1.00 47.59 O ATOM 2538 HA3 GLY A 152 22.056 28.884 3.799 1.00 0.00 H ATOM 2539 HA2 GLY A 152 21.302 27.511 2.956 1.00 0.00 H ATOM 2540 H GLY A 152 21.081 28.831 0.983 1.00 0.00 H ATOM 2541 N GLU A 153 19.133 29.797 3.274 1.00 47.25 N ATOM 2542 CA GLU A 153 17.816 30.122 3.845 1.00 45.76 C ATOM 2543 C GLU A 153 16.840 28.969 3.562 1.00 38.89 C ATOM 2544 O GLU A 153 17.003 28.270 2.591 1.00 36.54 O ATOM 2545 CB GLU A 153 17.255 31.409 3.255 1.00 52.59 C ATOM 2546 CG GLU A 153 18.008 32.669 3.705 1.00 64.41 C ATOM 2547 CD GLU A 153 19.225 32.993 2.835 1.00 72.51 C ATOM 2548 OE1 GLU A 153 19.511 32.235 1.882 1.00 67.59 O ATOM 2549 OE2 GLU A 153 19.898 34.020 3.106 1.00 83.79 O ATOM 2550 HA GLU A 153 17.938 30.263 4.919 1.00 0.00 H ATOM 2551 HB2 GLU A 153 17.310 31.343 2.168 1.00 0.00 H ATOM 2552 HB3 GLU A 153 16.213 31.503 3.559 1.00 0.00 H ATOM 2553 HG2 GLU A 153 17.321 33.514 3.667 1.00 0.00 H ATOM 2554 HG3 GLU A 153 18.346 32.522 4.731 1.00 0.00 H ATOM 2555 H GLU A 153 19.448 30.296 2.417 1.00 0.00 H ATOM 2556 N GLU A 154 15.877 28.737 4.463 1.00 40.82 N ATOM 2557 CA GLU A 154 14.842 27.733 4.233 1.00 41.01 C ATOM 2558 C GLU A 154 13.522 28.305 4.680 1.00 38.87 C ATOM 2559 O GLU A 154 13.477 29.117 5.585 1.00 39.32 O ATOM 2560 CB GLU A 154 15.020 26.468 5.076 1.00 45.09 C ATOM 2561 CG GLU A 154 16.274 25.665 4.951 1.00 44.36 C ATOM 2562 CD GLU A 154 16.316 24.558 6.022 1.00 41.15 C ATOM 2563 OE1 GLU A 154 16.999 24.767 7.037 1.00 40.85 O ATOM 2564 OE2 GLU A 154 15.662 23.501 5.847 1.00 36.62 O ATOM 2565 HA GLU A 154 14.896 27.479 3.174 1.00 0.00 H ATOM 2566 HB2 GLU A 154 14.941 26.770 6.120 1.00 0.00 H ATOM 2567 HB3 GLU A 154 14.193 25.803 4.827 1.00 0.00 H ATOM 2568 HG2 GLU A 154 16.311 25.209 3.962 1.00 0.00 H ATOM 2569 HG3 GLU A 154 17.135 26.321 5.079 1.00 0.00 H ATOM 2570 H GLU A 154 15.866 29.285 5.347 1.00 0.00 H ATOM 2571 N MET A 155 12.442 27.846 4.062 1.00 36.51 N ATOM 2572 CA MET A 155 11.108 28.156 4.549 1.00 38.73 C ATOM 2573 C MET A 155 10.271 26.916 4.372 1.00 37.60 C ATOM 2574 O MET A 155 10.323 26.253 3.325 1.00 39.12 O ATOM 2575 CB MET A 155 10.470 29.324 3.809 1.00 40.55 C ATOM 2576 CG MET A 155 9.057 29.587 4.292 1.00 44.56 C ATOM 2577 SD MET A 155 8.376 31.187 3.822 1.00 58.89 S ATOM 2578 CE MET A 155 9.519 32.330 4.600 1.00 71.49 C ATOM 2579 HA MET A 155 11.171 28.456 5.595 1.00 0.00 H ATOM 2580 HB2 MET A 155 11.072 30.218 3.973 1.00 0.00 H ATOM 2581 HB3 MET A 155 10.443 29.096 2.744 1.00 0.00 H ATOM 2582 HG2 MET A 155 9.054 29.525 5.380 1.00 0.00 H ATOM 2583 HG3 MET A 155 8.410 28.811 3.883 1.00 0.00 H ATOM 2584 HE1 MET A 155 9.517 32.167 5.678 1.00 0.00 H ATOM 2585 HE2 MET A 155 10.522 32.162 4.208 1.00 0.00 H ATOM 2586 HE3 MET A 155 9.210 33.353 4.386 1.00 0.00 H ATOM 2587 H MET A 155 12.551 27.254 3.214 1.00 0.00 H ATOM 2588 N ALA A 156 9.504 26.566 5.395 1.00 35.90 N ATOM 2589 CA ALA A 156 8.662 25.369 5.294 1.00 35.30 C ATOM 2590 C ALA A 156 7.328 25.596 5.978 1.00 36.29 C ATOM 2591 O ALA A 156 7.216 26.389 6.903 1.00 38.69 O ATOM 2592 CB ALA A 156 9.347 24.162 5.893 1.00 35.76 C ATOM 2593 HA ALA A 156 8.492 25.176 4.235 1.00 0.00 H ATOM 2594 HB1 ALA A 156 10.281 23.975 5.362 1.00 0.00 H ATOM 2595 HB2 ALA A 156 9.557 24.350 6.946 1.00 0.00 H ATOM 2596 HB3 ALA A 156 8.695 23.293 5.801 1.00 0.00 H ATOM 2597 H ALA A 156 9.499 27.137 6.264 1.00 0.00 H ATOM 2598 N THR A 157 6.326 24.871 5.494 1.00 36.04 N ATOM 2599 CA THR A 157 4.956 24.994 5.963 1.00 38.63 C ATOM 2600 C THR A 157 4.882 24.849 7.477 1.00 39.89 C ATOM 2601 O THR A 157 5.426 23.894 8.039 1.00 38.70 O ATOM 2602 CB THR A 157 4.087 23.914 5.297 1.00 39.36 C ATOM 2603 OG1 THR A 157 4.153 24.057 3.875 1.00 37.50 O ATOM 2604 CG2 THR A 157 2.645 23.988 5.761 1.00 43.88 C ATOM 2605 HA THR A 157 4.587 25.984 5.695 1.00 0.00 H ATOM 2606 HB THR A 157 4.476 22.939 5.589 1.00 0.00 H ATOM 2607 HG1 THR A 157 3.820 24.953 3.619 1.00 0.00 H ATOM 2608 HG23 THR A 157 2.607 23.878 6.845 1.00 0.00 H ATOM 2609 HG21 THR A 157 2.222 24.952 5.477 1.00 0.00 H ATOM 2610 HG22 THR A 157 2.073 23.187 5.293 1.00 0.00 H ATOM 2611 H THR A 157 6.532 24.182 4.743 1.00 0.00 H ATOM 2612 N LYS A 158 4.234 25.824 8.106 1.00 42.60 N ATOM 2613 CA LYS A 158 3.966 25.827 9.545 1.00 46.57 C ATOM 2614 C LYS A 158 5.232 25.739 10.377 1.00 46.10 C ATOM 2615 O LYS A 158 5.184 25.307 11.523 1.00 47.24 O ATOM 2616 CB LYS A 158 3.015 24.694 9.906 1.00 49.93 C ATOM 2617 CG LYS A 158 1.617 24.895 9.319 1.00 58.90 C ATOM 2618 CD LYS A 158 0.660 23.788 9.742 1.00 66.40 C ATOM 2619 CE LYS A 158 -0.768 24.065 9.273 1.00 73.65 C ATOM 2620 NZ LYS A 158 -0.923 23.831 7.805 1.00 74.05 N ATOM 2621 HA LYS A 158 3.499 26.783 9.780 1.00 0.00 H ATOM 2622 HB2 LYS A 158 3.424 23.759 9.524 1.00 0.00 H ATOM 2623 HB3 LYS A 158 2.934 24.637 10.992 1.00 0.00 H ATOM 2624 HG2 LYS A 158 1.224 25.852 9.663 1.00 0.00 H ATOM 2625 HG3 LYS A 158 1.689 24.903 8.231 1.00 0.00 H ATOM 2626 HD2 LYS A 158 0.997 22.845 9.311 1.00 0.00 H ATOM 2627 HD3 LYS A 158 0.666 23.712 10.829 1.00 0.00 H ATOM 2628 HE2 LYS A 158 -1.018 25.103 9.494 1.00 0.00 H ATOM 2629 HE3 LYS A 158 -1.451 23.406 9.810 1.00 0.00 H ATOM 2630 HZ1 LYS A 158 -0.279 24.461 7.285 1.00 0.00 H ATOM 2631 HZ2 LYS A 158 -0.693 22.841 7.587 1.00 0.00 H ATOM 2632 HZ3 LYS A 158 -1.905 24.029 7.525 1.00 0.00 H ATOM 2633 H LYS A 158 3.898 26.631 7.543 1.00 0.00 H ATOM 2634 N ALA A 159 6.353 26.171 9.795 1.00 45.04 N ATOM 2635 CA ALA A 159 7.656 26.150 10.470 1.00 45.45 C ATOM 2636 C ALA A 159 7.984 24.732 10.915 1.00 42.24 C ATOM 2637 O ALA A 159 8.670 24.531 11.921 1.00 43.91 O ATOM 2638 CB ALA A 159 7.668 27.094 11.655 1.00 50.32 C ATOM 2639 HA ALA A 159 8.417 26.487 9.766 1.00 0.00 H ATOM 2640 HB1 ALA A 159 7.468 28.109 11.311 1.00 0.00 H ATOM 2641 HB2 ALA A 159 6.900 26.792 12.367 1.00 0.00 H ATOM 2642 HB3 ALA A 159 8.645 27.058 12.136 1.00 0.00 H ATOM 2643 H ALA A 159 6.301 26.538 8.823 1.00 0.00 H ATOM 2644 N ASP A 160 7.440 23.778 10.178 1.00 38.81 N ATOM 2645 CA ASP A 160 7.700 22.348 10.341 1.00 38.79 C ATOM 2646 C ASP A 160 8.704 21.894 9.262 1.00 36.25 C ATOM 2647 O ASP A 160 8.354 21.774 8.104 1.00 35.23 O ATOM 2648 CB ASP A 160 6.376 21.573 10.210 1.00 41.34 C ATOM 2649 CG ASP A 160 6.538 20.063 10.394 1.00 43.64 C ATOM 2650 OD1 ASP A 160 7.683 19.544 10.348 1.00 42.94 O ATOM 2651 OD2 ASP A 160 5.493 19.379 10.569 1.00 45.71 O ATOM 2652 HA ASP A 160 8.125 22.150 11.325 1.00 0.00 H ATOM 2653 HB2 ASP A 160 5.683 21.942 10.966 1.00 0.00 H ATOM 2654 HB3 ASP A 160 5.963 21.759 9.219 1.00 0.00 H ATOM 2655 H ASP A 160 6.779 24.066 9.428 1.00 0.00 H ATOM 2656 N TYR A 161 9.939 21.607 9.682 1.00 35.16 N ATOM 2657 CA TYR A 161 11.079 21.405 8.759 1.00 33.36 C ATOM 2658 C TYR A 161 11.342 19.940 8.422 1.00 33.38 C ATOM 2659 O TYR A 161 12.213 19.606 7.621 1.00 30.95 O ATOM 2660 CB TYR A 161 12.297 22.152 9.333 1.00 34.22 C ATOM 2661 CG TYR A 161 12.081 23.602 9.099 1.00 36.43 C ATOM 2662 CD1 TYR A 161 11.350 24.376 9.987 1.00 40.26 C ATOM 2663 CD2 TYR A 161 12.512 24.178 7.924 1.00 37.82 C ATOM 2664 CE1 TYR A 161 11.101 25.721 9.735 1.00 44.48 C ATOM 2665 CE2 TYR A 161 12.275 25.502 7.657 1.00 41.84 C ATOM 2666 CZ TYR A 161 11.549 26.257 8.527 1.00 46.70 C ATOM 2667 OH TYR A 161 11.324 27.561 8.181 1.00 53.25 O ATOM 2668 HA TYR A 161 10.836 21.830 7.785 1.00 0.00 H ATOM 2669 HB3 TYR A 161 13.206 21.825 8.829 1.00 0.00 H ATOM 2670 HB2 TYR A 161 12.385 21.956 10.402 1.00 0.00 H ATOM 2671 HD2 TYR A 161 13.050 23.572 7.195 1.00 0.00 H ATOM 2672 HE2 TYR A 161 12.669 25.951 6.745 1.00 0.00 H ATOM 2673 HE1 TYR A 161 10.571 26.339 10.460 1.00 0.00 H ATOM 2674 HD1 TYR A 161 10.963 23.922 10.899 1.00 0.00 H ATOM 2675 HH TYR A 161 10.789 28.001 8.888 1.00 0.00 H ATOM 2676 H TYR A 161 10.108 21.521 10.705 1.00 0.00 H ATOM 2677 N THR A 162 10.564 19.062 9.061 1.00 34.30 N ATOM 2678 CA THR A 162 10.454 17.625 8.781 1.00 35.72 C ATOM 2679 C THR A 162 11.712 16.814 9.110 1.00 37.86 C ATOM 2680 O THR A 162 11.634 15.867 9.893 1.00 39.46 O ATOM 2681 CB THR A 162 10.172 17.369 7.257 1.00 36.09 C ATOM 2682 OG1 THR A 162 8.864 17.844 6.893 1.00 34.15 O ATOM 2683 CG2 THR A 162 10.269 15.912 6.893 1.00 36.00 C ATOM 2684 HA THR A 162 9.637 17.298 9.425 1.00 0.00 H ATOM 2685 HB THR A 162 10.939 17.917 6.709 1.00 0.00 H ATOM 2686 HG1 THR A 162 8.806 18.816 7.070 1.00 0.00 H ATOM 2687 HG23 THR A 162 11.256 15.536 7.163 1.00 0.00 H ATOM 2688 HG21 THR A 162 9.506 15.352 7.433 1.00 0.00 H ATOM 2689 HG22 THR A 162 10.116 15.796 5.820 1.00 0.00 H ATOM 2690 H THR A 162 9.977 19.434 9.835 1.00 0.00 H ATOM 2691 N LEU A 163 12.878 17.340 8.743 1.00 35.55 N ATOM 2692 CA LEU A 163 14.146 16.635 8.911 1.00 34.99 C ATOM 2693 C LEU A 163 14.981 17.318 9.991 1.00 34.15 C ATOM 2694 O LEU A 163 14.772 18.478 10.303 1.00 34.94 O ATOM 2695 CB LEU A 163 14.973 16.620 7.608 1.00 33.02 C ATOM 2696 CG LEU A 163 14.378 15.892 6.398 1.00 35.17 C ATOM 2697 CD1 LEU A 163 15.334 16.028 5.262 1.00 35.07 C ATOM 2698 CD2 LEU A 163 14.083 14.441 6.756 1.00 37.57 C ATOM 2699 HA LEU A 163 13.907 15.609 9.192 1.00 0.00 H ATOM 2700 HB2 LEU A 163 15.140 17.657 7.315 1.00 0.00 H ATOM 2701 HB3 LEU A 163 15.930 16.149 7.834 1.00 0.00 H ATOM 2702 HG LEU A 163 13.426 16.332 6.099 1.00 0.00 H ATOM 2703 HD21 LEU A 163 15.008 13.946 7.054 1.00 0.00 H ATOM 2704 HD22 LEU A 163 13.371 14.409 7.580 1.00 0.00 H ATOM 2705 HD23 LEU A 163 13.661 13.933 5.889 1.00 0.00 H ATOM 2706 HD11 LEU A 163 15.477 17.084 5.034 1.00 0.00 H ATOM 2707 HD12 LEU A 163 16.290 15.582 5.538 1.00 0.00 H ATOM 2708 HD13 LEU A 163 14.932 15.517 4.387 1.00 0.00 H ATOM 2709 H LEU A 163 12.887 18.290 8.320 1.00 0.00 H ATOM 2710 N ASP A 164 15.915 16.565 10.560 1.00 33.82 N ATOM 2711 CA ASP A 164 16.912 17.068 11.510 1.00 36.75 C ATOM 2712 C ASP A 164 17.857 18.072 10.843 1.00 35.03 C ATOM 2713 O ASP A 164 17.952 18.122 9.595 1.00 33.41 O ATOM 2714 CB ASP A 164 17.749 15.891 11.985 1.00 42.71 C ATOM 2715 CG ASP A 164 18.438 15.186 10.812 1.00 44.40 C ATOM 2716 OD1 ASP A 164 17.749 14.557 9.966 1.00 44.69 O ATOM 2717 OD2 ASP A 164 19.662 15.294 10.691 1.00 46.06 O ATOM 2718 HA ASP A 164 16.392 17.560 12.332 1.00 0.00 H ATOM 2719 HB2 ASP A 164 18.509 16.252 12.678 1.00 0.00 H ATOM 2720 HB3 ASP A 164 17.102 15.179 12.497 1.00 0.00 H ATOM 2721 H ASP A 164 15.941 15.554 10.316 1.00 0.00 H ATOM 2722 N GLU A 165 18.565 18.853 11.661 1.00 38.80 N ATOM 2723 CA GLU A 165 19.470 19.879 11.152 1.00 39.25 C ATOM 2724 C GLU A 165 20.593 19.303 10.311 1.00 39.03 C ATOM 2725 O GLU A 165 20.976 19.923 9.301 1.00 38.66 O ATOM 2726 CB GLU A 165 20.058 20.730 12.304 1.00 43.91 C ATOM 2727 CG GLU A 165 18.998 21.527 13.065 1.00 44.65 C ATOM 2728 CD GLU A 165 18.439 22.688 12.253 1.00 43.78 C ATOM 2729 OE1 GLU A 165 19.211 23.379 11.521 1.00 43.26 O ATOM 2730 OE2 GLU A 165 17.219 22.922 12.341 1.00 42.72 O ATOM 2731 HA GLU A 165 18.869 20.519 10.506 1.00 0.00 H ATOM 2732 HB2 GLU A 165 20.561 20.064 13.005 1.00 0.00 H ATOM 2733 HB3 GLU A 165 20.782 21.428 11.885 1.00 0.00 H ATOM 2734 HG2 GLU A 165 18.179 20.857 13.326 1.00 0.00 H ATOM 2735 HG3 GLU A 165 19.446 21.923 13.976 1.00 0.00 H ATOM 2736 H GLU A 165 18.469 18.727 12.689 1.00 0.00 H ATOM 2737 N GLU A 166 21.156 18.168 10.710 1.00 37.05 N ATOM 2738 CA GLU A 166 22.272 17.611 9.950 1.00 40.37 C ATOM 2739 C GLU A 166 21.835 17.281 8.495 1.00 36.37 C ATOM 2740 O GLU A 166 22.555 17.577 7.528 1.00 34.91 O ATOM 2741 CB GLU A 166 22.871 16.382 10.657 1.00 48.50 C ATOM 2742 CG GLU A 166 23.939 15.614 9.843 1.00 58.62 C ATOM 2743 CD GLU A 166 25.126 16.483 9.385 1.00 67.59 C ATOM 2744 OE1 GLU A 166 25.669 17.255 10.217 1.00 71.98 O ATOM 2745 OE2 GLU A 166 25.521 16.392 8.191 1.00 69.89 O ATOM 2746 HA GLU A 166 23.058 18.365 9.898 1.00 0.00 H ATOM 2747 HB2 GLU A 166 23.331 16.717 11.587 1.00 0.00 H ATOM 2748 HB3 GLU A 166 22.058 15.692 10.883 1.00 0.00 H ATOM 2749 HG2 GLU A 166 24.326 14.805 10.463 1.00 0.00 H ATOM 2750 HG3 GLU A 166 23.460 15.195 8.958 1.00 0.00 H ATOM 2751 H GLU A 166 20.804 17.679 11.558 1.00 0.00 H ATOM 2752 N SER A 167 20.658 16.692 8.330 1.00 35.57 N ATOM 2753 CA SER A 167 20.203 16.347 6.980 1.00 33.96 C ATOM 2754 C SER A 167 20.028 17.600 6.133 1.00 32.75 C ATOM 2755 O SER A 167 20.424 17.646 4.965 1.00 32.62 O ATOM 2756 CB SER A 167 18.870 15.582 6.998 1.00 34.30 C ATOM 2757 OG SER A 167 19.053 14.323 7.595 1.00 38.59 O ATOM 2758 HA SER A 167 20.972 15.705 6.549 1.00 0.00 H ATOM 2759 HB2 SER A 167 18.514 15.450 5.976 1.00 0.00 H ATOM 2760 HB3 SER A 167 18.134 16.150 7.568 1.00 0.00 H ATOM 2761 HG SER A 167 19.375 14.443 8.523 1.00 0.00 H ATOM 2762 H SER A 167 20.061 16.476 9.154 1.00 0.00 H ATOM 2763 N ARG A 168 19.410 18.613 6.715 1.00 32.22 N ATOM 2764 CA ARG A 168 19.194 19.836 5.983 1.00 30.03 C ATOM 2765 C ARG A 168 20.533 20.531 5.691 1.00 30.99 C ATOM 2766 O ARG A 168 20.719 21.127 4.615 1.00 30.75 O ATOM 2767 CB ARG A 168 18.165 20.692 6.703 1.00 31.44 C ATOM 2768 CG ARG A 168 16.767 20.095 6.463 1.00 30.85 C ATOM 2769 CD ARG A 168 15.799 20.326 7.557 1.00 31.73 C ATOM 2770 NE ARG A 168 15.917 21.693 7.988 1.00 35.08 N ATOM 2771 CZ ARG A 168 16.088 22.109 9.234 1.00 36.69 C ATOM 2772 NH1 ARG A 168 16.019 21.267 10.282 1.00 37.44 N ATOM 2773 NH2 ARG A 168 16.284 23.418 9.433 1.00 37.73 N ATOM 2774 HA ARG A 168 18.767 19.629 5.002 1.00 0.00 H ATOM 2775 HB2 ARG A 168 18.380 20.703 7.771 1.00 0.00 H ATOM 2776 HB3 ARG A 168 18.200 21.710 6.316 1.00 0.00 H ATOM 2777 HG2 ARG A 168 16.361 20.535 5.552 1.00 0.00 H ATOM 2778 HG3 ARG A 168 16.876 19.019 6.328 1.00 0.00 H ATOM 2779 HD2 ARG A 168 16.018 19.657 8.389 1.00 0.00 H ATOM 2780 HD3 ARG A 168 14.787 20.139 7.199 1.00 0.00 H ATOM 2781 HE ARG A 168 15.863 22.425 7.251 1.00 0.00 H ATOM 2782 HH12 ARG A 168 16.158 21.626 11.248 1.00 0.00 H ATOM 2783 HH11 ARG A 168 15.827 20.257 10.126 1.00 0.00 H ATOM 2784 HH22 ARG A 168 16.422 23.782 10.397 1.00 0.00 H ATOM 2785 HH21 ARG A 168 16.298 24.071 8.623 1.00 0.00 H ATOM 2786 H ARG A 168 19.081 18.528 7.698 1.00 0.00 H ATOM 2787 N ALA A 169 21.477 20.386 6.599 1.00 32.47 N ATOM 2788 CA ALA A 169 22.817 20.957 6.411 1.00 36.01 C ATOM 2789 C ALA A 169 23.559 20.309 5.226 1.00 33.89 C ATOM 2790 O ALA A 169 24.315 20.982 4.525 1.00 35.12 O ATOM 2791 CB ALA A 169 23.638 20.835 7.691 1.00 41.51 C ATOM 2792 HA ALA A 169 22.690 22.014 6.176 1.00 0.00 H ATOM 2793 HB1 ALA A 169 23.135 21.371 8.496 1.00 0.00 H ATOM 2794 HB2 ALA A 169 23.736 19.783 7.959 1.00 0.00 H ATOM 2795 HB3 ALA A 169 24.627 21.264 7.529 1.00 0.00 H ATOM 2796 H ALA A 169 21.268 19.855 7.469 1.00 0.00 H ATOM 2797 N ARG A 170 23.364 19.017 5.004 1.00 32.90 N ATOM 2798 CA ARG A 170 23.995 18.360 3.849 1.00 34.15 C ATOM 2799 C ARG A 170 23.481 18.979 2.572 1.00 30.36 C ATOM 2800 O ARG A 170 24.256 19.324 1.701 1.00 31.53 O ATOM 2801 CB ARG A 170 23.728 16.850 3.843 1.00 36.79 C ATOM 2802 CG ARG A 170 24.403 16.087 4.969 1.00 45.07 C ATOM 2803 CD ARG A 170 24.331 14.590 4.709 1.00 51.68 C ATOM 2804 NE ARG A 170 22.986 14.030 4.851 1.00 54.34 N ATOM 2805 CZ ARG A 170 22.469 13.561 5.995 1.00 54.50 C ATOM 2806 NH1 ARG A 170 23.173 13.601 7.118 1.00 54.73 N ATOM 2807 NH2 ARG A 170 21.240 13.051 6.022 1.00 52.96 N ATOM 2808 HA ARG A 170 25.073 18.506 3.923 1.00 0.00 H ATOM 2809 HB2 ARG A 170 22.652 16.694 3.923 1.00 0.00 H ATOM 2810 HB3 ARG A 170 24.084 16.445 2.896 1.00 0.00 H ATOM 2811 HG2 ARG A 170 25.448 16.391 5.034 1.00 0.00 H ATOM 2812 HG3 ARG A 170 23.900 16.314 5.909 1.00 0.00 H ATOM 2813 HD2 ARG A 170 24.990 14.086 5.416 1.00 0.00 H ATOM 2814 HD3 ARG A 170 24.677 14.400 3.693 1.00 0.00 H ATOM 2815 HE ARG A 170 22.387 13.993 4.001 1.00 0.00 H ATOM 2816 HH12 ARG A 170 22.764 13.235 8.001 1.00 0.00 H ATOM 2817 HH11 ARG A 170 24.134 13.999 7.115 1.00 0.00 H ATOM 2818 HH22 ARG A 170 20.847 12.689 6.914 1.00 0.00 H ATOM 2819 HH21 ARG A 170 20.673 13.014 5.151 1.00 0.00 H ATOM 2820 H ARG A 170 22.763 18.466 5.649 1.00 0.00 H ATOM 2821 N ILE A 171 22.165 19.121 2.465 1.00 28.46 N ATOM 2822 CA ILE A 171 21.557 19.764 1.308 1.00 29.49 C ATOM 2823 C ILE A 171 22.079 21.172 1.105 1.00 29.00 C ATOM 2824 O ILE A 171 22.460 21.549 -0.007 1.00 29.01 O ATOM 2825 CB ILE A 171 20.019 19.752 1.449 1.00 30.77 C ATOM 2826 CG1 ILE A 171 19.513 18.309 1.300 1.00 31.37 C ATOM 2827 CG2 ILE A 171 19.351 20.664 0.446 1.00 30.78 C ATOM 2828 CD1 ILE A 171 18.069 18.124 1.777 1.00 31.05 C ATOM 2829 HA ILE A 171 21.834 19.197 0.419 1.00 0.00 H ATOM 2830 HB ILE A 171 19.759 20.132 2.437 1.00 0.00 H ATOM 2831 HG12 ILE A 171 19.569 18.029 0.248 1.00 0.00 H ATOM 2832 HG13 ILE A 171 20.158 17.653 1.885 1.00 0.00 H ATOM 2833 HD11 ILE A 171 17.999 18.391 2.831 1.00 0.00 H ATOM 2834 HD12 ILE A 171 17.410 18.767 1.194 1.00 0.00 H ATOM 2835 HD13 ILE A 171 17.774 17.083 1.644 1.00 0.00 H ATOM 2836 HG21 ILE A 171 19.699 21.686 0.598 1.00 0.00 H ATOM 2837 HG22 ILE A 171 19.603 20.339 -0.563 1.00 0.00 H ATOM 2838 HG23 ILE A 171 18.270 20.623 0.583 1.00 0.00 H ATOM 2839 H ILE A 171 21.553 18.764 3.226 1.00 0.00 H ATOM 2840 N LYS A 172 22.079 21.982 2.157 1.00 28.96 N ATOM 2841 CA LYS A 172 22.607 23.335 2.049 1.00 30.30 C ATOM 2842 C LYS A 172 24.102 23.405 1.645 1.00 32.59 C ATOM 2843 O LYS A 172 24.509 24.284 0.830 1.00 32.92 O ATOM 2844 CB LYS A 172 22.337 24.116 3.356 1.00 33.47 C ATOM 2845 CG LYS A 172 20.828 24.344 3.591 1.00 33.41 C ATOM 2846 CD LYS A 172 20.552 25.057 4.954 1.00 45.46 C ATOM 2847 CE LYS A 172 20.441 24.093 6.117 1.00 47.86 C ATOM 2848 NZ LYS A 172 20.018 24.753 7.419 1.00 47.02 N ATOM 2849 HA LYS A 172 22.073 23.809 1.225 1.00 0.00 H ATOM 2850 HB2 LYS A 172 22.743 23.550 4.195 1.00 0.00 H ATOM 2851 HB3 LYS A 172 22.835 25.084 3.297 1.00 0.00 H ATOM 2852 HG2 LYS A 172 20.435 24.962 2.784 1.00 0.00 H ATOM 2853 HG3 LYS A 172 20.321 23.379 3.589 1.00 0.00 H ATOM 2854 HD2 LYS A 172 21.369 25.751 5.155 1.00 0.00 H ATOM 2855 HD3 LYS A 172 19.617 25.612 4.873 1.00 0.00 H ATOM 2856 HE2 LYS A 172 21.413 23.623 6.269 1.00 0.00 H ATOM 2857 HE3 LYS A 172 19.705 23.330 5.863 1.00 0.00 H ATOM 2858 HZ1 LYS A 172 20.716 25.477 7.682 1.00 0.00 H ATOM 2859 HZ2 LYS A 172 19.086 25.197 7.294 1.00 0.00 H ATOM 2860 HZ3 LYS A 172 19.963 24.034 8.169 1.00 0.00 H ATOM 2861 H LYS A 172 21.699 21.648 3.065 1.00 0.00 H ATOM 2862 N THR A 173 24.910 22.480 2.159 1.00 32.11 N ATOM 2863 CA THR A 173 26.332 22.460 1.825 1.00 33.59 C ATOM 2864 C THR A 173 26.485 22.133 0.306 1.00 32.54 C ATOM 2865 O THR A 173 27.340 22.691 -0.380 1.00 33.54 O ATOM 2866 CB THR A 173 27.075 21.432 2.645 1.00 34.87 C ATOM 2867 OG1 THR A 173 27.075 21.837 4.031 1.00 37.88 O ATOM 2868 CG2 THR A 173 28.512 21.317 2.208 1.00 39.21 C ATOM 2869 HA THR A 173 26.760 23.437 2.050 1.00 0.00 H ATOM 2870 HB THR A 173 26.574 20.474 2.508 1.00 0.00 H ATOM 2871 HG1 THR A 173 26.141 21.907 4.353 1.00 0.00 H ATOM 2872 HG23 THR A 173 28.549 21.012 1.162 1.00 0.00 H ATOM 2873 HG21 THR A 173 29.004 22.283 2.324 1.00 0.00 H ATOM 2874 HG22 THR A 173 29.019 20.574 2.823 1.00 0.00 H ATOM 2875 H THR A 173 24.524 21.763 2.806 1.00 0.00 H ATOM 2876 N ARG A 174 25.654 21.220 -0.186 1.00 31.04 N ATOM 2877 CA ARG A 174 25.700 20.832 -1.598 1.00 32.05 C ATOM 2878 C ARG A 174 25.311 22.016 -2.480 1.00 31.92 C ATOM 2879 O ARG A 174 25.967 22.274 -3.511 1.00 32.50 O ATOM 2880 CB ARG A 174 24.829 19.622 -1.861 1.00 32.19 C ATOM 2881 CG ARG A 174 24.713 19.183 -3.311 1.00 32.94 C ATOM 2882 CD ARG A 174 26.069 18.989 -3.954 1.00 35.31 C ATOM 2883 NE ARG A 174 25.883 18.505 -5.325 1.00 36.39 N ATOM 2884 CZ ARG A 174 26.840 18.420 -6.230 1.00 38.57 C ATOM 2885 NH1 ARG A 174 28.073 18.781 -5.940 1.00 37.55 N ATOM 2886 NH2 ARG A 174 26.540 17.971 -7.444 1.00 41.58 N ATOM 2887 HA ARG A 174 26.721 20.546 -1.850 1.00 0.00 H ATOM 2888 HB2 ARG A 174 25.238 18.787 -1.292 1.00 0.00 H ATOM 2889 HB3 ARG A 174 23.826 19.849 -1.500 1.00 0.00 H ATOM 2890 HG2 ARG A 174 24.166 18.241 -3.351 1.00 0.00 H ATOM 2891 HG3 ARG A 174 24.165 19.944 -3.867 1.00 0.00 H ATOM 2892 HD2 ARG A 174 26.643 18.259 -3.383 1.00 0.00 H ATOM 2893 HD3 ARG A 174 26.605 19.938 -3.971 1.00 0.00 H ATOM 2894 HE ARG A 174 24.927 18.207 -5.605 1.00 0.00 H ATOM 2895 HH12 ARG A 174 28.819 18.710 -6.661 1.00 0.00 H ATOM 2896 HH11 ARG A 174 28.301 19.137 -4.990 1.00 0.00 H ATOM 2897 HH22 ARG A 174 27.282 17.898 -8.169 1.00 0.00 H ATOM 2898 HH21 ARG A 174 25.563 17.693 -7.669 1.00 0.00 H ATOM 2899 H ARG A 174 24.958 20.772 0.443 1.00 0.00 H ATOM 2900 N LEU A 175 24.269 22.753 -2.091 1.00 29.63 N ATOM 2901 CA LEU A 175 23.849 23.927 -2.860 1.00 31.67 C ATOM 2902 C LEU A 175 24.904 24.991 -2.901 1.00 34.27 C ATOM 2903 O LEU A 175 25.118 25.640 -3.937 1.00 34.61 O ATOM 2904 CB LEU A 175 22.546 24.489 -2.308 1.00 33.69 C ATOM 2905 CG LEU A 175 21.388 23.519 -2.518 1.00 32.13 C ATOM 2906 CD1 LEU A 175 20.176 24.007 -1.797 1.00 33.05 C ATOM 2907 CD2 LEU A 175 21.062 23.273 -4.011 1.00 32.64 C ATOM 2908 HA LEU A 175 23.688 23.596 -3.886 1.00 0.00 H ATOM 2909 HB2 LEU A 175 22.664 24.675 -1.241 1.00 0.00 H ATOM 2910 HB3 LEU A 175 22.320 25.426 -2.816 1.00 0.00 H ATOM 2911 HG LEU A 175 21.702 22.559 -2.108 1.00 0.00 H ATOM 2912 HD21 LEU A 175 20.791 24.217 -4.483 1.00 0.00 H ATOM 2913 HD22 LEU A 175 21.937 22.855 -4.509 1.00 0.00 H ATOM 2914 HD23 LEU A 175 20.229 22.574 -4.089 1.00 0.00 H ATOM 2915 HD11 LEU A 175 20.394 24.081 -0.732 1.00 0.00 H ATOM 2916 HD12 LEU A 175 19.897 24.988 -2.181 1.00 0.00 H ATOM 2917 HD13 LEU A 175 19.355 23.307 -1.954 1.00 0.00 H ATOM 2918 H LEU A 175 23.748 22.490 -1.230 1.00 0.00 H ATOM 2919 N PHE A 176 25.573 25.188 -1.762 1.00 32.57 N ATOM 2920 CA PHE A 176 26.642 26.153 -1.677 1.00 34.92 C ATOM 2921 C PHE A 176 27.791 25.752 -2.592 1.00 35.39 C ATOM 2922 O PHE A 176 28.377 26.592 -3.287 1.00 36.98 O ATOM 2923 CB PHE A 176 27.093 26.291 -0.202 1.00 41.57 C ATOM 2924 CG PHE A 176 28.251 27.204 -0.031 1.00 50.08 C ATOM 2925 CD1 PHE A 176 28.055 28.579 0.061 1.00 55.58 C ATOM 2926 CD2 PHE A 176 29.547 26.701 -0.008 1.00 53.73 C ATOM 2927 CE1 PHE A 176 29.139 29.442 0.200 1.00 60.08 C ATOM 2928 CE2 PHE A 176 30.639 27.561 0.132 1.00 58.90 C ATOM 2929 CZ PHE A 176 30.427 28.928 0.231 1.00 61.60 C ATOM 2930 HA PHE A 176 26.290 27.127 -2.015 1.00 0.00 H ATOM 2931 HB2 PHE A 176 26.257 26.677 0.382 1.00 0.00 H ATOM 2932 HB3 PHE A 176 27.370 25.305 0.170 1.00 0.00 H ATOM 2933 HD2 PHE A 176 29.712 25.628 -0.100 1.00 0.00 H ATOM 2934 HE2 PHE A 176 31.652 27.160 0.163 1.00 0.00 H ATOM 2935 HZ PHE A 176 31.277 29.602 0.334 1.00 0.00 H ATOM 2936 HE1 PHE A 176 28.976 30.516 0.284 1.00 0.00 H ATOM 2937 HD1 PHE A 176 27.044 28.984 0.024 1.00 0.00 H ATOM 2938 H PHE A 176 25.318 24.634 -0.919 1.00 0.00 H ATOM 2939 N THR A 177 28.081 24.461 -2.640 1.00 35.39 N ATOM 2940 CA THR A 177 29.157 23.924 -3.480 1.00 38.32 C ATOM 2941 C THR A 177 28.838 24.111 -4.982 1.00 35.18 C ATOM 2942 O THR A 177 29.700 24.474 -5.754 1.00 36.32 O ATOM 2943 CB THR A 177 29.341 22.423 -3.181 1.00 42.88 C ATOM 2944 OG1 THR A 177 29.813 22.289 -1.833 1.00 43.55 O ATOM 2945 CG2 THR A 177 30.363 21.793 -4.091 1.00 49.15 C ATOM 2946 HA THR A 177 30.074 24.468 -3.252 1.00 0.00 H ATOM 2947 HB THR A 177 28.384 21.925 -3.334 1.00 0.00 H ATOM 2948 HG1 THR A 177 29.150 22.681 -1.212 1.00 0.00 H ATOM 2949 HG23 THR A 177 30.030 21.880 -5.125 1.00 0.00 H ATOM 2950 HG21 THR A 177 31.318 22.304 -3.971 1.00 0.00 H ATOM 2951 HG22 THR A 177 30.478 20.740 -3.833 1.00 0.00 H ATOM 2952 H THR A 177 27.524 23.802 -2.059 1.00 0.00 H ATOM 2953 N ILE A 178 27.592 23.838 -5.349 1.00 33.15 N ATOM 2954 CA ILE A 178 27.116 24.051 -6.729 1.00 33.05 C ATOM 2955 C ILE A 178 27.288 25.501 -7.106 1.00 34.27 C ATOM 2956 O ILE A 178 27.858 25.819 -8.154 1.00 36.55 O ATOM 2957 CB ILE A 178 25.658 23.641 -6.873 1.00 31.15 C ATOM 2958 CG1 ILE A 178 25.558 22.128 -6.818 1.00 30.29 C ATOM 2959 CG2 ILE A 178 25.049 24.188 -8.198 1.00 35.37 C ATOM 2960 CD1 ILE A 178 24.174 21.600 -6.722 1.00 28.78 C ATOM 2961 HA ILE A 178 27.708 23.429 -7.400 1.00 0.00 H ATOM 2962 HB ILE A 178 25.085 24.071 -6.051 1.00 0.00 H ATOM 2963 HG12 ILE A 178 26.014 21.724 -7.722 1.00 0.00 H ATOM 2964 HG13 ILE A 178 26.115 21.782 -5.947 1.00 0.00 H ATOM 2965 HD11 ILE A 178 23.703 21.980 -5.815 1.00 0.00 H ATOM 2966 HD12 ILE A 178 23.602 21.922 -7.592 1.00 0.00 H ATOM 2967 HD13 ILE A 178 24.204 20.511 -6.688 1.00 0.00 H ATOM 2968 HG21 ILE A 178 25.107 25.276 -8.201 1.00 0.00 H ATOM 2969 HG22 ILE A 178 25.608 23.791 -9.045 1.00 0.00 H ATOM 2970 HG23 ILE A 178 24.006 23.879 -8.272 1.00 0.00 H ATOM 2971 H ILE A 178 26.930 23.462 -4.641 1.00 0.00 H ATOM 2972 N ARG A 179 26.839 26.415 -6.245 1.00 34.49 N ATOM 2973 CA ARG A 179 27.010 27.834 -6.534 1.00 36.32 C ATOM 2974 C ARG A 179 28.493 28.273 -6.669 1.00 38.72 C ATOM 2975 O ARG A 179 28.870 29.037 -7.608 1.00 40.02 O ATOM 2976 CB ARG A 179 26.274 28.629 -5.476 1.00 36.82 C ATOM 2977 CG ARG A 179 26.593 30.099 -5.397 1.00 44.08 C ATOM 2978 CD ARG A 179 25.628 30.734 -4.397 1.00 50.04 C ATOM 2979 NE ARG A 179 25.772 32.177 -4.392 1.00 58.09 N ATOM 2980 CZ ARG A 179 26.656 32.823 -3.649 1.00 66.52 C ATOM 2981 NH1 ARG A 179 27.462 32.140 -2.840 1.00 70.80 N ATOM 2982 NH2 ARG A 179 26.733 34.149 -3.725 1.00 70.34 N ATOM 2983 HA ARG A 179 26.583 28.035 -7.517 1.00 0.00 H ATOM 2984 HB2 ARG A 179 25.206 28.532 -5.671 1.00 0.00 H ATOM 2985 HB3 ARG A 179 26.507 28.187 -4.507 1.00 0.00 H ATOM 2986 HG2 ARG A 179 27.620 30.238 -5.061 1.00 0.00 H ATOM 2987 HG3 ARG A 179 26.467 30.559 -6.377 1.00 0.00 H ATOM 2988 HD2 ARG A 179 25.841 30.349 -3.400 1.00 0.00 H ATOM 2989 HD3 ARG A 179 24.605 30.477 -4.673 1.00 0.00 H ATOM 2990 HE ARG A 179 25.146 32.735 -5.007 1.00 0.00 H ATOM 2991 HH12 ARG A 179 28.159 32.643 -2.254 1.00 0.00 H ATOM 2992 HH11 ARG A 179 27.395 31.103 -2.794 1.00 0.00 H ATOM 2993 HH22 ARG A 179 27.425 34.664 -3.144 1.00 0.00 H ATOM 2994 HH21 ARG A 179 26.101 34.671 -4.365 1.00 0.00 H ATOM 2995 H ARG A 179 26.367 26.116 -5.368 1.00 0.00 H ATOM 2996 N GLN A 180 29.331 27.788 -5.752 1.00 38.82 N ATOM 2997 CA GLN A 180 30.751 28.119 -5.776 1.00 42.71 C ATOM 2998 C GLN A 180 31.420 27.631 -7.059 1.00 41.53 C ATOM 2999 O GLN A 180 32.208 28.363 -7.663 1.00 43.57 O ATOM 3000 CB GLN A 180 31.471 27.539 -4.554 1.00 51.85 C ATOM 3001 CG GLN A 180 31.108 28.240 -3.240 1.00 65.11 C ATOM 3002 CD GLN A 180 31.260 29.750 -3.315 1.00 79.34 C ATOM 3003 OE1 GLN A 180 32.166 30.265 -3.977 1.00 84.05 O ATOM 3004 NE2 GLN A 180 30.365 30.468 -2.643 1.00 84.78 N ATOM 3005 HA GLN A 180 30.828 29.206 -5.745 1.00 0.00 H ATOM 3006 HB2 GLN A 180 31.208 26.485 -4.467 1.00 0.00 H ATOM 3007 HB3 GLN A 180 32.546 27.633 -4.710 1.00 0.00 H ATOM 3008 HG2 GLN A 180 30.072 28.006 -2.995 1.00 0.00 H ATOM 3009 HG3 GLN A 180 31.760 27.863 -2.452 1.00 0.00 H ATOM 3010 HE22 GLN A 180 29.619 29.991 -2.098 1.00 0.00 H ATOM 3011 HE21 GLN A 180 30.411 31.507 -2.662 1.00 0.00 H ATOM 3012 H GLN A 180 28.965 27.162 -5.006 1.00 0.00 H ATOM 3013 N GLU A 181 31.092 26.407 -7.455 1.00 41.39 N ATOM 3014 CA GLU A 181 31.650 25.811 -8.658 1.00 43.49 C ATOM 3015 C GLU A 181 31.139 26.533 -9.926 1.00 42.04 C ATOM 3016 O GLU A 181 31.940 26.883 -10.795 1.00 42.71 O ATOM 3017 CB GLU A 181 31.420 24.304 -8.681 1.00 46.89 C ATOM 3018 CG GLU A 181 32.078 23.587 -9.878 1.00 54.43 C ATOM 3019 CD GLU A 181 33.608 23.746 -9.933 1.00 59.78 C ATOM 3020 OE1 GLU A 181 34.257 23.880 -8.854 1.00 60.81 O ATOM 3021 OE2 GLU A 181 34.153 23.743 -11.074 1.00 61.47 O ATOM 3022 HA GLU A 181 32.731 25.950 -8.648 1.00 0.00 H ATOM 3023 HB2 GLU A 181 31.826 23.881 -7.762 1.00 0.00 H ATOM 3024 HB3 GLU A 181 30.346 24.121 -8.720 1.00 0.00 H ATOM 3025 HG2 GLU A 181 31.845 22.524 -9.813 1.00 0.00 H ATOM 3026 HG3 GLU A 181 31.657 23.994 -10.797 1.00 0.00 H ATOM 3027 H GLU A 181 30.415 25.858 -6.887 1.00 0.00 H ATOM 3028 N MET A 182 29.843 26.814 -10.005 1.00 39.91 N ATOM 3029 CA MET A 182 29.344 27.628 -11.140 1.00 40.29 C ATOM 3030 C MET A 182 30.093 28.946 -11.180 1.00 42.71 C ATOM 3031 O MET A 182 30.569 29.376 -12.235 1.00 44.51 O ATOM 3032 CB MET A 182 27.853 27.924 -11.009 1.00 39.00 C ATOM 3033 CG MET A 182 26.984 26.743 -11.275 1.00 37.11 C ATOM 3034 SD MET A 182 25.260 27.243 -11.241 1.00 36.84 S ATOM 3035 CE MET A 182 24.525 25.672 -11.588 1.00 34.47 C ATOM 3036 HA MET A 182 29.507 27.058 -12.055 1.00 0.00 H ATOM 3037 HB2 MET A 182 27.659 28.274 -9.995 1.00 0.00 H ATOM 3038 HB3 MET A 182 27.594 28.710 -11.719 1.00 0.00 H ATOM 3039 HG2 MET A 182 27.157 25.985 -10.511 1.00 0.00 H ATOM 3040 HG3 MET A 182 27.223 26.330 -12.255 1.00 0.00 H ATOM 3041 HE1 MET A 182 24.876 25.314 -12.556 1.00 0.00 H ATOM 3042 HE2 MET A 182 24.808 24.961 -10.812 1.00 0.00 H ATOM 3043 HE3 MET A 182 23.440 25.777 -11.609 1.00 0.00 H ATOM 3044 H MET A 182 29.185 26.467 -9.278 1.00 0.00 H ATOM 3045 N ALA A 183 30.218 29.588 -10.029 1.00 43.10 N ATOM 3046 CA ALA A 183 30.936 30.861 -9.945 1.00 45.80 C ATOM 3047 C ALA A 183 32.384 30.774 -10.454 1.00 47.76 C ATOM 3048 O ALA A 183 32.861 31.678 -11.161 1.00 50.14 O ATOM 3049 CB ALA A 183 30.887 31.398 -8.507 1.00 46.30 C ATOM 3050 HA ALA A 183 30.427 31.560 -10.609 1.00 0.00 H ATOM 3051 HB1 ALA A 183 29.849 31.551 -8.213 1.00 0.00 H ATOM 3052 HB2 ALA A 183 31.354 30.677 -7.835 1.00 0.00 H ATOM 3053 HB3 ALA A 183 31.424 32.345 -8.456 1.00 0.00 H ATOM 3054 H ALA A 183 29.799 29.181 -9.169 1.00 0.00 H ATOM 3055 N SER A 184 33.091 29.696 -10.144 1.00 47.15 N ATOM 3056 CA SER A 184 34.480 29.592 -10.597 1.00 49.39 C ATOM 3057 C SER A 184 34.545 29.458 -12.113 1.00 50.10 C ATOM 3058 O SER A 184 35.569 29.784 -12.711 1.00 52.55 O ATOM 3059 CB SER A 184 35.195 28.403 -9.970 1.00 50.00 C ATOM 3060 OG SER A 184 34.618 27.194 -10.402 1.00 53.17 O ATOM 3061 HA SER A 184 34.980 30.508 -10.282 1.00 0.00 H ATOM 3062 HB2 SER A 184 35.118 28.470 -8.885 1.00 0.00 H ATOM 3063 HB3 SER A 184 36.246 28.423 -10.260 1.00 0.00 H ATOM 3064 HG SER A 184 33.664 27.172 -10.137 1.00 0.00 H ATOM 3065 H SER A 184 32.663 28.931 -9.584 1.00 0.00 H ATOM 3066 N ARG A 185 33.469 28.946 -12.703 1.00 48.20 N ATOM 3067 CA ARG A 185 33.381 28.773 -14.172 1.00 49.04 C ATOM 3068 C ARG A 185 32.695 29.971 -14.869 1.00 50.15 C ATOM 3069 O ARG A 185 32.336 29.896 -16.079 1.00 50.87 O ATOM 3070 CB ARG A 185 32.639 27.462 -14.479 1.00 46.98 C ATOM 3071 CG ARG A 185 33.406 26.206 -14.067 1.00 46.76 C ATOM 3072 CD ARG A 185 32.514 25.020 -14.114 1.00 45.02 C ATOM 3073 NE ARG A 185 33.057 23.789 -13.524 1.00 46.93 N ATOM 3074 CZ ARG A 185 33.233 22.652 -14.201 1.00 49.80 C ATOM 3075 NH1 ARG A 185 32.956 22.570 -15.506 1.00 51.84 N ATOM 3076 NH2 ARG A 185 33.718 21.590 -13.589 1.00 51.12 N ATOM 3077 HA ARG A 185 34.394 28.728 -14.571 1.00 0.00 H ATOM 3078 HB2 ARG A 185 31.687 27.473 -13.948 1.00 0.00 H ATOM 3079 HB3 ARG A 185 32.454 27.415 -15.552 1.00 0.00 H ATOM 3080 HG2 ARG A 185 34.242 26.055 -14.749 1.00 0.00 H ATOM 3081 HG3 ARG A 185 33.785 26.332 -13.053 1.00 0.00 H ATOM 3082 HD2 ARG A 185 32.282 24.816 -15.159 1.00 0.00 H ATOM 3083 HD3 ARG A 185 31.596 25.270 -13.582 1.00 0.00 H ATOM 3084 HE ARG A 185 33.320 23.804 -12.518 1.00 0.00 H ATOM 3085 HH12 ARG A 185 33.101 21.674 -16.013 1.00 0.00 H ATOM 3086 HH11 ARG A 185 32.596 23.403 -16.014 1.00 0.00 H ATOM 3087 HH22 ARG A 185 33.855 20.704 -14.116 1.00 0.00 H ATOM 3088 HH21 ARG A 185 33.963 21.638 -12.579 1.00 0.00 H ATOM 3089 H ARG A 185 32.662 28.657 -12.114 1.00 0.00 H ATOM 3090 N SER A 186 32.466 31.036 -14.094 1.00 50.61 N ATOM 3091 CA SER A 186 31.673 32.213 -14.463 1.00 51.84 C ATOM 3092 C SER A 186 30.255 31.903 -15.026 1.00 50.53 C ATOM 3093 O SER A 186 29.763 32.598 -15.931 1.00 52.13 O ATOM 3094 CB SER A 186 32.464 33.079 -15.449 1.00 55.21 C ATOM 3095 OG SER A 186 33.685 33.519 -14.846 1.00 56.94 O ATOM 3096 HA SER A 186 31.493 32.752 -13.533 1.00 0.00 H ATOM 3097 HB2 SER A 186 31.866 33.947 -15.728 1.00 0.00 H ATOM 3098 HB3 SER A 186 32.692 32.495 -16.340 1.00 0.00 H ATOM 3099 HG SER A 186 34.230 32.732 -14.594 1.00 0.00 H ATOM 3100 H SER A 186 32.888 31.029 -13.144 1.00 0.00 H ATOM 3101 N LEU A 187 29.626 30.856 -14.488 1.00 47.55 N ATOM 3102 CA LEU A 187 28.279 30.461 -14.895 1.00 46.20 C ATOM 3103 C LEU A 187 27.188 30.984 -14.008 1.00 45.53 C ATOM 3104 O LEU A 187 26.030 30.932 -14.387 1.00 44.90 O ATOM 3105 CB LEU A 187 28.166 28.951 -14.873 1.00 43.97 C ATOM 3106 CG LEU A 187 28.979 28.254 -15.944 1.00 45.24 C ATOM 3107 CD1 LEU A 187 29.101 26.787 -15.594 1.00 43.34 C ATOM 3108 CD2 LEU A 187 28.272 28.470 -17.277 1.00 46.51 C ATOM 3109 HA LEU A 187 28.144 30.886 -15.889 1.00 0.00 H ATOM 3110 HB2 LEU A 187 28.506 28.596 -13.900 1.00 0.00 H ATOM 3111 HB3 LEU A 187 27.118 28.684 -15.010 1.00 0.00 H ATOM 3112 HG LEU A 187 29.989 28.658 -16.014 1.00 0.00 H ATOM 3113 HD21 LEU A 187 27.268 28.048 -17.227 1.00 0.00 H ATOM 3114 HD22 LEU A 187 28.208 29.538 -17.484 1.00 0.00 H ATOM 3115 HD23 LEU A 187 28.836 27.978 -18.070 1.00 0.00 H ATOM 3116 HD11 LEU A 187 29.599 26.685 -14.630 1.00 0.00 H ATOM 3117 HD12 LEU A 187 28.107 26.344 -15.540 1.00 0.00 H ATOM 3118 HD13 LEU A 187 29.685 26.279 -16.361 1.00 0.00 H ATOM 3119 H LEU A 187 30.111 30.302 -13.754 1.00 0.00 H ATOM 3120 N TRP A 188 27.569 31.500 -12.823 1.00 45.35 N ATOM 3121 CA TRP A 188 26.609 31.738 -11.758 1.00 44.79 C ATOM 3122 C TRP A 188 25.693 32.935 -12.005 1.00 48.55 C ATOM 3123 O TRP A 188 24.477 32.826 -11.792 1.00 45.72 O ATOM 3124 CB TRP A 188 27.295 31.886 -10.378 1.00 44.42 C ATOM 3125 CG TRP A 188 26.305 32.343 -9.344 1.00 45.56 C ATOM 3126 CD1 TRP A 188 26.177 33.604 -8.832 1.00 49.75 C ATOM 3127 CD2 TRP A 188 25.275 31.555 -8.727 1.00 41.59 C ATOM 3128 NE1 TRP A 188 25.141 33.642 -7.931 1.00 49.84 N ATOM 3129 CE2 TRP A 188 24.568 32.400 -7.860 1.00 45.11 C ATOM 3130 CE3 TRP A 188 24.882 30.213 -8.826 1.00 38.93 C ATOM 3131 CZ2 TRP A 188 23.490 31.945 -7.093 1.00 43.89 C ATOM 3132 CZ3 TRP A 188 23.803 29.776 -8.082 1.00 37.36 C ATOM 3133 CH2 TRP A 188 23.129 30.637 -7.226 1.00 40.87 C ATOM 3134 HA TRP A 188 25.981 30.847 -11.754 1.00 0.00 H ATOM 3135 HB2 TRP A 188 27.709 30.923 -10.078 1.00 0.00 H ATOM 3136 HB3 TRP A 188 28.099 32.618 -10.453 1.00 0.00 H ATOM 3137 HE1 TRP A 188 24.840 34.478 -7.390 1.00 0.00 H ATOM 3138 HD1 TRP A 188 26.805 34.454 -9.099 1.00 0.00 H ATOM 3139 HZ2 TRP A 188 22.958 32.612 -6.414 1.00 0.00 H ATOM 3140 HH2 TRP A 188 22.289 30.257 -6.645 1.00 0.00 H ATOM 3141 HZ3 TRP A 188 23.476 28.740 -8.168 1.00 0.00 H ATOM 3142 HE3 TRP A 188 25.419 29.525 -9.479 1.00 0.00 H ATOM 3143 H TRP A 188 28.571 31.733 -12.667 1.00 0.00 H ATOM 3144 N ASP A 189 26.273 34.072 -12.390 1.00 57.09 N ATOM 3145 CA ASP A 189 25.504 35.300 -12.597 1.00 66.30 C ATOM 3146 C ASP A 189 24.314 35.028 -13.505 1.00 65.44 C ATOM 3147 O ASP A 189 23.166 35.326 -13.161 1.00 71.56 O ATOM 3148 CB ASP A 189 26.372 36.377 -13.241 1.00 73.83 C ATOM 3149 CG ASP A 189 27.519 36.797 -12.363 1.00 77.89 C ATOM 3150 OD1 ASP A 189 27.370 36.734 -11.125 1.00 74.64 O ATOM 3151 OD2 ASP A 189 28.568 37.189 -12.918 1.00 84.00 O ATOM 3152 HA ASP A 189 25.158 35.646 -11.623 1.00 0.00 H ATOM 3153 HB2 ASP A 189 26.773 35.989 -14.178 1.00 0.00 H ATOM 3154 HB3 ASP A 189 25.752 37.249 -13.446 1.00 0.00 H ATOM 3155 H ASP A 189 27.301 34.087 -12.548 1.00 0.00 H ATOM 3156 N SER A 190 24.610 34.444 -14.653 1.00 58.57 N ATOM 3157 CA SER A 190 23.599 34.103 -15.629 1.00 56.94 C ATOM 3158 C SER A 190 22.563 33.122 -15.065 1.00 53.48 C ATOM 3159 O SER A 190 21.363 33.277 -15.295 1.00 54.27 O ATOM 3160 CB SER A 190 24.273 33.520 -16.863 1.00 62.13 C ATOM 3161 OG SER A 190 23.317 32.980 -17.747 1.00 68.58 O ATOM 3162 HA SER A 190 23.060 35.012 -15.897 1.00 0.00 H ATOM 3163 HB2 SER A 190 24.962 32.733 -16.556 1.00 0.00 H ATOM 3164 HB3 SER A 190 24.828 34.307 -17.373 1.00 0.00 H ATOM 3165 HG SER A 190 23.777 32.607 -18.541 1.00 0.00 H ATOM 3166 H SER A 190 25.604 34.222 -14.862 1.00 0.00 H ATOM 3167 N PHE A 191 23.022 32.126 -14.315 1.00 47.65 N ATOM 3168 CA PHE A 191 22.127 31.121 -13.786 1.00 44.31 C ATOM 3169 C PHE A 191 21.190 31.745 -12.737 1.00 47.17 C ATOM 3170 O PHE A 191 20.000 31.399 -12.675 1.00 46.35 O ATOM 3171 CB PHE A 191 22.948 29.961 -13.207 1.00 40.87 C ATOM 3172 CG PHE A 191 22.128 28.906 -12.497 1.00 38.39 C ATOM 3173 CD1 PHE A 191 21.391 27.973 -13.219 1.00 37.53 C ATOM 3174 CD2 PHE A 191 22.129 28.815 -11.125 1.00 36.88 C ATOM 3175 CE1 PHE A 191 20.658 27.003 -12.573 1.00 35.45 C ATOM 3176 CE2 PHE A 191 21.408 27.837 -10.459 1.00 34.79 C ATOM 3177 CZ PHE A 191 20.659 26.923 -11.191 1.00 34.05 C ATOM 3178 HA PHE A 191 21.500 30.724 -14.584 1.00 0.00 H ATOM 3179 HB2 PHE A 191 23.485 29.482 -14.025 1.00 0.00 H ATOM 3180 HB3 PHE A 191 23.664 30.372 -12.496 1.00 0.00 H ATOM 3181 HD2 PHE A 191 22.712 29.531 -10.546 1.00 0.00 H ATOM 3182 HE2 PHE A 191 21.428 27.785 -9.370 1.00 0.00 H ATOM 3183 HZ PHE A 191 20.079 26.152 -10.683 1.00 0.00 H ATOM 3184 HE1 PHE A 191 20.072 26.292 -13.155 1.00 0.00 H ATOM 3185 HD1 PHE A 191 21.394 28.010 -14.308 1.00 0.00 H ATOM 3186 H PHE A 191 24.039 32.068 -14.105 1.00 0.00 H ATOM 3187 N ARG A 192 21.704 32.683 -11.939 1.00 53.60 N ATOM 3188 CA ARG A 192 20.908 33.302 -10.867 1.00 56.95 C ATOM 3189 C ARG A 192 19.760 34.071 -11.518 1.00 58.07 C ATOM 3190 O ARG A 192 18.578 33.932 -11.154 1.00 59.26 O ATOM 3191 CB ARG A 192 21.787 34.239 -10.008 1.00 61.91 C ATOM 3192 CG ARG A 192 21.106 34.901 -8.769 1.00 64.64 C ATOM 3193 CD ARG A 192 22.053 35.881 -7.988 1.00 76.51 C ATOM 3194 NE ARG A 192 22.031 35.586 -6.546 1.00 78.81 N ATOM 3195 CZ ARG A 192 23.056 35.711 -5.692 1.00 78.96 C ATOM 3196 NH1 ARG A 192 24.245 36.155 -6.090 1.00 74.26 N ATOM 3197 NH2 ARG A 192 22.879 35.378 -4.414 1.00 82.22 N ATOM 3198 HA ARG A 192 20.510 32.536 -10.201 1.00 0.00 H ATOM 3199 HB2 ARG A 192 22.635 33.657 -9.647 1.00 0.00 H ATOM 3200 HB3 ARG A 192 22.146 35.040 -10.655 1.00 0.00 H ATOM 3201 HG2 ARG A 192 20.235 35.460 -9.111 1.00 0.00 H ATOM 3202 HG3 ARG A 192 20.786 34.113 -8.088 1.00 0.00 H ATOM 3203 HD2 ARG A 192 21.719 36.906 -8.149 1.00 0.00 H ATOM 3204 HD3 ARG A 192 23.071 35.769 -8.361 1.00 0.00 H ATOM 3205 HE ARG A 192 21.131 35.247 -6.151 1.00 0.00 H ATOM 3206 HH12 ARG A 192 25.023 36.242 -5.406 1.00 0.00 H ATOM 3207 HH11 ARG A 192 24.396 36.415 -7.086 1.00 0.00 H ATOM 3208 HH22 ARG A 192 23.665 35.469 -3.739 1.00 0.00 H ATOM 3209 HH21 ARG A 192 21.955 35.027 -4.091 1.00 0.00 H ATOM 3210 H ARG A 192 22.690 32.984 -12.078 1.00 0.00 H ATOM 3211 N GLN A 193 20.127 34.856 -12.513 1.00 58.03 N ATOM 3212 CA GLN A 193 19.204 35.793 -13.150 1.00 66.23 C ATOM 3213 C GLN A 193 18.120 35.140 -14.010 1.00 67.11 C ATOM 3214 O GLN A 193 17.081 35.744 -14.269 1.00 67.75 O ATOM 3215 CB GLN A 193 20.002 36.821 -13.973 1.00 76.68 C ATOM 3216 CG GLN A 193 20.393 38.058 -13.147 1.00 85.02 C ATOM 3217 CD GLN A 193 21.753 38.636 -13.514 1.00 88.64 C ATOM 3218 OE1 GLN A 193 21.924 39.222 -14.587 1.00 90.16 O ATOM 3219 NE2 GLN A 193 22.729 38.476 -12.617 1.00 88.95 N ATOM 3220 HA GLN A 193 18.663 36.283 -12.341 1.00 0.00 H ATOM 3221 HB2 GLN A 193 20.910 36.345 -14.342 1.00 0.00 H ATOM 3222 HB3 GLN A 193 19.393 37.142 -14.818 1.00 0.00 H ATOM 3223 HG2 GLN A 193 19.638 38.829 -13.303 1.00 0.00 H ATOM 3224 HG3 GLN A 193 20.411 37.777 -12.094 1.00 0.00 H ATOM 3225 HE22 GLN A 193 22.539 37.975 -11.726 1.00 0.00 H ATOM 3226 HE21 GLN A 193 23.679 38.852 -12.810 1.00 0.00 H ATOM 3227 H GLN A 193 21.108 34.806 -12.856 1.00 0.00 H ATOM 3228 N SER A 194 18.334 33.898 -14.418 1.00 69.08 N ATOM 3229 CA SER A 194 17.433 33.260 -15.363 1.00 70.37 C ATOM 3230 C SER A 194 16.272 32.457 -14.749 1.00 67.48 C ATOM 3231 O SER A 194 15.536 31.830 -15.501 1.00 67.96 O ATOM 3232 CB SER A 194 18.237 32.337 -16.266 1.00 72.34 C ATOM 3233 OG SER A 194 18.490 31.121 -15.596 1.00 73.12 O ATOM 3234 HA SER A 194 16.964 34.081 -15.905 1.00 0.00 H ATOM 3235 HB2 SER A 194 19.183 32.814 -16.522 1.00 0.00 H ATOM 3236 HB3 SER A 194 17.673 32.139 -17.177 1.00 0.00 H ATOM 3237 HG SER A 194 19.003 31.302 -14.769 1.00 0.00 H ATOM 3238 H SER A 194 19.157 33.373 -14.058 1.00 0.00 H ATOM 3239 N GLU A 195 16.110 32.452 -13.419 1.00 64.51 N ATOM 3240 CA GLU A 195 15.116 31.566 -12.762 1.00 64.46 C ATOM 3241 C GLU A 195 13.680 31.630 -13.338 1.00 71.28 C ATOM 3242 O GLU A 195 12.923 32.580 -13.110 1.00 76.13 O ATOM 3243 CB GLU A 195 15.095 31.776 -11.234 1.00 61.31 C ATOM 3244 CG GLU A 195 13.908 31.080 -10.501 1.00 55.89 C ATOM 3245 CD GLU A 195 14.237 30.685 -9.070 1.00 53.47 C ATOM 3246 OE1 GLU A 195 15.398 30.352 -8.804 1.00 50.46 O ATOM 3247 OE2 GLU A 195 13.341 30.703 -8.203 1.00 54.66 O ATOM 3248 HA GLU A 195 15.469 30.560 -12.991 1.00 0.00 H ATOM 3249 HB2 GLU A 195 16.026 31.384 -10.824 1.00 0.00 H ATOM 3250 HB3 GLU A 195 15.035 32.847 -11.038 1.00 0.00 H ATOM 3251 HG2 GLU A 195 13.060 31.765 -10.486 1.00 0.00 H ATOM 3252 HG3 GLU A 195 13.637 30.181 -11.055 1.00 0.00 H ATOM 3253 H GLU A 195 16.694 33.083 -12.834 1.00 0.00 H TER 3254 GLU A 195 HETATM 3255 MN MN A 1 9.657 20.681 -6.487 1.00 29.71 MN HETATM 3256 MN MN A 2 8.219 18.021 -8.794 1.00 50.08 MN HETATM 3257 O HOH 3 9.318 20.358 5.911 1.00 29.77 O HETATM 3258 O HOH 4 7.134 15.797 5.786 1.00 30.63 O HETATM 3259 O HOH 5 29.272 30.518 -20.223 1.00 42.43 O HETATM 3260 O HOH 6 8.312 17.216 11.455 1.00 43.18 O HETATM 3261 O HOH 7 32.119 24.377 -17.397 1.00 41.37 O HETATM 3262 O HOH 8 20.094 22.699 9.072 1.00 40.83 O HETATM 3263 O HOH 9 9.519 14.624 10.899 1.00 33.35 O HETATM 3264 O HOH 10 18.030 25.640 11.054 1.00 33.82 O HETATM 3265 O HOH 11 16.938 26.645 -8.638 1.00 45.65 O HETATM 3266 O HOH 12 18.834 13.142 4.351 1.00 37.10 O HETATM 3267 O HOH 13 13.615 7.334 2.351 1.00 36.20 O HETATM 3268 O HOH 14 16.593 24.016 -8.892 1.00 34.96 O HETATM 3269 O HOH 15 29.325 18.254 -3.478 1.00 44.32 O HETATM 3270 O HOH 16 12.935 13.444 10.956 1.00 42.96 O HETATM 3271 O HOH 17 33.501 24.170 -19.887 1.00 38.34 O HETATM 3272 O HOH 18 1.241 18.821 -5.069 1.00 44.96 O HETATM 3273 O HOH 19 7.739 12.862 -11.718 1.00 41.43 O HETATM 3274 O HOH 20 3.012 20.676 10.439 1.00 52.81 O HETATM 3275 O HOH 21 27.261 13.002 -15.115 1.00 41.99 O HETATM 3276 O HOH 22 24.820 14.082 -8.129 1.00 41.09 O HETATM 3277 O HOH 23 35.866 31.663 -14.841 1.00 43.79 O HETATM 3278 O HOH 24 18.785 26.387 1.940 1.00 46.65 O HETATM 3279 O HOH 25 28.708 19.348 -1.110 1.00 57.38 O HETATM 3280 O HOH 26 13.997 23.912 -25.682 1.00 49.62 O HETATM 3281 O HOH 27 13.945 24.028 -9.278 1.00 38.43 O HETATM 3282 O HOH 28 22.810 12.305 0.440 1.00 46.07 O HETATM 3283 O HOH 29 33.894 30.026 -6.588 1.00 48.03 O HETATM 3284 O HOH 30 10.289 28.975 9.702 1.00 55.08 O HETATM 3285 O HOH 31 12.097 24.119 -7.270 1.00 31.14 O HETATM 3286 O HOH 32 10.174 5.974 -4.370 1.00 39.19 O HETATM 3287 O HOH 33 1.305 20.115 5.811 1.00 48.74 O HETATM 3288 O HOH 34 21.674 13.146 9.326 1.00 55.57 O HETATM 3289 O HOH 35 15.023 16.952 -25.187 1.00 49.88 O HETATM 3290 O HOH 36 5.040 9.050 -19.281 1.00 50.73 O HETATM 3291 O HOH 37 26.547 17.871 1.255 1.00 44.26 O HETATM 3292 O HOH 38 28.055 17.444 3.599 1.00 57.02 O HETATM 3293 O HOH 39 1.399 15.575 -14.448 1.00 46.59 O HETATM 3294 O HOH 40 20.479 8.901 -3.624 1.00 57.24 O HETATM 3295 O HOH 41 3.200 20.184 -5.878 1.00 49.77 O HETATM 3296 O HOH 42 4.417 10.887 -20.825 1.00 53.97 O HETATM 3297 O HOH 43 18.376 5.624 1.838 1.00 55.67 O HETATM 3298 O HOH 44 1.275 17.543 -12.349 1.00 45.17 O HETATM 3299 O HOH 45 2.164 14.710 10.172 1.00 47.72 O HETATM 3300 O HOH 46 7.473 18.567 -10.791 1.00 28.94 O HETATM 3301 O HOH 47 14.417 9.549 9.704 1.00 50.50 O HETATM 3302 O HOH 48 14.049 18.252 -10.984 1.00 29.62 O HETATM 3303 O HOH 49 10.700 11.609 -17.708 1.00 47.00 O HETATM 3304 O HOH 50 12.730 11.587 -15.800 1.00 42.01 O HETATM 3305 O HOH 51 28.379 32.888 -18.080 1.00 47.91 O HETATM 3306 O HOH 52 28.417 35.652 -18.323 1.00 49.33 O HETATM 3307 O HOH 53 7.264 15.277 -11.679 1.00 39.48 O HETATM 3308 O HOH 54 7.823 13.686 -15.514 1.00 52.24 O HETATM 3309 O HOH 55 4.695 17.359 12.029 1.00 48.90 O HETATM 3310 O HOH 56 24.013 10.619 -17.836 1.00 49.79 O HETATM 3311 O HOH 57 0.837 20.058 9.181 1.00 62.79 O HETATM 3312 O HOH 58 9.714 6.489 -14.823 1.00 41.78 O HETATM 3313 O HOH 59 9.073 -5.058 12.130 1.00 40.82 O HETATM 3314 O HOH 60 -1.631 3.010 -8.927 1.00 46.15 O HETATM 3315 O HOH 61 13.576 25.991 -10.988 1.00 53.95 O HETATM 3316 O HOH 62 -3.207 4.185 -10.879 1.00 58.42 O HETATM 3317 O HOH 63 3.675 16.220 -15.146 1.00 61.97 O HETATM 3318 O HOH 64 24.953 30.290 -16.806 1.00 37.24 O HETATM 3319 O HOH 65 17.209 8.776 -1.645 1.00 51.86 O HETATM 3320 O HOH 66 7.427 15.973 -9.092 1.00 27.27 O HETATM 3321 O HOH 67 -0.355 15.400 1.763 1.00 39.42 O HETATM 3322 O HOH 68 9.406 5.033 -16.620 1.00 70.48 O HETATM 3323 O HOH 69 14.618 10.961 12.288 1.00 57.04 O HETATM 3324 O HOH 70 4.418 19.031 -10.574 1.00 44.27 O HETATM 3325 O HOH 71 16.572 15.576 -23.357 1.00 45.65 O HETATM 3326 O HOH 72 29.409 33.945 -12.535 1.00 45.16 O HETATM 3327 O HOH 73 34.297 24.674 -6.535 1.00 56.66 O HETATM 3328 O HOH 74 8.533 2.774 2.011 1.00 49.61 O HETATM 3329 O HOH 75 12.633 16.676 -12.907 1.00 45.43 O HETATM 3330 O HOH 76 -1.297 14.289 4.584 1.00 51.57 O HETATM 3331 O HOH 77 -0.460 17.294 6.150 1.00 58.87 O HETATM 3332 O HOH 78 26.075 31.888 -18.685 1.00 39.18 O HETATM 3333 O HOH 79 17.354 27.623 -19.540 1.00 39.09 O HETATM 3334 O HOH 80 17.333 13.472 -24.741 1.00 69.26 O HETATM 3335 O HOH 81 21.719 11.268 -3.379 1.00 57.69 O HETATM 3336 O HOH 82 23.547 26.982 1.113 1.00 56.87 O HETATM 3337 O HOH 83 26.070 13.881 7.361 1.00 59.34 O HETATM 3338 O HOH 84 23.746 13.166 -3.781 1.00 58.95 O HETATM 3339 O HOH 85 23.559 22.256 -21.978 1.00 46.33 O HETATM 3340 O HOH 86 13.571 27.609 -8.968 1.00 56.27 O HETATM 3341 O HOH 87 18.368 7.337 13.958 1.00 55.56 O HETATM 3342 O HOH 88 30.343 21.786 -24.080 1.00 51.49 O HETATM 3343 O HOH 89 8.776 17.395 -12.784 1.00 45.61 O HETATM 3344 O HOH 90 9.346 11.484 -23.878 1.00 50.42 O HETATM 3345 O HOH 91 30.190 19.729 -7.857 1.00 70.94 O HETATM 3346 O HOH 92 11.575 11.278 -22.062 1.00 50.49 O HETATM 3347 O HOH 93 20.891 16.235 13.355 1.00 38.10 O HETATM 3348 O HOH 94 13.089 9.813 -23.217 1.00 62.98 O HETATM 3349 O HOH 95 30.519 35.845 -14.064 1.00 57.36 O HETATM 3350 O HOH 96 32.394 17.132 -19.896 1.00 64.79 O HETATM 3351 O HOH 97 -0.796 2.597 -13.797 1.00 55.18 O HETATM 3352 O HOH 98 20.371 4.705 13.431 1.00 61.94 O HETATM 3353 O HOH 99 12.157 7.550 -14.905 1.00 61.93 O HETATM 3354 O HOH 100 -2.953 2.944 -13.461 1.00 60.41 O HETATM 3355 O HOH 101 7.671 23.130 14.125 1.00 52.51 O HETATM 3356 O HOH 102 -0.547 12.081 10.229 1.00 60.68 O HETATM 3357 O HOH 103 10.612 13.928 -14.004 1.00 59.28 O HETATM 3358 O HOH 104 20.856 33.217 -5.017 1.00 60.55 O HETATM 3359 O HOH 105 21.899 13.497 2.228 1.00 47.04 O HETATM 3360 O HOH 106 0.974 17.820 8.200 1.00 48.22 O HETATM 3361 O HOH 107 1.270 7.453 5.518 1.00 49.63 O HETATM 3362 O HOH 108 8.558 26.279 -9.810 1.00 54.28 O HETATM 3363 O HOH 109 20.834 15.050 3.213 1.00 59.46 O HETATM 3364 O HOH 110 14.172 -6.130 15.970 1.00 62.08 O HETATM 3365 O HOH 111 -10.665 24.468 -2.206 1.00 68.17 O HETATM 3366 O HOH 112 8.763 22.511 16.512 1.00 43.06 O HETATM 3367 O HOH 113 2.602 27.465 6.802 1.00 57.78 O HETATM 3368 O HOH 114 30.431 17.853 -21.448 1.00 61.48 O HETATM 3369 O HOH 115 12.826 31.559 6.717 1.00 62.55 O HETATM 3370 O HOH 116 -7.391 9.684 -1.767 1.00 68.06 O HETATM 3371 O HOH 117 34.305 36.223 -15.856 1.00 67.12 O HETATM 3372 O HOH 118 6.496 18.740 -7.831 1.00 30.82 O HETATM 3373 F UNN A 119 11.136 20.105 -19.342 1.00 -0.18 F HETATM 3374 C10 UNN A 119 11.043 20.437 -18.045 1.00 0.13 C HETATM 3375 C9 UNN A 119 11.222 19.481 -17.058 1.00 -0.03 C HETATM 3376 C8 UNN A 119 11.139 19.847 -15.716 1.00 -0.06 C HETATM 3377 C7 UNN A 119 10.861 21.167 -15.395 1.00 -0.02 C HETATM 3378 C12 UNN A 119 10.691 22.119 -16.386 1.00 -0.06 C HETATM 3379 C11 UNN A 119 10.780 21.750 -17.711 1.00 -0.03 C HETATM 3380 H3 UNN A 119 10.643 22.491 -18.491 1.00 0.06 H HETATM 3381 H4 UNN A 119 10.489 23.150 -16.121 1.00 0.06 H HETATM 3382 C6 UNN A 119 10.771 21.618 -13.961 1.00 -0.02 C HETATM 3383 C5 UNN A 119 10.251 20.780 -12.977 1.00 -0.04 C HETATM 3384 C4 UNN A 119 10.189 21.255 -11.638 1.00 0.02 C HETATM 3385 N UNN A 119 9.682 20.423 -10.680 1.00 -0.28 N HETATM 3386 C UNN A 119 9.589 20.816 -9.434 1.00 0.20 C HETATM 3387 O UNN A 119 9.060 19.967 -8.467 1.00 -0.31 O HETATM 3388 H6 UNN A 119 9.066 20.406 -7.625 1.00 0.25 H HETATM 3389 C1 UNN A 119 10.042 22.084 -9.036 1.00 0.15 C HETATM 3390 C2 UNN A 119 10.595 22.990 -9.968 1.00 -0.01 C HETATM 3391 C3 UNN A 119 10.645 22.514 -11.326 1.00 -0.01 C HETATM 3392 C14 UNN A 119 11.186 23.362 -12.338 1.00 -0.06 C HETATM 3393 C13 UNN A 119 11.245 22.899 -13.645 1.00 -0.06 C HETATM 3394 H7 UNN A 119 11.659 23.530 -14.424 1.00 0.06 H HETATM 3395 H8 UNN A 119 11.546 24.354 -12.089 1.00 0.06 H HETATM 3396 H9 UNN A 119 10.955 23.971 -9.682 1.00 0.06 H HETATM 3397 O1 UNN A 119 9.952 22.444 -7.695 1.00 -0.33 O HETATM 3398 H10 UNN A 119 9.561 21.732 -7.203 1.00 0.25 H HETATM 3399 H5 UNN A 119 9.900 19.785 -13.227 1.00 0.06 H HETATM 3400 H2 UNN A 119 11.290 19.111 -14.935 1.00 0.06 H HETATM 3401 H1 UNN A 119 11.426 18.451 -17.329 1.00 0.06 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 706 704 705 3255 CONECT 1331 1330 3256 CONECT 1774 1773 3256 CONECT 1775 1773 3255 CONECT 1975 1973 3255 CONECT 1985 1984 3255 CONECT 3255 706 1775 1975 1985 CONECT 3256 1331 1774 CONECT 3373 3374 CONECT 3374 3373 3375 3379 CONECT 3375 3374 3376 3401 CONECT 3376 3375 3377 3400 CONECT 3377 3376 3378 3382 CONECT 3378 3377 3379 3381 CONECT 3379 3374 3378 3380 CONECT 3380 3379 CONECT 3381 3378 CONECT 3382 3377 3383 3393 CONECT 3383 3382 3384 3399 CONECT 3384 3383 3385 3391 CONECT 3385 3384 3386 CONECT 3386 3385 3387 3389 CONECT 3387 3386 3388 CONECT 3388 3387 CONECT 3389 3386 3390 3397 CONECT 3390 3389 3391 3396 CONECT 3391 3384 3390 3392 CONECT 3392 3391 3393 3395 CONECT 3393 3382 3392 3394 CONECT 3394 3393 CONECT 3395 3392 CONECT 3396 3390 CONECT 3397 3389 3398 CONECT 3398 3397 CONECT 3399 3383 CONECT 3400 3376 CONECT 3401 3375 MASTER 0 0 0 0 0 0 0 0 3400 1 41 16 END
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Structure:
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Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 4kil
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4avg
RCSB PDB
PDBbind
204aa, >4AVG_1|Chains... at 97%
4awf
RCSB PDB
PDBbind
204aa, >4AWF_1|Chains... at 97%
4awg
RCSB PDB
PDBbind
204aa, >4AWG_1|Chains... at 97%
4awm
RCSB PDB
PDBbind
192aa, >4AWM_1|Chain... at 96%
4e5f
RCSB PDB
PDBbind
187aa, >4E5F_1|Chains... at 91%
4e5g
RCSB PDB
PDBbind
187aa, >4E5G_1|Chains... at 91%
4e5h
RCSB PDB
PDBbind
187aa, >4E5H_1|Chains... at 91%
4e5i
RCSB PDB
PDBbind
187aa, >4E5I_1|Chains... at 91%
4e5j
RCSB PDB
PDBbind
187aa, >4E5J_1|Chains... at 91%
4ln7
RCSB PDB
PDBbind
209aa, >4LN7_1|Chain... at 100%
4m4q
RCSB PDB
PDBbind
241aa, >4M4Q_1|Chain... *
4m5o
RCSB PDB
PDBbind
241aa, >4M5O_1|Chain... at 100%
4m5r
RCSB PDB
PDBbind
241aa, >4M5R_1|Chain... at 100%
4m5u
RCSB PDB
PDBbind
241aa, >4M5U_1|Chain... at 100%
4mk1
RCSB PDB
PDBbind
241aa, >4MK1_1|Chain... at 100%
4mk2
RCSB PDB
PDBbind
241aa, >4MK2_1|Chain... at 100%
4mk5
RCSB PDB
PDBbind
241aa, >4MK5_1|Chain... at 100%
4w9s
RCSB PDB
PDBbind
241aa, >4W9S_1|Chain... at 100%
5cgv
RCSB PDB
PDBbind
187aa, >5CGV_1|Chain... at 94%
5ega
RCSB PDB
PDBbind
187aa, >5EGA_1|Chain... at 94%
5w44
RCSB PDB
PDBbind
178aa, >5W44_1|Chain... at 98%
5w73
RCSB PDB
PDBbind
197aa, >5W73_1|Chain... at 93%
5w7u
RCSB PDB
PDBbind
197aa, >5W7U_1|Chain... at 93%
5w92
RCSB PDB
PDBbind
197aa, >5W92_1|Chain... at 93%
5w9g
RCSB PDB
PDBbind
197aa, >5W9G_1|Chain... at 93%
5wa7
RCSB PDB
PDBbind
197aa, >5WA7_1|Chain... at 93%
5wap
RCSB PDB
PDBbind
197aa, >5WAP_1|Chain... at 93%
5wb3
RCSB PDB
PDBbind
197aa, >5WB3_1|Chain... at 93%
5wdc
RCSB PDB
PDBbind
197aa, >5WDC_1|Chain... at 93%
5wdw
RCSB PDB
PDBbind
197aa, >5WDW_1|Chain... at 93%
5we9
RCSB PDB
PDBbind
187aa, >5WE9_1|Chain... at 94%
5web
RCSB PDB
PDBbind
197aa, >5WEB_1|Chain... at 93%
5wef
RCSB PDB
PDBbind
187aa, >5WEF_1|Chain... at 93%
5wei
RCSB PDB
PDBbind
197aa, >5WEI_1|Chain... at 92%
5wf3
RCSB PDB
PDBbind
197aa, >5WF3_1|Chain... at 92%
5wfm
RCSB PDB
PDBbind
197aa, >5WFM_1|Chain... at 92%
5wfw
RCSB PDB
PDBbind
197aa, >5WFW_1|Chain... at 92%
5wfz
RCSB PDB
PDBbind
197aa, >5WFZ_1|Chain... at 92%
5wg9
RCSB PDB
PDBbind
197aa, >5WG9_1|Chain... at 92%
6dcy
RCSB PDB
PDBbind
192aa, >6DCY_1|Chain... at 96%
6dcz
RCSB PDB
PDBbind
192aa, >6DCZ_1|Chain... at 96%
6dzq
RCSB PDB
PDBbind
192aa, >6DZQ_1|Chain... at 96%
6e0q
RCSB PDB
PDBbind
192aa, >6E0Q_1|Chain... at 96%
6nem
RCSB PDB
PDBbind
241aa, >6NEM_1|Chain... at 100%
6nel
RCSB PDB
PDBbind
241aa, >6NEL_1|Chain... at 100%
6e6w
RCSB PDB
PDBbind
192aa, >6E6W_1|Chain... at 96%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
6e4c
RCSB PDB
PDBbind
192aa, >6E4C_1|Chain... at 96%
6e3p
RCSB PDB
PDBbind
192aa, >6E3P_1|Chain... at 96%
6e3n
RCSB PDB
PDBbind
192aa, >6E3N_1|Chain... at 96%
6e3o
RCSB PDB
PDBbind
192aa, >6E3O_1|Chain... at 96%
6e3m
RCSB PDB
PDBbind
192aa, >6E3M_1|Chain... at 96%
5wa6
RCSB PDB
PDBbind
197aa, >5WA6_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4kil
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase PA
Ligand Name
1R5
EC.Number
E.C.-.-.-.-
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
IC50=0.5uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
ACS Med. Chem. Lett. 2013, 4, 547−550
Ligand Properties
Formula
C
1
5
H
1
0
FNO
2
Molecular Weight
255.244
Exact Mass
255.070
No. of atoms
29
No. of bonds
31
Polar Surface Area
53.35
LOGP Value
3.54 (
Computed with XLOGP3
)
3.45 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 3
Canonical SMILES
Fc1ccc(cc1)c1ccc2c(c1)nc(c(c2)O)O
InChI String
InChI=1S/C15H10FNO2/c16-12-5-3-9(4-6-12)10-1-2-11-8-14(18)15(19)17-13(11)7-10/h1-8,18H,(H,17,19)
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
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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