Browse entries in the PDBbind-CN Database
HEADER 3TC5_COMPLEX COMPND 3TC5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 31 LEU PRO PRO GLY TRP GLU LYS ALA MET SER ARG SER SER SEQRES 2 A 31 GLY ARG VAL TYR TYR PHE ASN HIS ILE THR ASN ALA SER SEQRES 3 A 31 GLN TRP GLU ARG PRO SEQRES 1 A 113 GLU PRO ALA ARG VAL ARG CYS SER HIS LEU LEU VAL LYS SEQRES 2 A 113 HIS SER GLN SER ARG ARG PRO SER SER TRP ARG GLN GLU SEQRES 3 A 113 LYS ILE THR ARG THR LYS GLU GLU ALA LEU GLU LEU ILE SEQRES 4 A 113 ASN GLY TYR ILE GLN LYS ILE LYS SER GLY GLU GLU ASP SEQRES 5 A 113 PHE GLU SER LEU ALA SER GLN PHE SER ASP CYS SER SER SEQRES 6 A 113 ALA LYS ALA ARG GLY ASP LEU GLY ALA PHE SER ARG GLY SEQRES 7 A 113 GLN MET GLN LYS PRO PHE GLU ASP ALA SER PHE ALA LEU SEQRES 8 A 113 ARG THR GLY GLU MET SER GLY PRO VAL PHE THR ASP SER SEQRES 9 A 113 GLY ILE HIS ILE ILE LEU ARG THR GLU HET UNN A 411 60 ATOM 1 N LEU A 7 11.366 -11.626 3.004 1.00 30.32 N ATOM 2 CA LEU A 7 11.738 -12.056 4.380 1.00 30.07 C ATOM 3 C LEU A 7 12.911 -11.244 4.912 1.00 30.00 C ATOM 4 O LEU A 7 13.344 -10.283 4.274 1.00 30.30 O ATOM 5 HA LEU A 7 10.881 -11.918 5.040 1.00 0.00 H ATOM 6 HN3 LEU A 7 12.178 -11.760 2.369 1.00 0.00 H ATOM 7 HN2 LEU A 7 11.096 -10.622 3.017 1.00 0.00 H ATOM 8 HN1 LEU A 7 10.564 -12.197 2.669 1.00 0.00 H ATOM 9 N PRO A 8 13.437 -11.631 6.086 1.00 29.95 N ATOM 10 CA PRO A 8 14.569 -10.928 6.702 1.00 29.77 C ATOM 11 C PRO A 8 15.839 -10.942 5.838 1.00 29.69 C ATOM 12 O PRO A 8 15.903 -11.680 4.854 1.00 30.11 O ATOM 13 CB PRO A 8 14.801 -11.699 8.004 1.00 29.86 C ATOM 14 CG PRO A 8 13.532 -12.428 8.265 1.00 30.08 C ATOM 15 CD PRO A 8 12.943 -12.730 6.933 1.00 29.99 C ATOM 16 HA PRO A 8 14.348 -9.870 6.842 1.00 0.00 H ATOM 17 HD3 PRO A 8 13.289 -13.695 6.562 1.00 0.00 H ATOM 18 HD2 PRO A 8 11.854 -12.729 6.978 1.00 0.00 H ATOM 19 HG3 PRO A 8 12.852 -11.806 8.847 1.00 0.00 H ATOM 20 HG2 PRO A 8 13.732 -13.352 8.808 1.00 0.00 H ATOM 21 HB2 PRO A 8 15.627 -12.401 7.890 1.00 0.00 H ATOM 22 HB3 PRO A 8 15.021 -11.011 8.821 1.00 0.00 H ATOM 23 N PRO A 9 16.848 -10.132 6.207 1.00 29.25 N ATOM 24 CA PRO A 9 18.040 -9.972 5.371 1.00 29.00 C ATOM 25 C PRO A 9 18.717 -11.281 4.955 1.00 28.52 C ATOM 26 O PRO A 9 19.225 -12.027 5.813 1.00 28.49 O ATOM 27 CB PRO A 9 18.971 -9.127 6.251 1.00 29.09 C ATOM 28 CG PRO A 9 18.045 -8.314 7.082 1.00 29.20 C ATOM 29 CD PRO A 9 16.872 -9.221 7.366 1.00 29.29 C ATOM 30 HA PRO A 9 17.782 -9.518 4.414 1.00 0.00 H ATOM 31 HD3 PRO A 9 17.023 -9.774 8.293 1.00 0.00 H ATOM 32 HD2 PRO A 9 15.946 -8.650 7.432 1.00 0.00 H ATOM 33 HG3 PRO A 9 17.720 -7.427 6.538 1.00 0.00 H ATOM 34 HG2 PRO A 9 18.529 -8.012 8.011 1.00 0.00 H ATOM 35 HB2 PRO A 9 19.595 -9.764 6.877 1.00 0.00 H ATOM 36 HB3 PRO A 9 19.606 -8.486 5.639 1.00 0.00 H ATOM 37 N GLY A 10 18.699 -11.540 3.644 1.00 27.92 N ATOM 38 CA GLY A 10 19.469 -12.621 3.036 1.00 26.94 C ATOM 39 C GLY A 10 18.708 -13.890 2.689 1.00 26.28 C ATOM 40 O GLY A 10 19.323 -14.865 2.283 1.00 24.93 O ATOM 41 HA3 GLY A 10 20.264 -12.892 3.731 1.00 0.00 H ATOM 42 HA2 GLY A 10 19.908 -12.237 2.115 1.00 0.00 H ATOM 43 H GLY A 10 18.109 -10.944 3.029 1.00 0.00 H ATOM 44 N TRP A 11 17.381 -13.876 2.812 1.00 25.88 N ATOM 45 CA TRP A 11 16.573 -15.099 2.649 1.00 25.66 C ATOM 46 C TRP A 11 15.971 -15.253 1.258 1.00 25.84 C ATOM 47 O TRP A 11 15.508 -14.282 0.659 1.00 25.89 O ATOM 48 CB TRP A 11 15.444 -15.146 3.682 1.00 25.53 C ATOM 49 CG TRP A 11 15.897 -15.420 5.070 1.00 24.31 C ATOM 50 CD1 TRP A 11 16.074 -14.508 6.068 1.00 24.07 C ATOM 51 CD2 TRP A 11 16.223 -16.695 5.636 1.00 22.92 C ATOM 52 NE1 TRP A 11 16.500 -15.124 7.208 1.00 23.67 N ATOM 53 CE2 TRP A 11 16.589 -16.472 6.979 1.00 22.79 C ATOM 54 CE3 TRP A 11 16.234 -18.005 5.143 1.00 21.98 C ATOM 55 CZ2 TRP A 11 16.974 -17.506 7.831 1.00 22.82 C ATOM 56 CZ3 TRP A 11 16.616 -19.033 5.995 1.00 21.42 C ATOM 57 CH2 TRP A 11 16.977 -18.779 7.323 1.00 22.06 C ATOM 58 HA TRP A 11 17.266 -15.926 2.801 1.00 0.00 H ATOM 59 HB2 TRP A 11 14.932 -14.184 3.673 1.00 0.00 H ATOM 60 HB3 TRP A 11 14.746 -15.930 3.389 1.00 0.00 H ATOM 61 HE1 TRP A 11 16.721 -14.648 8.106 1.00 0.00 H ATOM 62 HD1 TRP A 11 15.900 -13.437 5.969 1.00 0.00 H ATOM 63 HZ2 TRP A 11 17.262 -17.309 8.864 1.00 0.00 H ATOM 64 HH2 TRP A 11 17.266 -19.610 7.966 1.00 0.00 H ATOM 65 HZ3 TRP A 11 16.635 -20.057 5.622 1.00 0.00 H ATOM 66 HE3 TRP A 11 15.949 -18.214 4.112 1.00 0.00 H ATOM 67 H TRP A 11 16.902 -12.978 3.029 1.00 0.00 H ATOM 68 N GLU A 12 15.965 -16.490 0.761 1.00 25.52 N ATOM 69 CA GLU A 12 15.333 -16.826 -0.511 1.00 25.78 C ATOM 70 C GLU A 12 14.520 -18.107 -0.346 1.00 25.60 C ATOM 71 O GLU A 12 14.846 -18.954 0.489 1.00 24.49 O ATOM 72 CB GLU A 12 16.376 -17.004 -1.628 1.00 26.16 C ATOM 73 CG GLU A 12 17.134 -18.341 -1.604 1.00 27.36 C ATOM 74 CD GLU A 12 18.211 -18.452 -2.678 1.00 28.79 C ATOM 75 OE1 GLU A 12 19.257 -17.776 -2.560 1.00 29.24 O ATOM 76 OE2 GLU A 12 18.018 -19.242 -3.632 1.00 30.87 O ATOM 77 HA GLU A 12 14.677 -16.004 -0.799 1.00 0.00 H ATOM 78 HB2 GLU A 12 15.862 -16.924 -2.586 1.00 0.00 H ATOM 79 HB3 GLU A 12 17.106 -16.200 -1.540 1.00 0.00 H ATOM 80 HG2 GLU A 12 17.607 -18.452 -0.628 1.00 0.00 H ATOM 81 HG3 GLU A 12 16.416 -19.147 -1.751 1.00 0.00 H ATOM 82 H GLU A 12 16.430 -17.247 1.302 1.00 0.00 H ATOM 83 N LYS A 13 13.466 -18.227 -1.147 1.00 25.71 N ATOM 84 CA LYS A 13 12.641 -19.424 -1.192 1.00 26.15 C ATOM 85 C LYS A 13 13.300 -20.401 -2.153 1.00 26.21 C ATOM 86 O LYS A 13 13.768 -20.011 -3.227 1.00 26.74 O ATOM 87 CB LYS A 13 11.219 -19.076 -1.656 1.00 26.26 C ATOM 88 CG LYS A 13 10.203 -20.202 -1.510 1.00 26.89 C ATOM 89 CD LYS A 13 8.800 -19.746 -1.912 1.00 27.47 C ATOM 90 HA LYS A 13 12.559 -19.871 -0.201 1.00 0.00 H ATOM 91 HB2 LYS A 13 10.870 -18.226 -1.070 1.00 0.00 H ATOM 92 HB3 LYS A 13 11.265 -18.795 -2.708 1.00 0.00 H ATOM 93 HG2 LYS A 13 10.502 -21.034 -2.148 1.00 0.00 H ATOM 94 HG3 LYS A 13 10.185 -20.531 -0.471 1.00 0.00 H ATOM 95 HD2 LYS A 13 8.492 -18.918 -1.274 1.00 0.00 H ATOM 96 HD3 LYS A 13 8.809 -19.421 -2.952 1.00 0.00 H ATOM 97 H LYS A 13 13.221 -17.430 -1.769 1.00 0.00 H ATOM 98 N ALA A 14 13.347 -21.669 -1.758 1.00 26.01 N ATOM 99 CA ALA A 14 13.942 -22.718 -2.575 1.00 26.01 C ATOM 100 C ALA A 14 13.089 -23.977 -2.520 1.00 25.97 C ATOM 101 O ALA A 14 12.159 -24.079 -1.727 1.00 24.73 O ATOM 102 CB ALA A 14 15.358 -23.016 -2.106 1.00 26.04 C ATOM 103 HA ALA A 14 13.985 -22.372 -3.608 1.00 0.00 H ATOM 104 HB1 ALA A 14 15.964 -22.114 -2.189 1.00 0.00 H ATOM 105 HB2 ALA A 14 15.334 -23.345 -1.067 1.00 0.00 H ATOM 106 HB3 ALA A 14 15.787 -23.802 -2.727 1.00 0.00 H ATOM 107 H ALA A 14 12.945 -21.921 -0.833 1.00 0.00 H ATOM 108 N MET A 15 13.413 -24.932 -3.379 1.00 26.59 N ATOM 109 CA MET A 15 12.672 -26.181 -3.453 1.00 27.15 C ATOM 110 C MET A 15 13.614 -27.324 -3.127 1.00 26.74 C ATOM 111 O MET A 15 14.697 -27.419 -3.704 1.00 26.75 O ATOM 112 CB MET A 15 12.091 -26.346 -4.857 1.00 27.80 C ATOM 113 CG MET A 15 10.809 -27.145 -4.914 1.00 29.95 C ATOM 114 SD MET A 15 9.611 -26.326 -5.986 1.00 35.43 S ATOM 115 CE MET A 15 9.135 -24.950 -4.936 1.00 35.62 C ATOM 116 HA MET A 15 11.850 -26.178 -2.738 1.00 0.00 H ATOM 117 HB2 MET A 15 11.893 -25.354 -5.263 1.00 0.00 H ATOM 118 HB3 MET A 15 12.834 -26.849 -5.476 1.00 0.00 H ATOM 119 HG2 MET A 15 10.394 -27.232 -3.910 1.00 0.00 H ATOM 120 HG3 MET A 15 11.022 -28.140 -5.305 1.00 0.00 H ATOM 121 HE1 MET A 15 8.709 -25.333 -4.008 1.00 0.00 H ATOM 122 HE2 MET A 15 10.013 -24.345 -4.712 1.00 0.00 H ATOM 123 HE3 MET A 15 8.394 -24.340 -5.453 1.00 0.00 H ATOM 124 H MET A 15 14.220 -24.784 -4.018 1.00 0.00 H ATOM 125 N SER A 16 13.212 -28.178 -2.187 1.00 26.51 N ATOM 126 CA SER A 16 14.041 -29.305 -1.773 1.00 26.48 C ATOM 127 C SER A 16 14.344 -30.215 -2.960 1.00 26.51 C ATOM 128 O SER A 16 13.431 -30.661 -3.656 1.00 26.25 O ATOM 129 CB SER A 16 13.346 -30.118 -0.685 1.00 26.46 C ATOM 130 OG SER A 16 14.116 -31.265 -0.365 1.00 27.11 O ATOM 131 HA SER A 16 14.974 -28.902 -1.379 1.00 0.00 H ATOM 132 HB2 SER A 16 12.364 -30.431 -1.040 1.00 0.00 H ATOM 133 HB3 SER A 16 13.229 -29.502 0.207 1.00 0.00 H ATOM 134 HG SER A 16 15.007 -30.982 -0.040 1.00 0.00 H ATOM 135 H SER A 16 12.285 -28.038 -1.737 1.00 0.00 H ATOM 136 N ARG A 17 15.629 -30.484 -3.175 1.00 26.50 N ATOM 137 CA ARG A 17 16.078 -31.295 -4.304 1.00 26.70 C ATOM 138 C ARG A 17 15.598 -32.738 -4.171 1.00 26.91 C ATOM 139 O ARG A 17 15.315 -33.397 -5.173 1.00 27.19 O ATOM 140 CB ARG A 17 17.608 -31.242 -4.410 1.00 26.66 C ATOM 141 CG ARG A 17 18.202 -31.850 -5.675 1.00 27.06 C ATOM 142 CD ARG A 17 17.677 -31.188 -6.937 1.00 26.80 C ATOM 143 NE ARG A 17 17.873 -29.739 -6.939 1.00 26.59 N ATOM 144 CZ ARG A 17 18.976 -29.115 -7.357 1.00 27.15 C ATOM 145 NH1 ARG A 17 20.021 -29.798 -7.816 1.00 27.31 N ATOM 146 NH2 ARG A 17 19.033 -27.788 -7.307 1.00 27.21 N ATOM 147 HA ARG A 17 15.645 -30.885 -5.216 1.00 0.00 H ATOM 148 HB2 ARG A 17 17.911 -30.196 -4.366 1.00 0.00 H ATOM 149 HB3 ARG A 17 18.022 -31.776 -3.555 1.00 0.00 H ATOM 150 HG2 ARG A 17 19.285 -31.735 -5.644 1.00 0.00 H ATOM 151 HG3 ARG A 17 17.951 -32.910 -5.705 1.00 0.00 H ATOM 152 HD2 ARG A 17 16.610 -31.396 -7.022 1.00 0.00 H ATOM 153 HD3 ARG A 17 18.198 -31.612 -7.796 1.00 0.00 H ATOM 154 HE ARG A 17 17.092 -29.149 -6.587 1.00 0.00 H ATOM 155 HH12 ARG A 17 20.872 -29.293 -8.137 1.00 0.00 H ATOM 156 HH11 ARG A 17 19.987 -30.837 -7.854 1.00 0.00 H ATOM 157 HH22 ARG A 17 19.888 -27.292 -7.630 1.00 0.00 H ATOM 158 HH21 ARG A 17 18.223 -27.246 -6.945 1.00 0.00 H ATOM 159 H ARG A 17 16.338 -30.104 -2.516 1.00 0.00 H ATOM 160 N SER A 18 15.491 -33.219 -2.934 1.00 26.88 N ATOM 161 CA SER A 18 15.076 -34.596 -2.685 1.00 26.93 C ATOM 162 C SER A 18 13.556 -34.740 -2.553 1.00 26.66 C ATOM 163 O SER A 18 12.977 -35.619 -3.189 1.00 27.40 O ATOM 164 CB SER A 18 15.805 -35.176 -1.466 1.00 27.05 C ATOM 165 OG SER A 18 15.724 -34.317 -0.343 1.00 27.60 O ATOM 166 HA SER A 18 15.363 -35.178 -3.561 1.00 0.00 H ATOM 167 HB2 SER A 18 16.854 -35.325 -1.721 1.00 0.00 H ATOM 168 HB3 SER A 18 15.355 -36.135 -1.209 1.00 0.00 H ATOM 169 HG SER A 18 16.137 -33.445 -0.565 1.00 0.00 H ATOM 170 H SER A 18 15.708 -32.600 -2.127 1.00 0.00 H ATOM 171 N SER A 19 12.911 -33.864 -1.777 1.00 26.25 N ATOM 172 CA SER A 19 11.466 -33.985 -1.485 1.00 25.66 C ATOM 173 C SER A 19 10.535 -33.071 -2.305 1.00 25.12 C ATOM 174 O SER A 19 9.336 -33.332 -2.401 1.00 25.08 O ATOM 175 CB SER A 19 11.205 -33.760 0.013 1.00 25.89 C ATOM 176 OG SER A 19 11.198 -32.379 0.356 1.00 26.17 O ATOM 177 HA SER A 19 11.215 -35.001 -1.788 1.00 0.00 H ATOM 178 HB2 SER A 19 11.987 -34.260 0.585 1.00 0.00 H ATOM 179 HB3 SER A 19 10.237 -34.191 0.270 1.00 0.00 H ATOM 180 HG SER A 19 12.076 -31.980 0.133 1.00 0.00 H ATOM 181 H SER A 19 13.443 -33.071 -1.365 1.00 0.00 H ATOM 182 N GLY A 20 11.073 -31.991 -2.869 1.00 24.37 N ATOM 183 CA GLY A 20 10.262 -31.014 -3.607 1.00 23.98 C ATOM 184 C GLY A 20 9.516 -29.987 -2.762 1.00 23.38 C ATOM 185 O GLY A 20 8.840 -29.106 -3.295 1.00 23.71 O ATOM 186 HA3 GLY A 20 9.524 -31.566 -4.190 1.00 0.00 H ATOM 187 HA2 GLY A 20 10.925 -30.472 -4.282 1.00 0.00 H ATOM 188 H GLY A 20 12.098 -31.835 -2.784 1.00 0.00 H ATOM 189 N ARG A 21 9.635 -30.096 -1.443 1.00 22.84 N ATOM 190 CA ARG A 21 8.949 -29.198 -0.525 1.00 22.23 C ATOM 191 C ARG A 21 9.692 -27.861 -0.451 1.00 21.16 C ATOM 192 O ARG A 21 10.914 -27.818 -0.569 1.00 20.95 O ATOM 193 CB ARG A 21 8.873 -29.861 0.853 1.00 22.56 C ATOM 194 CG ARG A 21 7.889 -29.251 1.840 1.00 23.80 C ATOM 195 CD ARG A 21 7.347 -30.317 2.814 1.00 25.25 C ATOM 196 NE ARG A 21 8.311 -31.396 3.031 1.00 26.34 N ATOM 197 CZ ARG A 21 9.232 -31.436 3.994 1.00 26.81 C ATOM 198 NH1 ARG A 21 9.324 -30.467 4.901 1.00 26.50 N ATOM 199 NH2 ARG A 21 10.069 -32.472 4.055 1.00 27.69 N ATOM 200 HA ARG A 21 7.937 -29.001 -0.880 1.00 0.00 H ATOM 201 HB2 ARG A 21 8.593 -30.904 0.705 1.00 0.00 H ATOM 202 HB3 ARG A 21 9.866 -29.813 1.300 1.00 0.00 H ATOM 203 HG2 ARG A 21 8.394 -28.471 2.410 1.00 0.00 H ATOM 204 HG3 ARG A 21 7.056 -28.815 1.289 1.00 0.00 H ATOM 205 HD2 ARG A 21 6.431 -30.740 2.401 1.00 0.00 H ATOM 206 HD3 ARG A 21 7.127 -29.842 3.770 1.00 0.00 H ATOM 207 HE ARG A 21 8.275 -32.203 2.376 1.00 0.00 H ATOM 208 HH12 ARG A 21 10.050 -30.518 5.644 1.00 0.00 H ATOM 209 HH11 ARG A 21 8.670 -29.659 4.867 1.00 0.00 H ATOM 210 HH22 ARG A 21 10.791 -32.514 4.802 1.00 0.00 H ATOM 211 HH21 ARG A 21 10.000 -33.239 3.356 1.00 0.00 H ATOM 212 H ARG A 21 10.238 -30.848 -1.053 1.00 0.00 H ATOM 213 N VAL A 22 8.945 -26.780 -0.260 1.00 20.41 N ATOM 214 CA VAL A 22 9.521 -25.443 -0.162 1.00 19.89 C ATOM 215 C VAL A 22 10.357 -25.324 1.115 1.00 18.64 C ATOM 216 O VAL A 22 9.970 -25.818 2.162 1.00 17.47 O ATOM 217 CB VAL A 22 8.416 -24.358 -0.171 1.00 20.42 C ATOM 218 CG1 VAL A 22 8.981 -22.989 0.188 1.00 21.45 C ATOM 219 CG2 VAL A 22 7.740 -24.310 -1.535 1.00 21.75 C ATOM 220 HA VAL A 22 10.162 -25.286 -1.030 1.00 0.00 H ATOM 221 HB VAL A 22 7.676 -24.623 0.585 1.00 0.00 H ATOM 222 HG11 VAL A 22 9.421 -23.029 1.185 1.00 0.00 H ATOM 223 HG12 VAL A 22 9.746 -22.712 -0.537 1.00 0.00 H ATOM 224 HG13 VAL A 22 8.179 -22.251 0.172 1.00 0.00 H ATOM 225 HG21 VAL A 22 8.481 -24.073 -2.298 1.00 0.00 H ATOM 226 HG22 VAL A 22 7.292 -25.280 -1.751 1.00 0.00 H ATOM 227 HG23 VAL A 22 6.965 -23.543 -1.528 1.00 0.00 H ATOM 228 H VAL A 22 7.914 -26.890 -0.177 1.00 0.00 H ATOM 229 N TYR A 23 11.523 -24.696 1.005 1.00 17.81 N ATOM 230 CA TYR A 23 12.301 -24.330 2.181 1.00 17.08 C ATOM 231 C TYR A 23 12.936 -22.971 1.973 1.00 16.39 C ATOM 232 O TYR A 23 12.780 -22.359 0.920 1.00 16.09 O ATOM 233 CB TYR A 23 13.351 -25.396 2.509 1.00 16.90 C ATOM 234 CG TYR A 23 14.547 -25.424 1.592 1.00 17.31 C ATOM 235 CD1 TYR A 23 14.501 -26.092 0.378 1.00 18.55 C ATOM 236 CD2 TYR A 23 15.738 -24.800 1.952 1.00 17.18 C ATOM 237 CE1 TYR A 23 15.609 -26.124 -0.465 1.00 19.16 C ATOM 238 CE2 TYR A 23 16.848 -24.835 1.123 1.00 18.38 C ATOM 239 CZ TYR A 23 16.774 -25.490 -0.086 1.00 19.56 C ATOM 240 OH TYR A 23 17.870 -25.524 -0.908 1.00 21.63 O ATOM 241 HA TYR A 23 11.631 -24.272 3.039 1.00 0.00 H ATOM 242 HB3 TYR A 23 12.867 -26.372 2.462 1.00 0.00 H ATOM 243 HB2 TYR A 23 13.708 -25.217 3.523 1.00 0.00 H ATOM 244 HD2 TYR A 23 15.799 -24.274 2.905 1.00 0.00 H ATOM 245 HE2 TYR A 23 17.774 -24.347 1.426 1.00 0.00 H ATOM 246 HE1 TYR A 23 15.556 -26.647 -1.420 1.00 0.00 H ATOM 247 HD1 TYR A 23 13.584 -26.600 0.079 1.00 0.00 H ATOM 248 HH TYR A 23 18.130 -24.599 -1.148 1.00 0.00 H ATOM 249 H TYR A 23 11.888 -24.461 0.060 1.00 0.00 H ATOM 250 N TYR A 24 13.641 -22.503 2.993 1.00 15.67 N ATOM 251 CA TYR A 24 14.224 -21.176 2.963 1.00 15.91 C ATOM 252 C TYR A 24 15.707 -21.259 3.249 1.00 15.52 C ATOM 253 O TYR A 24 16.135 -22.008 4.111 1.00 14.78 O ATOM 254 CB TYR A 24 13.491 -20.269 3.948 1.00 16.40 C ATOM 255 CG TYR A 24 12.019 -20.161 3.599 1.00 17.32 C ATOM 256 CD1 TYR A 24 11.098 -21.081 4.099 1.00 18.04 C ATOM 257 CD2 TYR A 24 11.561 -19.187 2.722 1.00 19.36 C ATOM 258 CE1 TYR A 24 9.746 -21.008 3.762 1.00 19.51 C ATOM 259 CE2 TYR A 24 10.214 -19.106 2.375 1.00 19.96 C ATOM 260 CZ TYR A 24 9.313 -20.018 2.900 1.00 20.34 C ATOM 261 OH TYR A 24 7.979 -19.939 2.560 1.00 23.30 O ATOM 262 HA TYR A 24 14.110 -20.740 1.971 1.00 0.00 H ATOM 263 HB3 TYR A 24 13.938 -19.275 3.918 1.00 0.00 H ATOM 264 HB2 TYR A 24 13.590 -20.680 4.953 1.00 0.00 H ATOM 265 HD2 TYR A 24 12.267 -18.473 2.298 1.00 0.00 H ATOM 266 HE2 TYR A 24 9.870 -18.328 1.693 1.00 0.00 H ATOM 267 HE1 TYR A 24 9.037 -21.726 4.175 1.00 0.00 H ATOM 268 HD1 TYR A 24 11.441 -21.872 4.766 1.00 0.00 H ATOM 269 HH TYR A 24 7.479 -20.660 3.019 1.00 0.00 H ATOM 270 H TYR A 24 13.779 -23.101 3.833 1.00 0.00 H ATOM 271 N PHE A 25 16.471 -20.475 2.489 1.00 15.42 N ATOM 272 CA PHE A 25 17.925 -20.476 2.537 1.00 15.65 C ATOM 273 C PHE A 25 18.417 -19.043 2.689 1.00 15.31 C ATOM 274 O PHE A 25 17.923 -18.133 2.021 1.00 15.73 O ATOM 275 CB PHE A 25 18.498 -21.096 1.253 1.00 15.96 C ATOM 276 CG PHE A 25 19.986 -20.939 1.113 1.00 16.58 C ATOM 277 CD1 PHE A 25 20.852 -21.591 1.981 1.00 17.52 C ATOM 278 CD2 PHE A 25 20.520 -20.118 0.131 1.00 16.80 C ATOM 279 CE1 PHE A 25 22.236 -21.441 1.863 1.00 18.04 C ATOM 280 CE2 PHE A 25 21.902 -19.968 0.004 1.00 17.28 C ATOM 281 CZ PHE A 25 22.757 -20.630 0.879 1.00 17.53 C ATOM 282 HA PHE A 25 18.260 -21.071 3.387 1.00 0.00 H ATOM 283 HB2 PHE A 25 18.263 -22.160 1.251 1.00 0.00 H ATOM 284 HB3 PHE A 25 18.020 -20.618 0.398 1.00 0.00 H ATOM 285 HD2 PHE A 25 19.854 -19.585 -0.548 1.00 0.00 H ATOM 286 HE2 PHE A 25 22.311 -19.332 -0.781 1.00 0.00 H ATOM 287 HZ PHE A 25 23.836 -20.507 0.786 1.00 0.00 H ATOM 288 HE1 PHE A 25 22.902 -21.965 2.548 1.00 0.00 H ATOM 289 HD1 PHE A 25 20.446 -22.229 2.766 1.00 0.00 H ATOM 290 H PHE A 25 16.002 -19.827 1.825 1.00 0.00 H ATOM 291 N ASN A 26 19.386 -18.859 3.574 1.00 15.01 N ATOM 292 CA ASN A 26 19.998 -17.555 3.784 1.00 14.92 C ATOM 293 C ASN A 26 21.421 -17.559 3.242 1.00 14.77 C ATOM 294 O ASN A 26 22.269 -18.300 3.720 1.00 14.62 O ATOM 295 CB ASN A 26 19.985 -17.216 5.271 1.00 14.83 C ATOM 296 CG ASN A 26 20.425 -15.792 5.544 1.00 14.54 C ATOM 297 OD1 ASN A 26 21.533 -15.396 5.183 1.00 14.21 O ATOM 298 ND2 ASN A 26 19.558 -15.014 6.179 1.00 16.50 N ATOM 299 HA ASN A 26 19.429 -16.794 3.250 1.00 0.00 H ATOM 300 HB2 ASN A 26 18.972 -17.349 5.651 1.00 0.00 H ATOM 301 HB3 ASN A 26 20.659 -17.897 5.791 1.00 0.00 H ATOM 302 HD22 ASN A 26 18.632 -15.392 6.465 1.00 0.00 H ATOM 303 HD21 ASN A 26 19.804 -14.026 6.391 1.00 0.00 H ATOM 304 H ASN A 26 19.719 -19.669 4.135 1.00 0.00 H ATOM 305 N HIS A 27 21.683 -16.726 2.237 1.00 14.79 N ATOM 306 CA HIS A 27 22.984 -16.741 1.555 1.00 14.88 C ATOM 307 C HIS A 27 24.090 -15.991 2.308 1.00 14.75 C ATOM 308 O HIS A 27 25.242 -16.024 1.893 1.00 14.75 O ATOM 309 CB HIS A 27 22.874 -16.217 0.111 1.00 15.38 C ATOM 310 CG HIS A 27 22.509 -14.769 0.014 1.00 17.14 C ATOM 311 ND1 HIS A 27 23.450 -13.763 0.051 1.00 19.86 N ATOM 312 CD2 HIS A 27 21.311 -14.158 -0.135 1.00 18.97 C ATOM 313 CE1 HIS A 27 22.844 -12.595 -0.057 1.00 19.30 C ATOM 314 NE2 HIS A 27 21.547 -12.806 -0.172 1.00 20.15 N ATOM 315 HA HIS A 27 23.279 -17.790 1.533 1.00 0.00 H ATOM 316 HB2 HIS A 27 23.836 -16.362 -0.380 1.00 0.00 H ATOM 317 HB3 HIS A 27 22.112 -16.798 -0.408 1.00 0.00 H ATOM 318 HD2 HIS A 27 20.340 -14.648 -0.211 1.00 0.00 H ATOM 319 HE1 HIS A 27 23.333 -11.621 -0.052 1.00 0.00 H ATOM 320 H HIS A 27 20.953 -16.052 1.929 1.00 0.00 H ATOM 321 N ILE A 28 23.731 -15.343 3.413 1.00 14.68 N ATOM 322 CA ILE A 28 24.696 -14.658 4.269 1.00 14.95 C ATOM 323 C ILE A 28 25.179 -15.572 5.397 1.00 14.63 C ATOM 324 O ILE A 28 26.363 -15.589 5.710 1.00 15.04 O ATOM 325 CB ILE A 28 24.098 -13.373 4.871 1.00 15.11 C ATOM 326 CG1 ILE A 28 23.555 -12.462 3.767 1.00 16.08 C ATOM 327 CG2 ILE A 28 25.149 -12.625 5.705 1.00 15.56 C ATOM 328 CD1 ILE A 28 22.810 -11.255 4.287 1.00 17.99 C ATOM 329 HA ILE A 28 25.546 -14.389 3.641 1.00 0.00 H ATOM 330 HB ILE A 28 23.273 -13.657 5.525 1.00 0.00 H ATOM 331 HG12 ILE A 28 24.394 -12.115 3.163 1.00 0.00 H ATOM 332 HG13 ILE A 28 22.876 -13.044 3.144 1.00 0.00 H ATOM 333 HD11 ILE A 28 21.960 -11.584 4.884 1.00 0.00 H ATOM 334 HD12 ILE A 28 23.479 -10.655 4.904 1.00 0.00 H ATOM 335 HD13 ILE A 28 22.456 -10.658 3.446 1.00 0.00 H ATOM 336 HG21 ILE A 28 25.493 -13.268 6.515 1.00 0.00 H ATOM 337 HG22 ILE A 28 25.993 -12.358 5.069 1.00 0.00 H ATOM 338 HG23 ILE A 28 24.705 -11.721 6.121 1.00 0.00 H ATOM 339 H ILE A 28 22.725 -15.323 3.677 1.00 0.00 H ATOM 340 N THR A 29 24.259 -16.334 5.992 1.00 14.33 N ATOM 341 CA THR A 29 24.589 -17.238 7.102 1.00 13.87 C ATOM 342 C THR A 29 24.761 -18.699 6.675 1.00 13.59 C ATOM 343 O THR A 29 25.266 -19.506 7.441 1.00 13.51 O ATOM 344 CB THR A 29 23.488 -17.220 8.173 1.00 13.97 C ATOM 345 OG1 THR A 29 22.276 -17.757 7.623 1.00 14.01 O ATOM 346 CG2 THR A 29 23.243 -15.813 8.699 1.00 14.77 C ATOM 347 HA THR A 29 25.538 -16.864 7.488 1.00 0.00 H ATOM 348 HB THR A 29 23.817 -17.834 9.011 1.00 0.00 H ATOM 349 HG1 THR A 29 21.567 -17.745 8.314 1.00 0.00 H ATOM 350 HG23 THR A 29 24.169 -15.415 9.114 1.00 0.00 H ATOM 351 HG21 THR A 29 22.906 -15.175 7.882 1.00 0.00 H ATOM 352 HG22 THR A 29 22.479 -15.845 9.476 1.00 0.00 H ATOM 353 H THR A 29 23.275 -16.286 5.659 1.00 0.00 H ATOM 354 N ASN A 30 24.323 -19.019 5.456 1.00 13.41 N ATOM 355 CA ASN A 30 24.231 -20.399 4.945 1.00 13.20 C ATOM 356 C ASN A 30 23.271 -21.286 5.744 1.00 13.29 C ATOM 357 O ASN A 30 23.320 -22.511 5.637 1.00 13.26 O ATOM 358 CB ASN A 30 25.621 -21.034 4.790 1.00 13.36 C ATOM 359 CG ASN A 30 26.384 -20.462 3.613 1.00 14.07 C ATOM 360 OD1 ASN A 30 27.605 -20.246 3.676 1.00 15.62 O ATOM 361 ND2 ASN A 30 25.667 -20.215 2.525 1.00 13.37 N ATOM 362 HA ASN A 30 23.790 -20.326 3.951 1.00 0.00 H ATOM 363 HB2 ASN A 30 26.193 -20.854 5.700 1.00 0.00 H ATOM 364 HB3 ASN A 30 25.502 -22.108 4.643 1.00 0.00 H ATOM 365 HD22 ASN A 30 24.646 -20.412 2.519 1.00 0.00 H ATOM 366 HD21 ASN A 30 26.126 -19.824 1.678 1.00 0.00 H ATOM 367 H ASN A 30 24.028 -18.246 4.826 1.00 0.00 H ATOM 368 N ALA A 31 22.380 -20.656 6.507 1.00 13.30 N ATOM 369 CA ALA A 31 21.323 -21.380 7.214 1.00 13.31 C ATOM 370 C ALA A 31 20.239 -21.823 6.243 1.00 13.82 C ATOM 371 O ALA A 31 19.957 -21.153 5.242 1.00 13.53 O ATOM 372 CB ALA A 31 20.708 -20.510 8.310 1.00 13.40 C ATOM 373 HA ALA A 31 21.770 -22.261 7.675 1.00 0.00 H ATOM 374 HB1 ALA A 31 21.481 -20.229 9.025 1.00 0.00 H ATOM 375 HB2 ALA A 31 20.281 -19.612 7.863 1.00 0.00 H ATOM 376 HB3 ALA A 31 19.925 -21.071 8.821 1.00 0.00 H ATOM 377 H ALA A 31 22.437 -19.622 6.603 1.00 0.00 H ATOM 378 N SER A 32 19.622 -22.957 6.560 1.00 14.51 N ATOM 379 CA SER A 32 18.473 -23.433 5.810 1.00 15.00 C ATOM 380 C SER A 32 17.451 -24.017 6.773 1.00 15.57 C ATOM 381 O SER A 32 17.822 -24.646 7.761 1.00 15.92 O ATOM 382 CB SER A 32 18.885 -24.465 4.761 1.00 15.55 C ATOM 383 OG SER A 32 19.750 -25.441 5.296 1.00 17.14 O ATOM 384 HA SER A 32 18.027 -22.593 5.278 1.00 0.00 H ATOM 385 HB2 SER A 32 19.393 -23.954 3.943 1.00 0.00 H ATOM 386 HB3 SER A 32 17.990 -24.957 4.380 1.00 0.00 H ATOM 387 HG SER A 32 19.993 -26.089 4.588 1.00 0.00 H ATOM 388 H SER A 32 19.970 -23.517 7.364 1.00 0.00 H ATOM 389 N GLN A 33 16.174 -23.787 6.476 1.00 16.02 N ATOM 390 CA GLN A 33 15.074 -24.175 7.367 1.00 16.55 C ATOM 391 C GLN A 33 13.779 -24.360 6.575 1.00 16.79 C ATOM 392 O GLN A 33 13.611 -23.786 5.504 1.00 16.99 O ATOM 393 CB GLN A 33 14.888 -23.125 8.477 1.00 16.85 C ATOM 394 CG GLN A 33 14.429 -21.756 7.994 1.00 18.36 C ATOM 395 CD GLN A 33 14.334 -20.733 9.113 1.00 19.91 C ATOM 396 OE1 GLN A 33 15.291 -20.512 9.845 1.00 21.96 O ATOM 397 NE2 GLN A 33 13.182 -20.089 9.231 1.00 21.22 N ATOM 398 HA GLN A 33 15.326 -25.128 7.833 1.00 0.00 H ATOM 399 HB2 GLN A 33 14.146 -23.503 9.180 1.00 0.00 H ATOM 400 HB3 GLN A 33 15.842 -23.001 8.990 1.00 0.00 H ATOM 401 HG2 GLN A 33 15.139 -21.393 7.251 1.00 0.00 H ATOM 402 HG3 GLN A 33 13.446 -21.861 7.535 1.00 0.00 H ATOM 403 HE22 GLN A 33 12.395 -20.309 8.587 1.00 0.00 H ATOM 404 HE21 GLN A 33 13.065 -19.364 9.967 1.00 0.00 H ATOM 405 H GLN A 33 15.947 -23.314 5.578 1.00 0.00 H ATOM 406 N TRP A 34 12.862 -25.159 7.116 1.00 17.06 N ATOM 407 CA TRP A 34 11.569 -25.396 6.472 1.00 17.43 C ATOM 408 C TRP A 34 10.577 -24.242 6.647 1.00 18.47 C ATOM 409 O TRP A 34 9.838 -23.921 5.721 1.00 18.46 O ATOM 410 CB TRP A 34 10.939 -26.692 6.994 1.00 17.18 C ATOM 411 CG TRP A 34 11.692 -27.934 6.612 1.00 15.93 C ATOM 412 CD1 TRP A 34 12.331 -28.800 7.456 1.00 15.84 C ATOM 413 CD2 TRP A 34 11.896 -28.449 5.289 1.00 14.97 C ATOM 414 NE1 TRP A 34 12.894 -29.822 6.746 1.00 16.29 N ATOM 415 CE2 TRP A 34 12.654 -29.629 5.412 1.00 15.59 C ATOM 416 CE3 TRP A 34 11.501 -28.034 4.013 1.00 15.08 C ATOM 417 CZ2 TRP A 34 13.027 -30.397 4.308 1.00 15.47 C ATOM 418 CZ3 TRP A 34 11.870 -28.800 2.916 1.00 15.55 C ATOM 419 CH2 TRP A 34 12.631 -29.963 3.068 1.00 15.76 C ATOM 420 HA TRP A 34 11.778 -25.479 5.405 1.00 0.00 H ATOM 421 HB2 TRP A 34 10.895 -26.638 8.082 1.00 0.00 H ATOM 422 HB3 TRP A 34 9.928 -26.767 6.594 1.00 0.00 H ATOM 423 HE1 TRP A 34 13.421 -30.620 7.154 1.00 0.00 H ATOM 424 HD1 TRP A 34 12.383 -28.690 8.539 1.00 0.00 H ATOM 425 HZ2 TRP A 34 13.612 -31.309 4.427 1.00 0.00 H ATOM 426 HH2 TRP A 34 12.915 -30.536 2.185 1.00 0.00 H ATOM 427 HZ3 TRP A 34 11.561 -28.489 1.918 1.00 0.00 H ATOM 428 HE3 TRP A 34 10.914 -27.125 3.882 1.00 0.00 H ATOM 429 H TRP A 34 13.070 -25.628 8.021 1.00 0.00 H ATOM 430 N GLU A 35 10.542 -23.631 7.831 1.00 19.59 N ATOM 431 CA GLU A 35 9.574 -22.557 8.106 1.00 21.10 C ATOM 432 C GLU A 35 9.952 -21.224 7.470 1.00 21.58 C ATOM 433 O GLU A 35 11.134 -20.919 7.303 1.00 21.62 O ATOM 434 CB GLU A 35 9.413 -22.334 9.606 1.00 21.68 C ATOM 435 CG GLU A 35 8.351 -23.161 10.265 1.00 23.91 C ATOM 436 CD GLU A 35 8.061 -22.658 11.664 1.00 26.08 C ATOM 437 OE1 GLU A 35 7.664 -21.474 11.805 1.00 29.61 O ATOM 438 OE2 GLU A 35 8.243 -23.436 12.617 1.00 27.16 O ATOM 439 HA GLU A 35 8.638 -22.897 7.662 1.00 0.00 H ATOM 440 HB2 GLU A 35 10.365 -22.563 10.085 1.00 0.00 H ATOM 441 HB3 GLU A 35 9.171 -21.284 9.767 1.00 0.00 H ATOM 442 HG2 GLU A 35 7.439 -23.109 9.671 1.00 0.00 H ATOM 443 HG3 GLU A 35 8.688 -24.196 10.321 1.00 0.00 H ATOM 444 H GLU A 35 11.211 -23.918 8.574 1.00 0.00 H ATOM 445 N ARG A 36 8.940 -20.421 7.141 1.00 22.45 N ATOM 446 CA ARG A 36 9.164 -19.093 6.572 1.00 23.20 C ATOM 447 C ARG A 36 9.729 -18.155 7.644 1.00 23.72 C ATOM 448 O ARG A 36 9.110 -17.966 8.697 1.00 24.09 O ATOM 449 CB ARG A 36 7.869 -18.516 5.987 1.00 23.57 C ATOM 450 CG ARG A 36 8.088 -17.315 5.073 1.00 24.84 C ATOM 451 CD ARG A 36 6.772 -16.737 4.556 1.00 26.24 C ATOM 452 NE ARG A 36 6.995 -15.708 3.537 1.00 28.05 N ATOM 453 CZ ARG A 36 7.161 -15.934 2.232 1.00 29.02 C ATOM 454 NH1 ARG A 36 7.128 -17.170 1.733 1.00 29.96 N ATOM 455 NH2 ARG A 36 7.363 -14.906 1.407 1.00 29.98 N ATOM 456 HA ARG A 36 9.886 -19.185 5.760 1.00 0.00 H ATOM 457 HB2 ARG A 36 7.372 -19.299 5.414 1.00 0.00 H ATOM 458 HB3 ARG A 36 7.226 -18.208 6.812 1.00 0.00 H ATOM 459 HG2 ARG A 36 8.617 -16.541 5.630 1.00 0.00 H ATOM 460 HG3 ARG A 36 8.693 -17.627 4.222 1.00 0.00 H ATOM 461 HD2 ARG A 36 6.228 -16.296 5.391 1.00 0.00 H ATOM 462 HD3 ARG A 36 6.179 -17.542 4.122 1.00 0.00 H ATOM 463 HE ARG A 36 7.027 -14.719 3.857 1.00 0.00 H ATOM 464 HH12 ARG A 36 7.260 -17.323 0.713 1.00 0.00 H ATOM 465 HH11 ARG A 36 6.970 -17.982 2.364 1.00 0.00 H ATOM 466 HH22 ARG A 36 7.493 -15.074 0.389 1.00 0.00 H ATOM 467 HH21 ARG A 36 7.390 -13.936 1.782 1.00 0.00 H ATOM 468 H ARG A 36 7.965 -20.748 7.293 1.00 0.00 H ATOM 469 N PRO A 37 10.919 -17.582 7.391 1.00 23.99 N ATOM 470 CA PRO A 37 11.546 -16.687 8.362 1.00 24.35 C ATOM 471 C PRO A 37 10.848 -15.325 8.469 1.00 24.73 C ATOM 472 O PRO A 37 10.223 -14.869 7.511 1.00 25.53 O ATOM 473 CB PRO A 37 12.968 -16.531 7.812 1.00 24.31 C ATOM 474 CG PRO A 37 12.822 -16.702 6.366 1.00 24.07 C ATOM 475 CD PRO A 37 11.736 -17.713 6.170 1.00 23.85 C ATOM 476 HA PRO A 37 11.499 -17.088 9.375 1.00 0.00 H ATOM 477 HD3 PRO A 37 11.148 -17.486 5.281 1.00 0.00 H ATOM 478 HD2 PRO A 37 12.150 -18.718 6.084 1.00 0.00 H ATOM 479 HG3 PRO A 37 13.755 -17.061 5.932 1.00 0.00 H ATOM 480 HG2 PRO A 37 12.546 -15.756 5.900 1.00 0.00 H ATOM 481 HB2 PRO A 37 13.366 -15.543 8.045 1.00 0.00 H ATOM 482 HB3 PRO A 37 13.627 -17.294 8.226 1.00 0.00 H TER 483 PRO A 37 ATOM 484 N GLU A 51 18.939 -4.366 12.345 1.00 27.23 N ATOM 485 CA GLU A 51 20.177 -5.097 12.747 1.00 26.86 C ATOM 486 C GLU A 51 20.661 -4.644 14.125 1.00 26.60 C ATOM 487 O GLU A 51 20.723 -3.444 14.393 1.00 27.13 O ATOM 488 CB GLU A 51 21.280 -4.857 11.716 1.00 26.99 C ATOM 489 CG GLU A 51 22.610 -5.527 12.038 1.00 27.32 C ATOM 490 CD GLU A 51 23.663 -5.242 10.992 1.00 27.77 C ATOM 491 OE1 GLU A 51 23.561 -5.806 9.884 1.00 28.69 O ATOM 492 OE2 GLU A 51 24.601 -4.466 11.277 1.00 27.54 O ATOM 493 HA GLU A 51 19.942 -6.160 12.795 1.00 0.00 H ATOM 494 HB2 GLU A 51 20.934 -5.234 10.754 1.00 0.00 H ATOM 495 HB3 GLU A 51 21.450 -3.783 11.644 1.00 0.00 H ATOM 496 HG2 GLU A 51 22.964 -5.160 13.001 1.00 0.00 H ATOM 497 HG3 GLU A 51 22.455 -6.604 12.096 1.00 0.00 H ATOM 498 HN3 GLU A 51 19.136 -3.346 12.310 1.00 0.00 H ATOM 499 HN2 GLU A 51 18.187 -4.551 13.040 1.00 0.00 H ATOM 500 HN1 GLU A 51 18.634 -4.694 11.406 1.00 0.00 H ATOM 501 N PRO A 52 21.032 -5.600 14.999 1.00 26.05 N ATOM 502 CA PRO A 52 21.529 -5.217 16.323 1.00 25.68 C ATOM 503 C PRO A 52 22.918 -4.559 16.295 1.00 25.16 C ATOM 504 O PRO A 52 23.750 -4.903 15.456 1.00 25.64 O ATOM 505 CB PRO A 52 21.571 -6.549 17.082 1.00 25.64 C ATOM 506 CG PRO A 52 21.692 -7.584 16.039 1.00 26.01 C ATOM 507 CD PRO A 52 20.976 -7.065 14.833 1.00 26.09 C ATOM 508 HA PRO A 52 20.892 -4.461 16.783 1.00 0.00 H ATOM 509 HD3 PRO A 52 21.481 -7.373 13.918 1.00 0.00 H ATOM 510 HD2 PRO A 52 19.944 -7.415 14.812 1.00 0.00 H ATOM 511 HG3 PRO A 52 21.234 -8.514 16.377 1.00 0.00 H ATOM 512 HG2 PRO A 52 22.742 -7.761 15.806 1.00 0.00 H ATOM 513 HB2 PRO A 52 22.429 -6.580 17.753 1.00 0.00 H ATOM 514 HB3 PRO A 52 20.656 -6.691 17.657 1.00 0.00 H ATOM 515 N ALA A 53 23.149 -3.616 17.209 1.00 24.57 N ATOM 516 CA ALA A 53 24.429 -2.901 17.308 1.00 23.98 C ATOM 517 C ALA A 53 25.565 -3.790 17.808 1.00 23.31 C ATOM 518 O ALA A 53 26.725 -3.622 17.412 1.00 23.50 O ATOM 519 CB ALA A 53 24.277 -1.692 18.225 1.00 24.09 C ATOM 520 HA ALA A 53 24.694 -2.578 16.301 1.00 0.00 H ATOM 521 HB1 ALA A 53 23.520 -1.022 17.818 1.00 0.00 H ATOM 522 HB2 ALA A 53 23.973 -2.026 19.217 1.00 0.00 H ATOM 523 HB3 ALA A 53 25.230 -1.167 18.293 1.00 0.00 H ATOM 524 H ALA A 53 22.391 -3.376 17.880 1.00 0.00 H ATOM 525 N ARG A 54 25.226 -4.712 18.707 1.00 22.57 N ATOM 526 CA ARG A 54 26.176 -5.689 19.231 1.00 22.02 C ATOM 527 C ARG A 54 25.523 -7.067 19.253 1.00 20.94 C ATOM 528 O ARG A 54 24.308 -7.180 19.436 1.00 21.16 O ATOM 529 CB ARG A 54 26.642 -5.306 20.644 1.00 22.32 C ATOM 530 CG ARG A 54 27.624 -4.138 20.675 1.00 23.70 C ATOM 531 CD ARG A 54 27.953 -3.698 22.094 1.00 25.16 C ATOM 532 NE ARG A 54 28.769 -4.664 22.834 1.00 26.87 N ATOM 533 CZ ARG A 54 30.096 -4.783 22.746 1.00 27.83 C ATOM 534 NH1 ARG A 54 30.727 -5.691 23.485 1.00 28.54 N ATOM 535 NH2 ARG A 54 30.805 -4.011 21.927 1.00 29.22 N ATOM 536 HA ARG A 54 27.051 -5.706 18.582 1.00 0.00 H ATOM 537 HB2 ARG A 54 25.766 -5.034 21.233 1.00 0.00 H ATOM 538 HB3 ARG A 54 27.125 -6.173 21.093 1.00 0.00 H ATOM 539 HG2 ARG A 54 28.546 -4.441 20.179 1.00 0.00 H ATOM 540 HG3 ARG A 54 27.185 -3.296 20.139 1.00 0.00 H ATOM 541 HD2 ARG A 54 27.018 -3.551 22.635 1.00 0.00 H ATOM 542 HD3 ARG A 54 28.496 -2.754 22.045 1.00 0.00 H ATOM 543 HE ARG A 54 28.274 -5.310 23.481 1.00 0.00 H ATOM 544 HH12 ARG A 54 31.760 -5.787 23.420 1.00 0.00 H ATOM 545 HH11 ARG A 54 30.187 -6.305 24.128 1.00 0.00 H ATOM 546 HH22 ARG A 54 31.838 -4.120 21.874 1.00 0.00 H ATOM 547 HH21 ARG A 54 30.326 -3.298 21.340 1.00 0.00 H ATOM 548 H ARG A 54 24.244 -4.737 19.050 1.00 0.00 H ATOM 549 N VAL A 55 26.338 -8.097 19.029 1.00 19.86 N ATOM 550 CA VAL A 55 25.919 -9.490 19.203 1.00 18.96 C ATOM 551 C VAL A 55 26.983 -10.269 19.970 1.00 18.19 C ATOM 552 O VAL A 55 28.156 -9.891 19.999 1.00 18.54 O ATOM 553 CB VAL A 55 25.648 -10.196 17.843 1.00 18.93 C ATOM 554 CG1 VAL A 55 24.554 -9.470 17.067 1.00 18.95 C ATOM 555 CG2 VAL A 55 26.919 -10.302 17.022 1.00 19.06 C ATOM 556 HA VAL A 55 24.987 -9.474 19.767 1.00 0.00 H ATOM 557 HB VAL A 55 25.301 -11.208 18.050 1.00 0.00 H ATOM 558 HG11 VAL A 55 23.635 -9.468 17.653 1.00 0.00 H ATOM 559 HG12 VAL A 55 24.866 -8.443 16.876 1.00 0.00 H ATOM 560 HG13 VAL A 55 24.382 -9.981 16.120 1.00 0.00 H ATOM 561 HG21 VAL A 55 27.308 -9.303 16.826 1.00 0.00 H ATOM 562 HG22 VAL A 55 27.660 -10.880 17.575 1.00 0.00 H ATOM 563 HG23 VAL A 55 26.699 -10.799 16.077 1.00 0.00 H ATOM 564 H VAL A 55 27.311 -7.904 18.718 1.00 0.00 H ATOM 565 N ARG A 56 26.551 -11.351 20.610 1.00 17.01 N ATOM 566 CA ARG A 56 27.450 -12.301 21.235 1.00 16.59 C ATOM 567 C ARG A 56 27.318 -13.596 20.454 1.00 15.79 C ATOM 568 O ARG A 56 26.201 -14.027 20.151 1.00 16.25 O ATOM 569 CB ARG A 56 27.074 -12.538 22.694 1.00 16.63 C ATOM 570 CG ARG A 56 28.047 -13.429 23.437 1.00 17.20 C ATOM 571 CD ARG A 56 27.636 -13.611 24.888 1.00 18.65 C ATOM 572 NE ARG A 56 28.573 -14.447 25.635 1.00 20.08 N ATOM 573 CZ ARG A 56 28.456 -14.725 26.934 1.00 22.33 C ATOM 574 NH1 ARG A 56 27.435 -14.242 27.637 1.00 23.65 N ATOM 575 NH2 ARG A 56 29.352 -15.498 27.540 1.00 23.35 N ATOM 576 HA ARG A 56 28.472 -11.923 21.223 1.00 0.00 H ATOM 577 HB2 ARG A 56 27.035 -11.574 23.200 1.00 0.00 H ATOM 578 HB3 ARG A 56 26.089 -13.003 22.724 1.00 0.00 H ATOM 579 HG2 ARG A 56 28.077 -14.404 22.952 1.00 0.00 H ATOM 580 HG3 ARG A 56 29.039 -12.978 23.403 1.00 0.00 H ATOM 581 HD2 ARG A 56 26.651 -14.078 24.917 1.00 0.00 H ATOM 582 HD3 ARG A 56 27.586 -12.631 25.363 1.00 0.00 H ATOM 583 HE ARG A 56 29.382 -14.851 25.121 1.00 0.00 H ATOM 584 HH12 ARG A 56 27.350 -14.463 28.650 1.00 0.00 H ATOM 585 HH11 ARG A 56 26.722 -13.643 27.174 1.00 0.00 H ATOM 586 HH22 ARG A 56 29.255 -15.711 28.553 1.00 0.00 H ATOM 587 HH21 ARG A 56 30.150 -15.890 27.001 1.00 0.00 H ATOM 588 H ARG A 56 25.527 -11.523 20.665 1.00 0.00 H ATOM 589 N CYS A 57 28.453 -14.199 20.115 1.00 15.32 N ATOM 590 CA CYS A 57 28.446 -15.445 19.367 1.00 14.78 C ATOM 591 C CYS A 57 29.445 -16.434 19.912 1.00 14.20 C ATOM 592 O CYS A 57 30.459 -16.070 20.520 1.00 14.24 O ATOM 593 CB CYS A 57 28.764 -15.198 17.890 1.00 15.14 C ATOM 594 SG CYS A 57 27.501 -14.306 16.980 1.00 15.90 S ATOM 595 HA CYS A 57 27.443 -15.861 19.469 1.00 0.00 H ATOM 596 HB2 CYS A 57 28.908 -16.165 17.409 1.00 0.00 H ATOM 597 HB3 CYS A 57 29.689 -14.625 17.835 1.00 0.00 H ATOM 598 HG CYS A 57 27.905 -14.149 15.670 1.00 0.00 H ATOM 599 H CYS A 57 29.361 -13.772 20.389 1.00 0.00 H ATOM 600 N SER A 58 29.136 -17.704 19.667 1.00 13.40 N ATOM 601 CA SER A 58 30.082 -18.781 19.818 1.00 13.18 C ATOM 602 C SER A 58 30.370 -19.344 18.436 1.00 12.74 C ATOM 603 O SER A 58 29.589 -19.151 17.503 1.00 12.79 O ATOM 604 CB SER A 58 29.507 -19.877 20.711 1.00 13.12 C ATOM 605 OG SER A 58 29.236 -19.376 22.007 1.00 14.01 O ATOM 606 HA SER A 58 30.996 -18.411 20.283 1.00 0.00 H ATOM 607 HB2 SER A 58 30.227 -20.692 20.786 1.00 0.00 H ATOM 608 HB3 SER A 58 28.582 -20.249 20.270 1.00 0.00 H ATOM 609 HG SER A 58 28.865 -20.101 22.569 1.00 0.00 H ATOM 610 H SER A 58 28.171 -17.930 19.353 1.00 0.00 H ATOM 611 N HIS A 59 31.490 -20.037 18.298 1.00 12.80 N ATOM 612 CA HIS A 59 31.774 -20.731 17.054 1.00 12.48 C ATOM 613 C HIS A 59 32.497 -22.040 17.264 1.00 11.84 C ATOM 614 O HIS A 59 33.082 -22.292 18.323 1.00 12.33 O ATOM 615 CB HIS A 59 32.504 -19.826 16.050 1.00 12.54 C ATOM 616 CG HIS A 59 33.982 -19.709 16.264 1.00 13.15 C ATOM 617 ND1 HIS A 59 34.867 -19.632 15.210 1.00 14.14 N ATOM 618 CD2 HIS A 59 34.728 -19.625 17.391 1.00 14.45 C ATOM 619 CE1 HIS A 59 36.096 -19.509 15.679 1.00 14.65 C ATOM 620 NE2 HIS A 59 36.040 -19.504 16.999 1.00 14.07 N ATOM 621 HA HIS A 59 30.808 -20.986 16.618 1.00 0.00 H ATOM 622 HB2 HIS A 59 32.337 -20.226 15.050 1.00 0.00 H ATOM 623 HB3 HIS A 59 32.072 -18.828 16.117 1.00 0.00 H ATOM 624 HD2 HIS A 59 34.358 -19.649 18.416 1.00 0.00 H ATOM 625 HE1 HIS A 59 37.002 -19.426 15.079 1.00 0.00 H ATOM 626 H HIS A 59 32.169 -20.085 19.084 1.00 0.00 H ATOM 627 N LEU A 60 32.417 -22.872 16.240 1.00 11.48 N ATOM 628 CA LEU A 60 33.185 -24.093 16.134 1.00 11.94 C ATOM 629 C LEU A 60 33.937 -23.958 14.814 1.00 11.85 C ATOM 630 O LEU A 60 33.326 -23.838 13.750 1.00 12.49 O ATOM 631 CB LEU A 60 32.254 -25.304 16.113 1.00 12.05 C ATOM 632 CG LEU A 60 32.862 -26.712 16.177 1.00 11.75 C ATOM 633 CD1 LEU A 60 31.779 -27.751 16.493 1.00 12.87 C ATOM 634 CD2 LEU A 60 33.588 -27.086 14.895 1.00 13.13 C ATOM 635 HA LEU A 60 33.861 -24.239 16.976 1.00 0.00 H ATOM 636 HB2 LEU A 60 31.583 -25.206 16.967 1.00 0.00 H ATOM 637 HB3 LEU A 60 31.676 -25.247 15.190 1.00 0.00 H ATOM 638 HG LEU A 60 33.600 -26.705 16.979 1.00 0.00 H ATOM 639 HD21 LEU A 60 32.887 -27.058 14.061 1.00 0.00 H ATOM 640 HD22 LEU A 60 34.396 -26.377 14.716 1.00 0.00 H ATOM 641 HD23 LEU A 60 34.000 -28.091 14.992 1.00 0.00 H ATOM 642 HD11 LEU A 60 31.323 -27.518 17.455 1.00 0.00 H ATOM 643 HD12 LEU A 60 31.017 -27.729 15.714 1.00 0.00 H ATOM 644 HD13 LEU A 60 32.230 -28.743 16.534 1.00 0.00 H ATOM 645 H LEU A 60 31.764 -22.635 15.466 1.00 0.00 H ATOM 646 N LEU A 61 35.264 -23.948 14.893 1.00 11.88 N ATOM 647 CA LEU A 61 36.119 -23.793 13.719 1.00 12.34 C ATOM 648 C LEU A 61 36.755 -25.123 13.358 1.00 12.29 C ATOM 649 O LEU A 61 37.306 -25.794 14.218 1.00 12.56 O ATOM 650 CB LEU A 61 37.221 -22.776 14.019 1.00 12.33 C ATOM 651 CG LEU A 61 38.310 -22.526 12.960 1.00 12.64 C ATOM 652 CD1 LEU A 61 37.718 -22.036 11.636 1.00 14.79 C ATOM 653 CD2 LEU A 61 39.323 -21.537 13.502 1.00 14.09 C ATOM 654 HA LEU A 61 35.511 -23.445 12.884 1.00 0.00 H ATOM 655 HB2 LEU A 61 36.732 -21.820 14.208 1.00 0.00 H ATOM 656 HB3 LEU A 61 37.726 -23.109 14.926 1.00 0.00 H ATOM 657 HG LEU A 61 38.808 -23.473 12.749 1.00 0.00 H ATOM 658 HD21 LEU A 61 38.822 -20.598 13.738 1.00 0.00 H ATOM 659 HD22 LEU A 61 39.779 -21.944 14.405 1.00 0.00 H ATOM 660 HD23 LEU A 61 40.094 -21.360 12.752 1.00 0.00 H ATOM 661 HD11 LEU A 61 37.029 -22.786 11.248 1.00 0.00 H ATOM 662 HD12 LEU A 61 37.183 -21.101 11.803 1.00 0.00 H ATOM 663 HD13 LEU A 61 38.522 -21.873 10.918 1.00 0.00 H ATOM 664 H LEU A 61 35.710 -24.055 15.826 1.00 0.00 H ATOM 665 N VAL A 62 36.685 -25.496 12.080 1.00 12.61 N ATOM 666 CA VAL A 62 37.464 -26.612 11.552 1.00 12.65 C ATOM 667 C VAL A 62 38.456 -26.025 10.550 1.00 13.14 C ATOM 668 O VAL A 62 38.069 -25.458 9.530 1.00 13.24 O ATOM 669 CB VAL A 62 36.589 -27.716 10.907 1.00 12.29 C ATOM 670 CG1 VAL A 62 37.456 -28.851 10.351 1.00 13.42 C ATOM 671 CG2 VAL A 62 35.613 -28.276 11.929 1.00 12.42 C ATOM 672 HA VAL A 62 37.981 -27.114 12.370 1.00 0.00 H ATOM 673 HB VAL A 62 36.035 -27.266 10.083 1.00 0.00 H ATOM 674 HG11 VAL A 62 38.131 -28.453 9.594 1.00 0.00 H ATOM 675 HG12 VAL A 62 38.036 -29.293 11.161 1.00 0.00 H ATOM 676 HG13 VAL A 62 36.815 -29.611 9.905 1.00 0.00 H ATOM 677 HG21 VAL A 62 36.168 -28.703 12.764 1.00 0.00 H ATOM 678 HG22 VAL A 62 34.968 -27.475 12.291 1.00 0.00 H ATOM 679 HG23 VAL A 62 35.005 -29.051 11.462 1.00 0.00 H ATOM 680 H VAL A 62 36.055 -24.975 11.438 1.00 0.00 H ATOM 681 N LYS A 63 39.739 -26.137 10.874 1.00 14.06 N ATOM 682 CA LYS A 63 40.784 -25.638 9.989 1.00 14.39 C ATOM 683 C LYS A 63 41.141 -26.677 8.933 1.00 14.79 C ATOM 684 O LYS A 63 40.762 -27.845 9.032 1.00 14.57 O ATOM 685 CB LYS A 63 42.020 -25.228 10.796 1.00 14.49 C ATOM 686 CG LYS A 63 41.808 -23.977 11.631 1.00 14.20 C ATOM 687 CD LYS A 63 43.116 -23.492 12.269 1.00 15.29 C ATOM 688 CE LYS A 63 42.936 -22.168 12.995 1.00 15.64 C ATOM 689 NZ LYS A 63 44.239 -21.588 13.457 1.00 17.00 N ATOM 690 HA LYS A 63 40.406 -24.755 9.474 1.00 0.00 H ATOM 691 HB2 LYS A 63 42.285 -26.048 11.463 1.00 0.00 H ATOM 692 HB3 LYS A 63 42.841 -25.046 10.102 1.00 0.00 H ATOM 693 HG2 LYS A 63 41.413 -23.188 10.991 1.00 0.00 H ATOM 694 HG3 LYS A 63 41.090 -24.197 12.421 1.00 0.00 H ATOM 695 HD2 LYS A 63 43.460 -24.241 12.982 1.00 0.00 H ATOM 696 HD3 LYS A 63 43.865 -23.366 11.487 1.00 0.00 H ATOM 697 HE2 LYS A 63 42.297 -22.328 13.863 1.00 0.00 H ATOM 698 HE3 LYS A 63 42.457 -21.460 12.319 1.00 0.00 H ATOM 699 HZ1 LYS A 63 44.701 -22.253 14.110 1.00 0.00 H ATOM 700 HZ2 LYS A 63 44.855 -21.423 12.635 1.00 0.00 H ATOM 701 HZ3 LYS A 63 44.062 -20.687 13.945 1.00 0.00 H ATOM 702 H LYS A 63 40.002 -26.588 11.773 1.00 0.00 H ATOM 703 N HIS A 64 41.871 -26.236 7.912 1.00 15.55 N ATOM 704 CA HIS A 64 42.337 -27.126 6.858 1.00 16.24 C ATOM 705 C HIS A 64 43.717 -26.679 6.390 1.00 16.76 C ATOM 706 O HIS A 64 44.243 -25.664 6.857 1.00 16.73 O ATOM 707 CB HIS A 64 41.332 -27.166 5.690 1.00 16.10 C ATOM 708 CG HIS A 64 40.930 -25.818 5.180 1.00 16.97 C ATOM 709 ND1 HIS A 64 41.742 -25.050 4.372 1.00 18.29 N ATOM 710 CD2 HIS A 64 39.792 -25.104 5.355 1.00 17.57 C ATOM 711 CE1 HIS A 64 41.123 -23.920 4.077 1.00 18.77 C ATOM 712 NE2 HIS A 64 39.940 -23.927 4.664 1.00 18.58 N ATOM 713 HA HIS A 64 42.414 -28.140 7.251 1.00 0.00 H ATOM 714 HB2 HIS A 64 41.784 -27.722 4.869 1.00 0.00 H ATOM 715 HB3 HIS A 64 40.435 -27.685 6.028 1.00 0.00 H ATOM 716 HD2 HIS A 64 38.921 -25.407 5.936 1.00 0.00 H ATOM 717 HE1 HIS A 64 41.521 -23.118 3.455 1.00 0.00 H ATOM 718 H HIS A 64 42.116 -25.226 7.865 1.00 0.00 H ATOM 719 N SER A 65 44.304 -27.439 5.473 1.00 17.50 N ATOM 720 CA SER A 65 45.675 -27.168 5.027 1.00 18.03 C ATOM 721 C SER A 65 45.883 -25.785 4.384 1.00 18.23 C ATOM 722 O SER A 65 47.014 -25.292 4.341 1.00 19.11 O ATOM 723 CB SER A 65 46.154 -28.273 4.079 1.00 18.45 C ATOM 724 OG SER A 65 45.433 -28.265 2.863 1.00 20.36 O ATOM 725 HA SER A 65 46.279 -27.159 5.935 1.00 0.00 H ATOM 726 HB2 SER A 65 46.018 -29.239 4.565 1.00 0.00 H ATOM 727 HB3 SER A 65 47.212 -28.121 3.864 1.00 0.00 H ATOM 728 HG SER A 65 44.471 -28.408 3.050 1.00 0.00 H ATOM 729 H SER A 65 43.783 -28.240 5.064 1.00 0.00 H ATOM 730 N GLN A 66 44.816 -25.163 3.882 1.00 18.16 N ATOM 731 CA GLN A 66 44.907 -23.814 3.309 1.00 18.53 C ATOM 732 C GLN A 66 44.488 -22.698 4.280 1.00 18.47 C ATOM 733 O GLN A 66 44.443 -21.525 3.901 1.00 19.12 O ATOM 734 CB GLN A 66 44.114 -23.729 1.993 1.00 18.78 C ATOM 735 CG GLN A 66 44.814 -24.427 0.826 1.00 19.78 C ATOM 736 CD GLN A 66 44.362 -23.944 -0.554 1.00 21.04 C ATOM 737 OE1 GLN A 66 43.682 -22.926 -0.689 1.00 21.85 O ATOM 738 NE2 GLN A 66 44.775 -24.673 -1.591 1.00 22.00 N ATOM 739 HA GLN A 66 45.963 -23.643 3.102 1.00 0.00 H ATOM 740 HB2 GLN A 66 43.140 -24.195 2.143 1.00 0.00 H ATOM 741 HB3 GLN A 66 43.977 -22.678 1.737 1.00 0.00 H ATOM 742 HG2 GLN A 66 45.886 -24.252 0.916 1.00 0.00 H ATOM 743 HG3 GLN A 66 44.614 -25.496 0.897 1.00 0.00 H ATOM 744 HE22 GLN A 66 45.348 -25.526 -1.432 1.00 0.00 H ATOM 745 HE21 GLN A 66 44.524 -24.389 -2.559 1.00 0.00 H ATOM 746 H GLN A 66 43.895 -25.646 3.897 1.00 0.00 H ATOM 747 N SER A 67 44.207 -23.052 5.537 1.00 18.28 N ATOM 748 CA SER A 67 43.943 -22.050 6.570 1.00 18.39 C ATOM 749 C SER A 67 45.152 -21.139 6.717 1.00 18.78 C ATOM 750 O SER A 67 46.286 -21.590 6.562 1.00 19.74 O ATOM 751 CB SER A 67 43.669 -22.714 7.922 1.00 18.07 C ATOM 752 OG SER A 67 42.409 -23.370 7.948 1.00 17.16 O ATOM 753 HA SER A 67 43.066 -21.478 6.268 1.00 0.00 H ATOM 754 HB2 SER A 67 43.684 -21.950 8.699 1.00 0.00 H ATOM 755 HB3 SER A 67 44.452 -23.447 8.119 1.00 0.00 H ATOM 756 HG SER A 67 41.691 -22.710 7.776 1.00 0.00 H ATOM 757 H SER A 67 44.175 -24.061 5.787 1.00 0.00 H ATOM 758 N ARG A 68 44.912 -19.870 7.023 1.00 19.26 N ATOM 759 CA ARG A 68 46.011 -18.908 7.153 1.00 19.76 C ATOM 760 C ARG A 68 46.997 -19.336 8.247 1.00 20.36 C ATOM 761 O ARG A 68 48.200 -19.123 8.112 1.00 21.04 O ATOM 762 CB ARG A 68 45.485 -17.488 7.379 1.00 19.96 C ATOM 763 CG ARG A 68 44.760 -17.259 8.686 1.00 19.98 C ATOM 764 CD ARG A 68 44.172 -15.870 8.751 1.00 20.57 C ATOM 765 NE ARG A 68 43.680 -15.559 10.091 1.00 21.05 N ATOM 766 CZ ARG A 68 43.153 -14.394 10.461 1.00 21.46 C ATOM 767 NH1 ARG A 68 42.748 -14.231 11.715 1.00 22.01 N ATOM 768 NH2 ARG A 68 43.030 -13.392 9.596 1.00 22.18 N ATOM 769 HA ARG A 68 46.560 -18.899 6.211 1.00 0.00 H ATOM 770 HB2 ARG A 68 46.334 -16.806 7.343 1.00 0.00 H ATOM 771 HB3 ARG A 68 44.796 -17.252 6.568 1.00 0.00 H ATOM 772 HG2 ARG A 68 43.957 -17.990 8.780 1.00 0.00 H ATOM 773 HG3 ARG A 68 45.463 -17.386 9.509 1.00 0.00 H ATOM 774 HD2 ARG A 68 43.344 -15.802 8.045 1.00 0.00 H ATOM 775 HD3 ARG A 68 44.941 -15.147 8.479 1.00 0.00 H ATOM 776 HE ARG A 68 43.747 -16.306 10.812 1.00 0.00 H ATOM 777 HH12 ARG A 68 42.335 -13.325 12.014 1.00 0.00 H ATOM 778 HH11 ARG A 68 42.844 -15.010 12.398 1.00 0.00 H ATOM 779 HH22 ARG A 68 42.616 -12.489 9.902 1.00 0.00 H ATOM 780 HH21 ARG A 68 43.348 -13.512 8.613 1.00 0.00 H ATOM 781 H ARG A 68 43.932 -19.554 7.172 1.00 0.00 H ATOM 782 N ARG A 69 46.483 -19.951 9.310 1.00 20.71 N ATOM 783 CA ARG A 69 47.298 -20.537 10.372 1.00 20.82 C ATOM 784 C ARG A 69 46.925 -22.018 10.555 1.00 20.44 C ATOM 785 O ARG A 69 46.079 -22.331 11.390 1.00 20.02 O ATOM 786 CB ARG A 69 47.040 -19.805 11.691 1.00 21.61 C ATOM 787 CG ARG A 69 47.699 -18.443 11.859 1.00 23.68 C ATOM 788 CD ARG A 69 47.667 -18.006 13.336 1.00 26.24 C ATOM 789 NE ARG A 69 47.773 -19.156 14.243 1.00 28.15 N ATOM 790 CZ ARG A 69 46.913 -19.475 15.218 1.00 29.15 C ATOM 791 NH1 ARG A 69 47.136 -20.568 15.946 1.00 30.39 N ATOM 792 NH2 ARG A 69 45.848 -18.720 15.501 1.00 29.71 N ATOM 793 HA ARG A 69 48.349 -20.446 10.096 1.00 0.00 H ATOM 794 HB2 ARG A 69 45.963 -19.665 11.786 1.00 0.00 H ATOM 795 HB3 ARG A 69 47.394 -20.445 12.499 1.00 0.00 H ATOM 796 HG2 ARG A 69 48.735 -18.502 11.524 1.00 0.00 H ATOM 797 HG3 ARG A 69 47.165 -17.709 11.256 1.00 0.00 H ATOM 798 HD2 ARG A 69 46.729 -17.487 13.531 1.00 0.00 H ATOM 799 HD3 ARG A 69 48.501 -17.330 13.523 1.00 0.00 H ATOM 800 HE ARG A 69 48.594 -19.782 14.116 1.00 0.00 H ATOM 801 HH12 ARG A 69 46.477 -20.829 16.707 1.00 0.00 H ATOM 802 HH11 ARG A 69 47.969 -21.160 15.753 1.00 0.00 H ATOM 803 HH22 ARG A 69 45.201 -18.999 16.266 1.00 0.00 H ATOM 804 HH21 ARG A 69 45.666 -17.853 14.956 1.00 0.00 H ATOM 805 H ARG A 69 45.448 -20.018 9.389 1.00 0.00 H ATOM 806 N PRO A 70 47.545 -22.934 9.786 1.00 20.09 N ATOM 807 CA PRO A 70 47.177 -24.358 9.789 1.00 19.99 C ATOM 808 C PRO A 70 47.699 -25.117 11.013 1.00 19.84 C ATOM 809 O PRO A 70 48.416 -26.121 10.889 1.00 19.26 O ATOM 810 CB PRO A 70 47.801 -24.876 8.490 1.00 20.31 C ATOM 811 CG PRO A 70 48.995 -24.014 8.306 1.00 20.05 C ATOM 812 CD PRO A 70 48.634 -22.657 8.828 1.00 20.31 C ATOM 813 HA PRO A 70 46.098 -24.503 9.844 1.00 0.00 H ATOM 814 HD3 PRO A 70 49.484 -22.193 9.328 1.00 0.00 H ATOM 815 HD2 PRO A 70 48.289 -22.009 8.023 1.00 0.00 H ATOM 816 HG3 PRO A 70 49.255 -23.953 7.249 1.00 0.00 H ATOM 817 HG2 PRO A 70 49.840 -24.418 8.864 1.00 0.00 H ATOM 818 HB2 PRO A 70 48.088 -25.923 8.587 1.00 0.00 H ATOM 819 HB3 PRO A 70 47.109 -24.766 7.655 1.00 0.00 H ATOM 820 N SER A 71 47.300 -24.632 12.183 1.00 19.53 N ATOM 821 CA SER A 71 47.728 -25.176 13.460 1.00 19.72 C ATOM 822 C SER A 71 46.685 -24.812 14.513 1.00 19.15 C ATOM 823 O SER A 71 46.042 -23.770 14.413 1.00 19.22 O ATOM 824 CB SER A 71 49.082 -24.576 13.841 1.00 19.85 C ATOM 825 OG SER A 71 49.642 -25.226 14.965 1.00 22.15 O ATOM 826 HA SER A 71 47.828 -26.259 13.395 1.00 0.00 H ATOM 827 HB2 SER A 71 48.948 -23.519 14.073 1.00 0.00 H ATOM 828 HB3 SER A 71 49.764 -24.678 12.997 1.00 0.00 H ATOM 829 HG SER A 71 49.772 -26.186 14.759 1.00 0.00 H ATOM 830 H SER A 71 46.648 -23.822 12.185 1.00 0.00 H ATOM 831 N SER A 72 46.525 -25.673 15.514 1.00 18.69 N ATOM 832 CA SER A 72 45.632 -25.385 16.643 1.00 18.41 C ATOM 833 C SER A 72 46.056 -26.172 17.865 1.00 18.57 C ATOM 834 O SER A 72 46.969 -26.995 17.797 1.00 18.48 O ATOM 835 CB SER A 72 44.183 -25.755 16.299 1.00 18.27 C ATOM 836 OG SER A 72 44.001 -27.161 16.313 1.00 17.38 O ATOM 837 HA SER A 72 45.694 -24.317 16.851 1.00 0.00 H ATOM 838 HB2 SER A 72 43.944 -25.374 15.306 1.00 0.00 H ATOM 839 HB3 SER A 72 43.515 -25.301 17.032 1.00 0.00 H ATOM 840 HG SER A 72 43.060 -27.373 16.089 1.00 0.00 H ATOM 841 H SER A 72 47.046 -26.573 15.496 1.00 0.00 H ATOM 842 N TRP A 73 45.365 -25.947 18.979 1.00 18.51 N ATOM 843 CA TRP A 73 45.593 -26.743 20.187 1.00 18.75 C ATOM 844 C TRP A 73 45.350 -28.238 19.974 1.00 18.78 C ATOM 845 O TRP A 73 45.879 -29.062 20.709 1.00 19.16 O ATOM 846 CB TRP A 73 44.715 -26.240 21.343 1.00 18.65 C ATOM 847 CG TRP A 73 43.242 -26.498 21.161 1.00 18.86 C ATOM 848 CD1 TRP A 73 42.345 -25.694 20.528 1.00 18.45 C ATOM 849 CD2 TRP A 73 42.507 -27.637 21.625 1.00 18.65 C ATOM 850 NE1 TRP A 73 41.093 -26.259 20.568 1.00 17.89 N ATOM 851 CE2 TRP A 73 41.166 -27.457 21.227 1.00 18.29 C ATOM 852 CE3 TRP A 73 42.855 -28.803 22.322 1.00 18.91 C ATOM 853 CZ2 TRP A 73 40.165 -28.389 21.525 1.00 18.59 C ATOM 854 CZ3 TRP A 73 41.870 -29.730 22.609 1.00 19.67 C ATOM 855 CH2 TRP A 73 40.535 -29.519 22.202 1.00 18.23 C ATOM 856 HA TRP A 73 46.646 -26.616 20.439 1.00 0.00 H ATOM 857 HB2 TRP A 73 45.038 -26.736 22.258 1.00 0.00 H ATOM 858 HB3 TRP A 73 44.864 -25.165 21.442 1.00 0.00 H ATOM 859 HE1 TRP A 73 40.230 -25.844 20.163 1.00 0.00 H ATOM 860 HD1 TRP A 73 42.585 -24.740 20.058 1.00 0.00 H ATOM 861 HZ2 TRP A 73 39.130 -28.221 21.229 1.00 0.00 H ATOM 862 HH2 TRP A 73 39.782 -30.273 22.432 1.00 0.00 H ATOM 863 HZ3 TRP A 73 42.128 -30.636 23.157 1.00 0.00 H ATOM 864 HE3 TRP A 73 43.885 -28.976 22.633 1.00 0.00 H ATOM 865 H TRP A 73 44.650 -25.192 18.992 1.00 0.00 H ATOM 866 N ARG A 74 44.530 -28.583 18.982 1.00 18.84 N ATOM 867 CA ARG A 74 44.207 -29.977 18.695 1.00 19.17 C ATOM 868 C ARG A 74 45.322 -30.693 17.940 1.00 19.63 C ATOM 869 O ARG A 74 45.509 -31.890 18.102 1.00 19.80 O ATOM 870 CB ARG A 74 42.934 -30.068 17.850 1.00 19.04 C ATOM 871 CG ARG A 74 41.705 -29.438 18.482 1.00 19.19 C ATOM 872 CD ARG A 74 40.431 -29.940 17.816 1.00 18.66 C ATOM 873 NE ARG A 74 40.268 -31.377 18.037 1.00 18.29 N ATOM 874 CZ ARG A 74 39.860 -32.263 17.131 1.00 18.56 C ATOM 875 NH1 ARG A 74 39.525 -31.893 15.892 1.00 18.56 N ATOM 876 NH2 ARG A 74 39.780 -33.543 17.473 1.00 19.59 N ATOM 877 HA ARG A 74 44.070 -30.461 19.662 1.00 0.00 H ATOM 878 HB2 ARG A 74 43.121 -29.568 16.899 1.00 0.00 H ATOM 879 HB3 ARG A 74 42.721 -31.122 17.670 1.00 0.00 H ATOM 880 HG2 ARG A 74 41.678 -29.693 19.541 1.00 0.00 H ATOM 881 HG3 ARG A 74 41.762 -28.355 18.372 1.00 0.00 H ATOM 882 HD2 ARG A 74 40.485 -29.746 16.745 1.00 0.00 H ATOM 883 HD3 ARG A 74 39.575 -29.413 18.237 1.00 0.00 H ATOM 884 HE ARG A 74 40.491 -31.739 18.986 1.00 0.00 H ATOM 885 HH12 ARG A 74 39.209 -32.606 15.204 1.00 0.00 H ATOM 886 HH11 ARG A 74 39.580 -30.892 15.616 1.00 0.00 H ATOM 887 HH22 ARG A 74 39.463 -34.248 16.777 1.00 0.00 H ATOM 888 HH21 ARG A 74 40.034 -33.841 18.437 1.00 0.00 H ATOM 889 H ARG A 74 44.107 -27.836 18.394 1.00 0.00 H ATOM 890 N GLN A 75 46.034 -29.951 17.099 1.00 20.01 N ATOM 891 CA GLN A 75 46.908 -30.553 16.100 1.00 20.71 C ATOM 892 C GLN A 75 47.934 -29.522 15.666 1.00 20.68 C ATOM 893 O GLN A 75 47.578 -28.453 15.177 1.00 21.19 O ATOM 894 CB GLN A 75 46.055 -30.991 14.906 1.00 21.06 C ATOM 895 CG GLN A 75 46.681 -32.004 13.979 1.00 21.94 C ATOM 896 CD GLN A 75 45.668 -32.570 12.987 1.00 22.58 C ATOM 897 OE1 GLN A 75 45.771 -33.724 12.573 1.00 25.51 O ATOM 898 NE2 GLN A 75 44.676 -31.758 12.616 1.00 21.20 N ATOM 899 HA GLN A 75 47.425 -31.421 16.509 1.00 0.00 H ATOM 900 HB2 GLN A 75 45.132 -31.421 15.295 1.00 0.00 H ATOM 901 HB3 GLN A 75 45.821 -30.102 14.320 1.00 0.00 H ATOM 902 HG2 GLN A 75 47.487 -31.524 13.425 1.00 0.00 H ATOM 903 HG3 GLN A 75 47.088 -32.822 14.573 1.00 0.00 H ATOM 904 HE22 GLN A 75 44.629 -30.789 12.992 1.00 0.00 H ATOM 905 HE21 GLN A 75 43.950 -32.094 11.951 1.00 0.00 H ATOM 906 H GLN A 75 45.966 -28.915 17.155 1.00 0.00 H ATOM 907 N GLU A 76 49.215 -29.841 15.845 1.00 20.89 N ATOM 908 CA GLU A 76 50.274 -28.901 15.509 1.00 20.92 C ATOM 909 C GLU A 76 50.304 -28.602 14.010 1.00 20.66 C ATOM 910 O GLU A 76 50.422 -27.449 13.612 1.00 21.35 O ATOM 911 CB GLU A 76 51.634 -29.433 15.971 1.00 21.13 C ATOM 912 CG GLU A 76 52.760 -28.426 15.800 1.00 22.58 C ATOM 913 CD GLU A 76 53.956 -28.710 16.700 1.00 23.50 C ATOM 914 OE1 GLU A 76 54.068 -29.841 17.220 1.00 25.73 O ATOM 915 OE2 GLU A 76 54.778 -27.784 16.896 1.00 26.26 O ATOM 916 HA GLU A 76 50.064 -27.968 16.033 1.00 0.00 H ATOM 917 HB2 GLU A 76 51.563 -29.698 17.026 1.00 0.00 H ATOM 918 HB3 GLU A 76 51.874 -30.323 15.390 1.00 0.00 H ATOM 919 HG2 GLU A 76 53.093 -28.450 14.762 1.00 0.00 H ATOM 920 HG3 GLU A 76 52.377 -27.433 16.035 1.00 0.00 H ATOM 921 H GLU A 76 49.462 -30.775 16.230 1.00 0.00 H ATOM 922 N LYS A 77 50.191 -29.648 13.197 1.00 20.65 N ATOM 923 CA LYS A 77 50.131 -29.500 11.746 1.00 20.97 C ATOM 924 C LYS A 77 48.782 -29.993 11.233 1.00 20.63 C ATOM 925 O LYS A 77 48.517 -31.190 11.201 1.00 21.02 O ATOM 926 CB LYS A 77 51.274 -30.268 11.076 1.00 21.39 C ATOM 927 CG LYS A 77 51.399 -29.981 9.591 1.00 22.38 C ATOM 928 CD LYS A 77 52.332 -30.953 8.895 1.00 23.57 C ATOM 929 CE LYS A 77 52.428 -30.646 7.402 1.00 24.91 C ATOM 930 NZ LYS A 77 52.970 -29.282 7.134 1.00 25.92 N ATOM 931 HA LYS A 77 50.242 -28.445 11.495 1.00 0.00 H ATOM 932 HB2 LYS A 77 52.209 -29.991 11.562 1.00 0.00 H ATOM 933 HB3 LYS A 77 51.099 -31.336 11.209 1.00 0.00 H ATOM 934 HG2 LYS A 77 50.412 -30.054 9.135 1.00 0.00 H ATOM 935 HG3 LYS A 77 51.784 -28.970 9.460 1.00 0.00 H ATOM 936 HD2 LYS A 77 53.324 -30.876 9.340 1.00 0.00 H ATOM 937 HD3 LYS A 77 51.954 -31.967 9.027 1.00 0.00 H ATOM 938 HE2 LYS A 77 51.432 -30.719 6.965 1.00 0.00 H ATOM 939 HE3 LYS A 77 53.083 -31.381 6.935 1.00 0.00 H ATOM 940 HZ1 LYS A 77 52.347 -28.571 7.569 1.00 0.00 H ATOM 941 HZ2 LYS A 77 53.924 -29.204 7.540 1.00 0.00 H ATOM 942 HZ3 LYS A 77 53.015 -29.124 6.107 1.00 0.00 H ATOM 943 H LYS A 77 50.144 -30.602 13.608 1.00 0.00 H ATOM 944 N ILE A 78 47.938 -29.055 10.824 1.00 20.33 N ATOM 945 CA ILE A 78 46.625 -29.410 10.298 1.00 20.29 C ATOM 946 C ILE A 78 46.791 -29.714 8.820 1.00 19.98 C ATOM 947 O ILE A 78 47.191 -28.855 8.039 1.00 20.41 O ATOM 948 CB ILE A 78 45.599 -28.306 10.558 1.00 20.33 C ATOM 949 CG1 ILE A 78 45.327 -28.236 12.065 1.00 21.26 C ATOM 950 CG2 ILE A 78 44.295 -28.593 9.817 1.00 19.90 C ATOM 951 CD1 ILE A 78 44.569 -27.036 12.507 1.00 22.06 C ATOM 952 HA ILE A 78 46.235 -30.291 10.808 1.00 0.00 H ATOM 953 HB ILE A 78 45.995 -27.357 10.198 1.00 0.00 H ATOM 954 HG12 ILE A 78 44.757 -29.121 12.348 1.00 0.00 H ATOM 955 HG13 ILE A 78 46.286 -28.242 12.583 1.00 0.00 H ATOM 956 HD11 ILE A 78 45.129 -26.138 12.246 1.00 0.00 H ATOM 957 HD12 ILE A 78 43.599 -27.018 12.011 1.00 0.00 H ATOM 958 HD13 ILE A 78 44.426 -27.076 13.587 1.00 0.00 H ATOM 959 HG21 ILE A 78 44.491 -28.646 8.746 1.00 0.00 H ATOM 960 HG22 ILE A 78 43.885 -29.543 10.160 1.00 0.00 H ATOM 961 HG23 ILE A 78 43.581 -27.794 10.018 1.00 0.00 H ATOM 962 H ILE A 78 48.216 -28.054 10.879 1.00 0.00 H ATOM 963 N THR A 79 46.501 -30.959 8.461 1.00 20.09 N ATOM 964 CA THR A 79 46.764 -31.472 7.124 1.00 20.28 C ATOM 965 C THR A 79 45.507 -31.780 6.321 1.00 19.74 C ATOM 966 O THR A 79 45.588 -31.999 5.114 1.00 20.08 O ATOM 967 CB THR A 79 47.588 -32.765 7.203 1.00 20.59 C ATOM 968 OG1 THR A 79 46.886 -33.737 7.987 1.00 22.97 O ATOM 969 CG2 THR A 79 48.946 -32.492 7.828 1.00 21.50 C ATOM 970 HA THR A 79 47.305 -30.675 6.614 1.00 0.00 H ATOM 971 HB THR A 79 47.736 -33.147 6.193 1.00 0.00 H ATOM 972 HG1 THR A 79 46.011 -33.930 7.566 1.00 0.00 H ATOM 973 HG23 THR A 79 49.478 -31.752 7.230 1.00 0.00 H ATOM 974 HG21 THR A 79 48.809 -32.112 8.840 1.00 0.00 H ATOM 975 HG22 THR A 79 49.522 -33.417 7.861 1.00 0.00 H ATOM 976 H THR A 79 46.069 -31.593 9.163 1.00 0.00 H ATOM 977 N ARG A 80 44.346 -31.806 6.975 1.00 19.06 N ATOM 978 CA ARG A 80 43.117 -32.155 6.268 1.00 18.35 C ATOM 979 C ARG A 80 42.840 -31.162 5.147 1.00 17.93 C ATOM 980 O ARG A 80 43.212 -29.993 5.227 1.00 17.54 O ATOM 981 CB ARG A 80 41.918 -32.246 7.226 1.00 18.07 C ATOM 982 CG ARG A 80 41.437 -30.916 7.792 1.00 17.38 C ATOM 983 CD ARG A 80 40.168 -31.106 8.601 1.00 16.69 C ATOM 984 NE ARG A 80 40.402 -31.800 9.868 1.00 16.45 N ATOM 985 CZ ARG A 80 40.732 -31.210 11.019 1.00 16.32 C ATOM 986 NH1 ARG A 80 40.912 -29.897 11.097 1.00 16.26 N ATOM 987 NH2 ARG A 80 40.907 -31.952 12.107 1.00 17.22 N ATOM 988 HA ARG A 80 43.259 -33.142 5.828 1.00 0.00 H ATOM 989 HB2 ARG A 80 41.089 -32.703 6.686 1.00 0.00 H ATOM 990 HB3 ARG A 80 42.202 -32.886 8.062 1.00 0.00 H ATOM 991 HG2 ARG A 80 42.212 -30.499 8.434 1.00 0.00 H ATOM 992 HG3 ARG A 80 41.238 -30.228 6.970 1.00 0.00 H ATOM 993 HD2 ARG A 80 39.462 -31.689 8.010 1.00 0.00 H ATOM 994 HD3 ARG A 80 39.740 -30.126 8.814 1.00 0.00 H ATOM 995 HE ARG A 80 40.303 -32.835 9.872 1.00 0.00 H ATOM 996 HH12 ARG A 80 41.169 -29.460 12.005 1.00 0.00 H ATOM 997 HH11 ARG A 80 40.796 -29.305 10.250 1.00 0.00 H ATOM 998 HH22 ARG A 80 41.164 -31.501 13.008 1.00 0.00 H ATOM 999 HH21 ARG A 80 40.787 -32.984 12.058 1.00 0.00 H ATOM 1000 H ARG A 80 44.315 -31.578 7.989 1.00 0.00 H ATOM 1001 N THR A 81 42.189 -31.640 4.096 1.00 17.78 N ATOM 1002 CA THR A 81 41.812 -30.776 2.991 1.00 18.26 C ATOM 1003 C THR A 81 40.602 -29.928 3.369 1.00 18.08 C ATOM 1004 O THR A 81 39.875 -30.243 4.315 1.00 17.17 O ATOM 1005 CB THR A 81 41.467 -31.589 1.739 1.00 18.33 C ATOM 1006 OG1 THR A 81 40.288 -32.363 1.978 1.00 18.78 O ATOM 1007 CG2 THR A 81 42.613 -32.520 1.368 1.00 19.79 C ATOM 1008 HA THR A 81 42.667 -30.135 2.775 1.00 0.00 H ATOM 1009 HB THR A 81 41.296 -30.897 0.915 1.00 0.00 H ATOM 1010 HG1 THR A 81 40.068 -32.887 1.167 1.00 0.00 H ATOM 1011 HG23 THR A 81 43.513 -31.932 1.185 1.00 0.00 H ATOM 1012 HG21 THR A 81 42.793 -33.217 2.187 1.00 0.00 H ATOM 1013 HG22 THR A 81 42.351 -33.075 0.467 1.00 0.00 H ATOM 1014 H THR A 81 41.944 -32.650 4.062 1.00 0.00 H ATOM 1015 N LYS A 82 40.391 -28.856 2.615 1.00 18.31 N ATOM 1016 CA LYS A 82 39.183 -28.042 2.763 1.00 18.53 C ATOM 1017 C LYS A 82 37.917 -28.895 2.625 1.00 18.31 C ATOM 1018 O LYS A 82 36.956 -28.707 3.363 1.00 17.51 O ATOM 1019 CB LYS A 82 39.176 -26.915 1.738 1.00 19.05 C ATOM 1020 CG LYS A 82 38.026 -25.934 1.900 1.00 20.89 C ATOM 1021 CD LYS A 82 38.237 -24.684 1.061 1.00 23.35 C ATOM 1022 CE LYS A 82 38.129 -24.972 -0.430 1.00 25.07 C ATOM 1023 NZ LYS A 82 38.316 -23.749 -1.245 1.00 27.89 N ATOM 1024 HA LYS A 82 39.189 -27.610 3.764 1.00 0.00 H ATOM 1025 HB2 LYS A 82 40.112 -26.364 1.829 1.00 0.00 H ATOM 1026 HB3 LYS A 82 39.111 -27.357 0.744 1.00 0.00 H ATOM 1027 HG2 LYS A 82 37.101 -26.418 1.588 1.00 0.00 H ATOM 1028 HG3 LYS A 82 37.949 -25.648 2.949 1.00 0.00 H ATOM 1029 HD2 LYS A 82 37.482 -23.946 1.333 1.00 0.00 H ATOM 1030 HD3 LYS A 82 39.228 -24.282 1.271 1.00 0.00 H ATOM 1031 HE2 LYS A 82 37.143 -25.387 -0.638 1.00 0.00 H ATOM 1032 HE3 LYS A 82 38.893 -25.699 -0.705 1.00 0.00 H ATOM 1033 HZ1 LYS A 82 37.586 -23.052 -0.994 1.00 0.00 H ATOM 1034 HZ2 LYS A 82 39.258 -23.350 -1.058 1.00 0.00 H ATOM 1035 HZ3 LYS A 82 38.235 -23.990 -2.253 1.00 0.00 H ATOM 1036 H LYS A 82 41.100 -28.588 1.903 1.00 0.00 H ATOM 1037 N GLU A 83 37.929 -29.839 1.690 1.00 18.26 N ATOM 1038 CA GLU A 83 36.780 -30.712 1.458 1.00 18.66 C ATOM 1039 C GLU A 83 36.506 -31.600 2.679 1.00 18.00 C ATOM 1040 O GLU A 83 35.356 -31.787 3.087 1.00 17.67 O ATOM 1041 CB GLU A 83 37.005 -31.559 0.199 1.00 19.13 C ATOM 1042 CG GLU A 83 37.085 -30.762 -1.118 1.00 22.16 C ATOM 1043 CD GLU A 83 38.372 -29.939 -1.304 1.00 24.82 C ATOM 1044 OE1 GLU A 83 39.459 -30.326 -0.798 1.00 24.94 O ATOM 1045 OE2 GLU A 83 38.289 -28.882 -1.974 1.00 28.85 O ATOM 1046 HA GLU A 83 35.899 -30.089 1.302 1.00 0.00 H ATOM 1047 HB2 GLU A 83 37.941 -32.105 0.321 1.00 0.00 H ATOM 1048 HB3 GLU A 83 36.181 -32.267 0.116 1.00 0.00 H ATOM 1049 HG2 GLU A 83 37.012 -31.468 -1.945 1.00 0.00 H ATOM 1050 HG3 GLU A 83 36.238 -30.077 -1.151 1.00 0.00 H ATOM 1051 H GLU A 83 38.781 -29.960 1.106 1.00 0.00 H ATOM 1052 N GLU A 84 37.573 -32.122 3.281 1.00 17.49 N ATOM 1053 CA GLU A 84 37.469 -32.919 4.500 1.00 17.24 C ATOM 1054 C GLU A 84 36.966 -32.076 5.673 1.00 16.29 C ATOM 1055 O GLU A 84 36.148 -32.540 6.472 1.00 16.28 O ATOM 1056 CB GLU A 84 38.818 -33.573 4.838 1.00 17.56 C ATOM 1057 CG GLU A 84 39.163 -34.728 3.904 1.00 18.88 C ATOM 1058 CD GLU A 84 40.611 -35.200 4.013 1.00 21.00 C ATOM 1059 OE1 GLU A 84 41.468 -34.454 4.529 1.00 21.43 O ATOM 1060 OE2 GLU A 84 40.889 -36.331 3.560 1.00 23.72 O ATOM 1061 HA GLU A 84 36.739 -33.709 4.321 1.00 0.00 H ATOM 1062 HB2 GLU A 84 39.600 -32.818 4.763 1.00 0.00 H ATOM 1063 HB3 GLU A 84 38.776 -33.951 5.860 1.00 0.00 H ATOM 1064 HG2 GLU A 84 38.509 -35.568 4.140 1.00 0.00 H ATOM 1065 HG3 GLU A 84 38.983 -34.406 2.878 1.00 0.00 H ATOM 1066 H GLU A 84 38.513 -31.956 2.868 1.00 0.00 H ATOM 1067 N ALA A 85 37.437 -30.833 5.762 1.00 15.60 N ATOM 1068 CA ALA A 85 36.951 -29.906 6.784 1.00 15.24 C ATOM 1069 C ALA A 85 35.447 -29.651 6.635 1.00 14.76 C ATOM 1070 O ALA A 85 34.714 -29.647 7.622 1.00 14.51 O ATOM 1071 CB ALA A 85 37.714 -28.596 6.718 1.00 15.05 C ATOM 1072 HA ALA A 85 37.121 -30.365 7.758 1.00 0.00 H ATOM 1073 HB1 ALA A 85 38.774 -28.786 6.886 1.00 0.00 H ATOM 1074 HB2 ALA A 85 37.575 -28.145 5.735 1.00 0.00 H ATOM 1075 HB3 ALA A 85 37.339 -27.919 7.486 1.00 0.00 H ATOM 1076 H ALA A 85 38.165 -30.515 5.091 1.00 0.00 H ATOM 1077 N LEU A 86 34.990 -29.443 5.405 1.00 14.63 N ATOM 1078 CA LEU A 86 33.565 -29.197 5.157 1.00 14.33 C ATOM 1079 C LEU A 86 32.711 -30.405 5.542 1.00 14.48 C ATOM 1080 O LEU A 86 31.639 -30.246 6.121 1.00 14.24 O ATOM 1081 CB LEU A 86 33.325 -28.819 3.697 1.00 14.39 C ATOM 1082 CG LEU A 86 31.887 -28.427 3.334 1.00 14.34 C ATOM 1083 CD1 LEU A 86 31.340 -27.283 4.222 1.00 14.44 C ATOM 1084 CD2 LEU A 86 31.806 -28.062 1.854 1.00 14.81 C ATOM 1085 HA LEU A 86 33.264 -28.360 5.787 1.00 0.00 H ATOM 1086 HB2 LEU A 86 33.972 -27.974 3.460 1.00 0.00 H ATOM 1087 HB3 LEU A 86 33.604 -29.673 3.080 1.00 0.00 H ATOM 1088 HG LEU A 86 31.251 -29.292 3.525 1.00 0.00 H ATOM 1089 HD21 LEU A 86 32.470 -27.222 1.651 1.00 0.00 H ATOM 1090 HD22 LEU A 86 32.108 -28.919 1.253 1.00 0.00 H ATOM 1091 HD23 LEU A 86 30.782 -27.785 1.605 1.00 0.00 H ATOM 1092 HD11 LEU A 86 31.348 -27.599 5.265 1.00 0.00 H ATOM 1093 HD12 LEU A 86 31.968 -26.400 4.103 1.00 0.00 H ATOM 1094 HD13 LEU A 86 30.319 -27.047 3.921 1.00 0.00 H ATOM 1095 H LEU A 86 35.654 -29.455 4.604 1.00 0.00 H ATOM 1096 N GLU A 87 33.180 -31.609 5.219 1.00 14.48 N ATOM 1097 CA GLU A 87 32.489 -32.829 5.646 1.00 14.79 C ATOM 1098 C GLU A 87 32.366 -32.922 7.172 1.00 14.40 C ATOM 1099 O GLU A 87 31.314 -33.296 7.699 1.00 14.44 O ATOM 1100 CB GLU A 87 33.162 -34.086 5.073 1.00 15.31 C ATOM 1101 CG GLU A 87 32.862 -34.322 3.609 1.00 17.67 C ATOM 1102 HA GLU A 87 31.478 -32.773 5.243 1.00 0.00 H ATOM 1103 HB2 GLU A 87 34.241 -33.984 5.192 1.00 0.00 H ATOM 1104 HB3 GLU A 87 32.816 -34.951 5.639 1.00 0.00 H ATOM 1105 HG2 GLU A 87 31.787 -34.438 3.474 1.00 0.00 H ATOM 1106 HG3 GLU A 87 33.213 -33.471 3.026 1.00 0.00 H ATOM 1107 H GLU A 87 34.050 -31.685 4.655 1.00 0.00 H ATOM 1108 N LEU A 88 33.429 -32.558 7.889 1.00 13.94 N ATOM 1109 CA LEU A 88 33.400 -32.567 9.348 1.00 13.50 C ATOM 1110 C LEU A 88 32.382 -31.560 9.875 1.00 13.01 C ATOM 1111 O LEU A 88 31.574 -31.892 10.744 1.00 12.52 O ATOM 1112 CB LEU A 88 34.791 -32.272 9.931 1.00 13.85 C ATOM 1113 CG LEU A 88 35.772 -33.445 9.833 1.00 14.68 C ATOM 1114 CD1 LEU A 88 37.201 -32.948 10.006 1.00 15.11 C ATOM 1115 CD2 LEU A 88 35.454 -34.551 10.846 1.00 15.28 C ATOM 1116 HA LEU A 88 33.100 -33.565 9.668 1.00 0.00 H ATOM 1117 HB2 LEU A 88 35.215 -31.425 9.393 1.00 0.00 H ATOM 1118 HB3 LEU A 88 34.673 -32.011 10.983 1.00 0.00 H ATOM 1119 HG LEU A 88 35.665 -33.883 8.841 1.00 0.00 H ATOM 1120 HD21 LEU A 88 35.511 -34.144 11.856 1.00 0.00 H ATOM 1121 HD22 LEU A 88 34.449 -34.932 10.662 1.00 0.00 H ATOM 1122 HD23 LEU A 88 36.176 -35.360 10.738 1.00 0.00 H ATOM 1123 HD11 LEU A 88 37.429 -32.224 9.224 1.00 0.00 H ATOM 1124 HD12 LEU A 88 37.304 -32.475 10.983 1.00 0.00 H ATOM 1125 HD13 LEU A 88 37.889 -33.791 9.934 1.00 0.00 H ATOM 1126 H LEU A 88 34.297 -32.261 7.399 1.00 0.00 H ATOM 1127 N ILE A 89 32.414 -30.354 9.316 1.00 12.99 N ATOM 1128 CA ILE A 89 31.467 -29.290 9.660 1.00 12.75 C ATOM 1129 C ILE A 89 30.031 -29.754 9.405 1.00 12.74 C ATOM 1130 O ILE A 89 29.165 -29.593 10.268 1.00 12.69 O ATOM 1131 CB ILE A 89 31.773 -27.991 8.856 1.00 12.80 C ATOM 1132 CG1 ILE A 89 33.021 -27.306 9.416 1.00 13.27 C ATOM 1133 CG2 ILE A 89 30.577 -27.017 8.843 1.00 13.05 C ATOM 1134 CD1 ILE A 89 32.789 -26.511 10.698 1.00 13.86 C ATOM 1135 HA ILE A 89 31.578 -29.064 10.721 1.00 0.00 H ATOM 1136 HB ILE A 89 31.958 -28.282 7.822 1.00 0.00 H ATOM 1137 HG12 ILE A 89 33.767 -28.074 9.622 1.00 0.00 H ATOM 1138 HG13 ILE A 89 33.404 -26.624 8.657 1.00 0.00 H ATOM 1139 HD11 ILE A 89 32.055 -25.727 10.510 1.00 0.00 H ATOM 1140 HD12 ILE A 89 32.418 -27.179 11.476 1.00 0.00 H ATOM 1141 HD13 ILE A 89 33.728 -26.061 11.020 1.00 0.00 H ATOM 1142 HG21 ILE A 89 29.717 -27.505 8.384 1.00 0.00 H ATOM 1143 HG22 ILE A 89 30.331 -26.732 9.866 1.00 0.00 H ATOM 1144 HG23 ILE A 89 30.840 -26.128 8.270 1.00 0.00 H ATOM 1145 H ILE A 89 33.144 -30.157 8.602 1.00 0.00 H ATOM 1146 N ASN A 90 29.782 -30.341 8.238 1.00 12.82 N ATOM 1147 CA ASN A 90 28.435 -30.786 7.898 1.00 13.16 C ATOM 1148 C ASN A 90 27.927 -31.834 8.884 1.00 12.95 C ATOM 1149 O ASN A 90 26.758 -31.826 9.266 1.00 13.07 O ATOM 1150 CB ASN A 90 28.399 -31.330 6.464 1.00 13.88 C ATOM 1151 CG ASN A 90 28.431 -30.232 5.408 1.00 15.16 C ATOM 1152 OD1 ASN A 90 28.097 -29.075 5.669 1.00 18.62 O ATOM 1153 ND2 ASN A 90 28.817 -30.605 4.195 1.00 18.20 N ATOM 1154 HA ASN A 90 27.771 -29.924 7.963 1.00 0.00 H ATOM 1155 HB2 ASN A 90 29.262 -31.979 6.317 1.00 0.00 H ATOM 1156 HB3 ASN A 90 27.485 -31.909 6.335 1.00 0.00 H ATOM 1157 HD22 ASN A 90 29.091 -31.592 4.017 1.00 0.00 H ATOM 1158 HD21 ASN A 90 28.846 -29.910 3.422 1.00 0.00 H ATOM 1159 H ASN A 90 30.557 -30.485 7.559 1.00 0.00 H ATOM 1160 N GLY A 91 28.812 -32.731 9.302 1.00 12.78 N ATOM 1161 CA GLY A 91 28.480 -33.747 10.295 1.00 12.53 C ATOM 1162 C GLY A 91 28.152 -33.160 11.650 1.00 12.51 C ATOM 1163 O GLY A 91 27.217 -33.603 12.319 1.00 13.23 O ATOM 1164 HA3 GLY A 91 29.331 -34.419 10.404 1.00 0.00 H ATOM 1165 HA2 GLY A 91 27.617 -34.310 9.941 1.00 0.00 H ATOM 1166 H GLY A 91 29.774 -32.709 8.908 1.00 0.00 H ATOM 1167 N TYR A 92 28.919 -32.157 12.070 1.00 12.36 N ATOM 1168 CA TYR A 92 28.647 -31.505 13.345 1.00 12.06 C ATOM 1169 C TYR A 92 27.296 -30.793 13.305 1.00 11.70 C ATOM 1170 O TYR A 92 26.537 -30.865 14.266 1.00 11.72 O ATOM 1171 CB TYR A 92 29.747 -30.507 13.733 1.00 12.40 C ATOM 1172 CG TYR A 92 31.126 -31.128 13.940 1.00 12.34 C ATOM 1173 CD1 TYR A 92 31.286 -32.369 14.560 1.00 13.61 C ATOM 1174 CD2 TYR A 92 32.271 -30.459 13.521 1.00 12.34 C ATOM 1175 CE1 TYR A 92 32.549 -32.926 14.752 1.00 14.15 C ATOM 1176 CE2 TYR A 92 33.539 -31.006 13.709 1.00 12.80 C ATOM 1177 CZ TYR A 92 33.669 -32.241 14.320 1.00 13.29 C ATOM 1178 OH TYR A 92 34.919 -32.801 14.504 1.00 15.30 O ATOM 1179 HA TYR A 92 28.625 -32.288 14.103 1.00 0.00 H ATOM 1180 HB3 TYR A 92 29.451 -30.019 14.662 1.00 0.00 H ATOM 1181 HB2 TYR A 92 29.825 -29.762 12.941 1.00 0.00 H ATOM 1182 HD2 TYR A 92 32.175 -29.488 13.036 1.00 0.00 H ATOM 1183 HE2 TYR A 92 34.424 -30.464 13.376 1.00 0.00 H ATOM 1184 HE1 TYR A 92 32.653 -33.895 15.240 1.00 0.00 H ATOM 1185 HD1 TYR A 92 30.405 -32.913 14.901 1.00 0.00 H ATOM 1186 HH TYR A 92 34.823 -33.678 14.953 1.00 0.00 H ATOM 1187 H TYR A 92 29.717 -31.836 11.485 1.00 0.00 H ATOM 1188 N ILE A 93 27.010 -30.116 12.196 1.00 11.86 N ATOM 1189 CA ILE A 93 25.721 -29.451 12.019 1.00 11.86 C ATOM 1190 C ILE A 93 24.581 -30.465 12.120 1.00 12.08 C ATOM 1191 O ILE A 93 23.576 -30.198 12.778 1.00 12.14 O ATOM 1192 CB ILE A 93 25.644 -28.661 10.694 1.00 11.96 C ATOM 1193 CG1 ILE A 93 26.558 -27.435 10.752 1.00 12.48 C ATOM 1194 CG2 ILE A 93 24.210 -28.212 10.413 1.00 11.87 C ATOM 1195 CD1 ILE A 93 26.747 -26.735 9.420 1.00 13.70 C ATOM 1196 HA ILE A 93 25.617 -28.723 12.824 1.00 0.00 H ATOM 1197 HB ILE A 93 25.973 -29.320 9.890 1.00 0.00 H ATOM 1198 HG12 ILE A 93 26.129 -26.721 11.455 1.00 0.00 H ATOM 1199 HG13 ILE A 93 27.536 -27.754 11.112 1.00 0.00 H ATOM 1200 HD11 ILE A 93 27.189 -27.430 8.705 1.00 0.00 H ATOM 1201 HD12 ILE A 93 25.780 -26.396 9.049 1.00 0.00 H ATOM 1202 HD13 ILE A 93 27.408 -25.878 9.552 1.00 0.00 H ATOM 1203 HG21 ILE A 93 23.564 -29.087 10.339 1.00 0.00 H ATOM 1204 HG22 ILE A 93 23.865 -27.572 11.225 1.00 0.00 H ATOM 1205 HG23 ILE A 93 24.181 -27.658 9.475 1.00 0.00 H ATOM 1206 H ILE A 93 27.720 -30.059 11.438 1.00 0.00 H ATOM 1207 N GLN A 94 24.742 -31.628 11.489 1.00 12.59 N ATOM 1208 CA GLN A 94 23.724 -32.679 11.579 1.00 13.31 C ATOM 1209 C GLN A 94 23.463 -33.092 13.021 1.00 13.15 C ATOM 1210 O GLN A 94 22.301 -33.170 13.447 1.00 13.56 O ATOM 1211 CB GLN A 94 24.118 -33.904 10.753 1.00 13.57 C ATOM 1212 CG GLN A 94 23.993 -33.693 9.267 1.00 15.85 C ATOM 1213 CD GLN A 94 24.402 -34.907 8.465 1.00 19.63 C ATOM 1214 OE1 GLN A 94 25.399 -35.561 8.775 1.00 23.40 O ATOM 1215 NE2 GLN A 94 23.640 -35.211 7.422 1.00 22.71 N ATOM 1216 HA GLN A 94 22.804 -32.260 11.172 1.00 0.00 H ATOM 1217 HB2 GLN A 94 25.154 -34.155 10.980 1.00 0.00 H ATOM 1218 HB3 GLN A 94 23.473 -34.735 11.039 1.00 0.00 H ATOM 1219 HG2 GLN A 94 22.955 -33.456 9.035 1.00 0.00 H ATOM 1220 HG3 GLN A 94 24.629 -32.855 8.979 1.00 0.00 H ATOM 1221 HE22 GLN A 94 22.807 -34.629 7.199 1.00 0.00 H ATOM 1222 HE21 GLN A 94 23.875 -36.031 6.828 1.00 0.00 H ATOM 1223 H GLN A 94 25.601 -31.792 10.926 1.00 0.00 H ATOM 1224 N LYS A 95 24.531 -33.346 13.774 1.00 13.46 N ATOM 1225 CA LYS A 95 24.404 -33.797 15.155 1.00 13.87 C ATOM 1226 C LYS A 95 23.800 -32.731 16.068 1.00 13.25 C ATOM 1227 O LYS A 95 23.018 -33.039 16.973 1.00 13.83 O ATOM 1228 CB LYS A 95 25.757 -34.273 15.700 1.00 14.69 C ATOM 1229 CG LYS A 95 26.215 -35.601 15.100 1.00 17.04 C ATOM 1230 CD LYS A 95 27.316 -36.241 15.922 1.00 19.87 C ATOM 1231 CE LYS A 95 27.534 -37.702 15.535 1.00 22.05 C ATOM 1232 HA LYS A 95 23.711 -34.638 15.148 1.00 0.00 H ATOM 1233 HB2 LYS A 95 26.507 -33.514 15.476 1.00 0.00 H ATOM 1234 HB3 LYS A 95 25.673 -34.391 16.780 1.00 0.00 H ATOM 1235 HG2 LYS A 95 25.365 -36.282 15.058 1.00 0.00 H ATOM 1236 HG3 LYS A 95 26.586 -35.423 14.091 1.00 0.00 H ATOM 1237 HD2 LYS A 95 28.243 -35.691 15.761 1.00 0.00 H ATOM 1238 HD3 LYS A 95 27.044 -36.191 16.976 1.00 0.00 H ATOM 1239 HE2 LYS A 95 26.613 -38.261 15.700 1.00 0.00 H ATOM 1240 HE3 LYS A 95 27.813 -37.760 14.483 1.00 0.00 H ATOM 1241 H LYS A 95 25.480 -33.220 13.367 1.00 0.00 H ATOM 1242 N ILE A 96 24.143 -31.470 15.821 1.00 12.78 N ATOM 1243 CA ILE A 96 23.603 -30.367 16.611 1.00 12.63 C ATOM 1244 C ILE A 96 22.108 -30.185 16.307 1.00 12.45 C ATOM 1245 O ILE A 96 21.294 -30.043 17.222 1.00 12.36 O ATOM 1246 CB ILE A 96 24.386 -29.064 16.350 1.00 12.19 C ATOM 1247 CG1 ILE A 96 25.818 -29.204 16.878 1.00 12.23 C ATOM 1248 CG2 ILE A 96 23.695 -27.876 17.023 1.00 12.47 C ATOM 1249 CD1 ILE A 96 26.778 -28.194 16.305 1.00 12.55 C ATOM 1250 HA ILE A 96 23.714 -30.609 17.668 1.00 0.00 H ATOM 1251 HB ILE A 96 24.414 -28.884 15.275 1.00 0.00 H ATOM 1252 HG12 ILE A 96 25.799 -29.084 17.961 1.00 0.00 H ATOM 1253 HG13 ILE A 96 26.180 -30.202 16.630 1.00 0.00 H ATOM 1254 HD11 ILE A 96 26.819 -28.307 15.222 1.00 0.00 H ATOM 1255 HD12 ILE A 96 26.437 -27.189 16.554 1.00 0.00 H ATOM 1256 HD13 ILE A 96 27.770 -28.357 16.727 1.00 0.00 H ATOM 1257 HG21 ILE A 96 22.687 -27.769 16.622 1.00 0.00 H ATOM 1258 HG22 ILE A 96 23.644 -28.048 18.098 1.00 0.00 H ATOM 1259 HG23 ILE A 96 24.264 -26.967 16.826 1.00 0.00 H ATOM 1260 H ILE A 96 24.810 -31.265 15.049 1.00 0.00 H ATOM 1261 N LYS A 97 21.745 -30.226 15.030 1.00 12.47 N ATOM 1262 CA LYS A 97 20.340 -30.081 14.634 1.00 13.14 C ATOM 1263 C LYS A 97 19.461 -31.244 15.095 1.00 13.64 C ATOM 1264 O LYS A 97 18.274 -31.054 15.360 1.00 13.56 O ATOM 1265 CB LYS A 97 20.222 -29.924 13.121 1.00 13.06 C ATOM 1266 CG LYS A 97 20.594 -28.551 12.605 1.00 14.58 C ATOM 1267 CD LYS A 97 20.027 -28.348 11.204 1.00 15.55 C ATOM 1268 CE LYS A 97 20.118 -26.909 10.766 1.00 16.15 C ATOM 1269 NZ LYS A 97 19.428 -26.664 9.475 1.00 15.51 N ATOM 1270 HA LYS A 97 19.977 -29.182 15.133 1.00 0.00 H ATOM 1271 HB2 LYS A 97 20.879 -30.655 12.650 1.00 0.00 H ATOM 1272 HB3 LYS A 97 19.190 -30.128 12.836 1.00 0.00 H ATOM 1273 HG2 LYS A 97 20.187 -27.792 13.273 1.00 0.00 H ATOM 1274 HG3 LYS A 97 21.680 -28.460 12.572 1.00 0.00 H ATOM 1275 HD2 LYS A 97 20.588 -28.966 10.503 1.00 0.00 H ATOM 1276 HD3 LYS A 97 18.981 -28.653 11.199 1.00 0.00 H ATOM 1277 HE2 LYS A 97 21.169 -26.642 10.657 1.00 0.00 H ATOM 1278 HE3 LYS A 97 19.662 -26.281 11.531 1.00 0.00 H ATOM 1279 HZ1 LYS A 97 19.861 -27.253 8.735 1.00 0.00 H ATOM 1280 HZ2 LYS A 97 18.421 -26.908 9.570 1.00 0.00 H ATOM 1281 HZ3 LYS A 97 19.520 -25.660 9.219 1.00 0.00 H ATOM 1282 H LYS A 97 22.470 -30.363 14.297 1.00 0.00 H ATOM 1283 N SER A 98 20.032 -32.438 15.177 1.00 14.09 N ATOM 1284 CA SER A 98 19.277 -33.614 15.613 1.00 14.71 C ATOM 1285 C SER A 98 19.093 -33.657 17.120 1.00 15.19 C ATOM 1286 O SER A 98 18.256 -34.414 17.623 1.00 15.77 O ATOM 1287 CB SER A 98 19.985 -34.893 15.178 1.00 15.07 C ATOM 1288 OG SER A 98 21.131 -35.153 15.970 1.00 15.65 O ATOM 1289 HA SER A 98 18.295 -33.541 15.145 1.00 0.00 H ATOM 1290 HB2 SER A 98 20.291 -34.791 14.137 1.00 0.00 H ATOM 1291 HB3 SER A 98 19.293 -35.730 15.272 1.00 0.00 H ATOM 1292 HG SER A 98 21.563 -35.988 15.659 1.00 0.00 H ATOM 1293 H SER A 98 21.036 -32.541 14.927 1.00 0.00 H ATOM 1294 N GLY A 99 19.890 -32.882 17.850 1.00 15.31 N ATOM 1295 CA GLY A 99 19.871 -32.920 19.305 1.00 16.03 C ATOM 1296 C GLY A 99 20.733 -34.017 19.907 1.00 17.00 C ATOM 1297 O GLY A 99 20.818 -34.126 21.132 1.00 18.30 O ATOM 1298 HA3 GLY A 99 18.842 -33.075 19.631 1.00 0.00 H ATOM 1299 HA2 GLY A 99 20.228 -31.960 19.678 1.00 0.00 H ATOM 1300 H GLY A 99 20.544 -32.232 17.369 1.00 0.00 H ATOM 1301 N GLU A 100 21.385 -34.818 19.066 1.00 17.62 N ATOM 1302 CA GLU A 100 22.273 -35.874 19.553 1.00 18.82 C ATOM 1303 C GLU A 100 23.431 -35.261 20.347 1.00 18.99 C ATOM 1304 O GLU A 100 23.872 -35.815 21.352 1.00 19.41 O ATOM 1305 CB GLU A 100 22.815 -36.714 18.392 1.00 19.29 C ATOM 1306 CG GLU A 100 23.557 -37.973 18.848 1.00 22.91 C ATOM 1307 CD GLU A 100 24.370 -38.637 17.747 1.00 26.53 C ATOM 1308 OE1 GLU A 100 23.909 -38.672 16.581 1.00 29.21 O ATOM 1309 OE2 GLU A 100 25.477 -39.142 18.059 1.00 30.37 O ATOM 1310 HA GLU A 100 21.698 -36.530 20.207 1.00 0.00 H ATOM 1311 HB2 GLU A 100 21.978 -37.015 17.762 1.00 0.00 H ATOM 1312 HB3 GLU A 100 23.502 -36.099 17.811 1.00 0.00 H ATOM 1313 HG2 GLU A 100 24.233 -37.700 19.658 1.00 0.00 H ATOM 1314 HG3 GLU A 100 22.824 -38.691 19.215 1.00 0.00 H ATOM 1315 H GLU A 100 21.260 -34.690 18.041 1.00 0.00 H ATOM 1316 N GLU A 101 23.905 -34.106 19.888 1.00 19.08 N ATOM 1317 CA GLU A 101 24.993 -33.389 20.537 1.00 19.39 C ATOM 1318 C GLU A 101 24.614 -31.930 20.705 1.00 18.93 C ATOM 1319 O GLU A 101 23.837 -31.397 19.921 1.00 19.63 O ATOM 1320 CB GLU A 101 26.246 -33.469 19.670 1.00 20.02 C ATOM 1321 CG GLU A 101 26.848 -34.854 19.578 1.00 22.22 C ATOM 1322 CD GLU A 101 27.703 -35.214 20.775 1.00 25.24 C ATOM 1323 OE1 GLU A 101 27.571 -34.570 21.838 1.00 28.64 O ATOM 1324 OE2 GLU A 101 28.526 -36.141 20.643 1.00 28.84 O ATOM 1325 HA GLU A 101 25.183 -33.839 21.512 1.00 0.00 H ATOM 1326 HB2 GLU A 101 25.987 -33.141 18.663 1.00 0.00 H ATOM 1327 HB3 GLU A 101 26.995 -32.797 20.089 1.00 0.00 H ATOM 1328 HG2 GLU A 101 26.038 -35.579 19.500 1.00 0.00 H ATOM 1329 HG3 GLU A 101 27.467 -34.904 18.682 1.00 0.00 H ATOM 1330 H GLU A 101 23.481 -33.699 19.030 1.00 0.00 H ATOM 1331 N ASP A 102 25.154 -31.294 21.741 1.00 18.38 N ATOM 1332 CA ASP A 102 25.023 -29.858 21.927 1.00 18.38 C ATOM 1333 C ASP A 102 26.146 -29.160 21.174 1.00 17.07 C ATOM 1334 O ASP A 102 27.258 -29.692 21.072 1.00 16.37 O ATOM 1335 CB ASP A 102 25.124 -29.480 23.415 1.00 19.27 C ATOM 1336 CG ASP A 102 23.901 -29.884 24.224 1.00 22.26 C ATOM 1337 OD1 ASP A 102 22.788 -29.986 23.658 1.00 25.90 O ATOM 1338 OD2 ASP A 102 24.060 -30.070 25.449 1.00 26.75 O ATOM 1339 HA ASP A 102 24.048 -29.549 21.551 1.00 0.00 H ATOM 1340 HB2 ASP A 102 25.998 -29.974 23.839 1.00 0.00 H ATOM 1341 HB3 ASP A 102 25.247 -28.400 23.490 1.00 0.00 H ATOM 1342 H ASP A 102 25.689 -31.844 22.443 1.00 0.00 H ATOM 1343 N PHE A 103 25.859 -27.962 20.677 1.00 16.03 N ATOM 1344 CA PHE A 103 26.877 -27.120 20.052 1.00 15.51 C ATOM 1345 C PHE A 103 28.090 -26.968 20.974 1.00 15.29 C ATOM 1346 O PHE A 103 29.234 -27.084 20.535 1.00 14.37 O ATOM 1347 CB PHE A 103 26.305 -25.731 19.734 1.00 15.53 C ATOM 1348 CG PHE A 103 27.319 -24.788 19.169 1.00 16.48 C ATOM 1349 CD1 PHE A 103 28.156 -24.073 20.017 1.00 17.52 C ATOM 1350 CD2 PHE A 103 27.458 -24.629 17.798 1.00 17.41 C ATOM 1351 CE1 PHE A 103 29.103 -23.223 19.511 1.00 17.95 C ATOM 1352 CE2 PHE A 103 28.415 -23.772 17.296 1.00 18.20 C ATOM 1353 CZ PHE A 103 29.232 -23.080 18.159 1.00 17.61 C ATOM 1354 HA PHE A 103 27.189 -27.602 19.125 1.00 0.00 H ATOM 1355 HB2 PHE A 103 25.498 -25.846 19.010 1.00 0.00 H ATOM 1356 HB3 PHE A 103 25.908 -25.302 20.654 1.00 0.00 H ATOM 1357 HD2 PHE A 103 26.811 -25.182 17.117 1.00 0.00 H ATOM 1358 HE2 PHE A 103 28.523 -23.644 16.219 1.00 0.00 H ATOM 1359 HZ PHE A 103 29.992 -22.409 17.759 1.00 0.00 H ATOM 1360 HE1 PHE A 103 29.751 -22.663 20.185 1.00 0.00 H ATOM 1361 HD1 PHE A 103 28.058 -24.190 21.096 1.00 0.00 H ATOM 1362 H PHE A 103 24.881 -27.613 20.734 1.00 0.00 H ATOM 1363 N GLU A 104 27.823 -26.702 22.248 1.00 15.25 N ATOM 1364 CA GLU A 104 28.878 -26.452 23.235 1.00 15.41 C ATOM 1365 C GLU A 104 29.802 -27.643 23.397 1.00 15.22 C ATOM 1366 O GLU A 104 31.036 -27.487 23.521 1.00 15.08 O ATOM 1367 CB GLU A 104 28.261 -26.113 24.594 1.00 15.69 C ATOM 1368 CG GLU A 104 27.580 -24.754 24.652 1.00 16.83 C ATOM 1369 CD GLU A 104 26.126 -24.754 24.197 1.00 18.75 C ATOM 1370 OE1 GLU A 104 25.640 -25.754 23.622 1.00 18.50 O ATOM 1371 OE2 GLU A 104 25.460 -23.725 24.423 1.00 21.82 O ATOM 1372 HA GLU A 104 29.466 -25.611 22.867 1.00 0.00 H ATOM 1373 HB2 GLU A 104 27.521 -26.876 24.833 1.00 0.00 H ATOM 1374 HB3 GLU A 104 29.053 -26.130 25.343 1.00 0.00 H ATOM 1375 HG2 GLU A 104 27.614 -24.400 25.682 1.00 0.00 H ATOM 1376 HG3 GLU A 104 28.136 -24.067 24.014 1.00 0.00 H ATOM 1377 H GLU A 104 26.830 -26.670 22.556 1.00 0.00 H ATOM 1378 N SER A 105 29.210 -28.833 23.411 1.00 15.26 N ATOM 1379 CA SER A 105 29.962 -30.063 23.561 1.00 15.68 C ATOM 1380 C SER A 105 30.910 -30.280 22.383 1.00 14.88 C ATOM 1381 O SER A 105 32.075 -30.623 22.572 1.00 14.90 O ATOM 1382 CB SER A 105 29.007 -31.255 23.687 1.00 16.22 C ATOM 1383 OG SER A 105 29.704 -32.486 23.675 1.00 18.82 O ATOM 1384 HA SER A 105 30.559 -29.981 24.469 1.00 0.00 H ATOM 1385 HB2 SER A 105 28.307 -31.237 22.852 1.00 0.00 H ATOM 1386 HB3 SER A 105 28.456 -31.169 24.624 1.00 0.00 H ATOM 1387 HG SER A 105 29.057 -33.231 23.758 1.00 0.00 H ATOM 1388 H SER A 105 28.176 -28.883 23.311 1.00 0.00 H ATOM 1389 N LEU A 106 30.401 -30.098 21.170 1.00 14.06 N ATOM 1390 CA LEU A 106 31.210 -30.298 19.973 1.00 13.46 C ATOM 1391 C LEU A 106 32.282 -29.215 19.825 1.00 13.12 C ATOM 1392 O LEU A 106 33.400 -29.503 19.392 1.00 13.00 O ATOM 1393 CB LEU A 106 30.331 -30.381 18.721 1.00 13.23 C ATOM 1394 CG LEU A 106 29.400 -31.600 18.685 1.00 13.42 C ATOM 1395 CD1 LEU A 106 28.610 -31.595 17.399 1.00 14.08 C ATOM 1396 CD2 LEU A 106 30.182 -32.897 18.818 1.00 14.89 C ATOM 1397 HA LEU A 106 31.727 -31.251 20.085 1.00 0.00 H ATOM 1398 HB2 LEU A 106 29.718 -29.481 18.673 1.00 0.00 H ATOM 1399 HB3 LEU A 106 30.982 -30.422 17.848 1.00 0.00 H ATOM 1400 HG LEU A 106 28.717 -31.537 19.532 1.00 0.00 H ATOM 1401 HD21 LEU A 106 30.892 -32.978 17.995 1.00 0.00 H ATOM 1402 HD22 LEU A 106 30.721 -32.899 19.766 1.00 0.00 H ATOM 1403 HD23 LEU A 106 29.492 -33.740 18.789 1.00 0.00 H ATOM 1404 HD11 LEU A 106 28.016 -30.683 17.342 1.00 0.00 H ATOM 1405 HD12 LEU A 106 29.296 -31.637 16.553 1.00 0.00 H ATOM 1406 HD13 LEU A 106 27.950 -32.462 17.376 1.00 0.00 H ATOM 1407 H LEU A 106 29.407 -29.808 21.072 1.00 0.00 H ATOM 1408 N ALA A 107 31.957 -27.978 20.182 1.00 12.84 N ATOM 1409 CA ALA A 107 32.956 -26.905 20.138 1.00 12.89 C ATOM 1410 C ALA A 107 34.102 -27.210 21.102 1.00 13.38 C ATOM 1411 O ALA A 107 35.265 -27.101 20.727 1.00 13.20 O ATOM 1412 CB ALA A 107 32.327 -25.548 20.442 1.00 13.30 C ATOM 1413 HA ALA A 107 33.360 -26.856 19.127 1.00 0.00 H ATOM 1414 HB1 ALA A 107 31.554 -25.333 19.704 1.00 0.00 H ATOM 1415 HB2 ALA A 107 31.884 -25.569 21.438 1.00 0.00 H ATOM 1416 HB3 ALA A 107 33.095 -24.776 20.401 1.00 0.00 H ATOM 1417 H ALA A 107 30.988 -27.769 20.495 1.00 0.00 H ATOM 1418 N SER A 108 33.779 -27.612 22.328 1.00 13.46 N ATOM 1419 CA SER A 108 34.798 -27.908 23.339 1.00 14.06 C ATOM 1420 C SER A 108 35.725 -29.026 22.907 1.00 14.00 C ATOM 1421 O SER A 108 36.920 -28.986 23.188 1.00 14.79 O ATOM 1422 CB SER A 108 34.151 -28.291 24.668 1.00 13.97 C ATOM 1423 OG SER A 108 33.362 -27.231 25.176 1.00 16.08 O ATOM 1424 HA SER A 108 35.385 -26.998 23.460 1.00 0.00 H ATOM 1425 HB2 SER A 108 34.933 -28.530 25.389 1.00 0.00 H ATOM 1426 HB3 SER A 108 33.518 -29.165 24.517 1.00 0.00 H ATOM 1427 HG SER A 108 32.647 -27.013 24.527 1.00 0.00 H ATOM 1428 H SER A 108 32.775 -27.719 22.576 1.00 0.00 H ATOM 1429 N GLN A 109 35.178 -30.025 22.224 1.00 13.84 N ATOM 1430 CA GLN A 109 35.942 -31.189 21.822 1.00 14.59 C ATOM 1431 C GLN A 109 36.697 -31.001 20.514 1.00 14.47 C ATOM 1432 O GLN A 109 37.807 -31.519 20.371 1.00 15.25 O ATOM 1433 CB GLN A 109 35.019 -32.397 21.669 1.00 14.64 C ATOM 1434 CG GLN A 109 34.419 -32.885 22.975 1.00 15.48 C ATOM 1435 CD GLN A 109 33.485 -34.064 22.768 1.00 17.42 C ATOM 1436 OE1 GLN A 109 33.928 -35.200 22.644 1.00 19.95 O ATOM 1437 NE2 GLN A 109 32.191 -33.796 22.720 1.00 18.92 N ATOM 1438 HA GLN A 109 36.677 -31.347 22.611 1.00 0.00 H ATOM 1439 HB2 GLN A 109 34.204 -32.124 20.998 1.00 0.00 H ATOM 1440 HB3 GLN A 109 35.592 -33.213 21.229 1.00 0.00 H ATOM 1441 HG2 GLN A 109 35.226 -33.188 23.642 1.00 0.00 H ATOM 1442 HG3 GLN A 109 33.860 -32.069 23.432 1.00 0.00 H ATOM 1443 HE22 GLN A 109 31.858 -32.817 22.830 1.00 0.00 H ATOM 1444 HE21 GLN A 109 31.506 -34.564 22.572 1.00 0.00 H ATOM 1445 H GLN A 109 34.171 -29.970 21.970 1.00 0.00 H ATOM 1446 N PHE A 110 36.102 -30.298 19.548 1.00 14.26 N ATOM 1447 CA PHE A 110 36.576 -30.384 18.160 1.00 14.22 C ATOM 1448 C PHE A 110 36.913 -29.070 17.467 1.00 14.20 C ATOM 1449 O PHE A 110 37.409 -29.090 16.342 1.00 14.84 O ATOM 1450 CB PHE A 110 35.565 -31.169 17.312 1.00 14.31 C ATOM 1451 CG PHE A 110 35.262 -32.533 17.853 1.00 14.54 C ATOM 1452 CD1 PHE A 110 36.277 -33.459 18.034 1.00 15.31 C ATOM 1453 CD2 PHE A 110 33.969 -32.886 18.216 1.00 15.41 C ATOM 1454 CE1 PHE A 110 36.004 -34.716 18.549 1.00 16.32 C ATOM 1455 CE2 PHE A 110 33.693 -34.142 18.733 1.00 15.92 C ATOM 1456 CZ PHE A 110 34.710 -35.057 18.901 1.00 15.95 C ATOM 1457 HA PHE A 110 37.533 -30.900 18.239 1.00 0.00 H ATOM 1458 HB2 PHE A 110 34.636 -30.601 17.268 1.00 0.00 H ATOM 1459 HB3 PHE A 110 35.970 -31.279 16.306 1.00 0.00 H ATOM 1460 HD2 PHE A 110 33.160 -32.166 18.093 1.00 0.00 H ATOM 1461 HE2 PHE A 110 32.672 -34.406 19.007 1.00 0.00 H ATOM 1462 HZ PHE A 110 34.496 -36.045 19.309 1.00 0.00 H ATOM 1463 HE1 PHE A 110 36.811 -35.438 18.677 1.00 0.00 H ATOM 1464 HD1 PHE A 110 37.301 -33.196 17.768 1.00 0.00 H ATOM 1465 H PHE A 110 35.295 -29.684 19.780 1.00 0.00 H ATOM 1466 N SER A 111 36.656 -27.930 18.102 1.00 13.83 N ATOM 1467 CA SER A 111 36.975 -26.662 17.462 1.00 13.88 C ATOM 1468 C SER A 111 38.478 -26.416 17.454 1.00 14.55 C ATOM 1469 O SER A 111 39.114 -26.522 18.497 1.00 14.61 O ATOM 1470 CB SER A 111 36.293 -25.501 18.176 1.00 13.74 C ATOM 1471 OG SER A 111 36.565 -24.285 17.500 1.00 12.54 O ATOM 1472 HA SER A 111 36.611 -26.721 16.436 1.00 0.00 H ATOM 1473 HB2 SER A 111 36.666 -25.437 19.198 1.00 0.00 H ATOM 1474 HB3 SER A 111 35.216 -25.671 18.194 1.00 0.00 H ATOM 1475 HG SER A 111 36.117 -23.539 17.972 1.00 0.00 H ATOM 1476 H SER A 111 36.230 -27.944 19.050 1.00 0.00 H ATOM 1477 N ASP A 112 39.014 -26.056 16.285 1.00 15.09 N ATOM 1478 CA ASP A 112 40.441 -25.707 16.109 1.00 15.66 C ATOM 1479 C ASP A 112 40.724 -24.254 16.501 1.00 16.63 C ATOM 1480 O ASP A 112 41.568 -23.593 15.912 1.00 18.11 O ATOM 1481 CB ASP A 112 40.869 -25.916 14.645 1.00 15.27 C ATOM 1482 CG ASP A 112 41.077 -27.367 14.286 1.00 15.05 C ATOM 1483 OD1 ASP A 112 41.776 -28.085 15.025 1.00 15.19 O ATOM 1484 OD2 ASP A 112 40.563 -27.795 13.234 1.00 15.07 O ATOM 1485 HA ASP A 112 41.012 -26.364 16.765 1.00 0.00 H ATOM 1486 HB2 ASP A 112 40.095 -25.506 13.996 1.00 0.00 H ATOM 1487 HB3 ASP A 112 41.803 -25.380 14.477 1.00 0.00 H ATOM 1488 H ASP A 112 38.393 -26.019 15.451 1.00 0.00 H ATOM 1489 N CYS A 113 40.001 -23.752 17.492 1.00 17.54 N ATOM 1490 CA CYS A 113 40.179 -22.395 17.994 1.00 17.36 C ATOM 1491 C CYS A 113 40.381 -22.494 19.496 1.00 17.60 C ATOM 1492 O CYS A 113 39.787 -23.359 20.147 1.00 17.52 O ATOM 1493 CB CYS A 113 38.944 -21.541 17.687 1.00 17.68 C ATOM 1494 SG CYS A 113 39.042 -19.814 18.238 1.00 19.08 S ATOM 1495 HA CYS A 113 41.036 -21.922 17.515 1.00 0.00 H ATOM 1496 HB2 CYS A 113 38.085 -22.002 18.174 1.00 0.00 H ATOM 1497 HB3 CYS A 113 38.792 -21.543 16.608 1.00 0.00 H ATOM 1498 HG CYS A 113 40.111 -19.196 17.622 1.00 0.00 H ATOM 1499 H CYS A 113 39.274 -24.353 17.931 1.00 0.00 H ATOM 1500 N SER A 114 41.214 -21.611 20.043 1.00 17.65 N ATOM 1501 CA SER A 114 41.444 -21.543 21.484 1.00 17.82 C ATOM 1502 C SER A 114 40.157 -21.290 22.277 1.00 16.93 C ATOM 1503 O SER A 114 40.084 -21.611 23.466 1.00 17.68 O ATOM 1504 CB SER A 114 42.475 -20.450 21.807 1.00 18.16 C ATOM 1505 OG SER A 114 42.044 -19.183 21.339 1.00 21.26 O ATOM 1506 HA SER A 114 41.827 -22.517 21.788 1.00 0.00 H ATOM 1507 HB2 SER A 114 43.422 -20.702 21.330 1.00 0.00 H ATOM 1508 HB3 SER A 114 42.615 -20.401 22.887 1.00 0.00 H ATOM 1509 HG SER A 114 41.919 -19.220 20.358 1.00 0.00 H ATOM 1510 H SER A 114 41.719 -20.946 19.423 1.00 0.00 H ATOM 1511 N SER A 115 39.145 -20.721 21.622 1.00 15.76 N ATOM 1512 CA SER A 115 37.836 -20.519 22.248 1.00 15.22 C ATOM 1513 C SER A 115 37.113 -21.827 22.584 1.00 14.70 C ATOM 1514 O SER A 115 36.115 -21.803 23.301 1.00 14.08 O ATOM 1515 CB SER A 115 36.947 -19.656 21.355 1.00 15.28 C ATOM 1516 OG SER A 115 36.713 -20.304 20.124 1.00 15.86 O ATOM 1517 HA SER A 115 38.027 -20.010 23.193 1.00 0.00 H ATOM 1518 HB2 SER A 115 37.440 -18.701 21.171 1.00 0.00 H ATOM 1519 HB3 SER A 115 35.995 -19.481 21.856 1.00 0.00 H ATOM 1520 HG SER A 115 36.263 -21.170 20.289 1.00 0.00 H ATOM 1521 H SER A 115 39.289 -20.412 20.639 1.00 0.00 H ATOM 1522 N ALA A 116 37.609 -22.961 22.092 1.00 14.01 N ATOM 1523 CA ALA A 116 37.053 -24.259 22.443 1.00 13.85 C ATOM 1524 C ALA A 116 36.974 -24.423 23.962 1.00 13.99 C ATOM 1525 O ALA A 116 36.025 -25.021 24.466 1.00 14.01 O ATOM 1526 CB ALA A 116 37.876 -25.389 21.825 1.00 13.77 C ATOM 1527 HA ALA A 116 36.042 -24.312 22.039 1.00 0.00 H ATOM 1528 HB1 ALA A 116 37.873 -25.287 20.740 1.00 0.00 H ATOM 1529 HB2 ALA A 116 38.900 -25.334 22.194 1.00 0.00 H ATOM 1530 HB3 ALA A 116 37.439 -26.348 22.103 1.00 0.00 H ATOM 1531 H ALA A 116 38.417 -22.917 21.438 1.00 0.00 H ATOM 1532 N LYS A 117 37.957 -23.876 24.683 1.00 14.48 N ATOM 1533 CA LYS A 117 38.004 -23.994 26.143 1.00 15.05 C ATOM 1534 C LYS A 117 36.863 -23.263 26.832 1.00 14.62 C ATOM 1535 O LYS A 117 36.554 -23.559 27.988 1.00 14.02 O ATOM 1536 CB LYS A 117 39.328 -23.464 26.693 1.00 15.82 C ATOM 1537 CG LYS A 117 40.565 -24.082 26.105 1.00 18.86 C ATOM 1538 CD LYS A 117 40.624 -25.577 26.291 1.00 21.16 C ATOM 1539 CE LYS A 117 41.623 -26.194 25.327 1.00 22.08 C ATOM 1540 NZ LYS A 117 41.124 -27.422 24.714 1.00 22.94 N ATOM 1541 HA LYS A 117 37.906 -25.058 26.358 1.00 0.00 H ATOM 1542 HB2 LYS A 117 39.365 -22.391 26.504 1.00 0.00 H ATOM 1543 HB3 LYS A 117 39.341 -23.643 27.768 1.00 0.00 H ATOM 1544 HG2 LYS A 117 40.589 -23.864 25.037 1.00 0.00 H ATOM 1545 HG3 LYS A 117 41.437 -23.638 26.585 1.00 0.00 H ATOM 1546 HD2 LYS A 117 40.927 -25.800 27.314 1.00 0.00 H ATOM 1547 HD3 LYS A 117 39.637 -26.001 26.106 1.00 0.00 H ATOM 1548 HE2 LYS A 117 42.539 -26.422 25.871 1.00 0.00 H ATOM 1549 HE3 LYS A 117 41.840 -25.473 24.539 1.00 0.00 H ATOM 1550 HZ1 LYS A 117 40.921 -28.121 25.457 1.00 0.00 H ATOM 1551 HZ2 LYS A 117 40.253 -27.215 24.184 1.00 0.00 H ATOM 1552 HZ3 LYS A 117 41.843 -27.802 24.066 1.00 0.00 H ATOM 1553 H LYS A 117 38.710 -23.351 24.194 1.00 0.00 H ATOM 1554 N ALA A 118 36.257 -22.314 26.121 1.00 14.14 N ATOM 1555 CA ALA A 118 35.100 -21.580 26.606 1.00 14.03 C ATOM 1556 C ALA A 118 33.810 -22.016 25.886 1.00 13.90 C ATOM 1557 O ALA A 118 32.902 -21.206 25.710 1.00 13.57 O ATOM 1558 CB ALA A 118 35.332 -20.074 26.434 1.00 14.46 C ATOM 1559 HA ALA A 118 34.973 -21.805 27.665 1.00 0.00 H ATOM 1560 HB1 ALA A 118 36.213 -19.776 27.002 1.00 0.00 H ATOM 1561 HB2 ALA A 118 35.486 -19.850 25.379 1.00 0.00 H ATOM 1562 HB3 ALA A 118 34.461 -19.529 26.799 1.00 0.00 H ATOM 1563 H ALA A 118 36.628 -22.088 25.176 1.00 0.00 H ATOM 1564 N ARG A 119 33.731 -23.289 25.486 1.00 14.31 N ATOM 1565 CA ARG A 119 32.560 -23.825 24.766 1.00 14.59 C ATOM 1566 C ARG A 119 32.298 -23.070 23.458 1.00 14.55 C ATOM 1567 O ARG A 119 31.166 -23.007 22.968 1.00 14.98 O ATOM 1568 CB ARG A 119 31.308 -23.825 25.668 1.00 15.08 C ATOM 1569 CG ARG A 119 31.422 -24.767 26.839 1.00 16.26 C ATOM 1570 CD ARG A 119 30.278 -24.641 27.847 1.00 17.64 C ATOM 1571 NE ARG A 119 30.442 -25.660 28.885 1.00 19.80 N ATOM 1572 CZ ARG A 119 29.520 -26.541 29.282 1.00 20.33 C ATOM 1573 NH1 ARG A 119 29.836 -27.432 30.213 1.00 20.72 N ATOM 1574 NH2 ARG A 119 28.286 -26.541 28.778 1.00 21.36 N ATOM 1575 HA ARG A 119 32.788 -24.858 24.502 1.00 0.00 H ATOM 1576 HB2 ARG A 119 31.154 -22.815 26.049 1.00 0.00 H ATOM 1577 HB3 ARG A 119 30.448 -24.120 25.067 1.00 0.00 H ATOM 1578 HG2 ARG A 119 31.434 -25.788 26.459 1.00 0.00 H ATOM 1579 HG3 ARG A 119 32.360 -24.562 27.356 1.00 0.00 H ATOM 1580 HD2 ARG A 119 29.325 -24.787 27.339 1.00 0.00 H ATOM 1581 HD3 ARG A 119 30.298 -23.650 28.301 1.00 0.00 H ATOM 1582 HE ARG A 119 31.366 -25.702 29.360 1.00 0.00 H ATOM 1583 HH12 ARG A 119 29.128 -28.124 30.532 1.00 0.00 H ATOM 1584 HH11 ARG A 119 30.791 -27.438 30.624 1.00 0.00 H ATOM 1585 HH22 ARG A 119 27.590 -27.240 29.107 1.00 0.00 H ATOM 1586 HH21 ARG A 119 28.019 -25.842 28.055 1.00 0.00 H ATOM 1587 H ARG A 119 34.527 -23.927 25.690 1.00 0.00 H ATOM 1588 N GLY A 120 33.363 -22.513 22.888 1.00 14.22 N ATOM 1589 CA GLY A 120 33.269 -21.732 21.656 1.00 14.26 C ATOM 1590 C GLY A 120 32.891 -20.274 21.790 1.00 14.47 C ATOM 1591 O GLY A 120 32.884 -19.549 20.798 1.00 14.02 O ATOM 1592 HA3 GLY A 120 32.521 -22.208 21.022 1.00 0.00 H ATOM 1593 HA2 GLY A 120 34.241 -21.775 21.165 1.00 0.00 H ATOM 1594 H GLY A 120 34.294 -22.637 23.334 1.00 0.00 H ATOM 1595 N ASP A 121 32.603 -19.818 23.008 1.00 14.84 N ATOM 1596 CA ASP A 121 32.192 -18.430 23.233 1.00 15.52 C ATOM 1597 C ASP A 121 33.292 -17.436 22.851 1.00 15.69 C ATOM 1598 O ASP A 121 34.440 -17.572 23.290 1.00 16.52 O ATOM 1599 CB ASP A 121 31.799 -18.229 24.702 1.00 15.42 C ATOM 1600 CG ASP A 121 31.387 -16.807 25.018 1.00 16.53 C ATOM 1601 OD1 ASP A 121 30.648 -16.181 24.221 1.00 16.03 O ATOM 1602 OD2 ASP A 121 31.790 -16.317 26.096 1.00 18.40 O ATOM 1603 HA ASP A 121 31.332 -18.237 22.591 1.00 0.00 H ATOM 1604 HB2 ASP A 121 30.964 -18.891 24.932 1.00 0.00 H ATOM 1605 HB3 ASP A 121 32.652 -18.491 25.328 1.00 0.00 H ATOM 1606 H ASP A 121 32.672 -20.464 23.820 1.00 0.00 H ATOM 1607 N LEU A 122 32.926 -16.458 22.022 1.00 15.93 N ATOM 1608 CA LEU A 122 33.821 -15.371 21.609 1.00 16.73 C ATOM 1609 C LEU A 122 33.502 -14.063 22.321 1.00 17.19 C ATOM 1610 O LEU A 122 34.232 -13.085 22.161 1.00 18.09 O ATOM 1611 CB LEU A 122 33.722 -15.151 20.096 1.00 16.59 C ATOM 1612 CG LEU A 122 34.189 -16.330 19.242 1.00 16.88 C ATOM 1613 CD1 LEU A 122 33.860 -16.089 17.771 1.00 17.71 C ATOM 1614 CD2 LEU A 122 35.675 -16.557 19.445 1.00 17.73 C ATOM 1615 HA LEU A 122 34.833 -15.670 21.882 1.00 0.00 H ATOM 1616 HB2 LEU A 122 32.680 -14.947 19.851 1.00 0.00 H ATOM 1617 HB3 LEU A 122 34.331 -14.284 19.839 1.00 0.00 H ATOM 1618 HG LEU A 122 33.659 -17.230 19.555 1.00 0.00 H ATOM 1619 HD21 LEU A 122 36.222 -15.661 19.152 1.00 0.00 H ATOM 1620 HD22 LEU A 122 35.868 -16.774 20.496 1.00 0.00 H ATOM 1621 HD23 LEU A 122 36.000 -17.399 18.833 1.00 0.00 H ATOM 1622 HD11 LEU A 122 32.782 -15.972 17.655 1.00 0.00 H ATOM 1623 HD12 LEU A 122 34.363 -15.184 17.431 1.00 0.00 H ATOM 1624 HD13 LEU A 122 34.200 -16.939 17.180 1.00 0.00 H ATOM 1625 H LEU A 122 31.955 -16.466 21.649 1.00 0.00 H ATOM 1626 N GLY A 123 32.415 -14.033 23.089 1.00 17.69 N ATOM 1627 CA GLY A 123 31.975 -12.812 23.751 1.00 18.01 C ATOM 1628 C GLY A 123 31.227 -11.901 22.800 1.00 18.42 C ATOM 1629 O GLY A 123 30.878 -12.304 21.680 1.00 18.20 O ATOM 1630 HA3 GLY A 123 32.847 -12.283 24.135 1.00 0.00 H ATOM 1631 HA2 GLY A 123 31.318 -13.076 24.579 1.00 0.00 H ATOM 1632 H GLY A 123 31.865 -14.906 23.220 1.00 0.00 H ATOM 1633 N ALA A 124 30.968 -10.675 23.243 1.00 19.01 N ATOM 1634 CA ALA A 124 30.160 -9.728 22.480 1.00 19.57 C ATOM 1635 C ALA A 124 31.045 -8.808 21.650 1.00 19.99 C ATOM 1636 O ALA A 124 32.202 -8.568 21.988 1.00 20.53 O ATOM 1637 CB ALA A 124 29.273 -8.917 23.407 1.00 19.87 C ATOM 1638 HA ALA A 124 29.524 -10.294 21.800 1.00 0.00 H ATOM 1639 HB1 ALA A 124 28.611 -9.588 23.953 1.00 0.00 H ATOM 1640 HB2 ALA A 124 29.895 -8.365 24.112 1.00 0.00 H ATOM 1641 HB3 ALA A 124 28.679 -8.217 22.819 1.00 0.00 H ATOM 1642 H ALA A 124 31.353 -10.381 24.163 1.00 0.00 H ATOM 1643 N PHE A 125 30.490 -8.311 20.552 1.00 20.12 N ATOM 1644 CA PHE A 125 31.231 -7.436 19.648 1.00 20.41 C ATOM 1645 C PHE A 125 30.293 -6.633 18.754 1.00 20.70 C ATOM 1646 O PHE A 125 29.135 -7.001 18.550 1.00 20.47 O ATOM 1647 CB PHE A 125 32.231 -8.243 18.804 1.00 20.43 C ATOM 1648 CG PHE A 125 31.631 -9.456 18.128 1.00 21.08 C ATOM 1649 CD1 PHE A 125 30.975 -9.337 16.906 1.00 20.89 C ATOM 1650 CD2 PHE A 125 31.739 -10.716 18.705 1.00 20.82 C ATOM 1651 CE1 PHE A 125 30.426 -10.458 16.277 1.00 20.92 C ATOM 1652 CE2 PHE A 125 31.195 -11.834 18.083 1.00 20.53 C ATOM 1653 CZ PHE A 125 30.540 -11.704 16.871 1.00 20.32 C ATOM 1654 HA PHE A 125 31.791 -6.728 20.260 1.00 0.00 H ATOM 1655 HB2 PHE A 125 32.637 -7.587 18.034 1.00 0.00 H ATOM 1656 HB3 PHE A 125 33.038 -8.578 19.456 1.00 0.00 H ATOM 1657 HD2 PHE A 125 32.257 -10.829 19.657 1.00 0.00 H ATOM 1658 HE2 PHE A 125 31.285 -12.814 18.551 1.00 0.00 H ATOM 1659 HZ PHE A 125 30.114 -12.581 16.384 1.00 0.00 H ATOM 1660 HE1 PHE A 125 29.910 -10.352 15.323 1.00 0.00 H ATOM 1661 HD1 PHE A 125 30.888 -8.358 16.434 1.00 0.00 H ATOM 1662 H PHE A 125 29.503 -8.551 20.330 1.00 0.00 H ATOM 1663 N SER A 126 30.797 -5.503 18.261 1.00 21.40 N ATOM 1664 CA SER A 126 30.115 -4.738 17.228 1.00 22.12 C ATOM 1665 C SER A 126 30.810 -5.014 15.898 1.00 21.88 C ATOM 1666 O SER A 126 31.815 -5.732 15.843 1.00 21.93 O ATOM 1667 CB SER A 126 30.145 -3.241 17.547 1.00 22.57 C ATOM 1668 OG SER A 126 31.473 -2.780 17.616 1.00 24.62 O ATOM 1669 HA SER A 126 29.069 -5.039 17.176 1.00 0.00 H ATOM 1670 HB2 SER A 126 29.654 -3.068 18.505 1.00 0.00 H ATOM 1671 HB3 SER A 126 29.616 -2.696 16.765 1.00 0.00 H ATOM 1672 HG SER A 126 31.955 -3.271 18.327 1.00 0.00 H ATOM 1673 H SER A 126 31.707 -5.156 18.626 1.00 0.00 H ATOM 1674 N ARG A 127 30.279 -4.442 14.826 1.00 22.13 N ATOM 1675 CA ARG A 127 30.916 -4.563 13.515 1.00 22.19 C ATOM 1676 C ARG A 127 32.239 -3.808 13.482 1.00 22.64 C ATOM 1677 O ARG A 127 32.426 -2.831 14.221 1.00 22.94 O ATOM 1678 CB ARG A 127 30.013 -4.013 12.410 1.00 21.97 C ATOM 1679 CG ARG A 127 28.867 -4.918 12.005 1.00 21.50 C ATOM 1680 CD ARG A 127 28.234 -4.400 10.734 1.00 21.02 C ATOM 1681 NE ARG A 127 27.099 -5.202 10.278 1.00 20.74 N ATOM 1682 CZ ARG A 127 27.180 -6.245 9.451 1.00 20.05 C ATOM 1683 NH1 ARG A 127 28.346 -6.671 8.991 1.00 19.16 N ATOM 1684 NH2 ARG A 127 26.069 -6.878 9.094 1.00 21.00 N ATOM 1685 HA ARG A 127 31.094 -5.624 13.343 1.00 0.00 H ATOM 1686 HB2 ARG A 127 29.592 -3.069 12.756 1.00 0.00 H ATOM 1687 HB3 ARG A 127 30.629 -3.833 11.529 1.00 0.00 H ATOM 1688 HG2 ARG A 127 29.243 -5.927 11.838 1.00 0.00 H ATOM 1689 HG3 ARG A 127 28.121 -4.937 12.800 1.00 0.00 H ATOM 1690 HD2 ARG A 127 28.990 -4.394 9.949 1.00 0.00 H ATOM 1691 HD3 ARG A 127 27.888 -3.382 10.911 1.00 0.00 H ATOM 1692 HE ARG A 127 26.155 -4.938 10.626 1.00 0.00 H ATOM 1693 HH12 ARG A 127 28.384 -7.487 8.347 1.00 0.00 H ATOM 1694 HH11 ARG A 127 29.224 -6.190 9.274 1.00 0.00 H ATOM 1695 HH22 ARG A 127 26.119 -7.693 8.450 1.00 0.00 H ATOM 1696 HH21 ARG A 127 25.149 -6.559 9.459 1.00 0.00 H ATOM 1697 H ARG A 127 29.397 -3.899 14.919 1.00 0.00 H ATOM 1698 N GLY A 128 33.141 -4.268 12.623 1.00 23.27 N ATOM 1699 CA GLY A 128 34.404 -3.587 12.357 1.00 23.95 C ATOM 1700 C GLY A 128 35.610 -4.309 12.914 1.00 24.67 C ATOM 1701 O GLY A 128 36.746 -3.941 12.618 1.00 26.32 O ATOM 1702 HA3 GLY A 128 34.361 -2.593 12.803 1.00 0.00 H ATOM 1703 HA2 GLY A 128 34.525 -3.495 11.278 1.00 0.00 H ATOM 1704 H GLY A 128 32.938 -5.154 12.117 1.00 0.00 H ATOM 1705 N GLN A 129 35.361 -5.357 13.693 1.00 25.00 N ATOM 1706 CA GLN A 129 36.388 -5.990 14.511 1.00 25.39 C ATOM 1707 C GLN A 129 37.029 -7.235 13.885 1.00 25.22 C ATOM 1708 O GLN A 129 38.056 -7.703 14.377 1.00 26.03 O ATOM 1709 CB GLN A 129 35.792 -6.367 15.881 1.00 25.67 C ATOM 1710 CG GLN A 129 35.123 -5.209 16.649 1.00 26.72 C ATOM 1711 CD GLN A 129 34.703 -5.600 18.070 1.00 27.98 C ATOM 1712 OE1 GLN A 129 33.861 -4.948 18.704 1.00 28.74 O ATOM 1713 HA GLN A 129 37.186 -5.253 14.606 1.00 0.00 H ATOM 1714 HB2 GLN A 129 35.043 -7.143 15.721 1.00 0.00 H ATOM 1715 HB3 GLN A 129 36.596 -6.763 16.501 1.00 0.00 H ATOM 1716 HG2 GLN A 129 35.827 -4.379 16.710 1.00 0.00 H ATOM 1717 HG3 GLN A 129 34.237 -4.892 16.099 1.00 0.00 H ATOM 1718 H GLN A 129 34.395 -5.741 13.720 1.00 0.00 H ATOM 1719 N MET A 130 36.450 -7.774 12.810 1.00 25.07 N ATOM 1720 CA MET A 130 36.800 -9.135 12.385 1.00 24.53 C ATOM 1721 C MET A 130 36.628 -9.426 10.890 1.00 23.62 C ATOM 1722 O MET A 130 36.195 -8.574 10.116 1.00 24.11 O ATOM 1723 CB MET A 130 35.934 -10.118 13.169 1.00 24.92 C ATOM 1724 CG MET A 130 34.524 -10.249 12.612 1.00 26.42 C ATOM 1725 SD MET A 130 33.226 -10.124 13.834 1.00 28.86 S ATOM 1726 CE MET A 130 33.352 -8.394 14.286 1.00 28.80 C ATOM 1727 HA MET A 130 37.866 -9.243 12.585 1.00 0.00 H ATOM 1728 HB2 MET A 130 36.410 -11.098 13.142 1.00 0.00 H ATOM 1729 HB3 MET A 130 35.869 -9.776 14.202 1.00 0.00 H ATOM 1730 HG2 MET A 130 34.440 -11.220 12.124 1.00 0.00 H ATOM 1731 HG3 MET A 130 34.375 -9.460 11.875 1.00 0.00 H ATOM 1732 HE1 MET A 130 34.347 -8.195 14.684 1.00 0.00 H ATOM 1733 HE2 MET A 130 33.182 -7.776 13.404 1.00 0.00 H ATOM 1734 HE3 MET A 130 32.603 -8.162 15.043 1.00 0.00 H ATOM 1735 H MET A 130 35.748 -7.228 12.271 1.00 0.00 H ATOM 1736 N GLN A 131 36.947 -10.663 10.512 1.00 22.44 N ATOM 1737 CA GLN A 131 36.822 -11.114 9.129 1.00 21.23 C ATOM 1738 C GLN A 131 35.370 -11.010 8.662 1.00 20.33 C ATOM 1739 O GLN A 131 34.439 -11.416 9.367 1.00 19.24 O ATOM 1740 CB GLN A 131 37.348 -12.542 8.980 1.00 21.25 C ATOM 1741 CG GLN A 131 38.826 -12.689 9.349 1.00 21.38 C ATOM 1742 CD GLN A 131 39.374 -14.077 9.088 1.00 21.78 C ATOM 1743 OE1 GLN A 131 39.706 -14.814 10.017 1.00 22.42 O ATOM 1744 NE2 GLN A 131 39.468 -14.443 7.815 1.00 21.61 N ATOM 1745 HA GLN A 131 37.427 -10.466 8.495 1.00 0.00 H ATOM 1746 HB2 GLN A 131 36.764 -13.195 9.628 1.00 0.00 H ATOM 1747 HB3 GLN A 131 37.218 -12.851 7.943 1.00 0.00 H ATOM 1748 HG2 GLN A 131 39.402 -11.973 8.762 1.00 0.00 H ATOM 1749 HG3 GLN A 131 38.942 -12.465 10.409 1.00 0.00 H ATOM 1750 HE22 GLN A 131 39.176 -13.787 7.062 1.00 0.00 H ATOM 1751 HE21 GLN A 131 39.834 -15.385 7.571 1.00 0.00 H ATOM 1752 H GLN A 131 37.298 -11.331 11.228 1.00 0.00 H ATOM 1753 N LYS A 132 35.178 -10.464 7.467 1.00 19.64 N ATOM 1754 CA LYS A 132 33.854 -10.019 7.041 1.00 19.22 C ATOM 1755 C LYS A 132 32.798 -11.133 6.900 1.00 18.13 C ATOM 1756 O LYS A 132 31.660 -10.919 7.309 1.00 17.91 O ATOM 1757 CB LYS A 132 33.945 -9.188 5.753 1.00 19.62 C ATOM 1758 CG LYS A 132 32.706 -8.365 5.433 1.00 21.30 C ATOM 1759 CD LYS A 132 32.328 -7.343 6.514 1.00 22.99 C ATOM 1760 CE LYS A 132 33.326 -6.205 6.646 1.00 24.24 C ATOM 1761 NZ LYS A 132 32.800 -5.087 7.498 1.00 24.34 N ATOM 1762 HA LYS A 132 33.494 -9.396 7.860 1.00 0.00 H ATOM 1763 HB2 LYS A 132 34.790 -8.506 5.849 1.00 0.00 H ATOM 1764 HB3 LYS A 132 34.123 -9.870 4.922 1.00 0.00 H ATOM 1765 HG2 LYS A 132 32.885 -7.827 4.502 1.00 0.00 H ATOM 1766 HG3 LYS A 132 31.867 -9.048 5.301 1.00 0.00 H ATOM 1767 HD2 LYS A 132 31.354 -6.921 6.265 1.00 0.00 H ATOM 1768 HD3 LYS A 132 32.265 -7.860 7.471 1.00 0.00 H ATOM 1769 HE2 LYS A 132 33.548 -5.815 5.653 1.00 0.00 H ATOM 1770 HE3 LYS A 132 34.241 -6.590 7.097 1.00 0.00 H ATOM 1771 HZ1 LYS A 132 31.930 -4.708 7.072 1.00 0.00 H ATOM 1772 HZ2 LYS A 132 32.592 -5.448 8.451 1.00 0.00 H ATOM 1773 HZ3 LYS A 132 33.515 -4.334 7.559 1.00 0.00 H ATOM 1774 H LYS A 132 35.986 -10.351 6.822 1.00 0.00 H ATOM 1775 N PRO A 133 33.159 -12.301 6.325 1.00 17.25 N ATOM 1776 CA PRO A 133 32.127 -13.345 6.221 1.00 16.72 C ATOM 1777 C PRO A 133 31.601 -13.775 7.587 1.00 16.09 C ATOM 1778 O PRO A 133 30.417 -14.075 7.728 1.00 15.85 O ATOM 1779 CB PRO A 133 32.856 -14.505 5.537 1.00 16.72 C ATOM 1780 CG PRO A 133 33.986 -13.859 4.797 1.00 17.18 C ATOM 1781 CD PRO A 133 34.417 -12.720 5.679 1.00 17.26 C ATOM 1782 HA PRO A 133 31.250 -12.998 5.674 1.00 0.00 H ATOM 1783 HD3 PRO A 133 35.145 -13.052 6.419 1.00 0.00 H ATOM 1784 HD2 PRO A 133 34.844 -11.908 5.090 1.00 0.00 H ATOM 1785 HG3 PRO A 133 33.650 -13.490 3.828 1.00 0.00 H ATOM 1786 HG2 PRO A 133 34.804 -14.564 4.652 1.00 0.00 H ATOM 1787 HB2 PRO A 133 33.234 -15.211 6.276 1.00 0.00 H ATOM 1788 HB3 PRO A 133 32.191 -15.024 4.847 1.00 0.00 H ATOM 1789 N PHE A 134 32.482 -13.805 8.579 1.00 15.54 N ATOM 1790 CA PHE A 134 32.091 -14.146 9.945 1.00 14.96 C ATOM 1791 C PHE A 134 31.215 -13.052 10.541 1.00 14.85 C ATOM 1792 O PHE A 134 30.185 -13.329 11.143 1.00 14.12 O ATOM 1793 CB PHE A 134 33.332 -14.363 10.816 1.00 15.19 C ATOM 1794 CG PHE A 134 33.028 -14.956 12.166 1.00 14.95 C ATOM 1795 CD1 PHE A 134 32.558 -14.160 13.206 1.00 15.26 C ATOM 1796 CD2 PHE A 134 33.225 -16.312 12.401 1.00 15.11 C ATOM 1797 CE1 PHE A 134 32.264 -14.718 14.446 1.00 15.30 C ATOM 1798 CE2 PHE A 134 32.944 -16.871 13.639 1.00 14.69 C ATOM 1799 CZ PHE A 134 32.459 -16.078 14.656 1.00 14.52 C ATOM 1800 HA PHE A 134 31.516 -15.072 9.916 1.00 0.00 H ATOM 1801 HB2 PHE A 134 34.009 -15.035 10.289 1.00 0.00 H ATOM 1802 HB3 PHE A 134 33.821 -13.400 10.965 1.00 0.00 H ATOM 1803 HD2 PHE A 134 33.606 -16.946 11.600 1.00 0.00 H ATOM 1804 HE2 PHE A 134 33.107 -17.936 13.807 1.00 0.00 H ATOM 1805 HZ PHE A 134 32.228 -16.518 15.626 1.00 0.00 H ATOM 1806 HE1 PHE A 134 31.882 -14.090 15.251 1.00 0.00 H ATOM 1807 HD1 PHE A 134 32.419 -13.091 13.048 1.00 0.00 H ATOM 1808 H PHE A 134 33.477 -13.580 8.379 1.00 0.00 H ATOM 1809 N GLU A 135 31.635 -11.799 10.382 1.00 14.85 N ATOM 1810 CA GLU A 135 30.854 -10.664 10.855 1.00 15.00 C ATOM 1811 C GLU A 135 29.458 -10.626 10.225 1.00 14.54 C ATOM 1812 O GLU A 135 28.461 -10.480 10.928 1.00 14.40 O ATOM 1813 CB GLU A 135 31.592 -9.364 10.549 1.00 15.38 C ATOM 1814 CG GLU A 135 30.914 -8.135 11.080 1.00 16.53 C ATOM 1815 CD GLU A 135 31.581 -6.878 10.601 1.00 18.03 C ATOM 1816 OE1 GLU A 135 32.688 -6.589 11.092 1.00 19.76 O ATOM 1817 OE2 GLU A 135 30.991 -6.202 9.732 1.00 18.84 O ATOM 1818 HA GLU A 135 30.729 -10.776 11.932 1.00 0.00 H ATOM 1819 HB2 GLU A 135 32.587 -9.423 10.989 1.00 0.00 H ATOM 1820 HB3 GLU A 135 31.680 -9.266 9.467 1.00 0.00 H ATOM 1821 HG2 GLU A 135 29.876 -8.133 10.747 1.00 0.00 H ATOM 1822 HG3 GLU A 135 30.945 -8.158 12.169 1.00 0.00 H ATOM 1823 H GLU A 135 32.544 -11.626 9.908 1.00 0.00 H ATOM 1824 N ASP A 136 29.389 -10.741 8.899 1.00 14.31 N ATOM 1825 CA ASP A 136 28.111 -10.666 8.199 1.00 14.26 C ATOM 1826 C ASP A 136 27.147 -11.761 8.667 1.00 13.81 C ATOM 1827 O ASP A 136 25.961 -11.506 8.888 1.00 13.63 O ATOM 1828 CB ASP A 136 28.308 -10.741 6.683 1.00 14.44 C ATOM 1829 CG ASP A 136 28.848 -9.448 6.088 1.00 16.36 C ATOM 1830 OD1 ASP A 136 28.787 -8.387 6.747 1.00 18.26 O ATOM 1831 OD2 ASP A 136 29.337 -9.506 4.937 1.00 19.61 O ATOM 1832 HA ASP A 136 27.667 -9.701 8.442 1.00 0.00 H ATOM 1833 HB2 ASP A 136 29.011 -11.545 6.463 1.00 0.00 H ATOM 1834 HB3 ASP A 136 27.347 -10.963 6.218 1.00 0.00 H ATOM 1835 H ASP A 136 30.262 -10.887 8.353 1.00 0.00 H ATOM 1836 N ALA A 137 27.665 -12.973 8.823 1.00 13.71 N ATOM 1837 CA ALA A 137 26.854 -14.083 9.311 1.00 13.44 C ATOM 1838 C ALA A 137 26.362 -13.817 10.734 1.00 13.34 C ATOM 1839 O ALA A 137 25.179 -13.970 11.025 1.00 13.62 O ATOM 1840 CB ALA A 137 27.637 -15.378 9.248 1.00 12.95 C ATOM 1841 HA ALA A 137 25.980 -14.176 8.666 1.00 0.00 H ATOM 1842 HB1 ALA A 137 27.926 -15.576 8.216 1.00 0.00 H ATOM 1843 HB2 ALA A 137 28.530 -15.292 9.867 1.00 0.00 H ATOM 1844 HB3 ALA A 137 27.016 -16.195 9.616 1.00 0.00 H ATOM 1845 H ALA A 137 28.666 -13.134 8.593 1.00 0.00 H ATOM 1846 N SER A 138 27.270 -13.385 11.605 1.00 13.14 N ATOM 1847 CA SER A 138 26.935 -13.115 13.006 1.00 13.73 C ATOM 1848 C SER A 138 25.806 -12.095 13.153 1.00 13.93 C ATOM 1849 O SER A 138 24.873 -12.284 13.940 1.00 15.00 O ATOM 1850 CB SER A 138 28.164 -12.626 13.767 1.00 13.77 C ATOM 1851 OG SER A 138 29.175 -13.613 13.822 1.00 14.11 O ATOM 1852 HA SER A 138 26.588 -14.058 13.430 1.00 0.00 H ATOM 1853 HB2 SER A 138 27.869 -12.365 14.784 1.00 0.00 H ATOM 1854 HB3 SER A 138 28.560 -11.742 13.267 1.00 0.00 H ATOM 1855 HG SER A 138 29.453 -13.851 12.902 1.00 0.00 H ATOM 1856 H SER A 138 28.247 -13.234 11.282 1.00 0.00 H ATOM 1857 N PHE A 139 25.879 -11.016 12.379 1.00 14.44 N ATOM 1858 CA PHE A 139 24.882 -9.954 12.468 1.00 14.97 C ATOM 1859 C PHE A 139 23.577 -10.231 11.718 1.00 15.31 C ATOM 1860 O PHE A 139 22.575 -9.546 11.950 1.00 16.94 O ATOM 1861 CB PHE A 139 25.507 -8.606 12.070 1.00 15.09 C ATOM 1862 CG PHE A 139 26.329 -8.004 13.167 1.00 14.78 C ATOM 1863 CD1 PHE A 139 27.660 -8.340 13.316 1.00 14.61 C ATOM 1864 CD2 PHE A 139 25.745 -7.153 14.099 1.00 14.82 C ATOM 1865 CE1 PHE A 139 28.415 -7.819 14.357 1.00 15.31 C ATOM 1866 CE2 PHE A 139 26.490 -6.634 15.140 1.00 15.20 C ATOM 1867 CZ PHE A 139 27.825 -6.972 15.272 1.00 15.60 C ATOM 1868 HA PHE A 139 24.576 -9.912 13.513 1.00 0.00 H ATOM 1869 HB2 PHE A 139 26.145 -8.761 11.200 1.00 0.00 H ATOM 1870 HB3 PHE A 139 24.706 -7.912 11.813 1.00 0.00 H ATOM 1871 HD2 PHE A 139 24.690 -6.893 14.007 1.00 0.00 H ATOM 1872 HE2 PHE A 139 26.026 -5.958 15.858 1.00 0.00 H ATOM 1873 HZ PHE A 139 28.410 -6.569 16.099 1.00 0.00 H ATOM 1874 HE1 PHE A 139 29.470 -8.078 14.451 1.00 0.00 H ATOM 1875 HD1 PHE A 139 28.124 -9.024 12.606 1.00 0.00 H ATOM 1876 H PHE A 139 26.660 -10.927 11.698 1.00 0.00 H ATOM 1877 N ALA A 140 23.579 -11.247 10.854 1.00 15.41 N ATOM 1878 CA ALA A 140 22.366 -11.677 10.154 1.00 15.39 C ATOM 1879 C ALA A 140 21.593 -12.766 10.915 1.00 15.28 C ATOM 1880 O ALA A 140 20.421 -13.004 10.632 1.00 16.03 O ATOM 1881 CB ALA A 140 22.715 -12.159 8.755 1.00 15.23 C ATOM 1882 HA ALA A 140 21.709 -10.810 10.092 1.00 0.00 H ATOM 1883 HB1 ALA A 140 23.182 -11.347 8.198 1.00 0.00 H ATOM 1884 HB2 ALA A 140 23.407 -12.999 8.823 1.00 0.00 H ATOM 1885 HB3 ALA A 140 21.806 -12.476 8.244 1.00 0.00 H ATOM 1886 H ALA A 140 24.471 -11.750 10.671 1.00 0.00 H ATOM 1887 N LEU A 141 22.243 -13.431 11.868 1.00 15.31 N ATOM 1888 CA LEU A 141 21.570 -14.449 12.673 1.00 15.42 C ATOM 1889 C LEU A 141 20.595 -13.823 13.665 1.00 16.11 C ATOM 1890 O LEU A 141 20.844 -12.738 14.184 1.00 16.84 O ATOM 1891 CB LEU A 141 22.593 -15.278 13.454 1.00 15.13 C ATOM 1892 CG LEU A 141 23.473 -16.233 12.650 1.00 14.24 C ATOM 1893 CD1 LEU A 141 24.627 -16.747 13.504 1.00 14.17 C ATOM 1894 CD2 LEU A 141 22.663 -17.397 12.091 1.00 14.41 C ATOM 1895 HA LEU A 141 21.017 -15.088 11.984 1.00 0.00 H ATOM 1896 HB2 LEU A 141 23.252 -14.582 13.974 1.00 0.00 H ATOM 1897 HB3 LEU A 141 22.045 -15.873 14.185 1.00 0.00 H ATOM 1898 HG LEU A 141 23.884 -15.676 11.808 1.00 0.00 H ATOM 1899 HD21 LEU A 141 22.211 -17.951 12.913 1.00 0.00 H ATOM 1900 HD22 LEU A 141 21.881 -17.012 11.437 1.00 0.00 H ATOM 1901 HD23 LEU A 141 23.320 -18.057 11.525 1.00 0.00 H ATOM 1902 HD11 LEU A 141 25.233 -15.905 13.839 1.00 0.00 H ATOM 1903 HD12 LEU A 141 24.229 -17.277 14.370 1.00 0.00 H ATOM 1904 HD13 LEU A 141 25.241 -17.426 12.912 1.00 0.00 H ATOM 1905 H LEU A 141 23.247 -13.223 12.043 1.00 0.00 H ATOM 1906 N ARG A 142 19.505 -14.540 13.942 1.00 16.91 N ATOM 1907 CA ARG A 142 18.603 -14.209 15.040 1.00 17.21 C ATOM 1908 C ARG A 142 19.176 -14.763 16.344 1.00 17.44 C ATOM 1909 O ARG A 142 20.022 -15.665 16.338 1.00 17.24 O ATOM 1910 CB ARG A 142 17.212 -14.808 14.798 1.00 17.69 C ATOM 1911 CG ARG A 142 16.575 -14.452 13.464 1.00 18.94 C ATOM 1912 CD ARG A 142 16.402 -12.961 13.275 1.00 21.75 C ATOM 1913 HA ARG A 142 18.508 -13.125 15.103 1.00 0.00 H ATOM 1914 HB2 ARG A 142 17.298 -15.893 14.851 1.00 0.00 H ATOM 1915 HB3 ARG A 142 16.551 -14.458 15.591 1.00 0.00 H ATOM 1916 HG2 ARG A 142 17.208 -14.834 12.663 1.00 0.00 H ATOM 1917 HG3 ARG A 142 15.595 -14.926 13.408 1.00 0.00 H ATOM 1918 HD2 ARG A 142 15.762 -12.568 14.065 1.00 0.00 H ATOM 1919 HD3 ARG A 142 17.377 -12.475 13.319 1.00 0.00 H ATOM 1920 H ARG A 142 19.289 -15.368 13.351 1.00 0.00 H ATOM 1921 N THR A 143 18.708 -14.242 17.473 1.00 17.98 N ATOM 1922 CA THR A 143 19.144 -14.760 18.765 1.00 18.26 C ATOM 1923 C THR A 143 18.794 -16.236 18.877 1.00 17.67 C ATOM 1924 O THR A 143 17.649 -16.638 18.648 1.00 18.13 O ATOM 1925 CB THR A 143 18.507 -13.996 19.933 1.00 18.54 C ATOM 1926 OG1 THR A 143 18.869 -12.615 19.841 1.00 20.78 O ATOM 1927 CG2 THR A 143 18.975 -14.558 21.271 1.00 19.37 C ATOM 1928 HA THR A 143 20.224 -14.626 18.823 1.00 0.00 H ATOM 1929 HB THR A 143 17.424 -14.106 19.875 1.00 0.00 H ATOM 1930 HG1 THR A 143 18.460 -12.117 20.593 1.00 0.00 H ATOM 1931 HG23 THR A 143 18.698 -15.610 21.339 1.00 0.00 H ATOM 1932 HG21 THR A 143 20.058 -14.461 21.346 1.00 0.00 H ATOM 1933 HG22 THR A 143 18.502 -14.004 22.082 1.00 0.00 H ATOM 1934 H THR A 143 18.025 -13.458 17.435 1.00 0.00 H ATOM 1935 N GLY A 144 19.798 -17.044 19.196 1.00 17.02 N ATOM 1936 CA GLY A 144 19.632 -18.483 19.302 1.00 16.54 C ATOM 1937 C GLY A 144 19.808 -19.239 17.999 1.00 15.97 C ATOM 1938 O GLY A 144 19.820 -20.461 17.998 1.00 16.61 O ATOM 1939 HA3 GLY A 144 18.628 -18.683 19.678 1.00 0.00 H ATOM 1940 HA2 GLY A 144 20.367 -18.858 20.014 1.00 0.00 H ATOM 1941 H GLY A 144 20.736 -16.632 19.376 1.00 0.00 H ATOM 1942 N GLU A 145 19.944 -18.522 16.883 1.00 15.08 N ATOM 1943 CA GLU A 145 20.051 -19.163 15.576 1.00 14.77 C ATOM 1944 C GLU A 145 21.494 -19.558 15.286 1.00 14.12 C ATOM 1945 O GLU A 145 22.444 -18.913 15.747 1.00 14.32 O ATOM 1946 CB GLU A 145 19.521 -18.249 14.465 1.00 14.73 C ATOM 1947 CG GLU A 145 19.378 -18.933 13.092 1.00 15.79 C ATOM 1948 CD GLU A 145 18.909 -17.992 11.991 1.00 17.53 C ATOM 1949 OE1 GLU A 145 18.866 -16.763 12.226 1.00 18.03 O ATOM 1950 OE2 GLU A 145 18.604 -18.492 10.880 1.00 18.97 O ATOM 1951 HA GLU A 145 19.438 -20.064 15.599 1.00 0.00 H ATOM 1952 HB2 GLU A 145 18.541 -17.879 14.766 1.00 0.00 H ATOM 1953 HB3 GLU A 145 20.207 -17.409 14.358 1.00 0.00 H ATOM 1954 HG2 GLU A 145 20.347 -19.342 12.807 1.00 0.00 H ATOM 1955 HG3 GLU A 145 18.656 -19.744 13.184 1.00 0.00 H ATOM 1956 H GLU A 145 19.974 -17.484 16.945 1.00 0.00 H ATOM 1957 N MET A 146 21.630 -20.634 14.522 1.00 13.95 N ATOM 1958 CA MET A 146 22.922 -21.163 14.131 1.00 13.28 C ATOM 1959 C MET A 146 23.110 -21.046 12.626 1.00 12.92 C ATOM 1960 O MET A 146 22.178 -21.241 11.838 1.00 13.44 O ATOM 1961 CB MET A 146 23.029 -22.626 14.563 1.00 13.55 C ATOM 1962 CG MET A 146 24.398 -23.257 14.400 1.00 14.09 C ATOM 1963 SD MET A 146 24.414 -24.983 14.916 1.00 14.81 S ATOM 1964 CE MET A 146 23.463 -25.768 13.615 1.00 16.44 C ATOM 1965 HA MET A 146 23.705 -20.585 14.622 1.00 0.00 H ATOM 1966 HB2 MET A 146 22.755 -22.686 15.616 1.00 0.00 H ATOM 1967 HB3 MET A 146 22.320 -23.204 13.970 1.00 0.00 H ATOM 1968 HG2 MET A 146 25.115 -22.702 15.005 1.00 0.00 H ATOM 1969 HG3 MET A 146 24.689 -23.201 13.351 1.00 0.00 H ATOM 1970 HE1 MET A 146 22.462 -25.338 13.589 1.00 0.00 H ATOM 1971 HE2 MET A 146 23.956 -25.603 12.657 1.00 0.00 H ATOM 1972 HE3 MET A 146 23.396 -26.838 13.811 1.00 0.00 H ATOM 1973 H MET A 146 20.772 -21.119 14.189 1.00 0.00 H ATOM 1974 N SER A 147 24.337 -20.733 12.231 1.00 12.25 N ATOM 1975 CA SER A 147 24.674 -20.602 10.821 1.00 11.48 C ATOM 1976 C SER A 147 24.848 -21.970 10.168 1.00 11.42 C ATOM 1977 O SER A 147 24.922 -22.996 10.846 1.00 11.63 O ATOM 1978 CB SER A 147 25.975 -19.807 10.654 1.00 11.18 C ATOM 1979 OG SER A 147 27.110 -20.595 10.989 1.00 11.51 O ATOM 1980 HA SER A 147 23.852 -20.075 10.335 1.00 0.00 H ATOM 1981 HB2 SER A 147 25.944 -18.934 11.306 1.00 0.00 H ATOM 1982 HB3 SER A 147 26.062 -19.482 9.617 1.00 0.00 H ATOM 1983 HG SER A 147 27.147 -21.387 10.397 1.00 0.00 H ATOM 1984 H SER A 147 25.076 -20.577 12.946 1.00 0.00 H ATOM 1985 N GLY A 148 24.934 -21.970 8.842 1.00 11.26 N ATOM 1986 CA GLY A 148 25.510 -23.090 8.115 1.00 11.72 C ATOM 1987 C GLY A 148 27.022 -22.930 8.100 1.00 11.82 C ATOM 1988 O GLY A 148 27.587 -22.135 8.869 1.00 12.07 O ATOM 1989 HA3 GLY A 148 25.131 -23.099 7.093 1.00 0.00 H ATOM 1990 HA2 GLY A 148 25.244 -24.025 8.608 1.00 0.00 H ATOM 1991 H GLY A 148 24.581 -21.149 8.311 1.00 0.00 H ATOM 1992 N PRO A 149 27.706 -23.678 7.227 1.00 11.95 N ATOM 1993 CA PRO A 149 29.156 -23.501 7.110 1.00 12.39 C ATOM 1994 C PRO A 149 29.488 -22.098 6.636 1.00 12.81 C ATOM 1995 O PRO A 149 28.934 -21.654 5.640 1.00 13.52 O ATOM 1996 CB PRO A 149 29.561 -24.544 6.062 1.00 12.44 C ATOM 1997 CG PRO A 149 28.428 -25.536 6.050 1.00 13.37 C ATOM 1998 CD PRO A 149 27.197 -24.758 6.364 1.00 12.33 C ATOM 1999 HA PRO A 149 29.680 -23.629 8.057 1.00 0.00 H ATOM 2000 HD3 PRO A 149 26.744 -24.356 5.458 1.00 0.00 H ATOM 2001 HD2 PRO A 149 26.468 -25.372 6.892 1.00 0.00 H ATOM 2002 HG3 PRO A 149 28.591 -26.307 6.803 1.00 0.00 H ATOM 2003 HG2 PRO A 149 28.342 -26.001 5.068 1.00 0.00 H ATOM 2004 HB2 PRO A 149 29.676 -24.080 5.082 1.00 0.00 H ATOM 2005 HB3 PRO A 149 30.495 -25.030 6.344 1.00 0.00 H ATOM 2006 N VAL A 150 30.348 -21.400 7.371 1.00 12.75 N ATOM 2007 CA VAL A 150 30.793 -20.067 6.990 1.00 13.09 C ATOM 2008 C VAL A 150 32.297 -20.106 6.759 1.00 13.26 C ATOM 2009 O VAL A 150 33.059 -20.516 7.620 1.00 13.09 O ATOM 2010 CB VAL A 150 30.425 -19.026 8.055 1.00 13.05 C ATOM 2011 CG1 VAL A 150 31.001 -17.663 7.699 1.00 14.01 C ATOM 2012 CG2 VAL A 150 28.910 -18.933 8.206 1.00 13.51 C ATOM 2013 HA VAL A 150 30.288 -19.767 6.072 1.00 0.00 H ATOM 2014 HB VAL A 150 30.854 -19.344 9.005 1.00 0.00 H ATOM 2015 HG11 VAL A 150 32.087 -17.734 7.636 1.00 0.00 H ATOM 2016 HG12 VAL A 150 30.600 -17.340 6.738 1.00 0.00 H ATOM 2017 HG13 VAL A 150 30.727 -16.942 8.469 1.00 0.00 H ATOM 2018 HG21 VAL A 150 28.469 -18.639 7.254 1.00 0.00 H ATOM 2019 HG22 VAL A 150 28.516 -19.904 8.506 1.00 0.00 H ATOM 2020 HG23 VAL A 150 28.667 -18.190 8.965 1.00 0.00 H ATOM 2021 H VAL A 150 30.716 -21.820 8.248 1.00 0.00 H ATOM 2022 N PHE A 151 32.707 -19.683 5.568 1.00 13.50 N ATOM 2023 CA PHE A 151 34.090 -19.793 5.139 1.00 13.79 C ATOM 2024 C PHE A 151 34.836 -18.490 5.375 1.00 13.95 C ATOM 2025 O PHE A 151 34.351 -17.414 5.019 1.00 14.82 O ATOM 2026 CB PHE A 151 34.133 -20.151 3.651 1.00 13.71 C ATOM 2027 CG PHE A 151 33.529 -21.492 3.322 1.00 14.80 C ATOM 2028 CD1 PHE A 151 32.150 -21.654 3.267 1.00 15.02 C ATOM 2029 CD2 PHE A 151 34.332 -22.583 3.042 1.00 15.91 C ATOM 2030 CE1 PHE A 151 31.585 -22.894 2.953 1.00 15.45 C ATOM 2031 CE2 PHE A 151 33.767 -23.821 2.733 1.00 17.44 C ATOM 2032 CZ PHE A 151 32.394 -23.965 2.693 1.00 16.79 C ATOM 2033 HA PHE A 151 34.575 -20.576 5.722 1.00 0.00 H ATOM 2034 HB2 PHE A 151 33.588 -19.385 3.099 1.00 0.00 H ATOM 2035 HB3 PHE A 151 35.175 -20.157 3.330 1.00 0.00 H ATOM 2036 HD2 PHE A 151 35.416 -22.475 3.063 1.00 0.00 H ATOM 2037 HE2 PHE A 151 34.410 -24.676 2.523 1.00 0.00 H ATOM 2038 HZ PHE A 151 31.955 -24.934 2.454 1.00 0.00 H ATOM 2039 HE1 PHE A 151 30.501 -23.006 2.916 1.00 0.00 H ATOM 2040 HD1 PHE A 151 31.500 -20.803 3.471 1.00 0.00 H ATOM 2041 H PHE A 151 32.013 -19.258 4.920 1.00 0.00 H ATOM 2042 N THR A 152 36.004 -18.595 6.003 1.00 14.16 N ATOM 2043 CA THR A 152 36.918 -17.459 6.147 1.00 14.64 C ATOM 2044 C THR A 152 38.339 -17.903 5.823 1.00 14.97 C ATOM 2045 O THR A 152 38.587 -19.072 5.519 1.00 14.81 O ATOM 2046 CB THR A 152 36.905 -16.866 7.579 1.00 14.71 C ATOM 2047 OG1 THR A 152 37.525 -17.782 8.484 1.00 15.05 O ATOM 2048 CG2 THR A 152 35.490 -16.545 8.048 1.00 14.82 C ATOM 2049 HA THR A 152 36.579 -16.687 5.456 1.00 0.00 H ATOM 2050 HB THR A 152 37.464 -15.930 7.560 1.00 0.00 H ATOM 2051 HG1 THR A 152 37.028 -18.638 8.478 1.00 0.00 H ATOM 2052 HG23 THR A 152 35.027 -15.846 7.351 1.00 0.00 H ATOM 2053 HG21 THR A 152 34.904 -17.463 8.086 1.00 0.00 H ATOM 2054 HG22 THR A 152 35.531 -16.097 9.041 1.00 0.00 H ATOM 2055 H THR A 152 36.278 -19.514 6.405 1.00 0.00 H ATOM 2056 N ASP A 153 39.281 -16.965 5.903 1.00 15.32 N ATOM 2057 CA ASP A 153 40.693 -17.305 5.750 1.00 15.88 C ATOM 2058 C ASP A 153 41.186 -18.224 6.858 1.00 15.60 C ATOM 2059 O ASP A 153 42.217 -18.871 6.699 1.00 16.14 O ATOM 2060 CB ASP A 153 41.571 -16.050 5.718 1.00 16.28 C ATOM 2061 CG ASP A 153 41.348 -15.203 4.488 1.00 18.91 C ATOM 2062 OD1 ASP A 153 40.924 -15.753 3.453 1.00 20.38 O ATOM 2063 OD2 ASP A 153 41.607 -13.977 4.557 1.00 22.89 O ATOM 2064 HA ASP A 153 40.775 -17.830 4.798 1.00 0.00 H ATOM 2065 HB2 ASP A 153 41.349 -15.448 6.599 1.00 0.00 H ATOM 2066 HB3 ASP A 153 42.617 -16.357 5.743 1.00 0.00 H ATOM 2067 H ASP A 153 39.007 -15.977 6.077 1.00 0.00 H ATOM 2068 N SER A 154 40.464 -18.281 7.981 1.00 15.25 N ATOM 2069 CA SER A 154 40.850 -19.148 9.092 1.00 15.03 C ATOM 2070 C SER A 154 40.475 -20.609 8.881 1.00 14.69 C ATOM 2071 O SER A 154 41.129 -21.493 9.416 1.00 14.77 O ATOM 2072 CB SER A 154 40.224 -18.669 10.397 1.00 15.19 C ATOM 2073 OG SER A 154 40.584 -17.331 10.657 1.00 16.54 O ATOM 2074 HA SER A 154 41.937 -19.087 9.143 1.00 0.00 H ATOM 2075 HB2 SER A 154 40.573 -19.300 11.215 1.00 0.00 H ATOM 2076 HB3 SER A 154 39.139 -18.740 10.322 1.00 0.00 H ATOM 2077 HG SER A 154 41.569 -17.264 10.729 1.00 0.00 H ATOM 2078 H SER A 154 39.609 -17.695 8.066 1.00 0.00 H ATOM 2079 N GLY A 155 39.417 -20.853 8.112 1.00 14.29 N ATOM 2080 CA GLY A 155 38.862 -22.191 7.952 1.00 14.20 C ATOM 2081 C GLY A 155 37.367 -22.121 7.739 1.00 13.43 C ATOM 2082 O GLY A 155 36.872 -21.196 7.096 1.00 14.65 O ATOM 2083 HA3 GLY A 155 39.070 -22.776 8.848 1.00 0.00 H ATOM 2084 HA2 GLY A 155 39.325 -22.671 7.090 1.00 0.00 H ATOM 2085 H GLY A 155 38.970 -20.061 7.607 1.00 0.00 H ATOM 2086 N ILE A 156 36.653 -23.115 8.261 1.00 13.05 N ATOM 2087 CA ILE A 156 35.199 -23.188 8.113 1.00 12.43 C ATOM 2088 C ILE A 156 34.582 -23.165 9.508 1.00 12.03 C ATOM 2089 O ILE A 156 35.026 -23.894 10.391 1.00 12.13 O ATOM 2090 CB ILE A 156 34.754 -24.462 7.355 1.00 12.61 C ATOM 2091 CG1 ILE A 156 35.554 -24.645 6.056 1.00 13.41 C ATOM 2092 CG2 ILE A 156 33.265 -24.396 7.028 1.00 13.21 C ATOM 2093 CD1 ILE A 156 35.285 -25.958 5.387 1.00 14.53 C ATOM 2094 HA ILE A 156 34.860 -22.337 7.523 1.00 0.00 H ATOM 2095 HB ILE A 156 34.945 -25.315 8.006 1.00 0.00 H ATOM 2096 HG12 ILE A 156 35.289 -23.843 5.368 1.00 0.00 H ATOM 2097 HG13 ILE A 156 36.617 -24.585 6.290 1.00 0.00 H ATOM 2098 HD11 ILE A 156 35.555 -26.770 6.062 1.00 0.00 H ATOM 2099 HD12 ILE A 156 34.226 -26.027 5.139 1.00 0.00 H ATOM 2100 HD13 ILE A 156 35.879 -26.028 4.476 1.00 0.00 H ATOM 2101 HG21 ILE A 156 32.694 -24.316 7.953 1.00 0.00 H ATOM 2102 HG22 ILE A 156 33.070 -23.525 6.403 1.00 0.00 H ATOM 2103 HG23 ILE A 156 32.971 -25.300 6.495 1.00 0.00 H ATOM 2104 H ILE A 156 37.144 -23.863 8.791 1.00 0.00 H ATOM 2105 N HIS A 157 33.569 -22.316 9.680 1.00 12.08 N ATOM 2106 CA HIS A 157 32.957 -22.044 10.979 1.00 12.21 C ATOM 2107 C HIS A 157 31.496 -22.471 11.010 1.00 11.96 C ATOM 2108 O HIS A 157 30.787 -22.349 10.010 1.00 12.11 O ATOM 2109 CB HIS A 157 32.977 -20.542 11.300 1.00 12.32 C ATOM 2110 CG HIS A 157 34.324 -19.897 11.182 1.00 13.37 C ATOM 2111 ND1 HIS A 157 35.081 -19.559 12.283 1.00 14.16 N ATOM 2112 CD2 HIS A 157 35.036 -19.504 10.099 1.00 14.35 C ATOM 2113 CE1 HIS A 157 36.203 -18.984 11.880 1.00 14.53 C ATOM 2114 NE2 HIS A 157 36.204 -18.947 10.560 1.00 14.62 N ATOM 2115 HA HIS A 157 33.540 -22.608 11.707 1.00 0.00 H ATOM 2116 HB2 HIS A 157 32.297 -20.038 10.613 1.00 0.00 H ATOM 2117 HB3 HIS A 157 32.624 -20.408 12.322 1.00 0.00 H ATOM 2118 HD2 HIS A 157 34.738 -19.610 9.056 1.00 0.00 H ATOM 2119 HE1 HIS A 157 36.993 -18.605 12.528 1.00 0.00 H ATOM 2120 H HIS A 157 33.194 -21.821 8.846 1.00 0.00 H ATOM 2121 N ILE A 158 31.060 -22.934 12.179 1.00 11.48 N ATOM 2122 CA ILE A 158 29.649 -22.945 12.549 1.00 11.62 C ATOM 2123 C ILE A 158 29.516 -21.855 13.609 1.00 11.30 C ATOM 2124 O ILE A 158 30.270 -21.856 14.598 1.00 11.52 O ATOM 2125 CB ILE A 158 29.202 -24.291 13.139 1.00 11.45 C ATOM 2126 CG1 ILE A 158 29.546 -25.454 12.199 1.00 12.21 C ATOM 2127 CG2 ILE A 158 27.703 -24.272 13.457 1.00 13.14 C ATOM 2128 CD1 ILE A 158 29.470 -26.802 12.875 1.00 12.72 C ATOM 2129 HA ILE A 158 29.023 -22.781 11.672 1.00 0.00 H ATOM 2130 HB ILE A 158 29.748 -24.445 14.070 1.00 0.00 H ATOM 2131 HG12 ILE A 158 28.846 -25.444 11.363 1.00 0.00 H ATOM 2132 HG13 ILE A 158 30.559 -25.310 11.824 1.00 0.00 H ATOM 2133 HD11 ILE A 158 30.173 -26.830 13.708 1.00 0.00 H ATOM 2134 HD12 ILE A 158 28.458 -26.964 13.247 1.00 0.00 H ATOM 2135 HD13 ILE A 158 29.724 -27.582 12.157 1.00 0.00 H ATOM 2136 HG21 ILE A 158 27.496 -23.483 14.181 1.00 0.00 H ATOM 2137 HG22 ILE A 158 27.141 -24.084 12.542 1.00 0.00 H ATOM 2138 HG23 ILE A 158 27.409 -25.235 13.874 1.00 0.00 H ATOM 2139 H ILE A 158 31.755 -23.304 12.858 1.00 0.00 H ATOM 2140 N ILE A 159 28.588 -20.921 13.404 1.00 11.16 N ATOM 2141 CA ILE A 159 28.406 -19.772 14.301 1.00 11.79 C ATOM 2142 C ILE A 159 27.041 -19.873 14.993 1.00 11.80 C ATOM 2143 O ILE A 159 26.025 -20.120 14.348 1.00 12.36 O ATOM 2144 CB ILE A 159 28.496 -18.430 13.534 1.00 11.85 C ATOM 2145 CG1 ILE A 159 29.785 -18.358 12.710 1.00 12.50 C ATOM 2146 CG2 ILE A 159 28.408 -17.249 14.492 1.00 13.02 C ATOM 2147 CD1 ILE A 159 29.835 -17.165 11.761 1.00 14.08 C ATOM 2148 HA ILE A 159 29.206 -19.793 15.041 1.00 0.00 H ATOM 2149 HB ILE A 159 27.649 -18.378 12.850 1.00 0.00 H ATOM 2150 HG12 ILE A 159 30.630 -18.289 13.396 1.00 0.00 H ATOM 2151 HG13 ILE A 159 29.870 -19.271 12.121 1.00 0.00 H ATOM 2152 HD11 ILE A 159 29.002 -17.225 11.060 1.00 0.00 H ATOM 2153 HD12 ILE A 159 29.763 -16.242 12.336 1.00 0.00 H ATOM 2154 HD13 ILE A 159 30.776 -17.179 11.211 1.00 0.00 H ATOM 2155 HG21 ILE A 159 27.458 -17.285 15.025 1.00 0.00 H ATOM 2156 HG22 ILE A 159 29.229 -17.300 15.207 1.00 0.00 H ATOM 2157 HG23 ILE A 159 28.474 -16.319 13.927 1.00 0.00 H ATOM 2158 H ILE A 159 27.967 -21.009 12.575 1.00 0.00 H ATOM 2159 N LEU A 160 27.035 -19.669 16.305 1.00 12.09 N ATOM 2160 CA LEU A 160 25.812 -19.649 17.096 1.00 12.62 C ATOM 2161 C LEU A 160 25.691 -18.279 17.737 1.00 13.02 C ATOM 2162 O LEU A 160 26.569 -17.879 18.504 1.00 12.90 O ATOM 2163 CB LEU A 160 25.859 -20.737 18.182 1.00 12.87 C ATOM 2164 CG LEU A 160 24.674 -20.787 19.154 1.00 13.24 C ATOM 2165 CD1 LEU A 160 23.406 -21.233 18.449 1.00 14.64 C ATOM 2166 CD2 LEU A 160 24.988 -21.698 20.336 1.00 13.75 C ATOM 2167 HA LEU A 160 24.951 -19.847 16.458 1.00 0.00 H ATOM 2168 HB2 LEU A 160 25.917 -21.703 17.681 1.00 0.00 H ATOM 2169 HB3 LEU A 160 26.763 -20.579 18.770 1.00 0.00 H ATOM 2170 HG LEU A 160 24.506 -19.779 19.533 1.00 0.00 H ATOM 2171 HD21 LEU A 160 25.191 -22.706 19.973 1.00 0.00 H ATOM 2172 HD22 LEU A 160 25.863 -21.318 20.864 1.00 0.00 H ATOM 2173 HD23 LEU A 160 24.134 -21.719 21.013 1.00 0.00 H ATOM 2174 HD11 LEU A 160 23.171 -20.532 17.648 1.00 0.00 H ATOM 2175 HD12 LEU A 160 23.556 -22.228 18.030 1.00 0.00 H ATOM 2176 HD13 LEU A 160 22.584 -21.258 19.164 1.00 0.00 H ATOM 2177 H LEU A 160 27.943 -19.517 16.789 1.00 0.00 H ATOM 2178 N ARG A 161 24.614 -17.561 17.424 1.00 13.83 N ATOM 2179 CA ARG A 161 24.365 -16.273 18.064 1.00 14.70 C ATOM 2180 C ARG A 161 23.647 -16.512 19.380 1.00 15.17 C ATOM 2181 O ARG A 161 22.554 -17.076 19.405 1.00 15.55 O ATOM 2182 CB ARG A 161 23.554 -15.327 17.182 1.00 14.88 C ATOM 2183 CG ARG A 161 23.366 -13.970 17.853 1.00 15.54 C ATOM 2184 CD ARG A 161 22.519 -12.998 17.066 1.00 17.13 C ATOM 2185 NE ARG A 161 22.094 -11.908 17.943 1.00 17.58 N ATOM 2186 CZ ARG A 161 21.089 -11.067 17.695 1.00 18.85 C ATOM 2187 NH1 ARG A 161 20.378 -11.148 16.576 1.00 19.66 N ATOM 2188 NH2 ARG A 161 20.792 -10.127 18.588 1.00 19.20 N ATOM 2189 HA ARG A 161 25.326 -15.789 18.236 1.00 0.00 H ATOM 2190 HB2 ARG A 161 24.077 -15.187 16.236 1.00 0.00 H ATOM 2191 HB3 ARG A 161 22.576 -15.769 16.993 1.00 0.00 H ATOM 2192 HG2 ARG A 161 22.891 -14.131 18.821 1.00 0.00 H ATOM 2193 HG3 ARG A 161 24.349 -13.523 18.002 1.00 0.00 H ATOM 2194 HD2 ARG A 161 21.642 -13.513 16.674 1.00 0.00 H ATOM 2195 HD3 ARG A 161 23.102 -12.594 16.238 1.00 0.00 H ATOM 2196 HE ARG A 161 22.618 -11.778 18.832 1.00 0.00 H ATOM 2197 HH12 ARG A 161 19.599 -10.481 16.405 1.00 0.00 H ATOM 2198 HH11 ARG A 161 20.600 -11.879 15.870 1.00 0.00 H ATOM 2199 HH22 ARG A 161 20.011 -9.465 18.406 1.00 0.00 H ATOM 2200 HH21 ARG A 161 21.341 -10.054 19.468 1.00 0.00 H ATOM 2201 H ARG A 161 23.943 -17.922 16.716 1.00 0.00 H ATOM 2202 N THR A 162 24.278 -16.095 20.472 1.00 16.15 N ATOM 2203 CA THR A 162 23.748 -16.342 21.808 1.00 17.02 C ATOM 2204 C THR A 162 23.059 -15.122 22.418 1.00 18.12 C ATOM 2205 O THR A 162 22.166 -15.280 23.245 1.00 19.18 O ATOM 2206 CB THR A 162 24.846 -16.859 22.743 1.00 17.22 C ATOM 2207 OG1 THR A 162 25.924 -15.926 22.778 1.00 17.74 O ATOM 2208 CG2 THR A 162 25.350 -18.215 22.260 1.00 16.71 C ATOM 2209 HA THR A 162 22.982 -17.109 21.694 1.00 0.00 H ATOM 2210 HB THR A 162 24.435 -16.973 23.746 1.00 0.00 H ATOM 2211 HG1 THR A 162 26.631 -16.263 23.383 1.00 0.00 H ATOM 2212 HG23 THR A 162 24.521 -18.922 22.236 1.00 0.00 H ATOM 2213 HG21 THR A 162 25.769 -18.110 21.259 1.00 0.00 H ATOM 2214 HG22 THR A 162 26.120 -18.579 22.941 1.00 0.00 H ATOM 2215 H THR A 162 25.175 -15.578 20.371 1.00 0.00 H ATOM 2216 N GLU A 163 23.470 -13.922 22.019 1.00 18.80 N ATOM 2217 CA GLU A 163 22.819 -12.682 22.466 1.00 19.42 C ATOM 2218 C GLU A 163 22.756 -11.681 21.321 1.00 19.43 C ATOM 2219 O GLU A 163 21.899 -10.800 21.315 1.00 20.27 O ATOM 2220 CB GLU A 163 23.576 -12.036 23.631 1.00 19.95 C ATOM 2221 CG GLU A 163 23.711 -12.883 24.881 1.00 21.60 C ATOM 2222 CD GLU A 163 24.625 -12.254 25.933 1.00 24.30 C ATOM 2223 OE1 GLU A 163 25.088 -11.102 25.742 1.00 27.22 O ATOM 2224 OE2 GLU A 163 24.892 -12.927 26.953 1.00 26.76 O ATOM 2225 HA GLU A 163 21.815 -12.946 22.798 1.00 0.00 H ATOM 2226 OXT GLU A 163 23.555 -11.721 20.377 1.00 19.33 O ATOM 2227 HB2 GLU A 163 24.579 -11.791 23.283 1.00 0.00 H ATOM 2228 HB3 GLU A 163 23.053 -11.119 23.903 1.00 0.00 H ATOM 2229 HG2 GLU A 163 22.721 -13.019 25.317 1.00 0.00 H ATOM 2230 HG3 GLU A 163 24.120 -13.854 24.601 1.00 0.00 H ATOM 2231 H GLU A 163 24.279 -13.859 21.369 1.00 0.00 H TER 2232 GLU A 163 HETATM 2233 O HOH 1 35.569 -22.647 19.303 1.00 14.33 O HETATM 2234 O HOH 2 19.053 -27.971 5.094 1.00 18.24 O HETATM 2235 O HOH 3 26.212 -18.340 0.750 1.00 14.07 O HETATM 2236 O HOH 4 16.976 -28.773 14.578 1.00 13.94 O HETATM 2237 O HOH 5 38.655 -29.722 14.170 1.00 16.52 O HETATM 2238 O HOH 6 34.739 -23.362 30.077 1.00 15.52 O HETATM 2239 O HOH 7 38.436 -27.666 24.992 1.00 18.36 O HETATM 2240 O HOH 8 33.157 -25.588 29.845 1.00 19.61 O HETATM 2241 O HOH 9 31.560 -34.563 11.793 1.00 18.25 O HETATM 2242 O HOH 10 20.153 -17.271 8.980 1.00 18.55 O HETATM 2243 O HOH 11 40.292 -11.175 12.642 1.00 19.60 O HETATM 2244 O HOH 12 32.919 -16.626 2.878 1.00 18.49 O HETATM 2245 O HOH 13 11.861 -33.493 5.981 1.00 21.28 O HETATM 2246 O HOH 14 44.221 -32.186 9.918 1.00 20.81 O HETATM 2247 O HOH 15 28.335 -17.134 23.184 1.00 17.80 O HETATM 2248 O HOH 16 43.746 -20.154 10.459 1.00 18.12 O HETATM 2249 O HOH 17 21.349 -29.018 19.803 1.00 19.77 O HETATM 2250 O HOH 18 24.748 -30.544 7.614 1.00 19.73 O HETATM 2251 O HOH 19 11.979 -24.415 10.366 1.00 21.66 O HETATM 2252 O HOH 20 18.718 -15.113 10.191 1.00 17.52 O HETATM 2253 O HOH 21 37.149 -31.827 13.352 1.00 19.23 O HETATM 2254 O HOH 22 42.421 -30.565 14.116 1.00 18.07 O HETATM 2255 O HOH 23 36.114 -35.363 6.811 1.00 21.66 O HETATM 2256 O HOH 24 40.517 -34.988 10.051 1.00 24.81 O HETATM 2257 O HOH 25 28.717 -14.331 5.405 1.00 17.10 O HETATM 2258 O HOH 26 29.021 -21.434 23.591 1.00 22.61 O HETATM 2259 O HOH 27 17.872 -21.023 10.372 1.00 20.03 O HETATM 2260 O HOH 28 13.874 -26.447 9.633 1.00 19.52 O HETATM 2261 O HOH 29 20.017 -22.745 11.210 1.00 23.18 O HETATM 2262 O HOH 30 34.512 -25.894 27.175 1.00 17.92 O HETATM 2263 O HOH 31 24.995 -9.153 7.843 1.00 19.74 O HETATM 2264 O HOH 32 44.282 -23.164 19.085 1.00 23.64 O HETATM 2265 O HOH 33 25.689 -28.181 6.453 1.00 23.12 O HETATM 2266 O HOH 34 27.673 -3.001 14.998 1.00 23.41 O HETATM 2267 O HOH 35 37.953 -21.865 4.343 1.00 23.32 O HETATM 2268 O HOH 36 42.661 -33.087 15.397 1.00 23.96 O HETATM 2269 O HOH 37 49.945 -32.747 17.201 1.00 31.36 O HETATM 2270 O HOH 38 33.366 -36.250 13.150 1.00 26.96 O HETATM 2271 O HOH 39 38.818 -34.448 13.651 1.00 29.08 O HETATM 2272 O HOH 40 16.618 -26.724 10.441 1.00 21.68 O HETATM 2273 O HOH 41 16.881 -11.367 17.388 1.00 36.69 O HETATM 2274 O HOH 42 29.910 -35.507 13.669 1.00 23.73 O HETATM 2275 O HOH 43 10.110 -25.157 12.005 1.00 29.26 O HETATM 2276 O HOH 44 7.856 -22.653 15.154 1.00 23.01 O HETATM 2277 O HOH 45 50.645 -32.333 14.188 1.00 26.96 O HETATM 2278 O HOH 46 13.839 -28.937 10.953 1.00 21.35 O HETATM 2279 O HOH 47 20.109 -22.879 16.783 1.00 24.20 O HETATM 2280 O HOH 48 37.847 -14.213 5.645 1.00 28.42 O HETATM 2281 O HOH 49 22.357 -24.687 4.433 1.00 20.13 O HETATM 2282 O HOH 50 19.304 -16.446 -0.092 1.00 28.35 O HETATM 2283 O HOH 51 18.817 -11.559 8.970 1.00 34.12 O HETATM 2284 O HOH 52 27.899 -27.780 2.896 1.00 23.85 O HETATM 2285 O HOH 53 13.523 -31.130 9.340 1.00 22.66 O HETATM 2286 O HOH 54 31.646 -36.162 9.533 1.00 29.46 O HETATM 2287 O HOH 55 43.767 -21.987 16.348 1.00 23.84 O HETATM 2288 O HOH 56 20.084 -10.219 12.857 1.00 27.79 O HETATM 2289 O HOH 57 6.048 -26.917 -0.199 1.00 32.14 O HETATM 2290 O HOH 58 42.895 -27.789 1.604 1.00 30.89 O HETATM 2291 O HOH 59 21.847 -24.978 17.140 1.00 20.28 O HETATM 2292 O HOH 60 17.708 -29.578 -1.706 1.00 36.17 O HETATM 2293 O HOH 61 19.265 -19.331 -6.171 1.00 32.15 O HETATM 2294 O HOH 62 39.890 -34.002 -0.177 1.00 30.40 O HETATM 2295 O HOH 63 41.123 -18.823 16.286 1.00 32.86 O HETATM 2296 O HOH 64 31.148 -20.520 27.731 1.00 30.37 O HETATM 2297 O HOH 65 22.863 -8.235 21.402 1.00 29.12 O HETATM 2298 O HOH 66 16.847 -31.175 5.038 1.00 33.66 O HETATM 2299 O HOH 67 45.476 -31.444 21.966 1.00 27.31 O HETATM 2300 O HOH 68 36.604 -35.700 22.431 1.00 25.22 O HETATM 2301 O HOH 69 42.705 -19.943 18.084 1.00 29.69 O HETATM 2302 O HOH 70 19.806 -16.392 -4.784 1.00 25.62 O HETATM 2303 O HOH 71 26.918 -24.271 28.297 1.00 29.05 O HETATM 2304 O HOH 72 8.199 -25.741 4.045 1.00 28.08 O HETATM 2305 O HOH 73 27.193 -18.051 25.566 1.00 29.89 O HETATM 2306 O HOH 74 35.201 -35.558 15.117 1.00 26.24 O HETATM 2307 O HOH 75 25.396 -3.337 13.597 1.00 30.91 O HETATM 2308 O HOH 76 16.348 -13.751 9.616 1.00 30.04 O HETATM 2309 O HOH 77 49.488 -28.244 6.591 1.00 31.71 O HETATM 2310 O HOH 78 25.384 -8.560 5.175 1.00 31.64 O HETATM 2311 O HOH 79 33.183 -31.813 1.364 1.00 29.60 O HETATM 2312 O HOH 80 34.261 -10.330 22.068 1.00 32.02 O HETATM 2313 O HOH 81 8.082 -28.335 5.532 1.00 27.46 O HETATM 2314 O HOH 82 34.071 -36.624 8.068 1.00 30.68 O HETATM 2315 O HOH 83 24.728 -26.476 4.557 1.00 29.11 O HETATM 2316 O HOH 84 43.025 -20.367 0.147 1.00 29.16 O HETATM 2317 O HOH 85 43.300 -13.206 6.767 1.00 27.11 O HETATM 2318 O HOH 86 29.305 -6.175 5.338 1.00 49.70 O HETATM 2319 O HOH 87 30.285 -35.822 22.445 1.00 38.69 O HETATM 2320 O HOH 88 43.978 -35.047 10.164 1.00 35.09 O HETATM 2321 O HOH 89 22.293 -37.403 15.120 1.00 28.87 O HETATM 2322 O HOH 90 37.240 -17.179 2.695 1.00 30.71 O HETATM 2323 O HOH 91 43.409 -15.051 15.930 1.00 30.67 O HETATM 2324 O HOH 92 19.192 -22.356 14.008 1.00 27.67 O HETATM 2325 O HOH 93 19.209 -23.437 -1.735 1.00 30.88 O HETATM 2326 O HOH 94 32.678 -17.063 28.465 1.00 33.80 O HETATM 2327 O HOH 95 47.924 -28.216 22.452 1.00 27.61 O HETATM 2328 O HOH 96 22.775 -29.280 3.323 1.00 42.11 O HETATM 2329 O HOH 97 35.035 -6.153 10.079 1.00 27.91 O HETATM 2330 O HOH 98 27.153 -13.994 1.583 1.00 32.44 O HETATM 2331 O HOH 99 49.527 -26.139 4.963 1.00 30.45 O HETATM 2332 O HOH 100 17.549 -35.470 20.122 1.00 31.57 O HETATM 2333 O HOH 101 41.509 -20.867 25.922 1.00 42.88 O HETATM 2334 O HOH 102 29.859 -8.703 2.689 1.00 30.66 O HETATM 2335 O HOH 103 13.104 -22.353 11.890 1.00 30.66 O HETATM 2336 O HOH 104 15.281 -15.842 19.074 1.00 29.50 O HETATM 2337 O HOH 105 25.503 -8.587 23.478 1.00 37.17 O HETATM 2338 O HOH 106 23.550 -37.520 5.794 1.00 36.40 O HETATM 2339 O HOH 107 24.445 -10.019 -0.301 1.00 42.29 O HETATM 2340 O HOH 108 43.045 -19.080 3.718 1.00 32.78 O HETATM 2341 O HOH 109 44.036 -28.544 25.668 1.00 34.65 O HETATM 2342 O HOH 110 22.484 -8.317 8.797 1.00 35.37 O HETATM 2343 O HOH 111 27.390 -21.179 25.547 1.00 38.07 O HETATM 2344 O HOH 112 46.144 -26.969 24.702 1.00 33.80 O HETATM 2345 O HOH 113 20.181 -14.556 24.961 1.00 30.92 O HETATM 2346 O HOH 114 51.303 -26.147 10.565 1.00 33.70 O HETATM 2347 O HOH 115 48.150 -22.465 4.981 1.00 35.93 O HETATM 2348 O HOH 116 26.706 -9.991 3.373 1.00 36.87 O HETATM 2349 O HOH 117 23.332 -36.920 12.882 1.00 36.54 O HETATM 2350 O HOH 118 56.569 -27.620 19.099 1.00 40.52 O HETATM 2351 O HOH 119 47.459 -26.731 1.250 1.00 36.07 O HETATM 2352 O HOH 120 37.070 -14.004 22.730 1.00 34.56 O HETATM 2353 O HOH 121 19.409 -10.772 22.417 1.00 40.07 O HETATM 2354 O HOH 122 40.606 -20.457 3.506 1.00 36.00 O HETATM 2355 O HOH 123 30.832 -28.158 26.546 1.00 37.20 O HETATM 2356 O HOH 124 21.331 -18.219 23.767 1.00 36.64 O HETATM 2357 O HOH 125 42.802 -12.576 15.047 1.00 36.45 O HETATM 2358 O HOH 126 43.470 -33.758 18.174 1.00 39.07 O HETATM 2359 O HOH 127 25.505 -36.951 11.532 1.00 36.73 O HETATM 2360 O HOH 128 39.137 -37.662 1.769 1.00 41.40 O HETATM 2361 O HOH 129 46.252 -15.166 12.864 1.00 43.43 O HETATM 2362 O HOH 130 29.613 -33.764 3.782 1.00 57.91 O HETATM 2363 O HOH 131 6.662 -31.861 -3.412 1.00 36.85 O HETATM 2364 O HOH 132 4.515 -19.924 4.776 1.00 39.52 O HETATM 2365 O HOH 133 9.864 -11.608 0.765 1.00 53.08 O HETATM 2366 O HOH 134 38.434 -36.169 15.713 1.00 57.91 O HETATM 2367 O HOH 135 27.070 -6.366 24.490 1.00 40.21 O HETATM 2368 O HOH 136 45.437 -18.409 19.790 1.00 41.42 O HETATM 2369 O HOH 137 39.632 -35.688 19.871 1.00 36.24 O HETATM 2370 O HOH 138 9.030 -10.430 3.105 1.00 45.86 O HETATM 2371 O HOH 139 52.635 -31.991 17.846 1.00 43.85 O HETATM 2372 O HOH 140 35.861 -36.565 4.325 1.00 39.52 O HETATM 2373 O HOH 141 30.773 -35.970 16.407 1.00 39.71 O HETATM 2374 O HOH 142 6.206 -21.791 3.488 1.00 38.16 O HETATM 2375 O HOH 143 19.249 -24.994 13.598 1.00 37.69 O HETATM 2376 O HOH 144 29.536 -35.132 6.569 1.00 33.00 O HETATM 2377 O HOH 145 30.603 -31.791 2.072 1.00 43.17 O HETATM 2378 O HOH 146 54.185 -25.581 15.342 1.00 46.78 O HETATM 2379 O HOH 147 29.864 -6.877 26.367 1.00 43.32 O HETATM 2380 O HOH 148 11.853 -14.043 2.188 1.00 57.32 O HETATM 2381 O HOH 149 38.422 -36.175 8.091 1.00 39.39 O HETATM 2382 O HOH 150 16.181 -24.828 12.407 1.00 39.22 O HETATM 2383 O HOH 151 7.191 -23.555 5.012 1.00 31.36 O HETATM 2384 O HOH 152 33.911 -6.009 21.744 1.00 54.95 O HETATM 2385 O HOH 153 17.601 -27.337 -3.023 1.00 36.50 O HETATM 2386 O HOH 154 27.813 -10.331 26.898 1.00 39.30 O HETATM 2387 O HOH 155 50.644 -18.721 9.265 1.00 49.20 O HETATM 2388 O HOH 156 48.099 -35.295 14.086 1.00 42.49 O HETATM 2389 O HOH 157 15.303 -28.479 -6.246 1.00 34.30 O HETATM 2390 O HOH 158 12.933 -16.205 -3.036 1.00 41.05 O HETATM 2391 O HOH 159 24.917 -19.547 25.720 1.00 39.85 O HETATM 2392 O HOH 160 15.823 -20.145 -4.895 1.00 38.91 O HETATM 2393 O HOH 161 37.681 -9.954 6.009 1.00 43.27 O HETATM 2394 O HOH 162 37.303 -13.134 3.178 1.00 39.60 O HETATM 2395 O HOH 163 36.910 -6.202 7.357 1.00 36.78 O HETATM 2396 O HOH 164 41.669 -21.381 28.383 1.00 37.32 O HETATM 2397 O HOH 165 38.480 -37.489 18.013 1.00 50.96 O HETATM 2398 O HOH 166 15.303 -7.966 4.279 1.00 55.94 O HETATM 2399 O HOH 167 28.904 -30.008 1.018 1.00 40.27 O HETATM 2400 O HOH 168 49.169 -33.667 12.005 1.00 41.88 O HETATM 2401 O HOH 169 50.990 -22.696 11.388 1.00 47.16 O HETATM 2402 O HOH 170 25.951 -32.784 24.064 1.00 42.45 O HETATM 2403 O HOH 171 43.970 -35.694 4.309 1.00 48.86 O HETATM 2404 O HOH 172 20.140 -31.524 4.018 1.00 54.19 O HETATM 2405 O HOH 173 27.787 -23.539 3.371 1.00 39.23 O HETATM 2406 O HOH 174 39.456 -7.947 10.357 1.00 50.12 O HETATM 2407 O HOH 175 14.854 -15.507 10.839 1.00 47.66 O HETATM 2408 O HOH 176 12.502 -18.288 11.407 1.00 43.46 O HETATM 2409 O HOH 177 38.809 -15.121 2.107 1.00 55.38 O HETATM 2410 O HOH 178 21.357 -29.576 -4.605 1.00 37.58 O HETATM 2411 O HOH 179 26.542 -12.443 29.951 1.00 46.52 O HETATM 2412 O HOH 180 27.875 -29.125 26.807 1.00 44.41 O HETATM 2413 O HOH 181 33.760 -29.922 -0.885 1.00 64.52 O HETATM 2414 O HOH 182 18.159 -13.882 -1.244 1.00 39.01 O HETATM 2415 O HOH 183 28.157 -21.861 27.969 1.00 37.05 O HETATM 2416 O HOH 184 11.557 -15.655 11.471 1.00 58.09 O HETATM 2417 O HOH 185 47.108 -27.703 -2.327 1.00 41.19 O HETATM 2418 O HOH 186 23.418 -33.890 24.616 1.00 47.97 O HETATM 2419 O HOH 187 18.377 -11.478 -0.244 1.00 45.99 O HETATM 2420 O HOH 188 22.737 -24.612 1.700 1.00 39.72 O HETATM 2421 O HOH 189 12.846 -30.027 -6.280 1.00 38.63 O HETATM 2422 O HOH 190 14.985 -13.910 -2.533 1.00 45.69 O HETATM 2423 O HOH 191 51.823 -21.387 8.555 1.00 47.87 O HETATM 2424 O HOH 192 19.671 -31.200 -1.373 1.00 71.28 O HETATM 2425 O HOH 193 50.689 -21.836 5.868 1.00 41.41 O HETATM 2426 O HOH 194 30.644 -30.581 27.497 1.00 44.39 O HETATM 2427 O HOH 195 47.706 -31.579 3.546 1.00 58.95 O HETATM 2428 O HOH 196 20.999 -30.507 21.978 1.00 32.63 O HETATM 2429 O HOH 197 4.457 -19.343 8.069 1.00 39.89 O HETATM 2430 O HOH 198 22.680 -4.516 20.655 1.00 48.63 O HETATM 2431 O HOH 199 44.099 -23.875 24.046 1.00 46.77 O HETATM 2432 O HOH 200 45.081 -14.642 4.972 1.00 53.65 O HETATM 2433 O HOH 201 32.056 -28.009 -1.738 1.00 50.31 O HETATM 2434 O HOH 202 41.807 -35.748 7.041 1.00 46.89 O HETATM 2435 O HOH 203 20.591 -32.785 -8.318 1.00 63.82 O HETATM 2436 O HOH 204 17.923 -6.392 16.578 1.00 43.91 O HETATM 2437 O HOH 205 51.503 -26.964 7.874 1.00 43.41 O HETATM 2438 O HOH 206 48.694 -24.304 18.072 1.00 49.46 O HETATM 2439 O HOH 207 34.987 -27.575 -1.821 1.00 90.42 O HETATM 2440 O HOH 208 13.126 -13.492 11.324 1.00 64.27 O HETATM 2441 O HOH 209 16.773 -31.853 -0.517 1.00 49.91 O HETATM 2442 O HOH 210 24.003 -31.630 5.453 1.00 49.94 O HETATM 2443 O HOH 211 29.541 -28.480 -1.107 1.00 43.13 O HETATM 2444 O HOH 212 40.020 -12.122 6.264 1.00 43.68 O HETATM 2445 O HOH 213 19.817 -11.998 25.139 1.00 53.03 O HETATM 2446 O HOH 214 25.299 -2.262 9.203 1.00 51.17 O HETATM 2447 O HOH 215 25.241 -24.217 2.823 1.00 67.75 O HETATM 2448 O HOH 216 15.242 -11.492 2.632 1.00 38.72 O HETATM 2449 O HOH 217 10.871 -21.392 13.090 1.00 55.39 O HETATM 2450 O HOH 218 49.703 -29.968 4.337 1.00 44.25 O HETATM 2451 O HOH 219 33.581 -25.008 -1.102 1.00 49.81 O HETATM 2452 O HOH 220 10.455 -12.236 9.446 1.00 65.50 O HETATM 2453 O HOH 221 20.422 -6.625 20.652 1.00 50.49 O HETATM 2454 O HOH 222 35.034 -26.549 0.554 1.00 77.71 O HETATM 2455 O HOH 223 40.928 -21.855 0.960 1.00 50.37 O HETATM 2456 O HOH 224 18.325 -32.486 1.398 1.00 39.72 O HETATM 2457 O HOH 225 32.488 -37.273 21.257 1.00 50.93 O HETATM 2458 O HOH 226 41.407 -12.144 2.624 1.00 56.54 O HETATM 2459 O HOH 227 15.370 -24.529 -5.450 1.00 47.27 O HETATM 2460 O HOH 228 13.745 -11.834 14.484 1.00 61.62 O HETATM 2461 O HOH 229 23.148 -38.286 22.046 1.00 66.03 O HETATM 2462 O HOH 230 52.510 -20.308 3.856 1.00 55.47 O HETATM 2463 O HOH 231 8.305 -29.359 -5.959 1.00 51.11 O HETATM 2464 O HOH 232 47.863 -35.354 9.886 1.00 46.24 O HETATM 2465 O HOH 233 27.970 -36.838 12.276 1.00 52.46 O HETATM 2466 O HOH 234 36.231 -37.865 20.309 1.00 67.16 O HETATM 2467 O HOH 235 47.348 -24.050 20.926 1.00 65.38 O HETATM 2468 O HOH 236 7.828 -13.882 5.528 1.00 47.03 O HETATM 2469 O HOH 237 33.115 -37.147 24.234 1.00 49.80 O HETATM 2470 O HOH 238 26.688 -6.044 5.134 1.00 53.05 O HETATM 2471 O HOH 239 41.895 -30.459 -1.917 1.00 48.27 O HETATM 2472 O HOH 240 35.923 -22.580 -0.746 1.00 50.30 O HETATM 2473 O HOH 241 17.703 -8.829 13.895 1.00 44.64 O HETATM 2474 O HOH 242 11.496 -26.962 10.769 1.00 78.93 O HETATM 2475 O HOH 243 25.525 -36.215 23.777 1.00 51.97 O HETATM 2476 O HOH 244 19.671 -36.782 22.268 1.00 48.00 O HETATM 2477 O HOH 245 41.424 -25.169 -0.365 1.00 69.29 O HETATM 2478 O HOH 246 42.632 -33.204 -2.326 1.00 53.87 O HETATM 2479 O HOH 247 11.843 -15.781 0.349 1.00 53.02 O HETATM 2480 O HOH 248 31.716 -38.484 14.063 1.00 57.15 O HETATM 2481 O HOH 249 21.673 -8.095 4.307 1.00 46.50 O HETATM 2482 O HOH 250 34.980 -37.789 11.371 1.00 63.24 O HETATM 2483 O HOH 251 24.681 -15.874 26.511 1.00 54.27 O HETATM 2484 O HOH 252 10.089 -32.149 7.068 1.00 27.56 O HETATM 2485 O HOH 253 40.277 -9.969 14.721 1.00 52.28 O HETATM 2486 O HOH 254 37.945 -9.496 22.013 1.00 56.27 O HETATM 2487 O HOH 255 8.766 -13.800 10.887 1.00 46.73 O HETATM 2488 O HOH 256 44.810 -35.386 7.328 1.00 51.03 O HETATM 2489 O HOH 257 38.107 -5.349 20.817 1.00 58.49 O HETATM 2490 O HOH 258 19.936 -5.754 4.162 1.00 47.77 O HETATM 2491 O HOH 259 37.587 -16.603 23.396 1.00 61.30 O HETATM 2492 O HOH 260 8.174 -15.649 -1.529 1.00 50.48 O HETATM 2493 O HOH 261 48.196 -15.851 4.181 1.00 56.47 O HETATM 2494 O HOH 262 35.639 -8.081 21.629 1.00 62.46 O HETATM 2495 O HOH 263 41.665 -8.085 15.988 1.00 62.48 O HETATM 2496 O HOH 264 20.570 -9.091 1.879 1.00 63.66 O HETATM 2497 O HOH 265 51.339 -18.842 11.967 1.00 57.31 O HETATM 2498 O HOH 266 45.303 -11.806 13.572 1.00 50.23 O HETATM 2499 F UNN A 267 37.966 -11.460 16.010 1.00 -0.26 F HETATM 2500 C5 UNN A 267 37.730 -12.365 16.959 1.00 0.10 C HETATM 2501 C4 UNN A 267 39.035 -13.185 17.178 1.00 0.08 C HETATM 2502 O1 UNN A 267 38.941 -14.030 18.340 1.00 -0.39 O HETATM 2503 H UNN A 267 38.675 -13.503 19.097 1.00 0.21 H HETATM 2504 C3 UNN A 267 39.466 -14.028 15.944 1.00 -0.02 C HETATM 2505 C2 UNN A 267 38.288 -14.862 15.401 1.00 0.01 C HETATM 2506 C1 UNN A 267 37.935 -16.004 16.366 1.00 -0.06 C HETATM 2507 H UNN A 267 38.800 -16.656 16.488 1.00 0.02 H HETATM 2508 H UNN A 267 37.654 -15.587 17.333 1.00 0.02 H HETATM 2509 H UNN A 267 37.101 -16.577 15.960 1.00 0.02 H HETATM 2510 C17 UNN A 267 37.098 -13.952 15.139 1.00 -0.03 C HETATM 2511 C16 UNN A 267 36.589 -13.245 16.400 1.00 -0.01 C HETATM 2512 C15 UNN A 267 35.324 -12.417 16.092 1.00 -0.04 C HETATM 2513 C14 UNN A 267 34.863 -11.555 17.282 1.00 -0.03 C HETATM 2514 C13 UNN A 267 36.050 -10.775 17.840 1.00 -0.08 C HETATM 2515 C7 UNN A 267 37.292 -11.589 18.221 1.00 -0.02 C HETATM 2516 C8 UNN A 267 36.880 -12.507 19.379 1.00 -0.10 C HETATM 2517 H UNN A 267 36.042 -13.130 19.066 1.00 0.01 H HETATM 2518 H UNN A 267 37.722 -13.141 19.656 1.00 0.01 H HETATM 2519 H UNN A 267 36.584 -11.900 20.234 1.00 0.01 H HETATM 2520 C9 UNN A 267 38.341 -10.790 18.680 1.00 -0.09 C HETATM 2521 C10 UNN A 267 38.258 -9.406 18.811 1.00 0.04 C HETATM 2522 C11 UNN A 267 37.111 -8.705 18.460 1.00 0.25 C HETATM 2523 O2 UNN A 267 37.088 -7.482 18.600 1.00 -0.27 O HETATM 2524 C12 UNN A 267 36.002 -9.387 17.969 1.00 0.03 C HETATM 2525 H UNN A 267 35.102 -8.840 17.687 1.00 0.11 H HETATM 2526 H UNN A 267 39.116 -8.858 19.200 1.00 0.12 H HETATM 2527 H UNN A 267 39.278 -11.277 18.951 1.00 0.05 H HETATM 2528 H UNN A 267 34.096 -10.857 16.947 1.00 0.04 H HETATM 2529 H UNN A 267 34.456 -12.200 18.060 1.00 0.04 H HETATM 2530 H UNN A 267 35.560 -11.745 15.267 1.00 0.03 H HETATM 2531 H UNN A 267 34.520 -13.115 15.857 1.00 0.03 H HETATM 2532 H UNN A 267 36.304 -13.980 17.153 1.00 0.03 H HETATM 2533 C18 UNN A 267 36.120 -14.865 14.400 1.00 -0.05 C HETATM 2534 C19 UNN A 267 37.051 -15.719 13.512 1.00 -0.01 C HETATM 2535 C20 UNN A 267 36.839 -15.412 12.021 1.00 -0.06 C HETATM 2536 H UNN A 267 35.806 -15.629 11.750 1.00 0.02 H HETATM 2537 H UNN A 267 37.051 -14.359 11.834 1.00 0.02 H HETATM 2538 H UNN A 267 37.510 -16.030 11.425 1.00 0.02 H HETATM 2539 C21 UNN A 267 38.496 -15.398 13.972 1.00 0.14 C HETATM 2540 O3 UNN A 267 39.086 -14.391 13.132 1.00 -0.38 O HETATM 2541 H UNN A 267 39.207 -14.744 12.248 1.00 0.21 H HETATM 2542 C22 UNN A 267 39.402 -16.643 13.927 1.00 0.19 C HETATM 2543 O4 UNN A 267 38.932 -17.781 13.973 1.00 -0.33 O HETATM 2544 C23 UNN A 267 40.917 -16.435 13.788 1.00 0.16 C HETATM 2545 O5 UNN A 267 41.654 -17.671 13.823 1.00 -0.26 O HETATM 2546 P UNN A 267 43.190 -17.743 13.227 1.00 0.20 P HETATM 2547 O6 UNN A 267 43.079 -17.794 11.627 1.00 -0.55 O HETATM 2548 O7 UNN A 267 43.836 -16.318 13.607 1.00 -0.55 O HETATM 2549 O8 UNN A 267 43.951 -18.898 13.755 1.00 -0.55 O HETATM 2550 H UNN A 267 41.102 -15.962 12.823 1.00 0.08 H HETATM 2551 H UNN A 267 41.249 -15.824 14.627 1.00 0.08 H HETATM 2552 H UNN A 267 36.839 -16.783 13.621 1.00 0.03 H HETATM 2553 H UNN A 267 35.376 -14.313 13.826 1.00 0.03 H HETATM 2554 H UNN A 267 35.509 -15.466 15.074 1.00 0.03 H HETATM 2555 H UNN A 267 37.324 -13.077 14.530 1.00 0.03 H HETATM 2556 H UNN A 267 39.804 -13.350 15.160 1.00 0.03 H HETATM 2557 H UNN A 267 40.263 -14.707 16.247 1.00 0.03 H HETATM 2558 H UNN A 267 39.813 -12.438 17.336 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 484 485 498 499 500 CONECT 498 484 CONECT 499 484 CONECT 500 484 CONECT 2499 2500 CONECT 2500 2499 2501 2511 2515 CONECT 2501 2500 2502 2504 2558 CONECT 2502 2501 2503 CONECT 2503 2502 CONECT 2504 2501 2505 2556 2557 CONECT 2505 2504 2506 2510 2539 CONECT 2506 2505 2507 2508 2509 CONECT 2507 2506 CONECT 2508 2506 CONECT 2509 2506 CONECT 2510 2505 2511 2533 2555 CONECT 2511 2500 2510 2512 2532 CONECT 2512 2511 2513 2530 2531 CONECT 2513 2512 2514 2528 2529 CONECT 2514 2513 2515 2524 CONECT 2515 2500 2514 2516 2520 CONECT 2516 2515 2517 2518 2519 CONECT 2517 2516 CONECT 2518 2516 CONECT 2519 2516 CONECT 2520 2515 2521 2527 CONECT 2521 2520 2522 2526 CONECT 2522 2521 2523 2524 CONECT 2523 2522 CONECT 2524 2514 2522 2525 CONECT 2525 2524 CONECT 2526 2521 CONECT 2527 2520 CONECT 2528 2513 CONECT 2529 2513 CONECT 2530 2512 CONECT 2531 2512 CONECT 2532 2511 CONECT 2533 2510 2534 2553 2554 CONECT 2534 2533 2535 2539 2552 CONECT 2535 2534 2536 2537 2538 CONECT 2536 2535 CONECT 2537 2535 CONECT 2538 2535 CONECT 2539 2505 2534 2540 2542 CONECT 2540 2539 2541 CONECT 2541 2540 CONECT 2542 2539 2543 2544 CONECT 2543 2542 CONECT 2544 2542 2545 2550 2551 CONECT 2545 2544 2546 CONECT 2546 2545 2547 2548 2549 CONECT 2547 2546 CONECT 2548 2546 CONECT 2549 2546 CONECT 2550 2544 CONECT 2551 2544 CONECT 2552 2534 CONECT 2553 2533 CONECT 2554 2533 CONECT 2555 2510 CONECT 2556 2504 CONECT 2557 2504 CONECT 2558 2501 MASTER 0 0 0 0 0 0 0 0 2556 2 68 12 END
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Structure:
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Related entries of code: 3tc5
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
1f8a
RCSB PDB
PDBbind
167aa, >1F8A_1|Chain... *
2itk
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PDBbind
167aa, >2ITK_1|Chain... at 99%
2xp3
RCSB PDB
PDBbind
167aa, >2XP3_1|Chain... at 99%
2xp4
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PDBbind
167aa, >2XP4_1|Chain... at 99%
2xp5
RCSB PDB
PDBbind
167aa, >2XP5_1|Chain... at 99%
2xp6
RCSB PDB
PDBbind
167aa, >2XP6_1|Chain... at 98%
2xp7
RCSB PDB
PDBbind
167aa, >2XP7_1|Chain... at 99%
2xp8
RCSB PDB
PDBbind
167aa, >2XP8_1|Chain... at 99%
2xpa
RCSB PDB
PDBbind
167aa, >2XPA_1|Chain... at 99%
2xpb
RCSB PDB
PDBbind
167aa, >2XPB_1|Chain... at 99%
3i6c
RCSB PDB
PDBbind
123aa, >3I6C_1|Chains... at 95%
3ikd
RCSB PDB
PDBbind
123aa, >3IKD_1|Chains... at 95%
3ikg
RCSB PDB
PDBbind
123aa, >3IKG_1|Chains... at 95%
3jyj
RCSB PDB
PDBbind
123aa, >3JYJ_1|Chains... at 95%
3kab
RCSB PDB
PDBbind
167aa, >3KAB_1|Chain... at 99%
3kac
RCSB PDB
PDBbind
123aa, >3KAC_1|Chains... at 96%
3kad
RCSB PDB
PDBbind
167aa, >3KAD_1|Chain... at 98%
3kaf
RCSB PDB
PDBbind
167aa, >3KAF_1|Chain... at 98%
3kag
RCSB PDB
PDBbind
167aa, >3KAG_1|Chain... at 99%
3kah
RCSB PDB
PDBbind
167aa, >3KAH_1|Chain... at 99%
3kai
RCSB PDB
PDBbind
167aa, >3KAI_1|Chain... at 99%
3kce
RCSB PDB
PDBbind
167aa, >3KCE_1|Chain... at 99%
3ntp
RCSB PDB
PDBbind
167aa, >3NTP_1|Chain... at 99%
3odk
RCSB PDB
PDBbind
167aa, >3ODK_1|Chain... at 99%
3oob
RCSB PDB
PDBbind
163aa, >3OOB_1|Chain... at 99%
4tyo
RCSB PDB
PDBbind
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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
3tc5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1
Ligand Name
3T5
EC.Number
E.C.5.2.1.8
Resolution
1.4(Å)
Affinity (Kd/Ki/IC50)
Kd=6.8uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Acs Chem.Biol. Vol. 6: pp. 1008-1014
Ligand Properties
Formula
C
2
2
H
3
1
FO
8
P
Molecular Weight
473.449
Exact Mass
473.174
No. of atoms
63
No. of bonds
66
Polar Surface Area
158.11
LOGP Value
0.23 (
Computed with XLOGP3
)
1.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
O=C1C=C[C@]2(C(=C1)CC[C@@H]1[C@]2(F)[C@@H](O)C[C@]2([C@H]1C[C@H]([C@]2(O)C(=O)COP(O)(O)O)C)C)C
InChI String
InChI=1S/C22H32FO8P/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30/h6-7,9,12,15-17,25,27-30,32H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q13526
Entrez Gene ID
NCBI Entrez Gene ID:
5300
ASD
Information of known allosteric effects of PDB entries
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