Browse entries in the PDBbind-CN Database
HEADER 4I31_COMPLEX COMPND 4I31_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 182 ALA PRO ILE THR ALA TYR SER GLN GLN THR ARG GLY LEU SEQRES 2 A 182 LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG ASP LYS SEQRES 3 A 182 ASN GLN VAL ASP GLY GLU VAL GLN VAL LEU SER THR ALA SEQRES 4 A 182 THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY VAL CYS SEQRES 5 A 182 TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR LEU ALA SEQRES 6 A 182 GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR ASN VAL SEQRES 7 A 182 ASP GLN ASP LEU VAL GLY TRP PRO ALA PRO PRO GLY ALA SEQRES 8 A 182 ARG SER MET THR PRO CYS THR CYS GLY SER SER ASP LEU SEQRES 9 A 182 TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO VAL ARG SEQRES 10 A 182 ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER PRO ARG SEQRES 11 A 182 PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY PRO LEU SEQRES 12 A 182 LEU CYS PRO SER GLY HIS VAL VAL GLY ILE PHE ARG ALA SEQRES 13 A 182 ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL ASP PHE SEQRES 14 A 182 ILE PRO VAL GLU SER MET GLU THR THR MET ARG ALA SER HET NA A 1 1 HET LYS A 242 194 SSBOND 1 CYS A 47 CYS A 52 SSBOND 2 CYS A 97 CYS A 145 ATOM 1 N ALA A 1 65.868 36.775 11.610 1.00 70.89 N ATOM 2 CA ALA A 1 64.566 36.718 10.952 1.00 73.18 C ATOM 3 C ALA A 1 64.641 36.026 9.591 1.00 72.70 C ATOM 4 O ALA A 1 65.264 36.546 8.661 1.00 76.79 O ATOM 5 CB ALA A 1 63.990 38.129 10.789 1.00 72.32 C ATOM 6 HA ALA A 1 63.907 36.127 11.588 1.00 0.00 H ATOM 7 HB1 ALA A 1 63.873 38.588 11.771 1.00 0.00 H ATOM 8 HB2 ALA A 1 64.669 38.730 10.184 1.00 0.00 H ATOM 9 HB3 ALA A 1 63.019 38.069 10.297 1.00 0.00 H ATOM 10 HN3 ALA A 1 66.534 37.305 11.012 1.00 0.00 H ATOM 11 HN2 ALA A 1 66.224 35.809 11.756 1.00 0.00 H ATOM 12 HN1 ALA A 1 65.770 37.252 12.529 1.00 0.00 H ATOM 13 N PRO A 2 64.016 34.844 9.456 1.00 67.41 N ATOM 14 CA PRO A 2 63.415 33.909 10.410 1.00 65.53 C ATOM 15 C PRO A 2 64.521 33.011 10.950 1.00 59.69 C ATOM 16 O PRO A 2 65.692 33.361 10.799 1.00 59.45 O ATOM 17 CB PRO A 2 62.433 33.115 9.547 1.00 62.81 C ATOM 18 CG PRO A 2 63.091 33.060 8.223 1.00 65.72 C ATOM 19 CD PRO A 2 63.894 34.338 8.076 1.00 66.74 C ATOM 20 HA PRO A 2 62.925 34.376 11.264 1.00 0.00 H ATOM 21 HD3 PRO A 2 64.876 34.132 7.650 1.00 0.00 H ATOM 22 HD2 PRO A 2 63.369 35.055 7.445 1.00 0.00 H ATOM 23 HG3 PRO A 2 62.342 32.995 7.434 1.00 0.00 H ATOM 24 HG2 PRO A 2 63.751 32.194 8.168 1.00 0.00 H ATOM 25 HB2 PRO A 2 62.285 32.113 9.949 1.00 0.00 H ATOM 26 HB3 PRO A 2 61.472 33.625 9.482 1.00 0.00 H ATOM 27 N ILE A 3 64.150 31.924 11.618 1.00 52.02 N ATOM 28 CA ILE A 3 65.098 30.897 12.034 1.00 43.60 C ATOM 29 C ILE A 3 66.014 30.462 10.887 1.00 43.02 C ATOM 30 O ILE A 3 65.557 30.157 9.787 1.00 39.98 O ATOM 31 CB ILE A 3 64.323 29.650 12.464 1.00 47.24 C ATOM 32 CG1 ILE A 3 63.310 30.006 13.549 1.00 47.28 C ATOM 33 CG2 ILE A 3 65.256 28.563 12.940 1.00 47.26 C ATOM 34 CD1 ILE A 3 62.343 28.894 13.804 1.00 45.68 C ATOM 35 HA ILE A 3 65.696 31.320 12.841 1.00 0.00 H ATOM 36 HB ILE A 3 63.786 29.268 11.596 1.00 0.00 H ATOM 37 HG12 ILE A 3 63.846 30.224 14.473 1.00 0.00 H ATOM 38 HG13 ILE A 3 62.755 30.890 13.235 1.00 0.00 H ATOM 39 HD11 ILE A 3 61.796 28.673 12.888 1.00 0.00 H ATOM 40 HD12 ILE A 3 62.888 28.007 14.126 1.00 0.00 H ATOM 41 HD13 ILE A 3 61.643 29.195 14.583 1.00 0.00 H ATOM 42 HG21 ILE A 3 65.935 28.289 12.132 1.00 0.00 H ATOM 43 HG22 ILE A 3 65.831 28.926 13.792 1.00 0.00 H ATOM 44 HG23 ILE A 3 64.674 27.691 13.238 1.00 0.00 H ATOM 45 H ILE A 3 63.144 31.801 11.853 1.00 0.00 H ATOM 46 N THR A 4 67.314 30.427 11.159 1.00 42.19 N ATOM 47 CA THR A 4 68.301 30.006 10.170 1.00 36.93 C ATOM 48 C THR A 4 69.142 28.893 10.803 1.00 37.41 C ATOM 49 O THR A 4 69.081 28.690 12.008 1.00 37.50 O ATOM 50 CB THR A 4 69.244 31.160 9.765 1.00 39.08 C ATOM 51 OG1 THR A 4 69.943 31.629 10.921 1.00 42.34 O ATOM 52 CG2 THR A 4 68.469 32.324 9.144 1.00 45.92 C ATOM 53 HA THR A 4 67.778 29.672 9.274 1.00 0.00 H ATOM 54 HB THR A 4 69.945 30.779 9.023 1.00 0.00 H ATOM 55 HG1 THR A 4 70.473 30.888 11.308 1.00 0.00 H ATOM 56 HG23 THR A 4 67.934 31.973 8.262 1.00 0.00 H ATOM 57 HG21 THR A 4 67.757 32.714 9.871 1.00 0.00 H ATOM 58 HG22 THR A 4 69.166 33.112 8.858 1.00 0.00 H ATOM 59 H THR A 4 67.638 30.708 12.106 1.00 0.00 H ATOM 60 N ALA A 5 69.901 28.153 9.997 1.00 34.70 N ATOM 61 CA ALA A 5 70.699 27.059 10.537 1.00 35.25 C ATOM 62 C ALA A 5 71.917 26.844 9.679 1.00 32.41 C ATOM 63 O ALA A 5 71.917 27.174 8.513 1.00 33.73 O ATOM 64 CB ALA A 5 69.893 25.792 10.582 1.00 32.12 C ATOM 65 HA ALA A 5 71.005 27.321 11.550 1.00 0.00 H ATOM 66 HB1 ALA A 5 69.020 25.941 11.217 1.00 0.00 H ATOM 67 HB2 ALA A 5 69.571 25.532 9.574 1.00 0.00 H ATOM 68 HB3 ALA A 5 70.506 24.987 10.988 1.00 0.00 H ATOM 69 H ALA A 5 69.925 28.357 8.977 1.00 0.00 H ATOM 70 N TYR A 6 72.951 26.262 10.250 1.00 32.17 N ATOM 71 CA TYR A 6 74.042 25.777 9.436 1.00 33.06 C ATOM 72 C TYR A 6 74.618 24.530 10.075 1.00 32.88 C ATOM 73 O TYR A 6 74.428 24.283 11.271 1.00 31.80 O ATOM 74 CB TYR A 6 75.124 26.849 9.267 1.00 33.65 C ATOM 75 CG TYR A 6 75.785 27.239 10.550 1.00 33.92 C ATOM 76 CD1 TYR A 6 76.892 26.553 11.010 1.00 33.97 C ATOM 77 CD2 TYR A 6 75.303 28.291 11.314 1.00 39.38 C ATOM 78 CE1 TYR A 6 77.501 26.892 12.174 1.00 33.06 C ATOM 79 CE2 TYR A 6 75.914 28.637 12.499 1.00 34.41 C ATOM 80 CZ TYR A 6 77.021 27.936 12.918 1.00 38.69 C ATOM 81 OH TYR A 6 77.650 28.263 14.100 1.00 40.48 O ATOM 82 HA TYR A 6 73.666 25.536 8.442 1.00 0.00 H ATOM 83 HB3 TYR A 6 74.665 27.737 8.832 1.00 0.00 H ATOM 84 HB2 TYR A 6 75.886 26.466 8.589 1.00 0.00 H ATOM 85 HD2 TYR A 6 74.431 28.850 10.973 1.00 0.00 H ATOM 86 HE2 TYR A 6 75.524 29.459 13.099 1.00 0.00 H ATOM 87 HE1 TYR A 6 78.372 26.333 12.517 1.00 0.00 H ATOM 88 HD1 TYR A 6 77.285 25.721 10.425 1.00 0.00 H ATOM 89 HH TYR A 6 77.967 29.200 14.055 1.00 0.00 H ATOM 90 H TYR A 6 72.982 26.152 11.284 1.00 0.00 H ATOM 91 N SER A 7 75.333 23.756 9.273 1.00 28.85 N ATOM 92 CA SER A 7 75.849 22.473 9.717 1.00 33.92 C ATOM 93 C SER A 7 77.365 22.539 9.842 1.00 31.86 C ATOM 94 O SER A 7 78.002 23.368 9.194 1.00 32.32 O ATOM 95 CB SER A 7 75.450 21.385 8.724 1.00 33.86 C ATOM 96 OG SER A 7 76.197 21.496 7.521 1.00 39.00 O ATOM 97 HA SER A 7 75.426 22.234 10.693 1.00 0.00 H ATOM 98 HB2 SER A 7 74.389 21.482 8.495 1.00 0.00 H ATOM 99 HB3 SER A 7 75.636 20.408 9.171 1.00 0.00 H ATOM 100 HG SER A 7 76.028 22.380 7.109 1.00 0.00 H ATOM 101 H SER A 7 75.530 24.074 8.303 1.00 0.00 H ATOM 102 N GLN A 8 77.932 21.715 10.725 1.00 30.09 N ATOM 103 CA GLN A 8 79.382 21.508 10.770 1.00 31.28 C ATOM 104 C GLN A 8 79.648 20.015 10.849 1.00 34.59 C ATOM 105 O GLN A 8 79.097 19.352 11.707 1.00 29.21 O ATOM 106 CB GLN A 8 80.008 22.210 11.970 1.00 33.23 C ATOM 107 CG GLN A 8 79.954 23.722 11.909 1.00 33.11 C ATOM 108 CD GLN A 8 80.478 24.360 13.179 1.00 37.36 C ATOM 109 OE1 GLN A 8 80.330 23.810 14.270 1.00 34.91 O ATOM 110 NE2 GLN A 8 81.095 25.530 13.043 1.00 34.82 N ATOM 111 HA GLN A 8 79.831 21.932 9.872 1.00 0.00 H ATOM 112 HB2 GLN A 8 79.482 21.886 12.868 1.00 0.00 H ATOM 113 HB3 GLN A 8 81.053 21.908 12.035 1.00 0.00 H ATOM 114 HG2 GLN A 8 80.559 24.062 11.068 1.00 0.00 H ATOM 115 HG3 GLN A 8 78.920 24.032 11.760 1.00 0.00 H ATOM 116 HE22 GLN A 8 81.197 25.958 12.100 1.00 0.00 H ATOM 117 HE21 GLN A 8 81.476 26.017 13.879 1.00 0.00 H ATOM 118 H GLN A 8 77.328 21.205 11.401 1.00 0.00 H ATOM 119 N GLN A 9 80.467 19.489 9.947 1.00 31.38 N ATOM 120 CA GLN A 9 80.843 18.079 9.997 1.00 36.49 C ATOM 121 C GLN A 9 81.896 17.912 11.092 1.00 36.08 C ATOM 122 O GLN A 9 82.778 18.761 11.223 1.00 31.83 O ATOM 123 CB GLN A 9 81.380 17.623 8.634 1.00 35.89 C ATOM 124 CG GLN A 9 81.957 16.212 8.627 1.00 42.99 C ATOM 125 CD GLN A 9 82.109 15.646 7.221 1.00 57.16 C ATOM 126 OE1 GLN A 9 81.568 16.200 6.252 1.00 54.11 O ATOM 127 NE2 GLN A 9 82.846 14.531 7.101 1.00 50.88 N ATOM 128 HA GLN A 9 79.976 17.459 10.226 1.00 0.00 H ATOM 129 HB2 GLN A 9 80.562 17.661 7.914 1.00 0.00 H ATOM 130 HB3 GLN A 9 82.165 18.315 8.327 1.00 0.00 H ATOM 131 HG2 GLN A 9 82.938 16.234 9.102 1.00 0.00 H ATOM 132 HG3 GLN A 9 81.293 15.561 9.196 1.00 0.00 H ATOM 133 HE22 GLN A 9 83.281 14.102 7.943 1.00 0.00 H ATOM 134 HE21 GLN A 9 82.983 14.096 6.166 1.00 0.00 H ATOM 135 H GLN A 9 80.848 20.092 9.190 1.00 0.00 H ATOM 136 N THR A 10 81.714 16.941 11.991 1.00 35.62 N ATOM 137 CA THR A 10 82.766 16.592 12.954 1.00 35.96 C ATOM 138 C THR A 10 83.618 15.312 12.740 1.00 39.42 C ATOM 139 O THR A 10 84.677 15.158 13.364 1.00 36.51 O ATOM 140 CB THR A 10 82.179 16.585 14.386 1.00 39.31 C ATOM 141 OG1 THR A 10 81.237 15.511 14.509 1.00 41.01 O ATOM 142 CG2 THR A 10 81.455 17.908 14.670 1.00 39.23 C ATOM 143 HA THR A 10 83.496 17.382 12.778 1.00 0.00 H ATOM 144 HB THR A 10 82.994 16.457 15.098 1.00 0.00 H ATOM 145 HG1 THR A 10 80.861 15.506 15.425 1.00 0.00 H ATOM 146 HG23 THR A 10 82.161 18.734 14.580 1.00 0.00 H ATOM 147 HG21 THR A 10 80.646 18.040 13.951 1.00 0.00 H ATOM 148 HG22 THR A 10 81.046 17.887 15.680 1.00 0.00 H ATOM 149 H THR A 10 80.812 16.424 12.009 1.00 0.00 H ATOM 150 N ARG A 11 83.244 14.461 11.792 1.00 36.11 N ATOM 151 CA ARG A 11 83.916 13.162 11.664 1.00 41.66 C ATOM 152 C ARG A 11 83.977 12.697 10.230 1.00 41.06 C ATOM 153 O ARG A 11 83.085 12.980 9.435 1.00 45.27 O ATOM 154 CB ARG A 11 83.219 12.061 12.488 1.00 36.32 C ATOM 155 CG ARG A 11 83.478 12.104 13.969 1.00 41.39 C ATOM 156 CD ARG A 11 83.173 10.762 14.619 1.00 42.94 C ATOM 157 NE ARG A 11 83.263 10.857 16.067 1.00 42.88 N ATOM 158 CZ ARG A 11 84.393 10.719 16.755 1.00 47.94 C ATOM 159 NH1 ARG A 11 85.535 10.476 16.123 1.00 46.13 N ATOM 160 NH2 ARG A 11 84.381 10.833 18.076 1.00 49.15 N ATOM 161 HA ARG A 11 84.925 13.322 12.045 1.00 0.00 H ATOM 162 HB2 ARG A 11 82.144 12.152 12.331 1.00 0.00 H ATOM 163 HB3 ARG A 11 83.559 11.095 12.115 1.00 0.00 H ATOM 164 HG2 ARG A 11 84.525 12.353 14.140 1.00 0.00 H ATOM 165 HG3 ARG A 11 82.846 12.869 14.419 1.00 0.00 H ATOM 166 HD2 ARG A 11 83.890 10.022 14.264 1.00 0.00 H ATOM 167 HD3 ARG A 11 82.165 10.452 14.343 1.00 0.00 H ATOM 168 HE ARG A 11 82.389 11.045 16.598 1.00 0.00 H ATOM 169 HH12 ARG A 11 86.416 10.369 16.665 1.00 0.00 H ATOM 170 HH11 ARG A 11 85.548 10.393 15.086 1.00 0.00 H ATOM 171 HH22 ARG A 11 85.264 10.725 18.615 1.00 0.00 H ATOM 172 HH21 ARG A 11 83.489 11.030 18.573 1.00 0.00 H ATOM 173 H ARG A 11 82.475 14.715 11.140 1.00 0.00 H ATOM 174 N GLY A 12 85.035 11.957 9.922 1.00 44.18 N ATOM 175 CA GLY A 12 85.201 11.363 8.613 1.00 46.48 C ATOM 176 C GLY A 12 84.675 9.948 8.625 1.00 49.51 C ATOM 177 O GLY A 12 84.178 9.471 9.647 1.00 46.11 O ATOM 178 HA3 GLY A 12 86.259 11.354 8.350 1.00 0.00 H ATOM 179 HA2 GLY A 12 84.650 11.948 7.877 1.00 0.00 H ATOM 180 H GLY A 12 85.767 11.799 10.644 1.00 0.00 H ATOM 181 N LEU A 13 84.772 9.280 7.483 1.00 50.60 N ATOM 182 CA LEU A 13 84.293 7.909 7.352 1.00 53.17 C ATOM 183 C LEU A 13 85.041 6.933 8.264 1.00 55.75 C ATOM 184 O LEU A 13 84.429 6.102 8.934 1.00 53.94 O ATOM 185 CB LEU A 13 84.401 7.456 5.897 1.00 53.51 C ATOM 186 CG LEU A 13 84.319 5.951 5.662 1.00 58.87 C ATOM 187 CD1 LEU A 13 82.938 5.426 6.014 1.00 56.85 C ATOM 188 CD2 LEU A 13 84.667 5.638 4.216 1.00 58.16 C ATOM 189 HA LEU A 13 83.249 7.902 7.666 1.00 0.00 H ATOM 190 HB2 LEU A 13 83.591 7.926 5.339 1.00 0.00 H ATOM 191 HB3 LEU A 13 85.358 7.804 5.508 1.00 0.00 H ATOM 192 HG LEU A 13 85.038 5.452 6.311 1.00 0.00 H ATOM 193 HD21 LEU A 13 83.964 6.146 3.556 1.00 0.00 H ATOM 194 HD22 LEU A 13 85.679 5.983 4.004 1.00 0.00 H ATOM 195 HD23 LEU A 13 84.607 4.562 4.054 1.00 0.00 H ATOM 196 HD11 LEU A 13 82.730 5.631 7.064 1.00 0.00 H ATOM 197 HD12 LEU A 13 82.193 5.921 5.391 1.00 0.00 H ATOM 198 HD13 LEU A 13 82.904 4.351 5.838 1.00 0.00 H ATOM 199 H LEU A 13 85.201 9.747 6.659 1.00 0.00 H ATOM 200 N LEU A 14 86.366 7.032 8.296 1.00 50.37 N ATOM 201 CA LEU A 14 87.159 6.078 9.056 1.00 48.81 C ATOM 202 C LEU A 14 87.015 6.282 10.561 1.00 48.85 C ATOM 203 O LEU A 14 86.991 5.319 11.328 1.00 50.79 O ATOM 204 CB LEU A 14 88.630 6.142 8.642 1.00 52.45 C ATOM 205 CG LEU A 14 89.485 4.990 9.172 1.00 56.25 C ATOM 206 CD1 LEU A 14 88.965 3.646 8.650 1.00 47.54 C ATOM 207 CD2 LEU A 14 90.949 5.198 8.791 1.00 60.03 C ATOM 208 HA LEU A 14 86.774 5.085 8.825 1.00 0.00 H ATOM 209 HB2 LEU A 14 88.679 6.131 7.553 1.00 0.00 H ATOM 210 HB3 LEU A 14 89.049 7.077 9.014 1.00 0.00 H ATOM 211 HG LEU A 14 89.415 4.975 10.260 1.00 0.00 H ATOM 212 HD21 LEU A 14 91.038 5.238 7.705 1.00 0.00 H ATOM 213 HD22 LEU A 14 91.306 6.134 9.221 1.00 0.00 H ATOM 214 HD23 LEU A 14 91.544 4.370 9.175 1.00 0.00 H ATOM 215 HD11 LEU A 14 87.936 3.503 8.980 1.00 0.00 H ATOM 216 HD12 LEU A 14 89.003 3.642 7.561 1.00 0.00 H ATOM 217 HD13 LEU A 14 89.588 2.841 9.039 1.00 0.00 H ATOM 218 H LEU A 14 86.839 7.797 7.774 1.00 0.00 H ATOM 219 N GLY A 15 86.920 7.536 10.988 1.00 47.93 N ATOM 220 CA GLY A 15 86.720 7.830 12.396 1.00 47.06 C ATOM 221 C GLY A 15 85.349 7.346 12.851 1.00 48.23 C ATOM 222 O GLY A 15 85.159 6.950 14.004 1.00 46.81 O ATOM 223 HA3 GLY A 15 86.791 8.906 12.552 1.00 0.00 H ATOM 224 HA2 GLY A 15 87.491 7.328 12.981 1.00 0.00 H ATOM 225 H GLY A 15 86.990 8.317 10.305 1.00 0.00 H ATOM 226 N CYS A 16 84.387 7.393 11.937 1.00 46.53 N ATOM 227 CA CYS A 16 83.016 6.994 12.230 1.00 49.23 C ATOM 228 C CYS A 16 82.972 5.497 12.548 1.00 50.25 C ATOM 229 O CYS A 16 82.482 5.078 13.601 1.00 46.66 O ATOM 230 CB CYS A 16 82.124 7.307 11.024 1.00 46.58 C ATOM 231 SG CYS A 16 80.359 6.900 11.228 1.00 49.84 S ATOM 232 HA CYS A 16 82.651 7.548 13.095 1.00 0.00 H ATOM 233 HB2 CYS A 16 82.502 6.744 10.171 1.00 0.00 H ATOM 234 HB3 CYS A 16 82.201 8.374 10.817 1.00 0.00 H ATOM 235 HG CYS A 16 79.676 7.231 10.075 1.00 0.00 H ATOM 236 H CYS A 16 84.620 7.726 10.980 1.00 0.00 H ATOM 237 N ILE A 17 83.507 4.699 11.631 1.00 49.63 N ATOM 238 CA ILE A 17 83.587 3.253 11.807 1.00 48.24 C ATOM 239 C ILE A 17 84.210 2.856 13.142 1.00 51.67 C ATOM 240 O ILE A 17 83.665 2.033 13.883 1.00 53.02 O ATOM 241 CB ILE A 17 84.414 2.627 10.696 1.00 50.09 C ATOM 242 CG1 ILE A 17 83.710 2.818 9.359 1.00 49.86 C ATOM 243 CG2 ILE A 17 84.644 1.149 10.975 1.00 56.80 C ATOM 244 CD1 ILE A 17 84.484 2.249 8.191 1.00 55.78 C ATOM 245 HA ILE A 17 82.560 2.888 11.780 1.00 0.00 H ATOM 246 HB ILE A 17 85.385 3.120 10.655 1.00 0.00 H ATOM 247 HG12 ILE A 17 82.739 2.325 9.405 1.00 0.00 H ATOM 248 HG13 ILE A 17 83.566 3.886 9.192 1.00 0.00 H ATOM 249 HD11 ILE A 17 85.455 2.741 8.126 1.00 0.00 H ATOM 250 HD12 ILE A 17 84.627 1.179 8.338 1.00 0.00 H ATOM 251 HD13 ILE A 17 83.926 2.419 7.270 1.00 0.00 H ATOM 252 HG21 ILE A 17 85.175 1.037 11.920 1.00 0.00 H ATOM 253 HG22 ILE A 17 83.683 0.638 11.034 1.00 0.00 H ATOM 254 HG23 ILE A 17 85.238 0.717 10.170 1.00 0.00 H ATOM 255 H ILE A 17 83.882 5.120 10.757 1.00 0.00 H ATOM 256 N ILE A 18 85.356 3.444 13.446 1.00 44.01 N ATOM 257 CA ILE A 18 86.077 3.092 14.653 1.00 49.35 C ATOM 258 C ILE A 18 85.276 3.461 15.892 1.00 45.06 C ATOM 259 O ILE A 18 85.198 2.695 16.851 1.00 44.63 O ATOM 260 CB ILE A 18 87.453 3.783 14.693 1.00 45.83 C ATOM 261 CG1 ILE A 18 88.330 3.252 13.558 1.00 48.65 C ATOM 262 CG2 ILE A 18 88.118 3.576 16.041 1.00 48.39 C ATOM 263 CD1 ILE A 18 89.737 3.843 13.546 1.00 56.73 C ATOM 264 HA ILE A 18 86.228 2.013 14.644 1.00 0.00 H ATOM 265 HB ILE A 18 87.317 4.856 14.555 1.00 0.00 H ATOM 266 HG12 ILE A 18 88.411 2.170 13.662 1.00 0.00 H ATOM 267 HG13 ILE A 18 87.848 3.489 12.610 1.00 0.00 H ATOM 268 HD11 ILE A 18 89.674 4.925 13.431 1.00 0.00 H ATOM 269 HD12 ILE A 18 90.238 3.605 14.484 1.00 0.00 H ATOM 270 HD13 ILE A 18 90.300 3.420 12.714 1.00 0.00 H ATOM 271 HG21 ILE A 18 87.488 3.998 16.824 1.00 0.00 H ATOM 272 HG22 ILE A 18 88.254 2.509 16.218 1.00 0.00 H ATOM 273 HG23 ILE A 18 89.088 4.073 16.046 1.00 0.00 H ATOM 274 H ILE A 18 85.745 4.169 12.810 1.00 0.00 H ATOM 275 N THR A 19 84.681 4.645 15.871 1.00 44.43 N ATOM 276 CA THR A 19 83.896 5.105 17.006 1.00 42.31 C ATOM 277 C THR A 19 82.680 4.195 17.173 1.00 38.80 C ATOM 278 O THR A 19 82.202 3.975 18.282 1.00 39.63 O ATOM 279 CB THR A 19 83.452 6.574 16.839 1.00 40.96 C ATOM 280 OG1 THR A 19 84.607 7.406 16.668 1.00 47.81 O ATOM 281 CG2 THR A 19 82.702 7.037 18.064 1.00 39.53 C ATOM 282 HA THR A 19 84.519 5.059 17.899 1.00 0.00 H ATOM 283 HB THR A 19 82.802 6.644 15.967 1.00 0.00 H ATOM 284 HG1 THR A 19 85.104 7.117 15.862 1.00 0.00 H ATOM 285 HG23 THR A 19 81.820 6.412 18.206 1.00 0.00 H ATOM 286 HG21 THR A 19 83.350 6.957 18.937 1.00 0.00 H ATOM 287 HG22 THR A 19 82.396 8.075 17.931 1.00 0.00 H ATOM 288 H THR A 19 84.776 5.253 15.033 1.00 0.00 H ATOM 289 N SER A 20 82.192 3.667 16.062 1.00 37.81 N ATOM 290 CA SER A 20 81.077 2.735 16.107 1.00 46.09 C ATOM 291 C SER A 20 81.462 1.471 16.898 1.00 47.34 C ATOM 292 O SER A 20 80.667 0.947 17.674 1.00 41.41 O ATOM 293 CB SER A 20 80.645 2.374 14.688 1.00 41.77 C ATOM 294 OG SER A 20 79.423 1.673 14.703 1.00 49.95 O ATOM 295 HA SER A 20 80.239 3.210 16.617 1.00 0.00 H ATOM 296 HB2 SER A 20 81.411 1.749 14.228 1.00 0.00 H ATOM 297 HB3 SER A 20 80.526 3.288 14.106 1.00 0.00 H ATOM 298 HG SER A 20 78.724 2.239 15.117 1.00 0.00 H ATOM 299 H SER A 20 82.611 3.922 15.145 1.00 0.00 H ATOM 300 N LEU A 21 82.698 1.009 16.710 1.00 48.58 N ATOM 301 CA LEU A 21 83.177 -0.227 17.335 1.00 44.93 C ATOM 302 C LEU A 21 83.573 -0.075 18.802 1.00 45.29 C ATOM 303 O LEU A 21 83.344 -0.977 19.610 1.00 47.24 O ATOM 304 CB LEU A 21 84.366 -0.788 16.551 1.00 49.54 C ATOM 305 CG LEU A 21 84.119 -1.185 15.099 1.00 50.68 C ATOM 306 CD1 LEU A 21 85.046 -2.323 14.732 1.00 55.38 C ATOM 307 CD2 LEU A 21 82.670 -1.598 14.897 1.00 54.58 C ATOM 308 HA LEU A 21 82.331 -0.914 17.309 1.00 0.00 H ATOM 309 HB2 LEU A 21 85.149 -0.030 16.555 1.00 0.00 H ATOM 310 HB3 LEU A 21 84.718 -1.675 17.078 1.00 0.00 H ATOM 311 HG LEU A 21 84.319 -0.330 14.453 1.00 0.00 H ATOM 312 HD21 LEU A 21 82.443 -2.448 15.540 1.00 0.00 H ATOM 313 HD22 LEU A 21 82.017 -0.763 15.152 1.00 0.00 H ATOM 314 HD23 LEU A 21 82.515 -1.877 13.855 1.00 0.00 H ATOM 315 HD11 LEU A 21 86.080 -2.001 14.854 1.00 0.00 H ATOM 316 HD12 LEU A 21 84.850 -3.174 15.384 1.00 0.00 H ATOM 317 HD13 LEU A 21 84.873 -2.611 13.695 1.00 0.00 H ATOM 318 H LEU A 21 83.346 1.545 16.098 1.00 0.00 H ATOM 319 N THR A 22 84.221 1.035 19.142 1.00 45.70 N ATOM 320 CA THR A 22 84.603 1.281 20.532 1.00 44.20 C ATOM 321 C THR A 22 83.481 1.874 21.357 1.00 44.60 C ATOM 322 O THR A 22 83.481 1.766 22.586 1.00 44.29 O ATOM 323 CB THR A 22 85.815 2.226 20.643 1.00 49.68 C ATOM 324 OG1 THR A 22 85.377 3.596 20.583 1.00 44.29 O ATOM 325 CG2 THR A 22 86.822 1.936 19.529 1.00 50.56 C ATOM 326 HA THR A 22 84.857 0.296 20.924 1.00 0.00 H ATOM 327 HB THR A 22 86.307 2.057 21.601 1.00 0.00 H ATOM 328 HG1 THR A 22 86.162 4.196 20.655 1.00 0.00 H ATOM 329 HG23 THR A 22 87.141 0.896 19.591 1.00 0.00 H ATOM 330 HG21 THR A 22 86.354 2.116 18.561 1.00 0.00 H ATOM 331 HG22 THR A 22 87.687 2.590 19.643 1.00 0.00 H ATOM 332 H THR A 22 84.459 1.736 18.411 1.00 0.00 H ATOM 333 N GLY A 23 82.520 2.499 20.681 1.00 41.93 N ATOM 334 CA GLY A 23 81.468 3.224 21.371 1.00 42.53 C ATOM 335 C GLY A 23 82.002 4.411 22.157 1.00 41.29 C ATOM 336 O GLY A 23 81.287 4.994 22.967 1.00 43.53 O ATOM 337 HA3 GLY A 23 80.968 2.544 22.060 1.00 0.00 H ATOM 338 HA2 GLY A 23 80.750 3.586 20.634 1.00 0.00 H ATOM 339 H GLY A 23 82.523 2.468 19.641 1.00 0.00 H ATOM 340 N ARG A 24 83.262 4.766 21.916 1.00 41.23 N ATOM 341 CA ARG A 24 83.916 5.876 22.612 1.00 48.79 C ATOM 342 C ARG A 24 83.992 7.098 21.707 1.00 42.97 C ATOM 343 O ARG A 24 84.642 7.053 20.666 1.00 42.15 O ATOM 344 CB ARG A 24 85.341 5.485 23.007 1.00 51.29 C ATOM 345 CG ARG A 24 85.609 5.345 24.504 1.00 60.76 C ATOM 346 CD ARG A 24 87.092 5.007 24.727 1.00 67.89 C ATOM 347 NE ARG A 24 87.436 4.799 26.132 1.00 75.00 N ATOM 348 CZ ARG A 24 88.638 4.407 26.554 1.00 79.49 C ATOM 349 NH1 ARG A 24 89.607 4.182 25.677 1.00 81.97 N ATOM 350 NH2 ARG A 24 88.874 4.240 27.851 1.00 79.60 N ATOM 351 HA ARG A 24 83.330 6.107 23.501 1.00 0.00 H ATOM 352 HB2 ARG A 24 85.566 4.528 22.537 1.00 0.00 H ATOM 353 HB3 ARG A 24 86.016 6.247 22.617 1.00 0.00 H ATOM 354 HG2 ARG A 24 85.370 6.282 25.006 1.00 0.00 H ATOM 355 HG3 ARG A 24 84.988 4.547 24.912 1.00 0.00 H ATOM 356 HD2 ARG A 24 87.696 5.829 24.341 1.00 0.00 H ATOM 357 HD3 ARG A 24 87.326 4.096 24.175 1.00 0.00 H ATOM 358 HE ARG A 24 86.698 4.967 26.846 1.00 0.00 H ATOM 359 HH12 ARG A 24 90.545 3.876 26.006 1.00 0.00 H ATOM 360 HH11 ARG A 24 89.429 4.311 24.661 1.00 0.00 H ATOM 361 HH22 ARG A 24 89.814 3.934 28.173 1.00 0.00 H ATOM 362 HH21 ARG A 24 88.118 4.415 28.544 1.00 0.00 H ATOM 363 H ARG A 24 83.803 4.234 21.205 1.00 0.00 H ATOM 364 N ASP A 25 83.329 8.184 22.093 1.00 44.46 N ATOM 365 CA ASP A 25 83.425 9.426 21.324 1.00 44.97 C ATOM 366 C ASP A 25 83.871 10.525 22.270 1.00 43.62 C ATOM 367 O ASP A 25 83.149 10.883 23.197 1.00 44.41 O ATOM 368 CB ASP A 25 82.076 9.778 20.675 1.00 43.61 C ATOM 369 CG ASP A 25 82.162 10.985 19.732 1.00 50.74 C ATOM 370 OD1 ASP A 25 83.039 11.853 19.940 1.00 46.83 O ATOM 371 OD2 ASP A 25 81.355 11.072 18.776 1.00 48.67 O ATOM 372 HA ASP A 25 84.147 9.309 20.516 1.00 0.00 H ATOM 373 HB2 ASP A 25 81.729 8.916 20.106 1.00 0.00 H ATOM 374 HB3 ASP A 25 81.359 10.004 21.464 1.00 0.00 H ATOM 375 H ASP A 25 82.738 8.151 22.948 1.00 0.00 H ATOM 376 N LYS A 26 85.078 11.043 22.066 1.00 48.97 N ATOM 377 CA LYS A 26 85.588 12.077 22.971 1.00 50.63 C ATOM 378 C LYS A 26 85.409 13.512 22.452 1.00 51.19 C ATOM 379 O LYS A 26 85.755 14.480 23.133 1.00 53.33 O ATOM 380 CB LYS A 26 87.023 11.773 23.433 1.00 52.07 C ATOM 381 CG LYS A 26 87.080 10.681 24.524 1.00 59.51 C ATOM 382 CD LYS A 26 88.485 10.465 25.096 1.00 58.90 C ATOM 383 CE LYS A 26 89.439 9.929 24.027 1.00 69.50 C ATOM 384 NZ LYS A 26 90.854 9.819 24.505 1.00 70.78 N ATOM 385 HA LYS A 26 84.954 12.035 23.857 1.00 0.00 H ATOM 386 HB2 LYS A 26 87.603 11.438 22.573 1.00 0.00 H ATOM 387 HB3 LYS A 26 87.462 12.688 23.831 1.00 0.00 H ATOM 388 HG2 LYS A 26 86.416 10.971 25.338 1.00 0.00 H ATOM 389 HG3 LYS A 26 86.734 9.742 24.092 1.00 0.00 H ATOM 390 HD2 LYS A 26 88.867 11.415 25.470 1.00 0.00 H ATOM 391 HD3 LYS A 26 88.430 9.749 25.916 1.00 0.00 H ATOM 392 HE2 LYS A 26 89.413 10.602 23.170 1.00 0.00 H ATOM 393 HE3 LYS A 26 89.098 8.940 23.721 1.00 0.00 H ATOM 394 HZ1 LYS A 26 91.196 10.759 24.791 1.00 0.00 H ATOM 395 HZ2 LYS A 26 90.895 9.172 25.318 1.00 0.00 H ATOM 396 HZ3 LYS A 26 91.451 9.451 23.737 1.00 0.00 H ATOM 397 H LYS A 26 85.658 10.716 21.267 1.00 0.00 H ATOM 398 N ASN A 27 84.847 13.636 21.255 1.00 49.37 N ATOM 399 CA ASN A 27 84.598 14.944 20.655 1.00 47.89 C ATOM 400 C ASN A 27 83.720 15.849 21.494 1.00 51.29 C ATOM 401 O ASN A 27 82.826 15.383 22.220 1.00 47.69 O ATOM 402 CB ASN A 27 83.982 14.801 19.264 1.00 47.37 C ATOM 403 CG ASN A 27 85.003 14.443 18.219 1.00 50.56 C ATOM 404 OD1 ASN A 27 86.209 14.553 18.458 1.00 50.93 O ATOM 405 ND2 ASN A 27 84.536 14.015 17.050 1.00 44.59 N ATOM 406 HA ASN A 27 85.578 15.417 20.589 1.00 0.00 H ATOM 407 HB2 ASN A 27 83.224 14.019 19.295 1.00 0.00 H ATOM 408 HB3 ASN A 27 83.515 15.747 18.988 1.00 0.00 H ATOM 409 HD22 ASN A 27 83.510 13.939 16.896 1.00 0.00 H ATOM 410 HD21 ASN A 27 85.196 13.756 16.290 1.00 0.00 H ATOM 411 H ASN A 27 84.577 12.779 20.731 1.00 0.00 H ATOM 412 N GLN A 28 84.001 17.147 21.403 1.00 47.02 N ATOM 413 CA GLN A 28 83.103 18.169 21.901 1.00 47.44 C ATOM 414 C GLN A 28 81.812 18.013 21.133 1.00 43.34 C ATOM 415 O GLN A 28 81.840 17.868 19.915 1.00 47.47 O ATOM 416 CB GLN A 28 83.667 19.564 21.616 1.00 51.42 C ATOM 417 CG GLN A 28 82.625 20.684 21.735 1.00 53.88 C ATOM 418 CD GLN A 28 83.068 22.010 21.105 1.00 60.73 C ATOM 419 OE1 GLN A 28 84.254 22.347 21.099 1.00 64.32 O ATOM 420 NE2 GLN A 28 82.107 22.763 20.572 1.00 54.47 N ATOM 421 HA GLN A 28 82.965 18.063 22.977 1.00 0.00 H ATOM 422 HB2 GLN A 28 84.470 19.763 22.326 1.00 0.00 H ATOM 423 HB3 GLN A 28 84.069 19.573 20.603 1.00 0.00 H ATOM 424 HG2 GLN A 28 81.710 20.357 21.241 1.00 0.00 H ATOM 425 HG3 GLN A 28 82.424 20.856 22.792 1.00 0.00 H ATOM 426 HE22 GLN A 28 81.119 22.441 20.599 1.00 0.00 H ATOM 427 HE21 GLN A 28 82.345 23.673 20.129 1.00 0.00 H ATOM 428 H GLN A 28 84.896 17.437 20.959 1.00 0.00 H ATOM 429 N VAL A 29 80.694 18.028 21.850 1.00 44.28 N ATOM 430 CA VAL A 29 79.371 18.015 21.240 1.00 45.71 C ATOM 431 C VAL A 29 78.830 19.429 21.368 1.00 45.98 C ATOM 432 O VAL A 29 79.058 20.087 22.380 1.00 45.74 O ATOM 433 CB VAL A 29 78.399 17.055 21.984 1.00 46.80 C ATOM 434 CG1 VAL A 29 76.982 17.163 21.418 1.00 40.95 C ATOM 435 CG2 VAL A 29 78.897 15.609 21.939 1.00 41.86 C ATOM 436 HA VAL A 29 79.448 17.676 20.207 1.00 0.00 H ATOM 437 HB VAL A 29 78.370 17.362 23.030 1.00 0.00 H ATOM 438 HG11 VAL A 29 76.622 18.185 21.535 1.00 0.00 H ATOM 439 HG12 VAL A 29 76.993 16.899 20.360 1.00 0.00 H ATOM 440 HG13 VAL A 29 76.324 16.481 21.957 1.00 0.00 H ATOM 441 HG21 VAL A 29 78.976 15.285 20.901 1.00 0.00 H ATOM 442 HG22 VAL A 29 79.876 15.548 22.415 1.00 0.00 H ATOM 443 HG23 VAL A 29 78.193 14.967 22.469 1.00 0.00 H ATOM 444 H VAL A 29 80.766 18.050 22.887 1.00 0.00 H ATOM 445 N ASP A 30 78.122 19.901 20.350 1.00 41.39 N ATOM 446 CA ASP A 30 77.502 21.211 20.418 1.00 40.98 C ATOM 447 C ASP A 30 76.316 21.188 19.468 1.00 37.23 C ATOM 448 O ASP A 30 76.141 20.227 18.735 1.00 34.18 O ATOM 449 CB ASP A 30 78.517 22.282 19.984 1.00 43.05 C ATOM 450 CG ASP A 30 78.032 23.715 20.252 1.00 51.77 C ATOM 451 OD1 ASP A 30 77.159 23.924 21.136 1.00 47.71 O ATOM 452 OD2 ASP A 30 78.529 24.637 19.566 1.00 53.83 O ATOM 453 HA ASP A 30 77.176 21.446 21.431 1.00 0.00 H ATOM 454 HB2 ASP A 30 79.446 22.122 20.531 1.00 0.00 H ATOM 455 HB3 ASP A 30 78.702 22.172 18.915 1.00 0.00 H ATOM 456 H ASP A 30 78.010 19.324 19.492 1.00 0.00 H ATOM 457 N GLY A 31 75.539 22.262 19.432 1.00 35.28 N ATOM 458 CA GLY A 31 74.385 22.308 18.554 1.00 38.82 C ATOM 459 C GLY A 31 73.124 21.685 19.128 1.00 40.11 C ATOM 460 O GLY A 31 73.173 20.851 20.046 1.00 39.64 O ATOM 461 HA3 GLY A 31 74.637 21.780 17.634 1.00 0.00 H ATOM 462 HA2 GLY A 31 74.174 23.353 18.325 1.00 0.00 H ATOM 463 H GLY A 31 75.759 23.078 20.038 1.00 0.00 H ATOM 464 N GLU A 32 71.989 22.113 18.579 1.00 38.54 N ATOM 465 CA GLU A 32 70.667 21.631 18.967 1.00 37.62 C ATOM 466 C GLU A 32 70.335 20.288 18.313 1.00 36.65 C ATOM 467 O GLU A 32 69.572 19.470 18.858 1.00 35.43 O ATOM 468 CB GLU A 32 69.609 22.664 18.551 1.00 41.10 C ATOM 469 CG GLU A 32 69.535 23.930 19.421 1.00 42.73 C ATOM 470 CD GLU A 32 70.520 25.027 19.027 1.00 46.68 C ATOM 471 OE1 GLU A 32 71.381 24.810 18.141 1.00 40.82 O ATOM 472 OE2 GLU A 32 70.426 26.123 19.624 1.00 52.48 O ATOM 473 HA GLU A 32 70.667 21.491 20.048 1.00 0.00 H ATOM 474 HB2 GLU A 32 69.826 22.972 17.528 1.00 0.00 H ATOM 475 HB3 GLU A 32 68.634 22.177 18.584 1.00 0.00 H ATOM 476 HG2 GLU A 32 68.526 24.336 19.347 1.00 0.00 H ATOM 477 HG3 GLU A 32 69.737 23.646 20.454 1.00 0.00 H ATOM 478 H GLU A 32 72.048 22.832 17.830 1.00 0.00 H ATOM 479 N VAL A 33 70.901 20.074 17.130 1.00 32.80 N ATOM 480 CA VAL A 33 70.591 18.899 16.326 1.00 31.62 C ATOM 481 C VAL A 33 71.869 18.159 15.991 1.00 32.75 C ATOM 482 O VAL A 33 72.830 18.749 15.469 1.00 31.22 O ATOM 483 CB VAL A 33 69.888 19.320 15.023 1.00 26.30 C ATOM 484 CG1 VAL A 33 69.707 18.137 14.081 1.00 28.84 C ATOM 485 CG2 VAL A 33 68.567 19.981 15.340 1.00 31.21 C ATOM 486 HA VAL A 33 69.929 18.247 16.895 1.00 0.00 H ATOM 487 HB VAL A 33 70.520 20.042 14.507 1.00 0.00 H ATOM 488 HG11 VAL A 33 70.683 17.722 13.829 1.00 0.00 H ATOM 489 HG12 VAL A 33 69.101 17.374 14.570 1.00 0.00 H ATOM 490 HG13 VAL A 33 69.207 18.471 13.172 1.00 0.00 H ATOM 491 HG21 VAL A 33 67.932 19.280 15.881 1.00 0.00 H ATOM 492 HG22 VAL A 33 68.742 20.863 15.955 1.00 0.00 H ATOM 493 HG23 VAL A 33 68.077 20.275 14.412 1.00 0.00 H ATOM 494 H VAL A 33 71.586 20.767 16.767 1.00 0.00 H ATOM 495 N GLN A 34 71.889 16.860 16.284 1.00 30.56 N ATOM 496 CA GLN A 34 73.051 16.046 15.979 1.00 28.02 C ATOM 497 C GLN A 34 72.832 15.256 14.698 1.00 29.85 C ATOM 498 O GLN A 34 71.728 14.768 14.430 1.00 26.05 O ATOM 499 CB GLN A 34 73.382 15.100 17.136 1.00 29.57 C ATOM 500 CG GLN A 34 73.555 15.809 18.470 1.00 33.58 C ATOM 501 CD GLN A 34 74.619 16.894 18.413 1.00 35.09 C ATOM 502 OE1 GLN A 34 75.710 16.684 17.894 1.00 30.29 O ATOM 503 NE2 GLN A 34 74.294 18.063 18.942 1.00 36.16 N ATOM 504 HA GLN A 34 73.898 16.716 15.835 1.00 0.00 H ATOM 505 HB2 GLN A 34 72.573 14.376 17.232 1.00 0.00 H ATOM 506 HB3 GLN A 34 74.309 14.577 16.900 1.00 0.00 H ATOM 507 HG2 GLN A 34 72.605 16.264 18.752 1.00 0.00 H ATOM 508 HG3 GLN A 34 73.842 15.075 19.223 1.00 0.00 H ATOM 509 HE22 GLN A 34 73.357 18.197 19.372 1.00 0.00 H ATOM 510 HE21 GLN A 34 74.976 18.848 18.928 1.00 0.00 H ATOM 511 H GLN A 34 71.061 16.423 16.737 1.00 0.00 H ATOM 512 N VAL A 35 73.892 15.142 13.906 1.00 27.84 N ATOM 513 CA VAL A 35 73.845 14.379 12.675 1.00 29.46 C ATOM 514 C VAL A 35 74.417 13.005 13.006 1.00 29.30 C ATOM 515 O VAL A 35 75.543 12.900 13.460 1.00 33.14 O ATOM 516 CB VAL A 35 74.678 15.026 11.550 1.00 27.35 C ATOM 517 CG1 VAL A 35 74.596 14.158 10.278 1.00 30.70 C ATOM 518 CG2 VAL A 35 74.179 16.480 11.241 1.00 25.82 C ATOM 519 HA VAL A 35 72.819 14.330 12.310 1.00 0.00 H ATOM 520 HB VAL A 35 75.714 15.089 11.882 1.00 0.00 H ATOM 521 HG11 VAL A 35 74.988 13.164 10.492 1.00 0.00 H ATOM 522 HG12 VAL A 35 73.557 14.080 9.960 1.00 0.00 H ATOM 523 HG13 VAL A 35 75.186 14.619 9.486 1.00 0.00 H ATOM 524 HG21 VAL A 35 73.136 16.446 10.927 1.00 0.00 H ATOM 525 HG22 VAL A 35 74.270 17.092 12.138 1.00 0.00 H ATOM 526 HG23 VAL A 35 74.786 16.909 10.444 1.00 0.00 H ATOM 527 H VAL A 35 74.779 15.613 14.176 1.00 0.00 H ATOM 528 N LEU A 36 73.637 11.961 12.786 1.00 29.56 N ATOM 529 CA LEU A 36 73.986 10.646 13.311 1.00 29.93 C ATOM 530 C LEU A 36 74.222 9.667 12.202 1.00 30.76 C ATOM 531 O LEU A 36 73.656 9.796 11.121 1.00 31.21 O ATOM 532 CB LEU A 36 72.855 10.107 14.181 1.00 33.87 C ATOM 533 CG LEU A 36 72.420 10.923 15.381 1.00 32.35 C ATOM 534 CD1 LEU A 36 71.266 10.184 16.070 1.00 30.38 C ATOM 535 CD2 LEU A 36 73.605 11.147 16.322 1.00 32.53 C ATOM 536 HA LEU A 36 74.897 10.762 13.898 1.00 0.00 H ATOM 537 HB2 LEU A 36 71.983 9.987 13.539 1.00 0.00 H ATOM 538 HB3 LEU A 36 73.169 9.131 14.551 1.00 0.00 H ATOM 539 HG LEU A 36 72.071 11.909 15.074 1.00 0.00 H ATOM 540 HD21 LEU A 36 73.984 10.183 16.662 1.00 0.00 H ATOM 541 HD22 LEU A 36 74.393 11.682 15.791 1.00 0.00 H ATOM 542 HD23 LEU A 36 73.280 11.735 17.180 1.00 0.00 H ATOM 543 HD11 LEU A 36 70.437 10.074 15.370 1.00 0.00 H ATOM 544 HD12 LEU A 36 71.606 9.199 16.389 1.00 0.00 H ATOM 545 HD13 LEU A 36 70.937 10.755 16.938 1.00 0.00 H ATOM 546 H LEU A 36 72.765 12.079 12.232 1.00 0.00 H ATOM 547 N SER A 37 75.026 8.649 12.487 1.00 31.68 N ATOM 548 CA SER A 37 75.280 7.634 11.493 1.00 32.98 C ATOM 549 C SER A 37 75.439 6.249 12.125 1.00 33.97 C ATOM 550 O SER A 37 75.916 6.098 13.251 1.00 32.09 O ATOM 551 CB SER A 37 76.522 8.003 10.668 1.00 39.18 C ATOM 552 OG SER A 37 76.787 7.032 9.668 1.00 45.66 O ATOM 553 HA SER A 37 74.416 7.589 10.830 1.00 0.00 H ATOM 554 HB2 SER A 37 77.383 8.071 11.333 1.00 0.00 H ATOM 555 HB3 SER A 37 76.357 8.969 10.190 1.00 0.00 H ATOM 556 HG SER A 37 76.943 6.153 10.096 1.00 0.00 H ATOM 557 H SER A 37 75.472 8.583 13.424 1.00 0.00 H ATOM 558 N THR A 38 74.993 5.252 11.387 1.00 31.88 N ATOM 559 CA THR A 38 75.252 3.863 11.718 1.00 40.65 C ATOM 560 C THR A 38 76.018 3.329 10.528 1.00 47.22 C ATOM 561 O THR A 38 76.347 4.086 9.607 1.00 47.06 O ATOM 562 CB THR A 38 73.956 3.057 11.827 1.00 40.60 C ATOM 563 OG1 THR A 38 73.294 3.077 10.555 1.00 42.83 O ATOM 564 CG2 THR A 38 73.037 3.647 12.896 1.00 37.77 C ATOM 565 HA THR A 38 75.776 3.785 12.671 1.00 0.00 H ATOM 566 HB THR A 38 74.195 2.033 12.113 1.00 0.00 H ATOM 567 HG1 THR A 38 73.089 4.013 10.306 1.00 0.00 H ATOM 568 HG23 THR A 38 73.545 3.629 13.860 1.00 0.00 H ATOM 569 HG21 THR A 38 72.789 4.675 12.633 1.00 0.00 H ATOM 570 HG22 THR A 38 72.123 3.056 12.954 1.00 0.00 H ATOM 571 H THR A 38 74.435 5.469 10.536 1.00 0.00 H ATOM 572 N ALA A 39 76.306 2.033 10.536 1.00 49.27 N ATOM 573 CA ALA A 39 76.970 1.412 9.392 1.00 51.59 C ATOM 574 C ALA A 39 76.237 1.697 8.079 1.00 51.92 C ATOM 575 O ALA A 39 76.851 2.091 7.090 1.00 54.71 O ATOM 576 CB ALA A 39 77.105 -0.098 9.608 1.00 54.30 C ATOM 577 HA ALA A 39 77.964 1.853 9.314 1.00 0.00 H ATOM 578 HB1 ALA A 39 77.695 -0.284 10.506 1.00 0.00 H ATOM 579 HB2 ALA A 39 76.114 -0.537 9.725 1.00 0.00 H ATOM 580 HB3 ALA A 39 77.602 -0.544 8.746 1.00 0.00 H ATOM 581 H ALA A 39 76.057 1.455 11.364 1.00 0.00 H ATOM 582 N THR A 40 74.937 1.427 8.053 1.00 47.22 N ATOM 583 CA THR A 40 74.156 1.610 6.836 1.00 49.36 C ATOM 584 C THR A 40 73.378 2.930 6.618 1.00 49.81 C ATOM 585 O THR A 40 72.946 3.203 5.496 1.00 48.09 O ATOM 586 CB THR A 40 73.148 0.474 6.731 1.00 53.78 C ATOM 587 OG1 THR A 40 72.394 0.411 7.951 1.00 55.54 O ATOM 588 CG2 THR A 40 73.880 -0.858 6.519 1.00 55.29 C ATOM 589 HA THR A 40 74.929 1.633 6.068 1.00 0.00 H ATOM 590 HB THR A 40 72.483 0.653 5.886 1.00 0.00 H ATOM 591 HG1 THR A 40 73.009 0.246 8.709 1.00 0.00 H ATOM 592 HG23 THR A 40 74.453 -0.813 5.593 1.00 0.00 H ATOM 593 HG21 THR A 40 74.554 -1.038 7.357 1.00 0.00 H ATOM 594 HG22 THR A 40 73.151 -1.666 6.457 1.00 0.00 H ATOM 595 H THR A 40 74.469 1.080 8.914 1.00 0.00 H ATOM 596 N GLN A 41 73.226 3.766 7.645 1.00 44.16 N ATOM 597 CA GLN A 41 72.266 4.875 7.526 1.00 40.53 C ATOM 598 C GLN A 41 72.683 6.132 8.263 1.00 40.57 C ATOM 599 O GLN A 41 73.402 6.067 9.254 1.00 37.30 O ATOM 600 CB GLN A 41 70.899 4.461 8.075 1.00 41.98 C ATOM 601 CG GLN A 41 70.252 3.274 7.398 1.00 49.38 C ATOM 602 CD GLN A 41 68.907 2.935 8.009 1.00 44.46 C ATOM 603 OE1 GLN A 41 67.888 2.952 7.326 1.00 50.11 O ATOM 604 NE2 GLN A 41 68.897 2.635 9.309 1.00 46.13 N ATOM 605 HA GLN A 41 72.227 5.099 6.460 1.00 0.00 H ATOM 606 HB2 GLN A 41 71.021 4.219 9.131 1.00 0.00 H ATOM 607 HB3 GLN A 41 70.226 5.312 7.974 1.00 0.00 H ATOM 608 HG2 GLN A 41 70.111 3.505 6.342 1.00 0.00 H ATOM 609 HG3 GLN A 41 70.911 2.411 7.495 1.00 0.00 H ATOM 610 HE22 GLN A 41 69.786 2.633 9.849 1.00 0.00 H ATOM 611 HE21 GLN A 41 68.000 2.403 9.782 1.00 0.00 H ATOM 612 H GLN A 41 73.777 3.636 8.517 1.00 0.00 H ATOM 613 N SER A 42 72.193 7.275 7.790 1.00 37.51 N ATOM 614 CA SER A 42 72.395 8.533 8.496 1.00 36.56 C ATOM 615 C SER A 42 71.048 9.236 8.711 1.00 31.65 C ATOM 616 O SER A 42 70.125 9.083 7.925 1.00 31.48 O ATOM 617 CB SER A 42 73.418 9.419 7.769 1.00 35.32 C ATOM 618 OG SER A 42 73.855 10.506 8.588 1.00 38.21 O ATOM 619 HA SER A 42 72.817 8.327 9.480 1.00 0.00 H ATOM 620 HB2 SER A 42 72.959 9.820 6.865 1.00 0.00 H ATOM 621 HB3 SER A 42 74.282 8.812 7.498 1.00 0.00 H ATOM 622 HG SER A 42 74.279 10.150 9.409 1.00 0.00 H ATOM 623 H SER A 42 71.656 7.270 6.900 1.00 0.00 H ATOM 624 N PHE A 43 70.949 9.961 9.818 1.00 30.83 N ATOM 625 CA PHE A 43 69.709 10.575 10.263 1.00 30.29 C ATOM 626 C PHE A 43 70.069 11.592 11.335 1.00 27.82 C ATOM 627 O PHE A 43 71.252 11.896 11.544 1.00 30.18 O ATOM 628 CB PHE A 43 68.693 9.525 10.766 1.00 28.35 C ATOM 629 CG PHE A 43 69.284 8.496 11.692 1.00 30.62 C ATOM 630 CD1 PHE A 43 69.955 7.391 11.179 1.00 29.89 C ATOM 631 CD2 PHE A 43 69.176 8.634 13.068 1.00 27.56 C ATOM 632 CE1 PHE A 43 70.517 6.440 12.022 1.00 29.68 C ATOM 633 CE2 PHE A 43 69.735 7.693 13.924 1.00 30.70 C ATOM 634 CZ PHE A 43 70.408 6.587 13.402 1.00 28.14 C ATOM 635 HA PHE A 43 69.212 11.073 9.430 1.00 0.00 H ATOM 636 HB2 PHE A 43 67.895 10.046 11.296 1.00 0.00 H ATOM 637 HB3 PHE A 43 68.276 9.009 9.901 1.00 0.00 H ATOM 638 HD2 PHE A 43 68.646 9.491 13.483 1.00 0.00 H ATOM 639 HE2 PHE A 43 69.648 7.818 15.003 1.00 0.00 H ATOM 640 HZ PHE A 43 70.845 5.844 14.070 1.00 0.00 H ATOM 641 HE1 PHE A 43 71.042 5.581 11.604 1.00 0.00 H ATOM 642 HD1 PHE A 43 70.041 7.269 10.099 1.00 0.00 H ATOM 643 H PHE A 43 71.802 10.097 10.397 1.00 0.00 H ATOM 644 N LEU A 44 69.056 12.158 11.975 1.00 24.25 N ATOM 645 CA LEU A 44 69.254 13.273 12.892 1.00 27.07 C ATOM 646 C LEU A 44 68.712 12.930 14.271 1.00 25.16 C ATOM 647 O LEU A 44 67.906 12.009 14.421 1.00 27.05 O ATOM 648 CB LEU A 44 68.556 14.534 12.356 1.00 25.37 C ATOM 649 CG LEU A 44 68.986 15.024 10.978 1.00 28.21 C ATOM 650 CD1 LEU A 44 68.098 16.191 10.509 1.00 25.21 C ATOM 651 CD2 LEU A 44 70.476 15.421 10.968 1.00 23.87 C ATOM 652 HA LEU A 44 70.324 13.466 12.972 1.00 0.00 H ATOM 653 HB2 LEU A 44 67.487 14.327 12.314 1.00 0.00 H ATOM 654 HB3 LEU A 44 68.741 15.340 13.066 1.00 0.00 H ATOM 655 HG LEU A 44 68.859 14.201 10.275 1.00 0.00 H ATOM 656 HD21 LEU A 44 70.643 16.221 11.690 1.00 0.00 H ATOM 657 HD22 LEU A 44 71.083 14.556 11.235 1.00 0.00 H ATOM 658 HD23 LEU A 44 70.752 15.766 9.972 1.00 0.00 H ATOM 659 HD11 LEU A 44 67.061 15.858 10.456 1.00 0.00 H ATOM 660 HD12 LEU A 44 68.181 17.016 11.217 1.00 0.00 H ATOM 661 HD13 LEU A 44 68.426 16.522 9.524 1.00 0.00 H ATOM 662 H LEU A 44 68.093 11.797 11.819 1.00 0.00 H ATOM 663 N ALA A 45 69.179 13.668 15.271 1.00 27.51 N ATOM 664 CA ALA A 45 68.652 13.604 16.631 1.00 26.61 C ATOM 665 C ALA A 45 68.396 15.026 17.097 1.00 31.02 C ATOM 666 O ALA A 45 69.177 15.937 16.826 1.00 29.06 O ATOM 667 CB ALA A 45 69.635 12.927 17.576 1.00 28.23 C ATOM 668 HA ALA A 45 67.734 13.017 16.635 1.00 0.00 H ATOM 669 HB1 ALA A 45 69.828 11.911 17.231 1.00 0.00 H ATOM 670 HB2 ALA A 45 70.568 13.490 17.592 1.00 0.00 H ATOM 671 HB3 ALA A 45 69.210 12.897 18.579 1.00 0.00 H ATOM 672 H ALA A 45 69.961 14.326 15.075 1.00 0.00 H ATOM 673 N THR A 46 67.308 15.211 17.822 1.00 25.59 N ATOM 674 CA THR A 46 67.000 16.518 18.353 1.00 36.07 C ATOM 675 C THR A 46 67.097 16.453 19.867 1.00 35.69 C ATOM 676 O THR A 46 66.466 15.603 20.504 1.00 31.84 O ATOM 677 CB THR A 46 65.588 16.971 17.901 1.00 29.73 C ATOM 678 OG1 THR A 46 65.573 17.080 16.465 1.00 32.48 O ATOM 679 CG2 THR A 46 65.253 18.312 18.492 1.00 33.15 C ATOM 680 HA THR A 46 67.710 17.253 17.974 1.00 0.00 H ATOM 681 HB THR A 46 64.854 16.239 18.239 1.00 0.00 H ATOM 682 HG1 THR A 46 65.787 16.200 16.066 1.00 0.00 H ATOM 683 HG23 THR A 46 65.262 18.241 19.580 1.00 0.00 H ATOM 684 HG21 THR A 46 65.992 19.045 18.169 1.00 0.00 H ATOM 685 HG22 THR A 46 64.263 18.619 18.155 1.00 0.00 H ATOM 686 H THR A 46 66.670 14.412 18.011 1.00 0.00 H ATOM 687 N CYS A 47 67.895 17.336 20.452 1.00 33.33 N ATOM 688 CA CYS A 47 68.018 17.352 21.905 1.00 37.42 C ATOM 689 C CYS A 47 66.975 18.266 22.530 1.00 38.44 C ATOM 690 O CYS A 47 66.933 19.470 22.256 1.00 39.55 O ATOM 691 CB CYS A 47 69.444 17.740 22.317 1.00 42.57 C ATOM 692 SG CYS A 47 70.671 16.528 21.716 1.00 59.21 S ATOM 693 HA CYS A 47 67.828 16.347 22.283 1.00 0.00 H ATOM 694 HB2 CYS A 47 69.497 17.788 23.405 1.00 0.00 H ATOM 695 HB3 CYS A 47 69.679 18.719 21.899 1.00 0.00 H ATOM 696 HG CYS A 47 71.817 17.293 21.798 1.00 0.00 H ATOM 697 H CYS A 47 68.432 18.015 19.876 1.00 0.00 H ATOM 698 N VAL A 48 66.116 17.675 23.351 1.00 33.04 N ATOM 699 CA VAL A 48 65.011 18.381 23.975 1.00 37.88 C ATOM 700 C VAL A 48 64.976 17.998 25.452 1.00 44.51 C ATOM 701 O VAL A 48 64.838 16.823 25.785 1.00 44.01 O ATOM 702 CB VAL A 48 63.657 17.963 23.347 1.00 40.58 C ATOM 703 CG1 VAL A 48 62.506 18.733 23.989 1.00 42.34 C ATOM 704 CG2 VAL A 48 63.665 18.173 21.849 1.00 39.87 C ATOM 705 HA VAL A 48 65.155 19.452 23.834 1.00 0.00 H ATOM 706 HB VAL A 48 63.512 16.900 23.539 1.00 0.00 H ATOM 707 HG11 VAL A 48 62.480 18.521 25.058 1.00 0.00 H ATOM 708 HG12 VAL A 48 62.653 19.802 23.833 1.00 0.00 H ATOM 709 HG13 VAL A 48 61.565 18.424 23.533 1.00 0.00 H ATOM 710 HG21 VAL A 48 63.841 19.227 21.632 1.00 0.00 H ATOM 711 HG22 VAL A 48 64.458 17.572 21.403 1.00 0.00 H ATOM 712 HG23 VAL A 48 62.702 17.871 21.436 1.00 0.00 H ATOM 713 H VAL A 48 66.239 16.663 23.556 1.00 0.00 H ATOM 714 N ASN A 49 65.116 18.985 26.328 1.00 45.69 N ATOM 715 CA ASN A 49 65.100 18.758 27.775 1.00 46.79 C ATOM 716 C ASN A 49 66.025 17.653 28.269 1.00 43.52 C ATOM 717 O ASN A 49 65.608 16.762 29.003 1.00 49.19 O ATOM 718 CB ASN A 49 63.673 18.528 28.261 1.00 48.75 C ATOM 719 CG ASN A 49 62.826 19.778 28.146 1.00 53.68 C ATOM 720 OD1 ASN A 49 63.358 20.881 28.005 1.00 56.07 O ATOM 721 ND2 ASN A 49 61.507 19.617 28.204 1.00 55.46 N ATOM 722 HA ASN A 49 65.502 19.672 28.212 1.00 0.00 H ATOM 723 HB2 ASN A 49 63.220 17.739 27.661 1.00 0.00 H ATOM 724 HB3 ASN A 49 63.702 18.217 29.305 1.00 0.00 H ATOM 725 HD22 ASN A 49 61.104 18.666 28.324 1.00 0.00 H ATOM 726 HD21 ASN A 49 60.879 20.442 28.129 1.00 0.00 H ATOM 727 H ASN A 49 65.242 19.955 25.974 1.00 0.00 H ATOM 728 N GLY A 50 67.285 17.728 27.868 1.00 43.41 N ATOM 729 CA GLY A 50 68.290 16.787 28.322 1.00 45.20 C ATOM 730 C GLY A 50 68.266 15.388 27.715 1.00 46.18 C ATOM 731 O GLY A 50 69.049 14.534 28.121 1.00 45.92 O ATOM 732 HA3 GLY A 50 68.173 16.678 29.400 1.00 0.00 H ATOM 733 HA2 GLY A 50 69.266 17.221 28.106 1.00 0.00 H ATOM 734 H GLY A 50 67.561 18.483 27.209 1.00 0.00 H ATOM 735 N VAL A 51 67.381 15.147 26.751 1.00 45.70 N ATOM 736 CA VAL A 51 67.373 13.872 26.031 1.00 40.33 C ATOM 737 C VAL A 51 67.600 14.130 24.546 1.00 36.99 C ATOM 738 O VAL A 51 67.053 15.080 24.007 1.00 38.33 O ATOM 739 CB VAL A 51 66.047 13.124 26.228 1.00 36.70 C ATOM 740 CG1 VAL A 51 66.020 11.827 25.399 1.00 35.90 C ATOM 741 CG2 VAL A 51 65.840 12.797 27.704 1.00 44.69 C ATOM 742 HA VAL A 51 68.173 13.249 26.430 1.00 0.00 H ATOM 743 HB VAL A 51 65.239 13.771 25.886 1.00 0.00 H ATOM 744 HG11 VAL A 51 66.132 12.070 24.342 1.00 0.00 H ATOM 745 HG12 VAL A 51 66.839 11.179 25.713 1.00 0.00 H ATOM 746 HG13 VAL A 51 65.070 11.316 25.557 1.00 0.00 H ATOM 747 HG21 VAL A 51 66.660 12.169 28.054 1.00 0.00 H ATOM 748 HG22 VAL A 51 65.817 13.722 28.280 1.00 0.00 H ATOM 749 HG23 VAL A 51 64.896 12.267 27.828 1.00 0.00 H ATOM 750 H VAL A 51 66.683 15.877 26.505 1.00 0.00 H ATOM 751 N CYS A 52 68.436 13.315 23.905 1.00 39.70 N ATOM 752 CA CYS A 52 68.616 13.376 22.455 1.00 33.77 C ATOM 753 C CYS A 52 67.671 12.378 21.818 1.00 34.85 C ATOM 754 O CYS A 52 67.811 11.165 22.015 1.00 31.34 O ATOM 755 CB CYS A 52 70.073 13.079 22.057 1.00 39.38 C ATOM 756 SG CYS A 52 71.145 14.549 22.039 1.00 59.30 S ATOM 757 HA CYS A 52 68.391 14.383 22.103 1.00 0.00 H ATOM 758 HB2 CYS A 52 70.074 12.640 21.059 1.00 0.00 H ATOM 759 HB3 CYS A 52 70.484 12.362 22.768 1.00 0.00 H ATOM 760 HG CYS A 52 72.222 14.201 21.249 1.00 0.00 H ATOM 761 H CYS A 52 68.977 12.615 24.452 1.00 0.00 H ATOM 762 N TRP A 53 66.698 12.884 21.070 1.00 31.36 N ATOM 763 CA TRP A 53 65.638 12.047 20.543 1.00 30.38 C ATOM 764 C TRP A 53 65.822 11.779 19.067 1.00 29.15 C ATOM 765 O TRP A 53 66.181 12.672 18.298 1.00 26.38 O ATOM 766 CB TRP A 53 64.288 12.736 20.722 1.00 30.88 C ATOM 767 CG TRP A 53 63.929 13.036 22.119 1.00 34.82 C ATOM 768 CD1 TRP A 53 64.122 14.217 22.781 1.00 39.45 C ATOM 769 CD2 TRP A 53 63.287 12.156 23.042 1.00 36.02 C ATOM 770 NE1 TRP A 53 63.647 14.120 24.068 1.00 39.36 N ATOM 771 CE2 TRP A 53 63.116 12.871 24.251 1.00 41.14 C ATOM 772 CE3 TRP A 53 62.836 10.831 22.968 1.00 33.58 C ATOM 773 CZ2 TRP A 53 62.522 12.303 25.378 1.00 40.70 C ATOM 774 CZ3 TRP A 53 62.240 10.270 24.087 1.00 37.28 C ATOM 775 CH2 TRP A 53 62.089 11.009 25.275 1.00 43.18 C ATOM 776 HA TRP A 53 65.673 11.106 21.091 1.00 0.00 H ATOM 777 HB2 TRP A 53 64.310 13.674 20.168 1.00 0.00 H ATOM 778 HB3 TRP A 53 63.518 12.087 20.305 1.00 0.00 H ATOM 779 HE1 TRP A 53 63.685 14.872 24.785 1.00 0.00 H ATOM 780 HD1 TRP A 53 64.585 15.105 22.351 1.00 0.00 H ATOM 781 HZ2 TRP A 53 62.407 12.867 26.304 1.00 0.00 H ATOM 782 HH2 TRP A 53 61.615 10.538 26.136 1.00 0.00 H ATOM 783 HZ3 TRP A 53 61.883 9.241 24.046 1.00 0.00 H ATOM 784 HE3 TRP A 53 62.951 10.254 22.050 1.00 0.00 H ATOM 785 H TRP A 53 66.696 13.902 20.858 1.00 0.00 H ATOM 786 N THR A 54 65.533 10.554 18.651 1.00 28.28 N ATOM 787 CA THR A 54 65.615 10.234 17.238 1.00 26.84 C ATOM 788 C THR A 54 64.632 9.118 16.936 1.00 24.83 C ATOM 789 O THR A 54 63.846 8.727 17.801 1.00 25.66 O ATOM 790 CB THR A 54 67.067 9.854 16.813 1.00 27.64 C ATOM 791 OG1 THR A 54 67.152 9.783 15.381 1.00 28.55 O ATOM 792 CG2 THR A 54 67.485 8.507 17.408 1.00 28.21 C ATOM 793 HA THR A 54 65.352 11.116 16.654 1.00 0.00 H ATOM 794 HB THR A 54 67.739 10.624 17.190 1.00 0.00 H ATOM 795 HG1 THR A 54 66.917 10.663 14.994 1.00 0.00 H ATOM 796 HG23 THR A 54 67.422 8.556 18.495 1.00 0.00 H ATOM 797 HG21 THR A 54 66.820 7.726 17.039 1.00 0.00 H ATOM 798 HG22 THR A 54 68.510 8.283 17.112 1.00 0.00 H ATOM 799 H THR A 54 65.248 9.824 19.335 1.00 0.00 H ATOM 800 N VAL A 55 64.676 8.609 15.714 1.00 26.19 N ATOM 801 CA VAL A 55 63.735 7.592 15.275 1.00 27.78 C ATOM 802 C VAL A 55 64.271 6.176 15.477 1.00 30.58 C ATOM 803 O VAL A 55 65.475 5.933 15.342 1.00 29.37 O ATOM 804 CB VAL A 55 63.322 7.794 13.803 1.00 29.78 C ATOM 805 CG1 VAL A 55 62.355 8.962 13.697 1.00 29.40 C ATOM 806 CG2 VAL A 55 64.535 8.034 12.924 1.00 30.05 C ATOM 807 HA VAL A 55 62.852 7.708 15.904 1.00 0.00 H ATOM 808 HB VAL A 55 62.830 6.886 13.454 1.00 0.00 H ATOM 809 HG11 VAL A 55 61.469 8.754 14.296 1.00 0.00 H ATOM 810 HG12 VAL A 55 62.839 9.867 14.064 1.00 0.00 H ATOM 811 HG13 VAL A 55 62.067 9.100 12.655 1.00 0.00 H ATOM 812 HG21 VAL A 55 65.059 8.927 13.266 1.00 0.00 H ATOM 813 HG22 VAL A 55 65.202 7.174 12.985 1.00 0.00 H ATOM 814 HG23 VAL A 55 64.213 8.173 11.892 1.00 0.00 H ATOM 815 H VAL A 55 65.403 8.946 15.051 1.00 0.00 H ATOM 816 N TYR A 56 63.372 5.256 15.819 1.00 26.41 N ATOM 817 CA TYR A 56 63.753 3.856 16.012 1.00 28.43 C ATOM 818 C TYR A 56 64.180 3.238 14.685 1.00 31.60 C ATOM 819 O TYR A 56 65.082 2.386 14.624 1.00 30.37 O ATOM 820 CB TYR A 56 62.599 3.045 16.628 1.00 32.32 C ATOM 821 CG TYR A 56 63.020 1.625 16.920 1.00 36.11 C ATOM 822 CD1 TYR A 56 63.597 1.297 18.135 1.00 32.80 C ATOM 823 CD2 TYR A 56 62.883 0.621 15.961 1.00 36.52 C ATOM 824 CE1 TYR A 56 64.018 0.004 18.402 1.00 34.17 C ATOM 825 CE2 TYR A 56 63.294 -0.679 16.224 1.00 36.69 C ATOM 826 CZ TYR A 56 63.863 -0.978 17.441 1.00 39.35 C ATOM 827 OH TYR A 56 64.279 -2.272 17.714 1.00 44.32 O ATOM 828 HA TYR A 56 64.594 3.828 16.705 1.00 0.00 H ATOM 829 HB3 TYR A 56 61.762 3.031 15.930 1.00 0.00 H ATOM 830 HB2 TYR A 56 62.287 3.521 17.557 1.00 0.00 H ATOM 831 HD2 TYR A 56 62.447 0.861 14.991 1.00 0.00 H ATOM 832 HE2 TYR A 56 63.167 -1.457 15.472 1.00 0.00 H ATOM 833 HE1 TYR A 56 64.469 -0.238 19.364 1.00 0.00 H ATOM 834 HD1 TYR A 56 63.722 2.069 18.894 1.00 0.00 H ATOM 835 HH TYR A 56 64.662 -2.309 18.626 1.00 0.00 H ATOM 836 H TYR A 56 62.380 5.537 15.952 1.00 0.00 H ATOM 837 N HIS A 57 63.549 3.679 13.607 1.00 30.46 N ATOM 838 CA HIS A 57 63.874 3.126 12.304 1.00 33.88 C ATOM 839 C HIS A 57 65.257 3.562 11.795 1.00 33.29 C ATOM 840 O HIS A 57 65.750 3.005 10.820 1.00 32.12 O ATOM 841 CB HIS A 57 62.756 3.378 11.280 1.00 33.60 C ATOM 842 CG HIS A 57 62.780 4.739 10.652 1.00 33.13 C ATOM 843 ND1 HIS A 57 61.987 5.780 11.091 1.00 31.26 N ATOM 844 CD2 HIS A 57 63.456 5.208 9.577 1.00 31.43 C ATOM 845 CE1 HIS A 57 62.198 6.842 10.333 1.00 34.33 C ATOM 846 NE2 HIS A 57 63.090 6.523 9.407 1.00 34.59 N ATOM 847 HA HIS A 57 63.941 2.046 12.435 1.00 0.00 H ATOM 848 HB2 HIS A 57 62.847 2.636 10.487 1.00 0.00 H ATOM 849 HB3 HIS A 57 61.798 3.253 11.785 1.00 0.00 H ATOM 850 HD2 HIS A 57 64.159 4.648 8.961 1.00 0.00 H ATOM 851 HE1 HIS A 57 61.720 7.814 10.450 1.00 0.00 H ATOM 852 H HIS A 57 62.823 4.419 13.693 1.00 0.00 H ATOM 853 N GLY A 58 65.811 4.643 12.343 1.00 31.47 N ATOM 854 CA GLY A 58 67.248 4.875 12.262 1.00 33.78 C ATOM 855 C GLY A 58 68.171 4.183 13.256 1.00 30.79 C ATOM 856 O GLY A 58 69.123 3.515 12.870 1.00 32.79 O ATOM 857 HA3 GLY A 58 67.404 5.948 12.376 1.00 0.00 H ATOM 858 HA2 GLY A 58 67.565 4.567 11.266 1.00 0.00 H ATOM 859 H GLY A 58 65.209 5.332 12.836 1.00 0.00 H ATOM 860 N ALA A 59 67.873 4.341 14.545 1.00 29.38 N ATOM 861 CA ALA A 59 68.788 3.921 15.600 1.00 31.27 C ATOM 862 C ALA A 59 68.576 2.511 16.142 1.00 32.91 C ATOM 863 O ALA A 59 69.463 1.971 16.802 1.00 31.91 O ATOM 864 CB ALA A 59 68.730 4.899 16.745 1.00 31.22 C ATOM 865 HA ALA A 59 69.768 3.906 15.123 1.00 0.00 H ATOM 866 HB1 ALA A 59 69.018 5.889 16.391 1.00 0.00 H ATOM 867 HB2 ALA A 59 67.715 4.934 17.140 1.00 0.00 H ATOM 868 HB3 ALA A 59 69.416 4.579 17.529 1.00 0.00 H ATOM 869 H ALA A 59 66.964 4.775 14.805 1.00 0.00 H ATOM 870 N GLY A 60 67.429 1.908 15.841 1.00 31.47 N ATOM 871 CA GLY A 60 67.093 0.626 16.427 1.00 31.64 C ATOM 872 C GLY A 60 67.257 0.701 17.935 1.00 31.66 C ATOM 873 O GLY A 60 66.880 1.681 18.562 1.00 29.15 O ATOM 874 HA3 GLY A 60 67.755 -0.142 16.027 1.00 0.00 H ATOM 875 HA2 GLY A 60 66.060 0.375 16.185 1.00 0.00 H ATOM 876 H GLY A 60 66.767 2.361 15.179 1.00 0.00 H ATOM 877 N SER A 61 67.833 -0.352 18.500 1.00 28.19 N ATOM 878 CA SER A 61 68.121 -0.463 19.923 1.00 29.00 C ATOM 879 C SER A 61 69.525 -0.009 20.314 1.00 33.86 C ATOM 880 O SER A 61 69.987 -0.284 21.435 1.00 30.64 O ATOM 881 CB SER A 61 67.918 -1.907 20.385 1.00 32.05 C ATOM 882 OG SER A 61 66.539 -2.097 20.606 1.00 42.14 O ATOM 883 HA SER A 61 67.424 0.212 20.419 1.00 0.00 H ATOM 884 HB2 SER A 61 68.470 -2.083 21.308 1.00 0.00 H ATOM 885 HB3 SER A 61 68.269 -2.596 19.617 1.00 0.00 H ATOM 886 HG SER A 61 66.379 -3.027 20.907 1.00 0.00 H ATOM 887 H SER A 61 68.096 -1.150 17.887 1.00 0.00 H ATOM 888 N LYS A 62 70.242 0.574 19.360 1.00 30.80 N ATOM 889 CA LYS A 62 71.663 0.850 19.546 1.00 29.05 C ATOM 890 C LYS A 62 72.018 1.842 20.649 1.00 31.70 C ATOM 891 O LYS A 62 71.241 2.717 20.991 1.00 28.58 O ATOM 892 CB LYS A 62 72.281 1.295 18.234 1.00 29.71 C ATOM 893 CG LYS A 62 72.366 0.209 17.180 1.00 34.86 C ATOM 894 CD LYS A 62 72.783 0.822 15.858 1.00 34.20 C ATOM 895 CE LYS A 62 73.307 -0.238 14.902 1.00 47.62 C ATOM 896 NZ LYS A 62 72.269 -1.221 14.535 1.00 55.92 N ATOM 897 HA LYS A 62 72.082 -0.098 19.884 1.00 0.00 H ATOM 898 HB2 LYS A 62 71.680 2.112 17.834 1.00 0.00 H ATOM 899 HB3 LYS A 62 73.290 1.653 18.437 1.00 0.00 H ATOM 900 HG2 LYS A 62 73.101 -0.536 17.484 1.00 0.00 H ATOM 901 HG3 LYS A 62 71.392 -0.268 17.069 1.00 0.00 H ATOM 902 HD2 LYS A 62 71.922 1.314 15.406 1.00 0.00 H ATOM 903 HD3 LYS A 62 73.567 1.558 16.038 1.00 0.00 H ATOM 904 HE2 LYS A 62 74.135 -0.763 15.379 1.00 0.00 H ATOM 905 HE3 LYS A 62 73.663 0.252 13.996 1.00 0.00 H ATOM 906 HZ1 LYS A 62 71.928 -1.700 15.393 1.00 0.00 H ATOM 907 HZ2 LYS A 62 71.477 -0.731 14.072 1.00 0.00 H ATOM 908 HZ3 LYS A 62 72.673 -1.923 13.883 1.00 0.00 H ATOM 909 H LYS A 62 69.783 0.838 18.465 1.00 0.00 H ATOM 910 N THR A 63 73.215 1.666 21.211 1.00 30.95 N ATOM 911 CA THR A 63 73.839 2.646 22.090 1.00 28.13 C ATOM 912 C THR A 63 74.312 3.840 21.256 1.00 27.18 C ATOM 913 O THR A 63 74.436 3.750 20.040 1.00 29.93 O ATOM 914 CB THR A 63 75.081 2.043 22.772 1.00 28.58 C ATOM 915 OG1 THR A 63 75.923 1.475 21.768 1.00 31.25 O ATOM 916 CG2 THR A 63 74.682 0.924 23.740 1.00 35.65 C ATOM 917 HA THR A 63 73.108 2.949 22.840 1.00 0.00 H ATOM 918 HB THR A 63 75.593 2.832 23.323 1.00 0.00 H ATOM 919 HG1 THR A 63 76.198 2.181 21.131 1.00 0.00 H ATOM 920 HG23 THR A 63 74.037 1.332 24.519 1.00 0.00 H ATOM 921 HG21 THR A 63 74.148 0.146 23.194 1.00 0.00 H ATOM 922 HG22 THR A 63 75.578 0.501 24.193 1.00 0.00 H ATOM 923 H THR A 63 73.729 0.784 21.011 1.00 0.00 H ATOM 924 N LEU A 64 74.553 4.964 21.914 1.00 31.49 N ATOM 925 CA LEU A 64 75.137 6.118 21.247 1.00 31.95 C ATOM 926 C LEU A 64 76.581 6.258 21.724 1.00 31.22 C ATOM 927 O LEU A 64 76.838 6.214 22.915 1.00 33.36 O ATOM 928 CB LEU A 64 74.355 7.369 21.607 1.00 29.03 C ATOM 929 CG LEU A 64 74.861 8.726 21.102 1.00 32.20 C ATOM 930 CD1 LEU A 64 74.747 8.826 19.579 1.00 28.97 C ATOM 931 CD2 LEU A 64 74.022 9.802 21.775 1.00 29.05 C ATOM 932 HA LEU A 64 75.106 5.987 20.165 1.00 0.00 H ATOM 933 HB2 LEU A 64 73.345 7.239 21.219 1.00 0.00 H ATOM 934 HB3 LEU A 64 74.321 7.424 22.695 1.00 0.00 H ATOM 935 HG LEU A 64 75.916 8.850 21.349 1.00 0.00 H ATOM 936 HD21 LEU A 64 72.974 9.662 21.511 1.00 0.00 H ATOM 937 HD22 LEU A 64 74.138 9.728 22.856 1.00 0.00 H ATOM 938 HD23 LEU A 64 74.355 10.784 21.438 1.00 0.00 H ATOM 939 HD11 LEU A 64 75.343 8.038 19.119 1.00 0.00 H ATOM 940 HD12 LEU A 64 73.703 8.712 19.286 1.00 0.00 H ATOM 941 HD13 LEU A 64 75.113 9.799 19.252 1.00 0.00 H ATOM 942 H LEU A 64 74.321 5.023 22.926 1.00 0.00 H ATOM 943 N ALA A 65 77.522 6.397 20.801 1.00 30.38 N ATOM 944 CA ALA A 65 78.915 6.615 21.211 1.00 40.14 C ATOM 945 C ALA A 65 79.049 7.880 22.064 1.00 38.93 C ATOM 946 O ALA A 65 78.539 8.945 21.706 1.00 40.71 O ATOM 947 CB ALA A 65 79.850 6.672 19.993 1.00 40.10 C ATOM 948 HA ALA A 65 79.216 5.765 21.824 1.00 0.00 H ATOM 949 HB1 ALA A 65 79.791 5.731 19.447 1.00 0.00 H ATOM 950 HB2 ALA A 65 79.546 7.491 19.341 1.00 0.00 H ATOM 951 HB3 ALA A 65 80.874 6.834 20.330 1.00 0.00 H ATOM 952 H ALA A 65 77.275 6.352 19.792 1.00 0.00 H ATOM 953 N GLY A 66 79.772 7.765 23.173 1.00 40.52 N ATOM 954 CA GLY A 66 79.846 8.822 24.164 1.00 42.03 C ATOM 955 C GLY A 66 81.232 8.834 24.791 1.00 45.97 C ATOM 956 O GLY A 66 82.035 7.948 24.513 1.00 43.85 O ATOM 957 HA3 GLY A 66 79.098 8.648 24.938 1.00 0.00 H ATOM 958 HA2 GLY A 66 79.655 9.783 23.686 1.00 0.00 H ATOM 959 H GLY A 66 80.304 6.886 23.336 1.00 0.00 H ATOM 960 N PRO A 67 81.532 9.867 25.596 1.00 47.76 N ATOM 961 CA PRO A 67 82.867 10.089 26.171 1.00 48.44 C ATOM 962 C PRO A 67 83.281 9.002 27.159 1.00 52.75 C ATOM 963 O PRO A 67 84.436 8.576 27.155 1.00 57.84 O ATOM 964 CB PRO A 67 82.723 11.444 26.876 1.00 49.69 C ATOM 965 CG PRO A 67 81.276 11.582 27.147 1.00 54.12 C ATOM 966 CD PRO A 67 80.594 10.941 25.967 1.00 46.77 C ATOM 967 HA PRO A 67 83.645 10.068 25.408 1.00 0.00 H ATOM 968 HD3 PRO A 67 79.622 10.535 26.247 1.00 0.00 H ATOM 969 HD2 PRO A 67 80.468 11.653 25.151 1.00 0.00 H ATOM 970 HG3 PRO A 67 80.999 12.633 27.225 1.00 0.00 H ATOM 971 HG2 PRO A 67 81.008 11.068 28.070 1.00 0.00 H ATOM 972 HB2 PRO A 67 83.290 11.454 27.807 1.00 0.00 H ATOM 973 HB3 PRO A 67 83.071 12.251 26.231 1.00 0.00 H ATOM 974 N LYS A 68 82.333 8.555 27.976 1.00 48.67 N ATOM 975 CA LYS A 68 82.562 7.507 28.977 1.00 48.69 C ATOM 976 C LYS A 68 82.294 6.109 28.410 1.00 50.86 C ATOM 977 O LYS A 68 82.186 5.128 29.148 1.00 51.24 O ATOM 978 CB LYS A 68 81.812 7.780 30.281 1.00 50.35 C ATOM 979 CG LYS A 68 82.303 9.051 30.972 1.00 57.02 C ATOM 980 CD LYS A 68 81.643 9.288 32.325 1.00 60.23 C ATOM 981 CE LYS A 68 81.886 10.721 32.788 1.00 58.04 C ATOM 982 NZ LYS A 68 81.478 10.973 34.204 1.00 59.06 N ATOM 983 HA LYS A 68 83.621 7.532 29.234 1.00 0.00 H ATOM 984 HB2 LYS A 68 80.750 7.888 30.060 1.00 0.00 H ATOM 985 HB3 LYS A 68 81.958 6.935 30.954 1.00 0.00 H ATOM 986 HG2 LYS A 68 83.380 8.972 31.120 1.00 0.00 H ATOM 987 HG3 LYS A 68 82.088 9.903 30.327 1.00 0.00 H ATOM 988 HD2 LYS A 68 80.570 9.115 32.238 1.00 0.00 H ATOM 989 HD3 LYS A 68 82.063 8.597 33.056 1.00 0.00 H ATOM 990 HE2 LYS A 68 81.320 11.392 32.142 1.00 0.00 H ATOM 991 HE3 LYS A 68 82.950 10.938 32.692 1.00 0.00 H ATOM 992 HZ1 LYS A 68 80.461 10.781 34.310 1.00 0.00 H ATOM 993 HZ2 LYS A 68 82.018 10.347 34.836 1.00 0.00 H ATOM 994 HZ3 LYS A 68 81.672 11.965 34.448 1.00 0.00 H ATOM 995 H LYS A 68 81.382 8.969 27.902 1.00 0.00 H ATOM 996 N GLY A 69 82.110 6.052 27.095 1.00 47.42 N ATOM 997 CA GLY A 69 81.707 4.842 26.407 1.00 45.89 C ATOM 998 C GLY A 69 80.269 4.933 25.925 1.00 44.27 C ATOM 999 O GLY A 69 79.641 5.987 26.041 1.00 39.79 O ATOM 1000 HA3 GLY A 69 81.800 3.997 27.090 1.00 0.00 H ATOM 1001 HA2 GLY A 69 82.360 4.687 25.548 1.00 0.00 H ATOM 1002 H GLY A 69 82.262 6.915 26.534 1.00 0.00 H ATOM 1003 N PRO A 70 79.756 3.834 25.347 1.00 42.50 N ATOM 1004 CA PRO A 70 78.397 3.763 24.785 1.00 36.43 C ATOM 1005 C PRO A 70 77.308 4.122 25.797 1.00 35.13 C ATOM 1006 O PRO A 70 77.345 3.688 26.950 1.00 36.74 O ATOM 1007 CB PRO A 70 78.273 2.298 24.350 1.00 34.85 C ATOM 1008 CG PRO A 70 79.686 1.856 24.106 1.00 42.24 C ATOM 1009 CD PRO A 70 80.509 2.583 25.139 1.00 43.54 C ATOM 1010 HA PRO A 70 78.258 4.480 23.975 1.00 0.00 H ATOM 1011 HD3 PRO A 70 80.575 2.008 26.062 1.00 0.00 H ATOM 1012 HD2 PRO A 70 81.513 2.787 24.767 1.00 0.00 H ATOM 1013 HG3 PRO A 70 80.005 2.130 23.100 1.00 0.00 H ATOM 1014 HG2 PRO A 70 79.777 0.777 24.233 1.00 0.00 H ATOM 1015 HB2 PRO A 70 77.813 1.700 25.137 1.00 0.00 H ATOM 1016 HB3 PRO A 70 77.681 2.215 23.439 1.00 0.00 H ATOM 1017 N ILE A 71 76.335 4.910 25.351 1.00 36.08 N ATOM 1018 CA ILE A 71 75.229 5.338 26.187 1.00 33.22 C ATOM 1019 C ILE A 71 74.000 4.511 25.822 1.00 33.99 C ATOM 1020 O ILE A 71 73.642 4.419 24.654 1.00 33.29 O ATOM 1021 CB ILE A 71 74.889 6.820 25.924 1.00 34.60 C ATOM 1022 CG1 ILE A 71 76.121 7.697 26.127 1.00 39.04 C ATOM 1023 CG2 ILE A 71 73.726 7.268 26.804 1.00 34.32 C ATOM 1024 CD1 ILE A 71 75.946 9.111 25.552 1.00 39.46 C ATOM 1025 HA ILE A 71 75.509 5.207 27.232 1.00 0.00 H ATOM 1026 HB ILE A 71 74.576 6.929 24.886 1.00 0.00 H ATOM 1027 HG12 ILE A 71 76.320 7.777 27.196 1.00 0.00 H ATOM 1028 HG13 ILE A 71 76.971 7.223 25.635 1.00 0.00 H ATOM 1029 HD11 ILE A 71 75.756 9.045 24.481 1.00 0.00 H ATOM 1030 HD12 ILE A 71 75.104 9.600 26.042 1.00 0.00 H ATOM 1031 HD13 ILE A 71 76.854 9.688 25.726 1.00 0.00 H ATOM 1032 HG21 ILE A 71 72.849 6.659 26.583 1.00 0.00 H ATOM 1033 HG22 ILE A 71 73.998 7.148 27.853 1.00 0.00 H ATOM 1034 HG23 ILE A 71 73.502 8.316 26.603 1.00 0.00 H ATOM 1035 H ILE A 71 76.368 5.233 24.363 1.00 0.00 H ATOM 1036 N THR A 72 73.367 3.906 26.821 1.00 34.83 N ATOM 1037 CA THR A 72 72.185 3.086 26.607 1.00 34.85 C ATOM 1038 C THR A 72 70.987 4.013 26.435 1.00 33.96 C ATOM 1039 O THR A 72 70.941 5.077 27.035 1.00 31.67 O ATOM 1040 CB THR A 72 71.949 2.124 27.793 1.00 35.84 C ATOM 1041 OG1 THR A 72 73.110 1.298 27.981 1.00 37.63 O ATOM 1042 CG2 THR A 72 70.729 1.229 27.544 1.00 34.45 C ATOM 1043 HA THR A 72 72.325 2.475 25.715 1.00 0.00 H ATOM 1044 HB THR A 72 71.765 2.722 28.685 1.00 0.00 H ATOM 1045 HG1 THR A 72 72.956 0.683 28.741 1.00 0.00 H ATOM 1046 HG23 THR A 72 69.846 1.852 27.401 1.00 0.00 H ATOM 1047 HG21 THR A 72 70.898 0.626 26.652 1.00 0.00 H ATOM 1048 HG22 THR A 72 70.578 0.575 28.403 1.00 0.00 H ATOM 1049 H THR A 72 73.729 4.023 27.789 1.00 0.00 H ATOM 1050 N GLN A 73 70.036 3.621 25.593 1.00 31.70 N ATOM 1051 CA GLN A 73 68.796 4.385 25.441 1.00 34.97 C ATOM 1052 C GLN A 73 68.056 4.442 26.772 1.00 37.59 C ATOM 1053 O GLN A 73 67.947 3.426 27.488 1.00 33.22 O ATOM 1054 CB GLN A 73 67.901 3.757 24.365 1.00 29.48 C ATOM 1055 CG GLN A 73 68.531 3.740 22.989 1.00 27.75 C ATOM 1056 CD GLN A 73 67.650 3.097 21.960 1.00 30.81 C ATOM 1057 OE1 GLN A 73 66.487 2.792 22.235 1.00 31.83 O ATOM 1058 NE2 GLN A 73 68.178 2.915 20.749 1.00 29.13 N ATOM 1059 HA GLN A 73 69.048 5.398 25.128 1.00 0.00 H ATOM 1060 HB2 GLN A 73 67.680 2.730 24.656 1.00 0.00 H ATOM 1061 HB3 GLN A 73 66.973 4.326 24.313 1.00 0.00 H ATOM 1062 HG2 GLN A 73 68.732 4.767 22.684 1.00 0.00 H ATOM 1063 HG3 GLN A 73 69.469 3.187 23.041 1.00 0.00 H ATOM 1064 HE22 GLN A 73 69.164 3.188 20.565 1.00 0.00 H ATOM 1065 HE21 GLN A 73 67.603 2.500 19.988 1.00 0.00 H ATOM 1066 H GLN A 73 70.175 2.756 25.032 1.00 0.00 H ATOM 1067 N MET A 74 67.590 5.628 27.152 1.00 34.82 N ATOM 1068 CA MET A 74 66.727 5.694 28.310 1.00 36.34 C ATOM 1069 C MET A 74 65.255 5.582 27.928 1.00 40.72 C ATOM 1070 O MET A 74 64.407 5.349 28.785 1.00 40.42 O ATOM 1071 CB MET A 74 66.997 6.960 29.119 1.00 46.04 C ATOM 1072 CG MET A 74 66.921 8.250 28.341 1.00 49.64 C ATOM 1073 SD MET A 74 67.283 9.654 29.427 1.00 69.84 S ATOM 1074 CE MET A 74 66.252 9.263 30.848 1.00 61.71 C ATOM 1075 HA MET A 74 66.958 4.835 28.940 1.00 0.00 H ATOM 1076 HB2 MET A 74 66.264 7.008 29.924 1.00 0.00 H ATOM 1077 HB3 MET A 74 67.997 6.881 29.544 1.00 0.00 H ATOM 1078 HG2 MET A 74 65.919 8.363 27.927 1.00 0.00 H ATOM 1079 HG3 MET A 74 67.648 8.225 27.529 1.00 0.00 H ATOM 1080 HE1 MET A 74 65.209 9.212 30.535 1.00 0.00 H ATOM 1081 HE2 MET A 74 66.556 8.302 31.263 1.00 0.00 H ATOM 1082 HE3 MET A 74 66.368 10.039 31.604 1.00 0.00 H ATOM 1083 H MET A 74 67.841 6.490 26.627 1.00 0.00 H ATOM 1084 N TYR A 75 64.953 5.728 26.638 1.00 37.03 N ATOM 1085 CA TYR A 75 63.574 5.586 26.164 1.00 36.38 C ATOM 1086 C TYR A 75 63.541 4.865 24.832 1.00 36.04 C ATOM 1087 O TYR A 75 64.236 5.253 23.895 1.00 35.50 O ATOM 1088 CB TYR A 75 62.898 6.960 26.032 1.00 38.92 C ATOM 1089 CG TYR A 75 62.933 7.772 27.306 1.00 52.19 C ATOM 1090 CD1 TYR A 75 62.013 7.539 28.327 1.00 58.74 C ATOM 1091 CD2 TYR A 75 63.892 8.764 27.501 1.00 51.50 C ATOM 1092 CE1 TYR A 75 62.042 8.269 29.500 1.00 59.16 C ATOM 1093 CE2 TYR A 75 63.925 9.501 28.676 1.00 53.75 C ATOM 1094 CZ TYR A 75 62.997 9.247 29.670 1.00 59.21 C ATOM 1095 OH TYR A 75 63.020 9.976 30.840 1.00 67.19 O ATOM 1096 HA TYR A 75 63.025 4.997 26.898 1.00 0.00 H ATOM 1097 HB3 TYR A 75 61.857 6.807 25.748 1.00 0.00 H ATOM 1098 HB2 TYR A 75 63.408 7.522 25.250 1.00 0.00 H ATOM 1099 HD2 TYR A 75 64.626 8.964 26.720 1.00 0.00 H ATOM 1100 HE2 TYR A 75 64.678 10.276 28.815 1.00 0.00 H ATOM 1101 HE1 TYR A 75 61.313 8.072 30.286 1.00 0.00 H ATOM 1102 HD1 TYR A 75 61.256 6.766 28.198 1.00 0.00 H ATOM 1103 HH TYR A 75 62.292 9.666 31.435 1.00 0.00 H ATOM 1104 H TYR A 75 65.708 5.946 25.957 1.00 0.00 H ATOM 1105 N THR A 76 62.762 3.793 24.750 1.00 33.84 N ATOM 1106 CA THR A 76 62.661 3.066 23.508 1.00 28.52 C ATOM 1107 C THR A 76 61.186 2.776 23.309 1.00 37.02 C ATOM 1108 O THR A 76 60.619 1.976 24.050 1.00 34.12 O ATOM 1109 CB THR A 76 63.501 1.748 23.621 1.00 33.18 C ATOM 1110 OG1 THR A 76 64.812 2.052 24.133 1.00 29.13 O ATOM 1111 CG2 THR A 76 63.643 1.040 22.285 1.00 32.04 C ATOM 1112 HA THR A 76 63.050 3.626 22.658 1.00 0.00 H ATOM 1113 HB THR A 76 62.969 1.081 24.299 1.00 0.00 H ATOM 1114 HG1 THR A 76 65.267 2.681 23.519 1.00 0.00 H ATOM 1115 HG23 THR A 76 62.653 0.807 21.892 1.00 0.00 H ATOM 1116 HG21 THR A 76 64.170 1.689 21.585 1.00 0.00 H ATOM 1117 HG22 THR A 76 64.207 0.118 22.422 1.00 0.00 H ATOM 1118 H THR A 76 62.224 3.477 25.582 1.00 0.00 H ATOM 1119 N ASN A 77 60.561 3.387 22.304 1.00 36.87 N ATOM 1120 CA ASN A 77 59.171 3.060 22.012 1.00 35.56 C ATOM 1121 C ASN A 77 59.062 2.747 20.549 1.00 37.06 C ATOM 1122 O ASN A 77 58.935 3.657 19.717 1.00 33.06 O ATOM 1123 CB ASN A 77 58.319 4.291 22.308 1.00 37.60 C ATOM 1124 CG ASN A 77 56.820 4.035 22.172 1.00 39.28 C ATOM 1125 OD1 ASN A 77 56.383 3.158 21.436 1.00 38.37 O ATOM 1126 ND2 ASN A 77 56.032 4.832 22.871 1.00 41.28 N ATOM 1127 HA ASN A 77 58.838 2.212 22.611 1.00 0.00 H ATOM 1128 HB2 ASN A 77 58.524 4.617 23.328 1.00 0.00 H ATOM 1129 HB3 ASN A 77 58.600 5.082 21.612 1.00 0.00 H ATOM 1130 HD22 ASN A 77 56.444 5.564 23.484 1.00 0.00 H ATOM 1131 HD21 ASN A 77 54.999 4.728 22.808 1.00 0.00 H ATOM 1132 H ASN A 77 61.063 4.094 21.730 1.00 0.00 H ATOM 1133 N VAL A 78 58.895 1.470 20.246 1.00 32.93 N ATOM 1134 CA VAL A 78 59.089 1.005 18.890 1.00 33.89 C ATOM 1135 C VAL A 78 57.898 1.372 18.026 1.00 38.73 C ATOM 1136 O VAL A 78 58.054 1.805 16.887 1.00 37.22 O ATOM 1137 CB VAL A 78 59.334 -0.513 18.845 1.00 36.38 C ATOM 1138 CG1 VAL A 78 59.297 -1.022 17.406 1.00 39.23 C ATOM 1139 CG2 VAL A 78 60.667 -0.852 19.512 1.00 37.39 C ATOM 1140 HA VAL A 78 59.977 1.499 18.495 1.00 0.00 H ATOM 1141 HB VAL A 78 58.538 -1.012 19.397 1.00 0.00 H ATOM 1142 HG11 VAL A 78 58.320 -0.809 16.972 1.00 0.00 H ATOM 1143 HG12 VAL A 78 60.072 -0.522 16.825 1.00 0.00 H ATOM 1144 HG13 VAL A 78 59.473 -2.098 17.398 1.00 0.00 H ATOM 1145 HG21 VAL A 78 61.475 -0.344 18.986 1.00 0.00 H ATOM 1146 HG22 VAL A 78 60.646 -0.524 20.551 1.00 0.00 H ATOM 1147 HG23 VAL A 78 60.828 -1.929 19.473 1.00 0.00 H ATOM 1148 H VAL A 78 58.622 0.795 20.989 1.00 0.00 H ATOM 1149 N ASP A 79 56.705 1.221 18.580 1.00 39.71 N ATOM 1150 CA ASP A 79 55.498 1.451 17.797 1.00 41.96 C ATOM 1151 C ASP A 79 55.295 2.923 17.426 1.00 40.66 C ATOM 1152 O ASP A 79 54.698 3.219 16.388 1.00 39.27 O ATOM 1153 CB ASP A 79 54.269 0.857 18.499 1.00 48.26 C ATOM 1154 CG ASP A 79 54.392 -0.652 18.706 1.00 50.16 C ATOM 1155 OD1 ASP A 79 55.030 -1.330 17.863 1.00 49.84 O ATOM 1156 OD2 ASP A 79 53.861 -1.156 19.715 1.00 59.30 O ATOM 1157 HA ASP A 79 55.630 0.927 16.850 1.00 0.00 H ATOM 1158 HB2 ASP A 79 54.155 1.336 19.471 1.00 0.00 H ATOM 1159 HB3 ASP A 79 53.387 1.057 17.891 1.00 0.00 H ATOM 1160 H ASP A 79 56.629 0.937 19.578 1.00 0.00 H ATOM 1161 N GLN A 80 55.814 3.843 18.238 1.00 38.37 N ATOM 1162 CA GLN A 80 55.817 5.257 17.833 1.00 39.46 C ATOM 1163 C GLN A 80 57.118 5.680 17.133 1.00 37.89 C ATOM 1164 O GLN A 80 57.285 6.844 16.742 1.00 36.36 O ATOM 1165 CB GLN A 80 55.488 6.198 18.998 1.00 40.36 C ATOM 1166 CG GLN A 80 56.591 6.428 19.986 1.00 45.97 C ATOM 1167 CD GLN A 80 56.290 7.602 20.898 1.00 49.08 C ATOM 1168 OE1 GLN A 80 55.348 8.356 20.660 1.00 58.11 O ATOM 1169 NE2 GLN A 80 57.085 7.761 21.944 1.00 47.67 N ATOM 1170 HA GLN A 80 55.018 5.349 17.098 1.00 0.00 H ATOM 1171 HB2 GLN A 80 55.209 7.164 18.578 1.00 0.00 H ATOM 1172 HB3 GLN A 80 54.639 5.778 19.537 1.00 0.00 H ATOM 1173 HG2 GLN A 80 56.715 5.531 20.593 1.00 0.00 H ATOM 1174 HG3 GLN A 80 57.515 6.629 19.444 1.00 0.00 H ATOM 1175 HE22 GLN A 80 57.870 7.098 22.106 1.00 0.00 H ATOM 1176 HE21 GLN A 80 56.925 8.549 22.604 1.00 0.00 H ATOM 1177 H GLN A 80 56.216 3.562 19.155 1.00 0.00 H ATOM 1178 N ASP A 81 58.035 4.730 16.977 1.00 34.00 N ATOM 1179 CA ASP A 81 59.271 4.982 16.245 1.00 34.34 C ATOM 1180 C ASP A 81 60.128 6.054 16.926 1.00 31.39 C ATOM 1181 O ASP A 81 60.784 6.857 16.262 1.00 31.73 O ATOM 1182 CB ASP A 81 58.922 5.404 14.813 1.00 35.19 C ATOM 1183 CG ASP A 81 60.092 5.332 13.887 1.00 33.25 C ATOM 1184 OD1 ASP A 81 61.027 4.552 14.174 1.00 32.29 O ATOM 1185 OD2 ASP A 81 60.061 6.027 12.857 1.00 31.40 O ATOM 1186 HA ASP A 81 59.860 4.065 16.231 1.00 0.00 H ATOM 1187 HB2 ASP A 81 58.139 4.746 14.437 1.00 0.00 H ATOM 1188 HB3 ASP A 81 58.555 6.430 14.832 1.00 0.00 H ATOM 1189 H ASP A 81 57.868 3.788 17.385 1.00 0.00 H ATOM 1190 N LEU A 82 60.129 6.053 18.255 1.00 31.82 N ATOM 1191 CA LEU A 82 60.876 7.037 19.024 1.00 29.30 C ATOM 1192 C LEU A 82 61.867 6.380 19.991 1.00 29.51 C ATOM 1193 O LEU A 82 61.529 5.422 20.684 1.00 32.18 O ATOM 1194 CB LEU A 82 59.920 7.936 19.805 1.00 31.51 C ATOM 1195 CG LEU A 82 60.541 9.004 20.705 1.00 33.75 C ATOM 1196 CD1 LEU A 82 61.218 10.101 19.861 1.00 28.45 C ATOM 1197 CD2 LEU A 82 59.480 9.619 21.631 1.00 37.82 C ATOM 1198 HA LEU A 82 61.447 7.635 18.313 1.00 0.00 H ATOM 1199 HB2 LEU A 82 59.285 8.446 19.081 1.00 0.00 H ATOM 1200 HB3 LEU A 82 59.306 7.293 20.435 1.00 0.00 H ATOM 1201 HG LEU A 82 61.301 8.526 21.323 1.00 0.00 H ATOM 1202 HD21 LEU A 82 58.696 10.078 21.029 1.00 0.00 H ATOM 1203 HD22 LEU A 82 59.049 8.838 22.257 1.00 0.00 H ATOM 1204 HD23 LEU A 82 59.945 10.376 22.262 1.00 0.00 H ATOM 1205 HD11 LEU A 82 62.002 9.655 19.250 1.00 0.00 H ATOM 1206 HD12 LEU A 82 60.476 10.571 19.216 1.00 0.00 H ATOM 1207 HD13 LEU A 82 61.653 10.850 20.523 1.00 0.00 H ATOM 1208 H LEU A 82 59.580 5.328 18.760 1.00 0.00 H ATOM 1209 N VAL A 83 63.094 6.890 20.019 1.00 27.29 N ATOM 1210 CA VAL A 83 64.071 6.475 21.025 1.00 30.96 C ATOM 1211 C VAL A 83 64.762 7.702 21.568 1.00 33.38 C ATOM 1212 O VAL A 83 64.818 8.736 20.899 1.00 30.28 O ATOM 1213 CB VAL A 83 65.154 5.540 20.454 1.00 33.70 C ATOM 1214 CG1 VAL A 83 64.523 4.393 19.691 1.00 33.24 C ATOM 1215 CG2 VAL A 83 66.093 6.309 19.575 1.00 32.62 C ATOM 1216 HA VAL A 83 63.526 5.933 21.798 1.00 0.00 H ATOM 1217 HB VAL A 83 65.723 5.121 21.284 1.00 0.00 H ATOM 1218 HG11 VAL A 83 63.881 3.822 20.362 1.00 0.00 H ATOM 1219 HG12 VAL A 83 63.929 4.789 18.868 1.00 0.00 H ATOM 1220 HG13 VAL A 83 65.307 3.746 19.297 1.00 0.00 H ATOM 1221 HG21 VAL A 83 65.535 6.754 18.751 1.00 0.00 H ATOM 1222 HG22 VAL A 83 66.572 7.096 20.158 1.00 0.00 H ATOM 1223 HG23 VAL A 83 66.852 5.635 19.179 1.00 0.00 H ATOM 1224 H VAL A 83 63.366 7.600 19.309 1.00 0.00 H ATOM 1225 N GLY A 84 65.327 7.598 22.762 1.00 28.37 N ATOM 1226 CA GLY A 84 66.121 8.706 23.248 1.00 31.60 C ATOM 1227 C GLY A 84 67.230 8.218 24.151 1.00 35.67 C ATOM 1228 O GLY A 84 67.103 7.169 24.778 1.00 31.04 O ATOM 1229 HA3 GLY A 84 65.479 9.388 23.806 1.00 0.00 H ATOM 1230 HA2 GLY A 84 66.557 9.233 22.399 1.00 0.00 H ATOM 1231 H GLY A 84 65.203 6.740 23.337 1.00 0.00 H ATOM 1232 N TRP A 85 68.318 8.992 24.202 1.00 32.26 N ATOM 1233 CA TRP A 85 69.477 8.710 25.053 1.00 31.81 C ATOM 1234 C TRP A 85 69.650 9.952 25.899 1.00 40.48 C ATOM 1235 O TRP A 85 69.353 11.057 25.433 1.00 37.70 O ATOM 1236 CB TRP A 85 70.764 8.586 24.244 1.00 31.27 C ATOM 1237 CG TRP A 85 70.856 7.497 23.220 1.00 31.17 C ATOM 1238 CD1 TRP A 85 71.217 6.191 23.437 1.00 29.05 C ATOM 1239 CD2 TRP A 85 70.674 7.632 21.810 1.00 30.13 C ATOM 1240 NE1 TRP A 85 71.256 5.511 22.249 1.00 28.57 N ATOM 1241 CE2 TRP A 85 70.906 6.367 21.236 1.00 31.08 C ATOM 1242 CE3 TRP A 85 70.314 8.701 20.974 1.00 29.06 C ATOM 1243 CZ2 TRP A 85 70.796 6.138 19.863 1.00 30.53 C ATOM 1244 CZ3 TRP A 85 70.217 8.477 19.613 1.00 30.63 C ATOM 1245 CH2 TRP A 85 70.462 7.203 19.066 1.00 29.32 C ATOM 1246 HA TRP A 85 69.311 7.783 25.602 1.00 0.00 H ATOM 1247 HB2 TRP A 85 70.911 9.532 23.723 1.00 0.00 H ATOM 1248 HB3 TRP A 85 71.578 8.433 24.953 1.00 0.00 H ATOM 1249 HE1 TRP A 85 71.510 4.509 22.134 1.00 0.00 H ATOM 1250 HD1 TRP A 85 71.440 5.758 24.412 1.00 0.00 H ATOM 1251 HZ2 TRP A 85 70.969 5.149 19.440 1.00 0.00 H ATOM 1252 HH2 TRP A 85 70.385 7.060 17.988 1.00 0.00 H ATOM 1253 HZ3 TRP A 85 69.946 9.301 18.952 1.00 0.00 H ATOM 1254 HE3 TRP A 85 70.115 9.689 21.390 1.00 0.00 H ATOM 1255 H TRP A 85 68.344 9.842 23.604 1.00 0.00 H ATOM 1256 N PRO A 86 70.143 9.798 27.134 1.00 39.41 N ATOM 1257 CA PRO A 86 70.475 11.030 27.863 1.00 40.21 C ATOM 1258 C PRO A 86 71.462 11.857 27.047 1.00 44.44 C ATOM 1259 O PRO A 86 72.434 11.305 26.534 1.00 45.44 O ATOM 1260 CB PRO A 86 71.129 10.523 29.157 1.00 46.18 C ATOM 1261 CG PRO A 86 71.398 9.051 28.930 1.00 45.29 C ATOM 1262 CD PRO A 86 70.387 8.582 27.928 1.00 35.45 C ATOM 1263 HA PRO A 86 69.612 11.668 28.055 1.00 0.00 H ATOM 1264 HD3 PRO A 86 70.788 7.780 27.309 1.00 0.00 H ATOM 1265 HD2 PRO A 86 69.475 8.240 28.417 1.00 0.00 H ATOM 1266 HG3 PRO A 86 71.287 8.499 29.864 1.00 0.00 H ATOM 1267 HG2 PRO A 86 72.407 8.908 28.543 1.00 0.00 H ATOM 1268 HB2 PRO A 86 72.061 11.055 29.346 1.00 0.00 H ATOM 1269 HB3 PRO A 86 70.455 10.661 30.003 1.00 0.00 H ATOM 1270 N ALA A 87 71.195 13.157 26.916 1.00 46.21 N ATOM 1271 CA ALA A 87 71.983 14.047 26.062 1.00 49.95 C ATOM 1272 C ALA A 87 73.438 14.161 26.507 1.00 53.43 C ATOM 1273 O ALA A 87 73.716 14.503 27.658 1.00 51.71 O ATOM 1274 CB ALA A 87 71.341 15.439 26.026 1.00 47.38 C ATOM 1275 HA ALA A 87 71.987 13.608 25.064 1.00 0.00 H ATOM 1276 HB1 ALA A 87 70.329 15.361 25.628 1.00 0.00 H ATOM 1277 HB2 ALA A 87 71.305 15.847 27.036 1.00 0.00 H ATOM 1278 HB3 ALA A 87 71.934 16.095 25.388 1.00 0.00 H ATOM 1279 H ALA A 87 70.392 13.556 27.443 1.00 0.00 H ATOM 1280 N PRO A 88 74.380 13.882 25.596 1.00 54.79 N ATOM 1281 CA PRO A 88 75.780 14.054 25.996 1.00 53.97 C ATOM 1282 C PRO A 88 76.061 15.495 26.395 1.00 54.45 C ATOM 1283 O PRO A 88 75.319 16.396 26.001 1.00 51.44 O ATOM 1284 CB PRO A 88 76.564 13.671 24.735 1.00 52.85 C ATOM 1285 CG PRO A 88 75.577 13.684 23.620 1.00 49.89 C ATOM 1286 CD PRO A 88 74.254 13.345 24.231 1.00 55.35 C ATOM 1287 HA PRO A 88 76.049 13.450 26.863 1.00 0.00 H ATOM 1288 HD3 PRO A 88 73.437 13.826 23.693 1.00 0.00 H ATOM 1289 HD2 PRO A 88 74.092 12.267 24.246 1.00 0.00 H ATOM 1290 HG3 PRO A 88 75.847 12.943 22.867 1.00 0.00 H ATOM 1291 HG2 PRO A 88 75.539 14.671 23.160 1.00 0.00 H ATOM 1292 HB2 PRO A 88 77.358 14.394 24.548 1.00 0.00 H ATOM 1293 HB3 PRO A 88 76.998 12.677 24.846 1.00 0.00 H ATOM 1294 N PRO A 89 77.111 15.706 27.203 1.00 57.80 N ATOM 1295 CA PRO A 89 77.487 17.048 27.648 1.00 56.89 C ATOM 1296 C PRO A 89 77.808 17.964 26.469 1.00 57.22 C ATOM 1297 O PRO A 89 78.624 17.598 25.622 1.00 56.53 O ATOM 1298 CB PRO A 89 78.766 16.796 28.447 1.00 61.81 C ATOM 1299 CG PRO A 89 78.657 15.372 28.912 1.00 58.96 C ATOM 1300 CD PRO A 89 77.972 14.661 27.785 1.00 60.72 C ATOM 1301 HA PRO A 89 76.689 17.536 28.208 1.00 0.00 H ATOM 1302 HD3 PRO A 89 78.695 14.298 27.055 1.00 0.00 H ATOM 1303 HD2 PRO A 89 77.378 13.825 28.153 1.00 0.00 H ATOM 1304 HG3 PRO A 89 78.065 15.309 29.825 1.00 0.00 H ATOM 1305 HG2 PRO A 89 79.645 14.948 29.092 1.00 0.00 H ATOM 1306 HB2 PRO A 89 79.645 16.927 27.816 1.00 0.00 H ATOM 1307 HB3 PRO A 89 78.827 17.474 29.298 1.00 0.00 H ATOM 1308 N GLY A 90 77.208 19.154 26.447 1.00 49.69 N ATOM 1309 CA GLY A 90 77.497 20.144 25.423 1.00 50.66 C ATOM 1310 C GLY A 90 76.423 20.297 24.356 1.00 49.43 C ATOM 1311 O GLY A 90 76.378 21.313 23.664 1.00 49.09 O ATOM 1312 HA3 GLY A 90 78.426 19.859 24.930 1.00 0.00 H ATOM 1313 HA2 GLY A 90 77.628 21.109 25.912 1.00 0.00 H ATOM 1314 H GLY A 90 76.512 19.381 27.185 1.00 0.00 H ATOM 1315 N ALA A 91 75.550 19.303 24.220 1.00 50.20 N ATOM 1316 CA ALA A 91 74.422 19.417 23.302 1.00 44.96 C ATOM 1317 C ALA A 91 73.536 20.555 23.776 1.00 48.54 C ATOM 1318 O ALA A 91 73.180 20.606 24.953 1.00 52.16 O ATOM 1319 CB ALA A 91 73.633 18.110 23.273 1.00 51.37 C ATOM 1320 HA ALA A 91 74.780 19.619 22.292 1.00 0.00 H ATOM 1321 HB1 ALA A 91 74.284 17.301 22.941 1.00 0.00 H ATOM 1322 HB2 ALA A 91 73.260 17.890 24.273 1.00 0.00 H ATOM 1323 HB3 ALA A 91 72.794 18.209 22.584 1.00 0.00 H ATOM 1324 H ALA A 91 75.673 18.433 24.776 1.00 0.00 H ATOM 1325 N ARG A 92 73.175 21.468 22.878 1.00 45.23 N ATOM 1326 CA ARG A 92 72.292 22.569 23.252 1.00 48.22 C ATOM 1327 C ARG A 92 70.864 22.022 23.306 1.00 52.28 C ATOM 1328 O ARG A 92 70.337 21.546 22.296 1.00 51.50 O ATOM 1329 CB ARG A 92 72.370 23.712 22.222 1.00 47.58 C ATOM 1330 CG ARG A 92 73.784 24.255 21.885 1.00 48.09 C ATOM 1331 CD ARG A 92 73.687 25.357 20.791 1.00 52.89 C ATOM 1332 NE ARG A 92 74.961 26.005 20.458 1.00 52.09 N ATOM 1333 CZ ARG A 92 75.076 27.100 19.700 1.00 50.21 C ATOM 1334 NH1 ARG A 92 73.999 27.683 19.190 1.00 54.99 N ATOM 1335 NH2 ARG A 92 76.273 27.621 19.448 1.00 54.14 N ATOM 1336 HA ARG A 92 72.594 22.971 24.219 1.00 0.00 H ATOM 1337 HB2 ARG A 92 71.925 23.351 21.294 1.00 0.00 H ATOM 1338 HB3 ARG A 92 71.780 24.544 22.607 1.00 0.00 H ATOM 1339 HG2 ARG A 92 74.232 24.678 22.784 1.00 0.00 H ATOM 1340 HG3 ARG A 92 74.407 23.438 21.520 1.00 0.00 H ATOM 1341 HD2 ARG A 92 72.997 26.124 21.142 1.00 0.00 H ATOM 1342 HD3 ARG A 92 73.290 24.901 19.884 1.00 0.00 H ATOM 1343 HE ARG A 92 75.833 25.584 20.837 1.00 0.00 H ATOM 1344 HH12 ARG A 92 74.098 28.535 18.601 1.00 0.00 H ATOM 1345 HH11 ARG A 92 73.055 27.288 19.379 1.00 0.00 H ATOM 1346 HH22 ARG A 92 76.355 28.473 18.857 1.00 0.00 H ATOM 1347 HH21 ARG A 92 77.127 27.176 19.841 1.00 0.00 H ATOM 1348 H ARG A 92 73.525 21.397 21.901 1.00 0.00 H ATOM 1349 N SER A 93 70.228 22.099 24.473 1.00 48.28 N ATOM 1350 CA SER A 93 68.911 21.493 24.647 1.00 48.83 C ATOM 1351 C SER A 93 67.785 22.484 24.330 1.00 50.12 C ATOM 1352 O SER A 93 67.762 23.593 24.853 1.00 49.27 O ATOM 1353 CB SER A 93 68.754 20.951 26.065 1.00 47.80 C ATOM 1354 OG SER A 93 67.907 19.812 26.063 1.00 54.55 O ATOM 1355 HA SER A 93 68.835 20.666 23.941 1.00 0.00 H ATOM 1356 HB2 SER A 93 68.319 21.723 26.700 1.00 0.00 H ATOM 1357 HB3 SER A 93 69.733 20.672 26.454 1.00 0.00 H ATOM 1358 HG SER A 93 67.813 19.470 26.987 1.00 0.00 H ATOM 1359 H SER A 93 70.674 22.596 25.270 1.00 0.00 H ATOM 1360 N MET A 94 66.845 22.082 23.482 1.00 44.11 N ATOM 1361 CA MET A 94 65.803 23.005 23.064 1.00 45.39 C ATOM 1362 C MET A 94 64.608 22.962 23.991 1.00 43.61 C ATOM 1363 O MET A 94 64.531 22.125 24.883 1.00 48.08 O ATOM 1364 CB MET A 94 65.359 22.682 21.641 1.00 42.02 C ATOM 1365 CG MET A 94 66.517 22.665 20.635 1.00 45.74 C ATOM 1366 SD MET A 94 65.887 22.396 18.975 1.00 48.21 S ATOM 1367 CE MET A 94 65.027 23.948 18.745 1.00 46.12 C ATOM 1368 HA MET A 94 66.221 24.011 23.102 1.00 0.00 H ATOM 1369 HB2 MET A 94 64.885 21.701 21.640 1.00 0.00 H ATOM 1370 HB3 MET A 94 64.636 23.434 21.324 1.00 0.00 H ATOM 1371 HG2 MET A 94 67.208 21.862 20.893 1.00 0.00 H ATOM 1372 HG3 MET A 94 67.041 23.620 20.672 1.00 0.00 H ATOM 1373 HE1 MET A 94 64.256 24.051 19.508 1.00 0.00 H ATOM 1374 HE2 MET A 94 65.736 24.771 18.830 1.00 0.00 H ATOM 1375 HE3 MET A 94 64.567 23.964 17.757 1.00 0.00 H ATOM 1376 H MET A 94 66.855 21.108 23.118 1.00 0.00 H ATOM 1377 N THR A 95 63.659 23.849 23.723 1.00 45.76 N ATOM 1378 CA THR A 95 62.460 24.028 24.530 1.00 49.00 C ATOM 1379 C THR A 95 61.228 23.505 23.788 1.00 42.44 C ATOM 1380 O THR A 95 61.015 23.873 22.647 1.00 46.25 O ATOM 1381 CB THR A 95 62.258 25.526 24.851 1.00 49.13 C ATOM 1382 OG1 THR A 95 63.503 26.098 25.276 1.00 50.31 O ATOM 1383 CG2 THR A 95 61.205 25.718 25.941 1.00 53.46 C ATOM 1384 HA THR A 95 62.585 23.466 25.456 1.00 0.00 H ATOM 1385 HB THR A 95 61.910 26.027 23.948 1.00 0.00 H ATOM 1386 HG1 THR A 95 64.172 26.003 24.553 1.00 0.00 H ATOM 1387 HG23 THR A 95 60.261 25.282 25.614 1.00 0.00 H ATOM 1388 HG21 THR A 95 61.536 25.226 26.855 1.00 0.00 H ATOM 1389 HG22 THR A 95 61.069 26.783 26.129 1.00 0.00 H ATOM 1390 H THR A 95 63.778 24.454 22.885 1.00 0.00 H ATOM 1391 N PRO A 96 60.438 22.623 24.416 1.00 41.04 N ATOM 1392 CA PRO A 96 59.164 22.225 23.814 1.00 45.63 C ATOM 1393 C PRO A 96 58.282 23.432 23.515 1.00 50.61 C ATOM 1394 O PRO A 96 58.327 24.445 24.215 1.00 53.77 O ATOM 1395 CB PRO A 96 58.520 21.357 24.894 1.00 50.62 C ATOM 1396 CG PRO A 96 59.672 20.797 25.650 1.00 48.71 C ATOM 1397 CD PRO A 96 60.712 21.889 25.662 1.00 50.20 C ATOM 1398 HA PRO A 96 59.298 21.713 22.861 1.00 0.00 H ATOM 1399 HD3 PRO A 96 60.592 22.535 26.532 1.00 0.00 H ATOM 1400 HD2 PRO A 96 61.719 21.471 25.657 1.00 0.00 H ATOM 1401 HG3 PRO A 96 60.058 19.907 25.153 1.00 0.00 H ATOM 1402 HG2 PRO A 96 59.374 20.543 26.667 1.00 0.00 H ATOM 1403 HB2 PRO A 96 57.885 21.958 25.545 1.00 0.00 H ATOM 1404 HB3 PRO A 96 57.927 20.559 24.446 1.00 0.00 H ATOM 1405 N CYS A 97 57.486 23.325 22.461 1.00 51.79 N ATOM 1406 CA CYS A 97 56.607 24.415 22.089 1.00 52.21 C ATOM 1407 C CYS A 97 55.299 24.335 22.855 1.00 57.22 C ATOM 1408 O CYS A 97 54.652 23.292 22.914 1.00 58.16 O ATOM 1409 CB CYS A 97 56.343 24.433 20.587 1.00 49.44 C ATOM 1410 SG CYS A 97 55.211 25.740 20.091 1.00 63.86 S ATOM 1411 HA CYS A 97 57.109 25.346 22.351 1.00 0.00 H ATOM 1412 HB2 CYS A 97 55.915 23.473 20.297 1.00 0.00 H ATOM 1413 HB3 CYS A 97 57.291 24.578 20.069 1.00 0.00 H ATOM 1414 HG CYS A 97 54.570 24.572 19.730 1.00 0.00 H ATOM 1415 H CYS A 97 57.492 22.452 21.896 1.00 0.00 H ATOM 1416 N THR A 98 54.929 25.472 23.427 1.00 65.15 N ATOM 1417 CA THR A 98 53.727 25.638 24.228 1.00 65.30 C ATOM 1418 C THR A 98 52.634 26.358 23.429 1.00 69.91 C ATOM 1419 O THR A 98 51.537 25.823 23.238 1.00 70.39 O ATOM 1420 CB THR A 98 54.024 26.321 25.578 1.00 63.57 C ATOM 1421 OG1 THR A 98 54.801 27.505 25.360 1.00 69.88 O ATOM 1422 CG2 THR A 98 54.815 25.376 26.470 1.00 59.12 C ATOM 1423 HA THR A 98 53.346 24.646 24.472 1.00 0.00 H ATOM 1424 HB THR A 98 53.080 26.579 26.057 1.00 0.00 H ATOM 1425 HG1 THR A 98 54.989 27.940 26.229 1.00 0.00 H ATOM 1426 HG23 THR A 98 54.234 24.470 26.643 1.00 0.00 H ATOM 1427 HG21 THR A 98 55.755 25.118 25.981 1.00 0.00 H ATOM 1428 HG22 THR A 98 55.021 25.865 27.422 1.00 0.00 H ATOM 1429 H THR A 98 55.541 26.303 23.294 1.00 0.00 H ATOM 1430 N CYS A 99 52.946 27.569 22.973 1.00 64.74 N ATOM 1431 CA CYS A 99 51.960 28.524 22.467 1.00 68.06 C ATOM 1432 C CYS A 99 50.913 27.924 21.529 1.00 73.19 C ATOM 1433 O CYS A 99 49.739 28.290 21.605 1.00 80.30 O ATOM 1434 CB CYS A 99 52.666 29.692 21.760 1.00 72.36 C ATOM 1435 SG CYS A 99 53.501 29.257 20.196 1.00 73.57 S ATOM 1436 HA CYS A 99 51.418 28.869 23.347 1.00 0.00 H ATOM 1437 HB2 CYS A 99 53.414 30.098 22.441 1.00 0.00 H ATOM 1438 HB3 CYS A 99 51.920 30.457 21.544 1.00 0.00 H ATOM 1439 HG CYS A 99 54.093 30.384 19.663 1.00 0.00 H ATOM 1440 H CYS A 99 53.947 27.852 22.977 1.00 0.00 H ATOM 1441 N GLY A 100 51.312 27.007 20.653 1.00 71.35 N ATOM 1442 CA GLY A 100 50.337 26.360 19.791 1.00 67.42 C ATOM 1443 C GLY A 100 50.239 26.891 18.370 1.00 68.23 C ATOM 1444 O GLY A 100 49.234 26.661 17.689 1.00 67.78 O ATOM 1445 HA3 GLY A 100 49.357 26.470 20.256 1.00 0.00 H ATOM 1446 HA2 GLY A 100 50.594 25.302 19.734 1.00 0.00 H ATOM 1447 H GLY A 100 52.318 26.754 20.585 1.00 0.00 H ATOM 1448 N SER A 101 51.253 27.630 17.932 1.00 63.52 N ATOM 1449 CA SER A 101 51.319 28.087 16.547 1.00 59.17 C ATOM 1450 C SER A 101 51.237 26.914 15.558 1.00 57.62 C ATOM 1451 O SER A 101 51.821 25.856 15.784 1.00 55.71 O ATOM 1452 CB SER A 101 52.602 28.889 16.316 1.00 59.29 C ATOM 1453 OG SER A 101 52.720 29.293 14.961 1.00 56.80 O ATOM 1454 HA SER A 101 50.458 28.730 16.368 1.00 0.00 H ATOM 1455 HB2 SER A 101 53.460 28.270 16.578 1.00 0.00 H ATOM 1456 HB3 SER A 101 52.587 29.775 16.951 1.00 0.00 H ATOM 1457 HG SER A 101 53.557 29.808 14.843 1.00 0.00 H ATOM 1458 H SER A 101 52.016 27.888 18.590 1.00 0.00 H ATOM 1459 N SER A 102 50.485 27.103 14.476 1.00 54.96 N ATOM 1460 CA SER A 102 50.377 26.105 13.419 1.00 46.50 C ATOM 1461 C SER A 102 51.352 26.386 12.282 1.00 42.19 C ATOM 1462 O SER A 102 51.371 25.667 11.287 1.00 37.34 O ATOM 1463 CB SER A 102 48.951 26.047 12.875 1.00 53.61 C ATOM 1464 OG SER A 102 48.592 27.284 12.284 1.00 52.87 O ATOM 1465 HA SER A 102 50.632 25.140 13.857 1.00 0.00 H ATOM 1466 HB2 SER A 102 48.264 25.827 13.692 1.00 0.00 H ATOM 1467 HB3 SER A 102 48.885 25.259 12.125 1.00 0.00 H ATOM 1468 HG SER A 102 47.666 27.227 11.938 1.00 0.00 H ATOM 1469 H SER A 102 49.956 27.994 14.381 1.00 0.00 H ATOM 1470 N ASP A 103 52.166 27.428 12.428 1.00 39.54 N ATOM 1471 CA ASP A 103 53.121 27.769 11.389 1.00 37.12 C ATOM 1472 C ASP A 103 54.500 27.253 11.792 1.00 39.58 C ATOM 1473 O ASP A 103 55.177 27.825 12.658 1.00 42.56 O ATOM 1474 CB ASP A 103 53.140 29.285 11.172 1.00 41.62 C ATOM 1475 CG ASP A 103 51.757 29.838 10.780 1.00 43.63 C ATOM 1476 OD1 ASP A 103 51.151 29.313 9.822 1.00 43.39 O ATOM 1477 OD2 ASP A 103 51.268 30.777 11.443 1.00 40.95 O ATOM 1478 HA ASP A 103 52.831 27.301 10.448 1.00 0.00 H ATOM 1479 HB2 ASP A 103 53.462 29.767 12.095 1.00 0.00 H ATOM 1480 HB3 ASP A 103 53.848 29.516 10.377 1.00 0.00 H ATOM 1481 H ASP A 103 52.118 28.003 13.293 1.00 0.00 H ATOM 1482 N LEU A 104 54.936 26.196 11.113 1.00 34.58 N ATOM 1483 CA LEU A 104 56.119 25.471 11.549 1.00 34.54 C ATOM 1484 C LEU A 104 57.268 25.569 10.558 1.00 32.99 C ATOM 1485 O LEU A 104 57.123 26.076 9.444 1.00 33.38 O ATOM 1486 CB LEU A 104 55.779 23.983 11.731 1.00 31.01 C ATOM 1487 CG LEU A 104 54.550 23.653 12.599 1.00 36.44 C ATOM 1488 CD1 LEU A 104 54.284 22.164 12.625 1.00 33.85 C ATOM 1489 CD2 LEU A 104 54.729 24.183 14.001 1.00 37.38 C ATOM 1490 HA LEU A 104 56.433 25.927 12.488 1.00 0.00 H ATOM 1491 HB2 LEU A 104 55.607 23.560 10.741 1.00 0.00 H ATOM 1492 HB3 LEU A 104 56.644 23.500 12.186 1.00 0.00 H ATOM 1493 HG LEU A 104 53.685 24.142 12.152 1.00 0.00 H ATOM 1494 HD21 LEU A 104 55.611 23.727 14.451 1.00 0.00 H ATOM 1495 HD22 LEU A 104 54.856 25.265 13.966 1.00 0.00 H ATOM 1496 HD23 LEU A 104 53.849 23.938 14.596 1.00 0.00 H ATOM 1497 HD11 LEU A 104 54.099 21.811 11.610 1.00 0.00 H ATOM 1498 HD12 LEU A 104 55.151 21.648 13.038 1.00 0.00 H ATOM 1499 HD13 LEU A 104 53.411 21.963 13.246 1.00 0.00 H ATOM 1500 H LEU A 104 54.426 25.885 10.262 1.00 0.00 H ATOM 1501 N TYR A 105 58.395 25.008 10.965 1.00 29.03 N ATOM 1502 CA TYR A 105 59.571 24.905 10.133 1.00 26.14 C ATOM 1503 C TYR A 105 60.174 23.537 10.391 1.00 31.77 C ATOM 1504 O TYR A 105 60.212 23.077 11.529 1.00 34.22 O ATOM 1505 CB TYR A 105 60.602 25.943 10.544 1.00 29.31 C ATOM 1506 CG TYR A 105 60.209 27.378 10.256 1.00 33.58 C ATOM 1507 CD1 TYR A 105 60.310 27.908 8.973 1.00 36.89 C ATOM 1508 CD2 TYR A 105 59.771 28.213 11.276 1.00 41.19 C ATOM 1509 CE1 TYR A 105 59.962 29.241 8.717 1.00 41.54 C ATOM 1510 CE2 TYR A 105 59.420 29.534 11.029 1.00 40.00 C ATOM 1511 CZ TYR A 105 59.512 30.040 9.757 1.00 42.48 C ATOM 1512 OH TYR A 105 59.161 31.359 9.536 1.00 44.23 O ATOM 1513 HA TYR A 105 59.302 25.057 9.088 1.00 0.00 H ATOM 1514 HB3 TYR A 105 61.528 25.731 10.010 1.00 0.00 H ATOM 1515 HB2 TYR A 105 60.772 25.846 11.616 1.00 0.00 H ATOM 1516 HD2 TYR A 105 59.701 27.823 12.292 1.00 0.00 H ATOM 1517 HE2 TYR A 105 59.072 30.168 11.845 1.00 0.00 H ATOM 1518 HE1 TYR A 105 60.044 29.646 7.709 1.00 0.00 H ATOM 1519 HD1 TYR A 105 60.664 27.278 8.157 1.00 0.00 H ATOM 1520 HH TYR A 105 59.280 31.575 8.577 1.00 0.00 H ATOM 1521 H TYR A 105 58.436 24.623 11.930 1.00 0.00 H ATOM 1522 N LEU A 106 60.639 22.891 9.338 1.00 28.02 N ATOM 1523 CA LEU A 106 61.362 21.634 9.461 1.00 26.48 C ATOM 1524 C LEU A 106 62.820 21.911 9.164 1.00 28.56 C ATOM 1525 O LEU A 106 63.132 22.538 8.152 1.00 30.19 O ATOM 1526 CB LEU A 106 60.815 20.632 8.445 1.00 29.33 C ATOM 1527 CG LEU A 106 61.685 19.397 8.211 1.00 30.20 C ATOM 1528 CD1 LEU A 106 61.650 18.514 9.449 1.00 32.28 C ATOM 1529 CD2 LEU A 106 61.191 18.641 6.979 1.00 32.97 C ATOM 1530 HA LEU A 106 61.247 21.220 10.463 1.00 0.00 H ATOM 1531 HB2 LEU A 106 59.839 20.295 8.796 1.00 0.00 H ATOM 1532 HB3 LEU A 106 60.699 21.148 7.492 1.00 0.00 H ATOM 1533 HG LEU A 106 62.717 19.699 8.030 1.00 0.00 H ATOM 1534 HD21 LEU A 106 60.158 18.330 7.135 1.00 0.00 H ATOM 1535 HD22 LEU A 106 61.248 19.293 6.107 1.00 0.00 H ATOM 1536 HD23 LEU A 106 61.816 17.762 6.819 1.00 0.00 H ATOM 1537 HD11 LEU A 106 62.032 19.073 10.303 1.00 0.00 H ATOM 1538 HD12 LEU A 106 60.623 18.205 9.645 1.00 0.00 H ATOM 1539 HD13 LEU A 106 62.270 17.633 9.283 1.00 0.00 H ATOM 1540 H LEU A 106 60.484 23.293 8.391 1.00 0.00 H ATOM 1541 N VAL A 107 63.713 21.480 10.053 1.00 27.37 N ATOM 1542 CA VAL A 107 65.142 21.620 9.819 1.00 28.89 C ATOM 1543 C VAL A 107 65.674 20.307 9.261 1.00 30.20 C ATOM 1544 O VAL A 107 65.538 19.258 9.905 1.00 27.97 O ATOM 1545 CB VAL A 107 65.871 22.005 11.107 1.00 30.05 C ATOM 1546 CG1 VAL A 107 67.371 22.113 10.864 1.00 30.79 C ATOM 1547 CG2 VAL A 107 65.319 23.351 11.628 1.00 32.10 C ATOM 1548 HA VAL A 107 65.319 22.419 9.099 1.00 0.00 H ATOM 1549 HB VAL A 107 65.702 21.229 11.854 1.00 0.00 H ATOM 1550 HG11 VAL A 107 67.752 21.153 10.516 1.00 0.00 H ATOM 1551 HG12 VAL A 107 67.561 22.876 10.109 1.00 0.00 H ATOM 1552 HG13 VAL A 107 67.870 22.388 11.794 1.00 0.00 H ATOM 1553 HG21 VAL A 107 65.478 24.123 10.875 1.00 0.00 H ATOM 1554 HG22 VAL A 107 64.252 23.251 11.829 1.00 0.00 H ATOM 1555 HG23 VAL A 107 65.839 23.625 12.546 1.00 0.00 H ATOM 1556 H VAL A 107 63.382 21.034 10.932 1.00 0.00 H ATOM 1557 N THR A 108 66.247 20.358 8.057 1.00 29.12 N ATOM 1558 CA THR A 108 66.763 19.153 7.403 1.00 27.22 C ATOM 1559 C THR A 108 68.253 18.917 7.688 1.00 29.74 C ATOM 1560 O THR A 108 68.944 19.793 8.245 1.00 27.19 O ATOM 1561 CB THR A 108 66.569 19.250 5.872 1.00 31.82 C ATOM 1562 OG1 THR A 108 67.424 20.268 5.350 1.00 33.26 O ATOM 1563 CG2 THR A 108 65.108 19.583 5.519 1.00 32.07 C ATOM 1564 HA THR A 108 66.199 18.315 7.813 1.00 0.00 H ATOM 1565 HB THR A 108 66.820 18.285 5.432 1.00 0.00 H ATOM 1566 HG1 THR A 108 67.196 21.136 5.769 1.00 0.00 H ATOM 1567 HG23 THR A 108 64.454 18.807 5.917 1.00 0.00 H ATOM 1568 HG21 THR A 108 64.840 20.545 5.956 1.00 0.00 H ATOM 1569 HG22 THR A 108 64.999 19.632 4.436 1.00 0.00 H ATOM 1570 H THR A 108 66.329 21.274 7.572 1.00 0.00 H ATOM 1571 N ARG A 109 68.772 17.779 7.230 1.00 27.86 N ATOM 1572 CA ARG A 109 70.190 17.452 7.468 1.00 32.03 C ATOM 1573 C ARG A 109 71.137 18.375 6.674 1.00 34.91 C ATOM 1574 O ARG A 109 72.328 18.467 6.965 1.00 33.31 O ATOM 1575 CB ARG A 109 70.486 15.978 7.152 1.00 30.17 C ATOM 1576 CG ARG A 109 70.569 15.655 5.678 1.00 32.80 C ATOM 1577 CD ARG A 109 70.905 14.182 5.460 1.00 39.29 C ATOM 1578 NE ARG A 109 72.285 13.850 5.820 1.00 41.35 N ATOM 1579 CZ ARG A 109 72.645 13.110 6.868 1.00 39.36 C ATOM 1580 NH1 ARG A 109 71.736 12.608 7.708 1.00 32.08 N ATOM 1581 NH2 ARG A 109 73.930 12.876 7.084 1.00 40.71 N ATOM 1582 HA ARG A 109 70.376 17.620 8.529 1.00 0.00 H ATOM 1583 HB2 ARG A 109 71.439 15.716 7.612 1.00 0.00 H ATOM 1584 HB3 ARG A 109 69.694 15.370 7.589 1.00 0.00 H ATOM 1585 HG2 ARG A 109 69.610 15.875 5.210 1.00 0.00 H ATOM 1586 HG3 ARG A 109 71.345 16.269 5.221 1.00 0.00 H ATOM 1587 HD2 ARG A 109 70.753 13.943 4.407 1.00 0.00 H ATOM 1588 HD3 ARG A 109 70.232 13.578 6.069 1.00 0.00 H ATOM 1589 HE ARG A 109 73.042 14.220 5.211 1.00 0.00 H ATOM 1590 HH12 ARG A 109 72.040 12.033 8.520 1.00 0.00 H ATOM 1591 HH11 ARG A 109 70.725 12.792 7.550 1.00 0.00 H ATOM 1592 HH22 ARG A 109 74.224 12.300 7.898 1.00 0.00 H ATOM 1593 HH21 ARG A 109 74.646 13.268 6.439 1.00 0.00 H ATOM 1594 H ARG A 109 68.172 17.115 6.700 1.00 0.00 H ATOM 1595 N HIS A 110 70.593 19.064 5.682 1.00 36.10 N ATOM 1596 CA HIS A 110 71.373 19.990 4.865 1.00 35.36 C ATOM 1597 C HIS A 110 71.351 21.365 5.529 1.00 38.59 C ATOM 1598 O HIS A 110 71.834 22.351 4.966 1.00 39.36 O ATOM 1599 CB HIS A 110 70.794 20.072 3.451 1.00 37.97 C ATOM 1600 CG HIS A 110 70.579 18.735 2.802 1.00 39.57 C ATOM 1601 ND1 HIS A 110 71.617 17.890 2.472 1.00 47.23 N ATOM 1602 CD2 HIS A 110 69.443 18.103 2.417 1.00 41.41 C ATOM 1603 CE1 HIS A 110 71.132 16.794 1.918 1.00 47.80 C ATOM 1604 NE2 HIS A 110 69.815 16.898 1.872 1.00 46.75 N ATOM 1605 HA HIS A 110 72.401 19.635 4.787 1.00 0.00 H ATOM 1606 HB2 HIS A 110 69.835 20.587 3.502 1.00 0.00 H ATOM 1607 HB3 HIS A 110 71.481 20.648 2.831 1.00 0.00 H ATOM 1608 HD2 HIS A 110 68.426 18.480 2.520 1.00 0.00 H ATOM 1609 HE1 HIS A 110 71.718 15.948 1.560 1.00 0.00 H ATOM 1610 H HIS A 110 69.580 18.942 5.479 1.00 0.00 H ATOM 1611 N ALA A 111 70.759 21.411 6.721 1.00 30.42 N ATOM 1612 CA ALA A 111 70.511 22.632 7.462 1.00 29.32 C ATOM 1613 C ALA A 111 69.648 23.633 6.696 1.00 35.32 C ATOM 1614 O ALA A 111 69.776 24.824 6.906 1.00 33.42 O ATOM 1615 CB ALA A 111 71.841 23.291 7.906 1.00 31.57 C ATOM 1616 HA ALA A 111 69.945 22.341 8.347 1.00 0.00 H ATOM 1617 HB1 ALA A 111 72.392 22.600 8.544 1.00 0.00 H ATOM 1618 HB2 ALA A 111 72.438 23.530 7.026 1.00 0.00 H ATOM 1619 HB3 ALA A 111 71.625 24.205 8.460 1.00 0.00 H ATOM 1620 H ALA A 111 70.455 20.513 7.148 1.00 0.00 H ATOM 1621 N ASP A 112 68.790 23.178 5.793 1.00 32.34 N ATOM 1622 CA ASP A 112 67.733 24.070 5.314 1.00 35.67 C ATOM 1623 C ASP A 112 66.615 24.105 6.339 1.00 35.99 C ATOM 1624 O ASP A 112 66.424 23.144 7.090 1.00 31.45 O ATOM 1625 CB ASP A 112 67.194 23.618 3.968 1.00 38.73 C ATOM 1626 CG ASP A 112 68.261 23.568 2.914 1.00 43.54 C ATOM 1627 OD1 ASP A 112 69.109 24.486 2.895 1.00 44.27 O ATOM 1628 OD2 ASP A 112 68.266 22.603 2.118 1.00 49.30 O ATOM 1629 HA ASP A 112 68.150 25.068 5.182 1.00 0.00 H ATOM 1630 HB2 ASP A 112 66.764 22.623 4.079 1.00 0.00 H ATOM 1631 HB3 ASP A 112 66.418 24.314 3.649 1.00 0.00 H ATOM 1632 H ASP A 112 68.867 22.206 5.432 1.00 0.00 H ATOM 1633 N VAL A 113 65.899 25.223 6.397 1.00 32.55 N ATOM 1634 CA VAL A 113 64.789 25.375 7.323 1.00 33.59 C ATOM 1635 C VAL A 113 63.556 25.619 6.472 1.00 38.23 C ATOM 1636 O VAL A 113 63.412 26.698 5.883 1.00 40.15 O ATOM 1637 CB VAL A 113 65.016 26.597 8.257 1.00 34.18 C ATOM 1638 CG1 VAL A 113 63.906 26.718 9.281 1.00 37.82 C ATOM 1639 CG2 VAL A 113 66.382 26.493 8.966 1.00 37.05 C ATOM 1640 HA VAL A 113 64.687 24.490 7.951 1.00 0.00 H ATOM 1641 HB VAL A 113 65.008 27.494 7.637 1.00 0.00 H ATOM 1642 HG11 VAL A 113 62.952 26.844 8.768 1.00 0.00 H ATOM 1643 HG12 VAL A 113 63.876 25.815 9.890 1.00 0.00 H ATOM 1644 HG13 VAL A 113 64.094 27.582 9.919 1.00 0.00 H ATOM 1645 HG21 VAL A 113 66.412 25.581 9.563 1.00 0.00 H ATOM 1646 HG22 VAL A 113 67.176 26.466 8.220 1.00 0.00 H ATOM 1647 HG23 VAL A 113 66.520 27.358 9.614 1.00 0.00 H ATOM 1648 H VAL A 113 66.140 26.011 5.762 1.00 0.00 H ATOM 1649 N ILE A 114 62.639 24.661 6.414 1.00 31.43 N ATOM 1650 CA ILE A 114 61.561 24.823 5.446 1.00 32.78 C ATOM 1651 C ILE A 114 60.195 24.923 6.084 1.00 32.94 C ATOM 1652 O ILE A 114 59.893 24.231 7.057 1.00 32.05 O ATOM 1653 CB ILE A 114 61.573 23.722 4.367 1.00 37.94 C ATOM 1654 CG1 ILE A 114 61.581 22.351 5.001 1.00 37.78 C ATOM 1655 CG2 ILE A 114 62.812 23.849 3.484 1.00 41.33 C ATOM 1656 CD1 ILE A 114 62.037 21.258 4.031 1.00 44.20 C ATOM 1657 HA ILE A 114 61.758 25.778 4.960 1.00 0.00 H ATOM 1658 HB ILE A 114 60.673 23.845 3.765 1.00 0.00 H ATOM 1659 HG12 ILE A 114 62.258 22.365 5.855 1.00 0.00 H ATOM 1660 HG13 ILE A 114 60.572 22.117 5.342 1.00 0.00 H ATOM 1661 HD11 ILE A 114 61.362 21.228 3.176 1.00 0.00 H ATOM 1662 HD12 ILE A 114 63.049 21.476 3.690 1.00 0.00 H ATOM 1663 HD13 ILE A 114 62.024 20.294 4.540 1.00 0.00 H ATOM 1664 HG21 ILE A 114 62.810 24.823 2.995 1.00 0.00 H ATOM 1665 HG22 ILE A 114 63.707 23.751 4.099 1.00 0.00 H ATOM 1666 HG23 ILE A 114 62.801 23.063 2.729 1.00 0.00 H ATOM 1667 H ILE A 114 62.688 23.828 7.035 1.00 0.00 H ATOM 1668 N PRO A 115 59.355 25.785 5.508 1.00 30.61 N ATOM 1669 CA PRO A 115 58.022 26.075 6.043 1.00 33.38 C ATOM 1670 C PRO A 115 57.095 24.878 5.949 1.00 31.88 C ATOM 1671 O PRO A 115 56.963 24.255 4.893 1.00 32.80 O ATOM 1672 CB PRO A 115 57.513 27.203 5.133 1.00 36.47 C ATOM 1673 CG PRO A 115 58.742 27.801 4.526 1.00 41.40 C ATOM 1674 CD PRO A 115 59.720 26.674 4.388 1.00 35.93 C ATOM 1675 HA PRO A 115 58.056 26.337 7.100 1.00 0.00 H ATOM 1676 HD3 PRO A 115 59.603 26.167 3.430 1.00 0.00 H ATOM 1677 HD2 PRO A 115 60.746 27.030 4.487 1.00 0.00 H ATOM 1678 HG3 PRO A 115 59.147 28.578 5.175 1.00 0.00 H ATOM 1679 HG2 PRO A 115 58.514 28.228 3.549 1.00 0.00 H ATOM 1680 HB2 PRO A 115 56.859 26.804 4.358 1.00 0.00 H ATOM 1681 HB3 PRO A 115 56.972 27.949 5.715 1.00 0.00 H ATOM 1682 N VAL A 116 56.445 24.588 7.064 1.00 28.01 N ATOM 1683 CA VAL A 116 55.460 23.531 7.166 1.00 29.52 C ATOM 1684 C VAL A 116 54.208 24.134 7.831 1.00 30.80 C ATOM 1685 O VAL A 116 54.318 24.892 8.788 1.00 31.53 O ATOM 1686 CB VAL A 116 55.985 22.369 8.038 1.00 32.99 C ATOM 1687 CG1 VAL A 116 54.892 21.339 8.290 1.00 31.30 C ATOM 1688 CG2 VAL A 116 57.213 21.684 7.376 1.00 34.15 C ATOM 1689 HA VAL A 116 55.238 23.136 6.175 1.00 0.00 H ATOM 1690 HB VAL A 116 56.295 22.792 8.994 1.00 0.00 H ATOM 1691 HG11 VAL A 116 54.058 21.815 8.806 1.00 0.00 H ATOM 1692 HG12 VAL A 116 54.549 20.935 7.338 1.00 0.00 H ATOM 1693 HG13 VAL A 116 55.290 20.533 8.906 1.00 0.00 H ATOM 1694 HG21 VAL A 116 56.925 21.288 6.402 1.00 0.00 H ATOM 1695 HG22 VAL A 116 58.012 22.415 7.251 1.00 0.00 H ATOM 1696 HG23 VAL A 116 57.560 20.870 8.013 1.00 0.00 H ATOM 1697 H VAL A 116 56.653 25.150 7.914 1.00 0.00 H ATOM 1698 N ARG A 117 53.028 23.812 7.324 1.00 33.62 N ATOM 1699 CA ARG A 117 51.787 24.184 8.010 1.00 30.92 C ATOM 1700 C ARG A 117 51.235 22.980 8.776 1.00 32.22 C ATOM 1701 O ARG A 117 50.944 21.947 8.184 1.00 32.14 O ATOM 1702 CB ARG A 117 50.751 24.665 6.997 1.00 38.63 C ATOM 1703 CG ARG A 117 49.311 24.688 7.518 1.00 38.33 C ATOM 1704 CD ARG A 117 48.888 26.063 8.017 1.00 47.00 C ATOM 1705 NE ARG A 117 47.453 26.116 8.316 1.00 48.22 N ATOM 1706 CZ ARG A 117 46.525 26.604 7.494 1.00 53.01 C ATOM 1707 NH1 ARG A 117 46.864 27.105 6.310 1.00 49.71 N ATOM 1708 NH2 ARG A 117 45.248 26.607 7.864 1.00 52.13 N ATOM 1709 HA ARG A 117 52.001 24.991 8.711 1.00 0.00 H ATOM 1710 HB2 ARG A 117 51.018 25.677 6.691 1.00 0.00 H ATOM 1711 HB3 ARG A 117 50.789 24.003 6.132 1.00 0.00 H ATOM 1712 HG2 ARG A 117 48.643 24.389 6.710 1.00 0.00 H ATOM 1713 HG3 ARG A 117 49.226 23.977 8.340 1.00 0.00 H ATOM 1714 HD2 ARG A 117 49.116 26.803 7.250 1.00 0.00 H ATOM 1715 HD3 ARG A 117 49.446 26.297 8.923 1.00 0.00 H ATOM 1716 HE ARG A 117 47.137 25.746 9.235 1.00 0.00 H ATOM 1717 HH12 ARG A 117 46.131 27.483 5.676 1.00 0.00 H ATOM 1718 HH11 ARG A 117 47.862 27.119 6.018 1.00 0.00 H ATOM 1719 HH22 ARG A 117 44.522 26.987 7.224 1.00 0.00 H ATOM 1720 HH21 ARG A 117 44.975 26.229 8.794 1.00 0.00 H ATOM 1721 H ARG A 117 52.981 23.288 6.427 1.00 0.00 H ATOM 1722 N ARG A 118 51.056 23.112 10.086 1.00 32.63 N ATOM 1723 CA ARG A 118 50.569 21.976 10.868 1.00 36.78 C ATOM 1724 C ARG A 118 49.112 21.668 10.524 1.00 40.99 C ATOM 1725 O ARG A 118 48.258 22.561 10.572 1.00 41.34 O ATOM 1726 CB ARG A 118 50.702 22.261 12.361 1.00 34.96 C ATOM 1727 CG ARG A 118 50.549 21.008 13.210 1.00 38.08 C ATOM 1728 CD ARG A 118 50.685 21.298 14.693 1.00 40.78 C ATOM 1729 NE ARG A 118 50.688 20.048 15.438 1.00 36.26 N ATOM 1730 CZ ARG A 118 51.077 19.927 16.700 1.00 41.46 C ATOM 1731 NH1 ARG A 118 51.500 20.987 17.372 1.00 39.80 N ATOM 1732 NH2 ARG A 118 51.044 18.732 17.287 1.00 41.03 N ATOM 1733 HA ARG A 118 51.177 21.107 10.618 1.00 0.00 H ATOM 1734 HB2 ARG A 118 51.685 22.693 12.548 1.00 0.00 H ATOM 1735 HB3 ARG A 118 49.932 22.976 12.651 1.00 0.00 H ATOM 1736 HG2 ARG A 118 49.565 20.577 13.025 1.00 0.00 H ATOM 1737 HG3 ARG A 118 51.318 20.292 12.920 1.00 0.00 H ATOM 1738 HD2 ARG A 118 49.847 21.914 15.021 1.00 0.00 H ATOM 1739 HD3 ARG A 118 51.618 21.831 14.874 1.00 0.00 H ATOM 1740 HE ARG A 118 50.363 19.191 14.947 1.00 0.00 H ATOM 1741 HH12 ARG A 118 51.804 20.888 18.362 1.00 0.00 H ATOM 1742 HH11 ARG A 118 51.528 21.918 16.910 1.00 0.00 H ATOM 1743 HH22 ARG A 118 51.348 18.630 18.276 1.00 0.00 H ATOM 1744 HH21 ARG A 118 50.715 17.901 16.756 1.00 0.00 H ATOM 1745 H ARG A 118 51.261 24.018 10.553 1.00 0.00 H ATOM 1746 N ARG A 119 48.855 20.435 10.083 1.00 36.78 N ATOM 1747 CA ARG A 119 47.493 19.966 9.766 1.00 39.62 C ATOM 1748 C ARG A 119 46.773 19.090 10.809 1.00 46.77 C ATOM 1749 O ARG A 119 45.585 18.788 10.658 1.00 48.43 O ATOM 1750 CB ARG A 119 47.488 19.258 8.418 1.00 38.18 C ATOM 1751 CG ARG A 119 47.990 20.127 7.265 1.00 40.11 C ATOM 1752 CD ARG A 119 47.035 21.291 6.986 1.00 42.53 C ATOM 1753 NE ARG A 119 47.378 21.985 5.746 1.00 47.94 N ATOM 1754 CZ ARG A 119 46.657 22.968 5.207 1.00 46.94 C ATOM 1755 NH1 ARG A 119 45.549 23.377 5.798 1.00 41.89 N ATOM 1756 NH2 ARG A 119 47.046 23.540 4.071 1.00 42.50 N ATOM 1757 HA ARG A 119 46.910 20.887 9.758 1.00 0.00 H ATOM 1758 HB2 ARG A 119 48.127 18.378 8.489 1.00 0.00 H ATOM 1759 HB3 ARG A 119 46.467 18.948 8.196 1.00 0.00 H ATOM 1760 HG2 ARG A 119 48.971 20.527 7.523 1.00 0.00 H ATOM 1761 HG3 ARG A 119 48.073 19.513 6.368 1.00 0.00 H ATOM 1762 HD2 ARG A 119 47.088 21.998 7.814 1.00 0.00 H ATOM 1763 HD3 ARG A 119 46.019 20.904 6.905 1.00 0.00 H ATOM 1764 HE ARG A 119 48.244 21.692 5.250 1.00 0.00 H ATOM 1765 HH12 ARG A 119 44.987 24.144 5.376 1.00 0.00 H ATOM 1766 HH11 ARG A 119 45.238 22.932 6.685 1.00 0.00 H ATOM 1767 HH22 ARG A 119 46.480 24.307 3.654 1.00 0.00 H ATOM 1768 HH21 ARG A 119 47.916 23.221 3.599 1.00 0.00 H ATOM 1769 H ARG A 119 49.650 19.776 9.957 1.00 0.00 H ATOM 1770 N GLY A 120 47.466 18.719 11.881 1.00 42.66 N ATOM 1771 CA GLY A 120 46.902 17.818 12.873 1.00 45.80 C ATOM 1772 C GLY A 120 47.956 17.536 13.916 1.00 39.75 C ATOM 1773 O GLY A 120 49.019 18.132 13.873 1.00 41.28 O ATOM 1774 HA3 GLY A 120 46.599 16.887 12.395 1.00 0.00 H ATOM 1775 HA2 GLY A 120 46.035 18.283 13.342 1.00 0.00 H ATOM 1776 H GLY A 120 48.432 19.081 12.013 1.00 0.00 H ATOM 1777 N ASP A 121 47.687 16.627 14.843 1.00 40.25 N ATOM 1778 CA ASP A 121 48.639 16.401 15.930 1.00 44.66 C ATOM 1779 C ASP A 121 50.016 15.984 15.403 1.00 36.15 C ATOM 1780 O ASP A 121 51.030 16.492 15.840 1.00 40.53 O ATOM 1781 CB ASP A 121 48.115 15.340 16.909 1.00 47.29 C ATOM 1782 CG ASP A 121 46.966 15.850 17.775 1.00 56.64 C ATOM 1783 OD1 ASP A 121 47.029 17.014 18.233 1.00 59.10 O ATOM 1784 OD2 ASP A 121 46.001 15.085 18.000 1.00 61.24 O ATOM 1785 HA ASP A 121 48.749 17.349 16.457 1.00 0.00 H ATOM 1786 HB2 ASP A 121 47.765 14.480 16.337 1.00 0.00 H ATOM 1787 HB3 ASP A 121 48.933 15.033 17.561 1.00 0.00 H ATOM 1788 H ASP A 121 46.805 16.078 14.797 1.00 0.00 H ATOM 1789 N SER A 122 50.021 14.963 14.560 1.00 38.28 N ATOM 1790 CA SER A 122 51.234 14.393 13.960 1.00 40.56 C ATOM 1791 C SER A 122 51.582 14.777 12.509 1.00 37.07 C ATOM 1792 O SER A 122 52.431 14.128 11.907 1.00 34.18 O ATOM 1793 CB SER A 122 51.217 12.874 14.110 1.00 35.94 C ATOM 1794 OG SER A 122 50.239 12.341 13.243 1.00 48.33 O ATOM 1795 HA SER A 122 52.036 14.862 14.530 1.00 0.00 H ATOM 1796 HB2 SER A 122 50.977 12.610 15.140 1.00 0.00 H ATOM 1797 HB3 SER A 122 52.196 12.469 13.852 1.00 0.00 H ATOM 1798 HG SER A 122 49.352 12.712 13.480 1.00 0.00 H ATOM 1799 H SER A 122 49.107 14.537 14.306 1.00 0.00 H ATOM 1800 N ARG A 123 50.844 15.693 11.882 1.00 34.43 N ATOM 1801 CA ARG A 123 50.988 15.925 10.446 1.00 34.78 C ATOM 1802 C ARG A 123 51.163 17.392 10.064 1.00 37.34 C ATOM 1803 O ARG A 123 50.583 18.284 10.700 1.00 36.35 O ATOM 1804 CB ARG A 123 49.771 15.365 9.700 1.00 36.52 C ATOM 1805 CG ARG A 123 49.710 13.847 9.606 1.00 37.84 C ATOM 1806 CD ARG A 123 50.666 13.316 8.549 1.00 38.03 C ATOM 1807 NE ARG A 123 50.617 11.860 8.442 1.00 41.37 N ATOM 1808 CZ ARG A 123 49.972 11.202 7.485 1.00 41.59 C ATOM 1809 NH1 ARG A 123 49.314 11.867 6.545 1.00 42.24 N ATOM 1810 NH2 ARG A 123 49.989 9.878 7.464 1.00 45.49 N ATOM 1811 HA ARG A 123 51.904 15.410 10.157 1.00 0.00 H ATOM 1812 HB2 ARG A 123 48.873 15.708 10.214 1.00 0.00 H ATOM 1813 HB3 ARG A 123 49.783 15.766 8.686 1.00 0.00 H ATOM 1814 HG2 ARG A 123 49.978 13.421 10.573 1.00 0.00 H ATOM 1815 HG3 ARG A 123 48.694 13.548 9.348 1.00 0.00 H ATOM 1816 HD2 ARG A 123 51.681 13.615 8.811 1.00 0.00 H ATOM 1817 HD3 ARG A 123 50.399 13.748 7.585 1.00 0.00 H ATOM 1818 HE ARG A 123 51.120 11.302 9.162 1.00 0.00 H ATOM 1819 HH12 ARG A 123 48.810 11.349 5.797 1.00 0.00 H ATOM 1820 HH11 ARG A 123 49.302 12.907 6.556 1.00 0.00 H ATOM 1821 HH22 ARG A 123 49.484 9.363 6.715 1.00 0.00 H ATOM 1822 HH21 ARG A 123 50.507 9.353 8.197 1.00 0.00 H ATOM 1823 H ARG A 123 50.154 16.252 12.424 1.00 0.00 H ATOM 1824 N GLY A 124 51.912 17.635 8.993 1.00 32.44 N ATOM 1825 CA GLY A 124 51.965 18.979 8.441 1.00 36.54 C ATOM 1826 C GLY A 124 52.219 18.930 6.949 1.00 36.27 C ATOM 1827 O GLY A 124 52.823 17.979 6.444 1.00 33.42 O ATOM 1828 HA3 GLY A 124 52.769 19.534 8.924 1.00 0.00 H ATOM 1829 HA2 GLY A 124 51.016 19.481 8.627 1.00 0.00 H ATOM 1830 H GLY A 124 52.458 16.867 8.552 1.00 0.00 H ATOM 1831 N SER A 125 51.780 19.963 6.236 1.00 30.55 N ATOM 1832 CA SER A 125 51.955 19.977 4.794 1.00 28.60 C ATOM 1833 C SER A 125 53.159 20.839 4.473 1.00 32.57 C ATOM 1834 O SER A 125 53.392 21.849 5.130 1.00 35.48 O ATOM 1835 CB SER A 125 50.713 20.549 4.112 1.00 38.25 C ATOM 1836 OG SER A 125 50.457 21.856 4.595 1.00 41.10 O ATOM 1837 HA SER A 125 52.106 18.961 4.430 1.00 0.00 H ATOM 1838 HB2 SER A 125 49.856 19.910 4.326 1.00 0.00 H ATOM 1839 HB3 SER A 125 50.877 20.587 3.035 1.00 0.00 H ATOM 1840 HG SER A 125 51.234 22.437 4.400 1.00 0.00 H ATOM 1841 H SER A 125 51.311 20.761 6.711 1.00 0.00 H ATOM 1842 N LEU A 126 53.938 20.425 3.487 1.00 30.15 N ATOM 1843 CA LEU A 126 55.010 21.250 2.974 1.00 30.44 C ATOM 1844 C LEU A 126 54.366 22.319 2.124 1.00 35.79 C ATOM 1845 O LEU A 126 53.568 22.017 1.245 1.00 40.07 O ATOM 1846 CB LEU A 126 55.974 20.424 2.127 1.00 33.91 C ATOM 1847 CG LEU A 126 56.722 19.345 2.911 1.00 36.98 C ATOM 1848 CD1 LEU A 126 57.336 18.307 1.974 1.00 38.51 C ATOM 1849 CD2 LEU A 126 57.764 19.973 3.807 1.00 36.33 C ATOM 1850 HA LEU A 126 55.585 21.683 3.793 1.00 0.00 H ATOM 1851 HB2 LEU A 126 55.405 19.939 1.334 1.00 0.00 H ATOM 1852 HB3 LEU A 126 56.708 21.099 1.686 1.00 0.00 H ATOM 1853 HG LEU A 126 56.006 18.821 3.544 1.00 0.00 H ATOM 1854 HD21 LEU A 126 58.477 20.529 3.198 1.00 0.00 H ATOM 1855 HD22 LEU A 126 57.277 20.650 4.509 1.00 0.00 H ATOM 1856 HD23 LEU A 126 58.287 19.191 4.358 1.00 0.00 H ATOM 1857 HD11 LEU A 126 56.546 17.831 1.393 1.00 0.00 H ATOM 1858 HD12 LEU A 126 58.038 18.798 1.300 1.00 0.00 H ATOM 1859 HD13 LEU A 126 57.861 17.554 2.562 1.00 0.00 H ATOM 1860 H LEU A 126 53.776 19.485 3.071 1.00 0.00 H ATOM 1861 N LEU A 127 54.690 23.572 2.392 1.00 33.31 N ATOM 1862 CA LEU A 127 54.125 24.659 1.605 1.00 39.60 C ATOM 1863 C LEU A 127 54.638 24.627 0.171 1.00 40.99 C ATOM 1864 O LEU A 127 53.924 24.998 -0.769 1.00 42.64 O ATOM 1865 CB LEU A 127 54.377 26.003 2.288 1.00 38.80 C ATOM 1866 CG LEU A 127 53.326 26.220 3.386 1.00 43.12 C ATOM 1867 CD1 LEU A 127 53.912 26.153 4.786 1.00 40.81 C ATOM 1868 CD2 LEU A 127 52.612 27.541 3.172 1.00 49.96 C ATOM 1869 HA LEU A 127 53.045 24.523 1.549 1.00 0.00 H ATOM 1870 HB2 LEU A 127 55.373 26.005 2.731 1.00 0.00 H ATOM 1871 HB3 LEU A 127 54.306 26.804 1.553 1.00 0.00 H ATOM 1872 HG LEU A 127 52.610 25.402 3.308 1.00 0.00 H ATOM 1873 HD21 LEU A 127 53.337 28.354 3.205 1.00 0.00 H ATOM 1874 HD22 LEU A 127 52.118 27.532 2.200 1.00 0.00 H ATOM 1875 HD23 LEU A 127 51.869 27.683 3.957 1.00 0.00 H ATOM 1876 HD11 LEU A 127 54.361 25.172 4.944 1.00 0.00 H ATOM 1877 HD12 LEU A 127 54.674 26.925 4.897 1.00 0.00 H ATOM 1878 HD13 LEU A 127 53.120 26.314 5.518 1.00 0.00 H ATOM 1879 H LEU A 127 55.350 23.782 3.167 1.00 0.00 H ATOM 1880 N SER A 128 55.887 24.194 0.021 1.00 38.75 N ATOM 1881 CA SER A 128 56.450 23.830 -1.282 1.00 41.37 C ATOM 1882 C SER A 128 56.811 22.345 -1.304 1.00 37.08 C ATOM 1883 O SER A 128 57.639 21.904 -0.527 1.00 38.23 O ATOM 1884 CB SER A 128 57.696 24.662 -1.591 1.00 45.78 C ATOM 1885 OG SER A 128 57.391 26.044 -1.577 1.00 51.07 O ATOM 1886 HA SER A 128 55.696 24.033 -2.043 1.00 0.00 H ATOM 1887 HB2 SER A 128 58.074 24.389 -2.576 1.00 0.00 H ATOM 1888 HB3 SER A 128 58.459 24.456 -0.841 1.00 0.00 H ATOM 1889 HG SER A 128 57.051 26.297 -0.682 1.00 0.00 H ATOM 1890 H SER A 128 56.490 24.110 0.865 1.00 0.00 H ATOM 1891 N PRO A 129 56.183 21.564 -2.185 1.00 42.25 N ATOM 1892 CA PRO A 129 56.632 20.172 -2.348 1.00 40.33 C ATOM 1893 C PRO A 129 58.144 20.058 -2.612 1.00 39.30 C ATOM 1894 O PRO A 129 58.718 20.891 -3.306 1.00 41.53 O ATOM 1895 CB PRO A 129 55.849 19.702 -3.574 1.00 41.15 C ATOM 1896 CG PRO A 129 54.589 20.526 -3.534 1.00 53.66 C ATOM 1897 CD PRO A 129 54.991 21.873 -2.988 1.00 42.60 C ATOM 1898 HA PRO A 129 56.460 19.583 -1.447 1.00 0.00 H ATOM 1899 HD3 PRO A 129 55.231 22.567 -3.794 1.00 0.00 H ATOM 1900 HD2 PRO A 129 54.200 22.297 -2.369 1.00 0.00 H ATOM 1901 HG3 PRO A 129 53.850 20.058 -2.883 1.00 0.00 H ATOM 1902 HG2 PRO A 129 54.173 20.632 -4.536 1.00 0.00 H ATOM 1903 HB2 PRO A 129 56.409 19.893 -4.489 1.00 0.00 H ATOM 1904 HB3 PRO A 129 55.620 18.639 -3.505 1.00 0.00 H ATOM 1905 N ARG A 130 58.773 19.034 -2.044 1.00 37.91 N ATOM 1906 CA ARG A 130 60.184 18.748 -2.277 1.00 38.45 C ATOM 1907 C ARG A 130 60.337 17.317 -2.777 1.00 34.01 C ATOM 1908 O ARG A 130 59.494 16.462 -2.488 1.00 38.04 O ATOM 1909 CB ARG A 130 60.991 18.901 -0.982 1.00 39.19 C ATOM 1910 CG ARG A 130 60.815 20.239 -0.277 1.00 42.08 C ATOM 1911 CD ARG A 130 61.190 21.374 -1.181 1.00 46.67 C ATOM 1912 NE ARG A 130 62.487 21.958 -0.861 1.00 51.91 N ATOM 1913 CZ ARG A 130 62.640 23.120 -0.232 1.00 50.79 C ATOM 1914 NH1 ARG A 130 61.572 23.814 0.156 1.00 53.74 N ATOM 1915 NH2 ARG A 130 63.856 23.585 0.014 1.00 50.85 N ATOM 1916 HA ARG A 130 60.558 19.454 -3.019 1.00 0.00 H ATOM 1917 HB2 ARG A 130 60.684 18.112 -0.295 1.00 0.00 H ATOM 1918 HB3 ARG A 130 62.047 18.780 -1.223 1.00 0.00 H ATOM 1919 HG2 ARG A 130 59.773 20.350 0.023 1.00 0.00 H ATOM 1920 HG3 ARG A 130 61.451 20.263 0.608 1.00 0.00 H ATOM 1921 HD2 ARG A 130 60.430 22.150 -1.097 1.00 0.00 H ATOM 1922 HD3 ARG A 130 61.219 21.006 -2.206 1.00 0.00 H ATOM 1923 HE ARG A 130 63.342 21.436 -1.141 1.00 0.00 H ATOM 1924 HH12 ARG A 130 61.693 24.722 0.648 1.00 0.00 H ATOM 1925 HH11 ARG A 130 60.617 23.448 -0.033 1.00 0.00 H ATOM 1926 HH22 ARG A 130 63.976 24.494 0.506 1.00 0.00 H ATOM 1927 HH21 ARG A 130 64.691 23.041 -0.285 1.00 0.00 H ATOM 1928 H ARG A 130 58.237 18.411 -1.407 1.00 0.00 H ATOM 1929 N PRO A 131 61.427 17.038 -3.512 1.00 36.07 N ATOM 1930 CA PRO A 131 61.682 15.647 -3.876 1.00 34.05 C ATOM 1931 C PRO A 131 61.980 14.861 -2.616 1.00 37.33 C ATOM 1932 O PRO A 131 62.582 15.403 -1.687 1.00 37.74 O ATOM 1933 CB PRO A 131 62.940 15.735 -4.751 1.00 40.07 C ATOM 1934 CG PRO A 131 63.029 17.151 -5.174 1.00 39.66 C ATOM 1935 CD PRO A 131 62.441 17.950 -4.069 1.00 37.09 C ATOM 1936 HA PRO A 131 60.848 15.161 -4.382 1.00 0.00 H ATOM 1937 HD3 PRO A 131 63.194 18.203 -3.323 1.00 0.00 H ATOM 1938 HD2 PRO A 131 61.983 18.864 -4.446 1.00 0.00 H ATOM 1939 HG3 PRO A 131 62.467 17.307 -6.095 1.00 0.00 H ATOM 1940 HG2 PRO A 131 64.070 17.434 -5.333 1.00 0.00 H ATOM 1941 HB2 PRO A 131 63.823 15.452 -4.179 1.00 0.00 H ATOM 1942 HB3 PRO A 131 62.847 15.083 -5.619 1.00 0.00 H ATOM 1943 N VAL A 132 61.533 13.609 -2.584 1.00 37.39 N ATOM 1944 CA VAL A 132 61.795 12.696 -1.483 1.00 39.96 C ATOM 1945 C VAL A 132 63.302 12.580 -1.187 1.00 41.63 C ATOM 1946 O VAL A 132 63.700 12.463 -0.030 1.00 40.37 O ATOM 1947 CB VAL A 132 61.210 11.300 -1.814 1.00 40.37 C ATOM 1948 CG1 VAL A 132 62.153 10.200 -1.409 1.00 48.63 C ATOM 1949 CG2 VAL A 132 59.846 11.131 -1.166 1.00 44.21 C ATOM 1950 HA VAL A 132 61.313 13.095 -0.591 1.00 0.00 H ATOM 1951 HB VAL A 132 61.083 11.230 -2.894 1.00 0.00 H ATOM 1952 HG11 VAL A 132 63.096 10.316 -1.943 1.00 0.00 H ATOM 1953 HG12 VAL A 132 62.333 10.255 -0.335 1.00 0.00 H ATOM 1954 HG13 VAL A 132 61.711 9.235 -1.656 1.00 0.00 H ATOM 1955 HG21 VAL A 132 59.944 11.229 -0.085 1.00 0.00 H ATOM 1956 HG22 VAL A 132 59.169 11.899 -1.541 1.00 0.00 H ATOM 1957 HG23 VAL A 132 59.450 10.145 -1.409 1.00 0.00 H ATOM 1958 H VAL A 132 60.968 13.266 -3.387 1.00 0.00 H ATOM 1959 N SER A 133 64.126 12.631 -2.235 1.00 36.75 N ATOM 1960 CA SER A 133 65.578 12.533 -2.104 1.00 43.04 C ATOM 1961 C SER A 133 66.154 13.637 -1.230 1.00 40.73 C ATOM 1962 O SER A 133 67.206 13.480 -0.619 1.00 40.48 O ATOM 1963 CB SER A 133 66.249 12.591 -3.481 1.00 43.54 C ATOM 1964 OG SER A 133 66.111 13.891 -4.053 1.00 46.55 O ATOM 1965 HA SER A 133 65.783 11.575 -1.627 1.00 0.00 H ATOM 1966 HB2 SER A 133 65.781 11.858 -4.139 1.00 0.00 H ATOM 1967 HB3 SER A 133 67.308 12.357 -3.374 1.00 0.00 H ATOM 1968 HG SER A 133 66.538 14.558 -3.459 1.00 0.00 H ATOM 1969 H SER A 133 63.718 12.745 -3.185 1.00 0.00 H ATOM 1970 N TYR A 134 65.464 14.764 -1.183 1.00 39.43 N ATOM 1971 CA TYR A 134 65.940 15.903 -0.429 1.00 38.18 C ATOM 1972 C TYR A 134 65.688 15.742 1.078 1.00 42.03 C ATOM 1973 O TYR A 134 66.470 16.234 1.906 1.00 39.62 O ATOM 1974 CB TYR A 134 65.280 17.180 -0.953 1.00 40.98 C ATOM 1975 CG TYR A 134 65.479 18.363 -0.051 1.00 43.29 C ATOM 1976 CD1 TYR A 134 66.607 19.176 -0.167 1.00 44.64 C ATOM 1977 CD2 TYR A 134 64.550 18.660 0.937 1.00 43.66 C ATOM 1978 CE1 TYR A 134 66.794 20.255 0.684 1.00 45.26 C ATOM 1979 CE2 TYR A 134 64.720 19.731 1.780 1.00 43.63 C ATOM 1980 CZ TYR A 134 65.838 20.527 1.655 1.00 49.12 C ATOM 1981 OH TYR A 134 65.987 21.594 2.515 1.00 53.27 O ATOM 1982 HA TYR A 134 67.019 15.970 -0.566 1.00 0.00 H ATOM 1983 HB3 TYR A 134 64.210 17.000 -1.057 1.00 0.00 H ATOM 1984 HB2 TYR A 134 65.704 17.414 -1.930 1.00 0.00 H ATOM 1985 HD2 TYR A 134 63.667 18.030 1.046 1.00 0.00 H ATOM 1986 HE2 TYR A 134 63.974 19.950 2.544 1.00 0.00 H ATOM 1987 HE1 TYR A 134 67.681 20.882 0.592 1.00 0.00 H ATOM 1988 HD1 TYR A 134 67.350 18.961 -0.935 1.00 0.00 H ATOM 1989 HH TYR A 134 66.830 22.069 2.307 1.00 0.00 H ATOM 1990 H TYR A 134 64.563 14.833 -1.697 1.00 0.00 H ATOM 1991 N LEU A 135 64.579 15.086 1.422 1.00 34.96 N ATOM 1992 CA LEU A 135 64.236 14.782 2.818 1.00 37.95 C ATOM 1993 C LEU A 135 64.920 13.535 3.417 1.00 34.50 C ATOM 1994 O LEU A 135 64.956 13.376 4.641 1.00 31.81 O ATOM 1995 CB LEU A 135 62.714 14.645 2.978 1.00 32.96 C ATOM 1996 CG LEU A 135 61.870 15.844 2.530 1.00 33.35 C ATOM 1997 CD1 LEU A 135 60.388 15.576 2.727 1.00 35.47 C ATOM 1998 CD2 LEU A 135 62.295 17.108 3.259 1.00 33.83 C ATOM 1999 HA LEU A 135 64.622 15.631 3.381 1.00 0.00 H ATOM 2000 HB2 LEU A 135 62.396 13.780 2.397 1.00 0.00 H ATOM 2001 HB3 LEU A 135 62.506 14.469 4.033 1.00 0.00 H ATOM 2002 HG LEU A 135 62.042 15.994 1.464 1.00 0.00 H ATOM 2003 HD21 LEU A 135 62.165 16.968 4.332 1.00 0.00 H ATOM 2004 HD22 LEU A 135 63.343 17.316 3.043 1.00 0.00 H ATOM 2005 HD23 LEU A 135 61.681 17.944 2.923 1.00 0.00 H ATOM 2006 HD11 LEU A 135 60.096 14.705 2.140 1.00 0.00 H ATOM 2007 HD12 LEU A 135 60.192 15.386 3.782 1.00 0.00 H ATOM 2008 HD13 LEU A 135 59.816 16.445 2.400 1.00 0.00 H ATOM 2009 H LEU A 135 63.930 14.777 0.671 1.00 0.00 H ATOM 2010 N LYS A 136 65.419 12.635 2.577 1.00 34.02 N ATOM 2011 CA LYS A 136 66.032 11.407 3.085 1.00 34.94 C ATOM 2012 C LYS A 136 67.204 11.705 4.011 1.00 34.26 C ATOM 2013 O LYS A 136 68.014 12.569 3.707 1.00 34.11 O ATOM 2014 CB LYS A 136 66.504 10.518 1.932 1.00 40.09 C ATOM 2015 CG LYS A 136 65.387 9.881 1.168 1.00 44.13 C ATOM 2016 CD LYS A 136 65.922 9.060 0.008 1.00 57.79 C ATOM 2017 CE LYS A 136 64.812 8.247 -0.652 1.00 55.39 C ATOM 2018 NZ LYS A 136 65.303 7.611 -1.897 1.00 60.63 N ATOM 2019 HA LYS A 136 65.268 10.880 3.656 1.00 0.00 H ATOM 2020 HB2 LYS A 136 67.088 11.128 1.243 1.00 0.00 H ATOM 2021 HB3 LYS A 136 67.135 9.729 2.341 1.00 0.00 H ATOM 2022 HG2 LYS A 136 64.823 9.230 1.836 1.00 0.00 H ATOM 2023 HG3 LYS A 136 64.730 10.660 0.781 1.00 0.00 H ATOM 2024 HD2 LYS A 136 66.359 9.731 -0.731 1.00 0.00 H ATOM 2025 HD3 LYS A 136 66.689 8.380 0.378 1.00 0.00 H ATOM 2026 HE2 LYS A 136 63.978 8.907 -0.891 1.00 0.00 H ATOM 2027 HE3 LYS A 136 64.476 7.473 0.038 1.00 0.00 H ATOM 2028 HZ1 LYS A 136 65.622 8.347 -2.559 1.00 0.00 H ATOM 2029 HZ2 LYS A 136 66.097 6.978 -1.672 1.00 0.00 H ATOM 2030 HZ3 LYS A 136 64.534 7.062 -2.331 1.00 0.00 H ATOM 2031 H LYS A 136 65.374 12.804 1.552 1.00 0.00 H ATOM 2032 N GLY A 137 67.301 10.986 5.133 1.00 32.54 N ATOM 2033 CA GLY A 137 68.381 11.210 6.084 1.00 30.69 C ATOM 2034 C GLY A 137 68.089 12.338 7.076 1.00 30.64 C ATOM 2035 O GLY A 137 68.950 12.699 7.892 1.00 27.81 O ATOM 2036 HA3 GLY A 137 69.285 11.462 5.529 1.00 0.00 H ATOM 2037 HA2 GLY A 137 68.545 10.290 6.645 1.00 0.00 H ATOM 2038 H GLY A 137 66.591 10.252 5.331 1.00 0.00 H ATOM 2039 N SER A 138 66.895 12.931 6.964 1.00 29.61 N ATOM 2040 CA SER A 138 66.422 13.940 7.922 1.00 29.34 C ATOM 2041 C SER A 138 65.457 13.471 9.031 1.00 28.30 C ATOM 2042 O SER A 138 65.058 14.269 9.879 1.00 26.19 O ATOM 2043 CB SER A 138 65.837 15.153 7.190 1.00 26.50 C ATOM 2044 OG SER A 138 66.868 15.848 6.516 1.00 29.74 O ATOM 2045 HA SER A 138 67.329 14.204 8.466 1.00 0.00 H ATOM 2046 HB2 SER A 138 65.364 15.818 7.912 1.00 0.00 H ATOM 2047 HB3 SER A 138 65.094 14.816 6.467 1.00 0.00 H ATOM 2048 HG SER A 138 67.297 15.244 5.859 1.00 0.00 H ATOM 2049 H SER A 138 66.278 12.668 6.169 1.00 0.00 H ATOM 2050 N SER A 139 65.074 12.203 9.033 1.00 25.40 N ATOM 2051 CA SER A 139 64.252 11.708 10.137 1.00 27.76 C ATOM 2052 C SER A 139 65.001 11.999 11.446 1.00 26.34 C ATOM 2053 O SER A 139 66.229 11.929 11.490 1.00 26.64 O ATOM 2054 CB SER A 139 63.947 10.216 9.989 1.00 26.18 C ATOM 2055 OG SER A 139 65.138 9.465 10.232 1.00 36.98 O ATOM 2056 HA SER A 139 63.287 12.215 10.136 1.00 0.00 H ATOM 2057 HB2 SER A 139 63.589 10.015 8.979 1.00 0.00 H ATOM 2058 HB3 SER A 139 63.181 9.927 10.709 1.00 0.00 H ATOM 2059 HG SER A 139 65.461 9.649 11.150 1.00 0.00 H ATOM 2060 H SER A 139 65.354 11.567 8.259 1.00 0.00 H ATOM 2061 N GLY A 140 64.258 12.400 12.476 1.00 25.08 N ATOM 2062 CA GLY A 140 64.839 12.815 13.740 1.00 27.50 C ATOM 2063 C GLY A 140 65.083 14.314 13.825 1.00 28.29 C ATOM 2064 O GLY A 140 65.412 14.833 14.889 1.00 27.33 O ATOM 2065 HA3 GLY A 140 65.791 12.301 13.869 1.00 0.00 H ATOM 2066 HA2 GLY A 140 64.161 12.528 14.544 1.00 0.00 H ATOM 2067 H GLY A 140 63.223 12.416 12.371 1.00 0.00 H ATOM 2068 N GLY A 141 64.963 15.001 12.690 1.00 26.52 N ATOM 2069 CA GLY A 141 65.089 16.451 12.653 1.00 27.50 C ATOM 2070 C GLY A 141 63.890 17.145 13.288 1.00 29.44 C ATOM 2071 O GLY A 141 62.794 16.607 13.289 1.00 30.21 O ATOM 2072 HA3 GLY A 141 65.172 16.771 11.614 1.00 0.00 H ATOM 2073 HA2 GLY A 141 65.990 16.740 13.194 1.00 0.00 H ATOM 2074 H GLY A 141 64.774 14.487 11.806 1.00 0.00 H ATOM 2075 N PRO A 142 64.104 18.337 13.864 1.00 26.06 N ATOM 2076 CA PRO A 142 63.050 19.046 14.587 1.00 29.87 C ATOM 2077 C PRO A 142 62.037 19.792 13.694 1.00 30.65 C ATOM 2078 O PRO A 142 62.387 20.351 12.645 1.00 28.74 O ATOM 2079 CB PRO A 142 63.834 20.050 15.437 1.00 30.47 C ATOM 2080 CG PRO A 142 65.007 20.401 14.553 1.00 30.44 C ATOM 2081 CD PRO A 142 65.375 19.080 13.866 1.00 26.82 C ATOM 2082 HA PRO A 142 62.431 18.343 15.144 1.00 0.00 H ATOM 2083 HD3 PRO A 142 65.729 19.253 12.850 1.00 0.00 H ATOM 2084 HD2 PRO A 142 66.140 18.546 14.430 1.00 0.00 H ATOM 2085 HG3 PRO A 142 65.841 20.772 15.148 1.00 0.00 H ATOM 2086 HG2 PRO A 142 64.724 21.153 13.817 1.00 0.00 H ATOM 2087 HB2 PRO A 142 63.232 20.931 15.658 1.00 0.00 H ATOM 2088 HB3 PRO A 142 64.168 19.597 16.370 1.00 0.00 H ATOM 2089 N LEU A 143 60.792 19.804 14.148 1.00 31.85 N ATOM 2090 CA LEU A 143 59.781 20.744 13.673 1.00 33.32 C ATOM 2091 C LEU A 143 59.685 21.804 14.736 1.00 35.30 C ATOM 2092 O LEU A 143 59.505 21.484 15.918 1.00 31.88 O ATOM 2093 CB LEU A 143 58.434 20.059 13.488 1.00 31.85 C ATOM 2094 CG LEU A 143 58.448 19.398 12.115 1.00 39.10 C ATOM 2095 CD1 LEU A 143 58.822 17.929 12.230 1.00 30.96 C ATOM 2096 CD2 LEU A 143 57.148 19.591 11.410 1.00 38.09 C ATOM 2097 HA LEU A 143 60.054 21.159 12.703 1.00 0.00 H ATOM 2098 HB2 LEU A 143 58.288 19.307 14.263 1.00 0.00 H ATOM 2099 HB3 LEU A 143 57.631 20.794 13.541 1.00 0.00 H ATOM 2100 HG LEU A 143 59.212 19.883 11.508 1.00 0.00 H ATOM 2101 HD21 LEU A 143 56.346 19.149 12.001 1.00 0.00 H ATOM 2102 HD22 LEU A 143 56.961 20.657 11.281 1.00 0.00 H ATOM 2103 HD23 LEU A 143 57.190 19.108 10.434 1.00 0.00 H ATOM 2104 HD11 LEU A 143 59.814 17.842 12.674 1.00 0.00 H ATOM 2105 HD12 LEU A 143 58.094 17.418 12.860 1.00 0.00 H ATOM 2106 HD13 LEU A 143 58.826 17.478 11.238 1.00 0.00 H ATOM 2107 H LEU A 143 60.523 19.112 14.876 1.00 0.00 H ATOM 2108 N LEU A 144 59.845 23.057 14.320 1.00 30.79 N ATOM 2109 CA LEU A 144 59.937 24.186 15.242 1.00 33.09 C ATOM 2110 C LEU A 144 58.801 25.199 15.065 1.00 36.32 C ATOM 2111 O LEU A 144 58.321 25.377 13.954 1.00 29.27 O ATOM 2112 CB LEU A 144 61.243 24.928 14.982 1.00 32.00 C ATOM 2113 CG LEU A 144 62.520 24.085 15.057 1.00 34.11 C ATOM 2114 CD1 LEU A 144 63.728 24.940 14.815 1.00 31.53 C ATOM 2115 CD2 LEU A 144 62.612 23.428 16.410 1.00 33.52 C ATOM 2116 HA LEU A 144 59.879 23.774 16.250 1.00 0.00 H ATOM 2117 HB2 LEU A 144 61.187 25.362 13.984 1.00 0.00 H ATOM 2118 HB3 LEU A 144 61.326 25.726 15.720 1.00 0.00 H ATOM 2119 HG LEU A 144 62.483 23.316 14.285 1.00 0.00 H ATOM 2120 HD21 LEU A 144 62.637 24.195 17.184 1.00 0.00 H ATOM 2121 HD22 LEU A 144 61.744 22.786 16.561 1.00 0.00 H ATOM 2122 HD23 LEU A 144 63.521 22.829 16.461 1.00 0.00 H ATOM 2123 HD11 LEU A 144 63.659 25.392 13.826 1.00 0.00 H ATOM 2124 HD12 LEU A 144 63.775 25.723 15.572 1.00 0.00 H ATOM 2125 HD13 LEU A 144 64.625 24.324 14.872 1.00 0.00 H ATOM 2126 H LEU A 144 59.907 23.240 13.298 1.00 0.00 H ATOM 2127 N CYS A 145 58.394 25.845 16.164 1.00 34.43 N ATOM 2128 CA CYS A 145 57.612 27.104 16.136 1.00 40.38 C ATOM 2129 C CYS A 145 58.471 28.238 15.598 1.00 36.45 C ATOM 2130 O CYS A 145 59.682 28.157 15.660 1.00 36.76 O ATOM 2131 CB CYS A 145 57.247 27.553 17.560 1.00 39.31 C ATOM 2132 SG CYS A 145 56.226 26.472 18.496 1.00 68.09 S ATOM 2133 HA CYS A 145 56.730 26.910 15.526 1.00 0.00 H ATOM 2134 HB2 CYS A 145 56.730 28.509 17.482 1.00 0.00 H ATOM 2135 HB3 CYS A 145 58.177 27.688 18.112 1.00 0.00 H ATOM 2136 HG CYS A 145 55.517 27.518 17.942 1.00 0.00 H ATOM 2137 H CYS A 145 58.640 25.441 17.090 1.00 0.00 H ATOM 2138 N PRO A 146 57.840 29.347 15.152 1.00 35.59 N ATOM 2139 CA PRO A 146 58.597 30.542 14.747 1.00 40.22 C ATOM 2140 C PRO A 146 59.503 31.072 15.867 1.00 40.75 C ATOM 2141 O PRO A 146 60.509 31.727 15.611 1.00 41.18 O ATOM 2142 CB PRO A 146 57.495 31.567 14.445 1.00 41.87 C ATOM 2143 CG PRO A 146 56.286 30.760 14.148 1.00 44.91 C ATOM 2144 CD PRO A 146 56.387 29.566 15.058 1.00 43.30 C ATOM 2145 HA PRO A 146 59.263 30.334 13.909 1.00 0.00 H ATOM 2146 HD3 PRO A 146 55.958 29.781 16.037 1.00 0.00 H ATOM 2147 HD2 PRO A 146 55.886 28.700 14.626 1.00 0.00 H ATOM 2148 HG3 PRO A 146 56.280 30.448 13.104 1.00 0.00 H ATOM 2149 HG2 PRO A 146 55.382 31.330 14.361 1.00 0.00 H ATOM 2150 HB2 PRO A 146 57.323 32.210 15.308 1.00 0.00 H ATOM 2151 HB3 PRO A 146 57.767 32.180 13.585 1.00 0.00 H ATOM 2152 N SER A 147 59.144 30.793 17.112 1.00 41.05 N ATOM 2153 CA SER A 147 59.954 31.254 18.230 1.00 42.76 C ATOM 2154 C SER A 147 61.183 30.363 18.421 1.00 50.13 C ATOM 2155 O SER A 147 62.117 30.733 19.131 1.00 46.81 O ATOM 2156 CB SER A 147 59.121 31.287 19.509 1.00 43.46 C ATOM 2157 OG SER A 147 58.734 29.974 19.881 1.00 51.21 O ATOM 2158 HA SER A 147 60.298 32.264 18.006 1.00 0.00 H ATOM 2159 HB2 SER A 147 58.229 31.891 19.342 1.00 0.00 H ATOM 2160 HB3 SER A 147 59.712 31.729 20.312 1.00 0.00 H ATOM 2161 HG SER A 147 58.195 30.013 20.711 1.00 0.00 H ATOM 2162 H SER A 147 58.280 30.242 17.291 1.00 0.00 H ATOM 2163 N GLY A 148 61.177 29.185 17.792 1.00 45.30 N ATOM 2164 CA GLY A 148 62.327 28.296 17.841 1.00 41.08 C ATOM 2165 C GLY A 148 62.170 27.140 18.810 1.00 42.52 C ATOM 2166 O GLY A 148 63.095 26.368 19.005 1.00 41.31 O ATOM 2167 HA3 GLY A 148 63.199 28.878 18.140 1.00 0.00 H ATOM 2168 HA2 GLY A 148 62.488 27.888 16.843 1.00 0.00 H ATOM 2169 H GLY A 148 60.333 28.898 17.256 1.00 0.00 H ATOM 2170 N HIS A 149 61.007 27.031 19.443 1.00 40.94 N ATOM 2171 CA HIS A 149 60.713 25.885 20.299 1.00 45.36 C ATOM 2172 C HIS A 149 60.287 24.695 19.460 1.00 38.21 C ATOM 2173 O HIS A 149 59.790 24.873 18.361 1.00 36.63 O ATOM 2174 CB HIS A 149 59.639 26.233 21.329 1.00 44.86 C ATOM 2175 CG HIS A 149 59.971 27.442 22.144 1.00 50.95 C ATOM 2176 ND1 HIS A 149 59.159 27.907 23.157 1.00 53.80 N ATOM 2177 CD2 HIS A 149 61.030 28.286 22.093 1.00 49.38 C ATOM 2178 CE1 HIS A 149 59.702 28.989 23.690 1.00 53.80 C ATOM 2179 NE2 HIS A 149 60.840 29.237 23.064 1.00 53.28 N ATOM 2180 HA HIS A 149 61.622 25.620 20.839 1.00 0.00 H ATOM 2181 HB2 HIS A 149 58.702 26.416 20.804 1.00 0.00 H ATOM 2182 HB3 HIS A 149 59.517 25.384 22.002 1.00 0.00 H ATOM 2183 HD2 HIS A 149 61.875 28.222 21.408 1.00 0.00 H ATOM 2184 HE1 HIS A 149 59.283 29.577 24.507 1.00 0.00 H ATOM 2185 H HIS A 149 60.292 27.777 19.327 1.00 0.00 H ATOM 2186 N VAL A 150 60.464 23.491 19.994 1.00 38.71 N ATOM 2187 CA VAL A 150 60.232 22.254 19.244 1.00 38.38 C ATOM 2188 C VAL A 150 58.823 21.715 19.380 1.00 36.89 C ATOM 2189 O VAL A 150 58.346 21.523 20.485 1.00 39.82 O ATOM 2190 CB VAL A 150 61.189 21.146 19.736 1.00 38.19 C ATOM 2191 CG1 VAL A 150 61.022 19.892 18.908 1.00 33.69 C ATOM 2192 CG2 VAL A 150 62.598 21.632 19.677 1.00 42.51 C ATOM 2193 HA VAL A 150 60.405 22.514 18.200 1.00 0.00 H ATOM 2194 HB VAL A 150 60.944 20.902 20.770 1.00 0.00 H ATOM 2195 HG11 VAL A 150 59.995 19.536 18.993 1.00 0.00 H ATOM 2196 HG12 VAL A 150 61.245 20.115 17.865 1.00 0.00 H ATOM 2197 HG13 VAL A 150 61.705 19.124 19.271 1.00 0.00 H ATOM 2198 HG21 VAL A 150 62.848 21.894 18.649 1.00 0.00 H ATOM 2199 HG22 VAL A 150 62.705 22.510 20.314 1.00 0.00 H ATOM 2200 HG23 VAL A 150 63.267 20.845 20.025 1.00 0.00 H ATOM 2201 H VAL A 150 60.779 23.424 20.983 1.00 0.00 H ATOM 2202 N VAL A 151 58.139 21.502 18.265 1.00 32.24 N ATOM 2203 CA VAL A 151 56.828 20.881 18.322 1.00 38.08 C ATOM 2204 C VAL A 151 56.845 19.362 18.106 1.00 38.27 C ATOM 2205 O VAL A 151 55.855 18.685 18.376 1.00 35.39 O ATOM 2206 CB VAL A 151 55.818 21.580 17.369 1.00 40.22 C ATOM 2207 CG1 VAL A 151 56.020 23.080 17.421 1.00 43.86 C ATOM 2208 CG2 VAL A 151 55.980 21.101 15.961 1.00 38.66 C ATOM 2209 HA VAL A 151 56.486 21.027 19.347 1.00 0.00 H ATOM 2210 HB VAL A 151 54.810 21.331 17.701 1.00 0.00 H ATOM 2211 HG11 VAL A 151 55.859 23.432 18.440 1.00 0.00 H ATOM 2212 HG12 VAL A 151 57.037 23.319 17.109 1.00 0.00 H ATOM 2213 HG13 VAL A 151 55.310 23.564 16.751 1.00 0.00 H ATOM 2214 HG21 VAL A 151 56.991 21.321 15.618 1.00 0.00 H ATOM 2215 HG22 VAL A 151 55.807 20.025 15.922 1.00 0.00 H ATOM 2216 HG23 VAL A 151 55.259 21.609 15.320 1.00 0.00 H ATOM 2217 H VAL A 151 58.542 21.780 17.348 1.00 0.00 H ATOM 2218 N GLY A 152 57.982 18.822 17.670 1.00 35.22 N ATOM 2219 CA GLY A 152 58.063 17.397 17.366 1.00 36.64 C ATOM 2220 C GLY A 152 59.295 17.058 16.537 1.00 28.74 C ATOM 2221 O GLY A 152 60.063 17.951 16.183 1.00 29.57 O ATOM 2222 HA3 GLY A 152 57.173 17.105 16.809 1.00 0.00 H ATOM 2223 HA2 GLY A 152 58.104 16.839 18.302 1.00 0.00 H ATOM 2224 H GLY A 152 58.822 19.423 17.545 1.00 0.00 H ATOM 2225 N ILE A 153 59.497 15.775 16.243 1.00 30.92 N ATOM 2226 CA ILE A 153 60.575 15.387 15.329 1.00 29.79 C ATOM 2227 C ILE A 153 60.075 14.610 14.111 1.00 31.07 C ATOM 2228 O ILE A 153 59.114 13.819 14.183 1.00 30.68 O ATOM 2229 CB ILE A 153 61.702 14.595 16.025 1.00 33.77 C ATOM 2230 CG1 ILE A 153 61.170 13.253 16.521 1.00 31.25 C ATOM 2231 CG2 ILE A 153 62.332 15.430 17.151 1.00 33.76 C ATOM 2232 CD1 ILE A 153 62.239 12.331 17.115 1.00 33.82 C ATOM 2233 HA ILE A 153 60.990 16.333 14.982 1.00 0.00 H ATOM 2234 HB ILE A 153 62.494 14.385 15.306 1.00 0.00 H ATOM 2235 HG12 ILE A 153 60.420 13.445 17.288 1.00 0.00 H ATOM 2236 HG13 ILE A 153 60.704 12.739 15.681 1.00 0.00 H ATOM 2237 HD11 ILE A 153 62.993 12.115 16.358 1.00 0.00 H ATOM 2238 HD12 ILE A 153 62.709 12.823 17.967 1.00 0.00 H ATOM 2239 HD13 ILE A 153 61.774 11.401 17.442 1.00 0.00 H ATOM 2240 HG21 ILE A 153 62.749 16.346 16.733 1.00 0.00 H ATOM 2241 HG22 ILE A 153 61.568 15.680 17.887 1.00 0.00 H ATOM 2242 HG23 ILE A 153 63.124 14.854 17.629 1.00 0.00 H ATOM 2243 H ILE A 153 58.887 15.045 16.664 1.00 0.00 H ATOM 2244 N PHE A 154 60.748 14.852 12.992 1.00 28.74 N ATOM 2245 CA PHE A 154 60.360 14.331 11.680 1.00 27.39 C ATOM 2246 C PHE A 154 60.433 12.810 11.704 1.00 31.82 C ATOM 2247 O PHE A 154 61.459 12.241 12.085 1.00 27.25 O ATOM 2248 CB PHE A 154 61.346 14.890 10.648 1.00 25.36 C ATOM 2249 CG PHE A 154 61.040 14.543 9.212 1.00 30.38 C ATOM 2250 CD1 PHE A 154 59.759 14.243 8.791 1.00 30.75 C ATOM 2251 CD2 PHE A 154 62.061 14.554 8.268 1.00 28.27 C ATOM 2252 CE1 PHE A 154 59.508 13.953 7.467 1.00 27.91 C ATOM 2253 CE2 PHE A 154 61.811 14.263 6.950 1.00 29.93 C ATOM 2254 CZ PHE A 154 60.533 13.962 6.549 1.00 28.32 C ATOM 2255 HA PHE A 154 59.342 14.627 11.426 1.00 0.00 H ATOM 2256 HB2 PHE A 154 61.350 15.976 10.739 1.00 0.00 H ATOM 2257 HB3 PHE A 154 62.337 14.503 10.885 1.00 0.00 H ATOM 2258 HD2 PHE A 154 63.077 14.798 8.580 1.00 0.00 H ATOM 2259 HE2 PHE A 154 62.624 14.271 6.224 1.00 0.00 H ATOM 2260 HZ PHE A 154 60.330 13.730 5.503 1.00 0.00 H ATOM 2261 HE1 PHE A 154 58.494 13.716 7.146 1.00 0.00 H ATOM 2262 HD1 PHE A 154 58.941 14.236 9.511 1.00 0.00 H ATOM 2263 H PHE A 154 61.600 15.446 13.051 1.00 0.00 H ATOM 2264 N ARG A 155 59.347 12.163 11.292 1.00 27.90 N ATOM 2265 CA ARG A 155 59.255 10.698 11.285 1.00 32.81 C ATOM 2266 C ARG A 155 59.247 10.130 9.860 1.00 31.85 C ATOM 2267 O ARG A 155 60.054 9.268 9.520 1.00 31.01 O ATOM 2268 CB ARG A 155 58.084 10.181 12.133 1.00 33.06 C ATOM 2269 CG ARG A 155 57.856 8.662 12.066 1.00 33.59 C ATOM 2270 CD ARG A 155 56.913 8.184 13.204 1.00 35.43 C ATOM 2271 NE ARG A 155 55.634 8.888 13.188 1.00 34.37 N ATOM 2272 CZ ARG A 155 54.735 8.883 14.174 1.00 37.78 C ATOM 2273 NH1 ARG A 155 54.943 8.202 15.297 1.00 36.62 N ATOM 2274 NH2 ARG A 155 53.619 9.584 14.041 1.00 40.57 N ATOM 2275 HA ARG A 155 60.161 10.324 11.763 1.00 0.00 H ATOM 2276 HB2 ARG A 155 58.274 10.449 13.172 1.00 0.00 H ATOM 2277 HB3 ARG A 155 57.174 10.675 11.792 1.00 0.00 H ATOM 2278 HG2 ARG A 155 57.408 8.412 11.104 1.00 0.00 H ATOM 2279 HG3 ARG A 155 58.815 8.154 12.162 1.00 0.00 H ATOM 2280 HD2 ARG A 155 57.400 8.361 14.163 1.00 0.00 H ATOM 2281 HD3 ARG A 155 56.729 7.116 13.083 1.00 0.00 H ATOM 2282 HE ARG A 155 55.404 9.440 12.337 1.00 0.00 H ATOM 2283 HH12 ARG A 155 54.228 8.213 16.052 1.00 0.00 H ATOM 2284 HH11 ARG A 155 55.821 7.658 15.420 1.00 0.00 H ATOM 2285 HH22 ARG A 155 52.912 9.586 14.804 1.00 0.00 H ATOM 2286 HH21 ARG A 155 53.449 10.132 13.174 1.00 0.00 H ATOM 2287 H ARG A 155 58.531 12.716 10.962 1.00 0.00 H ATOM 2288 N ALA A 156 58.271 10.545 9.058 1.00 30.30 N ATOM 2289 CA ALA A 156 58.104 9.989 7.720 1.00 31.09 C ATOM 2290 C ALA A 156 57.546 11.027 6.745 1.00 31.98 C ATOM 2291 O ALA A 156 56.907 11.989 7.155 1.00 28.90 O ATOM 2292 CB ALA A 156 57.182 8.785 7.780 1.00 35.31 C ATOM 2293 HA ALA A 156 59.085 9.684 7.355 1.00 0.00 H ATOM 2294 HB1 ALA A 156 57.615 8.029 8.435 1.00 0.00 H ATOM 2295 HB2 ALA A 156 56.211 9.092 8.169 1.00 0.00 H ATOM 2296 HB3 ALA A 156 57.060 8.372 6.779 1.00 0.00 H ATOM 2297 H ALA A 156 57.615 11.280 9.391 1.00 0.00 H ATOM 2298 N ALA A 157 57.792 10.825 5.455 1.00 33.93 N ATOM 2299 CA ALA A 157 57.292 11.747 4.434 1.00 36.71 C ATOM 2300 C ALA A 157 56.074 11.139 3.747 1.00 36.76 C ATOM 2301 O ALA A 157 56.024 9.923 3.510 1.00 39.59 O ATOM 2302 CB ALA A 157 58.388 12.067 3.403 1.00 34.75 C ATOM 2303 HA ALA A 157 57.002 12.681 4.916 1.00 0.00 H ATOM 2304 HB1 ALA A 157 59.237 12.528 3.908 1.00 0.00 H ATOM 2305 HB2 ALA A 157 58.709 11.145 2.918 1.00 0.00 H ATOM 2306 HB3 ALA A 157 57.992 12.754 2.655 1.00 0.00 H ATOM 2307 H ALA A 157 58.350 9.997 5.165 1.00 0.00 H ATOM 2308 N VAL A 158 55.088 11.985 3.456 1.00 36.04 N ATOM 2309 CA VAL A 158 53.928 11.588 2.665 1.00 36.90 C ATOM 2310 C VAL A 158 54.246 11.971 1.226 1.00 40.08 C ATOM 2311 O VAL A 158 54.444 13.149 0.918 1.00 38.42 O ATOM 2312 CB VAL A 158 52.644 12.348 3.092 1.00 41.56 C ATOM 2313 CG1 VAL A 158 51.463 11.915 2.233 1.00 42.65 C ATOM 2314 CG2 VAL A 158 52.346 12.160 4.578 1.00 36.89 C ATOM 2315 HA VAL A 158 53.742 10.522 2.799 1.00 0.00 H ATOM 2316 HB VAL A 158 52.814 13.413 2.933 1.00 0.00 H ATOM 2317 HG11 VAL A 158 51.676 12.135 1.187 1.00 0.00 H ATOM 2318 HG12 VAL A 158 51.300 10.844 2.354 1.00 0.00 H ATOM 2319 HG13 VAL A 158 50.570 12.457 2.545 1.00 0.00 H ATOM 2320 HG21 VAL A 158 52.204 11.100 4.788 1.00 0.00 H ATOM 2321 HG22 VAL A 158 53.182 12.539 5.166 1.00 0.00 H ATOM 2322 HG23 VAL A 158 51.440 12.707 4.838 1.00 0.00 H ATOM 2323 H VAL A 158 55.147 12.963 3.805 1.00 0.00 H ATOM 2324 N CYS A 159 54.321 10.986 0.343 1.00 38.19 N ATOM 2325 CA CYS A 159 54.864 11.248 -0.974 1.00 41.97 C ATOM 2326 C CYS A 159 54.221 10.410 -2.067 1.00 44.77 C ATOM 2327 O CYS A 159 53.687 9.335 -1.810 1.00 44.61 O ATOM 2328 CB CYS A 159 56.379 11.034 -0.961 1.00 39.54 C ATOM 2329 SG CYS A 159 56.879 9.350 -0.493 1.00 56.69 S ATOM 2330 HA CYS A 159 54.635 12.287 -1.211 1.00 0.00 H ATOM 2331 HB2 CYS A 159 56.819 11.733 -0.250 1.00 0.00 H ATOM 2332 HB3 CYS A 159 56.764 11.242 -1.959 1.00 0.00 H ATOM 2333 HG CYS A 159 56.345 8.447 -1.390 1.00 0.00 H ATOM 2334 H CYS A 159 53.992 10.032 0.594 1.00 0.00 H ATOM 2335 N THR A 160 54.257 10.934 -3.285 1.00 45.99 N ATOM 2336 CA THR A 160 53.826 10.188 -4.463 1.00 47.58 C ATOM 2337 C THR A 160 54.757 10.505 -5.623 1.00 42.28 C ATOM 2338 O THR A 160 55.053 11.669 -5.892 1.00 43.29 O ATOM 2339 CB THR A 160 52.385 10.540 -4.873 1.00 51.79 C ATOM 2340 OG1 THR A 160 51.502 10.327 -3.764 1.00 60.12 O ATOM 2341 CG2 THR A 160 51.939 9.668 -6.033 1.00 50.51 C ATOM 2342 HA THR A 160 53.858 9.127 -4.215 1.00 0.00 H ATOM 2343 HB THR A 160 52.356 11.586 -5.176 1.00 0.00 H ATOM 2344 HG1 THR A 160 51.779 10.903 -3.008 1.00 0.00 H ATOM 2345 HG23 THR A 160 52.606 9.824 -6.881 1.00 0.00 H ATOM 2346 HG21 THR A 160 51.971 8.621 -5.732 1.00 0.00 H ATOM 2347 HG22 THR A 160 50.921 9.935 -6.316 1.00 0.00 H ATOM 2348 H THR A 160 54.603 11.907 -3.404 1.00 0.00 H ATOM 2349 N ARG A 161 55.228 9.463 -6.298 1.00 46.01 N ATOM 2350 CA ARG A 161 56.057 9.634 -7.484 1.00 45.59 C ATOM 2351 C ARG A 161 57.317 10.447 -7.185 1.00 38.57 C ATOM 2352 O ARG A 161 57.721 11.305 -7.969 1.00 37.67 O ATOM 2353 CB ARG A 161 55.227 10.274 -8.606 1.00 48.13 C ATOM 2354 CG ARG A 161 53.957 9.474 -8.938 1.00 56.59 C ATOM 2355 CD ARG A 161 53.130 10.133 -10.037 1.00 58.63 C ATOM 2356 NE ARG A 161 52.017 9.288 -10.466 1.00 65.19 N ATOM 2357 CZ ARG A 161 50.748 9.495 -10.127 1.00 69.17 C ATOM 2358 NH1 ARG A 161 50.423 10.527 -9.356 1.00 64.31 N ATOM 2359 NH2 ARG A 161 49.799 8.675 -10.565 1.00 75.95 N ATOM 2360 HA ARG A 161 56.395 8.651 -7.814 1.00 0.00 H ATOM 2361 HB2 ARG A 161 54.936 11.277 -8.295 1.00 0.00 H ATOM 2362 HB3 ARG A 161 55.843 10.337 -9.503 1.00 0.00 H ATOM 2363 HG2 ARG A 161 54.247 8.476 -9.267 1.00 0.00 H ATOM 2364 HG3 ARG A 161 53.346 9.395 -8.038 1.00 0.00 H ATOM 2365 HD2 ARG A 161 53.775 10.328 -10.894 1.00 0.00 H ATOM 2366 HD3 ARG A 161 52.732 11.076 -9.661 1.00 0.00 H ATOM 2367 HE ARG A 161 52.231 8.473 -11.075 1.00 0.00 H ATOM 2368 HH12 ARG A 161 49.430 10.687 -9.092 1.00 0.00 H ATOM 2369 HH11 ARG A 161 51.162 11.175 -9.016 1.00 0.00 H ATOM 2370 HH22 ARG A 161 48.807 8.838 -10.299 1.00 0.00 H ATOM 2371 HH21 ARG A 161 50.048 7.870 -11.174 1.00 0.00 H ATOM 2372 H ARG A 161 55.000 8.502 -5.972 1.00 0.00 H ATOM 2373 N GLY A 162 57.930 10.169 -6.037 1.00 43.00 N ATOM 2374 CA GLY A 162 59.179 10.807 -5.642 1.00 41.06 C ATOM 2375 C GLY A 162 59.026 12.230 -5.126 1.00 37.13 C ATOM 2376 O GLY A 162 60.015 12.892 -4.804 1.00 34.23 O ATOM 2377 HA3 GLY A 162 59.840 10.828 -6.509 1.00 0.00 H ATOM 2378 HA2 GLY A 162 59.634 10.206 -4.855 1.00 0.00 H ATOM 2379 H GLY A 162 57.501 9.470 -5.397 1.00 0.00 H ATOM 2380 N VAL A 163 57.789 12.710 -5.043 1.00 35.52 N ATOM 2381 CA VAL A 163 57.533 14.049 -4.512 1.00 36.65 C ATOM 2382 C VAL A 163 56.816 13.988 -3.151 1.00 40.16 C ATOM 2383 O VAL A 163 55.820 13.279 -3.004 1.00 36.68 O ATOM 2384 CB VAL A 163 56.728 14.938 -5.513 1.00 36.19 C ATOM 2385 CG1 VAL A 163 56.534 16.346 -4.957 1.00 35.23 C ATOM 2386 CG2 VAL A 163 57.438 15.014 -6.858 1.00 37.80 C ATOM 2387 HA VAL A 163 58.507 14.515 -4.367 1.00 0.00 H ATOM 2388 HB VAL A 163 55.750 14.476 -5.652 1.00 0.00 H ATOM 2389 HG11 VAL A 163 55.985 16.292 -4.017 1.00 0.00 H ATOM 2390 HG12 VAL A 163 57.508 16.805 -4.785 1.00 0.00 H ATOM 2391 HG13 VAL A 163 55.971 16.944 -5.674 1.00 0.00 H ATOM 2392 HG21 VAL A 163 58.429 15.447 -6.720 1.00 0.00 H ATOM 2393 HG22 VAL A 163 57.533 14.011 -7.275 1.00 0.00 H ATOM 2394 HG23 VAL A 163 56.859 15.638 -7.538 1.00 0.00 H ATOM 2395 H VAL A 163 56.990 12.124 -5.361 1.00 0.00 H ATOM 2396 N ALA A 164 57.326 14.732 -2.166 1.00 35.58 N ATOM 2397 CA ALA A 164 56.702 14.789 -0.839 1.00 34.63 C ATOM 2398 C ALA A 164 55.880 16.075 -0.648 1.00 36.99 C ATOM 2399 O ALA A 164 56.403 17.169 -0.792 1.00 35.19 O ATOM 2400 CB ALA A 164 57.767 14.660 0.256 1.00 35.20 C ATOM 2401 HA ALA A 164 56.012 13.949 -0.762 1.00 0.00 H ATOM 2402 HB1 ALA A 164 58.285 13.707 0.147 1.00 0.00 H ATOM 2403 HB2 ALA A 164 58.482 15.477 0.163 1.00 0.00 H ATOM 2404 HB3 ALA A 164 57.288 14.704 1.234 1.00 0.00 H ATOM 2405 H ALA A 164 58.188 15.286 -2.344 1.00 0.00 H ATOM 2406 N LYS A 165 54.579 15.939 -0.414 1.00 37.57 N ATOM 2407 CA LYS A 165 53.724 17.098 -0.143 1.00 37.12 C ATOM 2408 C LYS A 165 53.506 17.394 1.340 1.00 35.45 C ATOM 2409 O LYS A 165 53.041 18.475 1.706 1.00 35.51 O ATOM 2410 CB LYS A 165 52.360 16.869 -0.803 1.00 41.20 C ATOM 2411 CG LYS A 165 52.402 16.764 -2.325 1.00 51.53 C ATOM 2412 CD LYS A 165 52.232 18.134 -2.974 1.00 55.82 C ATOM 2413 CE LYS A 165 52.328 18.046 -4.490 1.00 59.37 C ATOM 2414 NZ LYS A 165 51.804 19.285 -5.145 1.00 56.99 N ATOM 2415 HA LYS A 165 54.245 17.963 -0.554 1.00 0.00 H ATOM 2416 HB2 LYS A 165 51.942 15.942 -0.409 1.00 0.00 H ATOM 2417 HB3 LYS A 165 51.709 17.702 -0.537 1.00 0.00 H ATOM 2418 HG2 LYS A 165 53.361 16.343 -2.627 1.00 0.00 H ATOM 2419 HG3 LYS A 165 51.598 16.109 -2.659 1.00 0.00 H ATOM 2420 HD2 LYS A 165 51.256 18.537 -2.703 1.00 0.00 H ATOM 2421 HD3 LYS A 165 53.013 18.800 -2.607 1.00 0.00 H ATOM 2422 HE2 LYS A 165 51.746 17.190 -4.833 1.00 0.00 H ATOM 2423 HE3 LYS A 165 53.372 17.910 -4.772 1.00 0.00 H ATOM 2424 HZ1 LYS A 165 50.806 19.418 -4.885 1.00 0.00 H ATOM 2425 HZ2 LYS A 165 52.358 20.105 -4.826 1.00 0.00 H ATOM 2426 HZ3 LYS A 165 51.885 19.190 -6.178 1.00 0.00 H ATOM 2427 H LYS A 165 54.158 14.988 -0.423 1.00 0.00 H ATOM 2428 N ALA A 166 53.876 16.445 2.194 1.00 32.81 N ATOM 2429 CA ALA A 166 53.542 16.523 3.612 1.00 32.82 C ATOM 2430 C ALA A 166 54.517 15.695 4.433 1.00 34.53 C ATOM 2431 O ALA A 166 55.257 14.864 3.888 1.00 33.93 O ATOM 2432 CB ALA A 166 52.088 16.050 3.867 1.00 35.74 C ATOM 2433 HA ALA A 166 53.620 17.566 3.920 1.00 0.00 H ATOM 2434 HB1 ALA A 166 51.398 16.683 3.309 1.00 0.00 H ATOM 2435 HB2 ALA A 166 51.981 15.016 3.538 1.00 0.00 H ATOM 2436 HB3 ALA A 166 51.866 16.119 4.932 1.00 0.00 H ATOM 2437 H ALA A 166 54.416 15.628 1.843 1.00 0.00 H ATOM 2438 N VAL A 167 54.525 15.934 5.739 1.00 31.30 N ATOM 2439 CA VAL A 167 55.375 15.177 6.653 1.00 30.59 C ATOM 2440 C VAL A 167 54.616 14.698 7.881 1.00 33.05 C ATOM 2441 O VAL A 167 53.714 15.362 8.388 1.00 34.47 O ATOM 2442 CB VAL A 167 56.582 15.996 7.121 1.00 29.57 C ATOM 2443 CG1 VAL A 167 57.478 16.329 5.942 1.00 29.03 C ATOM 2444 CG2 VAL A 167 56.118 17.282 7.845 1.00 33.02 C ATOM 2445 HA VAL A 167 55.718 14.313 6.084 1.00 0.00 H ATOM 2446 HB VAL A 167 57.156 15.400 7.830 1.00 0.00 H ATOM 2447 HG11 VAL A 167 57.829 15.405 5.482 1.00 0.00 H ATOM 2448 HG12 VAL A 167 56.914 16.909 5.211 1.00 0.00 H ATOM 2449 HG13 VAL A 167 58.332 16.911 6.289 1.00 0.00 H ATOM 2450 HG21 VAL A 167 55.523 17.887 7.162 1.00 0.00 H ATOM 2451 HG22 VAL A 167 55.515 17.012 8.712 1.00 0.00 H ATOM 2452 HG23 VAL A 167 56.990 17.850 8.169 1.00 0.00 H ATOM 2453 H VAL A 167 53.909 16.680 6.121 1.00 0.00 H ATOM 2454 N ASP A 168 54.997 13.523 8.348 1.00 29.75 N ATOM 2455 CA ASP A 168 54.446 12.946 9.554 1.00 29.90 C ATOM 2456 C ASP A 168 55.519 13.097 10.636 1.00 31.70 C ATOM 2457 O ASP A 168 56.693 12.814 10.387 1.00 30.96 O ATOM 2458 CB ASP A 168 54.126 11.482 9.266 1.00 35.18 C ATOM 2459 CG ASP A 168 53.377 10.819 10.384 1.00 40.52 C ATOM 2460 OD1 ASP A 168 52.160 10.588 10.245 1.00 50.37 O ATOM 2461 OD2 ASP A 168 54.003 10.526 11.408 1.00 44.97 O ATOM 2462 HA ASP A 168 53.529 13.432 9.887 1.00 0.00 H ATOM 2463 HB2 ASP A 168 53.520 11.429 8.361 1.00 0.00 H ATOM 2464 HB3 ASP A 168 55.061 10.946 9.107 1.00 0.00 H ATOM 2465 H ASP A 168 55.723 12.991 7.827 1.00 0.00 H ATOM 2466 N PHE A 169 55.147 13.594 11.811 1.00 30.46 N ATOM 2467 CA PHE A 169 56.131 13.767 12.883 1.00 32.02 C ATOM 2468 C PHE A 169 55.636 13.220 14.219 1.00 34.03 C ATOM 2469 O PHE A 169 54.435 12.959 14.402 1.00 31.33 O ATOM 2470 CB PHE A 169 56.574 15.241 13.022 1.00 31.12 C ATOM 2471 CG PHE A 169 55.454 16.199 13.364 1.00 35.12 C ATOM 2472 CD1 PHE A 169 54.683 16.781 12.361 1.00 36.22 C ATOM 2473 CD2 PHE A 169 55.184 16.532 14.688 1.00 32.44 C ATOM 2474 CE1 PHE A 169 53.651 17.657 12.675 1.00 36.08 C ATOM 2475 CE2 PHE A 169 54.162 17.419 15.012 1.00 36.17 C ATOM 2476 CZ PHE A 169 53.387 17.975 14.006 1.00 35.82 C ATOM 2477 HA PHE A 169 57.003 13.180 12.595 1.00 0.00 H ATOM 2478 HB2 PHE A 169 57.325 15.299 13.810 1.00 0.00 H ATOM 2479 HB3 PHE A 169 57.016 15.556 12.076 1.00 0.00 H ATOM 2480 HD2 PHE A 169 55.783 16.091 15.484 1.00 0.00 H ATOM 2481 HE2 PHE A 169 53.971 17.676 16.054 1.00 0.00 H ATOM 2482 HZ PHE A 169 52.575 18.658 14.255 1.00 0.00 H ATOM 2483 HE1 PHE A 169 53.048 18.096 11.880 1.00 0.00 H ATOM 2484 HD1 PHE A 169 54.891 16.547 11.317 1.00 0.00 H ATOM 2485 H PHE A 169 54.155 13.861 11.970 1.00 0.00 H ATOM 2486 N ILE A 170 56.571 13.057 15.146 1.00 32.42 N ATOM 2487 CA ILE A 170 56.270 12.644 16.516 1.00 32.81 C ATOM 2488 C ILE A 170 56.135 13.876 17.426 1.00 35.84 C ATOM 2489 O ILE A 170 57.121 14.553 17.691 1.00 33.19 O ATOM 2490 CB ILE A 170 57.409 11.750 17.068 1.00 34.04 C ATOM 2491 CG1 ILE A 170 57.577 10.486 16.217 1.00 28.69 C ATOM 2492 CG2 ILE A 170 57.164 11.420 18.537 1.00 39.54 C ATOM 2493 CD1 ILE A 170 58.998 9.876 16.279 1.00 34.11 C ATOM 2494 HA ILE A 170 55.333 12.087 16.504 1.00 0.00 H ATOM 2495 HB ILE A 170 58.346 12.303 17.006 1.00 0.00 H ATOM 2496 HG12 ILE A 170 56.866 9.738 16.568 1.00 0.00 H ATOM 2497 HG13 ILE A 170 57.356 10.738 15.180 1.00 0.00 H ATOM 2498 HD11 ILE A 170 59.722 10.607 15.920 1.00 0.00 H ATOM 2499 HD12 ILE A 170 59.232 9.607 17.309 1.00 0.00 H ATOM 2500 HD13 ILE A 170 59.037 8.986 15.652 1.00 0.00 H ATOM 2501 HG21 ILE A 170 57.126 12.344 19.114 1.00 0.00 H ATOM 2502 HG22 ILE A 170 56.217 10.890 18.636 1.00 0.00 H ATOM 2503 HG23 ILE A 170 57.974 10.792 18.907 1.00 0.00 H ATOM 2504 H ILE A 170 57.563 13.231 14.887 1.00 0.00 H ATOM 2505 N PRO A 171 54.912 14.176 17.907 1.00 36.95 N ATOM 2506 CA PRO A 171 54.698 15.389 18.710 1.00 38.50 C ATOM 2507 C PRO A 171 55.450 15.326 20.038 1.00 45.68 C ATOM 2508 O PRO A 171 55.584 14.228 20.585 1.00 43.04 O ATOM 2509 CB PRO A 171 53.183 15.381 18.971 1.00 42.52 C ATOM 2510 CG PRO A 171 52.604 14.461 17.965 1.00 39.93 C ATOM 2511 CD PRO A 171 53.663 13.427 17.693 1.00 38.09 C ATOM 2512 HA PRO A 171 55.055 16.285 18.203 1.00 0.00 H ATOM 2513 HD3 PRO A 171 53.583 12.590 18.387 1.00 0.00 H ATOM 2514 HD2 PRO A 171 53.597 13.057 16.670 1.00 0.00 H ATOM 2515 HG3 PRO A 171 52.360 15.003 17.051 1.00 0.00 H ATOM 2516 HG2 PRO A 171 51.704 13.988 18.357 1.00 0.00 H ATOM 2517 HB2 PRO A 171 52.973 15.022 19.979 1.00 0.00 H ATOM 2518 HB3 PRO A 171 52.772 16.383 18.850 1.00 0.00 H ATOM 2519 N VAL A 172 55.917 16.466 20.552 1.00 38.94 N ATOM 2520 CA VAL A 172 56.655 16.485 21.815 1.00 47.53 C ATOM 2521 C VAL A 172 55.819 15.938 22.977 1.00 53.55 C ATOM 2522 O VAL A 172 56.351 15.665 24.050 1.00 59.06 O ATOM 2523 CB VAL A 172 57.177 17.896 22.207 1.00 51.13 C ATOM 2524 CG1 VAL A 172 58.384 18.311 21.343 1.00 45.54 C ATOM 2525 CG2 VAL A 172 56.052 18.931 22.163 1.00 51.81 C ATOM 2526 HA VAL A 172 57.514 15.838 21.638 1.00 0.00 H ATOM 2527 HB VAL A 172 57.530 17.849 23.237 1.00 0.00 H ATOM 2528 HG11 VAL A 172 59.192 17.593 21.481 1.00 0.00 H ATOM 2529 HG12 VAL A 172 58.089 18.331 20.294 1.00 0.00 H ATOM 2530 HG13 VAL A 172 58.722 19.302 21.645 1.00 0.00 H ATOM 2531 HG21 VAL A 172 55.643 18.978 21.154 1.00 0.00 H ATOM 2532 HG22 VAL A 172 55.267 18.642 22.862 1.00 0.00 H ATOM 2533 HG23 VAL A 172 56.447 19.908 22.442 1.00 0.00 H ATOM 2534 H VAL A 172 55.753 17.359 20.044 1.00 0.00 H ATOM 2535 N GLU A 173 54.517 15.783 22.767 1.00 50.59 N ATOM 2536 CA GLU A 173 53.649 15.196 23.789 1.00 57.00 C ATOM 2537 C GLU A 173 53.798 13.677 23.854 1.00 59.93 C ATOM 2538 O GLU A 173 53.526 13.047 24.880 1.00 60.56 O ATOM 2539 CB GLU A 173 52.191 15.580 23.545 1.00 57.27 C ATOM 2540 CG GLU A 173 51.876 17.037 23.887 1.00 61.10 C ATOM 2541 CD GLU A 173 52.342 18.025 22.824 1.00 63.00 C ATOM 2542 OE1 GLU A 173 52.544 17.615 21.655 1.00 57.25 O ATOM 2543 OE2 GLU A 173 52.496 19.224 23.159 1.00 68.88 O ATOM 2544 HA GLU A 173 53.961 15.600 24.752 1.00 0.00 H ATOM 2545 HB2 GLU A 173 51.963 15.416 22.492 1.00 0.00 H ATOM 2546 HB3 GLU A 173 51.558 14.937 24.157 1.00 0.00 H ATOM 2547 HG2 GLU A 173 50.797 17.139 24.004 1.00 0.00 H ATOM 2548 HG3 GLU A 173 52.367 17.285 24.828 1.00 0.00 H ATOM 2549 H GLU A 173 54.107 16.084 21.860 1.00 0.00 H ATOM 2550 N SER A 174 54.231 13.090 22.748 1.00 57.63 N ATOM 2551 CA SER A 174 54.500 11.662 22.702 1.00 54.01 C ATOM 2552 C SER A 174 55.780 11.369 23.468 1.00 55.86 C ATOM 2553 O SER A 174 55.948 10.290 24.042 1.00 56.36 O ATOM 2554 CB SER A 174 54.631 11.200 21.256 1.00 49.48 C ATOM 2555 OG SER A 174 53.388 11.276 20.588 1.00 53.58 O ATOM 2556 HA SER A 174 53.673 11.121 23.162 1.00 0.00 H ATOM 2557 HB2 SER A 174 54.982 10.168 21.241 1.00 0.00 H ATOM 2558 HB3 SER A 174 55.352 11.835 20.742 1.00 0.00 H ATOM 2559 HG SER A 174 53.498 10.971 19.652 1.00 0.00 H ATOM 2560 H SER A 174 54.382 13.664 21.894 1.00 0.00 H ATOM 2561 N MET A 175 56.683 12.340 23.489 1.00 52.25 N ATOM 2562 CA MET A 175 57.954 12.166 24.180 1.00 53.41 C ATOM 2563 C MET A 175 57.763 12.101 25.688 1.00 60.13 C ATOM 2564 O MET A 175 58.335 11.238 26.348 1.00 62.01 O ATOM 2565 CB MET A 175 58.930 13.282 23.811 1.00 53.97 C ATOM 2566 CG MET A 175 59.396 13.224 22.365 1.00 48.63 C ATOM 2567 SD MET A 175 60.390 14.647 21.907 1.00 57.18 S ATOM 2568 CE MET A 175 60.021 14.707 20.156 1.00 40.96 C ATOM 2569 HA MET A 175 58.377 11.215 23.856 1.00 0.00 H ATOM 2570 HB2 MET A 175 58.438 14.240 23.978 1.00 0.00 H ATOM 2571 HB3 MET A 175 59.803 13.206 24.459 1.00 0.00 H ATOM 2572 HG2 MET A 175 58.521 13.185 21.716 1.00 0.00 H ATOM 2573 HG3 MET A 175 59.991 12.322 22.225 1.00 0.00 H ATOM 2574 HE1 MET A 175 60.332 13.773 19.688 1.00 0.00 H ATOM 2575 HE2 MET A 175 58.949 14.845 20.016 1.00 0.00 H ATOM 2576 HE3 MET A 175 60.558 15.539 19.701 1.00 0.00 H ATOM 2577 H MET A 175 56.481 13.238 23.005 1.00 0.00 H ATOM 2578 N GLU A 176 56.953 13.007 26.230 1.00 63.38 N ATOM 2579 CA GLU A 176 56.672 12.998 27.666 1.00 65.65 C ATOM 2580 C GLU A 176 55.721 11.865 28.043 1.00 68.46 C ATOM 2581 O GLU A 176 55.672 11.445 29.198 1.00 71.46 O ATOM 2582 CB GLU A 176 56.110 14.340 28.131 1.00 70.58 C ATOM 2583 CG GLU A 176 54.616 14.500 27.939 1.00 66.71 C ATOM 2584 CD GLU A 176 54.145 15.881 28.341 1.00 75.75 C ATOM 2585 OE1 GLU A 176 55.014 16.747 28.594 1.00 77.88 O ATOM 2586 OE2 GLU A 176 52.916 16.103 28.404 1.00 69.41 O ATOM 2587 HA GLU A 176 57.620 12.829 28.176 1.00 0.00 H ATOM 2588 HB2 GLU A 176 56.330 14.451 29.193 1.00 0.00 H ATOM 2589 HB3 GLU A 176 56.611 15.130 27.572 1.00 0.00 H ATOM 2590 HG2 GLU A 176 54.375 14.336 26.889 1.00 0.00 H ATOM 2591 HG3 GLU A 176 54.100 13.759 28.549 1.00 0.00 H ATOM 2592 H GLU A 176 56.514 13.731 25.625 1.00 0.00 H ATOM 2593 N THR A 177 54.967 11.367 27.067 1.00 67.06 N ATOM 2594 CA THR A 177 54.164 10.172 27.291 1.00 68.94 C ATOM 2595 C THR A 177 55.087 8.957 27.448 1.00 69.45 C ATOM 2596 O THR A 177 54.816 8.068 28.254 1.00 72.08 O ATOM 2597 CB THR A 177 53.141 9.941 26.163 1.00 64.18 C ATOM 2598 OG1 THR A 177 52.283 11.083 26.061 1.00 66.39 O ATOM 2599 CG2 THR A 177 52.294 8.708 26.456 1.00 67.70 C ATOM 2600 HA THR A 177 53.592 10.315 28.208 1.00 0.00 H ATOM 2601 HB THR A 177 53.679 9.789 25.227 1.00 0.00 H ATOM 2602 HG1 THR A 177 52.826 11.885 25.857 1.00 0.00 H ATOM 2603 HG23 THR A 177 52.941 7.835 26.535 1.00 0.00 H ATOM 2604 HG21 THR A 177 51.759 8.851 27.395 1.00 0.00 H ATOM 2605 HG22 THR A 177 51.578 8.560 25.647 1.00 0.00 H ATOM 2606 H THR A 177 54.950 11.834 26.138 1.00 0.00 H ATOM 2607 N THR A 178 56.178 8.931 26.685 1.00 65.35 N ATOM 2608 CA THR A 178 57.210 7.904 26.845 1.00 66.68 C ATOM 2609 C THR A 178 57.970 8.083 28.166 1.00 71.02 C ATOM 2610 O THR A 178 58.268 7.105 28.859 1.00 71.14 O ATOM 2611 CB THR A 178 58.220 7.908 25.666 1.00 62.41 C ATOM 2612 OG1 THR A 178 57.547 7.559 24.449 1.00 56.68 O ATOM 2613 CG2 THR A 178 59.344 6.915 25.920 1.00 54.84 C ATOM 2614 HA THR A 178 56.694 6.944 26.854 1.00 0.00 H ATOM 2615 HB THR A 178 58.644 8.908 25.580 1.00 0.00 H ATOM 2616 HG1 THR A 178 56.830 8.218 24.269 1.00 0.00 H ATOM 2617 HG23 THR A 178 59.857 7.178 26.845 1.00 0.00 H ATOM 2618 HG21 THR A 178 58.928 5.911 26.007 1.00 0.00 H ATOM 2619 HG22 THR A 178 60.049 6.947 25.090 1.00 0.00 H ATOM 2620 H THR A 178 56.301 9.661 25.954 1.00 0.00 H ATOM 2621 N MET A 179 58.281 9.335 28.507 1.00 66.65 N ATOM 2622 CA MET A 179 58.903 9.657 29.791 1.00 67.53 C ATOM 2623 C MET A 179 57.962 9.370 30.961 1.00 73.66 C ATOM 2624 O MET A 179 58.374 9.398 32.121 1.00 80.11 O ATOM 2625 CB MET A 179 59.364 11.116 29.823 1.00 65.74 C ATOM 2626 CG MET A 179 60.491 11.424 28.851 1.00 64.46 C ATOM 2627 SD MET A 179 61.108 13.119 28.949 1.00 74.13 S ATOM 2628 CE MET A 179 59.626 14.067 28.614 1.00 62.27 C ATOM 2629 HA MET A 179 59.776 9.013 29.899 1.00 0.00 H ATOM 2630 HB2 MET A 179 58.513 11.751 29.576 1.00 0.00 H ATOM 2631 HB3 MET A 179 59.707 11.346 30.832 1.00 0.00 H ATOM 2632 HG2 MET A 179 60.127 11.250 27.838 1.00 0.00 H ATOM 2633 HG3 MET A 179 61.318 10.746 29.060 1.00 0.00 H ATOM 2634 HE1 MET A 179 59.244 13.805 27.627 1.00 0.00 H ATOM 2635 HE2 MET A 179 58.873 13.840 29.368 1.00 0.00 H ATOM 2636 HE3 MET A 179 59.862 15.131 28.643 1.00 0.00 H ATOM 2637 H MET A 179 58.075 10.105 27.839 1.00 0.00 H ATOM 2638 N ARG A 180 56.700 9.098 30.644 1.00 71.65 N ATOM 2639 CA ARG A 180 55.706 8.708 31.637 1.00 74.81 C ATOM 2640 C ARG A 180 55.699 7.189 31.818 1.00 79.16 C ATOM 2641 O ARG A 180 55.999 6.682 32.901 1.00 83.36 O ATOM 2642 CB ARG A 180 54.323 9.207 31.236 1.00 73.08 C ATOM 2643 HA ARG A 180 55.972 9.167 32.589 1.00 0.00 H ATOM 2644 HB2 ARG A 180 54.339 10.294 31.159 1.00 0.00 H ATOM 2645 HB3 ARG A 180 54.048 8.777 30.273 1.00 0.00 H ATOM 2646 H ARG A 180 56.410 9.166 29.648 1.00 0.00 H ATOM 2647 N ALA A 181 55.339 6.473 30.755 1.00 76.37 N ATOM 2648 CA ALA A 181 55.272 5.011 30.774 1.00 79.64 C ATOM 2649 C ALA A 181 56.615 4.334 31.061 1.00 81.48 C ATOM 2650 O ALA A 181 56.656 3.204 31.554 1.00 83.80 O ATOM 2651 CB ALA A 181 54.695 4.493 29.453 1.00 79.25 C ATOM 2652 HA ALA A 181 54.614 4.748 31.602 1.00 0.00 H ATOM 2653 HB1 ALA A 181 53.692 4.896 29.313 1.00 0.00 H ATOM 2654 HB2 ALA A 181 55.334 4.812 28.629 1.00 0.00 H ATOM 2655 HB3 ALA A 181 54.650 3.404 29.480 1.00 0.00 H ATOM 2656 H ALA A 181 55.096 6.972 29.876 1.00 0.00 H ATOM 2657 N SER A 182 57.711 5.019 30.748 1.00 81.49 N ATOM 2658 CA SER A 182 59.044 4.456 30.953 1.00 82.05 C ATOM 2659 C SER A 182 59.715 5.052 32.186 1.00 84.21 C ATOM 2660 O SER A 182 60.320 6.127 32.127 1.00 82.31 O ATOM 2661 CB SER A 182 59.912 4.665 29.717 1.00 76.43 C ATOM 2662 HA SER A 182 58.930 3.385 31.120 1.00 0.00 H ATOM 2663 HB2 SER A 182 59.449 4.173 28.862 1.00 0.00 H ATOM 2664 HB3 SER A 182 60.006 5.732 29.517 1.00 0.00 H ATOM 2665 H SER A 182 57.618 5.975 30.349 1.00 0.00 H TER 2666 SER A 182 HETATM 2667 NA NA A 1 71.012 26.916 6.060 1.00 44.97 NA HETATM 2668 O HOH 2 83.413 21.110 10.313 1.00 29.57 O HETATM 2669 O HOH 3 75.374 24.577 6.300 1.00 31.33 O HETATM 2670 O HOH 4 67.586 15.224 4.031 1.00 32.63 O HETATM 2671 O HOH 5 86.802 11.087 13.217 1.00 32.33 O HETATM 2672 O HOH 6 69.204 -2.433 16.451 1.00 34.31 O HETATM 2673 O HOH 7 69.252 28.717 7.061 1.00 35.12 O HETATM 2674 O HOH 8 78.318 17.642 17.811 1.00 35.38 O HETATM 2675 O HOH 9 65.753 -0.005 13.142 1.00 35.95 O HETATM 2676 O HOH 10 57.785 24.411 2.404 1.00 37.67 O HETATM 2677 O HOH 11 47.734 14.209 12.745 1.00 39.26 O HETATM 2678 O HOH 12 79.058 9.743 19.193 1.00 39.65 O HETATM 2679 O HOH 13 70.765 5.626 29.678 1.00 40.95 O HETATM 2680 O HOH 14 73.572 30.162 8.356 1.00 39.96 O HETATM 2681 O HOH 15 66.919 27.924 5.155 1.00 39.86 O HETATM 2682 O HOH 16 63.221 12.056 -4.928 1.00 42.83 O HETATM 2683 O HOH 17 86.466 16.814 14.449 1.00 42.34 O HETATM 2684 O HOH 18 72.471 30.758 11.133 1.00 42.21 O HETATM 2685 O HOH 19 69.974 0.726 13.124 1.00 42.85 O HETATM 2686 O HOH 20 76.354 30.606 8.756 1.00 42.37 O HETATM 2687 O HOH 21 74.415 4.273 29.601 1.00 42.67 O HETATM 2688 O HOH 22 56.219 -0.244 21.280 1.00 44.35 O HETATM 2689 O HOH 23 87.683 10.065 9.817 1.00 43.42 O HETATM 2690 O HOH 24 61.372 1.352 8.257 1.00 42.42 O HETATM 2691 O HOH 25 69.077 14.040 1.396 1.00 43.21 O HETATM 2692 O HOH 26 69.816 27.095 3.491 1.00 45.63 O HETATM 2693 O HOH 27 62.965 -0.669 12.019 1.00 44.65 O HETATM 2694 O HOH 28 73.029 28.970 6.094 1.00 46.65 O HETATM 2695 O HOH 29 57.651 27.374 1.035 1.00 45.21 O HETATM 2696 O HOH 30 64.663 26.115 22.062 1.00 47.08 O HETATM 2697 O HOH 31 51.353 12.370 -1.567 1.00 47.17 O HETATM 2698 O HOH 32 54.087 7.856 1.339 1.00 48.29 O HETATM 2699 O HOH 33 73.041 0.668 31.162 1.00 46.95 O HETATM 2700 O HOH 34 81.436 14.057 16.567 1.00 46.38 O HETATM 2701 O HOH 35 80.558 15.795 17.954 1.00 46.96 O HETATM 2702 O HOH 36 50.102 23.891 2.805 1.00 47.89 O HETATM 2703 O HOH 37 73.896 -0.505 10.731 1.00 48.16 O HETATM 2704 O HOH 38 67.682 15.850 -3.633 1.00 48.82 O HETATM 2705 O HOH 39 79.406 8.015 27.694 1.00 48.34 O HETATM 2706 O HOH 40 67.855 -0.045 11.711 1.00 48.28 O HETATM 2707 O HOH 41 73.614 25.767 5.496 1.00 47.10 O HETATM 2708 O HOH 42 53.525 9.525 18.118 1.00 48.19 O HETATM 2709 O HOH 43 64.301 7.656 3.933 1.00 47.90 O HETATM 2710 O HOH 44 86.293 18.032 19.910 1.00 50.49 O HETATM 2711 O HOH 45 49.006 26.926 3.934 1.00 50.37 O HETATM 2712 O HOH 46 57.438 8.364 -3.209 1.00 49.52 O HETATM 2713 O HOH 47 53.540 19.368 19.590 1.00 50.39 O HETATM 2714 O HOH 48 74.573 14.944 4.158 1.00 53.15 O HETATM 2715 O HOH 49 60.732 0.378 10.538 1.00 51.92 O HETATM 2716 O HOH 50 61.372 26.129 1.117 1.00 52.98 O HETATM 2717 O HOH 51 65.438 1.486 8.491 1.00 52.13 O HETATM 2718 O HOH 52 76.048 0.421 13.053 1.00 54.44 O HETATM 2719 O HOH 53 51.722 7.768 -1.368 1.00 55.59 O HETATM 2720 O HOH 54 51.398 23.982 17.308 1.00 55.86 O HETATM 2721 O HOH 55 76.575 30.523 15.691 1.00 56.02 O HETATM 2722 O HOH 56 50.841 26.060 -0.440 1.00 57.53 O HETATM 2723 O HOH 57 72.395 29.194 13.164 1.00 43.24 O HETATM 2724 O HOH 58 79.836 0.208 20.178 1.00 45.14 O HETATM 2725 O HOH 59 73.704 30.850 15.034 1.00 54.41 O HETATM 2726 N LYS A 60 75.752 -3.760 14.735 1.00 0.24 N HETATM 2727 CA LYS A 60 76.076 -4.066 16.118 1.00 0.05 C HETATM 2728 C LYS A 60 76.916 -2.976 16.753 1.00 0.22 C HETATM 2729 O LYS A 60 77.201 -3.006 17.954 1.00 -0.39 O HETATM 2730 N LYS A 60 77.327 -2.011 15.940 1.00 -0.26 N HETATM 2731 CA LYS A 60 78.102 -0.890 16.438 1.00 0.12 C HETATM 2732 C LYS A 60 77.211 0.160 17.075 1.00 0.20 C HETATM 2733 O LYS A 60 75.984 0.090 16.959 1.00 -0.39 O HETATM 2734 N LYS A 60 77.830 1.120 17.758 1.00 -0.26 N HETATM 2735 CA LYS A 60 77.116 2.247 18.336 1.00 0.15 C HETATM 2736 C LYS A 60 76.692 3.211 17.244 1.00 0.21 C HETATM 2737 O LYS A 60 77.279 3.240 16.163 1.00 -0.39 O HETATM 2738 N LYS A 60 75.662 3.997 17.532 1.00 -0.26 N HETATM 2739 CA LYS A 60 75.341 5.140 16.688 1.00 0.13 C HETATM 2740 C LYS A 60 76.399 6.203 16.978 1.00 0.20 C HETATM 2741 O LYS A 60 76.846 6.346 18.124 1.00 -0.39 O HETATM 2742 N LYS A 60 76.785 6.949 15.950 1.00 -0.26 N HETATM 2743 CA LYS A 60 77.887 7.901 16.085 1.00 0.13 C HETATM 2744 C LYS A 60 77.482 9.307 15.630 1.00 0.20 C HETATM 2745 O LYS A 60 76.926 9.470 14.552 1.00 -0.39 O HETATM 2746 N LYS A 60 77.792 10.319 16.427 1.00 -0.26 N HETATM 2747 CA LYS A 60 77.567 11.685 15.983 1.00 0.13 C HETATM 2748 C LYS A 60 78.674 12.061 15.008 1.00 0.20 C HETATM 2749 O LYS A 60 79.869 12.070 15.366 1.00 -0.39 O HETATM 2750 N LYS A 60 78.286 12.309 13.760 1.00 -0.26 N HETATM 2751 CA LYS A 60 79.223 12.717 12.717 1.00 0.13 C HETATM 2752 C LYS A 60 79.207 14.215 12.333 1.00 0.20 C HETATM 2753 O LYS A 60 79.961 14.648 11.469 1.00 -0.39 O HETATM 2754 N LYS A 60 78.319 14.980 12.954 1.00 -0.27 N HETATM 2755 CA LYS A 60 78.144 16.381 12.614 1.00 0.12 C HETATM 2756 C LYS A 60 77.081 16.992 13.500 1.00 0.20 C HETATM 2757 O LYS A 60 76.478 16.309 14.326 1.00 -0.39 O HETATM 2758 N LYS A 60 76.867 18.294 13.358 1.00 -0.26 N HETATM 2759 CA LYS A 60 75.810 18.943 14.092 1.00 0.13 C HETATM 2760 C LYS A 60 75.246 20.104 13.307 1.00 0.20 C HETATM 2761 O LYS A 60 75.857 20.598 12.363 1.00 -0.39 O HETATM 2762 N LYS A 60 74.065 20.530 13.712 1.00 -0.26 N HETATM 2763 CA LYS A 60 73.390 21.648 13.076 1.00 0.13 C HETATM 2764 C LYS A 60 73.126 22.675 14.164 1.00 0.20 C HETATM 2765 O LYS A 60 72.634 22.332 15.242 1.00 -0.39 O HETATM 2766 N LYS A 60 73.523 23.915 13.899 1.00 -0.26 N HETATM 2767 CA LYS A 60 73.399 25.007 14.857 1.00 0.13 C HETATM 2768 C LYS A 60 72.269 25.923 14.404 1.00 0.20 C HETATM 2769 O LYS A 60 72.287 26.406 13.267 1.00 -0.39 O HETATM 2770 N LYS A 60 71.310 26.166 15.292 1.00 -0.26 N HETATM 2771 CA LYS A 60 70.124 26.966 14.972 1.00 0.13 C HETATM 2772 C LYS A 60 70.261 28.403 15.464 1.00 0.20 C HETATM 2773 O LYS A 60 70.803 28.638 16.545 1.00 -0.39 O HETATM 2774 N LYS A 60 69.780 29.359 14.668 1.00 -0.27 N HETATM 2775 CA LYS A 60 69.793 30.767 15.067 1.00 0.12 C HETATM 2776 C LYS A 60 68.387 31.351 15.008 1.00 0.06 C HETATM 2777 O LYS A 60 67.942 32.065 15.946 1.00 -0.57 O HETATM 2778 O LYS A 60 67.659 31.117 14.007 1.00 -0.57 O HETATM 2779 CB LYS A 60 70.732 31.579 14.176 1.00 0.08 C HETATM 2780 OG LYS A 60 70.853 32.907 14.650 1.00 -0.39 O HETATM 2781 H105 LYS A 60 71.440 33.392 14.082 1.00 0.21 H HETATM 2782 H103 LYS A 60 70.331 31.597 13.152 1.00 0.06 H HETATM 2783 H104 LYS A 60 71.725 31.106 14.173 1.00 0.06 H HETATM 2784 H102 LYS A 60 70.155 30.830 16.104 1.00 0.07 H HETATM 2785 H101 LYS A 60 69.401 29.108 13.777 1.00 0.19 H HETATM 2786 CB LYS A 60 68.883 26.350 15.608 1.00 -0.01 C HETATM 2787 CG LYS A 60 68.549 24.922 15.208 1.00 -0.04 C HETATM 2788 CD1 LYS A 60 67.224 24.498 15.824 1.00 -0.06 C HETATM 2789 H95 LYS A 60 66.996 23.464 15.526 1.00 0.02 H HETATM 2790 H96 LYS A 60 66.425 25.166 15.471 1.00 0.02 H HETATM 2791 H97 LYS A 60 67.294 24.557 16.920 1.00 0.02 H HETATM 2792 CD2 LYS A 60 68.510 24.797 13.703 1.00 -0.06 C HETATM 2793 H98 LYS A 60 69.478 25.109 13.284 1.00 0.02 H HETATM 2794 H99 LYS A 60 67.713 25.440 13.302 1.00 0.02 H HETATM 2795 H100 LYS A 60 68.311 23.751 13.427 1.00 0.02 H HETATM 2796 H94 LYS A 60 69.338 24.258 15.591 1.00 0.03 H HETATM 2797 H92 LYS A 60 68.023 26.981 15.340 1.00 0.03 H HETATM 2798 H93 LYS A 60 69.024 26.366 16.699 1.00 0.03 H HETATM 2799 H91 LYS A 60 69.998 26.978 13.879 1.00 0.08 H HETATM 2800 H90 LYS A 60 71.401 25.789 16.214 1.00 0.19 H HETATM 2801 CB LYS A 60 74.666 25.871 14.875 1.00 -0.00 C HETATM 2802 CG1 LYS A 60 75.917 25.026 15.150 1.00 -0.05 C HETATM 2803 CD1 LYS A 60 75.993 24.503 16.544 1.00 -0.06 C HETATM 2804 H87 LYS A 60 76.912 23.910 16.664 1.00 0.02 H HETATM 2805 H88 LYS A 60 75.118 23.867 16.745 1.00 0.02 H HETATM 2806 H89 LYS A 60 76.005 25.345 17.252 1.00 0.02 H HETATM 2807 H82 LYS A 60 76.804 25.649 14.964 1.00 0.03 H HETATM 2808 H83 LYS A 60 75.918 24.171 14.458 1.00 0.03 H HETATM 2809 CG2 LYS A 60 74.522 27.020 15.888 1.00 -0.06 C HETATM 2810 H84 LYS A 60 73.616 27.600 15.658 1.00 0.02 H HETATM 2811 H85 LYS A 60 75.403 27.676 15.826 1.00 0.02 H HETATM 2812 H86 LYS A 60 74.444 26.605 16.904 1.00 0.02 H HETATM 2813 H81 LYS A 60 74.781 26.318 13.877 1.00 0.03 H HETATM 2814 H80 LYS A 60 73.198 24.603 15.860 1.00 0.08 H HETATM 2815 H79 LYS A 60 73.924 24.108 13.004 1.00 0.19 H HETATM 2816 CB LYS A 60 72.092 21.182 12.380 1.00 -0.00 C HETATM 2817 CG1 LYS A 60 72.436 20.407 11.103 1.00 -0.05 C HETATM 2818 CD1 LYS A 60 71.269 19.616 10.557 1.00 -0.06 C HETATM 2819 H76 LYS A 60 71.580 19.085 9.645 1.00 0.02 H HETATM 2820 H77 LYS A 60 70.442 20.300 10.319 1.00 0.02 H HETATM 2821 H78 LYS A 60 70.936 18.887 11.310 1.00 0.02 H HETATM 2822 H71 LYS A 60 73.257 19.710 11.327 1.00 0.03 H HETATM 2823 H72 LYS A 60 72.763 21.124 10.335 1.00 0.03 H HETATM 2824 CG2 LYS A 60 71.157 22.370 12.085 1.00 -0.06 C HETATM 2825 H73 LYS A 60 70.932 22.901 13.022 1.00 0.02 H HETATM 2826 H74 LYS A 60 70.222 21.999 11.641 1.00 0.02 H HETATM 2827 H75 LYS A 60 71.649 23.058 11.382 1.00 0.02 H HETATM 2828 H70 LYS A 60 71.564 20.500 13.062 1.00 0.03 H HETATM 2829 H69 LYS A 60 74.050 22.090 12.316 1.00 0.08 H HETATM 2830 H68 LYS A 60 73.621 20.069 14.480 1.00 0.19 H HETATM 2831 CB LYS A 60 76.263 19.421 15.480 1.00 -0.01 C HETATM 2832 CG LYS A 60 77.236 20.572 15.477 1.00 -0.02 C HETATM 2833 CD LYS A 60 78.622 20.059 15.257 1.00 0.06 C HETATM 2834 NE LYS A 60 79.618 21.062 15.589 1.00 -0.27 N HETATM 2835 CZ LYS A 60 80.465 20.985 16.612 1.00 0.29 C HETATM 2836 NH1 LYS A 60 80.456 19.942 17.437 1.00 -0.28 N HETATM 2837 H64 LYS A 60 81.120 19.901 18.223 1.00 0.26 H HETATM 2838 H65 LYS A 60 79.785 19.175 17.290 1.00 0.26 H HETATM 2839 NH2 LYS A 60 81.324 21.965 16.805 1.00 -0.28 N HETATM 2840 H66 LYS A 60 81.334 22.774 16.168 1.00 0.26 H HETATM 2841 H67 LYS A 60 81.986 21.922 17.593 1.00 0.26 H HETATM 2842 H63 LYS A 60 79.673 21.896 14.987 1.00 0.26 H HETATM 2843 H61 LYS A 60 78.736 19.778 14.200 1.00 0.07 H HETATM 2844 H62 LYS A 60 78.781 19.174 15.891 1.00 0.07 H HETATM 2845 H59 LYS A 60 77.188 21.094 16.444 1.00 0.03 H HETATM 2846 H60 LYS A 60 76.973 21.271 14.670 1.00 0.03 H HETATM 2847 H57 LYS A 60 76.741 18.573 15.993 1.00 0.03 H HETATM 2848 H58 LYS A 60 75.370 19.732 16.041 1.00 0.03 H HETATM 2849 H56 LYS A 60 75.006 18.206 14.237 1.00 0.08 H HETATM 2850 H55 LYS A 60 77.442 18.828 12.738 1.00 0.19 H HETATM 2851 H53 LYS A 60 77.836 16.466 11.562 1.00 0.08 H HETATM 2852 H54 LYS A 60 79.094 16.915 12.762 1.00 0.08 H HETATM 2853 H52 LYS A 60 77.754 14.581 13.676 1.00 0.19 H HETATM 2854 CB LYS A 60 79.087 11.835 11.480 1.00 -0.01 C HETATM 2855 CG1 LYS A 60 79.232 10.365 11.897 1.00 -0.06 C HETATM 2856 H46 LYS A 60 79.135 9.721 11.010 1.00 0.02 H HETATM 2857 H47 LYS A 60 78.445 10.110 12.623 1.00 0.02 H HETATM 2858 H48 LYS A 60 80.219 10.210 12.357 1.00 0.02 H HETATM 2859 CG2 LYS A 60 77.778 12.087 10.745 1.00 -0.06 C HETATM 2860 H49 LYS A 60 77.713 13.149 10.465 1.00 0.02 H HETATM 2861 H50 LYS A 60 76.934 11.829 11.401 1.00 0.02 H HETATM 2862 H51 LYS A 60 77.741 11.465 9.838 1.00 0.02 H HETATM 2863 H45 LYS A 60 79.909 12.080 10.791 1.00 0.03 H HETATM 2864 H44 LYS A 60 80.225 12.528 13.130 1.00 0.08 H HETATM 2865 H43 LYS A 60 77.318 12.213 13.528 1.00 0.19 H HETATM 2866 CB LYS A 60 77.648 12.644 17.164 1.00 -0.00 C HETATM 2867 CG1 LYS A 60 76.532 12.342 18.166 1.00 -0.05 C HETATM 2868 CD1 LYS A 60 76.621 13.163 19.436 1.00 -0.06 C HETATM 2869 H40 LYS A 60 75.791 12.894 20.106 1.00 0.02 H HETATM 2870 H41 LYS A 60 76.558 14.232 19.186 1.00 0.02 H HETATM 2871 H42 LYS A 60 77.578 12.959 19.938 1.00 0.02 H HETATM 2872 H35 LYS A 60 76.585 11.277 18.436 1.00 0.03 H HETATM 2873 H36 LYS A 60 75.566 12.550 17.684 1.00 0.03 H HETATM 2874 CG2 LYS A 60 77.618 14.102 16.669 1.00 -0.06 C HETATM 2875 H37 LYS A 60 78.438 14.263 15.954 1.00 0.02 H HETATM 2876 H38 LYS A 60 77.738 14.782 17.525 1.00 0.02 H HETATM 2877 H39 LYS A 60 76.656 14.302 16.174 1.00 0.02 H HETATM 2878 H34 LYS A 60 78.609 12.482 17.673 1.00 0.03 H HETATM 2879 H33 LYS A 60 76.583 11.765 15.498 1.00 0.08 H HETATM 2880 H32 LYS A 60 78.180 10.144 17.332 1.00 0.19 H HETATM 2881 CB LYS A 60 79.092 7.476 15.220 1.00 -0.01 C HETATM 2882 CG1 LYS A 60 80.273 8.404 15.485 1.00 -0.06 C HETATM 2883 H26 LYS A 60 81.128 8.095 14.866 1.00 0.02 H HETATM 2884 H27 LYS A 60 80.552 8.349 16.548 1.00 0.02 H HETATM 2885 H28 LYS A 60 79.991 9.437 15.233 1.00 0.02 H HETATM 2886 CG2 LYS A 60 79.480 6.010 15.478 1.00 -0.06 C HETATM 2887 H29 LYS A 60 78.614 5.361 15.281 1.00 0.02 H HETATM 2888 H30 LYS A 60 79.795 5.893 16.526 1.00 0.02 H HETATM 2889 H31 LYS A 60 80.309 5.728 14.812 1.00 0.02 H HETATM 2890 H25 LYS A 60 78.807 7.572 14.162 1.00 0.03 H HETATM 2891 H24 LYS A 60 78.190 7.935 17.142 1.00 0.08 H HETATM 2892 H23 LYS A 60 76.316 6.859 15.072 1.00 0.19 H HETATM 2893 CB LYS A 60 73.954 5.705 17.014 1.00 -0.01 C HETATM 2894 CG1 LYS A 60 73.669 6.966 16.164 1.00 -0.06 C HETATM 2895 H17 LYS A 60 72.671 7.357 16.411 1.00 0.02 H HETATM 2896 H18 LYS A 60 73.706 6.705 15.096 1.00 0.02 H HETATM 2897 H19 LYS A 60 74.427 7.733 16.380 1.00 0.02 H HETATM 2898 CG2 LYS A 60 72.896 4.625 16.798 1.00 -0.06 C HETATM 2899 H20 LYS A 60 73.135 3.748 17.418 1.00 0.02 H HETATM 2900 H21 LYS A 60 72.883 4.331 15.738 1.00 0.02 H HETATM 2901 H22 LYS A 60 71.908 5.017 17.082 1.00 0.02 H HETATM 2902 H16 LYS A 60 73.936 5.997 18.074 1.00 0.03 H HETATM 2903 H15 LYS A 60 75.375 4.845 15.629 1.00 0.08 H HETATM 2904 H14 LYS A 60 75.101 3.803 18.337 1.00 0.19 H HETATM 2905 CB LYS A 60 77.999 3.011 19.330 1.00 0.08 C HETATM 2906 OG LYS A 60 78.289 2.246 20.484 1.00 -0.39 O HETATM 2907 H13 LYS A 60 78.747 1.453 20.230 1.00 0.21 H HETATM 2908 H11 LYS A 60 77.476 3.929 19.636 1.00 0.06 H HETATM 2909 H12 LYS A 60 78.944 3.276 18.834 1.00 0.06 H HETATM 2910 H10 LYS A 60 76.224 1.871 18.859 1.00 0.08 H HETATM 2911 H9 LYS A 60 78.821 1.064 17.878 1.00 0.19 H HETATM 2912 H7 LYS A 60 78.650 -0.434 15.601 1.00 0.08 H HETATM 2913 H8 LYS A 60 78.818 -1.255 17.189 1.00 0.08 H HETATM 2914 H6 LYS A 60 77.099 -2.057 14.967 1.00 0.19 H HETATM 2915 H4 LYS A 60 76.636 -5.012 16.152 1.00 0.11 H HETATM 2916 H5 LYS A 60 75.141 -4.173 16.688 1.00 0.11 H HETATM 2917 H1 LYS A 60 75.195 -4.505 14.348 1.00 0.20 H HETATM 2918 H2 LYS A 60 76.603 -3.666 14.203 1.00 0.20 H HETATM 2919 H3 LYS A 60 75.233 -2.897 14.694 1.00 0.20 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 63 62 2667 CONECT 692 691 696 756 CONECT 756 692 755 760 CONECT 1410 1409 1414 2132 CONECT 1614 1613 2667 CONECT 2132 1410 2131 2136 CONECT 2667 63 1614 CONECT 2726 2727 2917 2918 2919 CONECT 2727 2726 2728 2915 2916 CONECT 2728 2727 2729 2730 CONECT 2729 2728 CONECT 2730 2728 2731 2914 CONECT 2731 2730 2732 2912 2913 CONECT 2732 2731 2733 2734 CONECT 2733 2732 CONECT 2734 2732 2735 2911 CONECT 2735 2734 2736 2905 2910 CONECT 2736 2735 2737 2738 CONECT 2737 2736 CONECT 2738 2736 2739 2904 CONECT 2739 2738 2740 2893 2903 CONECT 2740 2739 2741 2742 CONECT 2741 2740 CONECT 2742 2740 2743 2892 CONECT 2743 2742 2744 2881 2891 CONECT 2744 2743 2745 2746 CONECT 2745 2744 CONECT 2746 2744 2747 2880 CONECT 2747 2746 2748 2866 2879 CONECT 2748 2747 2749 2750 CONECT 2749 2748 CONECT 2750 2748 2751 2865 CONECT 2751 2750 2752 2854 2864 CONECT 2752 2751 2753 2754 CONECT 2753 2752 CONECT 2754 2752 2755 2853 CONECT 2755 2754 2756 2851 2852 CONECT 2756 2755 2757 2758 CONECT 2757 2756 CONECT 2758 2756 2759 2850 CONECT 2759 2758 2760 2831 2849 CONECT 2760 2759 2761 2762 CONECT 2761 2760 CONECT 2762 2760 2763 2830 CONECT 2763 2762 2764 2816 2829 CONECT 2764 2763 2765 2766 CONECT 2765 2764 CONECT 2766 2764 2767 2815 CONECT 2767 2766 2768 2801 2814 CONECT 2768 2767 2769 2770 CONECT 2769 2768 CONECT 2770 2768 2771 2800 CONECT 2771 2770 2772 2786 2799 CONECT 2772 2771 2773 2774 CONECT 2773 2772 CONECT 2774 2772 2775 2785 CONECT 2775 2774 2776 2779 2784 CONECT 2776 2775 2777 2778 CONECT 2777 2776 CONECT 2778 2776 CONECT 2779 2775 2780 2782 2783 CONECT 2780 2779 2781 CONECT 2781 2780 CONECT 2782 2779 CONECT 2783 2779 CONECT 2784 2775 CONECT 2785 2774 CONECT 2786 2771 2787 2797 2798 CONECT 2787 2786 2788 2792 2796 CONECT 2788 2787 2789 2790 2791 CONECT 2789 2788 CONECT 2790 2788 CONECT 2791 2788 CONECT 2792 2787 2793 2794 2795 CONECT 2793 2792 CONECT 2794 2792 CONECT 2795 2792 CONECT 2796 2787 CONECT 2797 2786 CONECT 2798 2786 CONECT 2799 2771 CONECT 2800 2770 CONECT 2801 2767 2802 2809 2813 CONECT 2802 2801 2803 2807 2808 CONECT 2803 2802 2804 2805 2806 CONECT 2804 2803 CONECT 2805 2803 CONECT 2806 2803 CONECT 2807 2802 CONECT 2808 2802 CONECT 2809 2801 2810 2811 2812 CONECT 2810 2809 CONECT 2811 2809 CONECT 2812 2809 CONECT 2813 2801 CONECT 2814 2767 CONECT 2815 2766 CONECT 2816 2763 2817 2824 2828 CONECT 2817 2816 2818 2822 2823 CONECT 2818 2817 2819 2820 2821 CONECT 2819 2818 CONECT 2820 2818 CONECT 2821 2818 CONECT 2822 2817 CONECT 2823 2817 CONECT 2824 2816 2825 2826 2827 CONECT 2825 2824 CONECT 2826 2824 CONECT 2827 2824 CONECT 2828 2816 CONECT 2829 2763 CONECT 2830 2762 CONECT 2831 2759 2832 2847 2848 CONECT 2832 2831 2833 2845 2846 CONECT 2833 2832 2834 2843 2844 CONECT 2834 2833 2835 2842 CONECT 2835 2834 2836 2839 CONECT 2836 2835 2837 2838 CONECT 2837 2836 CONECT 2838 2836 CONECT 2839 2835 2840 2841 CONECT 2840 2839 CONECT 2841 2839 CONECT 2842 2834 CONECT 2843 2833 CONECT 2844 2833 CONECT 2845 2832 CONECT 2846 2832 CONECT 2847 2831 CONECT 2848 2831 CONECT 2849 2759 CONECT 2850 2758 CONECT 2851 2755 CONECT 2852 2755 CONECT 2853 2754 CONECT 2854 2751 2855 2859 2863 CONECT 2855 2854 2856 2857 2858 CONECT 2856 2855 CONECT 2857 2855 CONECT 2858 2855 CONECT 2859 2854 2860 2861 2862 CONECT 2860 2859 CONECT 2861 2859 CONECT 2862 2859 CONECT 2863 2854 CONECT 2864 2751 CONECT 2865 2750 CONECT 2866 2747 2867 2874 2878 CONECT 2867 2866 2868 2872 2873 CONECT 2868 2867 2869 2870 2871 CONECT 2869 2868 CONECT 2870 2868 CONECT 2871 2868 CONECT 2872 2867 CONECT 2873 2867 CONECT 2874 2866 2875 2876 2877 CONECT 2875 2874 CONECT 2876 2874 CONECT 2877 2874 CONECT 2878 2866 CONECT 2879 2747 CONECT 2880 2746 CONECT 2881 2743 2882 2886 2890 CONECT 2882 2881 2883 2884 2885 CONECT 2883 2882 CONECT 2884 2882 CONECT 2885 2882 CONECT 2886 2881 2887 2888 2889 CONECT 2887 2886 CONECT 2888 2886 CONECT 2889 2886 CONECT 2890 2881 CONECT 2891 2743 CONECT 2892 2742 CONECT 2893 2739 2894 2898 2902 CONECT 2894 2893 2895 2896 2897 CONECT 2895 2894 CONECT 2896 2894 CONECT 2897 2894 CONECT 2898 2893 2899 2900 2901 CONECT 2899 2898 CONECT 2900 2898 CONECT 2901 2898 CONECT 2902 2893 CONECT 2903 2739 CONECT 2904 2738 CONECT 2905 2735 2906 2908 2909 CONECT 2906 2905 2907 CONECT 2907 2906 CONECT 2908 2905 CONECT 2909 2905 CONECT 2910 2735 CONECT 2911 2734 CONECT 2912 2731 CONECT 2913 2731 CONECT 2914 2730 CONECT 2915 2727 CONECT 2916 2727 CONECT 2917 2726 CONECT 2918 2726 CONECT 2919 2726 MASTER 0 0 0 0 0 0 0 0 2918 1 205 14 END
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Related entries of code: 4i31
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
16aa, >1DXP_2|Chains... at 100%
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PDBbind
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3p8n
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4u01
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1czq
RCSB PDB
PDBbind
17-mer
1ej4
RCSB PDB
PDBbind
17-mer
1f47
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PDBbind
17-mer
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RCSB PDB
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PDBbind
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RCSB PDB
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17-mer
1ybo
RCSB PDB
PDBbind
17-mer
2br8
RCSB PDB
PDBbind
17-mer
2fys
RCSB PDB
PDBbind
17-mer
2jq9
RCSB PDB
PDBbind
17-mer
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RCSB PDB
PDBbind
17-mer
2ll6
RCSB PDB
PDBbind
17-mer
2ll7
RCSB PDB
PDBbind
17-mer
2n3k
RCSB PDB
PDBbind
17-mer
2n9x
RCSB PDB
PDBbind
17-mer
2nm1
RCSB PDB
PDBbind
17-mer
2odd
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PDBbind
17-mer
2r3c
RCSB PDB
PDBbind
17-mer
2r5b
RCSB PDB
PDBbind
17-mer
2r5d
RCSB PDB
PDBbind
17-mer
2uz6
RCSB PDB
PDBbind
17-mer
2w73
RCSB PDB
PDBbind
17-mer
2y6s
RCSB PDB
PDBbind
17-mer
3fdm
RCSB PDB
PDBbind
17-mer
6s07
RCSB PDB
PDBbind
17-mer
3ktr
RCSB PDB
PDBbind
17-mer
3o0e
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PDBbind
17-mer
3qn7
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17-mer
3t7g
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PDBbind
17-mer
3u3f
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PDBbind
17-mer
3uxg
RCSB PDB
PDBbind
17-mer
3uzd
RCSB PDB
PDBbind
17-mer
3v30
RCSB PDB
PDBbind
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3wp1
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PDBbind
17-mer
4blb
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PDBbind
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4djs
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PDBbind
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4esg
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PDBbind
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4fmq
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PDBbind
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4gy5
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17-mer
4i32
RCSB PDB
PDBbind
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4i33
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PDBbind
17-mer
4j2c
RCSB PDB
PDBbind
17-mer
4kmd
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PDBbind
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4lg6
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PDBbind
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4ngh
RCSB PDB
PDBbind
17-mer
4nhc
RCSB PDB
PDBbind
17-mer
4odn
RCSB PDB
PDBbind
17-mer
4qqi
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PDBbind
17-mer
4tzq
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PDBbind
17-mer
4u0c
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PDBbind
17-mer
4u0d
RCSB PDB
PDBbind
17-mer
4uu5
RCSB PDB
PDBbind
17-mer
4wym
RCSB PDB
PDBbind
17-mer
4z88
RCSB PDB
PDBbind
17-mer
4z89
RCSB PDB
PDBbind
17-mer
4z8a
RCSB PDB
PDBbind
17-mer
5ajo
RCSB PDB
PDBbind
17-mer
5ajp
RCSB PDB
PDBbind
17-mer
5fos
RCSB PDB
PDBbind
17-mer
5hog
RCSB PDB
PDBbind
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5i22
RCSB PDB
PDBbind
17-mer
5ixt
RCSB PDB
PDBbind
17-mer
5j3v
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PDBbind
17-mer
5twh
RCSB PDB
PDBbind
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5vlp
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5vzu
RCSB PDB
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5xgl
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5xxf
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17-mer
5yco
RCSB PDB
PDBbind
17-mer
5znr
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6rjp
RCSB PDB
PDBbind
17-mer
6qtm
RCSB PDB
PDBbind
17-mer
6q36
RCSB PDB
PDBbind
17-mer
6njz
RCSB PDB
PDBbind
17-mer
6kmj
RCSB PDB
PDBbind
17-mer
6dat
RCSB PDB
PDBbind
17-mer
6da1
RCSB PDB
PDBbind
17-mer
5zk5
RCSB PDB
PDBbind
17-mer
5oy3
RCSB PDB
PDBbind
17-mer
6uyx
RCSB PDB
PDBbind
17-mer
6uyy
RCSB PDB
PDBbind
17-mer
6uyz
RCSB PDB
PDBbind
17-mer
Entry Information
PDB ID
4i31
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Genome polyprotein
Ligand Name
17-mer
EC.Number
E.C.3.4.21.98; 3.6.1.15; 3.6.4.13
Resolution
1.93(Å)
Affinity (Kd/Ki/IC50)
IC50=0.48nM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) J.Biol.Chem. Vol. 288: pp. 5673-5681
Ligand Properties
Formula
C
5
7
H
1
0
6
N
1
6
O
1
6
Molecular Weight
1271.550
Exact Mass
1270.800
No. of atoms
195
No. of bonds
194
Polar Surface Area
520.61
LOGP Value
0.62 (
Computed with XLOGP3
)
-1.24 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 15
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 55
No. of Nitrogen and Oxygen Atoms: 32
No. of Rings: 0
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CO)CC(C)C)[C@H](CC)C)[C@H](CC)C)CCC[NH+]=C(N)N)C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)C[NH3+])CO)C
InChI String
InChI=1S/C57H104N16O16/c1-15-31(12)44(53(85)66-35(21-27(4)5)48(80)67-37(26-75)56(88)89)73-55(87)45(32(13)16-2)71-47(79)34(19-18-20-61-57(59)60)64-40(78)24-63-50(82)41(28(6)7)69-54(86)46(33(14)17-3)72-52(84)43(30(10)11)70-51(83)42(29(8)9)68-49(81)36(25-74)65-39(77)23-62-38(76)22-58/h27-37,41-46,74-75H,15-26,58H2,1-14H3,(H,62,76)(H,63,82)(H,64,78)(H,65,77)(H,66,85)(H,67,80)(H,68,81)(H,69,86)(H,70,83)(H,71,79)(H,72,84)(H,73,87)(H,88,89)(H4,59,60,61)/p+2/t31-,32-,33-,34-,35-,36-,37-,41-,42-,43-,44-,45-,46-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P26662
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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