Browse entries in the PDBbind-CN Database
HEADER 5MLO_COMPLEX COMPND 5MLO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 255 MET PHE GLU ALA ARG LEU VAL GLN GLY SER ILE LEU LYS SEQRES 2 A 255 LYS VAL LEU GLU ALA LEU LYS ASP LEU ILE ASN GLU ALA SEQRES 3 A 255 CYS TRP ASP ILE SER SER SER GLY VAL ASN LEU GLN SER SEQRES 4 A 255 MET ASP SER SER HIS VAL SER LEU VAL GLN LEU THR LEU SEQRES 5 A 255 ARG SER GLU GLY PHE ASP THR TYR ARG CYS ASP ARG ASN SEQRES 6 A 255 LEU ALA MET GLY VAL ASN LEU THR SER MET SER LYS ILE SEQRES 7 A 255 LEU LYS CYS ALA GLY ASN GLU ASP ILE ILE THR LEU ARG SEQRES 8 A 255 ALA GLU ASP ASN ALA ASP THR LEU ALA LEU VAL PHE GLU SEQRES 9 A 255 ALA PRO ASN GLN GLU LYS VAL SER ASP TYR GLU MET LYS SEQRES 10 A 255 LEU MET ASP LEU ASP VAL GLU GLN LEU GLY ILE PRO GLU SEQRES 11 A 255 GLN GLU TYR SER CYS VAL VAL LYS MET PRO SER GLY GLU SEQRES 12 A 255 PHE ALA ARG ILE CYS ARG ASP LEU SER HIS ILE GLY ASP SEQRES 13 A 255 ALA VAL VAL ILE SER CYS ALA LYS ASP GLY VAL LYS PHE SEQRES 14 A 255 SER ALA SER GLY GLU LEU GLY ASN GLY ASN ILE LYS LEU SEQRES 15 A 255 SER GLN THR SER ASN VAL ASP LYS GLU GLU GLU ALA VAL SEQRES 16 A 255 THR ILE GLU MET ASN GLU PRO VAL GLN LEU THR PHE ALA SEQRES 17 A 255 LEU ARG TYR LEU ASN PHE PHE THR LYS ALA THR PRO LEU SEQRES 18 A 255 SER SER THR VAL THR LEU SER MET SER ALA ASP VAL PRO SEQRES 19 A 255 LEU VAL VAL GLU TYR LYS ILE ALA ASP MET GLY HIS LEU SEQRES 20 A 255 LYS TYR TYR LEU ALA PRO LYS ILE HET NA A 1 1 HET NA A 2 1 HET NA A 3 1 HET LYS A 428 181 ATOM 1 N MET A 1 90.698 -20.920 23.648 1.00 63.02 N ATOM 2 CA MET A 1 89.411 -20.384 23.187 1.00 60.91 C ATOM 3 C MET A 1 88.754 -19.470 24.217 1.00 59.14 C ATOM 4 O MET A 1 88.929 -19.642 25.433 1.00 54.61 O ATOM 5 CB MET A 1 88.490 -21.554 22.818 1.00 65.57 C ATOM 6 CG MET A 1 87.018 -21.195 22.631 1.00 70.84 C ATOM 7 SD MET A 1 86.105 -22.512 21.820 1.00 72.89 S ATOM 8 CE MET A 1 86.656 -22.305 20.145 1.00 72.91 C ATOM 9 HN3 MET A 1 90.551 -21.471 24.518 1.00 0.00 H ATOM 10 HN2 MET A 1 91.351 -20.134 23.841 1.00 0.00 H ATOM 11 HN1 MET A 1 91.101 -21.534 22.911 1.00 0.00 H ATOM 12 N PHE A 2 88.024 -18.483 23.689 1.00 56.50 N ATOM 13 CA PHE A 2 86.940 -17.792 24.390 1.00 51.94 C ATOM 14 C PHE A 2 85.631 -18.211 23.757 1.00 50.40 C ATOM 15 O PHE A 2 85.516 -18.196 22.527 1.00 47.18 O ATOM 16 CB PHE A 2 87.104 -16.274 24.255 1.00 50.61 C ATOM 17 CG PHE A 2 85.845 -15.488 24.546 1.00 48.66 C ATOM 18 CD1 PHE A 2 85.277 -15.520 25.795 1.00 47.17 C ATOM 19 CD2 PHE A 2 85.312 -14.624 23.593 1.00 46.43 C ATOM 20 CE1 PHE A 2 84.186 -14.740 26.093 1.00 46.17 C ATOM 21 CE2 PHE A 2 84.218 -13.843 23.884 1.00 45.17 C ATOM 22 CZ PHE A 2 83.637 -13.914 25.134 1.00 45.98 C ATOM 23 H PHE A 2 88.240 -18.186 22.716 1.00 0.00 H ATOM 24 N GLU A 3 84.658 -18.581 24.583 1.00 45.86 N ATOM 25 CA GLU A 3 83.318 -18.887 24.115 1.00 45.88 C ATOM 26 C GLU A 3 82.266 -18.517 25.152 1.00 44.81 C ATOM 27 O GLU A 3 82.337 -18.962 26.311 1.00 44.51 O ATOM 28 CB GLU A 3 83.199 -20.363 23.795 1.00 49.10 C ATOM 29 CG GLU A 3 81.852 -20.735 23.210 1.00 52.89 C ATOM 30 CD GLU A 3 81.749 -22.205 22.852 1.00 58.05 C ATOM 31 OE1 GLU A 3 81.712 -22.532 21.648 1.00 57.38 O ATOM 32 OE2 GLU A 3 81.721 -23.029 23.785 1.00 66.54 O ATOM 33 H GLU A 3 84.863 -18.654 25.600 1.00 0.00 H ATOM 34 N ALA A 4 81.299 -17.704 24.743 1.00 40.49 N ATOM 35 CA ALA A 4 80.237 -17.242 25.632 1.00 39.31 C ATOM 36 C ALA A 4 78.910 -17.378 24.929 1.00 39.08 C ATOM 37 O ALA A 4 78.725 -16.824 23.837 1.00 35.49 O ATOM 38 CB ALA A 4 80.486 -15.789 26.045 1.00 39.04 C ATOM 39 H ALA A 4 81.298 -17.385 23.753 1.00 0.00 H ATOM 40 N ARG A 5 78.015 -18.184 25.509 1.00 39.01 N ATOM 41 CA ARG A 5 76.688 -18.428 24.947 1.00 39.67 C ATOM 42 C ARG A 5 75.666 -17.649 25.754 1.00 40.05 C ATOM 43 O ARG A 5 75.590 -17.820 26.989 1.00 37.87 O ATOM 44 CB ARG A 5 76.374 -19.928 24.995 1.00 40.76 C ATOM 45 CG ARG A 5 74.956 -20.329 24.651 1.00 41.27 C ATOM 46 CD ARG A 5 74.766 -21.827 24.866 1.00 43.34 C ATOM 47 NE ARG A 5 73.439 -22.265 24.439 1.00 43.80 N ATOM 48 CZ ARG A 5 73.107 -22.549 23.175 1.00 45.63 C ATOM 49 NH1 ARG A 5 73.978 -22.396 22.173 1.00 45.51 N ATOM 50 NH2 ARG A 5 71.876 -22.915 22.890 1.00 46.81 N ATOM 51 HE ARG A 5 72.703 -22.362 25.167 1.00 0.00 H ATOM 52 HH12 ARG A 5 73.695 -22.624 21.199 1.00 0.00 H ATOM 53 HH11 ARG A 5 74.939 -22.049 22.368 1.00 0.00 H ATOM 54 HH22 ARG A 5 71.613 -23.137 21.908 1.00 0.00 H ATOM 55 HH21 ARG A 5 71.165 -22.983 23.646 1.00 0.00 H ATOM 56 H ARG A 5 78.274 -18.658 26.398 1.00 0.00 H ATOM 57 N LEU A 6 74.876 -16.826 25.067 1.00 37.98 N ATOM 58 CA LEU A 6 73.825 -16.019 25.702 1.00 40.25 C ATOM 59 C LEU A 6 72.454 -16.349 25.123 1.00 40.26 C ATOM 60 O LEU A 6 72.160 -16.024 23.974 1.00 38.99 O ATOM 61 CB LEU A 6 74.135 -14.536 25.510 1.00 41.68 C ATOM 62 CG LEU A 6 73.297 -13.563 26.335 1.00 45.92 C ATOM 63 CD1 LEU A 6 73.388 -13.880 27.838 1.00 46.95 C ATOM 64 CD2 LEU A 6 73.743 -12.137 26.066 1.00 46.76 C ATOM 65 H LEU A 6 75.008 -16.751 24.038 1.00 0.00 H ATOM 66 N VAL A 7 71.600 -16.999 25.907 1.00 39.60 N ATOM 67 CA VAL A 7 70.272 -17.383 25.416 1.00 40.21 C ATOM 68 C VAL A 7 69.424 -16.143 25.117 1.00 40.38 C ATOM 69 O VAL A 7 68.720 -16.110 24.097 1.00 37.34 O ATOM 70 CB VAL A 7 69.558 -18.373 26.374 1.00 40.42 C ATOM 71 CG1 VAL A 7 68.073 -18.509 26.052 1.00 40.85 C ATOM 72 CG2 VAL A 7 70.220 -19.739 26.265 1.00 41.36 C ATOM 73 H VAL A 7 71.877 -17.238 26.881 1.00 0.00 H ATOM 74 N GLN A 8 69.549 -15.118 25.960 1.00 39.80 N ATOM 75 CA GLN A 8 68.875 -13.841 25.744 1.00 42.83 C ATOM 76 C GLN A 8 69.725 -12.926 24.888 1.00 39.25 C ATOM 77 O GLN A 8 70.296 -11.941 25.383 1.00 38.02 O ATOM 78 CB GLN A 8 68.577 -13.150 27.082 1.00 48.02 C ATOM 79 CG GLN A 8 67.485 -13.823 27.886 1.00 59.04 C ATOM 80 CD GLN A 8 66.100 -13.429 27.421 1.00 67.41 C ATOM 81 OE1 GLN A 8 65.942 -12.747 26.405 1.00 79.01 O ATOM 82 NE2 GLN A 8 65.085 -13.854 28.162 1.00 77.07 N ATOM 83 HE22 GLN A 8 65.265 -14.427 29.011 1.00 0.00 H ATOM 84 HE21 GLN A 8 64.109 -13.614 27.894 1.00 0.00 H ATOM 85 H GLN A 8 70.148 -15.232 26.802 1.00 0.00 H ATOM 86 N GLY A 9 69.874 -13.293 23.613 1.00 38.64 N ATOM 87 CA GLY A 9 70.803 -12.597 22.724 1.00 37.69 C ATOM 88 C GLY A 9 70.443 -11.135 22.478 1.00 34.82 C ATOM 89 O GLY A 9 71.320 -10.321 22.240 1.00 34.30 O ATOM 90 H GLY A 9 69.318 -14.091 23.244 1.00 0.00 H ATOM 91 N SER A 10 69.176 -10.787 22.666 1.00 34.66 N ATOM 92 CA SER A 10 68.723 -9.399 22.574 1.00 35.16 C ATOM 93 C SER A 10 69.418 -8.453 23.528 1.00 34.59 C ATOM 94 O SER A 10 69.573 -7.273 23.228 1.00 34.23 O ATOM 95 CB SER A 10 67.215 -9.288 22.763 1.00 37.21 C ATOM 96 OG SER A 10 66.846 -9.667 24.076 1.00 40.22 O ATOM 97 HG SER A 10 67.295 -9.073 24.728 1.00 0.00 H ATOM 98 H SER A 10 68.480 -11.528 22.887 1.00 0.00 H ATOM 99 N ILE A 11 69.982 -8.987 24.612 1.00 35.16 N ATOM 100 CA ILE A 11 70.807 -8.180 25.503 1.00 36.02 C ATOM 101 C ILE A 11 71.969 -7.567 24.772 1.00 34.98 C ATOM 102 O ILE A 11 72.217 -6.368 24.888 1.00 36.04 O ATOM 103 CB ILE A 11 71.316 -9.003 26.720 1.00 37.94 C ATOM 104 CG1 ILE A 11 70.145 -9.272 27.660 1.00 40.65 C ATOM 105 CG2 ILE A 11 72.459 -8.283 27.434 1.00 36.53 C ATOM 106 CD1 ILE A 11 70.495 -10.304 28.726 1.00 44.48 C ATOM 107 H ILE A 11 69.831 -9.994 24.825 1.00 0.00 H ATOM 108 N LEU A 12 72.709 -8.393 24.034 1.00 35.07 N ATOM 109 CA LEU A 12 73.821 -7.908 23.266 1.00 32.54 C ATOM 110 C LEU A 12 73.428 -6.921 22.186 1.00 30.16 C ATOM 111 O LEU A 12 74.145 -5.968 21.930 1.00 29.73 O ATOM 112 CB LEU A 12 74.569 -9.086 22.622 1.00 36.60 C ATOM 113 CG LEU A 12 75.452 -9.836 23.612 1.00 39.02 C ATOM 114 CD1 LEU A 12 75.899 -11.165 23.000 1.00 41.09 C ATOM 115 CD2 LEU A 12 76.646 -8.964 24.003 1.00 40.06 C ATOM 116 H LEU A 12 72.477 -9.407 24.014 1.00 0.00 H ATOM 117 N LYS A 13 72.329 -7.190 21.507 1.00 30.41 N ATOM 118 CA LYS A 13 71.771 -6.244 20.536 1.00 30.99 C ATOM 119 C LYS A 13 71.526 -4.894 21.191 1.00 29.69 C ATOM 120 O LYS A 13 72.005 -3.869 20.715 1.00 27.42 O ATOM 121 CB LYS A 13 70.472 -6.779 19.946 1.00 31.72 C ATOM 122 CG LYS A 13 70.650 -7.979 19.013 1.00 32.78 C ATOM 123 CD LYS A 13 69.316 -8.659 18.701 1.00 34.13 C ATOM 124 CE LYS A 13 68.365 -7.786 17.912 1.00 35.59 C ATOM 125 NZ LYS A 13 68.913 -7.332 16.626 1.00 38.38 N ATOM 126 HZ1 LYS A 13 69.777 -6.778 16.795 1.00 0.00 H ATOM 127 HZ2 LYS A 13 69.139 -8.158 16.036 1.00 0.00 H ATOM 128 HZ3 LYS A 13 68.209 -6.740 16.140 1.00 0.00 H ATOM 129 H LYS A 13 71.846 -8.097 21.665 1.00 0.00 H ATOM 130 N LYS A 14 70.917 -4.916 22.384 1.00 30.33 N ATOM 131 CA LYS A 14 70.631 -3.671 23.092 1.00 30.01 C ATOM 132 C LYS A 14 71.880 -2.966 23.531 1.00 29.75 C ATOM 133 O LYS A 14 71.966 -1.729 23.458 1.00 30.79 O ATOM 134 CB LYS A 14 69.671 -3.921 24.270 1.00 31.91 C ATOM 135 CG LYS A 14 68.274 -4.240 23.766 1.00 33.78 C ATOM 136 CD LYS A 14 67.446 -4.824 24.851 1.00 36.90 C ATOM 137 CE LYS A 14 66.125 -5.281 24.285 1.00 41.42 C ATOM 138 NZ LYS A 14 65.393 -5.837 25.438 1.00 46.15 N ATOM 139 HZ1 LYS A 14 65.934 -6.628 25.842 1.00 0.00 H ATOM 140 HZ2 LYS A 14 65.269 -5.097 26.158 1.00 0.00 H ATOM 141 HZ3 LYS A 14 64.461 -6.177 25.124 1.00 0.00 H ATOM 142 H LYS A 14 70.646 -5.826 22.809 1.00 0.00 H ATOM 143 N VAL A 15 72.871 -3.717 24.006 1.00 29.86 N ATOM 144 CA VAL A 15 74.101 -3.097 24.449 1.00 29.28 C ATOM 145 C VAL A 15 74.760 -2.317 23.294 1.00 31.71 C ATOM 146 O VAL A 15 75.276 -1.197 23.474 1.00 30.69 O ATOM 147 CB VAL A 15 75.054 -4.154 25.025 1.00 30.06 C ATOM 148 CG1 VAL A 15 76.470 -3.608 25.163 1.00 31.03 C ATOM 149 CG2 VAL A 15 74.547 -4.602 26.392 1.00 31.53 C ATOM 150 H VAL A 15 72.761 -4.750 24.059 1.00 0.00 H ATOM 151 N LEU A 16 74.850 -2.957 22.132 1.00 32.75 N ATOM 152 CA LEU A 16 75.476 -2.291 21.010 1.00 35.76 C ATOM 153 C LEU A 16 74.725 -1.091 20.514 1.00 35.82 C ATOM 154 O LEU A 16 75.325 -0.047 20.282 1.00 36.52 O ATOM 155 CB LEU A 16 75.804 -3.272 19.868 1.00 37.08 C ATOM 156 CG LEU A 16 77.256 -3.598 20.266 1.00 38.97 C ATOM 157 CD1 LEU A 16 77.460 -4.976 20.875 1.00 38.49 C ATOM 158 CD2 LEU A 16 78.288 -3.187 19.248 1.00 41.32 C ATOM 159 H LEU A 16 74.476 -3.922 22.031 1.00 0.00 H ATOM 160 N GLU A 17 73.413 -1.181 20.503 1.00 39.15 N ATOM 161 CA GLU A 17 72.607 0.007 20.228 1.00 42.41 C ATOM 162 C GLU A 17 72.828 1.134 21.279 1.00 41.86 C ATOM 163 O GLU A 17 72.830 2.301 20.933 1.00 44.80 O ATOM 164 CB GLU A 17 71.146 -0.386 20.055 1.00 44.41 C ATOM 165 CG GLU A 17 70.940 -1.301 18.851 1.00 48.93 C ATOM 166 CD GLU A 17 71.780 -0.866 17.647 1.00 54.11 C ATOM 167 OE1 GLU A 17 72.840 -1.514 17.321 1.00 49.59 O ATOM 168 OE2 GLU A 17 71.380 0.164 17.056 1.00 58.30 O ATOM 169 H GLU A 17 72.951 -2.094 20.689 1.00 0.00 H ATOM 170 N ALA A 18 73.160 0.772 22.516 1.00 40.96 N ATOM 171 CA ALA A 18 73.420 1.753 23.574 1.00 40.31 C ATOM 172 C ALA A 18 74.803 2.383 23.537 1.00 42.59 C ATOM 173 O ALA A 18 75.058 3.327 24.280 1.00 43.14 O ATOM 174 CB ALA A 18 73.214 1.117 24.933 1.00 40.12 C ATOM 175 H ALA A 18 73.238 -0.241 22.740 1.00 0.00 H ATOM 176 N LEU A 19 75.705 1.820 22.747 1.00 39.02 N ATOM 177 CA LEU A 19 77.087 2.262 22.697 1.00 40.07 C ATOM 178 C LEU A 19 77.488 2.944 21.386 1.00 41.53 C ATOM 179 O LEU A 19 78.285 3.885 21.387 1.00 41.14 O ATOM 180 CB LEU A 19 78.012 1.058 22.879 1.00 41.38 C ATOM 181 CG LEU A 19 78.037 0.464 24.278 1.00 41.59 C ATOM 182 CD1 LEU A 19 78.846 -0.811 24.263 1.00 44.57 C ATOM 183 CD2 LEU A 19 78.615 1.477 25.263 1.00 42.29 C ATOM 184 H LEU A 19 75.411 1.030 22.138 1.00 0.00 H ATOM 185 N LYS A 20 76.987 2.424 20.267 1.00 42.13 N ATOM 186 CA LYS A 20 77.630 2.690 18.977 1.00 46.28 C ATOM 187 C LYS A 20 77.524 4.158 18.554 1.00 47.11 C ATOM 188 O LYS A 20 78.300 4.589 17.737 1.00 46.91 O ATOM 189 CB LYS A 20 77.069 1.774 17.883 1.00 46.80 C ATOM 190 CG LYS A 20 75.562 1.840 17.739 1.00 49.52 C ATOM 191 CD LYS A 20 75.153 2.121 16.323 1.00 54.61 C ATOM 192 CE LYS A 20 73.647 2.119 16.199 1.00 56.82 C ATOM 193 NZ LYS A 20 73.215 3.293 15.403 1.00 60.65 N ATOM 194 HZ1 LYS A 20 73.523 4.165 15.879 1.00 0.00 H ATOM 195 HZ2 LYS A 20 73.641 3.244 14.456 1.00 0.00 H ATOM 196 HZ3 LYS A 20 72.178 3.290 15.318 1.00 0.00 H ATOM 197 H LYS A 20 76.136 1.827 20.309 1.00 0.00 H ATOM 198 N ASP A 21 76.517 4.892 19.034 1.00 47.81 N ATOM 199 CA ASP A 21 76.364 6.302 18.640 1.00 51.38 C ATOM 200 C ASP A 21 77.259 7.207 19.467 1.00 50.54 C ATOM 201 O ASP A 21 77.564 8.315 19.056 1.00 53.78 O ATOM 202 CB ASP A 21 74.924 6.800 18.786 1.00 53.25 C ATOM 203 CG ASP A 21 73.965 6.145 17.808 1.00 54.90 C ATOM 204 OD1 ASP A 21 74.406 5.685 16.733 1.00 55.90 O ATOM 205 OD2 ASP A 21 72.743 6.181 18.106 1.00 57.55 O ATOM 206 H ASP A 21 75.835 4.464 19.692 1.00 0.00 H ATOM 207 N LEU A 22 77.660 6.741 20.642 1.00 47.00 N ATOM 208 CA LEU A 22 78.552 7.505 21.487 1.00 46.40 C ATOM 209 C LEU A 22 80.037 7.187 21.266 1.00 44.71 C ATOM 210 O LEU A 22 80.879 8.070 21.332 1.00 42.98 O ATOM 211 CB LEU A 22 78.184 7.247 22.936 1.00 45.81 C ATOM 212 CG LEU A 22 79.033 7.961 23.975 1.00 46.78 C ATOM 213 CD1 LEU A 22 78.847 9.465 23.856 1.00 47.69 C ATOM 214 CD2 LEU A 22 78.657 7.464 25.372 1.00 47.19 C ATOM 215 H LEU A 22 77.327 5.809 20.962 1.00 0.00 H ATOM 216 N ILE A 23 80.336 5.921 21.032 1.00 42.97 N ATOM 217 CA ILE A 23 81.700 5.432 20.920 1.00 44.79 C ATOM 218 C ILE A 23 81.847 4.703 19.581 1.00 43.68 C ATOM 219 O ILE A 23 81.039 3.832 19.278 1.00 45.37 O ATOM 220 CB ILE A 23 81.984 4.409 22.039 1.00 44.10 C ATOM 221 CG1 ILE A 23 81.634 4.989 23.408 1.00 46.06 C ATOM 222 CG2 ILE A 23 83.446 4.002 22.025 1.00 45.58 C ATOM 223 CD1 ILE A 23 82.531 6.131 23.849 1.00 45.32 C ATOM 224 H ILE A 23 79.557 5.241 20.923 1.00 0.00 H ATOM 225 N ASN A 24 82.832 5.072 18.769 1.00 48.50 N ATOM 226 CA ASN A 24 83.022 4.419 17.457 1.00 50.38 C ATOM 227 C ASN A 24 83.755 3.088 17.589 1.00 48.73 C ATOM 228 O ASN A 24 83.465 2.118 16.881 1.00 47.43 O ATOM 229 CB ASN A 24 83.807 5.329 16.490 1.00 57.10 C ATOM 230 CG ASN A 24 83.174 6.713 16.309 1.00 62.57 C ATOM 231 OD1 ASN A 24 82.037 6.842 15.839 1.00 71.68 O ATOM 232 ND2 ASN A 24 83.936 7.760 16.626 1.00 67.75 N ATOM 233 HD22 ASN A 24 84.887 7.611 17.019 1.00 0.00 H ATOM 234 HD21 ASN A 24 83.579 8.726 16.480 1.00 0.00 H ATOM 235 H ASN A 24 83.479 5.832 19.061 1.00 0.00 H ATOM 236 N GLU A 25 84.746 3.048 18.461 1.00 47.54 N ATOM 237 CA GLU A 25 85.570 1.863 18.604 1.00 52.67 C ATOM 238 C GLU A 25 85.982 1.722 20.057 1.00 52.28 C ATOM 239 O GLU A 25 86.225 2.716 20.725 1.00 55.62 O ATOM 240 CB GLU A 25 86.812 1.963 17.701 1.00 58.01 C ATOM 241 CG GLU A 25 87.721 3.128 18.044 1.00 64.19 C ATOM 242 CD GLU A 25 88.410 3.665 16.805 1.00 72.32 C ATOM 243 OE1 GLU A 25 89.657 3.661 16.778 1.00 80.73 O ATOM 244 OE2 GLU A 25 87.709 3.999 15.814 1.00 73.58 O ATOM 245 H GLU A 25 84.939 3.880 19.055 1.00 0.00 H ATOM 246 N ALA A 26 86.123 0.488 20.522 1.00 50.87 N ATOM 247 CA ALA A 26 86.551 0.250 21.889 1.00 51.23 C ATOM 248 C ALA A 26 87.183 -1.125 22.042 1.00 49.73 C ATOM 249 O ALA A 26 87.021 -2.000 21.194 1.00 48.49 O ATOM 250 CB ALA A 26 85.360 0.396 22.824 1.00 52.12 C ATOM 251 H ALA A 26 85.924 -0.321 19.899 1.00 0.00 H ATOM 252 N CYS A 27 87.887 -1.298 23.150 1.00 49.17 N ATOM 253 CA CYS A 27 88.467 -2.574 23.528 1.00 51.26 C ATOM 254 C CYS A 27 87.530 -3.392 24.406 1.00 48.58 C ATOM 255 O CYS A 27 87.027 -2.894 25.424 1.00 46.32 O ATOM 256 CB CYS A 27 89.759 -2.344 24.298 1.00 59.17 C ATOM 257 SG CYS A 27 90.711 -3.871 24.495 1.00 68.89 S ATOM 258 H CYS A 27 88.031 -0.482 23.779 1.00 0.00 H ATOM 259 N TRP A 28 87.272 -4.630 24.002 1.00 44.55 N ATOM 260 CA TRP A 28 86.461 -5.554 24.800 1.00 46.56 C ATOM 261 C TRP A 28 87.411 -6.443 25.565 1.00 46.07 C ATOM 262 O TRP A 28 88.069 -7.312 24.988 1.00 48.22 O ATOM 263 CB TRP A 28 85.546 -6.412 23.926 1.00 44.80 C ATOM 264 CG TRP A 28 84.448 -5.651 23.290 1.00 44.76 C ATOM 265 CD1 TRP A 28 84.574 -4.629 22.412 1.00 46.23 C ATOM 266 CD2 TRP A 28 83.045 -5.845 23.482 1.00 44.17 C ATOM 267 NE1 TRP A 28 83.330 -4.160 22.048 1.00 47.57 N ATOM 268 CE2 TRP A 28 82.375 -4.882 22.708 1.00 45.99 C ATOM 269 CE3 TRP A 28 82.295 -6.730 24.242 1.00 46.42 C ATOM 270 CZ2 TRP A 28 80.981 -4.807 22.642 1.00 46.45 C ATOM 271 CZ3 TRP A 28 80.909 -6.611 24.241 1.00 47.05 C ATOM 272 CH2 TRP A 28 80.268 -5.647 23.460 1.00 48.96 C ATOM 273 HE1 TRP A 28 83.148 -3.384 21.380 1.00 0.00 H ATOM 274 H TRP A 28 87.657 -4.954 23.092 1.00 0.00 H ATOM 275 N ASP A 29 87.483 -6.206 26.863 1.00 44.67 N ATOM 276 CA ASP A 29 88.380 -6.940 27.728 1.00 47.31 C ATOM 277 C ASP A 29 87.686 -8.191 28.200 1.00 47.39 C ATOM 278 O ASP A 29 86.654 -8.127 28.878 1.00 45.07 O ATOM 279 CB ASP A 29 88.787 -6.077 28.902 1.00 51.26 C ATOM 280 CG ASP A 29 89.492 -4.820 28.458 1.00 55.30 C ATOM 281 OD1 ASP A 29 90.483 -4.941 27.709 1.00 63.68 O ATOM 282 OD2 ASP A 29 89.045 -3.717 28.830 1.00 59.77 O ATOM 283 H ASP A 29 86.876 -5.469 27.275 1.00 0.00 H ATOM 284 N ILE A 30 88.226 -9.328 27.776 1.00 46.28 N ATOM 285 CA ILE A 30 87.667 -10.634 28.074 1.00 46.49 C ATOM 286 C ILE A 30 88.581 -11.316 29.080 1.00 47.90 C ATOM 287 O ILE A 30 89.788 -11.427 28.865 1.00 51.43 O ATOM 288 CB ILE A 30 87.582 -11.491 26.812 1.00 47.63 C ATOM 289 CG1 ILE A 30 86.925 -10.710 25.683 1.00 47.79 C ATOM 290 CG2 ILE A 30 86.830 -12.783 27.074 1.00 50.24 C ATOM 291 CD1 ILE A 30 85.559 -10.148 26.025 1.00 46.94 C ATOM 292 H ILE A 30 89.092 -9.280 27.202 1.00 0.00 H ATOM 293 N SER A 31 87.991 -11.771 30.177 1.00 47.21 N ATOM 294 CA SER A 31 88.686 -12.548 31.166 1.00 47.64 C ATOM 295 C SER A 31 87.746 -13.613 31.700 1.00 48.07 C ATOM 296 O SER A 31 86.556 -13.660 31.343 1.00 47.53 O ATOM 297 CB SER A 31 89.127 -11.629 32.303 1.00 46.17 C ATOM 298 OG SER A 31 87.991 -11.095 32.940 1.00 46.45 O ATOM 299 HG SER A 31 87.459 -10.579 32.284 1.00 0.00 H ATOM 300 H SER A 31 86.985 -11.557 30.328 1.00 0.00 H ATOM 301 N SER A 32 88.245 -14.397 32.649 1.00 48.41 N ATOM 302 CA SER A 32 87.444 -15.452 33.261 1.00 48.04 C ATOM 303 C SER A 32 86.262 -14.901 34.033 1.00 44.57 C ATOM 304 O SER A 32 85.228 -15.564 34.145 1.00 44.92 O ATOM 305 CB SER A 32 88.316 -16.355 34.155 1.00 51.00 C ATOM 306 OG SER A 32 89.000 -17.292 33.319 1.00 53.75 O ATOM 307 HG SER A 32 88.337 -17.839 32.828 1.00 0.00 H ATOM 308 H SER A 32 89.227 -14.256 32.962 1.00 0.00 H ATOM 309 N SER A 33 86.362 -13.665 34.485 1.00 42.36 N ATOM 310 CA SER A 33 85.282 -13.094 35.258 1.00 43.34 C ATOM 311 C SER A 33 84.187 -12.472 34.362 1.00 41.79 C ATOM 312 O SER A 33 83.101 -12.189 34.828 1.00 38.81 O ATOM 313 CB SER A 33 85.833 -12.073 36.253 1.00 44.47 C ATOM 314 OG SER A 33 86.229 -10.909 35.572 1.00 45.47 O ATOM 315 HG SER A 33 86.932 -11.137 34.913 1.00 0.00 H ATOM 316 H SER A 33 87.215 -13.104 34.286 1.00 0.00 H ATOM 317 N GLY A 34 84.464 -12.299 33.076 1.00 41.22 N ATOM 318 CA GLY A 34 83.445 -11.818 32.160 1.00 41.77 C ATOM 319 C GLY A 34 83.977 -10.817 31.162 1.00 43.42 C ATOM 320 O GLY A 34 85.163 -10.794 30.837 1.00 43.52 O ATOM 321 H GLY A 34 85.419 -12.510 32.721 1.00 0.00 H ATOM 322 N VAL A 35 83.067 -10.000 30.664 1.00 44.86 N ATOM 323 CA VAL A 35 83.380 -9.005 29.659 1.00 46.14 C ATOM 324 C VAL A 35 83.317 -7.609 30.282 1.00 46.46 C ATOM 325 O VAL A 35 82.328 -7.262 30.948 1.00 48.07 O ATOM 326 CB VAL A 35 82.383 -9.118 28.503 1.00 44.28 C ATOM 327 CG1 VAL A 35 82.684 -8.089 27.431 1.00 45.96 C ATOM 328 CG2 VAL A 35 82.403 -10.530 27.924 1.00 45.18 C ATOM 329 H VAL A 35 82.088 -10.074 31.007 1.00 0.00 H ATOM 330 N ASN A 36 84.378 -6.840 30.086 1.00 46.49 N ATOM 331 CA ASN A 36 84.474 -5.452 30.540 1.00 47.97 C ATOM 332 C ASN A 36 84.878 -4.550 29.388 1.00 49.66 C ATOM 333 O ASN A 36 85.630 -4.968 28.508 1.00 48.10 O ATOM 334 CB ASN A 36 85.530 -5.318 31.613 1.00 52.73 C ATOM 335 CG ASN A 36 85.113 -5.965 32.916 1.00 58.80 C ATOM 336 OD1 ASN A 36 85.535 -7.075 33.231 1.00 67.03 O ATOM 337 ND2 ASN A 36 84.220 -5.313 33.639 1.00 62.38 N ATOM 338 HD22 ASN A 36 83.890 -4.375 33.335 1.00 0.00 H ATOM 339 HD21 ASN A 36 83.847 -5.738 34.512 1.00 0.00 H ATOM 340 H ASN A 36 85.190 -7.247 29.580 1.00 0.00 H ATOM 341 N LEU A 37 84.315 -3.352 29.352 1.00 46.05 N ATOM 342 CA LEU A 37 84.624 -2.400 28.315 1.00 45.12 C ATOM 343 C LEU A 37 84.571 -1.043 28.970 1.00 44.48 C ATOM 344 O LEU A 37 83.588 -0.719 29.639 1.00 43.33 O ATOM 345 CB LEU A 37 83.623 -2.493 27.144 1.00 44.66 C ATOM 346 CG LEU A 37 83.746 -1.507 25.974 1.00 45.89 C ATOM 347 CD1 LEU A 37 83.151 -2.113 24.704 1.00 46.66 C ATOM 348 CD2 LEU A 37 83.075 -0.167 26.263 1.00 45.93 C ATOM 349 H LEU A 37 83.632 -3.091 30.092 1.00 0.00 H ATOM 350 N GLN A 38 85.599 -0.240 28.724 1.00 44.26 N ATOM 351 CA GLN A 38 85.629 1.147 29.176 1.00 46.50 C ATOM 352 C GLN A 38 86.177 2.045 28.081 1.00 45.68 C ATOM 353 O GLN A 38 87.150 1.683 27.427 1.00 49.90 O ATOM 354 CB GLN A 38 86.509 1.264 30.416 1.00 48.71 C ATOM 355 CG GLN A 38 86.382 2.589 31.139 1.00 50.55 C ATOM 356 CD GLN A 38 87.558 2.846 32.080 1.00 52.04 C ATOM 357 OE1 GLN A 38 88.566 3.414 31.675 1.00 53.68 O ATOM 358 NE2 GLN A 38 87.435 2.429 33.326 1.00 53.72 N ATOM 359 HE22 GLN A 38 86.563 1.951 33.631 1.00 0.00 H ATOM 360 HE21 GLN A 38 88.210 2.578 34.003 1.00 0.00 H ATOM 361 H GLN A 38 86.411 -0.612 28.191 1.00 0.00 H ATOM 362 N SER A 39 85.514 3.163 27.804 1.00 43.84 N ATOM 363 CA SER A 39 85.946 4.027 26.707 1.00 45.91 C ATOM 364 C SER A 39 85.434 5.439 26.888 1.00 45.35 C ATOM 365 O SER A 39 84.318 5.634 27.383 1.00 44.01 O ATOM 366 CB SER A 39 85.453 3.480 25.351 1.00 45.53 C ATOM 367 OG SER A 39 85.929 4.291 24.297 1.00 49.38 O ATOM 368 HG SER A 39 85.594 5.215 24.416 1.00 0.00 H ATOM 369 H SER A 39 84.683 3.425 28.371 1.00 0.00 H ATOM 370 N MET A 40 86.230 6.405 26.421 1.00 45.47 N ATOM 371 CA MET A 40 85.843 7.812 26.377 1.00 45.73 C ATOM 372 C MET A 40 85.307 8.163 25.019 1.00 46.10 C ATOM 373 O MET A 40 85.762 7.614 24.017 1.00 48.40 O ATOM 374 CB MET A 40 87.039 8.713 26.632 1.00 48.33 C ATOM 375 CG MET A 40 87.517 8.706 28.062 1.00 47.75 C ATOM 376 SD MET A 40 88.722 9.988 28.378 1.00 53.18 S ATOM 377 CE MET A 40 90.118 9.274 27.481 1.00 54.13 C ATOM 378 H MET A 40 87.173 6.141 26.071 1.00 0.00 H ATOM 379 N ASP A 41 84.377 9.109 24.949 1.00 45.07 N ATOM 380 CA ASP A 41 83.936 9.589 23.637 1.00 45.54 C ATOM 381 C ASP A 41 85.050 10.462 23.091 1.00 47.39 C ATOM 382 O ASP A 41 85.963 10.835 23.833 1.00 44.63 O ATOM 383 CB ASP A 41 82.613 10.360 23.722 1.00 45.03 C ATOM 384 CG ASP A 41 82.795 11.787 24.190 1.00 47.79 C ATOM 385 OD1 ASP A 41 83.009 11.980 25.410 1.00 45.71 O ATOM 386 OD2 ASP A 41 82.710 12.711 23.342 1.00 46.65 O ATOM 387 H ASP A 41 83.966 9.505 25.818 1.00 0.00 H ATOM 388 N SER A 42 84.974 10.772 21.797 1.00 48.03 N ATOM 389 CA SER A 42 86.087 11.382 21.057 1.00 50.41 C ATOM 390 C SER A 42 86.292 12.861 21.409 1.00 51.59 C ATOM 391 O SER A 42 87.393 13.391 21.260 1.00 52.91 O ATOM 392 CB SER A 42 85.830 11.191 19.552 1.00 50.76 C ATOM 393 OG SER A 42 84.926 12.172 19.090 1.00 51.94 O ATOM 394 HG SER A 42 84.766 12.042 18.122 1.00 0.00 H ATOM 395 H SER A 42 84.088 10.573 21.289 1.00 0.00 H ATOM 396 N SER A 43 85.271 13.514 21.964 1.00 50.47 N ATOM 397 CA SER A 43 85.445 14.863 22.499 1.00 52.03 C ATOM 398 C SER A 43 85.818 14.879 23.997 1.00 50.83 C ATOM 399 O SER A 43 85.927 15.949 24.584 1.00 51.93 O ATOM 400 CB SER A 43 84.203 15.723 22.249 1.00 53.78 C ATOM 401 OG SER A 43 83.179 15.467 23.224 1.00 60.26 O ATOM 402 HG SER A 43 82.914 14.514 23.181 1.00 0.00 H ATOM 403 H SER A 43 84.338 13.057 22.017 1.00 0.00 H ATOM 404 N HIS A 44 86.034 13.717 24.615 1.00 50.16 N ATOM 405 CA HIS A 44 86.516 13.636 26.017 1.00 49.10 C ATOM 406 C HIS A 44 85.639 14.360 27.020 1.00 48.70 C ATOM 407 O HIS A 44 86.126 14.936 27.994 1.00 49.06 O ATOM 408 CB HIS A 44 87.948 14.122 26.119 1.00 52.46 C ATOM 409 CG HIS A 44 88.857 13.428 25.160 1.00 57.00 C ATOM 410 ND1 HIS A 44 89.331 14.033 24.018 1.00 61.24 N ATOM 411 CD2 HIS A 44 89.279 12.145 25.112 1.00 57.74 C ATOM 412 CE1 HIS A 44 90.050 13.165 23.331 1.00 61.46 C ATOM 413 NE2 HIS A 44 90.007 12.003 23.958 1.00 60.81 N ATOM 414 H HIS A 44 85.858 12.834 24.095 1.00 0.00 H ATOM 415 N VAL A 45 84.336 14.247 26.812 1.00 48.30 N ATOM 416 CA VAL A 45 83.341 14.818 27.719 1.00 49.66 C ATOM 417 C VAL A 45 82.728 13.720 28.605 1.00 46.21 C ATOM 418 O VAL A 45 82.271 13.982 29.721 1.00 48.67 O ATOM 419 CB VAL A 45 82.290 15.554 26.861 1.00 51.28 C ATOM 420 CG1 VAL A 45 81.064 15.913 27.659 1.00 52.02 C ATOM 421 CG2 VAL A 45 82.929 16.805 26.252 1.00 53.12 C ATOM 422 H VAL A 45 84.007 13.732 25.970 1.00 0.00 H ATOM 423 N SER A 46 82.721 12.486 28.110 1.00 45.79 N ATOM 424 CA SER A 46 82.049 11.383 28.787 1.00 46.12 C ATOM 425 C SER A 46 82.858 10.119 28.730 1.00 44.93 C ATOM 426 O SER A 46 83.787 9.980 27.923 1.00 46.10 O ATOM 427 CB SER A 46 80.678 11.117 28.178 1.00 47.05 C ATOM 428 OG SER A 46 80.789 10.563 26.875 1.00 47.76 O ATOM 429 HG SER A 46 81.276 11.195 26.289 1.00 0.00 H ATOM 430 H SER A 46 83.210 12.301 27.211 1.00 0.00 H ATOM 431 N LEU A 47 82.482 9.192 29.589 1.00 42.57 N ATOM 432 CA LEU A 47 83.067 7.877 29.642 1.00 43.26 C ATOM 433 C LEU A 47 81.957 6.849 29.835 1.00 41.41 C ATOM 434 O LEU A 47 80.990 7.091 30.583 1.00 40.61 O ATOM 435 CB LEU A 47 84.073 7.798 30.787 1.00 48.48 C ATOM 436 CG LEU A 47 84.790 6.447 30.954 1.00 53.07 C ATOM 437 CD1 LEU A 47 86.295 6.618 30.981 1.00 55.65 C ATOM 438 CD2 LEU A 47 84.315 5.727 32.209 1.00 52.19 C ATOM 439 H LEU A 47 81.724 9.422 30.263 1.00 0.00 H ATOM 440 N VAL A 48 82.120 5.698 29.198 1.00 37.97 N ATOM 441 CA VAL A 48 81.188 4.600 29.359 1.00 39.37 C ATOM 442 C VAL A 48 81.905 3.368 29.887 1.00 39.28 C ATOM 443 O VAL A 48 83.039 3.067 29.483 1.00 37.59 O ATOM 444 CB VAL A 48 80.440 4.270 28.047 1.00 38.53 C ATOM 445 CG1 VAL A 48 81.371 3.637 27.025 1.00 39.85 C ATOM 446 CG2 VAL A 48 79.247 3.366 28.317 1.00 39.82 C ATOM 447 H VAL A 48 82.938 5.580 28.566 1.00 0.00 H ATOM 448 N GLN A 49 81.252 2.695 30.831 1.00 37.26 N ATOM 449 CA GLN A 49 81.746 1.460 31.398 1.00 40.75 C ATOM 450 C GLN A 49 80.672 0.360 31.346 1.00 38.15 C ATOM 451 O GLN A 49 79.594 0.504 31.913 1.00 38.46 O ATOM 452 CB GLN A 49 82.191 1.694 32.842 1.00 43.26 C ATOM 453 CG GLN A 49 83.160 0.660 33.377 1.00 46.58 C ATOM 454 CD GLN A 49 82.467 -0.458 34.133 1.00 52.94 C ATOM 455 OE1 GLN A 49 81.881 -0.241 35.226 1.00 56.45 O ATOM 456 NE2 GLN A 49 82.597 -1.682 33.614 1.00 52.55 N ATOM 457 HE22 GLN A 49 83.090 -1.813 32.707 1.00 0.00 H ATOM 458 HE21 GLN A 49 82.206 -2.504 34.117 1.00 0.00 H ATOM 459 H GLN A 49 80.347 3.074 31.176 1.00 0.00 H ATOM 460 N LEU A 50 81.011 -0.759 30.713 1.00 35.64 N ATOM 461 CA LEU A 50 80.136 -1.927 30.576 1.00 35.37 C ATOM 462 C LEU A 50 80.717 -3.079 31.390 1.00 35.27 C ATOM 463 O LEU A 50 81.892 -3.415 31.248 1.00 34.45 O ATOM 464 CB LEU A 50 80.054 -2.358 29.086 1.00 34.01 C ATOM 465 CG LEU A 50 79.356 -3.679 28.749 1.00 33.92 C ATOM 466 CD1 LEU A 50 77.854 -3.586 28.935 1.00 34.08 C ATOM 467 CD2 LEU A 50 79.633 -4.108 27.321 1.00 35.03 C ATOM 468 H LEU A 50 81.959 -0.809 30.287 1.00 0.00 H ATOM 469 N THR A 51 79.851 -3.786 32.100 1.00 36.30 N ATOM 470 CA THR A 51 80.219 -5.045 32.717 1.00 37.15 C ATOM 471 C THR A 51 79.185 -6.101 32.381 1.00 34.92 C ATOM 472 O THR A 51 77.981 -5.901 32.597 1.00 32.80 O ATOM 473 CB THR A 51 80.316 -4.889 34.263 1.00 40.45 C ATOM 474 OG1 THR A 51 81.377 -3.987 34.550 1.00 43.76 O ATOM 475 CG2 THR A 51 80.602 -6.209 34.933 1.00 41.01 C ATOM 476 HG1 THR A 51 81.456 -3.873 35.530 1.00 0.00 H ATOM 477 H THR A 51 78.882 -3.429 32.218 1.00 0.00 H ATOM 478 N LEU A 52 79.656 -7.240 31.880 1.00 35.59 N ATOM 479 CA LEU A 52 78.828 -8.440 31.705 1.00 36.14 C ATOM 480 C LEU A 52 79.537 -9.620 32.370 1.00 38.10 C ATOM 481 O LEU A 52 80.524 -10.150 31.835 1.00 36.26 O ATOM 482 CB LEU A 52 78.609 -8.748 30.219 1.00 36.47 C ATOM 483 CG LEU A 52 77.945 -7.634 29.390 1.00 35.52 C ATOM 484 CD1 LEU A 52 78.079 -7.977 27.918 1.00 37.62 C ATOM 485 CD2 LEU A 52 76.486 -7.447 29.756 1.00 33.49 C ATOM 486 H LEU A 52 80.657 -7.282 31.599 1.00 0.00 H ATOM 487 N ARG A 53 79.022 -10.051 33.527 1.00 37.14 N ATOM 488 CA ARG A 53 79.691 -11.077 34.313 1.00 38.98 C ATOM 489 C ARG A 53 79.528 -12.468 33.709 1.00 39.14 C ATOM 490 O ARG A 53 78.485 -12.794 33.133 1.00 38.30 O ATOM 491 CB ARG A 53 79.192 -11.078 35.756 1.00 40.40 C ATOM 492 CG ARG A 53 79.762 -9.958 36.606 1.00 44.49 C ATOM 493 CD ARG A 53 79.148 -9.979 38.027 1.00 46.94 C ATOM 494 NE ARG A 53 77.694 -9.766 38.009 1.00 50.34 N ATOM 495 CZ ARG A 53 77.093 -8.572 38.085 1.00 52.05 C ATOM 496 NH1 ARG A 53 77.800 -7.442 38.218 1.00 55.51 N ATOM 497 NH2 ARG A 53 75.776 -8.512 38.053 1.00 50.58 N ATOM 498 HE ARG A 53 77.086 -10.606 37.931 1.00 0.00 H ATOM 499 HH12 ARG A 53 77.311 -6.526 38.275 1.00 0.00 H ATOM 500 HH11 ARG A 53 78.838 -7.481 38.264 1.00 0.00 H ATOM 501 HH22 ARG A 53 75.296 -7.591 38.111 1.00 0.00 H ATOM 502 HH21 ARG A 53 75.218 -9.385 37.970 1.00 0.00 H ATOM 503 H ARG A 53 78.128 -9.646 33.871 1.00 0.00 H ATOM 504 N SER A 54 80.554 -13.303 33.884 1.00 40.73 N ATOM 505 CA SER A 54 80.574 -14.648 33.305 1.00 41.48 C ATOM 506 C SER A 54 79.353 -15.452 33.709 1.00 43.20 C ATOM 507 O SER A 54 78.806 -16.184 32.894 1.00 41.79 O ATOM 508 CB SER A 54 81.851 -15.392 33.700 1.00 43.79 C ATOM 509 OG SER A 54 81.990 -15.407 35.099 1.00 47.24 O ATOM 510 HG SER A 54 82.039 -14.477 35.435 1.00 0.00 H ATOM 511 H SER A 54 81.367 -12.988 34.451 1.00 0.00 H ATOM 512 N GLU A 55 78.925 -15.317 34.968 1.00 44.43 N ATOM 513 CA GLU A 55 77.811 -16.107 35.489 1.00 45.18 C ATOM 514 C GLU A 55 76.458 -15.737 34.857 1.00 45.77 C ATOM 515 O GLU A 55 75.507 -16.510 34.951 1.00 44.73 O ATOM 516 CB GLU A 55 77.756 -16.082 37.033 1.00 45.99 C ATOM 517 CG GLU A 55 77.488 -14.737 37.700 1.00 45.62 C ATOM 518 CD GLU A 55 78.757 -13.983 38.087 1.00 46.24 C ATOM 519 OE1 GLU A 55 79.837 -14.303 37.537 1.00 47.21 O ATOM 520 OE2 GLU A 55 78.682 -13.055 38.934 1.00 47.47 O ATOM 521 H GLU A 55 79.397 -14.632 35.593 1.00 0.00 H ATOM 522 N GLY A 56 76.378 -14.574 34.210 1.00 43.57 N ATOM 523 CA GLY A 56 75.169 -14.172 33.494 1.00 43.33 C ATOM 524 C GLY A 56 75.010 -14.835 32.133 1.00 42.94 C ATOM 525 O GLY A 56 73.900 -14.900 31.596 1.00 42.35 O ATOM 526 H GLY A 56 77.199 -13.935 34.215 1.00 0.00 H ATOM 527 N PHE A 57 76.088 -15.420 31.617 1.00 40.39 N ATOM 528 CA PHE A 57 75.989 -16.216 30.405 1.00 40.72 C ATOM 529 C PHE A 57 75.535 -17.646 30.697 1.00 43.03 C ATOM 530 O PHE A 57 75.782 -18.207 31.768 1.00 41.05 O ATOM 531 CB PHE A 57 77.316 -16.240 29.686 1.00 38.68 C ATOM 532 CG PHE A 57 77.705 -14.914 29.119 1.00 37.88 C ATOM 533 CD1 PHE A 57 78.312 -13.960 29.908 1.00 38.17 C ATOM 534 CD2 PHE A 57 77.459 -14.619 27.771 1.00 39.92 C ATOM 535 CE1 PHE A 57 78.662 -12.732 29.403 1.00 38.44 C ATOM 536 CE2 PHE A 57 77.797 -13.384 27.252 1.00 37.81 C ATOM 537 CZ PHE A 57 78.436 -12.449 28.058 1.00 39.84 C ATOM 538 H PHE A 57 77.010 -15.307 32.085 1.00 0.00 H ATOM 539 N ASP A 58 74.922 -18.260 29.708 1.00 41.65 N ATOM 540 CA ASP A 58 74.495 -19.628 29.851 1.00 45.00 C ATOM 541 C ASP A 58 75.630 -20.633 29.886 1.00 44.42 C ATOM 542 O ASP A 58 75.624 -21.547 30.724 1.00 43.21 O ATOM 543 CB ASP A 58 73.451 -19.900 28.795 1.00 49.43 C ATOM 544 CG ASP A 58 72.247 -18.974 28.985 1.00 54.64 C ATOM 545 OD1 ASP A 58 72.298 -17.769 28.561 1.00 52.32 O ATOM 546 OD2 ASP A 58 71.375 -19.386 29.787 1.00 55.88 O ATOM 547 H ASP A 58 74.745 -17.754 28.817 1.00 0.00 H ATOM 548 N THR A 59 76.623 -20.444 29.022 1.00 42.14 N ATOM 549 CA THR A 59 77.929 -21.046 29.219 1.00 41.57 C ATOM 550 C THR A 59 79.003 -19.985 28.977 1.00 42.34 C ATOM 551 O THR A 59 78.783 -19.014 28.236 1.00 41.62 O ATOM 552 CB THR A 59 78.192 -22.217 28.255 1.00 43.77 C ATOM 553 OG1 THR A 59 78.408 -21.711 26.929 1.00 40.78 O ATOM 554 CG2 THR A 59 77.032 -23.207 28.253 1.00 43.02 C ATOM 555 HG1 THR A 59 79.191 -21.105 26.932 1.00 0.00 H ATOM 556 H THR A 59 76.460 -19.850 28.184 1.00 0.00 H ATOM 557 N TYR A 60 80.174 -20.178 29.584 1.00 39.90 N ATOM 558 CA TYR A 60 81.228 -19.203 29.486 1.00 40.14 C ATOM 559 C TYR A 60 82.560 -19.889 29.659 1.00 43.30 C ATOM 560 O TYR A 60 82.814 -20.529 30.673 1.00 43.81 O ATOM 561 CB TYR A 60 81.056 -18.118 30.535 1.00 40.69 C ATOM 562 CG TYR A 60 81.944 -16.923 30.323 1.00 41.36 C ATOM 563 CD1 TYR A 60 83.254 -16.892 30.836 1.00 41.29 C ATOM 564 CD2 TYR A 60 81.493 -15.816 29.616 1.00 41.03 C ATOM 565 CE1 TYR A 60 84.084 -15.811 30.610 1.00 41.99 C ATOM 566 CE2 TYR A 60 82.333 -14.722 29.380 1.00 40.66 C ATOM 567 CZ TYR A 60 83.612 -14.719 29.880 1.00 40.88 C ATOM 568 OH TYR A 60 84.443 -13.644 29.638 1.00 38.86 O ATOM 569 HH TYR A 60 85.321 -13.804 30.067 1.00 0.00 H ATOM 570 H TYR A 60 80.328 -21.046 30.136 1.00 0.00 H ATOM 571 N ARG A 61 83.445 -19.696 28.703 1.00 45.27 N ATOM 572 CA ARG A 61 84.791 -20.218 28.803 1.00 48.32 C ATOM 573 C ARG A 61 85.729 -19.135 28.328 1.00 48.05 C ATOM 574 O ARG A 61 85.535 -18.576 27.229 1.00 43.38 O ATOM 575 CB ARG A 61 84.916 -21.450 27.912 1.00 54.77 C ATOM 576 CG ARG A 61 86.335 -21.936 27.708 1.00 61.93 C ATOM 577 CD ARG A 61 86.357 -23.147 26.795 1.00 67.45 C ATOM 578 NE ARG A 61 87.728 -23.565 26.524 1.00 70.30 N ATOM 579 CZ ARG A 61 88.059 -24.605 25.768 1.00 74.73 C ATOM 580 NH1 ARG A 61 87.113 -25.351 25.212 1.00 76.20 N ATOM 581 NH2 ARG A 61 89.342 -24.908 25.579 1.00 75.71 N ATOM 582 HE ARG A 61 88.498 -23.011 26.952 1.00 0.00 H ATOM 583 HH12 ARG A 61 87.374 -26.165 24.620 1.00 0.00 H ATOM 584 HH11 ARG A 61 86.111 -25.121 25.368 1.00 0.00 H ATOM 585 HH22 ARG A 61 89.602 -25.722 24.987 1.00 0.00 H ATOM 586 HH21 ARG A 61 90.084 -24.330 26.023 1.00 0.00 H ATOM 587 H ARG A 61 83.170 -19.156 27.857 1.00 0.00 H ATOM 588 N CYS A 62 86.747 -18.849 29.132 1.00 46.85 N ATOM 589 CA CYS A 62 87.843 -17.979 28.714 1.00 49.49 C ATOM 590 C CYS A 62 89.196 -18.538 29.176 1.00 50.99 C ATOM 591 O CYS A 62 89.522 -18.462 30.355 1.00 48.81 O ATOM 592 CB CYS A 62 87.659 -16.581 29.288 1.00 50.34 C ATOM 593 SG CYS A 62 88.983 -15.445 28.809 1.00 57.15 S ATOM 594 H CYS A 62 86.764 -19.257 30.088 1.00 0.00 H ATOM 595 N ASP A 63 89.958 -19.084 28.236 1.00 52.41 N ATOM 596 CA ASP A 63 91.226 -19.746 28.528 1.00 59.70 C ATOM 597 C ASP A 63 92.345 -18.741 28.780 1.00 60.32 C ATOM 598 O ASP A 63 93.273 -19.028 29.497 1.00 60.25 O ATOM 599 CB ASP A 63 91.613 -20.691 27.371 1.00 60.46 C ATOM 600 CG ASP A 63 90.667 -21.880 27.243 1.00 63.79 C ATOM 601 OD1 ASP A 63 89.885 -22.151 28.186 1.00 61.13 O ATOM 602 OD2 ASP A 63 90.673 -22.530 26.176 1.00 65.99 O ATOM 603 H ASP A 63 89.637 -19.038 27.248 1.00 0.00 H ATOM 604 N ARG A 64 92.304 -17.602 28.103 1.00 65.82 N ATOM 605 CA ARG A 64 93.309 -16.561 28.305 1.00 67.24 C ATOM 606 C ARG A 64 92.660 -15.192 28.177 1.00 64.92 C ATOM 607 O ARG A 64 91.689 -15.018 27.429 1.00 66.90 O ATOM 608 CB ARG A 64 94.478 -16.744 27.321 1.00 71.33 C ATOM 609 CG ARG A 64 94.383 -15.973 26.019 1.00 74.87 C ATOM 610 CD ARG A 64 95.655 -16.159 25.204 1.00 76.66 C ATOM 611 NE ARG A 64 95.367 -15.951 23.789 1.00 81.58 N ATOM 612 CZ ARG A 64 95.281 -16.908 22.854 1.00 87.31 C ATOM 613 NH1 ARG A 64 95.501 -18.191 23.142 1.00 89.96 N ATOM 614 NH2 ARG A 64 94.974 -16.575 21.598 1.00 82.19 N ATOM 615 HE ARG A 64 95.214 -14.971 23.477 1.00 0.00 H ATOM 616 HH12 ARG A 64 95.427 -18.912 22.396 1.00 0.00 H ATOM 617 HH11 ARG A 64 95.747 -18.471 24.113 1.00 0.00 H ATOM 618 HH22 ARG A 64 94.905 -17.311 20.867 1.00 0.00 H ATOM 619 HH21 ARG A 64 94.804 -15.579 21.351 1.00 0.00 H ATOM 620 H ARG A 64 91.541 -17.446 27.414 1.00 0.00 H ATOM 621 N ASN A 65 93.199 -14.214 28.888 1.00 61.39 N ATOM 622 CA ASN A 65 92.681 -12.862 28.795 1.00 58.36 C ATOM 623 C ASN A 65 92.900 -12.245 27.418 1.00 56.01 C ATOM 624 O ASN A 65 93.960 -12.404 26.846 1.00 54.56 O ATOM 625 CB ASN A 65 93.309 -11.985 29.860 1.00 58.84 C ATOM 626 CG ASN A 65 92.862 -12.370 31.241 1.00 60.86 C ATOM 627 OD1 ASN A 65 92.403 -13.487 31.462 1.00 65.29 O ATOM 628 ND2 ASN A 65 92.916 -11.438 32.152 1.00 63.33 N ATOM 629 HD22 ASN A 65 93.314 -10.506 31.919 1.00 0.00 H ATOM 630 HD21 ASN A 65 92.561 -11.627 33.111 1.00 0.00 H ATOM 631 H ASN A 65 94.001 -14.417 29.519 1.00 0.00 H ATOM 632 N LEU A 66 91.871 -11.600 26.865 1.00 54.78 N ATOM 633 CA LEU A 66 91.983 -10.957 25.548 1.00 53.80 C ATOM 634 C LEU A 66 91.626 -9.495 25.651 1.00 52.91 C ATOM 635 O LEU A 66 90.854 -9.081 26.524 1.00 57.28 O ATOM 636 CB LEU A 66 91.055 -11.607 24.529 1.00 54.68 C ATOM 637 CG LEU A 66 91.077 -13.130 24.393 1.00 56.96 C ATOM 638 CD1 LEU A 66 89.878 -13.580 23.563 1.00 58.75 C ATOM 639 CD2 LEU A 66 92.374 -13.591 23.736 1.00 57.80 C ATOM 640 H LEU A 66 90.968 -11.551 27.378 1.00 0.00 H ATOM 641 N ALA A 67 92.165 -8.723 24.731 1.00 49.86 N ATOM 642 CA ALA A 67 91.767 -7.348 24.513 1.00 49.37 C ATOM 643 C ALA A 67 91.387 -7.255 23.043 1.00 49.70 C ATOM 644 O ALA A 67 92.252 -7.138 22.194 1.00 50.91 O ATOM 645 CB ALA A 67 92.928 -6.412 24.836 1.00 49.70 C ATOM 646 H ALA A 67 92.915 -9.121 24.130 1.00 0.00 H ATOM 647 N MET A 68 90.101 -7.349 22.729 1.00 48.46 N ATOM 648 CA MET A 68 89.691 -7.321 21.327 1.00 47.77 C ATOM 649 C MET A 68 89.283 -5.902 20.930 1.00 46.85 C ATOM 650 O MET A 68 88.347 -5.330 21.496 1.00 46.56 O ATOM 651 CB MET A 68 88.528 -8.277 21.111 1.00 48.56 C ATOM 652 CG MET A 68 88.806 -9.731 21.468 1.00 51.22 C ATOM 653 SD MET A 68 87.404 -10.819 21.060 1.00 50.29 S ATOM 654 CE MET A 68 86.205 -10.253 22.262 1.00 56.28 C ATOM 655 H MET A 68 89.387 -7.442 23.479 1.00 0.00 H ATOM 656 N GLY A 69 90.016 -5.314 19.995 1.00 45.56 N ATOM 657 CA GLY A 69 89.675 -4.001 19.449 1.00 44.46 C ATOM 658 C GLY A 69 88.537 -4.112 18.458 1.00 44.61 C ATOM 659 O GLY A 69 88.683 -4.756 17.396 1.00 44.52 O ATOM 660 H GLY A 69 90.862 -5.803 19.638 1.00 0.00 H ATOM 661 N VAL A 70 87.424 -3.432 18.738 1.00 44.84 N ATOM 662 CA VAL A 70 86.194 -3.610 17.935 1.00 43.73 C ATOM 663 C VAL A 70 85.661 -2.272 17.426 1.00 43.29 C ATOM 664 O VAL A 70 85.559 -1.298 18.175 1.00 43.79 O ATOM 665 CB VAL A 70 85.093 -4.268 18.779 1.00 47.23 C ATOM 666 CG1 VAL A 70 83.775 -4.342 17.996 1.00 45.14 C ATOM 667 CG2 VAL A 70 85.542 -5.637 19.256 1.00 48.39 C ATOM 668 H VAL A 70 87.421 -2.764 19.535 1.00 0.00 H ATOM 669 N ASN A 71 85.350 -2.222 16.145 1.00 43.01 N ATOM 670 CA ASN A 71 84.601 -1.127 15.566 1.00 42.79 C ATOM 671 C ASN A 71 83.133 -1.343 15.897 1.00 41.81 C ATOM 672 O ASN A 71 82.532 -2.316 15.439 1.00 40.40 O ATOM 673 CB ASN A 71 84.809 -1.109 14.046 1.00 44.93 C ATOM 674 CG ASN A 71 83.990 -0.041 13.367 1.00 48.11 C ATOM 675 OD1 ASN A 71 82.859 0.246 13.769 1.00 48.21 O ATOM 676 ND2 ASN A 71 84.560 0.577 12.341 1.00 49.52 N ATOM 677 HD22 ASN A 71 85.516 0.304 12.035 1.00 0.00 H ATOM 678 HD21 ASN A 71 84.051 1.335 11.843 1.00 0.00 H ATOM 679 H ASN A 71 85.655 -3.000 15.526 1.00 0.00 H ATOM 680 N LEU A 72 82.574 -0.492 16.757 1.00 43.39 N ATOM 681 CA LEU A 72 81.250 -0.760 17.319 1.00 42.32 C ATOM 682 C LEU A 72 80.143 -0.603 16.276 1.00 42.19 C ATOM 683 O LEU A 72 79.106 -1.272 16.365 1.00 41.45 O ATOM 684 CB LEU A 72 80.963 0.130 18.540 1.00 43.42 C ATOM 685 CG LEU A 72 81.891 -0.035 19.748 1.00 44.91 C ATOM 686 CD1 LEU A 72 81.303 0.684 20.949 1.00 47.04 C ATOM 687 CD2 LEU A 72 82.082 -1.500 20.081 1.00 46.14 C ATOM 688 H LEU A 72 83.084 0.372 17.031 1.00 0.00 H ATOM 689 N THR A 73 80.388 0.254 15.287 1.00 43.27 N ATOM 690 CA THR A 73 79.515 0.393 14.112 1.00 43.92 C ATOM 691 C THR A 73 79.418 -0.912 13.360 1.00 41.05 C ATOM 692 O THR A 73 78.329 -1.357 13.020 1.00 40.43 O ATOM 693 CB THR A 73 80.013 1.519 13.175 1.00 48.22 C ATOM 694 OG1 THR A 73 79.902 2.765 13.864 1.00 49.80 O ATOM 695 CG2 THR A 73 79.177 1.602 11.896 1.00 49.75 C ATOM 696 HG1 THR A 73 80.218 3.496 13.275 1.00 0.00 H ATOM 697 H THR A 73 81.236 0.853 15.348 1.00 0.00 H ATOM 698 N SER A 74 80.546 -1.594 13.223 1.00 40.03 N ATOM 699 CA SER A 74 80.576 -2.875 12.515 1.00 38.99 C ATOM 700 C SER A 74 79.891 -3.971 13.308 1.00 36.27 C ATOM 701 O SER A 74 79.115 -4.758 12.776 1.00 33.25 O ATOM 702 CB SER A 74 82.019 -3.269 12.228 1.00 41.13 C ATOM 703 OG SER A 74 82.576 -2.312 11.347 1.00 43.37 O ATOM 704 HG SER A 74 83.516 -2.554 11.150 1.00 0.00 H ATOM 705 H SER A 74 81.426 -1.212 13.626 1.00 0.00 H ATOM 706 N MET A 75 80.130 -3.981 14.608 1.00 33.57 N ATOM 707 CA MET A 75 79.535 -5.005 15.417 1.00 32.96 C ATOM 708 C MET A 75 78.021 -4.817 15.458 1.00 31.34 C ATOM 709 O MET A 75 77.266 -5.799 15.522 1.00 30.22 O ATOM 710 CB MET A 75 80.166 -4.989 16.817 1.00 33.73 C ATOM 711 CG MET A 75 79.838 -6.218 17.625 1.00 34.32 C ATOM 712 SD MET A 75 80.679 -6.173 19.225 1.00 36.31 S ATOM 713 CE MET A 75 80.096 -7.687 19.952 1.00 34.99 C ATOM 714 H MET A 75 80.740 -3.257 15.038 1.00 0.00 H ATOM 715 N SER A 76 77.583 -3.559 15.495 1.00 32.51 N ATOM 716 CA SER A 76 76.159 -3.216 15.503 1.00 32.98 C ATOM 717 C SER A 76 75.464 -3.704 14.245 1.00 34.09 C ATOM 718 O SER A 76 74.365 -4.279 14.308 1.00 33.14 O ATOM 719 CB SER A 76 75.956 -1.681 15.655 1.00 35.50 C ATOM 720 OG SER A 76 74.657 -1.287 15.204 1.00 36.49 O ATOM 721 HG SER A 76 74.553 -1.528 14.249 1.00 0.00 H ATOM 722 H SER A 76 78.281 -2.789 15.519 1.00 0.00 H ATOM 723 N LYS A 77 76.119 -3.504 13.107 1.00 33.69 N ATOM 724 CA LYS A 77 75.571 -3.981 11.846 1.00 34.87 C ATOM 725 C LYS A 77 75.377 -5.480 11.858 1.00 33.79 C ATOM 726 O LYS A 77 74.362 -5.990 11.359 1.00 31.89 O ATOM 727 CB LYS A 77 76.474 -3.588 10.686 1.00 37.65 C ATOM 728 CG LYS A 77 76.365 -2.122 10.334 1.00 41.87 C ATOM 729 CD LYS A 77 77.308 -1.784 9.179 1.00 48.17 C ATOM 730 CE LYS A 77 77.292 -0.295 8.891 1.00 53.46 C ATOM 731 NZ LYS A 77 78.500 0.119 8.119 1.00 58.31 N ATOM 732 HZ1 LYS A 77 79.354 -0.104 8.669 1.00 0.00 H ATOM 733 HZ2 LYS A 77 78.525 -0.394 7.215 1.00 0.00 H ATOM 734 HZ3 LYS A 77 78.460 1.142 7.938 1.00 0.00 H ATOM 735 H LYS A 77 77.030 -3.003 13.117 1.00 0.00 H ATOM 736 N ILE A 78 76.356 -6.195 12.406 1.00 32.20 N ATOM 737 CA ILE A 78 76.265 -7.657 12.526 1.00 32.82 C ATOM 738 C ILE A 78 75.145 -8.077 13.476 1.00 31.99 C ATOM 739 O ILE A 78 74.376 -8.949 13.161 1.00 33.42 O ATOM 740 CB ILE A 78 77.635 -8.255 12.987 1.00 34.45 C ATOM 741 CG1 ILE A 78 78.629 -8.181 11.827 1.00 33.98 C ATOM 742 CG2 ILE A 78 77.495 -9.710 13.436 1.00 35.61 C ATOM 743 CD1 ILE A 78 80.060 -8.463 12.208 1.00 34.29 C ATOM 744 H ILE A 78 77.205 -5.708 12.758 1.00 0.00 H ATOM 745 N LEU A 79 75.051 -7.437 14.638 1.00 33.72 N ATOM 746 CA LEU A 79 74.025 -7.821 15.612 1.00 34.76 C ATOM 747 C LEU A 79 72.624 -7.476 15.141 1.00 35.24 C ATOM 748 O LEU A 79 71.684 -8.114 15.558 1.00 35.35 O ATOM 749 CB LEU A 79 74.301 -7.199 16.965 1.00 35.17 C ATOM 750 CG LEU A 79 75.388 -7.972 17.707 1.00 36.93 C ATOM 751 CD1 LEU A 79 75.935 -7.096 18.796 1.00 39.10 C ATOM 752 CD2 LEU A 79 74.800 -9.259 18.295 1.00 39.20 C ATOM 753 H LEU A 79 75.708 -6.661 14.857 1.00 0.00 H ATOM 754 N LYS A 80 72.489 -6.500 14.249 1.00 37.48 N ATOM 755 CA LYS A 80 71.209 -6.274 13.598 1.00 37.93 C ATOM 756 C LYS A 80 70.763 -7.421 12.724 1.00 36.38 C ATOM 757 O LYS A 80 69.570 -7.513 12.409 1.00 34.92 O ATOM 758 CB LYS A 80 71.186 -4.953 12.819 1.00 41.86 C ATOM 759 CG LYS A 80 71.043 -3.763 13.744 1.00 46.69 C ATOM 760 CD LYS A 80 71.240 -2.458 13.012 1.00 52.19 C ATOM 761 CE LYS A 80 71.051 -1.307 14.005 1.00 57.37 C ATOM 762 NZ LYS A 80 71.085 0.028 13.351 1.00 60.83 N ATOM 763 HZ1 LYS A 80 72.004 0.159 12.882 1.00 0.00 H ATOM 764 HZ2 LYS A 80 70.323 0.087 12.646 1.00 0.00 H ATOM 765 HZ3 LYS A 80 70.952 0.768 14.069 1.00 0.00 H ATOM 766 H LYS A 80 73.302 -5.895 14.016 1.00 0.00 H ATOM 767 N CYS A 81 71.671 -8.325 12.356 1.00 34.71 N ATOM 768 CA CYS A 81 71.278 -9.532 11.626 1.00 34.94 C ATOM 769 C CYS A 81 70.776 -10.672 12.500 1.00 36.20 C ATOM 770 O CYS A 81 70.405 -11.746 11.980 1.00 36.84 O ATOM 771 CB CYS A 81 72.435 -10.045 10.781 1.00 36.50 C ATOM 772 SG CYS A 81 73.065 -8.794 9.646 1.00 36.03 S ATOM 773 H CYS A 81 72.672 -8.171 12.591 1.00 0.00 H ATOM 774 N ALA A 82 70.777 -10.462 13.818 1.00 33.70 N ATOM 775 CA ALA A 82 70.193 -11.411 14.739 1.00 33.50 C ATOM 776 C ALA A 82 68.720 -11.052 14.987 1.00 34.20 C ATOM 777 O ALA A 82 68.365 -9.876 15.153 1.00 32.80 O ATOM 778 CB ALA A 82 70.983 -11.380 16.060 1.00 33.66 C ATOM 779 H ALA A 82 71.209 -9.593 14.192 1.00 0.00 H ATOM 780 N GLY A 83 67.871 -12.066 15.048 1.00 34.89 N ATOM 781 CA GLY A 83 66.526 -11.877 15.566 1.00 37.16 C ATOM 782 C GLY A 83 66.542 -11.622 17.072 1.00 38.22 C ATOM 783 O GLY A 83 67.465 -12.025 17.781 1.00 34.01 O ATOM 784 H GLY A 83 68.169 -13.007 14.722 1.00 0.00 H ATOM 785 N ASN A 84 65.475 -10.993 17.562 1.00 44.53 N ATOM 786 CA ASN A 84 65.375 -10.643 18.979 1.00 47.11 C ATOM 787 C ASN A 84 65.306 -11.857 19.915 1.00 46.10 C ATOM 788 O ASN A 84 65.657 -11.736 21.091 1.00 45.18 O ATOM 789 CB ASN A 84 64.134 -9.773 19.222 1.00 52.65 C ATOM 790 CG ASN A 84 64.251 -8.408 18.581 1.00 54.83 C ATOM 791 OD1 ASN A 84 65.294 -7.768 18.649 1.00 56.09 O ATOM 792 ND2 ASN A 84 63.170 -7.953 17.960 1.00 59.32 N ATOM 793 HD22 ASN A 84 62.307 -8.532 17.928 1.00 0.00 H ATOM 794 HD21 ASN A 84 63.186 -7.018 17.506 1.00 0.00 H ATOM 795 H ASN A 84 64.694 -10.745 16.922 1.00 0.00 H ATOM 796 N GLU A 85 64.818 -12.993 19.401 1.00 43.73 N ATOM 797 CA GLU A 85 64.717 -14.223 20.183 1.00 43.56 C ATOM 798 C GLU A 85 65.916 -15.152 19.960 1.00 41.42 C ATOM 799 O GLU A 85 65.885 -16.284 20.397 1.00 42.32 O ATOM 800 CB GLU A 85 63.436 -14.999 19.817 1.00 45.70 C ATOM 801 CG GLU A 85 62.119 -14.218 19.807 1.00 47.51 C ATOM 802 CD GLU A 85 62.045 -13.059 20.786 1.00 48.27 C ATOM 803 OE1 GLU A 85 61.382 -12.049 20.448 1.00 47.88 O ATOM 804 OE2 GLU A 85 62.648 -13.141 21.882 1.00 50.48 O ATOM 805 H GLU A 85 64.500 -13.000 18.411 1.00 0.00 H ATOM 806 N ASP A 86 66.952 -14.698 19.255 1.00 37.29 N ATOM 807 CA ASP A 86 68.089 -15.565 18.945 1.00 36.09 C ATOM 808 C ASP A 86 68.950 -15.868 20.157 1.00 36.51 C ATOM 809 O ASP A 86 69.097 -15.031 21.055 1.00 36.71 O ATOM 810 CB ASP A 86 68.987 -14.976 17.849 1.00 35.07 C ATOM 811 CG ASP A 86 68.393 -15.128 16.450 1.00 35.49 C ATOM 812 OD1 ASP A 86 67.250 -15.599 16.318 1.00 34.82 O ATOM 813 OD2 ASP A 86 69.051 -14.700 15.487 1.00 36.88 O ATOM 814 H ASP A 86 66.952 -13.713 18.920 1.00 0.00 H ATOM 815 N ILE A 87 69.511 -17.074 20.163 1.00 36.21 N ATOM 816 CA ILE A 87 70.608 -17.421 21.057 1.00 35.28 C ATOM 817 C ILE A 87 71.888 -16.994 20.350 1.00 34.58 C ATOM 818 O ILE A 87 72.106 -17.333 19.164 1.00 33.80 O ATOM 819 CB ILE A 87 70.634 -18.936 21.306 1.00 36.88 C ATOM 820 CG1 ILE A 87 69.355 -19.369 22.029 1.00 38.57 C ATOM 821 CG2 ILE A 87 71.864 -19.328 22.089 1.00 37.46 C ATOM 822 CD1 ILE A 87 68.990 -20.819 21.810 1.00 39.65 C ATOM 823 H ILE A 87 69.153 -17.796 19.505 1.00 0.00 H ATOM 824 N ILE A 88 72.693 -16.205 21.032 1.00 31.78 N ATOM 825 CA ILE A 88 73.871 -15.628 20.430 1.00 32.19 C ATOM 826 C ILE A 88 75.119 -16.144 21.166 1.00 33.18 C ATOM 827 O ILE A 88 75.208 -16.069 22.407 1.00 32.27 O ATOM 828 CB ILE A 88 73.809 -14.081 20.448 1.00 31.79 C ATOM 829 CG1 ILE A 88 72.651 -13.587 19.591 1.00 32.30 C ATOM 830 CG2 ILE A 88 75.116 -13.495 19.959 1.00 33.37 C ATOM 831 CD1 ILE A 88 72.503 -12.080 19.556 1.00 32.85 C ATOM 832 H ILE A 88 72.475 -15.993 22.027 1.00 0.00 H ATOM 833 N THR A 89 76.065 -16.673 20.397 1.00 32.60 N ATOM 834 CA THR A 89 77.338 -17.143 20.929 1.00 33.46 C ATOM 835 C THR A 89 78.478 -16.333 20.354 1.00 34.36 C ATOM 836 O THR A 89 78.545 -16.036 19.115 1.00 30.54 O ATOM 837 CB THR A 89 77.552 -18.634 20.618 1.00 35.01 C ATOM 838 OG1 THR A 89 76.502 -19.370 21.221 1.00 36.20 O ATOM 839 CG2 THR A 89 78.896 -19.160 21.201 1.00 36.71 C ATOM 840 HG1 THR A 89 75.634 -19.067 20.853 1.00 0.00 H ATOM 841 H THR A 89 75.890 -16.755 19.375 1.00 0.00 H ATOM 842 N LEU A 90 79.342 -15.877 21.252 1.00 33.18 N ATOM 843 CA LEU A 90 80.529 -15.166 20.842 1.00 35.53 C ATOM 844 C LEU A 90 81.677 -16.142 20.972 1.00 40.23 C ATOM 845 O LEU A 90 81.814 -16.806 22.020 1.00 38.30 O ATOM 846 CB LEU A 90 80.785 -13.947 21.741 1.00 36.94 C ATOM 847 CG LEU A 90 79.689 -12.887 21.827 1.00 37.36 C ATOM 848 CD1 LEU A 90 80.083 -11.830 22.845 1.00 38.45 C ATOM 849 CD2 LEU A 90 79.444 -12.252 20.463 1.00 36.14 C ATOM 850 H LEU A 90 79.161 -16.034 22.264 1.00 0.00 H ATOM 851 N ARG A 91 82.571 -16.143 19.993 1.00 39.83 N ATOM 852 CA ARG A 91 83.677 -17.084 20.029 1.00 46.03 C ATOM 853 C ARG A 91 84.943 -16.528 19.412 1.00 45.36 C ATOM 854 O ARG A 91 84.911 -15.895 18.355 1.00 40.85 O ATOM 855 CB ARG A 91 83.289 -18.346 19.285 1.00 51.38 C ATOM 856 CG ARG A 91 83.888 -19.595 19.907 1.00 59.80 C ATOM 857 CD ARG A 91 84.087 -20.721 18.905 1.00 61.55 C ATOM 858 NE ARG A 91 83.036 -20.786 17.889 1.00 65.82 N ATOM 859 CZ ARG A 91 81.803 -21.267 18.069 1.00 66.45 C ATOM 860 NH1 ARG A 91 81.391 -21.699 19.257 1.00 63.35 N ATOM 861 NH2 ARG A 91 80.978 -21.350 17.024 1.00 71.08 N ATOM 862 HE ARG A 91 83.270 -20.425 16.942 1.00 0.00 H ATOM 863 HH12 ARG A 91 80.426 -22.069 19.370 1.00 0.00 H ATOM 864 HH11 ARG A 91 82.034 -21.667 20.074 1.00 0.00 H ATOM 865 HH22 ARG A 91 80.015 -21.723 17.150 1.00 0.00 H ATOM 866 HH21 ARG A 91 81.298 -21.042 16.083 1.00 0.00 H ATOM 867 H ARG A 91 82.481 -15.473 19.203 1.00 0.00 H ATOM 868 N ALA A 92 86.072 -16.765 20.072 1.00 47.98 N ATOM 869 CA ALA A 92 87.360 -16.519 19.452 1.00 50.49 C ATOM 870 C ALA A 92 88.116 -17.841 19.524 1.00 56.96 C ATOM 871 O ALA A 92 88.424 -18.327 20.607 1.00 59.58 O ATOM 872 CB ALA A 92 88.089 -15.343 20.097 1.00 52.01 C ATOM 873 H ALA A 92 86.031 -17.131 21.045 1.00 0.00 H ATOM 874 N GLU A 93 88.243 -18.497 18.367 1.00 59.57 N ATOM 875 CA GLU A 93 88.952 -19.769 18.275 1.00 63.62 C ATOM 876 C GLU A 93 90.384 -19.573 18.783 1.00 61.72 C ATOM 877 O GLU A 93 90.942 -18.476 18.708 1.00 60.74 O ATOM 878 CB GLU A 93 89.045 -20.259 16.822 1.00 68.09 C ATOM 879 CG GLU A 93 87.726 -20.393 16.053 1.00 68.73 C ATOM 880 CD GLU A 93 87.156 -21.821 16.103 1.00 70.15 C ATOM 881 OE1 GLU A 93 86.655 -22.398 15.090 1.00 72.68 O ATOM 882 OE2 GLU A 93 87.200 -22.383 17.205 1.00 73.99 O ATOM 883 H GLU A 93 87.824 -18.089 17.507 1.00 0.00 H ATOM 884 N ASP A 94 90.986 -20.667 19.225 1.00 66.88 N ATOM 885 CA ASP A 94 92.226 -20.655 20.036 1.00 70.65 C ATOM 886 C ASP A 94 93.326 -19.625 19.716 1.00 72.65 C ATOM 887 O ASP A 94 93.971 -19.091 20.627 1.00 87.69 O ATOM 888 CB ASP A 94 92.824 -22.073 20.076 1.00 70.29 C ATOM 889 CG ASP A 94 92.223 -22.933 21.184 1.00 71.01 C ATOM 890 OD1 ASP A 94 92.113 -22.433 22.329 1.00 73.14 O ATOM 891 OD2 ASP A 94 91.905 -24.114 20.926 1.00 69.42 O ATOM 892 H ASP A 94 90.564 -21.588 18.989 1.00 0.00 H ATOM 893 N ASN A 95 93.568 -19.348 18.454 1.00 70.69 N ATOM 894 CA ASN A 95 94.551 -18.343 18.114 1.00 70.33 C ATOM 895 C ASN A 95 94.109 -17.505 16.905 1.00 70.82 C ATOM 896 O ASN A 95 94.933 -16.964 16.185 1.00 70.47 O ATOM 897 CB ASN A 95 95.889 -19.051 17.889 1.00 70.04 C ATOM 898 CG ASN A 95 96.543 -19.540 19.192 1.00 71.61 C ATOM 899 OD1 ASN A 95 96.743 -18.776 20.136 1.00 65.83 O ATOM 900 ND2 ASN A 95 96.922 -20.810 19.221 1.00 71.49 N ATOM 901 HD22 ASN A 95 96.736 -21.427 18.405 1.00 0.00 H ATOM 902 HD21 ASN A 95 97.405 -21.189 20.060 1.00 0.00 H ATOM 903 H ASN A 95 93.054 -19.850 17.702 1.00 0.00 H ATOM 904 N ALA A 96 92.802 -17.301 16.759 1.00 72.99 N ATOM 905 CA ALA A 96 92.276 -16.397 15.723 1.00 71.89 C ATOM 906 C ALA A 96 92.429 -14.931 16.144 1.00 68.04 C ATOM 907 O ALA A 96 92.625 -14.635 17.320 1.00 68.11 O ATOM 908 CB ALA A 96 90.810 -16.721 15.448 1.00 73.84 C ATOM 909 H ALA A 96 92.137 -17.791 17.391 1.00 0.00 H ATOM 910 N ASP A 97 92.311 -14.023 15.167 1.00 63.92 N ATOM 911 CA ASP A 97 92.247 -12.575 15.419 1.00 60.01 C ATOM 912 C ASP A 97 90.958 -11.954 14.860 1.00 59.30 C ATOM 913 O ASP A 97 90.985 -10.783 14.479 1.00 58.94 O ATOM 914 CB ASP A 97 93.425 -11.878 14.729 1.00 59.23 C ATOM 915 CG ASP A 97 93.711 -12.449 13.349 1.00 57.96 C ATOM 916 OD1 ASP A 97 92.755 -12.667 12.568 1.00 53.96 O ATOM 917 OD2 ASP A 97 94.899 -12.694 13.052 1.00 59.29 O ATOM 918 H ASP A 97 92.262 -14.357 14.183 1.00 0.00 H ATOM 919 N THR A 98 89.890 -12.715 14.784 1.00 54.76 N ATOM 920 CA THR A 98 88.601 -12.185 14.444 1.00 51.49 C ATOM 921 C THR A 98 87.733 -12.554 15.641 1.00 45.88 C ATOM 922 O THR A 98 88.147 -13.346 16.488 1.00 42.95 O ATOM 923 CB THR A 98 88.116 -12.874 13.173 1.00 52.19 C ATOM 924 OG1 THR A 98 88.199 -14.288 13.363 1.00 53.54 O ATOM 925 CG2 THR A 98 88.998 -12.489 12.000 1.00 53.72 C ATOM 926 HG1 THR A 98 87.887 -14.749 12.544 1.00 0.00 H ATOM 927 H THR A 98 89.982 -13.733 14.976 1.00 0.00 H ATOM 928 N LEU A 99 86.542 -11.976 15.710 1.00 41.82 N ATOM 929 CA LEU A 99 85.549 -12.441 16.658 1.00 39.24 C ATOM 930 C LEU A 99 84.448 -13.091 15.850 1.00 38.32 C ATOM 931 O LEU A 99 83.959 -12.501 14.877 1.00 36.70 O ATOM 932 CB LEU A 99 85.031 -11.269 17.471 1.00 39.39 C ATOM 933 CG LEU A 99 83.885 -11.593 18.420 1.00 40.11 C ATOM 934 CD1 LEU A 99 84.301 -12.645 19.431 1.00 38.98 C ATOM 935 CD2 LEU A 99 83.383 -10.341 19.125 1.00 41.14 C ATOM 936 H LEU A 99 86.318 -11.181 15.078 1.00 0.00 H ATOM 937 N ALA A 100 84.108 -14.332 16.186 1.00 36.25 N ATOM 938 CA ALA A 100 82.985 -15.008 15.544 1.00 36.10 C ATOM 939 C ALA A 100 81.707 -14.830 16.365 1.00 34.72 C ATOM 940 O ALA A 100 81.736 -14.772 17.606 1.00 32.12 O ATOM 941 CB ALA A 100 83.287 -16.480 15.349 1.00 36.67 C ATOM 942 H ALA A 100 84.652 -14.830 16.919 1.00 0.00 H ATOM 943 N LEU A 101 80.610 -14.609 15.662 1.00 33.66 N ATOM 944 CA LEU A 101 79.276 -14.540 16.273 1.00 32.97 C ATOM 945 C LEU A 101 78.445 -15.621 15.622 1.00 32.87 C ATOM 946 O LEU A 101 78.305 -15.640 14.387 1.00 32.81 O ATOM 947 CB LEU A 101 78.655 -13.119 16.107 1.00 33.18 C ATOM 948 CG LEU A 101 79.466 -11.962 16.724 1.00 33.23 C ATOM 949 CD1 LEU A 101 80.478 -11.366 15.751 1.00 33.68 C ATOM 950 CD2 LEU A 101 78.567 -10.849 17.253 1.00 32.86 C ATOM 951 H LEU A 101 80.695 -14.479 14.634 1.00 0.00 H ATOM 952 N VAL A 102 77.767 -16.422 16.442 1.00 31.69 N ATOM 953 CA VAL A 102 76.791 -17.394 15.965 1.00 32.36 C ATOM 954 C VAL A 102 75.367 -17.100 16.455 1.00 31.53 C ATOM 955 O VAL A 102 75.143 -16.876 17.663 1.00 31.71 O ATOM 956 CB VAL A 102 77.192 -18.817 16.395 1.00 32.98 C ATOM 957 CG1 VAL A 102 76.242 -19.838 15.771 1.00 32.80 C ATOM 958 CG2 VAL A 102 78.638 -19.116 15.976 1.00 33.88 C ATOM 959 H VAL A 102 77.941 -16.351 17.465 1.00 0.00 H ATOM 960 N PHE A 103 74.404 -17.029 15.539 1.00 31.08 N ATOM 961 CA PHE A 103 72.997 -16.732 15.903 1.00 31.85 C ATOM 962 C PHE A 103 72.167 -17.976 15.600 1.00 33.97 C ATOM 963 O PHE A 103 72.039 -18.378 14.425 1.00 34.69 O ATOM 964 CB PHE A 103 72.415 -15.534 15.101 1.00 31.23 C ATOM 965 CG PHE A 103 73.274 -14.288 15.094 1.00 30.85 C ATOM 966 CD1 PHE A 103 74.064 -13.949 16.161 1.00 29.16 C ATOM 967 CD2 PHE A 103 73.197 -13.387 14.030 1.00 29.96 C ATOM 968 CE1 PHE A 103 74.831 -12.796 16.138 1.00 29.37 C ATOM 969 CE2 PHE A 103 73.949 -12.230 14.018 1.00 29.02 C ATOM 970 CZ PHE A 103 74.767 -11.936 15.069 1.00 28.73 C ATOM 971 H PHE A 103 74.645 -17.186 14.540 1.00 0.00 H ATOM 972 N GLU A 104 71.563 -18.562 16.628 1.00 35.52 N ATOM 973 CA GLU A 104 70.650 -19.681 16.458 1.00 38.10 C ATOM 974 C GLU A 104 69.221 -19.237 16.688 1.00 41.91 C ATOM 975 O GLU A 104 68.896 -18.685 17.748 1.00 40.94 O ATOM 976 CB GLU A 104 70.961 -20.812 17.432 1.00 40.35 C ATOM 977 CG GLU A 104 72.367 -21.374 17.272 1.00 41.84 C ATOM 978 CD GLU A 104 72.747 -22.317 18.423 1.00 43.35 C ATOM 979 OE1 GLU A 104 73.501 -21.913 19.336 1.00 41.32 O ATOM 980 OE2 GLU A 104 72.211 -23.430 18.452 1.00 43.63 O ATOM 981 H GLU A 104 71.750 -18.208 17.588 1.00 0.00 H ATOM 982 N ALA A 105 68.389 -19.391 15.653 1.00 43.77 N ATOM 983 CA ALA A 105 66.953 -19.097 15.785 1.00 47.45 C ATOM 984 C ALA A 105 66.271 -20.253 16.539 1.00 52.20 C ATOM 985 O ALA A 105 66.439 -21.406 16.149 1.00 55.27 O ATOM 986 CB ALA A 105 66.358 -18.901 14.411 1.00 44.57 C ATOM 987 H ALA A 105 68.762 -19.724 14.741 1.00 0.00 H ATOM 988 N PRO A 106 65.649 -19.979 17.704 1.00 59.96 N ATOM 989 CA PRO A 106 65.235 -21.122 18.534 1.00 62.20 C ATOM 990 C PRO A 106 63.982 -21.843 18.036 1.00 61.80 C ATOM 991 O PRO A 106 63.833 -23.036 18.266 1.00 60.57 O ATOM 992 CB PRO A 106 64.955 -20.489 19.903 1.00 63.32 C ATOM 993 CG PRO A 106 65.685 -19.197 19.893 1.00 63.51 C ATOM 994 CD PRO A 106 65.608 -18.720 18.476 1.00 63.12 C ATOM 995 N ASN A 107 63.119 -21.123 17.327 1.00 60.77 N ATOM 996 CA ASN A 107 61.916 -21.697 16.747 1.00 61.87 C ATOM 997 C ASN A 107 61.980 -21.749 15.215 1.00 60.10 C ATOM 998 O ASN A 107 60.957 -21.661 14.534 1.00 59.22 O ATOM 999 CB ASN A 107 60.688 -20.891 17.211 1.00 63.65 C ATOM 1000 CG ASN A 107 60.642 -20.717 18.727 1.00 66.00 C ATOM 1001 OD1 ASN A 107 60.696 -21.694 19.481 1.00 65.93 O ATOM 1002 ND2 ASN A 107 60.551 -19.473 19.179 1.00 67.56 N ATOM 1003 HD22 ASN A 107 60.508 -18.678 18.510 1.00 0.00 H ATOM 1004 HD21 ASN A 107 60.523 -19.292 20.203 1.00 0.00 H ATOM 1005 H ASN A 107 63.311 -20.111 17.182 1.00 0.00 H ATOM 1006 N GLN A 108 63.181 -21.927 14.677 1.00 56.52 N ATOM 1007 CA GLN A 108 63.372 -22.006 13.216 1.00 52.19 C ATOM 1008 C GLN A 108 64.668 -22.749 12.904 1.00 49.10 C ATOM 1009 O GLN A 108 65.586 -22.752 13.734 1.00 44.17 O ATOM 1010 CB GLN A 108 63.448 -20.596 12.662 1.00 53.21 C ATOM 1011 CG GLN A 108 63.507 -20.492 11.142 1.00 52.91 C ATOM 1012 CD GLN A 108 63.668 -19.050 10.693 1.00 53.56 C ATOM 1013 OE1 GLN A 108 63.902 -18.156 11.513 1.00 53.69 O ATOM 1014 NE2 GLN A 108 63.522 -18.811 9.400 1.00 55.02 N ATOM 1015 HE22 GLN A 108 63.326 -19.595 8.745 1.00 0.00 H ATOM 1016 HE21 GLN A 108 63.604 -17.839 9.038 1.00 0.00 H ATOM 1017 H GLN A 108 64.008 -22.013 15.301 1.00 0.00 H ATOM 1018 N GLU A 109 64.745 -23.381 11.736 1.00 48.10 N ATOM 1019 CA GLU A 109 65.954 -24.128 11.336 1.00 48.21 C ATOM 1020 C GLU A 109 66.907 -23.238 10.544 1.00 44.16 C ATOM 1021 O GLU A 109 67.181 -23.494 9.365 1.00 43.83 O ATOM 1022 CB GLU A 109 65.554 -25.364 10.519 1.00 53.41 C ATOM 1023 CG GLU A 109 64.739 -26.382 11.309 1.00 56.95 C ATOM 1024 CD GLU A 109 65.555 -27.045 12.407 1.00 59.83 C ATOM 1025 OE1 GLU A 109 66.809 -27.004 12.351 1.00 65.40 O ATOM 1026 OE2 GLU A 109 64.939 -27.603 13.333 1.00 64.00 O ATOM 1027 H GLU A 109 63.932 -23.348 11.088 1.00 0.00 H ATOM 1028 N LYS A 110 67.417 -22.212 11.222 1.00 40.04 N ATOM 1029 CA LYS A 110 68.300 -21.192 10.643 1.00 37.94 C ATOM 1030 C LYS A 110 69.467 -20.968 11.576 1.00 36.17 C ATOM 1031 O LYS A 110 69.302 -20.803 12.802 1.00 37.14 O ATOM 1032 CB LYS A 110 67.519 -19.880 10.457 1.00 38.00 C ATOM 1033 CG LYS A 110 68.316 -18.721 9.873 1.00 37.35 C ATOM 1034 CD LYS A 110 67.512 -17.416 9.890 1.00 38.40 C ATOM 1035 CE LYS A 110 68.271 -16.278 9.211 1.00 38.45 C ATOM 1036 NZ LYS A 110 67.549 -14.960 9.217 1.00 38.49 N ATOM 1037 HZ1 LYS A 110 66.642 -15.061 8.718 1.00 0.00 H ATOM 1038 HZ2 LYS A 110 67.375 -14.666 10.199 1.00 0.00 H ATOM 1039 HZ3 LYS A 110 68.132 -14.245 8.738 1.00 0.00 H ATOM 1040 H LYS A 110 67.174 -22.127 12.230 1.00 0.00 H ATOM 1041 N VAL A 111 70.668 -21.004 11.025 1.00 34.00 N ATOM 1042 CA VAL A 111 71.865 -20.704 11.785 1.00 32.32 C ATOM 1043 C VAL A 111 72.667 -19.712 10.950 1.00 31.77 C ATOM 1044 O VAL A 111 72.902 -19.941 9.742 1.00 30.24 O ATOM 1045 CB VAL A 111 72.706 -21.982 12.058 1.00 33.14 C ATOM 1046 CG1 VAL A 111 74.002 -21.647 12.819 1.00 32.28 C ATOM 1047 CG2 VAL A 111 71.867 -23.000 12.814 1.00 34.25 C ATOM 1048 H VAL A 111 70.756 -21.254 10.019 1.00 0.00 H ATOM 1049 N SER A 112 73.111 -18.650 11.604 1.00 31.74 N ATOM 1050 CA SER A 112 73.974 -17.653 10.983 1.00 32.51 C ATOM 1051 C SER A 112 75.311 -17.587 11.692 1.00 32.79 C ATOM 1052 O SER A 112 75.384 -17.600 12.947 1.00 33.34 O ATOM 1053 CB SER A 112 73.297 -16.282 11.030 1.00 32.51 C ATOM 1054 OG SER A 112 71.949 -16.359 10.572 1.00 32.74 O ATOM 1055 HG SER A 112 71.441 -16.983 11.148 1.00 0.00 H ATOM 1056 H SER A 112 72.834 -18.522 12.598 1.00 0.00 H ATOM 1057 N ASP A 113 76.377 -17.505 10.901 1.00 33.23 N ATOM 1058 CA ASP A 113 77.727 -17.265 11.406 1.00 34.61 C ATOM 1059 C ASP A 113 78.268 -15.983 10.807 1.00 35.01 C ATOM 1060 O ASP A 113 78.262 -15.827 9.553 1.00 32.92 O ATOM 1061 CB ASP A 113 78.650 -18.349 10.873 1.00 37.08 C ATOM 1062 CG ASP A 113 78.307 -19.691 11.396 1.00 39.28 C ATOM 1063 OD1 ASP A 113 78.693 -19.943 12.563 1.00 43.11 O ATOM 1064 OD2 ASP A 113 77.571 -20.437 10.715 1.00 38.51 O ATOM 1065 H ASP A 113 76.244 -17.617 9.876 1.00 0.00 H ATOM 1066 N TYR A 114 78.812 -15.134 11.661 1.00 32.35 N ATOM 1067 CA TYR A 114 79.471 -13.923 11.229 1.00 32.85 C ATOM 1068 C TYR A 114 80.873 -13.882 11.819 1.00 35.32 C ATOM 1069 O TYR A 114 81.127 -14.353 12.946 1.00 34.62 O ATOM 1070 CB TYR A 114 78.674 -12.676 11.663 1.00 31.90 C ATOM 1071 CG TYR A 114 77.321 -12.525 11.005 1.00 31.97 C ATOM 1072 CD1 TYR A 114 77.227 -11.937 9.750 1.00 33.31 C ATOM 1073 CD2 TYR A 114 76.174 -13.106 11.544 1.00 30.76 C ATOM 1074 CE1 TYR A 114 76.034 -11.875 9.067 1.00 32.64 C ATOM 1075 CE2 TYR A 114 74.978 -13.078 10.846 1.00 32.18 C ATOM 1076 CZ TYR A 114 74.916 -12.462 9.595 1.00 32.31 C ATOM 1077 OH TYR A 114 73.724 -12.371 8.886 1.00 31.67 O ATOM 1078 HH TYR A 114 73.378 -13.281 8.706 1.00 0.00 H ATOM 1079 H TYR A 114 78.764 -15.345 12.678 1.00 0.00 H ATOM 1080 N GLU A 115 81.816 -13.406 11.019 1.00 36.74 N ATOM 1081 CA GLU A 115 83.190 -13.249 11.458 1.00 38.45 C ATOM 1082 C GLU A 115 83.578 -11.798 11.278 1.00 38.05 C ATOM 1083 O GLU A 115 83.526 -11.245 10.167 1.00 36.19 O ATOM 1084 CB GLU A 115 84.104 -14.141 10.620 1.00 42.98 C ATOM 1085 CG GLU A 115 85.568 -14.081 10.999 1.00 46.57 C ATOM 1086 CD GLU A 115 86.424 -14.917 10.060 1.00 52.81 C ATOM 1087 OE1 GLU A 115 87.368 -14.349 9.460 1.00 62.08 O ATOM 1088 OE2 GLU A 115 86.101 -16.105 9.828 1.00 56.04 O ATOM 1089 H GLU A 115 81.564 -13.137 10.047 1.00 0.00 H ATOM 1090 N MET A 116 83.936 -11.168 12.381 1.00 36.06 N ATOM 1091 CA MET A 116 84.147 -9.763 12.412 1.00 37.32 C ATOM 1092 C MET A 116 85.635 -9.544 12.573 1.00 39.00 C ATOM 1093 O MET A 116 86.267 -10.061 13.503 1.00 37.19 O ATOM 1094 CB MET A 116 83.380 -9.145 13.601 1.00 38.96 C ATOM 1095 CG MET A 116 83.582 -7.655 13.754 1.00 39.73 C ATOM 1096 SD MET A 116 82.499 -6.969 15.023 1.00 42.15 S ATOM 1097 CE MET A 116 83.074 -7.747 16.516 1.00 40.27 C ATOM 1098 H MET A 116 84.068 -11.717 13.255 1.00 0.00 H ATOM 1099 N LYS A 117 86.170 -8.709 11.699 1.00 41.00 N ATOM 1100 CA LYS A 117 87.566 -8.327 11.753 1.00 43.70 C ATOM 1101 C LYS A 117 87.758 -7.410 12.941 1.00 43.47 C ATOM 1102 O LYS A 117 86.911 -6.534 13.202 1.00 39.90 O ATOM 1103 CB LYS A 117 87.936 -7.592 10.485 1.00 46.27 C ATOM 1104 CG LYS A 117 87.768 -8.439 9.234 1.00 49.21 C ATOM 1105 CD LYS A 117 88.321 -7.718 8.017 1.00 52.83 C ATOM 1106 CE LYS A 117 87.993 -8.486 6.743 1.00 56.22 C ATOM 1107 NZ LYS A 117 88.396 -7.687 5.553 1.00 61.01 N ATOM 1108 HZ1 LYS A 117 87.880 -6.784 5.553 1.00 0.00 H ATOM 1109 HZ2 LYS A 117 89.419 -7.504 5.590 1.00 0.00 H ATOM 1110 HZ3 LYS A 117 88.169 -8.217 4.688 1.00 0.00 H ATOM 1111 H LYS A 117 85.569 -8.313 10.948 1.00 0.00 H ATOM 1112 N LEU A 118 88.841 -7.647 13.680 1.00 43.86 N ATOM 1113 CA LEU A 118 89.199 -6.817 14.798 1.00 44.31 C ATOM 1114 C LEU A 118 90.194 -5.730 14.387 1.00 48.55 C ATOM 1115 O LEU A 118 90.682 -5.713 13.251 1.00 48.98 O ATOM 1116 CB LEU A 118 89.785 -7.689 15.907 1.00 45.23 C ATOM 1117 CG LEU A 118 88.806 -8.742 16.437 1.00 44.03 C ATOM 1118 CD1 LEU A 118 89.455 -9.596 17.510 1.00 44.51 C ATOM 1119 CD2 LEU A 118 87.535 -8.093 16.973 1.00 44.22 C ATOM 1120 H LEU A 118 89.446 -8.458 13.441 1.00 0.00 H ATOM 1121 N MET A 119 90.485 -4.808 15.299 1.00 52.34 N ATOM 1122 CA MET A 119 91.433 -3.730 15.005 1.00 58.80 C ATOM 1123 C MET A 119 92.406 -3.539 16.164 1.00 59.11 C ATOM 1124 O MET A 119 92.168 -4.029 17.260 1.00 57.46 O ATOM 1125 CB MET A 119 90.703 -2.426 14.633 1.00 61.81 C ATOM 1126 CG MET A 119 89.702 -1.907 15.653 1.00 65.06 C ATOM 1127 SD MET A 119 88.614 -0.618 14.994 1.00 68.40 S ATOM 1128 CE MET A 119 89.795 0.662 14.561 1.00 71.43 C ATOM 1129 H MET A 119 90.033 -4.852 16.235 1.00 0.00 H ATOM 1130 N ASP A 120 93.550 -2.922 15.881 1.00 62.61 N ATOM 1131 CA ASP A 120 94.545 -2.647 16.912 1.00 67.94 C ATOM 1132 C ASP A 120 94.285 -1.296 17.543 1.00 66.57 C ATOM 1133 O ASP A 120 94.260 -0.276 16.858 1.00 65.28 O ATOM 1134 CB ASP A 120 95.961 -2.691 16.346 1.00 74.95 C ATOM 1135 CG ASP A 120 96.445 -4.108 16.105 1.00 81.69 C ATOM 1136 OD1 ASP A 120 96.035 -5.019 16.856 1.00 88.50 O ATOM 1137 OD2 ASP A 120 97.231 -4.312 15.159 1.00 90.40 O ATOM 1138 H ASP A 120 93.740 -2.629 14.901 1.00 0.00 H ATOM 1139 N LEU A 121 94.021 -1.314 18.842 1.00 65.77 N ATOM 1140 CA LEU A 121 93.661 -0.111 19.572 1.00 68.44 C ATOM 1141 C LEU A 121 94.658 0.081 20.696 1.00 72.33 C ATOM 1142 O LEU A 121 94.925 -0.849 21.450 1.00 70.28 O ATOM 1143 CB LEU A 121 92.238 -0.230 20.146 1.00 66.83 C ATOM 1144 CG LEU A 121 91.084 -0.273 19.148 1.00 65.92 C ATOM 1145 CD1 LEU A 121 89.745 -0.290 19.867 1.00 65.15 C ATOM 1146 CD2 LEU A 121 91.156 0.910 18.197 1.00 67.93 C ATOM 1147 H LEU A 121 94.073 -2.218 19.354 1.00 0.00 H ATOM 1148 N ASP A 122 95.217 1.284 20.790 1.00 80.43 N ATOM 1149 CA ASP A 122 95.979 1.682 21.966 1.00 90.63 C ATOM 1150 C ASP A 122 95.116 2.617 22.800 1.00 94.03 C ATOM 1151 O ASP A 122 94.962 3.794 22.469 1.00 98.95 O ATOM 1152 CB ASP A 122 97.293 2.369 21.559 1.00 96.01 C ATOM 1153 CG ASP A 122 98.376 1.377 21.136 1.00 98.21 C ATOM 1154 OD1 ASP A 122 98.558 0.356 21.833 1.00101.52 O ATOM 1155 OD2 ASP A 122 99.057 1.623 20.116 1.00 99.04 O ATOM 1156 H ASP A 122 95.107 1.957 20.005 1.00 0.00 H ATOM 1157 N VAL A 123 94.482 2.058 23.827 1.00 97.59 N ATOM 1158 CA VAL A 123 93.724 2.844 24.797 1.00101.92 C ATOM 1159 C VAL A 123 94.472 2.897 26.130 1.00103.14 C ATOM 1160 O VAL A 123 94.897 1.869 26.665 1.00106.21 O ATOM 1161 CB VAL A 123 92.258 2.321 24.930 1.00103.95 C ATOM 1162 CG1 VAL A 123 92.083 1.205 25.963 1.00102.99 C ATOM 1163 CG2 VAL A 123 91.301 3.473 25.223 1.00105.03 C ATOM 1164 H VAL A 123 94.528 1.026 23.943 1.00 0.00 H ATOM 1165 N GLU A 124 94.755 4.110 26.597 1.00107.38 N ATOM 1166 CA GLU A 124 95.013 4.309 28.021 1.00113.07 C ATOM 1167 C GLU A 124 93.642 4.337 28.675 1.00108.22 C ATOM 1168 O GLU A 124 92.756 5.042 28.191 1.00104.48 O ATOM 1169 CB GLU A 124 95.748 5.641 28.287 1.00117.78 C ATOM 1170 CG GLU A 124 96.390 5.779 29.675 1.00121.49 C ATOM 1171 CD GLU A 124 95.607 6.671 30.632 1.00125.15 C ATOM 1172 OE1 GLU A 124 95.233 7.796 30.237 1.00127.63 O ATOM 1173 OE2 GLU A 124 95.400 6.270 31.799 1.00126.41 O ATOM 1174 H GLU A 124 94.793 4.920 25.946 1.00 0.00 H ATOM 1175 N GLN A 125 93.450 3.525 29.715 1.00103.60 N ATOM 1176 CA GLN A 125 92.203 3.534 30.484 1.00 96.58 C ATOM 1177 C GLN A 125 92.356 3.987 31.936 1.00 92.77 C ATOM 1178 O GLN A 125 93.414 3.875 32.574 1.00 91.11 O ATOM 1179 CB GLN A 125 91.491 2.179 30.425 1.00 96.90 C ATOM 1180 CG GLN A 125 92.393 0.999 30.746 1.00 95.65 C ATOM 1181 CD GLN A 125 91.625 -0.231 31.200 1.00 95.49 C ATOM 1182 OE1 GLN A 125 90.437 -0.396 30.904 1.00 90.56 O ATOM 1183 NE2 GLN A 125 92.303 -1.099 31.937 1.00 95.49 N ATOM 1184 HE22 GLN A 125 93.302 -0.921 32.163 1.00 0.00 H ATOM 1185 HE21 GLN A 125 91.836 -1.959 32.290 1.00 0.00 H ATOM 1186 H GLN A 125 94.207 2.866 29.988 1.00 0.00 H ATOM 1187 N LEU A 126 91.239 4.461 32.460 1.00 85.70 N ATOM 1188 CA LEU A 126 91.251 5.373 33.588 1.00 83.74 C ATOM 1189 C LEU A 126 90.799 4.676 34.859 1.00 78.98 C ATOM 1190 O LEU A 126 90.004 3.742 34.810 1.00 76.77 O ATOM 1191 CB LEU A 126 90.344 6.563 33.284 1.00 84.23 C ATOM 1192 CG LEU A 126 90.814 7.505 32.153 1.00 87.29 C ATOM 1193 CD1 LEU A 126 89.935 8.749 32.030 1.00 86.41 C ATOM 1194 CD2 LEU A 126 92.275 7.900 32.330 1.00 88.13 C ATOM 1195 H LEU A 126 90.327 4.172 32.053 1.00 0.00 H ATOM 1196 N GLY A 127 91.301 5.148 35.997 1.00 76.96 N ATOM 1197 CA GLY A 127 90.875 4.650 37.297 1.00 73.11 C ATOM 1198 C GLY A 127 89.613 5.367 37.728 1.00 73.16 C ATOM 1199 O GLY A 127 89.554 6.595 37.695 1.00 72.26 O ATOM 1200 H GLY A 127 92.021 5.897 35.957 1.00 0.00 H ATOM 1201 N ILE A 128 88.596 4.591 38.098 1.00 73.98 N ATOM 1202 CA ILE A 128 87.378 5.116 38.695 1.00 75.42 C ATOM 1203 C ILE A 128 87.532 5.041 40.209 1.00 78.16 C ATOM 1204 O ILE A 128 87.492 3.950 40.788 1.00 81.06 O ATOM 1205 CB ILE A 128 86.144 4.285 38.278 1.00 74.58 C ATOM 1206 CG1 ILE A 128 86.080 4.141 36.758 1.00 71.35 C ATOM 1207 CG2 ILE A 128 84.860 4.907 38.814 1.00 75.26 C ATOM 1208 CD1 ILE A 128 86.264 5.431 35.990 1.00 73.15 C ATOM 1209 H ILE A 128 88.676 3.564 37.954 1.00 0.00 H ATOM 1210 N PRO A 129 87.752 6.195 40.863 1.00 81.05 N ATOM 1211 CA PRO A 129 87.816 6.168 42.316 1.00 80.74 C ATOM 1212 C PRO A 129 86.416 5.879 42.834 1.00 82.97 C ATOM 1213 O PRO A 129 85.457 6.435 42.295 1.00 80.25 O ATOM 1214 CB PRO A 129 88.306 7.587 42.685 1.00 80.40 C ATOM 1215 CG PRO A 129 88.512 8.309 41.393 1.00 81.91 C ATOM 1216 CD PRO A 129 87.727 7.572 40.357 1.00 80.97 C ATOM 1217 N GLU A 130 86.281 4.935 43.770 1.00 86.29 N ATOM 1218 CA GLU A 130 85.053 4.841 44.554 1.00 85.54 C ATOM 1219 C GLU A 130 84.838 6.195 45.180 1.00 79.26 C ATOM 1220 O GLU A 130 85.788 6.811 45.662 1.00 77.20 O ATOM 1221 CB GLU A 130 85.135 3.792 45.668 1.00 92.86 C ATOM 1222 CG GLU A 130 83.911 3.783 46.581 1.00100.21 C ATOM 1223 CD GLU A 130 84.028 2.791 47.723 1.00105.09 C ATOM 1224 OE1 GLU A 130 84.922 2.972 48.575 1.00105.40 O ATOM 1225 OE2 GLU A 130 83.211 1.847 47.781 1.00106.26 O ATOM 1226 H GLU A 130 87.056 4.263 43.941 1.00 0.00 H ATOM 1227 N GLN A 131 83.608 6.685 45.110 1.00 71.05 N ATOM 1228 CA GLN A 131 83.211 7.766 45.965 1.00 68.04 C ATOM 1229 C GLN A 131 81.773 7.667 46.425 1.00 66.29 C ATOM 1230 O GLN A 131 81.012 6.788 46.014 1.00 65.65 O ATOM 1231 CB GLN A 131 83.522 9.111 45.315 1.00 71.07 C ATOM 1232 CG GLN A 131 82.661 9.528 44.147 1.00 72.10 C ATOM 1233 CD GLN A 131 82.696 11.033 43.970 1.00 74.91 C ATOM 1234 OE1 GLN A 131 83.483 11.574 43.192 1.00 75.54 O ATOM 1235 NE2 GLN A 131 81.869 11.726 44.746 1.00 78.22 N ATOM 1236 HE22 GLN A 131 81.220 11.229 45.389 1.00 0.00 H ATOM 1237 HE21 GLN A 131 81.871 12.765 44.710 1.00 0.00 H ATOM 1238 H GLN A 131 82.928 6.284 44.433 1.00 0.00 H ATOM 1239 N GLU A 132 81.447 8.517 47.383 1.00 66.82 N ATOM 1240 CA GLU A 132 80.084 8.668 47.840 1.00 63.12 C ATOM 1241 C GLU A 132 79.496 9.884 47.159 1.00 56.60 C ATOM 1242 O GLU A 132 80.199 10.850 46.893 1.00 56.12 O ATOM 1243 CB GLU A 132 80.025 8.794 49.365 1.00 65.21 C ATOM 1244 CG GLU A 132 80.272 7.455 50.051 1.00 68.66 C ATOM 1245 CD GLU A 132 79.118 6.471 49.867 1.00 69.21 C ATOM 1246 OE1 GLU A 132 77.983 6.752 50.301 1.00 68.06 O ATOM 1247 OE2 GLU A 132 79.356 5.391 49.295 1.00 67.92 O ATOM 1248 H GLU A 132 82.193 9.094 47.821 1.00 0.00 H ATOM 1249 N TYR A 133 78.206 9.816 46.861 1.00 47.60 N ATOM 1250 CA TYR A 133 77.522 10.888 46.156 1.00 44.14 C ATOM 1251 C TYR A 133 76.571 11.653 47.064 1.00 43.54 C ATOM 1252 O TYR A 133 76.024 11.099 48.013 1.00 40.91 O ATOM 1253 CB TYR A 133 76.803 10.283 44.959 1.00 43.19 C ATOM 1254 CG TYR A 133 77.768 9.830 43.895 1.00 41.84 C ATOM 1255 CD1 TYR A 133 78.325 10.742 43.024 1.00 41.75 C ATOM 1256 CD2 TYR A 133 78.203 8.515 43.835 1.00 41.89 C ATOM 1257 CE1 TYR A 133 79.209 10.334 42.026 1.00 43.41 C ATOM 1258 CE2 TYR A 133 79.127 8.103 42.888 1.00 41.59 C ATOM 1259 CZ TYR A 133 79.622 9.022 41.975 1.00 42.85 C ATOM 1260 OH TYR A 133 80.552 8.640 41.043 1.00 45.49 O ATOM 1261 HH TYR A 133 80.791 9.418 40.479 1.00 0.00 H ATOM 1262 H TYR A 133 77.667 8.971 47.140 1.00 0.00 H ATOM 1263 N SER A 134 76.436 12.949 46.816 1.00 42.84 N ATOM 1264 CA SER A 134 75.528 13.774 47.593 1.00 43.28 C ATOM 1265 C SER A 134 74.044 13.386 47.398 1.00 41.50 C ATOM 1266 O SER A 134 73.251 13.461 48.339 1.00 38.39 O ATOM 1267 CB SER A 134 75.700 15.234 47.198 1.00 44.82 C ATOM 1268 OG SER A 134 76.979 15.722 47.507 1.00 45.72 O ATOM 1269 HG SER A 134 77.044 16.671 47.233 1.00 0.00 H ATOM 1270 H SER A 134 76.991 13.383 46.051 1.00 0.00 H ATOM 1271 N CYS A 135 73.664 13.072 46.152 1.00 39.98 N ATOM 1272 CA CYS A 135 72.293 12.689 45.820 1.00 40.17 C ATOM 1273 C CYS A 135 72.313 11.507 44.874 1.00 38.33 C ATOM 1274 O CYS A 135 73.070 11.506 43.902 1.00 35.58 O ATOM 1275 CB CYS A 135 71.549 13.815 45.118 1.00 45.08 C ATOM 1276 SG CYS A 135 71.018 15.186 46.154 1.00 57.56 S ATOM 1277 H CYS A 135 74.372 13.102 45.391 1.00 0.00 H ATOM 1278 N VAL A 136 71.477 10.515 45.145 1.00 36.83 N ATOM 1279 CA VAL A 136 71.290 9.378 44.245 1.00 35.45 C ATOM 1280 C VAL A 136 69.793 9.243 44.037 1.00 34.30 C ATOM 1281 O VAL A 136 69.020 9.155 45.003 1.00 32.44 O ATOM 1282 CB VAL A 136 71.850 8.070 44.828 1.00 37.08 C ATOM 1283 CG1 VAL A 136 71.544 6.895 43.922 1.00 36.83 C ATOM 1284 CG2 VAL A 136 73.334 8.204 45.107 1.00 38.28 C ATOM 1285 H VAL A 136 70.934 10.546 46.031 1.00 0.00 H ATOM 1286 N VAL A 137 69.381 9.402 42.789 1.00 31.78 N ATOM 1287 CA VAL A 137 68.012 9.315 42.392 1.00 32.12 C ATOM 1288 C VAL A 137 67.844 8.029 41.590 1.00 32.81 C ATOM 1289 O VAL A 137 68.528 7.822 40.580 1.00 31.07 O ATOM 1290 CB VAL A 137 67.633 10.517 41.506 1.00 33.28 C ATOM 1291 CG1 VAL A 137 66.169 10.443 41.096 1.00 33.09 C ATOM 1292 CG2 VAL A 137 67.927 11.828 42.236 1.00 33.96 C ATOM 1293 H VAL A 137 70.093 9.601 42.058 1.00 0.00 H ATOM 1294 N LYS A 138 66.884 7.219 41.963 1.00 32.81 N ATOM 1295 CA LYS A 138 66.413 6.129 41.110 1.00 35.09 C ATOM 1296 C LYS A 138 65.015 6.483 40.600 1.00 33.51 C ATOM 1297 O LYS A 138 64.151 6.898 41.378 1.00 30.21 O ATOM 1298 CB LYS A 138 66.388 4.799 41.858 1.00 38.93 C ATOM 1299 CG LYS A 138 65.917 3.618 41.011 1.00 43.73 C ATOM 1300 CD LYS A 138 65.579 2.384 41.853 1.00 50.20 C ATOM 1301 CE LYS A 138 66.803 1.727 42.456 1.00 55.57 C ATOM 1302 NZ LYS A 138 67.436 0.747 41.529 1.00 57.75 N ATOM 1303 HZ1 LYS A 138 66.751 -0.000 41.296 1.00 0.00 H ATOM 1304 HZ2 LYS A 138 67.728 1.234 40.658 1.00 0.00 H ATOM 1305 HZ3 LYS A 138 68.269 0.325 41.988 1.00 0.00 H ATOM 1306 H LYS A 138 66.443 7.356 42.895 1.00 0.00 H ATOM 1307 N MET A 139 64.785 6.271 39.293 1.00 30.94 N ATOM 1308 CA MET A 139 63.537 6.681 38.647 1.00 31.26 C ATOM 1309 C MET A 139 63.306 5.854 37.364 1.00 31.23 C ATOM 1310 O MET A 139 64.225 5.162 36.914 1.00 29.79 O ATOM 1311 CB MET A 139 63.620 8.170 38.301 1.00 31.77 C ATOM 1312 CG MET A 139 64.637 8.485 37.210 1.00 32.39 C ATOM 1313 SD MET A 139 64.772 10.244 36.876 1.00 34.48 S ATOM 1314 CE MET A 139 63.237 10.426 35.971 1.00 36.14 C ATOM 1315 H MET A 139 65.517 5.801 38.723 1.00 0.00 H ATOM 1316 N PRO A 140 62.075 5.875 36.820 1.00 31.03 N ATOM 1317 CA PRO A 140 61.798 5.107 35.617 1.00 30.62 C ATOM 1318 C PRO A 140 62.626 5.622 34.434 1.00 29.38 C ATOM 1319 O PRO A 140 62.777 6.820 34.259 1.00 28.14 O ATOM 1320 CB PRO A 140 60.305 5.336 35.370 1.00 31.25 C ATOM 1321 CG PRO A 140 59.750 5.765 36.701 1.00 33.18 C ATOM 1322 CD PRO A 140 60.862 6.541 37.337 1.00 32.51 C ATOM 1323 N SER A 141 63.264 4.694 33.744 1.00 29.52 N ATOM 1324 CA SER A 141 64.183 5.016 32.641 1.00 30.16 C ATOM 1325 C SER A 141 63.456 5.742 31.504 1.00 30.52 C ATOM 1326 O SER A 141 64.004 6.653 30.905 1.00 32.22 O ATOM 1327 CB SER A 141 64.841 3.733 32.129 1.00 29.37 C ATOM 1328 OG SER A 141 63.850 2.823 31.662 1.00 31.10 O ATOM 1329 HG SER A 141 64.289 1.998 31.334 1.00 0.00 H ATOM 1330 H SER A 141 63.111 3.695 33.990 1.00 0.00 H ATOM 1331 N GLY A 142 62.233 5.334 31.219 1.00 31.37 N ATOM 1332 CA GLY A 142 61.439 5.958 30.165 1.00 32.97 C ATOM 1333 C GLY A 142 61.105 7.396 30.491 1.00 33.34 C ATOM 1334 O GLY A 142 61.065 8.256 29.623 1.00 29.93 O ATOM 1335 H GLY A 142 61.824 4.546 31.761 1.00 0.00 H ATOM 1336 N GLU A 143 60.836 7.662 31.769 1.00 33.18 N ATOM 1337 CA GLU A 143 60.555 9.010 32.160 1.00 34.00 C ATOM 1338 C GLU A 143 61.788 9.903 32.045 1.00 31.89 C ATOM 1339 O GLU A 143 61.695 11.021 31.544 1.00 31.96 O ATOM 1340 CB GLU A 143 60.017 9.045 33.601 1.00 36.84 C ATOM 1341 CG GLU A 143 59.537 10.423 33.982 1.00 40.61 C ATOM 1342 CD GLU A 143 58.458 10.926 33.033 1.00 45.78 C ATOM 1343 OE1 GLU A 143 57.460 10.182 32.849 1.00 47.02 O ATOM 1344 OE2 GLU A 143 58.656 12.020 32.422 1.00 49.15 O ATOM 1345 H GLU A 143 60.830 6.898 32.475 1.00 0.00 H ATOM 1346 N PHE A 144 62.942 9.427 32.500 1.00 30.00 N ATOM 1347 CA PHE A 144 64.195 10.166 32.328 1.00 29.99 C ATOM 1348 C PHE A 144 64.484 10.447 30.825 1.00 30.39 C ATOM 1349 O PHE A 144 64.844 11.557 30.446 1.00 29.33 O ATOM 1350 CB PHE A 144 65.363 9.403 32.959 1.00 30.09 C ATOM 1351 CG PHE A 144 66.692 10.085 32.812 1.00 30.41 C ATOM 1352 CD1 PHE A 144 66.928 11.300 33.408 1.00 31.62 C ATOM 1353 CD2 PHE A 144 67.747 9.455 32.149 1.00 31.17 C ATOM 1354 CE1 PHE A 144 68.153 11.923 33.281 1.00 32.84 C ATOM 1355 CE2 PHE A 144 68.976 10.080 31.987 1.00 30.86 C ATOM 1356 CZ PHE A 144 69.181 11.324 32.541 1.00 32.31 C ATOM 1357 H PHE A 144 62.956 8.509 32.989 1.00 0.00 H ATOM 1358 N ALA A 145 64.261 9.455 29.990 1.00 30.12 N ATOM 1359 CA ALA A 145 64.498 9.629 28.528 1.00 31.12 C ATOM 1360 C ALA A 145 63.556 10.705 27.963 1.00 32.40 C ATOM 1361 O ALA A 145 63.975 11.563 27.205 1.00 32.13 O ATOM 1362 CB ALA A 145 64.282 8.307 27.813 1.00 30.36 C ATOM 1363 H ALA A 145 63.917 8.543 30.352 1.00 0.00 H ATOM 1364 N ARG A 146 62.314 10.734 28.448 1.00 33.29 N ATOM 1365 CA ARG A 146 61.334 11.663 27.928 1.00 35.65 C ATOM 1366 C ARG A 146 61.702 13.072 28.340 1.00 32.97 C ATOM 1367 O ARG A 146 61.572 14.010 27.586 1.00 32.97 O ATOM 1368 CB ARG A 146 59.920 11.271 28.385 1.00 38.05 C ATOM 1369 CG ARG A 146 58.824 12.295 28.143 1.00 44.09 C ATOM 1370 CD ARG A 146 58.498 12.466 26.660 1.00 51.27 C ATOM 1371 NE ARG A 146 57.512 13.533 26.440 1.00 60.80 N ATOM 1372 CZ ARG A 146 56.303 13.374 25.892 1.00 71.40 C ATOM 1373 NH1 ARG A 146 55.848 12.174 25.530 1.00 74.07 N ATOM 1374 NH2 ARG A 146 55.520 14.439 25.718 1.00 79.07 N ATOM 1375 HE ARG A 146 57.777 14.494 26.736 1.00 0.00 H ATOM 1376 HH12 ARG A 146 54.903 12.082 25.106 1.00 0.00 H ATOM 1377 HH11 ARG A 146 56.438 11.330 25.672 1.00 0.00 H ATOM 1378 HH22 ARG A 146 54.577 14.328 25.293 1.00 0.00 H ATOM 1379 HH21 ARG A 146 55.852 15.381 26.008 1.00 0.00 H ATOM 1380 H ARG A 146 62.046 10.080 29.211 1.00 0.00 H ATOM 1381 N ILE A 147 62.090 13.217 29.584 1.00 32.10 N ATOM 1382 CA ILE A 147 62.522 14.484 30.116 1.00 31.57 C ATOM 1383 C ILE A 147 63.708 15.043 29.340 1.00 30.79 C ATOM 1384 O ILE A 147 63.675 16.189 28.964 1.00 30.34 O ATOM 1385 CB ILE A 147 62.844 14.341 31.622 1.00 31.30 C ATOM 1386 CG1 ILE A 147 61.530 14.199 32.413 1.00 31.37 C ATOM 1387 CG2 ILE A 147 63.633 15.534 32.116 1.00 32.02 C ATOM 1388 CD1 ILE A 147 61.678 13.785 33.888 1.00 31.75 C ATOM 1389 H ILE A 147 62.086 12.386 30.210 1.00 0.00 H ATOM 1390 N CYS A 148 64.759 14.255 29.118 1.00 31.15 N ATOM 1391 CA CYS A 148 65.925 14.756 28.412 1.00 32.68 C ATOM 1392 C CYS A 148 65.578 15.096 26.962 1.00 33.60 C ATOM 1393 O CYS A 148 66.138 16.022 26.386 1.00 34.86 O ATOM 1394 CB CYS A 148 67.081 13.749 28.449 1.00 32.88 C ATOM 1395 SG CYS A 148 67.665 13.481 30.170 1.00 32.77 S ATOM 1396 H CYS A 148 64.744 13.271 29.454 1.00 0.00 H ATOM 1397 N ARG A 149 64.726 14.296 26.350 1.00 34.26 N ATOM 1398 CA ARG A 149 64.324 14.561 24.984 1.00 36.64 C ATOM 1399 C ARG A 149 63.537 15.869 24.891 1.00 35.56 C ATOM 1400 O ARG A 149 63.867 16.753 24.093 1.00 34.29 O ATOM 1401 CB ARG A 149 63.539 13.375 24.405 1.00 38.92 C ATOM 1402 CG ARG A 149 63.105 13.543 22.949 1.00 42.29 C ATOM 1403 CD ARG A 149 64.297 13.612 22.004 1.00 47.63 C ATOM 1404 NE ARG A 149 65.210 12.463 22.100 1.00 51.78 N ATOM 1405 CZ ARG A 149 66.412 12.398 21.518 1.00 56.77 C ATOM 1406 NH1 ARG A 149 66.863 13.395 20.764 1.00 57.01 N ATOM 1407 NH2 ARG A 149 67.175 11.323 21.694 1.00 57.54 N ATOM 1408 HE ARG A 149 64.899 11.644 22.660 1.00 0.00 H ATOM 1409 HH12 ARG A 149 67.801 13.327 20.319 1.00 0.00 H ATOM 1410 HH11 ARG A 149 66.278 14.243 20.619 1.00 0.00 H ATOM 1411 HH22 ARG A 149 68.110 11.270 21.243 1.00 0.00 H ATOM 1412 HH21 ARG A 149 66.836 10.536 22.283 1.00 0.00 H ATOM 1413 H ARG A 149 64.341 13.470 26.851 1.00 0.00 H ATOM 1414 N ASP A 150 62.540 16.027 25.748 1.00 34.66 N ATOM 1415 CA ASP A 150 61.710 17.238 25.728 1.00 35.04 C ATOM 1416 C ASP A 150 62.525 18.509 25.985 1.00 36.07 C ATOM 1417 O ASP A 150 62.416 19.491 25.230 1.00 35.42 O ATOM 1418 CB ASP A 150 60.552 17.134 26.737 1.00 34.75 C ATOM 1419 CG ASP A 150 59.453 16.179 26.275 1.00 35.67 C ATOM 1420 OD1 ASP A 150 59.485 15.737 25.108 1.00 33.80 O ATOM 1421 OD2 ASP A 150 58.610 15.762 27.105 1.00 35.06 O ATOM 1422 H ASP A 150 62.342 15.282 26.446 1.00 0.00 H ATOM 1423 N LEU A 151 63.338 18.498 27.041 1.00 34.88 N ATOM 1424 CA LEU A 151 64.101 19.671 27.392 1.00 35.66 C ATOM 1425 C LEU A 151 65.145 20.053 26.356 1.00 36.15 C ATOM 1426 O LEU A 151 65.447 21.236 26.202 1.00 35.83 O ATOM 1427 CB LEU A 151 64.756 19.549 28.757 1.00 34.78 C ATOM 1428 CG LEU A 151 63.790 19.569 29.942 1.00 34.52 C ATOM 1429 CD1 LEU A 151 64.564 19.491 31.253 1.00 34.07 C ATOM 1430 CD2 LEU A 151 62.865 20.797 29.948 1.00 35.01 C ATOM 1431 H LEU A 151 63.423 17.636 27.617 1.00 0.00 H ATOM 1432 N SER A 152 65.647 19.083 25.614 1.00 37.01 N ATOM 1433 CA SER A 152 66.590 19.378 24.532 1.00 38.39 C ATOM 1434 C SER A 152 65.962 20.188 23.402 1.00 41.30 C ATOM 1435 O SER A 152 66.681 20.757 22.567 1.00 42.62 O ATOM 1436 CB SER A 152 67.212 18.088 23.978 1.00 37.82 C ATOM 1437 OG SER A 152 66.276 17.355 23.223 1.00 37.27 O ATOM 1438 HG SER A 152 65.507 17.114 23.797 1.00 0.00 H ATOM 1439 H SER A 152 65.370 18.098 25.800 1.00 0.00 H ATOM 1440 N HIS A 153 64.631 20.205 23.325 1.00 43.23 N ATOM 1441 CA HIS A 153 63.948 21.057 22.352 1.00 44.99 C ATOM 1442 C HIS A 153 63.775 22.463 22.865 1.00 45.33 C ATOM 1443 O HIS A 153 63.375 23.342 22.105 1.00 44.18 O ATOM 1444 CB HIS A 153 62.592 20.471 21.946 1.00 45.56 C ATOM 1445 CG HIS A 153 62.698 19.108 21.350 1.00 45.08 C ATOM 1446 ND1 HIS A 153 61.734 18.142 21.532 1.00 43.67 N ATOM 1447 CD2 HIS A 153 63.680 18.532 20.617 1.00 44.46 C ATOM 1448 CE1 HIS A 153 62.133 17.018 20.974 1.00 43.75 C ATOM 1449 NE2 HIS A 153 63.311 17.227 20.411 1.00 45.40 N ATOM 1450 H HIS A 153 64.072 19.605 23.965 1.00 0.00 H ATOM 1451 N ILE A 154 64.085 22.680 24.143 1.00 42.09 N ATOM 1452 CA ILE A 154 64.021 23.986 24.746 1.00 45.29 C ATOM 1453 C ILE A 154 65.410 24.619 24.796 1.00 45.26 C ATOM 1454 O ILE A 154 65.543 25.792 24.541 1.00 46.58 O ATOM 1455 CB ILE A 154 63.451 23.912 26.212 1.00 46.05 C ATOM 1456 CG1 ILE A 154 62.101 23.180 26.236 1.00 45.40 C ATOM 1457 CG2 ILE A 154 63.310 25.302 26.823 1.00 48.18 C ATOM 1458 CD1 ILE A 154 60.976 23.843 25.486 1.00 46.74 C ATOM 1459 H ILE A 154 64.385 21.874 24.728 1.00 0.00 H ATOM 1460 N GLY A 155 66.418 23.868 25.230 1.00 45.03 N ATOM 1461 CA GLY A 155 67.766 24.418 25.392 1.00 44.33 C ATOM 1462 C GLY A 155 68.785 23.321 25.269 1.00 44.32 C ATOM 1463 O GLY A 155 68.419 22.142 25.211 1.00 43.63 O ATOM 1464 H GLY A 155 66.246 22.868 25.459 1.00 0.00 H ATOM 1465 N ASP A 156 70.069 23.662 25.291 1.00 46.46 N ATOM 1466 CA ASP A 156 71.100 22.615 25.179 1.00 49.81 C ATOM 1467 C ASP A 156 71.708 22.151 26.501 1.00 44.50 C ATOM 1468 O ASP A 156 72.390 21.130 26.531 1.00 42.75 O ATOM 1469 CB ASP A 156 72.202 22.988 24.185 1.00 52.95 C ATOM 1470 CG ASP A 156 72.879 24.258 24.535 1.00 59.57 C ATOM 1471 OD1 ASP A 156 73.368 24.388 25.676 1.00 66.17 O ATOM 1472 OD2 ASP A 156 72.908 25.152 23.664 1.00 71.79 O ATOM 1473 H ASP A 156 70.344 24.660 25.387 1.00 0.00 H ATOM 1474 N ALA A 157 71.408 22.847 27.588 1.00 44.99 N ATOM 1475 CA ALA A 157 71.881 22.440 28.909 1.00 42.48 C ATOM 1476 C ALA A 157 70.713 22.200 29.879 1.00 42.55 C ATOM 1477 O ALA A 157 69.700 22.931 29.844 1.00 42.45 O ATOM 1478 CB ALA A 157 72.823 23.504 29.451 1.00 44.22 C ATOM 1479 H ALA A 157 70.823 23.702 27.499 1.00 0.00 H ATOM 1480 N VAL A 158 70.847 21.190 30.754 1.00 40.70 N ATOM 1481 CA VAL A 158 69.850 20.952 31.808 1.00 39.49 C ATOM 1482 C VAL A 158 70.480 21.186 33.180 1.00 39.32 C ATOM 1483 O VAL A 158 71.623 20.782 33.422 1.00 39.39 O ATOM 1484 CB VAL A 158 69.197 19.544 31.743 1.00 38.26 C ATOM 1485 CG1 VAL A 158 70.228 18.425 31.798 1.00 38.00 C ATOM 1486 CG2 VAL A 158 68.166 19.357 32.868 1.00 38.61 C ATOM 1487 H VAL A 158 71.674 20.563 30.685 1.00 0.00 H ATOM 1488 N VAL A 159 69.750 21.896 34.039 1.00 39.65 N ATOM 1489 CA VAL A 159 70.119 22.041 35.463 1.00 37.94 C ATOM 1490 C VAL A 159 69.325 21.012 36.246 1.00 37.74 C ATOM 1491 O VAL A 159 68.084 20.981 36.179 1.00 36.23 O ATOM 1492 CB VAL A 159 69.790 23.445 36.007 1.00 38.80 C ATOM 1493 CG1 VAL A 159 70.343 23.627 37.428 1.00 38.45 C ATOM 1494 CG2 VAL A 159 70.391 24.522 35.108 1.00 40.48 C ATOM 1495 H VAL A 159 68.888 22.366 33.695 1.00 0.00 H ATOM 1496 N ILE A 160 70.044 20.129 36.933 1.00 37.20 N ATOM 1497 CA ILE A 160 69.424 19.077 37.694 1.00 36.31 C ATOM 1498 C ILE A 160 69.588 19.410 39.180 1.00 38.28 C ATOM 1499 O ILE A 160 70.704 19.646 39.638 1.00 38.93 O ATOM 1500 CB ILE A 160 70.066 17.703 37.419 1.00 35.28 C ATOM 1501 CG1 ILE A 160 70.043 17.380 35.896 1.00 35.55 C ATOM 1502 CG2 ILE A 160 69.315 16.632 38.206 1.00 34.57 C ATOM 1503 CD1 ILE A 160 70.659 16.049 35.539 1.00 34.80 C ATOM 1504 H ILE A 160 71.081 20.201 36.920 1.00 0.00 H ATOM 1505 N SER A 161 68.470 19.451 39.890 1.00 39.52 N ATOM 1506 CA SER A 161 68.508 19.591 41.363 1.00 40.26 C ATOM 1507 C SER A 161 67.562 18.614 42.054 1.00 41.16 C ATOM 1508 O SER A 161 66.642 18.024 41.450 1.00 39.91 O ATOM 1509 CB SER A 161 68.232 21.039 41.781 1.00 40.11 C ATOM 1510 OG SER A 161 66.946 21.450 41.363 1.00 40.52 O ATOM 1511 HG SER A 161 66.885 21.386 40.377 1.00 0.00 H ATOM 1512 H SER A 161 67.552 19.384 39.405 1.00 0.00 H ATOM 1513 N CYS A 162 67.775 18.488 43.350 1.00 45.39 N ATOM 1514 CA CYS A 162 66.982 17.615 44.216 1.00 49.95 C ATOM 1515 C CYS A 162 66.284 18.417 45.344 1.00 52.67 C ATOM 1516 O CYS A 162 66.980 19.049 46.129 1.00 53.17 O ATOM 1517 CB CYS A 162 67.881 16.515 44.861 1.00 57.23 C ATOM 1518 SG CYS A 162 67.814 14.890 44.048 1.00 57.52 S ATOM 1519 H CYS A 162 68.547 19.038 43.778 1.00 0.00 H ATOM 1520 N ALA A 163 64.941 18.405 45.410 1.00 48.19 N ATOM 1521 CA ALA A 163 64.196 18.839 46.616 1.00 48.29 C ATOM 1522 C ALA A 163 63.852 17.606 47.460 1.00 46.78 C ATOM 1523 O ALA A 163 64.035 16.456 47.005 1.00 42.39 O ATOM 1524 CB ALA A 163 62.922 19.621 46.265 1.00 48.12 C ATOM 1525 H ALA A 163 64.403 18.078 44.582 1.00 0.00 H ATOM 1526 N LYS A 164 63.378 17.813 48.688 1.00 44.37 N ATOM 1527 CA LYS A 164 63.260 16.667 49.576 1.00 44.39 C ATOM 1528 C LYS A 164 62.132 15.750 49.157 1.00 42.59 C ATOM 1529 O LYS A 164 62.076 14.591 49.591 1.00 42.21 O ATOM 1530 CB LYS A 164 63.147 17.048 51.075 1.00 48.64 C ATOM 1531 CG LYS A 164 63.958 16.098 51.967 1.00 50.24 C ATOM 1532 CD LYS A 164 64.279 16.698 53.331 1.00 55.65 C ATOM 1533 CE LYS A 164 63.028 17.082 54.104 1.00 57.02 C ATOM 1534 NZ LYS A 164 63.260 16.948 55.562 1.00 61.94 N ATOM 1535 HZ1 LYS A 164 63.506 15.962 55.783 1.00 0.00 H ATOM 1536 HZ2 LYS A 164 64.040 17.574 55.847 1.00 0.00 H ATOM 1537 HZ3 LYS A 164 62.396 17.214 56.075 1.00 0.00 H ATOM 1538 H LYS A 164 63.101 18.765 49.002 1.00 0.00 H ATOM 1539 N ASP A 165 61.202 16.268 48.351 1.00 41.47 N ATOM 1540 CA ASP A 165 60.065 15.486 47.890 1.00 43.05 C ATOM 1541 C ASP A 165 60.106 15.228 46.380 1.00 42.34 C ATOM 1542 O ASP A 165 59.114 14.710 45.835 1.00 40.13 O ATOM 1543 CB ASP A 165 58.773 16.221 48.306 1.00 44.75 C ATOM 1544 CG ASP A 165 58.509 17.493 47.484 1.00 45.29 C ATOM 1545 OD1 ASP A 165 59.455 18.103 46.919 1.00 46.63 O ATOM 1546 OD2 ASP A 165 57.329 17.882 47.427 1.00 45.05 O ATOM 1547 H ASP A 165 61.293 17.258 48.044 1.00 0.00 H ATOM 1548 N GLY A 166 61.241 15.510 45.737 1.00 41.88 N ATOM 1549 CA GLY A 166 61.349 15.322 44.282 1.00 41.50 C ATOM 1550 C GLY A 166 62.644 15.779 43.618 1.00 40.70 C ATOM 1551 O GLY A 166 63.516 16.370 44.233 1.00 38.65 O ATOM 1552 H GLY A 166 62.059 15.867 46.271 1.00 0.00 H ATOM 1553 N VAL A 167 62.765 15.486 42.323 1.00 39.35 N ATOM 1554 CA VAL A 167 63.920 15.946 41.511 1.00 38.67 C ATOM 1555 C VAL A 167 63.433 16.863 40.405 1.00 38.01 C ATOM 1556 O VAL A 167 62.314 16.693 39.914 1.00 37.32 O ATOM 1557 CB VAL A 167 64.724 14.761 40.959 1.00 39.95 C ATOM 1558 CG1 VAL A 167 63.832 13.846 40.167 1.00 39.31 C ATOM 1559 CG2 VAL A 167 65.942 15.211 40.136 1.00 41.10 C ATOM 1560 H VAL A 167 62.025 14.916 41.866 1.00 0.00 H ATOM 1561 N LYS A 168 64.176 17.932 40.177 1.00 37.88 N ATOM 1562 CA LYS A 168 63.803 18.944 39.225 1.00 41.15 C ATOM 1563 C LYS A 168 64.819 19.039 38.072 1.00 38.22 C ATOM 1564 O LYS A 168 66.023 18.931 38.252 1.00 34.72 O ATOM 1565 CB LYS A 168 63.641 20.304 39.908 1.00 47.05 C ATOM 1566 CG LYS A 168 63.240 21.425 38.941 1.00 55.80 C ATOM 1567 CD LYS A 168 62.942 22.713 39.685 1.00 65.05 C ATOM 1568 CE LYS A 168 63.614 23.921 39.029 1.00 65.98 C ATOM 1569 NZ LYS A 168 63.366 25.127 39.878 1.00 72.29 N ATOM 1570 HZ1 LYS A 168 62.342 25.290 39.955 1.00 0.00 H ATOM 1571 HZ2 LYS A 168 63.766 24.971 40.825 1.00 0.00 H ATOM 1572 HZ3 LYS A 168 63.819 25.956 39.442 1.00 0.00 H ATOM 1573 H LYS A 168 65.064 18.046 40.706 1.00 0.00 H ATOM 1574 N PHE A 169 64.302 19.305 36.889 1.00 38.95 N ATOM 1575 CA PHE A 169 65.139 19.422 35.671 1.00 37.88 C ATOM 1576 C PHE A 169 64.703 20.708 34.995 1.00 39.81 C ATOM 1577 O PHE A 169 63.526 20.847 34.661 1.00 41.82 O ATOM 1578 CB PHE A 169 64.858 18.244 34.736 1.00 37.58 C ATOM 1579 CG PHE A 169 65.162 16.883 35.335 1.00 36.40 C ATOM 1580 CD1 PHE A 169 64.188 16.173 35.983 1.00 36.77 C ATOM 1581 CD2 PHE A 169 66.385 16.271 35.123 1.00 37.61 C ATOM 1582 CE1 PHE A 169 64.446 14.905 36.519 1.00 36.76 C ATOM 1583 CE2 PHE A 169 66.642 14.995 35.615 1.00 36.12 C ATOM 1584 CZ PHE A 169 65.666 14.312 36.302 1.00 35.72 C ATOM 1585 H PHE A 169 63.274 19.437 36.807 1.00 0.00 H ATOM 1586 N SER A 170 65.631 21.615 34.709 1.00 40.35 N ATOM 1587 CA SER A 170 65.276 22.819 33.965 1.00 40.78 C ATOM 1588 C SER A 170 66.226 23.183 32.816 1.00 40.71 C ATOM 1589 O SER A 170 67.405 22.795 32.795 1.00 40.63 O ATOM 1590 CB SER A 170 65.135 23.972 34.929 1.00 43.33 C ATOM 1591 OG SER A 170 66.389 24.356 35.401 1.00 44.95 O ATOM 1592 HG SER A 170 66.286 25.112 36.032 1.00 0.00 H ATOM 1593 H SER A 170 66.613 21.466 35.016 1.00 0.00 H ATOM 1594 N ALA A 171 65.668 23.884 31.833 1.00 39.99 N ATOM 1595 CA ALA A 171 66.415 24.295 30.627 1.00 39.53 C ATOM 1596 C ALA A 171 65.876 25.607 30.095 1.00 40.48 C ATOM 1597 O ALA A 171 64.724 25.972 30.339 1.00 39.01 O ATOM 1598 CB ALA A 171 66.315 23.242 29.543 1.00 39.10 C ATOM 1599 H ALA A 171 64.667 24.153 31.917 1.00 0.00 H ATOM 1600 N SER A 172 66.721 26.295 29.337 1.00 42.64 N ATOM 1601 CA SER A 172 66.466 27.658 28.920 1.00 45.19 C ATOM 1602 C SER A 172 67.031 27.853 27.512 1.00 45.88 C ATOM 1603 O SER A 172 68.124 27.395 27.232 1.00 43.90 O ATOM 1604 CB SER A 172 67.136 28.609 29.890 1.00 48.03 C ATOM 1605 OG SER A 172 66.689 29.912 29.652 1.00 53.44 O ATOM 1606 HG SER A 172 67.128 30.532 30.287 1.00 0.00 H ATOM 1607 H SER A 172 67.602 25.836 29.030 1.00 0.00 H ATOM 1608 N GLY A 173 66.297 28.545 26.647 1.00 46.37 N ATOM 1609 CA GLY A 173 66.776 28.819 25.286 1.00 48.58 C ATOM 1610 C GLY A 173 65.992 29.884 24.545 1.00 50.14 C ATOM 1611 O GLY A 173 65.238 30.625 25.137 1.00 48.81 O ATOM 1612 H GLY A 173 65.364 28.900 26.940 1.00 0.00 H ATOM 1613 N GLU A 174 66.156 29.928 23.230 1.00 54.20 N ATOM 1614 CA GLU A 174 65.607 31.024 22.420 1.00 59.74 C ATOM 1615 C GLU A 174 64.104 31.198 22.604 1.00 59.51 C ATOM 1616 O GLU A 174 63.614 32.314 22.715 1.00 62.28 O ATOM 1617 CB GLU A 174 65.921 30.814 20.947 1.00 63.06 C ATOM 1618 CG GLU A 174 67.136 31.585 20.462 1.00 68.40 C ATOM 1619 CD GLU A 174 67.169 31.693 18.944 1.00 73.72 C ATOM 1620 OE1 GLU A 174 66.937 32.803 18.414 1.00 81.17 O ATOM 1621 OE2 GLU A 174 67.402 30.663 18.271 1.00 76.23 O ATOM 1622 H GLU A 174 66.687 29.167 22.760 1.00 0.00 H ATOM 1623 N LEU A 175 63.367 30.104 22.703 1.00 59.52 N ATOM 1624 CA LEU A 175 61.919 30.232 22.776 1.00 60.52 C ATOM 1625 C LEU A 175 61.366 30.472 24.176 1.00 60.05 C ATOM 1626 O LEU A 175 60.206 30.875 24.322 1.00 60.97 O ATOM 1627 CB LEU A 175 61.244 29.050 22.106 1.00 64.27 C ATOM 1628 CG LEU A 175 61.321 27.695 22.776 1.00 64.22 C ATOM 1629 CD1 LEU A 175 60.270 27.591 23.886 1.00 64.63 C ATOM 1630 CD2 LEU A 175 61.143 26.619 21.711 1.00 62.11 C ATOM 1631 H LEU A 175 63.816 29.166 22.728 1.00 0.00 H ATOM 1632 N GLY A 176 62.217 30.352 25.194 1.00 55.12 N ATOM 1633 CA GLY A 176 61.787 30.507 26.557 1.00 52.99 C ATOM 1634 C GLY A 176 62.434 29.469 27.453 1.00 50.78 C ATOM 1635 O GLY A 176 63.534 29.002 27.182 1.00 48.89 O ATOM 1636 H GLY A 176 63.216 30.141 24.998 1.00 0.00 H ATOM 1637 N ASN A 177 61.739 29.076 28.509 1.00 49.05 N ATOM 1638 CA ASN A 177 62.310 28.096 29.428 1.00 49.42 C ATOM 1639 C ASN A 177 61.302 27.062 29.899 1.00 46.82 C ATOM 1640 O ASN A 177 60.085 27.270 29.806 1.00 46.87 O ATOM 1641 CB ASN A 177 62.989 28.791 30.598 1.00 51.41 C ATOM 1642 CG ASN A 177 62.023 29.581 31.429 1.00 55.43 C ATOM 1643 OD1 ASN A 177 61.258 29.015 32.216 1.00 61.07 O ATOM 1644 ND2 ASN A 177 62.097 30.902 31.322 1.00 58.53 N ATOM 1645 HD22 ASN A 177 62.758 31.333 30.644 1.00 0.00 H ATOM 1646 HD21 ASN A 177 61.494 31.506 31.916 1.00 0.00 H ATOM 1647 H ASN A 177 60.790 29.464 28.683 1.00 0.00 H ATOM 1648 N GLY A 178 61.826 25.934 30.357 1.00 43.78 N ATOM 1649 CA GLY A 178 61.008 24.899 30.967 1.00 44.39 C ATOM 1650 C GLY A 178 61.581 24.362 32.277 1.00 42.34 C ATOM 1651 O GLY A 178 62.806 24.356 32.488 1.00 40.07 O ATOM 1652 H GLY A 178 62.852 25.785 30.278 1.00 0.00 H ATOM 1653 N ASN A 179 60.682 23.922 33.161 1.00 43.66 N ATOM 1654 CA ASN A 179 61.061 23.231 34.396 1.00 45.07 C ATOM 1655 C ASN A 179 60.163 22.074 34.728 1.00 41.55 C ATOM 1656 O ASN A 179 58.944 22.206 34.739 1.00 43.63 O ATOM 1657 CB ASN A 179 60.918 24.170 35.571 1.00 49.44 C ATOM 1658 CG ASN A 179 61.597 25.481 35.353 1.00 54.15 C ATOM 1659 OD1 ASN A 179 62.793 25.607 35.579 1.00 60.61 O ATOM 1660 ND2 ASN A 179 60.835 26.473 34.922 1.00 55.47 N ATOM 1661 HD22 ASN A 179 59.823 26.312 34.745 1.00 0.00 H ATOM 1662 HD21 ASN A 179 61.248 27.414 34.760 1.00 0.00 H ATOM 1663 H ASN A 179 59.672 24.076 32.965 1.00 0.00 H ATOM 1664 N ILE A 180 60.764 20.934 34.996 1.00 39.24 N ATOM 1665 CA ILE A 180 60.009 19.729 35.225 1.00 38.35 C ATOM 1666 C ILE A 180 60.330 19.293 36.655 1.00 37.80 C ATOM 1667 O ILE A 180 61.490 19.071 36.977 1.00 36.48 O ATOM 1668 CB ILE A 180 60.389 18.644 34.203 1.00 37.31 C ATOM 1669 CG1 ILE A 180 60.113 19.170 32.780 1.00 38.37 C ATOM 1670 CG2 ILE A 180 59.598 17.363 34.449 1.00 36.96 C ATOM 1671 CD1 ILE A 180 60.513 18.235 31.669 1.00 36.39 C ATOM 1672 H ILE A 180 61.802 20.903 35.043 1.00 0.00 H ATOM 1673 N LYS A 181 59.280 19.074 37.447 1.00 37.61 N ATOM 1674 CA LYS A 181 59.444 18.446 38.763 1.00 37.57 C ATOM 1675 C LYS A 181 58.780 17.075 38.807 1.00 35.48 C ATOM 1676 O LYS A 181 57.577 16.928 38.578 1.00 33.77 O ATOM 1677 CB LYS A 181 58.913 19.305 39.896 1.00 37.62 C ATOM 1678 CG LYS A 181 59.273 18.682 41.237 1.00 38.54 C ATOM 1679 CD LYS A 181 59.117 19.662 42.379 1.00 39.97 C ATOM 1680 CE LYS A 181 59.287 18.948 43.721 1.00 41.32 C ATOM 1681 NZ LYS A 181 58.989 19.876 44.849 1.00 42.54 N ATOM 1682 HZ1 LYS A 181 59.641 20.685 44.812 1.00 0.00 H ATOM 1683 HZ2 LYS A 181 58.009 20.215 44.768 1.00 0.00 H ATOM 1684 HZ3 LYS A 181 59.110 19.373 45.751 1.00 0.00 H ATOM 1685 H LYS A 181 58.330 19.352 37.127 1.00 0.00 H ATOM 1686 N LEU A 182 59.602 16.077 39.095 1.00 35.81 N ATOM 1687 CA LEU A 182 59.119 14.760 39.382 1.00 37.94 C ATOM 1688 C LEU A 182 59.075 14.544 40.865 1.00 35.67 C ATOM 1689 O LEU A 182 60.137 14.393 41.456 1.00 34.41 O ATOM 1690 CB LEU A 182 60.110 13.725 38.930 1.00 42.04 C ATOM 1691 CG LEU A 182 59.779 12.999 37.675 1.00 45.89 C ATOM 1692 CD1 LEU A 182 60.866 11.958 37.513 1.00 47.86 C ATOM 1693 CD2 LEU A 182 58.410 12.326 37.707 1.00 47.88 C ATOM 1694 H LEU A 182 60.627 16.255 39.113 1.00 0.00 H ATOM 1695 N SER A 183 57.870 14.379 41.394 1.00 36.47 N ATOM 1696 CA SER A 183 57.683 14.209 42.842 1.00 36.36 C ATOM 1697 C SER A 183 57.499 12.761 43.224 1.00 35.39 C ATOM 1698 O SER A 183 57.039 11.929 42.422 1.00 34.32 O ATOM 1699 CB SER A 183 56.483 15.021 43.321 1.00 36.44 C ATOM 1700 OG SER A 183 56.731 16.411 43.113 1.00 37.33 O ATOM 1701 HG SER A 183 56.878 16.578 42.148 1.00 0.00 H ATOM 1702 H SER A 183 57.038 14.370 40.770 1.00 0.00 H ATOM 1703 N GLN A 184 57.861 12.456 44.469 1.00 33.79 N ATOM 1704 CA GLN A 184 57.749 11.108 44.958 1.00 31.94 C ATOM 1705 C GLN A 184 56.308 10.840 45.339 1.00 32.91 C ATOM 1706 O GLN A 184 55.565 11.751 45.758 1.00 33.69 O ATOM 1707 CB GLN A 184 58.659 10.956 46.159 1.00 32.50 C ATOM 1708 CG GLN A 184 60.098 11.167 45.832 1.00 32.32 C ATOM 1709 CD GLN A 184 60.901 11.129 47.084 1.00 31.15 C ATOM 1710 OE1 GLN A 184 60.944 12.121 47.788 1.00 31.03 O ATOM 1711 NE2 GLN A 184 61.556 10.019 47.347 1.00 30.87 N ATOM 1712 HE22 GLN A 184 61.478 9.205 46.705 1.00 0.00 H ATOM 1713 HE21 GLN A 184 62.152 9.956 48.197 1.00 0.00 H ATOM 1714 H GLN A 184 58.229 13.201 45.095 1.00 0.00 H ATOM 1715 N THR A 185 55.902 9.587 45.203 1.00 32.59 N ATOM 1716 CA THR A 185 54.633 9.171 45.689 1.00 33.27 C ATOM 1717 C THR A 185 54.625 7.683 45.963 1.00 33.15 C ATOM 1718 O THR A 185 55.293 6.898 45.285 1.00 32.17 O ATOM 1719 CB THR A 185 53.505 9.538 44.688 1.00 35.13 C ATOM 1720 OG1 THR A 185 52.270 9.025 45.173 1.00 35.60 O ATOM 1721 CG2 THR A 185 53.809 8.961 43.263 1.00 34.38 C ATOM 1722 HG1 THR A 185 51.546 9.256 44.538 1.00 0.00 H ATOM 1723 H THR A 185 56.522 8.896 44.733 1.00 0.00 H ATOM 1724 N SER A 186 53.881 7.286 46.982 1.00 33.23 N ATOM 1725 CA SER A 186 53.677 5.889 47.252 1.00 33.82 C ATOM 1726 C SER A 186 52.635 5.301 46.300 1.00 36.17 C ATOM 1727 O SER A 186 52.510 4.098 46.245 1.00 35.48 O ATOM 1728 CB SER A 186 53.195 5.681 48.706 1.00 33.88 C ATOM 1729 OG SER A 186 52.023 6.415 48.976 1.00 33.78 O ATOM 1730 HG SER A 186 51.303 6.122 48.363 1.00 0.00 H ATOM 1731 H SER A 186 53.436 7.996 47.598 1.00 0.00 H ATOM 1732 N ASN A 187 51.805 6.125 45.664 1.00 38.89 N ATOM 1733 CA ASN A 187 50.776 5.581 44.787 1.00 43.41 C ATOM 1734 C ASN A 187 51.372 5.173 43.425 1.00 44.77 C ATOM 1735 O ASN A 187 51.328 5.926 42.443 1.00 45.48 O ATOM 1736 CB ASN A 187 49.616 6.555 44.662 1.00 46.87 C ATOM 1737 CG ASN A 187 48.407 5.953 43.962 1.00 49.78 C ATOM 1738 OD1 ASN A 187 48.160 4.748 44.014 1.00 50.78 O ATOM 1739 ND2 ASN A 187 47.633 6.806 43.328 1.00 52.09 N ATOM 1740 HD22 ASN A 187 47.879 7.816 43.309 1.00 0.00 H ATOM 1741 HD21 ASN A 187 46.775 6.470 42.846 1.00 0.00 H ATOM 1742 H ASN A 187 51.891 7.153 45.793 1.00 0.00 H ATOM 1743 N VAL A 188 52.056 4.034 43.452 1.00 45.47 N ATOM 1744 CA VAL A 188 52.582 3.399 42.267 1.00 48.97 C ATOM 1745 C VAL A 188 52.111 1.946 42.288 1.00 53.62 C ATOM 1746 O VAL A 188 51.891 1.369 43.354 1.00 57.99 O ATOM 1747 CB VAL A 188 54.140 3.467 42.170 1.00 47.16 C ATOM 1748 CG1 VAL A 188 54.623 4.896 42.002 1.00 45.09 C ATOM 1749 CG2 VAL A 188 54.815 2.812 43.371 1.00 48.25 C ATOM 1750 H VAL A 188 52.220 3.578 44.372 1.00 0.00 H ATOM 1751 N ASP A 189 51.865 1.388 41.115 1.00 58.62 N ATOM 1752 CA ASP A 189 51.610 -0.054 40.992 1.00 65.38 C ATOM 1753 C ASP A 189 52.884 -0.868 41.225 1.00 67.73 C ATOM 1754 O ASP A 189 52.967 -1.699 42.127 1.00 73.04 O ATOM 1755 CB ASP A 189 51.059 -0.385 39.608 1.00 67.74 C ATOM 1756 CG ASP A 189 49.752 0.303 39.327 1.00 70.55 C ATOM 1757 OD1 ASP A 189 48.738 -0.073 39.949 1.00 72.90 O ATOM 1758 OD2 ASP A 189 49.745 1.231 38.487 1.00 73.79 O ATOM 1759 H ASP A 189 51.852 1.982 40.261 1.00 0.00 H ATOM 1760 N LYS A 190 53.872 -0.601 40.382 1.00 69.33 N ATOM 1761 CA LYS A 190 55.101 -1.368 40.289 1.00 68.07 C ATOM 1762 C LYS A 190 56.227 -0.623 40.977 1.00 64.00 C ATOM 1763 O LYS A 190 56.364 0.573 40.787 1.00 64.21 O ATOM 1764 CB LYS A 190 55.465 -1.497 38.817 1.00 74.06 C ATOM 1765 CG LYS A 190 54.456 -2.266 37.981 1.00 78.38 C ATOM 1766 CD LYS A 190 54.862 -3.721 37.836 1.00 83.78 C ATOM 1767 CE LYS A 190 53.816 -4.533 37.106 1.00 85.71 C ATOM 1768 NZ LYS A 190 53.457 -3.939 35.790 1.00 86.42 N ATOM 1769 HZ1 LYS A 190 53.079 -2.981 35.935 1.00 0.00 H ATOM 1770 HZ2 LYS A 190 54.305 -3.891 35.190 1.00 0.00 H ATOM 1771 HZ3 LYS A 190 52.737 -4.531 35.329 1.00 0.00 H ATOM 1772 H LYS A 190 53.759 0.213 39.744 1.00 0.00 H ATOM 1773 N GLU A 191 57.071 -1.329 41.716 1.00 60.18 N ATOM 1774 CA GLU A 191 58.338 -0.772 42.196 1.00 62.26 C ATOM 1775 C GLU A 191 59.116 0.077 41.176 1.00 57.83 C ATOM 1776 O GLU A 191 59.695 1.104 41.525 1.00 52.93 O ATOM 1777 CB GLU A 191 59.255 -1.902 42.620 1.00 67.84 C ATOM 1778 CG GLU A 191 60.357 -1.456 43.565 1.00 72.09 C ATOM 1779 CD GLU A 191 61.678 -2.110 43.249 1.00 77.89 C ATOM 1780 OE1 GLU A 191 61.660 -3.295 42.846 1.00 86.21 O ATOM 1781 OE2 GLU A 191 62.728 -1.447 43.421 1.00 80.62 O ATOM 1782 H GLU A 191 56.826 -2.309 41.963 1.00 0.00 H ATOM 1783 N GLU A 192 59.195 -0.411 39.944 1.00 55.80 N ATOM 1784 CA GLU A 192 59.943 0.249 38.870 1.00 52.99 C ATOM 1785 C GLU A 192 59.406 1.650 38.595 1.00 47.77 C ATOM 1786 O GLU A 192 60.084 2.433 37.951 1.00 45.51 O ATOM 1787 CB GLU A 192 59.874 -0.588 37.576 1.00 56.68 C ATOM 1788 CG GLU A 192 58.543 -0.427 36.842 1.00 61.99 C ATOM 1789 CD GLU A 192 58.179 -1.525 35.852 1.00 65.82 C ATOM 1790 OE1 GLU A 192 57.910 -1.173 34.684 1.00 68.29 O ATOM 1791 OE2 GLU A 192 58.006 -2.702 36.265 1.00 72.17 O ATOM 1792 H GLU A 192 58.704 -1.303 39.731 1.00 0.00 H ATOM 1793 N GLU A 193 58.167 1.928 39.007 1.00 44.55 N ATOM 1794 CA GLU A 193 57.597 3.268 38.906 1.00 44.88 C ATOM 1795 C GLU A 193 58.079 4.231 39.995 1.00 43.46 C ATOM 1796 O GLU A 193 57.825 5.435 39.886 1.00 42.22 O ATOM 1797 CB GLU A 193 56.067 3.217 38.912 1.00 49.05 C ATOM 1798 CG GLU A 193 55.464 2.566 37.695 1.00 53.31 C ATOM 1799 CD GLU A 193 54.086 1.970 37.958 1.00 58.13 C ATOM 1800 OE1 GLU A 193 53.827 0.844 37.470 1.00 61.99 O ATOM 1801 OE2 GLU A 193 53.275 2.593 38.680 1.00 60.29 O ATOM 1802 H GLU A 193 57.589 1.165 39.413 1.00 0.00 H ATOM 1803 N ALA A 194 58.682 3.707 41.065 1.00 39.64 N ATOM 1804 CA ALA A 194 59.017 4.543 42.234 1.00 38.87 C ATOM 1805 C ALA A 194 60.130 5.540 41.931 1.00 35.59 C ATOM 1806 O ALA A 194 61.023 5.253 41.146 1.00 36.50 O ATOM 1807 CB ALA A 194 59.422 3.677 43.414 1.00 39.03 C ATOM 1808 H ALA A 194 58.919 2.694 41.075 1.00 0.00 H ATOM 1809 N VAL A 195 60.007 6.746 42.470 1.00 32.78 N ATOM 1810 CA VAL A 195 61.093 7.677 42.492 1.00 30.86 C ATOM 1811 C VAL A 195 61.718 7.609 43.902 1.00 31.08 C ATOM 1812 O VAL A 195 61.034 7.824 44.895 1.00 29.01 O ATOM 1813 CB VAL A 195 60.645 9.082 42.083 1.00 31.66 C ATOM 1814 CG1 VAL A 195 61.818 10.039 42.236 1.00 32.47 C ATOM 1815 CG2 VAL A 195 60.170 9.108 40.602 1.00 32.39 C ATOM 1816 H VAL A 195 59.096 7.022 42.888 1.00 0.00 H ATOM 1817 N THR A 196 62.999 7.268 43.964 1.00 30.52 N ATOM 1818 CA THR A 196 63.719 7.102 45.221 1.00 30.62 C ATOM 1819 C THR A 196 64.871 8.091 45.235 1.00 32.77 C ATOM 1820 O THR A 196 65.634 8.155 44.249 1.00 31.07 O ATOM 1821 CB THR A 196 64.317 5.699 45.326 1.00 30.80 C ATOM 1822 OG1 THR A 196 63.289 4.714 45.261 1.00 32.15 O ATOM 1823 CG2 THR A 196 65.142 5.546 46.609 1.00 31.51 C ATOM 1824 HG1 THR A 196 62.809 4.796 44.399 1.00 0.00 H ATOM 1825 H THR A 196 63.514 7.112 43.074 1.00 0.00 H ATOM 1826 N ILE A 197 65.000 8.844 46.325 1.00 31.82 N ATOM 1827 CA ILE A 197 65.974 9.886 46.462 1.00 33.11 C ATOM 1828 C ILE A 197 66.703 9.697 47.778 1.00 37.26 C ATOM 1829 O ILE A 197 66.075 9.740 48.864 1.00 31.74 O ATOM 1830 CB ILE A 197 65.353 11.294 46.467 1.00 33.29 C ATOM 1831 CG1 ILE A 197 64.547 11.509 45.187 1.00 34.45 C ATOM 1832 CG2 ILE A 197 66.458 12.327 46.626 1.00 34.55 C ATOM 1833 CD1 ILE A 197 63.966 12.893 45.012 1.00 35.51 C ATOM 1834 H ILE A 197 64.357 8.666 47.123 1.00 0.00 H ATOM 1835 N GLU A 198 67.995 9.407 47.674 1.00 39.57 N ATOM 1836 CA GLU A 198 68.865 9.335 48.851 1.00 45.83 C ATOM 1837 C GLU A 198 69.711 10.575 48.802 1.00 48.00 C ATOM 1838 O GLU A 198 70.505 10.758 47.871 1.00 44.65 O ATOM 1839 CB GLU A 198 69.774 8.105 48.845 1.00 47.57 C ATOM 1840 CG GLU A 198 69.118 6.803 48.373 1.00 53.72 C ATOM 1841 CD GLU A 198 70.084 5.627 48.112 1.00 56.99 C ATOM 1842 OE1 GLU A 198 69.621 4.612 47.534 1.00 58.84 O ATOM 1843 OE2 GLU A 198 71.288 5.684 48.463 1.00 58.31 O ATOM 1844 H GLU A 198 68.400 9.226 46.733 1.00 0.00 H ATOM 1845 N MET A 199 69.508 11.460 49.768 1.00 50.14 N ATOM 1846 CA MET A 199 70.153 12.752 49.732 1.00 56.84 C ATOM 1847 C MET A 199 70.941 13.005 51.010 1.00 57.21 C ATOM 1848 O MET A 199 70.367 13.064 52.082 1.00 60.50 O ATOM 1849 CB MET A 199 69.138 13.867 49.527 1.00 62.54 C ATOM 1850 CG MET A 199 69.817 15.199 49.272 1.00 66.27 C ATOM 1851 SD MET A 199 68.809 16.611 49.692 1.00 84.96 S ATOM 1852 CE MET A 199 69.010 16.641 51.487 1.00 80.50 C ATOM 1853 H MET A 199 68.878 11.222 50.560 1.00 0.00 H ATOM 1854 N ASN A 200 72.247 13.211 50.856 1.00 57.19 N ATOM 1855 CA ASN A 200 73.119 13.641 51.942 1.00 58.75 C ATOM 1856 C ASN A 200 73.149 15.160 52.021 1.00 57.50 C ATOM 1857 O ASN A 200 72.979 15.729 53.093 1.00 55.37 O ATOM 1858 CB ASN A 200 74.519 13.073 51.740 1.00 59.85 C ATOM 1859 CG ASN A 200 74.515 11.567 51.745 1.00 60.71 C ATOM 1860 OD1 ASN A 200 73.905 10.954 52.615 1.00 63.47 O ATOM 1861 ND2 ASN A 200 75.133 10.958 50.736 1.00 61.28 N ATOM 1862 HD22 ASN A 200 75.638 11.519 50.021 1.00 0.00 H ATOM 1863 HD21 ASN A 200 75.111 9.921 50.663 1.00 0.00 H ATOM 1864 H ASN A 200 72.665 13.058 49.916 1.00 0.00 H ATOM 1865 N GLU A 201 73.299 15.812 50.875 1.00 53.67 N ATOM 1866 CA GLU A 201 73.067 17.247 50.789 1.00 55.95 C ATOM 1867 C GLU A 201 72.577 17.631 49.404 1.00 53.70 C ATOM 1868 O GLU A 201 72.832 16.918 48.430 1.00 49.42 O ATOM 1869 CB GLU A 201 74.329 18.036 51.146 1.00 60.17 C ATOM 1870 CG GLU A 201 75.606 17.564 50.484 1.00 62.28 C ATOM 1871 CD GLU A 201 76.790 18.457 50.840 1.00 68.23 C ATOM 1872 OE1 GLU A 201 77.744 17.946 51.462 1.00 69.45 O ATOM 1873 OE2 GLU A 201 76.764 19.668 50.507 1.00 69.35 O ATOM 1874 H GLU A 201 73.587 15.289 50.024 1.00 0.00 H ATOM 1875 N PRO A 202 71.844 18.748 49.316 1.00 54.67 N ATOM 1876 CA PRO A 202 71.278 19.116 48.021 1.00 53.84 C ATOM 1877 C PRO A 202 72.365 19.415 47.013 1.00 53.36 C ATOM 1878 O PRO A 202 73.456 19.800 47.384 1.00 52.64 O ATOM 1879 CB PRO A 202 70.446 20.374 48.322 1.00 54.30 C ATOM 1880 CG PRO A 202 70.864 20.819 49.704 1.00 59.70 C ATOM 1881 CD PRO A 202 71.310 19.579 50.412 1.00 56.77 C ATOM 1882 N VAL A 203 72.065 19.210 45.744 1.00 50.55 N ATOM 1883 CA VAL A 203 73.021 19.513 44.693 1.00 53.08 C ATOM 1884 C VAL A 203 72.298 20.260 43.592 1.00 52.72 C ATOM 1885 O VAL A 203 71.091 20.092 43.396 1.00 51.86 O ATOM 1886 CB VAL A 203 73.674 18.237 44.117 1.00 53.89 C ATOM 1887 CG1 VAL A 203 74.896 18.583 43.322 1.00 61.35 C ATOM 1888 CG2 VAL A 203 74.105 17.297 45.211 1.00 55.63 C ATOM 1889 H VAL A 203 71.131 18.826 45.493 1.00 0.00 H ATOM 1890 N GLN A 204 73.043 21.088 42.871 1.00 51.04 N ATOM 1891 CA GLN A 204 72.541 21.673 41.659 1.00 52.78 C ATOM 1892 C GLN A 204 73.658 21.697 40.624 1.00 51.74 C ATOM 1893 O GLN A 204 74.732 22.246 40.871 1.00 54.47 O ATOM 1894 CB GLN A 204 72.030 23.075 41.935 1.00 55.81 C ATOM 1895 CG GLN A 204 71.541 23.791 40.698 1.00 59.08 C ATOM 1896 CD GLN A 204 70.954 25.145 41.036 1.00 62.19 C ATOM 1897 OE1 GLN A 204 71.632 26.169 40.976 1.00 65.53 O ATOM 1898 NE2 GLN A 204 69.682 25.158 41.392 1.00 68.00 N ATOM 1899 HE22 GLN A 204 69.144 24.269 41.430 1.00 0.00 H ATOM 1900 HE21 GLN A 204 69.219 26.057 41.634 1.00 0.00 H ATOM 1901 H GLN A 204 74.006 21.317 43.189 1.00 0.00 H ATOM 1902 N LEU A 205 73.441 21.007 39.514 1.00 47.87 N ATOM 1903 CA LEU A 205 74.488 20.848 38.517 1.00 46.37 C ATOM 1904 C LEU A 205 73.914 21.023 37.148 1.00 43.38 C ATOM 1905 O LEU A 205 72.752 20.672 36.918 1.00 43.23 O ATOM 1906 CB LEU A 205 75.117 19.464 38.635 1.00 48.73 C ATOM 1907 CG LEU A 205 75.463 19.020 40.059 1.00 52.10 C ATOM 1908 CD1 LEU A 205 75.751 17.527 40.072 1.00 53.01 C ATOM 1909 CD2 LEU A 205 76.659 19.812 40.584 1.00 53.15 C ATOM 1910 H LEU A 205 72.510 20.573 39.353 1.00 0.00 H ATOM 1911 N THR A 206 74.784 21.386 36.215 1.00 40.50 N ATOM 1912 CA THR A 206 74.432 21.611 34.840 1.00 41.33 C ATOM 1913 C THR A 206 75.164 20.639 33.908 1.00 40.25 C ATOM 1914 O THR A 206 76.373 20.461 34.033 1.00 38.83 O ATOM 1915 CB THR A 206 74.811 23.043 34.430 1.00 41.89 C ATOM 1916 OG1 THR A 206 74.094 23.942 35.268 1.00 43.56 O ATOM 1917 CG2 THR A 206 74.432 23.320 33.010 1.00 41.62 C ATOM 1918 HG1 THR A 206 74.322 24.873 35.022 1.00 0.00 H ATOM 1919 H THR A 206 75.777 21.515 36.494 1.00 0.00 H ATOM 1920 N PHE A 207 74.422 20.064 32.956 1.00 39.70 N ATOM 1921 CA PHE A 207 74.950 19.038 32.043 1.00 39.90 C ATOM 1922 C PHE A 207 74.451 19.245 30.610 1.00 41.29 C ATOM 1923 O PHE A 207 73.358 19.791 30.405 1.00 44.06 O ATOM 1924 CB PHE A 207 74.514 17.638 32.517 1.00 39.32 C ATOM 1925 CG PHE A 207 75.066 17.259 33.858 1.00 38.12 C ATOM 1926 CD1 PHE A 207 76.390 16.861 33.980 1.00 38.17 C ATOM 1927 CD2 PHE A 207 74.275 17.336 34.999 1.00 39.88 C ATOM 1928 CE1 PHE A 207 76.935 16.548 35.201 1.00 38.13 C ATOM 1929 CE2 PHE A 207 74.806 17.004 36.246 1.00 38.80 C ATOM 1930 CZ PHE A 207 76.152 16.653 36.357 1.00 38.80 C ATOM 1931 H PHE A 207 73.428 20.355 32.856 1.00 0.00 H ATOM 1932 N ALA A 208 75.250 18.819 29.631 1.00 39.12 N ATOM 1933 CA ALA A 208 74.866 18.907 28.229 1.00 39.38 C ATOM 1934 C ALA A 208 73.816 17.863 27.881 1.00 37.38 C ATOM 1935 O ALA A 208 74.042 16.643 28.019 1.00 36.80 O ATOM 1936 CB ALA A 208 76.102 18.768 27.327 1.00 40.59 C ATOM 1937 H ALA A 208 76.175 18.412 29.876 1.00 0.00 H ATOM 1938 N LEU A 209 72.646 18.342 27.458 1.00 36.47 N ATOM 1939 CA LEU A 209 71.540 17.442 27.108 1.00 36.13 C ATOM 1940 C LEU A 209 71.840 16.516 25.912 1.00 35.69 C ATOM 1941 O LEU A 209 71.332 15.387 25.847 1.00 32.65 O ATOM 1942 CB LEU A 209 70.264 18.230 26.812 1.00 36.41 C ATOM 1943 CG LEU A 209 69.504 18.695 28.065 1.00 36.55 C ATOM 1944 CD1 LEU A 209 68.591 19.864 27.734 1.00 36.69 C ATOM 1945 CD2 LEU A 209 68.707 17.542 28.679 1.00 36.09 C ATOM 1946 H LEU A 209 72.515 19.370 27.375 1.00 0.00 H ATOM 1947 N ARG A 210 72.733 16.935 25.042 1.00 37.11 N ATOM 1948 CA ARG A 210 73.068 16.090 23.892 1.00 39.33 C ATOM 1949 C ARG A 210 73.676 14.772 24.348 1.00 38.40 C ATOM 1950 O ARG A 210 73.383 13.711 23.761 1.00 37.97 O ATOM 1951 CB ARG A 210 73.979 16.868 22.913 1.00 43.27 C ATOM 1952 CG ARG A 210 74.682 16.064 21.816 1.00 47.55 C ATOM 1953 CD ARG A 210 75.503 16.959 20.889 1.00 51.26 C ATOM 1954 NE ARG A 210 75.508 16.422 19.520 1.00 58.06 N ATOM 1955 CZ ARG A 210 76.403 15.547 19.066 1.00 62.61 C ATOM 1956 NH1 ARG A 210 77.369 15.107 19.862 1.00 67.98 N ATOM 1957 NH2 ARG A 210 76.352 15.116 17.814 1.00 64.03 N ATOM 1958 HE ARG A 210 74.767 16.746 18.866 1.00 0.00 H ATOM 1959 HH12 ARG A 210 78.067 14.424 19.504 1.00 0.00 H ATOM 1960 HH11 ARG A 210 77.429 15.446 20.844 1.00 0.00 H ATOM 1961 HH22 ARG A 210 77.056 14.432 17.470 1.00 0.00 H ATOM 1962 HH21 ARG A 210 75.608 15.461 17.175 1.00 0.00 H ATOM 1963 H ARG A 210 73.197 17.857 25.169 1.00 0.00 H ATOM 1964 N TYR A 211 74.523 14.829 25.382 1.00 37.72 N ATOM 1965 CA TYR A 211 75.167 13.619 25.889 1.00 36.94 C ATOM 1966 C TYR A 211 74.180 12.740 26.632 1.00 35.84 C ATOM 1967 O TYR A 211 74.151 11.506 26.435 1.00 35.20 O ATOM 1968 CB TYR A 211 76.395 13.953 26.742 1.00 38.07 C ATOM 1969 CG TYR A 211 77.606 14.217 25.892 1.00 41.58 C ATOM 1970 CD1 TYR A 211 77.777 15.450 25.279 1.00 43.63 C ATOM 1971 CD2 TYR A 211 78.468 13.190 25.549 1.00 42.66 C ATOM 1972 CE1 TYR A 211 78.829 15.677 24.415 1.00 45.93 C ATOM 1973 CE2 TYR A 211 79.502 13.396 24.660 1.00 46.09 C ATOM 1974 CZ TYR A 211 79.682 14.643 24.101 1.00 47.44 C ATOM 1975 OH TYR A 211 80.727 14.846 23.240 1.00 51.00 O ATOM 1976 HH TYR A 211 81.579 14.660 23.708 1.00 0.00 H ATOM 1977 H TYR A 211 74.726 15.745 25.830 1.00 0.00 H ATOM 1978 N LEU A 212 73.321 13.357 27.439 1.00 35.60 N ATOM 1979 CA LEU A 212 72.253 12.601 28.103 1.00 35.30 C ATOM 1980 C LEU A 212 71.392 11.836 27.105 1.00 35.70 C ATOM 1981 O LEU A 212 71.069 10.669 27.333 1.00 34.44 O ATOM 1982 CB LEU A 212 71.379 13.504 28.979 1.00 35.86 C ATOM 1983 CG LEU A 212 72.157 14.131 30.134 1.00 36.17 C ATOM 1984 CD1 LEU A 212 71.247 15.045 30.948 1.00 36.65 C ATOM 1985 CD2 LEU A 212 72.794 13.063 31.013 1.00 36.90 C ATOM 1986 H LEU A 212 73.407 14.381 27.600 1.00 0.00 H ATOM 1987 N ASN A 213 71.114 12.455 25.964 1.00 36.89 N ATOM 1988 CA ASN A 213 70.322 11.797 24.939 1.00 37.95 C ATOM 1989 C ASN A 213 71.045 10.652 24.204 1.00 36.09 C ATOM 1990 O ASN A 213 70.388 9.745 23.747 1.00 37.96 O ATOM 1991 CB ASN A 213 69.728 12.805 23.955 1.00 39.26 C ATOM 1992 CG ASN A 213 68.550 13.580 24.556 1.00 42.32 C ATOM 1993 OD1 ASN A 213 67.710 13.036 25.283 1.00 40.18 O ATOM 1994 ND2 ASN A 213 68.521 14.866 24.304 1.00 45.57 N ATOM 1995 HD22 ASN A 213 69.243 15.292 23.688 1.00 0.00 H ATOM 1996 HD21 ASN A 213 67.776 15.461 24.720 1.00 0.00 H ATOM 1997 H ASN A 213 71.466 13.420 25.802 1.00 0.00 H ATOM 1998 N PHE A 214 72.374 10.643 24.188 1.00 36.13 N ATOM 1999 CA PHE A 214 73.127 9.440 23.852 1.00 34.92 C ATOM 2000 C PHE A 214 72.950 8.367 24.919 1.00 33.82 C ATOM 2001 O PHE A 214 72.647 7.222 24.591 1.00 33.97 O ATOM 2002 CB PHE A 214 74.627 9.699 23.681 1.00 37.24 C ATOM 2003 CG PHE A 214 74.998 10.437 22.421 1.00 40.12 C ATOM 2004 CD1 PHE A 214 74.708 9.907 21.197 1.00 43.48 C ATOM 2005 CD2 PHE A 214 75.764 11.601 22.478 1.00 43.81 C ATOM 2006 CE1 PHE A 214 75.082 10.562 20.017 1.00 45.98 C ATOM 2007 CE2 PHE A 214 76.121 12.273 21.314 1.00 46.08 C ATOM 2008 CZ PHE A 214 75.765 11.762 20.087 1.00 45.22 C ATOM 2009 H PHE A 214 72.890 11.516 24.421 1.00 0.00 H ATOM 2010 N PHE A 215 73.087 8.736 26.200 1.00 32.77 N ATOM 2011 CA PHE A 215 72.983 7.748 27.289 1.00 32.61 C ATOM 2012 C PHE A 215 71.646 7.015 27.333 1.00 31.77 C ATOM 2013 O PHE A 215 71.594 5.806 27.579 1.00 31.93 O ATOM 2014 CB PHE A 215 73.174 8.399 28.673 1.00 32.60 C ATOM 2015 CG PHE A 215 74.474 9.134 28.852 1.00 33.23 C ATOM 2016 CD1 PHE A 215 75.521 9.017 27.947 1.00 32.47 C ATOM 2017 CD2 PHE A 215 74.700 9.869 30.019 1.00 33.55 C ATOM 2018 CE1 PHE A 215 76.713 9.696 28.140 1.00 32.78 C ATOM 2019 CE2 PHE A 215 75.902 10.552 30.213 1.00 33.50 C ATOM 2020 CZ PHE A 215 76.908 10.462 29.279 1.00 33.61 C ATOM 2021 H PHE A 215 73.269 9.734 26.429 1.00 0.00 H ATOM 2022 N THR A 216 70.559 7.732 27.059 1.00 31.23 N ATOM 2023 CA THR A 216 69.258 7.126 27.115 1.00 32.21 C ATOM 2024 C THR A 216 68.960 6.141 25.955 1.00 33.88 C ATOM 2025 O THR A 216 67.860 5.551 25.905 1.00 32.53 O ATOM 2026 CB THR A 216 68.129 8.184 27.171 1.00 32.37 C ATOM 2027 OG1 THR A 216 68.116 8.947 25.962 1.00 32.74 O ATOM 2028 CG2 THR A 216 68.274 9.113 28.375 1.00 32.90 C ATOM 2029 HG1 THR A 216 67.392 9.621 26.006 1.00 0.00 H ATOM 2030 H THR A 216 70.652 8.736 26.803 1.00 0.00 H ATOM 2031 N LYS A 217 69.932 5.921 25.064 1.00 33.93 N ATOM 2032 CA LYS A 217 69.853 4.798 24.152 1.00 35.70 C ATOM 2033 C LYS A 217 69.936 3.458 24.860 1.00 33.95 C ATOM 2034 O LYS A 217 69.576 2.445 24.288 1.00 33.16 O ATOM 2035 CB LYS A 217 70.946 4.895 23.075 1.00 38.85 C ATOM 2036 CG LYS A 217 70.799 6.099 22.153 1.00 42.76 C ATOM 2037 CD LYS A 217 69.521 6.049 21.353 1.00 49.14 C ATOM 2038 CE LYS A 217 69.226 7.308 20.541 1.00 54.74 C ATOM 2039 NZ LYS A 217 70.429 8.096 20.141 1.00 57.17 N ATOM 2040 HZ1 LYS A 217 70.940 8.403 20.993 1.00 0.00 H ATOM 2041 HZ2 LYS A 217 71.052 7.503 19.557 1.00 0.00 H ATOM 2042 HZ3 LYS A 217 70.130 8.929 19.595 1.00 0.00 H ATOM 2043 H LYS A 217 70.751 6.561 25.025 1.00 0.00 H ATOM 2044 N ALA A 218 70.361 3.471 26.126 1.00 33.62 N ATOM 2045 CA ALA A 218 70.361 2.285 26.970 1.00 32.56 C ATOM 2046 C ALA A 218 69.015 1.951 27.603 1.00 32.02 C ATOM 2047 O ALA A 218 68.843 0.863 28.161 1.00 32.81 O ATOM 2048 CB ALA A 218 71.380 2.473 28.067 1.00 33.24 C ATOM 2049 H ALA A 218 70.707 4.367 26.526 1.00 0.00 H ATOM 2050 N THR A 219 68.025 2.822 27.423 1.00 32.29 N ATOM 2051 CA THR A 219 66.701 2.663 28.040 1.00 31.03 C ATOM 2052 C THR A 219 66.076 1.266 27.890 1.00 31.89 C ATOM 2053 O THR A 219 65.561 0.715 28.885 1.00 30.36 O ATOM 2054 CB THR A 219 65.721 3.748 27.523 1.00 31.47 C ATOM 2055 OG1 THR A 219 66.190 5.040 27.936 1.00 30.69 O ATOM 2056 CG2 THR A 219 64.305 3.509 28.015 1.00 30.74 C ATOM 2057 HG1 THR A 219 67.092 5.198 27.559 1.00 0.00 H ATOM 2058 H THR A 219 68.196 3.651 26.819 1.00 0.00 H ATOM 2059 N PRO A 220 66.219 0.618 26.705 1.00 31.68 N ATOM 2060 CA PRO A 220 65.667 -0.734 26.572 1.00 31.86 C ATOM 2061 C PRO A 220 66.256 -1.782 27.499 1.00 30.32 C ATOM 2062 O PRO A 220 65.676 -2.840 27.653 1.00 30.62 O ATOM 2063 CB PRO A 220 65.979 -1.094 25.086 1.00 32.45 C ATOM 2064 CG PRO A 220 66.004 0.236 24.399 1.00 31.88 C ATOM 2065 CD PRO A 220 66.672 1.138 25.407 1.00 31.85 C ATOM 2066 N LEU A 221 67.407 -1.506 28.097 1.00 31.46 N ATOM 2067 CA LEU A 221 68.071 -2.505 28.923 1.00 31.49 C ATOM 2068 C LEU A 221 67.428 -2.606 30.307 1.00 33.33 C ATOM 2069 O LEU A 221 67.558 -3.640 30.975 1.00 34.51 O ATOM 2070 CB LEU A 221 69.541 -2.177 29.068 1.00 32.08 C ATOM 2071 CG LEU A 221 70.390 -2.461 27.818 1.00 32.64 C ATOM 2072 CD1 LEU A 221 71.716 -1.735 27.902 1.00 32.17 C ATOM 2073 CD2 LEU A 221 70.596 -3.952 27.640 1.00 33.34 C ATOM 2074 H LEU A 221 67.839 -0.568 27.975 1.00 0.00 H ATOM 2075 N SER A 222 66.760 -1.549 30.745 1.00 31.81 N ATOM 2076 CA SER A 222 66.227 -1.520 32.109 1.00 33.14 C ATOM 2077 C SER A 222 65.044 -0.595 32.213 1.00 32.35 C ATOM 2078 O SER A 222 65.062 0.486 31.675 1.00 31.64 O ATOM 2079 CB SER A 222 67.303 -1.074 33.115 1.00 33.80 C ATOM 2080 OG SER A 222 66.790 -1.183 34.446 1.00 37.25 O ATOM 2081 HG SER A 222 66.540 -2.124 34.626 1.00 0.00 H ATOM 2082 H SER A 222 66.613 -0.734 30.116 1.00 0.00 H ATOM 2083 N SER A 223 64.109 -0.962 33.074 1.00 34.17 N ATOM 2084 CA SER A 223 62.976 -0.126 33.404 1.00 36.17 C ATOM 2085 C SER A 223 63.326 1.048 34.299 1.00 32.86 C ATOM 2086 O SER A 223 62.506 1.945 34.477 1.00 31.54 O ATOM 2087 CB SER A 223 61.940 -0.945 34.172 1.00 39.96 C ATOM 2088 OG SER A 223 61.172 -1.642 33.256 1.00 46.64 O ATOM 2089 HG SER A 223 60.494 -2.179 33.737 1.00 0.00 H ATOM 2090 H SER A 223 64.192 -1.891 33.533 1.00 0.00 H ATOM 2091 N THR A 224 64.484 0.991 34.915 1.00 32.48 N ATOM 2092 CA THR A 224 64.882 2.029 35.839 1.00 34.21 C ATOM 2093 C THR A 224 66.271 2.510 35.528 1.00 31.48 C ATOM 2094 O THR A 224 67.057 1.793 34.904 1.00 31.74 O ATOM 2095 CB THR A 224 64.840 1.539 37.308 1.00 35.90 C ATOM 2096 OG1 THR A 224 65.807 0.515 37.471 1.00 39.53 O ATOM 2097 CG2 THR A 224 63.479 0.982 37.663 1.00 35.97 C ATOM 2098 HG1 THR A 224 66.705 0.874 37.261 1.00 0.00 H ATOM 2099 H THR A 224 65.122 0.190 34.736 1.00 0.00 H ATOM 2100 N VAL A 225 66.547 3.736 35.959 1.00 29.18 N ATOM 2101 CA VAL A 225 67.853 4.335 35.809 1.00 29.20 C ATOM 2102 C VAL A 225 68.223 5.015 37.113 1.00 29.36 C ATOM 2103 O VAL A 225 67.334 5.516 37.812 1.00 29.44 O ATOM 2104 CB VAL A 225 67.853 5.363 34.671 1.00 28.42 C ATOM 2105 CG1 VAL A 225 66.990 6.555 34.998 1.00 27.98 C ATOM 2106 CG2 VAL A 225 69.269 5.789 34.342 1.00 28.66 C ATOM 2107 H VAL A 225 65.795 4.285 36.422 1.00 0.00 H ATOM 2108 N THR A 226 69.505 4.978 37.460 1.00 29.43 N ATOM 2109 CA THR A 226 70.003 5.696 38.659 1.00 30.69 C ATOM 2110 C THR A 226 70.937 6.862 38.291 1.00 30.01 C ATOM 2111 O THR A 226 71.892 6.679 37.483 1.00 30.54 O ATOM 2112 CB THR A 226 70.711 4.691 39.607 1.00 32.04 C ATOM 2113 OG1 THR A 226 69.745 3.711 40.037 1.00 31.23 O ATOM 2114 CG2 THR A 226 71.220 5.376 40.868 1.00 35.41 C ATOM 2115 HG1 THR A 226 70.182 3.062 40.643 1.00 0.00 H ATOM 2116 H THR A 226 70.174 4.434 36.879 1.00 0.00 H ATOM 2117 N LEU A 227 70.627 8.059 38.802 1.00 28.40 N ATOM 2118 CA LEU A 227 71.480 9.231 38.687 1.00 28.58 C ATOM 2119 C LEU A 227 72.234 9.511 39.994 1.00 29.53 C ATOM 2120 O LEU A 227 71.597 9.709 41.050 1.00 29.45 O ATOM 2121 CB LEU A 227 70.665 10.465 38.329 1.00 29.15 C ATOM 2122 CG LEU A 227 69.542 10.281 37.292 1.00 30.79 C ATOM 2123 CD1 LEU A 227 68.762 11.579 37.128 1.00 30.89 C ATOM 2124 CD2 LEU A 227 70.122 9.814 35.971 1.00 30.88 C ATOM 2125 H LEU A 227 69.725 8.157 39.310 1.00 0.00 H ATOM 2126 N SER A 228 73.563 9.546 39.917 1.00 29.94 N ATOM 2127 CA SER A 228 74.419 9.821 41.080 1.00 31.98 C ATOM 2128 C SER A 228 75.203 11.108 40.872 1.00 33.50 C ATOM 2129 O SER A 228 75.837 11.290 39.824 1.00 34.17 O ATOM 2130 CB SER A 228 75.401 8.680 41.297 1.00 31.39 C ATOM 2131 OG SER A 228 74.700 7.478 41.515 1.00 32.08 O ATOM 2132 HG SER A 228 74.136 7.278 40.726 1.00 0.00 H ATOM 2133 H SER A 228 74.014 9.372 38.996 1.00 0.00 H ATOM 2134 N MET A 229 75.061 12.032 41.810 1.00 33.80 N ATOM 2135 CA MET A 229 75.495 13.401 41.627 1.00 36.38 C ATOM 2136 C MET A 229 76.233 13.950 42.856 1.00 37.56 C ATOM 2137 O MET A 229 75.768 13.796 43.988 1.00 35.32 O ATOM 2138 CB MET A 229 74.273 14.277 41.387 1.00 39.14 C ATOM 2139 CG MET A 229 73.654 14.092 40.014 1.00 41.58 C ATOM 2140 SD MET A 229 72.155 15.088 39.884 1.00 47.47 S ATOM 2141 CE MET A 229 70.992 14.146 40.851 1.00 46.94 C ATOM 2142 H MET A 229 74.621 11.764 42.713 1.00 0.00 H ATOM 2143 N SER A 230 77.352 14.636 42.623 1.00 39.88 N ATOM 2144 CA SER A 230 77.976 15.485 43.667 1.00 41.61 C ATOM 2145 C SER A 230 78.448 16.751 43.019 1.00 43.63 C ATOM 2146 O SER A 230 78.671 16.779 41.810 1.00 40.99 O ATOM 2147 CB SER A 230 79.144 14.772 44.355 1.00 40.68 C ATOM 2148 OG SER A 230 78.661 13.725 45.163 1.00 39.80 O ATOM 2149 HG SER A 230 78.053 14.095 45.852 1.00 0.00 H ATOM 2150 H SER A 230 77.799 14.574 41.686 1.00 0.00 H ATOM 2151 N ALA A 231 78.691 17.776 43.823 1.00 44.91 N ATOM 2152 CA ALA A 231 79.304 19.003 43.301 1.00 48.42 C ATOM 2153 C ALA A 231 80.661 18.708 42.673 1.00 50.10 C ATOM 2154 O ALA A 231 81.421 17.868 43.163 1.00 49.29 O ATOM 2155 CB ALA A 231 79.453 20.052 44.406 1.00 50.22 C ATOM 2156 H ALA A 231 78.445 17.710 44.831 1.00 0.00 H ATOM 2157 N ASP A 232 80.943 19.392 41.569 1.00 51.55 N ATOM 2158 CA ASP A 232 82.252 19.344 40.924 1.00 56.92 C ATOM 2159 C ASP A 232 82.763 17.956 40.531 1.00 56.23 C ATOM 2160 O ASP A 232 83.977 17.787 40.366 1.00 59.43 O ATOM 2161 CB ASP A 232 83.314 20.016 41.806 1.00 61.02 C ATOM 2162 CG ASP A 232 82.951 21.434 42.181 1.00 64.21 C ATOM 2163 OD1 ASP A 232 82.499 22.198 41.289 1.00 63.18 O ATOM 2164 OD2 ASP A 232 83.069 21.759 43.378 1.00 65.71 O ATOM 2165 H ASP A 232 80.201 19.986 41.147 1.00 0.00 H ATOM 2166 N VAL A 233 81.877 16.981 40.323 1.00 50.93 N ATOM 2167 CA VAL A 233 82.315 15.683 39.796 1.00 49.73 C ATOM 2168 C VAL A 233 81.354 15.169 38.699 1.00 46.26 C ATOM 2169 O VAL A 233 80.222 15.663 38.575 1.00 46.69 O ATOM 2170 CB VAL A 233 82.473 14.633 40.915 1.00 49.65 C ATOM 2171 CG1 VAL A 233 83.296 15.194 42.078 1.00 52.45 C ATOM 2172 CG2 VAL A 233 81.127 14.154 41.407 1.00 48.82 C ATOM 2173 H VAL A 233 80.872 17.141 40.535 1.00 0.00 H ATOM 2174 N PRO A 234 81.781 14.147 37.943 1.00 42.70 N ATOM 2175 CA PRO A 234 80.869 13.741 36.848 1.00 41.45 C ATOM 2176 C PRO A 234 79.561 13.155 37.392 1.00 38.69 C ATOM 2177 O PRO A 234 79.542 12.537 38.442 1.00 38.95 O ATOM 2178 CB PRO A 234 81.683 12.704 36.073 1.00 40.15 C ATOM 2179 CG PRO A 234 83.113 13.098 36.336 1.00 42.60 C ATOM 2180 CD PRO A 234 83.132 13.597 37.765 1.00 41.91 C ATOM 2181 N LEU A 235 78.468 13.393 36.682 1.00 37.46 N ATOM 2182 CA LEU A 235 77.238 12.645 36.874 1.00 34.94 C ATOM 2183 C LEU A 235 77.473 11.180 36.452 1.00 35.79 C ATOM 2184 O LEU A 235 78.118 10.934 35.430 1.00 33.78 O ATOM 2185 CB LEU A 235 76.142 13.263 35.996 1.00 34.59 C ATOM 2186 CG LEU A 235 74.854 12.489 35.793 1.00 34.01 C ATOM 2187 CD1 LEU A 235 74.026 12.487 37.072 1.00 32.87 C ATOM 2188 CD2 LEU A 235 74.080 13.168 34.667 1.00 34.81 C ATOM 2189 H LEU A 235 78.492 14.142 35.961 1.00 0.00 H ATOM 2190 N VAL A 236 76.891 10.231 37.184 1.00 34.94 N ATOM 2191 CA VAL A 236 76.822 8.821 36.771 1.00 35.49 C ATOM 2192 C VAL A 236 75.386 8.431 36.459 1.00 33.84 C ATOM 2193 O VAL A 236 74.491 8.614 37.287 1.00 33.24 O ATOM 2194 CB VAL A 236 77.369 7.844 37.844 1.00 37.54 C ATOM 2195 CG1 VAL A 236 77.658 6.484 37.193 1.00 37.90 C ATOM 2196 CG2 VAL A 236 78.630 8.409 38.483 1.00 39.39 C ATOM 2197 H VAL A 236 76.464 10.501 38.093 1.00 0.00 H ATOM 2198 N VAL A 237 75.161 7.965 35.236 1.00 32.92 N ATOM 2199 CA VAL A 237 73.873 7.466 34.797 1.00 32.24 C ATOM 2200 C VAL A 237 74.011 5.947 34.603 1.00 33.01 C ATOM 2201 O VAL A 237 74.800 5.490 33.753 1.00 32.30 O ATOM 2202 CB VAL A 237 73.451 8.168 33.486 1.00 31.94 C ATOM 2203 CG1 VAL A 237 72.109 7.695 33.011 1.00 30.26 C ATOM 2204 CG2 VAL A 237 73.424 9.676 33.665 1.00 32.10 C ATOM 2205 H VAL A 237 75.950 7.958 34.558 1.00 0.00 H ATOM 2206 N GLU A 238 73.302 5.158 35.419 1.00 31.70 N ATOM 2207 CA GLU A 238 73.507 3.711 35.469 1.00 33.67 C ATOM 2208 C GLU A 238 72.273 2.921 35.113 1.00 32.92 C ATOM 2209 O GLU A 238 71.189 3.160 35.657 1.00 32.66 O ATOM 2210 CB GLU A 238 74.005 3.244 36.856 1.00 37.57 C ATOM 2211 CG GLU A 238 74.195 1.721 36.888 1.00 41.94 C ATOM 2212 CD GLU A 238 74.881 1.198 38.138 1.00 45.50 C ATOM 2213 OE1 GLU A 238 74.835 1.890 39.171 1.00 48.62 O ATOM 2214 OE2 GLU A 238 75.495 0.102 38.069 1.00 50.14 O ATOM 2215 H GLU A 238 72.583 5.587 36.036 1.00 0.00 H ATOM 2216 N TYR A 239 72.442 1.985 34.179 1.00 32.64 N ATOM 2217 CA TYR A 239 71.407 1.041 33.771 1.00 33.20 C ATOM 2218 C TYR A 239 71.850 -0.367 34.134 1.00 35.08 C ATOM 2219 O TYR A 239 72.852 -0.871 33.603 1.00 35.28 O ATOM 2220 CB TYR A 239 71.215 1.120 32.239 1.00 32.01 C ATOM 2221 CG TYR A 239 70.698 2.463 31.764 1.00 31.29 C ATOM 2222 CD1 TYR A 239 71.567 3.488 31.471 1.00 31.80 C ATOM 2223 CD2 TYR A 239 69.332 2.724 31.672 1.00 32.04 C ATOM 2224 CE1 TYR A 239 71.118 4.715 31.052 1.00 30.92 C ATOM 2225 CE2 TYR A 239 68.871 3.954 31.223 1.00 32.06 C ATOM 2226 CZ TYR A 239 69.781 4.954 30.952 1.00 32.00 C ATOM 2227 OH TYR A 239 69.357 6.175 30.477 1.00 32.91 O ATOM 2228 HH TYR A 239 68.742 6.588 31.134 1.00 0.00 H ATOM 2229 H TYR A 239 73.369 1.924 33.712 1.00 0.00 H ATOM 2230 N LYS A 240 71.092 -1.028 35.000 1.00 37.57 N ATOM 2231 CA LYS A 240 71.329 -2.441 35.311 1.00 40.15 C ATOM 2232 C LYS A 240 70.952 -3.344 34.155 1.00 38.43 C ATOM 2233 O LYS A 240 69.941 -3.144 33.509 1.00 39.56 O ATOM 2234 CB LYS A 240 70.536 -2.861 36.550 1.00 44.60 C ATOM 2235 CG LYS A 240 71.002 -2.187 37.829 1.00 49.34 C ATOM 2236 CD LYS A 240 72.501 -2.356 38.040 1.00 53.62 C ATOM 2237 CE LYS A 240 72.909 -2.017 39.469 1.00 58.02 C ATOM 2238 NZ LYS A 240 74.404 -2.048 39.575 1.00 60.49 N ATOM 2239 HZ1 LYS A 240 74.748 -2.998 39.329 1.00 0.00 H ATOM 2240 HZ2 LYS A 240 74.811 -1.350 38.920 1.00 0.00 H ATOM 2241 HZ3 LYS A 240 74.686 -1.817 40.549 1.00 0.00 H ATOM 2242 H LYS A 240 70.309 -0.530 35.470 1.00 0.00 H ATOM 2243 N ILE A 241 71.784 -4.334 33.897 1.00 36.75 N ATOM 2244 CA ILE A 241 71.482 -5.380 32.916 1.00 38.07 C ATOM 2245 C ILE A 241 71.240 -6.648 33.734 1.00 41.03 C ATOM 2246 O ILE A 241 72.173 -7.312 34.165 1.00 39.61 O ATOM 2247 CB ILE A 241 72.640 -5.550 31.918 1.00 36.72 C ATOM 2248 CG1 ILE A 241 72.934 -4.218 31.233 1.00 35.51 C ATOM 2249 CG2 ILE A 241 72.303 -6.603 30.867 1.00 38.21 C ATOM 2250 CD1 ILE A 241 74.247 -4.167 30.476 1.00 36.42 C ATOM 2251 H ILE A 241 72.688 -4.374 34.409 1.00 0.00 H ATOM 2252 N ALA A 242 69.977 -6.914 34.046 1.00 47.73 N ATOM 2253 CA ALA A 242 69.640 -7.844 35.148 1.00 51.78 C ATOM 2254 C ALA A 242 70.324 -9.187 34.944 1.00 55.31 C ATOM 2255 O ALA A 242 70.451 -9.647 33.797 1.00 60.40 O ATOM 2256 CB ALA A 242 68.139 -8.041 35.232 1.00 54.26 C ATOM 2257 H ALA A 242 69.211 -6.461 33.507 1.00 0.00 H ATOM 2258 N ASP A 243 70.862 -9.741 36.031 1.00 58.16 N ATOM 2259 CA ASP A 243 71.613 -11.013 36.015 1.00 65.57 C ATOM 2260 C ASP A 243 73.028 -10.952 35.437 1.00 64.04 C ATOM 2261 O ASP A 243 73.737 -11.968 35.409 1.00 73.83 O ATOM 2262 CB ASP A 243 70.842 -12.110 35.269 1.00 68.97 C ATOM 2263 CG ASP A 243 69.488 -12.375 35.871 1.00 75.62 C ATOM 2264 OD1 ASP A 243 69.374 -12.351 37.113 1.00 81.02 O ATOM 2265 OD2 ASP A 243 68.533 -12.594 35.100 1.00 81.42 O ATOM 2266 H ASP A 243 70.746 -9.250 36.941 1.00 0.00 H ATOM 2267 N MET A 244 73.444 -9.795 34.941 1.00 55.16 N ATOM 2268 CA MET A 244 74.673 -9.725 34.169 1.00 50.62 C ATOM 2269 C MET A 244 75.614 -8.650 34.635 1.00 44.48 C ATOM 2270 O MET A 244 76.809 -8.848 34.642 1.00 41.64 O ATOM 2271 CB MET A 244 74.337 -9.531 32.698 1.00 52.43 C ATOM 2272 CG MET A 244 73.567 -10.715 32.165 1.00 56.42 C ATOM 2273 SD MET A 244 74.023 -11.065 30.474 1.00 61.22 S ATOM 2274 CE MET A 244 75.752 -11.449 30.643 1.00 55.41 C ATOM 2275 H MET A 244 72.887 -8.932 35.105 1.00 0.00 H ATOM 2276 N GLY A 245 75.089 -7.483 34.965 1.00 40.63 N ATOM 2277 CA GLY A 245 75.961 -6.363 35.279 1.00 40.58 C ATOM 2278 C GLY A 245 75.290 -5.055 34.965 1.00 37.79 C ATOM 2279 O GLY A 245 74.169 -4.817 35.401 1.00 35.00 O ATOM 2280 H GLY A 245 74.056 -7.366 35.000 1.00 0.00 H ATOM 2281 N HIS A 246 75.964 -4.206 34.198 1.00 36.71 N ATOM 2282 CA HIS A 246 75.512 -2.830 34.054 1.00 38.46 C ATOM 2283 C HIS A 246 76.203 -2.083 32.929 1.00 38.10 C ATOM 2284 O HIS A 246 77.246 -2.505 32.433 1.00 37.53 O ATOM 2285 CB HIS A 246 75.757 -2.063 35.359 1.00 39.85 C ATOM 2286 CG HIS A 246 77.197 -1.962 35.729 1.00 41.10 C ATOM 2287 ND1 HIS A 246 77.717 -2.552 36.864 1.00 44.53 N ATOM 2288 CD2 HIS A 246 78.221 -1.292 35.152 1.00 42.70 C ATOM 2289 CE1 HIS A 246 79.002 -2.260 36.959 1.00 43.56 C ATOM 2290 NE2 HIS A 246 79.342 -1.537 35.906 1.00 44.87 N ATOM 2291 H HIS A 246 76.818 -4.526 33.698 1.00 0.00 H ATOM 2292 N LEU A 247 75.577 -0.984 32.540 1.00 36.80 N ATOM 2293 CA LEU A 247 76.178 0.006 31.698 1.00 38.72 C ATOM 2294 C LEU A 247 76.094 1.310 32.470 1.00 39.22 C ATOM 2295 O LEU A 247 74.996 1.715 32.903 1.00 39.60 O ATOM 2296 CB LEU A 247 75.383 0.048 30.383 1.00 40.55 C ATOM 2297 CG LEU A 247 75.916 0.718 29.135 1.00 42.09 C ATOM 2298 CD1 LEU A 247 77.302 0.233 28.741 1.00 42.76 C ATOM 2299 CD2 LEU A 247 74.926 0.470 28.008 1.00 41.62 C ATOM 2300 H LEU A 247 74.600 -0.832 32.862 1.00 0.00 H ATOM 2301 N LYS A 248 77.253 1.912 32.736 1.00 38.61 N ATOM 2302 CA LYS A 248 77.343 3.190 33.443 1.00 38.71 C ATOM 2303 C LYS A 248 77.928 4.227 32.530 1.00 37.40 C ATOM 2304 O LYS A 248 79.012 4.020 31.981 1.00 38.68 O ATOM 2305 CB LYS A 248 78.277 3.103 34.647 1.00 39.61 C ATOM 2306 CG LYS A 248 77.770 2.301 35.815 1.00 40.95 C ATOM 2307 CD LYS A 248 78.864 2.250 36.869 1.00 43.33 C ATOM 2308 CE LYS A 248 78.453 1.406 38.049 1.00 46.27 C ATOM 2309 NZ LYS A 248 79.416 1.586 39.166 1.00 48.26 N ATOM 2310 HZ1 LYS A 248 80.365 1.298 38.854 1.00 0.00 H ATOM 2311 HZ2 LYS A 248 79.432 2.586 39.450 1.00 0.00 H ATOM 2312 HZ3 LYS A 248 79.122 1.000 39.973 1.00 0.00 H ATOM 2313 H LYS A 248 78.133 1.453 32.427 1.00 0.00 H ATOM 2314 N TYR A 249 77.280 5.379 32.460 1.00 35.72 N ATOM 2315 CA TYR A 249 77.811 6.533 31.760 1.00 35.83 C ATOM 2316 C TYR A 249 78.200 7.626 32.763 1.00 36.36 C ATOM 2317 O TYR A 249 77.445 7.944 33.699 1.00 35.88 O ATOM 2318 CB TYR A 249 76.767 7.077 30.795 1.00 36.38 C ATOM 2319 CG TYR A 249 76.212 6.096 29.799 1.00 34.93 C ATOM 2320 CD1 TYR A 249 75.157 5.253 30.127 1.00 34.45 C ATOM 2321 CD2 TYR A 249 76.722 6.032 28.500 1.00 35.95 C ATOM 2322 CE1 TYR A 249 74.592 4.399 29.193 1.00 34.31 C ATOM 2323 CE2 TYR A 249 76.171 5.172 27.557 1.00 34.70 C ATOM 2324 CZ TYR A 249 75.127 4.346 27.905 1.00 34.71 C ATOM 2325 OH TYR A 249 74.547 3.517 26.970 1.00 34.17 O ATOM 2326 HH TYR A 249 74.178 4.062 26.231 1.00 0.00 H ATOM 2327 H TYR A 249 76.353 5.460 32.925 1.00 0.00 H ATOM 2328 N TYR A 250 79.372 8.219 32.544 1.00 36.31 N ATOM 2329 CA TYR A 250 79.862 9.360 33.313 1.00 37.57 C ATOM 2330 C TYR A 250 79.900 10.589 32.431 1.00 39.51 C ATOM 2331 O TYR A 250 80.451 10.540 31.322 1.00 40.39 O ATOM 2332 CB TYR A 250 81.289 9.092 33.796 1.00 39.23 C ATOM 2333 CG TYR A 250 81.388 7.920 34.710 1.00 37.93 C ATOM 2334 CD1 TYR A 250 81.410 6.623 34.201 1.00 38.49 C ATOM 2335 CD2 TYR A 250 81.462 8.099 36.086 1.00 39.22 C ATOM 2336 CE1 TYR A 250 81.479 5.534 35.037 1.00 39.73 C ATOM 2337 CE2 TYR A 250 81.566 7.016 36.935 1.00 38.48 C ATOM 2338 CZ TYR A 250 81.544 5.743 36.407 1.00 38.91 C ATOM 2339 OH TYR A 250 81.662 4.658 37.202 1.00 42.81 O ATOM 2340 HH TYR A 250 81.624 3.839 36.648 1.00 0.00 H ATOM 2341 H TYR A 250 79.973 7.848 31.781 1.00 0.00 H ATOM 2342 N LEU A 251 79.392 11.705 32.932 1.00 39.08 N ATOM 2343 CA LEU A 251 79.371 12.945 32.160 1.00 39.31 C ATOM 2344 C LEU A 251 79.968 14.067 32.974 1.00 40.87 C ATOM 2345 O LEU A 251 79.448 14.390 34.044 1.00 40.22 O ATOM 2346 CB LEU A 251 77.938 13.311 31.803 1.00 38.67 C ATOM 2347 CG LEU A 251 77.702 14.565 30.966 1.00 39.19 C ATOM 2348 CD1 LEU A 251 78.506 14.504 29.675 1.00 41.03 C ATOM 2349 CD2 LEU A 251 76.216 14.706 30.646 1.00 38.23 C ATOM 2350 H LEU A 251 79.000 11.698 33.895 1.00 0.00 H ATOM 2351 N ALA A 252 81.010 14.703 32.432 1.00 42.79 N ATOM 2352 CA ALA A 252 81.593 15.870 33.047 1.00 44.44 C ATOM 2353 C ALA A 252 80.583 17.019 33.067 1.00 45.59 C ATOM 2354 O ALA A 252 79.877 17.255 32.084 1.00 44.86 O ATOM 2355 CB ALA A 252 82.857 16.292 32.311 1.00 46.80 C ATOM 2356 H ALA A 252 81.412 14.347 31.542 1.00 0.00 H ATOM 2357 N PRO A 253 80.483 17.716 34.205 1.00 45.17 N ATOM 2358 CA PRO A 253 79.569 18.841 34.280 1.00 47.57 C ATOM 2359 C PRO A 253 80.071 20.066 33.502 1.00 51.61 C ATOM 2360 O PRO A 253 81.243 20.135 33.120 1.00 52.08 O ATOM 2361 CB PRO A 253 79.503 19.131 35.786 1.00 47.08 C ATOM 2362 CG PRO A 253 80.851 18.743 36.293 1.00 46.09 C ATOM 2363 CD PRO A 253 81.356 17.634 35.385 1.00 47.23 C ATOM 2364 N LYS A 254 79.160 20.998 33.249 1.00 54.64 N ATOM 2365 CA LYS A 254 79.499 22.324 32.782 1.00 58.29 C ATOM 2366 C LYS A 254 79.630 23.236 33.979 1.00 60.53 C ATOM 2367 O LYS A 254 78.907 23.056 34.946 1.00 62.36 O ATOM 2368 CB LYS A 254 78.383 22.886 31.910 1.00 61.22 C ATOM 2369 CG LYS A 254 77.987 21.995 30.753 1.00 63.00 C ATOM 2370 CD LYS A 254 76.940 22.660 29.881 1.00 66.31 C ATOM 2371 CE LYS A 254 77.597 23.494 28.805 1.00 70.39 C ATOM 2372 NZ LYS A 254 76.603 24.295 28.047 1.00 71.99 N ATOM 2373 HZ1 LYS A 254 75.918 23.657 27.594 1.00 0.00 H ATOM 2374 HZ2 LYS A 254 76.105 24.934 28.699 1.00 0.00 H ATOM 2375 HZ3 LYS A 254 77.092 24.853 27.319 1.00 0.00 H ATOM 2376 H LYS A 254 78.157 20.764 33.393 1.00 0.00 H ATOM 2377 N ILE A 255 80.516 24.226 33.895 1.00 67.08 N ATOM 2378 CA ILE A 255 80.431 25.448 34.729 1.00 71.93 C ATOM 2379 C ILE A 255 79.662 26.570 34.034 1.00 74.01 C ATOM 2380 O ILE A 255 80.031 27.010 32.945 1.00 76.18 O ATOM 2381 CB ILE A 255 81.808 25.991 35.191 1.00 74.97 C ATOM 2382 CG1 ILE A 255 82.837 26.009 34.056 1.00 76.48 C ATOM 2383 CG2 ILE A 255 82.325 25.194 36.384 1.00 75.80 C ATOM 2384 CD1 ILE A 255 83.999 26.954 34.289 1.00 77.29 C ATOM 2385 H ILE A 255 81.299 24.138 33.217 1.00 0.00 H TER 2386 ILE A 255 HETATM 2387 NA NA A 1 66.828 -23.489 15.701 1.00 48.73 NA HETATM 2388 NA NA A 2 61.684 12.308 50.008 1.00 32.54 NA HETATM 2389 NA NA A 3 50.535 15.378 38.113 1.00 63.61 NA HETATM 2390 O HOH 4 90.812 -9.130 12.936 1.00 44.72 O HETATM 2391 O HOH 5 68.943 -15.243 13.162 1.00 40.71 O HETATM 2392 O HOH 6 91.332 -13.933 33.638 1.00 54.71 O HETATM 2393 O HOH 7 75.386 5.910 43.316 1.00 46.63 O HETATM 2394 O HOH 8 80.882 -21.580 26.700 1.00 45.41 O HETATM 2395 O HOH 9 75.596 -20.764 9.193 1.00 35.44 O HETATM 2396 O HOH 10 70.251 1.674 37.465 1.00 42.15 O HETATM 2397 O HOH 11 66.199 15.711 48.075 1.00 59.68 O HETATM 2398 O HOH 12 67.617 -12.998 22.505 1.00 48.15 O HETATM 2399 O HOH 13 81.884 17.084 45.554 1.00 57.28 O HETATM 2400 O HOH 14 74.844 5.813 23.669 1.00 40.61 O HETATM 2401 O HOH 15 86.309 -23.809 12.952 1.00 50.34 O HETATM 2402 O HOH 16 56.136 18.099 44.982 1.00 54.74 O HETATM 2403 O HOH 17 64.507 -13.956 17.019 1.00 56.70 O HETATM 2404 O HOH 18 66.647 -7.990 26.151 1.00 44.71 O HETATM 2405 O HOH 19 62.071 3.681 39.369 1.00 33.19 O HETATM 2406 O HOH 20 77.974 17.942 46.315 1.00 46.37 O HETATM 2407 O HOH 21 59.163 15.974 29.636 1.00 35.11 O HETATM 2408 O HOH 22 70.059 27.115 25.504 1.00 47.93 O HETATM 2409 O HOH 23 66.308 10.899 25.817 1.00 32.08 O HETATM 2410 O HOH 24 67.252 -5.881 15.223 1.00 48.82 O HETATM 2411 O HOH 25 73.988 -0.710 12.737 1.00 59.05 O HETATM 2412 O HOH 26 74.299 6.234 39.242 1.00 36.12 O HETATM 2413 O HOH 27 68.738 -0.254 12.214 1.00 61.88 O HETATM 2414 O HOH 28 62.997 0.144 29.257 1.00 36.68 O HETATM 2415 O HOH 29 73.260 -6.364 37.361 1.00 42.00 O HETATM 2416 O HOH 30 62.825 4.071 42.714 1.00 33.69 O HETATM 2417 O HOH 31 75.527 21.698 43.644 1.00 49.07 O HETATM 2418 O HOH 32 65.802 -29.944 14.290 1.00 59.93 O HETATM 2419 O HOH 33 87.871 -1.461 27.519 1.00 49.18 O HETATM 2420 O HOH 34 92.356 -17.317 21.814 1.00 43.82 O HETATM 2421 O HOH 35 58.749 7.614 46.294 1.00 31.39 O HETATM 2422 O HOH 36 60.914 17.719 56.630 1.00 46.20 O HETATM 2423 O HOH 37 93.084 -3.306 20.395 1.00 68.92 O HETATM 2424 O HOH 38 67.125 -25.407 14.507 1.00 50.76 O HETATM 2425 O HOH 39 74.336 4.548 21.018 1.00 44.82 O HETATM 2426 O HOH 40 73.377 19.634 24.503 1.00 48.05 O HETATM 2427 O HOH 41 89.158 -12.139 35.148 1.00 51.36 O HETATM 2428 O HOH 42 55.781 17.249 40.717 1.00 36.55 O HETATM 2429 O HOH 43 57.227 5.237 46.214 1.00 38.68 O HETATM 2430 O HOH 44 66.641 6.347 30.280 1.00 29.52 O HETATM 2431 O HOH 45 74.381 -19.339 19.443 1.00 40.53 O HETATM 2432 O HOH 46 75.882 4.361 39.644 1.00 54.26 O HETATM 2433 O HOH 47 84.839 -18.241 33.795 1.00 45.37 O HETATM 2434 O HOH 48 67.522 -4.926 33.383 1.00 40.77 O HETATM 2435 O HOH 49 94.620 -7.268 20.838 1.00 62.38 O HETATM 2436 O HOH 50 86.965 -19.439 31.791 1.00 58.19 O HETATM 2437 O HOH 51 56.624 13.994 46.908 1.00 44.80 O HETATM 2438 O HOH 52 66.479 -17.160 22.928 1.00 43.51 O HETATM 2439 O HOH 53 78.222 -19.007 32.716 1.00 47.50 O HETATM 2440 O HOH 54 77.837 18.333 30.385 1.00 41.99 O HETATM 2441 O HOH 55 83.207 9.260 20.339 1.00 46.84 O HETATM 2442 O HOH 56 58.575 -3.270 38.890 1.00 65.00 O HETATM 2443 O HOH 57 70.280 -17.403 12.511 1.00 31.52 O HETATM 2444 O HOH 58 71.501 -13.540 10.054 1.00 28.53 O HETATM 2445 O HOH 59 67.227 -3.622 35.685 1.00 59.24 O HETATM 2446 O HOH 60 94.224 3.341 19.203 1.00 63.80 O HETATM 2447 O HOH 61 80.524 -18.050 13.466 1.00 40.55 O HETATM 2448 O HOH 62 69.559 -0.355 23.841 1.00 34.75 O HETATM 2449 O HOH 63 87.124 -8.736 31.571 1.00 51.24 O HETATM 2450 O HOH 64 68.081 -13.531 11.569 1.00 49.80 O HETATM 2451 O HOH 65 72.087 13.557 21.275 1.00 39.83 O HETATM 2452 O HOH 66 63.581 22.661 19.388 1.00 43.00 O HETATM 2453 O HOH 67 68.990 -22.592 14.947 1.00 41.45 O HETATM 2454 O HOH 68 88.689 -26.015 22.970 1.00 62.99 O HETATM 2455 O HOH 69 77.860 14.562 39.686 1.00 38.06 O HETATM 2456 O HOH 70 92.438 -7.523 18.846 1.00 50.95 O HETATM 2457 O HOH 71 76.209 -4.598 38.169 1.00 51.81 O HETATM 2458 O HOH 72 70.699 -24.317 16.181 1.00 55.81 O HETATM 2459 O HOH 73 53.242 9.390 48.833 1.00 31.42 O HETATM 2460 O HOH 74 85.049 -3.722 10.944 1.00 29.60 O HETATM 2461 O HOH 75 63.060 20.368 49.983 1.00 64.10 O HETATM 2462 O HOH 76 69.094 -25.310 11.868 1.00 36.29 O HETATM 2463 O HOH 77 70.046 -15.544 28.775 1.00 46.28 O HETATM 2464 O HOH 78 65.537 5.943 24.213 1.00 66.35 O HETATM 2465 O HOH 79 55.916 20.414 47.222 1.00 43.76 O HETATM 2466 O HOH 80 75.310 -21.307 33.604 1.00 42.24 O HETATM 2467 O HOH 81 64.041 -3.708 34.027 1.00 47.05 O HETATM 2468 O HOH 82 57.375 7.621 43.353 1.00 27.01 O HETATM 2469 O HOH 83 66.675 22.043 38.525 1.00 43.79 O HETATM 2470 O HOH 84 87.944 -11.751 8.271 1.00 66.69 O HETATM 2471 O HOH 85 69.563 21.177 22.448 1.00 48.15 O HETATM 2472 O HOH 86 65.042 15.349 18.997 1.00 58.49 O HETATM 2473 O HOH 87 88.633 1.079 24.979 1.00 47.37 O HETATM 2474 O HOH 88 75.820 -12.439 38.917 1.00 62.84 O HETATM 2475 O HOH 89 60.462 7.698 26.812 1.00 44.90 O HETATM 2476 O HOH 90 82.755 10.351 17.315 1.00 69.53 O HETATM 2477 O HOH 91 84.863 6.898 19.854 1.00 60.26 O HETATM 2478 O HOH 92 73.372 9.929 48.503 1.00 53.56 O HETATM 2479 O HOH 93 60.484 2.991 32.596 1.00 41.36 O HETATM 2480 O HOH 94 83.237 -8.681 34.193 1.00 60.69 O HETATM 2481 O HOH 95 49.645 1.522 45.287 1.00 58.06 O HETATM 2482 O HOH 96 69.620 2.822 42.868 1.00 52.38 O HETATM 2483 O HOH 97 49.383 5.303 48.185 1.00 44.32 O HETATM 2484 O HOH 98 63.347 -18.236 16.615 1.00 49.12 O HETATM 2485 O HOH 99 56.423 9.307 41.100 1.00 45.35 O HETATM 2486 O HOH 100 84.899 -4.852 14.764 1.00 53.97 O HETATM 2487 O HOH 101 77.358 22.996 42.126 1.00 69.06 O HETATM 2488 O HOH 102 79.512 12.918 20.015 1.00 53.46 O HETATM 2489 O HOH 103 82.172 -17.064 11.915 1.00 41.23 O HETATM 2490 O HOH 104 59.097 5.143 32.197 1.00 51.00 O HETATM 2491 O HOH 105 64.709 9.824 23.642 1.00 48.83 O HETATM 2492 O HOH 106 75.899 3.195 13.765 1.00 54.68 O HETATM 2493 O HOH 107 68.238 32.221 24.161 1.00 65.51 O HETATM 2494 O HOH 108 87.303 -16.454 16.027 1.00 47.01 O HETATM 2495 O HOH 109 61.153 1.975 30.044 1.00 44.91 O HETATM 2496 O HOH 110 70.987 -4.830 16.875 1.00 50.04 O HETATM 2497 O HOH 111 66.616 -5.732 20.847 1.00 46.33 O HETATM 2498 O HOH 112 84.548 -19.731 15.081 1.00 52.76 O HETATM 2499 O HOH 113 67.750 -24.127 17.674 1.00 40.25 O HETATM 2500 O HOH 114 53.709 -0.194 45.780 1.00 54.73 O HETATM 2501 O HOH 115 93.872 -7.223 14.622 1.00 57.82 O HETATM 2502 O HOH 116 61.760 9.814 25.036 1.00 59.30 O HETATM 2503 O HOH 117 81.531 22.274 37.227 1.00 49.56 O HETATM 2504 O HOH 118 63.576 -3.626 30.439 1.00 54.81 O HETATM 2505 O HOH 119 50.148 9.083 41.050 1.00 30.80 O HETATM 2506 O HOH 120 71.321 19.280 22.553 1.00 61.15 O HETATM 2507 O HOH 121 51.224 10.964 48.196 1.00 59.61 O HETATM 2508 O HOH 122 68.336 -3.582 19.877 1.00 45.84 O HETATM 2509 O HOH 123 68.784 -3.526 17.182 1.00 38.96 O HETATM 2510 O HOH 124 62.369 0.351 26.393 1.00 47.60 O HETATM 2511 O HOH 125 55.076 20.091 41.233 1.00 51.71 O HETATM 2512 O HOH 126 67.797 -1.157 21.617 1.00 37.93 O HETATM 2513 O HOH 127 65.266 -2.275 21.934 1.00 47.70 O HETATM 2514 O HOH 128 88.003 20.299 32.643 1.00 56.52 O HETATM 2515 O HOH 129 84.322 23.940 26.767 1.00 63.04 O HETATM 2516 O HOH 130 65.115 -7.565 0.896 1.00 27.54 O HETATM 2517 O HOH 131 73.894 -27.637 8.681 1.00 40.16 O HETATM 2518 O HOH 132 69.274 -12.886 8.387 1.00 39.20 O HETATM 2519 O HOH 133 72.643 -4.818 9.426 1.00 42.21 O HETATM 2520 O HOH 134 76.731 -19.890 0.258 1.00 36.90 O HETATM 2521 O HOH 135 80.205 -10.847 -0.743 1.00 51.53 O HETATM 2522 O HOH 136 70.196 -5.764 8.876 1.00 41.64 O HETATM 2523 O HOH 137 71.078 -28.865 7.198 1.00 60.18 O HETATM 2524 O HOH 138 65.085 -23.708 7.396 1.00 38.26 O HETATM 2525 O HOH 139 79.686 -19.566 0.456 1.00 55.10 O HETATM 2526 O HOH 140 81.430 -16.548 9.058 1.00 52.34 O HETATM 2527 O HOH 141 75.503 -3.737 -0.233 1.00 46.48 O HETATM 2528 O HOH 142 81.433 -6.643 -0.562 1.00 41.76 O HETATM 2529 O HOH 143 69.194 -27.697 10.894 1.00 54.23 O HETATM 2530 O HOH 144 70.592 -24.658 9.610 1.00 49.06 O HETATM 2531 O HOH 145 61.363 -9.931 6.317 1.00 49.71 O HETATM 2532 O HOH 146 57.002 -15.500 4.329 1.00 34.60 O HETATM 2533 O HOH 147 55.675 -13.258 4.068 1.00 44.89 O HETATM 2534 O HOH 148 81.056 -14.924 0.365 1.00 52.14 O HETATM 2535 O HOH 149 81.103 -8.609 -2.302 1.00 53.83 O HETATM 2536 O HOH 150 85.671 -9.004 0.640 1.00 56.40 O HETATM 2537 O HOH 151 65.068 -8.297 14.780 1.00 61.40 O HETATM 2538 O HOH 152 72.772 -2.109 9.899 1.00 42.27 O HETATM 2539 O HOH 153 56.331 21.806 15.951 1.00 49.28 O HETATM 2540 O HOH 154 47.626 22.237 34.461 1.00 43.59 O HETATM 2541 O HOH 155 59.330 19.894 21.642 1.00 50.07 O HETATM 2542 O HOH 156 53.694 15.473 31.346 1.00 45.80 O HETATM 2543 O HOH 157 50.945 20.664 19.554 1.00 41.62 O HETATM 2544 O HOH 158 44.562 15.420 27.579 1.00 42.93 O HETATM 2545 O HOH 159 57.133 22.406 37.523 1.00 42.69 O HETATM 2546 O HOH 160 55.983 33.918 20.290 1.00 58.42 O HETATM 2547 O HOH 161 49.363 11.151 39.512 1.00 72.47 O HETATM 2548 O HOH 162 57.127 18.349 30.005 1.00 36.29 O HETATM 2549 O HOH 163 54.257 17.289 33.242 1.00 36.95 O HETATM 2550 O HOH 164 54.328 18.372 13.860 1.00 52.10 O HETATM 2551 O HOH 165 51.368 10.888 25.335 1.00 61.11 O HETATM 2552 O HOH 166 53.433 14.912 21.388 1.00 44.10 O HETATM 2553 O HOH 167 51.889 18.628 20.664 1.00 41.63 O HETATM 2554 O HOH 168 57.231 22.471 13.272 1.00 42.13 O HETATM 2555 O HOH 169 57.062 24.673 11.572 1.00 44.08 O HETATM 2556 O HOH 170 48.394 16.524 18.633 1.00 32.79 O HETATM 2557 O HOH 171 50.994 16.920 19.104 1.00 48.45 O HETATM 2558 O HOH 172 56.286 22.002 40.028 1.00 49.32 O HETATM 2559 N LYS A 173 81.413 26.798 30.432 1.00 0.24 N HETATM 2560 CA LYS A 173 82.478 25.942 29.836 1.00 0.07 C HETATM 2561 C LYS A 173 82.267 24.469 30.184 1.00 0.23 C HETATM 2562 O LYS A 173 82.042 24.114 31.347 1.00 -0.39 O HETATM 2563 N LYS A 173 82.358 23.622 29.162 1.00 -0.26 N HETATM 2564 CA LYS A 173 82.266 22.178 29.326 1.00 0.13 C HETATM 2565 C LYS A 173 83.610 21.650 29.822 1.00 0.20 C HETATM 2566 O LYS A 173 84.635 21.859 29.180 1.00 -0.39 O HETATM 2567 N LYS A 173 83.601 20.980 30.971 1.00 -0.26 N HETATM 2568 CA LYS A 173 84.817 20.406 31.528 1.00 0.14 C HETATM 2569 C LYS A 173 85.210 19.147 30.776 1.00 0.21 C HETATM 2570 O LYS A 173 84.388 18.531 30.093 1.00 -0.39 O HETATM 2571 N LYS A 173 86.475 18.769 30.930 1.00 -0.26 N HETATM 2572 CA LYS A 173 87.021 17.567 30.326 1.00 0.14 C HETATM 2573 C LYS A 173 86.906 16.429 31.322 1.00 0.21 C HETATM 2574 O LYS A 173 87.189 16.616 32.500 1.00 -0.39 O HETATM 2575 N LYS A 173 86.536 15.246 30.833 1.00 -0.26 N HETATM 2576 CA LYS A 173 86.334 14.063 31.683 1.00 0.13 C HETATM 2577 C LYS A 173 87.643 13.529 32.290 1.00 0.20 C HETATM 2578 O LYS A 173 87.628 12.855 33.321 1.00 -0.39 O HETATM 2579 N LYS A 173 88.774 13.844 31.666 1.00 -0.26 N HETATM 2580 CA LYS A 173 90.078 13.444 32.203 1.00 0.13 C HETATM 2581 C LYS A 173 90.545 14.320 33.369 1.00 0.20 C HETATM 2582 O LYS A 173 91.467 13.948 34.093 1.00 -0.39 O HETATM 2583 N LYS A 173 89.905 15.470 33.556 1.00 -0.26 N HETATM 2584 CA LYS A 173 90.132 16.290 34.742 1.00 0.15 C HETATM 2585 C LYS A 173 89.704 15.588 36.040 1.00 0.21 C HETATM 2586 O LYS A 173 90.054 16.046 37.124 1.00 -0.39 O HETATM 2587 N LYS A 173 88.927 14.507 35.933 1.00 -0.26 N HETATM 2588 CA LYS A 173 88.303 13.884 37.104 1.00 0.14 C HETATM 2589 C LYS A 173 88.798 12.478 37.406 1.00 0.21 C HETATM 2590 O LYS A 173 88.584 11.978 38.509 1.00 -0.39 O HETATM 2591 N LYS A 173 89.421 11.823 36.430 1.00 -0.26 N HETATM 2592 CA LYS A 173 89.889 10.450 36.608 1.00 0.14 C HETATM 2593 C LYS A 173 91.341 10.325 36.179 1.00 0.21 C HETATM 2594 O LYS A 173 91.772 10.985 35.236 1.00 -0.39 O HETATM 2595 N LYS A 173 92.068 9.431 36.845 1.00 -0.27 N HETATM 2596 CA LYS A 173 93.515 9.303 36.673 1.00 0.10 C HETATM 2597 C LYS A 173 93.924 7.828 36.656 1.00 0.06 C HETATM 2598 O LYS A 173 94.554 7.356 35.707 1.00 -0.57 O HETATM 2599 OXT LYS A 173 93.633 7.079 37.591 1.00 -0.57 O HETATM 2600 CB LYS A 173 94.271 10.054 37.796 1.00 -0.01 C HETATM 2601 CG1 LYS A 173 93.725 9.677 39.170 1.00 -0.06 C HETATM 2602 H85 LYS A 173 94.279 10.224 39.947 1.00 0.02 H HETATM 2603 H86 LYS A 173 93.844 8.595 39.328 1.00 0.02 H HETATM 2604 H87 LYS A 173 92.659 9.941 39.226 1.00 0.02 H HETATM 2605 CG2 LYS A 173 95.773 9.801 37.709 1.00 -0.06 C HETATM 2606 H88 LYS A 173 96.135 10.082 36.709 1.00 0.02 H HETATM 2607 H89 LYS A 173 95.976 8.735 37.886 1.00 0.02 H HETATM 2608 H90 LYS A 173 96.291 10.404 38.469 1.00 0.02 H HETATM 2609 H84 LYS A 173 94.103 11.132 37.652 1.00 0.03 H HETATM 2610 H83 LYS A 173 93.790 9.753 35.708 1.00 0.07 H HETATM 2611 H82 LYS A 173 91.606 8.822 37.489 1.00 0.19 H HETATM 2612 CB LYS A 173 89.028 9.472 35.797 1.00 0.02 C HETATM 2613 CG LYS A 173 87.578 9.432 36.215 1.00 -0.04 C HETATM 2614 CD1 LYS A 173 87.223 9.320 37.555 1.00 -0.06 C HETATM 2615 CE1 LYS A 173 85.891 9.273 37.938 1.00 -0.07 C HETATM 2616 CZ LYS A 173 84.896 9.321 36.977 1.00 -0.07 C HETATM 2617 CE2 LYS A 173 85.234 9.415 35.636 1.00 -0.07 C HETATM 2618 CD2 LYS A 173 86.567 9.467 35.260 1.00 -0.06 C HETATM 2619 H78 LYS A 173 86.825 9.536 34.209 1.00 0.06 H HETATM 2620 H80 LYS A 173 84.456 9.448 34.882 1.00 0.06 H HETATM 2621 H81 LYS A 173 83.854 9.285 37.273 1.00 0.06 H HETATM 2622 H79 LYS A 173 85.630 9.199 38.987 1.00 0.06 H HETATM 2623 H77 LYS A 173 87.998 9.269 38.311 1.00 0.06 H HETATM 2624 H75 LYS A 173 89.449 8.463 35.914 1.00 0.05 H HETATM 2625 H76 LYS A 173 89.074 9.768 34.739 1.00 0.05 H HETATM 2626 H74 LYS A 173 89.811 10.189 37.674 1.00 0.08 H HETATM 2627 H73 LYS A 173 89.573 12.281 35.554 1.00 0.19 H HETATM 2628 CB LYS A 173 86.782 13.866 36.929 1.00 0.02 C HETATM 2629 CG LYS A 173 86.196 15.218 36.665 1.00 -0.04 C HETATM 2630 CD1 LYS A 173 85.899 16.070 37.708 1.00 -0.06 C HETATM 2631 CE1 LYS A 173 85.369 17.324 37.469 1.00 -0.07 C HETATM 2632 CZ LYS A 173 85.154 17.748 36.169 1.00 -0.07 C HETATM 2633 CE2 LYS A 173 85.487 16.918 35.115 1.00 -0.07 C HETATM 2634 CD2 LYS A 173 85.998 15.659 35.367 1.00 -0.06 C HETATM 2635 H69 LYS A 173 86.247 15.008 34.537 1.00 0.06 H HETATM 2636 H71 LYS A 173 85.348 17.254 34.094 1.00 0.06 H HETATM 2637 H72 LYS A 173 84.727 18.726 35.978 1.00 0.06 H HETATM 2638 H70 LYS A 173 85.122 17.975 38.300 1.00 0.06 H HETATM 2639 H68 LYS A 173 86.084 15.752 38.728 1.00 0.06 H HETATM 2640 H66 LYS A 173 86.330 13.464 37.848 1.00 0.05 H HETATM 2641 H67 LYS A 173 86.537 13.209 36.082 1.00 0.05 H HETATM 2642 H65 LYS A 173 88.543 14.511 37.976 1.00 0.08 H HETATM 2643 H64 LYS A 173 88.766 14.111 35.029 1.00 0.19 H HETATM 2644 CB LYS A 173 89.385 17.622 34.628 1.00 0.08 C HETATM 2645 OG LYS A 173 89.634 18.257 33.387 1.00 -0.39 O HETATM 2646 H63 LYS A 173 89.156 19.078 33.351 1.00 0.21 H HETATM 2647 H61 LYS A 173 89.714 18.286 35.441 1.00 0.06 H HETATM 2648 H62 LYS A 173 88.305 17.434 34.722 1.00 0.06 H HETATM 2649 H60 LYS A 173 91.210 16.498 34.805 1.00 0.08 H HETATM 2650 H59 LYS A 173 89.251 15.781 32.866 1.00 0.19 H HETATM 2651 CB LYS A 173 91.136 13.456 31.099 1.00 -0.01 C HETATM 2652 CG LYS A 173 90.915 12.393 30.039 1.00 -0.02 C HETATM 2653 CD LYS A 173 91.784 12.624 28.819 1.00 0.06 C HETATM 2654 NE LYS A 173 91.407 13.839 28.102 1.00 -0.27 N HETATM 2655 CZ LYS A 173 91.819 14.141 26.874 1.00 0.29 C HETATM 2656 NH1 LYS A 173 92.620 13.314 26.207 1.00 -0.28 N HETATM 2657 H55 LYS A 173 92.934 13.556 25.256 1.00 0.26 H HETATM 2658 H56 LYS A 173 92.926 12.432 26.641 1.00 0.26 H HETATM 2659 NH2 LYS A 173 91.431 15.273 26.311 1.00 -0.28 N HETATM 2660 H57 LYS A 173 90.811 15.917 26.823 1.00 0.26 H HETATM 2661 H58 LYS A 173 91.749 15.511 25.361 1.00 0.26 H HETATM 2662 H54 LYS A 173 90.782 14.505 28.578 1.00 0.26 H HETATM 2663 H52 LYS A 173 91.680 11.764 28.141 1.00 0.07 H HETATM 2664 H53 LYS A 173 92.832 12.712 29.141 1.00 0.07 H HETATM 2665 H50 LYS A 173 89.859 12.411 29.732 1.00 0.03 H HETATM 2666 H51 LYS A 173 91.156 11.409 30.466 1.00 0.03 H HETATM 2667 H48 LYS A 173 92.121 13.290 31.559 1.00 0.03 H HETATM 2668 H49 LYS A 173 91.120 14.442 30.612 1.00 0.03 H HETATM 2669 H47 LYS A 173 89.981 12.414 32.576 1.00 0.08 H HETATM 2670 H46 LYS A 173 88.734 14.364 30.813 1.00 0.19 H HETATM 2671 CB LYS A 173 85.592 12.937 30.900 1.00 -0.00 C HETATM 2672 CG1 LYS A 173 85.069 11.838 31.837 1.00 -0.05 C HETATM 2673 CD1 LYS A 173 84.044 12.314 32.846 1.00 -0.06 C HETATM 2674 H43 LYS A 173 83.725 11.468 33.472 1.00 0.02 H HETATM 2675 H44 LYS A 173 83.172 12.727 32.317 1.00 0.02 H HETATM 2676 H45 LYS A 173 84.490 13.093 33.482 1.00 0.02 H HETATM 2677 H38 LYS A 173 85.924 11.418 32.387 1.00 0.03 H HETATM 2678 H39 LYS A 173 84.607 11.052 31.222 1.00 0.03 H HETATM 2679 CG2 LYS A 173 86.492 12.326 29.832 1.00 -0.06 C HETATM 2680 H40 LYS A 173 86.862 13.120 29.166 1.00 0.02 H HETATM 2681 H41 LYS A 173 85.919 11.593 29.245 1.00 0.02 H HETATM 2682 H42 LYS A 173 87.345 11.825 30.314 1.00 0.02 H HETATM 2683 H37 LYS A 173 84.727 13.393 30.397 1.00 0.03 H HETATM 2684 H36 LYS A 173 85.688 14.370 32.519 1.00 0.08 H HETATM 2685 H35 LYS A 173 86.390 15.159 29.848 1.00 0.19 H HETATM 2686 CB LYS A 173 88.494 17.786 29.975 1.00 0.04 C HETATM 2687 CG LYS A 173 89.032 16.745 29.020 1.00 0.04 C HETATM 2688 OD1 LYS A 173 89.254 15.589 29.434 1.00 -0.57 O HETATM 2689 OD2 LYS A 173 89.273 17.102 27.853 1.00 -0.57 O HETATM 2690 H33 LYS A 173 89.085 17.750 30.902 1.00 0.05 H HETATM 2691 H34 LYS A 173 88.600 18.777 29.510 1.00 0.05 H HETATM 2692 H32 LYS A 173 86.458 17.322 29.414 1.00 0.08 H HETATM 2693 H31 LYS A 173 87.079 19.339 31.488 1.00 0.19 H HETATM 2694 CB LYS A 173 84.646 20.091 33.017 1.00 0.01 C HETATM 2695 CG LYS A 173 84.890 21.265 33.912 1.00 -0.00 C HETATM 2696 ND1 LYS A 173 86.049 21.412 34.645 1.00 -0.33 N HETATM 2697 CE1 LYS A 173 85.996 22.543 35.323 1.00 0.09 C HETATM 2698 NE2 LYS A 173 84.850 23.140 35.049 1.00 -0.28 N HETATM 2699 CD2 LYS A 173 84.141 22.363 34.166 1.00 0.03 C HETATM 2700 H28 LYS A 173 83.161 22.588 33.749 1.00 0.07 H HETATM 2701 H30 LYS A 173 84.538 24.043 35.435 1.00 0.24 H HETATM 2702 H29 LYS A 173 86.766 22.920 35.994 1.00 0.12 H HETATM 2703 H26 LYS A 173 85.355 19.295 33.287 1.00 0.04 H HETATM 2704 H27 LYS A 173 83.618 19.737 33.181 1.00 0.04 H HETATM 2705 H25 LYS A 173 85.626 21.143 31.420 1.00 0.08 H HETATM 2706 H24 LYS A 173 82.738 20.868 31.464 1.00 0.19 H HETATM 2707 CB LYS A 173 81.874 21.518 27.989 1.00 0.00 C HETATM 2708 CG LYS A 173 81.940 19.995 27.971 1.00 0.04 C HETATM 2709 CD LYS A 173 80.905 19.343 28.874 1.00 0.17 C HETATM 2710 OE1 LYS A 173 79.703 19.474 28.646 1.00 -0.40 O HETATM 2711 NE2 LYS A 173 81.370 18.621 29.892 1.00 -0.30 N HETATM 2712 H22 LYS A 173 80.733 18.170 30.517 1.00 0.18 H HETATM 2713 H23 LYS A 173 82.356 18.530 30.031 1.00 0.18 H HETATM 2714 H20 LYS A 173 82.941 19.684 28.304 1.00 0.05 H HETATM 2715 H21 LYS A 173 81.773 19.649 26.940 1.00 0.05 H HETATM 2716 H18 LYS A 173 82.553 21.897 27.211 1.00 0.03 H HETATM 2717 H19 LYS A 173 80.842 21.816 27.752 1.00 0.03 H HETATM 2718 H17 LYS A 173 81.493 21.948 30.074 1.00 0.08 H HETATM 2719 H16 LYS A 173 82.495 23.992 28.243 1.00 0.19 H HETATM 2720 CB LYS A 173 83.868 26.390 30.306 1.00 0.01 C HETATM 2721 CG LYS A 173 84.512 27.480 29.457 1.00 -0.04 C HETATM 2722 CD LYS A 173 84.967 26.970 28.093 1.00 -0.01 C HETATM 2723 CE LYS A 173 86.259 26.166 28.170 1.00 -0.04 C HETATM 2724 NZ LYS A 173 87.460 27.031 28.339 1.00 0.22 N HETATM 2725 H13 LYS A 173 88.286 26.454 28.384 1.00 0.20 H HETATM 2726 H14 LYS A 173 87.374 27.562 29.191 1.00 0.20 H HETATM 2727 H15 LYS A 173 87.533 27.661 27.556 1.00 0.20 H HETATM 2728 H11 LYS A 173 86.370 25.586 27.242 1.00 0.08 H HETATM 2729 H12 LYS A 173 86.196 25.479 29.026 1.00 0.08 H HETATM 2730 H9 LYS A 173 85.128 27.833 27.430 1.00 0.03 H HETATM 2731 H10 LYS A 173 84.177 26.328 27.675 1.00 0.03 H HETATM 2732 H7 LYS A 173 85.386 27.875 29.995 1.00 0.03 H HETATM 2733 H8 LYS A 173 83.780 28.287 29.305 1.00 0.03 H HETATM 2734 H5 LYS A 173 84.531 25.513 30.296 1.00 0.03 H HETATM 2735 H6 LYS A 173 83.775 26.768 31.335 1.00 0.03 H HETATM 2736 H4 LYS A 173 82.430 26.049 28.742 1.00 0.11 H HETATM 2737 H1 LYS A 173 81.579 27.761 30.186 1.00 0.20 H HETATM 2738 H2 LYS A 173 81.426 26.701 31.435 1.00 0.20 H HETATM 2739 H3 LYS A 173 80.514 26.511 30.078 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 985 984 2387 CONECT 1009 1008 2387 CONECT 1529 1528 2388 CONECT 1710 1709 2388 CONECT 2387 985 1009 CONECT 2388 1529 1710 CONECT 2559 2560 2737 2738 2739 CONECT 2560 2559 2561 2720 2736 CONECT 2561 2560 2562 2563 CONECT 2562 2561 CONECT 2563 2561 2564 2719 CONECT 2564 2563 2565 2707 2718 CONECT 2565 2564 2566 2567 CONECT 2566 2565 CONECT 2567 2565 2568 2706 CONECT 2568 2567 2569 2694 2705 CONECT 2569 2568 2570 2571 CONECT 2570 2569 CONECT 2571 2569 2572 2693 CONECT 2572 2571 2573 2686 2692 CONECT 2573 2572 2574 2575 CONECT 2574 2573 CONECT 2575 2573 2576 2685 CONECT 2576 2575 2577 2671 2684 CONECT 2577 2576 2578 2579 CONECT 2578 2577 CONECT 2579 2577 2580 2670 CONECT 2580 2579 2581 2651 2669 CONECT 2581 2580 2582 2583 CONECT 2582 2581 CONECT 2583 2581 2584 2650 CONECT 2584 2583 2585 2644 2649 CONECT 2585 2584 2586 2587 CONECT 2586 2585 CONECT 2587 2585 2588 2643 CONECT 2588 2587 2589 2628 2642 CONECT 2589 2588 2590 2591 CONECT 2590 2589 CONECT 2591 2589 2592 2627 CONECT 2592 2591 2593 2612 2626 CONECT 2593 2592 2594 2595 CONECT 2594 2593 CONECT 2595 2593 2596 2611 CONECT 2596 2595 2597 2600 2610 CONECT 2597 2596 2598 2599 CONECT 2598 2597 CONECT 2599 2597 CONECT 2600 2596 2601 2605 2609 CONECT 2601 2600 2602 2603 2604 CONECT 2602 2601 CONECT 2603 2601 CONECT 2604 2601 CONECT 2605 2600 2606 2607 2608 CONECT 2606 2605 CONECT 2607 2605 CONECT 2608 2605 CONECT 2609 2600 CONECT 2610 2596 CONECT 2611 2595 CONECT 2612 2592 2613 2624 2625 CONECT 2613 2612 2614 2618 CONECT 2614 2613 2615 2623 CONECT 2615 2614 2616 2622 CONECT 2616 2615 2617 2621 CONECT 2617 2616 2618 2620 CONECT 2618 2613 2617 2619 CONECT 2619 2618 CONECT 2620 2617 CONECT 2621 2616 CONECT 2622 2615 CONECT 2623 2614 CONECT 2624 2612 CONECT 2625 2612 CONECT 2626 2592 CONECT 2627 2591 CONECT 2628 2588 2629 2640 2641 CONECT 2629 2628 2630 2634 CONECT 2630 2629 2631 2639 CONECT 2631 2630 2632 2638 CONECT 2632 2631 2633 2637 CONECT 2633 2632 2634 2636 CONECT 2634 2629 2633 2635 CONECT 2635 2634 CONECT 2636 2633 CONECT 2637 2632 CONECT 2638 2631 CONECT 2639 2630 CONECT 2640 2628 CONECT 2641 2628 CONECT 2642 2588 CONECT 2643 2587 CONECT 2644 2584 2645 2647 2648 CONECT 2645 2644 2646 CONECT 2646 2645 CONECT 2647 2644 CONECT 2648 2644 CONECT 2649 2584 CONECT 2650 2583 CONECT 2651 2580 2652 2667 2668 CONECT 2652 2651 2653 2665 2666 CONECT 2653 2652 2654 2663 2664 CONECT 2654 2653 2655 2662 CONECT 2655 2654 2656 2659 CONECT 2656 2655 2657 2658 CONECT 2657 2656 CONECT 2658 2656 CONECT 2659 2655 2660 2661 CONECT 2660 2659 CONECT 2661 2659 CONECT 2662 2654 CONECT 2663 2653 CONECT 2664 2653 CONECT 2665 2652 CONECT 2666 2652 CONECT 2667 2651 CONECT 2668 2651 CONECT 2669 2580 CONECT 2670 2579 CONECT 2671 2576 2672 2679 2683 CONECT 2672 2671 2673 2677 2678 CONECT 2673 2672 2674 2675 2676 CONECT 2674 2673 CONECT 2675 2673 CONECT 2676 2673 CONECT 2677 2672 CONECT 2678 2672 CONECT 2679 2671 2680 2681 2682 CONECT 2680 2679 CONECT 2681 2679 CONECT 2682 2679 CONECT 2683 2671 CONECT 2684 2576 CONECT 2685 2575 CONECT 2686 2572 2687 2690 2691 CONECT 2687 2686 2688 2689 CONECT 2688 2687 CONECT 2689 2687 CONECT 2690 2686 CONECT 2691 2686 CONECT 2692 2572 CONECT 2693 2571 CONECT 2694 2568 2695 2703 2704 CONECT 2695 2694 2696 2699 CONECT 2696 2695 2697 CONECT 2697 2696 2698 2702 CONECT 2698 2697 2699 2701 CONECT 2699 2695 2698 2700 CONECT 2700 2699 CONECT 2701 2698 CONECT 2702 2697 CONECT 2703 2694 CONECT 2704 2694 CONECT 2705 2568 CONECT 2706 2567 CONECT 2707 2564 2708 2716 2717 CONECT 2708 2707 2709 2714 2715 CONECT 2709 2708 2710 2711 CONECT 2710 2709 CONECT 2711 2709 2712 2713 CONECT 2712 2711 CONECT 2713 2711 CONECT 2714 2708 CONECT 2715 2708 CONECT 2716 2707 CONECT 2717 2707 CONECT 2718 2564 CONECT 2719 2563 CONECT 2720 2560 2721 2734 2735 CONECT 2721 2720 2722 2732 2733 CONECT 2722 2721 2723 2730 2731 CONECT 2723 2722 2724 2728 2729 CONECT 2724 2723 2725 2726 2727 CONECT 2725 2724 CONECT 2726 2724 CONECT 2727 2724 CONECT 2728 2723 CONECT 2729 2723 CONECT 2730 2722 CONECT 2731 2722 CONECT 2732 2721 CONECT 2733 2721 CONECT 2734 2720 CONECT 2735 2720 CONECT 2736 2560 CONECT 2737 2559 CONECT 2738 2559 CONECT 2739 2559 MASTER 0 0 0 0 0 0 0 0 2738 1 191 20 END
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Entry Information
PDB ID
5mlo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Proliferating cell nuclear antigen
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
1.96(Å)
Affinity (Kd/Ki/IC50)
Kd=4.8uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Nat Commun Vol. 8: pp. 15847-15847
Ligand Properties
Formula
C
5
9
H
9
2
N
1
7
O
1
5
Molecular Weight
1279.470
Exact Mass
1278.700
No. of atoms
183
No. of bonds
185
Polar Surface Area
549.79
LOGP Value
-2.41 (
Computed with XLOGP3
)
-1.90 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 50
No. of Nitrogen and Oxygen Atoms: 32
No. of Rings: 3
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)Cc1ccccc1)Cc1ccccc1)CO)CCC[NH+]=C(N)N)[C@H](CC)C)CC(=O)O)Cc1nc[nH]c1)CCC(=O)N)[NH3+]
InChI String
InChI=1S/C59H89N17O15/c1-5-33(4)48(76-55(87)43(28-46(79)80)73-53(85)42(27-36-29-65-31-67-36)72-51(83)39(21-22-45(62)78)68-49(81)37(61)19-12-13-23-60)57(89)69-38(20-14-24-66-59(63)64)50(82)74-44(30-77)56(88)71-40(25-34-15-8-6-9-16-34)52(84)70-41(26-35-17-10-7-11-18-35)54(86)75-47(32(2)3)58(90)91/h6-11,15-18,29,31-33,37-44,47-48,77H,5,12-14,19-28,30,60-61H2,1-4H3,(H2,62,78)(H,65,67)(H,68,81)(H,69,89)(H,70,84)(H,71,88)(H,72,83)(H,73,85)(H,74,82)(H,75,86)(H,76,87)(H,79,80)(H,90,91)(H4,63,64,66)/p+3/t33-,37-,38-,39-,40-,41-,42-,43-,44-,47-,48-/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):
Q5FWF4
P12004
Entrez Gene ID
NCBI Entrez Gene ID:
84083
5111
ASD
Information of known allosteric effects of PDB entries
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