Browse entries in the PDBbind-CN Database
HEADER 4P3H_COMPLEX COMPND 4P3H_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 190 GLY LEU TYR VAL GLY GLY PHE VAL ASP VAL VAL SER CYS SEQRES 2 A 190 PRO LYS LEU GLU GLN GLU LEU TYR LEU ASP PRO ASP GLN SEQRES 3 A 190 VAL THR ASP TYR LEU PRO VAL THR GLU PRO LEU PRO ILE SEQRES 4 A 190 THR ILE GLU HIS LEU PRO GLU THR GLU VAL GLY TRP THR SEQRES 5 A 190 LEU GLY LEU PHE GLN VAL SER HIS GLY ILE PHE CYS THR SEQRES 6 A 190 GLY ALA ILE THR SER PRO ALA PHE LEU GLU LEU ALA SER SEQRES 7 A 190 ARG LEU ALA ASP THR SER HIS VAL ALA ARG ALA PRO VAL SEQRES 8 A 190 LYS ASN LEU PRO LYS GLU PRO LEU LEU GLU ILE LEU HIS SEQRES 9 A 190 THR TRP LEU PRO GLY LEU SER LEU SER SER ILE HIS PRO SEQRES 10 A 190 ARG GLU LEU SER GLN THR PRO SER GLY PRO VAL PHE GLN SEQRES 11 A 190 HIS VAL SER LEU CYS ALA LEU GLY ARG ARG ARG GLY THR SEQRES 12 A 190 VAL ALA VAL TYR GLY HIS ASP ALA GLU TRP VAL VAL SER SEQRES 13 A 190 ARG PHE SER SER VAL SER LYS SER GLU ARG ALA HIS ILE SEQRES 14 A 190 LEU GLN HIS VAL SER SER CYS ARG LEU GLU ASP LEU SER SEQRES 15 A 190 THR PRO ASN PHE VAL SER PRO LEU HET UNN A 333 62 ATOM 1 N GLY A 4 -7.011 -16.245 -44.796 1.00 79.96 N ATOM 2 CA GLY A 4 -7.666 -15.846 -43.559 1.00 83.51 C ATOM 3 C GLY A 4 -8.897 -14.992 -43.795 1.00 78.44 C ATOM 4 O GLY A 4 -9.036 -14.397 -44.861 1.00 88.82 O ATOM 5 HN3 GLY A 4 -6.714 -15.396 -45.319 1.00 0.00 H ATOM 6 HN2 GLY A 4 -7.675 -16.797 -45.376 1.00 0.00 H ATOM 7 HN1 GLY A 4 -6.177 -16.826 -44.574 1.00 0.00 H ATOM 8 N LEU A 5 -9.789 -14.925 -42.805 1.00 55.72 N ATOM 9 CA LEU A 5 -10.901 -13.978 -42.850 1.00 36.41 C ATOM 10 C LEU A 5 -10.956 -13.153 -41.567 1.00 30.39 C ATOM 11 O LEU A 5 -10.953 -13.691 -40.455 1.00 29.81 O ATOM 12 CB LEU A 5 -12.235 -14.700 -43.084 1.00 37.00 C ATOM 13 CG LEU A 5 -13.184 -14.215 -44.188 1.00 54.31 C ATOM 14 CD1 LEU A 5 -14.561 -14.790 -43.938 1.00 57.71 C ATOM 15 CD2 LEU A 5 -13.271 -12.706 -44.269 1.00 63.38 C ATOM 16 H LEU A 5 -9.691 -15.559 -41.986 1.00 0.00 H ATOM 17 N TYR A 6 -10.951 -11.838 -41.735 1.00 31.38 N ATOM 18 CA TYR A 6 -11.077 -10.883 -40.644 1.00 28.80 C ATOM 19 C TYR A 6 -12.367 -10.093 -40.799 1.00 27.69 C ATOM 20 O TYR A 6 -12.868 -9.915 -41.931 1.00 28.92 O ATOM 21 CB TYR A 6 -9.892 -9.926 -40.623 1.00 33.30 C ATOM 22 CG TYR A 6 -8.587 -10.601 -40.326 1.00 41.57 C ATOM 23 CD1 TYR A 6 -8.125 -10.702 -39.021 1.00 46.02 C ATOM 24 CD2 TYR A 6 -7.823 -11.158 -41.340 1.00 46.39 C ATOM 25 CE1 TYR A 6 -6.931 -11.326 -38.731 1.00 53.21 C ATOM 26 CE2 TYR A 6 -6.617 -11.786 -41.060 1.00 55.86 C ATOM 27 CZ TYR A 6 -6.179 -11.866 -39.750 1.00 56.45 C ATOM 28 OH TYR A 6 -4.992 -12.487 -39.447 1.00 59.14 O ATOM 29 HH TYR A 6 -4.841 -12.449 -38.469 1.00 0.00 H ATOM 30 H TYR A 6 -10.851 -11.468 -42.702 1.00 0.00 H ATOM 31 N VAL A 7 -12.902 -9.607 -39.690 1.00 29.12 N ATOM 32 CA VAL A 7 -14.074 -8.755 -39.731 1.00 25.57 C ATOM 33 C VAL A 7 -13.805 -7.547 -38.867 1.00 26.28 C ATOM 34 O VAL A 7 -13.074 -7.638 -37.891 1.00 27.30 O ATOM 35 CB VAL A 7 -15.326 -9.515 -39.244 1.00 23.74 C ATOM 36 CG1 VAL A 7 -15.149 -10.002 -37.818 1.00 26.66 C ATOM 37 CG2 VAL A 7 -16.586 -8.659 -39.389 1.00 28.27 C ATOM 38 H VAL A 7 -12.473 -9.841 -38.772 1.00 0.00 H ATOM 39 N GLY A 8 -14.342 -6.402 -39.262 1.00 26.36 N ATOM 40 CA GLY A 8 -14.183 -5.200 -38.494 1.00 27.35 C ATOM 41 C GLY A 8 -15.349 -4.246 -38.583 1.00 26.67 C ATOM 42 O GLY A 8 -16.052 -4.195 -39.581 1.00 29.30 O ATOM 43 H GLY A 8 -14.889 -6.374 -40.146 1.00 0.00 H ATOM 44 N GLY A 9 -15.530 -3.442 -37.540 1.00 30.06 N ATOM 45 CA GLY A 9 -16.538 -2.405 -37.582 1.00 34.43 C ATOM 46 C GLY A 9 -16.913 -1.886 -36.220 1.00 33.88 C ATOM 47 O GLY A 9 -16.472 -2.411 -35.197 1.00 28.95 O ATOM 48 H GLY A 9 -14.944 -3.559 -36.689 1.00 0.00 H ATOM 49 N PHE A 10 -17.708 -0.827 -36.208 1.00 34.60 N ATOM 50 CA PHE A 10 -18.289 -0.321 -34.972 1.00 31.72 C ATOM 51 C PHE A 10 -19.464 -1.183 -34.545 1.00 31.60 C ATOM 52 O PHE A 10 -20.267 -1.635 -35.384 1.00 33.02 O ATOM 53 CB PHE A 10 -18.713 1.140 -35.135 1.00 35.40 C ATOM 54 CG PHE A 10 -17.563 2.084 -35.297 1.00 39.19 C ATOM 55 CD1 PHE A 10 -17.064 2.394 -36.550 1.00 44.03 C ATOM 56 CD2 PHE A 10 -16.985 2.678 -34.189 1.00 41.28 C ATOM 57 CE1 PHE A 10 -16.004 3.267 -36.691 1.00 45.52 C ATOM 58 CE2 PHE A 10 -15.933 3.555 -34.325 1.00 45.47 C ATOM 59 CZ PHE A 10 -15.440 3.854 -35.574 1.00 54.12 C ATOM 60 H PHE A 10 -17.923 -0.344 -37.104 1.00 0.00 H ATOM 61 N VAL A 11 -19.550 -1.421 -33.237 1.00 30.84 N ATOM 62 CA VAL A 11 -20.560 -2.302 -32.681 1.00 31.47 C ATOM 63 C VAL A 11 -21.723 -1.543 -32.065 1.00 32.34 C ATOM 64 O VAL A 11 -21.597 -0.372 -31.675 1.00 35.06 O ATOM 65 CB VAL A 11 -19.977 -3.198 -31.562 1.00 28.09 C ATOM 66 CG1 VAL A 11 -18.769 -3.988 -32.047 1.00 27.66 C ATOM 67 CG2 VAL A 11 -19.587 -2.376 -30.332 1.00 30.28 C ATOM 68 H VAL A 11 -18.873 -0.962 -32.595 1.00 0.00 H ATOM 69 N ASP A 12 -22.851 -2.235 -31.959 1.00 30.37 N ATOM 70 CA ASP A 12 -23.873 -1.900 -30.976 1.00 33.42 C ATOM 71 C ASP A 12 -23.596 -2.710 -29.718 1.00 31.51 C ATOM 72 O ASP A 12 -23.200 -3.874 -29.820 1.00 32.40 O ATOM 73 CB ASP A 12 -25.257 -2.245 -31.491 1.00 32.63 C ATOM 74 CG ASP A 12 -25.794 -1.202 -32.420 1.00 37.95 C ATOM 75 OD1 ASP A 12 -26.268 -0.142 -31.927 1.00 37.82 O ATOM 76 OD2 ASP A 12 -25.737 -1.440 -33.653 1.00 37.78 O ATOM 77 H ASP A 12 -23.010 -3.041 -32.597 1.00 0.00 H ATOM 78 N VAL A 13 -23.793 -2.092 -28.551 1.00 30.92 N ATOM 79 CA VAL A 13 -23.633 -2.743 -27.243 1.00 29.51 C ATOM 80 C VAL A 13 -25.016 -3.099 -26.701 1.00 37.63 C ATOM 81 O VAL A 13 -25.860 -2.228 -26.531 1.00 34.72 O ATOM 82 CB VAL A 13 -22.875 -1.840 -26.286 1.00 35.44 C ATOM 83 CG1 VAL A 13 -22.633 -2.548 -24.954 1.00 35.88 C ATOM 84 CG2 VAL A 13 -21.549 -1.405 -26.916 1.00 36.24 C ATOM 85 H VAL A 13 -24.076 -1.091 -28.569 1.00 0.00 H ATOM 86 N VAL A 14 -25.267 -4.387 -26.485 1.00 32.02 N ATOM 87 CA VAL A 14 -26.606 -4.847 -26.106 1.00 32.31 C ATOM 88 C VAL A 14 -26.591 -5.762 -24.880 1.00 30.70 C ATOM 89 O VAL A 14 -25.815 -6.715 -24.838 1.00 29.51 O ATOM 90 CB VAL A 14 -27.281 -5.602 -27.257 1.00 30.61 C ATOM 91 CG1 VAL A 14 -28.729 -5.912 -26.897 1.00 30.30 C ATOM 92 CG2 VAL A 14 -27.213 -4.788 -28.567 1.00 29.85 C ATOM 93 H VAL A 14 -24.499 -5.081 -26.587 1.00 0.00 H ATOM 94 N SER A 15 -27.476 -5.487 -23.926 1.00 34.50 N ATOM 95 CA SER A 15 -27.685 -6.340 -22.758 1.00 32.80 C ATOM 96 C SER A 15 -28.882 -7.251 -23.017 1.00 42.99 C ATOM 97 O SER A 15 -29.929 -6.791 -23.460 1.00 34.91 O ATOM 98 CB SER A 15 -27.928 -5.490 -21.500 1.00 38.88 C ATOM 99 OG SER A 15 -28.473 -6.276 -20.457 1.00 44.22 O ATOM 100 HG SER A 15 -29.335 -6.662 -20.752 1.00 0.00 H ATOM 101 H SER A 15 -28.047 -4.623 -24.016 1.00 0.00 H ATOM 102 N CYS A 16 -28.731 -8.538 -22.737 1.00 34.26 N ATOM 103 CA CYS A 16 -29.798 -9.523 -22.953 1.00 34.98 C ATOM 104 C CYS A 16 -30.318 -9.503 -24.395 1.00 33.41 C ATOM 105 O CYS A 16 -31.532 -9.431 -24.630 1.00 33.81 O ATOM 106 CB CYS A 16 -30.958 -9.317 -21.969 1.00 38.22 C ATOM 107 SG CYS A 16 -30.535 -9.756 -20.301 1.00 45.37 S ATOM 108 H CYS A 16 -27.822 -8.862 -22.350 1.00 0.00 H ATOM 109 N PRO A 17 -29.405 -9.574 -25.368 1.00 30.63 N ATOM 110 CA PRO A 17 -29.826 -9.545 -26.771 1.00 30.15 C ATOM 111 C PRO A 17 -30.865 -10.625 -27.096 1.00 32.53 C ATOM 112 O PRO A 17 -30.778 -11.749 -26.594 1.00 35.78 O ATOM 113 CB PRO A 17 -28.513 -9.784 -27.533 1.00 33.90 C ATOM 114 CG PRO A 17 -27.594 -10.427 -26.560 1.00 31.25 C ATOM 115 CD PRO A 17 -27.977 -9.918 -25.201 1.00 32.11 C ATOM 116 N LYS A 18 -31.864 -10.256 -27.895 1.00 35.65 N ATOM 117 CA LYS A 18 -32.884 -11.192 -28.398 1.00 43.46 C ATOM 118 C LYS A 18 -33.879 -11.650 -27.329 1.00 44.73 C ATOM 119 O LYS A 18 -34.746 -12.483 -27.608 1.00 45.16 O ATOM 120 CB LYS A 18 -32.252 -12.437 -29.055 1.00 36.75 C ATOM 121 CG LYS A 18 -31.070 -12.182 -30.005 1.00 43.20 C ATOM 122 CD LYS A 18 -31.483 -11.574 -31.343 1.00 39.37 C ATOM 123 CE LYS A 18 -32.273 -12.538 -32.249 1.00 33.38 C ATOM 124 NZ LYS A 18 -31.463 -13.719 -32.677 1.00 30.92 N ATOM 125 HZ1 LYS A 18 -30.630 -13.393 -33.207 1.00 0.00 H ATOM 126 HZ2 LYS A 18 -31.155 -14.250 -31.837 1.00 0.00 H ATOM 127 HZ3 LYS A 18 -32.042 -14.334 -33.284 1.00 0.00 H ATOM 128 H LYS A 18 -31.927 -9.257 -28.178 1.00 0.00 H ATOM 129 N LEU A 19 -33.766 -11.105 -26.117 1.00 39.44 N ATOM 130 CA LEU A 19 -34.665 -11.452 -25.014 1.00 43.66 C ATOM 131 C LEU A 19 -35.629 -10.320 -24.697 1.00 44.64 C ATOM 132 O LEU A 19 -35.474 -9.200 -25.174 1.00 43.63 O ATOM 133 CB LEU A 19 -33.853 -11.796 -23.756 1.00 45.40 C ATOM 134 CG LEU A 19 -32.841 -12.941 -23.874 1.00 42.58 C ATOM 135 CD1 LEU A 19 -32.087 -13.091 -22.555 1.00 51.44 C ATOM 136 CD2 LEU A 19 -33.532 -14.244 -24.244 1.00 51.66 C ATOM 137 H LEU A 19 -33.012 -10.408 -25.949 1.00 0.00 H ATOM 138 N GLU A 20 -36.618 -10.621 -23.865 1.00 60.49 N ATOM 139 CA GLU A 20 -37.573 -9.621 -23.413 1.00 69.42 C ATOM 140 C GLU A 20 -36.872 -8.411 -22.790 1.00 55.17 C ATOM 141 O GLU A 20 -37.296 -7.266 -22.988 1.00 59.15 O ATOM 142 CB GLU A 20 -38.525 -10.246 -22.392 1.00 60.70 C ATOM 143 CG GLU A 20 -39.650 -9.328 -21.942 1.00 94.93 C ATOM 144 CD GLU A 20 -40.533 -9.963 -20.884 1.00 99.80 C ATOM 145 OE1 GLU A 20 -40.150 -11.022 -20.340 1.00 96.17 O ATOM 146 OE2 GLU A 20 -41.613 -9.404 -20.596 1.00103.88 O ATOM 147 H GLU A 20 -36.713 -11.600 -23.526 1.00 0.00 H ATOM 148 N GLN A 21 -35.800 -8.665 -22.040 1.00 53.42 N ATOM 149 CA GLN A 21 -35.138 -7.606 -21.277 1.00 62.00 C ATOM 150 C GLN A 21 -34.062 -6.930 -22.097 1.00 54.99 C ATOM 151 O GLN A 21 -33.216 -6.228 -21.551 1.00 49.10 O ATOM 152 CB GLN A 21 -34.494 -8.154 -20.000 1.00 74.07 C ATOM 153 CG GLN A 21 -35.428 -8.926 -19.093 1.00 84.22 C ATOM 154 CD GLN A 21 -35.688 -10.337 -19.581 1.00 87.62 C ATOM 155 OE1 GLN A 21 -35.013 -10.834 -20.486 1.00 58.61 O ATOM 156 NE2 GLN A 21 -36.679 -10.992 -18.986 1.00103.81 N ATOM 157 HE22 GLN A 21 -37.223 -10.534 -18.227 1.00 0.00 H ATOM 158 HE21 GLN A 21 -36.911 -11.962 -19.280 1.00 0.00 H ATOM 159 H GLN A 21 -35.427 -9.635 -21.996 1.00 0.00 H ATOM 160 N GLU A 22 -34.087 -7.151 -23.403 1.00 41.91 N ATOM 161 CA GLU A 22 -33.080 -6.575 -24.283 1.00 39.25 C ATOM 162 C GLU A 22 -32.979 -5.075 -24.060 1.00 43.38 C ATOM 163 O GLU A 22 -33.992 -4.376 -24.016 1.00 44.50 O ATOM 164 CB GLU A 22 -33.420 -6.843 -25.742 1.00 40.19 C ATOM 165 CG GLU A 22 -32.408 -6.261 -26.701 1.00 36.91 C ATOM 166 CD GLU A 22 -32.772 -6.533 -28.133 1.00 41.67 C ATOM 167 OE1 GLU A 22 -32.305 -7.564 -28.656 1.00 43.30 O ATOM 168 OE2 GLU A 22 -33.526 -5.722 -28.716 1.00 50.33 O ATOM 169 H GLU A 22 -34.839 -7.746 -23.807 1.00 0.00 H ATOM 170 N LEU A 23 -31.745 -4.598 -23.925 1.00 40.06 N ATOM 171 CA LEU A 23 -31.479 -3.188 -23.711 1.00 41.73 C ATOM 172 C LEU A 23 -30.193 -2.794 -24.420 1.00 47.58 C ATOM 173 O LEU A 23 -29.121 -3.311 -24.109 1.00 41.58 O ATOM 174 CB LEU A 23 -31.364 -2.890 -22.208 1.00 45.11 C ATOM 175 CG LEU A 23 -31.148 -1.424 -21.881 1.00 48.94 C ATOM 176 CD1 LEU A 23 -32.372 -0.600 -22.232 1.00 52.58 C ATOM 177 CD2 LEU A 23 -30.824 -1.280 -20.401 1.00 52.10 C ATOM 178 H LEU A 23 -30.943 -5.258 -23.975 1.00 0.00 H ATOM 179 N TYR A 24 -30.305 -1.885 -25.383 1.00 39.76 N ATOM 180 CA TYR A 24 -29.144 -1.328 -26.068 1.00 42.29 C ATOM 181 C TYR A 24 -28.534 -0.271 -25.163 1.00 49.12 C ATOM 182 O TYR A 24 -29.250 0.575 -24.633 1.00 45.85 O ATOM 183 CB TYR A 24 -29.544 -0.689 -27.405 1.00 48.93 C ATOM 184 CG TYR A 24 -29.747 -1.661 -28.550 1.00 39.96 C ATOM 185 CD1 TYR A 24 -28.959 -1.591 -29.683 1.00 38.72 C ATOM 186 CD2 TYR A 24 -30.732 -2.629 -28.494 1.00 40.41 C ATOM 187 CE1 TYR A 24 -29.146 -2.483 -30.743 1.00 32.28 C ATOM 188 CE2 TYR A 24 -30.921 -3.520 -29.541 1.00 38.05 C ATOM 189 CZ TYR A 24 -30.118 -3.441 -30.649 1.00 37.04 C ATOM 190 OH TYR A 24 -30.319 -4.312 -31.698 1.00 37.07 O ATOM 191 HH TYR A 24 -30.204 -5.242 -31.380 1.00 0.00 H ATOM 192 H TYR A 24 -31.254 -1.559 -25.658 1.00 0.00 H ATOM 193 N LEU A 25 -27.216 -0.335 -24.989 1.00 39.93 N ATOM 194 CA LEU A 25 -26.489 0.585 -24.117 1.00 49.43 C ATOM 195 C LEU A 25 -25.824 1.700 -24.924 1.00 44.84 C ATOM 196 O LEU A 25 -25.328 1.464 -26.029 1.00 45.99 O ATOM 197 CB LEU A 25 -25.397 -0.175 -23.352 1.00 45.66 C ATOM 198 CG LEU A 25 -25.750 -1.026 -22.128 1.00 50.99 C ATOM 199 CD1 LEU A 25 -26.554 -2.251 -22.493 1.00 51.67 C ATOM 200 CD2 LEU A 25 -24.470 -1.421 -21.395 1.00 56.13 C ATOM 201 H LEU A 25 -26.682 -1.070 -25.495 1.00 0.00 H ATOM 202 N ASP A 26 -25.820 2.910 -24.376 1.00 50.46 N ATOM 203 CA ASP A 26 -24.972 3.982 -24.884 1.00 57.87 C ATOM 204 C ASP A 26 -23.529 3.504 -24.685 1.00 58.04 C ATOM 205 O ASP A 26 -23.214 2.943 -23.640 1.00 54.90 O ATOM 206 CB ASP A 26 -25.284 5.276 -24.112 1.00 66.29 C ATOM 207 CG ASP A 26 -24.233 6.369 -24.294 1.00 72.10 C ATOM 208 OD1 ASP A 26 -23.535 6.408 -25.323 1.00 71.03 O ATOM 209 OD2 ASP A 26 -24.124 7.222 -23.389 1.00 85.60 O ATOM 210 H ASP A 26 -26.439 3.098 -23.562 1.00 0.00 H ATOM 211 N PRO A 27 -22.662 3.664 -25.699 1.00 51.78 N ATOM 212 CA PRO A 27 -21.293 3.155 -25.535 1.00 52.23 C ATOM 213 C PRO A 27 -20.536 3.753 -24.344 1.00 52.29 C ATOM 214 O PRO A 27 -19.639 3.108 -23.801 1.00 49.45 O ATOM 215 CB PRO A 27 -20.611 3.537 -26.858 1.00 60.07 C ATOM 216 CG PRO A 27 -21.544 4.521 -27.530 1.00 61.78 C ATOM 217 CD PRO A 27 -22.903 4.115 -27.080 1.00 54.93 C ATOM 218 N ASP A 28 -20.897 4.958 -23.926 1.00 48.37 N ATOM 219 CA ASP A 28 -20.207 5.579 -22.804 1.00 59.60 C ATOM 220 C ASP A 28 -20.473 4.841 -21.490 1.00 46.49 C ATOM 221 O ASP A 28 -19.747 5.030 -20.523 1.00 48.46 O ATOM 222 CB ASP A 28 -20.579 7.059 -22.693 1.00 75.36 C ATOM 223 CG ASP A 28 -19.920 7.905 -23.772 1.00 90.39 C ATOM 224 OD1 ASP A 28 -20.598 8.792 -24.332 1.00100.53 O ATOM 225 OD2 ASP A 28 -18.722 7.685 -24.060 1.00 90.47 O ATOM 226 H ASP A 28 -21.674 5.461 -24.400 1.00 0.00 H ATOM 227 N GLN A 29 -21.476 3.971 -21.469 1.00 46.82 N ATOM 228 CA GLN A 29 -21.783 3.190 -20.272 1.00 55.04 C ATOM 229 C GLN A 29 -20.801 2.043 -20.044 1.00 48.01 C ATOM 230 O GLN A 29 -20.748 1.490 -18.941 1.00 45.86 O ATOM 231 CB GLN A 29 -23.204 2.626 -20.345 1.00 68.86 C ATOM 232 CG GLN A 29 -24.292 3.680 -20.247 1.00 79.50 C ATOM 233 CD GLN A 29 -25.686 3.086 -20.228 1.00 84.38 C ATOM 234 OE1 GLN A 29 -26.288 2.843 -21.276 1.00 83.16 O ATOM 235 NE2 GLN A 29 -26.211 2.853 -19.031 1.00 90.85 N ATOM 236 HE22 GLN A 29 -25.667 3.074 -18.173 1.00 0.00 H ATOM 237 HE21 GLN A 29 -27.166 2.450 -18.952 1.00 0.00 H ATOM 238 H GLN A 29 -22.056 3.842 -22.323 1.00 0.00 H ATOM 239 N VAL A 30 -20.034 1.686 -21.077 1.00 40.57 N ATOM 240 CA VAL A 30 -19.067 0.590 -20.977 1.00 37.74 C ATOM 241 C VAL A 30 -17.620 0.979 -21.313 1.00 38.56 C ATOM 242 O VAL A 30 -16.724 0.141 -21.215 1.00 40.86 O ATOM 243 CB VAL A 30 -19.462 -0.637 -21.868 1.00 47.69 C ATOM 244 CG1 VAL A 30 -20.812 -1.213 -21.436 1.00 50.29 C ATOM 245 CG2 VAL A 30 -19.442 -0.286 -23.365 1.00 42.48 C ATOM 246 H VAL A 30 -20.125 2.200 -21.977 1.00 0.00 H ATOM 247 N THR A 31 -17.379 2.227 -21.708 1.00 43.10 N ATOM 248 CA THR A 31 -16.028 2.619 -22.109 1.00 49.52 C ATOM 249 C THR A 31 -14.996 2.482 -20.981 1.00 47.31 C ATOM 250 O THR A 31 -13.812 2.303 -21.254 1.00 48.55 O ATOM 251 CB THR A 31 -15.976 4.051 -22.685 1.00 84.27 C ATOM 252 OG1 THR A 31 -16.811 4.919 -21.911 1.00 97.60 O ATOM 253 CG2 THR A 31 -16.437 4.056 -24.142 1.00 80.35 C ATOM 254 HG1 THR A 31 -17.744 4.589 -21.939 1.00 0.00 H ATOM 255 H THR A 31 -18.151 2.923 -21.732 1.00 0.00 H ATOM 256 N ASP A 32 -15.435 2.568 -19.725 1.00 44.38 N ATOM 257 CA ASP A 32 -14.542 2.332 -18.591 1.00 52.60 C ATOM 258 C ASP A 32 -13.975 0.917 -18.592 1.00 47.26 C ATOM 259 O ASP A 32 -12.972 0.636 -17.934 1.00 43.30 O ATOM 260 CB ASP A 32 -15.277 2.548 -17.268 1.00 60.10 C ATOM 261 CG ASP A 32 -15.532 4.006 -16.971 1.00 62.06 C ATOM 262 OD1 ASP A 32 -14.957 4.865 -17.671 1.00 59.02 O ATOM 263 OD2 ASP A 32 -16.296 4.291 -16.022 1.00 62.92 O ATOM 264 H ASP A 32 -16.432 2.807 -19.548 1.00 0.00 H ATOM 265 N TYR A 33 -14.626 0.022 -19.321 1.00 42.24 N ATOM 266 CA TYR A 33 -14.260 -1.384 -19.301 1.00 35.42 C ATOM 267 C TYR A 33 -13.543 -1.798 -20.578 1.00 37.52 C ATOM 268 O TYR A 33 -13.357 -2.988 -20.835 1.00 42.68 O ATOM 269 CB TYR A 33 -15.507 -2.224 -19.037 1.00 38.79 C ATOM 270 CG TYR A 33 -16.234 -1.756 -17.802 1.00 46.67 C ATOM 271 CD1 TYR A 33 -17.449 -1.098 -17.888 1.00 46.14 C ATOM 272 CD2 TYR A 33 -15.675 -1.936 -16.540 1.00 50.60 C ATOM 273 CE1 TYR A 33 -18.098 -0.657 -16.757 1.00 54.77 C ATOM 274 CE2 TYR A 33 -16.316 -1.499 -15.407 1.00 52.96 C ATOM 275 CZ TYR A 33 -17.525 -0.860 -15.517 1.00 51.42 C ATOM 276 OH TYR A 33 -18.168 -0.422 -14.386 1.00 60.61 O ATOM 277 HH TYR A 33 -19.020 0.014 -14.640 1.00 0.00 H ATOM 278 H TYR A 33 -15.417 0.333 -19.921 1.00 0.00 H ATOM 279 N LEU A 34 -13.152 -0.792 -21.369 1.00 39.62 N ATOM 280 CA LEU A 34 -12.409 -0.984 -22.609 1.00 37.26 C ATOM 281 C LEU A 34 -10.987 -0.453 -22.425 1.00 42.39 C ATOM 282 O LEU A 34 -10.762 0.428 -21.601 1.00 45.68 O ATOM 283 CB LEU A 34 -13.096 -0.232 -23.766 1.00 35.88 C ATOM 284 CG LEU A 34 -14.463 -0.752 -24.230 1.00 35.40 C ATOM 285 CD1 LEU A 34 -14.952 0.054 -25.422 1.00 48.76 C ATOM 286 CD2 LEU A 34 -14.400 -2.231 -24.544 1.00 35.19 C ATOM 287 H LEU A 34 -13.391 0.179 -21.084 1.00 0.00 H ATOM 288 N PRO A 35 -10.019 -0.974 -23.200 1.00 37.01 N ATOM 289 CA PRO A 35 -10.181 -1.988 -24.247 1.00 35.71 C ATOM 290 C PRO A 35 -10.303 -3.410 -23.714 1.00 39.90 C ATOM 291 O PRO A 35 -9.903 -3.681 -22.576 1.00 42.32 O ATOM 292 CB PRO A 35 -8.893 -1.850 -25.056 1.00 47.84 C ATOM 293 CG PRO A 35 -7.885 -1.393 -24.073 1.00 44.92 C ATOM 294 CD PRO A 35 -8.625 -0.494 -23.114 1.00 42.71 C ATOM 295 N VAL A 36 -10.856 -4.295 -24.542 1.00 37.38 N ATOM 296 CA VAL A 36 -10.846 -5.729 -24.275 1.00 34.02 C ATOM 297 C VAL A 36 -9.934 -6.401 -25.276 1.00 35.87 C ATOM 298 O VAL A 36 -10.244 -6.460 -26.464 1.00 35.08 O ATOM 299 CB VAL A 36 -12.248 -6.349 -24.310 1.00 54.31 C ATOM 300 CG1 VAL A 36 -12.167 -7.882 -24.298 1.00 53.71 C ATOM 301 CG2 VAL A 36 -13.052 -5.858 -23.122 1.00 70.19 C ATOM 302 H VAL A 36 -11.312 -3.951 -25.411 1.00 0.00 H ATOM 303 N THR A 37 -8.812 -6.906 -24.775 1.00 42.02 N ATOM 304 CA THR A 37 -7.751 -7.462 -25.605 1.00 59.43 C ATOM 305 C THR A 37 -7.838 -8.989 -25.723 1.00 51.41 C ATOM 306 O THR A 37 -7.319 -9.579 -26.675 1.00 52.32 O ATOM 307 CB THR A 37 -6.377 -7.077 -25.023 1.00 73.13 C ATOM 308 OG1 THR A 37 -6.377 -7.307 -23.609 1.00 82.79 O ATOM 309 CG2 THR A 37 -6.076 -5.604 -25.291 1.00 78.49 C ATOM 310 HG1 THR A 37 -5.494 -7.060 -23.236 1.00 0.00 H ATOM 311 H THR A 37 -8.685 -6.904 -23.743 1.00 0.00 H ATOM 312 N GLU A 38 -8.510 -9.621 -24.767 1.00 36.77 N ATOM 313 CA GLU A 38 -8.587 -11.070 -24.767 1.00 44.10 C ATOM 314 C GLU A 38 -9.755 -11.538 -25.639 1.00 31.32 C ATOM 315 O GLU A 38 -10.743 -10.839 -25.792 1.00 31.15 O ATOM 316 CB GLU A 38 -8.682 -11.617 -23.341 1.00 53.66 C ATOM 317 CG GLU A 38 -7.494 -11.209 -22.453 1.00 54.70 C ATOM 318 CD GLU A 38 -6.137 -11.468 -23.107 1.00 49.03 C ATOM 319 OE1 GLU A 38 -5.236 -10.611 -22.964 1.00 50.89 O ATOM 320 OE2 GLU A 38 -5.968 -12.523 -23.759 1.00 41.49 O ATOM 321 H GLU A 38 -8.982 -9.076 -24.017 1.00 0.00 H ATOM 322 N PRO A 39 -9.613 -12.728 -26.240 1.00 27.27 N ATOM 323 CA PRO A 39 -10.604 -13.153 -27.248 1.00 26.28 C ATOM 324 C PRO A 39 -11.979 -13.503 -26.680 1.00 25.13 C ATOM 325 O PRO A 39 -12.050 -14.220 -25.670 1.00 28.81 O ATOM 326 CB PRO A 39 -9.989 -14.401 -27.877 1.00 31.18 C ATOM 327 CG PRO A 39 -8.892 -14.825 -26.953 1.00 34.69 C ATOM 328 CD PRO A 39 -8.437 -13.617 -26.188 1.00 31.22 C ATOM 329 N LEU A 40 -13.016 -12.945 -27.284 1.00 24.87 N ATOM 330 CA LEU A 40 -14.389 -13.346 -27.032 1.00 22.61 C ATOM 331 C LEU A 40 -14.861 -14.141 -28.245 1.00 22.45 C ATOM 332 O LEU A 40 -14.423 -13.898 -29.390 1.00 22.09 O ATOM 333 CB LEU A 40 -15.290 -12.111 -26.882 1.00 24.30 C ATOM 334 CG LEU A 40 -14.900 -11.163 -25.734 1.00 28.73 C ATOM 335 CD1 LEU A 40 -15.763 -9.908 -25.882 1.00 32.66 C ATOM 336 CD2 LEU A 40 -15.122 -11.826 -24.403 1.00 33.25 C ATOM 337 H LEU A 40 -12.840 -12.184 -27.971 1.00 0.00 H ATOM 338 N PRO A 41 -15.815 -15.054 -28.038 1.00 20.39 N ATOM 339 CA PRO A 41 -16.370 -15.760 -29.192 1.00 20.44 C ATOM 340 C PRO A 41 -17.116 -14.826 -30.101 1.00 20.30 C ATOM 341 O PRO A 41 -17.731 -13.856 -29.645 1.00 21.18 O ATOM 342 CB PRO A 41 -17.357 -16.765 -28.564 1.00 23.15 C ATOM 343 CG PRO A 41 -17.221 -16.672 -27.131 1.00 27.17 C ATOM 344 CD PRO A 41 -16.465 -15.442 -26.774 1.00 19.63 C ATOM 345 N ILE A 42 -17.056 -15.129 -31.398 1.00 19.37 N ATOM 346 CA ILE A 42 -17.886 -14.512 -32.421 1.00 18.67 C ATOM 347 C ILE A 42 -18.908 -15.554 -32.846 1.00 20.28 C ATOM 348 O ILE A 42 -18.533 -16.630 -33.328 1.00 19.88 O ATOM 349 CB ILE A 42 -17.085 -14.054 -33.627 1.00 20.74 C ATOM 350 CG1 ILE A 42 -16.092 -12.950 -33.218 1.00 23.03 C ATOM 351 CG2 ILE A 42 -18.018 -13.524 -34.710 1.00 20.05 C ATOM 352 CD1 ILE A 42 -15.123 -12.526 -34.304 1.00 26.02 C ATOM 353 H ILE A 42 -16.372 -15.853 -31.698 1.00 0.00 H ATOM 354 N THR A 43 -20.184 -15.240 -32.655 1.00 19.79 N ATOM 355 CA THR A 43 -21.291 -16.127 -33.058 1.00 20.43 C ATOM 356 C THR A 43 -22.219 -15.414 -34.030 1.00 17.99 C ATOM 357 O THR A 43 -21.984 -14.282 -34.425 1.00 20.45 O ATOM 358 CB THR A 43 -22.103 -16.570 -31.840 1.00 20.99 C ATOM 359 OG1 THR A 43 -22.614 -15.409 -31.174 1.00 21.39 O ATOM 360 CG2 THR A 43 -21.253 -17.360 -30.866 1.00 20.66 C ATOM 361 HG1 THR A 43 -23.141 -15.688 -30.384 1.00 0.00 H ATOM 362 H THR A 43 -20.412 -14.332 -32.203 1.00 0.00 H ATOM 363 N ILE A 44 -23.248 -16.131 -34.489 1.00 18.68 N ATOM 364 CA ILE A 44 -24.220 -15.559 -35.417 1.00 19.32 C ATOM 365 C ILE A 44 -25.536 -15.334 -34.681 1.00 18.92 C ATOM 366 O ILE A 44 -26.101 -16.279 -34.096 1.00 18.76 O ATOM 367 CB ILE A 44 -24.460 -16.493 -36.622 1.00 20.53 C ATOM 368 CG1 ILE A 44 -23.139 -16.730 -37.378 1.00 20.99 C ATOM 369 CG2 ILE A 44 -25.559 -15.923 -37.553 1.00 19.18 C ATOM 370 CD1 ILE A 44 -23.247 -17.769 -38.500 1.00 26.08 C ATOM 371 H ILE A 44 -23.360 -17.117 -34.179 1.00 0.00 H ATOM 372 N GLU A 45 -26.036 -14.091 -34.662 1.00 21.00 N ATOM 373 CA GLU A 45 -27.372 -13.777 -34.114 1.00 19.90 C ATOM 374 C GLU A 45 -27.540 -14.258 -32.674 1.00 21.18 C ATOM 375 O GLU A 45 -28.623 -14.628 -32.244 1.00 21.10 O ATOM 376 CB GLU A 45 -28.439 -14.352 -35.037 1.00 19.62 C ATOM 377 CG GLU A 45 -28.697 -13.468 -36.221 1.00 21.95 C ATOM 378 CD GLU A 45 -29.333 -12.119 -35.862 1.00 25.32 C ATOM 379 OE1 GLU A 45 -29.722 -11.908 -34.668 1.00 26.37 O ATOM 380 OE2 GLU A 45 -29.431 -11.237 -36.710 1.00 26.90 O ATOM 381 H GLU A 45 -25.461 -13.316 -35.049 1.00 0.00 H ATOM 382 N HIS A 46 -26.449 -14.189 -31.914 1.00 20.44 N ATOM 383 CA HIS A 46 -26.477 -14.509 -30.483 1.00 19.09 C ATOM 384 C HIS A 46 -26.920 -15.933 -30.206 1.00 20.62 C ATOM 385 O HIS A 46 -27.410 -16.238 -29.116 1.00 23.93 O ATOM 386 CB HIS A 46 -27.324 -13.524 -29.677 1.00 22.41 C ATOM 387 CG HIS A 46 -26.976 -12.097 -29.928 1.00 23.26 C ATOM 388 ND1 HIS A 46 -25.874 -11.487 -29.370 1.00 22.46 N ATOM 389 CD2 HIS A 46 -27.561 -11.171 -30.723 1.00 25.56 C ATOM 390 CE1 HIS A 46 -25.824 -10.232 -29.784 1.00 22.89 C ATOM 391 NE2 HIS A 46 -26.820 -10.024 -30.624 1.00 27.89 N ATOM 392 H HIS A 46 -25.550 -13.899 -32.348 1.00 0.00 H ATOM 393 N LEU A 47 -26.686 -16.811 -31.173 1.00 20.50 N ATOM 394 CA LEU A 47 -26.910 -18.247 -31.022 1.00 21.34 C ATOM 395 C LEU A 47 -25.589 -18.934 -30.585 1.00 21.16 C ATOM 396 O LEU A 47 -24.630 -19.002 -31.348 1.00 20.82 O ATOM 397 CB LEU A 47 -27.445 -18.835 -32.347 1.00 20.98 C ATOM 398 CG LEU A 47 -28.771 -18.220 -32.757 1.00 21.52 C ATOM 399 CD1 LEU A 47 -29.088 -18.480 -34.235 1.00 27.00 C ATOM 400 CD2 LEU A 47 -29.938 -18.681 -31.895 1.00 25.76 C ATOM 401 H LEU A 47 -26.325 -16.460 -32.083 1.00 0.00 H ATOM 402 N PRO A 48 -25.543 -19.483 -29.371 1.00 22.97 N ATOM 403 CA PRO A 48 -24.236 -19.962 -28.881 1.00 23.94 C ATOM 404 C PRO A 48 -23.614 -21.136 -29.646 1.00 24.71 C ATOM 405 O PRO A 48 -22.401 -21.352 -29.568 1.00 22.84 O ATOM 406 CB PRO A 48 -24.527 -20.356 -27.422 1.00 23.87 C ATOM 407 CG PRO A 48 -25.991 -20.590 -27.357 1.00 25.58 C ATOM 408 CD PRO A 48 -26.611 -19.657 -28.384 1.00 24.91 C ATOM 409 N GLU A 49 -24.430 -21.861 -30.399 1.00 21.88 N ATOM 410 CA GLU A 49 -23.981 -23.034 -31.125 1.00 22.31 C ATOM 411 C GLU A 49 -23.463 -22.689 -32.523 1.00 19.68 C ATOM 412 O GLU A 49 -23.140 -23.572 -33.279 1.00 21.53 O ATOM 413 CB GLU A 49 -25.147 -24.041 -31.228 1.00 29.49 C ATOM 414 CG GLU A 49 -26.270 -23.690 -32.244 1.00 64.13 C ATOM 415 CD GLU A 49 -27.367 -22.744 -31.727 1.00 52.52 C ATOM 416 OE1 GLU A 49 -27.241 -22.141 -30.634 1.00 30.31 O ATOM 417 OE2 GLU A 49 -28.386 -22.604 -32.445 1.00 41.03 O ATOM 418 H GLU A 49 -25.428 -21.578 -30.472 1.00 0.00 H ATOM 419 N THR A 50 -23.308 -21.395 -32.794 1.00 20.50 N ATOM 420 CA THR A 50 -22.814 -20.893 -34.084 1.00 18.70 C ATOM 421 C THR A 50 -21.491 -20.098 -33.945 1.00 18.25 C ATOM 422 O THR A 50 -21.280 -19.135 -34.686 1.00 18.05 O ATOM 423 CB THR A 50 -23.862 -20.014 -34.794 1.00 19.67 C ATOM 424 OG1 THR A 50 -24.101 -18.817 -34.049 1.00 20.24 O ATOM 425 CG2 THR A 50 -25.175 -20.797 -35.040 1.00 22.87 C ATOM 426 HG1 THR A 50 -24.436 -19.052 -33.147 1.00 0.00 H ATOM 427 H THR A 50 -23.549 -20.704 -32.055 1.00 0.00 H ATOM 428 N GLU A 51 -20.603 -20.476 -33.028 1.00 17.56 N ATOM 429 CA GLU A 51 -19.285 -19.834 -32.958 1.00 17.05 C ATOM 430 C GLU A 51 -18.551 -20.021 -34.283 1.00 17.02 C ATOM 431 O GLU A 51 -18.371 -21.154 -34.721 1.00 17.93 O ATOM 432 CB GLU A 51 -18.419 -20.450 -31.876 1.00 19.01 C ATOM 433 CG GLU A 51 -18.954 -20.370 -30.474 1.00 21.84 C ATOM 434 CD GLU A 51 -18.132 -21.193 -29.529 1.00 20.39 C ATOM 435 OE1 GLU A 51 -17.322 -22.064 -29.953 1.00 20.12 O ATOM 436 OE2 GLU A 51 -18.263 -21.004 -28.273 1.00 21.55 O ATOM 437 H GLU A 51 -20.845 -21.232 -32.356 1.00 0.00 H ATOM 438 N VAL A 52 -18.049 -18.928 -34.848 1.00 18.86 N ATOM 439 CA VAL A 52 -17.298 -18.973 -36.102 1.00 16.88 C ATOM 440 C VAL A 52 -15.923 -18.334 -36.002 1.00 18.58 C ATOM 441 O VAL A 52 -15.117 -18.455 -36.913 1.00 19.92 O ATOM 442 CB VAL A 52 -18.071 -18.323 -37.283 1.00 18.22 C ATOM 443 CG1 VAL A 52 -19.321 -19.140 -37.557 1.00 17.74 C ATOM 444 CG2 VAL A 52 -18.374 -16.863 -36.950 1.00 21.99 C ATOM 445 H VAL A 52 -18.195 -18.009 -34.383 1.00 0.00 H ATOM 446 N GLY A 53 -15.585 -17.772 -34.837 1.00 18.32 N ATOM 447 CA GLY A 53 -14.298 -17.120 -34.714 1.00 18.95 C ATOM 448 C GLY A 53 -14.118 -16.464 -33.370 1.00 18.24 C ATOM 449 O GLY A 53 -14.860 -16.773 -32.441 1.00 19.59 O ATOM 450 H GLY A 53 -16.239 -17.803 -34.029 1.00 0.00 H ATOM 451 N TRP A 54 -13.147 -15.561 -33.282 1.00 19.89 N ATOM 452 CA TRP A 54 -12.714 -14.965 -32.027 1.00 20.67 C ATOM 453 C TRP A 54 -12.406 -13.491 -32.230 1.00 22.88 C ATOM 454 O TRP A 54 -11.819 -13.117 -33.236 1.00 24.56 O ATOM 455 CB TRP A 54 -11.442 -15.643 -31.524 1.00 22.02 C ATOM 456 CG TRP A 54 -11.625 -17.092 -31.252 1.00 22.20 C ATOM 457 CD1 TRP A 54 -11.204 -18.141 -32.027 1.00 23.08 C ATOM 458 CD2 TRP A 54 -12.287 -17.679 -30.113 1.00 21.23 C ATOM 459 NE1 TRP A 54 -11.554 -19.337 -31.452 1.00 24.38 N ATOM 460 CE2 TRP A 54 -12.209 -19.085 -30.268 1.00 23.21 C ATOM 461 CE3 TRP A 54 -12.934 -17.159 -28.984 1.00 24.11 C ATOM 462 CZ2 TRP A 54 -12.779 -19.967 -29.367 1.00 22.28 C ATOM 463 CZ3 TRP A 54 -13.479 -18.044 -28.076 1.00 23.57 C ATOM 464 CH2 TRP A 54 -13.401 -19.436 -28.285 1.00 23.91 C ATOM 465 HE1 TRP A 54 -11.357 -20.279 -31.846 1.00 0.00 H ATOM 466 H TRP A 54 -12.671 -15.264 -34.158 1.00 0.00 H ATOM 467 N THR A 55 -12.771 -12.645 -31.265 1.00 22.70 N ATOM 468 CA THR A 55 -12.400 -11.240 -31.360 1.00 24.51 C ATOM 469 C THR A 55 -10.914 -11.055 -31.134 1.00 26.10 C ATOM 470 O THR A 55 -10.281 -11.833 -30.431 1.00 27.46 O ATOM 471 CB THR A 55 -13.180 -10.349 -30.382 1.00 23.63 C ATOM 472 OG1 THR A 55 -12.916 -10.720 -29.023 1.00 24.86 O ATOM 473 CG2 THR A 55 -14.677 -10.456 -30.651 1.00 24.31 C ATOM 474 HG1 THR A 55 -11.948 -10.623 -28.838 1.00 0.00 H ATOM 475 H THR A 55 -13.318 -12.987 -30.449 1.00 0.00 H ATOM 476 N LEU A 56 -10.361 -10.005 -31.732 1.00 27.47 N ATOM 477 CA LEU A 56 -8.953 -9.683 -31.560 1.00 31.09 C ATOM 478 C LEU A 56 -8.754 -8.397 -30.777 1.00 34.78 C ATOM 479 O LEU A 56 -7.640 -8.073 -30.404 1.00 51.32 O ATOM 480 CB LEU A 56 -8.305 -9.543 -32.935 1.00 31.94 C ATOM 481 CG LEU A 56 -8.462 -10.797 -33.785 1.00 34.51 C ATOM 482 CD1 LEU A 56 -7.887 -10.567 -35.174 1.00 37.46 C ATOM 483 CD2 LEU A 56 -7.819 -11.990 -33.115 1.00 38.88 C ATOM 484 H LEU A 56 -10.950 -9.398 -32.338 1.00 0.00 H ATOM 485 N GLY A 57 -9.837 -7.665 -30.540 1.00 28.88 N ATOM 486 CA GLY A 57 -9.781 -6.414 -29.816 1.00 31.56 C ATOM 487 C GLY A 57 -11.081 -5.637 -29.900 1.00 35.01 C ATOM 488 O GLY A 57 -11.746 -5.598 -30.935 1.00 31.25 O ATOM 489 H GLY A 57 -10.757 -8.003 -30.887 1.00 0.00 H ATOM 490 N LEU A 58 -11.441 -5.019 -28.786 1.00 34.40 N ATOM 491 CA LEU A 58 -12.549 -4.078 -28.711 1.00 29.88 C ATOM 492 C LEU A 58 -11.990 -2.792 -28.116 1.00 35.27 C ATOM 493 O LEU A 58 -11.467 -2.780 -26.986 1.00 33.90 O ATOM 494 CB LEU A 58 -13.666 -4.616 -27.815 1.00 37.70 C ATOM 495 CG LEU A 58 -14.319 -5.906 -28.318 1.00 62.71 C ATOM 496 CD1 LEU A 58 -15.010 -6.638 -27.180 1.00 80.77 C ATOM 497 CD2 LEU A 58 -15.299 -5.585 -29.416 1.00 55.60 C ATOM 498 H LEU A 58 -10.903 -5.216 -27.918 1.00 0.00 H ATOM 499 N PHE A 59 -12.099 -1.704 -28.876 1.00 37.98 N ATOM 500 CA PHE A 59 -11.435 -0.458 -28.543 1.00 38.76 C ATOM 501 C PHE A 59 -12.373 0.740 -28.597 1.00 36.92 C ATOM 502 O PHE A 59 -13.220 0.839 -29.491 1.00 36.00 O ATOM 503 CB PHE A 59 -10.263 -0.220 -29.505 1.00 50.50 C ATOM 504 CG PHE A 59 -9.143 -1.211 -29.358 1.00 53.84 C ATOM 505 CD1 PHE A 59 -8.149 -1.023 -28.412 1.00 68.33 C ATOM 506 CD2 PHE A 59 -9.083 -2.325 -30.173 1.00 64.10 C ATOM 507 CE1 PHE A 59 -7.118 -1.934 -28.280 1.00 74.79 C ATOM 508 CE2 PHE A 59 -8.054 -3.239 -30.046 1.00 73.79 C ATOM 509 CZ PHE A 59 -7.073 -3.044 -29.101 1.00 77.63 C ATOM 510 H PHE A 59 -12.680 -1.749 -29.737 1.00 0.00 H ATOM 511 N GLN A 60 -12.200 1.651 -27.648 1.00 41.08 N ATOM 512 CA GLN A 60 -12.876 2.935 -27.685 1.00 39.94 C ATOM 513 C GLN A 60 -12.122 3.818 -28.653 1.00 47.17 C ATOM 514 O GLN A 60 -10.921 4.039 -28.489 1.00 51.15 O ATOM 515 CB GLN A 60 -12.872 3.599 -26.300 1.00 42.37 C ATOM 516 CG GLN A 60 -13.688 4.883 -26.234 1.00 75.81 C ATOM 517 CD GLN A 60 -13.585 5.585 -24.887 1.00 86.76 C ATOM 518 OE1 GLN A 60 -12.802 5.189 -24.020 1.00 68.21 O ATOM 519 NE2 GLN A 60 -14.382 6.634 -24.708 1.00103.32 N ATOM 520 HE22 GLN A 60 -15.027 6.933 -25.467 1.00 0.00 H ATOM 521 HE21 GLN A 60 -14.361 7.156 -23.809 1.00 0.00 H ATOM 522 H GLN A 60 -11.562 1.439 -26.855 1.00 0.00 H ATOM 523 N VAL A 61 -12.821 4.308 -29.667 1.00 44.86 N ATOM 524 CA VAL A 61 -12.268 5.333 -30.541 1.00 52.41 C ATOM 525 C VAL A 61 -13.214 6.529 -30.523 1.00 52.70 C ATOM 526 O VAL A 61 -14.220 6.511 -29.816 1.00 56.09 O ATOM 527 CB VAL A 61 -12.024 4.797 -31.963 1.00 54.72 C ATOM 528 CG1 VAL A 61 -10.888 3.762 -31.938 1.00 54.37 C ATOM 529 CG2 VAL A 61 -13.300 4.218 -32.556 1.00 44.78 C ATOM 530 H VAL A 61 -13.783 3.954 -29.842 1.00 0.00 H ATOM 531 N SER A 62 -12.880 7.577 -31.267 1.00 55.48 N ATOM 532 CA SER A 62 -13.670 8.803 -31.245 1.00 63.24 C ATOM 533 C SER A 62 -15.157 8.566 -31.518 1.00 69.35 C ATOM 534 O SER A 62 -16.016 9.015 -30.755 1.00 68.56 O ATOM 535 CB SER A 62 -13.131 9.782 -32.286 1.00 69.98 C ATOM 536 OG SER A 62 -11.716 9.815 -32.270 1.00 71.80 O ATOM 537 HG SER A 62 -11.364 8.912 -32.471 1.00 0.00 H ATOM 538 H SER A 62 -12.039 7.523 -31.877 1.00 0.00 H ATOM 539 N HIS A 63 -15.444 7.839 -32.595 1.00 70.11 N ATOM 540 CA HIS A 63 -16.798 7.666 -33.122 1.00 72.20 C ATOM 541 C HIS A 63 -17.580 6.547 -32.429 1.00 74.26 C ATOM 542 O HIS A 63 -18.768 6.354 -32.696 1.00 79.14 O ATOM 543 CB HIS A 63 -16.710 7.382 -34.631 1.00 68.64 C ATOM 544 CG HIS A 63 -18.038 7.236 -35.310 1.00 65.91 C ATOM 545 ND1 HIS A 63 -18.849 8.312 -35.603 1.00 66.91 N ATOM 546 CD2 HIS A 63 -18.692 6.139 -35.761 1.00 56.92 C ATOM 547 CE1 HIS A 63 -19.947 7.883 -36.201 1.00 60.55 C ATOM 548 NE2 HIS A 63 -19.876 6.569 -36.309 1.00 57.04 N ATOM 549 H HIS A 63 -14.661 7.367 -33.091 1.00 0.00 H ATOM 550 N GLY A 64 -16.917 5.793 -31.554 1.00 67.14 N ATOM 551 CA GLY A 64 -17.590 4.710 -30.853 1.00 60.79 C ATOM 552 C GLY A 64 -16.682 3.571 -30.430 1.00 48.36 C ATOM 553 O GLY A 64 -15.519 3.785 -30.100 1.00 51.47 O ATOM 554 H GLY A 64 -15.911 5.980 -31.370 1.00 0.00 H ATOM 555 N ILE A 65 -17.226 2.356 -30.438 1.00 36.35 N ATOM 556 CA ILE A 65 -16.489 1.163 -30.025 1.00 36.26 C ATOM 557 C ILE A 65 -16.243 0.253 -31.239 1.00 32.91 C ATOM 558 O ILE A 65 -17.180 -0.261 -31.851 1.00 31.56 O ATOM 559 CB ILE A 65 -17.251 0.393 -28.918 1.00 35.13 C ATOM 560 CG1 ILE A 65 -17.420 1.273 -27.675 1.00 37.92 C ATOM 561 CG2 ILE A 65 -16.538 -0.929 -28.575 1.00 30.69 C ATOM 562 CD1 ILE A 65 -18.487 0.757 -26.727 1.00 36.93 C ATOM 563 H ILE A 65 -18.213 2.252 -30.750 1.00 0.00 H ATOM 564 N PHE A 66 -14.971 0.081 -31.587 1.00 31.60 N ATOM 565 CA PHE A 66 -14.565 -0.674 -32.766 1.00 31.36 C ATOM 566 C PHE A 66 -14.124 -2.081 -32.394 1.00 31.76 C ATOM 567 O PHE A 66 -13.403 -2.282 -31.420 1.00 30.77 O ATOM 568 CB PHE A 66 -13.421 0.043 -33.479 1.00 36.49 C ATOM 569 CG PHE A 66 -13.200 -0.432 -34.889 1.00 37.11 C ATOM 570 CD1 PHE A 66 -13.892 0.137 -35.943 1.00 46.24 C ATOM 571 CD2 PHE A 66 -12.309 -1.452 -35.157 1.00 36.16 C ATOM 572 CE1 PHE A 66 -13.689 -0.299 -37.243 1.00 37.36 C ATOM 573 CE2 PHE A 66 -12.105 -1.893 -36.461 1.00 38.02 C ATOM 574 CZ PHE A 66 -12.801 -1.316 -37.497 1.00 38.49 C ATOM 575 H PHE A 66 -14.232 0.505 -30.990 1.00 0.00 H ATOM 576 N CYS A 67 -14.583 -3.049 -33.169 1.00 29.73 N ATOM 577 CA CYS A 67 -14.236 -4.445 -33.016 1.00 27.90 C ATOM 578 C CYS A 67 -13.473 -4.961 -34.223 1.00 30.39 C ATOM 579 O CYS A 67 -13.807 -4.661 -35.364 1.00 27.34 O ATOM 580 CB CYS A 67 -15.514 -5.276 -32.868 1.00 30.58 C ATOM 581 SG CYS A 67 -15.255 -7.083 -32.819 1.00 30.84 S ATOM 582 H CYS A 67 -15.235 -2.790 -33.937 1.00 0.00 H ATOM 583 N THR A 68 -12.439 -5.738 -33.947 1.00 29.53 N ATOM 584 CA THR A 68 -11.761 -6.506 -34.978 1.00 28.48 C ATOM 585 C THR A 68 -11.847 -7.961 -34.553 1.00 28.51 C ATOM 586 O THR A 68 -11.656 -8.278 -33.373 1.00 29.57 O ATOM 587 CB THR A 68 -10.284 -6.098 -35.155 1.00 34.91 C ATOM 588 OG1 THR A 68 -10.178 -4.677 -35.296 1.00 35.58 O ATOM 589 CG2 THR A 68 -9.697 -6.750 -36.405 1.00 33.50 C ATOM 590 HG1 THR A 68 -9.227 -4.428 -35.409 1.00 0.00 H ATOM 591 H THR A 68 -12.102 -5.801 -32.965 1.00 0.00 H ATOM 592 N GLY A 69 -12.132 -8.834 -35.515 1.00 28.84 N ATOM 593 CA GLY A 69 -12.249 -10.254 -35.238 1.00 30.03 C ATOM 594 C GLY A 69 -11.653 -11.113 -36.328 1.00 26.29 C ATOM 595 O GLY A 69 -11.427 -10.652 -37.451 1.00 28.15 O ATOM 596 H GLY A 69 -12.274 -8.492 -36.487 1.00 0.00 H ATOM 597 N ALA A 70 -11.387 -12.373 -35.988 1.00 26.60 N ATOM 598 CA ALA A 70 -10.954 -13.360 -36.977 1.00 23.89 C ATOM 599 C ALA A 70 -12.031 -14.427 -37.086 1.00 23.42 C ATOM 600 O ALA A 70 -12.472 -14.970 -36.070 1.00 24.69 O ATOM 601 CB ALA A 70 -9.639 -13.997 -36.528 1.00 25.78 C ATOM 602 H ALA A 70 -11.490 -12.662 -34.994 1.00 0.00 H ATOM 603 N ILE A 71 -12.447 -14.718 -38.310 1.00 25.10 N ATOM 604 CA ILE A 71 -13.359 -15.818 -38.579 1.00 21.81 C ATOM 605 C ILE A 71 -12.516 -17.036 -38.914 1.00 20.18 C ATOM 606 O ILE A 71 -11.886 -17.057 -39.985 1.00 24.77 O ATOM 607 CB ILE A 71 -14.289 -15.463 -39.738 1.00 22.20 C ATOM 608 CG1 ILE A 71 -15.026 -14.168 -39.379 1.00 32.39 C ATOM 609 CG2 ILE A 71 -15.234 -16.642 -40.030 1.00 22.62 C ATOM 610 CD1 ILE A 71 -16.109 -13.747 -40.344 1.00 49.83 C ATOM 611 H ILE A 71 -12.110 -14.140 -39.106 1.00 0.00 H ATOM 612 N THR A 72 -12.490 -18.029 -38.023 1.00 22.49 N ATOM 613 CA THR A 72 -11.484 -19.098 -38.090 1.00 23.29 C ATOM 614 C THR A 72 -12.059 -20.496 -38.270 1.00 22.43 C ATOM 615 O THR A 72 -11.309 -21.430 -38.587 1.00 28.43 O ATOM 616 CB THR A 72 -10.643 -19.159 -36.781 1.00 23.05 C ATOM 617 OG1 THR A 72 -11.488 -19.497 -35.693 1.00 24.53 O ATOM 618 CG2 THR A 72 -9.969 -17.826 -36.470 1.00 30.16 C ATOM 619 HG1 THR A 72 -10.953 -19.536 -34.861 1.00 0.00 H ATOM 620 H THR A 72 -13.199 -18.047 -37.262 1.00 0.00 H ATOM 621 N SER A 73 -13.367 -20.645 -38.129 1.00 22.45 N ATOM 622 CA SER A 73 -13.997 -21.950 -38.255 1.00 20.99 C ATOM 623 C SER A 73 -13.873 -22.490 -39.662 1.00 21.42 C ATOM 624 O SER A 73 -14.436 -21.908 -40.593 1.00 21.14 O ATOM 625 CB SER A 73 -15.478 -21.815 -37.981 1.00 20.33 C ATOM 626 OG SER A 73 -16.219 -22.976 -38.326 1.00 21.05 O ATOM 627 HG SER A 73 -15.886 -23.747 -37.801 1.00 0.00 H ATOM 628 H SER A 73 -13.956 -19.812 -37.924 1.00 0.00 H ATOM 629 N PRO A 74 -13.171 -23.614 -39.828 1.00 23.33 N ATOM 630 CA PRO A 74 -13.069 -24.125 -41.192 1.00 24.58 C ATOM 631 C PRO A 74 -14.395 -24.556 -41.742 1.00 24.06 C ATOM 632 O PRO A 74 -14.662 -24.314 -42.913 1.00 25.95 O ATOM 633 CB PRO A 74 -12.133 -25.320 -41.019 1.00 28.82 C ATOM 634 CG PRO A 74 -11.293 -24.982 -39.834 1.00 31.26 C ATOM 635 CD PRO A 74 -12.264 -24.319 -38.909 1.00 30.29 C ATOM 636 N ALA A 75 -15.251 -25.153 -40.925 1.00 23.14 N ATOM 637 CA ALA A 75 -16.557 -25.560 -41.404 1.00 22.23 C ATOM 638 C ALA A 75 -17.353 -24.363 -41.946 1.00 22.28 C ATOM 639 O ALA A 75 -18.031 -24.447 -42.988 1.00 20.20 O ATOM 640 CB ALA A 75 -17.346 -26.240 -40.296 1.00 26.16 C ATOM 641 H ALA A 75 -14.984 -25.330 -39.936 1.00 0.00 H ATOM 642 N PHE A 76 -17.373 -23.265 -41.202 1.00 19.40 N ATOM 643 CA PHE A 76 -18.058 -22.060 -41.622 1.00 18.84 C ATOM 644 C PHE A 76 -17.428 -21.500 -42.893 1.00 20.07 C ATOM 645 O PHE A 76 -18.140 -21.164 -43.840 1.00 19.58 O ATOM 646 CB PHE A 76 -18.078 -20.983 -40.510 1.00 19.53 C ATOM 647 CG PHE A 76 -18.734 -19.691 -40.959 1.00 20.33 C ATOM 648 CD1 PHE A 76 -20.118 -19.585 -41.053 1.00 19.95 C ATOM 649 CD2 PHE A 76 -17.968 -18.600 -41.324 1.00 24.49 C ATOM 650 CE1 PHE A 76 -20.701 -18.418 -41.510 1.00 22.75 C ATOM 651 CE2 PHE A 76 -18.554 -17.433 -41.775 1.00 27.24 C ATOM 652 CZ PHE A 76 -19.933 -17.351 -41.867 1.00 22.80 C ATOM 653 H PHE A 76 -16.880 -23.270 -40.286 1.00 0.00 H ATOM 654 N LEU A 77 -16.116 -21.418 -42.936 1.00 19.81 N ATOM 655 CA LEU A 77 -15.458 -20.773 -44.042 1.00 23.63 C ATOM 656 C LEU A 77 -15.753 -21.579 -45.308 1.00 20.58 C ATOM 657 O LEU A 77 -15.996 -21.011 -46.384 1.00 22.36 O ATOM 658 CB LEU A 77 -13.954 -20.649 -43.784 1.00 23.49 C ATOM 659 CG LEU A 77 -13.521 -19.651 -42.705 1.00 30.76 C ATOM 660 CD1 LEU A 77 -12.056 -19.794 -42.313 1.00 33.08 C ATOM 661 CD2 LEU A 77 -13.834 -18.236 -43.169 1.00 34.85 C ATOM 662 H LEU A 77 -15.549 -21.823 -42.164 1.00 0.00 H ATOM 663 N GLU A 78 -15.680 -22.903 -45.199 1.00 19.17 N ATOM 664 CA GLU A 78 -15.900 -23.746 -46.378 1.00 21.75 C ATOM 665 C GLU A 78 -17.339 -23.636 -46.842 1.00 21.17 C ATOM 666 O GLU A 78 -17.623 -23.528 -48.056 1.00 20.63 O ATOM 667 CB GLU A 78 -15.531 -25.184 -46.065 1.00 24.78 C ATOM 668 CG GLU A 78 -14.016 -25.336 -46.041 1.00 53.11 C ATOM 669 CD GLU A 78 -13.535 -26.614 -45.399 1.00 89.31 C ATOM 670 OE1 GLU A 78 -14.349 -27.542 -45.223 1.00101.27 O ATOM 671 OE2 GLU A 78 -12.332 -26.686 -45.068 1.00102.51 O ATOM 672 H GLU A 78 -15.467 -23.339 -44.279 1.00 0.00 H ATOM 673 N LEU A 79 -18.287 -23.643 -45.925 1.00 18.26 N ATOM 674 CA LEU A 79 -19.696 -23.584 -46.271 1.00 17.83 C ATOM 675 C LEU A 79 -20.016 -22.235 -46.902 1.00 17.92 C ATOM 676 O LEU A 79 -20.642 -22.170 -47.993 1.00 17.83 O ATOM 677 CB LEU A 79 -20.582 -23.831 -45.016 1.00 18.71 C ATOM 678 CG LEU A 79 -22.079 -23.635 -45.266 1.00 21.36 C ATOM 679 CD1 LEU A 79 -22.602 -24.563 -46.341 1.00 25.29 C ATOM 680 CD2 LEU A 79 -22.825 -23.846 -43.985 1.00 21.03 C ATOM 681 H LEU A 79 -18.017 -23.692 -44.922 1.00 0.00 H ATOM 682 N ALA A 80 -19.603 -21.146 -46.276 1.00 17.60 N ATOM 683 CA ALA A 80 -19.907 -19.798 -46.736 1.00 18.27 C ATOM 684 C ALA A 80 -19.302 -19.588 -48.145 1.00 17.87 C ATOM 685 O ALA A 80 -19.940 -19.008 -49.010 1.00 18.43 O ATOM 686 CB ALA A 80 -19.342 -18.778 -45.769 1.00 20.44 C ATOM 687 H ALA A 80 -19.033 -21.257 -45.413 1.00 0.00 H ATOM 688 N SER A 81 -18.061 -20.030 -48.350 1.00 18.16 N ATOM 689 CA SER A 81 -17.402 -19.886 -49.643 1.00 23.86 C ATOM 690 C SER A 81 -18.175 -20.641 -50.718 1.00 20.91 C ATOM 691 O SER A 81 -18.395 -20.126 -51.847 1.00 19.86 O ATOM 692 CB SER A 81 -15.964 -20.405 -49.575 1.00 27.79 C ATOM 693 OG SER A 81 -15.224 -19.735 -48.569 1.00 27.66 O ATOM 694 HG SER A 81 -15.655 -19.882 -47.690 1.00 0.00 H ATOM 695 H SER A 81 -17.550 -20.489 -47.569 1.00 0.00 H ATOM 696 N ARG A 82 -18.594 -21.857 -50.397 1.00 17.88 N ATOM 697 CA ARG A 82 -19.367 -22.665 -51.332 1.00 19.61 C ATOM 698 C ARG A 82 -20.677 -21.976 -51.665 1.00 19.10 C ATOM 699 O ARG A 82 -21.074 -21.921 -52.840 1.00 18.24 O ATOM 700 CB ARG A 82 -19.645 -24.036 -50.715 1.00 22.36 C ATOM 701 CG ARG A 82 -20.687 -24.896 -51.431 1.00 28.82 C ATOM 702 CD ARG A 82 -20.814 -26.242 -50.719 1.00 69.98 C ATOM 703 NE ARG A 82 -21.822 -27.123 -51.302 1.00 69.88 N ATOM 704 CZ ARG A 82 -21.965 -28.404 -50.980 1.00 82.90 C ATOM 705 NH1 ARG A 82 -21.160 -28.964 -50.087 1.00 91.11 N ATOM 706 NH2 ARG A 82 -22.910 -29.133 -51.555 1.00 89.36 N ATOM 707 HE ARG A 82 -22.467 -26.723 -52.013 1.00 0.00 H ATOM 708 HH12 ARG A 82 -21.277 -29.967 -49.839 1.00 0.00 H ATOM 709 HH11 ARG A 82 -20.412 -28.400 -49.635 1.00 0.00 H ATOM 710 HH22 ARG A 82 -23.020 -30.136 -51.301 1.00 0.00 H ATOM 711 HH21 ARG A 82 -23.542 -28.703 -52.260 1.00 0.00 H ATOM 712 H ARG A 82 -18.366 -22.243 -49.458 1.00 0.00 H ATOM 713 N LEU A 83 -21.380 -21.424 -50.687 1.00 17.29 N ATOM 714 CA LEU A 83 -22.633 -20.734 -50.962 1.00 17.06 C ATOM 715 C LEU A 83 -22.387 -19.492 -51.795 1.00 18.56 C ATOM 716 O LEU A 83 -23.190 -19.166 -52.689 1.00 18.38 O ATOM 717 CB LEU A 83 -23.374 -20.368 -49.654 1.00 19.18 C ATOM 718 CG LEU A 83 -23.804 -21.571 -48.807 1.00 21.52 C ATOM 719 CD1 LEU A 83 -24.542 -21.092 -47.529 1.00 19.47 C ATOM 720 CD2 LEU A 83 -24.690 -22.563 -49.484 1.00 21.45 C ATOM 721 H LEU A 83 -21.032 -21.484 -49.709 1.00 0.00 H ATOM 722 N ALA A 84 -21.281 -18.815 -51.534 1.00 18.22 N ATOM 723 CA ALA A 84 -20.947 -17.643 -52.294 1.00 19.02 C ATOM 724 C ALA A 84 -20.820 -17.940 -53.768 1.00 20.20 C ATOM 725 O ALA A 84 -21.095 -17.075 -54.579 1.00 21.79 O ATOM 726 CB ALA A 84 -19.672 -16.992 -51.777 1.00 21.20 C ATOM 727 H ALA A 84 -20.648 -19.134 -50.773 1.00 0.00 H ATOM 728 N ASP A 85 -20.361 -19.138 -54.104 1.00 17.30 N ATOM 729 CA ASP A 85 -20.080 -19.497 -55.482 1.00 17.69 C ATOM 730 C ASP A 85 -21.226 -20.228 -56.170 1.00 20.62 C ATOM 731 O ASP A 85 -21.208 -20.364 -57.402 1.00 21.48 O ATOM 732 CB ASP A 85 -18.875 -20.434 -55.517 1.00 20.66 C ATOM 733 CG ASP A 85 -17.545 -19.718 -55.316 1.00 21.21 C ATOM 734 OD1 ASP A 85 -17.519 -18.499 -55.102 1.00 26.15 O ATOM 735 OD2 ASP A 85 -16.526 -20.426 -55.365 1.00 23.26 O ATOM 736 H ASP A 85 -20.197 -19.842 -53.357 1.00 0.00 H ATOM 737 N THR A 86 -22.249 -20.668 -55.431 1.00 18.04 N ATOM 738 CA THR A 86 -23.230 -21.568 -55.958 1.00 16.12 C ATOM 739 C THR A 86 -24.698 -21.243 -55.634 1.00 17.41 C ATOM 740 O THR A 86 -25.591 -21.767 -56.278 1.00 19.38 O ATOM 741 CB THR A 86 -22.976 -23.032 -55.616 1.00 18.35 C ATOM 742 OG1 THR A 86 -23.056 -23.235 -54.205 1.00 18.73 O ATOM 743 CG2 THR A 86 -21.628 -23.487 -56.125 1.00 22.56 C ATOM 744 HG1 THR A 86 -22.376 -22.675 -53.753 1.00 0.00 H ATOM 745 H THR A 86 -22.335 -20.348 -54.445 1.00 0.00 H ATOM 746 N SER A 87 -24.901 -20.421 -54.602 1.00 16.89 N ATOM 747 CA SER A 87 -26.264 -20.157 -54.144 1.00 18.14 C ATOM 748 C SER A 87 -26.853 -18.905 -54.751 1.00 15.22 C ATOM 749 O SER A 87 -26.364 -17.803 -54.513 1.00 16.85 O ATOM 750 CB SER A 87 -26.275 -20.021 -52.623 1.00 17.53 C ATOM 751 OG SER A 87 -27.565 -19.563 -52.219 1.00 18.32 O ATOM 752 HG SER A 87 -27.749 -18.685 -52.639 1.00 0.00 H ATOM 753 H SER A 87 -24.093 -19.971 -54.126 1.00 0.00 H ATOM 754 N HIS A 88 -27.933 -19.066 -55.513 1.00 18.83 N ATOM 755 CA HIS A 88 -28.610 -17.916 -56.098 1.00 18.29 C ATOM 756 C HIS A 88 -29.243 -17.025 -55.020 1.00 19.64 C ATOM 757 O HIS A 88 -29.319 -15.807 -55.170 1.00 20.50 O ATOM 758 CB HIS A 88 -29.684 -18.369 -57.049 1.00 18.41 C ATOM 759 CG HIS A 88 -29.202 -19.145 -58.220 1.00 21.25 C ATOM 760 ND1 HIS A 88 -27.974 -19.762 -58.353 1.00 31.93 N ATOM 761 CD2 HIS A 88 -29.838 -19.343 -59.378 1.00 19.60 C ATOM 762 CE1 HIS A 88 -27.924 -20.318 -59.564 1.00 21.99 C ATOM 763 NE2 HIS A 88 -29.051 -20.107 -60.177 1.00 31.06 N ATOM 764 H HIS A 88 -28.297 -20.023 -55.693 1.00 0.00 H ATOM 765 N VAL A 89 -29.680 -17.640 -53.934 1.00 18.33 N ATOM 766 CA VAL A 89 -30.276 -16.902 -52.823 1.00 18.85 C ATOM 767 C VAL A 89 -29.211 -16.013 -52.173 1.00 17.75 C ATOM 768 O VAL A 89 -29.419 -14.818 -51.975 1.00 17.94 O ATOM 769 CB VAL A 89 -30.887 -17.898 -51.828 1.00 19.86 C ATOM 770 CG1 VAL A 89 -31.153 -17.256 -50.439 1.00 21.81 C ATOM 771 CG2 VAL A 89 -32.137 -18.549 -52.370 1.00 23.08 C ATOM 772 H VAL A 89 -29.597 -18.675 -53.869 1.00 0.00 H ATOM 773 N ALA A 90 -28.046 -16.578 -51.896 1.00 16.33 N ATOM 774 CA ALA A 90 -26.993 -15.809 -51.242 1.00 15.23 C ATOM 775 C ALA A 90 -26.580 -14.629 -52.126 1.00 17.04 C ATOM 776 O ALA A 90 -26.272 -13.546 -51.631 1.00 16.59 O ATOM 777 CB ALA A 90 -25.786 -16.706 -51.000 1.00 17.82 C ATOM 778 H ALA A 90 -27.881 -17.574 -52.146 1.00 0.00 H ATOM 779 N ARG A 91 -26.524 -14.860 -53.431 1.00 17.05 N ATOM 780 CA ARG A 91 -26.022 -13.853 -54.367 1.00 18.74 C ATOM 781 C ARG A 91 -27.068 -12.814 -54.774 1.00 15.40 C ATOM 782 O ARG A 91 -26.725 -11.736 -55.260 1.00 20.16 O ATOM 783 CB ARG A 91 -25.440 -14.530 -55.595 1.00 19.01 C ATOM 784 CG ARG A 91 -24.228 -15.385 -55.238 1.00 20.87 C ATOM 785 CD ARG A 91 -23.754 -16.226 -56.400 1.00 23.70 C ATOM 786 NE ARG A 91 -23.259 -15.374 -57.450 1.00 19.56 N ATOM 787 CZ ARG A 91 -21.984 -15.078 -57.690 1.00 21.52 C ATOM 788 NH1 ARG A 91 -21.005 -15.623 -56.998 1.00 23.63 N ATOM 789 NH2 ARG A 91 -21.687 -14.273 -58.706 1.00 22.99 N ATOM 790 HE ARG A 91 -23.967 -14.949 -58.082 1.00 0.00 H ATOM 791 HH12 ARG A 91 -20.018 -15.373 -57.208 1.00 0.00 H ATOM 792 HH11 ARG A 91 -21.219 -16.304 -56.242 1.00 0.00 H ATOM 793 HH22 ARG A 91 -20.695 -14.032 -58.906 1.00 0.00 H ATOM 794 HH21 ARG A 91 -22.447 -13.884 -59.300 1.00 0.00 H ATOM 795 H ARG A 91 -26.845 -15.779 -53.798 1.00 0.00 H ATOM 796 N ALA A 92 -28.345 -13.098 -54.558 1.00 17.11 N ATOM 797 CA ALA A 92 -29.413 -12.244 -55.062 1.00 17.25 C ATOM 798 C ALA A 92 -29.333 -10.766 -54.614 1.00 19.38 C ATOM 799 O ALA A 92 -29.488 -9.853 -55.450 1.00 21.60 O ATOM 800 CB ALA A 92 -30.796 -12.842 -54.732 1.00 20.40 C ATOM 801 H ALA A 92 -28.590 -13.951 -54.016 1.00 0.00 H ATOM 802 N PRO A 93 -29.084 -10.519 -53.327 1.00 18.33 N ATOM 803 CA PRO A 93 -29.114 -9.133 -52.847 1.00 18.44 C ATOM 804 C PRO A 93 -27.764 -8.432 -52.932 1.00 22.40 C ATOM 805 O PRO A 93 -27.622 -7.327 -52.446 1.00 24.97 O ATOM 806 CB PRO A 93 -29.545 -9.294 -51.380 1.00 20.37 C ATOM 807 CG PRO A 93 -28.892 -10.600 -50.966 1.00 21.06 C ATOM 808 CD PRO A 93 -28.866 -11.476 -52.219 1.00 18.03 C ATOM 809 N VAL A 94 -26.794 -9.082 -53.541 1.00 21.81 N ATOM 810 CA VAL A 94 -25.448 -8.531 -53.706 1.00 22.28 C ATOM 811 C VAL A 94 -25.299 -8.037 -55.160 1.00 22.14 C ATOM 812 O VAL A 94 -25.996 -8.511 -56.068 1.00 22.02 O ATOM 813 CB VAL A 94 -24.453 -9.657 -53.452 1.00 20.98 C ATOM 814 CG1 VAL A 94 -23.026 -9.231 -53.674 1.00 27.16 C ATOM 815 CG2 VAL A 94 -24.642 -10.189 -51.989 1.00 24.69 C ATOM 816 H VAL A 94 -26.993 -10.029 -53.922 1.00 0.00 H ATOM 817 N LYS A 95 -24.407 -7.071 -55.385 1.00 23.40 N ATOM 818 CA LYS A 95 -24.120 -6.572 -56.729 1.00 23.36 C ATOM 819 C LYS A 95 -23.731 -7.752 -57.599 1.00 23.97 C ATOM 820 O LYS A 95 -23.163 -8.725 -57.115 1.00 23.01 O ATOM 821 CB LYS A 95 -22.992 -5.550 -56.700 1.00 31.65 C ATOM 822 CG LYS A 95 -21.643 -6.146 -56.304 1.00 40.35 C ATOM 823 CD LYS A 95 -20.563 -5.069 -56.200 1.00 58.30 C ATOM 824 CE LYS A 95 -19.229 -5.655 -55.762 1.00 71.14 C ATOM 825 NZ LYS A 95 -18.170 -4.616 -55.608 1.00 80.06 N ATOM 826 HZ1 LYS A 95 -18.025 -4.133 -56.518 1.00 0.00 H ATOM 827 HZ2 LYS A 95 -18.467 -3.924 -54.891 1.00 0.00 H ATOM 828 HZ3 LYS A 95 -17.283 -5.069 -55.309 1.00 0.00 H ATOM 829 H LYS A 95 -23.898 -6.659 -54.577 1.00 0.00 H ATOM 830 N ASN A 96 -24.067 -7.679 -58.875 1.00 26.11 N ATOM 831 CA ASN A 96 -23.756 -8.775 -59.779 1.00 25.59 C ATOM 832 C ASN A 96 -22.263 -8.941 -60.023 1.00 24.42 C ATOM 833 O ASN A 96 -21.519 -7.971 -60.158 1.00 26.47 O ATOM 834 CB ASN A 96 -24.469 -8.580 -61.115 1.00 25.62 C ATOM 835 CG ASN A 96 -25.911 -9.063 -61.095 1.00 25.31 C ATOM 836 OD1 ASN A 96 -26.327 -9.828 -60.219 1.00 28.07 O ATOM 837 ND2 ASN A 96 -26.691 -8.600 -62.069 1.00 28.32 N ATOM 838 HD22 ASN A 96 -26.300 -7.957 -62.787 1.00 0.00 H ATOM 839 HD21 ASN A 96 -27.691 -8.881 -62.112 1.00 0.00 H ATOM 840 H ASN A 96 -24.556 -6.834 -59.234 1.00 0.00 H ATOM 841 N LEU A 97 -21.844 -10.202 -60.059 1.00 25.31 N ATOM 842 CA LEU A 97 -20.510 -10.569 -60.545 1.00 26.41 C ATOM 843 C LEU A 97 -19.374 -9.901 -59.773 1.00 26.31 C ATOM 844 O LEU A 97 -18.451 -9.324 -60.364 1.00 28.05 O ATOM 845 CB LEU A 97 -20.379 -10.253 -62.038 1.00 29.76 C ATOM 846 CG LEU A 97 -21.466 -10.890 -62.934 1.00 32.31 C ATOM 847 CD1 LEU A 97 -21.474 -10.340 -64.353 1.00 37.01 C ATOM 848 CD2 LEU A 97 -21.294 -12.398 -62.963 1.00 28.74 C ATOM 849 H LEU A 97 -22.484 -10.954 -59.731 1.00 0.00 H ATOM 850 N PRO A 98 -19.467 -9.993 -58.434 1.00 27.75 N ATOM 851 CA PRO A 98 -18.360 -9.390 -57.683 1.00 30.43 C ATOM 852 C PRO A 98 -17.067 -10.209 -57.773 1.00 26.13 C ATOM 853 O PRO A 98 -17.152 -11.432 -57.879 1.00 27.33 O ATOM 854 CB PRO A 98 -18.892 -9.414 -56.243 1.00 30.66 C ATOM 855 CG PRO A 98 -19.730 -10.635 -56.177 1.00 24.87 C ATOM 856 CD PRO A 98 -20.442 -10.653 -57.558 1.00 26.26 C ATOM 857 N LYS A 99 -15.925 -9.569 -57.594 1.00 27.70 N ATOM 858 CA LYS A 99 -14.660 -10.289 -57.614 1.00 28.01 C ATOM 859 C LYS A 99 -14.450 -11.136 -56.365 1.00 31.53 C ATOM 860 O LYS A 99 -13.772 -12.156 -56.414 1.00 37.54 O ATOM 861 CB LYS A 99 -13.476 -9.335 -57.797 1.00 40.97 C ATOM 862 CG LYS A 99 -12.125 -10.042 -57.799 1.00 65.97 C ATOM 863 CD LYS A 99 -11.041 -9.234 -58.509 1.00 96.67 C ATOM 864 CE LYS A 99 -10.945 -7.806 -57.988 1.00118.47 C ATOM 865 NZ LYS A 99 -10.683 -7.746 -56.524 1.00128.42 N ATOM 866 HZ1 LYS A 99 -11.456 -8.221 -56.015 1.00 0.00 H ATOM 867 HZ2 LYS A 99 -9.783 -8.224 -56.314 1.00 0.00 H ATOM 868 HZ3 LYS A 99 -10.627 -6.752 -56.223 1.00 0.00 H ATOM 869 H LYS A 99 -15.930 -8.541 -57.437 1.00 0.00 H ATOM 870 N GLU A 100 -15.060 -10.738 -55.255 1.00 27.97 N ATOM 871 CA GLU A 100 -14.811 -11.430 -53.975 1.00 32.38 C ATOM 872 C GLU A 100 -16.158 -11.772 -53.365 1.00 29.03 C ATOM 873 O GLU A 100 -16.605 -11.123 -52.428 1.00 28.38 O ATOM 874 CB GLU A 100 -13.992 -10.543 -53.040 1.00 48.38 C ATOM 875 CG GLU A 100 -12.580 -10.279 -53.545 1.00 72.61 C ATOM 876 CD GLU A 100 -11.522 -10.955 -52.700 1.00 89.40 C ATOM 877 OE1 GLU A 100 -11.718 -12.130 -52.327 1.00 91.61 O ATOM 878 OE2 GLU A 100 -10.496 -10.308 -52.402 1.00 94.02 O ATOM 879 H GLU A 100 -15.718 -9.933 -55.287 1.00 0.00 H ATOM 880 N PRO A 101 -16.836 -12.786 -53.919 1.00 24.76 N ATOM 881 CA PRO A 101 -18.231 -13.013 -53.535 1.00 23.97 C ATOM 882 C PRO A 101 -18.417 -13.375 -52.079 1.00 22.33 C ATOM 883 O PRO A 101 -19.405 -12.940 -51.532 1.00 22.91 O ATOM 884 CB PRO A 101 -18.706 -14.118 -54.503 1.00 24.68 C ATOM 885 CG PRO A 101 -17.461 -14.720 -55.049 1.00 26.68 C ATOM 886 CD PRO A 101 -16.403 -13.659 -55.024 1.00 25.73 C ATOM 887 N LEU A 102 -17.481 -14.112 -51.491 1.00 22.65 N ATOM 888 CA LEU A 102 -17.598 -14.436 -50.078 1.00 20.98 C ATOM 889 C LEU A 102 -17.597 -13.163 -49.255 1.00 22.01 C ATOM 890 O LEU A 102 -18.448 -13.009 -48.365 1.00 21.47 O ATOM 891 CB LEU A 102 -16.477 -15.368 -49.650 1.00 23.76 C ATOM 892 CG LEU A 102 -16.369 -15.571 -48.131 1.00 26.33 C ATOM 893 CD1 LEU A 102 -17.538 -16.322 -47.670 1.00 27.68 C ATOM 894 CD2 LEU A 102 -15.063 -16.276 -47.788 1.00 33.41 C ATOM 895 H LEU A 102 -16.667 -14.456 -52.039 1.00 0.00 H ATOM 896 N LEU A 103 -16.671 -12.256 -49.510 1.00 24.77 N ATOM 897 CA LEU A 103 -16.628 -11.010 -48.744 1.00 21.06 C ATOM 898 C LEU A 103 -17.905 -10.201 -48.926 1.00 25.45 C ATOM 899 O LEU A 103 -18.396 -9.603 -47.983 1.00 23.03 O ATOM 900 CB LEU A 103 -15.432 -10.148 -49.081 1.00 24.61 C ATOM 901 CG LEU A 103 -14.063 -10.815 -49.056 1.00 28.15 C ATOM 902 CD1 LEU A 103 -12.977 -9.818 -49.332 1.00 27.99 C ATOM 903 CD2 LEU A 103 -13.896 -11.484 -47.691 1.00 27.83 C ATOM 904 H LEU A 103 -15.970 -12.428 -50.258 1.00 0.00 H ATOM 905 N GLU A 104 -18.427 -10.147 -50.152 1.00 23.70 N ATOM 906 CA GLU A 104 -19.618 -9.331 -50.409 1.00 23.88 C ATOM 907 C GLU A 104 -20.867 -9.925 -49.765 1.00 20.61 C ATOM 908 O GLU A 104 -21.707 -9.208 -49.250 1.00 23.85 O ATOM 909 CB GLU A 104 -19.816 -9.189 -51.922 1.00 26.47 C ATOM 910 CG GLU A 104 -18.627 -8.544 -52.606 1.00 31.19 C ATOM 911 CD GLU A 104 -18.415 -7.078 -52.249 1.00 42.61 C ATOM 912 OE1 GLU A 104 -19.252 -6.493 -51.538 1.00 38.56 O ATOM 913 OE2 GLU A 104 -17.396 -6.506 -52.688 1.00 43.55 O ATOM 914 H GLU A 104 -17.989 -10.684 -50.927 1.00 0.00 H ATOM 915 N ILE A 105 -20.959 -11.235 -49.779 1.00 18.65 N ATOM 916 CA ILE A 105 -22.104 -11.924 -49.212 1.00 20.57 C ATOM 917 C ILE A 105 -22.134 -11.737 -47.708 1.00 20.23 C ATOM 918 O ILE A 105 -23.201 -11.500 -47.145 1.00 20.18 O ATOM 919 CB ILE A 105 -22.100 -13.388 -49.639 1.00 22.74 C ATOM 920 CG1 ILE A 105 -22.656 -13.460 -51.064 1.00 25.38 C ATOM 921 CG2 ILE A 105 -22.906 -14.250 -48.713 1.00 31.13 C ATOM 922 CD1 ILE A 105 -22.337 -14.698 -51.765 1.00 33.38 C ATOM 923 H ILE A 105 -20.192 -11.793 -50.207 1.00 0.00 H ATOM 924 N LEU A 106 -20.978 -11.837 -47.049 1.00 17.83 N ATOM 925 CA LEU A 106 -20.939 -11.636 -45.612 1.00 19.28 C ATOM 926 C LEU A 106 -21.307 -10.191 -45.254 1.00 17.76 C ATOM 927 O LEU A 106 -22.089 -9.966 -44.320 1.00 19.37 O ATOM 928 CB LEU A 106 -19.576 -12.027 -45.033 1.00 19.91 C ATOM 929 CG LEU A 106 -19.260 -13.517 -45.125 1.00 20.10 C ATOM 930 CD1 LEU A 106 -17.832 -13.794 -44.716 1.00 23.17 C ATOM 931 CD2 LEU A 106 -20.195 -14.351 -44.251 1.00 27.26 C ATOM 932 H LEU A 106 -20.103 -12.059 -47.566 1.00 0.00 H ATOM 933 N HIS A 107 -20.714 -9.225 -45.957 1.00 18.39 N ATOM 934 CA HIS A 107 -20.949 -7.806 -45.788 1.00 18.96 C ATOM 935 C HIS A 107 -22.437 -7.476 -45.932 1.00 22.76 C ATOM 936 O HIS A 107 -22.976 -6.582 -45.276 1.00 25.43 O ATOM 937 CB HIS A 107 -20.128 -7.105 -46.881 1.00 24.17 C ATOM 938 CG HIS A 107 -20.316 -5.627 -46.964 1.00 26.26 C ATOM 939 ND1 HIS A 107 -19.912 -4.760 -45.967 1.00 36.20 N ATOM 940 CD2 HIS A 107 -20.823 -4.855 -47.956 1.00 31.59 C ATOM 941 CE1 HIS A 107 -20.183 -3.518 -46.337 1.00 38.73 C ATOM 942 NE2 HIS A 107 -20.733 -3.550 -47.538 1.00 38.01 N ATOM 943 H HIS A 107 -20.029 -9.514 -46.684 1.00 0.00 H ATOM 944 N THR A 108 -23.102 -8.196 -46.812 1.00 22.39 N ATOM 945 CA THR A 108 -24.507 -7.940 -47.076 1.00 22.34 C ATOM 946 C THR A 108 -25.451 -8.651 -46.086 1.00 18.42 C ATOM 947 O THR A 108 -26.367 -8.021 -45.519 1.00 21.32 O ATOM 948 CB THR A 108 -24.838 -8.395 -48.505 1.00 22.45 C ATOM 949 OG1 THR A 108 -24.082 -7.604 -49.433 1.00 24.78 O ATOM 950 CG2 THR A 108 -26.313 -8.256 -48.828 1.00 20.77 C ATOM 951 HG1 THR A 108 -23.115 -7.726 -49.258 1.00 0.00 H ATOM 952 H THR A 108 -22.614 -8.958 -47.325 1.00 0.00 H ATOM 953 N TRP A 109 -25.259 -9.954 -45.914 1.00 17.63 N ATOM 954 CA TRP A 109 -26.162 -10.764 -45.081 1.00 18.47 C ATOM 955 C TRP A 109 -25.948 -10.611 -43.578 1.00 18.54 C ATOM 956 O TRP A 109 -26.907 -10.806 -42.809 1.00 18.72 O ATOM 957 CB TRP A 109 -26.059 -12.240 -45.451 1.00 17.73 C ATOM 958 CG TRP A 109 -26.721 -12.568 -46.747 1.00 15.90 C ATOM 959 CD1 TRP A 109 -26.157 -12.524 -47.996 1.00 17.38 C ATOM 960 CD2 TRP A 109 -28.054 -13.032 -46.929 1.00 16.43 C ATOM 961 NE1 TRP A 109 -27.067 -12.914 -48.920 1.00 16.69 N ATOM 962 CE2 TRP A 109 -28.257 -13.217 -48.305 1.00 18.51 C ATOM 963 CE3 TRP A 109 -29.131 -13.283 -46.053 1.00 16.49 C ATOM 964 CZ2 TRP A 109 -29.449 -13.665 -48.815 1.00 18.12 C ATOM 965 CZ3 TRP A 109 -30.286 -13.702 -46.556 1.00 19.33 C ATOM 966 CH2 TRP A 109 -30.469 -13.892 -47.918 1.00 17.96 C ATOM 967 HE1 TRP A 109 -26.891 -12.975 -49.943 1.00 0.00 H ATOM 968 H TRP A 109 -24.450 -10.413 -46.380 1.00 0.00 H ATOM 969 N LEU A 110 -24.723 -10.286 -43.165 1.00 17.81 N ATOM 970 CA LEU A 110 -24.370 -10.150 -41.740 1.00 15.88 C ATOM 971 C LEU A 110 -23.686 -8.782 -41.536 1.00 19.20 C ATOM 972 O LEU A 110 -22.487 -8.690 -41.226 1.00 20.07 O ATOM 973 CB LEU A 110 -23.475 -11.311 -41.324 1.00 16.53 C ATOM 974 CG LEU A 110 -24.124 -12.694 -41.284 1.00 18.79 C ATOM 975 CD1 LEU A 110 -23.107 -13.787 -41.062 1.00 18.73 C ATOM 976 CD2 LEU A 110 -25.262 -12.761 -40.272 1.00 18.12 C ATOM 977 H LEU A 110 -23.985 -10.121 -43.879 1.00 0.00 H ATOM 978 N PRO A 111 -24.439 -7.697 -41.714 1.00 19.77 N ATOM 979 CA PRO A 111 -23.865 -6.348 -41.663 1.00 20.80 C ATOM 980 C PRO A 111 -23.598 -5.829 -40.254 1.00 23.30 C ATOM 981 O PRO A 111 -22.836 -4.865 -40.068 1.00 24.91 O ATOM 982 CB PRO A 111 -24.948 -5.502 -42.327 1.00 25.71 C ATOM 983 CG PRO A 111 -26.198 -6.240 -42.035 1.00 20.35 C ATOM 984 CD PRO A 111 -25.859 -7.675 -42.108 1.00 18.73 C ATOM 985 N GLY A 112 -24.235 -6.432 -39.265 1.00 21.37 N ATOM 986 CA GLY A 112 -24.168 -5.891 -37.906 1.00 23.98 C ATOM 987 C GLY A 112 -23.181 -6.598 -36.994 1.00 20.74 C ATOM 988 O GLY A 112 -23.094 -7.819 -37.014 1.00 20.68 O ATOM 989 H GLY A 112 -24.786 -7.294 -39.453 1.00 0.00 H ATOM 990 N LEU A 113 -22.456 -5.822 -36.183 1.00 22.21 N ATOM 991 CA LEU A 113 -21.658 -6.379 -35.089 1.00 24.55 C ATOM 992 C LEU A 113 -22.307 -5.984 -33.783 1.00 23.77 C ATOM 993 O LEU A 113 -22.506 -4.800 -33.502 1.00 25.88 O ATOM 994 CB LEU A 113 -20.228 -5.856 -35.117 1.00 24.31 C ATOM 995 CG LEU A 113 -19.515 -6.135 -36.440 1.00 26.20 C ATOM 996 CD1 LEU A 113 -18.125 -5.534 -36.368 1.00 32.34 C ATOM 997 CD2 LEU A 113 -19.468 -7.637 -36.778 1.00 28.18 C ATOM 998 H LEU A 113 -22.459 -4.793 -36.333 1.00 0.00 H ATOM 999 N SER A 114 -22.653 -6.991 -33.004 1.00 22.32 N ATOM 1000 CA SER A 114 -23.393 -6.785 -31.769 1.00 23.06 C ATOM 1001 C SER A 114 -22.610 -7.338 -30.601 1.00 20.56 C ATOM 1002 O SER A 114 -22.413 -8.537 -30.504 1.00 23.11 O ATOM 1003 CB SER A 114 -24.700 -7.528 -31.879 1.00 24.76 C ATOM 1004 OG SER A 114 -25.564 -7.199 -30.852 1.00 28.41 O ATOM 1005 HG SER A 114 -25.754 -6.228 -30.881 1.00 0.00 H ATOM 1006 H SER A 114 -22.389 -7.958 -33.281 1.00 0.00 H ATOM 1007 N LEU A 115 -22.160 -6.444 -29.727 1.00 23.74 N ATOM 1008 CA LEU A 115 -21.418 -6.815 -28.524 1.00 23.67 C ATOM 1009 C LEU A 115 -22.342 -6.997 -27.315 1.00 23.94 C ATOM 1010 O LEU A 115 -22.995 -6.063 -26.893 1.00 24.58 O ATOM 1011 CB LEU A 115 -20.413 -5.704 -28.199 1.00 25.61 C ATOM 1012 CG LEU A 115 -19.622 -5.804 -26.888 1.00 24.32 C ATOM 1013 CD1 LEU A 115 -18.801 -7.069 -26.898 1.00 24.70 C ATOM 1014 CD2 LEU A 115 -18.769 -4.554 -26.728 1.00 28.29 C ATOM 1015 H LEU A 115 -22.344 -5.436 -29.907 1.00 0.00 H ATOM 1016 N SER A 116 -22.378 -8.215 -26.789 1.00 22.32 N ATOM 1017 CA SER A 116 -23.172 -8.544 -25.621 1.00 22.03 C ATOM 1018 C SER A 116 -22.483 -8.044 -24.368 1.00 25.87 C ATOM 1019 O SER A 116 -21.280 -8.311 -24.154 1.00 26.24 O ATOM 1020 CB SER A 116 -23.360 -10.049 -25.552 1.00 22.85 C ATOM 1021 OG SER A 116 -24.095 -10.445 -24.423 1.00 27.58 O ATOM 1022 HG SER A 116 -23.619 -10.158 -23.604 1.00 0.00 H ATOM 1023 H SER A 116 -21.812 -8.966 -27.234 1.00 0.00 H ATOM 1024 N SER A 117 -23.257 -7.346 -23.546 1.00 26.92 N ATOM 1025 CA SER A 117 -22.795 -6.769 -22.265 1.00 24.63 C ATOM 1026 C SER A 117 -23.725 -7.138 -21.102 1.00 26.51 C ATOM 1027 O SER A 117 -24.892 -7.461 -21.329 1.00 30.95 O ATOM 1028 CB SER A 117 -22.790 -5.236 -22.367 1.00 30.11 C ATOM 1029 OG SER A 117 -22.297 -4.647 -21.193 1.00 43.34 O ATOM 1030 HG SER A 117 -22.868 -4.910 -20.428 1.00 0.00 H ATOM 1031 H SER A 117 -24.249 -7.196 -23.820 1.00 0.00 H ATOM 1032 N ILE A 118 -23.233 -7.066 -19.876 1.00 28.73 N ATOM 1033 CA ILE A 118 -24.105 -7.117 -18.705 1.00 29.98 C ATOM 1034 C ILE A 118 -24.933 -5.840 -18.675 1.00 34.59 C ATOM 1035 O ILE A 118 -24.674 -4.899 -19.431 1.00 33.20 O ATOM 1036 CB ILE A 118 -23.330 -7.296 -17.374 1.00 30.71 C ATOM 1037 CG1 ILE A 118 -22.346 -6.139 -17.142 1.00 31.71 C ATOM 1038 CG2 ILE A 118 -22.623 -8.642 -17.382 1.00 33.88 C ATOM 1039 CD1 ILE A 118 -21.502 -6.282 -15.849 1.00 32.51 C ATOM 1040 H ILE A 118 -22.206 -6.971 -19.743 1.00 0.00 H ATOM 1041 N HIS A 119 -25.941 -5.835 -17.820 1.00 37.15 N ATOM 1042 CA HIS A 119 -26.920 -4.746 -17.757 1.00 43.52 C ATOM 1043 C HIS A 119 -26.344 -3.548 -17.004 1.00 43.21 C ATOM 1044 O HIS A 119 -25.567 -3.735 -16.080 1.00 39.78 O ATOM 1045 CB HIS A 119 -28.172 -5.243 -17.039 1.00 41.30 C ATOM 1046 CG HIS A 119 -29.297 -4.254 -17.023 1.00 50.16 C ATOM 1047 ND1 HIS A 119 -29.401 -3.258 -16.076 1.00 46.04 N ATOM 1048 CD2 HIS A 119 -30.364 -4.102 -17.844 1.00 45.26 C ATOM 1049 CE1 HIS A 119 -30.483 -2.539 -16.309 1.00 51.82 C ATOM 1050 NE2 HIS A 119 -31.091 -3.034 -17.372 1.00 49.30 N ATOM 1051 H HIS A 119 -26.044 -6.636 -17.165 1.00 0.00 H ATOM 1052 N PRO A 120 -26.727 -2.317 -17.384 1.00 48.45 N ATOM 1053 CA PRO A 120 -26.172 -1.111 -16.756 1.00 56.16 C ATOM 1054 C PRO A 120 -26.257 -1.059 -15.233 1.00 48.69 C ATOM 1055 O PRO A 120 -25.430 -0.385 -14.617 1.00 53.31 O ATOM 1056 CB PRO A 120 -27.027 0.009 -17.351 1.00 71.63 C ATOM 1057 CG PRO A 120 -27.392 -0.483 -18.675 1.00 62.15 C ATOM 1058 CD PRO A 120 -27.549 -1.972 -18.558 1.00 50.19 C ATOM 1059 N ARG A 121 -27.233 -1.736 -14.635 1.00 44.26 N ATOM 1060 CA ARG A 121 -27.377 -1.701 -13.183 1.00 51.01 C ATOM 1061 C ARG A 121 -26.132 -2.298 -12.539 1.00 51.56 C ATOM 1062 O ARG A 121 -25.800 -1.979 -11.406 1.00 50.27 O ATOM 1063 CB ARG A 121 -28.636 -2.449 -12.719 1.00 49.35 C ATOM 1064 CG ARG A 121 -28.563 -3.966 -12.856 1.00 52.58 C ATOM 1065 CD ARG A 121 -29.780 -4.648 -12.246 1.00 65.43 C ATOM 1066 NE ARG A 121 -31.016 -4.319 -12.954 1.00 68.54 N ATOM 1067 CZ ARG A 121 -31.430 -4.914 -14.070 1.00 66.45 C ATOM 1068 NH1 ARG A 121 -32.568 -4.538 -14.634 1.00 61.31 N ATOM 1069 NH2 ARG A 121 -30.711 -5.882 -14.629 1.00 66.12 N ATOM 1070 HE ARG A 121 -31.614 -3.566 -12.557 1.00 0.00 H ATOM 1071 HH12 ARG A 121 -32.894 -5.001 -15.506 1.00 0.00 H ATOM 1072 HH11 ARG A 121 -33.135 -3.780 -14.205 1.00 0.00 H ATOM 1073 HH22 ARG A 121 -31.044 -6.340 -15.501 1.00 0.00 H ATOM 1074 HH21 ARG A 121 -29.815 -6.182 -14.194 1.00 0.00 H ATOM 1075 H ARG A 121 -27.899 -2.295 -15.206 1.00 0.00 H ATOM 1076 N GLU A 122 -25.438 -3.158 -13.279 1.00 43.88 N ATOM 1077 CA GLU A 122 -24.221 -3.778 -12.781 1.00 44.76 C ATOM 1078 C GLU A 122 -23.022 -2.836 -12.946 1.00 45.05 C ATOM 1079 O GLU A 122 -21.955 -3.083 -12.387 1.00 45.08 O ATOM 1080 CB GLU A 122 -23.958 -5.099 -13.515 1.00 47.87 C ATOM 1081 CG GLU A 122 -25.079 -6.120 -13.411 1.00 69.50 C ATOM 1082 CD GLU A 122 -25.312 -6.600 -11.995 1.00 86.55 C ATOM 1083 OE1 GLU A 122 -24.407 -6.443 -11.149 1.00 81.89 O ATOM 1084 OE2 GLU A 122 -26.405 -7.138 -11.726 1.00 91.00 O ATOM 1085 H GLU A 122 -25.773 -3.392 -14.235 1.00 0.00 H ATOM 1086 N LEU A 123 -23.200 -1.759 -13.708 1.00 63.27 N ATOM 1087 CA LEU A 123 -22.093 -0.853 -14.024 1.00 78.74 C ATOM 1088 C LEU A 123 -22.056 0.416 -13.161 1.00 93.08 C ATOM 1089 O LEU A 123 -21.082 1.167 -13.204 1.00 93.70 O ATOM 1090 CB LEU A 123 -22.134 -0.493 -15.508 1.00 69.25 C ATOM 1091 CG LEU A 123 -22.253 -1.718 -16.418 1.00 59.96 C ATOM 1092 CD1 LEU A 123 -22.362 -1.313 -17.885 1.00 64.46 C ATOM 1093 CD2 LEU A 123 -21.075 -2.667 -16.203 1.00 57.01 C ATOM 1094 H LEU A 123 -24.147 -1.556 -14.088 1.00 0.00 H ATOM 1095 N SER A 124 -23.110 0.654 -12.385 1.00102.80 N ATOM 1096 CA SER A 124 -23.115 1.760 -11.432 1.00107.85 C ATOM 1097 C SER A 124 -22.025 1.514 -10.395 1.00109.15 C ATOM 1098 O SER A 124 -21.167 2.365 -10.158 1.00115.97 O ATOM 1099 CB SER A 124 -24.476 1.877 -10.745 1.00105.54 C ATOM 1100 OG SER A 124 -24.732 0.759 -9.918 1.00 98.09 O ATOM 1101 HG SER A 124 -24.726 -0.065 -10.467 1.00 0.00 H ATOM 1102 H SER A 124 -23.946 0.040 -12.459 1.00 0.00 H ATOM 1103 N GLN A 125 -22.073 0.335 -9.786 1.00 98.43 N ATOM 1104 CA GLN A 125 -21.036 -0.120 -8.868 1.00 87.07 C ATOM 1105 C GLN A 125 -19.831 -0.618 -9.662 1.00 69.22 C ATOM 1106 O GLN A 125 -19.633 -0.243 -10.816 1.00 63.39 O ATOM 1107 CB GLN A 125 -21.574 -1.263 -8.003 1.00 92.96 C ATOM 1108 CG GLN A 125 -20.945 -1.376 -6.611 1.00 94.43 C ATOM 1109 CD GLN A 125 -20.934 -2.801 -6.067 1.00 87.57 C ATOM 1110 OE1 GLN A 125 -21.119 -3.772 -6.806 1.00 79.45 O ATOM 1111 NE2 GLN A 125 -20.721 -2.928 -4.762 1.00 86.41 N ATOM 1112 HE22 GLN A 125 -20.570 -2.083 -4.175 1.00 0.00 H ATOM 1113 HE21 GLN A 125 -20.706 -3.873 -4.327 1.00 0.00 H ATOM 1114 H GLN A 125 -22.884 -0.289 -9.972 1.00 0.00 H ATOM 1115 N THR A 126 -19.024 -1.460 -9.033 1.00 63.35 N ATOM 1116 CA THR A 126 -17.956 -2.155 -9.721 1.00 57.37 C ATOM 1117 C THR A 126 -18.513 -3.522 -10.104 1.00 41.68 C ATOM 1118 O THR A 126 -18.992 -4.259 -9.244 1.00 44.27 O ATOM 1119 CB THR A 126 -16.721 -2.309 -8.816 1.00 53.58 C ATOM 1120 OG1 THR A 126 -16.260 -1.012 -8.413 1.00 60.02 O ATOM 1121 CG2 THR A 126 -15.600 -3.024 -9.541 1.00 48.58 C ATOM 1122 HG1 THR A 126 -15.465 -1.112 -7.831 1.00 0.00 H ATOM 1123 H THR A 126 -19.162 -1.627 -8.016 1.00 0.00 H ATOM 1124 N PRO A 127 -18.488 -3.857 -11.397 1.00 38.00 N ATOM 1125 CA PRO A 127 -19.009 -5.178 -11.768 1.00 35.05 C ATOM 1126 C PRO A 127 -18.181 -6.317 -11.176 1.00 36.00 C ATOM 1127 O PRO A 127 -16.994 -6.138 -10.929 1.00 40.10 O ATOM 1128 CB PRO A 127 -18.917 -5.178 -13.294 1.00 34.36 C ATOM 1129 CG PRO A 127 -17.959 -4.097 -13.637 1.00 42.88 C ATOM 1130 CD PRO A 127 -18.096 -3.066 -12.577 1.00 43.16 C ATOM 1131 N SER A 128 -18.809 -7.471 -10.968 1.00 35.79 N ATOM 1132 CA SER A 128 -18.146 -8.580 -10.279 1.00 34.54 C ATOM 1133 C SER A 128 -17.321 -9.376 -11.280 1.00 33.39 C ATOM 1134 O SER A 128 -16.131 -9.622 -11.056 1.00 35.58 O ATOM 1135 CB SER A 128 -19.176 -9.478 -9.586 1.00 39.27 C ATOM 1136 OG SER A 128 -19.812 -8.801 -8.507 1.00 41.37 O ATOM 1137 HG SER A 128 -20.276 -7.997 -8.851 1.00 0.00 H ATOM 1138 H SER A 128 -19.788 -7.588 -11.300 1.00 0.00 H ATOM 1139 N GLY A 129 -17.936 -9.729 -12.401 1.00 31.67 N ATOM 1140 CA GLY A 129 -17.287 -10.533 -13.411 1.00 34.01 C ATOM 1141 C GLY A 129 -17.210 -9.819 -14.744 1.00 29.71 C ATOM 1142 O GLY A 129 -17.457 -8.610 -14.812 1.00 30.70 O ATOM 1143 H GLY A 129 -18.916 -9.417 -12.558 1.00 0.00 H ATOM 1144 N PRO A 130 -16.830 -10.553 -15.783 1.00 28.07 N ATOM 1145 CA PRO A 130 -16.641 -9.999 -17.122 1.00 27.09 C ATOM 1146 C PRO A 130 -17.852 -9.186 -17.574 1.00 25.86 C ATOM 1147 O PRO A 130 -18.989 -9.638 -17.502 1.00 27.90 O ATOM 1148 CB PRO A 130 -16.446 -11.236 -17.991 1.00 29.69 C ATOM 1149 CG PRO A 130 -15.908 -12.257 -17.072 1.00 30.16 C ATOM 1150 CD PRO A 130 -16.600 -12.009 -15.764 1.00 34.31 C ATOM 1151 N VAL A 131 -17.573 -7.983 -18.048 1.00 27.84 N ATOM 1152 CA VAL A 131 -18.605 -7.090 -18.553 1.00 27.21 C ATOM 1153 C VAL A 131 -19.170 -7.549 -19.899 1.00 29.68 C ATOM 1154 O VAL A 131 -20.345 -7.363 -20.158 1.00 27.21 O ATOM 1155 CB VAL A 131 -18.056 -5.658 -18.661 1.00 30.15 C ATOM 1156 CG1 VAL A 131 -19.032 -4.709 -19.334 1.00 35.72 C ATOM 1157 CG2 VAL A 131 -17.705 -5.157 -17.275 1.00 28.91 C ATOM 1158 H VAL A 131 -16.583 -7.665 -18.060 1.00 0.00 H ATOM 1159 N PHE A 132 -18.343 -8.180 -20.722 1.00 24.47 N ATOM 1160 CA PHE A 132 -18.748 -8.607 -22.058 1.00 25.85 C ATOM 1161 C PHE A 132 -18.743 -10.114 -22.230 1.00 22.85 C ATOM 1162 O PHE A 132 -17.942 -10.815 -21.602 1.00 24.02 O ATOM 1163 CB PHE A 132 -17.817 -7.984 -23.080 1.00 23.25 C ATOM 1164 CG PHE A 132 -17.740 -6.507 -22.982 1.00 27.65 C ATOM 1165 CD1 PHE A 132 -16.594 -5.880 -22.523 1.00 32.69 C ATOM 1166 CD2 PHE A 132 -18.834 -5.728 -23.326 1.00 29.92 C ATOM 1167 CE1 PHE A 132 -16.530 -4.511 -22.428 1.00 34.20 C ATOM 1168 CE2 PHE A 132 -18.778 -4.367 -23.231 1.00 31.98 C ATOM 1169 CZ PHE A 132 -17.626 -3.748 -22.782 1.00 33.20 C ATOM 1170 H PHE A 132 -17.373 -8.377 -20.405 1.00 0.00 H ATOM 1171 N GLN A 133 -19.594 -10.618 -23.123 1.00 21.76 N ATOM 1172 CA GLN A 133 -19.731 -12.066 -23.315 1.00 20.94 C ATOM 1173 C GLN A 133 -19.269 -12.574 -24.679 1.00 19.54 C ATOM 1174 O GLN A 133 -18.590 -13.602 -24.771 1.00 22.51 O ATOM 1175 CB GLN A 133 -21.173 -12.508 -23.081 1.00 23.36 C ATOM 1176 CG GLN A 133 -21.692 -12.302 -21.689 1.00 23.90 C ATOM 1177 CD GLN A 133 -22.019 -10.859 -21.397 1.00 26.42 C ATOM 1178 OE1 GLN A 133 -22.733 -10.203 -22.169 1.00 28.23 O ATOM 1179 NE2 GLN A 133 -21.493 -10.343 -20.302 1.00 28.03 N ATOM 1180 HE22 GLN A 133 -20.900 -10.931 -19.683 1.00 0.00 H ATOM 1181 HE21 GLN A 133 -21.672 -9.348 -20.058 1.00 0.00 H ATOM 1182 H GLN A 133 -20.173 -9.971 -23.696 1.00 0.00 H ATOM 1183 N HIS A 134 -19.660 -11.884 -25.753 1.00 20.14 N ATOM 1184 CA HIS A 134 -19.353 -12.343 -27.104 1.00 20.04 C ATOM 1185 C HIS A 134 -19.684 -11.203 -28.039 1.00 19.55 C ATOM 1186 O HIS A 134 -20.269 -10.212 -27.638 1.00 20.54 O ATOM 1187 CB HIS A 134 -20.193 -13.565 -27.469 1.00 21.45 C ATOM 1188 CG HIS A 134 -21.665 -13.302 -27.520 1.00 21.09 C ATOM 1189 ND1 HIS A 134 -22.541 -13.653 -26.504 1.00 23.92 N ATOM 1190 CD2 HIS A 134 -22.423 -12.708 -28.471 1.00 20.96 C ATOM 1191 CE1 HIS A 134 -23.771 -13.282 -26.839 1.00 24.53 C ATOM 1192 NE2 HIS A 134 -23.729 -12.727 -28.044 1.00 23.21 N ATOM 1193 H HIS A 134 -20.194 -11.001 -25.624 1.00 0.00 H ATOM 1194 N VAL A 135 -19.294 -11.349 -29.308 1.00 19.14 N ATOM 1195 CA VAL A 135 -19.751 -10.474 -30.397 1.00 19.82 C ATOM 1196 C VAL A 135 -20.504 -11.364 -31.343 1.00 20.34 C ATOM 1197 O VAL A 135 -20.062 -12.473 -31.652 1.00 20.86 O ATOM 1198 CB VAL A 135 -18.565 -9.743 -31.075 1.00 21.25 C ATOM 1199 CG1 VAL A 135 -18.981 -9.043 -32.382 1.00 22.34 C ATOM 1200 CG2 VAL A 135 -17.937 -8.743 -30.108 1.00 25.10 C ATOM 1201 H VAL A 135 -18.634 -12.120 -29.537 1.00 0.00 H ATOM 1202 N SER A 136 -21.654 -10.890 -31.802 1.00 19.39 N ATOM 1203 CA SER A 136 -22.396 -11.603 -32.850 1.00 18.63 C ATOM 1204 C SER A 136 -22.455 -10.851 -34.152 1.00 20.60 C ATOM 1205 O SER A 136 -22.572 -9.618 -34.190 1.00 21.48 O ATOM 1206 CB SER A 136 -23.821 -11.962 -32.417 1.00 23.58 C ATOM 1207 OG SER A 136 -23.818 -13.017 -31.453 1.00 22.09 O ATOM 1208 HG SER A 136 -23.395 -13.821 -31.847 1.00 0.00 H ATOM 1209 H SER A 136 -22.035 -10.003 -31.415 1.00 0.00 H ATOM 1210 N LEU A 137 -22.332 -11.631 -35.227 1.00 19.13 N ATOM 1211 CA LEU A 137 -22.636 -11.190 -36.586 1.00 19.98 C ATOM 1212 C LEU A 137 -24.149 -11.302 -36.756 1.00 18.63 C ATOM 1213 O LEU A 137 -24.743 -12.386 -36.559 1.00 19.83 O ATOM 1214 CB LEU A 137 -21.891 -12.048 -37.614 1.00 20.27 C ATOM 1215 CG LEU A 137 -20.398 -12.306 -37.338 1.00 19.96 C ATOM 1216 CD1 LEU A 137 -19.866 -13.281 -38.410 1.00 22.13 C ATOM 1217 CD2 LEU A 137 -19.612 -11.047 -37.342 1.00 19.57 C ATOM 1218 H LEU A 137 -22.001 -12.607 -35.090 1.00 0.00 H ATOM 1219 N CYS A 138 -24.777 -10.183 -37.122 1.00 19.43 N ATOM 1220 CA CYS A 138 -26.221 -10.096 -37.111 1.00 19.87 C ATOM 1221 C CYS A 138 -26.817 -9.601 -38.394 1.00 20.30 C ATOM 1222 O CYS A 138 -26.309 -8.698 -39.039 1.00 22.73 O ATOM 1223 CB CYS A 138 -26.678 -9.195 -35.959 1.00 21.33 C ATOM 1224 SG CYS A 138 -26.348 -9.849 -34.301 1.00 22.74 S ATOM 1225 H CYS A 138 -24.218 -9.358 -37.421 1.00 0.00 H ATOM 1226 N ALA A 139 -27.943 -10.201 -38.747 1.00 20.56 N ATOM 1227 CA ALA A 139 -28.726 -9.805 -39.885 1.00 21.67 C ATOM 1228 C ALA A 139 -29.680 -8.660 -39.549 1.00 23.05 C ATOM 1229 O ALA A 139 -30.028 -7.871 -40.406 1.00 27.38 O ATOM 1230 CB ALA A 139 -29.497 -10.989 -40.363 1.00 22.05 C ATOM 1231 H ALA A 139 -28.278 -11.000 -38.171 1.00 0.00 H ATOM 1232 N LEU A 140 -30.072 -8.581 -38.269 1.00 22.92 N ATOM 1233 CA LEU A 140 -30.989 -7.544 -37.806 1.00 25.61 C ATOM 1234 C LEU A 140 -30.446 -6.885 -36.545 1.00 27.61 C ATOM 1235 O LEU A 140 -29.681 -7.498 -35.802 1.00 26.83 O ATOM 1236 CB LEU A 140 -32.365 -8.147 -37.503 1.00 28.81 C ATOM 1237 CG LEU A 140 -33.158 -8.616 -38.723 1.00 28.37 C ATOM 1238 CD1 LEU A 140 -34.419 -9.339 -38.285 1.00 33.57 C ATOM 1239 CD2 LEU A 140 -33.549 -7.446 -39.575 1.00 32.53 C ATOM 1240 H LEU A 140 -29.712 -9.279 -37.587 1.00 0.00 H ATOM 1241 N GLY A 141 -30.829 -5.628 -36.324 1.00 33.66 N ATOM 1242 CA GLY A 141 -30.550 -4.988 -35.041 1.00 30.43 C ATOM 1243 C GLY A 141 -29.516 -3.878 -35.043 1.00 34.70 C ATOM 1244 O GLY A 141 -29.237 -3.316 -33.991 1.00 33.75 O ATOM 1245 H GLY A 141 -31.329 -5.100 -37.068 1.00 0.00 H ATOM 1246 N ARG A 142 -28.969 -3.520 -36.199 1.00 35.49 N ATOM 1247 CA ARG A 142 -27.911 -2.510 -36.241 1.00 35.17 C ATOM 1248 C ARG A 142 -28.503 -1.121 -36.014 1.00 36.10 C ATOM 1249 O ARG A 142 -29.487 -0.741 -36.646 1.00 38.47 O ATOM 1250 CB ARG A 142 -27.157 -2.558 -37.584 1.00 34.09 C ATOM 1251 CG ARG A 142 -25.896 -1.681 -37.586 1.00 40.58 C ATOM 1252 CD ARG A 142 -25.098 -1.828 -38.883 1.00 41.64 C ATOM 1253 NE ARG A 142 -25.851 -1.421 -40.074 1.00 44.64 N ATOM 1254 CZ ARG A 142 -25.890 -0.181 -40.555 1.00 56.63 C ATOM 1255 NH1 ARG A 142 -25.231 0.800 -39.953 1.00 51.30 N ATOM 1256 NH2 ARG A 142 -26.604 0.082 -41.647 1.00 62.85 N ATOM 1257 HE ARG A 142 -26.392 -2.153 -40.578 1.00 0.00 H ATOM 1258 HH12 ARG A 142 -25.269 1.765 -40.338 1.00 0.00 H ATOM 1259 HH11 ARG A 142 -24.676 0.604 -39.095 1.00 0.00 H ATOM 1260 HH22 ARG A 142 -26.637 1.050 -42.026 1.00 0.00 H ATOM 1261 HH21 ARG A 142 -27.129 -0.680 -42.121 1.00 0.00 H ATOM 1262 H ARG A 142 -29.295 -3.961 -37.082 1.00 0.00 H ATOM 1263 N ARG A 143 -27.914 -0.367 -35.091 1.00 37.13 N ATOM 1264 CA ARG A 143 -28.405 0.974 -34.778 1.00 43.34 C ATOM 1265 C ARG A 143 -27.250 1.965 -34.820 1.00 45.27 C ATOM 1266 O ARG A 143 -27.133 2.754 -35.759 1.00 50.10 O ATOM 1267 CB ARG A 143 -29.075 0.993 -33.401 1.00 45.34 C ATOM 1268 CG ARG A 143 -30.405 0.252 -33.357 1.00 45.10 C ATOM 1269 CD ARG A 143 -31.044 0.344 -31.972 1.00 43.78 C ATOM 1270 NE ARG A 143 -32.102 -0.651 -31.807 1.00 51.25 N ATOM 1271 CZ ARG A 143 -32.792 -0.842 -30.687 1.00 43.97 C ATOM 1272 NH1 ARG A 143 -32.560 -0.099 -29.612 1.00 47.13 N ATOM 1273 NH2 ARG A 143 -33.724 -1.786 -30.653 1.00 49.64 N ATOM 1274 HE ARG A 143 -32.331 -1.252 -32.624 1.00 0.00 H ATOM 1275 HH12 ARG A 143 -33.107 -0.258 -28.742 1.00 0.00 H ATOM 1276 HH11 ARG A 143 -31.831 0.643 -29.640 1.00 0.00 H ATOM 1277 HH22 ARG A 143 -34.271 -1.946 -29.783 1.00 0.00 H ATOM 1278 HH21 ARG A 143 -33.907 -2.366 -31.496 1.00 0.00 H ATOM 1279 H ARG A 143 -27.087 -0.739 -34.581 1.00 0.00 H ATOM 1280 N ARG A 144 -26.387 1.913 -33.808 1.00 43.44 N ATOM 1281 CA ARG A 144 -25.228 2.792 -33.762 1.00 48.96 C ATOM 1282 C ARG A 144 -24.054 2.195 -34.530 1.00 43.28 C ATOM 1283 O ARG A 144 -23.168 2.916 -34.990 1.00 52.74 O ATOM 1284 CB ARG A 144 -24.800 3.053 -32.312 1.00 54.95 C ATOM 1285 CG ARG A 144 -25.776 3.893 -31.497 1.00 69.50 C ATOM 1286 CD ARG A 144 -25.090 4.509 -30.275 1.00 82.87 C ATOM 1287 NE ARG A 144 -26.050 4.926 -29.253 1.00 96.89 N ATOM 1288 CZ ARG A 144 -25.854 5.917 -28.386 1.00111.20 C ATOM 1289 NH1 ARG A 144 -24.731 6.624 -28.408 1.00113.78 N ATOM 1290 NH2 ARG A 144 -26.794 6.209 -27.497 1.00118.33 N ATOM 1291 HE ARG A 144 -26.952 4.410 -29.200 1.00 0.00 H ATOM 1292 HH12 ARG A 144 -24.589 7.396 -27.726 1.00 0.00 H ATOM 1293 HH11 ARG A 144 -23.993 6.406 -29.108 1.00 0.00 H ATOM 1294 HH22 ARG A 144 -26.645 6.982 -26.818 1.00 0.00 H ATOM 1295 HH21 ARG A 144 -27.680 5.665 -27.479 1.00 0.00 H ATOM 1296 H ARG A 144 -26.544 1.233 -33.037 1.00 0.00 H ATOM 1297 N GLY A 145 -24.043 0.878 -34.664 1.00 38.30 N ATOM 1298 CA GLY A 145 -22.934 0.204 -35.313 1.00 39.85 C ATOM 1299 C GLY A 145 -22.915 0.551 -36.792 1.00 40.55 C ATOM 1300 O GLY A 145 -23.913 1.013 -37.336 1.00 43.52 O ATOM 1301 H GLY A 145 -24.840 0.319 -34.299 1.00 0.00 H ATOM 1302 N THR A 146 -21.762 0.353 -37.424 1.00 41.94 N ATOM 1303 CA THR A 146 -21.670 0.545 -38.868 1.00 48.75 C ATOM 1304 C THR A 146 -21.750 -0.811 -39.549 1.00 42.13 C ATOM 1305 O THR A 146 -21.797 -1.850 -38.877 1.00 39.14 O ATOM 1306 CB THR A 146 -20.374 1.264 -39.281 1.00 52.95 C ATOM 1307 OG1 THR A 146 -20.303 1.356 -40.708 1.00 54.84 O ATOM 1308 CG2 THR A 146 -19.178 0.517 -38.786 1.00 51.25 C ATOM 1309 HG1 THR A 146 -21.082 1.866 -41.044 1.00 0.00 H ATOM 1310 H THR A 146 -20.921 0.060 -36.887 1.00 0.00 H ATOM 1311 N VAL A 147 -21.797 -0.800 -40.878 1.00 41.23 N ATOM 1312 CA VAL A 147 -21.823 -2.050 -41.616 1.00 35.98 C ATOM 1313 C VAL A 147 -20.461 -2.731 -41.504 1.00 35.25 C ATOM 1314 O VAL A 147 -19.418 -2.123 -41.780 1.00 43.04 O ATOM 1315 CB VAL A 147 -22.197 -1.838 -43.093 1.00 39.63 C ATOM 1316 CG1 VAL A 147 -22.190 -3.172 -43.836 1.00 37.72 C ATOM 1317 CG2 VAL A 147 -23.562 -1.182 -43.187 1.00 42.58 C ATOM 1318 H VAL A 147 -21.815 0.105 -41.389 1.00 0.00 H ATOM 1319 N ALA A 148 -20.488 -3.999 -41.121 1.00 30.18 N ATOM 1320 CA ALA A 148 -19.274 -4.792 -40.956 1.00 34.36 C ATOM 1321 C ALA A 148 -18.551 -5.010 -42.295 1.00 36.47 C ATOM 1322 O ALA A 148 -19.174 -5.219 -43.361 1.00 32.33 O ATOM 1323 CB ALA A 148 -19.606 -6.125 -40.311 1.00 30.05 C ATOM 1324 H ALA A 148 -21.408 -4.446 -40.931 1.00 0.00 H ATOM 1325 N VAL A 149 -17.228 -4.901 -42.227 1.00 27.58 N ATOM 1326 CA VAL A 149 -16.331 -5.135 -43.348 1.00 30.43 C ATOM 1327 C VAL A 149 -15.587 -6.438 -43.124 1.00 27.99 C ATOM 1328 O VAL A 149 -15.032 -6.662 -42.058 1.00 27.67 O ATOM 1329 CB VAL A 149 -15.339 -3.972 -43.532 1.00 32.17 C ATOM 1330 CG1 VAL A 149 -14.315 -4.290 -44.638 1.00 35.12 C ATOM 1331 CG2 VAL A 149 -16.107 -2.698 -43.896 1.00 34.07 C ATOM 1332 H VAL A 149 -16.808 -4.631 -41.315 1.00 0.00 H ATOM 1333 N TYR A 150 -15.624 -7.293 -44.136 1.00 29.02 N ATOM 1334 CA TYR A 150 -14.919 -8.560 -44.137 1.00 29.65 C ATOM 1335 C TYR A 150 -13.798 -8.529 -45.172 1.00 28.86 C ATOM 1336 O TYR A 150 -13.992 -8.041 -46.296 1.00 30.65 O ATOM 1337 CB TYR A 150 -15.897 -9.681 -44.455 1.00 26.96 C ATOM 1338 CG TYR A 150 -17.045 -9.814 -43.471 1.00 23.07 C ATOM 1339 CD1 TYR A 150 -18.191 -9.018 -43.581 1.00 23.14 C ATOM 1340 CD2 TYR A 150 -17.000 -10.744 -42.451 1.00 22.94 C ATOM 1341 CE1 TYR A 150 -19.246 -9.146 -42.717 1.00 23.06 C ATOM 1342 CE2 TYR A 150 -18.059 -10.878 -41.560 1.00 23.69 C ATOM 1343 CZ TYR A 150 -19.170 -10.071 -41.678 1.00 21.52 C ATOM 1344 OH TYR A 150 -20.217 -10.217 -40.803 1.00 21.95 O ATOM 1345 HH TYR A 150 -20.927 -9.564 -41.028 1.00 0.00 H ATOM 1346 H TYR A 150 -16.188 -7.042 -44.973 1.00 0.00 H ATOM 1347 N GLY A 151 -12.641 -9.069 -44.798 1.00 29.71 N ATOM 1348 CA GLY A 151 -11.473 -9.051 -45.663 1.00 32.94 C ATOM 1349 C GLY A 151 -10.441 -10.102 -45.298 1.00 38.30 C ATOM 1350 O GLY A 151 -10.581 -10.795 -44.296 1.00 39.83 O ATOM 1351 H GLY A 151 -12.570 -9.516 -43.862 1.00 0.00 H ATOM 1352 N HIS A 152 -9.386 -10.211 -46.100 1.00 36.59 N ATOM 1353 CA HIS A 152 -8.385 -11.258 -45.909 1.00 41.04 C ATOM 1354 C HIS A 152 -7.199 -10.778 -45.089 1.00 42.02 C ATOM 1355 O HIS A 152 -6.377 -11.577 -44.648 1.00 52.01 O ATOM 1356 CB HIS A 152 -7.925 -11.797 -47.266 1.00 44.17 C ATOM 1357 CG HIS A 152 -9.039 -12.360 -48.096 1.00 46.89 C ATOM 1358 ND1 HIS A 152 -9.796 -13.440 -47.695 1.00 54.41 N ATOM 1359 CD2 HIS A 152 -9.521 -11.993 -49.308 1.00 58.43 C ATOM 1360 CE1 HIS A 152 -10.698 -13.713 -48.621 1.00 57.09 C ATOM 1361 NE2 HIS A 152 -10.552 -12.849 -49.610 1.00 61.03 N ATOM 1362 H HIS A 152 -9.271 -9.535 -46.882 1.00 0.00 H ATOM 1363 N ASP A 153 -7.134 -9.467 -44.864 1.00 47.73 N ATOM 1364 CA ASP A 153 -6.024 -8.837 -44.149 1.00 55.61 C ATOM 1365 C ASP A 153 -6.532 -7.739 -43.206 1.00 48.80 C ATOM 1366 O ASP A 153 -7.219 -6.817 -43.647 1.00 47.16 O ATOM 1367 CB ASP A 153 -5.041 -8.255 -45.171 1.00 62.55 C ATOM 1368 CG ASP A 153 -4.163 -7.170 -44.591 1.00 63.59 C ATOM 1369 OD1 ASP A 153 -4.580 -5.995 -44.616 1.00 58.77 O ATOM 1370 OD2 ASP A 153 -3.048 -7.489 -44.128 1.00 70.41 O ATOM 1371 H ASP A 153 -7.907 -8.864 -45.212 1.00 0.00 H ATOM 1372 N ALA A 154 -6.176 -7.830 -41.920 1.00 47.31 N ATOM 1373 CA ALA A 154 -6.715 -6.927 -40.906 1.00 40.60 C ATOM 1374 C ALA A 154 -6.466 -5.450 -41.222 1.00 43.09 C ATOM 1375 O ALA A 154 -7.331 -4.614 -40.984 1.00 42.71 O ATOM 1376 CB ALA A 154 -6.161 -7.280 -39.534 1.00 45.50 C ATOM 1377 H ALA A 154 -5.497 -8.564 -41.634 1.00 0.00 H ATOM 1378 N GLU A 155 -5.293 -5.132 -41.766 1.00 46.09 N ATOM 1379 CA GLU A 155 -4.967 -3.755 -42.132 1.00 49.51 C ATOM 1380 C GLU A 155 -5.954 -3.238 -43.181 1.00 54.10 C ATOM 1381 O GLU A 155 -6.464 -2.120 -43.069 1.00 50.58 O ATOM 1382 CB GLU A 155 -3.526 -3.666 -42.657 1.00 55.41 C ATOM 1383 CG GLU A 155 -2.838 -2.314 -42.457 1.00 90.22 C ATOM 1384 CD GLU A 155 -3.418 -1.192 -43.300 1.00119.29 C ATOM 1385 OE1 GLU A 155 -3.310 -0.021 -42.875 1.00124.85 O ATOM 1386 OE2 GLU A 155 -3.962 -1.469 -44.389 1.00135.99 O ATOM 1387 H GLU A 155 -4.592 -5.881 -41.935 1.00 0.00 H ATOM 1388 N TRP A 156 -6.234 -4.055 -44.195 1.00 51.11 N ATOM 1389 CA TRP A 156 -7.159 -3.655 -45.240 1.00 72.63 C ATOM 1390 C TRP A 156 -8.533 -3.391 -44.651 1.00 62.61 C ATOM 1391 O TRP A 156 -9.180 -2.413 -44.993 1.00 49.51 O ATOM 1392 CB TRP A 156 -7.266 -4.720 -46.325 1.00 83.31 C ATOM 1393 CG TRP A 156 -8.188 -4.297 -47.415 1.00 87.31 C ATOM 1394 CD1 TRP A 156 -7.901 -3.454 -48.448 1.00 90.41 C ATOM 1395 CD2 TRP A 156 -9.558 -4.676 -47.577 1.00 78.22 C ATOM 1396 NE1 TRP A 156 -9.006 -3.290 -49.247 1.00 82.80 N ATOM 1397 CE2 TRP A 156 -10.037 -4.030 -48.733 1.00 76.59 C ATOM 1398 CE3 TRP A 156 -10.425 -5.502 -46.858 1.00 61.27 C ATOM 1399 CZ2 TRP A 156 -11.342 -4.187 -49.187 1.00 71.64 C ATOM 1400 CZ3 TRP A 156 -11.718 -5.652 -47.306 1.00 61.87 C ATOM 1401 CH2 TRP A 156 -12.166 -5.000 -48.462 1.00 65.72 C ATOM 1402 HE1 TRP A 156 -9.052 -2.700 -50.102 1.00 0.00 H ATOM 1403 H TRP A 156 -5.784 -4.992 -44.239 1.00 0.00 H ATOM 1404 N VAL A 157 -8.970 -4.262 -43.750 1.00 53.23 N ATOM 1405 CA VAL A 157 -10.287 -4.120 -43.149 1.00 38.75 C ATOM 1406 C VAL A 157 -10.415 -2.830 -42.351 1.00 41.05 C ATOM 1407 O VAL A 157 -11.363 -2.077 -42.542 1.00 42.39 O ATOM 1408 CB VAL A 157 -10.628 -5.341 -42.286 1.00 35.78 C ATOM 1409 CG1 VAL A 157 -11.822 -5.069 -41.357 1.00 33.51 C ATOM 1410 CG2 VAL A 157 -10.931 -6.536 -43.182 1.00 34.36 C ATOM 1411 H VAL A 157 -8.362 -5.058 -43.470 1.00 0.00 H ATOM 1412 N VAL A 158 -9.464 -2.551 -41.462 1.00 41.00 N ATOM 1413 CA VAL A 158 -9.579 -1.353 -40.638 1.00 45.04 C ATOM 1414 C VAL A 158 -9.434 -0.094 -41.499 1.00 58.48 C ATOM 1415 O VAL A 158 -10.087 0.923 -41.253 1.00 47.34 O ATOM 1416 CB VAL A 158 -8.551 -1.360 -39.489 1.00 58.87 C ATOM 1417 CG1 VAL A 158 -8.714 -0.128 -38.612 1.00 64.16 C ATOM 1418 CG2 VAL A 158 -8.713 -2.619 -38.652 1.00 56.02 C ATOM 1419 H VAL A 158 -8.645 -3.183 -41.356 1.00 0.00 H ATOM 1420 N SER A 159 -8.605 -0.176 -42.533 1.00 55.04 N ATOM 1421 CA SER A 159 -8.350 0.971 -43.394 1.00 62.80 C ATOM 1422 C SER A 159 -9.571 1.370 -44.234 1.00 63.45 C ATOM 1423 O SER A 159 -9.543 2.389 -44.923 1.00 59.28 O ATOM 1424 CB SER A 159 -7.168 0.674 -44.315 1.00 70.18 C ATOM 1425 OG SER A 159 -7.492 -0.356 -45.228 1.00 66.45 O ATOM 1426 HG SER A 159 -7.723 -1.178 -44.728 1.00 0.00 H ATOM 1427 H SER A 159 -8.128 -1.078 -42.732 1.00 0.00 H ATOM 1428 N ARG A 160 -10.638 0.576 -44.183 1.00 60.17 N ATOM 1429 CA ARG A 160 -11.866 0.914 -44.904 1.00 57.25 C ATOM 1430 C ARG A 160 -12.746 1.914 -44.151 1.00 62.39 C ATOM 1431 O ARG A 160 -13.699 2.444 -44.716 1.00 63.52 O ATOM 1432 CB ARG A 160 -12.682 -0.343 -45.230 1.00 56.27 C ATOM 1433 CG ARG A 160 -12.006 -1.315 -46.192 1.00 64.56 C ATOM 1434 CD ARG A 160 -11.421 -0.618 -47.423 1.00 81.50 C ATOM 1435 NE ARG A 160 -12.432 0.148 -48.151 1.00 96.58 N ATOM 1436 CZ ARG A 160 -12.190 0.884 -49.234 1.00115.42 C ATOM 1437 NH1 ARG A 160 -10.962 0.970 -49.729 1.00128.71 N ATOM 1438 NH2 ARG A 160 -13.182 1.540 -49.822 1.00118.11 N ATOM 1439 HE ARG A 160 -13.410 0.116 -47.798 1.00 0.00 H ATOM 1440 HH12 ARG A 160 -10.782 1.547 -50.575 1.00 0.00 H ATOM 1441 HH11 ARG A 160 -10.180 0.460 -49.271 1.00 0.00 H ATOM 1442 HH22 ARG A 160 -12.995 2.115 -50.668 1.00 0.00 H ATOM 1443 HH21 ARG A 160 -14.146 1.479 -49.437 1.00 0.00 H ATOM 1444 H ARG A 160 -10.598 -0.299 -43.622 1.00 0.00 H ATOM 1445 N PHE A 161 -12.424 2.178 -42.887 1.00 46.53 N ATOM 1446 CA PHE A 161 -13.210 3.097 -42.075 1.00 59.92 C ATOM 1447 C PHE A 161 -12.500 4.438 -41.989 1.00 65.85 C ATOM 1448 O PHE A 161 -11.539 4.595 -41.238 1.00 58.19 O ATOM 1449 CB PHE A 161 -13.430 2.507 -40.676 1.00 45.24 C ATOM 1450 CG PHE A 161 -14.231 1.231 -40.685 1.00 45.21 C ATOM 1451 CD1 PHE A 161 -15.605 1.260 -40.511 1.00 42.17 C ATOM 1452 CD2 PHE A 161 -13.613 0.002 -40.887 1.00 40.91 C ATOM 1453 CE1 PHE A 161 -16.342 0.102 -40.525 1.00 37.53 C ATOM 1454 CE2 PHE A 161 -14.347 -1.168 -40.904 1.00 37.68 C ATOM 1455 CZ PHE A 161 -15.717 -1.125 -40.714 1.00 35.12 C ATOM 1456 H PHE A 161 -11.591 1.717 -42.469 1.00 0.00 H ATOM 1457 N SER A 162 -12.962 5.409 -42.768 1.00 67.04 N ATOM 1458 CA SER A 162 -12.344 6.731 -42.736 1.00 71.67 C ATOM 1459 C SER A 162 -12.587 7.410 -41.385 1.00 65.15 C ATOM 1460 O SER A 162 -11.920 8.384 -41.052 1.00 61.35 O ATOM 1461 CB SER A 162 -12.856 7.609 -43.888 1.00 74.46 C ATOM 1462 OG SER A 162 -14.260 7.777 -43.829 1.00 71.17 O ATOM 1463 HG SER A 162 -14.555 8.346 -44.583 1.00 0.00 H ATOM 1464 H SER A 162 -13.766 5.227 -43.402 1.00 0.00 H ATOM 1465 N SER A 163 -13.531 6.880 -40.608 1.00 69.79 N ATOM 1466 CA SER A 163 -13.849 7.414 -39.283 1.00 83.34 C ATOM 1467 C SER A 163 -12.871 6.939 -38.206 1.00 87.57 C ATOM 1468 O SER A 163 -13.031 7.268 -37.030 1.00 89.16 O ATOM 1469 CB SER A 163 -15.277 7.027 -38.883 1.00 77.88 C ATOM 1470 OG SER A 163 -15.520 5.652 -39.126 1.00 67.75 O ATOM 1471 HG SER A 163 -16.447 5.430 -38.859 1.00 0.00 H ATOM 1472 H SER A 163 -14.062 6.056 -40.956 1.00 0.00 H ATOM 1473 N VAL A 164 -11.869 6.163 -38.611 1.00 85.02 N ATOM 1474 CA VAL A 164 -10.836 5.681 -37.698 1.00 84.34 C ATOM 1475 C VAL A 164 -9.500 6.252 -38.137 1.00 80.51 C ATOM 1476 O VAL A 164 -8.995 5.922 -39.210 1.00 76.68 O ATOM 1477 CB VAL A 164 -10.759 4.141 -37.686 1.00 77.55 C ATOM 1478 CG1 VAL A 164 -9.579 3.650 -36.827 1.00 74.56 C ATOM 1479 CG2 VAL A 164 -12.087 3.553 -37.212 1.00 50.76 C ATOM 1480 H VAL A 164 -11.820 5.890 -39.613 1.00 0.00 H ATOM 1481 N SER A 165 -8.933 7.107 -37.295 1.00 72.90 N ATOM 1482 CA SER A 165 -7.691 7.791 -37.618 1.00 69.93 C ATOM 1483 C SER A 165 -6.566 6.800 -37.867 1.00 65.74 C ATOM 1484 O SER A 165 -6.610 5.663 -37.394 1.00 60.76 O ATOM 1485 CB SER A 165 -7.288 8.715 -36.473 1.00 63.38 C ATOM 1486 OG SER A 165 -6.805 7.963 -35.380 1.00 63.09 O ATOM 1487 HG SER A 165 -7.514 7.348 -35.065 1.00 0.00 H ATOM 1488 H SER A 165 -9.389 7.293 -36.379 1.00 0.00 H ATOM 1489 N LYS A 166 -5.550 7.254 -38.595 1.00 66.82 N ATOM 1490 CA LYS A 166 -4.346 6.459 -38.815 1.00 71.43 C ATOM 1491 C LYS A 166 -3.766 6.053 -37.467 1.00 67.34 C ATOM 1492 O LYS A 166 -3.252 4.944 -37.306 1.00 61.12 O ATOM 1493 CB LYS A 166 -3.303 7.249 -39.615 1.00 77.45 C ATOM 1494 CG LYS A 166 -3.879 8.141 -40.715 1.00 83.43 C ATOM 1495 CD LYS A 166 -4.804 7.375 -41.653 1.00 89.15 C ATOM 1496 CE LYS A 166 -5.643 8.314 -42.499 1.00 97.02 C ATOM 1497 NZ LYS A 166 -4.803 9.280 -43.256 1.00106.01 N ATOM 1498 HZ1 LYS A 166 -4.247 9.852 -42.588 1.00 0.00 H ATOM 1499 HZ2 LYS A 166 -4.161 8.759 -43.887 1.00 0.00 H ATOM 1500 HZ3 LYS A 166 -5.416 9.902 -43.821 1.00 0.00 H ATOM 1501 H LYS A 166 -5.615 8.201 -39.019 1.00 0.00 H ATOM 1502 N SER A 167 -3.860 6.963 -36.500 1.00 74.75 N ATOM 1503 CA SER A 167 -3.370 6.720 -35.152 1.00 73.73 C ATOM 1504 C SER A 167 -4.152 5.600 -34.491 1.00 63.87 C ATOM 1505 O SER A 167 -3.571 4.642 -33.975 1.00 58.10 O ATOM 1506 CB SER A 167 -3.485 7.992 -34.305 1.00 83.59 C ATOM 1507 OG SER A 167 -3.121 7.747 -32.956 1.00 82.52 O ATOM 1508 HG SER A 167 -3.205 8.585 -32.435 1.00 0.00 H ATOM 1509 H SER A 167 -4.299 7.881 -36.716 1.00 0.00 H ATOM 1510 N GLU A 168 -5.473 5.739 -34.493 1.00 62.68 N ATOM 1511 CA GLU A 168 -6.345 4.724 -33.925 1.00 58.96 C ATOM 1512 C GLU A 168 -6.162 3.405 -34.663 1.00 65.79 C ATOM 1513 O GLU A 168 -6.151 2.345 -34.053 1.00 55.58 O ATOM 1514 CB GLU A 168 -7.802 5.182 -33.994 1.00 58.47 C ATOM 1515 CG GLU A 168 -8.121 6.319 -33.034 1.00 59.77 C ATOM 1516 CD GLU A 168 -9.453 6.984 -33.310 1.00 75.87 C ATOM 1517 OE1 GLU A 168 -9.905 6.970 -34.478 1.00 68.47 O ATOM 1518 OE2 GLU A 168 -10.045 7.524 -32.351 1.00 64.77 O ATOM 1519 H GLU A 168 -5.893 6.594 -34.911 1.00 0.00 H ATOM 1520 N ARG A 169 -6.018 3.471 -35.982 1.00 58.43 N ATOM 1521 CA ARG A 169 -5.768 2.270 -36.762 1.00 76.38 C ATOM 1522 C ARG A 169 -4.501 1.581 -36.255 1.00 82.17 C ATOM 1523 O ARG A 169 -4.460 0.364 -36.092 1.00 54.76 O ATOM 1524 CB ARG A 169 -5.636 2.624 -38.243 1.00 72.00 C ATOM 1525 CG ARG A 169 -5.435 1.434 -39.150 1.00 74.97 C ATOM 1526 CD ARG A 169 -4.776 1.864 -40.448 1.00 84.53 C ATOM 1527 NE ARG A 169 -5.493 2.967 -41.079 1.00 90.45 N ATOM 1528 CZ ARG A 169 -5.001 3.709 -42.064 1.00 99.83 C ATOM 1529 NH1 ARG A 169 -3.784 3.474 -42.533 1.00101.61 N ATOM 1530 NH2 ARG A 169 -5.728 4.690 -42.580 1.00105.76 N ATOM 1531 HE ARG A 169 -6.450 3.186 -40.736 1.00 0.00 H ATOM 1532 HH12 ARG A 169 -3.402 4.058 -43.305 1.00 0.00 H ATOM 1533 HH11 ARG A 169 -3.211 2.706 -42.129 1.00 0.00 H ATOM 1534 HH22 ARG A 169 -5.344 5.272 -43.352 1.00 0.00 H ATOM 1535 HH21 ARG A 169 -6.683 4.878 -42.213 1.00 0.00 H ATOM 1536 H ARG A 169 -6.085 4.391 -36.462 1.00 0.00 H ATOM 1537 N ALA A 170 -3.465 2.362 -35.978 1.00 56.50 N ATOM 1538 CA ALA A 170 -2.217 1.785 -35.513 1.00 56.72 C ATOM 1539 C ALA A 170 -2.417 1.113 -34.153 1.00 55.95 C ATOM 1540 O ALA A 170 -1.893 0.026 -33.896 1.00 55.69 O ATOM 1541 CB ALA A 170 -1.154 2.852 -35.450 1.00 57.84 C ATOM 1542 H ALA A 170 -3.547 3.392 -36.095 1.00 0.00 H ATOM 1543 N HIS A 171 -3.187 1.752 -33.281 1.00 56.99 N ATOM 1544 CA HIS A 171 -3.456 1.173 -31.974 1.00 63.09 C ATOM 1545 C HIS A 171 -4.262 -0.111 -32.120 1.00 62.96 C ATOM 1546 O HIS A 171 -3.965 -1.114 -31.466 1.00 54.61 O ATOM 1547 CB HIS A 171 -4.190 2.159 -31.065 1.00 68.79 C ATOM 1548 CG HIS A 171 -4.428 1.634 -29.682 1.00 56.85 C ATOM 1549 ND1 HIS A 171 -5.684 1.551 -29.123 1.00 57.96 N ATOM 1550 CD2 HIS A 171 -3.571 1.146 -28.755 1.00 57.50 C ATOM 1551 CE1 HIS A 171 -5.590 1.046 -27.905 1.00 58.25 C ATOM 1552 NE2 HIS A 171 -4.317 0.792 -27.658 1.00 57.56 N ATOM 1553 H HIS A 171 -3.601 2.672 -33.534 1.00 0.00 H ATOM 1554 N ILE A 172 -5.269 -0.089 -32.988 1.00 54.21 N ATOM 1555 CA ILE A 172 -6.082 -1.271 -33.204 1.00 53.28 C ATOM 1556 C ILE A 172 -5.226 -2.407 -33.742 1.00 52.98 C ATOM 1557 O ILE A 172 -5.319 -3.538 -33.276 1.00 52.63 O ATOM 1558 CB ILE A 172 -7.250 -0.967 -34.165 1.00 53.00 C ATOM 1559 CG1 ILE A 172 -8.302 -0.136 -33.437 1.00 53.50 C ATOM 1560 CG2 ILE A 172 -7.872 -2.246 -34.718 1.00 54.64 C ATOM 1561 CD1 ILE A 172 -9.196 0.645 -34.358 1.00 53.94 C ATOM 1562 H ILE A 172 -5.476 0.783 -33.516 1.00 0.00 H ATOM 1563 N LEU A 173 -4.400 -2.103 -34.732 1.00 53.41 N ATOM 1564 CA LEU A 173 -3.667 -3.140 -35.441 1.00 53.48 C ATOM 1565 C LEU A 173 -2.483 -3.634 -34.620 1.00 60.96 C ATOM 1566 O LEU A 173 -1.997 -4.746 -34.828 1.00 55.00 O ATOM 1567 CB LEU A 173 -3.199 -2.621 -36.796 1.00 54.14 C ATOM 1568 CG LEU A 173 -4.306 -2.324 -37.812 1.00 53.88 C ATOM 1569 CD1 LEU A 173 -3.725 -1.674 -39.049 1.00 55.02 C ATOM 1570 CD2 LEU A 173 -5.033 -3.595 -38.209 1.00 53.63 C ATOM 1571 H LEU A 173 -4.274 -1.108 -35.006 1.00 0.00 H ATOM 1572 N GLN A 174 -2.016 -2.801 -33.696 1.00 68.95 N ATOM 1573 CA GLN A 174 -0.988 -3.216 -32.753 1.00 64.02 C ATOM 1574 C GLN A 174 -1.415 -4.513 -32.079 1.00 61.88 C ATOM 1575 O GLN A 174 -0.687 -5.502 -32.096 1.00 55.86 O ATOM 1576 CB GLN A 174 -0.757 -2.121 -31.705 1.00 62.90 C ATOM 1577 CG GLN A 174 0.156 -2.518 -30.538 1.00 79.16 C ATOM 1578 CD GLN A 174 -0.211 -1.832 -29.231 1.00 97.92 C ATOM 1579 OE1 GLN A 174 -1.114 -0.996 -29.179 1.00 95.04 O ATOM 1580 NE2 GLN A 174 0.492 -2.191 -28.163 1.00113.77 N ATOM 1581 HE22 GLN A 174 1.246 -2.901 -28.252 1.00 0.00 H ATOM 1582 HE21 GLN A 174 0.288 -1.762 -27.238 1.00 0.00 H ATOM 1583 H GLN A 174 -2.393 -1.833 -33.646 1.00 0.00 H ATOM 1584 N HIS A 175 -2.607 -4.527 -31.501 1.00 70.15 N ATOM 1585 CA HIS A 175 -3.043 -5.688 -30.738 1.00 74.28 C ATOM 1586 C HIS A 175 -3.532 -6.818 -31.630 1.00 77.19 C ATOM 1587 O HIS A 175 -3.429 -7.986 -31.268 1.00 88.67 O ATOM 1588 CB HIS A 175 -4.110 -5.292 -29.722 1.00 73.10 C ATOM 1589 CG HIS A 175 -3.557 -4.571 -28.534 1.00 66.76 C ATOM 1590 ND1 HIS A 175 -3.524 -3.197 -28.447 1.00 60.89 N ATOM 1591 CD2 HIS A 175 -2.989 -5.035 -27.395 1.00 67.21 C ATOM 1592 CE1 HIS A 175 -2.971 -2.844 -27.300 1.00 57.33 C ATOM 1593 NE2 HIS A 175 -2.638 -3.940 -26.644 1.00 63.61 N ATOM 1594 H HIS A 175 -3.235 -3.703 -31.593 1.00 0.00 H ATOM 1595 N VAL A 176 -4.059 -6.478 -32.800 1.00 74.08 N ATOM 1596 CA VAL A 176 -4.483 -7.507 -33.742 1.00 69.78 C ATOM 1597 C VAL A 176 -3.288 -8.393 -34.081 1.00 74.09 C ATOM 1598 O VAL A 176 -3.438 -9.580 -34.349 1.00 65.17 O ATOM 1599 CB VAL A 176 -5.063 -6.901 -35.042 1.00 56.99 C ATOM 1600 CG1 VAL A 176 -5.245 -7.968 -36.102 1.00 55.15 C ATOM 1601 CG2 VAL A 176 -6.388 -6.216 -34.771 1.00 53.58 C ATOM 1602 H VAL A 176 -4.170 -5.474 -33.046 1.00 0.00 H ATOM 1603 N SER A 177 -2.097 -7.810 -34.059 1.00 89.77 N ATOM 1604 CA SER A 177 -0.889 -8.547 -34.395 1.00103.15 C ATOM 1605 C SER A 177 -0.284 -9.244 -33.176 1.00 94.21 C ATOM 1606 O SER A 177 0.337 -10.298 -33.307 1.00 85.03 O ATOM 1607 CB SER A 177 0.135 -7.606 -35.019 1.00119.81 C ATOM 1608 OG SER A 177 -0.427 -6.901 -36.113 1.00124.22 O ATOM 1609 HG SER A 177 -1.200 -6.368 -35.799 1.00 0.00 H ATOM 1610 H SER A 177 -2.025 -6.806 -33.796 1.00 0.00 H ATOM 1611 N SER A 178 -0.466 -8.660 -31.995 1.00 96.87 N ATOM 1612 CA SER A 178 0.105 -9.229 -30.775 1.00102.66 C ATOM 1613 C SER A 178 -0.587 -10.544 -30.429 1.00 97.36 C ATOM 1614 O SER A 178 0.059 -11.590 -30.330 1.00 95.47 O ATOM 1615 CB SER A 178 -0.013 -8.253 -29.601 1.00107.87 C ATOM 1616 OG SER A 178 -1.252 -8.401 -28.930 1.00108.05 O ATOM 1617 HG SER A 178 -1.992 -8.223 -29.563 1.00 0.00 H ATOM 1618 H SER A 178 -1.024 -7.784 -31.938 1.00 0.00 H ATOM 1619 N CYS A 179 -1.903 -10.492 -30.255 1.00106.94 N ATOM 1620 CA CYS A 179 -2.659 -11.689 -29.925 1.00106.82 C ATOM 1621 C CYS A 179 -2.811 -12.585 -31.153 1.00105.91 C ATOM 1622 O CYS A 179 -3.533 -12.254 -32.098 1.00 99.37 O ATOM 1623 CB CYS A 179 -4.023 -11.333 -29.312 1.00101.69 C ATOM 1624 SG CYS A 179 -5.110 -10.264 -30.298 1.00 78.44 S ATOM 1625 H CYS A 179 -2.399 -9.583 -30.356 1.00 0.00 H ATOM 1626 N ARG A 180 -2.137 -13.733 -31.112 1.00108.71 N ATOM 1627 CA ARG A 180 -2.161 -14.697 -32.209 1.00102.33 C ATOM 1628 C ARG A 180 -3.409 -15.567 -32.194 1.00 85.81 C ATOM 1629 O ARG A 180 -4.097 -15.669 -31.182 1.00 59.43 O ATOM 1630 CB ARG A 180 -0.924 -15.590 -32.162 1.00103.92 C ATOM 1631 CG ARG A 180 -0.016 -15.447 -33.375 1.00106.18 C ATOM 1632 CD ARG A 180 -0.543 -16.204 -34.599 1.00102.92 C ATOM 1633 NE ARG A 180 -1.587 -15.487 -35.330 1.00100.06 N ATOM 1634 CZ ARG A 180 -1.370 -14.453 -36.137 1.00103.57 C ATOM 1635 NH1 ARG A 180 -0.141 -13.983 -36.320 1.00113.26 N ATOM 1636 NH2 ARG A 180 -2.394 -13.883 -36.756 1.00 97.75 N ATOM 1637 HE ARG A 180 -2.569 -15.809 -35.210 1.00 0.00 H ATOM 1638 HH12 ARG A 180 0.017 -13.174 -36.954 1.00 0.00 H ATOM 1639 HH11 ARG A 180 0.663 -14.424 -35.830 1.00 0.00 H ATOM 1640 HH22 ARG A 180 -2.234 -13.074 -37.389 1.00 0.00 H ATOM 1641 HH21 ARG A 180 -3.358 -14.245 -36.609 1.00 0.00 H ATOM 1642 H ARG A 180 -1.572 -13.951 -30.267 1.00 0.00 H ATOM 1643 N LEU A 181 -3.635 -16.240 -33.317 1.00 89.18 N ATOM 1644 CA LEU A 181 -4.877 -16.926 -33.622 1.00 83.55 C ATOM 1645 C LEU A 181 -4.684 -18.417 -33.642 1.00 69.93 C ATOM 1646 O LEU A 181 -5.541 -19.166 -33.189 1.00 48.21 O ATOM 1647 CB LEU A 181 -5.342 -16.547 -35.026 1.00 82.11 C ATOM 1648 CG LEU A 181 -6.077 -15.232 -35.199 1.00 74.89 C ATOM 1649 CD1 LEU A 181 -6.198 -14.901 -36.678 1.00 70.72 C ATOM 1650 CD2 LEU A 181 -7.434 -15.353 -34.543 1.00 65.55 C ATOM 1651 H LEU A 181 -2.872 -16.278 -34.023 1.00 0.00 H ATOM 1652 N GLU A 182 -3.560 -18.838 -34.210 1.00 67.67 N ATOM 1653 CA GLU A 182 -3.279 -20.247 -34.460 1.00 70.21 C ATOM 1654 C GLU A 182 -3.543 -21.119 -33.242 1.00 56.11 C ATOM 1655 O GLU A 182 -4.046 -22.235 -33.363 1.00 52.56 O ATOM 1656 CB GLU A 182 -1.819 -20.413 -34.893 1.00 81.75 C ATOM 1657 CG GLU A 182 -1.432 -21.837 -35.267 1.00 80.62 C ATOM 1658 CD GLU A 182 0.054 -21.987 -35.543 1.00 80.42 C ATOM 1659 OE1 GLU A 182 0.873 -21.600 -34.678 1.00 77.72 O ATOM 1660 OE2 GLU A 182 0.401 -22.496 -36.628 1.00 84.44 O ATOM 1661 H GLU A 182 -2.849 -18.132 -34.489 1.00 0.00 H ATOM 1662 N ASP A 183 -3.185 -20.598 -32.068 1.00 46.51 N ATOM 1663 CA ASP A 183 -3.316 -21.342 -30.815 1.00 49.15 C ATOM 1664 C ASP A 183 -4.743 -21.393 -30.244 1.00 43.22 C ATOM 1665 O ASP A 183 -5.021 -22.172 -29.339 1.00 47.30 O ATOM 1666 CB ASP A 183 -2.397 -20.740 -29.746 1.00 69.69 C ATOM 1667 CG ASP A 183 -0.920 -20.876 -30.088 1.00 82.38 C ATOM 1668 OD1 ASP A 183 -0.594 -21.207 -31.249 1.00 74.28 O ATOM 1669 OD2 ASP A 183 -0.085 -20.636 -29.188 1.00 86.74 O ATOM 1670 H ASP A 183 -2.800 -19.632 -32.042 1.00 0.00 H ATOM 1671 N LEU A 184 -5.647 -20.575 -30.760 1.00 39.31 N ATOM 1672 CA LEU A 184 -7.004 -20.571 -30.215 1.00 39.65 C ATOM 1673 C LEU A 184 -7.779 -21.829 -30.604 1.00 39.91 C ATOM 1674 O LEU A 184 -7.552 -22.438 -31.653 1.00 36.70 O ATOM 1675 CB LEU A 184 -7.759 -19.301 -30.624 1.00 36.88 C ATOM 1676 CG LEU A 184 -7.134 -18.005 -30.078 1.00 38.61 C ATOM 1677 CD1 LEU A 184 -7.958 -16.785 -30.463 1.00 39.57 C ATOM 1678 CD2 LEU A 184 -6.919 -18.044 -28.546 1.00 47.73 C ATOM 1679 H LEU A 184 -5.395 -19.941 -31.545 1.00 0.00 H ATOM 1680 N SER A 185 -8.713 -22.210 -29.750 1.00 30.94 N ATOM 1681 CA SER A 185 -9.440 -23.440 -29.942 1.00 28.73 C ATOM 1682 C SER A 185 -10.371 -23.298 -31.143 1.00 28.00 C ATOM 1683 O SER A 185 -10.789 -22.206 -31.500 1.00 26.59 O ATOM 1684 CB SER A 185 -10.197 -23.817 -28.653 1.00 33.76 C ATOM 1685 OG SER A 185 -9.279 -24.224 -27.645 1.00 34.19 O ATOM 1686 HG SER A 185 -8.768 -25.010 -27.963 1.00 0.00 H ATOM 1687 H SER A 185 -8.927 -21.613 -28.926 1.00 0.00 H ATOM 1688 N THR A 186 -10.755 -24.421 -31.730 1.00 24.59 N ATOM 1689 CA THR A 186 -11.639 -24.385 -32.887 1.00 24.52 C ATOM 1690 C THR A 186 -13.045 -23.987 -32.457 1.00 19.95 C ATOM 1691 O THR A 186 -13.598 -24.551 -31.502 1.00 22.52 O ATOM 1692 CB THR A 186 -11.647 -25.746 -33.527 1.00 26.16 C ATOM 1693 OG1 THR A 186 -10.314 -26.099 -33.891 1.00 30.03 O ATOM 1694 CG2 THR A 186 -12.518 -25.728 -34.768 1.00 24.08 C ATOM 1695 HG1 THR A 186 -9.745 -26.115 -33.081 1.00 0.00 H ATOM 1696 H THR A 186 -10.423 -25.335 -31.362 1.00 0.00 H ATOM 1697 N PRO A 187 -13.656 -22.986 -33.131 1.00 21.10 N ATOM 1698 CA PRO A 187 -15.003 -22.569 -32.778 1.00 21.16 C ATOM 1699 C PRO A 187 -16.014 -23.704 -32.995 1.00 17.70 C ATOM 1700 O PRO A 187 -15.728 -24.610 -33.786 1.00 20.97 O ATOM 1701 CB PRO A 187 -15.289 -21.419 -33.769 1.00 21.34 C ATOM 1702 CG PRO A 187 -13.984 -20.916 -34.140 1.00 20.51 C ATOM 1703 CD PRO A 187 -13.083 -22.111 -34.174 1.00 20.61 C ATOM 1704 N ASN A 188 -17.163 -23.682 -32.320 1.00 18.40 N ATOM 1705 CA ASN A 188 -18.070 -24.827 -32.337 1.00 18.66 C ATOM 1706 C ASN A 188 -19.003 -24.997 -33.565 1.00 19.55 C ATOM 1707 O ASN A 188 -19.703 -26.004 -33.637 1.00 20.55 O ATOM 1708 CB ASN A 188 -18.866 -24.898 -31.036 1.00 20.01 C ATOM 1709 CG ASN A 188 -19.898 -23.806 -30.904 1.00 21.85 C ATOM 1710 OD1 ASN A 188 -20.305 -23.200 -31.899 1.00 21.28 O ATOM 1711 ND2 ASN A 188 -20.360 -23.563 -29.667 1.00 24.27 N ATOM 1712 HD22 ASN A 188 -19.987 -24.099 -28.858 1.00 0.00 H ATOM 1713 HD21 ASN A 188 -21.091 -22.838 -29.518 1.00 0.00 H ATOM 1714 H ASN A 188 -17.418 -22.836 -31.772 1.00 0.00 H ATOM 1715 N PHE A 189 -18.995 -24.064 -34.512 1.00 20.35 N ATOM 1716 CA PHE A 189 -19.950 -24.142 -35.634 1.00 20.13 C ATOM 1717 C PHE A 189 -19.857 -25.498 -36.349 1.00 19.43 C ATOM 1718 O PHE A 189 -18.768 -26.001 -36.649 1.00 20.95 O ATOM 1719 CB PHE A 189 -19.709 -23.030 -36.626 1.00 18.95 C ATOM 1720 CG PHE A 189 -20.610 -23.078 -37.842 1.00 18.30 C ATOM 1721 CD1 PHE A 189 -21.848 -22.481 -37.796 1.00 22.30 C ATOM 1722 CD2 PHE A 189 -20.219 -23.699 -39.019 1.00 19.14 C ATOM 1723 CE1 PHE A 189 -22.698 -22.508 -38.894 1.00 22.13 C ATOM 1724 CE2 PHE A 189 -21.050 -23.702 -40.128 1.00 20.63 C ATOM 1725 CZ PHE A 189 -22.279 -23.112 -40.065 1.00 21.24 C ATOM 1726 H PHE A 189 -18.315 -23.279 -34.462 1.00 0.00 H ATOM 1727 N VAL A 190 -21.027 -26.077 -36.634 1.00 21.44 N ATOM 1728 CA VAL A 190 -21.122 -27.302 -37.419 1.00 21.58 C ATOM 1729 C VAL A 190 -21.933 -27.049 -38.683 1.00 22.26 C ATOM 1730 O VAL A 190 -23.039 -26.503 -38.640 1.00 23.38 O ATOM 1731 CB VAL A 190 -21.772 -28.488 -36.640 1.00 27.35 C ATOM 1732 CG1 VAL A 190 -21.079 -28.724 -35.310 1.00 23.32 C ATOM 1733 CG2 VAL A 190 -23.247 -28.309 -36.417 1.00 44.19 C ATOM 1734 H VAL A 190 -21.902 -25.638 -36.283 1.00 0.00 H ATOM 1735 N SER A 191 -21.383 -27.401 -39.842 1.00 22.58 N ATOM 1736 CA SER A 191 -22.107 -27.187 -41.072 1.00 23.68 C ATOM 1737 C SER A 191 -23.317 -28.107 -41.119 1.00 26.08 C ATOM 1738 O SER A 191 -23.178 -29.310 -40.880 1.00 28.15 O ATOM 1739 CB SER A 191 -21.215 -27.451 -42.284 1.00 23.62 C ATOM 1740 OG SER A 191 -21.962 -27.367 -43.477 1.00 26.57 O ATOM 1741 HG SER A 191 -21.368 -27.541 -44.250 1.00 0.00 H ATOM 1742 H SER A 191 -20.435 -27.829 -39.862 1.00 0.00 H ATOM 1743 N PRO A 192 -24.511 -27.557 -41.451 1.00 25.34 N ATOM 1744 CA PRO A 192 -25.717 -28.373 -41.544 1.00 30.11 C ATOM 1745 C PRO A 192 -25.772 -29.178 -42.844 1.00 32.48 C ATOM 1746 O PRO A 192 -26.688 -29.981 -43.016 1.00 42.14 O ATOM 1747 CB PRO A 192 -26.828 -27.323 -41.527 1.00 29.63 C ATOM 1748 CG PRO A 192 -26.217 -26.131 -42.167 1.00 27.77 C ATOM 1749 CD PRO A 192 -24.804 -26.132 -41.647 1.00 23.19 C ATOM 1750 N LEU A 193 -24.809 -28.950 -43.739 1.00 32.47 N ATOM 1751 CA LEU A 193 -24.706 -29.677 -45.006 1.00 51.69 C ATOM 1752 C LEU A 193 -23.835 -30.927 -44.898 1.00 71.53 C ATOM 1753 O LEU A 193 -23.211 -31.179 -43.868 1.00 78.29 O ATOM 1754 CB LEU A 193 -24.145 -28.759 -46.099 1.00 39.94 C ATOM 1755 CG LEU A 193 -25.185 -27.920 -46.844 1.00 49.19 C ATOM 1756 CD1 LEU A 193 -25.910 -26.975 -45.907 1.00 48.19 C ATOM 1757 CD2 LEU A 193 -24.535 -27.153 -47.986 1.00 48.85 C ATOM 1758 H LEU A 193 -24.098 -28.221 -43.527 1.00 0.00 H TER 1759 LEU A 193 HETATM 1760 O HOH 1 -21.764 1.861 -42.076 1.00 38.98 O HETATM 1761 O HOH 2 -28.702 -23.082 -34.775 1.00 52.24 O HETATM 1762 O HOH 3 -35.303 -2.467 -23.084 1.00 47.09 O HETATM 1763 O HOH 4 -14.087 2.638 -47.672 1.00 67.71 O HETATM 1764 O HOH 5 -12.028 -14.083 -56.482 1.00 16.13 O HETATM 1765 O HOH 6 -26.913 -5.445 -45.741 1.00 29.69 O HETATM 1766 O HOH 7 -31.216 -7.861 -55.643 1.00 42.85 O HETATM 1767 O HOH 8 -31.289 2.236 -29.509 1.00 44.90 O HETATM 1768 O HOH 9 -30.706 -8.089 -42.978 1.00 25.37 O HETATM 1769 O HOH 10 -11.780 -14.494 -53.613 1.00 39.85 O HETATM 1770 O HOH 11 -19.743 -6.287 -59.000 1.00 50.02 O HETATM 1771 O HOH 12 -18.898 -13.393 -58.543 1.00 24.45 O HETATM 1772 O HOH 13 -12.620 -18.748 -49.137 1.00 49.03 O HETATM 1773 O HOH 14 -27.601 -2.931 -41.508 1.00 33.53 O HETATM 1774 O HOH 15 -21.866 -6.465 -50.609 1.00 37.54 O HETATM 1775 O HOH 16 -29.336 -14.654 -57.689 1.00 31.95 O HETATM 1776 O HOH 17 -25.687 -23.994 -53.642 1.00 19.50 O HETATM 1777 O HOH 18 -24.642 -11.216 -57.077 1.00 22.48 O HETATM 1778 O HOH 19 -29.543 -10.432 -43.730 1.00 22.81 O HETATM 1779 O HOH 20 -23.506 -24.791 -35.798 1.00 24.05 O HETATM 1780 O HOH 21 -32.517 -4.119 -38.054 1.00 34.75 O HETATM 1781 O HOH 22 -15.785 -24.384 -50.061 1.00 27.45 O HETATM 1782 O HOH 23 -29.339 -29.086 -45.999 1.00 46.81 O HETATM 1783 O HOH 24 -27.948 2.695 -38.528 1.00 44.75 O HETATM 1784 O HOH 25 -16.141 -6.681 -57.445 1.00 40.38 O HETATM 1785 O HOH 26 -29.450 2.704 -22.661 1.00 53.75 O HETATM 1786 O HOH 27 -25.659 -14.783 -59.011 1.00 23.58 O HETATM 1787 O HOH 28 -32.858 -0.878 -26.405 1.00 38.88 O HETATM 1788 O HOH 29 -28.641 -30.958 -41.047 1.00 50.73 O HETATM 1789 O HOH 30 -28.733 0.644 -39.131 1.00 43.38 O HETATM 1790 O HOH 31 -34.274 -2.906 -27.977 1.00 52.32 O HETATM 1791 O HOH 32 -23.217 -5.712 -53.033 1.00 31.49 O HETATM 1792 O HOH 33 -25.814 -5.387 -59.615 1.00 39.58 O HETATM 1793 O HOH 34 -28.706 -5.436 -50.411 1.00 35.36 O HETATM 1794 O HOH 35 -22.973 -26.241 -53.984 1.00 35.07 O HETATM 1795 O HOH 36 -31.960 -15.943 -30.575 1.00 49.01 O HETATM 1796 O HOH 37 -24.439 -4.530 -49.168 1.00 50.70 O HETATM 1797 O HOH 38 -28.229 -12.172 -60.990 1.00 31.48 O HETATM 1798 O HOH 39 -33.406 -4.599 -32.193 1.00 54.08 O HETATM 1799 O HOH 40 -27.702 -12.704 -58.219 1.00 36.38 O HETATM 1800 O HOH 41 -23.318 4.210 -38.082 1.00 60.99 O HETATM 1801 O HOH 42 -29.152 -4.618 -39.532 1.00 44.47 O HETATM 1802 O HOH 43 -27.717 -16.453 -60.030 1.00 42.42 O HETATM 1803 O HOH 44 -23.400 -2.631 -50.103 1.00 59.72 O HETATM 1804 O HOH 45 -32.575 -8.300 -33.296 1.00 36.62 O HETATM 1805 O HOH 46 -9.820 -12.277 -56.175 1.00 50.33 O HETATM 1806 O HOH 47 -31.954 -29.938 -45.392 1.00 47.56 O HETATM 1807 O HOH 48 -34.560 0.000 -24.452 1.00 46.15 O HETATM 1808 O HOH 49 -16.301 -24.904 -36.463 1.00 19.05 O HETATM 1809 O HOH 50 -20.675 -19.988 -27.746 1.00 21.53 O HETATM 1810 O HOH 51 -14.708 -26.406 -38.278 1.00 23.97 O HETATM 1811 O HOH 52 -16.947 -13.385 -20.869 1.00 23.29 O HETATM 1812 O HOH 53 -23.592 -16.226 -28.663 1.00 22.63 O HETATM 1813 O HOH 54 -22.815 -12.751 -17.856 1.00 34.25 O HETATM 1814 O HOH 55 -15.558 -19.084 -30.897 1.00 23.67 O HETATM 1815 O HOH 56 -30.105 -9.384 -33.947 1.00 25.75 O HETATM 1816 O HOH 57 -24.176 -4.333 -46.451 1.00 31.27 O HETATM 1817 O HOH 58 -19.139 -29.228 -39.823 1.00 27.49 O HETATM 1818 O HOH 59 -22.285 -26.014 -32.630 1.00 26.92 O HETATM 1819 O HOH 60 -20.229 -12.024 -18.304 1.00 22.33 O HETATM 1820 O HOH 61 -11.059 -9.079 -27.809 1.00 28.10 O HETATM 1821 O HOH 62 -6.558 -22.610 -27.460 1.00 23.67 O HETATM 1822 O HOH 63 -22.341 -3.024 -36.469 1.00 30.39 O HETATM 1823 O HOH 64 -18.304 -27.003 -44.133 1.00 25.36 O HETATM 1824 O HOH 65 -27.570 -6.160 -38.076 1.00 31.93 O HETATM 1825 O HOH 66 -16.709 -6.761 -46.762 1.00 31.27 O HETATM 1826 O HOH 67 -28.845 -8.301 -31.853 1.00 29.86 O HETATM 1827 O HOH 68 -22.696 -15.378 -24.389 1.00 27.67 O HETATM 1828 O HOH 69 -9.804 -20.720 -33.951 1.00 27.91 O HETATM 1829 O HOH 70 -25.594 -12.787 -23.631 1.00 33.22 O HETATM 1830 O HOH 71 -16.037 -7.791 -54.650 1.00 35.97 O HETATM 1831 O HOH 72 -13.984 -15.222 -23.608 1.00 37.27 O HETATM 1832 O HOH 73 -21.548 -7.462 -11.451 1.00 37.53 O HETATM 1833 O HOH 74 -15.433 -8.819 -20.533 1.00 36.47 O HETATM 1834 O HOH 75 -20.516 -16.649 -24.950 1.00 30.95 O HETATM 1835 O HOH 76 -25.000 -3.826 -34.620 1.00 34.93 O HETATM 1836 O HOH 77 -7.238 -20.280 -34.835 1.00 36.29 O HETATM 1837 O HOH 78 -19.575 1.916 -31.771 1.00 38.83 O HETATM 1838 O HOH 79 -14.520 -7.193 -18.518 1.00 33.53 O HETATM 1839 O HOH 80 -31.088 -6.498 -20.026 1.00 39.14 O HETATM 1840 O HOH 81 -19.874 -27.373 -48.048 1.00 45.44 O HETATM 1841 O HOH 82 -25.931 -16.060 -26.857 1.00 35.09 O HETATM 1842 O HOH 83 -21.041 -17.017 -27.425 1.00 28.72 O HETATM 1843 O HOH 84 -26.433 -8.050 -16.149 1.00 39.50 O HETATM 1844 O HOH 85 -9.419 -8.523 -48.380 1.00 43.89 O HETATM 1845 O HOH 86 -24.556 0.721 -28.255 1.00 40.34 O HETATM 1846 O HOH 87 -26.953 -13.972 -25.884 1.00 37.79 O HETATM 1847 O HOH 88 -9.453 -2.663 -20.129 1.00 41.15 O HETATM 1848 O HOH 89 -26.459 -5.746 -35.310 1.00 34.99 O HETATM 1849 O HOH 90 -20.298 -6.039 -8.197 1.00 40.75 O HETATM 1850 O HOH 91 -10.360 1.240 -25.350 1.00 37.03 O HETATM 1851 O HOH 92 -30.786 -6.797 -30.812 1.00 46.01 O HETATM 1852 O HOH 93 -29.887 -16.862 -28.469 1.00 38.95 O HETATM 1853 O HOH 94 -13.108 -5.063 -18.980 1.00 44.84 O HETATM 1854 O HOH 95 -27.388 -5.744 -32.481 1.00 39.50 O HETATM 1855 O HOH 96 -26.473 1.284 -29.716 1.00 39.19 O HETATM 1856 O HOH 97 -6.893 -19.876 -37.636 1.00 46.98 O HETATM 1857 O HOH 98 -20.492 -27.874 -45.530 1.00 33.58 O HETATM 1858 O HOH 99 -17.035 -28.176 -30.749 1.00 53.47 O HETATM 1859 O HOH 100 -6.486 -22.938 -33.900 1.00 34.41 O HETATM 1860 O HOH 101 -27.523 -9.965 -57.651 1.00 11.47 O HETATM 1861 O HOH 102 -22.499 -26.788 -29.901 1.00 35.30 O HETATM 1862 O HOH 103 -2.930 -20.138 -26.458 1.00 36.79 O HETATM 1863 O HOH 104 -9.415 -17.221 -41.258 1.00 40.51 O HETATM 1864 O HOH 105 -3.028 -6.660 -41.554 1.00 47.18 O HETATM 1865 O HOH 106 -7.902 -11.824 -28.994 1.00 38.93 O HETATM 1866 O HOH 107 -32.088 -1.884 -36.351 1.00 46.09 O HETATM 1867 O HOH 108 -18.648 -27.813 -28.901 1.00 53.93 O HETATM 1868 O HOH 109 -18.799 0.091 -43.283 1.00 43.70 O HETATM 1869 O HOH 110 -11.269 3.291 -23.196 1.00 51.63 O HETATM 1870 O HOH 111 -12.505 -26.810 -30.104 1.00 41.46 O HETATM 1871 O HOH 112 -9.558 -27.010 -30.662 1.00 33.55 O HETATM 1872 O HOH 113 -17.721 -29.213 -42.419 1.00 37.16 O HETATM 1873 O HOH 114 -18.923 -28.422 -32.381 1.00 35.73 O HETATM 1874 O HOH 115 -29.536 -13.755 -25.390 1.00 40.22 O HETATM 1875 O HOH 116 -12.740 -28.043 -37.786 1.00 40.69 O HETATM 1876 O HOH 117 -13.250 -10.392 -21.091 1.00 53.87 O HETATM 1877 O HOH 118 -15.646 -27.727 -33.840 1.00 46.18 O HETATM 1878 O HOH 119 -8.947 -26.910 -27.690 1.00 38.69 O HETATM 1879 O HOH 120 -11.204 3.100 -20.840 1.00 46.84 O HETATM 1880 O HOH 121 -6.448 -10.186 -18.959 1.00 54.89 O HETATM 1881 O HOH 122 -12.558 -8.724 -17.589 1.00 47.64 O HETATM 1882 O HOH 123 -8.070 3.181 -40.800 1.00 58.19 O HETATM 1883 O HOH 124 -38.284 -10.922 -27.395 1.00 57.53 O HETATM 1884 O HOH 125 -7.817 4.619 -44.197 1.00 49.84 O HETATM 1885 O HOH 126 -7.589 -17.695 -39.708 1.00 46.88 O HETATM 1886 O HOH 127 -16.164 -28.086 -45.897 1.00 49.85 O HETATM 1887 O HOH 128 -17.500 -28.509 -37.421 1.00 38.22 O HETATM 1888 O HOH 129 -38.067 -13.032 -26.864 1.00 57.26 O HETATM 1889 O HOH 130 -11.952 -24.417 -44.462 1.00 52.44 O HETATM 1890 O HOH 131 -26.337 -9.966 -21.451 1.00 54.14 O HETATM 1891 O HOH 132 -2.300 -12.486 -34.163 1.00 61.48 O HETATM 1892 O HOH 133 -28.501 -7.549 -58.469 1.00 46.93 O HETATM 1893 O HOH 134 -5.767 -13.793 -28.552 1.00 51.79 O HETATM 1894 O HOH 135 -3.552 -17.934 -30.701 1.00 51.39 O HETATM 1895 O HOH 136 -19.787 -31.850 -39.254 1.00 45.63 O HETATM 1896 O HOH 137 -3.602 -14.790 -29.251 1.00 56.61 O HETATM 1897 O HOH 138 -8.496 -18.678 -43.230 1.00 60.87 O HETATM 1898 O HOH 139 -27.168 -11.585 -21.105 1.00 65.79 O HETATM 1899 O HOH 140 -28.283 -23.642 -28.649 1.00 55.54 O HETATM 1900 O HOH 141 -19.469 6.919 -29.890 1.00 66.17 O HETATM 1901 O HOH 142 -16.456 1.084 -44.065 1.00 54.32 O HETATM 1902 C10 UNN A 143 -29.503 -14.624 -42.307 1.00 -0.04 C HETATM 1903 C09 UNN A 143 -28.084 -14.589 -42.484 1.00 -0.03 C HETATM 1904 C08 UNN A 143 -27.328 -15.849 -42.633 1.00 0.03 C HETATM 1905 C07 UNN A 143 -25.838 -15.810 -42.787 1.00 0.00 C HETATM 1906 C03 UNN A 143 -25.310 -16.675 -43.923 1.00 -0.03 C HETATM 1907 C02 UNN A 143 -23.814 -16.815 -43.708 1.00 -0.05 C HETATM 1908 C01 UNN A 143 -23.128 -17.546 -44.838 1.00 -0.05 C HETATM 1909 C06 UNN A 143 -23.494 -17.014 -46.203 1.00 -0.05 C HETATM 1910 C05 UNN A 143 -24.989 -16.830 -46.392 1.00 -0.05 C HETATM 1911 C04 UNN A 143 -25.601 -16.050 -45.242 1.00 -0.05 C HETATM 1912 H UNN A 143 -25.192 -15.029 -45.249 1.00 0.03 H HETATM 1913 H UNN A 143 -26.691 -16.009 -45.382 1.00 0.03 H HETATM 1914 H UNN A 143 -25.166 -16.283 -47.330 1.00 0.03 H HETATM 1915 H UNN A 143 -25.467 -17.819 -46.448 1.00 0.03 H HETATM 1916 H UNN A 143 -23.130 -17.721 -46.963 1.00 0.03 H HETATM 1917 H UNN A 143 -23.002 -16.040 -46.342 1.00 0.03 H HETATM 1918 H UNN A 143 -23.411 -18.608 -44.790 1.00 0.03 H HETATM 1919 H UNN A 143 -22.040 -17.450 -44.706 1.00 0.03 H HETATM 1920 H UNN A 143 -23.375 -15.810 -43.622 1.00 0.03 H HETATM 1921 H UNN A 143 -23.643 -17.371 -42.774 1.00 0.03 H HETATM 1922 H UNN A 143 -25.785 -17.667 -43.886 1.00 0.03 H HETATM 1923 H UNN A 143 -25.537 -14.769 -42.976 1.00 0.05 H HETATM 1924 H UNN A 143 -25.384 -16.158 -41.847 1.00 0.05 H HETATM 1925 N13 UNN A 143 -27.982 -17.103 -42.648 1.00 -0.28 N HETATM 1926 C12 UNN A 143 -29.407 -17.134 -42.498 1.00 0.12 C HETATM 1927 C11 UNN A 143 -30.186 -15.894 -42.316 1.00 -0.02 C HETATM 1928 H UNN A 143 -31.262 -15.937 -42.190 1.00 0.07 H HETATM 1929 C14 UNN A 143 -30.012 -18.466 -42.502 1.00 0.25 C HETATM 1930 O15 UNN A 143 -31.201 -18.650 -42.230 1.00 -0.37 O HETATM 1931 N16 UNN A 143 -29.094 -19.400 -42.889 1.00 -0.23 N HETATM 1932 C17 UNN A 143 -29.281 -20.764 -42.954 1.00 0.08 C HETATM 1933 C18 UNN A 143 -28.227 -21.617 -43.516 1.00 -0.00 C HETATM 1934 C22 UNN A 143 -28.363 -23.078 -43.570 1.00 -0.05 C HETATM 1935 C21 UNN A 143 -29.542 -23.722 -42.992 1.00 0.02 C HETATM 1936 C20 UNN A 143 -30.589 -22.892 -42.413 1.00 -0.06 C HETATM 1937 C19 UNN A 143 -30.471 -21.422 -42.389 1.00 -0.04 C HETATM 1938 H UNN A 143 -31.263 -20.824 -41.954 1.00 0.05 H HETATM 1939 H UNN A 143 -31.470 -23.363 -41.992 1.00 0.06 H HETATM 1940 C30 UNN A 143 -29.657 -25.191 -43.130 1.00 0.17 C HETATM 1941 N31 UNN A 143 -30.417 -25.966 -42.349 1.00 -0.16 N HETATM 1942 N34 UNN A 143 -30.228 -27.186 -42.851 1.00 -0.07 N HETATM 1943 N33 UNN A 143 -29.389 -27.145 -43.877 1.00 -0.14 N HETATM 1944 N32 UNN A 143 -29.019 -25.867 -44.052 1.00 -0.22 N HETATM 1945 H UNN A 143 -31.006 -25.687 -41.552 1.00 0.27 H HETATM 1946 H UNN A 143 -27.591 -23.678 -44.038 1.00 0.06 H HETATM 1947 C23 UNN A 143 -27.009 -20.984 -44.114 1.00 0.01 C HETATM 1948 C24 UNN A 143 -25.960 -20.677 -43.114 1.00 -0.03 C HETATM 1949 C26 UNN A 143 -24.552 -20.795 -43.520 1.00 -0.06 C HETATM 1950 C25 UNN A 143 -23.460 -20.478 -42.584 1.00 -0.07 C HETATM 1951 C29 UNN A 143 -23.776 -20.043 -41.241 1.00 -0.07 C HETATM 1952 C28 UNN A 143 -25.178 -19.891 -40.832 1.00 -0.07 C HETATM 1953 C27 UNN A 143 -26.304 -20.218 -41.756 1.00 -0.06 C HETATM 1954 H UNN A 143 -27.336 -20.122 -41.440 1.00 0.06 H HETATM 1955 H UNN A 143 -25.401 -19.532 -39.834 1.00 0.06 H HETATM 1956 H UNN A 143 -22.979 -19.830 -40.538 1.00 0.06 H HETATM 1957 H UNN A 143 -22.427 -20.570 -42.899 1.00 0.06 H HETATM 1958 H UNN A 143 -24.313 -21.121 -44.526 1.00 0.06 H HETATM 1959 H UNN A 143 -26.588 -21.673 -44.862 1.00 0.06 H HETATM 1960 H UNN A 143 -27.308 -20.047 -44.606 1.00 0.06 H HETATM 1961 H UNN A 143 -28.192 -19.059 -43.153 1.00 0.23 H HETATM 1962 H UNN A 143 -27.564 -13.638 -42.509 1.00 0.07 H HETATM 1963 H UNN A 143 -30.060 -13.704 -42.167 1.00 0.07 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 1902 1903 1927 1963 CONECT 1903 1902 1904 1962 CONECT 1904 1903 1905 1925 CONECT 1905 1904 1906 1923 1924 CONECT 1906 1905 1907 1911 1922 CONECT 1907 1906 1908 1920 1921 CONECT 1908 1907 1909 1918 1919 CONECT 1909 1908 1910 1916 1917 CONECT 1910 1909 1911 1914 1915 CONECT 1911 1906 1910 1912 1913 CONECT 1912 1911 CONECT 1913 1911 CONECT 1914 1910 CONECT 1915 1910 CONECT 1916 1909 CONECT 1917 1909 CONECT 1918 1908 CONECT 1919 1908 CONECT 1920 1907 CONECT 1921 1907 CONECT 1922 1906 CONECT 1923 1905 CONECT 1924 1905 CONECT 1925 1904 1926 CONECT 1926 1925 1927 1929 CONECT 1927 1902 1926 1928 CONECT 1928 1927 CONECT 1929 1926 1930 1931 CONECT 1930 1929 CONECT 1931 1929 1932 1961 CONECT 1932 1931 1933 1937 CONECT 1933 1932 1934 1947 CONECT 1934 1933 1935 1946 CONECT 1935 1934 1936 1940 CONECT 1936 1935 1937 1939 CONECT 1937 1932 1936 1938 CONECT 1938 1937 CONECT 1939 1936 CONECT 1940 1935 1941 1944 CONECT 1941 1940 1942 1945 CONECT 1942 1941 1943 CONECT 1943 1942 1944 CONECT 1944 1940 1943 CONECT 1945 1941 CONECT 1946 1934 CONECT 1947 1933 1948 1959 1960 CONECT 1948 1947 1949 1953 CONECT 1949 1948 1950 1958 CONECT 1950 1949 1951 1957 CONECT 1951 1950 1952 1956 CONECT 1952 1951 1953 1955 CONECT 1953 1948 1952 1954 CONECT 1954 1953 CONECT 1955 1952 CONECT 1956 1951 CONECT 1957 1950 CONECT 1958 1949 CONECT 1959 1947 CONECT 1960 1947 CONECT 1961 1931 CONECT 1962 1903 CONECT 1963 1902 MASTER 0 0 0 0 0 0 0 0 1962 1 66 15 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 4p3h
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3njq
RCSB PDB
PDBbind
193aa, >3NJQ_2|Chain... at 100%
4p2t
RCSB PDB
PDBbind
194aa, >4P2T_1|Chains... *
5v5d
RCSB PDB
PDBbind
193aa, >5V5D_1|Chains... at 100%
5v5e
RCSB PDB
PDBbind
193aa, >5V5E_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4p3h
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
KSHV Protease
Ligand Name
25G
EC.Number
E.C.3.4.21.97
Resolution
1.45(Å)
Affinity (Kd/Ki/IC50)
Kd=1.0uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Biochemistry Vol. 53: pp. 4648-4660
Ligand Properties
Formula
C
2
7
H
2
8
N
6
O
Molecular Weight
452.551
Exact Mass
452.232
No. of atoms
62
No. of bonds
66
Polar Surface Area
96.45
LOGP Value
6.26 (
Computed with XLOGP3
)
5.30 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 5
Canonical SMILES
O=C(c1cccc(n1)CC1CCCCC1)Nc1ccc(cc1Cc1ccccc1)c1nnn[nH]1
InChI String
InChI=1S/C27H28N6O/c34-27(25-13-7-12-23(28-25)17-20-10-5-2-6-11-20)29-24-15-14-21(26-30-32-33-31-26)18-22(24)16-19-8-3-1-4-9-19/h1,3-4,7-9,12-15,18,20H,2,5-6,10-11,16-17H2,(H,29,34)(H,30,31,32,33)
Links to External Databases
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The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O36607
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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