Browse entries in the PDBbind-CN Database
HEADER 5MOC_COMPLEX COMPND 5MOC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 75 GLY ALA MET GLY SER MET GLU ARG ALA SER LEU ILE GLN SEQRES 2 A 75 LYS ALA LYS LEU ALA GLU GLN ALA GLU ARG TYR GLU ASP SEQRES 3 A 75 MET ALA ALA PHE MET LYS GLY ALA VAL GLU LYS GLY GLU SEQRES 4 A 75 GLU LEU SER CYS GLU GLU ARG ASN LEU LEU SER VAL ALA SEQRES 5 A 75 TYR LYS ASN VAL VAL GLY GLY GLN ARG ALA ALA TRP ARG SEQRES 6 A 75 VAL LEU SER SER ILE GLU GLN LYS SER ASN SEQRES 1 A 59 GLY PRO GLU VAL ARG GLU TYR ARG GLU LYS VAL GLU THR SEQRES 2 A 59 GLU LEU GLN GLY VAL CYS ASP THR VAL LEU GLY LEU LEU SEQRES 3 A 59 ASP SER HIS LEU ILE LYS GLU ALA GLY ASP ALA GLU SER SEQRES 4 A 59 ARG VAL PHE TYR LEU LYS MET LYS GLY ASP TYR TYR ARG SEQRES 5 A 59 TYR LEU ALA GLU VAL ALA THR SEQRES 1 A 93 ASP LYS LYS ARG ILE ILE ASP SER ALA ARG SER ALA TYR SEQRES 2 A 93 GLN GLU ALA MET ASP ILE SER LYS LYS GLU MET PRO PRO SEQRES 3 A 93 THR ASN PRO ILE ARG LEU GLY LEU ALA LEU ASN PHE SER SEQRES 4 A 93 VAL PHE HIS TYR GLU ILE ALA ASN SER PRO GLU GLU ALA SEQRES 5 A 93 ILE SER LEU ALA LYS THR THR PHE ASP GLU ALA MET ALA SEQRES 6 A 93 ASP LEU HIS THR LEU SER GLU ASP SER TYR LYS ASP SER SEQRES 7 A 93 THR LEU ILE MET GLN LEU LEU ARG ASP ASN LEU THR LEU SEQRES 8 A 93 TRP THR HET MG A 1 1 HET LYS A 619 191 ATOM 1 N GLY A -4 -44.300 -13.597 -4.315 1.00 41.15 N ATOM 2 CA GLY A -4 -44.026 -12.153 -4.054 1.00 36.05 C ATOM 3 C GLY A -4 -43.795 -11.347 -5.317 1.00 29.13 C ATOM 4 O GLY A -4 -44.286 -11.706 -6.392 1.00 26.04 O ATOM 5 HN3 GLY A -4 -43.489 -14.018 -4.811 1.00 0.00 H ATOM 6 HN2 GLY A -4 -45.153 -13.686 -4.904 1.00 0.00 H ATOM 7 HN1 GLY A -4 -44.448 -14.089 -3.411 1.00 0.00 H ATOM 8 N ALA A -3 -43.031 -10.256 -5.188 1.00 28.06 N ATOM 9 CA ALA A -3 -42.831 -9.341 -6.306 1.00 27.69 C ATOM 10 C ALA A -3 -42.029 -9.965 -7.437 1.00 23.55 C ATOM 11 O ALA A -3 -42.080 -9.461 -8.565 1.00 24.76 O ATOM 12 CB ALA A -3 -42.135 -8.069 -5.828 1.00 31.35 C ATOM 13 H ALA A -3 -42.572 -10.057 -4.276 1.00 0.00 H ATOM 14 N MET A -2 -41.291 -11.038 -7.168 1.00 18.15 N ATOM 15 CA MET A -2 -40.553 -11.753 -8.205 1.00 14.38 C ATOM 16 C MET A -2 -41.341 -12.922 -8.781 1.00 12.56 C ATOM 17 O MET A -2 -40.794 -13.679 -9.591 1.00 11.61 O ATOM 18 CB MET A -2 -39.218 -12.265 -7.657 1.00 12.69 C ATOM 19 CG MET A -2 -38.257 -11.181 -7.200 1.00 12.43 C ATOM 20 SD MET A -2 -37.887 -9.958 -8.465 1.00 15.31 S ATOM 21 CE MET A -2 -36.940 -8.758 -7.530 1.00 20.79 C ATOM 22 H MET A -2 -41.238 -11.379 -6.187 1.00 0.00 H ATOM 23 N GLY A -1 -42.611 -13.069 -8.400 1.00 12.02 N ATOM 24 CA GLY A -1 -43.380 -14.234 -8.812 1.00 11.58 C ATOM 25 C GLY A -1 -43.574 -14.335 -10.314 1.00 10.51 C ATOM 26 O GLY A -1 -43.723 -15.440 -10.856 1.00 10.67 O ATOM 27 H GLY A -1 -43.056 -12.344 -7.802 1.00 0.00 H ATOM 28 N SER A 0 -43.561 -13.197 -11.013 1.00 9.82 N ATOM 29 CA SER A 0 -43.810 -13.189 -12.452 1.00 10.56 C ATOM 30 C SER A 0 -42.550 -13.364 -13.301 1.00 9.03 C ATOM 31 O SER A 0 -42.663 -13.467 -14.528 1.00 9.21 O ATOM 32 CB SER A 0 -44.497 -11.884 -12.851 1.00 13.83 C ATOM 33 OG SER A 0 -43.667 -10.778 -12.538 1.00 16.07 O ATOM 34 HG SER A 0 -42.812 -10.859 -13.031 1.00 0.00 H ATOM 35 H SER A 0 -43.370 -12.300 -10.523 1.00 0.00 H ATOM 36 N MET A 1 -41.361 -13.393 -12.703 1.00 8.95 N ATOM 37 CA MET A 1 -40.128 -13.534 -13.463 1.00 10.30 C ATOM 38 C MET A 1 -39.674 -14.989 -13.503 1.00 11.28 C ATOM 39 O MET A 1 -39.783 -15.719 -12.509 1.00 11.80 O ATOM 40 CB MET A 1 -39.017 -12.660 -12.876 1.00 11.82 C ATOM 41 CG MET A 1 -37.928 -12.344 -13.896 1.00 13.52 C ATOM 42 SD MET A 1 -36.530 -11.442 -13.212 1.00 14.53 S ATOM 43 CE MET A 1 -37.345 -10.039 -12.457 1.00 16.68 C ATOM 44 H MET A 1 -41.312 -13.313 -11.667 1.00 0.00 H ATOM 45 N GLU A 2 -39.154 -15.396 -14.662 1.00 10.06 N ATOM 46 CA GLU A 2 -38.620 -16.737 -14.834 1.00 9.71 C ATOM 47 C GLU A 2 -37.499 -17.006 -13.839 1.00 9.30 C ATOM 48 O GLU A 2 -36.679 -16.132 -13.551 1.00 9.21 O ATOM 49 CB GLU A 2 -38.079 -16.912 -16.246 1.00 10.53 C ATOM 50 CG GLU A 2 -39.130 -16.991 -17.307 1.00 12.90 C ATOM 51 CD GLU A 2 -39.736 -18.374 -17.425 1.00 15.36 C ATOM 52 OE1 GLU A 2 -39.594 -19.173 -16.478 1.00 16.32 O ATOM 53 OE2 GLU A 2 -40.340 -18.667 -18.476 1.00 15.31 O ATOM 54 H GLU A 2 -39.130 -14.735 -15.465 1.00 0.00 H ATOM 55 N ARG A 3 -37.439 -18.250 -13.362 1.00 9.51 N ATOM 56 CA ARG A 3 -36.351 -18.660 -12.483 1.00 9.20 C ATOM 57 C ARG A 3 -35.000 -18.353 -13.110 1.00 8.74 C ATOM 58 O ARG A 3 -34.114 -17.807 -12.453 1.00 8.56 O ATOM 59 CB ARG A 3 -36.455 -20.152 -12.174 1.00 10.46 C ATOM 60 CG ARG A 3 -35.490 -20.613 -11.108 1.00 11.19 C ATOM 61 CD ARG A 3 -35.600 -22.110 -10.889 1.00 12.58 C ATOM 62 NE ARG A 3 -34.808 -22.551 -9.745 1.00 12.97 N ATOM 63 CZ ARG A 3 -33.494 -22.752 -9.768 1.00 13.00 C ATOM 64 NH1 ARG A 3 -32.801 -22.549 -10.879 1.00 11.99 N ATOM 65 NH2 ARG A 3 -32.868 -23.157 -8.669 1.00 14.25 N ATOM 66 HE ARG A 3 -35.307 -22.720 -8.848 1.00 0.00 H ATOM 67 HH12 ARG A 3 -31.773 -22.709 -10.887 1.00 0.00 H ATOM 68 HH11 ARG A 3 -33.285 -22.230 -11.743 1.00 0.00 H ATOM 69 HH22 ARG A 3 -31.840 -23.315 -8.684 1.00 0.00 H ATOM 70 HH21 ARG A 3 -33.406 -23.316 -7.793 1.00 0.00 H ATOM 71 H ARG A 3 -38.177 -18.936 -13.620 1.00 0.00 H ATOM 72 N ALA A 4 -34.822 -18.714 -14.383 1.00 9.02 N ATOM 73 CA ALA A 4 -33.531 -18.509 -15.036 1.00 10.48 C ATOM 74 C ALA A 4 -33.187 -17.028 -15.112 1.00 9.16 C ATOM 75 O ALA A 4 -32.019 -16.640 -14.969 1.00 8.98 O ATOM 76 CB ALA A 4 -33.544 -19.129 -16.431 1.00 13.43 C ATOM 77 H ALA A 4 -35.607 -19.144 -14.913 1.00 0.00 H ATOM 78 N SER A 5 -34.197 -16.184 -15.333 1.00 8.95 N ATOM 79 CA SER A 5 -33.969 -14.748 -15.420 1.00 8.87 C ATOM 80 C SER A 5 -33.587 -14.173 -14.062 1.00 8.58 C ATOM 81 O SER A 5 -32.733 -13.283 -13.982 1.00 8.54 O ATOM 82 CB SER A 5 -35.219 -14.055 -15.966 1.00 9.29 C ATOM 83 OG SER A 5 -35.535 -14.518 -17.272 1.00 10.57 O ATOM 84 HG SER A 5 -35.701 -15.494 -17.244 1.00 0.00 H ATOM 85 H SER A 5 -35.161 -16.557 -15.445 1.00 0.00 H ATOM 86 N LEU A 6 -34.207 -14.671 -12.983 1.00 8.56 N ATOM 87 CA LEU A 6 -33.826 -14.241 -11.638 1.00 8.13 C ATOM 88 C LEU A 6 -32.373 -14.590 -11.336 1.00 8.57 C ATOM 89 O LEU A 6 -31.645 -13.789 -10.745 1.00 8.68 O ATOM 90 CB LEU A 6 -34.754 -14.877 -10.601 1.00 8.05 C ATOM 91 CG LEU A 6 -36.200 -14.371 -10.633 1.00 8.71 C ATOM 92 CD1 LEU A 6 -37.137 -15.328 -9.919 1.00 9.15 C ATOM 93 CD2 LEU A 6 -36.294 -12.971 -10.024 1.00 9.37 C ATOM 94 H LEU A 6 -34.967 -15.371 -13.103 1.00 0.00 H ATOM 95 N ILE A 7 -31.940 -15.798 -11.694 1.00 10.31 N ATOM 96 CA ILE A 7 -30.555 -16.199 -11.455 1.00 10.71 C ATOM 97 C ILE A 7 -29.609 -15.337 -12.276 1.00 10.11 C ATOM 98 O ILE A 7 -28.580 -14.867 -11.783 1.00 9.36 O ATOM 99 CB ILE A 7 -30.367 -17.692 -11.781 1.00 11.18 C ATOM 100 CG1 ILE A 7 -31.283 -18.577 -10.917 1.00 11.14 C ATOM 101 CG2 ILE A 7 -28.900 -18.098 -11.634 1.00 11.49 C ATOM 102 CD1 ILE A 7 -31.039 -18.483 -9.428 1.00 10.37 C ATOM 103 H ILE A 7 -32.596 -16.464 -12.149 1.00 0.00 H ATOM 104 N GLN A 8 -29.943 -15.116 -13.545 1.00 9.27 N ATOM 105 CA GLN A 8 -29.115 -14.250 -14.377 1.00 10.31 C ATOM 106 C GLN A 8 -29.004 -12.851 -13.775 1.00 9.32 C ATOM 107 O GLN A 8 -27.910 -12.274 -13.714 1.00 10.78 O ATOM 108 CB GLN A 8 -29.696 -14.192 -15.791 1.00 13.94 C ATOM 109 CG GLN A 8 -28.907 -13.328 -16.748 1.00 19.86 C ATOM 110 CD GLN A 8 -29.512 -13.312 -18.140 1.00 26.86 C ATOM 111 OE1 GLN A 8 -30.455 -14.049 -18.431 1.00 29.87 O ATOM 112 NE2 GLN A 8 -28.978 -12.464 -19.002 1.00 29.43 N ATOM 113 HE22 GLN A 8 -28.182 -11.860 -18.713 1.00 0.00 H ATOM 114 HE21 GLN A 8 -29.354 -12.400 -19.970 1.00 0.00 H ATOM 115 H GLN A 8 -30.794 -15.561 -13.944 1.00 0.00 H ATOM 116 N LYS A 9 -30.121 -12.295 -13.308 1.00 8.47 N ATOM 117 CA LYS A 9 -30.085 -10.944 -12.757 1.00 8.35 C ATOM 118 C LYS A 9 -29.384 -10.907 -11.406 1.00 8.70 C ATOM 119 O LYS A 9 -28.771 -9.889 -11.058 1.00 9.02 O ATOM 120 CB LYS A 9 -31.498 -10.385 -12.650 1.00 8.28 C ATOM 121 CG LYS A 9 -32.075 -10.045 -14.013 1.00 8.56 C ATOM 122 CD LYS A 9 -33.459 -9.438 -13.928 1.00 9.85 C ATOM 123 CE LYS A 9 -34.093 -9.353 -15.305 1.00 10.33 C ATOM 124 NZ LYS A 9 -35.485 -8.822 -15.241 1.00 10.83 N ATOM 125 HZ1 LYS A 9 -36.067 -9.450 -14.651 1.00 0.00 H ATOM 126 HZ2 LYS A 9 -35.472 -7.868 -14.827 1.00 0.00 H ATOM 127 HZ3 LYS A 9 -35.883 -8.779 -16.201 1.00 0.00 H ATOM 128 H LYS A 9 -31.017 -12.823 -13.336 1.00 0.00 H ATOM 129 N ALA A 10 -29.451 -11.994 -10.637 1.00 8.83 N ATOM 130 CA ALA A 10 -28.660 -12.060 -9.413 1.00 9.56 C ATOM 131 C ALA A 10 -27.172 -11.936 -9.729 1.00 8.84 C ATOM 132 O ALA A 10 -26.437 -11.233 -9.026 1.00 8.10 O ATOM 133 CB ALA A 10 -28.949 -13.363 -8.666 1.00 9.74 C ATOM 134 H ALA A 10 -30.063 -12.790 -10.908 1.00 0.00 H ATOM 135 N LYS A 11 -26.714 -12.604 -10.796 1.00 8.70 N ATOM 136 CA LYS A 11 -25.309 -12.514 -11.195 1.00 9.55 C ATOM 137 C LYS A 11 -24.949 -11.108 -11.659 1.00 9.50 C ATOM 138 O LYS A 11 -23.862 -10.602 -11.340 1.00 10.78 O ATOM 139 CB LYS A 11 -25.006 -13.533 -12.302 1.00 10.94 C ATOM 140 CG LYS A 11 -25.090 -14.987 -11.832 1.00 12.06 C ATOM 141 CD LYS A 11 -24.918 -15.964 -12.982 1.00 15.21 C ATOM 142 CE LYS A 11 -25.272 -17.378 -12.554 1.00 18.10 C ATOM 143 NZ LYS A 11 -25.320 -18.334 -13.700 1.00 19.59 N ATOM 144 HZ1 LYS A 11 -26.038 -18.019 -14.383 1.00 0.00 H ATOM 145 HZ2 LYS A 11 -24.389 -18.365 -14.163 1.00 0.00 H ATOM 146 HZ3 LYS A 11 -25.566 -19.282 -13.349 1.00 0.00 H ATOM 147 H LYS A 11 -27.367 -13.195 -11.349 1.00 0.00 H ATOM 148 N LEU A 12 -25.829 -10.472 -12.433 1.00 8.63 N ATOM 149 CA LEU A 12 -25.606 -9.087 -12.840 1.00 9.72 C ATOM 150 C LEU A 12 -25.554 -8.161 -11.631 1.00 9.75 C ATOM 151 O LEU A 12 -24.701 -7.264 -11.556 1.00 10.61 O ATOM 152 CB LEU A 12 -26.717 -8.635 -13.792 1.00 10.73 C ATOM 153 CG LEU A 12 -26.778 -9.323 -15.156 1.00 12.99 C ATOM 154 CD1 LEU A 12 -28.103 -9.062 -15.843 1.00 13.15 C ATOM 155 CD2 LEU A 12 -25.625 -8.872 -16.048 1.00 14.52 C ATOM 156 H LEU A 12 -26.686 -10.969 -12.751 1.00 0.00 H ATOM 157 N ALA A 13 -26.477 -8.349 -10.686 1.00 9.65 N ATOM 158 CA ALA A 13 -26.509 -7.513 -9.493 1.00 9.40 C ATOM 159 C ALA A 13 -25.223 -7.653 -8.692 1.00 10.41 C ATOM 160 O ALA A 13 -24.686 -6.661 -8.178 1.00 11.72 O ATOM 161 CB ALA A 13 -27.726 -7.876 -8.643 1.00 9.21 C ATOM 162 H ALA A 13 -27.184 -9.103 -10.803 1.00 0.00 H ATOM 163 N GLU A 14 -24.700 -8.874 -8.582 1.00 10.70 N ATOM 164 CA GLU A 14 -23.402 -9.060 -7.943 1.00 12.09 C ATOM 165 C GLU A 14 -22.314 -8.261 -8.655 1.00 13.14 C ATOM 166 O GLU A 14 -21.460 -7.648 -8.006 1.00 14.15 O ATOM 167 CB GLU A 14 -23.023 -10.540 -7.910 1.00 14.11 C ATOM 168 CG GLU A 14 -21.750 -10.770 -7.125 1.00 15.90 C ATOM 169 CD GLU A 14 -21.307 -12.207 -7.091 1.00 18.18 C ATOM 170 OE1 GLU A 14 -21.720 -12.993 -7.965 1.00 19.74 O ATOM 171 OE2 GLU A 14 -20.524 -12.538 -6.184 1.00 19.24 O ATOM 172 H GLU A 14 -25.218 -9.696 -8.953 1.00 0.00 H ATOM 173 N GLN A 15 -22.313 -8.266 -9.989 1.00 13.26 N ATOM 174 CA GLN A 15 -21.303 -7.517 -10.732 1.00 14.94 C ATOM 175 C GLN A 15 -21.429 -6.022 -10.493 1.00 13.69 C ATOM 176 O GLN A 15 -20.418 -5.306 -10.472 1.00 13.97 O ATOM 177 CB GLN A 15 -21.421 -7.805 -12.225 1.00 17.20 C ATOM 178 CG GLN A 15 -21.047 -9.211 -12.614 1.00 20.09 C ATOM 179 CD GLN A 15 -21.112 -9.422 -14.108 1.00 23.69 C ATOM 180 OE1 GLN A 15 -22.019 -10.085 -14.617 1.00 30.17 O ATOM 181 NE2 GLN A 15 -20.155 -8.852 -14.823 1.00 23.07 N ATOM 182 HE22 GLN A 15 -19.410 -8.302 -14.350 1.00 0.00 H ATOM 183 HE21 GLN A 15 -20.148 -8.954 -15.858 1.00 0.00 H ATOM 184 H GLN A 15 -23.037 -8.807 -10.504 1.00 0.00 H ATOM 185 N ALA A 16 -22.652 -5.538 -10.317 1.00 12.45 N ATOM 186 CA ALA A 16 -22.945 -4.143 -10.046 1.00 13.03 C ATOM 187 C ALA A 16 -22.827 -3.794 -8.569 1.00 13.30 C ATOM 188 O ALA A 16 -23.046 -2.630 -8.209 1.00 13.74 O ATOM 189 CB ALA A 16 -24.356 -3.822 -10.546 1.00 13.37 C ATOM 190 H ALA A 16 -23.451 -6.201 -10.377 1.00 0.00 H ATOM 191 N GLU A 17 -22.492 -4.772 -7.725 1.00 13.87 N ATOM 192 CA GLU A 17 -22.440 -4.585 -6.274 1.00 15.07 C ATOM 193 C GLU A 17 -23.782 -4.098 -5.728 1.00 13.66 C ATOM 194 O GLU A 17 -23.842 -3.309 -4.779 1.00 14.20 O ATOM 195 CB GLU A 17 -21.299 -3.639 -5.892 1.00 17.43 C ATOM 196 CG GLU A 17 -19.938 -4.222 -6.242 1.00 19.78 C ATOM 197 CD GLU A 17 -18.772 -3.331 -5.856 1.00 22.04 C ATOM 198 OE1 GLU A 17 -18.989 -2.290 -5.195 1.00 22.49 O ATOM 199 OE2 GLU A 17 -17.631 -3.682 -6.226 1.00 22.87 O ATOM 200 H GLU A 17 -22.258 -5.707 -8.115 1.00 0.00 H ATOM 201 N ARG A 18 -24.870 -4.601 -6.314 1.00 11.18 N ATOM 202 CA ARG A 18 -26.232 -4.261 -5.902 1.00 10.62 C ATOM 203 C ARG A 18 -26.783 -5.435 -5.099 1.00 9.87 C ATOM 204 O ARG A 18 -27.564 -6.253 -5.588 1.00 9.26 O ATOM 205 CB ARG A 18 -27.095 -3.957 -7.119 1.00 12.58 C ATOM 206 CG ARG A 18 -26.667 -2.730 -7.911 1.00 15.03 C ATOM 207 CD ARG A 18 -27.405 -1.496 -7.446 1.00 15.70 C ATOM 208 NE ARG A 18 -28.842 -1.638 -7.664 1.00 15.85 N ATOM 209 CZ ARG A 18 -29.729 -0.664 -7.502 1.00 16.05 C ATOM 210 NH1 ARG A 18 -29.340 0.546 -7.103 1.00 16.35 N ATOM 211 NH2 ARG A 18 -31.008 -0.906 -7.722 1.00 15.36 N ATOM 212 HE ARG A 18 -29.195 -2.568 -7.968 1.00 0.00 H ATOM 213 HH12 ARG A 18 -30.042 1.303 -6.979 1.00 0.00 H ATOM 214 HH11 ARG A 18 -28.334 0.733 -6.916 1.00 0.00 H ATOM 215 HH22 ARG A 18 -31.710 -0.148 -7.597 1.00 0.00 H ATOM 216 HH21 ARG A 18 -31.314 -1.854 -8.020 1.00 0.00 H ATOM 217 H ARG A 18 -24.744 -5.267 -7.102 1.00 0.00 H ATOM 218 N TYR A 19 -26.353 -5.528 -3.841 1.00 9.84 N ATOM 219 CA TYR A 19 -26.579 -6.762 -3.097 1.00 9.46 C ATOM 220 C TYR A 19 -28.008 -6.888 -2.584 1.00 9.65 C ATOM 221 O TYR A 19 -28.494 -8.011 -2.427 1.00 9.58 O ATOM 222 CB TYR A 19 -25.567 -6.876 -1.957 1.00 9.26 C ATOM 223 CG TYR A 19 -24.155 -7.009 -2.474 1.00 11.89 C ATOM 224 CD1 TYR A 19 -23.731 -8.176 -3.100 1.00 12.13 C ATOM 225 CD2 TYR A 19 -23.255 -5.961 -2.376 1.00 16.54 C ATOM 226 CE1 TYR A 19 -22.451 -8.300 -3.582 1.00 15.07 C ATOM 227 CE2 TYR A 19 -21.965 -6.080 -2.862 1.00 18.96 C ATOM 228 CZ TYR A 19 -21.572 -7.250 -3.458 1.00 19.49 C ATOM 229 OH TYR A 19 -20.296 -7.367 -3.939 1.00 23.44 O ATOM 230 HH TYR A 19 -19.652 -7.243 -3.197 1.00 0.00 H ATOM 231 H TYR A 19 -25.861 -4.728 -3.394 1.00 0.00 H ATOM 232 N GLU A 20 -28.703 -5.780 -2.305 1.00 9.52 N ATOM 233 CA GLU A 20 -30.110 -5.898 -1.946 1.00 10.06 C ATOM 234 C GLU A 20 -30.920 -6.448 -3.112 1.00 8.30 C ATOM 235 O GLU A 20 -31.759 -7.335 -2.926 1.00 7.24 O ATOM 236 CB GLU A 20 -30.660 -4.552 -1.484 1.00 12.09 C ATOM 237 CG GLU A 20 -30.093 -4.109 -0.152 1.00 14.94 C ATOM 238 CD GLU A 20 -30.742 -2.846 0.374 1.00 22.20 C ATOM 239 OE1 GLU A 20 -31.739 -2.395 -0.228 1.00 23.51 O ATOM 240 OE2 GLU A 20 -30.254 -2.306 1.390 1.00 26.56 O ATOM 241 H GLU A 20 -28.245 -4.847 -2.344 1.00 0.00 H ATOM 242 N ASP A 21 -30.676 -5.944 -4.324 1.00 7.64 N ATOM 243 CA ASP A 21 -31.294 -6.532 -5.511 1.00 8.83 C ATOM 244 C ASP A 21 -30.911 -7.998 -5.649 1.00 9.34 C ATOM 245 O ASP A 21 -31.749 -8.849 -5.970 1.00 9.60 O ATOM 246 CB ASP A 21 -30.855 -5.793 -6.771 1.00 10.31 C ATOM 247 CG ASP A 21 -31.451 -4.414 -6.899 1.00 13.38 C ATOM 248 OD1 ASP A 21 -32.391 -4.060 -6.150 1.00 13.50 O ATOM 249 OD2 ASP A 21 -30.958 -3.690 -7.789 1.00 15.33 O ATOM 250 H ASP A 21 -30.041 -5.126 -4.424 1.00 0.00 H ATOM 251 N MET A 22 -29.622 -8.296 -5.479 1.00 9.31 N ATOM 252 CA MET A 22 -29.156 -9.668 -5.599 1.00 8.40 C ATOM 253 C MET A 22 -29.929 -10.582 -4.662 1.00 7.35 C ATOM 254 O MET A 22 -30.359 -11.673 -5.057 1.00 7.02 O ATOM 255 CB MET A 22 -27.661 -9.722 -5.304 1.00 8.70 C ATOM 256 CG MET A 22 -27.015 -11.026 -5.704 1.00 8.90 C ATOM 257 SD MET A 22 -25.333 -11.136 -5.110 1.00 9.28 S ATOM 258 CE MET A 22 -24.904 -12.797 -5.649 1.00 9.49 C ATOM 259 H MET A 22 -28.943 -7.539 -5.258 1.00 0.00 H ATOM 260 N ALA A 23 -30.130 -10.141 -3.419 1.00 7.30 N ATOM 261 CA ALA A 23 -30.858 -10.939 -2.440 1.00 7.83 C ATOM 262 C ALA A 23 -32.320 -11.105 -2.836 1.00 8.41 C ATOM 263 O ALA A 23 -32.885 -12.198 -2.712 1.00 7.82 O ATOM 264 CB ALA A 23 -30.747 -10.293 -1.060 1.00 8.00 C ATOM 265 H ALA A 23 -29.760 -9.209 -3.143 1.00 0.00 H ATOM 266 N ALA A 24 -32.949 -10.033 -3.315 1.00 9.98 N ATOM 267 CA ALA A 24 -34.346 -10.118 -3.725 1.00 9.67 C ATOM 268 C ALA A 24 -34.520 -11.081 -4.893 1.00 9.07 C ATOM 269 O ALA A 24 -35.494 -11.841 -4.935 1.00 8.79 O ATOM 270 CB ALA A 24 -34.869 -8.737 -4.097 1.00 9.00 C ATOM 271 H ALA A 24 -32.441 -9.129 -3.397 1.00 0.00 H ATOM 272 N PHE A 25 -33.596 -11.048 -5.857 1.00 7.73 N ATOM 273 CA PHE A 25 -33.657 -11.980 -6.978 1.00 8.82 C ATOM 274 C PHE A 25 -33.511 -13.420 -6.496 1.00 8.32 C ATOM 275 O PHE A 25 -34.269 -14.303 -6.914 1.00 8.48 O ATOM 276 CB PHE A 25 -32.571 -11.655 -8.003 1.00 10.12 C ATOM 277 CG PHE A 25 -32.780 -10.348 -8.748 1.00 10.77 C ATOM 278 CD1 PHE A 25 -31.698 -9.527 -9.034 1.00 10.65 C ATOM 279 CD2 PHE A 25 -34.033 -9.966 -9.194 1.00 11.28 C ATOM 280 CE1 PHE A 25 -31.865 -8.336 -9.721 1.00 10.37 C ATOM 281 CE2 PHE A 25 -34.208 -8.776 -9.889 1.00 10.39 C ATOM 282 CZ PHE A 25 -33.121 -7.966 -10.159 1.00 9.88 C ATOM 283 H PHE A 25 -32.826 -10.351 -5.808 1.00 0.00 H ATOM 284 N MET A 26 -32.552 -13.677 -5.599 1.00 8.03 N ATOM 285 CA MET A 26 -32.356 -15.045 -5.126 1.00 7.98 C ATOM 286 C MET A 26 -33.487 -15.501 -4.212 1.00 8.85 C ATOM 287 O MET A 26 -33.831 -16.692 -4.214 1.00 9.68 O ATOM 288 CB MET A 26 -31.013 -15.179 -4.411 1.00 8.42 C ATOM 289 CG MET A 26 -29.807 -15.097 -5.338 1.00 9.16 C ATOM 290 SD MET A 26 -29.924 -16.171 -6.804 1.00 10.26 S ATOM 291 CE MET A 26 -29.952 -17.813 -6.081 1.00 11.18 C ATOM 292 H MET A 26 -31.950 -12.908 -5.241 1.00 0.00 H ATOM 293 N LYS A 27 -34.065 -14.595 -3.417 1.00 8.61 N ATOM 294 CA LYS A 27 -35.293 -14.933 -2.704 1.00 7.88 C ATOM 295 C LYS A 27 -36.356 -15.391 -3.686 1.00 7.24 C ATOM 296 O LYS A 27 -37.010 -16.424 -3.485 1.00 7.40 O ATOM 297 CB LYS A 27 -35.786 -13.729 -1.885 1.00 8.01 C ATOM 298 CG LYS A 27 -37.086 -13.970 -1.111 1.00 10.23 C ATOM 299 CD LYS A 27 -37.389 -12.853 -0.125 1.00 13.73 C ATOM 300 CE LYS A 27 -38.645 -13.147 0.694 1.00 16.79 C ATOM 301 NZ LYS A 27 -39.861 -13.206 -0.148 1.00 18.11 N ATOM 302 HZ1 LYS A 27 -39.994 -12.293 -0.627 1.00 0.00 H ATOM 303 HZ2 LYS A 27 -39.754 -13.959 -0.857 1.00 0.00 H ATOM 304 HZ3 LYS A 27 -40.687 -13.408 0.451 1.00 0.00 H ATOM 305 H LYS A 27 -33.641 -13.652 -3.307 1.00 0.00 H ATOM 306 N GLY A 28 -36.518 -14.650 -4.784 1.00 7.24 N ATOM 307 CA GLY A 28 -37.510 -15.026 -5.777 1.00 7.45 C ATOM 308 C GLY A 28 -37.209 -16.372 -6.400 1.00 7.59 C ATOM 309 O GLY A 28 -38.115 -17.167 -6.653 1.00 8.58 O ATOM 310 H GLY A 28 -35.933 -13.802 -4.929 1.00 0.00 H ATOM 311 N ALA A 29 -35.928 -16.638 -6.665 1.00 7.57 N ATOM 312 CA ALA A 29 -35.533 -17.924 -7.221 1.00 7.76 C ATOM 313 C ALA A 29 -35.865 -19.062 -6.258 1.00 7.77 C ATOM 314 O ALA A 29 -36.431 -20.086 -6.660 1.00 7.99 O ATOM 315 CB ALA A 29 -34.040 -17.899 -7.555 1.00 7.76 C ATOM 316 H ALA A 29 -35.203 -15.918 -6.472 1.00 0.00 H ATOM 317 N VAL A 30 -35.501 -18.909 -4.982 1.00 8.79 N ATOM 318 CA VAL A 30 -35.820 -19.930 -3.986 1.00 9.36 C ATOM 319 C VAL A 30 -37.320 -20.203 -3.963 1.00 9.05 C ATOM 320 O VAL A 30 -37.759 -21.356 -3.880 1.00 9.14 O ATOM 321 CB VAL A 30 -35.319 -19.501 -2.591 1.00 9.42 C ATOM 322 CG1 VAL A 30 -35.842 -20.462 -1.519 1.00 10.14 C ATOM 323 CG2 VAL A 30 -33.808 -19.462 -2.541 1.00 9.31 C ATOM 324 H VAL A 30 -34.985 -18.053 -4.694 1.00 0.00 H ATOM 325 N GLU A 31 -38.127 -19.147 -4.000 1.00 8.91 N ATOM 326 CA GLU A 31 -39.570 -19.304 -3.884 1.00 10.00 C ATOM 327 C GLU A 31 -40.200 -19.979 -5.100 1.00 9.49 C ATOM 328 O GLU A 31 -41.373 -20.360 -5.026 1.00 10.76 O ATOM 329 CB GLU A 31 -40.191 -17.931 -3.603 1.00 11.93 C ATOM 330 CG GLU A 31 -39.817 -17.447 -2.201 1.00 14.90 C ATOM 331 CD GLU A 31 -40.298 -16.045 -1.878 1.00 17.74 C ATOM 332 OE1 GLU A 31 -40.776 -15.345 -2.786 1.00 19.04 O ATOM 333 OE2 GLU A 31 -40.187 -15.648 -0.698 1.00 18.20 O ATOM 334 H GLU A 31 -37.722 -18.196 -4.113 1.00 0.00 H ATOM 335 N LYS A 32 -39.452 -20.184 -6.193 1.00 8.22 N ATOM 336 CA LYS A 32 -39.964 -21.010 -7.282 1.00 9.02 C ATOM 337 C LYS A 32 -40.171 -22.457 -6.852 1.00 10.31 C ATOM 338 O LYS A 32 -40.917 -23.190 -7.511 1.00 9.84 O ATOM 339 CB LYS A 32 -39.028 -20.963 -8.490 1.00 9.98 C ATOM 340 CG LYS A 32 -38.829 -19.579 -9.075 1.00 9.40 C ATOM 341 CD LYS A 32 -40.123 -18.992 -9.595 1.00 9.19 C ATOM 342 CE LYS A 32 -39.898 -17.587 -10.141 1.00 10.23 C ATOM 343 NZ LYS A 32 -41.194 -16.959 -10.526 1.00 11.41 N ATOM 344 HZ1 LYS A 32 -41.653 -17.536 -11.259 1.00 0.00 H ATOM 345 HZ2 LYS A 32 -41.811 -16.901 -9.691 1.00 0.00 H ATOM 346 HZ3 LYS A 32 -41.018 -16.003 -10.895 1.00 0.00 H ATOM 347 H LYS A 32 -38.507 -19.755 -6.265 1.00 0.00 H ATOM 348 N GLY A 33 -39.534 -22.887 -5.763 1.00 10.35 N ATOM 349 CA GLY A 33 -39.801 -24.192 -5.197 1.00 10.71 C ATOM 350 C GLY A 33 -38.872 -25.309 -5.629 1.00 12.29 C ATOM 351 O GLY A 33 -39.002 -26.431 -5.121 1.00 14.75 O ATOM 352 H GLY A 33 -38.829 -22.271 -5.310 1.00 0.00 H ATOM 353 N GLU A 34 -37.963 -25.058 -6.565 1.00 11.46 N ATOM 354 CA GLU A 34 -36.983 -26.055 -6.962 1.00 13.57 C ATOM 355 C GLU A 34 -35.765 -25.969 -6.051 1.00 13.11 C ATOM 356 O GLU A 34 -35.470 -24.917 -5.478 1.00 12.16 O ATOM 357 CB GLU A 34 -36.562 -25.857 -8.421 1.00 17.00 C ATOM 358 CG GLU A 34 -37.700 -25.943 -9.432 1.00 21.40 C ATOM 359 CD GLU A 34 -37.931 -27.349 -9.961 1.00 27.05 C ATOM 360 OE1 GLU A 34 -37.613 -28.328 -9.251 1.00 29.60 O ATOM 361 OE2 GLU A 34 -38.433 -27.474 -11.099 1.00 31.00 O ATOM 362 H GLU A 34 -37.953 -24.125 -7.025 1.00 0.00 H ATOM 363 N GLU A 35 -35.077 -27.095 -5.895 1.00 15.92 N ATOM 364 CA GLU A 35 -33.830 -27.096 -5.149 1.00 19.28 C ATOM 365 C GLU A 35 -32.812 -26.215 -5.882 1.00 18.20 C ATOM 366 O GLU A 35 -32.929 -25.951 -7.082 1.00 21.99 O ATOM 367 CB GLU A 35 -33.321 -28.534 -4.956 1.00 24.22 C ATOM 368 CG GLU A 35 -34.291 -29.450 -4.146 1.00 30.41 C ATOM 369 CD GLU A 35 -33.738 -30.861 -3.861 1.00 37.74 C ATOM 370 OE1 GLU A 35 -32.512 -31.055 -3.990 1.00 46.56 O ATOM 371 OE2 GLU A 35 -34.524 -31.780 -3.505 1.00 33.92 O ATOM 372 H GLU A 35 -35.433 -27.980 -6.309 1.00 0.00 H ATOM 373 N LEU A 36 -31.831 -25.718 -5.140 1.00 13.46 N ATOM 374 CA LEU A 36 -30.807 -24.841 -5.694 1.00 11.53 C ATOM 375 C LEU A 36 -29.552 -25.642 -5.998 1.00 11.04 C ATOM 376 O LEU A 36 -29.172 -26.529 -5.232 1.00 11.69 O ATOM 377 CB LEU A 36 -30.442 -23.710 -4.733 1.00 12.37 C ATOM 378 CG LEU A 36 -31.501 -22.720 -4.248 1.00 14.39 C ATOM 379 CD1 LEU A 36 -30.815 -21.625 -3.449 1.00 13.71 C ATOM 380 CD2 LEU A 36 -32.290 -22.135 -5.382 1.00 15.98 C ATOM 381 H LEU A 36 -31.791 -25.962 -4.130 1.00 0.00 H ATOM 382 N SER A 37 -28.903 -25.314 -7.112 1.00 9.83 N ATOM 383 CA SER A 37 -27.605 -25.896 -7.420 1.00 9.79 C ATOM 384 C SER A 37 -26.531 -25.310 -6.504 1.00 10.25 C ATOM 385 O SER A 37 -26.754 -24.337 -5.790 1.00 10.59 O ATOM 386 CB SER A 37 -27.220 -25.609 -8.864 1.00 10.30 C ATOM 387 OG SER A 37 -26.938 -24.219 -9.001 1.00 10.91 O ATOM 388 HG SER A 37 -26.687 -24.025 -9.939 1.00 0.00 H ATOM 389 H SER A 37 -29.329 -24.632 -7.772 1.00 0.00 H ATOM 390 N CYS A 38 -25.328 -25.888 -6.570 1.00 11.76 N ATOM 391 CA CYS A 38 -24.206 -25.366 -5.793 1.00 13.02 C ATOM 392 C CYS A 38 -23.953 -23.892 -6.099 1.00 11.18 C ATOM 393 O CYS A 38 -23.811 -23.070 -5.185 1.00 10.98 O ATOM 394 CB CYS A 38 -22.947 -26.187 -6.072 1.00 17.26 C ATOM 395 SG CYS A 38 -21.545 -25.671 -5.070 1.00 19.68 S ATOM 396 H CYS A 38 -25.189 -26.718 -7.181 1.00 0.00 H ATOM 397 N GLU A 39 -23.889 -23.535 -7.382 1.00 9.65 N ATOM 398 CA GLU A 39 -23.656 -22.137 -7.738 1.00 10.67 C ATOM 399 C GLU A 39 -24.767 -21.240 -7.208 1.00 8.81 C ATOM 400 O GLU A 39 -24.508 -20.132 -6.716 1.00 8.55 O ATOM 401 CB GLU A 39 -23.524 -21.994 -9.256 1.00 16.84 C ATOM 402 CG GLU A 39 -23.239 -20.560 -9.707 1.00 21.88 C ATOM 403 CD GLU A 39 -23.019 -20.441 -11.206 1.00 26.46 C ATOM 404 OE1 GLU A 39 -23.196 -21.450 -11.924 1.00 27.62 O ATOM 405 OE2 GLU A 39 -22.662 -19.335 -11.662 1.00 27.79 O ATOM 406 H GLU A 39 -24.005 -24.250 -8.128 1.00 0.00 H ATOM 407 N GLU A 40 -26.013 -21.698 -7.303 1.00 8.67 N ATOM 408 CA GLU A 40 -27.151 -20.901 -6.855 1.00 9.24 C ATOM 409 C GLU A 40 -27.160 -20.731 -5.338 1.00 8.57 C ATOM 410 O GLU A 40 -27.454 -19.636 -4.835 1.00 8.01 O ATOM 411 CB GLU A 40 -28.442 -21.552 -7.355 1.00 10.72 C ATOM 412 CG GLU A 40 -28.532 -21.564 -8.882 1.00 11.41 C ATOM 413 CD GLU A 40 -29.607 -22.502 -9.423 1.00 12.50 C ATOM 414 OE1 GLU A 40 -30.169 -23.280 -8.632 1.00 11.23 O ATOM 415 OE2 GLU A 40 -29.890 -22.455 -10.645 1.00 13.43 O ATOM 416 H GLU A 40 -26.179 -22.643 -7.705 1.00 0.00 H ATOM 417 N ARG A 41 -26.836 -21.792 -4.590 1.00 8.47 N ATOM 418 CA ARG A 41 -26.705 -21.654 -3.142 1.00 9.99 C ATOM 419 C ARG A 41 -25.686 -20.592 -2.788 1.00 9.71 C ATOM 420 O ARG A 41 -25.881 -19.811 -1.850 1.00 9.96 O ATOM 421 CB ARG A 41 -26.287 -22.981 -2.506 1.00 13.40 C ATOM 422 CG ARG A 41 -27.297 -24.074 -2.637 1.00 15.27 C ATOM 423 CD ARG A 41 -26.981 -25.232 -1.700 1.00 14.85 C ATOM 424 NE ARG A 41 -25.769 -25.974 -2.041 1.00 14.56 N ATOM 425 CZ ARG A 41 -25.714 -26.968 -2.926 1.00 15.18 C ATOM 426 NH1 ARG A 41 -26.802 -27.328 -3.603 1.00 13.87 N ATOM 427 NH2 ARG A 41 -24.561 -27.604 -3.141 1.00 15.99 N ATOM 428 HE ARG A 41 -24.887 -25.707 -1.559 1.00 0.00 H ATOM 429 HH12 ARG A 41 -26.752 -28.105 -4.293 1.00 0.00 H ATOM 430 HH11 ARG A 41 -27.702 -26.832 -3.442 1.00 0.00 H ATOM 431 HH22 ARG A 41 -24.516 -28.380 -3.832 1.00 0.00 H ATOM 432 HH21 ARG A 41 -23.707 -27.323 -2.618 1.00 0.00 H ATOM 433 H ARG A 41 -26.677 -22.716 -5.040 1.00 0.00 H ATOM 434 N ASN A 42 -24.571 -20.561 -3.509 1.00 9.98 N ATOM 435 CA ASN A 42 -23.543 -19.591 -3.188 1.00 10.67 C ATOM 436 C ASN A 42 -23.971 -18.181 -3.568 1.00 10.64 C ATOM 437 O ASN A 42 -23.613 -17.224 -2.874 1.00 11.05 O ATOM 438 CB ASN A 42 -22.238 -20.005 -3.855 1.00 14.76 C ATOM 439 CG ASN A 42 -21.533 -21.112 -3.071 1.00 22.30 C ATOM 440 OD1 ASN A 42 -20.841 -20.837 -2.099 1.00 26.30 O ATOM 441 ND2 ASN A 42 -21.756 -22.360 -3.454 1.00 25.79 N ATOM 442 HD22 ASN A 42 -22.350 -22.550 -4.286 1.00 0.00 H ATOM 443 HD21 ASN A 42 -21.337 -23.150 -2.923 1.00 0.00 H ATOM 444 H ASN A 42 -24.437 -21.227 -4.297 1.00 0.00 H ATOM 445 N LEU A 43 -24.774 -18.031 -4.625 1.00 10.65 N ATOM 446 CA LEU A 43 -25.344 -16.721 -4.927 1.00 9.46 C ATOM 447 C LEU A 43 -26.260 -16.263 -3.805 1.00 8.11 C ATOM 448 O LEU A 43 -26.212 -15.104 -3.386 1.00 7.31 O ATOM 449 CB LEU A 43 -26.115 -16.759 -6.247 1.00 9.90 C ATOM 450 CG LEU A 43 -25.319 -16.904 -7.528 1.00 10.98 C ATOM 451 CD1 LEU A 43 -26.271 -17.228 -8.672 1.00 11.72 C ATOM 452 CD2 LEU A 43 -24.522 -15.650 -7.819 1.00 12.11 C ATOM 453 H LEU A 43 -24.993 -18.846 -5.232 1.00 0.00 H ATOM 454 N LEU A 44 -27.132 -17.157 -3.338 1.00 7.98 N ATOM 455 CA LEU A 44 -28.009 -16.851 -2.214 1.00 8.13 C ATOM 456 C LEU A 44 -27.202 -16.372 -1.020 1.00 9.51 C ATOM 457 O LEU A 44 -27.481 -15.318 -0.439 1.00 8.92 O ATOM 458 CB LEU A 44 -28.816 -18.096 -1.844 1.00 7.84 C ATOM 459 CG LEU A 44 -29.785 -17.939 -0.669 1.00 9.09 C ATOM 460 CD1 LEU A 44 -30.943 -17.015 -1.046 1.00 9.92 C ATOM 461 CD2 LEU A 44 -30.287 -19.299 -0.198 1.00 10.09 C ATOM 462 H LEU A 44 -27.188 -18.094 -3.786 1.00 0.00 H ATOM 463 N SER A 45 -26.180 -17.147 -0.648 1.00 9.67 N ATOM 464 CA SER A 45 -25.386 -16.836 0.530 1.00 10.14 C ATOM 465 C SER A 45 -24.633 -15.519 0.363 1.00 10.05 C ATOM 466 O SER A 45 -24.643 -14.669 1.258 1.00 10.73 O ATOM 467 CB SER A 45 -24.412 -17.982 0.797 1.00 11.75 C ATOM 468 OG SER A 45 -23.648 -17.728 1.955 1.00 13.60 O ATOM 469 HG SER A 45 -23.133 -16.892 1.832 1.00 0.00 H ATOM 470 H SER A 45 -25.947 -17.989 -1.212 1.00 0.00 H ATOM 471 N VAL A 46 -23.965 -15.336 -0.778 1.00 9.32 N ATOM 472 CA VAL A 46 -23.221 -14.100 -1.021 1.00 10.32 C ATOM 473 C VAL A 46 -24.142 -12.890 -0.912 1.00 9.75 C ATOM 474 O VAL A 46 -23.789 -11.877 -0.294 1.00 9.84 O ATOM 475 CB VAL A 46 -22.518 -14.168 -2.394 1.00 13.07 C ATOM 476 CG1 VAL A 46 -22.024 -12.790 -2.853 1.00 13.67 C ATOM 477 CG2 VAL A 46 -21.356 -15.132 -2.325 1.00 15.48 C ATOM 478 H VAL A 46 -23.974 -16.081 -1.503 1.00 0.00 H ATOM 479 N ALA A 47 -25.341 -12.978 -1.495 1.00 8.78 N ATOM 480 CA ALA A 47 -26.252 -11.838 -1.494 1.00 7.61 C ATOM 481 C ALA A 47 -26.616 -11.433 -0.075 1.00 7.48 C ATOM 482 O ALA A 47 -26.443 -10.273 0.315 1.00 7.68 O ATOM 483 CB ALA A 47 -27.509 -12.165 -2.291 1.00 7.94 C ATOM 484 H ALA A 47 -25.627 -13.866 -1.953 1.00 0.00 H ATOM 485 N TYR A 48 -27.123 -12.381 0.717 1.00 6.69 N ATOM 486 CA TYR A 48 -27.599 -12.027 2.049 1.00 6.61 C ATOM 487 C TYR A 48 -26.443 -11.718 2.981 1.00 8.37 C ATOM 488 O TYR A 48 -26.578 -10.858 3.853 1.00 9.30 O ATOM 489 CB TYR A 48 -28.495 -13.133 2.613 1.00 6.62 C ATOM 490 CG TYR A 48 -29.912 -13.010 2.103 1.00 7.72 C ATOM 491 CD1 TYR A 48 -30.750 -12.007 2.572 1.00 7.17 C ATOM 492 CD2 TYR A 48 -30.405 -13.867 1.130 1.00 10.44 C ATOM 493 CE1 TYR A 48 -32.042 -11.879 2.111 1.00 8.42 C ATOM 494 CE2 TYR A 48 -31.704 -13.741 0.651 1.00 11.94 C ATOM 495 CZ TYR A 48 -32.517 -12.742 1.145 1.00 11.13 C ATOM 496 OH TYR A 48 -33.812 -12.612 0.681 1.00 11.48 O ATOM 497 HH TYR A 48 -34.250 -11.851 1.138 1.00 0.00 H ATOM 498 H TYR A 48 -27.178 -13.365 0.386 1.00 0.00 H ATOM 499 N LYS A 49 -25.295 -12.377 2.798 1.00 8.88 N ATOM 500 CA LYS A 49 -24.138 -12.064 3.631 1.00 9.67 C ATOM 501 C LYS A 49 -23.726 -10.608 3.461 1.00 8.73 C ATOM 502 O LYS A 49 -23.348 -9.942 4.431 1.00 8.22 O ATOM 503 CB LYS A 49 -22.972 -12.987 3.291 1.00 12.03 C ATOM 504 CG LYS A 49 -21.897 -13.042 4.368 1.00 14.86 C ATOM 505 CD LYS A 49 -22.334 -13.879 5.565 1.00 16.78 C ATOM 506 CE LYS A 49 -22.183 -15.373 5.299 1.00 16.01 C ATOM 507 NZ LYS A 49 -22.872 -16.189 6.341 1.00 13.03 N ATOM 508 HZ1 LYS A 49 -22.461 -15.978 7.273 1.00 0.00 H ATOM 509 HZ2 LYS A 49 -23.886 -15.957 6.347 1.00 0.00 H ATOM 510 HZ3 LYS A 49 -22.748 -17.199 6.127 1.00 0.00 H ATOM 511 H LYS A 49 -25.226 -13.111 2.064 1.00 0.00 H ATOM 512 N ASN A 50 -23.799 -10.092 2.233 1.00 8.63 N ATOM 513 CA ASN A 50 -23.425 -8.705 2.003 1.00 8.44 C ATOM 514 C ASN A 50 -24.458 -7.757 2.586 1.00 8.27 C ATOM 515 O ASN A 50 -24.097 -6.744 3.202 1.00 8.79 O ATOM 516 CB ASN A 50 -23.231 -8.454 0.509 1.00 9.66 C ATOM 517 CG ASN A 50 -21.826 -8.750 0.054 1.00 12.82 C ATOM 518 OD1 ASN A 50 -20.921 -7.937 0.248 1.00 14.99 O ATOM 519 ND2 ASN A 50 -21.626 -9.916 -0.550 1.00 13.30 N ATOM 520 HD22 ASN A 50 -22.421 -10.571 -0.692 1.00 0.00 H ATOM 521 HD21 ASN A 50 -20.674 -10.174 -0.881 1.00 0.00 H ATOM 522 H ASN A 50 -24.123 -10.681 1.440 1.00 0.00 H ATOM 523 N VAL A 51 -25.747 -8.070 2.420 1.00 8.09 N ATOM 524 CA VAL A 51 -26.796 -7.223 2.987 1.00 8.63 C ATOM 525 C VAL A 51 -26.672 -7.168 4.504 1.00 9.15 C ATOM 526 O VAL A 51 -26.613 -6.087 5.103 1.00 9.75 O ATOM 527 CB VAL A 51 -28.190 -7.723 2.562 1.00 8.77 C ATOM 528 CG1 VAL A 51 -29.294 -6.973 3.320 1.00 10.16 C ATOM 529 CG2 VAL A 51 -28.385 -7.559 1.067 1.00 8.06 C ATOM 530 H VAL A 51 -26.006 -8.922 1.883 1.00 0.00 H ATOM 531 N VAL A 52 -26.659 -8.334 5.154 1.00 8.60 N ATOM 532 CA VAL A 52 -26.641 -8.348 6.610 1.00 8.73 C ATOM 533 C VAL A 52 -25.315 -7.813 7.122 1.00 10.17 C ATOM 534 O VAL A 52 -25.255 -7.227 8.208 1.00 10.45 O ATOM 535 CB VAL A 52 -26.942 -9.767 7.135 1.00 9.87 C ATOM 536 CG1 VAL A 52 -25.701 -10.672 7.088 1.00 10.92 C ATOM 537 CG2 VAL A 52 -27.521 -9.708 8.537 1.00 11.07 C ATOM 538 H VAL A 52 -26.662 -9.228 4.623 1.00 0.00 H ATOM 539 N GLY A 53 -24.236 -7.993 6.355 1.00 11.77 N ATOM 540 CA GLY A 53 -22.951 -7.447 6.760 1.00 13.68 C ATOM 541 C GLY A 53 -22.978 -5.938 6.918 1.00 14.61 C ATOM 542 O GLY A 53 -22.454 -5.392 7.893 1.00 15.36 O ATOM 543 H GLY A 53 -24.316 -8.526 5.465 1.00 0.00 H ATOM 544 N GLY A 54 -23.561 -5.240 5.945 1.00 14.70 N ATOM 545 CA GLY A 54 -23.724 -3.801 6.080 1.00 14.18 C ATOM 546 C GLY A 54 -24.561 -3.422 7.290 1.00 12.75 C ATOM 547 O GLY A 54 -24.270 -2.436 7.976 1.00 13.54 O ATOM 548 H GLY A 54 -23.900 -5.724 5.089 1.00 0.00 H ATOM 549 N GLN A 55 -25.610 -4.197 7.569 1.00 9.60 N ATOM 550 CA GLN A 55 -26.458 -3.916 8.723 1.00 9.04 C ATOM 551 C GLN A 55 -25.721 -4.168 10.036 1.00 9.03 C ATOM 552 O GLN A 55 -25.880 -3.407 10.997 1.00 9.55 O ATOM 553 CB GLN A 55 -27.726 -4.767 8.668 1.00 10.50 C ATOM 554 CG GLN A 55 -28.589 -4.527 7.443 1.00 12.20 C ATOM 555 CD GLN A 55 -29.731 -5.515 7.339 1.00 13.61 C ATOM 556 OE1 GLN A 55 -29.564 -6.708 7.575 1.00 12.88 O ATOM 557 NE2 GLN A 55 -30.908 -5.014 7.010 1.00 15.59 N ATOM 558 HE22 GLN A 55 -31.005 -3.996 6.818 1.00 0.00 H ATOM 559 HE21 GLN A 55 -31.738 -5.637 6.943 1.00 0.00 H ATOM 560 H GLN A 55 -25.826 -5.010 6.958 1.00 0.00 H ATOM 561 N ARG A 56 -24.951 -5.256 10.114 1.00 8.60 N ATOM 562 CA ARG A 56 -24.182 -5.535 11.324 1.00 8.69 C ATOM 563 C ARG A 56 -23.173 -4.429 11.590 1.00 9.63 C ATOM 564 O ARG A 56 -23.032 -3.958 12.720 1.00 9.62 O ATOM 565 CB ARG A 56 -23.468 -6.880 11.185 1.00 9.68 C ATOM 566 CG ARG A 56 -24.404 -8.079 11.086 1.00 10.27 C ATOM 567 CD ARG A 56 -23.679 -9.302 10.573 1.00 11.17 C ATOM 568 NE ARG A 56 -22.793 -9.878 11.580 1.00 12.46 N ATOM 569 CZ ARG A 56 -21.725 -10.629 11.313 1.00 13.47 C ATOM 570 NH1 ARG A 56 -21.365 -10.885 10.058 1.00 12.85 N ATOM 571 NH2 ARG A 56 -21.002 -11.122 12.310 1.00 13.92 N ATOM 572 HE ARG A 56 -23.011 -9.688 12.579 1.00 0.00 H ATOM 573 HH12 ARG A 56 -20.529 -11.473 9.867 1.00 0.00 H ATOM 574 HH11 ARG A 56 -21.920 -10.497 9.268 1.00 0.00 H ATOM 575 HH22 ARG A 56 -20.168 -11.709 12.107 1.00 0.00 H ATOM 576 HH21 ARG A 56 -21.270 -10.922 13.295 1.00 0.00 H ATOM 577 H ARG A 56 -24.898 -5.910 9.307 1.00 0.00 H ATOM 578 N ALA A 57 -22.469 -3.992 10.552 1.00 11.07 N ATOM 579 CA ALA A 57 -21.489 -2.927 10.723 1.00 11.99 C ATOM 580 C ALA A 57 -22.152 -1.633 11.186 1.00 11.90 C ATOM 581 O ALA A 57 -21.639 -0.956 12.084 1.00 12.28 O ATOM 582 CB ALA A 57 -20.723 -2.713 9.415 1.00 12.29 C ATOM 583 H ALA A 57 -22.618 -4.412 9.612 1.00 0.00 H ATOM 584 N ALA A 58 -23.297 -1.276 10.592 1.00 10.70 N ATOM 585 CA ALA A 58 -24.024 -0.084 11.026 1.00 10.84 C ATOM 586 C ALA A 58 -24.508 -0.227 12.462 1.00 10.37 C ATOM 587 O ALA A 58 -24.426 0.721 13.252 1.00 10.79 O ATOM 588 CB ALA A 58 -25.207 0.172 10.091 1.00 11.24 C ATOM 589 H ALA A 58 -23.674 -1.853 9.813 1.00 0.00 H ATOM 590 N TRP A 59 -25.026 -1.406 12.813 1.00 10.77 N ATOM 591 CA TRP A 59 -25.535 -1.627 14.162 1.00 12.10 C ATOM 592 C TRP A 59 -24.431 -1.463 15.201 1.00 12.36 C ATOM 593 O TRP A 59 -24.659 -0.899 16.276 1.00 12.97 O ATOM 594 CB TRP A 59 -26.163 -3.019 14.250 1.00 12.38 C ATOM 595 CG TRP A 59 -26.782 -3.311 15.586 1.00 11.62 C ATOM 596 CD1 TRP A 59 -28.074 -3.111 15.940 1.00 10.84 C ATOM 597 CD2 TRP A 59 -26.130 -3.864 16.733 1.00 11.80 C ATOM 598 NE1 TRP A 59 -28.277 -3.494 17.242 1.00 10.76 N ATOM 599 CE2 TRP A 59 -27.097 -3.960 17.753 1.00 11.80 C ATOM 600 CE3 TRP A 59 -24.822 -4.281 17.000 1.00 12.29 C ATOM 601 CZ2 TRP A 59 -26.803 -4.454 19.015 1.00 12.86 C ATOM 602 CZ3 TRP A 59 -24.531 -4.778 18.257 1.00 12.83 C ATOM 603 CH2 TRP A 59 -25.518 -4.859 19.249 1.00 13.33 C ATOM 604 HE1 TRP A 59 -29.180 -3.439 17.756 1.00 0.00 H ATOM 605 H TRP A 59 -25.067 -2.177 12.116 1.00 0.00 H ATOM 606 N ARG A 60 -23.223 -1.943 14.901 1.00 11.67 N ATOM 607 CA ARG A 60 -22.136 -1.833 15.870 1.00 12.83 C ATOM 608 C ARG A 60 -21.696 -0.384 16.051 1.00 13.03 C ATOM 609 O ARG A 60 -21.403 0.045 17.174 1.00 12.77 O ATOM 610 CB ARG A 60 -20.955 -2.703 15.442 1.00 14.10 C ATOM 611 CG ARG A 60 -21.278 -4.190 15.433 1.00 14.36 C ATOM 612 CD ARG A 60 -20.021 -5.037 15.369 1.00 14.93 C ATOM 613 NE ARG A 60 -19.210 -4.766 14.184 1.00 16.40 N ATOM 614 CZ ARG A 60 -19.348 -5.382 13.012 1.00 17.48 C ATOM 615 NH1 ARG A 60 -20.282 -6.307 12.834 1.00 17.07 N ATOM 616 NH2 ARG A 60 -18.547 -5.069 12.007 1.00 18.87 N ATOM 617 HE ARG A 60 -18.471 -4.039 14.262 1.00 0.00 H ATOM 618 HH12 ARG A 60 -20.377 -6.779 11.912 1.00 0.00 H ATOM 619 HH11 ARG A 60 -20.919 -6.560 13.616 1.00 0.00 H ATOM 620 HH22 ARG A 60 -18.652 -5.548 11.090 1.00 0.00 H ATOM 621 HH21 ARG A 60 -17.812 -4.344 12.134 1.00 0.00 H ATOM 622 H ARG A 60 -23.056 -2.394 13.979 1.00 0.00 H ATOM 623 N VAL A 61 -21.620 0.378 14.958 1.00 12.45 N ATOM 624 CA VAL A 61 -21.353 1.812 15.064 1.00 12.22 C ATOM 625 C VAL A 61 -22.358 2.459 16.001 1.00 12.13 C ATOM 626 O VAL A 61 -21.994 3.142 16.968 1.00 13.81 O ATOM 627 CB VAL A 61 -21.391 2.468 13.670 1.00 12.44 C ATOM 628 CG1 VAL A 61 -21.393 3.993 13.774 1.00 13.11 C ATOM 629 CG2 VAL A 61 -20.207 2.008 12.847 1.00 13.50 C ATOM 630 H VAL A 61 -21.752 -0.053 14.021 1.00 0.00 H ATOM 631 N LEU A 62 -23.643 2.252 15.721 1.00 9.97 N ATOM 632 CA LEU A 62 -24.694 2.905 16.488 1.00 11.21 C ATOM 633 C LEU A 62 -24.702 2.433 17.932 1.00 13.93 C ATOM 634 O LEU A 62 -24.890 3.239 18.854 1.00 15.96 O ATOM 635 CB LEU A 62 -26.046 2.648 15.827 1.00 10.73 C ATOM 636 CG LEU A 62 -26.159 3.223 14.422 1.00 11.34 C ATOM 637 CD1 LEU A 62 -27.479 2.799 13.806 1.00 12.89 C ATOM 638 CD2 LEU A 62 -26.051 4.738 14.435 1.00 11.16 C ATOM 639 H LEU A 62 -23.900 1.613 14.942 1.00 0.00 H ATOM 640 N SER A 63 -24.508 1.131 18.149 1.00 14.22 N ATOM 641 CA SER A 63 -24.474 0.608 19.509 1.00 14.67 C ATOM 642 C SER A 63 -23.322 1.217 20.296 1.00 14.69 C ATOM 643 O SER A 63 -23.475 1.556 21.479 1.00 14.11 O ATOM 644 CB SER A 63 -24.364 -0.918 19.473 1.00 14.79 C ATOM 645 OG SER A 63 -24.417 -1.455 20.781 1.00 15.24 O ATOM 646 HG SER A 63 -25.277 -1.206 21.204 1.00 0.00 H ATOM 647 H SER A 63 -24.380 0.486 17.343 1.00 0.00 H ATOM 648 N SER A 64 -22.161 1.370 19.655 1.00 14.51 N ATOM 649 CA SER A 64 -21.022 1.995 20.314 1.00 19.13 C ATOM 650 C SER A 64 -21.337 3.435 20.706 1.00 18.39 C ATOM 651 O SER A 64 -21.013 3.871 21.818 1.00 19.00 O ATOM 652 CB SER A 64 -19.804 1.946 19.395 1.00 25.84 C ATOM 653 OG SER A 64 -18.704 2.618 19.982 1.00 32.55 O ATOM 654 HG SER A 64 -18.474 2.184 20.841 1.00 0.00 H ATOM 655 H SER A 64 -22.069 1.039 18.673 1.00 0.00 H ATOM 656 N ILE A 65 -21.957 4.191 19.800 1.00 17.12 N ATOM 657 CA ILE A 65 -22.362 5.559 20.117 1.00 17.13 C ATOM 658 C ILE A 65 -23.364 5.558 21.263 1.00 18.78 C ATOM 659 O ILE A 65 -23.260 6.358 22.206 1.00 21.24 O ATOM 660 CB ILE A 65 -22.939 6.239 18.862 1.00 15.09 C ATOM 661 CG1 ILE A 65 -21.867 6.357 17.782 1.00 14.44 C ATOM 662 CG2 ILE A 65 -23.529 7.614 19.204 1.00 14.49 C ATOM 663 CD1 ILE A 65 -22.395 6.814 16.438 1.00 14.42 C ATOM 664 H ILE A 65 -22.155 3.803 18.856 1.00 0.00 H ATOM 665 N GLU A 66 -24.352 4.663 21.198 1.00 17.69 N ATOM 666 CA GLU A 66 -25.363 4.587 22.245 1.00 18.57 C ATOM 667 C GLU A 66 -24.716 4.361 23.605 1.00 23.37 C ATOM 668 O GLU A 66 -25.010 5.068 24.574 1.00 25.68 O ATOM 669 CB GLU A 66 -26.348 3.465 21.925 1.00 16.64 C ATOM 670 CG GLU A 66 -27.634 3.494 22.727 1.00 16.98 C ATOM 671 CD GLU A 66 -28.525 2.319 22.411 1.00 18.19 C ATOM 672 OE1 GLU A 66 -28.078 1.453 21.641 1.00 19.20 O ATOM 673 OE2 GLU A 66 -29.660 2.251 22.938 1.00 18.51 O ATOM 674 H GLU A 66 -24.401 4.011 20.389 1.00 0.00 H ATOM 675 N GLN A 67 -23.815 3.382 23.691 1.00 23.22 N ATOM 676 CA GLN A 67 -23.196 3.063 24.972 1.00 28.71 C ATOM 677 C GLN A 67 -22.360 4.230 25.487 1.00 30.34 C ATOM 678 O GLN A 67 -22.379 4.534 26.687 1.00 33.85 O ATOM 679 CB GLN A 67 -22.348 1.797 24.839 1.00 35.49 C ATOM 680 CG GLN A 67 -23.150 0.544 24.488 1.00 46.76 C ATOM 681 CD GLN A 67 -24.320 0.300 25.427 1.00 59.01 C ATOM 682 OE1 GLN A 67 -24.184 0.396 26.648 1.00 65.56 O ATOM 683 NE2 GLN A 67 -25.483 -0.011 24.857 1.00 61.04 N ATOM 684 HE22 GLN A 67 -25.552 -0.081 23.822 1.00 0.00 H ATOM 685 HE21 GLN A 67 -26.322 -0.184 25.447 1.00 0.00 H ATOM 686 H GLN A 67 -23.553 2.844 22.841 1.00 0.00 H ATOM 687 N LYS A 68 -21.622 4.901 24.600 1.00 29.85 N ATOM 688 CA LYS A 68 -20.901 6.101 25.013 1.00 33.57 C ATOM 689 C LYS A 68 -21.859 7.150 25.562 1.00 35.59 C ATOM 690 O LYS A 68 -21.578 7.781 26.587 1.00 38.88 O ATOM 691 CB LYS A 68 -20.101 6.674 23.843 1.00 40.08 C ATOM 692 CG LYS A 68 -18.978 5.770 23.343 1.00 50.42 C ATOM 693 CD LYS A 68 -18.262 6.379 22.133 1.00 58.35 C ATOM 694 CE LYS A 68 -17.777 5.320 21.143 1.00 60.91 C ATOM 695 NZ LYS A 68 -18.518 5.381 19.845 1.00 60.24 N ATOM 696 HZ1 LYS A 68 -19.531 5.223 20.018 1.00 0.00 H ATOM 697 HZ2 LYS A 68 -18.380 6.317 19.412 1.00 0.00 H ATOM 698 HZ3 LYS A 68 -18.156 4.645 19.205 1.00 0.00 H ATOM 699 H LYS A 68 -21.561 4.569 23.616 1.00 0.00 H ATOM 700 N SER A 69 -22.999 7.347 24.898 1.00 36.94 N ATOM 701 CA SER A 69 -23.957 8.356 25.332 1.00 42.61 C ATOM 702 C SER A 69 -24.705 7.950 26.595 1.00 46.67 C ATOM 703 O SER A 69 -25.457 8.769 27.137 1.00 47.56 O ATOM 704 CB SER A 69 -24.958 8.651 24.212 1.00 45.03 C ATOM 705 OG SER A 69 -25.929 7.625 24.111 1.00 47.48 O ATOM 706 HG SER A 69 -25.479 6.765 23.916 1.00 0.00 H ATOM 707 H SER A 69 -23.208 6.771 24.057 1.00 0.00 H ATOM 708 N ASN A 70 -24.525 6.721 27.069 1.00 48.13 N ATOM 709 CA ASN A 70 -25.082 6.294 28.349 1.00 52.22 C ATOM 710 C ASN A 70 -23.977 6.263 29.400 1.00 57.90 C ATOM 711 O ASN A 70 -24.178 6.684 30.538 1.00 62.42 O ATOM 712 CB ASN A 70 -25.739 4.915 28.238 1.00 50.39 C ATOM 713 CG ASN A 70 -26.931 4.904 27.296 1.00 47.86 C ATOM 714 OD1 ASN A 70 -27.596 5.923 27.101 1.00 49.48 O ATOM 715 ND2 ASN A 70 -27.209 3.743 26.708 1.00 43.82 N ATOM 716 HD22 ASN A 70 -26.620 2.908 26.902 1.00 0.00 H ATOM 717 HD21 ASN A 70 -28.015 3.671 26.055 1.00 0.00 H ATOM 718 H ASN A 70 -23.970 6.042 26.510 1.00 0.00 H TER 719 ASN A 70 ATOM 720 N GLY A 78 -31.218 12.559 24.733 1.00 29.95 N ATOM 721 CA GLY A 78 -32.417 12.338 23.950 1.00 25.58 C ATOM 722 C GLY A 78 -32.483 10.942 23.365 1.00 19.54 C ATOM 723 O GLY A 78 -31.506 10.193 23.422 1.00 17.75 O ATOM 724 HN3 GLY A 78 -30.382 12.426 24.129 1.00 0.00 H ATOM 725 HN2 GLY A 78 -31.190 11.881 25.521 1.00 0.00 H ATOM 726 HN1 GLY A 78 -31.225 13.529 25.109 1.00 0.00 H ATOM 727 N PRO A 79 -33.636 10.591 22.798 1.00 17.29 N ATOM 728 CA PRO A 79 -33.898 9.208 22.380 1.00 14.92 C ATOM 729 C PRO A 79 -33.384 8.838 20.999 1.00 13.34 C ATOM 730 O PRO A 79 -33.545 7.681 20.599 1.00 11.83 O ATOM 731 CB PRO A 79 -35.433 9.158 22.402 1.00 15.79 C ATOM 732 CG PRO A 79 -35.838 10.546 21.998 1.00 17.56 C ATOM 733 CD PRO A 79 -34.792 11.472 22.557 1.00 17.77 C ATOM 734 N GLU A 80 -32.773 9.777 20.274 1.00 13.18 N ATOM 735 CA GLU A 80 -32.527 9.577 18.849 1.00 12.74 C ATOM 736 C GLU A 80 -31.533 8.450 18.591 1.00 11.77 C ATOM 737 O GLU A 80 -31.724 7.660 17.664 1.00 10.90 O ATOM 738 CB GLU A 80 -32.041 10.876 18.218 1.00 13.83 C ATOM 739 CG GLU A 80 -33.129 11.940 18.082 1.00 14.30 C ATOM 740 CD GLU A 80 -33.259 12.833 19.300 1.00 16.34 C ATOM 741 OE1 GLU A 80 -32.545 12.606 20.299 1.00 16.07 O ATOM 742 OE2 GLU A 80 -34.074 13.784 19.252 1.00 18.27 O ATOM 743 H GLU A 80 -32.469 10.661 20.729 1.00 0.00 H ATOM 744 N VAL A 81 -30.456 8.362 19.377 1.00 13.59 N ATOM 745 CA VAL A 81 -29.487 7.292 19.154 1.00 15.14 C ATOM 746 C VAL A 81 -30.151 5.935 19.350 1.00 12.69 C ATOM 747 O VAL A 81 -30.048 5.044 18.500 1.00 11.88 O ATOM 748 CB VAL A 81 -28.262 7.458 20.075 1.00 21.04 C ATOM 749 CG1 VAL A 81 -27.282 6.311 19.846 1.00 26.30 C ATOM 750 CG2 VAL A 81 -27.569 8.779 19.818 1.00 20.55 C ATOM 751 H VAL A 81 -30.309 9.051 20.142 1.00 0.00 H ATOM 752 N ARG A 82 -30.831 5.747 20.484 1.00 11.25 N ATOM 753 CA ARG A 82 -31.532 4.486 20.709 1.00 10.29 C ATOM 754 C ARG A 82 -32.541 4.208 19.603 1.00 9.26 C ATOM 755 O ARG A 82 -32.665 3.070 19.143 1.00 9.63 O ATOM 756 CB ARG A 82 -32.244 4.499 22.065 1.00 13.16 C ATOM 757 CG ARG A 82 -33.181 3.295 22.254 1.00 18.71 C ATOM 758 CD ARG A 82 -33.981 3.356 23.541 1.00 26.28 C ATOM 759 NE ARG A 82 -34.814 4.554 23.626 1.00 33.65 N ATOM 760 CZ ARG A 82 -35.955 4.734 22.962 1.00 36.68 C ATOM 761 NH1 ARG A 82 -36.417 3.799 22.144 1.00 38.33 N ATOM 762 NH2 ARG A 82 -36.638 5.861 23.119 1.00 35.82 N ATOM 763 HE ARG A 82 -34.493 5.322 24.250 1.00 0.00 H ATOM 764 HH12 ARG A 82 -37.309 3.951 21.631 1.00 0.00 H ATOM 765 HH11 ARG A 82 -35.888 2.913 22.015 1.00 0.00 H ATOM 766 HH22 ARG A 82 -37.529 6.005 22.602 1.00 0.00 H ATOM 767 HH21 ARG A 82 -36.282 6.600 23.759 1.00 0.00 H ATOM 768 H ARG A 82 -30.861 6.496 21.205 1.00 0.00 H ATOM 769 N GLU A 83 -33.297 5.226 19.184 1.00 9.26 N ATOM 770 CA GLU A 83 -34.329 5.013 18.173 1.00 9.17 C ATOM 771 C GLU A 83 -33.729 4.509 16.873 1.00 9.29 C ATOM 772 O GLU A 83 -34.256 3.574 16.253 1.00 8.53 O ATOM 773 CB GLU A 83 -35.094 6.311 17.915 1.00 9.81 C ATOM 774 CG GLU A 83 -36.052 6.670 19.003 1.00 11.62 C ATOM 775 CD GLU A 83 -36.641 8.062 18.845 1.00 13.53 C ATOM 776 OE1 GLU A 83 -36.200 8.803 17.935 1.00 13.72 O ATOM 777 OE2 GLU A 83 -37.555 8.406 19.624 1.00 14.06 O ATOM 778 H GLU A 83 -33.150 6.176 19.580 1.00 0.00 H ATOM 779 N TYR A 84 -32.626 5.121 16.443 1.00 10.24 N ATOM 780 CA TYR A 84 -32.049 4.767 15.154 1.00 10.94 C ATOM 781 C TYR A 84 -31.337 3.419 15.232 1.00 10.76 C ATOM 782 O TYR A 84 -31.402 2.618 14.290 1.00 10.54 O ATOM 783 CB TYR A 84 -31.108 5.883 14.679 1.00 10.39 C ATOM 784 CG TYR A 84 -30.578 5.642 13.278 1.00 9.88 C ATOM 785 CD1 TYR A 84 -31.432 5.268 12.262 1.00 8.93 C ATOM 786 CD2 TYR A 84 -29.229 5.762 12.986 1.00 11.19 C ATOM 787 CE1 TYR A 84 -30.964 5.012 10.998 1.00 9.47 C ATOM 788 CE2 TYR A 84 -28.751 5.514 11.724 1.00 11.76 C ATOM 789 CZ TYR A 84 -29.623 5.138 10.730 1.00 11.19 C ATOM 790 OH TYR A 84 -29.156 4.885 9.459 1.00 12.16 O ATOM 791 HH TYR A 84 -29.913 4.629 8.875 1.00 0.00 H ATOM 792 H TYR A 84 -32.176 5.853 17.029 1.00 0.00 H ATOM 793 N ARG A 85 -30.678 3.137 16.359 1.00 10.32 N ATOM 794 CA ARG A 85 -30.121 1.804 16.568 1.00 10.58 C ATOM 795 C ARG A 85 -31.213 0.738 16.488 1.00 10.27 C ATOM 796 O ARG A 85 -31.019 -0.317 15.866 1.00 9.15 O ATOM 797 CB ARG A 85 -29.402 1.749 17.916 1.00 11.27 C ATOM 798 CG ARG A 85 -28.567 0.494 18.139 1.00 11.82 C ATOM 799 CD ARG A 85 -29.359 -0.582 18.876 1.00 12.40 C ATOM 800 NE ARG A 85 -29.799 -0.099 20.185 1.00 14.63 N ATOM 801 CZ ARG A 85 -30.856 -0.554 20.848 1.00 17.18 C ATOM 802 NH1 ARG A 85 -31.597 -1.532 20.351 1.00 18.91 N ATOM 803 NH2 ARG A 85 -31.175 -0.022 22.013 1.00 17.48 N ATOM 804 HE ARG A 85 -29.242 0.658 20.630 1.00 0.00 H ATOM 805 HH12 ARG A 85 -32.422 -1.879 20.880 1.00 0.00 H ATOM 806 HH11 ARG A 85 -31.354 -1.953 19.432 1.00 0.00 H ATOM 807 HH22 ARG A 85 -32.002 -0.374 22.537 1.00 0.00 H ATOM 808 HH21 ARG A 85 -30.600 0.749 22.407 1.00 0.00 H ATOM 809 H ARG A 85 -30.561 3.869 17.089 1.00 0.00 H ATOM 810 N GLU A 86 -32.368 1.002 17.113 1.00 10.62 N ATOM 811 CA GLU A 86 -33.499 0.079 17.043 1.00 10.98 C ATOM 812 C GLU A 86 -33.995 -0.088 15.612 1.00 10.02 C ATOM 813 O GLU A 86 -34.353 -1.198 15.197 1.00 9.96 O ATOM 814 CB GLU A 86 -34.640 0.574 17.937 1.00 12.95 C ATOM 815 CG GLU A 86 -34.346 0.556 19.431 1.00 15.68 C ATOM 816 CD GLU A 86 -35.483 1.143 20.257 1.00 20.43 C ATOM 817 OE1 GLU A 86 -35.606 0.783 21.447 1.00 24.38 O ATOM 818 OE2 GLU A 86 -36.257 1.962 19.719 1.00 23.90 O ATOM 819 H GLU A 86 -32.462 1.882 17.659 1.00 0.00 H ATOM 820 N LYS A 87 -34.049 1.005 14.851 1.00 9.60 N ATOM 821 CA LYS A 87 -34.470 0.921 13.454 1.00 11.00 C ATOM 822 C LYS A 87 -33.571 -0.028 12.675 1.00 9.75 C ATOM 823 O LYS A 87 -34.053 -0.933 11.986 1.00 9.79 O ATOM 824 CB LYS A 87 -34.458 2.310 12.813 1.00 15.38 C ATOM 825 CG LYS A 87 -34.824 2.320 11.315 1.00 21.59 C ATOM 826 CD LYS A 87 -34.512 3.662 10.656 1.00 28.12 C ATOM 827 CE LYS A 87 -34.669 3.593 9.140 1.00 33.68 C ATOM 828 NZ LYS A 87 -35.165 4.883 8.577 1.00 37.53 N ATOM 829 HZ1 LYS A 87 -36.091 5.108 8.993 1.00 0.00 H ATOM 830 HZ2 LYS A 87 -34.489 5.641 8.802 1.00 0.00 H ATOM 831 HZ3 LYS A 87 -35.259 4.796 7.545 1.00 0.00 H ATOM 832 H LYS A 87 -33.789 1.927 15.256 1.00 0.00 H ATOM 833 N VAL A 88 -32.252 0.175 12.767 1.00 9.67 N ATOM 834 CA VAL A 88 -31.312 -0.691 12.065 1.00 9.52 C ATOM 835 C VAL A 88 -31.417 -2.111 12.588 1.00 9.68 C ATOM 836 O VAL A 88 -31.379 -3.080 11.819 1.00 10.38 O ATOM 837 CB VAL A 88 -29.880 -0.150 12.207 1.00 9.53 C ATOM 838 CG1 VAL A 88 -28.869 -1.120 11.565 1.00 10.60 C ATOM 839 CG2 VAL A 88 -29.784 1.219 11.570 1.00 9.13 C ATOM 840 H VAL A 88 -31.892 0.960 13.346 1.00 0.00 H ATOM 841 N GLU A 89 -31.519 -2.256 13.907 1.00 9.18 N ATOM 842 CA GLU A 89 -31.632 -3.575 14.510 1.00 10.28 C ATOM 843 C GLU A 89 -32.859 -4.310 13.981 1.00 10.79 C ATOM 844 O GLU A 89 -32.796 -5.500 13.653 1.00 10.08 O ATOM 845 CB GLU A 89 -31.687 -3.410 16.024 1.00 11.62 C ATOM 846 CG GLU A 89 -31.816 -4.678 16.799 1.00 13.31 C ATOM 847 CD GLU A 89 -31.753 -4.417 18.280 1.00 14.92 C ATOM 848 OE1 GLU A 89 -30.746 -3.833 18.752 1.00 13.59 O ATOM 849 OE2 GLU A 89 -32.715 -4.795 18.967 1.00 16.90 O ATOM 850 H GLU A 89 -31.518 -1.413 14.516 1.00 0.00 H ATOM 851 N THR A 90 -33.984 -3.608 13.871 1.00 12.76 N ATOM 852 CA THR A 90 -35.204 -4.250 13.402 1.00 12.47 C ATOM 853 C THR A 90 -35.077 -4.665 11.943 1.00 10.38 C ATOM 854 O THR A 90 -35.577 -5.725 11.546 1.00 9.69 O ATOM 855 CB THR A 90 -36.380 -3.296 13.621 1.00 14.86 C ATOM 856 OG1 THR A 90 -36.515 -3.044 15.024 1.00 14.35 O ATOM 857 CG2 THR A 90 -37.678 -3.880 13.092 1.00 17.17 C ATOM 858 HG1 THR A 90 -35.681 -2.634 15.366 1.00 0.00 H ATOM 859 H THR A 90 -33.992 -2.598 14.121 1.00 0.00 H ATOM 860 N GLU A 91 -34.409 -3.847 11.128 1.00 9.48 N ATOM 861 CA GLU A 91 -34.205 -4.214 9.731 1.00 10.04 C ATOM 862 C GLU A 91 -33.274 -5.410 9.611 1.00 9.78 C ATOM 863 O GLU A 91 -33.498 -6.287 8.771 1.00 8.78 O ATOM 864 CB GLU A 91 -33.660 -3.026 8.944 1.00 10.92 C ATOM 865 CG GLU A 91 -34.750 -2.102 8.445 1.00 11.91 C ATOM 866 CD GLU A 91 -34.225 -0.787 7.914 1.00 14.73 C ATOM 867 OE1 GLU A 91 -34.921 0.236 8.101 1.00 15.42 O ATOM 868 OE2 GLU A 91 -33.130 -0.773 7.309 1.00 14.67 O ATOM 869 H GLU A 91 -34.033 -2.947 11.489 1.00 0.00 H ATOM 870 N LEU A 92 -32.237 -5.462 10.452 1.00 9.29 N ATOM 871 CA LEU A 92 -31.329 -6.602 10.497 1.00 9.78 C ATOM 872 C LEU A 92 -32.070 -7.872 10.876 1.00 9.42 C ATOM 873 O LEU A 92 -31.872 -8.929 10.264 1.00 9.06 O ATOM 874 CB LEU A 92 -30.211 -6.308 11.504 1.00 11.40 C ATOM 875 CG LEU A 92 -29.049 -7.292 11.727 1.00 13.64 C ATOM 876 CD1 LEU A 92 -27.873 -6.551 12.341 1.00 15.11 C ATOM 877 CD2 LEU A 92 -29.434 -8.443 12.640 1.00 13.79 C ATOM 878 H LEU A 92 -32.072 -4.662 11.096 1.00 0.00 H ATOM 879 N GLN A 93 -32.919 -7.791 11.902 1.00 9.04 N ATOM 880 CA GLN A 93 -33.700 -8.948 12.316 1.00 9.86 C ATOM 881 C GLN A 93 -34.652 -9.384 11.210 1.00 10.72 C ATOM 882 O GLN A 93 -34.870 -10.582 11.006 1.00 10.93 O ATOM 883 CB GLN A 93 -34.456 -8.619 13.604 1.00 11.46 C ATOM 884 CG GLN A 93 -33.543 -8.455 14.802 1.00 13.26 C ATOM 885 CD GLN A 93 -34.236 -7.803 15.978 1.00 15.52 C ATOM 886 OE1 GLN A 93 -35.118 -6.960 15.804 1.00 15.35 O ATOM 887 NE2 GLN A 93 -33.840 -8.192 17.186 1.00 16.40 N ATOM 888 HE22 GLN A 93 -33.091 -8.907 17.282 1.00 0.00 H ATOM 889 HE21 GLN A 93 -34.279 -7.781 18.035 1.00 0.00 H ATOM 890 H GLN A 93 -33.024 -6.891 12.412 1.00 0.00 H ATOM 891 N GLY A 94 -35.210 -8.427 10.468 1.00 12.45 N ATOM 892 CA GLY A 94 -36.075 -8.779 9.355 1.00 11.83 C ATOM 893 C GLY A 94 -35.353 -9.553 8.270 1.00 10.90 C ATOM 894 O GLY A 94 -35.899 -10.503 7.708 1.00 12.15 O ATOM 895 H GLY A 94 -35.026 -7.427 10.686 1.00 0.00 H ATOM 896 N VAL A 95 -34.122 -9.149 7.950 1.00 9.38 N ATOM 897 CA VAL A 95 -33.330 -9.882 6.967 1.00 9.80 C ATOM 898 C VAL A 95 -33.035 -11.289 7.478 1.00 8.37 C ATOM 899 O VAL A 95 -33.218 -12.278 6.764 1.00 7.60 O ATOM 900 CB VAL A 95 -32.040 -9.108 6.629 1.00 11.92 C ATOM 901 CG1 VAL A 95 -31.031 -9.983 5.866 1.00 13.28 C ATOM 902 CG2 VAL A 95 -32.363 -7.886 5.794 1.00 12.65 C ATOM 903 H VAL A 95 -33.723 -8.303 8.406 1.00 0.00 H ATOM 904 N CYS A 96 -32.618 -11.404 8.738 1.00 9.57 N ATOM 905 CA CYS A 96 -32.345 -12.726 9.299 1.00 10.18 C ATOM 906 C CYS A 96 -33.592 -13.600 9.278 1.00 11.09 C ATOM 907 O CYS A 96 -33.519 -14.790 8.951 1.00 11.82 O ATOM 908 CB CYS A 96 -31.821 -12.603 10.727 1.00 9.77 C ATOM 909 SG CYS A 96 -30.173 -11.888 10.860 1.00 10.52 S ATOM 910 H CYS A 96 -32.487 -10.554 9.322 1.00 0.00 H ATOM 911 N ASP A 97 -34.740 -13.033 9.655 1.00 10.30 N ATOM 912 CA ASP A 97 -35.990 -13.791 9.629 1.00 11.82 C ATOM 913 C ASP A 97 -36.346 -14.222 8.212 1.00 9.79 C ATOM 914 O ASP A 97 -36.872 -15.319 8.005 1.00 8.81 O ATOM 915 CB ASP A 97 -37.125 -12.962 10.228 1.00 17.89 C ATOM 916 CG ASP A 97 -37.012 -12.812 11.733 1.00 24.31 C ATOM 917 OD1 ASP A 97 -36.254 -13.585 12.359 1.00 25.49 O ATOM 918 OD2 ASP A 97 -37.700 -11.927 12.290 1.00 27.18 O ATOM 919 H ASP A 97 -34.745 -12.042 9.970 1.00 0.00 H ATOM 920 N THR A 98 -36.074 -13.369 7.227 1.00 11.10 N ATOM 921 CA THR A 98 -36.340 -13.727 5.834 1.00 12.13 C ATOM 922 C THR A 98 -35.519 -14.941 5.413 1.00 10.38 C ATOM 923 O THR A 98 -36.042 -15.881 4.801 1.00 9.29 O ATOM 924 CB THR A 98 -36.033 -12.529 4.931 1.00 14.50 C ATOM 925 OG1 THR A 98 -36.987 -11.490 5.179 1.00 15.07 O ATOM 926 CG2 THR A 98 -36.070 -12.909 3.450 1.00 16.18 C ATOM 927 HG1 THR A 98 -36.932 -11.212 6.128 1.00 0.00 H ATOM 928 H THR A 98 -35.668 -12.438 7.450 1.00 0.00 H ATOM 929 N VAL A 99 -34.224 -14.933 5.732 1.00 10.57 N ATOM 930 CA VAL A 99 -33.345 -16.037 5.351 1.00 9.87 C ATOM 931 C VAL A 99 -33.760 -17.314 6.067 1.00 8.53 C ATOM 932 O VAL A 99 -33.839 -18.390 5.464 1.00 8.49 O ATOM 933 CB VAL A 99 -31.877 -15.681 5.651 1.00 10.30 C ATOM 934 CG1 VAL A 99 -30.975 -16.879 5.439 1.00 10.10 C ATOM 935 CG2 VAL A 99 -31.418 -14.523 4.783 1.00 11.51 C ATOM 936 H VAL A 99 -33.833 -14.127 6.261 1.00 0.00 H ATOM 937 N LEU A 100 -34.025 -17.213 7.368 1.00 7.07 N ATOM 938 CA LEU A 100 -34.472 -18.377 8.120 1.00 7.68 C ATOM 939 C LEU A 100 -35.789 -18.910 7.581 1.00 9.50 C ATOM 940 O LEU A 100 -36.004 -20.128 7.569 1.00 9.48 O ATOM 941 CB LEU A 100 -34.588 -18.021 9.605 1.00 7.73 C ATOM 942 CG LEU A 100 -33.233 -17.667 10.237 1.00 8.66 C ATOM 943 CD1 LEU A 100 -33.393 -17.018 11.597 1.00 10.54 C ATOM 944 CD2 LEU A 100 -32.362 -18.919 10.357 1.00 7.93 C ATOM 945 H LEU A 100 -33.912 -16.298 7.849 1.00 0.00 H ATOM 946 N GLY A 101 -36.663 -18.021 7.105 1.00 11.43 N ATOM 947 CA GLY A 101 -37.907 -18.464 6.491 1.00 11.73 C ATOM 948 C GLY A 101 -37.692 -19.258 5.217 1.00 11.49 C ATOM 949 O GLY A 101 -38.398 -20.239 4.963 1.00 12.99 O ATOM 950 H GLY A 101 -36.454 -17.004 7.173 1.00 0.00 H ATOM 951 N LEU A 102 -36.732 -18.834 4.390 1.00 9.10 N ATOM 952 CA LEU A 102 -36.412 -19.573 3.171 1.00 9.50 C ATOM 953 C LEU A 102 -35.821 -20.934 3.496 1.00 10.44 C ATOM 954 O LEU A 102 -36.129 -21.931 2.833 1.00 11.08 O ATOM 955 CB LEU A 102 -35.428 -18.774 2.312 1.00 10.45 C ATOM 956 CG LEU A 102 -35.927 -17.438 1.762 1.00 12.01 C ATOM 957 CD1 LEU A 102 -34.758 -16.658 1.148 1.00 12.91 C ATOM 958 CD2 LEU A 102 -37.040 -17.638 0.747 1.00 13.34 C ATOM 959 H LEU A 102 -36.206 -17.966 4.617 1.00 0.00 H ATOM 960 N LEU A 103 -34.941 -20.988 4.496 1.00 11.08 N ATOM 961 CA LEU A 103 -34.345 -22.259 4.887 1.00 10.98 C ATOM 962 C LEU A 103 -35.402 -23.214 5.427 1.00 10.61 C ATOM 963 O LEU A 103 -35.379 -24.416 5.127 1.00 10.75 O ATOM 964 CB LEU A 103 -33.250 -22.006 5.927 1.00 10.58 C ATOM 965 CG LEU A 103 -32.082 -21.160 5.422 1.00 10.82 C ATOM 966 CD1 LEU A 103 -31.194 -20.726 6.573 1.00 11.94 C ATOM 967 CD2 LEU A 103 -31.274 -21.921 4.394 1.00 10.63 C ATOM 968 H LEU A 103 -34.678 -20.117 5.000 1.00 0.00 H ATOM 969 N ASP A 104 -36.336 -22.698 6.226 1.00 9.63 N ATOM 970 CA ASP A 104 -37.398 -23.524 6.796 1.00 12.83 C ATOM 971 C ASP A 104 -38.523 -23.819 5.813 1.00 13.95 C ATOM 972 O ASP A 104 -39.271 -24.784 6.021 1.00 15.42 O ATOM 973 CB ASP A 104 -37.993 -22.845 8.028 1.00 19.76 C ATOM 974 CG ASP A 104 -38.750 -23.811 8.912 1.00 29.19 C ATOM 975 OD1 ASP A 104 -38.180 -24.872 9.254 1.00 33.92 O ATOM 976 OD2 ASP A 104 -39.915 -23.520 9.254 1.00 31.54 O ATOM 977 H ASP A 104 -36.308 -21.683 6.449 1.00 0.00 H ATOM 978 N SER A 105 -38.659 -23.028 4.755 1.00 15.37 N ATOM 979 CA SER A 105 -39.743 -23.201 3.797 1.00 16.78 C ATOM 980 C SER A 105 -39.266 -23.086 2.349 1.00 14.80 C ATOM 981 O SER A 105 -39.538 -22.071 1.710 1.00 14.16 O ATOM 982 CB SER A 105 -40.839 -22.153 4.058 1.00 19.52 C ATOM 983 OG SER A 105 -41.457 -22.345 5.319 1.00 21.07 O ATOM 984 HG SER A 105 -41.871 -23.244 5.349 1.00 0.00 H ATOM 985 H SER A 105 -37.971 -22.262 4.606 1.00 0.00 H ATOM 986 N HIS A 106 -38.599 -24.099 1.787 1.00 13.36 N ATOM 987 CA HIS A 106 -38.415 -25.426 2.366 1.00 13.00 C ATOM 988 C HIS A 106 -37.040 -25.978 1.984 1.00 11.95 C ATOM 989 O HIS A 106 -36.894 -27.156 1.680 1.00 13.99 O ATOM 990 CB HIS A 106 -39.514 -26.368 1.876 1.00 14.87 C ATOM 991 CG HIS A 106 -40.896 -25.891 2.197 1.00 16.39 C ATOM 992 ND1 HIS A 106 -41.520 -26.161 3.398 1.00 17.11 N ATOM 993 CD2 HIS A 106 -41.769 -25.148 1.479 1.00 16.96 C ATOM 994 CE1 HIS A 106 -42.718 -25.603 3.404 1.00 17.87 C ATOM 995 NE2 HIS A 106 -42.895 -24.986 2.250 1.00 17.69 N ATOM 996 H HIS A 106 -38.173 -23.926 0.854 1.00 0.00 H ATOM 997 N LEU A 107 -36.024 -25.119 2.003 1.00 11.41 N ATOM 998 CA LEU A 107 -34.715 -25.517 1.486 1.00 10.42 C ATOM 999 C LEU A 107 -34.128 -26.682 2.274 1.00 11.25 C ATOM 1000 O LEU A 107 -33.651 -27.662 1.689 1.00 12.71 O ATOM 1001 CB LEU A 107 -33.760 -24.326 1.501 1.00 9.37 C ATOM 1002 CG LEU A 107 -33.988 -23.281 0.408 1.00 10.43 C ATOM 1003 CD1 LEU A 107 -33.168 -22.066 0.714 1.00 9.68 C ATOM 1004 CD2 LEU A 107 -33.631 -23.837 -0.971 1.00 12.15 C ATOM 1005 H LEU A 107 -36.161 -24.162 2.386 1.00 0.00 H ATOM 1006 N ILE A 108 -34.148 -26.600 3.603 1.00 11.22 N ATOM 1007 CA ILE A 108 -33.492 -27.633 4.401 1.00 12.45 C ATOM 1008 C ILE A 108 -34.196 -28.972 4.232 1.00 13.21 C ATOM 1009 O ILE A 108 -33.545 -30.007 4.044 1.00 13.79 O ATOM 1010 CB ILE A 108 -33.421 -27.221 5.880 1.00 12.97 C ATOM 1011 CG1 ILE A 108 -32.400 -26.098 6.052 1.00 12.81 C ATOM 1012 CG2 ILE A 108 -33.019 -28.418 6.751 1.00 13.28 C ATOM 1013 CD1 ILE A 108 -32.470 -25.395 7.395 1.00 12.76 C ATOM 1014 H ILE A 108 -34.628 -25.805 4.070 1.00 0.00 H ATOM 1015 N LYS A 109 -35.529 -28.987 4.307 1.00 13.08 N ATOM 1016 CA LYS A 109 -36.204 -30.281 4.302 1.00 15.02 C ATOM 1017 C LYS A 109 -36.064 -30.979 2.956 1.00 15.12 C ATOM 1018 O LYS A 109 -36.113 -32.212 2.899 1.00 17.08 O ATOM 1019 CB LYS A 109 -37.678 -30.138 4.684 1.00 17.64 C ATOM 1020 CG LYS A 109 -38.563 -29.448 3.669 1.00 20.00 C ATOM 1021 CD LYS A 109 -40.045 -29.576 4.038 1.00 21.32 C ATOM 1022 CE LYS A 109 -40.345 -29.050 5.437 1.00 22.34 C ATOM 1023 NZ LYS A 109 -39.977 -27.615 5.614 1.00 22.63 N ATOM 1024 HZ1 LYS A 109 -38.958 -27.496 5.444 1.00 0.00 H ATOM 1025 HZ2 LYS A 109 -40.513 -27.035 4.937 1.00 0.00 H ATOM 1026 HZ3 LYS A 109 -40.205 -27.317 6.584 1.00 0.00 H ATOM 1027 H LYS A 109 -36.071 -28.101 4.367 1.00 0.00 H ATOM 1028 N GLU A 110 -35.879 -30.226 1.868 1.00 12.83 N ATOM 1029 CA GLU A 110 -35.705 -30.851 0.565 1.00 13.42 C ATOM 1030 C GLU A 110 -34.246 -31.076 0.198 1.00 15.31 C ATOM 1031 O GLU A 110 -33.977 -31.648 -0.864 1.00 16.94 O ATOM 1032 CB GLU A 110 -36.389 -30.020 -0.526 1.00 13.39 C ATOM 1033 CG GLU A 110 -37.905 -30.029 -0.440 1.00 14.48 C ATOM 1034 CD GLU A 110 -38.478 -31.429 -0.294 1.00 17.77 C ATOM 1035 OE1 GLU A 110 -37.915 -32.386 -0.870 1.00 17.09 O ATOM 1036 OE2 GLU A 110 -39.498 -31.575 0.409 1.00 24.45 O ATOM 1037 H GLU A 110 -35.859 -29.190 1.952 1.00 0.00 H ATOM 1038 N ALA A 111 -33.303 -30.682 1.056 1.00 15.34 N ATOM 1039 CA ALA A 111 -31.880 -30.897 0.796 1.00 15.70 C ATOM 1040 C ALA A 111 -31.516 -32.312 1.232 1.00 20.06 C ATOM 1041 O ALA A 111 -31.402 -32.603 2.423 1.00 20.70 O ATOM 1042 CB ALA A 111 -31.034 -29.862 1.526 1.00 14.49 C ATOM 1043 H ALA A 111 -33.589 -30.208 1.936 1.00 0.00 H ATOM 1044 N GLY A 112 -31.351 -33.198 0.267 1.00 28.60 N ATOM 1045 CA GLY A 112 -31.037 -34.581 0.553 1.00 33.76 C ATOM 1046 C GLY A 112 -29.558 -34.877 0.704 1.00 31.49 C ATOM 1047 O GLY A 112 -29.174 -35.680 1.563 1.00 43.63 O ATOM 1048 H GLY A 112 -31.449 -32.894 -0.723 1.00 0.00 H ATOM 1049 N ASP A 113 -28.731 -34.205 -0.096 1.00 17.98 N ATOM 1050 CA ASP A 113 -27.299 -34.454 -0.143 1.00 13.59 C ATOM 1051 C ASP A 113 -26.587 -33.769 1.013 1.00 12.24 C ATOM 1052 O ASP A 113 -27.101 -32.830 1.627 1.00 10.88 O ATOM 1053 CB ASP A 113 -26.727 -33.968 -1.472 1.00 12.25 C ATOM 1054 CG ASP A 113 -27.246 -34.764 -2.631 1.00 12.07 C ATOM 1055 OD1 ASP A 113 -27.954 -35.752 -2.354 1.00 11.64 O ATOM 1056 OD2 ASP A 113 -26.950 -34.422 -3.799 1.00 12.17 O ATOM 1057 H ASP A 113 -29.128 -33.469 -0.715 1.00 0.00 H ATOM 1058 N ALA A 114 -25.387 -34.263 1.327 1.00 15.42 N ATOM 1059 CA ALA A 114 -24.630 -33.629 2.400 1.00 17.30 C ATOM 1060 C ALA A 114 -24.209 -32.212 2.034 1.00 16.39 C ATOM 1061 O ALA A 114 -24.298 -31.303 2.867 1.00 16.24 O ATOM 1062 CB ALA A 114 -23.410 -34.484 2.747 1.00 19.07 C ATOM 1063 H ALA A 114 -25.000 -35.083 0.817 1.00 0.00 H ATOM 1064 N GLU A 115 -23.756 -31.999 0.795 1.00 16.64 N ATOM 1065 CA GLU A 115 -23.262 -30.684 0.396 1.00 19.51 C ATOM 1066 C GLU A 115 -24.355 -29.622 0.512 1.00 15.17 C ATOM 1067 O GLU A 115 -24.086 -28.476 0.905 1.00 15.63 O ATOM 1068 CB GLU A 115 -22.709 -30.750 -1.032 1.00 24.34 C ATOM 1069 CG GLU A 115 -21.395 -31.535 -1.176 1.00 28.69 C ATOM 1070 CD GLU A 115 -21.519 -33.019 -0.826 1.00 30.67 C ATOM 1071 OE1 GLU A 115 -22.597 -33.615 -1.057 1.00 27.57 O ATOM 1072 OE2 GLU A 115 -20.530 -33.589 -0.311 1.00 34.93 O ATOM 1073 H GLU A 115 -23.755 -32.779 0.107 1.00 0.00 H ATOM 1074 N SER A 116 -25.598 -29.973 0.184 1.00 12.53 N ATOM 1075 CA SER A 116 -26.671 -28.989 0.300 1.00 11.70 C ATOM 1076 C SER A 116 -27.150 -28.853 1.740 1.00 10.98 C ATOM 1077 O SER A 116 -27.298 -27.736 2.251 1.00 10.61 O ATOM 1078 CB SER A 116 -27.837 -29.361 -0.615 1.00 12.80 C ATOM 1079 OG SER A 116 -28.352 -30.632 -0.280 1.00 12.58 O ATOM 1080 HG SER A 116 -27.639 -31.312 -0.378 1.00 0.00 H ATOM 1081 H SER A 116 -25.802 -30.936 -0.151 1.00 0.00 H ATOM 1082 N ARG A 117 -27.390 -29.979 2.414 1.00 10.87 N ATOM 1083 CA ARG A 117 -27.960 -29.919 3.754 1.00 10.63 C ATOM 1084 C ARG A 117 -27.020 -29.227 4.732 1.00 9.67 C ATOM 1085 O ARG A 117 -27.458 -28.396 5.538 1.00 8.94 O ATOM 1086 CB ARG A 117 -28.300 -31.327 4.238 1.00 12.03 C ATOM 1087 CG ARG A 117 -29.129 -31.303 5.481 1.00 16.21 C ATOM 1088 CD ARG A 117 -29.729 -32.643 5.841 1.00 23.37 C ATOM 1089 NE ARG A 117 -30.544 -32.455 7.034 1.00 29.40 N ATOM 1090 CZ ARG A 117 -31.840 -32.164 7.030 1.00 32.77 C ATOM 1091 NH1 ARG A 117 -32.508 -32.070 5.890 1.00 31.33 N ATOM 1092 NH2 ARG A 117 -32.473 -31.982 8.181 1.00 35.57 N ATOM 1093 HE ARG A 117 -30.076 -32.556 7.957 1.00 0.00 H ATOM 1094 HH12 ARG A 117 -33.523 -31.842 5.899 1.00 0.00 H ATOM 1095 HH11 ARG A 117 -32.018 -32.225 4.986 1.00 0.00 H ATOM 1096 HH22 ARG A 117 -33.488 -31.754 8.186 1.00 0.00 H ATOM 1097 HH21 ARG A 117 -31.955 -32.067 9.079 1.00 0.00 H ATOM 1098 H ARG A 117 -27.170 -30.900 1.983 1.00 0.00 H ATOM 1099 N VAL A 118 -25.726 -29.564 4.687 1.00 9.10 N ATOM 1100 CA VAL A 118 -24.748 -28.897 5.542 1.00 8.30 C ATOM 1101 C VAL A 118 -24.691 -27.409 5.226 1.00 7.64 C ATOM 1102 O VAL A 118 -24.621 -26.568 6.130 1.00 7.86 O ATOM 1103 CB VAL A 118 -23.368 -29.560 5.380 1.00 9.75 C ATOM 1104 CG1 VAL A 118 -22.273 -28.738 6.092 1.00 9.31 C ATOM 1105 CG2 VAL A 118 -23.409 -30.986 5.908 1.00 11.02 C ATOM 1106 H VAL A 118 -25.413 -30.311 4.035 1.00 0.00 H ATOM 1107 N PHE A 119 -24.700 -27.058 3.938 1.00 8.32 N ATOM 1108 CA PHE A 119 -24.670 -25.649 3.556 1.00 8.59 C ATOM 1109 C PHE A 119 -25.827 -24.889 4.195 1.00 7.65 C ATOM 1110 O PHE A 119 -25.644 -23.807 4.764 1.00 7.81 O ATOM 1111 CB PHE A 119 -24.715 -25.534 2.028 1.00 10.08 C ATOM 1112 CG PHE A 119 -24.500 -24.137 1.517 1.00 12.79 C ATOM 1113 CD1 PHE A 119 -25.548 -23.235 1.462 1.00 12.57 C ATOM 1114 CD2 PHE A 119 -23.252 -23.732 1.073 1.00 15.49 C ATOM 1115 CE1 PHE A 119 -25.348 -21.944 0.984 1.00 12.20 C ATOM 1116 CE2 PHE A 119 -23.054 -22.459 0.591 1.00 15.75 C ATOM 1117 CZ PHE A 119 -24.107 -21.564 0.551 1.00 13.96 C ATOM 1118 H PHE A 119 -24.729 -27.793 3.202 1.00 0.00 H ATOM 1119 N TYR A 120 -27.036 -25.445 4.119 1.00 7.61 N ATOM 1120 CA TYR A 120 -28.208 -24.729 4.613 1.00 7.18 C ATOM 1121 C TYR A 120 -28.241 -24.697 6.135 1.00 8.70 C ATOM 1122 O TYR A 120 -28.647 -23.691 6.734 1.00 9.16 O ATOM 1123 CB TYR A 120 -29.476 -25.370 4.068 1.00 7.15 C ATOM 1124 CG TYR A 120 -29.674 -25.204 2.577 1.00 7.49 C ATOM 1125 CD1 TYR A 120 -29.501 -23.972 1.959 1.00 9.07 C ATOM 1126 CD2 TYR A 120 -30.042 -26.286 1.789 1.00 7.59 C ATOM 1127 CE1 TYR A 120 -29.690 -23.836 0.595 1.00 9.57 C ATOM 1128 CE2 TYR A 120 -30.229 -26.161 0.440 1.00 8.72 C ATOM 1129 CZ TYR A 120 -30.055 -24.931 -0.157 1.00 10.31 C ATOM 1130 OH TYR A 120 -30.241 -24.812 -1.521 1.00 11.33 O ATOM 1131 HH TYR A 120 -31.169 -25.069 -1.750 1.00 0.00 H ATOM 1132 H TYR A 120 -27.145 -26.393 3.706 1.00 0.00 H ATOM 1133 N LEU A 121 -27.828 -25.790 6.781 1.00 9.51 N ATOM 1134 CA LEU A 121 -27.806 -25.810 8.241 1.00 9.26 C ATOM 1135 C LEU A 121 -26.757 -24.849 8.777 1.00 8.32 C ATOM 1136 O LEU A 121 -26.990 -24.167 9.782 1.00 8.98 O ATOM 1137 CB LEU A 121 -27.552 -27.226 8.746 1.00 10.27 C ATOM 1138 CG LEU A 121 -28.717 -28.200 8.634 1.00 11.74 C ATOM 1139 CD1 LEU A 121 -28.217 -29.595 8.970 1.00 12.68 C ATOM 1140 CD2 LEU A 121 -29.851 -27.803 9.549 1.00 12.27 C ATOM 1141 H LEU A 121 -27.522 -26.627 6.245 1.00 0.00 H ATOM 1142 N LYS A 122 -25.612 -24.748 8.097 1.00 7.45 N ATOM 1143 CA LYS A 122 -24.637 -23.724 8.451 1.00 8.43 C ATOM 1144 C LYS A 122 -25.241 -22.330 8.319 1.00 8.57 C ATOM 1145 O LYS A 122 -25.062 -21.475 9.197 1.00 8.18 O ATOM 1146 CB LYS A 122 -23.393 -23.852 7.577 1.00 8.82 C ATOM 1147 CG LYS A 122 -22.357 -22.762 7.822 1.00 8.90 C ATOM 1148 CD LYS A 122 -21.286 -22.788 6.762 1.00 10.40 C ATOM 1149 CE LYS A 122 -20.524 -21.468 6.704 1.00 12.35 C ATOM 1150 NZ LYS A 122 -21.382 -20.348 6.216 1.00 13.19 N ATOM 1151 HZ1 LYS A 122 -21.726 -20.568 5.259 1.00 0.00 H ATOM 1152 HZ2 LYS A 122 -22.192 -20.228 6.858 1.00 0.00 H ATOM 1153 HZ3 LYS A 122 -20.824 -19.471 6.192 1.00 0.00 H ATOM 1154 H LYS A 122 -25.415 -25.402 7.313 1.00 0.00 H ATOM 1155 N MET A 123 -25.939 -22.075 7.212 1.00 8.19 N ATOM 1156 CA MET A 123 -26.612 -20.792 7.047 1.00 8.04 C ATOM 1157 C MET A 123 -27.585 -20.538 8.185 1.00 7.84 C ATOM 1158 O MET A 123 -27.665 -19.418 8.700 1.00 7.02 O ATOM 1159 CB MET A 123 -27.354 -20.739 5.715 1.00 8.69 C ATOM 1160 CG MET A 123 -26.476 -20.444 4.528 1.00 9.01 C ATOM 1161 SD MET A 123 -27.478 -20.143 3.062 1.00 9.68 S ATOM 1162 CE MET A 123 -27.807 -18.398 3.252 1.00 9.48 C ATOM 1163 H MET A 123 -26.004 -22.794 6.463 1.00 0.00 H ATOM 1164 N LYS A 124 -28.340 -21.568 8.588 1.00 7.85 N ATOM 1165 CA LYS A 124 -29.285 -21.402 9.683 1.00 8.29 C ATOM 1166 C LYS A 124 -28.556 -21.010 10.961 1.00 8.34 C ATOM 1167 O LYS A 124 -28.971 -20.077 11.653 1.00 7.21 O ATOM 1168 CB LYS A 124 -30.095 -22.683 9.880 1.00 9.57 C ATOM 1169 CG LYS A 124 -31.160 -22.587 10.950 1.00 11.65 C ATOM 1170 CD LYS A 124 -32.015 -23.838 10.982 1.00 15.26 C ATOM 1171 CE LYS A 124 -33.139 -23.742 11.991 1.00 19.84 C ATOM 1172 NZ LYS A 124 -34.076 -24.896 11.850 1.00 22.03 N ATOM 1173 HZ1 LYS A 124 -34.482 -24.896 10.893 1.00 0.00 H ATOM 1174 HZ2 LYS A 124 -33.557 -25.783 12.008 1.00 0.00 H ATOM 1175 HZ3 LYS A 124 -34.839 -24.809 12.552 1.00 0.00 H ATOM 1176 H LYS A 124 -28.251 -22.491 8.117 1.00 0.00 H ATOM 1177 N GLY A 125 -27.441 -21.681 11.267 1.00 10.04 N ATOM 1178 CA GLY A 125 -26.641 -21.280 12.413 1.00 10.10 C ATOM 1179 C GLY A 125 -26.135 -19.855 12.298 1.00 8.52 C ATOM 1180 O GLY A 125 -26.165 -19.095 13.270 1.00 9.61 O ATOM 1181 H GLY A 125 -27.146 -22.491 10.685 1.00 0.00 H ATOM 1182 N ASP A 126 -25.680 -19.471 11.103 1.00 6.58 N ATOM 1183 CA ASP A 126 -25.128 -18.136 10.892 1.00 6.13 C ATOM 1184 C ASP A 126 -26.165 -17.058 11.177 1.00 7.56 C ATOM 1185 O ASP A 126 -25.869 -16.062 11.853 1.00 7.89 O ATOM 1186 CB ASP A 126 -24.610 -17.981 9.458 1.00 5.75 C ATOM 1187 CG ASP A 126 -23.340 -18.756 9.188 1.00 7.67 C ATOM 1188 OD1 ASP A 126 -22.617 -19.114 10.139 1.00 7.97 O ATOM 1189 OD2 ASP A 126 -23.060 -18.986 7.996 1.00 7.59 O ATOM 1190 H ASP A 126 -25.720 -20.137 10.305 1.00 0.00 H ATOM 1191 N TYR A 127 -27.388 -17.219 10.660 1.00 8.26 N ATOM 1192 CA TYR A 127 -28.346 -16.125 10.802 1.00 8.34 C ATOM 1193 C TYR A 127 -28.990 -16.103 12.187 1.00 8.65 C ATOM 1194 O TYR A 127 -29.362 -15.023 12.660 1.00 9.46 O ATOM 1195 CB TYR A 127 -29.369 -16.162 9.657 1.00 8.87 C ATOM 1196 CG TYR A 127 -28.715 -15.612 8.402 1.00 7.81 C ATOM 1197 CD1 TYR A 127 -28.806 -14.261 8.078 1.00 8.15 C ATOM 1198 CD2 TYR A 127 -27.912 -16.417 7.612 1.00 8.34 C ATOM 1199 CE1 TYR A 127 -28.150 -13.745 6.980 1.00 7.66 C ATOM 1200 CE2 TYR A 127 -27.253 -15.915 6.511 1.00 9.29 C ATOM 1201 CZ TYR A 127 -27.375 -14.577 6.198 1.00 9.34 C ATOM 1202 OH TYR A 127 -26.709 -14.090 5.105 1.00 10.91 O ATOM 1203 HH TYR A 127 -25.736 -14.232 5.223 1.00 0.00 H ATOM 1204 H TYR A 127 -27.650 -18.098 10.171 1.00 0.00 H ATOM 1205 N TYR A 128 -29.074 -17.244 12.883 1.00 7.35 N ATOM 1206 CA TYR A 128 -29.384 -17.188 14.310 1.00 7.62 C ATOM 1207 C TYR A 128 -28.253 -16.522 15.088 1.00 8.15 C ATOM 1208 O TYR A 128 -28.501 -15.804 16.064 1.00 8.38 O ATOM 1209 CB TYR A 128 -29.662 -18.589 14.864 1.00 8.33 C ATOM 1210 CG TYR A 128 -31.105 -19.003 14.704 1.00 9.19 C ATOM 1211 CD1 TYR A 128 -32.110 -18.344 15.398 1.00 11.77 C ATOM 1212 CD2 TYR A 128 -31.470 -20.036 13.857 1.00 9.64 C ATOM 1213 CE1 TYR A 128 -33.437 -18.698 15.258 1.00 14.19 C ATOM 1214 CE2 TYR A 128 -32.812 -20.393 13.705 1.00 13.03 C ATOM 1215 CZ TYR A 128 -33.782 -19.718 14.410 1.00 15.03 C ATOM 1216 OH TYR A 128 -35.114 -20.046 14.286 1.00 16.57 O ATOM 1217 HH TYR A 128 -35.395 -19.931 13.344 1.00 0.00 H ATOM 1218 H TYR A 128 -28.920 -18.159 12.413 1.00 0.00 H ATOM 1219 N ARG A 129 -27.004 -16.744 14.670 1.00 9.13 N ATOM 1220 CA ARG A 129 -25.881 -16.073 15.317 1.00 9.13 C ATOM 1221 C ARG A 129 -25.958 -14.559 15.126 1.00 9.73 C ATOM 1222 O ARG A 129 -25.694 -13.792 16.061 1.00 9.88 O ATOM 1223 CB ARG A 129 -24.554 -16.630 14.791 1.00 8.76 C ATOM 1224 CG ARG A 129 -23.328 -15.872 15.292 1.00 8.30 C ATOM 1225 CD ARG A 129 -22.037 -16.638 15.108 1.00 7.66 C ATOM 1226 NE ARG A 129 -21.791 -16.988 13.711 1.00 8.19 N ATOM 1227 CZ ARG A 129 -21.112 -16.238 12.854 1.00 8.87 C ATOM 1228 NH1 ARG A 129 -20.577 -15.084 13.236 1.00 9.86 N ATOM 1229 NH2 ARG A 129 -20.960 -16.644 11.608 1.00 8.02 N ATOM 1230 HE ARG A 129 -22.176 -17.890 13.364 1.00 0.00 H ATOM 1231 HH12 ARG A 129 -20.047 -14.505 12.554 1.00 0.00 H ATOM 1232 HH11 ARG A 129 -20.688 -14.759 14.218 1.00 0.00 H ATOM 1233 HH22 ARG A 129 -20.428 -16.059 10.932 1.00 0.00 H ATOM 1234 HH21 ARG A 129 -21.372 -17.549 11.302 1.00 0.00 H ATOM 1235 H ARG A 129 -26.831 -17.398 13.880 1.00 0.00 H ATOM 1236 N TYR A 130 -26.324 -14.099 13.932 1.00 8.98 N ATOM 1237 CA TYR A 130 -26.480 -12.659 13.749 1.00 8.65 C ATOM 1238 C TYR A 130 -27.616 -12.126 14.613 1.00 8.61 C ATOM 1239 O TYR A 130 -27.500 -11.049 15.209 1.00 9.35 O ATOM 1240 CB TYR A 130 -26.688 -12.331 12.268 1.00 7.54 C ATOM 1241 CG TYR A 130 -25.612 -12.910 11.365 1.00 7.67 C ATOM 1242 CD1 TYR A 130 -24.305 -13.053 11.808 1.00 7.39 C ATOM 1243 CD2 TYR A 130 -25.911 -13.314 10.075 1.00 8.79 C ATOM 1244 CE1 TYR A 130 -23.318 -13.596 10.990 1.00 8.48 C ATOM 1245 CE2 TYR A 130 -24.942 -13.855 9.246 1.00 9.98 C ATOM 1246 CZ TYR A 130 -23.645 -13.996 9.706 1.00 10.11 C ATOM 1247 OH TYR A 130 -22.679 -14.536 8.878 1.00 10.97 O ATOM 1248 HH TYR A 130 -21.814 -14.566 9.358 1.00 0.00 H ATOM 1249 H TYR A 130 -26.496 -14.754 13.143 1.00 0.00 H ATOM 1250 N LEU A 131 -28.714 -12.876 14.729 1.00 8.68 N ATOM 1251 CA LEU A 131 -29.756 -12.486 15.680 1.00 8.92 C ATOM 1252 C LEU A 131 -29.207 -12.423 17.100 1.00 9.50 C ATOM 1253 O LEU A 131 -29.516 -11.491 17.855 1.00 10.18 O ATOM 1254 CB LEU A 131 -30.935 -13.459 15.606 1.00 8.46 C ATOM 1255 CG LEU A 131 -31.818 -13.386 14.355 1.00 8.50 C ATOM 1256 CD1 LEU A 131 -32.870 -14.483 14.378 1.00 9.00 C ATOM 1257 CD2 LEU A 131 -32.480 -12.017 14.204 1.00 9.80 C ATOM 1258 H LEU A 131 -28.828 -13.731 14.148 1.00 0.00 H ATOM 1259 N ALA A 132 -28.374 -13.397 17.478 1.00 8.71 N ATOM 1260 CA ALA A 132 -27.834 -13.431 18.835 1.00 9.37 C ATOM 1261 C ALA A 132 -26.955 -12.225 19.122 1.00 11.42 C ATOM 1262 O ALA A 132 -26.913 -11.744 20.261 1.00 11.99 O ATOM 1263 CB ALA A 132 -27.039 -14.715 19.049 1.00 7.93 C ATOM 1264 H ALA A 132 -28.107 -14.138 16.799 1.00 0.00 H ATOM 1265 N GLU A 133 -26.250 -11.723 18.101 1.00 12.55 N ATOM 1266 CA GLU A 133 -25.348 -10.595 18.304 1.00 11.59 C ATOM 1267 C GLU A 133 -26.088 -9.376 18.832 1.00 11.40 C ATOM 1268 O GLU A 133 -25.502 -8.570 19.559 1.00 12.46 O ATOM 1269 CB GLU A 133 -24.630 -10.240 17.002 1.00 10.63 C ATOM 1270 CG GLU A 133 -23.535 -11.206 16.595 1.00 11.74 C ATOM 1271 CD GLU A 133 -22.848 -10.806 15.297 1.00 13.31 C ATOM 1272 OE1 GLU A 133 -23.411 -9.995 14.519 1.00 14.16 O ATOM 1273 OE2 GLU A 133 -21.726 -11.293 15.063 1.00 12.87 O ATOM 1274 H GLU A 133 -26.346 -12.141 17.154 1.00 0.00 H ATOM 1275 N VAL A 134 -27.365 -9.221 18.480 1.00 10.74 N ATOM 1276 CA VAL A 134 -28.151 -8.058 18.878 1.00 13.18 C ATOM 1277 C VAL A 134 -29.222 -8.401 19.899 1.00 15.87 C ATOM 1278 O VAL A 134 -29.978 -7.511 20.313 1.00 17.54 O ATOM 1279 CB VAL A 134 -28.775 -7.361 17.652 1.00 14.39 C ATOM 1280 CG1 VAL A 134 -27.704 -7.079 16.614 1.00 15.94 C ATOM 1281 CG2 VAL A 134 -29.903 -8.187 17.033 1.00 13.93 C ATOM 1282 H VAL A 134 -27.817 -9.956 17.900 1.00 0.00 H ATOM 1283 N ALA A 135 -29.294 -9.651 20.344 1.00 14.19 N ATOM 1284 CA ALA A 135 -30.356 -10.080 21.238 1.00 15.24 C ATOM 1285 C ALA A 135 -30.036 -9.691 22.669 1.00 19.44 C ATOM 1286 O ALA A 135 -28.878 -9.728 23.093 1.00 17.35 O ATOM 1287 CB ALA A 135 -30.549 -11.595 21.142 1.00 14.57 C ATOM 1288 H ALA A 135 -28.573 -10.339 20.045 1.00 0.00 H ATOM 1289 N THR A 136 -31.072 -9.314 23.407 1.00 27.49 N ATOM 1290 CA THR A 136 -30.938 -9.005 24.827 1.00 39.21 C ATOM 1291 C THR A 136 -32.097 -9.616 25.608 1.00 55.03 C ATOM 1292 O THR A 136 -32.018 -9.786 26.824 1.00 64.97 O ATOM 1293 CB THR A 136 -30.903 -7.490 25.075 1.00 34.56 C ATOM 1294 OG1 THR A 136 -32.103 -6.894 24.570 1.00 32.40 O ATOM 1295 CG2 THR A 136 -29.705 -6.862 24.385 1.00 32.49 C ATOM 1296 HG1 THR A 136 -32.078 -5.917 24.731 1.00 0.00 H ATOM 1297 H THR A 136 -32.008 -9.236 22.960 1.00 0.00 H TER 1298 THR A 136 ATOM 1299 N ASP A 139 -35.309 -13.836 25.053 1.00 48.95 N ATOM 1300 CA ASP A 139 -35.163 -14.859 24.026 1.00 48.35 C ATOM 1301 C ASP A 139 -33.715 -15.024 23.578 1.00 34.14 C ATOM 1302 O ASP A 139 -33.428 -15.830 22.693 1.00 31.22 O ATOM 1303 CB ASP A 139 -36.033 -14.530 22.805 1.00 59.74 C ATOM 1304 CG ASP A 139 -37.401 -15.185 22.862 1.00 67.54 C ATOM 1305 OD1 ASP A 139 -37.550 -16.220 23.548 1.00 68.37 O ATOM 1306 OD2 ASP A 139 -38.330 -14.668 22.205 1.00 71.54 O ATOM 1307 HN3 ASP A 139 -34.980 -12.923 24.680 1.00 0.00 H ATOM 1308 HN2 ASP A 139 -34.741 -14.097 25.884 1.00 0.00 H ATOM 1309 HN1 ASP A 139 -36.310 -13.760 25.325 1.00 0.00 H ATOM 1310 N LYS A 140 -32.802 -14.259 24.177 1.00 26.34 N ATOM 1311 CA LYS A 140 -31.391 -14.402 23.834 1.00 24.08 C ATOM 1312 C LYS A 140 -30.951 -15.858 23.930 1.00 21.15 C ATOM 1313 O LYS A 140 -30.304 -16.388 23.016 1.00 20.24 O ATOM 1314 CB LYS A 140 -30.536 -13.523 24.746 1.00 29.65 C ATOM 1315 CG LYS A 140 -29.041 -13.687 24.540 1.00 36.48 C ATOM 1316 CD LYS A 140 -28.402 -12.378 24.150 1.00 42.89 C ATOM 1317 CE LYS A 140 -26.941 -12.547 23.771 1.00 46.43 C ATOM 1318 NZ LYS A 140 -26.039 -12.358 24.936 1.00 48.54 N ATOM 1319 HZ1 LYS A 140 -26.167 -11.400 25.320 1.00 0.00 H ATOM 1320 HZ2 LYS A 140 -26.269 -13.060 25.668 1.00 0.00 H ATOM 1321 HZ3 LYS A 140 -25.052 -12.482 24.632 1.00 0.00 H ATOM 1322 H LYS A 140 -33.096 -13.560 24.889 1.00 0.00 H ATOM 1323 N LYS A 141 -31.299 -16.523 25.034 1.00 19.81 N ATOM 1324 CA LYS A 141 -30.823 -17.885 25.263 1.00 19.82 C ATOM 1325 C LYS A 141 -31.371 -18.850 24.226 1.00 15.80 C ATOM 1326 O LYS A 141 -30.666 -19.768 23.788 1.00 12.93 O ATOM 1327 CB LYS A 141 -31.216 -18.354 26.665 1.00 25.26 C ATOM 1328 CG LYS A 141 -30.322 -17.830 27.760 1.00 33.93 C ATOM 1329 CD LYS A 141 -30.716 -18.395 29.116 1.00 44.96 C ATOM 1330 CE LYS A 141 -29.795 -17.886 30.211 1.00 55.27 C ATOM 1331 NZ LYS A 141 -30.178 -18.407 31.554 1.00 62.16 N ATOM 1332 HZ1 LYS A 141 -31.147 -18.104 31.779 1.00 0.00 H ATOM 1333 HZ2 LYS A 141 -30.131 -19.446 31.548 1.00 0.00 H ATOM 1334 HZ3 LYS A 141 -29.522 -18.033 32.269 1.00 0.00 H ATOM 1335 H LYS A 141 -31.915 -16.067 25.737 1.00 0.00 H ATOM 1336 N ARG A 142 -32.638 -18.685 23.844 1.00 17.64 N ATOM 1337 CA ARG A 142 -33.220 -19.606 22.882 1.00 20.31 C ATOM 1338 C ARG A 142 -32.680 -19.345 21.485 1.00 15.22 C ATOM 1339 O ARG A 142 -32.530 -20.282 20.700 1.00 13.27 O ATOM 1340 CB ARG A 142 -34.746 -19.511 22.908 1.00 29.84 C ATOM 1341 CG ARG A 142 -35.397 -20.582 23.781 1.00 40.91 C ATOM 1342 CD ARG A 142 -36.910 -20.493 23.749 1.00 48.81 C ATOM 1343 NE ARG A 142 -37.403 -19.422 24.612 1.00 51.07 N ATOM 1344 CZ ARG A 142 -37.783 -19.580 25.877 1.00 49.07 C ATOM 1345 NH1 ARG A 142 -37.743 -20.776 26.453 1.00 41.76 N ATOM 1346 NH2 ARG A 142 -38.211 -18.533 26.570 1.00 53.95 N ATOM 1347 HE ARG A 142 -37.461 -18.466 24.207 1.00 0.00 H ATOM 1348 HH12 ARG A 142 -38.043 -20.887 27.443 1.00 0.00 H ATOM 1349 HH11 ARG A 142 -37.412 -21.602 25.914 1.00 0.00 H ATOM 1350 HH22 ARG A 142 -38.509 -18.651 27.559 1.00 0.00 H ATOM 1351 HH21 ARG A 142 -38.248 -17.594 26.124 1.00 0.00 H ATOM 1352 H ARG A 142 -33.205 -17.904 24.231 1.00 0.00 H ATOM 1353 N ILE A 143 -32.374 -18.089 21.160 1.00 15.93 N ATOM 1354 CA ILE A 143 -31.731 -17.791 19.883 1.00 14.49 C ATOM 1355 C ILE A 143 -30.369 -18.473 19.812 1.00 12.71 C ATOM 1356 O ILE A 143 -30.005 -19.080 18.798 1.00 11.91 O ATOM 1357 CB ILE A 143 -31.612 -16.269 19.694 1.00 15.27 C ATOM 1358 CG1 ILE A 143 -33.006 -15.647 19.553 1.00 20.22 C ATOM 1359 CG2 ILE A 143 -30.755 -15.950 18.483 1.00 12.27 C ATOM 1360 CD1 ILE A 143 -33.019 -14.131 19.647 1.00 23.24 C ATOM 1361 H ILE A 143 -32.595 -17.316 21.820 1.00 0.00 H ATOM 1362 N ILE A 144 -29.597 -18.379 20.894 1.00 11.41 N ATOM 1363 CA ILE A 144 -28.278 -18.999 20.944 1.00 11.79 C ATOM 1364 C ILE A 144 -28.385 -20.509 20.787 1.00 12.37 C ATOM 1365 O ILE A 144 -27.594 -21.132 20.061 1.00 13.91 O ATOM 1366 CB ILE A 144 -27.570 -18.594 22.251 1.00 13.98 C ATOM 1367 CG1 ILE A 144 -27.185 -17.113 22.162 1.00 17.11 C ATOM 1368 CG2 ILE A 144 -26.349 -19.477 22.534 1.00 12.53 C ATOM 1369 CD1 ILE A 144 -26.635 -16.531 23.455 1.00 19.16 C ATOM 1370 H ILE A 144 -29.943 -17.852 21.721 1.00 0.00 H ATOM 1371 N ASP A 145 -29.359 -21.126 21.462 1.00 11.99 N ATOM 1372 CA ASP A 145 -29.537 -22.570 21.347 1.00 13.04 C ATOM 1373 C ASP A 145 -29.944 -22.967 19.935 1.00 11.28 C ATOM 1374 O ASP A 145 -29.548 -24.032 19.446 1.00 10.31 O ATOM 1375 CB ASP A 145 -30.582 -23.058 22.347 1.00 16.60 C ATOM 1376 CG ASP A 145 -31.139 -24.420 21.980 1.00 19.52 C ATOM 1377 OD1 ASP A 145 -32.279 -24.479 21.475 1.00 21.17 O ATOM 1378 OD2 ASP A 145 -30.428 -25.429 22.177 1.00 20.47 O ATOM 1379 H ASP A 145 -29.994 -20.574 22.073 1.00 0.00 H ATOM 1380 N SER A 146 -30.748 -22.135 19.271 1.00 12.70 N ATOM 1381 CA SER A 146 -31.128 -22.424 17.894 1.00 13.25 C ATOM 1382 C SER A 146 -29.906 -22.402 16.988 1.00 11.87 C ATOM 1383 O SER A 146 -29.755 -23.259 16.110 1.00 11.66 O ATOM 1384 CB SER A 146 -32.169 -21.414 17.415 1.00 14.33 C ATOM 1385 OG SER A 146 -33.419 -21.625 18.054 1.00 15.84 O ATOM 1386 HG SER A 146 -33.309 -21.526 19.033 1.00 0.00 H ATOM 1387 H SER A 146 -31.105 -21.277 19.738 1.00 0.00 H ATOM 1388 N ALA A 147 -29.023 -21.422 17.182 1.00 10.78 N ATOM 1389 CA ALA A 147 -27.787 -21.397 16.409 1.00 9.86 C ATOM 1390 C ALA A 147 -26.963 -22.649 16.686 1.00 10.27 C ATOM 1391 O ALA A 147 -26.519 -23.333 15.759 1.00 8.95 O ATOM 1392 CB ALA A 147 -26.990 -20.137 16.736 1.00 9.67 C ATOM 1393 H ALA A 147 -29.215 -20.678 17.883 1.00 0.00 H ATOM 1394 N ARG A 148 -26.780 -22.970 17.968 1.00 11.42 N ATOM 1395 CA ARG A 148 -26.006 -24.146 18.354 1.00 11.42 C ATOM 1396 C ARG A 148 -26.570 -25.409 17.722 1.00 11.22 C ATOM 1397 O ARG A 148 -25.824 -26.226 17.166 1.00 10.68 O ATOM 1398 CB ARG A 148 -25.993 -24.274 19.879 1.00 12.15 C ATOM 1399 CG ARG A 148 -25.110 -25.399 20.403 1.00 12.50 C ATOM 1400 CD ARG A 148 -25.252 -25.558 21.907 1.00 13.51 C ATOM 1401 NE ARG A 148 -25.274 -24.259 22.572 1.00 14.16 N ATOM 1402 CZ ARG A 148 -24.206 -23.635 23.055 1.00 12.53 C ATOM 1403 NH1 ARG A 148 -23.001 -24.191 22.977 1.00 10.74 N ATOM 1404 NH2 ARG A 148 -24.348 -22.445 23.622 1.00 11.14 N ATOM 1405 HE ARG A 148 -26.195 -23.787 22.675 1.00 0.00 H ATOM 1406 HH12 ARG A 148 -22.172 -23.692 23.359 1.00 0.00 H ATOM 1407 HH11 ARG A 148 -22.887 -25.125 22.534 1.00 0.00 H ATOM 1408 HH22 ARG A 148 -23.518 -21.948 24.003 1.00 0.00 H ATOM 1409 HH21 ARG A 148 -25.290 -22.008 23.685 1.00 0.00 H ATOM 1410 H ARG A 148 -27.197 -22.370 18.708 1.00 0.00 H ATOM 1411 N SER A 149 -27.888 -25.598 17.811 1.00 12.88 N ATOM 1412 CA SER A 149 -28.516 -26.808 17.298 1.00 13.86 C ATOM 1413 C SER A 149 -28.283 -26.959 15.801 1.00 11.80 C ATOM 1414 O SER A 149 -27.986 -28.055 15.316 1.00 10.16 O ATOM 1415 CB SER A 149 -30.016 -26.782 17.599 1.00 15.70 C ATOM 1416 OG SER A 149 -30.630 -28.003 17.227 1.00 16.76 O ATOM 1417 HG SER A 149 -31.598 -27.960 17.432 1.00 0.00 H ATOM 1418 H SER A 149 -28.479 -24.867 18.256 1.00 0.00 H ATOM 1419 N ALA A 150 -28.434 -25.865 15.052 1.00 9.73 N ATOM 1420 CA ALA A 150 -28.230 -25.913 13.608 1.00 9.25 C ATOM 1421 C ALA A 150 -26.777 -26.219 13.270 1.00 9.90 C ATOM 1422 O ALA A 150 -26.489 -27.097 12.442 1.00 9.25 O ATOM 1423 CB ALA A 150 -28.660 -24.589 12.978 1.00 8.45 C ATOM 1424 H ALA A 150 -28.700 -24.967 15.503 1.00 0.00 H ATOM 1425 N TYR A 151 -25.842 -25.508 13.911 1.00 10.14 N ATOM 1426 CA TYR A 151 -24.426 -25.778 13.689 1.00 9.36 C ATOM 1427 C TYR A 151 -24.077 -27.217 14.031 1.00 9.88 C ATOM 1428 O TYR A 151 -23.272 -27.852 13.334 1.00 9.69 O ATOM 1429 CB TYR A 151 -23.563 -24.842 14.528 1.00 8.74 C ATOM 1430 CG TYR A 151 -23.390 -23.428 14.015 1.00 8.20 C ATOM 1431 CD1 TYR A 151 -23.093 -23.165 12.678 1.00 7.82 C ATOM 1432 CD2 TYR A 151 -23.485 -22.360 14.883 1.00 8.67 C ATOM 1433 CE1 TYR A 151 -22.903 -21.862 12.228 1.00 8.27 C ATOM 1434 CE2 TYR A 151 -23.299 -21.055 14.444 1.00 9.24 C ATOM 1435 CZ TYR A 151 -23.004 -20.814 13.120 1.00 9.35 C ATOM 1436 OH TYR A 151 -22.831 -19.515 12.688 1.00 9.17 O ATOM 1437 HH TYR A 151 -22.626 -19.515 11.719 1.00 0.00 H ATOM 1438 H TYR A 151 -26.127 -24.758 14.572 1.00 0.00 H ATOM 1439 N GLN A 152 -24.630 -27.734 15.129 1.00 9.34 N ATOM 1440 CA GLN A 152 -24.266 -29.077 15.564 1.00 10.64 C ATOM 1441 C GLN A 152 -24.768 -30.134 14.589 1.00 11.32 C ATOM 1442 O GLN A 152 -24.057 -31.105 14.305 1.00 13.40 O ATOM 1443 CB GLN A 152 -24.814 -29.356 16.962 1.00 12.56 C ATOM 1444 CG GLN A 152 -24.315 -30.676 17.515 1.00 16.14 C ATOM 1445 CD GLN A 152 -22.825 -30.645 17.730 1.00 19.30 C ATOM 1446 OE1 GLN A 152 -22.321 -29.807 18.481 1.00 21.05 O ATOM 1447 NE2 GLN A 152 -22.105 -31.541 17.062 1.00 20.17 N ATOM 1448 HE22 GLN A 152 -22.577 -32.228 16.440 1.00 0.00 H ATOM 1449 HE21 GLN A 152 -21.070 -31.555 17.161 1.00 0.00 H ATOM 1450 H GLN A 152 -25.320 -27.180 15.674 1.00 0.00 H ATOM 1451 N GLU A 153 -26.004 -29.997 14.104 1.00 10.03 N ATOM 1452 CA GLU A 153 -26.501 -30.942 13.111 1.00 10.72 C ATOM 1453 C GLU A 153 -25.629 -30.910 11.869 1.00 9.42 C ATOM 1454 O GLU A 153 -25.282 -31.959 11.316 1.00 10.36 O ATOM 1455 CB GLU A 153 -27.955 -30.636 12.742 1.00 15.48 C ATOM 1456 CG GLU A 153 -28.537 -31.659 11.772 1.00 22.95 C ATOM 1457 CD GLU A 153 -30.024 -31.485 11.504 1.00 30.81 C ATOM 1458 OE1 GLU A 153 -30.684 -30.683 12.199 1.00 32.83 O ATOM 1459 OE2 GLU A 153 -30.532 -32.166 10.587 1.00 34.66 O ATOM 1460 H GLU A 153 -26.610 -29.219 14.433 1.00 0.00 H ATOM 1461 N ALA A 154 -25.265 -29.707 11.420 1.00 9.28 N ATOM 1462 CA ALA A 154 -24.401 -29.573 10.255 1.00 8.53 C ATOM 1463 C ALA A 154 -23.049 -30.215 10.508 1.00 10.29 C ATOM 1464 O ALA A 154 -22.488 -30.878 9.627 1.00 10.94 O ATOM 1465 CB ALA A 154 -24.241 -28.092 9.910 1.00 7.83 C ATOM 1466 H ALA A 154 -25.603 -28.853 11.909 1.00 0.00 H ATOM 1467 N MET A 155 -22.507 -30.025 11.714 1.00 10.65 N ATOM 1468 CA MET A 155 -21.225 -30.632 12.051 1.00 11.47 C ATOM 1469 C MET A 155 -21.318 -32.152 11.999 1.00 11.13 C ATOM 1470 O MET A 155 -20.457 -32.819 11.414 1.00 11.72 O ATOM 1471 CB MET A 155 -20.778 -30.172 13.440 1.00 12.17 C ATOM 1472 CG MET A 155 -20.310 -28.726 13.508 1.00 13.07 C ATOM 1473 SD MET A 155 -18.678 -28.480 12.773 1.00 14.43 S ATOM 1474 CE MET A 155 -17.652 -29.350 13.954 1.00 15.22 C ATOM 1475 H MET A 155 -23.003 -29.440 12.417 1.00 0.00 H ATOM 1476 N ASP A 156 -22.363 -32.719 12.610 1.00 11.07 N ATOM 1477 CA ASP A 156 -22.501 -34.174 12.648 1.00 13.86 C ATOM 1478 C ASP A 156 -22.531 -34.759 11.242 1.00 14.08 C ATOM 1479 O ASP A 156 -21.847 -35.748 10.954 1.00 15.30 O ATOM 1480 CB ASP A 156 -23.765 -34.574 13.414 1.00 16.95 C ATOM 1481 CG ASP A 156 -23.718 -34.181 14.886 1.00 19.09 C ATOM 1482 OD1 ASP A 156 -22.629 -33.869 15.394 1.00 18.84 O ATOM 1483 OD2 ASP A 156 -24.782 -34.200 15.538 1.00 20.78 O ATOM 1484 H ASP A 156 -23.084 -32.120 13.062 1.00 0.00 H ATOM 1485 N ILE A 157 -23.328 -34.161 10.353 1.00 11.81 N ATOM 1486 CA ILE A 157 -23.402 -34.632 8.973 1.00 10.76 C ATOM 1487 C ILE A 157 -22.048 -34.482 8.292 1.00 9.82 C ATOM 1488 O ILE A 157 -21.574 -35.398 7.607 1.00 11.50 O ATOM 1489 CB ILE A 157 -24.501 -33.872 8.204 1.00 10.87 C ATOM 1490 CG1 ILE A 157 -25.873 -34.149 8.818 1.00 13.73 C ATOM 1491 CG2 ILE A 157 -24.510 -34.278 6.738 1.00 11.35 C ATOM 1492 CD1 ILE A 157 -26.972 -33.253 8.286 1.00 15.61 C ATOM 1493 H ILE A 157 -23.905 -33.347 10.648 1.00 0.00 H ATOM 1494 N SER A 158 -21.408 -33.320 8.464 1.00 8.80 N ATOM 1495 CA SER A 158 -20.173 -33.042 7.737 1.00 10.99 C ATOM 1496 C SER A 158 -19.074 -34.012 8.139 1.00 12.70 C ATOM 1497 O SER A 158 -18.244 -34.406 7.307 1.00 14.21 O ATOM 1498 CB SER A 158 -19.735 -31.590 7.966 1.00 12.35 C ATOM 1499 OG SER A 158 -19.191 -31.398 9.263 1.00 15.88 O ATOM 1500 HG SER A 158 -19.873 -31.627 9.943 1.00 0.00 H ATOM 1501 H SER A 158 -21.793 -32.610 9.120 1.00 0.00 H ATOM 1502 N LYS A 159 -19.047 -34.417 9.411 1.00 13.76 N ATOM 1503 CA LYS A 159 -18.021 -35.357 9.844 1.00 15.65 C ATOM 1504 C LYS A 159 -18.281 -36.756 9.305 1.00 15.18 C ATOM 1505 O LYS A 159 -17.333 -37.512 9.068 1.00 16.16 O ATOM 1506 CB LYS A 159 -17.934 -35.386 11.370 1.00 20.67 C ATOM 1507 CG LYS A 159 -17.458 -34.071 12.003 1.00 27.40 C ATOM 1508 CD LYS A 159 -16.556 -34.351 13.201 1.00 35.54 C ATOM 1509 CE LYS A 159 -16.781 -33.384 14.347 1.00 42.23 C ATOM 1510 NZ LYS A 159 -15.905 -33.743 15.506 1.00 46.55 N ATOM 1511 HZ1 LYS A 159 -16.131 -34.707 15.824 1.00 0.00 H ATOM 1512 HZ2 LYS A 159 -14.908 -33.698 15.213 1.00 0.00 H ATOM 1513 HZ3 LYS A 159 -16.069 -33.073 16.284 1.00 0.00 H ATOM 1514 H LYS A 159 -19.753 -34.064 10.088 1.00 0.00 H ATOM 1515 N LYS A 160 -19.548 -37.117 9.109 1.00 14.44 N ATOM 1516 CA LYS A 160 -19.884 -38.438 8.589 1.00 16.00 C ATOM 1517 C LYS A 160 -19.759 -38.509 7.074 1.00 16.18 C ATOM 1518 O LYS A 160 -19.417 -39.567 6.535 1.00 17.15 O ATOM 1519 CB LYS A 160 -21.314 -38.822 8.982 1.00 17.67 C ATOM 1520 CG LYS A 160 -21.569 -38.922 10.473 1.00 18.96 C ATOM 1521 CD LYS A 160 -23.048 -39.173 10.794 1.00 24.54 C ATOM 1522 CE LYS A 160 -23.956 -38.060 10.273 1.00 30.54 C ATOM 1523 NZ LYS A 160 -25.300 -38.038 10.917 1.00 34.07 N ATOM 1524 HZ1 LYS A 160 -25.782 -38.942 10.740 1.00 0.00 H ATOM 1525 HZ2 LYS A 160 -25.190 -37.897 11.941 1.00 0.00 H ATOM 1526 HZ3 LYS A 160 -25.862 -37.260 10.517 1.00 0.00 H ATOM 1527 H LYS A 160 -20.311 -36.446 9.330 1.00 0.00 H ATOM 1528 N GLU A 161 -20.029 -37.403 6.371 1.00 14.62 N ATOM 1529 CA GLU A 161 -20.229 -37.447 4.932 1.00 16.12 C ATOM 1530 C GLU A 161 -19.200 -36.706 4.091 1.00 16.01 C ATOM 1531 O GLU A 161 -19.203 -36.883 2.867 1.00 17.42 O ATOM 1532 CB GLU A 161 -21.615 -36.879 4.587 1.00 20.45 C ATOM 1533 CG GLU A 161 -22.763 -37.622 5.240 1.00 28.08 C ATOM 1534 CD GLU A 161 -22.881 -39.064 4.765 1.00 37.43 C ATOM 1535 OE1 GLU A 161 -22.427 -39.370 3.640 1.00 36.41 O ATOM 1536 OE2 GLU A 161 -23.424 -39.894 5.526 1.00 45.30 O ATOM 1537 H GLU A 161 -20.097 -36.491 6.866 1.00 0.00 H ATOM 1538 N MET A 162 -18.340 -35.887 4.680 1.00 15.88 N ATOM 1539 CA MET A 162 -17.426 -35.037 3.929 1.00 16.15 C ATOM 1540 C MET A 162 -16.001 -35.253 4.397 1.00 14.65 C ATOM 1541 O MET A 162 -15.780 -35.555 5.574 1.00 12.51 O ATOM 1542 CB MET A 162 -17.766 -33.553 4.115 1.00 16.63 C ATOM 1543 CG MET A 162 -19.086 -33.128 3.551 1.00 17.26 C ATOM 1544 SD MET A 162 -19.404 -31.442 4.077 1.00 16.51 S ATOM 1545 CE MET A 162 -20.486 -30.883 2.779 1.00 16.92 C ATOM 1546 H MET A 162 -18.317 -35.850 5.719 1.00 0.00 H ATOM 1547 N PRO A 163 -15.013 -35.081 3.516 1.00 14.08 N ATOM 1548 CA PRO A 163 -13.620 -35.137 3.952 1.00 13.21 C ATOM 1549 C PRO A 163 -13.276 -33.918 4.784 1.00 13.30 C ATOM 1550 O PRO A 163 -13.939 -32.876 4.669 1.00 13.31 O ATOM 1551 CB PRO A 163 -12.829 -35.150 2.637 1.00 14.58 C ATOM 1552 CG PRO A 163 -13.708 -34.486 1.672 1.00 17.29 C ATOM 1553 CD PRO A 163 -15.110 -34.883 2.056 1.00 17.30 C ATOM 1554 N PRO A 164 -12.245 -34.006 5.628 1.00 16.03 N ATOM 1555 CA PRO A 164 -11.915 -32.875 6.511 1.00 15.57 C ATOM 1556 C PRO A 164 -11.438 -31.626 5.782 1.00 14.33 C ATOM 1557 O PRO A 164 -11.408 -30.557 6.403 1.00 14.25 O ATOM 1558 CB PRO A 164 -10.819 -33.442 7.426 1.00 16.60 C ATOM 1559 CG PRO A 164 -10.306 -34.671 6.738 1.00 17.90 C ATOM 1560 CD PRO A 164 -11.403 -35.191 5.871 1.00 17.77 C ATOM 1561 N THR A 165 -11.078 -31.717 4.501 1.00 12.49 N ATOM 1562 CA THR A 165 -10.691 -30.555 3.706 1.00 12.41 C ATOM 1563 C THR A 165 -11.854 -29.921 2.959 1.00 12.32 C ATOM 1564 O THR A 165 -11.663 -28.898 2.295 1.00 11.63 O ATOM 1565 CB THR A 165 -9.641 -30.937 2.675 1.00 13.65 C ATOM 1566 OG1 THR A 165 -10.083 -32.101 1.975 1.00 13.94 O ATOM 1567 CG2 THR A 165 -8.299 -31.201 3.334 1.00 14.67 C ATOM 1568 HG1 THR A 165 -10.942 -31.906 1.523 1.00 0.00 H ATOM 1569 H THR A 165 -11.073 -32.654 4.050 1.00 0.00 H ATOM 1570 N ASN A 166 -13.032 -30.502 3.012 1.00 13.10 N ATOM 1571 CA ASN A 166 -14.151 -29.966 2.252 1.00 13.48 C ATOM 1572 C ASN A 166 -14.383 -28.501 2.630 1.00 11.96 C ATOM 1573 O ASN A 166 -14.576 -28.204 3.820 1.00 10.61 O ATOM 1574 CB ASN A 166 -15.405 -30.788 2.506 1.00 14.82 C ATOM 1575 CG ASN A 166 -16.584 -30.294 1.711 1.00 18.70 C ATOM 1576 OD1 ASN A 166 -17.152 -29.254 2.024 1.00 19.34 O ATOM 1577 ND2 ASN A 166 -16.957 -31.032 0.671 1.00 20.99 N ATOM 1578 HD22 ASN A 166 -16.444 -31.908 0.444 1.00 0.00 H ATOM 1579 HD21 ASN A 166 -17.762 -30.734 0.084 1.00 0.00 H ATOM 1580 H ASN A 166 -13.165 -31.349 3.600 1.00 0.00 H ATOM 1581 N PRO A 167 -14.373 -27.566 1.673 1.00 12.39 N ATOM 1582 CA PRO A 167 -14.536 -26.146 2.038 1.00 11.47 C ATOM 1583 C PRO A 167 -15.800 -25.833 2.817 1.00 10.70 C ATOM 1584 O PRO A 167 -15.786 -24.914 3.648 1.00 9.87 O ATOM 1585 CB PRO A 167 -14.536 -25.441 0.676 1.00 12.83 C ATOM 1586 CG PRO A 167 -13.729 -26.346 -0.206 1.00 14.86 C ATOM 1587 CD PRO A 167 -14.093 -27.718 0.232 1.00 15.15 C ATOM 1588 N ILE A 168 -16.905 -26.534 2.550 1.00 11.86 N ATOM 1589 CA ILE A 168 -18.133 -26.298 3.306 1.00 11.80 C ATOM 1590 C ILE A 168 -17.938 -26.714 4.758 1.00 9.97 C ATOM 1591 O ILE A 168 -18.266 -25.969 5.691 1.00 9.92 O ATOM 1592 CB ILE A 168 -19.314 -27.046 2.660 1.00 14.02 C ATOM 1593 CG1 ILE A 168 -19.536 -26.572 1.217 1.00 18.20 C ATOM 1594 CG2 ILE A 168 -20.590 -26.830 3.474 1.00 12.92 C ATOM 1595 CD1 ILE A 168 -20.410 -27.504 0.412 1.00 21.05 C ATOM 1596 H ILE A 168 -16.891 -27.253 1.799 1.00 0.00 H ATOM 1597 N ARG A 169 -17.408 -27.915 4.966 1.00 10.03 N ATOM 1598 CA ARG A 169 -17.086 -28.372 6.314 1.00 10.01 C ATOM 1599 C ARG A 169 -16.130 -27.407 7.013 1.00 9.52 C ATOM 1600 O ARG A 169 -16.304 -27.097 8.198 1.00 9.01 O ATOM 1601 CB ARG A 169 -16.498 -29.783 6.239 1.00 10.33 C ATOM 1602 CG ARG A 169 -16.086 -30.359 7.571 1.00 10.77 C ATOM 1603 CD ARG A 169 -15.645 -31.811 7.434 1.00 12.27 C ATOM 1604 NE ARG A 169 -15.038 -32.287 8.671 1.00 13.39 N ATOM 1605 CZ ARG A 169 -14.634 -33.532 8.886 1.00 16.14 C ATOM 1606 NH1 ARG A 169 -14.776 -34.459 7.949 1.00 17.27 N ATOM 1607 NH2 ARG A 169 -14.085 -33.852 10.047 1.00 17.07 N ATOM 1608 HE ARG A 169 -14.912 -31.600 9.442 1.00 0.00 H ATOM 1609 HH12 ARG A 169 -14.456 -35.432 8.128 1.00 0.00 H ATOM 1610 HH11 ARG A 169 -15.207 -34.213 7.035 1.00 0.00 H ATOM 1611 HH22 ARG A 169 -13.767 -34.827 10.221 1.00 0.00 H ATOM 1612 HH21 ARG A 169 -13.972 -33.129 10.786 1.00 0.00 H ATOM 1613 H ARG A 169 -17.220 -28.539 4.155 1.00 0.00 H ATOM 1614 N LEU A 170 -15.132 -26.896 6.292 1.00 9.70 N ATOM 1615 CA LEU A 170 -14.170 -25.991 6.914 1.00 8.79 C ATOM 1616 C LEU A 170 -14.810 -24.665 7.306 1.00 9.62 C ATOM 1617 O LEU A 170 -14.559 -24.156 8.403 1.00 10.62 O ATOM 1618 CB LEU A 170 -12.993 -25.739 5.979 1.00 9.33 C ATOM 1619 CG LEU A 170 -12.054 -26.914 5.755 1.00 11.04 C ATOM 1620 CD1 LEU A 170 -11.028 -26.519 4.695 1.00 12.59 C ATOM 1621 CD2 LEU A 170 -11.375 -27.349 7.054 1.00 12.78 C ATOM 1622 H LEU A 170 -15.039 -27.142 5.286 1.00 0.00 H ATOM 1623 N GLY A 171 -15.618 -24.079 6.419 1.00 9.86 N ATOM 1624 CA GLY A 171 -16.263 -22.813 6.739 1.00 10.91 C ATOM 1625 C GLY A 171 -17.274 -22.966 7.856 1.00 10.67 C ATOM 1626 O GLY A 171 -17.444 -22.069 8.689 1.00 11.41 O ATOM 1627 H GLY A 171 -15.787 -24.528 5.496 1.00 0.00 H ATOM 1628 N LEU A 172 -17.954 -24.109 7.888 1.00 9.94 N ATOM 1629 CA LEU A 172 -18.825 -24.431 9.009 1.00 10.42 C ATOM 1630 C LEU A 172 -18.050 -24.442 10.316 1.00 10.91 C ATOM 1631 O LEU A 172 -18.456 -23.807 11.292 1.00 11.34 O ATOM 1632 CB LEU A 172 -19.486 -25.786 8.772 1.00 10.18 C ATOM 1633 CG LEU A 172 -20.156 -26.431 9.982 1.00 10.06 C ATOM 1634 CD1 LEU A 172 -21.288 -25.569 10.493 1.00 10.19 C ATOM 1635 CD2 LEU A 172 -20.659 -27.802 9.616 1.00 10.59 C ATOM 1636 H LEU A 172 -17.862 -24.782 7.101 1.00 0.00 H ATOM 1637 N ALA A 173 -16.945 -25.191 10.365 1.00 11.22 N ATOM 1638 CA ALA A 173 -16.165 -25.280 11.599 1.00 11.40 C ATOM 1639 C ALA A 173 -15.632 -23.911 12.007 1.00 10.44 C ATOM 1640 O ALA A 173 -15.641 -23.552 13.191 1.00 8.83 O ATOM 1641 CB ALA A 173 -15.016 -26.273 11.419 1.00 11.47 C ATOM 1642 H ALA A 173 -16.637 -25.714 9.520 1.00 0.00 H ATOM 1643 N LEU A 174 -15.170 -23.129 11.033 1.00 10.26 N ATOM 1644 CA LEU A 174 -14.730 -21.769 11.313 1.00 9.73 C ATOM 1645 C LEU A 174 -15.816 -20.982 12.033 1.00 9.06 C ATOM 1646 O LEU A 174 -15.583 -20.413 13.109 1.00 9.39 O ATOM 1647 CB LEU A 174 -14.343 -21.076 10.005 1.00 10.12 C ATOM 1648 CG LEU A 174 -13.917 -19.603 10.061 1.00 11.84 C ATOM 1649 CD1 LEU A 174 -12.573 -19.444 10.746 1.00 13.81 C ATOM 1650 CD2 LEU A 174 -13.878 -19.036 8.635 1.00 12.61 C ATOM 1651 H LEU A 174 -15.123 -23.494 10.060 1.00 0.00 H ATOM 1652 N ASN A 175 -17.019 -20.951 11.450 1.00 8.38 N ATOM 1653 CA ASN A 175 -18.099 -20.127 11.983 1.00 8.48 C ATOM 1654 C ASN A 175 -18.603 -20.658 13.322 1.00 8.92 C ATOM 1655 O ASN A 175 -18.909 -19.875 14.229 1.00 11.00 O ATOM 1656 CB ASN A 175 -19.234 -20.054 10.966 1.00 8.94 C ATOM 1657 CG ASN A 175 -18.887 -19.172 9.779 1.00 10.51 C ATOM 1658 OD1 ASN A 175 -17.719 -18.815 9.571 1.00 10.24 O ATOM 1659 ND2 ASN A 175 -19.899 -18.797 9.006 1.00 11.70 N ATOM 1660 HD22 ASN A 175 -20.864 -19.121 9.219 1.00 0.00 H ATOM 1661 HD21 ASN A 175 -19.727 -18.179 8.188 1.00 0.00 H ATOM 1662 H ASN A 175 -17.188 -21.526 10.600 1.00 0.00 H ATOM 1663 N PHE A 176 -18.681 -21.982 13.471 1.00 7.61 N ATOM 1664 CA PHE A 176 -19.104 -22.559 14.743 1.00 7.68 C ATOM 1665 C PHE A 176 -18.090 -22.230 15.835 1.00 8.04 C ATOM 1666 O PHE A 176 -18.465 -21.940 16.980 1.00 8.95 O ATOM 1667 CB PHE A 176 -19.290 -24.071 14.559 1.00 7.51 C ATOM 1668 CG PHE A 176 -20.085 -24.769 15.652 1.00 8.66 C ATOM 1669 CD1 PHE A 176 -20.922 -24.085 16.512 1.00 9.75 C ATOM 1670 CD2 PHE A 176 -19.983 -26.142 15.790 1.00 11.74 C ATOM 1671 CE1 PHE A 176 -21.649 -24.755 17.493 1.00 10.27 C ATOM 1672 CE2 PHE A 176 -20.697 -26.822 16.769 1.00 12.84 C ATOM 1673 CZ PHE A 176 -21.536 -26.119 17.622 1.00 11.64 C ATOM 1674 H PHE A 176 -18.439 -22.607 12.675 1.00 0.00 H ATOM 1675 N SER A 177 -16.799 -22.203 15.487 1.00 9.40 N ATOM 1676 CA SER A 177 -15.776 -21.834 16.462 1.00 9.97 C ATOM 1677 C SER A 177 -15.960 -20.397 16.929 1.00 9.80 C ATOM 1678 O SER A 177 -15.802 -20.095 18.116 1.00 10.59 O ATOM 1679 CB SER A 177 -14.387 -22.026 15.855 1.00 10.36 C ATOM 1680 OG SER A 177 -13.377 -21.674 16.780 1.00 10.50 O ATOM 1681 HG SER A 177 -13.454 -22.246 17.585 1.00 0.00 H ATOM 1682 H SER A 177 -16.521 -22.447 14.515 1.00 0.00 H ATOM 1683 N VAL A 178 -16.290 -19.490 16.001 1.00 8.82 N ATOM 1684 CA VAL A 178 -16.539 -18.098 16.380 1.00 10.44 C ATOM 1685 C VAL A 178 -17.804 -17.991 17.229 1.00 11.83 C ATOM 1686 O VAL A 178 -17.858 -17.216 18.192 1.00 14.26 O ATOM 1687 CB VAL A 178 -16.613 -17.200 15.129 1.00 11.94 C ATOM 1688 CG1 VAL A 178 -17.144 -15.794 15.483 1.00 13.48 C ATOM 1689 CG2 VAL A 178 -15.237 -17.083 14.491 1.00 12.22 C ATOM 1690 H VAL A 178 -16.370 -19.776 15.004 1.00 0.00 H ATOM 1691 N PHE A 179 -18.846 -18.743 16.875 1.00 10.82 N ATOM 1692 CA PHE A 179 -20.018 -18.855 17.738 1.00 10.55 C ATOM 1693 C PHE A 179 -19.613 -19.224 19.162 1.00 9.98 C ATOM 1694 O PHE A 179 -20.019 -18.570 20.130 1.00 10.79 O ATOM 1695 CB PHE A 179 -20.984 -19.900 17.175 1.00 10.04 C ATOM 1696 CG PHE A 179 -22.088 -20.273 18.126 1.00 10.06 C ATOM 1697 CD1 PHE A 179 -23.247 -19.519 18.202 1.00 10.32 C ATOM 1698 CD2 PHE A 179 -21.961 -21.375 18.947 1.00 10.70 C ATOM 1699 CE1 PHE A 179 -24.258 -19.861 19.086 1.00 11.61 C ATOM 1700 CE2 PHE A 179 -22.976 -21.719 19.834 1.00 12.51 C ATOM 1701 CZ PHE A 179 -24.118 -20.955 19.897 1.00 13.01 C ATOM 1702 H PHE A 179 -18.824 -19.257 15.971 1.00 0.00 H ATOM 1703 N HIS A 180 -18.827 -20.291 19.308 1.00 9.13 N ATOM 1704 CA HIS A 180 -18.377 -20.706 20.630 1.00 10.11 C ATOM 1705 C HIS A 180 -17.648 -19.573 21.335 1.00 11.94 C ATOM 1706 O HIS A 180 -17.884 -19.301 22.519 1.00 13.87 O ATOM 1707 CB HIS A 180 -17.452 -21.926 20.518 1.00 10.51 C ATOM 1708 CG HIS A 180 -18.153 -23.213 20.196 1.00 11.04 C ATOM 1709 ND1 HIS A 180 -19.265 -23.654 20.882 1.00 11.87 N ATOM 1710 CD2 HIS A 180 -17.859 -24.179 19.296 1.00 10.88 C ATOM 1711 CE1 HIS A 180 -19.639 -24.826 20.401 1.00 12.11 C ATOM 1712 NE2 HIS A 180 -18.800 -25.169 19.438 1.00 11.43 N ATOM 1713 H HIS A 180 -18.532 -20.832 18.470 1.00 0.00 H ATOM 1714 N TYR A 181 -16.739 -18.903 20.626 1.00 10.52 N ATOM 1715 CA TYR A 181 -15.838 -17.975 21.298 1.00 11.91 C ATOM 1716 C TYR A 181 -16.592 -16.783 21.874 1.00 15.60 C ATOM 1717 O TYR A 181 -16.392 -16.417 23.039 1.00 17.67 O ATOM 1718 CB TYR A 181 -14.750 -17.506 20.336 1.00 11.73 C ATOM 1719 CG TYR A 181 -13.652 -16.758 21.037 1.00 14.49 C ATOM 1720 CD1 TYR A 181 -13.754 -15.395 21.273 1.00 17.24 C ATOM 1721 CD2 TYR A 181 -12.511 -17.419 21.482 1.00 16.48 C ATOM 1722 CE1 TYR A 181 -12.753 -14.712 21.929 1.00 20.41 C ATOM 1723 CE2 TYR A 181 -11.507 -16.739 22.131 1.00 19.96 C ATOM 1724 CZ TYR A 181 -11.632 -15.387 22.349 1.00 21.93 C ATOM 1725 OH TYR A 181 -10.630 -14.704 22.999 1.00 24.55 O ATOM 1726 HH TYR A 181 -10.506 -15.085 23.905 1.00 0.00 H ATOM 1727 H TYR A 181 -16.673 -19.042 19.597 1.00 0.00 H ATOM 1728 N GLU A 182 -17.462 -16.156 21.077 1.00 14.84 N ATOM 1729 CA GLU A 182 -18.020 -14.873 21.455 1.00 17.30 C ATOM 1730 C GLU A 182 -19.534 -14.836 21.597 1.00 16.44 C ATOM 1731 O GLU A 182 -20.053 -13.825 22.080 1.00 17.49 O ATOM 1732 CB GLU A 182 -17.598 -13.800 20.445 1.00 20.10 C ATOM 1733 CG GLU A 182 -18.136 -14.008 19.063 1.00 21.58 C ATOM 1734 CD GLU A 182 -17.809 -12.849 18.169 1.00 23.17 C ATOM 1735 OE1 GLU A 182 -18.295 -12.835 17.023 1.00 21.02 O ATOM 1736 OE2 GLU A 182 -17.064 -11.950 18.626 1.00 25.89 O ATOM 1737 H GLU A 182 -17.742 -16.593 20.176 1.00 0.00 H ATOM 1738 N ILE A 183 -20.258 -15.873 21.189 1.00 14.58 N ATOM 1739 CA ILE A 183 -21.696 -15.957 21.442 1.00 13.84 C ATOM 1740 C ILE A 183 -21.984 -16.842 22.641 1.00 14.90 C ATOM 1741 O ILE A 183 -22.704 -16.445 23.557 1.00 15.66 O ATOM 1742 CB ILE A 183 -22.453 -16.467 20.195 1.00 12.30 C ATOM 1743 CG1 ILE A 183 -22.082 -15.652 18.955 1.00 11.52 C ATOM 1744 CG2 ILE A 183 -23.964 -16.432 20.444 1.00 12.97 C ATOM 1745 CD1 ILE A 183 -22.355 -14.162 19.073 1.00 12.67 C ATOM 1746 H ILE A 183 -19.789 -16.646 20.676 1.00 0.00 H ATOM 1747 N ALA A 184 -21.419 -18.049 22.643 1.00 14.58 N ATOM 1748 CA ALA A 184 -21.609 -18.995 23.729 1.00 15.37 C ATOM 1749 C ALA A 184 -20.640 -18.774 24.885 1.00 16.45 C ATOM 1750 O ALA A 184 -20.766 -19.441 25.915 1.00 18.25 O ATOM 1751 CB ALA A 184 -21.472 -20.415 23.184 1.00 15.91 C ATOM 1752 H ALA A 184 -20.820 -18.324 21.838 1.00 0.00 H ATOM 1753 N ASN A 185 -19.692 -17.851 24.753 1.00 16.50 N ATOM 1754 CA ASN A 185 -18.709 -17.598 25.808 1.00 26.09 C ATOM 1755 C ASN A 185 -17.996 -18.891 26.205 1.00 21.79 C ATOM 1756 O ASN A 185 -17.774 -19.174 27.385 1.00 21.51 O ATOM 1757 CB ASN A 185 -19.362 -16.934 27.023 1.00 41.47 C ATOM 1758 CG ASN A 185 -19.899 -15.545 26.711 1.00 53.95 C ATOM 1759 OD1 ASN A 185 -19.366 -14.838 25.855 1.00 58.26 O ATOM 1760 ND2 ASN A 185 -20.962 -15.151 27.403 1.00 58.44 N ATOM 1761 HD22 ASN A 185 -21.380 -15.781 28.117 1.00 0.00 H ATOM 1762 HD21 ASN A 185 -21.376 -14.213 27.231 1.00 0.00 H ATOM 1763 H ASN A 185 -19.648 -17.293 23.876 1.00 0.00 H ATOM 1764 N SER A 186 -17.632 -19.680 25.193 1.00 19.09 N ATOM 1765 CA SER A 186 -16.924 -20.947 25.355 1.00 16.64 C ATOM 1766 C SER A 186 -15.599 -20.869 24.603 1.00 14.83 C ATOM 1767 O SER A 186 -15.407 -21.577 23.607 1.00 13.40 O ATOM 1768 CB SER A 186 -17.755 -22.115 24.822 1.00 16.87 C ATOM 1769 OG SER A 186 -18.988 -22.275 25.510 1.00 18.78 O ATOM 1770 HG SER A 186 -19.482 -23.042 25.125 1.00 0.00 H ATOM 1771 H SER A 186 -17.867 -19.374 24.227 1.00 0.00 H ATOM 1772 N PRO A 187 -14.664 -20.024 25.044 1.00 17.00 N ATOM 1773 CA PRO A 187 -13.440 -19.830 24.242 1.00 17.38 C ATOM 1774 C PRO A 187 -12.606 -21.088 24.085 1.00 14.58 C ATOM 1775 O PRO A 187 -11.963 -21.274 23.046 1.00 13.75 O ATOM 1776 CB PRO A 187 -12.681 -18.734 25.005 1.00 20.56 C ATOM 1777 CG PRO A 187 -13.290 -18.678 26.354 1.00 20.89 C ATOM 1778 CD PRO A 187 -14.709 -19.125 26.211 1.00 19.23 C ATOM 1779 N GLU A 188 -12.594 -21.969 25.078 1.00 13.54 N ATOM 1780 CA GLU A 188 -11.787 -23.174 24.961 1.00 15.76 C ATOM 1781 C GLU A 188 -12.379 -24.142 23.946 1.00 12.17 C ATOM 1782 O GLU A 188 -11.635 -24.783 23.188 1.00 10.66 O ATOM 1783 CB GLU A 188 -11.630 -23.807 26.338 1.00 24.31 C ATOM 1784 CG GLU A 188 -10.650 -23.016 27.162 1.00 33.44 C ATOM 1785 CD GLU A 188 -10.536 -23.484 28.579 1.00 41.26 C ATOM 1786 OE1 GLU A 188 -11.490 -24.110 29.090 1.00 45.24 O ATOM 1787 OE2 GLU A 188 -9.483 -23.210 29.192 1.00 42.42 O ATOM 1788 H GLU A 188 -13.158 -21.799 25.935 1.00 0.00 H ATOM 1789 N GLU A 189 -13.709 -24.248 23.892 1.00 13.82 N ATOM 1790 CA GLU A 189 -14.336 -25.004 22.814 1.00 12.94 C ATOM 1791 C GLU A 189 -13.972 -24.419 21.456 1.00 11.94 C ATOM 1792 O GLU A 189 -13.658 -25.158 20.516 1.00 13.07 O ATOM 1793 CB GLU A 189 -15.853 -25.015 22.991 1.00 13.75 C ATOM 1794 CG GLU A 189 -16.586 -25.924 22.020 1.00 13.79 C ATOM 1795 CD GLU A 189 -16.333 -27.398 22.296 1.00 13.97 C ATOM 1796 OE1 GLU A 189 -15.819 -27.723 23.389 1.00 12.41 O ATOM 1797 OE2 GLU A 189 -16.662 -28.220 21.423 1.00 14.95 O ATOM 1798 H GLU A 189 -14.297 -23.792 24.618 1.00 0.00 H ATOM 1799 N ALA A 190 -14.024 -23.092 21.331 1.00 10.56 N ATOM 1800 CA ALA A 190 -13.687 -22.437 20.070 1.00 10.69 C ATOM 1801 C ALA A 190 -12.269 -22.776 19.630 1.00 11.33 C ATOM 1802 O ALA A 190 -12.021 -23.078 18.453 1.00 10.79 O ATOM 1803 CB ALA A 190 -13.843 -20.929 20.223 1.00 12.31 C ATOM 1804 H ALA A 190 -14.310 -22.513 22.146 1.00 0.00 H ATOM 1805 N ILE A 191 -11.322 -22.697 20.565 1.00 11.51 N ATOM 1806 CA ILE A 191 -9.919 -22.966 20.267 1.00 12.52 C ATOM 1807 C ILE A 191 -9.731 -24.426 19.885 1.00 11.63 C ATOM 1808 O ILE A 191 -9.045 -24.749 18.908 1.00 10.68 O ATOM 1809 CB ILE A 191 -9.050 -22.573 21.478 1.00 14.85 C ATOM 1810 CG1 ILE A 191 -9.059 -21.050 21.636 1.00 15.98 C ATOM 1811 CG2 ILE A 191 -7.624 -23.076 21.326 1.00 16.55 C ATOM 1812 CD1 ILE A 191 -8.497 -20.549 22.946 1.00 17.56 C ATOM 1813 H ILE A 191 -11.591 -22.436 21.535 1.00 0.00 H ATOM 1814 N SER A 192 -10.322 -25.331 20.666 1.00 14.24 N ATOM 1815 CA SER A 192 -10.213 -26.756 20.374 1.00 15.24 C ATOM 1816 C SER A 192 -10.793 -27.076 19.003 1.00 13.28 C ATOM 1817 O SER A 192 -10.175 -27.792 18.204 1.00 13.56 O ATOM 1818 CB SER A 192 -10.919 -27.567 21.459 1.00 16.74 C ATOM 1819 OG SER A 192 -10.776 -28.962 21.231 1.00 18.35 O ATOM 1820 HG SER A 192 -11.172 -29.194 20.354 1.00 0.00 H ATOM 1821 H SER A 192 -10.868 -25.017 21.494 1.00 0.00 H ATOM 1822 N LEU A 193 -11.982 -26.550 18.709 1.00 10.85 N ATOM 1823 CA LEU A 193 -12.594 -26.836 17.417 1.00 10.78 C ATOM 1824 C LEU A 193 -11.715 -26.330 16.278 1.00 11.06 C ATOM 1825 O LEU A 193 -11.490 -27.043 15.294 1.00 10.81 O ATOM 1826 CB LEU A 193 -13.994 -26.227 17.344 1.00 11.16 C ATOM 1827 CG LEU A 193 -14.717 -26.339 16.003 1.00 13.22 C ATOM 1828 CD1 LEU A 193 -14.695 -27.763 15.481 1.00 14.74 C ATOM 1829 CD2 LEU A 193 -16.145 -25.852 16.136 1.00 13.72 C ATOM 1830 H LEU A 193 -12.469 -25.940 19.396 1.00 0.00 H ATOM 1831 N ALA A 194 -11.191 -25.109 16.399 1.00 11.69 N ATOM 1832 CA ALA A 194 -10.390 -24.545 15.315 1.00 12.93 C ATOM 1833 C ALA A 194 -9.092 -25.314 15.124 1.00 12.25 C ATOM 1834 O ALA A 194 -8.649 -25.521 13.988 1.00 12.16 O ATOM 1835 CB ALA A 194 -10.092 -23.073 15.587 1.00 14.58 C ATOM 1836 H ALA A 194 -11.353 -24.558 17.266 1.00 0.00 H ATOM 1837 N LYS A 195 -8.459 -25.726 16.222 1.00 11.18 N ATOM 1838 CA LYS A 195 -7.214 -26.482 16.128 1.00 12.88 C ATOM 1839 C LYS A 195 -7.436 -27.829 15.457 1.00 11.64 C ATOM 1840 O LYS A 195 -6.739 -28.181 14.500 1.00 12.74 O ATOM 1841 CB LYS A 195 -6.618 -26.703 17.519 1.00 18.93 C ATOM 1842 CG LYS A 195 -6.039 -25.496 18.202 1.00 27.67 C ATOM 1843 CD LYS A 195 -5.536 -25.902 19.589 1.00 36.13 C ATOM 1844 CE LYS A 195 -4.670 -24.835 20.242 1.00 40.95 C ATOM 1845 NZ LYS A 195 -4.198 -25.262 21.595 1.00 42.39 N ATOM 1846 HZ1 LYS A 195 -5.020 -25.439 22.207 1.00 0.00 H ATOM 1847 HZ2 LYS A 195 -3.636 -26.133 21.506 1.00 0.00 H ATOM 1848 HZ3 LYS A 195 -3.611 -24.510 22.009 1.00 0.00 H ATOM 1849 H LYS A 195 -8.857 -25.506 17.157 1.00 0.00 H ATOM 1850 N THR A 196 -8.384 -28.620 15.971 1.00 13.34 N ATOM 1851 CA THR A 196 -8.630 -29.952 15.425 1.00 13.81 C ATOM 1852 C THR A 196 -9.014 -29.876 13.953 1.00 12.48 C ATOM 1853 O THR A 196 -8.576 -30.697 13.137 1.00 11.37 O ATOM 1854 CB THR A 196 -9.730 -30.636 16.241 1.00 14.79 C ATOM 1855 OG1 THR A 196 -9.270 -30.832 17.583 1.00 14.92 O ATOM 1856 CG2 THR A 196 -10.131 -31.981 15.644 1.00 15.50 C ATOM 1857 HG1 THR A 196 -9.980 -31.274 18.113 1.00 0.00 H ATOM 1858 H THR A 196 -8.955 -28.281 16.772 1.00 0.00 H ATOM 1859 N THR A 197 -9.851 -28.900 13.604 1.00 11.88 N ATOM 1860 CA THR A 197 -10.270 -28.729 12.217 1.00 11.28 C ATOM 1861 C THR A 197 -9.069 -28.454 11.322 1.00 11.57 C ATOM 1862 O THR A 197 -8.924 -29.044 10.242 1.00 12.27 O ATOM 1863 CB THR A 197 -11.281 -27.583 12.122 1.00 11.26 C ATOM 1864 OG1 THR A 197 -12.426 -27.872 12.937 1.00 10.36 O ATOM 1865 CG2 THR A 197 -11.723 -27.382 10.676 1.00 12.34 C ATOM 1866 HG1 THR A 197 -12.141 -27.979 13.879 1.00 0.00 H ATOM 1867 H THR A 197 -10.211 -28.250 14.332 1.00 0.00 H ATOM 1868 N PHE A 198 -8.196 -27.549 11.762 1.00 10.20 N ATOM 1869 CA PHE A 198 -7.019 -27.192 10.976 1.00 11.45 C ATOM 1870 C PHE A 198 -6.091 -28.391 10.816 1.00 11.99 C ATOM 1871 O PHE A 198 -5.641 -28.704 9.705 1.00 12.95 O ATOM 1872 CB PHE A 198 -6.305 -26.019 11.650 1.00 12.65 C ATOM 1873 CG PHE A 198 -5.088 -25.540 10.915 1.00 13.40 C ATOM 1874 CD1 PHE A 198 -5.140 -24.404 10.141 1.00 12.66 C ATOM 1875 CD2 PHE A 198 -3.888 -26.225 11.005 1.00 14.14 C ATOM 1876 CE1 PHE A 198 -4.029 -23.959 9.469 1.00 12.86 C ATOM 1877 CE2 PHE A 198 -2.773 -25.780 10.334 1.00 14.81 C ATOM 1878 CZ PHE A 198 -2.849 -24.646 9.561 1.00 13.99 C ATOM 1879 H PHE A 198 -8.356 -27.089 12.681 1.00 0.00 H ATOM 1880 N ASP A 199 -5.823 -29.097 11.916 1.00 12.12 N ATOM 1881 CA ASP A 199 -4.921 -30.244 11.880 1.00 13.18 C ATOM 1882 C ASP A 199 -5.457 -31.357 10.982 1.00 11.67 C ATOM 1883 O ASP A 199 -4.705 -31.955 10.202 1.00 13.85 O ATOM 1884 CB ASP A 199 -4.695 -30.759 13.304 1.00 18.83 C ATOM 1885 CG ASP A 199 -3.914 -29.782 14.169 1.00 27.16 C ATOM 1886 OD1 ASP A 199 -3.218 -28.897 13.625 1.00 28.78 O ATOM 1887 OD2 ASP A 199 -3.989 -29.904 15.410 1.00 32.52 O ATOM 1888 H ASP A 199 -6.266 -28.825 12.817 1.00 0.00 H ATOM 1889 N GLU A 200 -6.749 -31.665 11.078 1.00 9.39 N ATOM 1890 CA GLU A 200 -7.284 -32.769 10.287 1.00 10.95 C ATOM 1891 C GLU A 200 -7.362 -32.408 8.815 1.00 12.36 C ATOM 1892 O GLU A 200 -7.200 -33.280 7.951 1.00 14.63 O ATOM 1893 CB GLU A 200 -8.656 -33.178 10.802 1.00 15.80 C ATOM 1894 CG GLU A 200 -8.637 -33.923 12.119 1.00 27.25 C ATOM 1895 CD GLU A 200 -9.988 -34.534 12.438 1.00 41.15 C ATOM 1896 OE1 GLU A 200 -10.902 -33.777 12.824 1.00 43.70 O ATOM 1897 OE2 GLU A 200 -10.144 -35.765 12.272 1.00 49.23 O ATOM 1898 H GLU A 200 -7.372 -31.124 11.711 1.00 0.00 H ATOM 1899 N ALA A 201 -7.610 -31.137 8.506 1.00 11.25 N ATOM 1900 CA ALA A 201 -7.505 -30.684 7.124 1.00 11.30 C ATOM 1901 C ALA A 201 -6.069 -30.799 6.629 1.00 10.71 C ATOM 1902 O ALA A 201 -5.806 -31.328 5.538 1.00 10.28 O ATOM 1903 CB ALA A 201 -7.995 -29.243 7.011 1.00 11.75 C ATOM 1904 H ALA A 201 -7.879 -30.465 9.253 1.00 0.00 H ATOM 1905 N MET A 202 -5.117 -30.285 7.410 1.00 10.56 N ATOM 1906 CA MET A 202 -3.720 -30.339 7.008 1.00 11.68 C ATOM 1907 C MET A 202 -3.318 -31.753 6.603 1.00 11.48 C ATOM 1908 O MET A 202 -2.636 -31.950 5.590 1.00 12.25 O ATOM 1909 CB MET A 202 -2.833 -29.829 8.147 1.00 12.63 C ATOM 1910 CG MET A 202 -1.340 -29.993 7.906 1.00 14.67 C ATOM 1911 SD MET A 202 -0.785 -29.259 6.357 1.00 17.35 S ATOM 1912 CE MET A 202 -1.065 -27.521 6.677 1.00 18.81 C ATOM 1913 H MET A 202 -5.376 -29.842 8.314 1.00 0.00 H ATOM 1914 N ALA A 203 -3.736 -32.745 7.380 1.00 10.33 N ATOM 1915 CA ALA A 203 -3.341 -34.125 7.139 1.00 12.00 C ATOM 1916 C ALA A 203 -4.005 -34.728 5.912 1.00 12.94 C ATOM 1917 O ALA A 203 -3.584 -35.805 5.470 1.00 14.25 O ATOM 1918 CB ALA A 203 -3.658 -34.960 8.381 1.00 13.61 C ATOM 1919 H ALA A 203 -4.362 -32.530 8.182 1.00 0.00 H ATOM 1920 N ASP A 204 -5.010 -34.054 5.347 1.00 11.26 N ATOM 1921 CA ASP A 204 -5.735 -34.533 4.178 1.00 13.54 C ATOM 1922 C ASP A 204 -5.409 -33.734 2.915 1.00 13.25 C ATOM 1923 O ASP A 204 -5.870 -34.097 1.825 1.00 13.36 O ATOM 1924 CB ASP A 204 -7.242 -34.499 4.500 1.00 17.24 C ATOM 1925 CG ASP A 204 -8.110 -35.133 3.425 1.00 23.68 C ATOM 1926 OD1 ASP A 204 -7.959 -36.347 3.184 1.00 25.04 O ATOM 1927 OD2 ASP A 204 -8.989 -34.432 2.857 1.00 27.13 O ATOM 1928 H ASP A 204 -5.289 -33.142 5.762 1.00 0.00 H ATOM 1929 N LEU A 205 -4.590 -32.681 3.018 1.00 12.95 N ATOM 1930 CA LEU A 205 -4.281 -31.868 1.844 1.00 13.40 C ATOM 1931 C LEU A 205 -3.599 -32.679 0.753 1.00 12.91 C ATOM 1932 O LEU A 205 -3.730 -32.356 -0.433 1.00 13.89 O ATOM 1933 CB LEU A 205 -3.391 -30.688 2.235 1.00 13.02 C ATOM 1934 CG LEU A 205 -4.070 -29.608 3.075 1.00 13.28 C ATOM 1935 CD1 LEU A 205 -3.039 -28.623 3.554 1.00 12.40 C ATOM 1936 CD2 LEU A 205 -5.142 -28.890 2.254 1.00 14.95 C ATOM 1937 H LEU A 205 -4.171 -32.440 3.939 1.00 0.00 H ATOM 1938 N HIS A 206 -2.848 -33.714 1.126 1.00 12.87 N ATOM 1939 CA HIS A 206 -2.105 -34.480 0.134 1.00 14.02 C ATOM 1940 C HIS A 206 -3.020 -35.173 -0.868 1.00 15.61 C ATOM 1941 O HIS A 206 -2.545 -35.580 -1.932 1.00 16.02 O ATOM 1942 CB HIS A 206 -1.209 -35.512 0.825 1.00 14.76 C ATOM 1943 CG HIS A 206 -1.959 -36.649 1.449 1.00 15.10 C ATOM 1944 ND1 HIS A 206 -2.130 -37.863 0.817 1.00 16.27 N ATOM 1945 CD2 HIS A 206 -2.580 -36.759 2.646 1.00 15.15 C ATOM 1946 CE1 HIS A 206 -2.822 -38.670 1.600 1.00 16.68 C ATOM 1947 NE2 HIS A 206 -3.112 -38.024 2.713 1.00 16.66 N ATOM 1948 H HIS A 206 -2.792 -33.977 2.131 1.00 0.00 H ATOM 1949 N THR A 207 -4.314 -35.309 -0.562 1.00 16.45 N ATOM 1950 CA THR A 207 -5.247 -35.977 -1.466 1.00 16.98 C ATOM 1951 C THR A 207 -5.802 -35.059 -2.547 1.00 17.84 C ATOM 1952 O THR A 207 -6.460 -35.557 -3.469 1.00 19.31 O ATOM 1953 CB THR A 207 -6.426 -36.570 -0.684 1.00 15.20 C ATOM 1954 OG1 THR A 207 -7.243 -35.513 -0.165 1.00 13.16 O ATOM 1955 CG2 THR A 207 -5.933 -37.448 0.462 1.00 15.74 C ATOM 1956 HG1 THR A 207 -6.701 -34.945 0.438 1.00 0.00 H ATOM 1957 H THR A 207 -4.665 -34.930 0.341 1.00 0.00 H ATOM 1958 N LEU A 208 -5.532 -33.756 -2.474 1.00 16.29 N ATOM 1959 CA LEU A 208 -6.227 -32.751 -3.260 1.00 17.03 C ATOM 1960 C LEU A 208 -5.454 -32.345 -4.509 1.00 19.30 C ATOM 1961 O LEU A 208 -4.221 -32.350 -4.536 1.00 18.89 O ATOM 1962 CB LEU A 208 -6.472 -31.504 -2.419 1.00 16.49 C ATOM 1963 CG LEU A 208 -7.248 -31.720 -1.120 1.00 15.31 C ATOM 1964 CD1 LEU A 208 -7.452 -30.400 -0.419 1.00 13.35 C ATOM 1965 CD2 LEU A 208 -8.586 -32.404 -1.390 1.00 16.29 C ATOM 1966 H LEU A 208 -4.786 -33.443 -1.821 1.00 0.00 H ATOM 1967 N SER A 209 -6.207 -31.965 -5.537 1.00 18.76 N ATOM 1968 CA SER A 209 -5.651 -31.260 -6.677 1.00 20.73 C ATOM 1969 C SER A 209 -5.209 -29.862 -6.257 1.00 19.60 C ATOM 1970 O SER A 209 -5.557 -29.369 -5.184 1.00 17.41 O ATOM 1971 CB SER A 209 -6.686 -31.156 -7.793 1.00 21.68 C ATOM 1972 OG SER A 209 -7.702 -30.232 -7.428 1.00 21.32 O ATOM 1973 HG SER A 209 -8.146 -30.542 -6.599 1.00 0.00 H ATOM 1974 H SER A 209 -7.225 -32.179 -5.524 1.00 0.00 H ATOM 1975 N GLU A 210 -4.440 -29.206 -7.132 1.00 21.58 N ATOM 1976 CA GLU A 210 -3.976 -27.858 -6.821 1.00 27.29 C ATOM 1977 C GLU A 210 -5.150 -26.911 -6.590 1.00 21.62 C ATOM 1978 O GLU A 210 -5.104 -26.063 -5.694 1.00 19.27 O ATOM 1979 CB GLU A 210 -3.083 -27.335 -7.944 1.00 42.75 C ATOM 1980 CG GLU A 210 -2.449 -25.987 -7.637 1.00 56.26 C ATOM 1981 CD GLU A 210 -1.459 -25.551 -8.698 1.00 66.91 C ATOM 1982 OE1 GLU A 210 -1.578 -26.013 -9.852 1.00 68.80 O ATOM 1983 OE2 GLU A 210 -0.560 -24.747 -8.374 1.00 71.81 O ATOM 1984 H GLU A 210 -4.173 -29.655 -8.031 1.00 0.00 H ATOM 1985 N ASP A 211 -6.207 -27.034 -7.392 1.00 22.72 N ATOM 1986 CA ASP A 211 -7.352 -26.139 -7.244 1.00 26.16 C ATOM 1987 C ASP A 211 -8.077 -26.371 -5.922 1.00 21.21 C ATOM 1988 O ASP A 211 -8.443 -25.411 -5.235 1.00 21.18 O ATOM 1989 CB ASP A 211 -8.313 -26.319 -8.416 1.00 37.37 C ATOM 1990 CG ASP A 211 -7.865 -25.571 -9.654 1.00 49.31 C ATOM 1991 OD1 ASP A 211 -6.651 -25.295 -9.783 1.00 46.34 O ATOM 1992 OD2 ASP A 211 -8.730 -25.258 -10.496 1.00 61.06 O ATOM 1993 H ASP A 211 -6.217 -27.770 -8.126 1.00 0.00 H ATOM 1994 N SER A 212 -8.307 -27.632 -5.557 1.00 20.41 N ATOM 1995 CA SER A 212 -8.948 -27.927 -4.278 1.00 18.22 C ATOM 1996 C SER A 212 -8.054 -27.523 -3.111 1.00 15.81 C ATOM 1997 O SER A 212 -8.537 -27.018 -2.091 1.00 15.13 O ATOM 1998 CB SER A 212 -9.294 -29.414 -4.200 1.00 19.96 C ATOM 1999 OG SER A 212 -10.207 -29.782 -5.214 1.00 22.18 O ATOM 2000 HG SER A 212 -10.411 -30.748 -5.138 1.00 0.00 H ATOM 2001 H SER A 212 -8.028 -28.411 -6.187 1.00 0.00 H ATOM 2002 N TYR A 213 -6.747 -27.747 -3.246 1.00 14.85 N ATOM 2003 CA TYR A 213 -5.792 -27.298 -2.240 1.00 14.14 C ATOM 2004 C TYR A 213 -5.939 -25.804 -1.967 1.00 14.79 C ATOM 2005 O TYR A 213 -5.980 -25.373 -0.809 1.00 13.95 O ATOM 2006 CB TYR A 213 -4.386 -27.634 -2.729 1.00 15.53 C ATOM 2007 CG TYR A 213 -3.255 -27.177 -1.855 1.00 17.16 C ATOM 2008 CD1 TYR A 213 -2.697 -28.023 -0.911 1.00 17.14 C ATOM 2009 CD2 TYR A 213 -2.705 -25.910 -2.010 1.00 21.06 C ATOM 2010 CE1 TYR A 213 -1.630 -27.611 -0.131 1.00 20.00 C ATOM 2011 CE2 TYR A 213 -1.648 -25.495 -1.237 1.00 24.17 C ATOM 2012 CZ TYR A 213 -1.117 -26.346 -0.303 1.00 25.76 C ATOM 2013 OH TYR A 213 -0.065 -25.914 0.461 1.00 31.78 O ATOM 2014 HH TYR A 213 0.206 -26.634 1.084 1.00 0.00 H ATOM 2015 H TYR A 213 -6.401 -28.253 -4.086 1.00 0.00 H ATOM 2016 N LYS A 214 -6.018 -24.994 -3.028 1.00 18.07 N ATOM 2017 CA LYS A 214 -6.194 -23.554 -2.853 1.00 20.18 C ATOM 2018 C LYS A 214 -7.491 -23.242 -2.119 1.00 16.82 C ATOM 2019 O LYS A 214 -7.520 -22.393 -1.220 1.00 15.40 O ATOM 2020 CB LYS A 214 -6.171 -22.855 -4.215 1.00 24.35 C ATOM 2021 CG LYS A 214 -6.317 -21.336 -4.146 1.00 27.33 C ATOM 2022 CD LYS A 214 -6.567 -20.733 -5.518 1.00 34.55 C ATOM 2023 CE LYS A 214 -6.729 -19.219 -5.441 1.00 41.13 C ATOM 2024 NZ LYS A 214 -5.480 -18.537 -4.993 1.00 45.44 N ATOM 2025 HZ1 LYS A 214 -5.218 -18.882 -4.047 1.00 0.00 H ATOM 2026 HZ2 LYS A 214 -4.713 -18.745 -5.664 1.00 0.00 H ATOM 2027 HZ3 LYS A 214 -5.641 -17.510 -4.957 1.00 0.00 H ATOM 2028 H LYS A 214 -5.954 -25.393 -3.986 1.00 0.00 H ATOM 2029 N ASP A 215 -8.582 -23.915 -2.494 1.00 15.14 N ATOM 2030 CA ASP A 215 -9.861 -23.701 -1.822 1.00 16.27 C ATOM 2031 C ASP A 215 -9.753 -23.987 -0.324 1.00 14.52 C ATOM 2032 O ASP A 215 -10.180 -23.178 0.509 1.00 14.94 O ATOM 2033 CB ASP A 215 -10.939 -24.587 -2.446 1.00 21.20 C ATOM 2034 CG ASP A 215 -11.352 -24.136 -3.847 1.00 27.32 C ATOM 2035 OD1 ASP A 215 -11.142 -22.958 -4.209 1.00 28.24 O ATOM 2036 OD2 ASP A 215 -11.910 -24.977 -4.581 1.00 30.48 O ATOM 2037 H ASP A 215 -8.520 -24.600 -3.274 1.00 0.00 H ATOM 2038 N SER A 216 -9.184 -25.138 0.037 1.00 14.12 N ATOM 2039 CA SER A 216 -9.142 -25.545 1.440 1.00 13.76 C ATOM 2040 C SER A 216 -8.200 -24.668 2.259 1.00 14.19 C ATOM 2041 O SER A 216 -8.544 -24.241 3.372 1.00 13.54 O ATOM 2042 CB SER A 216 -8.726 -27.012 1.540 1.00 13.46 C ATOM 2043 OG SER A 216 -9.625 -27.830 0.820 1.00 14.44 O ATOM 2044 HG SER A 216 -10.536 -27.727 1.194 1.00 0.00 H ATOM 2045 H SER A 216 -8.765 -25.754 -0.689 1.00 0.00 H ATOM 2046 N THR A 217 -6.993 -24.410 1.749 1.00 13.98 N ATOM 2047 CA THR A 217 -6.038 -23.637 2.533 1.00 13.95 C ATOM 2048 C THR A 217 -6.496 -22.196 2.730 1.00 15.99 C ATOM 2049 O THR A 217 -6.084 -21.555 3.702 1.00 14.65 O ATOM 2050 CB THR A 217 -4.649 -23.657 1.891 1.00 14.39 C ATOM 2051 OG1 THR A 217 -4.702 -23.104 0.565 1.00 14.51 O ATOM 2052 CG2 THR A 217 -4.095 -25.079 1.853 1.00 14.83 C ATOM 2053 HG1 THR A 217 -3.797 -23.124 0.164 1.00 0.00 H ATOM 2054 H THR A 217 -6.737 -24.757 0.803 1.00 0.00 H ATOM 2055 N LEU A 218 -7.345 -21.675 1.842 1.00 18.88 N ATOM 2056 CA LEU A 218 -7.892 -20.338 2.052 1.00 21.46 C ATOM 2057 C LEU A 218 -8.673 -20.269 3.359 1.00 15.95 C ATOM 2058 O LEU A 218 -8.538 -19.309 4.130 1.00 13.70 O ATOM 2059 CB LEU A 218 -8.782 -19.944 0.873 1.00 30.77 C ATOM 2060 CG LEU A 218 -9.338 -18.520 0.941 1.00 43.88 C ATOM 2061 CD1 LEU A 218 -9.328 -17.892 -0.439 1.00 47.56 C ATOM 2062 CD2 LEU A 218 -10.749 -18.495 1.531 1.00 51.15 C ATOM 2063 H LEU A 218 -7.617 -22.222 1.000 1.00 0.00 H ATOM 2064 N ILE A 219 -9.510 -21.272 3.621 1.00 15.36 N ATOM 2065 CA ILE A 219 -10.298 -21.257 4.848 1.00 13.97 C ATOM 2066 C ILE A 219 -9.437 -21.647 6.042 1.00 11.70 C ATOM 2067 O ILE A 219 -9.656 -21.159 7.152 1.00 11.73 O ATOM 2068 CB ILE A 219 -11.525 -22.172 4.709 1.00 15.51 C ATOM 2069 CG1 ILE A 219 -12.347 -21.767 3.482 1.00 20.29 C ATOM 2070 CG2 ILE A 219 -12.388 -22.084 5.948 1.00 13.53 C ATOM 2071 CD1 ILE A 219 -13.297 -22.830 3.011 1.00 23.53 C ATOM 2072 H ILE A 219 -9.601 -22.063 2.952 1.00 0.00 H ATOM 2073 N MET A 220 -8.446 -22.519 5.842 1.00 11.60 N ATOM 2074 CA MET A 220 -7.533 -22.866 6.926 1.00 11.29 C ATOM 2075 C MET A 220 -6.787 -21.637 7.428 1.00 12.38 C ATOM 2076 O MET A 220 -6.521 -21.508 8.630 1.00 13.85 O ATOM 2077 CB MET A 220 -6.548 -23.935 6.448 1.00 11.99 C ATOM 2078 CG MET A 220 -7.190 -25.277 6.173 1.00 12.34 C ATOM 2079 SD MET A 220 -6.070 -26.452 5.396 1.00 12.66 S ATOM 2080 CE MET A 220 -4.916 -26.769 6.708 1.00 12.90 C ATOM 2081 H MET A 220 -8.324 -22.955 4.906 1.00 0.00 H ATOM 2082 N GLN A 221 -6.420 -20.732 6.518 1.00 11.61 N ATOM 2083 CA GLN A 221 -5.768 -19.494 6.925 1.00 14.99 C ATOM 2084 C GLN A 221 -6.661 -18.693 7.866 1.00 11.38 C ATOM 2085 O GLN A 221 -6.173 -18.050 8.805 1.00 11.05 O ATOM 2086 CB GLN A 221 -5.410 -18.667 5.689 1.00 26.25 C ATOM 2087 CG GLN A 221 -4.666 -17.376 5.984 1.00 38.60 C ATOM 2088 CD GLN A 221 -3.254 -17.626 6.469 1.00 47.49 C ATOM 2089 OE1 GLN A 221 -2.407 -18.106 5.715 1.00 52.11 O ATOM 2090 NE2 GLN A 221 -2.996 -17.311 7.736 1.00 48.16 N ATOM 2091 HE22 GLN A 221 -3.745 -16.908 8.334 1.00 0.00 H ATOM 2092 HE21 GLN A 221 -2.046 -17.468 8.128 1.00 0.00 H ATOM 2093 H GLN A 221 -6.601 -20.912 5.510 1.00 0.00 H ATOM 2094 N LEU A 222 -7.975 -18.720 7.631 1.00 11.56 N ATOM 2095 CA LEU A 222 -8.891 -18.005 8.512 1.00 12.61 C ATOM 2096 C LEU A 222 -8.944 -18.656 9.889 1.00 12.10 C ATOM 2097 O LEU A 222 -9.009 -17.957 10.905 1.00 12.74 O ATOM 2098 CB LEU A 222 -10.287 -17.942 7.888 1.00 14.36 C ATOM 2099 CG LEU A 222 -10.399 -17.278 6.515 1.00 16.60 C ATOM 2100 CD1 LEU A 222 -11.836 -17.322 6.029 1.00 16.34 C ATOM 2101 CD2 LEU A 222 -9.895 -15.848 6.559 1.00 17.93 C ATOM 2102 H LEU A 222 -8.346 -19.252 6.818 1.00 0.00 H ATOM 2103 N LEU A 223 -8.910 -19.996 9.948 1.00 10.95 N ATOM 2104 CA LEU A 223 -8.814 -20.670 11.236 1.00 11.22 C ATOM 2105 C LEU A 223 -7.559 -20.245 11.987 1.00 12.39 C ATOM 2106 O LEU A 223 -7.610 -19.959 13.188 1.00 11.36 O ATOM 2107 CB LEU A 223 -8.822 -22.189 11.043 1.00 11.32 C ATOM 2108 CG LEU A 223 -10.139 -22.788 10.572 1.00 11.02 C ATOM 2109 CD1 LEU A 223 -9.898 -24.172 9.978 1.00 12.36 C ATOM 2110 CD2 LEU A 223 -11.130 -22.869 11.737 1.00 10.36 C ATOM 2111 H LEU A 223 -8.952 -20.555 9.072 1.00 0.00 H ATOM 2112 N ARG A 224 -6.420 -20.207 11.293 1.00 13.69 N ATOM 2113 CA ARG A 224 -5.169 -19.834 11.949 1.00 16.54 C ATOM 2114 C ARG A 224 -5.180 -18.369 12.377 1.00 14.00 C ATOM 2115 O ARG A 224 -4.701 -18.036 13.465 1.00 13.51 O ATOM 2116 CB ARG A 224 -3.989 -20.127 11.019 1.00 23.59 C ATOM 2117 CG ARG A 224 -2.597 -20.026 11.660 1.00 31.46 C ATOM 2118 CD ARG A 224 -2.474 -20.725 13.033 1.00 37.20 C ATOM 2119 NE ARG A 224 -2.744 -22.165 13.007 1.00 40.17 N ATOM 2120 CZ ARG A 224 -2.567 -22.980 14.049 1.00 40.97 C ATOM 2121 NH1 ARG A 224 -2.117 -22.508 15.205 1.00 41.65 N ATOM 2122 NH2 ARG A 224 -2.840 -24.274 13.939 1.00 42.39 N ATOM 2123 HE ARG A 224 -3.096 -22.578 12.120 1.00 0.00 H ATOM 2124 HH12 ARG A 224 -1.982 -23.150 16.012 1.00 0.00 H ATOM 2125 HH11 ARG A 224 -1.899 -21.496 15.304 1.00 0.00 H ATOM 2126 HH22 ARG A 224 -2.701 -24.906 14.753 1.00 0.00 H ATOM 2127 HH21 ARG A 224 -3.193 -24.656 13.039 1.00 0.00 H ATOM 2128 H ARG A 224 -6.423 -20.444 10.280 1.00 0.00 H ATOM 2129 N ASP A 225 -5.732 -17.482 11.548 1.00 13.03 N ATOM 2130 CA ASP A 225 -5.871 -16.079 11.940 1.00 13.81 C ATOM 2131 C ASP A 225 -6.555 -15.958 13.293 1.00 13.90 C ATOM 2132 O ASP A 225 -6.109 -15.212 14.174 1.00 14.71 O ATOM 2133 CB ASP A 225 -6.692 -15.303 10.912 1.00 15.24 C ATOM 2134 CG ASP A 225 -5.984 -15.124 9.593 1.00 18.06 C ATOM 2135 OD1 ASP A 225 -4.743 -15.218 9.541 1.00 19.48 O ATOM 2136 OD2 ASP A 225 -6.699 -14.859 8.606 1.00 18.38 O ATOM 2137 H ASP A 225 -6.067 -17.791 10.613 1.00 0.00 H ATOM 2138 N ASN A 226 -7.676 -16.658 13.459 1.00 13.52 N ATOM 2139 CA ASN A 226 -8.418 -16.574 14.712 1.00 12.60 C ATOM 2140 C ASN A 226 -7.623 -17.177 15.860 1.00 12.81 C ATOM 2141 O ASN A 226 -7.550 -16.596 16.950 1.00 14.13 O ATOM 2142 CB ASN A 226 -9.760 -17.286 14.573 1.00 11.56 C ATOM 2143 CG ASN A 226 -10.755 -16.520 13.728 1.00 12.22 C ATOM 2144 OD1 ASN A 226 -10.608 -15.318 13.494 1.00 12.48 O ATOM 2145 ND2 ASN A 226 -11.806 -17.212 13.291 1.00 12.74 N ATOM 2146 HD22 ASN A 226 -11.890 -18.225 13.512 1.00 0.00 H ATOM 2147 HD21 ASN A 226 -12.543 -16.739 12.729 1.00 0.00 H ATOM 2148 H ASN A 226 -8.024 -17.267 12.691 1.00 0.00 H ATOM 2149 N LEU A 227 -7.021 -18.344 15.633 1.00 12.66 N ATOM 2150 CA LEU A 227 -6.249 -18.990 16.684 1.00 13.85 C ATOM 2151 C LEU A 227 -5.115 -18.098 17.158 1.00 17.45 C ATOM 2152 O LEU A 227 -4.796 -18.071 18.352 1.00 18.90 O ATOM 2153 CB LEU A 227 -5.710 -20.329 16.179 1.00 13.98 C ATOM 2154 CG LEU A 227 -6.696 -21.503 16.210 1.00 13.89 C ATOM 2155 CD1 LEU A 227 -6.117 -22.699 15.471 1.00 15.42 C ATOM 2156 CD2 LEU A 227 -7.022 -21.876 17.651 1.00 13.20 C ATOM 2157 H LEU A 227 -7.103 -18.796 14.700 1.00 0.00 H ATOM 2158 N THR A 228 -4.497 -17.360 16.234 1.00 19.17 N ATOM 2159 CA THR A 228 -3.419 -16.441 16.600 1.00 23.24 C ATOM 2160 C THR A 228 -3.905 -15.365 17.561 1.00 23.70 C ATOM 2161 O THR A 228 -3.171 -14.948 18.465 1.00 25.88 O ATOM 2162 CB THR A 228 -2.833 -15.814 15.335 1.00 26.16 C ATOM 2163 OG1 THR A 228 -2.222 -16.844 14.549 1.00 26.06 O ATOM 2164 CG2 THR A 228 -1.795 -14.750 15.668 1.00 28.94 C ATOM 2165 HG1 THR A 228 -2.904 -17.519 14.304 1.00 0.00 H ATOM 2166 H THR A 228 -4.786 -17.439 15.238 1.00 0.00 H ATOM 2167 N LEU A 229 -5.134 -14.892 17.380 1.00 21.41 N ATOM 2168 CA LEU A 229 -5.681 -13.883 18.276 1.00 23.92 C ATOM 2169 C LEU A 229 -6.251 -14.479 19.555 1.00 23.27 C ATOM 2170 O LEU A 229 -6.330 -13.774 20.568 1.00 25.11 O ATOM 2171 CB LEU A 229 -6.776 -13.092 17.569 1.00 27.10 C ATOM 2172 CG LEU A 229 -6.336 -12.258 16.380 1.00 32.52 C ATOM 2173 CD1 LEU A 229 -7.570 -11.706 15.719 1.00 34.94 C ATOM 2174 CD2 LEU A 229 -5.401 -11.143 16.814 1.00 35.71 C ATOM 2175 H LEU A 229 -5.711 -15.246 16.590 1.00 0.00 H ATOM 2176 N TRP A 230 -6.652 -15.748 19.532 1.00 20.25 N ATOM 2177 CA TRP A 230 -7.256 -16.389 20.690 1.00 18.75 C ATOM 2178 C TRP A 230 -6.232 -16.992 21.640 1.00 22.06 C ATOM 2179 O TRP A 230 -6.590 -17.319 22.776 1.00 24.02 O ATOM 2180 CB TRP A 230 -8.220 -17.492 20.239 1.00 16.02 C ATOM 2181 CG TRP A 230 -9.428 -16.975 19.502 1.00 14.93 C ATOM 2182 CD1 TRP A 230 -9.876 -15.691 19.467 1.00 15.71 C ATOM 2183 CD2 TRP A 230 -10.339 -17.741 18.698 1.00 13.69 C ATOM 2184 NE1 TRP A 230 -11.017 -15.607 18.695 1.00 14.79 N ATOM 2185 CE2 TRP A 230 -11.319 -16.850 18.214 1.00 13.84 C ATOM 2186 CE3 TRP A 230 -10.422 -19.092 18.342 1.00 12.63 C ATOM 2187 CZ2 TRP A 230 -12.370 -17.263 17.401 1.00 13.12 C ATOM 2188 CZ3 TRP A 230 -11.471 -19.500 17.536 1.00 11.95 C ATOM 2189 CH2 TRP A 230 -12.427 -18.586 17.069 1.00 12.79 C ATOM 2190 HE1 TRP A 230 -11.559 -14.739 18.509 1.00 0.00 H ATOM 2191 H TRP A 230 -6.530 -16.299 18.658 1.00 0.00 H ATOM 2192 N THR A 231 -4.988 -17.157 21.205 1.00 24.34 N ATOM 2193 CA THR A 231 -3.970 -17.815 22.011 1.00 29.82 C ATOM 2194 C THR A 231 -2.710 -16.967 22.085 1.00 38.24 C ATOM 2195 O THR A 231 -1.730 -17.356 22.719 1.00 43.96 O ATOM 2196 CB THR A 231 -3.613 -19.203 21.441 1.00 27.44 C ATOM 2197 OG1 THR A 231 -3.039 -19.056 20.138 1.00 27.10 O ATOM 2198 CG2 THR A 231 -4.855 -20.082 21.342 1.00 25.61 C ATOM 2199 HG1 THR A 231 -3.691 -18.613 19.540 1.00 0.00 H ATOM 2200 H THR A 231 -4.733 -16.805 20.260 1.00 0.00 H TER 2201 THR A 231 HETATM 2202 MG MG A 1 -16.196 -9.279 9.247 1.00 14.62 MG HETATM 2203 O HOH 2 -25.678 -32.103 -4.864 1.00 17.05 O HETATM 2204 O HOH 3 -37.840 2.883 18.678 1.00 34.75 O HETATM 2205 O HOH 4 -19.009 -37.736 0.929 1.00 28.66 O HETATM 2206 O HOH 5 -32.719 -26.057 20.091 1.00 41.61 O HETATM 2207 O HOH 6 -38.590 -9.913 12.345 1.00 51.29 O HETATM 2208 O HOH 7 -34.965 -4.236 19.398 1.00 11.28 O HETATM 2209 O HOH 8 -10.231 -26.816 -11.322 1.00 37.89 O HETATM 2210 O HOH 9 -11.736 -36.049 10.545 1.00 46.57 O HETATM 2211 O HOH 10 -1.265 -14.198 19.671 1.00 33.60 O HETATM 2212 O HOH 11 -31.075 -20.623 31.619 1.00 20.81 O HETATM 2213 O HOH 12 -38.392 -27.975 -13.447 1.00 46.05 O HETATM 2214 O HOH 13 -40.955 -20.956 -15.605 1.00 0.01 O HETATM 2215 O HOH 14 -23.228 -12.063 -15.356 1.00 33.98 O HETATM 2216 O HOH 15 -5.170 -31.333 16.991 1.00 28.86 O HETATM 2217 O HOH 16 -37.918 -23.703 -13.676 1.00 39.48 O HETATM 2218 O HOH 17 -42.902 -24.080 6.250 1.00 32.49 O HETATM 2219 O HOH 18 -11.631 -20.912 -2.948 1.00 36.91 O HETATM 2220 O HOH 19 -6.370 -37.909 4.265 1.00 41.22 O HETATM 2221 O HOH 20 -33.939 -22.751 20.841 1.00 26.03 O HETATM 2222 O HOH 21 -38.430 7.118 21.560 1.00 21.65 O HETATM 2223 O HOH 22 -19.490 -14.771 -5.754 1.00 37.25 O HETATM 2224 O HOH 23 -35.925 -26.780 -2.243 1.00 20.91 O HETATM 2225 O HOH 24 -40.350 -26.794 -2.975 1.00 27.31 O HETATM 2226 O HOH 25 -39.337 -22.420 -11.704 1.00 15.98 O HETATM 2227 O HOH 26 -31.062 -18.153 33.904 1.00 32.07 O HETATM 2228 O HOH 27 -34.356 6.857 7.183 1.00 36.06 O HETATM 2229 O HOH 28 -33.951 -0.683 22.724 1.00 34.71 O HETATM 2230 O HOH 29 -24.165 -18.300 5.700 1.00 31.79 O HETATM 2231 O HOH 30 -11.070 -30.982 19.689 1.00 23.71 O HETATM 2232 O HOH 31 -3.030 -13.953 10.963 1.00 40.40 O HETATM 2233 O HOH 32 -31.950 15.058 20.761 1.00 51.06 O HETATM 2234 O HOH 33 -18.131 -5.445 -11.637 1.00 38.76 O HETATM 2235 O HOH 34 -32.973 -26.777 -9.516 1.00 23.55 O HETATM 2236 O HOH 35 -21.618 -16.150 1.942 1.00 25.49 O HETATM 2237 O HOH 36 -30.015 3.682 25.047 1.00 26.34 O HETATM 2238 O HOH 37 -23.451 -16.828 25.995 1.00 34.30 O HETATM 2239 O HOH 38 -10.926 -38.046 13.189 1.00 33.01 O HETATM 2240 O HOH 39 -35.811 -24.253 13.650 1.00 46.57 O HETATM 2241 O HOH 40 -41.686 -14.824 -5.145 1.00 16.56 O HETATM 2242 O HOH 41 -7.313 -35.861 8.172 1.00 20.74 O HETATM 2243 O HOH 42 -36.309 -29.569 -7.382 1.00 33.61 O HETATM 2244 O HOH 43 -20.892 -15.457 -8.041 1.00 33.91 O HETATM 2245 O HOH 44 -35.888 -22.811 -7.149 1.00 8.69 O HETATM 2246 O HOH 45 -20.205 -29.135 19.843 1.00 46.46 O HETATM 2247 O HOH 46 -21.379 -19.193 -0.150 1.00 28.79 O HETATM 2248 O HOH 47 -27.219 -17.485 -15.272 1.00 16.25 O HETATM 2249 O HOH 48 -3.041 -21.771 -0.945 1.00 37.14 O HETATM 2250 O HOH 49 -17.376 -30.726 21.630 1.00 16.81 O HETATM 2251 O HOH 50 -21.186 -5.365 0.655 1.00 29.14 O HETATM 2252 O HOH 51 -23.573 -24.040 -11.893 1.00 29.01 O HETATM 2253 O HOH 52 -31.392 -26.923 -2.564 1.00 10.23 O HETATM 2254 O HOH 53 -35.485 -4.850 17.322 1.00 26.14 O HETATM 2255 O HOH 54 -28.617 -21.758 -12.833 1.00 18.47 O HETATM 2256 O HOH 55 -33.365 -1.654 -5.731 1.00 38.16 O HETATM 2257 O HOH 56 -8.732 -16.288 23.900 1.00 29.93 O HETATM 2258 O HOH 57 -27.378 -38.077 -1.268 1.00 27.35 O HETATM 2259 O HOH 58 -30.629 13.437 21.900 1.00 43.20 O HETATM 2260 O HOH 59 -42.228 -20.281 -17.601 1.00 11.62 O HETATM 2261 O HOH 60 -28.800 13.475 25.236 1.00 38.73 O HETATM 2262 O HOH 61 -21.934 -17.289 -10.170 1.00 30.90 O HETATM 2263 O HOH 62 -29.938 -4.886 21.032 1.00 12.41 O HETATM 2264 O HOH 63 -19.502 -10.569 -4.752 1.00 31.11 O HETATM 2265 O HOH 64 -34.731 14.918 21.546 1.00 22.18 O HETATM 2266 O HOH 65 -35.630 -24.161 9.371 1.00 23.24 O HETATM 2267 O HOH 66 -35.874 -21.402 12.136 1.00 33.24 O HETATM 2268 O HOH 67 -26.971 -3.634 4.147 1.00 18.24 O HETATM 2269 O HOH 68 -24.602 -34.364 18.185 1.00 45.07 O HETATM 2270 O HOH 69 -18.067 -6.181 -3.097 1.00 45.38 O HETATM 2271 O HOH 70 -22.326 -10.940 -17.120 1.00 38.24 O HETATM 2272 O HOH 71 -25.150 -15.957 4.010 1.00 18.36 O HETATM 2273 O HOH 72 -2.463 -26.708 14.964 1.00 51.71 O HETATM 2274 O HOH 73 -29.444 -29.123 -5.814 1.00 27.08 O HETATM 2275 O HOH 74 -26.771 -0.913 21.927 1.00 25.10 O HETATM 2276 O HOH 75 -33.955 -4.303 -3.993 1.00 33.67 O HETATM 2277 O HOH 76 -23.657 -13.988 24.030 1.00 28.31 O HETATM 2278 O HOH 77 -33.847 -34.063 -4.737 1.00 28.83 O HETATM 2279 O HOH 78 -22.912 -21.156 -14.574 1.00 34.60 O HETATM 2280 O HOH 79 -7.717 -16.777 3.801 1.00 23.47 O HETATM 2281 O HOH 80 -36.885 3.031 16.224 1.00 13.14 O HETATM 2282 O HOH 81 -18.009 -23.822 27.482 1.00 30.81 O HETATM 2283 O HOH 82 -28.631 -20.895 25.141 1.00 16.58 O HETATM 2284 O HOH 83 -29.747 10.535 21.409 1.00 33.82 O HETATM 2285 O HOH 84 -12.908 -34.307 14.544 1.00 39.35 O HETATM 2286 O HOH 85 -20.523 -13.647 15.736 1.00 9.07 O HETATM 2287 O HOH 86 -28.794 -35.598 4.237 1.00 49.40 O HETATM 2288 O HOH 87 -38.695 -20.218 -19.956 1.00 24.09 O HETATM 2289 O HOH 88 -31.895 -24.641 15.197 1.00 18.35 O HETATM 2290 O HOH 89 -30.151 -1.205 3.860 1.00 41.47 O HETATM 2291 O HOH 90 -36.727 -23.871 -3.315 1.00 20.12 O HETATM 2292 O HOH 91 -29.961 -18.303 -15.591 1.00 14.60 O HETATM 2293 O HOH 92 -23.100 -26.324 -1.235 1.00 20.19 O HETATM 2294 O HOH 93 -16.683 -1.297 -4.138 1.00 45.55 O HETATM 2295 O HOH 94 -42.407 -22.535 -3.750 1.00 11.83 O HETATM 2296 O HOH 95 -45.548 -17.226 -9.902 1.00 33.08 O HETATM 2297 O HOH 96 -38.634 -15.701 3.955 1.00 14.03 O HETATM 2298 O HOH 97 -20.308 -23.626 23.534 1.00 18.59 O HETATM 2299 O HOH 98 -25.944 -9.091 14.022 1.00 9.25 O HETATM 2300 O HOH 99 -12.166 -31.832 11.370 1.00 13.68 O HETATM 2301 O HOH 100 -33.317 -7.656 -0.694 1.00 18.17 O HETATM 2302 O HOH 101 -33.057 -27.372 11.234 1.00 36.98 O HETATM 2303 O HOH 102 -33.528 -27.774 -1.056 1.00 11.61 O HETATM 2304 O HOH 103 -26.359 -12.003 -18.297 1.00 30.50 O HETATM 2305 O HOH 104 -25.959 -23.842 -11.545 1.00 23.16 O HETATM 2306 O HOH 105 -34.349 -25.814 -12.192 1.00 35.40 O HETATM 2307 O HOH 106 -14.679 -26.758 25.704 1.00 27.71 O HETATM 2308 O HOH 107 -22.713 -2.134 -2.556 1.00 29.35 O HETATM 2309 O HOH 108 -17.930 -34.442 0.027 1.00 42.35 O HETATM 2310 O HOH 109 -27.314 -23.000 23.946 1.00 23.19 O HETATM 2311 O HOH 110 -41.480 -23.041 -10.213 1.00 24.64 O HETATM 2312 O HOH 111 -12.247 -21.496 -0.232 1.00 23.71 O HETATM 2313 O HOH 112 -22.815 -7.950 19.777 1.00 21.32 O HETATM 2314 O HOH 113 -29.920 -27.751 23.642 1.00 46.78 O HETATM 2315 O HOH 114 -13.696 -30.329 13.053 1.00 16.37 O HETATM 2316 O HOH 115 -11.603 -20.043 14.141 1.00 17.95 O HETATM 2317 O HOH 116 -11.018 -28.922 -1.310 1.00 16.70 O HETATM 2318 O HOH 117 -40.269 -16.910 1.767 1.00 27.95 O HETATM 2319 O HOH 118 -34.685 -9.981 0.572 1.00 24.58 O HETATM 2320 O HOH 119 -29.454 12.198 26.844 1.00 40.96 O HETATM 2321 O HOH 120 -20.767 -37.165 13.082 1.00 22.60 O HETATM 2322 O HOH 121 -22.652 -18.202 -14.459 1.00 37.95 O HETATM 2323 O HOH 122 -35.592 -6.063 6.959 1.00 20.29 O HETATM 2324 O HOH 123 -14.250 -28.042 20.050 1.00 44.07 O HETATM 2325 O HOH 124 -40.838 -16.669 -6.940 1.00 11.03 O HETATM 2326 O HOH 125 -28.575 6.767 24.207 1.00 28.65 O HETATM 2327 O HOH 126 -28.029 -30.396 19.162 1.00 41.17 O HETATM 2328 O HOH 127 -21.773 -12.443 -10.866 1.00 18.64 O HETATM 2329 O HOH 128 -11.044 -30.589 9.253 1.00 12.80 O HETATM 2330 O HOH 129 -27.366 -34.331 14.457 1.00 37.31 O HETATM 2331 O HOH 130 -39.940 -12.131 -2.739 1.00 37.90 O HETATM 2332 O HOH 131 -4.055 -38.927 5.198 1.00 32.36 O HETATM 2333 O HOH 132 -13.665 -36.780 9.089 1.00 37.75 O HETATM 2334 O HOH 133 -32.709 -7.316 20.969 1.00 27.77 O HETATM 2335 O HOH 134 -41.361 -26.105 7.552 1.00 47.91 O HETATM 2336 O HOH 135 -43.490 -17.996 -9.256 1.00 18.54 O HETATM 2337 O HOH 136 -18.040 -27.879 18.983 1.00 19.68 O HETATM 2338 O HOH 137 -40.627 -19.520 2.241 1.00 24.96 O HETATM 2339 O HOH 138 -15.672 -10.894 20.845 1.00 28.45 O HETATM 2340 O HOH 139 -35.556 -16.913 -18.772 1.00 21.46 O HETATM 2341 O HOH 140 -25.970 -20.790 -12.459 1.00 32.10 O HETATM 2342 O HOH 141 -11.943 -31.680 -0.119 1.00 14.67 O HETATM 2343 O HOH 142 -1.986 -37.825 6.658 1.00 13.29 O HETATM 2344 O HOH 143 -30.794 7.539 22.683 1.00 25.05 O HETATM 2345 O HOH 144 -23.811 -28.610 20.578 1.00 20.98 O HETATM 2346 O HOH 145 -39.465 -10.891 3.926 1.00 41.93 O HETATM 2347 O HOH 146 -18.649 -7.819 -7.587 1.00 45.47 O HETATM 2348 O HOH 147 -37.802 -11.010 -3.488 1.00 17.48 O HETATM 2349 O HOH 148 -39.320 -21.991 -1.129 1.00 27.37 O HETATM 2350 O HOH 149 -36.650 -0.767 10.820 1.00 20.30 O HETATM 2351 O HOH 150 -37.053 -26.836 5.396 1.00 11.87 O HETATM 2352 O HOH 151 -24.727 -36.893 0.439 1.00 21.69 O HETATM 2353 O HOH 152 -22.399 -7.335 14.762 1.00 13.52 O HETATM 2354 O HOH 153 -6.398 -14.801 5.761 1.00 31.44 O HETATM 2355 O HOH 154 -21.852 -19.882 2.524 1.00 43.31 O HETATM 2356 O HOH 155 -37.939 -7.254 12.080 1.00 23.09 O HETATM 2357 O HOH 156 -18.809 -1.126 12.493 1.00 21.78 O HETATM 2358 O HOH 157 -24.383 -20.615 25.829 1.00 30.75 O HETATM 2359 O HOH 158 -11.547 -25.183 -9.965 1.00 47.63 O HETATM 2360 O HOH 159 -6.231 -37.939 -5.054 1.00 39.00 O HETATM 2361 O HOH 160 -4.574 -13.011 13.146 1.00 30.29 O HETATM 2362 O HOH 161 -8.810 -25.308 24.127 1.00 23.16 O HETATM 2363 O HOH 162 -26.896 1.429 -5.870 1.00 14.59 O HETATM 2364 O HOH 163 -14.839 -15.299 25.192 1.00 47.98 O HETATM 2365 O HOH 164 -37.743 -7.424 14.703 1.00 37.84 O HETATM 2366 O HOH 165 -31.406 -1.678 -4.236 1.00 25.48 O HETATM 2367 O HOH 166 -20.738 -1.020 -8.853 1.00 36.61 O HETATM 2368 O HOH 167 -9.100 -32.438 -5.465 1.00 21.63 O HETATM 2369 O HOH 168 -38.813 -17.326 29.128 1.00 39.89 O HETATM 2370 O HOH 169 -28.354 -30.553 16.727 1.00 35.93 O HETATM 2371 O HOH 170 -38.129 -1.456 17.648 1.00 36.43 O HETATM 2372 O HOH 171 -15.454 -30.604 10.998 1.00 23.54 O HETATM 2373 O HOH 172 -16.902 -22.303 3.039 1.00 28.05 O HETATM 2374 O HOH 173 -33.242 -21.615 -13.597 1.00 16.00 O HETATM 2375 O HOH 174 -42.963 -13.911 -1.514 1.00 26.00 O HETATM 2376 O HOH 175 -11.825 -26.071 -7.280 1.00 34.89 O HETATM 2377 O HOH 176 -3.321 -30.854 -9.259 1.00 31.71 O HETATM 2378 O HOH 177 -22.012 -10.405 7.257 1.00 22.06 O HETATM 2379 O HOH 178 -34.738 -21.875 9.534 1.00 23.77 O HETATM 2380 O HOH 179 -32.300 -10.608 17.826 1.00 11.47 O HETATM 2381 O HOH 180 -40.688 -12.352 -4.629 1.00 22.02 O HETATM 2382 O HOH 181 -41.845 -9.134 -2.753 1.00 35.30 O HETATM 2383 O HOH 182 -19.884 -10.308 17.125 1.00 24.64 O HETATM 2384 O HOH 183 -38.836 -10.527 7.679 1.00 30.46 O HETATM 2385 O HOH 184 -18.704 2.617 23.135 1.00 44.16 O HETATM 2386 O HOH 185 -8.995 -12.859 13.360 1.00 33.32 O HETATM 2387 O HOH 186 -20.483 -2.136 18.926 1.00 28.12 O HETATM 2388 O HOH 187 -23.008 -0.004 -6.864 1.00 33.33 O HETATM 2389 O HOH 188 -36.706 -20.375 -15.938 1.00 15.63 O HETATM 2390 O HOH 189 -35.356 -31.558 7.618 1.00 30.54 O HETATM 2391 O HOH 190 -19.209 4.146 16.755 1.00 42.73 O HETATM 2392 O HOH 191 -29.607 -34.965 10.221 1.00 51.27 O HETATM 2393 O HOH 192 -11.694 -23.278 -7.112 1.00 51.67 O HETATM 2394 O HOH 193 -33.257 -29.744 11.043 1.00 46.19 O HETATM 2395 O HOH 194 -45.515 -14.995 -1.989 1.00 40.96 O HETATM 2396 O HOH 195 -26.290 -7.596 22.258 1.00 41.11 O HETATM 2397 O HOH 196 -23.484 -21.812 4.301 1.00 15.80 O HETATM 2398 O HOH 197 -19.122 -10.570 -2.024 1.00 19.95 O HETATM 2399 O HOH 198 -32.241 -16.426 -18.746 1.00 39.16 O HETATM 2400 O HOH 199 -21.261 -42.039 2.964 1.00 51.28 O HETATM 2401 O HOH 200 -38.331 -17.008 9.998 1.00 36.29 O HETATM 2402 O HOH 201 -40.981 -9.968 -11.469 1.00 24.49 O HETATM 2403 O HOH 202 -23.171 -29.766 -4.705 1.00 45.34 O HETATM 2404 O HOH 203 -18.791 -23.190 4.653 1.00 26.05 O HETATM 2405 O HOH 204 -35.062 -6.583 19.578 1.00 35.22 O HETATM 2406 O HOH 205 -22.074 -18.469 -7.366 1.00 21.84 O HETATM 2407 O HOH 206 -9.185 -22.822 -6.602 1.00 42.56 O HETATM 2408 O HOH 207 -13.886 -31.489 15.422 1.00 23.55 O HETATM 2409 O HOH 208 -33.390 6.695 25.238 1.00 32.20 O HETATM 2410 O HOH 209 -37.930 -24.659 -1.123 1.00 25.61 O HETATM 2411 O HOH 210 -19.714 -10.864 21.465 1.00 40.80 O HETATM 2412 O HOH 211 -6.383 -28.424 -10.113 1.00 29.95 O HETATM 2413 O HOH 212 -20.662 -42.002 5.153 1.00 48.70 O HETATM 2414 O HOH 213 -22.135 -26.860 21.742 1.00 21.85 O HETATM 2415 O HOH 214 -35.308 -0.855 -1.225 1.00 52.06 O HETATM 2416 O HOH 215 -14.405 -32.308 -0.473 1.00 38.14 O HETATM 2417 O HOH 216 -30.115 -29.032 -3.234 1.00 23.33 O HETATM 2418 O HOH 217 -29.155 -3.262 -4.466 1.00 11.89 O HETATM 2419 O HOH 218 -25.765 -12.894 -15.856 1.00 23.01 O HETATM 2420 O HOH 219 -36.451 -11.898 15.129 1.00 34.20 O HETATM 2421 O HOH 220 -25.456 -3.196 -2.000 1.00 32.44 O HETATM 2422 O HOH 221 -37.288 -16.493 12.704 1.00 36.67 O HETATM 2423 O HOH 222 -18.999 -31.665 17.047 1.00 36.22 O HETATM 2424 O HOH 223 -41.425 -30.262 -3.643 1.00 45.62 O HETATM 2425 O HOH 224 -2.493 -23.377 18.179 1.00 48.27 O HETATM 2426 O HOH 225 -20.346 -10.074 -17.696 1.00 36.85 O HETATM 2427 O HOH 226 -12.520 -27.875 -3.512 1.00 22.99 O HETATM 2428 O HOH 227 -22.221 -11.559 21.718 1.00 43.64 O HETATM 2429 O HOH 228 -20.158 -35.835 15.317 1.00 36.57 O HETATM 2430 O HOH 229 -13.291 -30.397 18.313 1.00 28.82 O HETATM 2431 O HOH 230 -27.379 -3.614 1.213 1.00 48.59 O HETATM 2432 O HOH 231 -38.636 -8.887 -15.566 1.00 29.02 O HETATM 2433 O HOH 232 -18.839 8.367 18.804 1.00 41.68 O HETATM 2434 O HOH 233 -33.246 -26.210 17.622 1.00 36.46 O HETATM 2435 O HOH 234 -35.124 -34.913 1.457 1.00 38.84 O HETATM 2436 O HOH 235 -41.753 -10.214 -15.067 1.00 31.26 O HETATM 2437 O HOH 236 -20.960 -24.758 -1.435 1.00 33.20 O HETATM 2438 O HOH 237 -32.122 -4.364 22.551 1.00 30.37 O HETATM 2439 O HOH 238 -25.065 -0.316 -4.966 1.00 32.25 O HETATM 2440 O HOH 239 -42.365 -11.295 -0.911 1.00 42.56 O HETATM 2441 O HOH 240 -18.508 -1.282 -9.631 1.00 38.75 O HETATM 2442 O HOH 241 -38.045 -31.125 -4.379 1.00 36.90 O HETATM 2443 O HOH 242 -35.769 5.123 5.377 1.00 49.20 O HETATM 2444 O HOH 243 -36.563 -21.614 10.447 1.00 36.29 O HETATM 2445 O HOH 244 -30.208 13.921 27.564 1.00 42.70 O HETATM 2446 O HOH 245 -34.532 -23.956 15.991 1.00 38.41 O HETATM 2447 O HOH 246 -38.907 0.089 19.083 1.00 45.16 O HETATM 2448 O HOH 247 -7.106 -26.478 22.647 1.00 27.67 O HETATM 2449 O HOH 248 -41.364 -17.724 27.238 1.00 45.31 O HETATM 2450 O HOH 249 -16.636 -6.469 -7.847 1.00 45.64 O HETATM 2451 O HOH 250 -40.037 -15.997 9.048 1.00 43.55 O HETATM 2452 O HOH 251 -0.051 -31.943 1.907 1.00 16.32 O HETATM 2453 O HOH 252 -17.462 -28.015 -1.720 1.00 31.06 O HETATM 2454 O HOH 253 -16.944 -39.484 4.166 1.00 48.01 O HETATM 2455 O HOH 254 -36.804 6.574 11.072 1.00 20.62 O HETATM 2456 O HOH 255 -20.755 0.617 -5.674 1.00 42.99 O HETATM 2457 O HOH 256 1.198 -23.616 -11.109 1.00 43.98 O HETATM 2458 O HOH 257 -46.482 -14.643 -6.769 1.00 30.16 O HETATM 2459 O HOH 258 -27.390 -2.567 -2.378 1.00 31.27 O HETATM 2460 O HOH 259 -40.341 -30.262 -11.858 1.00 41.26 O HETATM 2461 O HOH 260 -26.933 -36.169 4.165 1.00 43.89 O HETATM 2462 O HOH 261 -41.202 -15.341 20.379 1.00 46.48 O HETATM 2463 O HOH 262 -34.449 10.638 26.178 1.00 37.21 O HETATM 2464 O HOH 263 -15.693 -38.471 2.935 1.00 38.12 O HETATM 2465 O HOH 264 -17.663 -8.422 -0.954 1.00 39.63 O HETATM 2466 O HOH 265 -37.619 0.303 15.163 1.00 27.02 O HETATM 2467 O HOH 266 -35.777 -33.363 6.297 1.00 41.82 O HETATM 2468 O HOH 267 -19.541 -23.082 0.313 1.00 32.72 O HETATM 2469 O HOH 268 -28.077 -32.901 15.734 1.00 41.45 O HETATM 2470 O HOH 269 -27.620 10.510 22.911 1.00 38.55 O HETATM 2471 O HOH 270 -33.809 -10.179 20.136 1.00 27.95 O HETATM 2472 O HOH 271 -33.860 -4.470 4.902 1.00 39.13 O HETATM 2473 O HOH 272 -31.621 -26.948 13.424 1.00 31.66 O HETATM 2474 O HOH 273 -32.869 8.609 26.317 1.00 41.77 O HETATM 2475 O HOH 274 -33.553 -4.440 26.765 1.00 48.07 O HETATM 2476 O HOH 275 -35.684 8.019 25.869 1.00 37.90 O HETATM 2477 O HOH 276 -34.599 -28.083 10.165 1.00 40.83 O HETATM 2478 O HOH 277 -32.636 -35.141 10.506 1.00 47.28 O HETATM 2479 O HOH 278 -1.241 -23.918 19.905 1.00 48.68 O HETATM 2480 O HOH 279 -17.980 -0.182 14.984 1.00 34.09 O HETATM 2481 O HOH 280 -32.658 -5.065 3.003 1.00 30.01 O HETATM 2482 O HOH 281 -37.725 -5.261 8.533 1.00 42.75 O HETATM 2483 O HOH 282 -37.061 -16.268 29.320 1.00 48.13 O HETATM 2484 O HOH 283 -40.097 -33.591 3.537 1.00 43.15 O HETATM 2485 O HOH 284 -29.207 -35.978 7.285 1.00 46.95 O HETATM 2486 O HOH 285 -25.151 -6.453 14.623 1.00 11.15 O HETATM 2487 O HOH 286 -21.136 -25.394 -9.231 1.00 37.95 O HETATM 2488 O HOH 287 -30.570 -35.854 5.291 1.00 52.31 O HETATM 2489 O HOH 288 -40.143 -13.421 4.211 1.00 28.58 O HETATM 2490 O HOH 289 -38.352 -19.253 10.459 1.00 33.86 O HETATM 2491 O HOH 290 -29.421 -21.733 29.806 1.00 21.49 O HETATM 2492 O HOH 291 -16.833 -1.299 -1.983 1.00 52.93 O HETATM 2493 O HOH 292 -37.807 -2.872 9.558 1.00 28.22 O HETATM 2494 O HOH 293 -31.699 -33.640 14.483 1.00 50.98 O HETATM 2495 O HOH 294 -36.227 -19.561 -18.437 1.00 27.30 O HETATM 2496 O HOH 295 -19.368 -26.370 24.368 1.00 25.80 O HETATM 2497 O HOH 296 -20.737 -22.754 3.179 1.00 28.77 O HETATM 2498 O HOH 297 -17.076 -12.337 -8.100 1.00 51.44 O HETATM 2499 O HOH 298 -29.765 -2.477 24.831 1.00 40.20 O HETATM 2500 O HOH 299 -37.569 4.793 14.316 1.00 22.91 O HETATM 2501 O HOH 300 -34.659 -8.997 3.015 1.00 30.63 O HETATM 2502 O HOH 301 -26.151 -15.533 -16.509 1.00 30.90 O HETATM 2503 O HOH 302 -29.529 -14.227 27.910 1.00 43.93 O HETATM 2504 O HOH 303 -40.341 -23.289 -14.629 1.00 40.99 O HETATM 2505 O HOH 304 -20.464 -28.385 22.949 1.00 43.25 O HETATM 2506 O HOH 305 -19.938 -21.325 -6.986 1.00 31.77 O HETATM 2507 O HOH 306 -10.271 -35.228 16.615 1.00 14.72 O HETATM 2508 O HOH 307 -39.040 6.703 15.834 1.00 38.06 O HETATM 2509 O HOH 308 -13.110 -23.998 -8.405 1.00 46.14 O HETATM 2510 O HOH 309 -34.903 -12.202 17.079 1.00 31.71 O HETATM 2511 O HOH 310 -32.115 16.171 22.888 1.00 47.69 O HETATM 2512 O HOH 311 -6.370 -33.341 15.679 1.00 23.83 O HETATM 2513 O HOH 312 -23.854 -17.236 -17.470 1.00 41.95 O HETATM 2514 O HOH 313 -28.258 -3.257 22.513 1.00 25.00 O HETATM 2515 O HOH 314 -27.074 -20.329 29.431 1.00 26.46 O HETATM 2516 O HOH 315 -21.201 -10.490 19.732 1.00 28.17 O HETATM 2517 O HOH 316 -21.266 -14.594 -12.194 1.00 37.42 O HETATM 2518 O HOH 317 -21.500 -7.460 17.378 1.00 16.64 O HETATM 2519 O HOH 318 -7.150 -13.162 24.944 1.00 45.97 O HETATM 2520 O HOH 319 -29.923 -22.274 27.224 1.00 25.58 O HETATM 2521 O HOH 320 -23.392 -38.295 15.359 1.00 41.06 O HETATM 2522 O HOH 321 -15.390 -12.201 23.011 1.00 40.35 O HETATM 2523 O HOH 322 -27.665 13.790 26.976 1.00 52.15 O HETATM 2524 O HOH 323 -38.313 0.153 12.622 1.00 33.74 O HETATM 2525 O HOH 324 -6.344 -36.998 10.415 1.00 47.57 O HETATM 2526 O HOH 325 -22.253 -6.159 21.353 1.00 41.41 O HETATM 2527 O HOH 326 -18.783 -39.466 12.803 1.00 49.28 O HETATM 2528 O HOH 327 -26.798 -39.492 2.643 1.00 49.45 O HETATM 2529 O HOH 328 -24.729 -11.401 -19.829 1.00 39.77 O HETATM 2530 O HOH 329 -27.241 -16.553 26.896 1.00 41.24 O HETATM 2531 O HOH 330 -17.930 -29.892 17.163 1.00 34.08 O HETATM 2532 O HOH 331 -9.745 -15.232 2.673 1.00 30.15 O HETATM 2533 O HOH 332 -25.241 10.297 32.997 1.00 45.49 O HETATM 2534 O HOH 333 -38.112 -9.105 -2.472 1.00 41.97 O HETATM 2535 O HOH 334 -0.451 -23.549 23.503 1.00 45.27 O HETATM 2536 O HOH 335 -27.847 -36.680 5.799 1.00 45.71 O HETATM 2537 O HOH 336 -29.321 -34.489 15.099 1.00 51.35 O HETATM 2538 O HOH 337 -26.179 -5.015 23.064 1.00 33.89 O HETATM 2539 O HOH 338 -38.852 -8.459 -4.267 1.00 32.78 O HETATM 2540 O HOH 339 -9.094 -19.418 26.612 1.00 27.34 O HETATM 2541 O HOH 340 -32.758 -7.261 1.864 1.00 30.87 O HETATM 2542 O HOH 341 -39.163 -7.168 -11.325 1.00 37.41 O HETATM 2543 O HOH 342 -36.658 -22.919 21.474 1.00 36.99 O HETATM 2544 O HOH 343 -21.841 -15.449 -14.980 1.00 41.37 O HETATM 2545 O HOH 344 -16.915 -3.954 -13.306 1.00 43.94 O HETATM 2546 O HOH 345 -36.928 -9.421 -0.837 1.00 27.65 O HETATM 2547 O HOH 346 -26.888 -19.092 26.620 1.00 28.40 O HETATM 2548 O HOH 347 -18.914 -26.448 -2.842 1.00 34.77 O HETATM 2549 O HOH 348 -38.469 2.046 5.455 1.00 43.88 O HETATM 2550 O HOH 349 -20.391 -4.732 18.937 1.00 30.09 O HETATM 2551 O HOH 350 -29.834 -38.011 12.969 1.00 43.91 O HETATM 2552 O HOH 351 -38.221 6.465 4.863 1.00 31.24 O HETATM 2553 O HOH 352 -38.571 2.976 11.833 1.00 36.19 O HETATM 2554 O HOH 353 -37.895 -9.610 26.348 1.00 41.90 O HETATM 2555 O HOH 354 -20.392 -10.428 29.793 1.00 44.13 O HETATM 2556 O HOH 355 -40.163 -3.242 10.438 1.00 38.45 O HETATM 2557 O HOH 356 -16.511 1.962 13.435 1.00 49.96 O HETATM 2558 O HOH 357 -14.317 -21.846 -8.913 1.00 48.20 O HETATM 2559 O HOH 358 -13.148 -17.343 -3.151 1.00 52.52 O HETATM 2560 O HOH 359 -25.841 14.089 30.216 1.00 52.25 O HETATM 2561 O HOH 360 -40.955 2.629 15.605 1.00 38.36 O HETATM 2562 O HOH 361 -14.530 -15.561 -5.394 1.00 44.34 O HETATM 2563 O HOH 362 -13.779 -14.913 -8.605 1.00 45.38 O HETATM 2564 O HOH 363 -11.599 -14.965 -7.991 1.00 48.50 O HETATM 2565 O HOH 364 -8.675 -12.522 5.743 1.00 36.81 O HETATM 2566 O HOH 365 -16.884 -4.903 4.676 1.00 33.71 O HETATM 2567 O HOH 366 -17.518 -9.863 10.748 1.00 24.06 O HETATM 2568 O HOH 367 -20.086 -16.445 7.435 1.00 11.59 O HETATM 2569 O HOH 368 -17.213 -11.059 8.410 1.00 29.21 O HETATM 2570 O HOH 369 -16.280 -19.789 1.776 1.00 43.90 O HETATM 2571 O HOH 370 -17.200 -12.022 12.577 1.00 15.48 O HETATM 2572 O HOH 371 -16.986 -2.654 14.862 1.00 31.08 O HETATM 2573 O HOH 372 -20.122 -9.376 7.169 1.00 45.40 O HETATM 2574 O HOH 373 -16.577 -11.627 15.189 1.00 17.36 O HETATM 2575 O HOH 374 -9.990 -10.786 13.087 1.00 32.97 O HETATM 2576 O HOH 375 -13.117 -2.238 17.650 1.00 41.22 O HETATM 2577 O HOH 376 -13.881 -14.639 4.888 1.00 26.98 O HETATM 2578 O HOH 377 -17.117 -2.541 10.237 1.00 44.70 O HETATM 2579 O HOH 378 -20.111 -17.346 0.770 1.00 32.74 O HETATM 2580 O HOH 379 -16.746 -12.897 6.646 1.00 27.88 O HETATM 2581 O HOH 380 -13.976 -9.103 20.098 1.00 34.31 O HETATM 2582 O HOH 381 -13.279 -5.671 20.530 1.00 38.53 O HETATM 2583 O HOH 382 -14.437 -10.649 9.936 1.00 32.43 O HETATM 2584 O HOH 383 -14.258 -18.026 3.440 1.00 20.63 O HETATM 2585 O HOH 384 -14.587 -12.436 8.219 1.00 27.52 O HETATM 2586 O HOH 385 -14.973 -7.291 10.068 1.00 36.16 O HETATM 2587 O HOH 386 -13.703 -1.999 20.277 1.00 48.51 O HETATM 2588 O HOH 387 -13.821 -15.326 0.683 1.00 40.05 O HETATM 2589 O HOH 388 -17.657 -13.312 -1.947 1.00 45.24 O HETATM 2590 O HOH 389 -12.388 -15.572 2.981 1.00 43.73 O HETATM 2591 O HOH 390 -17.946 -16.228 -1.010 1.00 41.90 O HETATM 2592 O HOH 391 -16.173 -7.822 23.886 1.00 39.68 O HETATM 2593 N LYS A 392 -15.805 -2.875 17.255 1.00 0.24 N HETATM 2594 CA LYS A 392 -15.561 -4.196 17.819 1.00 0.07 C HETATM 2595 C LYS A 392 -14.571 -4.983 16.979 1.00 0.23 C HETATM 2596 O LYS A 392 -14.598 -4.920 15.749 1.00 -0.39 O HETATM 2597 N LYS A 392 -13.707 -5.734 17.656 1.00 -0.26 N HETATM 2598 CA LYS A 392 -12.845 -6.705 16.989 1.00 0.13 C HETATM 2599 C LYS A 392 -13.704 -7.856 16.481 1.00 0.20 C HETATM 2600 O LYS A 392 -14.291 -8.595 17.280 1.00 -0.39 O HETATM 2601 N LYS A 392 -13.798 -7.996 15.157 1.00 -0.26 N HETATM 2602 CA LYS A 392 -14.554 -9.071 14.525 1.00 0.13 C HETATM 2603 C LYS A 392 -13.595 -10.179 14.113 1.00 0.20 C HETATM 2604 O LYS A 392 -12.593 -9.919 13.441 1.00 -0.39 O HETATM 2605 N LYS A 392 -13.905 -11.407 14.508 1.00 -0.26 N HETATM 2606 CA LYS A 392 -13.074 -12.527 14.112 1.00 0.14 C HETATM 2607 C LYS A 392 -13.447 -12.976 12.702 1.00 0.21 C HETATM 2608 O LYS A 392 -14.461 -12.564 12.136 1.00 -0.39 O HETATM 2609 N LYS A 392 -12.586 -13.797 12.116 1.00 -0.26 N HETATM 2610 CA LYS A 392 -12.799 -14.263 10.755 1.00 0.13 C HETATM 2611 C LYS A 392 -13.930 -15.280 10.693 1.00 0.20 C HETATM 2612 O LYS A 392 -13.927 -16.264 11.430 1.00 -0.39 O HETATM 2613 N LYS A 392 -14.902 -15.022 9.818 1.00 -0.26 N HETATM 2614 CA LYS A 392 -15.925 -16.006 9.494 1.00 0.16 C HETATM 2615 CB LYS A 392 -17.295 -15.609 10.068 1.00 0.13 C HETATM 2616 CG2 LYS A 392 -17.206 -15.783 11.589 1.00 -0.03 C HETATM 2617 H61 LYS A 392 -18.168 -15.509 12.046 1.00 0.03 H HETATM 2618 H62 LYS A 392 -16.413 -15.133 11.987 1.00 0.03 H HETATM 2619 H63 LYS A 392 -16.973 -16.832 11.825 1.00 0.03 H HETATM 2620 OG1 LYS A 392 -17.575 -14.256 9.704 1.00 -0.27 O HETATM 2621 P LYS A 392 -19.089 -13.772 9.972 1.00 0.20 P HETATM 2622 O1P LYS A 392 -19.329 -12.508 9.028 1.00 -0.55 O HETATM 2623 O2P LYS A 392 -19.237 -13.381 11.522 1.00 -0.55 O HETATM 2624 O3P LYS A 392 -20.049 -14.851 9.622 1.00 -0.55 O HETATM 2625 H60 LYS A 392 -18.082 -16.264 9.665 1.00 0.07 H HETATM 2626 C LYS A 392 -16.001 -16.158 7.986 1.00 0.21 C HETATM 2627 O LYS A 392 -15.437 -15.363 7.236 1.00 -0.39 O HETATM 2628 N LYS A 392 -16.709 -17.189 7.556 1.00 -0.26 N HETATM 2629 CA LYS A 392 -16.727 -17.598 6.159 1.00 0.13 C HETATM 2630 C LYS A 392 -17.343 -16.550 5.239 1.00 0.20 C HETATM 2631 O LYS A 392 -18.363 -15.939 5.563 1.00 -0.39 O HETATM 2632 N LYS A 392 -16.710 -16.342 4.088 1.00 -0.27 N HETATM 2633 CA LYS A 392 -17.338 -15.627 3.006 1.00 0.12 C HETATM 2634 C LYS A 392 -17.140 -14.130 3.085 1.00 0.20 C HETATM 2635 O LYS A 392 -16.248 -13.632 3.784 1.00 -0.39 O HETATM 2636 N LYS A 392 -17.983 -13.375 2.356 1.00 -0.25 N HETATM 2637 CA LYS A 392 -17.782 -11.924 2.255 1.00 0.13 C HETATM 2638 C LYS A 392 -17.604 -11.244 3.598 1.00 0.20 C HETATM 2639 O LYS A 392 -18.502 -11.267 4.446 1.00 -0.39 O HETATM 2640 N LYS A 392 -16.431 -10.640 3.796 1.00 -0.26 N HETATM 2641 CA LYS A 392 -16.168 -9.789 4.956 1.00 0.14 C HETATM 2642 C LYS A 392 -16.872 -8.450 4.725 1.00 0.21 C HETATM 2643 O LYS A 392 -16.259 -7.404 4.500 1.00 -0.39 O HETATM 2644 N LYS A 392 -18.201 -8.511 4.777 1.00 -0.26 N HETATM 2645 CA LYS A 392 -19.071 -7.422 4.350 1.00 0.15 C HETATM 2646 C LYS A 392 -19.451 -6.474 5.477 1.00 0.21 C HETATM 2647 O LYS A 392 -20.168 -5.497 5.227 1.00 -0.39 O HETATM 2648 N LYS A 392 -19.010 -6.745 6.702 1.00 -0.27 N HETATM 2649 CA LYS A 392 -19.290 -5.873 7.833 1.00 0.11 C HETATM 2650 C LYS A 392 -17.988 -5.255 8.338 1.00 0.06 C HETATM 2651 O LYS A 392 -17.174 -4.780 7.546 1.00 -0.57 O HETATM 2652 OXT LYS A 392 -17.715 -5.202 9.536 1.00 -0.57 O HETATM 2653 CB LYS A 392 -19.998 -6.648 8.945 1.00 0.04 C HETATM 2654 CG LYS A 392 -19.123 -7.711 9.563 1.00 0.04 C HETATM 2655 OD1 LYS A 392 -19.259 -7.953 10.782 1.00 -0.57 O HETATM 2656 OD2 LYS A 392 -18.294 -8.301 8.833 1.00 -0.57 O HETATM 2657 H91 LYS A 392 -20.892 -7.130 8.523 1.00 0.05 H HETATM 2658 H92 LYS A 392 -20.299 -5.940 9.731 1.00 0.05 H HETATM 2659 H90 LYS A 392 -19.955 -5.063 7.497 1.00 0.07 H HETATM 2660 H89 LYS A 392 -18.470 -7.573 6.851 1.00 0.19 H HETATM 2661 CB LYS A 392 -20.344 -7.999 3.735 1.00 0.08 C HETATM 2662 OG LYS A 392 -20.924 -8.951 4.614 1.00 -0.39 O HETATM 2663 H88 LYS A 392 -21.714 -9.303 4.221 1.00 0.21 H HETATM 2664 H86 LYS A 392 -20.098 -8.488 2.781 1.00 0.06 H HETATM 2665 H87 LYS A 392 -21.062 -7.185 3.555 1.00 0.06 H HETATM 2666 H85 LYS A 392 -18.537 -6.842 3.583 1.00 0.08 H HETATM 2667 H84 LYS A 392 -18.624 -9.347 5.127 1.00 0.19 H HETATM 2668 CB LYS A 392 -14.668 -9.626 5.159 1.00 0.04 C HETATM 2669 CG LYS A 392 -14.316 -9.100 6.534 1.00 0.04 C HETATM 2670 OD1 LYS A 392 -13.116 -8.845 6.779 1.00 -0.57 O HETATM 2671 OD2 LYS A 392 -15.232 -8.946 7.369 1.00 -0.57 O HETATM 2672 H82 LYS A 392 -14.286 -8.922 4.405 1.00 0.05 H HETATM 2673 H83 LYS A 392 -14.187 -10.606 5.024 1.00 0.05 H HETATM 2674 H81 LYS A 392 -16.590 -10.261 5.855 1.00 0.08 H HETATM 2675 H80 LYS A 392 -15.702 -10.774 3.124 1.00 0.19 H HETATM 2676 CB LYS A 392 -19.061 -11.442 1.556 1.00 -0.01 C HETATM 2677 CG LYS A 392 -19.516 -12.609 0.764 1.00 -0.03 C HETATM 2678 CD LYS A 392 -19.124 -13.832 1.539 1.00 0.04 C HETATM 2679 H78 LYS A 392 -19.952 -14.174 2.177 1.00 0.05 H HETATM 2680 H79 LYS A 392 -18.822 -14.645 0.863 1.00 0.05 H HETATM 2681 H76 LYS A 392 -19.028 -12.612 -0.222 1.00 0.03 H HETATM 2682 H77 LYS A 392 -20.608 -12.576 0.633 1.00 0.03 H HETATM 2683 H74 LYS A 392 -18.846 -10.587 0.899 1.00 0.03 H HETATM 2684 H75 LYS A 392 -19.823 -11.154 2.295 1.00 0.03 H HETATM 2685 H73 LYS A 392 -16.899 -11.708 1.635 1.00 0.08 H HETATM 2686 H71 LYS A 392 -18.417 -15.838 3.028 1.00 0.08 H HETATM 2687 H72 LYS A 392 -16.913 -15.986 2.057 1.00 0.08 H HETATM 2688 H70 LYS A 392 -15.779 -16.689 3.971 1.00 0.19 H HETATM 2689 CB LYS A 392 -17.497 -18.921 6.033 1.00 -0.00 C HETATM 2690 CG LYS A 392 -17.565 -19.504 4.630 1.00 0.00 C HETATM 2691 CD LYS A 392 -18.768 -19.012 3.825 1.00 0.04 C HETATM 2692 OE1 LYS A 392 -19.849 -18.756 4.412 1.00 -0.57 O HETATM 2693 OE2 LYS A 392 -18.622 -18.892 2.595 1.00 -0.57 O HETATM 2694 H68 LYS A 392 -17.624 -20.599 4.710 1.00 0.04 H HETATM 2695 H69 LYS A 392 -16.648 -19.224 4.091 1.00 0.04 H HETATM 2696 H66 LYS A 392 -18.527 -18.749 6.379 1.00 0.03 H HETATM 2697 H67 LYS A 392 -17.010 -19.661 6.685 1.00 0.03 H HETATM 2698 H65 LYS A 392 -15.688 -17.762 5.838 1.00 0.08 H HETATM 2699 H64 LYS A 392 -17.253 -17.707 8.216 1.00 0.19 H HETATM 2700 H59 LYS A 392 -15.634 -16.972 9.933 1.00 0.08 H HETATM 2701 H58 LYS A 392 -14.929 -14.128 9.372 1.00 0.19 H HETATM 2702 CB LYS A 392 -11.519 -14.881 10.190 1.00 -0.01 C HETATM 2703 CG LYS A 392 -10.291 -13.976 10.266 1.00 -0.04 C HETATM 2704 CD LYS A 392 -10.490 -12.700 9.458 1.00 -0.01 C HETATM 2705 CE LYS A 392 -9.185 -11.920 9.299 1.00 -0.04 C HETATM 2706 NZ LYS A 392 -8.285 -12.509 8.265 1.00 0.22 N HETATM 2707 H55 LYS A 392 -7.443 -11.959 8.200 1.00 0.20 H HETATM 2708 H56 LYS A 392 -8.754 -12.511 7.373 1.00 0.20 H HETATM 2709 H57 LYS A 392 -8.050 -13.455 8.523 1.00 0.20 H HETATM 2710 H53 LYS A 392 -8.657 -11.916 10.264 1.00 0.08 H HETATM 2711 H54 LYS A 392 -9.426 -10.887 9.009 1.00 0.08 H HETATM 2712 H51 LYS A 392 -11.225 -12.063 9.973 1.00 0.03 H HETATM 2713 H52 LYS A 392 -10.870 -12.966 8.460 1.00 0.03 H HETATM 2714 H49 LYS A 392 -9.421 -14.519 9.869 1.00 0.03 H HETATM 2715 H50 LYS A 392 -10.108 -13.709 11.317 1.00 0.03 H HETATM 2716 H47 LYS A 392 -11.696 -15.132 9.134 1.00 0.03 H HETATM 2717 H48 LYS A 392 -11.303 -15.800 10.754 1.00 0.03 H HETATM 2718 H46 LYS A 392 -13.074 -13.398 10.133 1.00 0.08 H HETATM 2719 H45 LYS A 392 -11.777 -14.101 12.618 1.00 0.19 H HETATM 2720 CB LYS A 392 -13.206 -13.662 15.127 1.00 0.02 C HETATM 2721 CG LYS A 392 -12.841 -13.244 16.518 1.00 -0.04 C HETATM 2722 CD1 LYS A 392 -11.535 -12.900 16.819 1.00 -0.06 C HETATM 2723 CE1 LYS A 392 -11.185 -12.489 18.081 1.00 -0.07 C HETATM 2724 CZ LYS A 392 -12.146 -12.422 19.073 1.00 -0.07 C HETATM 2725 CE2 LYS A 392 -13.456 -12.761 18.788 1.00 -0.07 C HETATM 2726 CD2 LYS A 392 -13.799 -13.164 17.510 1.00 -0.06 C HETATM 2727 H41 LYS A 392 -14.828 -13.419 17.285 1.00 0.06 H HETATM 2728 H43 LYS A 392 -14.212 -12.711 19.564 1.00 0.06 H HETATM 2729 H44 LYS A 392 -11.873 -12.104 20.073 1.00 0.06 H HETATM 2730 H42 LYS A 392 -10.158 -12.218 18.299 1.00 0.06 H HETATM 2731 H40 LYS A 392 -10.777 -12.956 16.046 1.00 0.06 H HETATM 2732 H38 LYS A 392 -12.543 -14.485 14.822 1.00 0.05 H HETATM 2733 H39 LYS A 392 -14.249 -14.013 15.128 1.00 0.05 H HETATM 2734 H37 LYS A 392 -12.024 -12.198 14.101 1.00 0.08 H HETATM 2735 H36 LYS A 392 -14.712 -11.560 15.079 1.00 0.19 H HETATM 2736 CB LYS A 392 -15.316 -8.575 13.292 1.00 -0.00 C HETATM 2737 CG LYS A 392 -16.312 -7.463 13.551 1.00 -0.00 C HETATM 2738 SD LYS A 392 -17.539 -7.857 14.818 1.00 -0.16 S HETATM 2739 CE LYS A 392 -18.545 -9.085 13.994 1.00 -0.02 C HETATM 2740 H33 LYS A 392 -19.347 -9.416 14.670 1.00 0.03 H HETATM 2741 H34 LYS A 392 -17.919 -9.947 13.718 1.00 0.03 H HETATM 2742 H35 LYS A 392 -18.988 -8.648 13.087 1.00 0.03 H HETATM 2743 H31 LYS A 392 -16.842 -7.247 12.611 1.00 0.04 H HETATM 2744 H32 LYS A 392 -15.757 -6.569 13.873 1.00 0.04 H HETATM 2745 H29 LYS A 392 -15.863 -9.428 12.864 1.00 0.03 H HETATM 2746 H30 LYS A 392 -14.579 -8.208 12.562 1.00 0.03 H HETATM 2747 H28 LYS A 392 -15.278 -9.470 15.251 1.00 0.08 H HETATM 2748 H27 LYS A 392 -13.329 -7.334 14.572 1.00 0.19 H HETATM 2749 CB LYS A 392 -11.774 -7.203 17.957 1.00 -0.01 C HETATM 2750 CG LYS A 392 -10.780 -8.254 17.449 1.00 -0.04 C HETATM 2751 CD1 LYS A 392 -9.973 -7.733 16.268 1.00 -0.06 C HETATM 2752 H21 LYS A 392 -9.272 -8.511 15.931 1.00 0.02 H HETATM 2753 H22 LYS A 392 -9.409 -6.840 16.575 1.00 0.02 H HETATM 2754 H23 LYS A 392 -10.654 -7.472 15.445 1.00 0.02 H HETATM 2755 CD2 LYS A 392 -9.855 -8.684 18.581 1.00 -0.06 C HETATM 2756 H24 LYS A 392 -10.456 -9.057 19.424 1.00 0.02 H HETATM 2757 H25 LYS A 392 -9.255 -7.823 18.911 1.00 0.02 H HETATM 2758 H26 LYS A 392 -9.187 -9.482 18.226 1.00 0.02 H HETATM 2759 H20 LYS A 392 -11.350 -9.133 17.113 1.00 0.03 H HETATM 2760 H18 LYS A 392 -12.293 -7.636 18.825 1.00 0.03 H HETATM 2761 H19 LYS A 392 -11.190 -6.328 18.278 1.00 0.03 H HETATM 2762 H17 LYS A 392 -12.351 -6.223 16.133 1.00 0.08 H HETATM 2763 H16 LYS A 392 -13.646 -5.631 18.649 1.00 0.19 H HETATM 2764 CB LYS A 392 -16.866 -4.988 17.931 1.00 0.01 C HETATM 2765 CG LYS A 392 -16.665 -6.436 18.362 1.00 -0.04 C HETATM 2766 CD LYS A 392 -17.969 -7.201 18.408 1.00 -0.01 C HETATM 2767 CE LYS A 392 -17.729 -8.677 18.716 1.00 -0.04 C HETATM 2768 NZ LYS A 392 -16.987 -9.401 17.637 1.00 0.22 N HETATM 2769 H13 LYS A 392 -16.863 -10.365 17.903 1.00 0.20 H HETATM 2770 H14 LYS A 392 -16.085 -8.971 17.503 1.00 0.20 H HETATM 2771 H15 LYS A 392 -17.513 -9.354 16.778 1.00 0.20 H HETATM 2772 H11 LYS A 392 -18.704 -9.166 18.856 1.00 0.08 H HETATM 2773 H12 LYS A 392 -17.146 -8.748 19.646 1.00 0.08 H HETATM 2774 H9 LYS A 392 -18.471 -7.114 17.433 1.00 0.03 H HETATM 2775 H10 LYS A 392 -18.611 -6.770 19.191 1.00 0.03 H HETATM 2776 H7 LYS A 392 -16.211 -6.448 19.364 1.00 0.03 H HETATM 2777 H8 LYS A 392 -15.990 -6.929 17.647 1.00 0.03 H HETATM 2778 H5 LYS A 392 -17.361 -4.983 16.949 1.00 0.03 H HETATM 2779 H6 LYS A 392 -17.512 -4.492 18.670 1.00 0.03 H HETATM 2780 H4 LYS A 392 -15.140 -4.067 18.827 1.00 0.11 H HETATM 2781 H1 LYS A 392 -16.465 -2.379 17.834 1.00 0.20 H HETATM 2782 H2 LYS A 392 -16.181 -2.971 16.325 1.00 0.20 H HETATM 2783 H3 LYS A 392 -14.939 -2.361 17.216 1.00 0.20 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 720 721 724 725 726 CONECT 724 720 CONECT 725 720 CONECT 726 720 CONECT 1299 1300 1307 1308 1309 CONECT 1307 1299 CONECT 1308 1299 CONECT 1309 1299 CONECT 2593 2594 2781 2782 2783 CONECT 2594 2593 2595 2764 2780 CONECT 2595 2594 2596 2597 CONECT 2596 2595 CONECT 2597 2595 2598 2763 CONECT 2598 2597 2599 2749 2762 CONECT 2599 2598 2600 2601 CONECT 2600 2599 CONECT 2601 2599 2602 2748 CONECT 2602 2601 2603 2736 2747 CONECT 2603 2602 2604 2605 CONECT 2604 2603 CONECT 2605 2603 2606 2735 CONECT 2606 2605 2607 2720 2734 CONECT 2607 2606 2608 2609 CONECT 2608 2607 CONECT 2609 2607 2610 2719 CONECT 2610 2609 2611 2702 2718 CONECT 2611 2610 2612 2613 CONECT 2612 2611 CONECT 2613 2611 2614 2701 CONECT 2614 2613 2615 2626 2700 CONECT 2615 2614 2616 2620 2625 CONECT 2616 2615 2617 2618 2619 CONECT 2617 2616 CONECT 2618 2616 CONECT 2619 2616 CONECT 2620 2615 2621 CONECT 2621 2620 2622 2623 2624 CONECT 2622 2621 CONECT 2623 2621 CONECT 2624 2621 CONECT 2625 2615 CONECT 2626 2614 2627 2628 CONECT 2627 2626 CONECT 2628 2626 2629 2699 CONECT 2629 2628 2630 2689 2698 CONECT 2630 2629 2631 2632 CONECT 2631 2630 CONECT 2632 2630 2633 2688 CONECT 2633 2632 2634 2686 2687 CONECT 2634 2633 2635 2636 CONECT 2635 2634 CONECT 2636 2634 2637 2678 CONECT 2637 2636 2638 2676 2685 CONECT 2638 2637 2639 2640 CONECT 2639 2638 CONECT 2640 2638 2641 2675 CONECT 2641 2640 2642 2668 2674 CONECT 2642 2641 2643 2644 CONECT 2643 2642 CONECT 2644 2642 2645 2667 CONECT 2645 2644 2646 2661 2666 CONECT 2646 2645 2647 2648 CONECT 2647 2646 CONECT 2648 2646 2649 2660 CONECT 2649 2648 2650 2653 2659 CONECT 2650 2649 2651 2652 CONECT 2651 2650 CONECT 2652 2650 CONECT 2653 2649 2654 2657 2658 CONECT 2654 2653 2655 2656 CONECT 2655 2654 CONECT 2656 2654 CONECT 2657 2653 CONECT 2658 2653 CONECT 2659 2649 CONECT 2660 2648 CONECT 2661 2645 2662 2664 2665 CONECT 2662 2661 2663 CONECT 2663 2662 CONECT 2664 2661 CONECT 2665 2661 CONECT 2666 2645 CONECT 2667 2644 CONECT 2668 2641 2669 2672 2673 CONECT 2669 2668 2670 2671 CONECT 2670 2669 CONECT 2671 2669 CONECT 2672 2668 CONECT 2673 2668 CONECT 2674 2641 CONECT 2675 2640 CONECT 2676 2637 2677 2683 2684 CONECT 2677 2676 2678 2681 2682 CONECT 2678 2636 2677 2679 2680 CONECT 2679 2678 CONECT 2680 2678 CONECT 2681 2677 CONECT 2682 2677 CONECT 2683 2676 CONECT 2684 2676 CONECT 2685 2637 CONECT 2686 2633 CONECT 2687 2633 CONECT 2688 2632 CONECT 2689 2629 2690 2696 2697 CONECT 2690 2689 2691 2694 2695 CONECT 2691 2690 2692 2693 CONECT 2692 2691 CONECT 2693 2691 CONECT 2694 2690 CONECT 2695 2690 CONECT 2696 2689 CONECT 2697 2689 CONECT 2698 2629 CONECT 2699 2628 CONECT 2700 2614 CONECT 2701 2613 CONECT 2702 2610 2703 2716 2717 CONECT 2703 2702 2704 2714 2715 CONECT 2704 2703 2705 2712 2713 CONECT 2705 2704 2706 2710 2711 CONECT 2706 2705 2707 2708 2709 CONECT 2707 2706 CONECT 2708 2706 CONECT 2709 2706 CONECT 2710 2705 CONECT 2711 2705 CONECT 2712 2704 CONECT 2713 2704 CONECT 2714 2703 CONECT 2715 2703 CONECT 2716 2702 CONECT 2717 2702 CONECT 2718 2610 CONECT 2719 2609 CONECT 2720 2606 2721 2732 2733 CONECT 2721 2720 2722 2726 CONECT 2722 2721 2723 2731 CONECT 2723 2722 2724 2730 CONECT 2724 2723 2725 2729 CONECT 2725 2724 2726 2728 CONECT 2726 2721 2725 2727 CONECT 2727 2726 CONECT 2728 2725 CONECT 2729 2724 CONECT 2730 2723 CONECT 2731 2722 CONECT 2732 2720 CONECT 2733 2720 CONECT 2734 2606 CONECT 2735 2605 CONECT 2736 2602 2737 2745 2746 CONECT 2737 2736 2738 2743 2744 CONECT 2738 2737 2739 CONECT 2739 2738 2740 2741 2742 CONECT 2740 2739 CONECT 2741 2739 CONECT 2742 2739 CONECT 2743 2737 CONECT 2744 2737 CONECT 2745 2736 CONECT 2746 2736 CONECT 2747 2602 CONECT 2748 2601 CONECT 2749 2598 2750 2760 2761 CONECT 2750 2749 2751 2755 2759 CONECT 2751 2750 2752 2753 2754 CONECT 2752 2751 CONECT 2753 2751 CONECT 2754 2751 CONECT 2755 2750 2756 2757 2758 CONECT 2756 2755 CONECT 2757 2755 CONECT 2758 2755 CONECT 2759 2750 CONECT 2760 2749 CONECT 2761 2749 CONECT 2762 2598 CONECT 2763 2597 CONECT 2764 2594 2765 2778 2779 CONECT 2765 2764 2766 2776 2777 CONECT 2766 2765 2767 2774 2775 CONECT 2767 2766 2768 2772 2773 CONECT 2768 2767 2769 2770 2771 CONECT 2769 2768 CONECT 2770 2768 CONECT 2771 2768 CONECT 2772 2767 CONECT 2773 2767 CONECT 2774 2766 CONECT 2775 2766 CONECT 2776 2765 CONECT 2777 2765 CONECT 2778 2764 CONECT 2779 2764 CONECT 2780 2594 CONECT 2781 2593 CONECT 2782 2593 CONECT 2783 2593 MASTER 0 0 0 0 0 0 0 0 2780 3 203 19 END
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5huw
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5huy
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5i2i
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5icz
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5id1
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5ih2
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5iop
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5ir1
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5iv2
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5ivn
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5ivz
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5ixq
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5tbn
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5v1d
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5w4s
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5w5s
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12-mer
5w5u
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5w6i
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PDBbind
12-mer
5w6r
RCSB PDB
PDBbind
12-mer
5w6t
RCSB PDB
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12-mer
5w6u
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PDBbind
12-mer
5wle
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12-mer
5wxf
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12-mer
5wxo
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PDBbind
12-mer
5xup
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PDBbind
12-mer
5xwr
RCSB PDB
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12-mer
5xxk
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PDBbind
12-mer
5y1u
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PDBbind
12-mer
5y59
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PDBbind
12-mer
6bgg
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PDBbind
12-mer
6e83
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PDBbind
12-mer
6f7t
RCSB PDB
PDBbind
12-mer
6f8g
RCSB PDB
PDBbind
12-mer
6rr0
RCSB PDB
PDBbind
12-mer
6qtr
RCSB PDB
PDBbind
12-mer
6qto
RCSB PDB
PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
6peu
RCSB PDB
PDBbind
12-mer
6o3x
RCSB PDB
PDBbind
12-mer
6nk0
RCSB PDB
PDBbind
12-mer
6mm5
RCSB PDB
PDBbind
12-mer
6k5t
RCSB PDB
PDBbind
12-mer
6k5r
RCSB PDB
PDBbind
12-mer
6iam
RCSB PDB
PDBbind
12-mer
6hy2
RCSB PDB
PDBbind
12-mer
6byk
RCSB PDB
PDBbind
12-mer
6bw4
RCSB PDB
PDBbind
12-mer
6bw3
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PDBbind
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Entry Information
PDB ID
5moc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
14-3-3 protein sigma
Ligand Name
12-mer
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=23.6uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) FEBS Lett. Vol. 591: pp. 2449-2457
Ligand Properties
Formula
C
5
9
H
9
9
N
1
4
O
2
4
PS
Molecular Weight
1451.540
Exact Mass
1450.640
No. of atoms
198
No. of bonds
199
Polar Surface Area
672.47
LOGP Value
-7.33 (
Computed with XLOGP3
)
-4.27 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 55
No. of Nitrogen and Oxygen Atoms: 38
No. of Rings: 2
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@@H]([C@H](OP(O)(O)O)C)C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CO)CC(=O)O)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCC[NH3+])[NH3+])CC(C)C)CCSC)Cc1ccccc1
InChI String
InChI=1S/C59H97N14O24PS/c1-31(2)25-38(67-49(82)34(62)15-8-10-21-60)53(86)65-37(20-24-99-4)51(84)68-39(26-33-13-6-5-7-14-33)54(87)64-35(16-9-11-22-61)52(85)72-48(32(3)97-98(94,95)96)58(91)66-36(18-19-45(76)77)50(83)63-29-44(75)73-23-12-17-43(73)57(90)69-40(27-46(78)79)55(88)71-42(30-74)56(89)70-41(59(92)93)28-47(80)81/h5-7,13-14,31-32,34-43,48,74,94-96,98H,8-12,15-30,60-62H2,1-4H3,(H,63,83)(H,64,87)(H,65,86)(H,66,91)(H,67,82)(H,68,84)(H,69,90)(H,70,89)(H,71,88)(H,72,85)(H,76,77)(H,78,79)(H,80,81)(H,92,93)/p+3/t32-,34+,35+,36+,37+,38+,39+,40+,41+,42+,43+,48+/m1/s1
Links to External Databases
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UniProtKB AC
UniProt accession number (AC):
P31947
P04637
Entrez Gene ID
NCBI Entrez Gene ID:
2810
7157
ASD
Information of known allosteric effects of PDB entries
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