Browse entries in the PDBbind-CN Database
HEADER 6FUT_COMPLEX COMPND 6FUT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 44 ILE LEU GLY GLY ARG GLU ALA GLU ALA HIS ALA ARG PRO SEQRES 2 A 44 TYR MET ALA SER VAL GLN LEU ASN GLY ALA HIS LEU CYS SEQRES 3 A 44 GLY GLY VAL LEU VAL ALA GLU GLN TRP VAL LEU SER ALA SEQRES 4 A 44 ALA HIS CYS LEU GLU SEQRES 1 A 184 GLY LYS VAL GLN VAL LEU LEU GLY ALA HIS SER LEU SER SEQRES 2 A 184 GLN PRO GLU PRO SER LYS ARG LEU TYR ASP VAL LEU ARG SEQRES 3 A 184 ALA VAL PRO HIS PRO ASP SER GLN PRO ASP THR ILE ASP SEQRES 4 A 184 HIS ASP LEU LEU LEU LEU GLN LEU SER GLU LYS ALA THR SEQRES 5 A 184 LEU GLY PRO ALA VAL ARG PRO LEU PRO TRP GLN ARG VAL SEQRES 6 A 184 ASP ARG ASP VAL ALA PRO GLY THR LEU CYS ASP VAL ALA SEQRES 7 A 184 GLY TRP GLY ILE VAL ASN HIS ALA GLY ARG ARG PRO ASP SEQRES 8 A 184 SER LEU GLN HIS VAL LEU LEU PRO VAL LEU ASP ARG ALA SEQRES 9 A 184 THR CYS ASN ARG ARG THR HIS HIS ASP GLY ALA ILE THR SEQRES 10 A 184 GLU ARG LEU MET CYS ALA GLU SER ASN ARG ARG ASP SER SEQRES 11 A 184 CYS LYS GLY ASP SER GLY GLY PRO LEU VAL CYS GLY GLY SEQRES 12 A 184 VAL LEU GLU GLY VAL VAL THR SER GLY SER ARG VAL CYS SEQRES 13 A 184 GLY ASN ARG LYS LYS PRO GLY ILE TYR THR ARG VAL ALA SEQRES 14 A 184 SER TYR ALA ALA TRP ILE ASP SER VAL LEU ALA SER ALA SEQRES 15 A 184 ALA ALA HET E A 82 52 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 168 CYS A 182 SSBOND 3 CYS A 136 CYS A 201 SSBOND 4 CYS A 191 CYS A 220 ATOM 1 N ILE A 16 -1.109 12.858 -13.609 1.00 7.57 N ATOM 2 CA ILE A 16 0.065 12.772 -12.725 1.00 7.48 C ATOM 3 C ILE A 16 0.585 11.326 -12.664 1.00 7.81 C ATOM 4 O ILE A 16 -0.190 10.367 -12.395 1.00 8.02 O ATOM 5 CB ILE A 16 -0.355 13.203 -11.307 1.00 7.83 C ATOM 6 CG1 ILE A 16 -0.905 14.649 -11.274 1.00 7.80 C ATOM 7 CG2 ILE A 16 0.758 12.945 -10.278 1.00 9.08 C ATOM 8 CD1 ILE A 16 0.083 15.723 -11.473 1.00 7.76 C ATOM 9 HN3 ILE A 16 -1.863 12.241 -13.243 1.00 0.00 H ATOM 10 HN2 ILE A 16 -0.843 12.552 -14.567 1.00 0.00 H ATOM 11 HN1 ILE A 16 -1.448 13.841 -13.639 1.00 0.00 H ATOM 12 N LEU A 17 1.863 11.177 -12.968 1.00 8.35 N ATOM 13 CA LEU A 17 2.550 9.851 -12.856 1.00 8.97 C ATOM 14 C LEU A 17 3.280 9.756 -11.553 1.00 8.40 C ATOM 15 O LEU A 17 3.969 10.675 -11.107 1.00 8.57 O ATOM 16 CB LEU A 17 3.565 9.598 -13.983 1.00 9.59 C ATOM 17 CG LEU A 17 3.005 9.784 -15.364 1.00 11.43 C ATOM 18 CD1 LEU A 17 4.118 9.447 -16.372 1.00 12.67 C ATOM 19 CD2 LEU A 17 1.796 9.000 -15.797 1.00 12.85 C ATOM 20 H LEU A 17 2.406 12.002 -13.294 1.00 0.00 H ATOM 21 N GLY A 18 3.207 8.595 -10.887 1.00 9.11 N ATOM 22 CA GLY A 18 4.007 8.346 -9.708 1.00 9.11 C ATOM 23 C GLY A 18 3.515 9.108 -8.503 1.00 9.13 C ATOM 24 O GLY A 18 4.313 9.239 -7.542 1.00 11.38 O ATOM 25 H GLY A 18 2.559 7.855 -11.226 1.00 0.00 H ATOM 26 N GLY A 19 2.283 9.557 -8.533 1.00 8.53 N ATOM 27 CA GLY A 19 1.762 10.320 -7.422 1.00 8.09 C ATOM 28 C GLY A 19 0.816 9.615 -6.527 1.00 8.49 C ATOM 29 O GLY A 19 0.906 8.364 -6.404 1.00 10.63 O ATOM 30 H GLY A 19 1.680 9.364 -9.358 1.00 0.00 H ATOM 31 N ARG A 20 -0.041 10.364 -5.828 1.00 7.56 N ATOM 32 CA ARG A 20 -0.919 9.806 -4.798 1.00 7.51 C ATOM 33 C ARG A 20 -2.222 10.603 -4.860 1.00 7.62 C ATOM 34 O ARG A 20 -2.300 11.778 -5.361 1.00 7.49 O ATOM 35 CB ARG A 20 -0.326 9.853 -3.413 1.00 8.41 C ATOM 36 CG ARG A 20 0.177 11.201 -2.977 1.00 8.78 C ATOM 37 CD ARG A 20 0.958 11.187 -1.668 1.00 11.06 C ATOM 38 NE ARG A 20 2.172 10.430 -1.819 1.00 11.02 N ATOM 39 CZ ARG A 20 3.031 10.200 -0.801 1.00 11.10 C ATOM 40 NH1 ARG A 20 2.879 10.680 0.373 1.00 11.77 N ATOM 41 NH2 ARG A 20 4.082 9.490 -1.130 1.00 13.28 N ATOM 42 HE ARG A 20 2.400 10.041 -2.756 1.00 0.00 H ATOM 43 HH12 ARG A 20 3.575 10.467 1.116 1.00 0.00 H ATOM 44 HH11 ARG A 20 2.059 11.284 0.586 1.00 0.00 H ATOM 45 HH22 ARG A 20 4.800 9.261 -0.413 1.00 0.00 H ATOM 46 HH21 ARG A 20 4.198 9.155 -2.108 1.00 0.00 H ATOM 47 H ARG A 20 -0.086 11.384 -6.023 1.00 0.00 H ATOM 48 N GLU A 21 -3.292 10.046 -4.350 1.00 7.50 N ATOM 49 CA GLU A 21 -4.536 10.740 -4.278 1.00 8.14 C ATOM 50 C GLU A 21 -4.396 11.952 -3.403 1.00 7.42 C ATOM 51 O GLU A 21 -3.923 11.906 -2.280 1.00 9.13 O ATOM 52 CB GLU A 21 -5.669 9.826 -3.824 1.00 9.58 C ATOM 53 CG GLU A 21 -7.045 10.492 -3.973 1.00 11.78 C ATOM 54 CD GLU A 21 -8.270 9.695 -3.775 1.00 15.79 C ATOM 55 OE1 GLU A 21 -8.207 8.428 -3.781 1.00 18.78 O ATOM 56 OE2 GLU A 21 -9.273 10.308 -3.293 1.00 16.32 O ATOM 57 H GLU A 21 -3.233 9.073 -3.988 1.00 0.00 H ATOM 58 N ALA A 22 -4.941 13.083 -3.908 1.00 7.35 N ATOM 59 CA ALA A 22 -5.048 14.304 -3.115 1.00 7.32 C ATOM 60 C ALA A 22 -6.116 14.165 -2.065 1.00 7.71 C ATOM 61 O ALA A 22 -7.059 13.397 -2.209 1.00 9.68 O ATOM 62 CB ALA A 22 -5.261 15.494 -4.010 1.00 7.06 C ATOM 63 H ALA A 22 -5.293 13.082 -4.887 1.00 0.00 H ATOM 64 N GLU A 23 -5.986 14.925 -0.964 1.00 7.10 N ATOM 65 CA GLU A 23 -7.033 15.017 0.067 1.00 6.65 C ATOM 66 C GLU A 23 -8.159 15.806 -0.516 1.00 6.86 C ATOM 67 O GLU A 23 -7.931 16.921 -1.060 1.00 7.14 O ATOM 68 CB GLU A 23 -6.502 15.605 1.355 1.00 8.31 C ATOM 69 CG GLU A 23 -5.247 14.951 1.894 1.00 8.64 C ATOM 70 CD GLU A 23 -3.963 15.357 1.258 1.00 9.75 C ATOM 71 OE1 GLU A 23 -3.903 16.193 0.346 1.00 9.42 O ATOM 72 OE2 GLU A 23 -2.841 14.812 1.641 1.00 12.15 O ATOM 73 H GLU A 23 -5.110 15.470 -0.835 1.00 0.00 H ATOM 74 N ALA A 24 -9.399 15.352 -0.366 1.00 6.62 N ATOM 75 CA ALA A 24 -10.497 16.024 -1.079 1.00 6.02 C ATOM 76 C ALA A 24 -10.683 17.472 -0.624 1.00 6.87 C ATOM 77 O ALA A 24 -10.828 17.809 0.544 1.00 6.65 O ATOM 78 CB ALA A 24 -11.786 15.255 -0.814 1.00 7.21 C ATOM 79 H ALA A 24 -9.591 14.534 0.246 1.00 0.00 H ATOM 80 N HIS A 25 -10.562 18.386 -1.599 1.00 6.00 N ATOM 81 CA HIS A 25 -10.791 19.815 -1.393 1.00 5.98 C ATOM 82 C HIS A 25 -9.706 20.503 -0.621 1.00 6.66 C ATOM 83 O HIS A 25 -9.880 21.690 -0.311 1.00 7.27 O ATOM 84 CB HIS A 25 -12.160 20.100 -0.799 1.00 5.67 C ATOM 85 CG HIS A 25 -13.238 19.274 -1.420 1.00 6.20 C ATOM 86 ND1 HIS A 25 -13.673 19.428 -2.740 1.00 6.68 N ATOM 87 CD2 HIS A 25 -13.880 18.181 -0.948 1.00 7.01 C ATOM 88 CE1 HIS A 25 -14.566 18.478 -3.006 1.00 6.72 C ATOM 89 NE2 HIS A 25 -14.720 17.717 -1.920 1.00 6.78 N ATOM 90 H HIS A 25 -10.292 18.061 -2.549 1.00 0.00 H ATOM 91 N ALA A 26 -8.561 19.939 -0.435 1.00 6.39 N ATOM 92 CA ALA A 26 -7.448 20.495 0.310 1.00 6.20 C ATOM 93 C ALA A 26 -6.636 21.525 -0.538 1.00 6.98 C ATOM 94 O ALA A 26 -5.797 22.218 0.021 1.00 8.26 O ATOM 95 CB ALA A 26 -6.545 19.491 0.946 1.00 6.17 C ATOM 96 H ALA A 26 -8.423 18.999 -0.858 1.00 0.00 H ATOM 97 N ARG A 27 -6.936 21.506 -1.840 1.00 6.16 N ATOM 98 CA ARG A 27 -6.266 22.439 -2.780 1.00 5.99 C ATOM 99 C ARG A 27 -7.437 23.186 -3.490 1.00 5.85 C ATOM 100 O ARG A 27 -7.815 22.841 -4.584 1.00 5.74 O ATOM 101 CB ARG A 27 -5.376 21.679 -3.772 1.00 6.45 C ATOM 102 CG ARG A 27 -4.222 21.034 -3.082 1.00 6.63 C ATOM 103 CD ARG A 27 -3.541 19.987 -3.952 1.00 6.95 C ATOM 104 NE ARG A 27 -2.346 19.391 -3.317 1.00 7.11 N ATOM 105 CZ ARG A 27 -2.383 18.564 -2.279 1.00 7.40 C ATOM 106 NH1 ARG A 27 -3.502 18.050 -1.859 1.00 7.26 N ATOM 107 NH2 ARG A 27 -1.272 18.137 -1.705 1.00 8.09 N ATOM 108 HE ARG A 27 -1.415 19.636 -3.710 1.00 0.00 H ATOM 109 HH12 ARG A 27 -3.504 17.405 -1.043 1.00 0.00 H ATOM 110 HH11 ARG A 27 -4.394 18.285 -2.339 1.00 0.00 H ATOM 111 HH22 ARG A 27 -1.322 17.489 -0.893 1.00 0.00 H ATOM 112 HH21 ARG A 27 -0.348 18.449 -2.065 1.00 0.00 H ATOM 113 H ARG A 27 -7.644 20.833 -2.197 1.00 0.00 H ATOM 114 N PRO A 28 -8.033 24.160 -2.794 1.00 6.25 N ATOM 115 CA PRO A 28 -9.366 24.699 -3.219 1.00 7.22 C ATOM 116 C PRO A 28 -9.261 25.607 -4.400 1.00 6.48 C ATOM 117 O PRO A 28 -10.291 26.056 -4.930 1.00 6.96 O ATOM 118 CB PRO A 28 -9.803 25.433 -1.971 1.00 7.41 C ATOM 119 CG PRO A 28 -8.531 25.863 -1.296 1.00 7.36 C ATOM 120 CD PRO A 28 -7.575 24.686 -1.483 1.00 6.87 C ATOM 121 N TYR A 29 -8.027 25.889 -4.894 1.00 5.82 N ATOM 122 CA TYR A 29 -7.803 26.597 -6.134 1.00 6.49 C ATOM 123 C TYR A 29 -7.839 25.716 -7.311 1.00 6.70 C ATOM 124 O TYR A 29 -7.777 26.209 -8.463 1.00 7.05 O ATOM 125 CB TYR A 29 -6.439 27.209 -6.043 1.00 6.59 C ATOM 126 CG TYR A 29 -5.317 26.293 -5.557 1.00 6.69 C ATOM 127 CD1 TYR A 29 -4.714 25.452 -6.477 1.00 8.34 C ATOM 128 CD2 TYR A 29 -4.948 26.218 -4.252 1.00 8.05 C ATOM 129 CE1 TYR A 29 -3.742 24.561 -5.976 1.00 9.35 C ATOM 130 CE2 TYR A 29 -3.965 25.362 -3.805 1.00 8.35 C ATOM 131 CZ TYR A 29 -3.410 24.561 -4.691 1.00 9.46 C ATOM 132 OH TYR A 29 -2.372 23.588 -4.312 1.00 13.16 O ATOM 133 HH TYR A 29 -1.596 24.068 -3.927 1.00 0.00 H ATOM 134 H TYR A 29 -7.197 25.578 -4.349 1.00 0.00 H ATOM 135 N MET A 30 -7.858 24.405 -7.130 1.00 5.96 N ATOM 136 CA MET A 30 -7.724 23.527 -8.288 1.00 5.96 C ATOM 137 C MET A 30 -8.997 23.526 -9.120 1.00 6.81 C ATOM 138 O MET A 30 -10.108 23.452 -8.569 1.00 7.71 O ATOM 139 CB MET A 30 -7.340 22.141 -7.775 1.00 5.55 C ATOM 140 CG MET A 30 -6.967 21.138 -8.835 1.00 4.91 C ATOM 141 SD MET A 30 -5.418 21.504 -9.632 1.00 4.88 S ATOM 142 CE MET A 30 -5.666 20.921 -11.313 1.00 5.23 C ATOM 143 H MET A 30 -7.967 24.006 -6.176 1.00 0.00 H ATOM 144 N ALA A 31 -8.835 23.675 -10.428 1.00 7.06 N ATOM 145 CA ALA A 31 -9.899 23.729 -11.407 1.00 6.91 C ATOM 146 C ALA A 31 -9.772 22.667 -12.451 1.00 7.00 C ATOM 147 O ALA A 31 -8.611 22.380 -12.890 1.00 7.01 O ATOM 148 CB ALA A 31 -9.936 25.059 -12.115 1.00 7.69 C ATOM 149 H ALA A 31 -7.860 23.760 -10.780 1.00 0.00 H ATOM 150 N SER A 32 -10.858 22.055 -12.906 1.00 7.40 N ATOM 151 CA SER A 32 -10.819 21.216 -14.090 1.00 7.31 C ATOM 152 C SER A 32 -11.388 22.004 -15.249 1.00 8.74 C ATOM 153 O SER A 32 -12.552 22.474 -15.225 1.00 9.69 O ATOM 154 CB SER A 32 -11.679 20.017 -13.864 1.00 8.59 C ATOM 155 OG SER A 32 -11.907 19.254 -15.074 1.00 8.31 O ATOM 156 HG SER A 32 -11.039 18.941 -15.434 1.00 0.00 H ATOM 157 H SER A 32 -11.759 22.180 -12.402 1.00 0.00 H ATOM 158 N VAL A 33 -10.562 22.269 -16.242 1.00 8.89 N ATOM 159 CA VAL A 33 -10.998 22.918 -17.498 1.00 9.35 C ATOM 160 C VAL A 33 -11.520 21.829 -18.398 1.00 9.34 C ATOM 161 O VAL A 33 -10.829 20.860 -18.721 1.00 10.92 O ATOM 162 CB VAL A 33 -9.862 23.705 -18.136 1.00 9.76 C ATOM 163 CG1 VAL A 33 -10.332 24.275 -19.454 1.00 12.05 C ATOM 164 CG2 VAL A 33 -9.285 24.745 -17.220 1.00 10.19 C ATOM 165 H VAL A 33 -9.560 22.010 -16.138 1.00 0.00 H ATOM 166 N GLN A 34 -12.830 21.980 -18.771 1.00 10.23 N ATOM 167 CA GLN A 34 -13.552 20.966 -19.457 1.00 10.91 C ATOM 168 C GLN A 34 -13.990 21.397 -20.866 1.00 10.54 C ATOM 169 O GLN A 34 -14.262 22.531 -21.091 1.00 13.18 O ATOM 170 CB GLN A 34 -14.776 20.521 -18.641 1.00 13.08 C ATOM 171 CG GLN A 34 -14.345 20.174 -17.219 1.00 12.18 C ATOM 172 CD GLN A 34 -15.248 19.284 -16.467 1.00 13.93 C ATOM 173 OE1 GLN A 34 -16.440 19.304 -16.674 1.00 17.31 O ATOM 174 NE2 GLN A 34 -14.700 18.516 -15.527 1.00 10.82 N ATOM 175 HE22 GLN A 34 -13.670 18.528 -15.381 1.00 0.00 H ATOM 176 HE21 GLN A 34 -15.302 17.904 -14.939 1.00 0.00 H ATOM 177 H GLN A 34 -13.315 22.871 -18.543 1.00 0.00 H ATOM 178 N LEU A 35 -13.969 20.378 -21.735 1.00 14.91 N ATOM 179 CA LEU A 35 -14.356 20.614 -23.187 1.00 16.27 C ATOM 180 C LEU A 35 -15.381 19.573 -23.516 1.00 15.34 C ATOM 181 O LEU A 35 -15.218 18.403 -23.359 1.00 16.12 O ATOM 182 CB LEU A 35 -13.134 20.495 -24.101 1.00 18.29 C ATOM 183 CG LEU A 35 -13.473 20.642 -25.620 1.00 20.17 C ATOM 184 CD1 LEU A 35 -13.825 22.042 -25.899 1.00 21.12 C ATOM 185 CD2 LEU A 35 -12.158 20.288 -26.272 1.00 21.23 C ATOM 186 H LEU A 35 -13.689 19.428 -21.418 1.00 0.00 H ATOM 187 N ASN A 36 -16.543 20.091 -23.949 1.00 18.56 N ATOM 188 CA ASN A 36 -17.677 19.178 -24.280 1.00 22.18 C ATOM 189 C ASN A 36 -17.927 18.196 -23.215 1.00 19.57 C ATOM 190 O ASN A 36 -18.248 17.019 -23.339 1.00 23.34 O ATOM 191 CB ASN A 36 -17.448 18.512 -25.676 1.00 23.46 C ATOM 192 CG ASN A 36 -17.351 19.546 -26.751 1.00 26.07 C ATOM 193 OD1 ASN A 36 -18.040 20.556 -26.716 1.00 27.71 O ATOM 194 ND2 ASN A 36 -16.440 19.351 -27.685 1.00 29.29 N ATOM 195 HD22 ASN A 36 -15.872 18.480 -27.684 1.00 0.00 H ATOM 196 HD21 ASN A 36 -16.290 20.069 -28.423 1.00 0.00 H ATOM 197 H ASN A 36 -16.652 21.120 -24.053 1.00 0.00 H ATOM 198 N GLY A 38 -17.961 18.568 -21.766 1.00 18.53 N ATOM 199 CA GLY A 38 -18.233 17.750 -20.623 1.00 22.20 C ATOM 200 C GLY A 38 -17.144 16.834 -20.092 1.00 20.07 C ATOM 201 O GLY A 38 -17.328 16.206 -19.089 1.00 22.97 O ATOM 202 H GLY A 38 -17.757 19.567 -21.559 1.00 0.00 H ATOM 203 N ALA A 39 -15.930 16.884 -20.684 1.00 15.96 N ATOM 204 CA ALA A 39 -14.867 15.975 -20.332 1.00 14.30 C ATOM 205 C ALA A 39 -13.671 16.847 -19.850 1.00 11.84 C ATOM 206 O ALA A 39 -13.403 17.906 -20.365 1.00 12.15 O ATOM 207 CB ALA A 39 -14.343 15.118 -21.496 1.00 16.43 C ATOM 208 H ALA A 39 -15.757 17.601 -21.417 1.00 0.00 H ATOM 209 N HIS A 40 -13.025 16.304 -18.806 1.00 11.05 N ATOM 210 CA HIS A 40 -11.765 16.923 -18.309 1.00 9.42 C ATOM 211 C HIS A 40 -10.777 17.025 -19.469 1.00 9.57 C ATOM 212 O HIS A 40 -10.479 16.026 -20.099 1.00 11.11 O ATOM 213 CB HIS A 40 -11.205 16.176 -17.163 1.00 9.25 C ATOM 214 CG HIS A 40 -9.870 16.699 -16.763 1.00 8.39 C ATOM 215 ND1 HIS A 40 -9.729 17.831 -15.939 1.00 8.61 N ATOM 216 CD2 HIS A 40 -8.613 16.357 -17.178 1.00 8.95 C ATOM 217 CE1 HIS A 40 -8.433 18.097 -15.858 1.00 8.36 C ATOM 218 NE2 HIS A 40 -7.730 17.257 -16.639 1.00 9.22 N ATOM 219 H HIS A 40 -13.404 15.452 -18.345 1.00 0.00 H ATOM 220 N LEU A 41 -10.227 18.197 -19.685 1.00 9.31 N ATOM 221 CA LEU A 41 -9.247 18.468 -20.753 1.00 10.35 C ATOM 222 C LEU A 41 -7.904 18.868 -20.093 1.00 9.41 C ATOM 223 O LEU A 41 -6.873 18.293 -20.438 1.00 10.36 O ATOM 224 CB LEU A 41 -9.787 19.576 -21.677 1.00 11.61 C ATOM 225 CG LEU A 41 -8.752 20.069 -22.728 1.00 14.16 C ATOM 226 CD1 LEU A 41 -8.386 18.955 -23.667 1.00 15.77 C ATOM 227 CD2 LEU A 41 -9.291 21.306 -23.408 1.00 15.25 C ATOM 228 H LEU A 41 -10.500 18.985 -19.063 1.00 0.00 H ATOM 229 N CYS A 42 -7.912 19.911 -19.242 1.00 8.57 N ATOM 230 CA CYS A 42 -6.694 20.445 -18.701 1.00 9.85 C ATOM 231 C CYS A 42 -6.921 20.890 -17.292 1.00 8.79 C ATOM 232 O CYS A 42 -8.066 21.061 -16.835 1.00 7.81 O ATOM 233 CB CYS A 42 -6.213 21.667 -19.450 1.00 10.96 C ATOM 234 SG CYS A 42 -5.247 21.178 -20.938 1.00 13.18 S ATOM 235 H CYS A 42 -8.820 20.339 -18.971 1.00 0.00 H ATOM 236 N GLY A 43 -5.871 21.020 -16.520 1.00 7.41 N ATOM 237 CA GLY A 43 -6.007 21.674 -15.188 1.00 7.96 C ATOM 238 C GLY A 43 -6.090 23.168 -15.341 1.00 8.77 C ATOM 239 O GLY A 43 -5.841 23.768 -16.436 1.00 7.82 O ATOM 240 H GLY A 43 -4.945 20.668 -16.836 1.00 0.00 H ATOM 241 N GLY A 44 -6.378 23.845 -14.217 1.00 7.16 N ATOM 242 CA GLY A 44 -6.369 25.260 -14.122 1.00 7.14 C ATOM 243 C GLY A 44 -6.297 25.652 -12.692 1.00 6.55 C ATOM 244 O GLY A 44 -6.456 24.802 -11.762 1.00 7.05 O ATOM 245 H GLY A 44 -6.622 23.299 -13.366 1.00 0.00 H ATOM 246 N VAL A 45 -6.001 26.922 -12.431 1.00 6.92 N ATOM 247 CA VAL A 45 -5.818 27.455 -11.120 1.00 6.61 C ATOM 248 C VAL A 45 -6.707 28.646 -10.915 1.00 6.85 C ATOM 249 O VAL A 45 -6.547 29.653 -11.660 1.00 7.49 O ATOM 250 CB VAL A 45 -4.366 27.861 -10.861 1.00 8.26 C ATOM 251 CG1 VAL A 45 -4.119 28.295 -9.458 1.00 8.76 C ATOM 252 CG2 VAL A 45 -3.419 26.762 -11.322 1.00 10.20 C ATOM 253 H VAL A 45 -5.896 27.571 -13.237 1.00 0.00 H ATOM 254 N LEU A 46 -7.602 28.631 -9.963 1.00 6.77 N ATOM 255 CA LEU A 46 -8.355 29.777 -9.621 1.00 6.85 C ATOM 256 C LEU A 46 -7.443 30.854 -9.044 1.00 7.21 C ATOM 257 O LEU A 46 -6.786 30.647 -8.053 1.00 7.31 O ATOM 258 CB LEU A 46 -9.452 29.441 -8.631 1.00 6.99 C ATOM 259 CG LEU A 46 -10.518 30.524 -8.387 1.00 7.75 C ATOM 260 CD1 LEU A 46 -11.417 30.794 -9.592 1.00 8.63 C ATOM 261 CD2 LEU A 46 -11.373 30.219 -7.181 1.00 8.16 C ATOM 262 H LEU A 46 -7.765 27.747 -9.440 1.00 0.00 H ATOM 263 N VAL A 47 -7.358 32.054 -9.719 1.00 8.11 N ATOM 264 CA VAL A 47 -6.451 33.111 -9.290 1.00 9.02 C ATOM 265 C VAL A 47 -7.164 34.385 -8.842 1.00 8.88 C ATOM 266 O VAL A 47 -6.516 35.226 -8.258 1.00 9.73 O ATOM 267 CB VAL A 47 -5.342 33.434 -10.328 1.00 9.42 C ATOM 268 CG1 VAL A 47 -4.386 32.231 -10.506 1.00 9.96 C ATOM 269 CG2 VAL A 47 -5.935 33.868 -11.643 1.00 10.43 C ATOM 270 H VAL A 47 -7.956 32.208 -10.555 1.00 0.00 H ATOM 271 N ALA A 48 -8.429 34.476 -9.146 1.00 9.73 N ATOM 272 CA ALA A 48 -9.277 35.523 -8.578 1.00 10.30 C ATOM 273 C ALA A 48 -10.674 34.964 -8.575 1.00 10.07 C ATOM 274 O ALA A 48 -10.930 33.929 -9.222 1.00 10.74 O ATOM 275 CB ALA A 48 -9.222 36.771 -9.430 1.00 11.90 C ATOM 276 H ALA A 48 -8.844 33.789 -9.807 1.00 0.00 H ATOM 277 N GLU A 49 -11.671 35.665 -7.989 1.00 12.10 N ATOM 278 CA GLU A 49 -13.046 35.198 -7.967 1.00 12.90 C ATOM 279 C GLU A 49 -13.616 34.797 -9.272 1.00 11.79 C ATOM 280 O GLU A 49 -14.432 33.906 -9.375 1.00 13.02 O ATOM 281 CB GLU A 49 -13.988 36.259 -7.344 1.00 15.93 C ATOM 282 CG GLU A 49 -13.644 36.461 -5.877 1.00 18.42 C ATOM 283 CD GLU A 49 -14.618 37.334 -5.085 1.00 21.12 C ATOM 284 OE1 GLU A 49 -15.813 37.412 -5.486 1.00 22.87 O ATOM 285 OE2 GLU A 49 -14.188 37.858 -4.031 1.00 30.07 O ATOM 286 H GLU A 49 -11.444 36.574 -7.537 1.00 0.00 H ATOM 287 N GLN A 50 -13.269 35.515 -10.336 1.00 10.40 N ATOM 288 CA GLN A 50 -13.839 35.260 -11.600 1.00 10.84 C ATOM 289 C GLN A 50 -12.864 34.800 -12.695 1.00 11.30 C ATOM 290 O GLN A 50 -13.177 34.749 -13.888 1.00 11.24 O ATOM 291 CB GLN A 50 -14.600 36.590 -12.094 1.00 12.01 C ATOM 292 CG GLN A 50 -15.635 36.324 -13.133 1.00 12.04 C ATOM 293 CD GLN A 50 -16.546 37.490 -13.484 1.00 15.45 C ATOM 294 OE1 GLN A 50 -16.459 38.486 -12.804 1.00 18.94 O ATOM 295 NE2 GLN A 50 -17.320 37.326 -14.544 1.00 16.65 N ATOM 296 HE22 GLN A 50 -17.315 36.421 -15.057 1.00 0.00 H ATOM 297 HE21 GLN A 50 -17.934 38.102 -14.865 1.00 0.00 H ATOM 298 H GLN A 50 -12.567 36.276 -10.234 1.00 0.00 H ATOM 299 N TRP A 51 -11.643 34.373 -12.251 1.00 9.44 N ATOM 300 CA TRP A 51 -10.598 34.067 -13.286 1.00 9.30 C ATOM 301 C TRP A 51 -9.816 32.788 -12.924 1.00 8.54 C ATOM 302 O TRP A 51 -9.319 32.699 -11.772 1.00 8.70 O ATOM 303 CB TRP A 51 -9.589 35.255 -13.387 1.00 10.83 C ATOM 304 CG TRP A 51 -10.176 36.499 -13.986 1.00 9.89 C ATOM 305 CD1 TRP A 51 -10.696 37.545 -13.305 1.00 12.67 C ATOM 306 CD2 TRP A 51 -10.210 36.787 -15.388 1.00 12.12 C ATOM 307 NE1 TRP A 51 -11.123 38.483 -14.294 1.00 13.29 N ATOM 308 CE2 TRP A 51 -10.795 38.046 -15.532 1.00 13.08 C ATOM 309 CE3 TRP A 51 -9.774 36.107 -16.521 1.00 12.82 C ATOM 310 CZ2 TRP A 51 -10.909 38.638 -16.822 1.00 15.29 C ATOM 311 CZ3 TRP A 51 -9.929 36.657 -17.790 1.00 13.10 C ATOM 312 CH2 TRP A 51 -10.496 37.931 -17.913 1.00 14.24 C ATOM 313 HE1 TRP A 51 -11.616 39.376 -14.091 1.00 0.00 H ATOM 314 H TRP A 51 -11.445 34.264 -11.236 1.00 0.00 H ATOM 315 N VAL A 52 -9.626 31.998 -13.945 1.00 8.71 N ATOM 316 CA VAL A 52 -8.829 30.740 -13.853 1.00 8.81 C ATOM 317 C VAL A 52 -7.696 30.848 -14.782 1.00 8.67 C ATOM 318 O VAL A 52 -7.874 31.207 -15.961 1.00 9.85 O ATOM 319 CB VAL A 52 -9.722 29.552 -14.177 1.00 9.72 C ATOM 320 CG1 VAL A 52 -8.921 28.273 -14.341 1.00 9.52 C ATOM 321 CG2 VAL A 52 -10.762 29.391 -13.091 1.00 10.82 C ATOM 322 H VAL A 52 -10.047 32.256 -14.860 1.00 0.00 H ATOM 323 N LEU A 53 -6.486 30.596 -14.310 1.00 7.93 N ATOM 324 CA LEU A 53 -5.258 30.561 -15.116 1.00 7.47 C ATOM 325 C LEU A 53 -5.068 29.165 -15.579 1.00 8.05 C ATOM 326 O LEU A 53 -5.097 28.203 -14.750 1.00 8.76 O ATOM 327 CB LEU A 53 -4.097 31.078 -14.309 1.00 8.05 C ATOM 328 CG LEU A 53 -2.714 31.149 -14.965 1.00 8.79 C ATOM 329 CD1 LEU A 53 -2.790 32.163 -16.128 1.00 10.33 C ATOM 330 CD2 LEU A 53 -1.705 31.551 -13.995 1.00 9.35 C ATOM 331 H LEU A 53 -6.397 30.408 -13.291 1.00 0.00 H ATOM 332 N SER A 54 -4.715 28.941 -16.829 1.00 7.58 N ATOM 333 CA SER A 54 -4.464 27.644 -17.385 1.00 7.64 C ATOM 334 C SER A 54 -3.409 27.817 -18.533 1.00 7.30 C ATOM 335 O SER A 54 -2.692 28.790 -18.526 1.00 8.47 O ATOM 336 CB SER A 54 -5.754 26.977 -17.837 1.00 7.77 C ATOM 337 OG SER A 54 -5.625 25.698 -18.366 1.00 8.83 O ATOM 338 HG SER A 54 -5.229 25.099 -17.685 1.00 0.00 H ATOM 339 H SER A 54 -4.611 29.764 -17.456 1.00 0.00 H ATOM 340 N ALA A 55 -3.347 26.828 -19.422 1.00 8.63 N ATOM 341 CA ALA A 55 -2.352 26.835 -20.507 1.00 8.70 C ATOM 342 C ALA A 55 -3.001 27.089 -21.841 1.00 10.69 C ATOM 343 O ALA A 55 -3.982 26.486 -22.180 1.00 11.06 O ATOM 344 CB ALA A 55 -1.584 25.523 -20.499 1.00 10.23 C ATOM 345 H ALA A 55 -4.015 26.034 -19.349 1.00 0.00 H ATOM 346 N ALA A 56 -2.386 28.021 -22.601 1.00 10.44 N ATOM 347 CA ALA A 56 -3.004 28.338 -23.922 1.00 11.75 C ATOM 348 C ALA A 56 -3.158 27.193 -24.814 1.00 11.67 C ATOM 349 O ALA A 56 -4.158 27.092 -25.527 1.00 11.81 O ATOM 350 CB ALA A 56 -2.200 29.449 -24.608 1.00 12.75 C ATOM 351 H ALA A 56 -1.519 28.497 -22.279 1.00 0.00 H ATOM 352 N HIS A 57 -2.196 26.272 -24.860 1.00 11.32 N ATOM 353 CA HIS A 57 -2.257 25.166 -25.799 1.00 11.24 C ATOM 354 C HIS A 57 -3.430 24.294 -25.630 1.00 13.04 C ATOM 355 O HIS A 57 -3.828 23.522 -26.511 1.00 15.36 O ATOM 356 CB HIS A 57 -0.943 24.379 -25.848 1.00 12.01 C ATOM 357 CG HIS A 57 -0.810 23.387 -24.752 1.00 12.32 C ATOM 358 ND1 HIS A 57 -0.086 23.637 -23.632 1.00 12.87 N ATOM 359 CD2 HIS A 57 -1.336 22.151 -24.633 1.00 13.94 C ATOM 360 CE1 HIS A 57 -0.124 22.527 -22.859 1.00 11.25 C ATOM 361 NE2 HIS A 57 -0.861 21.616 -23.450 1.00 14.38 N ATOM 362 H HIS A 57 -1.387 26.347 -24.211 1.00 0.00 H ATOM 363 N CYS A 58 -4.014 24.292 -24.407 1.00 13.23 N ATOM 364 CA CYS A 58 -5.128 23.409 -24.174 1.00 14.27 C ATOM 365 C CYS A 58 -6.314 23.695 -25.072 1.00 14.55 C ATOM 366 O CYS A 58 -7.025 22.746 -25.426 1.00 16.07 O ATOM 367 CB CYS A 58 -5.600 23.622 -22.725 1.00 13.59 C ATOM 368 SG CYS A 58 -4.421 23.004 -21.474 1.00 14.45 S ATOM 369 H CYS A 58 -3.665 24.916 -23.652 1.00 0.00 H ATOM 370 N LEU A 59 -6.483 24.952 -25.426 1.00 14.42 N ATOM 371 CA LEU A 59 -7.608 25.347 -26.268 1.00 17.95 C ATOM 372 C LEU A 59 -7.246 25.343 -27.772 1.00 26.02 C ATOM 373 O LEU A 59 -8.137 25.432 -28.563 1.00 28.63 O ATOM 374 CB LEU A 59 -8.231 26.608 -25.746 1.00 19.87 C ATOM 375 CG LEU A 59 -9.191 26.484 -24.591 1.00 24.11 C ATOM 376 CD1 LEU A 59 -8.680 25.731 -23.396 1.00 36.29 C ATOM 377 CD2 LEU A 59 -9.722 27.858 -24.235 1.00 25.57 C ATOM 378 H LEU A 59 -5.807 25.672 -25.102 1.00 0.00 H ATOM 379 N GLU A 60 -6.005 25.120 -28.220 1.00 30.58 N ATOM 380 CA GLU A 60 -5.799 24.630 -29.728 1.00 33.10 C ATOM 381 C GLU A 60 -6.865 23.738 -30.479 1.00 38.58 C ATOM 382 O GLU A 60 -7.156 22.571 -30.056 1.00 48.90 O ATOM 383 CB GLU A 60 -4.476 23.919 -29.807 1.00 34.73 C ATOM 384 CG GLU A 60 -3.359 24.990 -29.800 1.00 37.90 C ATOM 385 CD GLU A 60 -1.915 24.476 -29.649 1.00 40.37 C ATOM 386 OE1 GLU A 60 -1.787 23.270 -29.983 1.00 35.25 O ATOM 387 OE2 GLU A 60 -0.989 25.313 -29.176 1.00 29.68 O ATOM 388 H GLU A 60 -5.186 25.263 -27.596 1.00 0.00 H TER 389 GLU A 60 ATOM 390 N GLY A 62 -15.955 23.714 -29.701 1.00 37.20 N ATOM 391 CA GLY A 62 -16.575 23.074 -28.525 1.00 29.78 C ATOM 392 C GLY A 62 -16.818 23.999 -27.310 1.00 24.51 C ATOM 393 O GLY A 62 -16.385 25.162 -27.193 1.00 27.16 O ATOM 394 HN3 GLY A 62 -15.026 24.098 -29.435 1.00 0.00 H ATOM 395 HN2 GLY A 62 -16.567 24.485 -30.038 1.00 0.00 H ATOM 396 HN1 GLY A 62 -15.837 23.009 -30.456 1.00 0.00 H ATOM 397 N LYS A 63 -17.558 23.463 -26.353 1.00 24.32 N ATOM 398 CA LYS A 63 -18.015 24.223 -25.168 1.00 21.54 C ATOM 399 C LYS A 63 -16.967 24.068 -24.018 1.00 16.57 C ATOM 400 O LYS A 63 -16.793 22.894 -23.569 1.00 18.72 O ATOM 401 CB LYS A 63 -19.331 23.641 -24.712 1.00 23.57 C ATOM 402 CG LYS A 63 -19.895 24.386 -23.538 1.00 30.49 C ATOM 403 CD LYS A 63 -20.287 25.781 -23.960 1.00 40.36 C ATOM 404 CE LYS A 63 -21.140 26.561 -22.939 1.00 46.87 C ATOM 405 NZ LYS A 63 -21.095 28.048 -23.283 1.00 43.99 N ATOM 406 HZ1 LYS A 63 -20.111 28.382 -23.245 1.00 0.00 H ATOM 407 HZ2 LYS A 63 -21.475 28.193 -24.240 1.00 0.00 H ATOM 408 HZ3 LYS A 63 -21.669 28.579 -22.597 1.00 0.00 H ATOM 409 H LYS A 63 -17.831 22.463 -26.437 1.00 0.00 H ATOM 410 N VAL A 64 -16.391 25.211 -23.667 1.00 18.27 N ATOM 411 CA VAL A 64 -15.338 25.212 -22.591 1.00 17.46 C ATOM 412 C VAL A 64 -16.051 25.629 -21.326 1.00 16.28 C ATOM 413 O VAL A 64 -16.729 26.647 -21.273 1.00 17.42 O ATOM 414 CB VAL A 64 -14.260 26.195 -22.877 1.00 18.26 C ATOM 415 CG1 VAL A 64 -13.166 26.093 -21.778 1.00 21.35 C ATOM 416 CG2 VAL A 64 -13.631 25.796 -24.229 1.00 21.46 C ATOM 417 H VAL A 64 -16.665 26.100 -24.132 1.00 0.00 H ATOM 418 N GLN A 65 -15.843 24.792 -20.248 1.00 13.63 N ATOM 419 CA GLN A 65 -16.397 25.110 -18.926 1.00 12.85 C ATOM 420 C GLN A 65 -15.327 24.885 -17.884 1.00 10.93 C ATOM 421 O GLN A 65 -14.278 24.290 -18.192 1.00 12.94 O ATOM 422 CB GLN A 65 -17.578 24.266 -18.652 1.00 13.69 C ATOM 423 CG GLN A 65 -18.759 24.478 -19.650 1.00 14.10 C ATOM 424 CD GLN A 65 -19.876 23.546 -19.401 1.00 15.63 C ATOM 425 OE1 GLN A 65 -19.749 22.310 -19.492 1.00 17.61 O ATOM 426 NE2 GLN A 65 -21.060 24.130 -18.992 1.00 17.09 N ATOM 427 HE22 GLN A 65 -21.134 25.165 -18.926 1.00 0.00 H ATOM 428 HE21 GLN A 65 -21.877 23.534 -18.750 1.00 0.00 H ATOM 429 H GLN A 65 -15.286 23.923 -20.374 1.00 0.00 H ATOM 430 N VAL A 66 -15.535 25.375 -16.691 1.00 8.81 N ATOM 431 CA VAL A 66 -14.643 25.163 -15.574 1.00 8.83 C ATOM 432 C VAL A 66 -15.382 24.609 -14.369 1.00 8.34 C ATOM 433 O VAL A 66 -16.408 25.123 -13.963 1.00 9.78 O ATOM 434 CB VAL A 66 -13.971 26.429 -15.151 1.00 10.10 C ATOM 435 CG1 VAL A 66 -13.098 26.253 -13.936 1.00 12.92 C ATOM 436 CG2 VAL A 66 -13.123 27.045 -16.303 1.00 10.07 C ATOM 437 H VAL A 66 -16.389 25.949 -16.537 1.00 0.00 H ATOM 438 N LEU A 67 -14.898 23.465 -13.893 1.00 7.80 N ATOM 439 CA LEU A 67 -15.441 22.813 -12.669 1.00 7.63 C ATOM 440 C LEU A 67 -14.584 23.171 -11.481 1.00 7.00 C ATOM 441 O LEU A 67 -13.357 22.880 -11.467 1.00 8.37 O ATOM 442 CB LEU A 67 -15.469 21.320 -12.850 1.00 8.25 C ATOM 443 CG LEU A 67 -16.019 20.499 -11.698 1.00 9.39 C ATOM 444 CD1 LEU A 67 -17.474 20.789 -11.466 1.00 10.30 C ATOM 445 CD2 LEU A 67 -15.746 19.060 -11.942 1.00 10.21 C ATOM 446 H LEU A 67 -14.110 23.008 -14.395 1.00 0.00 H ATOM 447 N LEU A 68 -15.203 23.839 -10.548 1.00 7.14 N ATOM 448 CA LEU A 68 -14.584 24.245 -9.275 1.00 6.11 C ATOM 449 C LEU A 68 -15.141 23.403 -8.120 1.00 6.34 C ATOM 450 O LEU A 68 -16.196 22.834 -8.210 1.00 6.91 O ATOM 451 CB LEU A 68 -14.782 25.711 -8.980 1.00 7.27 C ATOM 452 CG LEU A 68 -14.234 26.703 -10.030 1.00 7.43 C ATOM 453 CD1 LEU A 68 -14.465 28.131 -9.586 1.00 8.68 C ATOM 454 CD2 LEU A 68 -12.769 26.470 -10.242 1.00 9.71 C ATOM 455 H LEU A 68 -16.196 24.101 -10.713 1.00 0.00 H ATOM 456 N GLY A 69 -14.390 23.351 -7.057 1.00 6.23 N ATOM 457 CA GLY A 69 -14.843 22.684 -5.853 1.00 6.81 C ATOM 458 C GLY A 69 -14.798 21.216 -5.874 1.00 6.41 C ATOM 459 O GLY A 69 -15.457 20.568 -5.010 1.00 7.26 O ATOM 460 H GLY A 69 -13.450 23.795 -7.073 1.00 0.00 H ATOM 461 N ALA A 70 -14.104 20.616 -6.833 1.00 6.38 N ATOM 462 CA ALA A 70 -14.191 19.198 -7.093 1.00 6.20 C ATOM 463 C ALA A 70 -13.030 18.404 -6.539 1.00 5.89 C ATOM 464 O ALA A 70 -11.858 18.837 -6.449 1.00 6.60 O ATOM 465 CB ALA A 70 -14.239 18.918 -8.581 1.00 5.92 C ATOM 466 H ALA A 70 -13.470 21.192 -7.423 1.00 0.00 H ATOM 467 N HIS A 71 -13.354 17.131 -6.214 1.00 5.87 N ATOM 468 CA HIS A 71 -12.369 16.118 -5.983 1.00 6.13 C ATOM 469 C HIS A 71 -12.546 15.012 -7.018 1.00 6.29 C ATOM 470 O HIS A 71 -11.660 14.745 -7.854 1.00 6.82 O ATOM 471 CB HIS A 71 -12.383 15.571 -4.561 1.00 5.86 C ATOM 472 CG HIS A 71 -11.272 14.637 -4.333 1.00 6.14 C ATOM 473 ND1 HIS A 71 -9.951 15.021 -4.545 1.00 7.15 N ATOM 474 CD2 HIS A 71 -11.249 13.338 -3.906 1.00 7.01 C ATOM 475 CE1 HIS A 71 -9.159 13.965 -4.290 1.00 6.94 C ATOM 476 NE2 HIS A 71 -9.922 12.939 -3.906 1.00 8.29 N ATOM 477 H HIS A 71 -14.359 16.878 -6.129 1.00 0.00 H ATOM 478 N SER A 72 -13.717 14.373 -6.985 1.00 6.52 N ATOM 479 CA SER A 72 -14.143 13.414 -7.999 1.00 7.57 C ATOM 480 C SER A 72 -14.752 14.143 -9.163 1.00 7.37 C ATOM 481 O SER A 72 -15.595 15.013 -9.010 1.00 8.59 O ATOM 482 CB SER A 72 -15.140 12.466 -7.369 1.00 8.01 C ATOM 483 OG SER A 72 -15.766 11.704 -8.424 1.00 9.07 O ATOM 484 HG SER A 72 -15.075 11.194 -8.916 1.00 0.00 H ATOM 485 H SER A 72 -14.362 14.569 -6.193 1.00 0.00 H ATOM 486 N LEU A 73 -14.409 13.736 -10.381 1.00 8.17 N ATOM 487 CA LEU A 73 -15.014 14.291 -11.566 1.00 8.86 C ATOM 488 C LEU A 73 -16.478 13.819 -11.761 1.00 10.04 C ATOM 489 O LEU A 73 -17.237 14.567 -12.387 1.00 12.22 O ATOM 490 CB LEU A 73 -14.193 13.918 -12.830 1.00 9.17 C ATOM 491 CG LEU A 73 -12.800 14.526 -12.870 1.00 9.44 C ATOM 492 CD1 LEU A 73 -12.054 13.970 -14.080 1.00 10.04 C ATOM 493 CD2 LEU A 73 -12.825 16.046 -12.943 1.00 11.59 C ATOM 494 H LEU A 73 -13.684 12.997 -10.482 1.00 0.00 H ATOM 495 N SER A 74 -16.812 12.697 -11.169 1.00 9.50 N ATOM 496 CA SER A 74 -18.081 12.087 -11.438 1.00 11.32 C ATOM 497 C SER A 74 -19.029 12.096 -10.295 1.00 10.55 C ATOM 498 O SER A 74 -20.250 12.009 -10.549 1.00 13.31 O ATOM 499 CB SER A 74 -17.843 10.593 -11.865 1.00 10.34 C ATOM 500 OG SER A 74 -17.307 9.815 -10.895 1.00 12.06 O ATOM 501 HG SER A 74 -16.428 10.183 -10.626 1.00 0.00 H ATOM 502 H SER A 74 -16.153 12.248 -10.501 1.00 0.00 H ATOM 503 N GLN A 75 -18.581 12.053 -9.059 1.00 9.49 N ATOM 504 CA GLN A 75 -19.450 11.793 -7.919 1.00 10.32 C ATOM 505 C GLN A 75 -20.042 13.089 -7.359 1.00 10.09 C ATOM 506 O GLN A 75 -19.421 14.183 -7.469 1.00 9.94 O ATOM 507 CB GLN A 75 -18.680 11.067 -6.846 1.00 11.43 C ATOM 508 CG GLN A 75 -18.179 9.692 -7.241 1.00 13.40 C ATOM 509 CD GLN A 75 -19.346 8.793 -7.686 1.00 22.65 C ATOM 510 OE1 GLN A 75 -20.300 8.658 -6.884 1.00 29.51 O ATOM 511 NE2 GLN A 75 -19.388 8.402 -9.017 1.00 29.90 N ATOM 512 HE22 GLN A 75 -18.558 8.544 -9.627 1.00 0.00 H ATOM 513 HE21 GLN A 75 -20.250 7.967 -9.404 1.00 0.00 H ATOM 514 H GLN A 75 -17.567 12.211 -8.889 1.00 0.00 H ATOM 515 N PRO A 76 -21.211 13.065 -6.712 1.00 10.53 N ATOM 516 CA PRO A 76 -21.793 14.235 -6.135 1.00 9.94 C ATOM 517 C PRO A 76 -20.961 14.768 -4.964 1.00 8.95 C ATOM 518 O PRO A 76 -20.594 13.992 -4.066 1.00 8.77 O ATOM 519 CB PRO A 76 -23.151 13.779 -5.695 1.00 11.80 C ATOM 520 CG PRO A 76 -23.037 12.337 -5.489 1.00 12.95 C ATOM 521 CD PRO A 76 -22.069 11.868 -6.509 1.00 10.85 C ATOM 522 N GLU A 77 -20.701 16.087 -4.942 1.00 7.77 N ATOM 523 CA GLU A 77 -19.997 16.677 -3.852 1.00 7.03 C ATOM 524 C GLU A 77 -20.638 18.022 -3.549 1.00 7.99 C ATOM 525 O GLU A 77 -21.011 18.722 -4.456 1.00 8.59 O ATOM 526 CB GLU A 77 -18.499 16.881 -4.186 1.00 8.10 C ATOM 527 CG GLU A 77 -17.746 15.588 -4.504 1.00 8.11 C ATOM 528 CD GLU A 77 -16.376 15.731 -5.067 1.00 9.46 C ATOM 529 OE1 GLU A 77 -16.050 16.857 -5.556 1.00 10.36 O ATOM 530 OE2 GLU A 77 -15.654 14.733 -5.041 1.00 9.92 O ATOM 531 H GLU A 77 -21.018 16.685 -5.731 1.00 0.00 H ATOM 532 N PRO A 78 -20.717 18.415 -2.302 1.00 6.90 N ATOM 533 CA PRO A 78 -21.469 19.634 -1.986 1.00 8.11 C ATOM 534 C PRO A 78 -20.920 20.907 -2.509 1.00 7.67 C ATOM 535 O PRO A 78 -21.677 21.821 -2.785 1.00 9.01 O ATOM 536 CB PRO A 78 -21.477 19.689 -0.515 1.00 9.58 C ATOM 537 CG PRO A 78 -20.440 18.528 -0.030 1.00 8.90 C ATOM 538 CD PRO A 78 -20.352 17.626 -1.107 1.00 8.49 C ATOM 539 N SER A 79 -19.592 20.957 -2.704 1.00 7.33 N ATOM 540 CA SER A 79 -18.940 22.159 -3.199 1.00 6.62 C ATOM 541 C SER A 79 -18.783 22.216 -4.713 1.00 6.52 C ATOM 542 O SER A 79 -18.306 23.232 -5.264 1.00 7.05 O ATOM 543 CB SER A 79 -17.591 22.278 -2.508 1.00 6.36 C ATOM 544 OG SER A 79 -16.800 21.088 -2.702 1.00 8.09 O ATOM 545 HG SER A 79 -16.649 20.948 -3.670 1.00 0.00 H ATOM 546 H SER A 79 -19.016 20.116 -2.496 1.00 0.00 H ATOM 547 N LYS A 80 -19.047 21.124 -5.408 1.00 6.75 N ATOM 548 CA LYS A 80 -18.817 21.136 -6.838 1.00 8.34 C ATOM 549 C LYS A 80 -19.712 22.096 -7.584 1.00 9.27 C ATOM 550 O LYS A 80 -20.972 22.096 -7.329 1.00 11.25 O ATOM 551 CB LYS A 80 -19.010 19.736 -7.462 1.00 10.85 C ATOM 552 CG LYS A 80 -17.844 18.945 -7.438 1.00 13.00 C ATOM 553 CD LYS A 80 -18.023 17.365 -7.738 1.00 16.63 C ATOM 554 CE LYS A 80 -18.340 17.224 -9.167 1.00 15.77 C ATOM 555 NZ LYS A 80 -18.300 15.716 -9.441 1.00 11.28 N ATOM 556 HZ1 LYS A 80 -17.352 15.350 -9.221 1.00 0.00 H ATOM 557 HZ2 LYS A 80 -19.004 15.238 -8.844 1.00 0.00 H ATOM 558 HZ3 LYS A 80 -18.517 15.541 -10.443 1.00 0.00 H ATOM 559 H LYS A 80 -19.413 20.272 -4.937 1.00 0.00 H ATOM 560 N ARG A 81 -19.130 22.948 -8.439 1.00 8.60 N ATOM 561 CA ARG A 81 -19.952 23.823 -9.234 1.00 9.34 C ATOM 562 C ARG A 81 -19.284 24.030 -10.574 1.00 8.72 C ATOM 563 O ARG A 81 -18.096 24.341 -10.668 1.00 8.53 O ATOM 564 CB ARG A 81 -20.128 25.135 -8.563 1.00 11.94 C ATOM 565 CG ARG A 81 -21.070 26.024 -9.322 1.00 17.92 C ATOM 566 CD ARG A 81 -21.795 27.019 -8.490 1.00 25.00 C ATOM 567 NE ARG A 81 -22.366 27.854 -9.536 1.00 30.17 N ATOM 568 CZ ARG A 81 -22.586 29.144 -9.444 1.00 33.11 C ATOM 569 NH1 ARG A 81 -22.400 29.727 -8.270 1.00 30.47 N ATOM 570 NH2 ARG A 81 -23.041 29.807 -10.545 1.00 30.94 N ATOM 571 HE ARG A 81 -22.621 27.390 -10.431 1.00 0.00 H ATOM 572 HH12 ARG A 81 -22.566 30.748 -8.164 1.00 0.00 H ATOM 573 HH11 ARG A 81 -22.088 29.164 -7.453 1.00 0.00 H ATOM 574 HH22 ARG A 81 -23.223 30.830 -10.498 1.00 0.00 H ATOM 575 HH21 ARG A 81 -23.206 29.290 -11.432 1.00 0.00 H ATOM 576 H ARG A 81 -18.094 22.977 -8.528 1.00 0.00 H ATOM 577 N LEU A 82 -20.059 23.880 -11.605 1.00 8.71 N ATOM 578 CA LEU A 82 -19.668 24.041 -13.003 1.00 9.45 C ATOM 579 C LEU A 82 -19.989 25.455 -13.442 1.00 10.66 C ATOM 580 O LEU A 82 -21.095 25.988 -13.201 1.00 11.50 O ATOM 581 CB LEU A 82 -20.437 23.057 -13.825 1.00 10.79 C ATOM 582 CG LEU A 82 -20.048 22.975 -15.274 1.00 12.05 C ATOM 583 CD1 LEU A 82 -18.661 22.395 -15.470 1.00 13.23 C ATOM 584 CD2 LEU A 82 -21.004 22.042 -16.010 1.00 14.55 C ATOM 585 H LEU A 82 -21.049 23.622 -11.418 1.00 0.00 H ATOM 586 N TYR A 83 -19.020 26.103 -14.077 1.00 8.96 N ATOM 587 CA TYR A 83 -19.081 27.487 -14.588 1.00 9.70 C ATOM 588 C TYR A 83 -18.885 27.515 -16.082 1.00 11.61 C ATOM 589 O TYR A 83 -17.998 26.889 -16.634 1.00 11.60 O ATOM 590 CB TYR A 83 -18.107 28.410 -13.918 1.00 10.74 C ATOM 591 CG TYR A 83 -18.357 28.598 -12.464 1.00 10.21 C ATOM 592 CD1 TYR A 83 -17.914 27.670 -11.528 1.00 10.81 C ATOM 593 CD2 TYR A 83 -19.110 29.623 -11.972 1.00 12.09 C ATOM 594 CE1 TYR A 83 -18.152 27.836 -10.250 1.00 11.04 C ATOM 595 CE2 TYR A 83 -19.335 29.838 -10.654 1.00 11.21 C ATOM 596 CZ TYR A 83 -18.854 28.903 -9.733 1.00 10.55 C ATOM 597 OH TYR A 83 -19.140 29.133 -8.397 1.00 12.56 O ATOM 598 HH TYR A 83 -18.749 28.408 -7.848 1.00 0.00 H ATOM 599 H TYR A 83 -18.131 25.585 -14.229 1.00 0.00 H ATOM 600 N ASP A 84 -19.737 28.284 -16.796 1.00 15.09 N ATOM 601 CA ASP A 84 -19.432 28.608 -18.189 1.00 15.10 C ATOM 602 C ASP A 84 -18.347 29.648 -18.184 1.00 14.27 C ATOM 603 O ASP A 84 -18.042 30.339 -17.206 1.00 14.46 O ATOM 604 CB ASP A 84 -20.732 29.133 -18.813 1.00 17.64 C ATOM 605 CG ASP A 84 -21.701 28.047 -19.172 1.00 20.35 C ATOM 606 OD1 ASP A 84 -21.422 26.870 -19.389 1.00 21.55 O ATOM 607 OD2 ASP A 84 -22.878 28.451 -19.422 1.00 27.89 O ATOM 608 H ASP A 84 -20.608 28.644 -16.356 1.00 0.00 H ATOM 609 N VAL A 85 -17.717 29.783 -19.383 1.00 17.49 N ATOM 610 CA VAL A 85 -16.583 30.671 -19.606 1.00 16.46 C ATOM 611 C VAL A 85 -17.134 31.822 -20.477 1.00 16.87 C ATOM 612 O VAL A 85 -17.655 31.544 -21.581 1.00 19.74 O ATOM 613 CB VAL A 85 -15.519 29.892 -20.310 1.00 18.59 C ATOM 614 CG1 VAL A 85 -14.475 30.844 -20.784 1.00 17.80 C ATOM 615 CG2 VAL A 85 -14.883 28.873 -19.326 1.00 19.66 C ATOM 616 H VAL A 85 -18.065 29.220 -20.186 1.00 0.00 H ATOM 617 N LEU A 86 -16.977 33.018 -20.016 1.00 15.96 N ATOM 618 CA LEU A 86 -17.389 34.226 -20.753 1.00 19.11 C ATOM 619 C LEU A 86 -16.343 34.592 -21.804 1.00 21.26 C ATOM 620 O LEU A 86 -16.690 34.936 -22.958 1.00 20.29 O ATOM 621 CB LEU A 86 -17.607 35.309 -19.799 1.00 21.37 C ATOM 622 CG LEU A 86 -18.009 36.743 -20.145 1.00 29.30 C ATOM 623 CD1 LEU A 86 -19.283 36.724 -20.974 1.00 30.93 C ATOM 624 CD2 LEU A 86 -18.182 37.526 -18.838 1.00 31.09 C ATOM 625 H LEU A 86 -16.539 33.134 -19.080 1.00 0.00 H ATOM 626 N ARG A 87 -15.065 34.515 -21.439 1.00 16.88 N ATOM 627 CA ARG A 87 -13.978 34.885 -22.382 1.00 20.61 C ATOM 628 C ARG A 87 -12.774 34.050 -22.099 1.00 17.80 C ATOM 629 O ARG A 87 -12.486 33.809 -20.891 1.00 18.48 O ATOM 630 CB ARG A 87 -13.572 36.296 -22.174 1.00 26.16 C ATOM 631 CG ARG A 87 -13.928 37.099 -23.406 1.00 36.41 C ATOM 632 CD ARG A 87 -13.037 38.297 -23.575 1.00 39.11 C ATOM 633 NE ARG A 87 -12.912 38.925 -22.294 1.00 39.82 N ATOM 634 CZ ARG A 87 -11.890 39.694 -21.953 1.00 34.87 C ATOM 635 NH1 ARG A 87 -10.964 39.967 -22.847 1.00 30.37 N ATOM 636 NH2 ARG A 87 -11.873 40.234 -20.730 1.00 37.65 N ATOM 637 HE ARG A 87 -13.665 38.768 -21.594 1.00 0.00 H ATOM 638 HH12 ARG A 87 -10.156 40.570 -22.591 1.00 0.00 H ATOM 639 HH11 ARG A 87 -11.040 39.580 -23.809 1.00 0.00 H ATOM 640 HH22 ARG A 87 -11.080 40.841 -20.441 1.00 0.00 H ATOM 641 HH21 ARG A 87 -12.653 40.047 -20.068 1.00 0.00 H ATOM 642 H ARG A 87 -14.824 34.191 -20.480 1.00 0.00 H ATOM 643 N ALA A 88 -12.070 33.648 -23.132 1.00 14.85 N ATOM 644 CA ALA A 88 -10.813 32.917 -23.040 1.00 13.91 C ATOM 645 C ALA A 88 -9.767 33.861 -23.581 1.00 16.03 C ATOM 646 O ALA A 88 -9.857 34.287 -24.723 1.00 19.44 O ATOM 647 CB ALA A 88 -10.826 31.627 -23.799 1.00 17.66 C ATOM 648 H ALA A 88 -12.435 33.866 -24.081 1.00 0.00 H ATOM 649 N VAL A 89 -8.755 34.198 -22.794 1.00 12.51 N ATOM 650 CA VAL A 89 -7.755 35.194 -23.145 1.00 11.79 C ATOM 651 C VAL A 89 -6.381 34.498 -23.161 1.00 11.01 C ATOM 652 O VAL A 89 -5.703 34.415 -22.092 1.00 10.72 O ATOM 653 CB VAL A 89 -7.738 36.354 -22.187 1.00 11.48 C ATOM 654 CG1 VAL A 89 -6.778 37.460 -22.623 1.00 13.27 C ATOM 655 CG2 VAL A 89 -9.124 36.905 -21.959 1.00 13.95 C ATOM 656 H VAL A 89 -8.671 33.723 -21.873 1.00 0.00 H ATOM 657 N PRO A 90 -5.865 34.043 -24.333 1.00 12.24 N ATOM 658 CA PRO A 90 -4.523 33.504 -24.405 1.00 12.16 C ATOM 659 C PRO A 90 -3.536 34.594 -24.291 1.00 12.11 C ATOM 660 O PRO A 90 -3.796 35.729 -24.677 1.00 13.07 O ATOM 661 CB PRO A 90 -4.484 32.805 -25.779 1.00 14.54 C ATOM 662 CG PRO A 90 -5.421 33.682 -26.525 1.00 15.93 C ATOM 663 CD PRO A 90 -6.514 34.071 -25.660 1.00 13.49 C ATOM 664 N HIS A 91 -2.370 34.299 -23.794 1.00 11.03 N ATOM 665 CA HIS A 91 -1.293 35.245 -23.803 1.00 10.36 C ATOM 666 C HIS A 91 -1.062 35.745 -25.289 1.00 9.51 C ATOM 667 O HIS A 91 -1.047 34.931 -26.181 1.00 11.60 O ATOM 668 CB HIS A 91 0.016 34.651 -23.242 1.00 9.59 C ATOM 669 CG HIS A 91 1.114 35.691 -23.001 1.00 10.62 C ATOM 670 ND1 HIS A 91 1.803 36.307 -24.068 1.00 10.97 N ATOM 671 CD2 HIS A 91 1.609 36.228 -21.883 1.00 9.75 C ATOM 672 CE1 HIS A 91 2.680 37.103 -23.532 1.00 11.12 C ATOM 673 NE2 HIS A 91 2.564 37.158 -22.226 1.00 11.08 N ATOM 674 H HIS A 91 -2.216 33.357 -23.381 1.00 0.00 H ATOM 675 N PRO A 92 -0.864 37.099 -25.409 1.00 10.40 N ATOM 676 CA PRO A 92 -0.839 37.592 -26.797 1.00 13.24 C ATOM 677 C PRO A 92 0.389 37.225 -27.544 1.00 13.55 C ATOM 678 O PRO A 92 0.401 37.355 -28.779 1.00 17.18 O ATOM 679 CB PRO A 92 -0.894 39.078 -26.576 1.00 12.01 C ATOM 680 CG PRO A 92 -0.339 39.373 -25.187 1.00 10.69 C ATOM 681 CD PRO A 92 -0.901 38.180 -24.429 1.00 9.88 C ATOM 682 N ASP A 93 1.423 36.729 -26.912 1.00 13.25 N ATOM 683 CA ASP A 93 2.646 36.285 -27.654 1.00 13.13 C ATOM 684 C ASP A 93 2.724 34.724 -27.733 1.00 15.61 C ATOM 685 O ASP A 93 3.731 34.181 -28.135 1.00 18.20 O ATOM 686 CB ASP A 93 3.893 36.922 -27.018 1.00 13.99 C ATOM 687 CG ASP A 93 3.902 38.581 -27.003 1.00 16.37 C ATOM 688 OD1 ASP A 93 3.530 38.976 -28.163 1.00 18.45 O ATOM 689 OD2 ASP A 93 4.088 39.258 -25.897 1.00 17.70 O ATOM 690 H ASP A 93 1.395 36.642 -25.876 1.00 0.00 H ATOM 691 N SER A 94 1.717 34.021 -27.217 1.00 14.61 N ATOM 692 CA SER A 94 1.667 32.566 -27.346 1.00 14.00 C ATOM 693 C SER A 94 1.438 32.204 -28.825 1.00 17.83 C ATOM 694 O SER A 94 0.840 33.009 -29.587 1.00 18.87 O ATOM 695 CB SER A 94 0.601 31.910 -26.457 1.00 12.22 C ATOM 696 OG SER A 94 -0.696 32.291 -26.844 1.00 10.64 O ATOM 697 HG SER A 94 -0.786 33.274 -26.770 1.00 0.00 H ATOM 698 H SER A 94 0.953 34.516 -26.714 1.00 0.00 H ATOM 699 N GLN A 95 1.902 31.028 -29.202 1.00 18.88 N ATOM 700 CA GLN A 95 1.772 30.531 -30.581 1.00 21.63 C ATOM 701 C GLN A 95 1.742 29.026 -30.548 1.00 20.86 C ATOM 702 O GLN A 95 2.436 28.427 -29.727 1.00 20.45 O ATOM 703 CB GLN A 95 3.007 30.911 -31.391 1.00 23.76 C ATOM 704 CG GLN A 95 3.307 32.401 -31.565 1.00 29.65 C ATOM 705 CD GLN A 95 4.588 32.570 -32.406 1.00 38.15 C ATOM 706 OE1 GLN A 95 4.834 31.770 -33.317 1.00 47.58 O ATOM 707 NE2 GLN A 95 5.391 33.563 -32.111 1.00 43.26 N ATOM 708 HE22 GLN A 95 5.149 34.215 -31.338 1.00 0.00 H ATOM 709 HE21 GLN A 95 6.270 33.699 -32.650 1.00 0.00 H ATOM 710 H GLN A 95 2.378 30.429 -28.497 1.00 0.00 H ATOM 711 N PRO A 96 0.997 28.400 -31.452 1.00 23.70 N ATOM 712 CA PRO A 96 0.933 26.928 -31.466 1.00 23.04 C ATOM 713 C PRO A 96 2.301 26.191 -31.648 1.00 26.20 C ATOM 714 O PRO A 96 2.550 25.087 -31.127 1.00 27.70 O ATOM 715 CB PRO A 96 -0.044 26.624 -32.597 1.00 30.12 C ATOM 716 CG PRO A 96 -0.719 27.897 -32.914 1.00 32.24 C ATOM 717 CD PRO A 96 0.117 29.028 -32.448 1.00 29.54 C ATOM 718 N ASP A 97 3.223 26.828 -32.319 1.00 24.16 N ATOM 719 CA ASP A 97 4.531 26.126 -32.514 1.00 40.33 C ATOM 720 C ASP A 97 5.633 26.363 -31.448 1.00 40.03 C ATOM 721 O ASP A 97 6.670 25.687 -31.541 1.00 41.07 O ATOM 722 CB ASP A 97 5.089 26.210 -33.997 1.00 48.89 C ATOM 723 CG ASP A 97 5.191 27.652 -34.562 1.00 61.13 C ATOM 724 OD1 ASP A 97 4.525 28.587 -34.041 1.00 69.98 O ATOM 725 OD2 ASP A 97 5.931 27.825 -35.566 1.00 68.42 O ATOM 726 H ASP A 97 3.056 27.781 -32.701 1.00 0.00 H ATOM 727 N THR A 98 5.429 27.241 -30.427 1.00 29.27 N ATOM 728 CA THR A 98 6.405 27.373 -29.344 1.00 24.28 C ATOM 729 C THR A 98 5.826 26.903 -27.936 1.00 20.37 C ATOM 730 O THR A 98 4.656 26.743 -27.705 1.00 23.82 O ATOM 731 CB THR A 98 6.842 28.799 -29.162 1.00 24.73 C ATOM 732 OG1 THR A 98 5.754 29.524 -28.564 1.00 28.02 O ATOM 733 CG2 THR A 98 7.152 29.503 -30.498 1.00 31.62 C ATOM 734 HG1 THR A 98 6.020 30.469 -28.434 1.00 0.00 H ATOM 735 H THR A 98 4.569 27.825 -30.417 1.00 0.00 H ATOM 736 N ILE A 99 6.747 26.745 -27.016 1.00 19.73 N ATOM 737 CA ILE A 99 6.380 26.544 -25.630 1.00 18.99 C ATOM 738 C ILE A 99 6.311 27.853 -24.870 1.00 17.79 C ATOM 739 O ILE A 99 6.067 27.806 -23.668 1.00 17.60 O ATOM 740 CB ILE A 99 7.367 25.566 -24.991 1.00 19.88 C ATOM 741 CG1 ILE A 99 8.775 26.056 -24.940 1.00 23.03 C ATOM 742 CG2 ILE A 99 7.271 24.229 -25.722 1.00 23.73 C ATOM 743 CD1 ILE A 99 9.696 25.210 -24.033 1.00 25.18 C ATOM 744 H ILE A 99 7.751 26.764 -27.285 1.00 0.00 H ATOM 745 N ASP A 100 6.627 29.022 -25.424 1.00 13.77 N ATOM 746 CA ASP A 100 6.740 30.250 -24.704 1.00 13.76 C ATOM 747 C ASP A 100 5.370 30.900 -24.439 1.00 12.11 C ATOM 748 O ASP A 100 4.457 30.855 -25.334 1.00 14.49 O ATOM 749 CB ASP A 100 7.581 31.271 -25.515 1.00 14.65 C ATOM 750 CG ASP A 100 8.966 30.742 -25.794 1.00 19.99 C ATOM 751 OD1 ASP A 100 9.647 30.163 -24.933 1.00 16.33 O ATOM 752 OD2 ASP A 100 9.416 30.875 -26.924 1.00 24.24 O ATOM 753 H ASP A 100 6.803 29.042 -26.449 1.00 0.00 H ATOM 754 N HIS A 101 5.256 31.544 -23.311 1.00 13.13 N ATOM 755 CA HIS A 101 4.107 32.301 -22.947 1.00 12.50 C ATOM 756 C HIS A 101 2.830 31.484 -23.013 1.00 13.92 C ATOM 757 O HIS A 101 1.802 31.954 -23.422 1.00 13.45 O ATOM 758 CB HIS A 101 3.952 33.555 -23.844 1.00 12.82 C ATOM 759 CG HIS A 101 5.255 34.192 -24.158 1.00 13.69 C ATOM 760 ND1 HIS A 101 6.162 34.552 -23.206 1.00 13.91 N ATOM 761 CD2 HIS A 101 5.822 34.416 -25.383 1.00 15.18 C ATOM 762 CE1 HIS A 101 7.217 35.093 -23.847 1.00 17.07 C ATOM 763 NE2 HIS A 101 7.047 34.967 -25.157 1.00 16.02 N ATOM 764 H HIS A 101 6.049 31.502 -22.640 1.00 0.00 H ATOM 765 N ASP A 102 2.857 30.205 -22.597 1.00 11.25 N ATOM 766 CA ASP A 102 1.773 29.302 -22.729 1.00 10.64 C ATOM 767 C ASP A 102 0.744 29.369 -21.629 1.00 11.47 C ATOM 768 O ASP A 102 0.458 28.390 -20.895 1.00 11.95 O ATOM 769 CB ASP A 102 2.335 27.863 -22.788 1.00 11.80 C ATOM 770 CG ASP A 102 1.319 26.846 -23.158 1.00 12.30 C ATOM 771 OD1 ASP A 102 0.271 27.146 -23.813 1.00 12.23 O ATOM 772 OD2 ASP A 102 1.446 25.615 -22.798 1.00 13.25 O ATOM 773 H ASP A 102 3.729 29.857 -22.150 1.00 0.00 H ATOM 774 N LEU A 103 0.214 30.571 -21.493 1.00 10.47 N ATOM 775 CA LEU A 103 -0.737 30.921 -20.452 1.00 10.47 C ATOM 776 C LEU A 103 -2.043 31.355 -21.034 1.00 10.41 C ATOM 777 O LEU A 103 -2.122 31.891 -22.140 1.00 10.71 O ATOM 778 CB LEU A 103 -0.213 31.984 -19.549 1.00 9.61 C ATOM 779 CG LEU A 103 1.014 31.644 -18.706 1.00 10.63 C ATOM 780 CD1 LEU A 103 1.440 32.792 -17.883 1.00 11.36 C ATOM 781 CD2 LEU A 103 0.790 30.447 -17.786 1.00 11.08 C ATOM 782 H LEU A 103 0.493 31.309 -22.170 1.00 0.00 H ATOM 783 N LEU A 104 -3.099 31.092 -20.298 1.00 10.04 N ATOM 784 CA LEU A 104 -4.502 31.288 -20.713 1.00 9.73 C ATOM 785 C LEU A 104 -5.259 31.770 -19.545 1.00 10.55 C ATOM 786 O LEU A 104 -5.204 31.150 -18.435 1.00 9.92 O ATOM 787 CB LEU A 104 -5.089 30.026 -21.206 1.00 10.90 C ATOM 788 CG LEU A 104 -6.561 29.938 -21.554 1.00 12.18 C ATOM 789 CD1 LEU A 104 -6.765 30.857 -22.757 1.00 14.40 C ATOM 790 CD2 LEU A 104 -6.920 28.527 -21.895 1.00 13.16 C ATOM 791 H LEU A 104 -2.933 30.714 -19.343 1.00 0.00 H ATOM 792 N LEU A 105 -5.995 32.875 -19.654 1.00 10.19 N ATOM 793 CA LEU A 105 -6.871 33.380 -18.606 1.00 9.95 C ATOM 794 C LEU A 105 -8.310 33.127 -19.017 1.00 11.71 C ATOM 795 O LEU A 105 -8.750 33.580 -20.071 1.00 11.06 O ATOM 796 CB LEU A 105 -6.604 34.830 -18.246 1.00 9.70 C ATOM 797 CG LEU A 105 -5.454 35.096 -17.338 1.00 9.48 C ATOM 798 CD1 LEU A 105 -5.045 36.548 -17.323 1.00 10.49 C ATOM 799 CD2 LEU A 105 -5.743 34.681 -15.894 1.00 10.10 C ATOM 800 H LEU A 105 -5.941 33.411 -20.544 1.00 0.00 H ATOM 801 N LEU A 106 -9.090 32.440 -18.201 1.00 9.77 N ATOM 802 CA LEU A 106 -10.495 32.139 -18.430 1.00 9.27 C ATOM 803 C LEU A 106 -11.315 32.927 -17.477 1.00 10.16 C ATOM 804 O LEU A 106 -11.216 32.809 -16.224 1.00 10.68 O ATOM 805 CB LEU A 106 -10.772 30.655 -18.272 1.00 10.82 C ATOM 806 CG LEU A 106 -9.969 29.688 -19.087 1.00 12.22 C ATOM 807 CD1 LEU A 106 -10.122 28.226 -18.642 1.00 14.17 C ATOM 808 CD2 LEU A 106 -10.291 29.852 -20.542 1.00 15.35 C ATOM 809 H LEU A 106 -8.664 32.085 -17.321 1.00 0.00 H ATOM 810 N GLN A 107 -12.193 33.813 -18.013 1.00 11.55 N ATOM 811 CA GLN A 107 -13.122 34.582 -17.225 1.00 12.25 C ATOM 812 C GLN A 107 -14.394 33.794 -17.092 1.00 13.04 C ATOM 813 O GLN A 107 -15.015 33.436 -18.095 1.00 13.78 O ATOM 814 CB GLN A 107 -13.441 35.928 -17.952 1.00 12.77 C ATOM 815 CG GLN A 107 -14.234 36.860 -17.041 1.00 15.23 C ATOM 816 CD GLN A 107 -14.598 38.222 -17.728 1.00 16.58 C ATOM 817 OE1 GLN A 107 -14.704 38.212 -18.944 1.00 24.41 O ATOM 818 NE2 GLN A 107 -14.890 39.210 -16.973 1.00 22.32 N ATOM 819 HE22 GLN A 107 -14.768 39.131 -15.943 1.00 0.00 H ATOM 820 HE21 GLN A 107 -15.249 40.093 -17.388 1.00 0.00 H ATOM 821 H GLN A 107 -12.195 33.943 -19.045 1.00 0.00 H ATOM 822 N LEU A 108 -14.770 33.483 -15.869 1.00 11.79 N ATOM 823 CA LEU A 108 -16.024 32.773 -15.584 1.00 13.20 C ATOM 824 C LEU A 108 -17.277 33.613 -15.924 1.00 13.73 C ATOM 825 O LEU A 108 -17.167 34.807 -15.854 1.00 13.48 O ATOM 826 CB LEU A 108 -15.986 32.274 -14.156 1.00 13.28 C ATOM 827 CG LEU A 108 -14.770 31.431 -13.744 1.00 13.19 C ATOM 828 CD1 LEU A 108 -14.978 31.097 -12.290 1.00 14.10 C ATOM 829 CD2 LEU A 108 -14.609 30.217 -14.606 1.00 13.86 C ATOM 830 H LEU A 108 -14.155 33.750 -15.074 1.00 0.00 H ATOM 831 N SER A 109 -18.351 32.899 -16.169 1.00 15.20 N ATOM 832 CA SER A 109 -19.685 33.600 -16.481 1.00 17.39 C ATOM 833 C SER A 109 -20.113 34.471 -15.346 1.00 18.90 C ATOM 834 O SER A 109 -20.818 35.469 -15.527 1.00 19.60 O ATOM 835 CB SER A 109 -20.758 32.531 -16.797 1.00 19.85 C ATOM 836 OG SER A 109 -21.108 31.914 -15.521 1.00 27.67 O ATOM 837 HG SER A 109 -21.796 31.218 -15.670 1.00 0.00 H ATOM 838 H SER A 109 -18.300 31.860 -16.152 1.00 0.00 H ATOM 839 N GLU A 110 -19.743 34.129 -14.123 1.00 15.68 N ATOM 840 CA GLU A 110 -19.964 34.936 -12.963 1.00 17.24 C ATOM 841 C GLU A 110 -18.898 34.717 -11.914 1.00 15.64 C ATOM 842 O GLU A 110 -18.108 33.784 -12.102 1.00 14.64 O ATOM 843 CB GLU A 110 -21.345 34.648 -12.327 1.00 23.01 C ATOM 844 CG GLU A 110 -21.500 33.225 -11.910 1.00 27.09 C ATOM 845 CD GLU A 110 -22.926 32.822 -11.449 1.00 32.96 C ATOM 846 OE1 GLU A 110 -23.156 32.632 -10.218 1.00 37.58 O ATOM 847 OE2 GLU A 110 -23.752 32.640 -12.344 1.00 34.48 O ATOM 848 H GLU A 110 -19.261 33.216 -13.997 1.00 0.00 H ATOM 849 N LYS A 111 -18.810 35.572 -10.923 1.00 16.72 N ATOM 850 CA LYS A 111 -17.898 35.410 -9.773 1.00 14.99 C ATOM 851 C LYS A 111 -18.200 34.035 -9.155 1.00 14.90 C ATOM 852 O LYS A 111 -19.373 33.697 -8.906 1.00 16.82 O ATOM 853 CB LYS A 111 -18.012 36.475 -8.736 1.00 18.97 C ATOM 854 CG LYS A 111 -17.561 37.780 -9.394 1.00 25.80 C ATOM 855 CD LYS A 111 -18.279 38.918 -8.727 1.00 34.40 C ATOM 856 CE LYS A 111 -17.417 39.563 -7.726 1.00 44.45 C ATOM 857 NZ LYS A 111 -17.878 40.972 -7.483 1.00 51.85 N ATOM 858 HZ1 LYS A 111 -17.832 41.509 -8.372 1.00 0.00 H ATOM 859 HZ2 LYS A 111 -18.858 40.960 -7.135 1.00 0.00 H ATOM 860 HZ3 LYS A 111 -17.263 41.419 -6.774 1.00 0.00 H ATOM 861 H LYS A 111 -19.419 36.415 -10.949 1.00 0.00 H ATOM 862 N ALA A 112 -17.138 33.231 -8.926 1.00 12.46 N ATOM 863 CA ALA A 112 -17.345 31.964 -8.215 1.00 12.97 C ATOM 864 C ALA A 112 -17.819 32.186 -6.807 1.00 10.05 C ATOM 865 O ALA A 112 -17.370 33.053 -6.096 1.00 11.71 O ATOM 866 CB ALA A 112 -16.070 31.199 -8.227 1.00 11.34 C ATOM 867 H ALA A 112 -16.188 33.506 -9.249 1.00 0.00 H ATOM 868 N THR A 113 -18.679 31.250 -6.386 1.00 11.44 N ATOM 869 CA THR A 113 -19.019 31.183 -4.930 1.00 12.05 C ATOM 870 C THR A 113 -17.865 30.649 -4.134 1.00 10.66 C ATOM 871 O THR A 113 -17.463 29.493 -4.335 1.00 10.95 O ATOM 872 CB THR A 113 -20.212 30.259 -4.815 1.00 13.45 C ATOM 873 OG1 THR A 113 -21.274 30.804 -5.611 1.00 17.37 O ATOM 874 CG2 THR A 113 -20.670 30.180 -3.338 1.00 12.76 C ATOM 875 HG1 THR A 113 -20.979 30.867 -6.554 1.00 0.00 H ATOM 876 H THR A 113 -19.104 30.581 -7.059 1.00 0.00 H ATOM 877 N LEU A 114 -17.236 31.480 -3.333 1.00 9.73 N ATOM 878 CA LEU A 114 -16.076 31.132 -2.639 1.00 10.92 C ATOM 879 C LEU A 114 -16.443 30.375 -1.389 1.00 8.96 C ATOM 880 O LEU A 114 -17.580 30.453 -0.849 1.00 10.56 O ATOM 881 CB LEU A 114 -15.145 32.313 -2.288 1.00 11.61 C ATOM 882 CG LEU A 114 -14.708 33.094 -3.532 1.00 12.42 C ATOM 883 CD1 LEU A 114 -13.761 34.169 -2.985 1.00 16.40 C ATOM 884 CD2 LEU A 114 -14.023 32.245 -4.609 1.00 13.98 C ATOM 885 H LEU A 114 -17.620 32.439 -3.211 1.00 0.00 H ATOM 886 N GLY A 115 -15.522 29.597 -0.864 1.00 8.41 N ATOM 887 CA GLY A 115 -15.734 28.864 0.431 1.00 8.64 C ATOM 888 C GLY A 115 -14.534 28.054 0.716 1.00 8.45 C ATOM 889 O GLY A 115 -13.517 28.073 0.003 1.00 8.78 O ATOM 890 H GLY A 115 -14.616 29.485 -1.362 1.00 0.00 H ATOM 891 N PRO A 118 -14.619 27.180 1.735 1.00 7.50 N ATOM 892 CA PRO A 118 -13.483 26.329 2.087 1.00 7.76 C ATOM 893 C PRO A 118 -12.919 25.499 0.927 1.00 7.00 C ATOM 894 O PRO A 118 -11.719 25.280 0.883 1.00 8.17 O ATOM 895 CB PRO A 118 -14.029 25.451 3.198 1.00 8.63 C ATOM 896 CG PRO A 118 -15.131 26.287 3.812 1.00 9.24 C ATOM 897 CD PRO A 118 -15.711 27.083 2.729 1.00 8.01 C ATOM 898 N ALA A 119 -13.793 25.060 0.016 1.00 7.29 N ATOM 899 CA ALA A 119 -13.401 24.247 -1.126 1.00 7.16 C ATOM 900 C ALA A 119 -13.117 24.984 -2.386 1.00 6.94 C ATOM 901 O ALA A 119 -12.758 24.380 -3.381 1.00 7.71 O ATOM 902 CB ALA A 119 -14.424 23.174 -1.360 1.00 7.56 C ATOM 903 H ALA A 119 -14.796 25.310 0.128 1.00 0.00 H ATOM 904 N VAL A 120 -13.361 26.322 -2.416 1.00 6.75 N ATOM 905 CA VAL A 120 -13.223 27.157 -3.647 1.00 6.98 C ATOM 906 C VAL A 120 -12.568 28.460 -3.252 1.00 7.70 C ATOM 907 O VAL A 120 -13.232 29.333 -2.655 1.00 8.37 O ATOM 908 CB VAL A 120 -14.560 27.391 -4.324 1.00 7.16 C ATOM 909 CG1 VAL A 120 -14.321 28.210 -5.582 1.00 7.67 C ATOM 910 CG2 VAL A 120 -15.248 26.103 -4.603 1.00 7.60 C ATOM 911 H VAL A 120 -13.659 26.788 -1.535 1.00 0.00 H ATOM 912 N ARG A 121 -11.266 28.580 -3.496 1.00 8.05 N ATOM 913 CA ARG A 121 -10.522 29.764 -3.006 1.00 9.41 C ATOM 914 C ARG A 121 -9.415 30.013 -4.018 1.00 8.87 C ATOM 915 O ARG A 121 -8.652 29.098 -4.326 1.00 8.59 O ATOM 916 CB ARG A 121 -9.979 29.516 -1.631 1.00 12.29 C ATOM 917 CG ARG A 121 -9.276 30.726 -1.059 1.00 19.16 C ATOM 918 CD ARG A 121 -9.972 31.462 0.020 1.00 30.68 C ATOM 919 NE ARG A 121 -11.055 30.850 0.848 1.00 37.32 N ATOM 920 CZ ARG A 121 -12.263 31.433 1.029 1.00 41.69 C ATOM 921 NH1 ARG A 121 -12.546 32.627 0.456 1.00 46.82 N ATOM 922 NH2 ARG A 121 -13.191 30.877 1.810 1.00 39.35 N ATOM 923 HE ARG A 121 -10.872 29.934 1.306 1.00 0.00 H ATOM 924 HH12 ARG A 121 -13.477 33.066 0.602 1.00 0.00 H ATOM 925 HH11 ARG A 121 -11.832 33.105 -0.130 1.00 0.00 H ATOM 926 HH22 ARG A 121 -14.113 31.343 1.935 1.00 0.00 H ATOM 927 HH21 ARG A 121 -12.993 29.978 2.294 1.00 0.00 H ATOM 928 H ARG A 121 -10.769 27.841 -4.032 1.00 0.00 H ATOM 929 N PRO A 122 -9.163 31.292 -4.375 1.00 9.00 N ATOM 930 CA PRO A 122 -8.005 31.545 -5.190 1.00 8.40 C ATOM 931 C PRO A 122 -6.694 31.305 -4.532 1.00 8.90 C ATOM 932 O PRO A 122 -6.565 31.378 -3.335 1.00 11.60 O ATOM 933 CB PRO A 122 -8.095 33.020 -5.513 1.00 8.88 C ATOM 934 CG PRO A 122 -9.545 33.360 -5.448 1.00 10.86 C ATOM 935 CD PRO A 122 -10.014 32.497 -4.241 1.00 9.77 C ATOM 936 N LEU A 123 -5.697 30.995 -5.326 1.00 8.83 N ATOM 937 CA LEU A 123 -4.329 30.736 -4.846 1.00 9.55 C ATOM 938 C LEU A 123 -3.484 31.931 -5.093 1.00 9.68 C ATOM 939 O LEU A 123 -3.354 32.340 -6.258 1.00 10.76 O ATOM 940 CB LEU A 123 -3.703 29.542 -5.547 1.00 10.19 C ATOM 941 CG LEU A 123 -2.260 29.127 -5.307 1.00 10.40 C ATOM 942 CD1 LEU A 123 -2.007 28.804 -3.871 1.00 12.31 C ATOM 943 CD2 LEU A 123 -1.844 27.917 -6.101 1.00 10.93 C ATOM 944 H LEU A 123 -5.882 30.929 -6.347 1.00 0.00 H ATOM 945 N PRO A 124 -2.838 32.440 -4.029 1.00 11.46 N ATOM 946 CA PRO A 124 -1.857 33.536 -4.311 1.00 10.59 C ATOM 947 C PRO A 124 -0.753 32.993 -5.212 1.00 11.43 C ATOM 948 O PRO A 124 -0.236 31.879 -5.054 1.00 10.71 O ATOM 949 CB PRO A 124 -1.325 33.829 -2.931 1.00 12.28 C ATOM 950 CG PRO A 124 -2.452 33.493 -1.998 1.00 14.78 C ATOM 951 CD PRO A 124 -2.981 32.229 -2.578 1.00 12.78 C ATOM 952 N TRP A 124A -0.349 33.862 -6.119 1.00 10.70 N ATOM 953 CA TRP A 124A 0.688 33.548 -7.091 1.00 10.51 C ATOM 954 C TRP A 124A 1.874 34.479 -6.965 1.00 10.52 C ATOM 955 O TRP A 124A 1.754 35.621 -6.494 1.00 13.52 O ATOM 956 CB TRP A 124A 0.108 33.509 -8.499 1.00 11.31 C ATOM 957 CG TRP A 124A -0.588 34.791 -8.982 1.00 12.27 C ATOM 958 CD1 TRP A 124A -1.906 35.014 -8.872 1.00 12.88 C ATOM 959 CD2 TRP A 124A -0.031 35.946 -9.601 1.00 11.97 C ATOM 960 NE1 TRP A 124A -2.254 36.215 -9.481 1.00 13.00 N ATOM 961 CE2 TRP A 124A -1.098 36.806 -9.880 1.00 11.58 C ATOM 962 CE3 TRP A 124A 1.262 36.346 -9.944 1.00 13.50 C ATOM 963 CZ2 TRP A 124A -0.935 38.047 -10.477 1.00 12.79 C ATOM 964 CZ3 TRP A 124A 1.411 37.575 -10.600 1.00 15.50 C ATOM 965 CH2 TRP A 124A 0.326 38.407 -10.782 1.00 13.16 C ATOM 966 HE1 TRP A 124A -3.216 36.589 -9.607 1.00 0.00 H ATOM 967 H TRP A 124A -0.787 34.805 -6.140 1.00 0.00 H ATOM 968 N GLN A 125 3.032 33.960 -7.246 1.00 9.51 N ATOM 969 CA GLN A 125 4.316 34.633 -6.937 1.00 10.44 C ATOM 970 C GLN A 125 4.493 35.870 -7.799 1.00 11.12 C ATOM 971 O GLN A 125 4.431 35.792 -9.028 1.00 11.18 O ATOM 972 CB GLN A 125 5.415 33.610 -7.235 1.00 11.26 C ATOM 973 CG GLN A 125 6.803 34.164 -6.885 1.00 11.06 C ATOM 974 CD GLN A 125 6.904 34.502 -5.467 1.00 12.11 C ATOM 975 OE1 GLN A 125 6.839 35.676 -5.101 1.00 13.62 O ATOM 976 NE2 GLN A 125 7.145 33.499 -4.604 1.00 14.16 N ATOM 977 HE22 GLN A 125 7.193 32.518 -4.947 1.00 0.00 H ATOM 978 HE21 GLN A 125 7.283 33.704 -3.594 1.00 0.00 H ATOM 979 H GLN A 125 3.059 33.029 -7.709 1.00 0.00 H ATOM 980 N ARG A 126 4.772 36.971 -7.113 1.00 12.80 N ATOM 981 CA ARG A 126 5.081 38.236 -7.843 1.00 14.50 C ATOM 982 C ARG A 126 6.534 38.547 -7.739 1.00 16.54 C ATOM 983 O ARG A 126 6.983 39.429 -8.543 1.00 18.88 O ATOM 984 CB ARG A 126 4.273 39.367 -7.234 1.00 16.53 C ATOM 985 CG ARG A 126 2.817 39.268 -7.477 1.00 17.56 C ATOM 986 CD ARG A 126 2.058 40.444 -6.901 1.00 20.87 C ATOM 987 NE ARG A 126 0.695 40.345 -7.347 1.00 24.24 N ATOM 988 CZ ARG A 126 0.216 40.979 -8.452 1.00 20.61 C ATOM 989 NH1 ARG A 126 1.022 41.737 -9.199 1.00 21.36 N ATOM 990 NH2 ARG A 126 -1.064 40.823 -8.675 1.00 22.33 N ATOM 991 HE ARG A 126 0.039 39.757 -6.795 1.00 0.00 H ATOM 992 HH12 ARG A 126 0.649 42.219 -10.042 1.00 0.00 H ATOM 993 HH11 ARG A 126 2.023 41.846 -8.938 1.00 0.00 H ATOM 994 HH22 ARG A 126 -1.507 41.276 -9.500 1.00 0.00 H ATOM 995 HH21 ARG A 126 -1.638 40.246 -8.027 1.00 0.00 H ATOM 996 H ARG A 126 4.775 36.953 -6.073 1.00 0.00 H ATOM 997 N VAL A 127 7.302 37.937 -6.865 1.00 14.82 N ATOM 998 CA VAL A 127 8.743 38.264 -6.699 1.00 14.43 C ATOM 999 C VAL A 127 9.404 37.395 -7.782 1.00 15.78 C ATOM 1000 O VAL A 127 9.412 36.142 -7.728 1.00 15.16 O ATOM 1001 CB VAL A 127 9.234 38.055 -5.299 1.00 18.01 C ATOM 1002 CG1 VAL A 127 10.764 38.267 -5.238 1.00 19.64 C ATOM 1003 CG2 VAL A 127 8.487 38.954 -4.315 1.00 20.60 C ATOM 1004 H VAL A 127 6.886 37.196 -6.266 1.00 0.00 H ATOM 1005 N ASP A 128 9.988 38.012 -8.798 1.00 15.13 N ATOM 1006 CA ASP A 128 10.595 37.331 -9.868 1.00 14.00 C ATOM 1007 C ASP A 128 11.994 36.805 -9.566 1.00 18.47 C ATOM 1008 O ASP A 128 13.002 37.402 -9.954 1.00 18.11 O ATOM 1009 CB ASP A 128 10.581 38.204 -11.119 1.00 16.41 C ATOM 1010 CG ASP A 128 10.901 37.446 -12.378 1.00 18.11 C ATOM 1011 OD1 ASP A 128 11.139 36.225 -12.379 1.00 17.95 O ATOM 1012 OD2 ASP A 128 10.829 38.021 -13.472 1.00 20.31 O ATOM 1013 H ASP A 128 9.998 39.052 -8.805 1.00 0.00 H ATOM 1014 N ARG A 129 12.040 35.666 -8.870 1.00 16.18 N ATOM 1015 CA ARG A 129 13.241 34.984 -8.493 1.00 18.40 C ATOM 1016 C ARG A 129 13.005 33.472 -8.633 1.00 14.32 C ATOM 1017 O ARG A 129 11.934 33.002 -8.199 1.00 15.96 O ATOM 1018 CB ARG A 129 13.607 35.286 -7.024 1.00 24.26 C ATOM 1019 CG ARG A 129 14.826 36.151 -6.838 1.00 41.63 C ATOM 1020 CD ARG A 129 15.249 36.285 -5.366 1.00 53.22 C ATOM 1021 NE ARG A 129 14.414 37.257 -4.622 1.00 65.56 N ATOM 1022 CZ ARG A 129 14.591 38.588 -4.590 1.00 73.96 C ATOM 1023 NH1 ARG A 129 15.595 39.166 -5.248 1.00 85.58 N ATOM 1024 NH2 ARG A 129 13.761 39.361 -3.877 1.00 78.54 N ATOM 1025 HE ARG A 129 13.618 36.873 -4.074 1.00 0.00 H ATOM 1026 HH12 ARG A 129 15.715 40.198 -5.211 1.00 0.00 H ATOM 1027 HH11 ARG A 129 16.259 38.585 -5.799 1.00 0.00 H ATOM 1028 HH22 ARG A 129 13.901 40.391 -3.854 1.00 0.00 H ATOM 1029 HH21 ARG A 129 12.977 38.931 -3.346 1.00 0.00 H ATOM 1030 H ARG A 129 11.135 35.243 -8.580 1.00 0.00 H ATOM 1031 N ASP A 129A 13.971 32.782 -9.198 1.00 13.50 N ATOM 1032 CA ASP A 129A 13.879 31.359 -9.322 1.00 13.45 C ATOM 1033 C ASP A 129A 13.754 30.660 -7.985 1.00 12.58 C ATOM 1034 O ASP A 129A 14.341 31.005 -6.958 1.00 13.91 O ATOM 1035 CB ASP A 129A 15.090 30.793 -9.999 1.00 14.71 C ATOM 1036 CG ASP A 129A 15.162 31.092 -11.490 1.00 18.94 C ATOM 1037 OD1 ASP A 129A 14.165 31.214 -12.171 1.00 19.31 O ATOM 1038 OD2 ASP A 129A 16.310 31.129 -12.037 1.00 22.12 O ATOM 1039 H ASP A 129A 14.812 33.276 -9.559 1.00 0.00 H ATOM 1040 N VAL A 130 12.952 29.591 -7.997 1.00 12.29 N ATOM 1041 CA VAL A 130 12.942 28.635 -6.892 1.00 11.26 C ATOM 1042 C VAL A 130 14.208 27.878 -6.850 1.00 13.15 C ATOM 1043 O VAL A 130 14.729 27.391 -7.942 1.00 12.69 O ATOM 1044 CB VAL A 130 11.754 27.679 -7.036 1.00 10.79 C ATOM 1045 CG1 VAL A 130 11.755 26.649 -5.957 1.00 11.11 C ATOM 1046 CG2 VAL A 130 10.394 28.399 -7.046 1.00 11.14 C ATOM 1047 H VAL A 130 12.322 29.436 -8.810 1.00 0.00 H ATOM 1048 N ALA A 131 14.791 27.674 -5.668 1.00 12.81 N ATOM 1049 CA ALA A 131 16.068 27.013 -5.581 1.00 12.42 C ATOM 1050 C ALA A 131 16.070 25.598 -6.123 1.00 12.74 C ATOM 1051 O ALA A 131 15.182 24.782 -5.742 1.00 9.98 O ATOM 1052 CB ALA A 131 16.568 26.937 -4.162 1.00 13.64 C ATOM 1053 H ALA A 131 14.318 27.996 -4.799 1.00 0.00 H ATOM 1054 N PRO A 132 16.953 25.214 -6.997 1.00 12.70 N ATOM 1055 CA PRO A 132 17.021 23.858 -7.381 1.00 11.93 C ATOM 1056 C PRO A 132 17.075 22.835 -6.306 1.00 10.49 C ATOM 1057 O PRO A 132 17.773 23.073 -5.251 1.00 12.53 O ATOM 1058 CB PRO A 132 18.252 23.790 -8.361 1.00 14.29 C ATOM 1059 CG PRO A 132 18.230 25.145 -8.945 1.00 17.52 C ATOM 1060 CD PRO A 132 17.757 26.120 -7.874 1.00 16.11 C ATOM 1061 N GLY A 133 16.372 21.709 -6.413 1.00 9.28 N ATOM 1062 CA GLY A 133 16.262 20.700 -5.395 1.00 9.48 C ATOM 1063 C GLY A 133 15.075 20.809 -4.426 1.00 8.85 C ATOM 1064 O GLY A 133 14.662 19.852 -3.850 1.00 10.94 O ATOM 1065 H GLY A 133 15.862 21.547 -7.305 1.00 0.00 H ATOM 1066 N THR A 134 14.481 21.961 -4.459 1.00 8.35 N ATOM 1067 CA THR A 134 13.249 22.205 -3.712 1.00 8.36 C ATOM 1068 C THR A 134 12.148 21.282 -4.222 1.00 8.14 C ATOM 1069 O THR A 134 11.909 21.232 -5.444 1.00 8.71 O ATOM 1070 CB THR A 134 12.746 23.636 -3.905 1.00 7.85 C ATOM 1071 OG1 THR A 134 13.746 24.593 -3.466 1.00 9.36 O ATOM 1072 CG2 THR A 134 11.468 23.978 -3.216 1.00 8.29 C ATOM 1073 HG1 THR A 134 14.574 24.469 -3.995 1.00 0.00 H ATOM 1074 H THR A 134 14.890 22.728 -5.030 1.00 0.00 H ATOM 1075 N LEU A 135 11.368 20.672 -3.338 1.00 6.88 N ATOM 1076 CA LEU A 135 10.191 19.916 -3.794 1.00 6.97 C ATOM 1077 C LEU A 135 8.981 20.824 -3.809 1.00 6.88 C ATOM 1078 O LEU A 135 8.616 21.436 -2.796 1.00 7.74 O ATOM 1079 CB LEU A 135 9.903 18.708 -2.868 1.00 7.63 C ATOM 1080 CG LEU A 135 10.953 17.578 -2.862 1.00 10.72 C ATOM 1081 CD1 LEU A 135 10.386 16.368 -2.180 1.00 10.75 C ATOM 1082 CD2 LEU A 135 11.393 17.194 -4.199 1.00 15.59 C ATOM 1083 H LEU A 135 11.589 20.728 -2.323 1.00 0.00 H ATOM 1084 N CYS A 136 8.320 20.824 -4.965 1.00 6.93 N ATOM 1085 CA CYS A 136 7.084 21.554 -5.160 1.00 6.76 C ATOM 1086 C CYS A 136 5.976 20.555 -5.523 1.00 6.21 C ATOM 1087 O CYS A 136 6.234 19.419 -5.942 1.00 7.51 O ATOM 1088 CB CYS A 136 7.219 22.536 -6.256 1.00 6.83 C ATOM 1089 SG CYS A 136 8.559 23.767 -5.922 1.00 9.15 S ATOM 1090 H CYS A 136 8.707 20.277 -5.761 1.00 0.00 H ATOM 1091 N ASP A 137 4.715 20.955 -5.302 1.00 5.66 N ATOM 1092 CA ASP A 137 3.563 20.117 -5.392 1.00 6.33 C ATOM 1093 C ASP A 137 2.819 20.392 -6.680 1.00 6.52 C ATOM 1094 O ASP A 137 2.397 21.542 -6.940 1.00 7.96 O ATOM 1095 CB ASP A 137 2.672 20.356 -4.203 1.00 7.04 C ATOM 1096 CG ASP A 137 1.630 19.315 -3.938 1.00 7.71 C ATOM 1097 OD1 ASP A 137 1.648 18.253 -4.526 1.00 9.83 O ATOM 1098 OD2 ASP A 137 0.789 19.547 -3.036 1.00 9.24 O ATOM 1099 H ASP A 137 4.565 21.952 -5.046 1.00 0.00 H ATOM 1100 N VAL A 138 2.620 19.386 -7.509 1.00 6.73 N ATOM 1101 CA VAL A 138 1.829 19.518 -8.747 1.00 7.84 C ATOM 1102 C VAL A 138 0.653 18.570 -8.763 1.00 7.01 C ATOM 1103 O VAL A 138 0.767 17.333 -8.480 1.00 6.49 O ATOM 1104 CB VAL A 138 2.663 19.292 -10.007 1.00 9.61 C ATOM 1105 CG1 VAL A 138 3.342 17.987 -9.950 1.00 12.89 C ATOM 1106 CG2 VAL A 138 1.793 19.478 -11.273 1.00 10.36 C ATOM 1107 H VAL A 138 3.038 18.461 -7.281 1.00 0.00 H ATOM 1108 N ALA A 139 -0.522 19.149 -9.047 1.00 6.60 N ATOM 1109 CA ALA A 139 -1.777 18.378 -8.926 1.00 7.39 C ATOM 1110 C ALA A 139 -2.527 18.381 -10.255 1.00 6.35 C ATOM 1111 O ALA A 139 -2.392 19.309 -11.066 1.00 7.17 O ATOM 1112 CB ALA A 139 -2.670 18.964 -7.830 1.00 7.56 C ATOM 1113 H ALA A 139 -0.551 20.143 -9.353 1.00 0.00 H ATOM 1114 N GLY A 140 -3.320 17.352 -10.458 1.00 6.08 N ATOM 1115 CA GLY A 140 -4.156 17.272 -11.663 1.00 6.35 C ATOM 1116 C GLY A 140 -4.946 15.991 -11.813 1.00 5.86 C ATOM 1117 O GLY A 140 -4.750 15.019 -11.060 1.00 7.07 O ATOM 1118 H GLY A 140 -3.356 16.585 -9.756 1.00 0.00 H ATOM 1119 N TRP A 141 -5.822 15.995 -12.809 1.00 6.14 N ATOM 1120 CA TRP A 141 -6.617 14.891 -13.216 1.00 6.91 C ATOM 1121 C TRP A 141 -6.084 14.286 -14.510 1.00 7.03 C ATOM 1122 O TRP A 141 -6.816 13.579 -15.247 1.00 8.87 O ATOM 1123 CB TRP A 141 -8.077 15.278 -13.387 1.00 7.12 C ATOM 1124 CG TRP A 141 -8.848 15.630 -12.113 1.00 6.52 C ATOM 1125 CD1 TRP A 141 -9.558 14.782 -11.371 1.00 7.20 C ATOM 1126 CD2 TRP A 141 -9.072 16.943 -11.595 1.00 6.67 C ATOM 1127 NE1 TRP A 141 -10.217 15.449 -10.356 1.00 7.70 N ATOM 1128 CE2 TRP A 141 -9.920 16.789 -10.458 1.00 7.46 C ATOM 1129 CE3 TRP A 141 -8.620 18.209 -11.906 1.00 7.27 C ATOM 1130 CZ2 TRP A 141 -10.354 17.922 -9.712 1.00 7.15 C ATOM 1131 CZ3 TRP A 141 -9.063 19.266 -11.163 1.00 8.26 C ATOM 1132 CH2 TRP A 141 -9.888 19.101 -10.100 1.00 7.38 C ATOM 1133 HE1 TRP A 141 -10.831 15.014 -9.639 1.00 0.00 H ATOM 1134 H TRP A 141 -5.936 16.883 -13.337 1.00 0.00 H ATOM 1135 N GLY A 142 -4.823 14.545 -14.847 1.00 7.44 N ATOM 1136 CA GLY A 142 -4.217 13.889 -15.992 1.00 7.78 C ATOM 1137 C GLY A 142 -3.999 12.455 -15.828 1.00 7.47 C ATOM 1138 O GLY A 142 -4.228 11.804 -14.805 1.00 7.82 O ATOM 1139 H GLY A 142 -4.267 15.222 -14.286 1.00 0.00 H ATOM 1140 N ILE A 143 -3.494 11.873 -16.944 1.00 8.31 N ATOM 1141 CA ILE A 143 -3.274 10.456 -16.923 1.00 9.08 C ATOM 1142 C ILE A 143 -2.332 9.989 -15.876 1.00 8.63 C ATOM 1143 O ILE A 143 -1.386 10.714 -15.499 1.00 8.95 O ATOM 1144 CB ILE A 143 -2.894 9.888 -18.322 1.00 9.36 C ATOM 1145 CG1 ILE A 143 -1.506 10.343 -18.739 1.00 8.96 C ATOM 1146 CG2 ILE A 143 -3.968 10.256 -19.347 1.00 9.27 C ATOM 1147 CD1 ILE A 143 -1.070 9.751 -20.104 1.00 10.73 C ATOM 1148 H ILE A 143 -3.273 12.437 -17.789 1.00 0.00 H ATOM 1149 N VAL A 144 -2.517 8.783 -15.372 1.00 7.99 N ATOM 1150 CA VAL A 144 -1.801 8.245 -14.275 1.00 8.50 C ATOM 1151 C VAL A 144 -0.809 7.112 -14.630 1.00 10.70 C ATOM 1152 O VAL A 144 -0.143 6.548 -13.738 1.00 11.50 O ATOM 1153 CB VAL A 144 -2.638 7.837 -13.084 1.00 9.81 C ATOM 1154 CG1 VAL A 144 -3.368 9.037 -12.438 1.00 10.74 C ATOM 1155 CG2 VAL A 144 -3.638 6.727 -13.457 1.00 10.54 C ATOM 1156 H VAL A 144 -3.243 8.183 -15.814 1.00 0.00 H ATOM 1157 N ASN A 145 -0.813 6.733 -15.918 1.00 9.60 N ATOM 1158 CA ASN A 145 0.180 5.697 -16.341 1.00 9.74 C ATOM 1159 C ASN A 145 0.372 5.856 -17.864 1.00 8.76 C ATOM 1160 O ASN A 145 -0.263 6.645 -18.533 1.00 9.20 O ATOM 1161 CB ASN A 145 -0.211 4.301 -15.900 1.00 8.56 C ATOM 1162 CG ASN A 145 -1.475 3.778 -16.559 1.00 8.93 C ATOM 1163 OD1 ASN A 145 -1.835 4.153 -17.644 1.00 10.12 O ATOM 1164 ND2 ASN A 145 -2.173 2.909 -15.800 1.00 11.14 N ATOM 1165 HD22 ASN A 145 -1.809 2.623 -14.869 1.00 0.00 H ATOM 1166 HD21 ASN A 145 -3.076 2.525 -16.146 1.00 0.00 H ATOM 1167 H ASN A 145 -1.483 7.145 -16.598 1.00 0.00 H ATOM 1168 N HIS A 146 1.358 5.053 -18.383 1.00 10.13 N ATOM 1169 CA HIS A 146 1.705 5.176 -19.776 1.00 11.46 C ATOM 1170 C HIS A 146 0.610 4.618 -20.685 1.00 11.96 C ATOM 1171 O HIS A 146 0.631 4.859 -21.913 1.00 12.74 O ATOM 1172 CB HIS A 146 2.938 4.425 -20.093 1.00 14.26 C ATOM 1173 CG HIS A 146 4.193 5.086 -19.716 1.00 16.40 C ATOM 1174 ND1 HIS A 146 4.447 5.448 -18.447 1.00 17.25 N ATOM 1175 CD2 HIS A 146 5.306 5.371 -20.433 1.00 20.06 C ATOM 1176 CE1 HIS A 146 5.690 5.940 -18.355 1.00 19.42 C ATOM 1177 NE2 HIS A 146 6.213 5.924 -19.563 1.00 19.71 N ATOM 1178 H HIS A 146 1.848 4.364 -17.778 1.00 0.00 H ATOM 1179 N ALA A 147 -0.304 3.845 -20.133 1.00 11.27 N ATOM 1180 CA ALA A 147 -1.411 3.354 -20.880 1.00 10.04 C ATOM 1181 C ALA A 147 -2.461 4.321 -21.185 1.00 10.53 C ATOM 1182 O ALA A 147 -3.481 4.156 -21.827 1.00 13.17 O ATOM 1183 CB ALA A 147 -1.919 2.114 -20.277 1.00 10.33 C ATOM 1184 H ALA A 147 -0.214 3.588 -19.129 1.00 0.00 H ATOM 1185 N GLY A 149 -2.389 5.564 -20.455 1.00 10.00 N ATOM 1186 CA GLY A 149 -3.394 6.585 -20.590 1.00 9.61 C ATOM 1187 C GLY A 149 -4.602 6.498 -19.645 1.00 9.93 C ATOM 1188 O GLY A 149 -5.582 7.188 -19.884 1.00 11.21 O ATOM 1189 H GLY A 149 -1.587 5.727 -19.813 1.00 0.00 H ATOM 1190 N ARG A 150 -4.502 5.703 -18.611 1.00 9.52 N ATOM 1191 CA ARG A 150 -5.645 5.571 -17.684 1.00 10.21 C ATOM 1192 C ARG A 150 -5.901 6.941 -17.018 1.00 10.55 C ATOM 1193 O ARG A 150 -4.922 7.597 -16.535 1.00 10.49 O ATOM 1194 CB ARG A 150 -5.396 4.517 -16.708 1.00 11.73 C ATOM 1195 CG ARG A 150 -6.631 4.352 -15.789 1.00 13.90 C ATOM 1196 CD ARG A 150 -6.574 3.025 -15.056 1.00 14.66 C ATOM 1197 NE ARG A 150 -5.467 2.826 -14.265 1.00 15.73 N ATOM 1198 CZ ARG A 150 -5.261 3.294 -13.084 1.00 17.81 C ATOM 1199 NH1 ARG A 150 -6.171 4.118 -12.548 1.00 17.33 N ATOM 1200 NH2 ARG A 150 -4.180 3.024 -12.432 1.00 22.06 N ATOM 1201 HE ARG A 150 -4.713 2.232 -14.665 1.00 0.00 H ATOM 1202 HH12 ARG A 150 -6.023 4.507 -11.595 1.00 0.00 H ATOM 1203 HH11 ARG A 150 -7.026 4.369 -13.085 1.00 0.00 H ATOM 1204 HH22 ARG A 150 -4.037 3.414 -11.479 1.00 0.00 H ATOM 1205 HH21 ARG A 150 -3.453 2.416 -12.860 1.00 0.00 H ATOM 1206 H ARG A 150 -3.626 5.169 -18.443 1.00 0.00 H ATOM 1207 N ARG A 151 -7.156 7.353 -16.961 1.00 11.46 N ATOM 1208 CA ARG A 151 -7.589 8.638 -16.437 1.00 12.41 C ATOM 1209 C ARG A 151 -8.128 8.380 -15.027 1.00 12.45 C ATOM 1210 O ARG A 151 -8.951 7.494 -14.808 1.00 14.02 O ATOM 1211 CB ARG A 151 -8.605 9.309 -17.335 1.00 14.72 C ATOM 1212 CG ARG A 151 -8.111 9.686 -18.731 1.00 15.98 C ATOM 1213 CD ARG A 151 -9.149 10.127 -19.724 1.00 21.71 C ATOM 1214 NE ARG A 151 -9.943 8.985 -20.095 1.00 38.07 N ATOM 1215 CZ ARG A 151 -11.251 8.775 -19.832 1.00 54.94 C ATOM 1216 NH1 ARG A 151 -12.024 9.669 -19.166 1.00 63.65 N ATOM 1217 NH2 ARG A 151 -11.796 7.622 -20.233 1.00 55.11 N ATOM 1218 HE ARG A 151 -9.454 8.236 -20.626 1.00 0.00 H ATOM 1219 HH12 ARG A 151 -13.027 9.459 -18.989 1.00 0.00 H ATOM 1220 HH11 ARG A 151 -11.614 10.564 -18.832 1.00 0.00 H ATOM 1221 HH22 ARG A 151 -12.801 7.429 -20.046 1.00 0.00 H ATOM 1222 HH21 ARG A 151 -11.215 6.918 -20.732 1.00 0.00 H ATOM 1223 H ARG A 151 -7.890 6.708 -17.318 1.00 0.00 H ATOM 1224 N PRO A 152 -7.771 9.200 -14.015 1.00 10.54 N ATOM 1225 CA PRO A 152 -8.270 9.054 -12.695 1.00 10.65 C ATOM 1226 C PRO A 152 -9.587 9.771 -12.510 1.00 9.88 C ATOM 1227 O PRO A 152 -9.742 10.848 -13.082 1.00 11.46 O ATOM 1228 CB PRO A 152 -7.185 9.751 -11.863 1.00 9.09 C ATOM 1229 CG PRO A 152 -6.671 10.832 -12.713 1.00 8.78 C ATOM 1230 CD PRO A 152 -6.748 10.258 -14.150 1.00 9.78 C ATOM 1231 N ASP A 153 -10.458 9.245 -11.701 1.00 9.65 N ATOM 1232 CA ASP A 153 -11.673 9.960 -11.351 1.00 9.67 C ATOM 1233 C ASP A 153 -11.401 11.100 -10.330 1.00 9.61 C ATOM 1234 O ASP A 153 -12.076 12.142 -10.402 1.00 9.90 O ATOM 1235 CB ASP A 153 -12.679 8.987 -10.756 1.00 10.35 C ATOM 1236 CG ASP A 153 -14.013 9.708 -10.290 1.00 10.71 C ATOM 1237 OD1 ASP A 153 -14.687 10.199 -11.229 1.00 12.56 O ATOM 1238 OD2 ASP A 153 -14.236 9.684 -9.057 1.00 12.09 O ATOM 1239 H ASP A 153 -10.283 8.302 -11.300 1.00 0.00 H ATOM 1240 N SER A 154 -10.457 10.899 -9.438 1.00 9.12 N ATOM 1241 CA SER A 154 -10.194 11.902 -8.401 1.00 9.00 C ATOM 1242 C SER A 154 -8.848 12.545 -8.557 1.00 8.91 C ATOM 1243 O SER A 154 -7.912 12.040 -9.201 1.00 8.19 O ATOM 1244 CB SER A 154 -10.259 11.294 -7.088 1.00 10.06 C ATOM 1245 OG SER A 154 -9.281 10.305 -7.013 1.00 11.49 O ATOM 1246 HG SER A 154 -9.448 9.623 -7.711 1.00 0.00 H ATOM 1247 H SER A 154 -9.894 10.025 -9.468 1.00 0.00 H ATOM 1248 N LEU A 155 -8.740 13.752 -7.993 1.00 7.42 N ATOM 1249 CA LEU A 155 -7.525 14.532 -8.149 1.00 6.36 C ATOM 1250 C LEU A 155 -6.331 13.816 -7.523 1.00 5.77 C ATOM 1251 O LEU A 155 -6.420 13.281 -6.417 1.00 6.23 O ATOM 1252 CB LEU A 155 -7.727 15.843 -7.358 1.00 6.19 C ATOM 1253 CG LEU A 155 -6.644 16.908 -7.451 1.00 6.58 C ATOM 1254 CD1 LEU A 155 -6.521 17.454 -8.887 1.00 6.69 C ATOM 1255 CD2 LEU A 155 -6.864 18.044 -6.460 1.00 6.64 C ATOM 1256 H LEU A 155 -9.532 14.135 -7.438 1.00 0.00 H ATOM 1257 N GLN A 156 -5.208 13.838 -8.253 1.00 5.82 N ATOM 1258 CA GLN A 156 -3.959 13.312 -7.824 1.00 6.33 C ATOM 1259 C GLN A 156 -2.941 14.400 -7.649 1.00 6.32 C ATOM 1260 O GLN A 156 -3.088 15.515 -8.147 1.00 6.44 O ATOM 1261 CB GLN A 156 -3.401 12.294 -8.812 1.00 6.95 C ATOM 1262 CG GLN A 156 -4.405 11.209 -9.246 1.00 7.54 C ATOM 1263 CD GLN A 156 -4.851 10.247 -8.187 1.00 7.84 C ATOM 1264 OE1 GLN A 156 -3.966 9.640 -7.509 1.00 11.98 O ATOM 1265 NE2 GLN A 156 -6.135 10.153 -7.944 1.00 8.88 N ATOM 1266 HE22 GLN A 156 -6.815 10.674 -8.533 1.00 0.00 H ATOM 1267 HE21 GLN A 156 -6.474 9.558 -7.162 1.00 0.00 H ATOM 1268 H GLN A 156 -5.253 14.269 -9.198 1.00 0.00 H ATOM 1269 N HIS A 157 -1.847 14.124 -6.940 1.00 7.00 N ATOM 1270 CA HIS A 157 -0.757 15.088 -6.880 1.00 6.45 C ATOM 1271 C HIS A 157 0.561 14.360 -6.646 1.00 7.02 C ATOM 1272 O HIS A 157 0.553 13.158 -6.305 1.00 7.65 O ATOM 1273 CB HIS A 157 -1.017 16.150 -5.754 1.00 6.84 C ATOM 1274 CG HIS A 157 -0.711 15.662 -4.385 1.00 6.87 C ATOM 1275 ND1 HIS A 157 0.368 16.146 -3.685 1.00 7.62 N ATOM 1276 CD2 HIS A 157 -1.325 14.751 -3.627 1.00 7.22 C ATOM 1277 CE1 HIS A 157 0.387 15.475 -2.519 1.00 8.11 C ATOM 1278 NE2 HIS A 157 -0.660 14.662 -2.434 1.00 8.18 N ATOM 1279 H HIS A 157 -1.772 13.221 -6.430 1.00 0.00 H ATOM 1280 N VAL A 158 1.642 15.099 -6.814 1.00 6.22 N ATOM 1281 CA VAL A 158 2.977 14.575 -6.651 1.00 6.19 C ATOM 1282 C VAL A 158 3.912 15.669 -6.256 1.00 6.27 C ATOM 1283 O VAL A 158 3.792 16.792 -6.796 1.00 6.68 O ATOM 1284 CB VAL A 158 3.455 13.806 -7.887 1.00 6.83 C ATOM 1285 CG1 VAL A 158 3.688 14.709 -9.068 1.00 6.82 C ATOM 1286 CG2 VAL A 158 4.598 12.934 -7.616 1.00 7.42 C ATOM 1287 H VAL A 158 1.527 16.099 -7.074 1.00 0.00 H ATOM 1288 N LEU A 159 4.942 15.381 -5.498 1.00 6.27 N ATOM 1289 CA LEU A 159 6.025 16.306 -5.171 1.00 7.19 C ATOM 1290 C LEU A 159 7.167 16.006 -6.105 1.00 7.42 C ATOM 1291 O LEU A 159 7.605 14.866 -6.271 1.00 8.12 O ATOM 1292 CB LEU A 159 6.500 16.153 -3.757 1.00 7.72 C ATOM 1293 CG LEU A 159 5.540 16.412 -2.707 1.00 10.74 C ATOM 1294 CD1 LEU A 159 6.140 16.373 -1.307 1.00 11.69 C ATOM 1295 CD2 LEU A 159 4.709 17.617 -2.831 1.00 12.65 C ATOM 1296 H LEU A 159 4.992 14.422 -5.099 1.00 0.00 H ATOM 1297 N LEU A 160 7.661 17.028 -6.746 1.00 6.54 N ATOM 1298 CA LEU A 160 8.746 16.990 -7.714 1.00 7.30 C ATOM 1299 C LEU A 160 9.836 17.997 -7.389 1.00 7.35 C ATOM 1300 O LEU A 160 9.554 19.115 -7.051 1.00 7.27 O ATOM 1301 CB LEU A 160 8.225 17.358 -9.095 1.00 8.08 C ATOM 1302 CG LEU A 160 7.104 16.509 -9.616 1.00 8.12 C ATOM 1303 CD1 LEU A 160 6.573 17.062 -10.931 1.00 10.59 C ATOM 1304 CD2 LEU A 160 7.422 15.025 -9.820 1.00 7.85 C ATOM 1305 H LEU A 160 7.240 17.958 -6.547 1.00 0.00 H ATOM 1306 N PRO A 161 11.128 17.639 -7.574 1.00 7.92 N ATOM 1307 CA PRO A 161 12.207 18.539 -7.315 1.00 8.00 C ATOM 1308 C PRO A 161 12.453 19.480 -8.512 1.00 9.09 C ATOM 1309 O PRO A 161 12.571 19.021 -9.671 1.00 8.59 O ATOM 1310 CB PRO A 161 13.435 17.597 -7.111 1.00 8.92 C ATOM 1311 CG PRO A 161 13.041 16.318 -7.706 1.00 11.93 C ATOM 1312 CD PRO A 161 11.589 16.273 -7.979 1.00 9.92 C ATOM 1313 N VAL A 162 12.687 20.754 -8.198 1.00 8.39 N ATOM 1314 CA VAL A 162 13.053 21.767 -9.167 1.00 7.75 C ATOM 1315 C VAL A 162 14.403 21.343 -9.717 1.00 8.37 C ATOM 1316 O VAL A 162 15.321 21.010 -8.945 1.00 8.60 O ATOM 1317 CB VAL A 162 13.037 23.121 -8.585 1.00 8.97 C ATOM 1318 CG1 VAL A 162 13.620 24.128 -9.603 1.00 9.49 C ATOM 1319 CG2 VAL A 162 11.605 23.487 -8.206 1.00 9.34 C ATOM 1320 H VAL A 162 12.602 21.037 -7.201 1.00 0.00 H ATOM 1321 N LEU A 163 14.585 21.401 -10.989 1.00 7.49 N ATOM 1322 CA LEU A 163 15.877 21.135 -11.725 1.00 8.19 C ATOM 1323 C LEU A 163 16.426 22.426 -12.193 1.00 8.86 C ATOM 1324 O LEU A 163 15.741 23.245 -12.860 1.00 10.21 O ATOM 1325 CB LEU A 163 15.579 20.228 -12.919 1.00 9.01 C ATOM 1326 CG LEU A 163 16.790 19.782 -13.738 1.00 9.74 C ATOM 1327 CD1 LEU A 163 17.688 18.976 -12.853 1.00 10.22 C ATOM 1328 CD2 LEU A 163 16.327 19.019 -14.967 1.00 10.87 C ATOM 1329 H LEU A 163 13.760 21.657 -11.569 1.00 0.00 H ATOM 1330 N ASP A 164 17.722 22.608 -11.946 1.00 9.72 N ATOM 1331 CA ASP A 164 18.379 23.850 -12.382 1.00 9.99 C ATOM 1332 C ASP A 164 18.374 24.036 -13.889 1.00 10.01 C ATOM 1333 O ASP A 164 18.441 23.068 -14.676 1.00 9.93 O ATOM 1334 CB ASP A 164 19.831 23.853 -11.956 1.00 11.39 C ATOM 1335 CG ASP A 164 20.609 22.652 -12.406 1.00 15.77 C ATOM 1336 OD1 ASP A 164 20.299 21.528 -12.025 1.00 16.68 O ATOM 1337 OD2 ASP A 164 21.609 22.780 -13.153 1.00 17.70 O ATOM 1338 H ASP A 164 18.267 21.876 -11.447 1.00 0.00 H ATOM 1339 N ARG A 165 18.180 25.302 -14.305 1.00 10.86 N ATOM 1340 CA ARG A 165 18.063 25.617 -15.689 1.00 10.59 C ATOM 1341 C ARG A 165 19.226 25.208 -16.563 1.00 10.70 C ATOM 1342 O ARG A 165 19.080 24.720 -17.699 1.00 14.03 O ATOM 1343 CB ARG A 165 17.683 27.101 -15.821 1.00 13.15 C ATOM 1344 CG ARG A 165 17.317 27.518 -17.186 1.00 15.54 C ATOM 1345 CD ARG A 165 16.791 28.996 -17.270 1.00 16.01 C ATOM 1346 NE ARG A 165 15.611 29.295 -16.514 1.00 15.15 N ATOM 1347 CZ ARG A 165 15.534 29.835 -15.327 1.00 13.92 C ATOM 1348 NH1 ARG A 165 16.570 30.190 -14.629 1.00 13.44 N ATOM 1349 NH2 ARG A 165 14.317 29.984 -14.767 1.00 14.87 N ATOM 1350 HE ARG A 165 14.706 29.053 -16.965 1.00 0.00 H ATOM 1351 HH12 ARG A 165 16.442 30.615 -13.689 1.00 0.00 H ATOM 1352 HH11 ARG A 165 17.527 30.049 -15.010 1.00 0.00 H ATOM 1353 HH22 ARG A 165 14.228 30.411 -13.823 1.00 0.00 H ATOM 1354 HH21 ARG A 165 13.467 29.672 -15.279 1.00 0.00 H ATOM 1355 H ARG A 165 18.114 26.065 -13.601 1.00 0.00 H ATOM 1356 N ALA A 166 20.430 25.385 -16.002 1.00 10.22 N ATOM 1357 CA ALA A 166 21.694 24.976 -16.765 1.00 11.34 C ATOM 1358 C ALA A 166 21.731 23.530 -17.117 1.00 10.67 C ATOM 1359 O ALA A 166 22.043 23.171 -18.247 1.00 14.25 O ATOM 1360 CB ALA A 166 22.926 25.371 -15.943 1.00 11.49 C ATOM 1361 H ALA A 166 20.506 25.799 -15.051 1.00 0.00 H ATOM 1362 N THR A 167 21.262 22.669 -16.227 1.00 10.82 N ATOM 1363 CA THR A 167 21.091 21.267 -16.521 1.00 10.66 C ATOM 1364 C THR A 167 19.980 21.004 -17.527 1.00 11.25 C ATOM 1365 O THR A 167 20.122 20.323 -18.546 1.00 11.94 O ATOM 1366 CB THR A 167 20.897 20.469 -15.254 1.00 11.52 C ATOM 1367 OG1 THR A 167 22.086 20.610 -14.467 1.00 13.20 O ATOM 1368 CG2 THR A 167 20.711 19.012 -15.587 1.00 11.78 C ATOM 1369 HG1 THR A 167 22.228 21.566 -14.255 1.00 0.00 H ATOM 1370 H THR A 167 21.007 23.017 -15.280 1.00 0.00 H ATOM 1371 N CYS A 168 18.798 21.605 -17.257 1.00 11.18 N ATOM 1372 CA CYS A 168 17.653 21.419 -18.116 1.00 11.53 C ATOM 1373 C CYS A 168 17.845 21.827 -19.576 1.00 11.18 C ATOM 1374 O CYS A 168 17.222 21.212 -20.465 1.00 12.65 O ATOM 1375 CB CYS A 168 16.474 22.152 -17.494 1.00 12.30 C ATOM 1376 SG CYS A 168 14.906 21.520 -18.036 1.00 12.41 S ATOM 1377 H CYS A 168 18.713 22.211 -16.416 1.00 0.00 H ATOM 1378 N ASN A 169 18.751 22.813 -19.762 1.00 12.06 N ATOM 1379 CA ASN A 169 19.022 23.330 -21.109 1.00 12.89 C ATOM 1380 C ASN A 169 20.079 22.515 -21.866 1.00 16.28 C ATOM 1381 O ASN A 169 20.338 22.827 -23.025 1.00 16.67 O ATOM 1382 CB ASN A 169 19.434 24.762 -21.042 1.00 14.41 C ATOM 1383 CG ASN A 169 18.297 25.682 -21.188 1.00 12.16 C ATOM 1384 OD1 ASN A 169 17.368 25.350 -21.924 1.00 14.81 O ATOM 1385 ND2 ASN A 169 18.374 26.863 -20.564 1.00 14.97 N ATOM 1386 HD22 ASN A 169 19.190 27.077 -19.955 1.00 0.00 H ATOM 1387 HD21 ASN A 169 17.618 27.567 -20.688 1.00 0.00 H ATOM 1388 H ASN A 169 19.259 23.208 -18.945 1.00 0.00 H ATOM 1389 N ARG A 170 20.611 21.461 -21.276 1.00 15.20 N ATOM 1390 CA ARG A 170 21.618 20.684 -21.994 1.00 14.51 C ATOM 1391 C ARG A 170 21.008 20.012 -23.172 1.00 16.80 C ATOM 1392 O ARG A 170 19.784 19.745 -23.240 1.00 15.24 O ATOM 1393 CB ARG A 170 22.306 19.719 -21.100 1.00 13.06 C ATOM 1394 CG ARG A 170 23.231 20.399 -20.141 1.00 12.66 C ATOM 1395 CD ARG A 170 23.987 19.357 -19.388 1.00 13.29 C ATOM 1396 NE ARG A 170 25.290 19.780 -19.019 1.00 13.21 N ATOM 1397 CZ ARG A 170 26.052 19.164 -18.130 1.00 15.78 C ATOM 1398 NH1 ARG A 170 25.660 18.075 -17.514 1.00 22.12 N ATOM 1399 NH2 ARG A 170 27.253 19.639 -17.975 1.00 17.05 N ATOM 1400 HE ARG A 170 25.672 20.631 -19.478 1.00 0.00 H ATOM 1401 HH12 ARG A 170 26.285 17.616 -16.821 1.00 0.00 H ATOM 1402 HH11 ARG A 170 24.724 17.670 -17.719 1.00 0.00 H ATOM 1403 HH22 ARG A 170 27.902 19.199 -17.291 1.00 0.00 H ATOM 1404 HH21 ARG A 170 27.564 20.458 -18.535 1.00 0.00 H ATOM 1405 H ARG A 170 20.318 21.188 -20.316 1.00 0.00 H ATOM 1406 N ARG A 170A 21.860 19.740 -24.171 1.00 16.25 N ATOM 1407 CA ARG A 170A 21.393 19.153 -25.422 1.00 17.88 C ATOM 1408 C ARG A 170A 20.633 17.866 -25.210 1.00 17.40 C ATOM 1409 O ARG A 170A 19.643 17.689 -25.900 1.00 20.79 O ATOM 1410 CB ARG A 170A 22.661 18.958 -26.349 1.00 21.69 C ATOM 1411 H ARG A 170A 22.871 19.951 -24.052 1.00 0.00 H ATOM 1412 N THR A 170B 21.031 17.013 -24.275 1.00 18.38 N ATOM 1413 CA THR A 170B 20.341 15.807 -24.054 1.00 20.50 C ATOM 1414 C THR A 170B 18.890 16.026 -23.495 1.00 20.44 C ATOM 1415 O THR A 170B 18.068 15.132 -23.580 1.00 20.39 O ATOM 1416 CB THR A 170B 21.189 14.970 -23.101 1.00 23.84 C ATOM 1417 OG1 THR A 170B 20.640 13.676 -23.093 1.00 32.06 O ATOM 1418 CG2 THR A 170B 21.402 15.544 -21.737 1.00 24.67 C ATOM 1419 HG1 THR A 170B 19.701 13.719 -22.782 1.00 0.00 H ATOM 1420 H THR A 170B 21.865 17.239 -23.697 1.00 0.00 H ATOM 1421 N HIS A 171 18.701 17.168 -22.859 1.00 16.12 N ATOM 1422 CA HIS A 171 17.395 17.493 -22.227 1.00 14.15 C ATOM 1423 C HIS A 171 16.653 18.413 -23.146 1.00 13.66 C ATOM 1424 O HIS A 171 16.191 17.951 -24.190 1.00 16.64 O ATOM 1425 CB HIS A 171 17.657 18.061 -20.797 1.00 13.62 C ATOM 1426 CG HIS A 171 18.254 17.077 -19.887 1.00 15.55 C ATOM 1427 ND1 HIS A 171 19.281 17.310 -18.992 1.00 24.06 N ATOM 1428 CD2 HIS A 171 17.950 15.772 -19.764 1.00 17.63 C ATOM 1429 CE1 HIS A 171 19.605 16.165 -18.378 1.00 21.97 C ATOM 1430 NE2 HIS A 171 18.784 15.226 -18.803 1.00 24.72 N ATOM 1431 H HIS A 171 19.481 17.853 -22.799 1.00 0.00 H ATOM 1432 N HIS A 172 16.471 19.677 -22.809 1.00 12.20 N ATOM 1433 CA HIS A 172 15.665 20.594 -23.644 1.00 12.84 C ATOM 1434 C HIS A 172 16.398 21.584 -24.538 1.00 13.84 C ATOM 1435 O HIS A 172 15.801 22.458 -25.125 1.00 14.49 O ATOM 1436 CB HIS A 172 14.617 21.325 -22.780 1.00 12.08 C ATOM 1437 CG HIS A 172 13.569 20.390 -22.253 1.00 12.23 C ATOM 1438 ND1 HIS A 172 12.789 19.603 -23.068 1.00 14.68 N ATOM 1439 CD2 HIS A 172 13.264 20.037 -20.973 1.00 11.35 C ATOM 1440 CE1 HIS A 172 11.958 18.896 -22.309 1.00 13.93 C ATOM 1441 NE2 HIS A 172 12.256 19.098 -21.029 1.00 12.14 N ATOM 1442 H HIS A 172 16.905 20.036 -21.935 1.00 0.00 H ATOM 1443 N ASP A 173 17.731 21.419 -24.573 1.00 14.78 N ATOM 1444 CA ASP A 173 18.575 22.010 -25.661 1.00 15.94 C ATOM 1445 C ASP A 173 18.356 23.462 -25.881 1.00 16.41 C ATOM 1446 O ASP A 173 17.944 23.881 -26.982 1.00 19.87 O ATOM 1447 CB ASP A 173 18.403 21.172 -26.959 1.00 17.30 C ATOM 1448 CG ASP A 173 19.465 21.520 -28.049 1.00 22.61 C ATOM 1449 OD1 ASP A 173 20.498 22.011 -27.662 1.00 23.15 O ATOM 1450 OD2 ASP A 173 19.122 21.308 -29.255 1.00 28.27 O ATOM 1451 H ASP A 173 18.191 20.865 -23.823 1.00 0.00 H ATOM 1452 N GLY A 174 18.487 24.254 -24.811 1.00 15.83 N ATOM 1453 CA GLY A 174 18.400 25.672 -24.889 1.00 16.23 C ATOM 1454 C GLY A 174 17.042 26.312 -24.800 1.00 16.74 C ATOM 1455 O GLY A 174 16.937 27.529 -24.825 1.00 18.98 O ATOM 1456 H GLY A 174 18.660 23.815 -23.884 1.00 0.00 H ATOM 1457 N ALA A 175 15.979 25.501 -24.771 1.00 16.21 N ATOM 1458 CA ALA A 175 14.603 26.037 -24.851 1.00 15.94 C ATOM 1459 C ALA A 175 14.078 26.646 -23.548 1.00 15.41 C ATOM 1460 O ALA A 175 13.035 27.290 -23.538 1.00 14.63 O ATOM 1461 CB ALA A 175 13.661 25.014 -25.391 1.00 16.82 C ATOM 1462 H ALA A 175 16.123 24.474 -24.691 1.00 0.00 H ATOM 1463 N ILE A 176 14.807 26.449 -22.442 1.00 13.26 N ATOM 1464 CA ILE A 176 14.336 26.890 -21.122 1.00 12.04 C ATOM 1465 C ILE A 176 14.818 28.290 -20.903 1.00 13.67 C ATOM 1466 O ILE A 176 15.958 28.568 -20.564 1.00 15.00 O ATOM 1467 CB ILE A 176 14.715 25.921 -19.972 1.00 11.96 C ATOM 1468 CG1 ILE A 176 14.443 24.515 -20.383 1.00 11.75 C ATOM 1469 CG2 ILE A 176 14.033 26.348 -18.659 1.00 12.95 C ATOM 1470 CD1 ILE A 176 13.045 24.106 -20.698 1.00 11.99 C ATOM 1471 H ILE A 176 15.728 25.973 -22.519 1.00 0.00 H ATOM 1472 N THR A 177 13.933 29.245 -21.126 1.00 12.56 N ATOM 1473 CA THR A 177 14.177 30.614 -20.948 1.00 11.94 C ATOM 1474 C THR A 177 14.057 31.032 -19.485 1.00 11.83 C ATOM 1475 O THR A 177 13.670 30.187 -18.640 1.00 11.87 O ATOM 1476 CB THR A 177 13.173 31.460 -21.695 1.00 14.35 C ATOM 1477 OG1 THR A 177 11.904 31.312 -20.997 1.00 12.88 O ATOM 1478 CG2 THR A 177 13.074 31.059 -23.161 1.00 13.94 C ATOM 1479 HG1 THR A 177 11.212 31.852 -21.454 1.00 0.00 H ATOM 1480 H THR A 177 12.989 28.961 -21.457 1.00 0.00 H ATOM 1481 N GLU A 178 14.299 32.266 -19.100 1.00 12.50 N ATOM 1482 CA GLU A 178 14.139 32.745 -17.784 1.00 14.71 C ATOM 1483 C GLU A 178 12.664 32.700 -17.316 1.00 12.69 C ATOM 1484 O GLU A 178 12.429 32.869 -16.119 1.00 13.09 O ATOM 1485 CB GLU A 178 14.705 34.194 -17.600 1.00 19.50 C ATOM 1486 CG GLU A 178 13.834 35.320 -18.246 1.00 24.42 C ATOM 1487 CD GLU A 178 14.151 36.731 -17.717 1.00 31.56 C ATOM 1488 OE1 GLU A 178 15.302 37.159 -17.914 1.00 42.09 O ATOM 1489 OE2 GLU A 178 13.304 37.393 -17.083 1.00 36.99 O ATOM 1490 H GLU A 178 14.633 32.938 -19.820 1.00 0.00 H ATOM 1491 N ARG A 179 11.761 32.562 -18.296 1.00 11.94 N ATOM 1492 CA ARG A 179 10.293 32.597 -17.949 1.00 11.31 C ATOM 1493 C ARG A 179 9.764 31.198 -17.755 1.00 10.90 C ATOM 1494 O ARG A 179 8.563 31.035 -17.501 1.00 10.28 O ATOM 1495 CB ARG A 179 9.541 33.283 -19.095 1.00 13.53 C ATOM 1496 CG ARG A 179 10.193 34.666 -19.391 1.00 18.82 C ATOM 1497 CD ARG A 179 9.394 35.424 -20.458 1.00 21.47 C ATOM 1498 NE ARG A 179 8.518 36.322 -19.810 1.00 31.63 N ATOM 1499 CZ ARG A 179 7.710 37.231 -20.395 1.00 32.38 C ATOM 1500 NH1 ARG A 179 7.745 37.467 -21.703 1.00 38.15 N ATOM 1501 NH2 ARG A 179 6.894 37.951 -19.626 1.00 26.66 N ATOM 1502 HE ARG A 179 8.493 36.278 -18.771 1.00 0.00 H ATOM 1503 HH12 ARG A 179 7.108 38.175 -22.121 1.00 0.00 H ATOM 1504 HH11 ARG A 179 8.410 36.944 -22.308 1.00 0.00 H ATOM 1505 HH22 ARG A 179 6.263 38.657 -20.056 1.00 0.00 H ATOM 1506 HH21 ARG A 179 6.888 37.807 -18.596 1.00 0.00 H ATOM 1507 H ARG A 179 12.067 32.433 -19.281 1.00 0.00 H ATOM 1508 N LEU A 180 10.654 30.207 -17.785 1.00 10.91 N ATOM 1509 CA LEU A 180 10.323 28.784 -17.644 1.00 9.72 C ATOM 1510 C LEU A 180 11.145 28.207 -16.535 1.00 9.64 C ATOM 1511 O LEU A 180 12.225 28.653 -16.234 1.00 11.32 O ATOM 1512 CB LEU A 180 10.585 27.984 -18.945 1.00 10.75 C ATOM 1513 CG LEU A 180 9.722 28.418 -20.122 1.00 11.62 C ATOM 1514 CD1 LEU A 180 10.181 27.766 -21.405 1.00 12.88 C ATOM 1515 CD2 LEU A 180 8.247 28.120 -19.938 1.00 11.65 C ATOM 1516 H LEU A 180 11.654 30.460 -17.918 1.00 0.00 H ATOM 1517 N MET A 181 10.607 27.150 -15.907 1.00 9.18 N ATOM 1518 CA MET A 181 11.372 26.371 -14.934 1.00 9.53 C ATOM 1519 C MET A 181 11.164 24.899 -15.198 1.00 9.61 C ATOM 1520 O MET A 181 10.127 24.500 -15.770 1.00 10.83 O ATOM 1521 CB MET A 181 10.986 26.750 -13.508 1.00 9.40 C ATOM 1522 CG MET A 181 9.537 26.480 -13.143 1.00 10.74 C ATOM 1523 SD MET A 181 8.925 27.009 -11.539 1.00 12.41 S ATOM 1524 CE MET A 181 9.819 25.908 -10.455 1.00 12.26 C ATOM 1525 H MET A 181 9.625 26.879 -16.117 1.00 0.00 H ATOM 1526 N CYS A 182 12.073 24.067 -14.758 1.00 8.85 N ATOM 1527 CA CYS A 182 11.989 22.659 -14.923 1.00 9.14 C ATOM 1528 C CYS A 182 11.868 21.940 -13.607 1.00 8.76 C ATOM 1529 O CYS A 182 12.314 22.428 -12.567 1.00 8.87 O ATOM 1530 CB CYS A 182 13.221 22.101 -15.577 1.00 9.50 C ATOM 1531 SG CYS A 182 13.494 22.777 -17.246 1.00 12.06 S ATOM 1532 H CYS A 182 12.900 24.457 -14.262 1.00 0.00 H ATOM 1533 N ALA A 183 11.236 20.785 -13.633 1.00 7.98 N ATOM 1534 CA ALA A 183 11.262 19.871 -12.511 1.00 6.96 C ATOM 1535 C ALA A 183 11.728 18.512 -13.032 1.00 8.21 C ATOM 1536 O ALA A 183 11.530 18.188 -14.200 1.00 8.27 O ATOM 1537 CB ALA A 183 9.936 19.714 -11.782 1.00 8.43 C ATOM 1538 H ALA A 183 10.702 20.522 -14.486 1.00 0.00 H ATOM 1539 N GLU A 184 12.342 17.738 -12.161 1.00 8.08 N ATOM 1540 CA GLU A 184 12.716 16.365 -12.494 1.00 9.26 C ATOM 1541 C GLU A 184 11.531 15.603 -12.987 1.00 9.82 C ATOM 1542 O GLU A 184 10.409 15.760 -12.540 1.00 9.07 O ATOM 1543 CB GLU A 184 13.474 15.694 -11.400 1.00 10.78 C ATOM 1544 CG GLU A 184 14.808 16.380 -11.057 1.00 14.32 C ATOM 1545 CD GLU A 184 15.663 15.649 -10.057 1.00 18.39 C ATOM 1546 OE1 GLU A 184 15.586 14.394 -10.030 1.00 17.89 O ATOM 1547 OE2 GLU A 184 16.358 16.337 -9.251 1.00 18.70 O ATOM 1548 H GLU A 184 12.565 18.112 -11.217 1.00 0.00 H ATOM 1549 N SER A 185 11.784 14.625 -13.890 1.00 9.51 N ATOM 1550 CA SER A 185 10.750 13.762 -14.489 1.00 9.80 C ATOM 1551 C SER A 185 11.120 12.314 -14.402 1.00 11.68 C ATOM 1552 O SER A 185 10.804 11.532 -15.313 1.00 14.22 O ATOM 1553 CB SER A 185 10.611 14.189 -15.963 1.00 10.87 C ATOM 1554 OG SER A 185 11.922 14.136 -16.550 1.00 10.62 O ATOM 1555 HG SER A 185 11.868 14.406 -17.501 1.00 0.00 H ATOM 1556 H SER A 185 12.771 14.473 -14.179 1.00 0.00 H ATOM 1557 N ASN A 186 11.828 11.924 -13.350 1.00 12.58 N ATOM 1558 CA ASN A 186 12.222 10.513 -13.181 1.00 15.45 C ATOM 1559 C ASN A 186 11.069 9.750 -12.589 1.00 14.19 C ATOM 1560 O ASN A 186 10.907 9.684 -11.390 1.00 13.93 O ATOM 1561 CB ASN A 186 13.401 10.434 -12.266 1.00 17.12 C ATOM 1562 CG ASN A 186 13.992 9.005 -12.185 1.00 20.12 C ATOM 1563 OD1 ASN A 186 14.644 8.707 -11.215 1.00 31.98 O ATOM 1564 ND2 ASN A 186 13.735 8.168 -13.140 1.00 18.48 N ATOM 1565 HD22 ASN A 186 13.168 8.470 -13.958 1.00 0.00 H ATOM 1566 HD21 ASN A 186 14.096 7.194 -13.089 1.00 0.00 H ATOM 1567 H ASN A 186 12.109 12.624 -12.634 1.00 0.00 H ATOM 1568 N ARG A 187 10.331 9.116 -13.475 1.00 11.35 N ATOM 1569 CA ARG A 187 9.205 8.313 -13.158 1.00 12.59 C ATOM 1570 C ARG A 187 7.970 9.156 -12.735 1.00 12.64 C ATOM 1571 O ARG A 187 6.961 9.187 -13.451 1.00 13.85 O ATOM 1572 CB ARG A 187 9.481 7.094 -12.182 1.00 16.73 C ATOM 1573 CG ARG A 187 8.344 6.126 -11.982 1.00 25.03 C ATOM 1574 CD ARG A 187 8.669 4.955 -11.043 1.00 26.49 C ATOM 1575 NE ARG A 187 8.937 5.421 -9.678 1.00 28.49 N ATOM 1576 CZ ARG A 187 7.952 5.809 -8.860 1.00 32.68 C ATOM 1577 NH1 ARG A 187 8.219 6.244 -7.620 1.00 31.83 N ATOM 1578 NH2 ARG A 187 6.682 5.672 -9.280 1.00 28.38 N ATOM 1579 HE ARG A 187 9.919 5.451 -9.337 1.00 0.00 H ATOM 1580 HH12 ARG A 187 7.443 6.542 -6.995 1.00 0.00 H ATOM 1581 HH11 ARG A 187 9.202 6.283 -7.283 1.00 0.00 H ATOM 1582 HH22 ARG A 187 5.896 5.965 -8.665 1.00 0.00 H ATOM 1583 HH21 ARG A 187 6.485 5.273 -10.220 1.00 0.00 H ATOM 1584 H ARG A 187 10.591 9.210 -14.478 1.00 0.00 H ATOM 1585 N ARG A 188 8.134 9.902 -11.660 1.00 10.55 N ATOM 1586 CA ARG A 188 7.155 10.893 -11.184 1.00 9.58 C ATOM 1587 C ARG A 188 7.135 12.073 -12.120 1.00 9.69 C ATOM 1588 O ARG A 188 8.207 12.565 -12.523 1.00 10.08 O ATOM 1589 CB ARG A 188 7.559 11.319 -9.769 1.00 9.09 C ATOM 1590 CG ARG A 188 7.525 10.191 -8.751 1.00 12.01 C ATOM 1591 CD ARG A 188 7.894 10.722 -7.419 1.00 14.33 C ATOM 1592 NE ARG A 188 7.669 9.766 -6.377 1.00 24.35 N ATOM 1593 CZ ARG A 188 8.492 8.969 -5.767 1.00 29.63 C ATOM 1594 NH1 ARG A 188 9.762 8.853 -6.168 1.00 37.80 N ATOM 1595 NH2 ARG A 188 7.942 8.274 -4.712 1.00 27.43 N ATOM 1596 HE ARG A 188 6.682 9.699 -6.056 1.00 0.00 H ATOM 1597 HH12 ARG A 188 10.408 8.210 -5.668 1.00 0.00 H ATOM 1598 HH11 ARG A 188 10.104 9.406 -6.980 1.00 0.00 H ATOM 1599 HH22 ARG A 188 8.527 7.611 -4.164 1.00 0.00 H ATOM 1600 HH21 ARG A 188 6.942 8.412 -4.464 1.00 0.00 H ATOM 1601 H ARG A 188 9.011 9.783 -11.114 1.00 0.00 H ATOM 1602 N ASP A 189 5.964 12.539 -12.522 1.00 7.76 N ATOM 1603 CA ASP A 189 5.892 13.686 -13.465 1.00 8.11 C ATOM 1604 C ASP A 189 4.476 14.132 -13.613 1.00 8.98 C ATOM 1605 O ASP A 189 3.521 13.445 -13.240 1.00 9.36 O ATOM 1606 CB ASP A 189 6.334 13.196 -14.855 1.00 8.43 C ATOM 1607 CG ASP A 189 6.846 14.205 -15.747 1.00 8.66 C ATOM 1608 OD1 ASP A 189 6.867 15.450 -15.476 1.00 9.07 O ATOM 1609 OD2 ASP A 189 7.311 13.829 -16.886 1.00 9.81 O ATOM 1610 H ASP A 189 5.087 12.100 -12.176 1.00 0.00 H ATOM 1611 N SER A 190 4.317 15.309 -14.227 1.00 7.77 N ATOM 1612 CA SER A 190 3.053 15.733 -14.777 1.00 8.55 C ATOM 1613 C SER A 190 2.875 15.114 -16.151 1.00 9.22 C ATOM 1614 O SER A 190 3.864 14.719 -16.789 1.00 10.23 O ATOM 1615 CB SER A 190 2.966 17.258 -14.813 1.00 10.03 C ATOM 1616 OG SER A 190 4.038 17.798 -15.497 1.00 12.95 O ATOM 1617 HG SER A 190 4.880 17.538 -15.047 1.00 0.00 H ATOM 1618 H SER A 190 5.137 15.943 -14.311 1.00 0.00 H ATOM 1619 N CYS A 191 1.653 14.984 -16.626 1.00 9.58 N ATOM 1620 CA CYS A 191 1.399 14.327 -17.906 1.00 9.49 C ATOM 1621 C CYS A 191 0.146 14.840 -18.576 1.00 9.62 C ATOM 1622 O CYS A 191 -0.470 15.806 -18.184 1.00 9.31 O ATOM 1623 CB CYS A 191 1.409 12.835 -17.711 1.00 9.68 C ATOM 1624 SG CYS A 191 1.765 11.798 -19.220 1.00 11.33 S ATOM 1625 H CYS A 191 0.852 15.357 -16.078 1.00 0.00 H ATOM 1626 N LYS A 192 -0.260 14.165 -19.670 1.00 8.06 N ATOM 1627 CA LYS A 192 -1.444 14.554 -20.488 1.00 8.39 C ATOM 1628 C LYS A 192 -2.667 14.770 -19.606 1.00 8.43 C ATOM 1629 O LYS A 192 -3.055 13.873 -18.800 1.00 9.53 O ATOM 1630 CB LYS A 192 -1.773 13.430 -21.473 1.00 10.16 C ATOM 1631 CG LYS A 192 -2.851 13.838 -22.459 1.00 12.45 C ATOM 1632 CD LYS A 192 -3.116 12.682 -23.425 1.00 16.11 C ATOM 1633 CE LYS A 192 -4.139 13.175 -24.370 1.00 22.43 C ATOM 1634 NZ LYS A 192 -4.594 12.032 -25.161 1.00 31.77 N ATOM 1635 HZ1 LYS A 192 -3.787 11.626 -25.677 1.00 0.00 H ATOM 1636 HZ2 LYS A 192 -4.999 11.313 -24.528 1.00 0.00 H ATOM 1637 HZ3 LYS A 192 -5.317 12.347 -25.839 1.00 0.00 H ATOM 1638 H LYS A 192 0.283 13.326 -19.959 1.00 0.00 H ATOM 1639 N GLY A 193 -3.215 15.989 -19.689 1.00 8.11 N ATOM 1640 CA GLY A 193 -4.362 16.395 -18.955 1.00 8.72 C ATOM 1641 C GLY A 193 -4.006 17.137 -17.657 1.00 8.82 C ATOM 1642 O GLY A 193 -4.907 17.658 -17.009 1.00 7.95 O ATOM 1643 H GLY A 193 -2.775 16.680 -20.329 1.00 0.00 H ATOM 1644 N ASP A 194 -2.732 17.237 -17.341 1.00 7.52 N ATOM 1645 CA ASP A 194 -2.246 18.056 -16.232 1.00 6.93 C ATOM 1646 C ASP A 194 -1.872 19.449 -16.669 1.00 7.56 C ATOM 1647 O ASP A 194 -1.681 20.359 -15.821 1.00 7.85 O ATOM 1648 CB ASP A 194 -1.087 17.402 -15.473 1.00 7.05 C ATOM 1649 CG ASP A 194 -1.424 16.066 -14.875 1.00 7.20 C ATOM 1650 OD1 ASP A 194 -2.517 16.023 -14.240 1.00 8.40 O ATOM 1651 OD2 ASP A 194 -0.563 15.165 -14.878 1.00 7.99 O ATOM 1652 H ASP A 194 -2.038 16.708 -17.907 1.00 0.00 H ATOM 1653 N SER A 195 -1.657 19.665 -17.991 1.00 8.66 N ATOM 1654 CA SER A 195 -1.280 21.032 -18.428 1.00 8.95 C ATOM 1655 C SER A 195 -2.260 22.074 -17.877 1.00 8.26 C ATOM 1656 O SER A 195 -3.475 21.815 -17.806 1.00 8.68 O ATOM 1657 CB SER A 195 -1.332 21.145 -19.945 1.00 10.54 C ATOM 1658 OG SER A 195 -0.316 20.292 -20.520 1.00 12.41 O ATOM 1659 HG SER A 195 -0.347 20.363 -21.507 1.00 0.00 H ATOM 1660 H SER A 195 -1.754 18.892 -18.680 1.00 0.00 H ATOM 1661 N GLY A 196 -1.761 23.221 -17.560 1.00 7.82 N ATOM 1662 CA GLY A 196 -2.595 24.258 -17.038 1.00 7.65 C ATOM 1663 C GLY A 196 -2.733 24.313 -15.561 1.00 8.51 C ATOM 1664 O GLY A 196 -3.193 25.296 -15.033 1.00 8.26 O ATOM 1665 H GLY A 196 -0.743 23.393 -17.685 1.00 0.00 H ATOM 1666 N GLY A 197 -2.406 23.199 -14.907 1.00 7.84 N ATOM 1667 CA GLY A 197 -2.496 23.116 -13.495 1.00 7.85 C ATOM 1668 C GLY A 197 -1.294 23.669 -12.753 1.00 7.91 C ATOM 1669 O GLY A 197 -0.361 24.191 -13.363 1.00 6.92 O ATOM 1670 H GLY A 197 -2.077 22.372 -15.445 1.00 0.00 H ATOM 1671 N PRO A 198 -1.315 23.640 -11.440 1.00 8.81 N ATOM 1672 CA PRO A 198 -0.358 24.362 -10.626 1.00 8.97 C ATOM 1673 C PRO A 198 0.889 23.597 -10.214 1.00 9.38 C ATOM 1674 O PRO A 198 0.836 22.343 -10.046 1.00 10.25 O ATOM 1675 CB PRO A 198 -1.137 24.591 -9.298 1.00 9.82 C ATOM 1676 CG PRO A 198 -2.036 23.402 -9.233 1.00 10.79 C ATOM 1677 CD PRO A 198 -2.427 23.025 -10.690 1.00 10.01 C ATOM 1678 N LEU A 199 2.011 24.313 -10.123 1.00 7.64 N ATOM 1679 CA LEU A 199 3.218 23.863 -9.442 1.00 8.72 C ATOM 1680 C LEU A 199 3.350 24.808 -8.256 1.00 7.89 C ATOM 1681 O LEU A 199 3.539 26.024 -8.454 1.00 7.75 O ATOM 1682 CB LEU A 199 4.432 23.903 -10.330 1.00 11.15 C ATOM 1683 CG LEU A 199 5.765 23.398 -9.719 1.00 12.96 C ATOM 1684 CD1 LEU A 199 5.734 21.900 -9.454 1.00 15.26 C ATOM 1685 CD2 LEU A 199 6.985 23.744 -10.556 1.00 14.60 C ATOM 1686 H LEU A 199 2.025 25.253 -10.567 1.00 0.00 H ATOM 1687 N VAL A 200 3.229 24.296 -7.049 1.00 6.92 N ATOM 1688 CA VAL A 200 3.081 25.114 -5.898 1.00 7.03 C ATOM 1689 C VAL A 200 4.275 24.897 -5.013 1.00 7.64 C ATOM 1690 O VAL A 200 4.617 23.735 -4.707 1.00 8.42 O ATOM 1691 CB VAL A 200 1.819 24.734 -5.089 1.00 6.94 C ATOM 1692 CG1 VAL A 200 1.648 25.616 -3.834 1.00 8.15 C ATOM 1693 CG2 VAL A 200 0.576 24.870 -6.022 1.00 8.55 C ATOM 1694 H VAL A 200 3.242 23.262 -6.935 1.00 0.00 H ATOM 1695 N CYS A 201 4.929 25.936 -4.562 1.00 7.50 N ATOM 1696 CA CYS A 201 6.125 25.783 -3.673 1.00 9.81 C ATOM 1697 C CYS A 201 5.904 26.662 -2.466 1.00 11.68 C ATOM 1698 O CYS A 201 5.630 27.876 -2.624 1.00 10.56 O ATOM 1699 CB CYS A 201 7.410 26.175 -4.392 1.00 10.88 C ATOM 1700 SG CYS A 201 7.647 25.603 -6.061 1.00 11.33 S ATOM 1701 H CYS A 201 4.611 26.890 -4.827 1.00 0.00 H ATOM 1702 N GLY A 202 6.020 26.060 -1.273 1.00 12.21 N ATOM 1703 CA GLY A 202 5.915 26.912 -0.034 1.00 13.44 C ATOM 1704 C GLY A 202 4.528 27.358 -0.055 1.00 14.11 C ATOM 1705 O GLY A 202 4.252 28.574 0.416 1.00 14.59 O ATOM 1706 H GLY A 202 6.178 25.034 -1.205 1.00 0.00 H ATOM 1707 N GLY A 207 3.323 26.837 -0.605 1.00 11.38 N ATOM 1708 CA GLY A 207 2.040 27.338 -0.569 1.00 11.78 C ATOM 1709 C GLY A 207 1.635 28.461 -1.572 1.00 10.54 C ATOM 1710 O GLY A 207 0.525 28.965 -1.530 1.00 13.74 O ATOM 1711 H GLY A 207 3.427 25.936 -1.114 1.00 0.00 H ATOM 1712 N VAL A 208 2.623 28.830 -2.448 1.00 9.34 N ATOM 1713 CA VAL A 208 2.387 29.876 -3.393 1.00 8.80 C ATOM 1714 C VAL A 208 2.577 29.315 -4.820 1.00 8.09 C ATOM 1715 O VAL A 208 3.438 28.451 -5.084 1.00 8.37 O ATOM 1716 CB VAL A 208 3.470 30.936 -3.228 1.00 10.80 C ATOM 1717 CG1 VAL A 208 3.345 32.055 -4.210 1.00 11.73 C ATOM 1718 CG2 VAL A 208 3.387 31.554 -1.822 1.00 14.10 C ATOM 1719 H VAL A 208 3.545 28.349 -2.425 1.00 0.00 H ATOM 1720 N LEU A 209 1.704 29.719 -5.763 1.00 7.83 N ATOM 1721 CA LEU A 209 1.824 29.291 -7.153 1.00 8.06 C ATOM 1722 C LEU A 209 3.143 29.800 -7.760 1.00 8.06 C ATOM 1723 O LEU A 209 3.360 31.030 -7.727 1.00 8.31 O ATOM 1724 CB LEU A 209 0.666 29.838 -8.047 1.00 8.61 C ATOM 1725 CG LEU A 209 0.627 29.284 -9.429 1.00 9.29 C ATOM 1726 CD1 LEU A 209 0.326 27.823 -9.493 1.00 9.53 C ATOM 1727 CD2 LEU A 209 -0.342 30.095 -10.317 1.00 10.94 C ATOM 1728 H LEU A 209 0.924 30.352 -5.493 1.00 0.00 H ATOM 1729 N GLU A 210 3.975 28.949 -8.234 1.00 6.82 N ATOM 1730 CA GLU A 210 5.224 29.273 -8.924 1.00 7.62 C ATOM 1731 C GLU A 210 5.125 28.970 -10.375 1.00 7.99 C ATOM 1732 O GLU A 210 5.677 29.753 -11.186 1.00 9.45 O ATOM 1733 CB GLU A 210 6.423 28.580 -8.322 1.00 8.81 C ATOM 1734 CG GLU A 210 6.792 29.148 -6.962 1.00 9.38 C ATOM 1735 CD GLU A 210 7.571 30.499 -6.938 1.00 10.86 C ATOM 1736 OE1 GLU A 210 7.877 30.961 -8.037 1.00 13.24 O ATOM 1737 OE2 GLU A 210 7.799 30.953 -5.800 1.00 13.80 O ATOM 1738 H GLU A 210 3.743 27.942 -8.119 1.00 0.00 H ATOM 1739 N GLY A 211 4.520 27.878 -10.778 1.00 7.92 N ATOM 1740 CA GLY A 211 4.555 27.414 -12.152 1.00 8.72 C ATOM 1741 C GLY A 211 3.199 26.952 -12.583 1.00 7.66 C ATOM 1742 O GLY A 211 2.332 26.581 -11.774 1.00 9.08 O ATOM 1743 H GLY A 211 3.990 27.319 -10.079 1.00 0.00 H ATOM 1744 N VAL A 212 2.959 26.969 -13.890 1.00 8.40 N ATOM 1745 CA VAL A 212 1.814 26.425 -14.537 1.00 8.46 C ATOM 1746 C VAL A 212 2.307 25.344 -15.458 1.00 8.07 C ATOM 1747 O VAL A 212 3.215 25.557 -16.311 1.00 9.33 O ATOM 1748 CB VAL A 212 0.995 27.511 -15.311 1.00 8.59 C ATOM 1749 CG1 VAL A 212 -0.167 26.871 -16.079 1.00 9.33 C ATOM 1750 CG2 VAL A 212 0.550 28.551 -14.372 1.00 10.48 C ATOM 1751 H VAL A 212 3.673 27.421 -14.496 1.00 0.00 H ATOM 1752 N VAL A 213 1.737 24.141 -15.361 1.00 7.35 N ATOM 1753 CA VAL A 213 2.236 23.042 -16.180 1.00 8.57 C ATOM 1754 C VAL A 213 2.105 23.354 -17.686 1.00 9.54 C ATOM 1755 O VAL A 213 1.026 23.786 -18.154 1.00 9.39 O ATOM 1756 CB VAL A 213 1.405 21.777 -15.887 1.00 8.10 C ATOM 1757 CG1 VAL A 213 1.875 20.576 -16.719 1.00 9.46 C ATOM 1758 CG2 VAL A 213 1.361 21.387 -14.382 1.00 7.74 C ATOM 1759 H VAL A 213 0.943 23.988 -14.707 1.00 0.00 H ATOM 1760 N THR A 214 3.189 23.125 -18.406 1.00 12.58 N ATOM 1761 CA THR A 214 3.082 23.008 -19.882 1.00 14.08 C ATOM 1762 C THR A 214 3.605 21.673 -20.345 1.00 17.72 C ATOM 1763 O THR A 214 4.065 20.830 -19.550 1.00 15.68 O ATOM 1764 CB THR A 214 3.806 24.080 -20.596 1.00 13.93 C ATOM 1765 OG1 THR A 214 3.427 24.044 -21.992 1.00 11.49 O ATOM 1766 CG2 THR A 214 5.308 23.872 -20.578 1.00 13.04 C ATOM 1767 HG1 THR A 214 2.450 24.186 -22.071 1.00 0.00 H ATOM 1768 H THR A 214 4.114 23.027 -17.940 1.00 0.00 H ATOM 1769 N SER A 215 3.215 21.306 -21.615 1.00 21.50 N ATOM 1770 CA SER A 215 3.444 19.946 -22.144 1.00 25.22 C ATOM 1771 C SER A 215 4.800 19.713 -22.658 1.00 24.94 C ATOM 1772 O SER A 215 5.107 18.504 -22.655 1.00 22.30 O ATOM 1773 CB SER A 215 2.316 19.510 -23.139 1.00 26.28 C ATOM 1774 OG SER A 215 2.220 20.481 -24.183 1.00 26.85 O ATOM 1775 HG SER A 215 1.509 20.213 -24.817 1.00 0.00 H ATOM 1776 H SER A 215 2.745 22.009 -22.220 1.00 0.00 H ATOM 1777 N GLY A 216 5.658 20.757 -23.042 1.00 20.05 N ATOM 1778 CA GLY A 216 7.112 20.499 -23.265 1.00 20.02 C ATOM 1779 C GLY A 216 7.191 19.405 -24.381 1.00 23.26 C ATOM 1780 O GLY A 216 6.603 19.474 -25.448 1.00 26.59 O ATOM 1781 H GLY A 216 5.278 21.716 -23.172 1.00 0.00 H ATOM 1782 N SER A 217 7.898 18.376 -23.996 1.00 17.73 N ATOM 1783 CA SER A 217 7.952 17.023 -24.502 1.00 18.81 C ATOM 1784 C SER A 217 6.614 16.376 -24.304 1.00 17.63 C ATOM 1785 O SER A 217 6.102 16.438 -23.175 1.00 20.92 O ATOM 1786 CB SER A 217 8.942 16.207 -23.596 1.00 17.07 C ATOM 1787 OG SER A 217 8.587 16.150 -22.174 1.00 15.05 O ATOM 1788 HG SER A 217 7.698 15.726 -22.074 1.00 0.00 H ATOM 1789 H SER A 217 8.528 18.562 -23.190 1.00 0.00 H ATOM 1790 N ARG A 218 6.110 15.635 -25.233 1.00 19.25 N ATOM 1791 CA ARG A 218 4.928 14.851 -24.926 1.00 17.80 C ATOM 1792 C ARG A 218 5.333 13.713 -24.020 1.00 14.32 C ATOM 1793 O ARG A 218 4.528 13.007 -23.411 1.00 13.45 O ATOM 1794 CB ARG A 218 4.328 14.274 -26.214 1.00 23.66 C ATOM 1795 CG ARG A 218 3.745 15.373 -27.080 1.00 32.27 C ATOM 1796 CD ARG A 218 3.519 14.903 -28.514 1.00 39.85 C ATOM 1797 NE ARG A 218 2.207 14.290 -28.560 1.00 46.40 N ATOM 1798 CZ ARG A 218 1.948 13.002 -28.665 1.00 50.05 C ATOM 1799 NH1 ARG A 218 2.920 12.075 -28.788 1.00 57.91 N ATOM 1800 NH2 ARG A 218 0.667 12.645 -28.666 1.00 50.47 N ATOM 1801 HE ARG A 218 1.389 14.930 -28.505 1.00 0.00 H ATOM 1802 HH12 ARG A 218 2.671 11.068 -28.868 1.00 0.00 H ATOM 1803 HH11 ARG A 218 3.918 12.367 -28.803 1.00 0.00 H ATOM 1804 HH22 ARG A 218 0.407 11.641 -28.746 1.00 0.00 H ATOM 1805 HH21 ARG A 218 -0.075 13.370 -28.586 1.00 0.00 H ATOM 1806 H ARG A 218 6.541 15.601 -26.179 1.00 0.00 H ATOM 1807 N VAL A 219 6.632 13.403 -23.912 1.00 12.76 N ATOM 1808 CA VAL A 219 7.103 12.281 -23.118 1.00 12.51 C ATOM 1809 C VAL A 219 6.974 12.610 -21.669 1.00 12.01 C ATOM 1810 O VAL A 219 7.408 13.710 -21.245 1.00 12.55 O ATOM 1811 CB VAL A 219 8.563 11.897 -23.472 1.00 14.53 C ATOM 1812 CG1 VAL A 219 9.076 10.736 -22.668 1.00 14.67 C ATOM 1813 CG2 VAL A 219 8.587 11.499 -24.958 1.00 15.49 C ATOM 1814 H VAL A 219 7.329 13.988 -24.415 1.00 0.00 H ATOM 1815 N CYS A 220 6.394 11.722 -20.916 1.00 10.57 N ATOM 1816 CA CYS A 220 6.254 11.842 -19.485 1.00 10.68 C ATOM 1817 C CYS A 220 7.053 10.795 -18.733 1.00 11.90 C ATOM 1818 O CYS A 220 7.121 9.606 -19.209 1.00 12.25 O ATOM 1819 CB CYS A 220 4.799 11.686 -19.061 1.00 11.05 C ATOM 1820 SG CYS A 220 3.633 12.603 -20.002 1.00 12.20 S ATOM 1821 H CYS A 220 6.007 10.872 -21.374 1.00 0.00 H ATOM 1822 N GLY A 221 7.572 11.096 -17.575 1.00 10.07 N ATOM 1823 CA GLY A 221 8.192 10.152 -16.742 1.00 10.23 C ATOM 1824 C GLY A 221 9.559 9.674 -17.133 1.00 10.06 C ATOM 1825 O GLY A 221 10.063 8.699 -16.462 1.00 11.42 O ATOM 1826 H GLY A 221 7.524 12.084 -17.253 1.00 0.00 H ATOM 1827 N ASN A 222 10.137 10.303 -18.103 1.00 10.67 N ATOM 1828 CA ASN A 222 11.502 9.951 -18.622 1.00 11.52 C ATOM 1829 C ASN A 222 12.446 11.072 -18.123 1.00 11.72 C ATOM 1830 O ASN A 222 12.275 12.232 -18.494 1.00 10.61 O ATOM 1831 CB ASN A 222 11.484 9.915 -20.117 1.00 12.39 C ATOM 1832 CG ASN A 222 12.791 9.381 -20.693 1.00 16.07 C ATOM 1833 OD1 ASN A 222 13.835 9.536 -20.089 1.00 15.40 O ATOM 1834 ND2 ASN A 222 12.708 8.735 -21.841 1.00 15.48 N ATOM 1835 HD22 ASN A 222 11.788 8.632 -22.315 1.00 0.00 H ATOM 1836 HD21 ASN A 222 13.563 8.329 -22.272 1.00 0.00 H ATOM 1837 H ASN A 222 9.630 11.095 -18.548 1.00 0.00 H ATOM 1838 N ARG A 223 13.395 10.689 -17.272 1.00 12.32 N ATOM 1839 CA ARG A 223 14.339 11.687 -16.704 1.00 12.73 C ATOM 1840 C ARG A 223 15.027 12.501 -17.717 1.00 12.01 C ATOM 1841 O ARG A 223 15.420 13.617 -17.479 1.00 13.31 O ATOM 1842 CB ARG A 223 15.298 10.989 -15.699 1.00 16.27 C ATOM 1843 CG ARG A 223 16.280 10.078 -16.435 1.00 23.32 C ATOM 1844 CD ARG A 223 16.830 9.046 -15.432 1.00 32.17 C ATOM 1845 NE ARG A 223 17.806 9.704 -14.585 1.00 42.11 N ATOM 1846 CZ ARG A 223 19.138 9.569 -14.738 1.00 64.63 C ATOM 1847 NH1 ARG A 223 19.674 8.768 -15.699 1.00 70.50 N ATOM 1848 NH2 ARG A 223 19.963 10.220 -13.912 1.00 67.13 N ATOM 1849 HE ARG A 223 17.459 10.314 -13.817 1.00 0.00 H ATOM 1850 HH12 ARG A 223 20.707 8.686 -15.791 1.00 0.00 H ATOM 1851 HH11 ARG A 223 19.051 8.238 -16.342 1.00 0.00 H ATOM 1852 HH22 ARG A 223 20.993 10.122 -14.022 1.00 0.00 H ATOM 1853 HH21 ARG A 223 19.575 10.824 -13.159 1.00 0.00 H ATOM 1854 H ARG A 223 13.476 9.688 -17.003 1.00 0.00 H ATOM 1855 N LYS A 223A 15.238 11.933 -18.932 1.00 12.24 N ATOM 1856 CA LYS A 223A 15.868 12.664 -19.967 1.00 14.21 C ATOM 1857 C LYS A 223A 15.118 13.883 -20.495 1.00 13.24 C ATOM 1858 O LYS A 223A 15.663 14.781 -21.142 1.00 12.73 O ATOM 1859 CB LYS A 223A 16.114 11.687 -21.172 1.00 18.21 C ATOM 1860 CG LYS A 223A 17.092 12.135 -22.205 1.00 24.64 C ATOM 1861 CD LYS A 223A 17.270 11.087 -23.328 1.00 29.01 C ATOM 1862 CE LYS A 223A 18.271 11.658 -24.347 1.00 31.88 C ATOM 1863 NZ LYS A 223A 18.007 10.912 -25.636 1.00 48.89 N ATOM 1864 HZ1 LYS A 223A 18.159 9.894 -25.484 1.00 0.00 H ATOM 1865 HZ2 LYS A 223A 17.025 11.076 -25.935 1.00 0.00 H ATOM 1866 HZ3 LYS A 223A 18.657 11.254 -26.372 1.00 0.00 H ATOM 1867 H LYS A 223A 14.934 10.953 -19.103 1.00 0.00 H ATOM 1868 N LYS A 224 13.797 13.963 -20.225 1.00 11.40 N ATOM 1869 CA LYS A 224 12.954 15.064 -20.720 1.00 10.88 C ATOM 1870 C LYS A 224 12.188 15.639 -19.475 1.00 10.82 C ATOM 1871 O LYS A 224 11.080 15.273 -19.205 1.00 9.70 O ATOM 1872 CB LYS A 224 11.964 14.666 -21.852 1.00 12.78 C ATOM 1873 CG LYS A 224 12.668 14.168 -23.129 1.00 15.58 C ATOM 1874 CD LYS A 224 13.419 15.257 -23.803 1.00 17.36 C ATOM 1875 CE LYS A 224 14.495 14.682 -24.743 1.00 22.15 C ATOM 1876 NZ LYS A 224 15.042 15.775 -25.588 1.00 23.68 N ATOM 1877 HZ1 LYS A 224 14.274 16.194 -26.151 1.00 0.00 H ATOM 1878 HZ2 LYS A 224 15.464 16.504 -24.979 1.00 0.00 H ATOM 1879 HZ3 LYS A 224 15.769 15.389 -26.224 1.00 0.00 H ATOM 1880 H LYS A 224 13.359 13.219 -19.646 1.00 0.00 H ATOM 1881 N PRO A 225 12.858 16.556 -18.770 1.00 10.00 N ATOM 1882 CA PRO A 225 12.258 17.168 -17.580 1.00 9.34 C ATOM 1883 C PRO A 225 10.942 17.808 -17.890 1.00 9.30 C ATOM 1884 O PRO A 225 10.627 18.285 -18.987 1.00 9.74 O ATOM 1885 CB PRO A 225 13.287 18.228 -17.182 1.00 9.62 C ATOM 1886 CG PRO A 225 14.621 17.644 -17.611 1.00 11.32 C ATOM 1887 CD PRO A 225 14.250 17.031 -18.926 1.00 10.70 C ATOM 1888 N GLY A 226 10.112 17.920 -16.833 1.00 8.84 N ATOM 1889 CA GLY A 226 8.897 18.708 -16.959 1.00 8.14 C ATOM 1890 C GLY A 226 9.202 20.175 -17.018 1.00 7.41 C ATOM 1891 O GLY A 226 10.129 20.664 -16.414 1.00 8.39 O ATOM 1892 H GLY A 226 10.339 17.447 -15.935 1.00 0.00 H ATOM 1893 N ILE A 227 8.387 20.908 -17.785 1.00 7.73 N ATOM 1894 CA ILE A 227 8.504 22.320 -17.986 1.00 8.83 C ATOM 1895 C ILE A 227 7.259 23.000 -17.459 1.00 7.94 C ATOM 1896 O ILE A 227 6.139 22.569 -17.720 1.00 9.16 O ATOM 1897 CB ILE A 227 8.688 22.691 -19.478 1.00 9.66 C ATOM 1898 CG1 ILE A 227 9.965 22.023 -20.012 1.00 11.52 C ATOM 1899 CG2 ILE A 227 8.803 24.174 -19.701 1.00 11.64 C ATOM 1900 CD1 ILE A 227 10.175 22.135 -21.500 1.00 11.99 C ATOM 1901 H ILE A 227 7.611 20.415 -18.271 1.00 0.00 H ATOM 1902 N TYR A 228 7.511 24.094 -16.737 1.00 7.77 N ATOM 1903 CA TYR A 228 6.424 24.855 -16.079 1.00 7.41 C ATOM 1904 C TYR A 228 6.622 26.334 -16.319 1.00 8.81 C ATOM 1905 O TYR A 228 7.768 26.830 -16.211 1.00 8.77 O ATOM 1906 CB TYR A 228 6.423 24.531 -14.569 1.00 8.08 C ATOM 1907 CG TYR A 228 6.374 23.051 -14.266 1.00 7.39 C ATOM 1908 CD1 TYR A 228 7.499 22.223 -14.381 1.00 8.45 C ATOM 1909 CD2 TYR A 228 5.184 22.428 -13.977 1.00 7.58 C ATOM 1910 CE1 TYR A 228 7.415 20.870 -14.176 1.00 8.19 C ATOM 1911 CE2 TYR A 228 5.109 21.055 -13.764 1.00 7.94 C ATOM 1912 CZ TYR A 228 6.225 20.295 -13.891 1.00 8.75 C ATOM 1913 OH TYR A 228 6.118 18.909 -13.715 1.00 8.66 O ATOM 1914 HH TYR A 228 7.008 18.492 -13.837 1.00 0.00 H ATOM 1915 H TYR A 228 8.493 24.420 -16.634 1.00 0.00 H ATOM 1916 N THR A 229 5.572 27.043 -16.705 1.00 8.76 N ATOM 1917 CA THR A 229 5.715 28.487 -16.965 1.00 9.35 C ATOM 1918 C THR A 229 5.763 29.262 -15.670 1.00 8.87 C ATOM 1919 O THR A 229 4.932 29.006 -14.798 1.00 8.48 O ATOM 1920 CB THR A 229 4.522 28.906 -17.806 1.00 9.50 C ATOM 1921 OG1 THR A 229 4.450 28.089 -18.965 1.00 11.17 O ATOM 1922 CG2 THR A 229 4.654 30.404 -18.178 1.00 9.34 C ATOM 1923 HG1 THR A 229 5.280 28.194 -19.494 1.00 0.00 H ATOM 1924 H THR A 229 4.648 26.582 -16.825 1.00 0.00 H ATOM 1925 N ARG A 230 6.753 30.144 -15.472 1.00 8.63 N ATOM 1926 CA ARG A 230 6.913 30.833 -14.245 1.00 8.77 C ATOM 1927 C ARG A 230 5.918 31.998 -14.176 1.00 9.75 C ATOM 1928 O ARG A 230 6.039 33.021 -14.917 1.00 10.68 O ATOM 1929 CB ARG A 230 8.322 31.411 -14.081 1.00 9.26 C ATOM 1930 CG ARG A 230 9.352 30.284 -13.958 1.00 10.64 C ATOM 1931 CD ARG A 230 10.771 30.818 -13.796 1.00 10.52 C ATOM 1932 NE ARG A 230 10.918 31.641 -12.643 1.00 12.34 N ATOM 1933 CZ ARG A 230 10.929 32.955 -12.546 1.00 13.08 C ATOM 1934 NH1 ARG A 230 11.048 33.675 -13.677 1.00 13.63 N ATOM 1935 NH2 ARG A 230 10.802 33.544 -11.362 1.00 12.41 N ATOM 1936 HE ARG A 230 11.034 31.129 -11.745 1.00 0.00 H ATOM 1937 HH12 ARG A 230 11.060 34.714 -13.633 1.00 0.00 H ATOM 1938 HH11 ARG A 230 11.128 33.192 -14.595 1.00 0.00 H ATOM 1939 HH22 ARG A 230 10.812 34.582 -11.294 1.00 0.00 H ATOM 1940 HH21 ARG A 230 10.693 32.967 -10.503 1.00 0.00 H ATOM 1941 H ARG A 230 7.425 30.328 -16.244 1.00 0.00 H ATOM 1942 N VAL A 231 4.948 31.947 -13.266 1.00 9.11 N ATOM 1943 CA VAL A 231 3.914 32.978 -13.201 1.00 9.17 C ATOM 1944 C VAL A 231 4.459 34.342 -12.891 1.00 9.79 C ATOM 1945 O VAL A 231 3.939 35.354 -13.376 1.00 10.19 O ATOM 1946 CB VAL A 231 2.773 32.582 -12.254 1.00 10.56 C ATOM 1947 CG1 VAL A 231 2.135 31.334 -12.791 1.00 11.09 C ATOM 1948 CG2 VAL A 231 3.240 32.420 -10.809 1.00 11.29 C ATOM 1949 H VAL A 231 4.925 31.158 -12.588 1.00 0.00 H ATOM 1950 N ALA A 232 5.503 34.440 -12.150 1.00 9.92 N ATOM 1951 CA ALA A 232 6.049 35.712 -11.718 1.00 10.89 C ATOM 1952 C ALA A 232 6.502 36.522 -12.905 1.00 12.65 C ATOM 1953 O ALA A 232 6.388 37.749 -12.861 1.00 15.76 O ATOM 1954 CB ALA A 232 7.224 35.545 -10.765 1.00 11.35 C ATOM 1955 H ALA A 232 5.979 33.567 -11.846 1.00 0.00 H ATOM 1956 N SER A 233 6.870 35.835 -13.961 1.00 10.88 N ATOM 1957 CA SER A 233 7.350 36.510 -15.190 1.00 12.57 C ATOM 1958 C SER A 233 6.215 37.245 -15.915 1.00 14.33 C ATOM 1959 O SER A 233 6.480 38.006 -16.847 1.00 15.94 O ATOM 1960 CB SER A 233 7.982 35.514 -16.151 1.00 14.97 C ATOM 1961 OG SER A 233 9.079 34.869 -15.608 1.00 17.94 O ATOM 1962 HG SER A 233 9.768 35.538 -15.368 1.00 0.00 H ATOM 1963 H SER A 233 6.824 34.796 -13.935 1.00 0.00 H ATOM 1964 N TYR A 234 4.940 36.946 -15.566 1.00 11.40 N ATOM 1965 CA TYR A 234 3.751 37.352 -16.334 1.00 10.41 C ATOM 1966 C TYR A 234 2.836 38.211 -15.470 1.00 9.62 C ATOM 1967 O TYR A 234 1.664 38.405 -15.815 1.00 10.59 O ATOM 1968 CB TYR A 234 3.037 36.073 -16.871 1.00 10.79 C ATOM 1969 CG TYR A 234 3.832 35.400 -17.900 1.00 10.38 C ATOM 1970 CD1 TYR A 234 3.882 35.842 -19.204 1.00 11.28 C ATOM 1971 CD2 TYR A 234 4.693 34.366 -17.577 1.00 10.71 C ATOM 1972 CE1 TYR A 234 4.690 35.292 -20.135 1.00 11.58 C ATOM 1973 CE2 TYR A 234 5.484 33.811 -18.468 1.00 11.95 C ATOM 1974 CZ TYR A 234 5.531 34.239 -19.811 1.00 11.72 C ATOM 1975 OH TYR A 234 6.343 33.665 -20.715 1.00 12.94 O ATOM 1976 HH TYR A 234 6.225 34.109 -21.592 1.00 0.00 H ATOM 1977 H TYR A 234 4.791 36.393 -14.698 1.00 0.00 H ATOM 1978 N ALA A 235 3.315 38.821 -14.386 1.00 12.78 N ATOM 1979 CA ALA A 235 2.478 39.602 -13.494 1.00 14.16 C ATOM 1980 C ALA A 235 1.791 40.736 -14.219 1.00 12.90 C ATOM 1981 O ALA A 235 0.548 40.944 -13.981 1.00 14.25 O ATOM 1982 CB ALA A 235 3.348 40.143 -12.378 1.00 14.73 C ATOM 1983 H ALA A 235 4.329 38.734 -14.171 1.00 0.00 H ATOM 1984 N ALA A 236 2.521 41.454 -15.079 1.00 13.45 N ATOM 1985 CA ALA A 236 1.849 42.598 -15.725 1.00 15.64 C ATOM 1986 C ALA A 236 0.658 42.182 -16.602 1.00 13.96 C ATOM 1987 O ALA A 236 -0.385 42.855 -16.642 1.00 14.48 O ATOM 1988 CB ALA A 236 2.887 43.409 -16.493 1.00 16.14 C ATOM 1989 H ALA A 236 3.513 41.218 -15.283 1.00 0.00 H ATOM 1990 N TRP A 237 0.794 41.079 -17.344 1.00 10.89 N ATOM 1991 CA TRP A 237 -0.209 40.577 -18.197 1.00 10.32 C ATOM 1992 C TRP A 237 -1.477 40.225 -17.339 1.00 11.62 C ATOM 1993 O TRP A 237 -2.593 40.627 -17.652 1.00 11.38 O ATOM 1994 CB TRP A 237 0.243 39.391 -19.036 1.00 9.99 C ATOM 1995 CG TRP A 237 -0.761 38.806 -19.832 1.00 10.29 C ATOM 1996 CD1 TRP A 237 -1.488 39.405 -20.886 1.00 10.60 C ATOM 1997 CD2 TRP A 237 -1.365 37.485 -19.759 1.00 10.44 C ATOM 1998 NE1 TRP A 237 -2.402 38.587 -21.401 1.00 11.86 N ATOM 1999 CE2 TRP A 237 -2.344 37.369 -20.734 1.00 10.08 C ATOM 2000 CE3 TRP A 237 -1.124 36.345 -18.905 1.00 11.71 C ATOM 2001 CZ2 TRP A 237 -3.153 36.228 -20.901 1.00 11.23 C ATOM 2002 CZ3 TRP A 237 -1.848 35.250 -19.107 1.00 10.78 C ATOM 2003 CH2 TRP A 237 -2.834 35.146 -20.080 1.00 10.85 C ATOM 2004 HE1 TRP A 237 -3.054 38.821 -22.177 1.00 0.00 H ATOM 2005 H TRP A 237 1.694 40.560 -17.289 1.00 0.00 H ATOM 2006 N ILE A 238 -1.238 39.383 -16.285 1.00 11.08 N ATOM 2007 CA ILE A 238 -2.393 38.986 -15.488 1.00 10.48 C ATOM 2008 C ILE A 238 -3.054 40.237 -14.897 1.00 9.79 C ATOM 2009 O ILE A 238 -4.313 40.387 -14.984 1.00 11.32 O ATOM 2010 CB ILE A 238 -1.901 38.008 -14.392 1.00 10.58 C ATOM 2011 CG1 ILE A 238 -1.399 36.754 -14.989 1.00 12.17 C ATOM 2012 CG2 ILE A 238 -3.086 37.709 -13.433 1.00 11.85 C ATOM 2013 CD1 ILE A 238 -0.583 35.887 -14.038 1.00 12.43 C ATOM 2014 H ILE A 238 -0.280 39.044 -16.064 1.00 0.00 H ATOM 2015 N ASP A 239 -2.269 41.121 -14.320 1.00 9.27 N ATOM 2016 CA ASP A 239 -2.876 42.313 -13.692 1.00 10.87 C ATOM 2017 C ASP A 239 -3.694 43.139 -14.724 1.00 10.78 C ATOM 2018 O ASP A 239 -4.775 43.623 -14.439 1.00 6.67 O ATOM 2019 CB ASP A 239 -1.833 43.194 -13.060 1.00 12.89 C ATOM 2020 CG ASP A 239 -1.231 42.641 -11.758 1.00 14.21 C ATOM 2021 OD1 ASP A 239 -1.819 41.655 -11.211 1.00 15.42 O ATOM 2022 OD2 ASP A 239 -0.186 43.178 -11.386 1.00 16.73 O ATOM 2023 H ASP A 239 -1.238 40.983 -14.306 1.00 0.00 H ATOM 2024 N SER A 240 -3.105 43.306 -15.931 1.00 9.47 N ATOM 2025 CA SER A 240 -3.793 44.145 -16.949 1.00 9.25 C ATOM 2026 C SER A 240 -5.043 43.528 -17.491 1.00 10.56 C ATOM 2027 O SER A 240 -6.041 44.239 -17.581 1.00 10.97 O ATOM 2028 CB SER A 240 -2.846 44.492 -18.121 1.00 7.68 C ATOM 2029 OG SER A 240 -1.739 45.240 -17.634 1.00 6.60 O ATOM 2030 HG SER A 240 -1.249 44.703 -16.962 1.00 0.00 H ATOM 2031 H SER A 240 -2.191 42.857 -16.142 1.00 0.00 H ATOM 2032 N VAL A 241 -5.036 42.220 -17.796 1.00 11.58 N ATOM 2033 CA VAL A 241 -6.265 41.522 -18.251 1.00 11.35 C ATOM 2034 C VAL A 241 -7.384 41.671 -17.194 1.00 11.72 C ATOM 2035 O VAL A 241 -8.524 42.071 -17.494 1.00 11.52 O ATOM 2036 CB VAL A 241 -6.014 40.054 -18.574 1.00 11.83 C ATOM 2037 CG1 VAL A 241 -7.294 39.334 -18.799 1.00 12.73 C ATOM 2038 CG2 VAL A 241 -5.090 39.965 -19.810 1.00 12.02 C ATOM 2039 H VAL A 241 -4.149 41.684 -17.712 1.00 0.00 H ATOM 2040 N LEU A 242 -7.048 41.447 -15.948 1.00 11.88 N ATOM 2041 CA LEU A 242 -8.073 41.539 -14.875 1.00 12.56 C ATOM 2042 C LEU A 242 -8.538 42.977 -14.679 1.00 11.47 C ATOM 2043 O LEU A 242 -9.753 43.226 -14.523 1.00 13.77 O ATOM 2044 CB LEU A 242 -7.499 40.978 -13.553 1.00 12.47 C ATOM 2045 CG LEU A 242 -7.695 39.433 -13.376 1.00 14.11 C ATOM 2046 CD1 LEU A 242 -7.160 38.600 -14.472 1.00 13.56 C ATOM 2047 CD2 LEU A 242 -7.065 39.146 -12.057 1.00 14.96 C ATOM 2048 H LEU A 242 -6.065 41.205 -15.709 1.00 0.00 H ATOM 2049 N ALA A 243 -7.617 43.931 -14.808 1.00 12.35 N ATOM 2050 CA ALA A 243 -7.967 45.346 -14.548 1.00 12.31 C ATOM 2051 C ALA A 243 -8.863 45.806 -15.676 1.00 13.56 C ATOM 2052 O ALA A 243 -9.808 46.536 -15.419 1.00 15.60 O ATOM 2053 CB ALA A 243 -6.747 46.245 -14.450 1.00 12.58 C ATOM 2054 H ALA A 243 -6.648 43.681 -15.092 1.00 0.00 H ATOM 2055 N SER A 244 -8.596 45.387 -16.925 1.00 13.71 N ATOM 2056 CA SER A 244 -9.452 45.817 -18.050 1.00 15.60 C ATOM 2057 C SER A 244 -10.871 45.347 -17.801 1.00 16.07 C ATOM 2058 O SER A 244 -11.847 46.021 -18.064 1.00 15.73 O ATOM 2059 CB SER A 244 -9.060 45.211 -19.385 1.00 18.81 C ATOM 2060 OG SER A 244 -7.708 45.361 -19.677 1.00 23.67 O ATOM 2061 HG SER A 244 -7.169 44.917 -18.976 1.00 0.00 H ATOM 2062 H SER A 244 -7.786 44.759 -17.100 1.00 0.00 H ATOM 2063 N ALA A 245 -11.011 44.081 -17.398 1.00 14.52 N ATOM 2064 CA ALA A 245 -12.357 43.533 -17.194 1.00 14.89 C ATOM 2065 C ALA A 245 -13.105 44.161 -16.079 1.00 15.91 C ATOM 2066 O ALA A 245 -14.365 44.141 -16.133 1.00 18.51 O ATOM 2067 CB ALA A 245 -12.272 41.995 -17.050 1.00 17.03 C ATOM 2068 H ALA A 245 -10.173 43.489 -17.230 1.00 0.00 H ATOM 2069 N ALA A 246 -12.423 44.697 -15.108 1.00 15.93 N ATOM 2070 CA ALA A 246 -12.983 45.362 -13.954 1.00 18.81 C ATOM 2071 C ALA A 246 -13.373 46.821 -14.244 1.00 22.50 C ATOM 2072 O ALA A 246 -13.989 47.422 -13.369 1.00 25.94 O ATOM 2073 CB ALA A 246 -12.033 45.346 -12.851 1.00 17.94 C ATOM 2074 H ALA A 246 -11.386 44.642 -15.168 1.00 0.00 H ATOM 2075 N ALA A 247 -13.049 47.345 -15.410 1.00 20.33 N ATOM 2076 CA ALA A 247 -13.351 48.723 -15.703 1.00 25.31 C ATOM 2077 C ALA A 247 -14.889 48.894 -15.888 1.00 22.81 C ATOM 2078 O ALA A 247 -15.214 50.083 -15.851 1.00 34.74 O ATOM 2079 CB ALA A 247 -12.586 49.142 -16.937 1.00 21.68 C ATOM 2080 H ALA A 247 -12.572 46.759 -16.124 1.00 0.00 H TER 2081 ALA A 247 HETATM 2082 O HOH 1 27.629 20.559 -18.397 1.00 31.79 O HETATM 2083 O HOH 2 -24.106 26.752 -20.349 1.00 37.37 O HETATM 2084 O HOH 3 -2.939 16.145 -27.180 1.00 38.38 O HETATM 2085 O HOH 4 19.304 20.731 -10.080 1.00 27.61 O HETATM 2086 O HOH 5 -12.088 37.445 -3.107 1.00 46.84 O HETATM 2087 O HOH 6 -10.846 9.674 -1.625 1.00 30.97 O HETATM 2088 O HOH 7 -12.781 8.589 -7.147 1.00 28.06 O HETATM 2089 O HOH 8 -0.360 30.785 -0.196 1.00 35.04 O HETATM 2090 O HOH 9 22.299 15.690 -17.651 1.00 45.58 O HETATM 2091 O HOH 10 -0.976 9.321 -25.779 1.00 37.22 O HETATM 2092 O HOH 11 6.407 40.546 -10.682 1.00 38.98 O HETATM 2093 O HOH 12 -1.094 36.426 -30.545 1.00 52.78 O HETATM 2094 O HOH 13 -14.619 40.630 -8.667 1.00 41.20 O HETATM 2095 O HOH 14 5.638 32.036 -28.779 1.00 27.17 O HETATM 2096 O HOH 15 18.014 32.946 -11.629 1.00 37.25 O HETATM 2097 O HOH 16 11.037 9.969 -8.058 1.00 30.84 O HETATM 2098 O HOH 17 -17.543 35.565 -5.282 1.00 17.85 O HETATM 2099 O HOH 18 7.022 40.205 -13.116 1.00 30.45 O HETATM 2100 O HOH 19 -18.231 40.244 -12.218 1.00 34.52 O HETATM 2101 O HOH 20 -21.193 32.022 -8.208 1.00 31.08 O HETATM 2102 O HOH 21 -18.802 28.164 -21.541 1.00 23.11 O HETATM 2103 O HOH 22 -4.809 37.787 -25.868 1.00 19.20 O HETATM 2104 O HOH 23 -23.442 25.423 -12.261 1.00 24.81 O HETATM 2105 O HOH 24 6.307 7.209 -14.997 1.00 21.36 O HETATM 2106 O HOH 25 1.815 38.861 -30.354 1.00 31.39 O HETATM 2107 O HOH 26 -3.441 23.301 -0.152 1.00 21.04 O HETATM 2108 O HOH 27 5.405 4.965 -11.433 1.00 39.29 O HETATM 2109 O HOH 28 -21.966 29.465 -15.320 1.00 22.41 O HETATM 2110 O HOH 29 -16.374 12.390 -4.152 1.00 22.03 O HETATM 2111 O HOH 30 -2.475 10.710 -0.469 1.00 19.27 O HETATM 2112 O HOH 31 6.306 36.477 -2.668 1.00 32.44 O HETATM 2113 O HOH 32 -14.576 10.052 -13.842 1.00 21.48 O HETATM 2114 O HOH 33 17.001 18.825 -8.739 1.00 15.73 O HETATM 2115 O HOH 34 -8.573 45.983 -22.641 1.00 15.46 O HETATM 2116 O HOH 35 12.919 16.654 -26.858 1.00 36.79 O HETATM 2117 O HOH 36 -18.013 27.748 -6.469 1.00 10.35 O HETATM 2118 O HOH 37 14.031 21.559 -26.851 1.00 37.72 O HETATM 2119 O HOH 38 -1.539 24.053 -1.859 1.00 19.73 O HETATM 2120 O HOH 39 3.106 29.410 -27.072 1.00 16.82 O HETATM 2121 O HOH 40 -11.774 24.561 -6.856 1.00 11.73 O HETATM 2122 O HOH 41 21.188 19.091 -11.561 1.00 30.59 O HETATM 2123 O HOH 42 1.679 36.353 -3.958 1.00 31.04 O HETATM 2124 O HOH 43 11.005 14.671 -26.198 1.00 29.14 O HETATM 2125 O HOH 44 -9.826 41.707 -19.920 1.00 21.34 O HETATM 2126 O HOH 45 -5.706 20.260 -26.446 1.00 33.15 O HETATM 2127 O HOH 46 -1.936 8.255 -8.499 1.00 19.66 O HETATM 2128 O HOH 47 1.147 44.885 -12.922 1.00 29.90 O HETATM 2129 O HOH 48 7.620 29.797 -3.416 1.00 20.52 O HETATM 2130 O HOH 49 23.608 18.474 -14.046 1.00 23.33 O HETATM 2131 O HOH 50 -6.618 33.535 -1.785 1.00 27.52 O HETATM 2132 O HOH 51 11.102 36.647 -15.790 1.00 20.51 O HETATM 2133 O HOH 52 27.860 18.324 -15.042 1.00 18.01 O HETATM 2134 O HOH 53 -1.131 27.801 -28.201 1.00 27.03 O HETATM 2135 O HOH 54 -5.968 20.192 -30.375 1.00 47.43 O HETATM 2136 O HOH 55 9.710 31.537 -22.633 1.00 16.06 O HETATM 2137 O HOH 56 9.700 40.456 -13.496 1.00 29.80 O HETATM 2138 O HOH 57 -0.403 7.069 -23.035 1.00 22.54 O HETATM 2139 O HOH 58 -18.879 12.180 -3.066 1.00 18.34 O HETATM 2140 O HOH 59 -10.591 7.213 -4.047 1.00 40.45 O HETATM 2141 O HOH 60 14.551 25.392 -13.959 1.00 18.97 O HETATM 2142 O HOH 61 -6.661 15.817 -21.752 1.00 13.99 O HETATM 2143 O HOH 62 -6.783 6.517 -2.526 1.00 40.27 O HETATM 2144 O HOH 63 -9.265 23.544 1.546 1.00 16.95 O HETATM 2145 O HOH 64 11.596 28.389 -25.535 1.00 19.45 O HETATM 2146 O HOH 65 2.163 6.365 -12.351 1.00 19.62 O HETATM 2147 O HOH 66 13.941 12.708 -8.714 1.00 22.06 O HETATM 2148 O HOH 67 0.384 21.906 -1.789 1.00 16.75 O HETATM 2149 O HOH 68 -9.834 48.568 -13.640 1.00 27.16 O HETATM 2150 O HOH 69 7.325 31.203 -21.236 1.00 13.12 O HETATM 2151 O HOH 70 5.812 39.281 -23.816 1.00 30.68 O HETATM 2152 O HOH 71 -15.992 46.093 -12.131 1.00 55.23 O HETATM 2153 O HOH 72 12.758 19.156 -25.735 1.00 27.73 O HETATM 2154 O HOH 73 -3.651 12.676 -12.308 1.00 8.59 O HETATM 2155 O HOH 74 17.795 30.471 -21.144 1.00 32.45 O HETATM 2156 O HOH 75 -4.511 34.781 -6.450 1.00 14.22 O HETATM 2157 O HOH 76 -8.893 5.150 -13.440 1.00 18.45 O HETATM 2158 O HOH 77 -3.343 19.936 -13.535 1.00 6.09 O HETATM 2159 O HOH 78 -12.372 21.687 -9.050 1.00 7.30 O HETATM 2160 O HOH 79 14.816 9.996 -8.823 1.00 39.00 O HETATM 2161 O HOH 80 10.434 13.339 -11.160 1.00 13.13 O HETATM 2162 O HOH 81 -22.110 23.251 -5.069 1.00 17.69 O HETATM 2163 O HOH 82 19.811 24.774 -4.609 1.00 27.16 O HETATM 2164 O HOH 83 22.515 24.391 -20.645 1.00 23.52 O HETATM 2165 O HOH 84 0.846 28.045 -26.394 1.00 19.25 O HETATM 2166 O HOH 85 -4.838 37.101 -9.619 1.00 27.61 O HETATM 2167 O HOH 86 -18.988 25.819 -4.694 1.00 10.25 O HETATM 2168 O HOH 87 -6.289 37.904 -7.746 1.00 30.93 O HETATM 2169 O HOH 88 -4.375 41.722 -10.233 1.00 23.86 O HETATM 2170 O HOH 89 -16.562 16.334 -14.371 1.00 14.94 O HETATM 2171 O HOH 90 0.020 8.881 -10.101 1.00 14.07 O HETATM 2172 O HOH 91 -6.083 8.869 -21.991 1.00 18.26 O HETATM 2173 O HOH 92 -9.294 12.219 -15.415 1.00 11.34 O HETATM 2174 O HOH 93 -11.456 41.358 -13.452 1.00 17.07 O HETATM 2175 O HOH 94 15.633 17.299 -4.142 1.00 15.08 O HETATM 2176 O HOH 95 -6.299 18.417 -2.690 1.00 6.92 O HETATM 2177 O HOH 96 8.337 17.269 -14.029 1.00 8.75 O HETATM 2178 O HOH 97 -10.532 21.223 -6.113 1.00 8.00 O HETATM 2179 O HOH 98 5.320 29.129 -21.360 1.00 11.14 O HETATM 2180 O HOH 99 -1.398 13.270 -0.124 1.00 14.13 O HETATM 2181 O HOH 100 -22.012 14.116 -1.710 1.00 13.95 O HETATM 2182 O HOH 101 -21.789 37.787 -14.402 1.00 44.53 O HETATM 2183 O HOH 102 13.147 25.682 -1.008 1.00 13.32 O HETATM 2184 O HOH 103 6.965 32.164 -10.834 1.00 11.34 O HETATM 2185 O HOH 104 -12.183 39.979 -6.798 1.00 52.68 O HETATM 2186 O HOH 105 -5.593 43.701 -11.806 1.00 16.57 O HETATM 2187 O HOH 106 -22.600 28.295 -13.031 1.00 25.06 O HETATM 2188 O HOH 107 15.998 7.910 -19.527 1.00 29.60 O HETATM 2189 O HOH 108 -11.561 43.727 -20.784 1.00 22.20 O HETATM 2190 O HOH 109 8.524 18.556 -20.814 1.00 14.64 O HETATM 2191 O HOH 110 -14.541 39.782 -11.287 1.00 18.35 O HETATM 2192 O HOH 111 -13.916 16.615 -25.023 1.00 30.58 O HETATM 2193 O HOH 112 -23.352 31.175 -19.566 1.00 37.18 O HETATM 2194 O HOH 113 -1.993 34.899 -28.783 1.00 35.03 O HETATM 2195 O HOH 114 -9.031 8.280 -8.885 1.00 18.50 O HETATM 2196 O HOH 115 -17.276 18.906 -1.059 1.00 10.80 O HETATM 2197 O HOH 116 4.840 10.002 -4.929 1.00 21.13 O HETATM 2198 O HOH 117 6.326 19.267 -19.126 1.00 16.57 O HETATM 2199 O HOH 118 11.964 31.986 -27.019 1.00 35.02 O HETATM 2200 O HOH 119 -14.516 17.348 -27.506 1.00 34.01 O HETATM 2201 O HOH 120 9.996 13.483 -6.625 1.00 12.51 O HETATM 2202 O HOH 121 8.360 15.748 -18.614 1.00 10.71 O HETATM 2203 O HOH 122 6.122 30.604 0.796 1.00 28.49 O HETATM 2204 O HOH 123 4.540 38.702 -21.005 1.00 18.52 O HETATM 2205 O HOH 124 -22.518 19.885 -8.037 1.00 22.42 O HETATM 2206 O HOH 125 -4.670 7.271 -6.206 1.00 25.87 O HETATM 2207 O HOH 126 -5.459 29.398 -26.431 1.00 23.59 O HETATM 2208 O HOH 127 -22.566 13.337 -9.689 1.00 26.79 O HETATM 2209 O HOH 128 -19.729 32.218 -0.444 1.00 22.22 O HETATM 2210 O HOH 129 -2.150 11.838 -26.882 1.00 35.73 O HETATM 2211 O HOH 130 -9.911 15.339 -22.765 1.00 28.96 O HETATM 2212 O HOH 131 -0.810 16.540 0.746 1.00 11.51 O HETATM 2213 O HOH 132 10.460 40.785 -8.772 1.00 21.97 O HETATM 2214 O HOH 133 -15.671 42.057 -17.506 1.00 39.59 O HETATM 2215 O HOH 134 -0.218 37.628 -6.321 1.00 28.17 O HETATM 2216 O HOH 135 1.946 26.794 -19.009 1.00 11.83 O HETATM 2217 O HOH 136 -2.895 39.221 -7.250 1.00 32.32 O HETATM 2218 O HOH 137 -16.992 27.645 -24.957 1.00 26.93 O HETATM 2219 O HOH 138 8.533 35.377 -27.521 1.00 29.82 O HETATM 2220 O HOH 139 -15.708 15.148 -1.286 1.00 11.31 O HETATM 2221 O HOH 140 -5.457 22.259 2.825 1.00 22.00 O HETATM 2222 O HOH 141 -0.602 44.854 -9.150 1.00 33.14 O HETATM 2223 O HOH 142 8.388 32.947 -28.548 1.00 29.53 O HETATM 2224 O HOH 143 -9.894 13.361 -19.356 1.00 21.52 O HETATM 2225 O HOH 144 -7.403 7.875 -6.439 1.00 21.22 O HETATM 2226 O HOH 145 5.398 19.809 -16.965 1.00 34.40 O HETATM 2227 O HOH 146 -5.569 18.452 -14.366 1.00 7.00 O HETATM 2228 O HOH 147 16.780 15.889 -6.478 1.00 24.68 O HETATM 2229 O HOH 148 -12.200 21.631 -3.831 1.00 6.83 O HETATM 2230 O HOH 149 -10.825 37.724 -6.216 1.00 24.66 O HETATM 2231 O HOH 150 -25.615 27.885 -18.878 1.00 21.27 O HETATM 2232 O HOH 151 1.983 25.765 -27.864 1.00 35.65 O HETATM 2233 O HOH 152 13.930 35.786 -12.778 1.00 24.34 O HETATM 2234 O HOH 153 22.579 24.456 -23.710 1.00 33.60 O HETATM 2235 O HOH 154 8.321 23.916 -1.413 1.00 10.54 O HETATM 2236 O HOH 155 -13.734 13.734 -17.779 1.00 14.82 O HETATM 2237 O HOH 156 9.532 12.777 -19.575 1.00 9.71 O HETATM 2238 O HOH 157 -18.022 27.363 -2.511 1.00 9.77 O HETATM 2239 O HOH 158 -9.990 17.883 -4.451 1.00 6.58 O HETATM 2240 O HOH 159 23.591 22.498 -11.100 1.00 12.53 O HETATM 2241 O HOH 160 14.439 33.317 -14.108 1.00 17.56 O HETATM 2242 O HOH 161 -0.914 46.018 -14.989 1.00 29.36 O HETATM 2243 O HOH 162 10.402 32.186 -5.834 1.00 19.80 O HETATM 2244 O HOH 163 16.298 34.152 -10.202 1.00 23.59 O HETATM 2245 O HOH 164 17.682 27.290 -12.280 1.00 22.62 O HETATM 2246 O HOH 165 17.198 31.196 -6.630 1.00 38.41 O HETATM 2247 O HOH 166 13.647 28.996 -3.376 1.00 22.14 O HETATM 2248 O HOH 167 -2.978 7.394 -3.260 1.00 19.16 O HETATM 2249 O HOH 168 15.977 13.207 -12.633 1.00 30.84 O HETATM 2250 O HOH 169 3.835 42.304 -9.601 1.00 30.02 O HETATM 2251 O HOH 170 -19.972 16.182 -11.762 1.00 18.07 O HETATM 2252 O HOH 171 -18.142 34.205 -2.918 1.00 17.34 O HETATM 2253 O HOH 172 7.579 15.145 -27.687 1.00 39.22 O HETATM 2254 O HOH 173 13.443 8.025 -16.116 1.00 21.91 O HETATM 2255 O HOH 174 -14.305 25.257 -31.530 1.00 39.36 O HETATM 2256 O HOH 175 10.357 34.749 -5.355 1.00 24.38 O HETATM 2257 O HOH 176 -0.816 21.380 -5.400 1.00 18.89 O HETATM 2258 O HOH 177 -17.380 21.509 -21.068 1.00 17.52 O HETATM 2259 O HOH 178 -8.390 20.033 -3.898 1.00 6.91 O HETATM 2260 O HOH 179 -16.560 25.829 -0.539 1.00 10.08 O HETATM 2261 O HOH 180 1.058 12.696 1.464 1.00 18.39 O HETATM 2262 O HOH 181 -14.709 46.460 -18.504 1.00 29.25 O HETATM 2263 O HOH 182 -9.131 5.914 -18.579 1.00 19.40 O HETATM 2264 O HOH 183 -20.737 37.782 -10.872 1.00 34.75 O HETATM 2265 O HOH 184 15.580 34.050 -21.044 1.00 28.07 O HETATM 2266 O HOH 185 -1.408 26.864 -0.844 1.00 19.02 O HETATM 2267 O HOH 186 9.237 38.791 -17.491 1.00 39.44 O HETATM 2268 O HOH 187 -7.117 13.166 -18.141 1.00 18.23 O HETATM 2269 O HOH 188 14.590 14.766 -14.902 1.00 15.22 O HETATM 2270 O HOH 189 -13.437 34.173 -25.684 1.00 24.27 O HETATM 2271 O HOH 190 -3.673 1.902 -23.712 1.00 15.21 O HETATM 2272 O HOH 191 4.174 37.443 -4.269 1.00 20.13 O HETATM 2273 O HOH 192 -6.227 28.816 -1.923 1.00 21.31 O HETATM 2274 O HOH 193 19.422 30.509 -15.291 1.00 27.41 O HETATM 2275 O HOH 194 -10.186 37.039 -25.750 1.00 37.53 O HETATM 2276 O HOH 195 20.943 27.228 -13.747 1.00 17.10 O HETATM 2277 O HOH 196 5.988 20.899 -1.544 1.00 12.28 O HETATM 2278 O HOH 197 -9.440 32.679 -27.182 1.00 34.18 O HETATM 2279 O HOH 198 4.553 12.775 -4.123 1.00 10.64 O HETATM 2280 O HOH 199 -14.493 41.260 -19.769 1.00 41.63 O HETATM 2281 O HOH 200 -12.264 38.314 -10.256 1.00 13.96 O HETATM 2282 O HOH 201 -22.070 17.381 -7.246 1.00 16.91 O HETATM 2283 O HOH 202 -1.132 2.331 -13.065 1.00 18.10 O HETATM 2284 O HOH 203 -10.197 6.322 -11.138 1.00 23.66 O HETATM 2285 O HOH 204 -8.578 6.748 -21.533 1.00 43.73 O HETATM 2286 O HOH 205 -19.131 39.483 -15.571 1.00 32.39 O HETATM 2287 O HOH 206 -14.797 9.782 -18.031 1.00 31.78 O HETATM 2288 O HOH 207 12.597 31.614 -4.584 1.00 35.80 O HETATM 2289 O HOH 208 -1.190 6.253 -6.859 1.00 26.00 O HETATM 2290 O HOH 209 -0.997 4.832 -11.401 1.00 24.09 O HETATM 2291 O HOH 210 9.523 27.219 -28.119 1.00 43.91 O HETATM 2292 O HOH 211 -4.994 4.826 -9.842 1.00 35.18 O HETATM 2293 O HOH 212 11.756 29.003 -10.725 1.00 22.67 O HETATM 2294 O HOH 213 19.296 28.929 -23.472 1.00 37.84 O HETATM 2295 O HOH 214 5.123 23.237 -0.500 1.00 22.85 O HETATM 2296 O HOH 215 6.768 6.575 -2.448 1.00 41.76 O HETATM 2297 O HOH 216 -10.144 27.799 1.646 1.00 34.98 O HETATM 2298 O HOH 217 -8.562 41.816 -22.362 1.00 28.73 O HETATM 2299 O HOH 218 5.208 40.923 -16.497 1.00 29.64 O HETATM 2300 O HOH 219 -6.536 4.067 -21.326 1.00 40.08 O HETATM 2301 O HOH 220 -19.865 14.586 -14.052 1.00 30.29 O HETATM 2302 O HOH 221 -4.139 39.614 -23.773 1.00 14.88 O HETATM 2303 O HOH 222 8.271 40.746 -19.845 1.00 45.48 O HETATM 2304 O HOH 223 3.427 17.783 -25.263 1.00 36.28 O HETATM 2305 O HOH 224 16.757 6.403 -10.814 1.00 39.26 O HETATM 2306 O HOH 225 2.334 23.836 -0.705 1.00 15.23 O HETATM 2307 O HOH 226 -5.830 13.503 -20.377 1.00 18.76 O HETATM 2308 O HOH 227 -11.084 24.152 -28.088 1.00 38.93 O HETATM 2309 O HOH 228 -2.277 38.695 -30.051 1.00 31.13 O HETATM 2310 O HOH 229 -12.087 9.610 -14.976 1.00 38.35 O HETATM 2311 O HOH 230 -2.542 18.881 1.741 1.00 23.00 O HETATM 2312 O HOH 231 -22.886 27.897 -5.485 1.00 22.85 O HETATM 2313 O HOH 232 -11.374 12.263 -17.179 1.00 14.20 O HETATM 2314 O HOH 233 -23.371 16.390 -2.605 1.00 18.35 O HETATM 2315 O HOH 234 -2.353 36.614 -5.917 1.00 22.74 O HETATM 2316 O HOH 235 18.437 9.146 -18.868 1.00 34.91 O HETATM 2317 O HOH 236 -24.127 17.343 -4.785 1.00 26.57 O HETATM 2318 O HOH 237 -15.970 14.536 -16.426 1.00 23.13 O HETATM 2319 O HOH 238 2.820 28.820 3.517 1.00 32.93 O HETATM 2320 O HOH 239 7.164 31.790 -1.623 1.00 42.15 O HETATM 2321 O HOH 240 1.113 7.309 -0.694 1.00 23.59 O HETATM 2322 O HOH 241 3.002 8.583 -28.971 1.00 33.56 O HETATM 2323 O HOH 242 18.855 11.719 -18.671 1.00 25.58 O HETATM 2324 O HOH 243 6.426 2.412 -19.180 1.00 25.03 O HETATM 2325 O HOH 244 -6.636 6.559 -10.007 1.00 30.88 O HETATM 2326 O HOH 245 8.417 5.596 -15.729 1.00 30.48 O HETATM 2327 O HOH 246 21.201 28.881 -16.251 1.00 29.76 O HETATM 2328 O HOH 247 16.932 33.801 -14.655 1.00 29.00 O HETATM 2329 O HOH 248 -6.504 11.398 -22.111 1.00 25.46 O HETATM 2330 O HOH 249 -24.180 22.980 -8.857 1.00 25.99 O HETATM 2331 O HOH 250 9.509 35.551 -2.596 1.00 39.91 O HETATM 2332 O HOH 251 9.722 5.532 -18.503 1.00 35.46 O HETATM 2333 O HOH 252 -4.625 25.612 0.918 1.00 29.26 O HETATM 2334 O HOH 253 12.270 10.965 -4.434 1.00 46.27 O HETATM 2335 O HOH 254 -1.505 21.160 0.451 1.00 19.83 O HETATM 2336 O HOH 255 -13.988 42.055 -12.995 1.00 24.69 O HETATM 2337 O HOH 256 -6.919 25.200 1.961 1.00 29.99 O HETATM 2338 O HOH 257 -8.283 44.073 -11.133 1.00 24.37 O HETATM 2339 O HOH 258 -21.185 15.823 -25.334 1.00 40.07 O HETATM 2340 O HOH 259 10.588 34.066 -23.189 1.00 23.53 O HETATM 2341 O HOH 260 21.309 27.071 -22.935 1.00 33.31 O HETATM 2342 O HOH 261 -2.294 8.479 -23.655 1.00 35.54 O HETATM 2343 O HOH 262 -10.371 42.188 -10.913 1.00 23.78 O HETATM 2344 O HOH 263 -14.839 12.233 -19.636 1.00 23.81 O HETATM 2345 O HOH 264 -4.111 43.072 -7.959 1.00 35.63 O HETATM 2346 O HOH 265 14.249 5.182 -22.042 1.00 33.20 O HETATM 2347 O HOH 266 19.145 19.020 -6.766 1.00 25.60 O HETATM 2348 O HOH 267 26.116 18.636 -12.852 1.00 17.62 O HETATM 2349 O HOH 268 17.026 15.075 -13.587 1.00 37.05 O HETATM 2350 O HOH 269 9.495 32.904 -1.545 1.00 49.33 O HETATM 2351 O HOH 270 -5.338 35.464 -3.834 1.00 28.51 O HETATM 2352 O HOH 271 -21.146 20.167 -10.758 1.00 21.88 O HETATM 2353 O HOH 272 -22.235 16.134 -9.796 1.00 28.82 O HETATM 2354 O HOH 273 11.286 12.619 -8.712 1.00 16.79 O HETATM 2355 O HOH 274 -4.323 10.619 1.510 1.00 22.98 O HETATM 2356 O HOH 275 1.714 4.404 -10.879 1.00 33.47 O HETATM 2357 O HOH 276 -16.410 11.568 -15.023 1.00 35.32 O HETATM 2358 O HOH 277 10.056 26.139 -1.086 1.00 16.43 O HETATM 2359 O HOH 278 -2.927 5.822 -9.772 1.00 33.06 O HETATM 2360 O HOH 279 -8.148 4.027 -20.117 1.00 40.86 O HETATM 2361 O HOH 280 13.705 29.798 -26.694 1.00 29.13 O HETATM 2362 O HOH 281 6.942 11.578 -28.224 1.00 34.29 O HETATM 2363 O HOH 282 12.743 35.143 -22.197 1.00 39.55 O HETATM 2364 O HOH 283 18.484 29.502 -5.448 1.00 38.24 O HETATM 2365 O HOH 284 -0.858 8.828 0.485 1.00 30.03 O HETATM 2366 O HOH 285 4.266 5.795 -13.741 1.00 26.21 O HETATM 2367 O HOH 286 -4.250 46.033 -11.073 1.00 26.71 O HETATM 2368 O HOH 287 -3.988 37.307 -28.573 1.00 27.91 O HETATM 2369 O HOH 288 -0.034 28.801 2.659 1.00 28.06 O HETATM 2370 O HOH 289 -14.855 43.826 -11.211 1.00 36.54 O HETATM 2371 O HOH 290 -21.644 25.839 -4.283 1.00 18.32 O HETATM 2372 O HOH 291 -8.966 46.528 -11.207 1.00 32.36 O HETATM 2373 O HOH 292 -5.191 33.107 0.355 1.00 35.57 O HETATM 2374 O HOH 293 -0.729 26.431 1.748 1.00 16.74 O HETATM 2375 O HOH 294 -10.288 3.321 -14.880 1.00 31.88 O HETATM 2376 O HOH 295 1.868 2.725 -12.950 1.00 26.86 O HETATM 2377 O HOH 296 -10.818 25.394 5.181 1.00 23.86 O HETATM 2378 O HOH 297 -20.656 34.131 -2.423 1.00 32.34 O HETATM 2379 O HOH 298 -3.130 30.605 0.357 1.00 33.09 O HETATM 2380 O HOH 299 -5.354 39.742 -8.896 1.00 31.87 O HETATM 2381 O HOH 300 10.130 28.259 -2.928 1.00 23.51 O HETATM 2382 O HOH 301 8.583 29.882 0.843 1.00 36.59 O HETATM 2383 O HOH 302 -7.601 37.992 -26.143 1.00 30.69 O HETATM 2384 O HOH 303 15.401 6.409 -17.080 1.00 39.53 O HETATM 2385 O HOH 304 17.075 32.382 -22.924 1.00 36.98 O HETATM 2386 O HOH 305 -13.298 10.966 -1.118 1.00 28.17 O HETATM 2387 O HOH 306 -10.426 40.070 -8.983 1.00 28.91 O HETATM 2388 O HOH 307 -12.874 7.222 -2.828 1.00 40.01 O HETATM 2389 O HOH 308 0.678 33.539 0.034 1.00 36.83 O HETATM 2390 O HOH 309 -3.169 23.286 3.993 1.00 31.16 O HETATM 2391 O HOH 310 -7.990 39.977 -7.969 1.00 32.49 O HETATM 2392 O HOH 311 -11.265 2.666 -19.649 1.00 46.41 O HETATM 2393 O HOH 312 2.042 35.007 -1.443 1.00 33.81 O HETATM 2394 O HOH 313 -4.302 27.279 -0.827 1.00 25.92 O HETATM 2395 O HOH 314 -19.818 40.661 -17.832 1.00 44.26 O HETATM 2396 O HOH 315 -12.388 43.376 -9.717 1.00 38.13 O HETATM 2397 O HOH 316 -1.291 35.190 0.600 1.00 48.27 O HETATM 2398 O HOH 317 -25.999 12.561 -3.201 1.00 29.03 O HETATM 2399 O HOH 318 -1.890 37.091 -0.947 1.00 43.93 O HETATM 2400 C3 E A 82 2.394 10.084 -24.352 1.00 0.07 C HETATM 2401 C15 E A 82 3.132 9.513 -23.223 1.00 -0.02 C HETATM 2402 C14 E A 82 4.491 9.118 -23.208 1.00 -0.04 C HETATM 2403 C11 E A 82 5.301 9.196 -24.462 1.00 -0.02 C HETATM 2404 C8 E A 82 4.699 10.063 -25.561 1.00 -0.04 C HETATM 2405 C5 E A 82 3.196 9.889 -25.662 1.00 -0.02 C HETATM 2406 H17 E A 82 2.823 10.619 -26.395 1.00 0.03 H HETATM 2407 H18 E A 82 3.000 8.870 -26.026 1.00 0.03 H HETATM 2408 H15 E A 82 5.154 9.784 -26.523 1.00 0.03 H HETATM 2409 H16 E A 82 4.920 11.118 -25.343 1.00 0.03 H HETATM 2410 H6 E A 82 5.418 8.176 -24.857 1.00 0.04 H HETATM 2411 H7 E A 82 6.289 9.606 -24.206 1.00 0.04 H HETATM 2412 C22 E A 82 5.029 8.601 -22.005 1.00 -0.07 C HETATM 2413 C20 E A 82 4.302 8.478 -20.856 1.00 -0.08 C HETATM 2414 C18 E A 82 2.982 8.821 -20.854 1.00 -0.08 C HETATM 2415 C16 E A 82 2.419 9.359 -22.019 1.00 -0.06 C HETATM 2416 H8 E A 82 1.382 9.672 -21.992 1.00 0.05 H HETATM 2417 H9 E A 82 2.378 8.680 -19.965 1.00 0.05 H HETATM 2418 H10 E A 82 4.771 8.110 -19.951 1.00 0.05 H HETATM 2419 H11 E A 82 6.067 8.288 -21.996 1.00 0.05 H HETATM 2420 N1 E A 82 2.147 11.570 -24.138 1.00 -0.27 N HETATM 2421 C24 E A 82 1.113 12.184 -24.615 1.00 0.21 C HETATM 2422 C26 E A 82 0.881 13.644 -24.273 1.00 0.05 C HETATM 2423 C27 E A 82 1.525 14.181 -23.131 1.00 -0.03 C HETATM 2424 C29 E A 82 1.262 15.517 -22.817 1.00 -0.01 C HETATM 2425 C30 E A 82 0.334 16.286 -23.494 1.00 -0.05 C HETATM 2426 C32 E A 82 -0.312 15.768 -24.630 1.00 -0.06 C HETATM 2427 C34 E A 82 -0.079 14.413 -24.931 1.00 -0.04 C HETATM 2428 H19 E A 82 -0.672 13.946 -25.709 1.00 0.07 H HETATM 2429 H20 E A 82 -0.959 16.383 -25.245 1.00 0.06 H HETATM 2430 H13 E A 82 0.105 17.288 -23.149 1.00 0.07 H HETATM 2431 C36 E A 82 1.946 16.174 -21.638 1.00 -0.02 C HETATM 2432 C44 E A 82 1.273 17.152 -20.841 1.00 -0.06 C HETATM 2433 C42 E A 82 1.844 17.702 -19.714 1.00 -0.07 C HETATM 2434 C40 E A 82 3.140 17.313 -19.348 1.00 -0.06 C HETATM 2435 C39 E A 82 3.799 16.335 -20.144 1.00 0.00 C HETATM 2436 C46 E A 82 5.160 15.828 -19.791 1.00 -0.00 C HETATM 2437 N49 E A 82 6.240 16.691 -20.321 1.00 0.23 N HETATM 2438 H23 E A 82 7.135 16.309 -20.058 1.00 0.20 H HETATM 2439 H24 E A 82 6.146 17.619 -19.940 1.00 0.20 H HETATM 2440 H25 E A 82 6.175 16.732 -21.326 1.00 0.20 H HETATM 2441 H4 E A 82 5.279 14.817 -20.208 1.00 0.10 H HETATM 2442 H5 E A 82 5.248 15.786 -18.695 1.00 0.10 H HETATM 2443 C37 E A 82 3.228 15.829 -21.289 1.00 -0.05 C HETATM 2444 H22 E A 82 3.794 15.153 -21.920 1.00 0.06 H HETATM 2445 H21 E A 82 3.627 17.746 -18.482 1.00 0.06 H HETATM 2446 H2 E A 82 1.299 18.425 -19.119 1.00 0.06 H HETATM 2447 H3 E A 82 0.279 17.472 -21.134 1.00 0.06 H HETATM 2448 H12 E A 82 2.194 13.580 -22.526 1.00 0.07 H HETATM 2449 O25 E A 82 0.168 11.675 -25.301 1.00 -0.38 O HETATM 2450 H14 E A 82 2.812 12.094 -23.606 1.00 0.19 H HETATM 2451 H1 E A 82 1.426 9.569 -24.441 1.00 0.07 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 234 233 368 CONECT 368 234 367 CONECT 390 391 394 395 396 CONECT 394 390 CONECT 395 390 CONECT 396 390 CONECT 1089 1088 1700 CONECT 1376 1375 1531 CONECT 1531 1376 1530 CONECT 1624 1623 1820 CONECT 1700 1089 1699 CONECT 1820 1624 1819 CONECT 2400 2401 2405 2420 2451 CONECT 2401 2400 2402 2415 CONECT 2402 2401 2403 2412 CONECT 2403 2402 2404 2410 2411 CONECT 2404 2403 2405 2408 2409 CONECT 2405 2400 2404 2406 2407 CONECT 2406 2405 CONECT 2407 2405 CONECT 2408 2404 CONECT 2409 2404 CONECT 2410 2403 CONECT 2411 2403 CONECT 2412 2402 2413 2419 CONECT 2413 2412 2414 2418 CONECT 2414 2413 2415 2417 CONECT 2415 2401 2414 2416 CONECT 2416 2415 CONECT 2417 2414 CONECT 2418 2413 CONECT 2419 2412 CONECT 2420 2400 2421 2450 CONECT 2421 2420 2422 2449 CONECT 2422 2421 2423 2427 CONECT 2423 2422 2424 2448 CONECT 2424 2423 2425 2431 CONECT 2425 2424 2426 2430 CONECT 2426 2425 2427 2429 CONECT 2427 2422 2426 2428 CONECT 2428 2427 CONECT 2429 2426 CONECT 2430 2425 CONECT 2431 2424 2432 2443 CONECT 2432 2431 2433 2447 CONECT 2433 2432 2434 2446 CONECT 2434 2433 2435 2445 CONECT 2435 2434 2436 2443 CONECT 2436 2435 2437 2441 2442 CONECT 2437 2436 2438 2439 2440 CONECT 2438 2437 CONECT 2439 2437 CONECT 2440 2437 CONECT 2441 2436 CONECT 2442 2436 CONECT 2443 2431 2435 2444 CONECT 2444 2443 CONECT 2445 2434 CONECT 2446 2433 CONECT 2447 2432 CONECT 2448 2423 CONECT 2449 2421 CONECT 2450 2420 CONECT 2451 2400 MASTER 0 0 0 0 0 0 0 0 2449 2 68 19 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6fut
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Complement Factor D
Ligand Name
E82
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=20uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Med Chem Lett Vol. 9: pp. 490-495
Ligand Properties
Formula
C
2
4
H
2
5
N
2
O
Molecular Weight
357.468
Exact Mass
357.197
No. of atoms
52
No. of bonds
55
Polar Surface Area
56.74
LOGP Value
3.96 (
Computed with XLOGP3
)
4.29 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 4
Canonical SMILES
[NH3+]Cc1cccc(c1)c1cccc(c1)C(=O)N[C@H]1CCCc2c1cccc2
InChI String
InChI=1S/C24H24N2O/c25-16-17-6-3-9-19(14-17)20-10-4-11-21(15-20)24(27)26-23-13-5-8-18-7-1-2-12-22(18)23/h1-4,6-7,9-12,14-15,23H,5,8,13,16,25H2,(H,26,27)/p+1/t23-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00746
Entrez Gene ID
NCBI Entrez Gene ID:
1675
ASD
Information of known allosteric effects of PDB entries
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