Browse entries in the PDBbind-CN Database
HEADER 5EI3_COMPLEX COMPND 5EI3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 191 GLU VAL ALA ASN PRO GLU HIS TYR ILE LYS HIS PRO LEU SEQRES 2 A 191 GLN ASN ARG TRP ALA LEU TRP PHE PHE LYS ASN ASP LYS SEQRES 3 A 191 SER LYS THR TRP GLN ALA ASN LEU ARG LEU ILE SER LYS SEQRES 4 A 191 PHE ASP THR VAL GLU ASP PHE TRP ALA LEU TYR ASN HIS SEQRES 5 A 191 ILE GLN LEU SER SER ASN LEU MET PRO GLY CYS ASP TYR SEQRES 6 A 191 SER LEU PHE LYS ASP GLY ILE GLU PRO MET TRP GLU ASP SEQRES 7 A 191 GLU LYS ASN LYS ARG GLY GLY ARG TRP LEU ILE THR LEU SEQRES 8 A 191 ASN LYS GLN GLN ARG ARG SER ASP LEU ASP ARG PHE TRP SEQRES 9 A 191 LEU GLU THR LEU LEU CYS LEU ILE GLY GLU SER PHE ASP SEQRES 10 A 191 ASP TYR SER ASP ASP VAL CYS GLY ALA VAL VAL ASN VAL SEQRES 11 A 191 ARG ALA LYS GLY ASP LYS ILE ALA ILE TRP THR THR GLU SEQRES 12 A 191 CYS GLU ASN ARG GLU ALA VAL THR HIS ILE GLY ARG VAL SEQRES 13 A 191 TYR LYS GLU ARG LEU GLY LEU PRO PRO LYS ILE VAL ILE SEQRES 14 A 191 GLY TYR GLN SER HIS ALA ASP THR ALA THR LYS SER GLY SEQRES 15 A 191 SER THR THR LYS ASN ARG PHE VAL VAL HET UNN A 547 55 ATOM 1 N GLU A 27 -24.240 -3.874 -50.824 1.00 33.45 N ATOM 2 CA GLU A 27 -23.001 -4.626 -50.641 1.00 31.74 C ATOM 3 C GLU A 27 -22.071 -3.870 -49.698 1.00 29.92 C ATOM 4 O GLU A 27 -21.988 -2.642 -49.763 1.00 38.90 O ATOM 5 CB GLU A 27 -22.320 -4.876 -51.980 1.00 33.79 C ATOM 6 CG GLU A 27 -21.271 -5.970 -51.931 1.00 40.97 C ATOM 7 CD GLU A 27 -20.923 -6.495 -53.308 1.00 52.39 C ATOM 8 OE1 GLU A 27 -21.058 -5.729 -54.290 1.00 54.44 O ATOM 9 OE2 GLU A 27 -20.526 -7.676 -53.407 1.00 55.29 O ATOM 10 HN3 GLU A 27 -24.022 -2.942 -51.230 1.00 0.00 H ATOM 11 HN2 GLU A 27 -24.709 -3.751 -49.904 1.00 0.00 H ATOM 12 HN1 GLU A 27 -24.869 -4.395 -51.468 1.00 0.00 H ATOM 13 N VAL A 28 -21.379 -4.590 -48.817 1.00 23.54 N ATOM 14 CA VAL A 28 -20.512 -3.953 -47.834 1.00 18.96 C ATOM 15 C VAL A 28 -19.059 -4.210 -48.199 1.00 20.87 C ATOM 16 O VAL A 28 -18.721 -5.116 -48.966 1.00 18.90 O ATOM 17 CB VAL A 28 -20.800 -4.412 -46.388 1.00 23.26 C ATOM 18 CG1 VAL A 28 -22.205 -3.996 -45.967 1.00 20.81 C ATOM 19 CG2 VAL A 28 -20.581 -5.920 -46.225 1.00 21.64 C ATOM 20 H VAL A 28 -21.459 -5.627 -48.831 1.00 0.00 H ATOM 21 N ALA A 29 -18.185 -3.394 -47.620 1.00 18.78 N ATOM 22 CA ALA A 29 -16.762 -3.528 -47.864 1.00 14.17 C ATOM 23 C ALA A 29 -16.243 -4.866 -47.338 1.00 11.15 C ATOM 24 O ALA A 29 -16.825 -5.494 -46.451 1.00 16.13 O ATOM 25 CB ALA A 29 -16.010 -2.365 -47.217 1.00 13.89 C ATOM 26 H ALA A 29 -18.527 -2.647 -46.982 1.00 0.00 H ATOM 27 N ASN A 30 -15.132 -5.296 -47.918 1.00 14.29 N ATOM 28 CA ASN A 30 -14.442 -6.507 -47.495 1.00 15.16 C ATOM 29 C ASN A 30 -13.728 -6.246 -46.170 1.00 12.26 C ATOM 30 O ASN A 30 -12.819 -5.407 -46.130 1.00 13.13 O ATOM 31 CB ASN A 30 -13.441 -6.906 -48.581 1.00 14.43 C ATOM 32 CG ASN A 30 -12.807 -8.259 -48.342 1.00 18.29 C ATOM 33 OD1 ASN A 30 -12.773 -8.764 -47.219 1.00 18.62 O ATOM 34 ND2 ASN A 30 -12.300 -8.862 -49.415 1.00 23.36 N ATOM 35 HD22 ASN A 30 -12.351 -8.398 -50.345 1.00 0.00 H ATOM 36 HD21 ASN A 30 -11.853 -9.797 -49.324 1.00 0.00 H ATOM 37 H ASN A 30 -14.737 -4.746 -48.707 1.00 0.00 H ATOM 38 N PRO A 31 -14.101 -6.926 -45.074 1.00 13.59 N ATOM 39 CA PRO A 31 -13.416 -6.679 -43.788 1.00 12.58 C ATOM 40 C PRO A 31 -11.916 -6.931 -43.824 1.00 13.98 C ATOM 41 O PRO A 31 -11.173 -6.312 -43.048 1.00 13.19 O ATOM 42 CB PRO A 31 -14.129 -7.637 -42.817 1.00 15.23 C ATOM 43 CG PRO A 31 -14.842 -8.623 -43.683 1.00 21.37 C ATOM 44 CD PRO A 31 -15.214 -7.879 -44.924 1.00 15.18 C ATOM 45 N GLU A 32 -11.437 -7.816 -44.699 1.00 13.94 N ATOM 46 CA GLU A 32 -9.997 -8.057 -44.761 1.00 14.56 C ATOM 47 C GLU A 32 -9.235 -6.781 -45.096 1.00 17.76 C ATOM 48 O GLU A 32 -8.076 -6.622 -44.692 1.00 18.49 O ATOM 49 CB GLU A 32 -9.688 -9.149 -45.790 1.00 20.54 C ATOM 50 CG GLU A 32 -8.328 -9.823 -45.600 1.00 27.00 C ATOM 51 CD GLU A 32 -7.173 -8.969 -46.099 1.00 36.22 C ATOM 52 OE1 GLU A 32 -7.360 -8.247 -47.109 1.00 32.93 O ATOM 53 OE2 GLU A 32 -6.092 -8.994 -45.463 1.00 35.03 O ATOM 54 H GLU A 32 -12.083 -8.330 -45.332 1.00 0.00 H ATOM 55 N HIS A 33 -9.875 -5.850 -45.809 1.00 12.69 N ATOM 56 CA HIS A 33 -9.207 -4.632 -46.243 1.00 11.15 C ATOM 57 C HIS A 33 -9.043 -3.598 -45.135 1.00 11.87 C ATOM 58 O HIS A 33 -8.224 -2.682 -45.288 1.00 12.78 O ATOM 59 CB HIS A 33 -9.982 -3.987 -47.393 1.00 14.74 C ATOM 60 CG HIS A 33 -10.059 -4.840 -48.621 1.00 20.82 C ATOM 61 ND1 HIS A 33 -10.966 -4.607 -49.633 1.00 18.76 N ATOM 62 CD2 HIS A 33 -9.338 -5.923 -49.002 1.00 20.42 C ATOM 63 CE1 HIS A 33 -10.803 -5.512 -50.584 1.00 21.18 C ATOM 64 NE2 HIS A 33 -9.822 -6.322 -50.227 1.00 24.09 N ATOM 65 H HIS A 33 -10.873 -5.999 -46.060 1.00 0.00 H ATOM 66 N TYR A 34 -9.799 -3.695 -44.040 1.00 8.98 N ATOM 67 CA TYR A 34 -9.778 -2.581 -43.092 1.00 9.64 C ATOM 68 C TYR A 34 -9.907 -2.969 -41.615 1.00 9.85 C ATOM 69 O TYR A 34 -9.656 -2.117 -40.758 1.00 10.15 O ATOM 70 CB TYR A 34 -10.883 -1.557 -43.455 1.00 10.28 C ATOM 71 CG TYR A 34 -12.262 -2.103 -43.184 1.00 9.93 C ATOM 72 CD1 TYR A 34 -12.836 -2.004 -41.918 1.00 7.93 C ATOM 73 CD2 TYR A 34 -12.965 -2.785 -44.172 1.00 10.38 C ATOM 74 CE1 TYR A 34 -14.083 -2.547 -41.656 1.00 9.64 C ATOM 75 CE2 TYR A 34 -14.204 -3.327 -43.918 1.00 11.16 C ATOM 76 CZ TYR A 34 -14.756 -3.214 -42.661 1.00 8.77 C ATOM 77 OH TYR A 34 -15.984 -3.772 -42.408 1.00 13.63 O ATOM 78 HH TYR A 34 -16.234 -3.602 -41.465 1.00 0.00 H ATOM 79 H TYR A 34 -10.385 -4.536 -43.866 1.00 0.00 H ATOM 80 N ILE A 35 -10.294 -4.216 -41.254 1.00 5.40 N ATOM 81 CA ILE A 35 -10.433 -4.494 -39.821 1.00 6.87 C ATOM 82 C ILE A 35 -9.063 -4.794 -39.226 1.00 7.91 C ATOM 83 O ILE A 35 -8.186 -5.372 -39.878 1.00 9.88 O ATOM 84 CB ILE A 35 -11.416 -5.646 -39.505 1.00 9.33 C ATOM 85 CG1 ILE A 35 -10.856 -7.009 -39.929 1.00 10.43 C ATOM 86 CG2 ILE A 35 -12.807 -5.385 -40.105 1.00 8.33 C ATOM 87 CD1 ILE A 35 -11.581 -8.191 -39.285 1.00 13.28 C ATOM 88 H ILE A 35 -10.485 -4.949 -41.967 1.00 0.00 H ATOM 89 N LYS A 36 -8.871 -4.392 -37.972 1.00 6.74 N ATOM 90 CA LYS A 36 -7.710 -4.876 -37.234 1.00 6.98 C ATOM 91 C LYS A 36 -7.848 -6.379 -37.024 1.00 5.81 C ATOM 92 O LYS A 36 -8.955 -6.922 -37.008 1.00 7.53 O ATOM 93 CB LYS A 36 -7.589 -4.152 -35.895 1.00 7.85 C ATOM 94 CG LYS A 36 -7.251 -2.654 -36.059 1.00 7.24 C ATOM 95 CD LYS A 36 -6.885 -2.013 -34.729 1.00 12.68 C ATOM 96 CE LYS A 36 -8.121 -1.671 -33.947 1.00 13.95 C ATOM 97 NZ LYS A 36 -7.857 -0.701 -32.829 1.00 11.52 N ATOM 98 HZ1 LYS A 36 -7.168 -1.114 -32.169 1.00 0.00 H ATOM 99 HZ2 LYS A 36 -7.475 0.183 -33.222 1.00 0.00 H ATOM 100 HZ3 LYS A 36 -8.746 -0.503 -32.326 1.00 0.00 H ATOM 101 H LYS A 36 -9.543 -3.738 -37.522 1.00 0.00 H ATOM 102 N HIS A 37 -6.708 -7.059 -36.894 1.00 7.16 N ATOM 103 CA HIS A 37 -6.712 -8.514 -36.733 1.00 6.70 C ATOM 104 C HIS A 37 -6.915 -8.868 -35.265 1.00 8.13 C ATOM 105 O HIS A 37 -6.019 -8.641 -34.443 1.00 7.04 O ATOM 106 CB HIS A 37 -5.401 -9.104 -37.271 1.00 6.40 C ATOM 107 CG HIS A 37 -5.211 -8.873 -38.736 1.00 8.54 C ATOM 108 ND1 HIS A 37 -4.888 -7.637 -39.257 1.00 8.82 N ATOM 109 CD2 HIS A 37 -5.354 -9.706 -39.794 1.00 9.77 C ATOM 110 CE1 HIS A 37 -4.823 -7.727 -40.576 1.00 11.12 C ATOM 111 NE2 HIS A 37 -5.092 -8.974 -40.925 1.00 13.37 N ATOM 112 H HIS A 37 -5.802 -6.548 -36.907 1.00 0.00 H ATOM 113 N PRO A 38 -8.063 -9.435 -34.901 1.00 6.60 N ATOM 114 CA PRO A 38 -8.379 -9.610 -33.474 1.00 5.85 C ATOM 115 C PRO A 38 -7.558 -10.717 -32.835 1.00 8.66 C ATOM 116 O PRO A 38 -7.251 -11.735 -33.466 1.00 7.35 O ATOM 117 CB PRO A 38 -9.871 -9.969 -33.474 1.00 9.34 C ATOM 118 CG PRO A 38 -10.356 -9.726 -34.873 1.00 15.52 C ATOM 119 CD PRO A 38 -9.169 -9.873 -35.768 1.00 10.45 C ATOM 120 N LEU A 39 -7.209 -10.506 -31.566 1.00 5.37 N ATOM 121 CA LEU A 39 -6.636 -11.556 -30.739 1.00 4.13 C ATOM 122 C LEU A 39 -7.742 -12.346 -30.050 1.00 7.99 C ATOM 123 O LEU A 39 -8.870 -11.872 -29.883 1.00 8.83 O ATOM 124 CB LEU A 39 -5.693 -10.978 -29.686 1.00 5.49 C ATOM 125 CG LEU A 39 -4.518 -10.171 -30.211 1.00 4.43 C ATOM 126 CD1 LEU A 39 -3.772 -9.525 -29.049 1.00 4.75 C ATOM 127 CD2 LEU A 39 -3.583 -11.056 -31.057 1.00 6.03 C ATOM 128 H LEU A 39 -7.351 -9.561 -31.155 1.00 0.00 H ATOM 129 N GLN A 40 -7.406 -13.574 -29.659 1.00 5.26 N ATOM 130 CA GLN A 40 -8.362 -14.390 -28.915 1.00 5.69 C ATOM 131 C GLN A 40 -8.704 -13.756 -27.575 1.00 6.45 C ATOM 132 O GLN A 40 -9.863 -13.795 -27.136 1.00 7.76 O ATOM 133 CB GLN A 40 -7.791 -15.793 -28.704 1.00 7.40 C ATOM 134 CG GLN A 40 -8.682 -16.695 -27.853 1.00 8.79 C ATOM 135 CD GLN A 40 -10.012 -17.013 -28.530 1.00 11.04 C ATOM 136 OE1 GLN A 40 -10.143 -16.942 -29.755 1.00 10.35 O ATOM 137 NE2 GLN A 40 -11.010 -17.367 -27.721 1.00 13.20 N ATOM 138 HE22 GLN A 40 -10.855 -17.414 -26.694 1.00 0.00 H ATOM 139 HE21 GLN A 40 -11.944 -17.597 -28.117 1.00 0.00 H ATOM 140 H GLN A 40 -6.463 -13.952 -29.883 1.00 0.00 H ATOM 141 N ASN A 41 -7.700 -13.147 -26.955 1.00 6.94 N ATOM 142 CA ASN A 41 -7.863 -12.506 -25.662 1.00 6.13 C ATOM 143 C ASN A 41 -7.472 -11.042 -25.679 1.00 6.91 C ATOM 144 O ASN A 41 -6.655 -10.612 -26.494 1.00 7.35 O ATOM 145 CB ASN A 41 -6.995 -13.208 -24.623 1.00 7.49 C ATOM 146 CG ASN A 41 -7.635 -14.463 -24.089 1.00 10.38 C ATOM 147 OD1 ASN A 41 -7.177 -15.572 -24.363 1.00 11.32 O ATOM 148 ND2 ASN A 41 -8.704 -14.300 -23.318 1.00 7.03 N ATOM 149 HD22 ASN A 41 -9.056 -13.343 -23.113 1.00 0.00 H ATOM 150 HD21 ASN A 41 -9.189 -15.129 -22.919 1.00 0.00 H ATOM 151 H ASN A 41 -6.765 -13.128 -27.411 1.00 0.00 H ATOM 152 N ARG A 42 -8.047 -10.284 -24.755 1.00 7.01 N ATOM 153 CA ARG A 42 -7.547 -8.959 -24.454 1.00 7.92 C ATOM 154 C ARG A 42 -6.471 -9.170 -23.396 1.00 6.54 C ATOM 155 O ARG A 42 -6.653 -9.942 -22.454 1.00 6.86 O ATOM 156 CB ARG A 42 -8.664 -8.040 -23.946 1.00 6.01 C ATOM 157 CG ARG A 42 -8.197 -6.661 -23.510 1.00 6.86 C ATOM 158 CD ARG A 42 -9.379 -5.740 -23.252 1.00 10.77 C ATOM 159 NE ARG A 42 -10.002 -5.293 -24.495 1.00 12.01 N ATOM 160 CZ ARG A 42 -11.298 -5.036 -24.634 1.00 19.18 C ATOM 161 NH1 ARG A 42 -12.119 -5.181 -23.603 1.00 21.56 N ATOM 162 NH2 ARG A 42 -11.775 -4.634 -25.804 1.00 18.41 N ATOM 163 HE ARG A 42 -9.390 -5.168 -25.327 1.00 0.00 H ATOM 164 HH12 ARG A 42 -13.133 -4.979 -23.714 1.00 0.00 H ATOM 165 HH11 ARG A 42 -11.749 -5.496 -22.684 1.00 0.00 H ATOM 166 HH22 ARG A 42 -12.790 -4.433 -25.911 1.00 0.00 H ATOM 167 HH21 ARG A 42 -11.134 -4.519 -26.615 1.00 0.00 H ATOM 168 H ARG A 42 -8.872 -10.648 -24.237 1.00 0.00 H ATOM 169 N TRP A 43 -5.340 -8.477 -23.563 1.00 5.81 N ATOM 170 CA TRP A 43 -4.175 -8.602 -22.694 1.00 5.99 C ATOM 171 C TRP A 43 -3.860 -7.254 -22.072 1.00 4.29 C ATOM 172 O TRP A 43 -4.153 -6.206 -22.653 1.00 6.39 O ATOM 173 CB TRP A 43 -2.936 -9.102 -23.468 1.00 5.92 C ATOM 174 CG TRP A 43 -3.145 -10.465 -24.067 1.00 6.61 C ATOM 175 CD1 TRP A 43 -3.690 -10.754 -25.292 1.00 6.24 C ATOM 176 CD2 TRP A 43 -2.849 -11.722 -23.455 1.00 6.89 C ATOM 177 NE1 TRP A 43 -3.733 -12.106 -25.478 1.00 5.96 N ATOM 178 CE2 TRP A 43 -3.234 -12.728 -24.366 1.00 5.90 C ATOM 179 CE3 TRP A 43 -2.287 -12.095 -22.230 1.00 7.41 C ATOM 180 CZ2 TRP A 43 -3.082 -14.090 -24.091 1.00 5.40 C ATOM 181 CZ3 TRP A 43 -2.143 -13.448 -21.946 1.00 6.29 C ATOM 182 CH2 TRP A 43 -2.526 -14.432 -22.881 1.00 7.63 C ATOM 183 HE1 TRP A 43 -4.088 -12.586 -26.329 1.00 0.00 H ATOM 184 H TRP A 43 -5.288 -7.810 -24.359 1.00 0.00 H ATOM 185 N ALA A 44 -3.272 -7.283 -20.879 1.00 4.83 N ATOM 186 CA ALA A 44 -2.835 -6.071 -20.196 1.00 5.88 C ATOM 187 C ALA A 44 -1.341 -6.150 -19.917 1.00 4.18 C ATOM 188 O ALA A 44 -0.852 -7.153 -19.387 1.00 5.09 O ATOM 189 CB ALA A 44 -3.598 -5.859 -18.881 1.00 9.18 C ATOM 190 H ALA A 44 -3.119 -8.202 -20.417 1.00 0.00 H ATOM 191 N LEU A 45 -0.616 -5.089 -20.266 1.00 5.58 N ATOM 192 CA LEU A 45 0.802 -4.996 -19.935 1.00 6.15 C ATOM 193 C LEU A 45 0.963 -4.123 -18.700 1.00 7.05 C ATOM 194 O LEU A 45 0.407 -3.011 -18.636 1.00 7.23 O ATOM 195 CB LEU A 45 1.608 -4.419 -21.097 1.00 4.94 C ATOM 196 CG LEU A 45 3.127 -4.412 -20.904 1.00 7.24 C ATOM 197 CD1 LEU A 45 3.694 -5.832 -20.977 1.00 7.24 C ATOM 198 CD2 LEU A 45 3.772 -3.498 -21.947 1.00 8.30 C ATOM 199 H LEU A 45 -1.070 -4.311 -20.785 1.00 0.00 H ATOM 200 N TRP A 46 1.716 -4.635 -17.730 1.00 6.53 N ATOM 201 CA TRP A 46 1.967 -3.984 -16.452 1.00 7.47 C ATOM 202 C TRP A 46 3.452 -3.686 -16.312 1.00 7.18 C ATOM 203 O TRP A 46 4.301 -4.379 -16.891 1.00 6.94 O ATOM 204 CB TRP A 46 1.545 -4.875 -15.275 1.00 7.03 C ATOM 205 CG TRP A 46 0.113 -5.276 -15.298 1.00 6.79 C ATOM 206 CD1 TRP A 46 -0.486 -6.160 -16.151 1.00 5.67 C ATOM 207 CD2 TRP A 46 -0.912 -4.812 -14.414 1.00 7.41 C ATOM 208 NE1 TRP A 46 -1.825 -6.269 -15.852 1.00 7.02 N ATOM 209 CE2 TRP A 46 -2.107 -5.458 -14.785 1.00 8.71 C ATOM 210 CE3 TRP A 46 -0.928 -3.920 -13.331 1.00 12.69 C ATOM 211 CZ2 TRP A 46 -3.318 -5.233 -14.121 1.00 11.12 C ATOM 212 CZ3 TRP A 46 -2.130 -3.703 -12.670 1.00 15.77 C ATOM 213 CH2 TRP A 46 -3.305 -4.355 -13.072 1.00 17.37 C ATOM 214 HE1 TRP A 46 -2.510 -6.869 -16.354 1.00 0.00 H ATOM 215 H TRP A 46 2.155 -5.563 -17.896 1.00 0.00 H ATOM 216 N PHE A 47 3.759 -2.657 -15.529 1.00 7.10 N ATOM 217 CA PHE A 47 5.136 -2.293 -15.223 1.00 6.88 C ATOM 218 C PHE A 47 5.347 -2.279 -13.719 1.00 9.31 C ATOM 219 O PHE A 47 4.515 -1.759 -12.971 1.00 10.77 O ATOM 220 CB PHE A 47 5.496 -0.920 -15.816 1.00 9.16 C ATOM 221 CG PHE A 47 6.946 -0.568 -15.657 1.00 9.89 C ATOM 222 CD1 PHE A 47 7.896 -1.160 -16.463 1.00 11.13 C ATOM 223 CD2 PHE A 47 7.362 0.330 -14.683 1.00 15.14 C ATOM 224 CE1 PHE A 47 9.238 -0.860 -16.321 1.00 11.68 C ATOM 225 CE2 PHE A 47 8.716 0.634 -14.532 1.00 14.15 C ATOM 226 CZ PHE A 47 9.647 0.041 -15.357 1.00 12.02 C ATOM 227 H PHE A 47 2.988 -2.091 -15.120 1.00 0.00 H ATOM 228 N PHE A 48 6.461 -2.851 -13.277 1.00 9.11 N ATOM 229 CA PHE A 48 6.858 -2.810 -11.875 1.00 8.45 C ATOM 230 C PHE A 48 8.115 -1.965 -11.767 1.00 10.19 C ATOM 231 O PHE A 48 9.123 -2.265 -12.414 1.00 9.45 O ATOM 232 CB PHE A 48 7.107 -4.209 -11.320 1.00 10.14 C ATOM 233 CG PHE A 48 7.560 -4.207 -9.889 1.00 9.45 C ATOM 234 CD1 PHE A 48 6.634 -4.194 -8.856 1.00 14.88 C ATOM 235 CD2 PHE A 48 8.913 -4.199 -9.574 1.00 13.58 C ATOM 236 CE1 PHE A 48 7.049 -4.174 -7.540 1.00 15.66 C ATOM 237 CE2 PHE A 48 9.329 -4.185 -8.259 1.00 12.64 C ATOM 238 CZ PHE A 48 8.399 -4.170 -7.243 1.00 14.52 C ATOM 239 H PHE A 48 7.073 -3.347 -13.956 1.00 0.00 H ATOM 240 N LYS A 49 8.043 -0.907 -10.965 1.00 10.91 N ATOM 241 CA LYS A 49 9.159 0.005 -10.751 1.00 18.71 C ATOM 242 C LYS A 49 9.815 -0.321 -9.416 1.00 19.80 C ATOM 243 O LYS A 49 9.147 -0.328 -8.377 1.00 19.61 O ATOM 244 CB LYS A 49 8.671 1.455 -10.779 1.00 16.76 C ATOM 245 CG LYS A 49 9.697 2.492 -10.328 1.00 22.65 C ATOM 246 CD LYS A 49 10.924 2.511 -11.217 1.00 19.78 C ATOM 247 CE LYS A 49 11.878 3.623 -10.781 1.00 24.27 C ATOM 248 NZ LYS A 49 13.050 3.722 -11.684 1.00 22.72 N ATOM 249 HZ1 LYS A 49 13.569 2.821 -11.676 1.00 0.00 H ATOM 250 HZ2 LYS A 49 12.725 3.928 -12.650 1.00 0.00 H ATOM 251 HZ3 LYS A 49 13.674 4.487 -11.357 1.00 0.00 H ATOM 252 H LYS A 49 7.149 -0.722 -10.467 1.00 0.00 H ATOM 253 N ASN A 50 11.119 -0.584 -9.451 1.00 20.87 N ATOM 254 CA ASN A 50 11.905 -0.815 -8.241 1.00 23.80 C ATOM 255 C ASN A 50 12.025 0.500 -7.481 1.00 27.56 C ATOM 256 O ASN A 50 12.776 1.397 -7.874 1.00 25.73 O ATOM 257 CB ASN A 50 13.279 -1.373 -8.588 1.00 23.94 C ATOM 258 CG ASN A 50 14.097 -1.698 -7.350 1.00 31.17 C ATOM 259 OD1 ASN A 50 13.542 -1.993 -6.289 1.00 40.72 O ATOM 260 ND2 ASN A 50 15.421 -1.646 -7.478 1.00 34.69 N ATOM 261 HD22 ASN A 50 15.845 -1.392 -8.393 1.00 0.00 H ATOM 262 HD21 ASN A 50 16.031 -1.859 -6.663 1.00 0.00 H ATOM 263 H ASN A 50 11.596 -0.627 -10.374 1.00 0.00 H ATOM 264 N ASP A 51 11.261 0.613 -6.392 1.00 27.27 N ATOM 265 CA ASP A 51 11.277 1.779 -5.506 1.00 29.79 C ATOM 266 C ASP A 51 10.921 1.264 -4.116 1.00 33.42 C ATOM 267 O ASP A 51 9.741 1.077 -3.806 1.00 31.05 O ATOM 268 CB ASP A 51 10.305 2.854 -5.971 1.00 31.77 C ATOM 269 CG ASP A 51 10.299 4.080 -5.062 1.00 38.66 C ATOM 270 OD1 ASP A 51 10.892 4.032 -3.959 1.00 34.31 O ATOM 271 OD2 ASP A 51 9.661 5.085 -5.434 1.00 34.73 O ATOM 272 H ASP A 51 10.618 -0.171 -6.160 1.00 0.00 H ATOM 273 N LYS A 52 11.938 1.029 -3.285 1.00 37.97 N ATOM 274 CA LYS A 52 11.674 0.400 -1.996 1.00 35.72 C ATOM 275 C LYS A 52 11.138 1.417 -0.976 1.00 35.45 C ATOM 276 O LYS A 52 10.789 1.044 0.147 1.00 35.03 O ATOM 277 CB LYS A 52 12.936 -0.393 -1.544 1.00 42.86 C ATOM 278 CG LYS A 52 13.422 -1.674 -2.328 1.00 48.06 C ATOM 279 CD LYS A 52 14.719 -2.312 -1.732 1.00 54.37 C ATOM 280 CE LYS A 52 15.280 -3.545 -2.362 1.00 60.38 C ATOM 281 NZ LYS A 52 16.536 -3.936 -1.616 1.00 70.18 N ATOM 282 HZ1 LYS A 52 17.227 -3.161 -1.674 1.00 0.00 H ATOM 283 HZ2 LYS A 52 16.303 -4.121 -0.619 1.00 0.00 H ATOM 284 HZ3 LYS A 52 16.939 -4.794 -2.044 1.00 0.00 H ATOM 285 H LYS A 52 12.908 1.291 -3.553 1.00 0.00 H ATOM 286 N SER A 53 10.961 2.689 -1.343 1.00 37.54 N ATOM 287 CA SER A 53 10.155 3.483 -0.420 1.00 38.22 C ATOM 288 C SER A 53 8.665 3.122 -0.466 1.00 42.77 C ATOM 289 O SER A 53 7.877 3.728 0.273 1.00 40.42 O ATOM 290 CB SER A 53 10.350 4.980 -0.665 1.00 37.04 C ATOM 291 OG SER A 53 9.821 5.412 -1.908 1.00 42.18 O ATOM 292 HG SER A 53 10.271 4.925 -2.644 1.00 0.00 H ATOM 293 H SER A 53 11.365 3.083 -2.217 1.00 0.00 H ATOM 294 N LYS A 54 8.273 2.122 -1.269 1.00 38.07 N ATOM 295 CA LYS A 54 6.882 1.696 -1.411 1.00 28.33 C ATOM 296 C LYS A 54 6.741 0.176 -1.307 1.00 28.42 C ATOM 297 O LYS A 54 7.718 -0.575 -1.388 1.00 32.36 O ATOM 298 CB LYS A 54 6.302 2.154 -2.752 1.00 34.72 C ATOM 299 CG LYS A 54 6.657 3.568 -3.166 1.00 34.09 C ATOM 300 CD LYS A 54 5.796 3.988 -4.345 1.00 39.31 C ATOM 301 CE LYS A 54 6.413 5.136 -5.119 1.00 41.90 C ATOM 302 NZ LYS A 54 5.631 5.414 -6.360 1.00 47.47 N ATOM 303 HZ1 LYS A 54 5.625 4.566 -6.962 1.00 0.00 H ATOM 304 HZ2 LYS A 54 4.655 5.666 -6.104 1.00 0.00 H ATOM 305 HZ3 LYS A 54 6.070 6.203 -6.875 1.00 0.00 H ATOM 306 H LYS A 54 8.999 1.622 -1.821 1.00 0.00 H ATOM 307 N THR A 55 5.494 -0.283 -1.157 1.00 25.55 N ATOM 308 CA THR A 55 5.208 -1.715 -1.142 1.00 30.72 C ATOM 309 C THR A 55 5.246 -2.288 -2.556 1.00 20.30 C ATOM 310 O THR A 55 5.135 -1.563 -3.548 1.00 26.68 O ATOM 311 CB THR A 55 3.835 -2.013 -0.536 1.00 31.27 C ATOM 312 OG1 THR A 55 2.820 -1.351 -1.303 1.00 30.85 O ATOM 313 CG2 THR A 55 3.767 -1.559 0.918 1.00 37.39 C ATOM 314 HG1 THR A 55 1.932 -1.545 -0.910 1.00 0.00 H ATOM 315 H THR A 55 4.712 0.394 -1.049 1.00 0.00 H ATOM 316 N TRP A 56 5.392 -3.613 -2.634 1.00 24.32 N ATOM 317 CA TRP A 56 5.427 -4.280 -3.934 1.00 24.16 C ATOM 318 C TRP A 56 4.168 -3.972 -4.737 1.00 24.77 C ATOM 319 O TRP A 56 4.238 -3.635 -5.925 1.00 21.25 O ATOM 320 CB TRP A 56 5.589 -5.789 -3.746 1.00 24.97 C ATOM 321 CG TRP A 56 5.771 -6.555 -5.032 1.00 21.39 C ATOM 322 CD1 TRP A 56 6.946 -6.774 -5.696 1.00 23.97 C ATOM 323 CD2 TRP A 56 4.749 -7.216 -5.797 1.00 23.09 C ATOM 324 NE1 TRP A 56 6.719 -7.525 -6.829 1.00 16.78 N ATOM 325 CE2 TRP A 56 5.380 -7.808 -6.915 1.00 22.87 C ATOM 326 CE3 TRP A 56 3.366 -7.362 -5.648 1.00 22.54 C ATOM 327 CZ2 TRP A 56 4.673 -8.534 -7.877 1.00 18.61 C ATOM 328 CZ3 TRP A 56 2.665 -8.084 -6.603 1.00 21.44 C ATOM 329 CH2 TRP A 56 3.323 -8.665 -7.704 1.00 17.26 C ATOM 330 HE1 TRP A 56 7.446 -7.828 -7.509 1.00 0.00 H ATOM 331 H TRP A 56 5.481 -4.175 -1.763 1.00 0.00 H ATOM 332 N GLN A 57 3.008 -4.049 -4.082 1.00 24.98 N ATOM 333 CA GLN A 57 1.734 -3.848 -4.763 1.00 24.61 C ATOM 334 C GLN A 57 1.609 -2.426 -5.307 1.00 24.98 C ATOM 335 O GLN A 57 1.104 -2.218 -6.417 1.00 26.61 O ATOM 336 CB GLN A 57 0.579 -4.161 -3.804 1.00 28.04 C ATOM 337 CG GLN A 57 0.415 -5.638 -3.355 1.00 36.82 C ATOM 338 CD GLN A 57 -0.707 -5.884 -2.343 1.00 59.48 C ATOM 339 OE1 GLN A 57 -1.094 -4.955 -1.595 1.00 59.22 O ATOM 340 NE2 GLN A 57 -1.217 -7.123 -2.292 1.00 55.86 N ATOM 341 HE22 GLN A 57 -0.861 -7.859 -2.935 1.00 0.00 H ATOM 342 HE21 GLN A 57 -1.969 -7.348 -1.609 1.00 0.00 H ATOM 343 H GLN A 57 3.012 -4.257 -3.063 1.00 0.00 H ATOM 344 N ALA A 58 2.077 -1.430 -4.549 1.00 21.48 N ATOM 345 CA ALA A 58 1.990 -0.042 -5.001 1.00 22.20 C ATOM 346 C ALA A 58 2.967 0.271 -6.133 1.00 24.99 C ATOM 347 O ALA A 58 2.773 1.255 -6.854 1.00 25.13 O ATOM 348 CB ALA A 58 2.233 0.904 -3.824 1.00 28.63 C ATOM 349 H ALA A 58 2.508 -1.644 -3.627 1.00 0.00 H ATOM 350 N ASN A 59 4.013 -0.532 -6.298 1.00 18.97 N ATOM 351 CA ASN A 59 4.972 -0.331 -7.374 1.00 17.74 C ATOM 352 C ASN A 59 4.552 -1.010 -8.666 1.00 16.53 C ATOM 353 O ASN A 59 5.225 -0.832 -9.688 1.00 13.55 O ATOM 354 CB ASN A 59 6.348 -0.835 -6.951 1.00 18.41 C ATOM 355 CG ASN A 59 7.109 0.194 -6.145 1.00 20.10 C ATOM 356 OD1 ASN A 59 7.050 1.396 -6.437 1.00 27.42 O ATOM 357 ND2 ASN A 59 7.835 -0.266 -5.133 1.00 21.83 N ATOM 358 HD22 ASN A 59 7.853 -1.285 -4.927 1.00 0.00 H ATOM 359 HD21 ASN A 59 8.386 0.393 -4.547 1.00 0.00 H ATOM 360 H ASN A 59 4.150 -1.326 -5.640 1.00 0.00 H ATOM 361 N LEU A 60 3.455 -1.759 -8.639 1.00 15.41 N ATOM 362 CA LEU A 60 2.944 -2.490 -9.794 1.00 14.52 C ATOM 363 C LEU A 60 1.787 -1.699 -10.394 1.00 16.08 C ATOM 364 O LEU A 60 0.772 -1.488 -9.722 1.00 19.08 O ATOM 365 CB LEU A 60 2.489 -3.886 -9.366 1.00 14.22 C ATOM 366 CG LEU A 60 1.749 -4.728 -10.405 1.00 17.34 C ATOM 367 CD1 LEU A 60 2.695 -5.082 -11.540 1.00 13.66 C ATOM 368 CD2 LEU A 60 1.161 -5.990 -9.776 1.00 17.81 C ATOM 369 H LEU A 60 2.931 -1.828 -7.744 1.00 0.00 H ATOM 370 N ARG A 61 1.946 -1.238 -11.639 1.00 12.94 N ATOM 371 CA ARG A 61 0.943 -0.385 -12.264 1.00 12.12 C ATOM 372 C ARG A 61 0.693 -0.775 -13.712 1.00 14.78 C ATOM 373 O ARG A 61 1.595 -1.219 -14.422 1.00 11.48 O ATOM 374 CB ARG A 61 1.371 1.103 -12.193 1.00 19.07 C ATOM 375 CG ARG A 61 1.359 1.683 -10.780 1.00 19.48 C ATOM 376 CD ARG A 61 -0.053 1.812 -10.216 1.00 33.02 C ATOM 377 NE ARG A 61 -0.084 2.351 -8.853 1.00 36.67 N ATOM 378 CZ ARG A 61 -0.255 1.620 -7.753 1.00 33.07 C ATOM 379 NH1 ARG A 61 -0.270 2.206 -6.564 1.00 40.95 N ATOM 380 NH2 ARG A 61 -0.406 0.305 -7.837 1.00 29.28 N ATOM 381 HE ARG A 61 0.036 3.377 -8.737 1.00 0.00 H ATOM 382 HH12 ARG A 61 -0.404 1.636 -5.705 1.00 0.00 H ATOM 383 HH11 ARG A 61 -0.148 3.236 -6.490 1.00 0.00 H ATOM 384 HH22 ARG A 61 -0.539 -0.259 -6.974 1.00 0.00 H ATOM 385 HH21 ARG A 61 -0.391 -0.162 -8.766 1.00 0.00 H ATOM 386 H ARG A 61 2.802 -1.493 -12.172 1.00 0.00 H ATOM 387 N LEU A 62 -0.548 -0.568 -14.145 1.00 12.15 N ATOM 388 CA LEU A 62 -0.947 -0.886 -15.509 1.00 11.21 C ATOM 389 C LEU A 62 -0.332 0.086 -16.517 1.00 10.94 C ATOM 390 O LEU A 62 -0.259 1.295 -16.274 1.00 12.09 O ATOM 391 CB LEU A 62 -2.479 -0.842 -15.614 1.00 11.13 C ATOM 392 CG LEU A 62 -3.112 -1.006 -17.004 1.00 14.31 C ATOM 393 CD1 LEU A 62 -2.983 -2.448 -17.507 1.00 8.89 C ATOM 394 CD2 LEU A 62 -4.580 -0.569 -16.994 1.00 13.88 C ATOM 395 H LEU A 62 -1.252 -0.168 -13.492 1.00 0.00 H ATOM 396 N ILE A 63 0.063 -0.424 -17.682 1.00 8.90 N ATOM 397 CA ILE A 63 0.451 0.448 -18.792 1.00 8.53 C ATOM 398 C ILE A 63 -0.717 0.652 -19.752 1.00 11.82 C ATOM 399 O ILE A 63 -1.167 1.777 -19.969 1.00 14.60 O ATOM 400 CB ILE A 63 1.632 -0.111 -19.612 1.00 7.17 C ATOM 401 CG1 ILE A 63 2.873 -0.256 -18.729 1.00 8.64 C ATOM 402 CG2 ILE A 63 1.923 0.785 -20.806 1.00 8.24 C ATOM 403 CD1 ILE A 63 4.099 -0.738 -19.473 1.00 9.01 C ATOM 404 H ILE A 63 0.096 -1.456 -17.805 1.00 0.00 H ATOM 405 N SER A 64 -1.207 -0.447 -20.317 1.00 7.52 N ATOM 406 CA SER A 64 -2.383 -0.415 -21.181 1.00 7.38 C ATOM 407 C SER A 64 -2.790 -1.816 -21.630 1.00 6.23 C ATOM 408 O SER A 64 -2.052 -2.785 -21.449 1.00 7.44 O ATOM 409 CB SER A 64 -2.198 0.500 -22.397 1.00 10.12 C ATOM 410 OG SER A 64 -1.159 0.028 -23.237 1.00 9.10 O ATOM 411 HG SER A 64 -1.061 0.636 -24.012 1.00 0.00 H ATOM 412 H SER A 64 -0.738 -1.358 -20.138 1.00 0.00 H ATOM 413 N LYS A 65 -3.977 -1.900 -22.217 1.00 8.08 N ATOM 414 CA LYS A 65 -4.551 -3.149 -22.693 1.00 5.75 C ATOM 415 C LYS A 65 -4.696 -3.104 -24.209 1.00 8.22 C ATOM 416 O LYS A 65 -4.795 -2.034 -24.814 1.00 9.32 O ATOM 417 CB LYS A 65 -5.921 -3.422 -22.038 1.00 8.02 C ATOM 418 CG LYS A 65 -5.899 -3.346 -20.511 1.00 8.94 C ATOM 419 CD LYS A 65 -7.241 -3.739 -19.909 1.00 14.43 C ATOM 420 CE LYS A 65 -7.211 -3.648 -18.386 1.00 18.20 C ATOM 421 NZ LYS A 65 -8.489 -4.107 -17.761 1.00 18.42 N ATOM 422 HZ1 LYS A 65 -9.273 -3.515 -18.103 1.00 0.00 H ATOM 423 HZ2 LYS A 65 -8.664 -5.099 -18.020 1.00 0.00 H ATOM 424 HZ3 LYS A 65 -8.417 -4.025 -16.727 1.00 0.00 H ATOM 425 H LYS A 65 -4.526 -1.026 -22.344 1.00 0.00 H ATOM 426 N PHE A 66 -4.722 -4.285 -24.827 1.00 7.40 N ATOM 427 CA PHE A 66 -4.889 -4.379 -26.274 1.00 6.09 C ATOM 428 C PHE A 66 -5.551 -5.710 -26.600 1.00 5.79 C ATOM 429 O PHE A 66 -5.460 -6.672 -25.832 1.00 6.35 O ATOM 430 CB PHE A 66 -3.541 -4.255 -27.010 1.00 6.70 C ATOM 431 CG PHE A 66 -2.554 -5.318 -26.611 1.00 6.58 C ATOM 432 CD1 PHE A 66 -2.535 -6.544 -27.269 1.00 5.69 C ATOM 433 CD2 PHE A 66 -1.691 -5.118 -25.542 1.00 6.46 C ATOM 434 CE1 PHE A 66 -1.658 -7.546 -26.878 1.00 6.63 C ATOM 435 CE2 PHE A 66 -0.798 -6.122 -25.152 1.00 4.91 C ATOM 436 CZ PHE A 66 -0.786 -7.336 -25.821 1.00 4.90 C ATOM 437 H PHE A 66 -4.621 -5.156 -24.267 1.00 0.00 H ATOM 438 N ASP A 67 -6.219 -5.762 -27.750 1.00 5.79 N ATOM 439 CA ASP A 67 -6.854 -6.996 -28.204 1.00 5.58 C ATOM 440 C ASP A 67 -6.805 -7.194 -29.723 1.00 5.35 C ATOM 441 O ASP A 67 -7.644 -7.897 -30.287 1.00 7.97 O ATOM 442 CB ASP A 67 -8.291 -7.119 -27.666 1.00 5.79 C ATOM 443 CG ASP A 67 -9.251 -6.133 -28.307 1.00 11.34 C ATOM 444 OD1 ASP A 67 -8.795 -5.297 -29.115 1.00 8.64 O ATOM 445 OD2 ASP A 67 -10.461 -6.195 -28.002 1.00 13.11 O ATOM 446 H ASP A 67 -6.290 -4.906 -28.337 1.00 0.00 H ATOM 447 N THR A 68 -5.816 -6.589 -30.380 1.00 4.37 N ATOM 448 CA THR A 68 -5.566 -6.869 -31.787 1.00 4.54 C ATOM 449 C THR A 68 -4.068 -6.958 -32.022 1.00 7.23 C ATOM 450 O THR A 68 -3.261 -6.495 -31.211 1.00 5.51 O ATOM 451 CB THR A 68 -6.139 -5.785 -32.719 1.00 6.10 C ATOM 452 OG1 THR A 68 -5.397 -4.570 -32.538 1.00 6.58 O ATOM 453 CG2 THR A 68 -7.620 -5.518 -32.418 1.00 6.63 C ATOM 454 HG1 THR A 68 -5.474 -4.275 -31.596 1.00 0.00 H ATOM 455 H THR A 68 -5.213 -5.906 -29.880 1.00 0.00 H ATOM 456 N VAL A 69 -3.706 -7.525 -33.172 1.00 5.18 N ATOM 457 CA VAL A 69 -2.294 -7.607 -33.549 1.00 3.91 C ATOM 458 C VAL A 69 -1.712 -6.213 -33.698 1.00 7.22 C ATOM 459 O VAL A 69 -0.616 -5.925 -33.204 1.00 6.34 O ATOM 460 CB VAL A 69 -2.126 -8.417 -34.848 1.00 4.31 C ATOM 461 CG1 VAL A 69 -0.646 -8.467 -35.253 1.00 4.39 C ATOM 462 CG2 VAL A 69 -2.681 -9.818 -34.681 1.00 7.40 C ATOM 463 H VAL A 69 -4.433 -7.913 -33.807 1.00 0.00 H ATOM 464 N GLU A 70 -2.436 -5.326 -34.391 1.00 6.68 N ATOM 465 CA GLU A 70 -1.950 -3.964 -34.592 1.00 7.16 C ATOM 466 C GLU A 70 -1.725 -3.211 -33.308 1.00 6.85 C ATOM 467 O GLU A 70 -0.722 -2.514 -33.163 1.00 6.85 O ATOM 468 CB GLU A 70 -2.904 -3.211 -35.531 1.00 8.75 C ATOM 469 CG GLU A 70 -2.882 -3.705 -36.971 1.00 10.01 C ATOM 470 CD GLU A 70 -3.822 -4.872 -37.215 1.00 10.56 C ATOM 471 OE1 GLU A 70 -4.064 -5.205 -38.394 1.00 11.76 O ATOM 472 OE2 GLU A 70 -4.318 -5.460 -36.230 1.00 8.07 O ATOM 473 H GLU A 70 -3.354 -5.610 -34.790 1.00 0.00 H ATOM 474 N ASP A 71 -2.655 -3.335 -32.362 1.00 5.99 N ATOM 475 CA ASP A 71 -2.506 -2.588 -31.118 1.00 5.79 C ATOM 476 C ASP A 71 -1.405 -3.176 -30.253 1.00 6.93 C ATOM 477 O ASP A 71 -0.746 -2.437 -29.513 1.00 7.08 O ATOM 478 CB ASP A 71 -3.841 -2.542 -30.375 1.00 6.88 C ATOM 479 CG ASP A 71 -4.883 -1.732 -31.126 1.00 9.27 C ATOM 480 OD1 ASP A 71 -4.546 -0.607 -31.564 1.00 11.78 O ATOM 481 OD2 ASP A 71 -6.027 -2.211 -31.295 1.00 11.30 O ATOM 482 H ASP A 71 -3.476 -3.956 -32.509 1.00 0.00 H ATOM 483 N PHE A 72 -1.161 -4.491 -30.356 1.00 5.53 N ATOM 484 CA PHE A 72 0.003 -5.056 -29.683 1.00 3.57 C ATOM 485 C PHE A 72 1.283 -4.376 -30.150 1.00 4.22 C ATOM 486 O PHE A 72 2.115 -3.967 -29.333 1.00 5.13 O ATOM 487 CB PHE A 72 0.113 -6.562 -29.935 1.00 5.15 C ATOM 488 CG PHE A 72 1.448 -7.113 -29.548 1.00 5.03 C ATOM 489 CD1 PHE A 72 1.790 -7.257 -28.206 1.00 3.63 C ATOM 490 CD2 PHE A 72 2.374 -7.453 -30.522 1.00 5.37 C ATOM 491 CE1 PHE A 72 3.031 -7.762 -27.835 1.00 7.67 C ATOM 492 CE2 PHE A 72 3.622 -7.952 -30.160 1.00 6.57 C ATOM 493 CZ PHE A 72 3.949 -8.105 -28.818 1.00 6.95 C ATOM 494 H PHE A 72 -1.795 -5.101 -30.910 1.00 0.00 H ATOM 495 N TRP A 73 1.466 -4.266 -31.468 1.00 4.85 N ATOM 496 CA TRP A 73 2.731 -3.724 -31.957 1.00 6.21 C ATOM 497 C TRP A 73 2.842 -2.236 -31.668 1.00 6.90 C ATOM 498 O TRP A 73 3.951 -1.737 -31.447 1.00 5.41 O ATOM 499 CB TRP A 73 2.900 -4.003 -33.446 1.00 5.34 C ATOM 500 CG TRP A 73 3.228 -5.425 -33.728 1.00 5.19 C ATOM 501 CD1 TRP A 73 2.464 -6.317 -34.425 1.00 5.68 C ATOM 502 CD2 TRP A 73 4.394 -6.142 -33.295 1.00 5.48 C ATOM 503 NE1 TRP A 73 3.095 -7.539 -34.471 1.00 6.58 N ATOM 504 CE2 TRP A 73 4.278 -7.460 -33.788 1.00 5.91 C ATOM 505 CE3 TRP A 73 5.533 -5.795 -32.547 1.00 5.91 C ATOM 506 CZ2 TRP A 73 5.254 -8.439 -33.567 1.00 6.51 C ATOM 507 CZ3 TRP A 73 6.511 -6.774 -32.331 1.00 7.27 C ATOM 508 CH2 TRP A 73 6.355 -8.085 -32.837 1.00 6.08 C ATOM 509 HE1 TRP A 73 2.731 -8.388 -34.949 1.00 0.00 H ATOM 510 H TRP A 73 0.723 -4.560 -32.133 1.00 0.00 H ATOM 511 N ALA A 74 1.713 -1.519 -31.628 1.00 5.89 N ATOM 512 CA ALA A 74 1.778 -0.099 -31.289 1.00 7.00 C ATOM 513 C ALA A 74 2.329 0.089 -29.879 1.00 6.39 C ATOM 514 O ALA A 74 3.089 1.032 -29.616 1.00 8.29 O ATOM 515 CB ALA A 74 0.393 0.541 -31.426 1.00 7.44 C ATOM 516 H ALA A 74 0.798 -1.968 -31.836 1.00 0.00 H ATOM 517 N LEU A 75 1.967 -0.819 -28.966 1.00 4.40 N ATOM 518 CA LEU A 75 2.485 -0.791 -27.603 1.00 6.82 C ATOM 519 C LEU A 75 3.948 -1.214 -27.566 1.00 5.85 C ATOM 520 O LEU A 75 4.815 -0.477 -27.083 1.00 5.38 O ATOM 521 CB LEU A 75 1.641 -1.709 -26.717 1.00 6.31 C ATOM 522 CG LEU A 75 2.130 -1.913 -25.279 1.00 7.13 C ATOM 523 CD1 LEU A 75 2.253 -0.589 -24.543 1.00 7.77 C ATOM 524 CD2 LEU A 75 1.159 -2.837 -24.552 1.00 8.01 C ATOM 525 H LEU A 75 1.297 -1.567 -29.236 1.00 0.00 H ATOM 526 N TYR A 76 4.240 -2.409 -28.076 1.00 6.36 N ATOM 527 CA TYR A 76 5.602 -2.923 -28.011 1.00 7.07 C ATOM 528 C TYR A 76 6.598 -1.976 -28.673 1.00 5.87 C ATOM 529 O TYR A 76 7.704 -1.778 -28.163 1.00 7.26 O ATOM 530 CB TYR A 76 5.666 -4.300 -28.665 1.00 4.54 C ATOM 531 CG TYR A 76 7.043 -4.922 -28.617 1.00 4.39 C ATOM 532 CD1 TYR A 76 7.441 -5.688 -27.525 1.00 5.68 C ATOM 533 CD2 TYR A 76 7.941 -4.748 -29.668 1.00 7.60 C ATOM 534 CE1 TYR A 76 8.701 -6.259 -27.474 1.00 4.85 C ATOM 535 CE2 TYR A 76 9.199 -5.312 -29.624 1.00 4.88 C ATOM 536 CZ TYR A 76 9.566 -6.074 -28.534 1.00 6.34 C ATOM 537 OH TYR A 76 10.814 -6.644 -28.496 1.00 8.82 O ATOM 538 HH TYR A 76 10.917 -7.154 -27.654 1.00 0.00 H ATOM 539 H TYR A 76 3.493 -2.978 -28.523 1.00 0.00 H ATOM 540 N ASN A 77 6.235 -1.387 -29.811 1.00 4.73 N ATOM 541 CA ASN A 77 7.225 -0.597 -30.534 1.00 5.95 C ATOM 542 C ASN A 77 7.597 0.712 -29.844 1.00 9.39 C ATOM 543 O ASN A 77 8.627 1.298 -30.204 1.00 8.75 O ATOM 544 CB ASN A 77 6.744 -0.301 -31.952 1.00 8.79 C ATOM 545 CG ASN A 77 6.831 -1.510 -32.858 1.00 8.79 C ATOM 546 OD1 ASN A 77 7.634 -2.425 -32.630 1.00 11.07 O ATOM 547 ND2 ASN A 77 5.995 -1.529 -33.893 1.00 10.17 N ATOM 548 HD22 ASN A 77 5.338 -0.738 -34.045 1.00 0.00 H ATOM 549 HD21 ASN A 77 5.999 -2.335 -34.550 1.00 0.00 H ATOM 550 H ASN A 77 5.266 -1.488 -30.176 1.00 0.00 H ATOM 551 N HIS A 78 6.816 1.200 -28.877 1.00 7.54 N ATOM 552 CA HIS A 78 7.169 2.471 -28.256 1.00 8.04 C ATOM 553 C HIS A 78 7.760 2.331 -26.853 1.00 8.80 C ATOM 554 O HIS A 78 8.167 3.345 -26.270 1.00 7.94 O ATOM 555 CB HIS A 78 5.962 3.439 -28.254 1.00 9.56 C ATOM 556 CG HIS A 78 5.025 3.294 -27.091 1.00 7.92 C ATOM 557 ND1 HIS A 78 3.846 2.587 -27.175 1.00 8.86 N ATOM 558 CD2 HIS A 78 5.054 3.825 -25.844 1.00 10.01 C ATOM 559 CE1 HIS A 78 3.210 2.647 -26.018 1.00 9.13 C ATOM 560 NE2 HIS A 78 3.911 3.410 -25.198 1.00 10.18 N ATOM 561 H HIS A 78 5.968 0.681 -28.571 1.00 0.00 H ATOM 562 N ILE A 79 7.874 1.116 -26.311 1.00 6.70 N ATOM 563 CA ILE A 79 8.358 0.940 -24.943 1.00 6.47 C ATOM 564 C ILE A 79 9.757 0.349 -24.980 1.00 5.69 C ATOM 565 O ILE A 79 10.186 -0.267 -25.965 1.00 6.54 O ATOM 566 CB ILE A 79 7.423 0.061 -24.079 1.00 6.50 C ATOM 567 CG1 ILE A 79 7.379 -1.382 -24.613 1.00 6.23 C ATOM 568 CG2 ILE A 79 6.004 0.674 -24.030 1.00 5.86 C ATOM 569 CD1 ILE A 79 6.347 -2.277 -23.895 1.00 7.29 C ATOM 570 H ILE A 79 7.614 0.280 -26.872 1.00 0.00 H ATOM 571 N GLN A 80 10.481 0.555 -23.879 1.00 5.91 N ATOM 572 CA GLN A 80 11.864 0.099 -23.788 1.00 6.19 C ATOM 573 C GLN A 80 11.953 -1.421 -23.847 1.00 6.08 C ATOM 574 O GLN A 80 11.108 -2.136 -23.296 1.00 7.54 O ATOM 575 CB GLN A 80 12.494 0.611 -22.492 1.00 7.77 C ATOM 576 CG GLN A 80 12.839 2.091 -22.587 1.00 10.16 C ATOM 577 CD GLN A 80 13.425 2.629 -21.316 1.00 17.43 C ATOM 578 OE1 GLN A 80 14.274 1.987 -20.690 1.00 18.44 O ATOM 579 NE2 GLN A 80 12.970 3.825 -20.909 1.00 17.50 N ATOM 580 HE22 GLN A 80 12.254 4.328 -21.471 1.00 0.00 H ATOM 581 HE21 GLN A 80 13.334 4.249 -20.032 1.00 0.00 H ATOM 582 H GLN A 80 10.052 1.050 -23.071 1.00 0.00 H ATOM 583 N LEU A 81 12.982 -1.904 -24.535 1.00 5.08 N ATOM 584 CA LEU A 81 13.394 -3.301 -24.403 1.00 6.14 C ATOM 585 C LEU A 81 13.689 -3.643 -22.950 1.00 7.46 C ATOM 586 O LEU A 81 14.163 -2.809 -22.175 1.00 7.50 O ATOM 587 CB LEU A 81 14.643 -3.571 -25.235 1.00 5.82 C ATOM 588 CG LEU A 81 14.454 -3.510 -26.752 1.00 7.98 C ATOM 589 CD1 LEU A 81 15.814 -3.597 -27.444 1.00 10.15 C ATOM 590 CD2 LEU A 81 13.512 -4.603 -27.254 1.00 8.86 C ATOM 591 H LEU A 81 13.504 -1.277 -25.180 1.00 0.00 H ATOM 592 N SER A 82 13.411 -4.900 -22.583 1.00 6.70 N ATOM 593 CA SER A 82 13.682 -5.339 -21.218 1.00 7.98 C ATOM 594 C SER A 82 15.144 -5.111 -20.851 1.00 9.04 C ATOM 595 O SER A 82 15.451 -4.691 -19.728 1.00 9.52 O ATOM 596 CB SER A 82 13.307 -6.815 -21.055 1.00 8.53 C ATOM 597 OG SER A 82 11.904 -6.996 -21.209 1.00 8.76 O ATOM 598 HG SER A 82 11.630 -6.693 -22.111 1.00 0.00 H ATOM 599 H SER A 82 13.002 -5.564 -23.271 1.00 0.00 H ATOM 600 N SER A 83 16.055 -5.346 -21.801 1.00 8.25 N ATOM 601 CA SER A 83 17.482 -5.184 -21.531 1.00 9.69 C ATOM 602 C SER A 83 17.865 -3.752 -21.184 1.00 12.15 C ATOM 603 O SER A 83 18.969 -3.531 -20.661 1.00 13.79 O ATOM 604 CB SER A 83 18.291 -5.663 -22.737 1.00 8.70 C ATOM 605 OG SER A 83 17.987 -4.896 -23.890 1.00 9.86 O ATOM 606 HG SER A 83 18.523 -5.225 -24.655 1.00 0.00 H ATOM 607 H SER A 83 15.743 -5.649 -22.746 1.00 0.00 H ATOM 608 N ASN A 84 16.994 -2.776 -21.451 1.00 9.39 N ATOM 609 CA ASN A 84 17.285 -1.383 -21.131 1.00 12.82 C ATOM 610 C ASN A 84 16.637 -0.896 -19.837 1.00 13.15 C ATOM 611 O ASN A 84 16.896 0.238 -19.430 1.00 11.86 O ATOM 612 CB ASN A 84 16.874 -0.479 -22.297 1.00 13.82 C ATOM 613 CG ASN A 84 17.772 -0.678 -23.522 1.00 14.63 C ATOM 614 OD1 ASN A 84 17.296 -0.770 -24.646 1.00 14.40 O ATOM 615 ND2 ASN A 84 19.082 -0.770 -23.290 1.00 16.39 N ATOM 616 HD22 ASN A 84 19.445 -0.686 -22.319 1.00 0.00 H ATOM 617 HD21 ASN A 84 19.740 -0.926 -24.080 1.00 0.00 H ATOM 618 H ASN A 84 16.086 -3.015 -21.898 1.00 0.00 H ATOM 619 N LEU A 85 15.832 -1.721 -19.167 1.00 11.78 N ATOM 620 CA LEU A 85 15.179 -1.288 -17.938 1.00 10.92 C ATOM 621 C LEU A 85 16.173 -1.203 -16.779 1.00 13.31 C ATOM 622 O LEU A 85 17.222 -1.850 -16.770 1.00 12.97 O ATOM 623 CB LEU A 85 14.052 -2.246 -17.550 1.00 12.61 C ATOM 624 CG LEU A 85 12.888 -2.394 -18.526 1.00 11.16 C ATOM 625 CD1 LEU A 85 11.861 -3.341 -17.927 1.00 10.41 C ATOM 626 CD2 LEU A 85 12.270 -1.026 -18.840 1.00 11.53 C ATOM 627 H LEU A 85 15.668 -2.684 -19.525 1.00 0.00 H ATOM 628 N MET A 86 15.807 -0.411 -15.773 1.00 13.37 N ATOM 629 CA MET A 86 16.629 -0.294 -14.580 1.00 15.68 C ATOM 630 C MET A 86 16.568 -1.578 -13.758 1.00 17.16 C ATOM 631 O MET A 86 15.550 -2.279 -13.770 1.00 12.73 O ATOM 632 CB MET A 86 16.167 0.887 -13.729 1.00 15.76 C ATOM 633 CG MET A 86 16.414 2.225 -14.396 1.00 22.60 C ATOM 634 SD MET A 86 16.170 3.592 -13.256 1.00 33.00 S ATOM 635 CE MET A 86 17.418 3.210 -12.020 1.00 28.41 C ATOM 636 H MET A 86 14.922 0.131 -15.842 1.00 0.00 H ATOM 637 N PRO A 87 17.640 -1.894 -13.028 1.00 16.04 N ATOM 638 CA PRO A 87 17.647 -3.091 -12.180 1.00 17.73 C ATOM 639 C PRO A 87 16.449 -3.126 -11.254 1.00 14.57 C ATOM 640 O PRO A 87 16.105 -2.133 -10.611 1.00 18.05 O ATOM 641 CB PRO A 87 18.953 -2.968 -11.378 1.00 20.05 C ATOM 642 CG PRO A 87 19.763 -1.943 -12.068 1.00 25.50 C ATOM 643 CD PRO A 87 18.853 -1.071 -12.859 1.00 21.00 C ATOM 644 N GLY A 88 15.806 -4.282 -11.196 1.00 11.84 N ATOM 645 CA GLY A 88 14.716 -4.490 -10.276 1.00 11.62 C ATOM 646 C GLY A 88 13.340 -4.280 -10.853 1.00 10.28 C ATOM 647 O GLY A 88 12.356 -4.516 -10.142 1.00 12.34 O ATOM 648 H GLY A 88 16.094 -5.056 -11.828 1.00 0.00 H ATOM 649 N CYS A 89 13.232 -3.848 -12.107 1.00 8.58 N ATOM 650 CA CYS A 89 11.932 -3.627 -12.735 1.00 9.45 C ATOM 651 C CYS A 89 11.449 -4.898 -13.433 1.00 10.21 C ATOM 652 O CYS A 89 12.240 -5.789 -13.761 1.00 8.69 O ATOM 653 CB CYS A 89 12.012 -2.470 -13.737 1.00 11.68 C ATOM 654 SG CYS A 89 12.380 -0.840 -12.965 1.00 15.32 S ATOM 655 H CYS A 89 14.097 -3.663 -12.655 1.00 0.00 H ATOM 656 N ASP A 90 10.128 -4.951 -13.632 1.00 8.46 N ATOM 657 CA ASP A 90 9.420 -6.052 -14.286 1.00 7.46 C ATOM 658 C ASP A 90 8.532 -5.516 -15.411 1.00 8.55 C ATOM 659 O ASP A 90 8.059 -4.381 -15.349 1.00 9.10 O ATOM 660 CB ASP A 90 8.476 -6.757 -13.293 1.00 9.87 C ATOM 661 CG ASP A 90 9.202 -7.453 -12.154 1.00 9.77 C ATOM 662 OD1 ASP A 90 10.424 -7.681 -12.277 1.00 10.46 O ATOM 663 OD2 ASP A 90 8.550 -7.771 -11.137 1.00 11.55 O ATOM 664 H ASP A 90 9.560 -4.148 -13.296 1.00 0.00 H ATOM 665 N TYR A 91 8.286 -6.346 -16.423 1.00 5.88 N ATOM 666 CA TYR A 91 7.132 -6.202 -17.301 1.00 4.41 C ATOM 667 C TYR A 91 6.312 -7.463 -17.029 1.00 4.48 C ATOM 668 O TYR A 91 6.872 -8.541 -16.828 1.00 5.35 O ATOM 669 CB TYR A 91 7.498 -6.198 -18.795 1.00 6.07 C ATOM 670 CG TYR A 91 7.945 -4.893 -19.451 1.00 4.05 C ATOM 671 CD1 TYR A 91 9.160 -4.850 -20.129 1.00 6.28 C ATOM 672 CD2 TYR A 91 7.189 -3.729 -19.405 1.00 7.02 C ATOM 673 CE1 TYR A 91 9.610 -3.697 -20.739 1.00 6.00 C ATOM 674 CE2 TYR A 91 7.643 -2.564 -20.020 1.00 7.40 C ATOM 675 CZ TYR A 91 8.849 -2.557 -20.682 1.00 7.76 C ATOM 676 OH TYR A 91 9.292 -1.404 -21.288 1.00 6.14 O ATOM 677 HH TYR A 91 10.169 -1.573 -21.715 1.00 0.00 H ATOM 678 H TYR A 91 8.946 -7.131 -16.594 1.00 0.00 H ATOM 679 N SER A 92 4.983 -7.329 -17.034 1.00 5.63 N ATOM 680 CA SER A 92 4.075 -8.467 -16.942 1.00 5.11 C ATOM 681 C SER A 92 3.000 -8.302 -18.006 1.00 5.09 C ATOM 682 O SER A 92 2.413 -7.221 -18.128 1.00 6.75 O ATOM 683 CB SER A 92 3.407 -8.569 -15.552 1.00 7.90 C ATOM 684 OG SER A 92 4.380 -8.642 -14.519 1.00 8.24 O ATOM 685 HG SER A 92 4.944 -7.829 -14.540 1.00 0.00 H ATOM 686 H SER A 92 4.579 -6.374 -17.107 1.00 0.00 H ATOM 687 N LEU A 93 2.728 -9.368 -18.765 1.00 4.82 N ATOM 688 CA LEU A 93 1.605 -9.382 -19.704 1.00 4.49 C ATOM 689 C LEU A 93 0.628 -10.433 -19.210 1.00 5.87 C ATOM 690 O LEU A 93 0.961 -11.619 -19.180 1.00 5.54 O ATOM 691 CB LEU A 93 2.042 -9.694 -21.134 1.00 5.06 C ATOM 692 CG LEU A 93 0.869 -9.539 -22.125 1.00 5.25 C ATOM 693 CD1 LEU A 93 0.678 -8.059 -22.498 1.00 4.62 C ATOM 694 CD2 LEU A 93 1.018 -10.402 -23.391 1.00 5.16 C ATOM 695 H LEU A 93 3.331 -10.211 -18.686 1.00 0.00 H ATOM 696 N PHE A 94 -0.568 -10.007 -18.812 1.00 5.51 N ATOM 697 CA PHE A 94 -1.549 -10.940 -18.276 1.00 6.98 C ATOM 698 C PHE A 94 -2.883 -10.765 -18.976 1.00 5.51 C ATOM 699 O PHE A 94 -3.222 -9.679 -19.455 1.00 5.67 O ATOM 700 CB PHE A 94 -1.715 -10.772 -16.756 1.00 5.93 C ATOM 701 CG PHE A 94 -0.759 -11.609 -15.972 1.00 5.51 C ATOM 702 CD1 PHE A 94 0.599 -11.301 -15.961 1.00 6.45 C ATOM 703 CD2 PHE A 94 -1.202 -12.723 -15.272 1.00 6.93 C ATOM 704 CE1 PHE A 94 1.499 -12.093 -15.262 1.00 6.98 C ATOM 705 CE2 PHE A 94 -0.316 -13.517 -14.560 1.00 6.40 C ATOM 706 CZ PHE A 94 1.038 -13.215 -14.563 1.00 7.54 C ATOM 707 H PHE A 94 -0.805 -8.997 -18.885 1.00 0.00 H ATOM 708 N LYS A 95 -3.630 -11.866 -19.054 1.00 7.11 N ATOM 709 CA LYS A 95 -4.967 -11.804 -19.615 1.00 6.14 C ATOM 710 C LYS A 95 -5.795 -10.763 -18.880 1.00 8.55 C ATOM 711 O LYS A 95 -5.707 -10.625 -17.659 1.00 6.72 O ATOM 712 CB LYS A 95 -5.653 -13.168 -19.519 1.00 7.47 C ATOM 713 CG LYS A 95 -5.279 -14.135 -20.594 1.00 14.91 C ATOM 714 CD LYS A 95 -6.105 -15.396 -20.458 1.00 14.48 C ATOM 715 CE LYS A 95 -5.536 -16.493 -21.310 1.00 16.54 C ATOM 716 NZ LYS A 95 -6.084 -17.812 -20.865 1.00 11.88 N ATOM 717 HZ1 LYS A 95 -5.825 -17.976 -19.871 1.00 0.00 H ATOM 718 HZ2 LYS A 95 -7.120 -17.805 -20.957 1.00 0.00 H ATOM 719 HZ3 LYS A 95 -5.687 -18.569 -21.458 1.00 0.00 H ATOM 720 H LYS A 95 -3.253 -12.773 -18.712 1.00 0.00 H ATOM 721 N ASP A 96 -6.566 -9.996 -19.645 1.00 6.70 N ATOM 722 CA ASP A 96 -7.469 -9.008 -19.070 1.00 8.88 C ATOM 723 C ASP A 96 -8.294 -9.639 -17.957 1.00 12.54 C ATOM 724 O ASP A 96 -8.924 -10.679 -18.157 1.00 12.49 O ATOM 725 CB ASP A 96 -8.373 -8.465 -20.180 1.00 11.36 C ATOM 726 CG ASP A 96 -9.324 -7.399 -19.707 1.00 15.48 C ATOM 727 OD1 ASP A 96 -9.005 -6.684 -18.730 1.00 14.78 O ATOM 728 OD2 ASP A 96 -10.401 -7.280 -20.343 1.00 17.75 O ATOM 729 H ASP A 96 -6.523 -10.104 -20.678 1.00 0.00 H ATOM 730 N GLY A 97 -8.249 -9.026 -16.772 1.00 8.76 N ATOM 731 CA GLY A 97 -8.984 -9.504 -15.614 1.00 10.74 C ATOM 732 C GLY A 97 -8.178 -10.346 -14.644 1.00 15.75 C ATOM 733 O GLY A 97 -8.690 -10.685 -13.562 1.00 14.16 O ATOM 734 H GLY A 97 -7.664 -8.172 -16.674 1.00 0.00 H ATOM 735 N ILE A 98 -6.947 -10.707 -14.999 1.00 10.08 N ATOM 736 CA ILE A 98 -6.043 -11.417 -14.099 1.00 8.24 C ATOM 737 C ILE A 98 -4.955 -10.436 -13.689 1.00 10.76 C ATOM 738 O ILE A 98 -4.170 -9.981 -14.532 1.00 11.67 O ATOM 739 CB ILE A 98 -5.425 -12.667 -14.750 1.00 9.50 C ATOM 740 CG1 ILE A 98 -6.506 -13.614 -15.294 1.00 9.27 C ATOM 741 CG2 ILE A 98 -4.548 -13.386 -13.735 1.00 8.82 C ATOM 742 CD1 ILE A 98 -5.954 -14.903 -15.969 1.00 8.76 C ATOM 743 H ILE A 98 -6.616 -10.474 -15.957 1.00 0.00 H ATOM 744 N GLU A 99 -4.907 -10.100 -12.407 1.00 11.45 N ATOM 745 CA GLU A 99 -3.826 -9.254 -11.932 1.00 14.63 C ATOM 746 C GLU A 99 -2.521 -10.050 -11.867 1.00 10.82 C ATOM 747 O GLU A 99 -2.534 -11.248 -11.594 1.00 9.11 O ATOM 748 CB GLU A 99 -4.172 -8.680 -10.565 1.00 17.16 C ATOM 749 CG GLU A 99 -5.407 -7.801 -10.636 1.00 21.67 C ATOM 750 CD GLU A 99 -5.409 -6.732 -9.576 1.00 30.96 C ATOM 751 OE1 GLU A 99 -5.008 -7.032 -8.431 1.00 33.83 O ATOM 752 OE2 GLU A 99 -5.803 -5.592 -9.892 1.00 41.67 O ATOM 753 H GLU A 99 -5.637 -10.439 -11.748 1.00 0.00 H ATOM 754 N PRO A 100 -1.361 -9.399 -12.159 1.00 8.78 N ATOM 755 CA PRO A 100 -0.073 -10.109 -12.213 1.00 8.74 C ATOM 756 C PRO A 100 0.533 -10.358 -10.833 1.00 11.07 C ATOM 757 O PRO A 100 1.689 -10.021 -10.569 1.00 10.04 O ATOM 758 CB PRO A 100 0.791 -9.173 -13.065 1.00 12.06 C ATOM 759 CG PRO A 100 0.205 -7.811 -12.821 1.00 15.76 C ATOM 760 CD PRO A 100 -1.249 -7.982 -12.552 1.00 11.01 C ATOM 761 N MET A 101 -0.260 -10.956 -9.949 1.00 9.64 N ATOM 762 CA MET A 101 0.157 -11.288 -8.595 1.00 9.79 C ATOM 763 C MET A 101 -0.434 -12.645 -8.239 1.00 8.79 C ATOM 764 O MET A 101 -1.532 -12.990 -8.680 1.00 7.64 O ATOM 765 CB MET A 101 -0.283 -10.197 -7.591 1.00 13.53 C ATOM 766 CG MET A 101 -1.779 -10.046 -7.435 1.00 17.18 C ATOM 767 SD MET A 101 -2.196 -8.689 -6.298 1.00 27.75 S ATOM 768 CE MET A 101 -1.436 -7.306 -7.126 1.00 21.71 C ATOM 769 H MET A 101 -1.228 -11.199 -10.240 1.00 0.00 H ATOM 770 N TRP A 102 0.305 -13.427 -7.450 1.00 7.89 N ATOM 771 CA TRP A 102 -0.112 -14.811 -7.265 1.00 8.27 C ATOM 772 C TRP A 102 -1.386 -14.915 -6.445 1.00 10.05 C ATOM 773 O TRP A 102 -2.079 -15.930 -6.537 1.00 9.42 O ATOM 774 CB TRP A 102 1.021 -15.648 -6.649 1.00 10.94 C ATOM 775 CG TRP A 102 1.142 -15.626 -5.139 1.00 8.67 C ATOM 776 CD1 TRP A 102 1.859 -14.734 -4.378 1.00 9.91 C ATOM 777 CD2 TRP A 102 0.569 -16.567 -4.224 1.00 8.31 C ATOM 778 NE1 TRP A 102 1.742 -15.056 -3.037 1.00 11.94 N ATOM 779 CE2 TRP A 102 0.963 -16.179 -2.919 1.00 9.53 C ATOM 780 CE3 TRP A 102 -0.239 -17.698 -4.378 1.00 10.95 C ATOM 781 CZ2 TRP A 102 0.565 -16.882 -1.778 1.00 11.26 C ATOM 782 CZ3 TRP A 102 -0.632 -18.401 -3.240 1.00 13.12 C ATOM 783 CH2 TRP A 102 -0.220 -17.987 -1.957 1.00 9.26 C ATOM 784 HE1 TRP A 102 2.174 -14.533 -2.249 1.00 0.00 H ATOM 785 H TRP A 102 1.156 -13.059 -6.979 1.00 0.00 H ATOM 786 N GLU A 103 -1.734 -13.874 -5.686 1.00 11.12 N ATOM 787 CA GLU A 103 -2.967 -13.895 -4.904 1.00 11.21 C ATOM 788 C GLU A 103 -4.235 -13.834 -5.750 1.00 12.51 C ATOM 789 O GLU A 103 -5.315 -14.135 -5.221 1.00 15.06 O ATOM 790 CB GLU A 103 -2.945 -12.735 -3.907 1.00 11.20 C ATOM 791 CG GLU A 103 -1.799 -12.835 -2.917 1.00 14.06 C ATOM 792 CD GLU A 103 -0.626 -11.921 -3.239 1.00 19.27 C ATOM 793 OE1 GLU A 103 -0.296 -11.729 -4.433 1.00 13.09 O ATOM 794 OE2 GLU A 103 -0.013 -11.392 -2.283 1.00 18.87 O ATOM 795 H GLU A 103 -1.119 -13.036 -5.651 1.00 0.00 H ATOM 796 N ASP A 104 -4.142 -13.469 -7.030 1.00 9.77 N ATOM 797 CA ASP A 104 -5.314 -13.447 -7.898 1.00 12.24 C ATOM 798 C ASP A 104 -6.001 -14.806 -7.908 1.00 12.62 C ATOM 799 O ASP A 104 -5.347 -15.853 -7.830 1.00 10.27 O ATOM 800 CB ASP A 104 -4.913 -13.064 -9.333 1.00 10.22 C ATOM 801 CG ASP A 104 -6.122 -12.742 -10.225 1.00 13.07 C ATOM 802 OD1 ASP A 104 -6.442 -11.550 -10.398 1.00 12.74 O ATOM 803 OD2 ASP A 104 -6.752 -13.676 -10.757 1.00 10.73 O ATOM 804 H ASP A 104 -3.216 -13.195 -7.416 1.00 0.00 H ATOM 805 N GLU A 105 -7.338 -14.789 -8.016 1.00 11.87 N ATOM 806 CA GLU A 105 -8.098 -16.034 -7.968 1.00 11.38 C ATOM 807 C GLU A 105 -7.656 -17.005 -9.056 1.00 12.28 C ATOM 808 O GLU A 105 -7.692 -18.221 -8.850 1.00 13.44 O ATOM 809 CB GLU A 105 -9.607 -15.745 -8.058 1.00 17.95 C ATOM 810 CG GLU A 105 -10.470 -16.996 -8.173 1.00 26.30 C ATOM 811 CD GLU A 105 -10.761 -17.597 -6.786 1.00 31.18 C ATOM 812 OE1 GLU A 105 -10.455 -16.946 -5.752 1.00 28.76 O ATOM 813 OE2 GLU A 105 -11.277 -18.737 -6.709 1.00 45.74 O ATOM 814 H GLU A 105 -7.836 -13.884 -8.135 1.00 0.00 H ATOM 815 N LYS A 106 -7.206 -16.485 -10.202 1.00 10.98 N ATOM 816 CA LYS A 106 -6.735 -17.334 -11.294 1.00 10.88 C ATOM 817 C LYS A 106 -5.271 -17.747 -11.173 1.00 8.77 C ATOM 818 O LYS A 106 -4.818 -18.594 -11.954 1.00 10.00 O ATOM 819 CB LYS A 106 -6.935 -16.631 -12.644 1.00 12.15 C ATOM 820 CG LYS A 106 -8.402 -16.505 -13.037 1.00 16.25 C ATOM 821 CD LYS A 106 -9.016 -17.881 -13.251 1.00 20.15 C ATOM 822 CE LYS A 106 -8.440 -18.556 -14.487 1.00 21.28 C ATOM 823 NZ LYS A 106 -9.069 -19.886 -14.726 1.00 31.50 N ATOM 824 HZ1 LYS A 106 -8.899 -20.501 -13.905 1.00 0.00 H ATOM 825 HZ2 LYS A 106 -10.093 -19.764 -14.863 1.00 0.00 H ATOM 826 HZ3 LYS A 106 -8.653 -20.317 -15.576 1.00 0.00 H ATOM 827 H LYS A 106 -7.191 -15.452 -10.319 1.00 0.00 H ATOM 828 N ASN A 107 -4.522 -17.190 -10.220 1.00 8.78 N ATOM 829 CA ASN A 107 -3.125 -17.551 -10.018 1.00 8.25 C ATOM 830 C ASN A 107 -2.868 -18.358 -8.752 1.00 7.60 C ATOM 831 O ASN A 107 -1.858 -19.064 -8.682 1.00 9.52 O ATOM 832 CB ASN A 107 -2.248 -16.289 -9.954 1.00 9.28 C ATOM 833 CG ASN A 107 -2.191 -15.540 -11.278 1.00 9.00 C ATOM 834 OD1 ASN A 107 -2.146 -16.143 -12.348 1.00 9.37 O ATOM 835 ND2 ASN A 107 -2.165 -14.216 -11.205 1.00 8.10 N ATOM 836 HD22 ASN A 107 -2.205 -13.745 -10.278 1.00 0.00 H ATOM 837 HD21 ASN A 107 -2.104 -13.648 -12.074 1.00 0.00 H ATOM 838 H ASN A 107 -4.950 -16.473 -9.600 1.00 0.00 H ATOM 839 N LYS A 108 -3.752 -18.277 -7.755 1.00 9.80 N ATOM 840 CA LYS A 108 -3.378 -18.739 -6.418 1.00 9.70 C ATOM 841 C LYS A 108 -3.150 -20.246 -6.342 1.00 9.22 C ATOM 842 O LYS A 108 -2.347 -20.700 -5.513 1.00 11.60 O ATOM 843 CB LYS A 108 -4.435 -18.300 -5.402 1.00 9.70 C ATOM 844 CG LYS A 108 -5.843 -18.791 -5.664 1.00 13.61 C ATOM 845 CD LYS A 108 -6.783 -18.104 -4.671 1.00 15.99 C ATOM 846 CE LYS A 108 -8.152 -18.737 -4.646 1.00 29.38 C ATOM 847 NZ LYS A 108 -9.075 -18.038 -3.700 1.00 33.56 N ATOM 848 HZ1 LYS A 108 -8.680 -18.079 -2.739 1.00 0.00 H ATOM 849 HZ2 LYS A 108 -9.181 -17.045 -3.991 1.00 0.00 H ATOM 850 HZ3 LYS A 108 -10.004 -18.506 -3.715 1.00 0.00 H ATOM 851 H LYS A 108 -4.701 -17.888 -7.928 1.00 0.00 H ATOM 852 N ARG A 109 -3.802 -21.011 -7.208 1.00 9.38 N ATOM 853 CA ARG A 109 -3.590 -22.452 -7.234 1.00 11.66 C ATOM 854 C ARG A 109 -2.609 -22.852 -8.334 1.00 11.77 C ATOM 855 O ARG A 109 -2.428 -24.038 -8.609 1.00 9.72 O ATOM 856 CB ARG A 109 -4.919 -23.186 -7.423 1.00 14.15 C ATOM 857 CG ARG A 109 -5.841 -23.122 -6.216 1.00 18.41 C ATOM 858 CD ARG A 109 -7.121 -23.904 -6.458 1.00 21.97 C ATOM 859 NE ARG A 109 -6.867 -25.332 -6.623 1.00 35.37 N ATOM 860 CZ ARG A 109 -6.734 -26.189 -5.616 1.00 40.38 C ATOM 861 NH1 ARG A 109 -6.830 -25.763 -4.364 1.00 37.52 N ATOM 862 NH2 ARG A 109 -6.504 -27.472 -5.860 1.00 38.14 N ATOM 863 HE ARG A 109 -6.785 -25.703 -7.591 1.00 0.00 H ATOM 864 HH12 ARG A 109 -6.726 -26.435 -3.577 1.00 0.00 H ATOM 865 HH11 ARG A 109 -7.010 -24.757 -4.169 1.00 0.00 H ATOM 866 HH22 ARG A 109 -6.400 -28.141 -5.071 1.00 0.00 H ATOM 867 HH21 ARG A 109 -6.427 -27.809 -6.841 1.00 0.00 H ATOM 868 H ARG A 109 -4.471 -20.577 -7.875 1.00 0.00 H ATOM 869 N GLY A 110 -1.985 -21.863 -8.968 1.00 11.06 N ATOM 870 CA GLY A 110 -1.122 -22.162 -10.095 1.00 9.47 C ATOM 871 C GLY A 110 0.353 -22.012 -9.788 1.00 10.59 C ATOM 872 O GLY A 110 0.784 -22.163 -8.642 1.00 10.33 O ATOM 873 H GLY A 110 -2.115 -20.879 -8.657 1.00 0.00 H ATOM 874 N GLY A 111 1.130 -21.707 -10.819 1.00 8.85 N ATOM 875 CA GLY A 111 2.574 -21.711 -10.720 1.00 5.36 C ATOM 876 C GLY A 111 3.159 -21.177 -12.009 1.00 7.78 C ATOM 877 O GLY A 111 2.441 -20.641 -12.855 1.00 7.15 O ATOM 878 H GLY A 111 0.688 -21.457 -11.727 1.00 0.00 H ATOM 879 N ARG A 112 4.475 -21.339 -12.164 1.00 7.54 N ATOM 880 CA ARG A 112 5.143 -20.739 -13.315 1.00 5.43 C ATOM 881 C ARG A 112 6.258 -21.626 -13.849 1.00 8.00 C ATOM 882 O ARG A 112 6.993 -22.264 -13.085 1.00 6.70 O ATOM 883 CB ARG A 112 5.717 -19.355 -12.965 1.00 6.24 C ATOM 884 CG ARG A 112 6.737 -19.414 -11.828 1.00 7.70 C ATOM 885 CD ARG A 112 7.219 -18.033 -11.392 1.00 9.14 C ATOM 886 NE ARG A 112 8.151 -18.177 -10.277 1.00 13.70 N ATOM 887 CZ ARG A 112 9.129 -17.319 -9.982 1.00 17.30 C ATOM 888 NH1 ARG A 112 9.303 -16.214 -10.697 1.00 11.42 N ATOM 889 NH2 ARG A 112 9.930 -17.564 -8.950 1.00 17.37 N ATOM 890 HE ARG A 112 8.044 -19.012 -9.666 1.00 0.00 H ATOM 891 HH12 ARG A 112 10.070 -15.554 -10.456 1.00 0.00 H ATOM 892 HH11 ARG A 112 8.673 -16.009 -11.498 1.00 0.00 H ATOM 893 HH22 ARG A 112 10.694 -16.899 -8.715 1.00 0.00 H ATOM 894 HH21 ARG A 112 9.793 -18.421 -8.377 1.00 0.00 H ATOM 895 H ARG A 112 5.020 -21.889 -11.470 1.00 0.00 H ATOM 896 N TRP A 113 6.372 -21.653 -15.179 1.00 5.46 N ATOM 897 CA TRP A 113 7.562 -22.161 -15.850 1.00 5.36 C ATOM 898 C TRP A 113 8.622 -21.071 -15.831 1.00 6.40 C ATOM 899 O TRP A 113 8.405 -19.994 -16.396 1.00 7.13 O ATOM 900 CB TRP A 113 7.230 -22.543 -17.293 1.00 7.80 C ATOM 901 CG TRP A 113 6.567 -23.884 -17.396 1.00 7.30 C ATOM 902 CD1 TRP A 113 5.261 -24.146 -17.724 1.00 7.87 C ATOM 903 CD2 TRP A 113 7.188 -25.151 -17.156 1.00 6.97 C ATOM 904 NE1 TRP A 113 5.039 -25.510 -17.704 1.00 7.48 N ATOM 905 CE2 TRP A 113 6.204 -26.144 -17.355 1.00 7.88 C ATOM 906 CE3 TRP A 113 8.484 -25.544 -16.803 1.00 6.83 C ATOM 907 CZ2 TRP A 113 6.479 -27.508 -17.204 1.00 8.94 C ATOM 908 CZ3 TRP A 113 8.753 -26.902 -16.642 1.00 7.64 C ATOM 909 CH2 TRP A 113 7.759 -27.863 -16.861 1.00 7.86 C ATOM 910 HE1 TRP A 113 4.136 -25.979 -17.919 1.00 0.00 H ATOM 911 H TRP A 113 5.583 -21.299 -15.757 1.00 0.00 H ATOM 912 N LEU A 114 9.748 -21.332 -15.174 1.00 5.62 N ATOM 913 CA LEU A 114 10.764 -20.315 -14.916 1.00 6.79 C ATOM 914 C LEU A 114 11.988 -20.514 -15.805 1.00 8.64 C ATOM 915 O LEU A 114 12.567 -21.607 -15.840 1.00 10.50 O ATOM 916 CB LEU A 114 11.193 -20.339 -13.447 1.00 7.89 C ATOM 917 CG LEU A 114 12.277 -19.325 -13.103 1.00 12.71 C ATOM 918 CD1 LEU A 114 11.750 -17.903 -13.270 1.00 10.23 C ATOM 919 CD2 LEU A 114 12.778 -19.566 -11.680 1.00 17.12 C ATOM 920 H LEU A 114 9.912 -22.300 -14.830 1.00 0.00 H ATOM 921 N ILE A 115 12.389 -19.440 -16.487 1.00 6.61 N ATOM 922 CA ILE A 115 13.594 -19.378 -17.317 1.00 9.99 C ATOM 923 C ILE A 115 14.566 -18.477 -16.572 1.00 9.26 C ATOM 924 O ILE A 115 14.316 -17.273 -16.453 1.00 8.22 O ATOM 925 CB ILE A 115 13.305 -18.792 -18.713 1.00 8.86 C ATOM 926 CG1 ILE A 115 12.044 -19.402 -19.352 1.00 12.53 C ATOM 927 CG2 ILE A 115 14.533 -18.901 -19.629 1.00 16.49 C ATOM 928 CD1 ILE A 115 12.129 -20.884 -19.621 1.00 14.17 C ATOM 929 H ILE A 115 11.803 -18.583 -16.425 1.00 0.00 H ATOM 930 N THR A 116 15.676 -19.030 -16.079 1.00 10.31 N ATOM 931 CA THR A 116 16.715 -18.228 -15.437 1.00 8.34 C ATOM 932 C THR A 116 17.861 -18.000 -16.410 1.00 10.98 C ATOM 933 O THR A 116 18.373 -18.951 -17.009 1.00 17.60 O ATOM 934 CB THR A 116 17.248 -18.908 -14.176 1.00 22.42 C ATOM 935 OG1 THR A 116 17.785 -20.190 -14.529 1.00 28.01 O ATOM 936 CG2 THR A 116 16.137 -19.085 -13.166 1.00 12.97 C ATOM 937 HG1 THR A 116 17.072 -20.745 -14.933 1.00 0.00 H ATOM 938 H THR A 116 15.805 -20.059 -16.154 1.00 0.00 H ATOM 939 N LEU A 117 18.269 -16.745 -16.555 1.00 9.36 N ATOM 940 CA LEU A 117 19.316 -16.359 -17.485 1.00 9.45 C ATOM 941 C LEU A 117 20.571 -15.987 -16.708 1.00 11.32 C ATOM 942 O LEU A 117 20.493 -15.482 -15.586 1.00 14.30 O ATOM 943 CB LEU A 117 18.874 -15.173 -18.351 1.00 10.08 C ATOM 944 CG LEU A 117 17.610 -15.352 -19.202 1.00 15.52 C ATOM 945 CD1 LEU A 117 17.440 -14.170 -20.156 1.00 12.76 C ATOM 946 CD2 LEU A 117 17.652 -16.651 -19.988 1.00 16.17 C ATOM 947 H LEU A 117 17.819 -16.006 -15.978 1.00 0.00 H ATOM 948 N ASN A 118 21.729 -16.258 -17.299 1.00 12.50 N ATOM 949 CA ASN A 118 22.962 -15.785 -16.682 1.00 11.62 C ATOM 950 C ASN A 118 23.206 -14.323 -17.077 1.00 12.70 C ATOM 951 O ASN A 118 22.481 -13.743 -17.890 1.00 9.79 O ATOM 952 CB ASN A 118 24.144 -16.697 -17.057 1.00 13.03 C ATOM 953 CG ASN A 118 24.466 -16.696 -18.560 1.00 14.18 C ATOM 954 OD1 ASN A 118 24.442 -15.656 -19.223 1.00 11.77 O ATOM 955 ND2 ASN A 118 24.776 -17.875 -19.096 1.00 18.00 N ATOM 956 HD22 ASN A 118 24.785 -18.729 -18.503 1.00 0.00 H ATOM 957 HD21 ASN A 118 25.009 -17.941 -20.107 1.00 0.00 H ATOM 958 H ASN A 118 21.756 -16.799 -18.187 1.00 0.00 H ATOM 959 N LYS A 119 24.249 -13.715 -16.500 1.00 11.12 N ATOM 960 CA LYS A 119 24.448 -12.292 -16.757 1.00 11.86 C ATOM 961 C LYS A 119 24.770 -12.016 -18.222 1.00 11.85 C ATOM 962 O LYS A 119 24.410 -10.953 -18.740 1.00 14.64 O ATOM 963 CB LYS A 119 25.551 -11.727 -15.858 1.00 11.61 C ATOM 964 CG LYS A 119 25.175 -11.560 -14.394 1.00 15.33 C ATOM 965 CD LYS A 119 26.351 -10.918 -13.652 1.00 17.65 C ATOM 966 CE LYS A 119 26.232 -11.062 -12.163 1.00 30.94 C ATOM 967 NZ LYS A 119 27.315 -10.286 -11.493 1.00 30.70 N ATOM 968 HZ1 LYS A 119 28.240 -10.647 -11.801 1.00 0.00 H ATOM 969 HZ2 LYS A 119 27.230 -9.282 -11.750 1.00 0.00 H ATOM 970 HZ3 LYS A 119 27.227 -10.390 -10.462 1.00 0.00 H ATOM 971 H LYS A 119 24.901 -14.242 -15.885 1.00 0.00 H ATOM 972 N GLN A 120 25.435 -12.951 -18.910 1.00 10.73 N ATOM 973 CA GLN A 120 25.774 -12.725 -20.314 1.00 9.04 C ATOM 974 C GLN A 120 24.554 -12.798 -21.220 1.00 14.51 C ATOM 975 O GLN A 120 24.566 -12.217 -22.313 1.00 10.41 O ATOM 976 CB GLN A 120 26.829 -13.734 -20.780 1.00 13.14 C ATOM 977 CG GLN A 120 28.174 -13.583 -20.073 1.00 13.74 C ATOM 978 CD GLN A 120 28.167 -14.129 -18.657 1.00 16.18 C ATOM 979 OE1 GLN A 120 27.616 -15.200 -18.392 1.00 15.57 O ATOM 980 NE2 GLN A 120 28.763 -13.382 -17.731 1.00 11.48 N ATOM 981 HE22 GLN A 120 29.216 -12.485 -17.999 1.00 0.00 H ATOM 982 HE21 GLN A 120 28.776 -13.695 -16.739 1.00 0.00 H ATOM 983 H GLN A 120 25.711 -13.840 -18.446 1.00 0.00 H ATOM 984 N GLN A 121 23.497 -13.478 -20.784 1.00 10.48 N ATOM 985 CA GLN A 121 22.315 -13.626 -21.619 1.00 7.94 C ATOM 986 C GLN A 121 21.439 -12.383 -21.652 1.00 9.55 C ATOM 987 O GLN A 121 20.498 -12.343 -22.451 1.00 9.83 O ATOM 988 CB GLN A 121 21.490 -14.818 -21.147 1.00 11.60 C ATOM 989 CG GLN A 121 22.091 -16.134 -21.560 1.00 13.93 C ATOM 990 CD GLN A 121 21.293 -17.297 -21.038 1.00 14.11 C ATOM 991 OE1 GLN A 121 21.334 -17.596 -19.845 1.00 13.06 O ATOM 992 NE2 GLN A 121 20.542 -17.957 -21.930 1.00 17.29 N ATOM 993 HE22 GLN A 121 20.542 -17.664 -22.928 1.00 0.00 H ATOM 994 HE21 GLN A 121 19.959 -18.762 -21.624 1.00 0.00 H ATOM 995 H GLN A 121 23.516 -13.908 -19.837 1.00 0.00 H ATOM 996 N ARG A 122 21.706 -11.375 -20.816 1.00 10.45 N ATOM 997 CA ARG A 122 20.989 -10.116 -20.994 1.00 10.12 C ATOM 998 C ARG A 122 21.261 -9.540 -22.375 1.00 13.88 C ATOM 999 O ARG A 122 20.347 -9.051 -23.053 1.00 12.86 O ATOM 1000 CB ARG A 122 21.370 -9.090 -19.929 1.00 10.59 C ATOM 1001 CG ARG A 122 20.672 -7.757 -20.251 1.00 15.02 C ATOM 1002 CD ARG A 122 20.724 -6.751 -19.159 1.00 21.00 C ATOM 1003 NE ARG A 122 20.161 -7.270 -17.920 1.00 15.84 N ATOM 1004 CZ ARG A 122 20.333 -6.675 -16.752 1.00 15.76 C ATOM 1005 NH1 ARG A 122 21.039 -5.552 -16.698 1.00 24.36 N ATOM 1006 NH2 ARG A 122 19.810 -7.194 -15.648 1.00 11.90 N ATOM 1007 HE ARG A 122 19.600 -8.145 -17.956 1.00 0.00 H ATOM 1008 HH12 ARG A 122 21.183 -5.072 -15.787 1.00 0.00 H ATOM 1009 HH11 ARG A 122 21.448 -5.152 -17.567 1.00 0.00 H ATOM 1010 HH22 ARG A 122 19.950 -6.719 -14.733 1.00 0.00 H ATOM 1011 HH21 ARG A 122 19.260 -8.075 -15.698 1.00 0.00 H ATOM 1012 H ARG A 122 22.408 -11.485 -20.057 1.00 0.00 H ATOM 1013 N ARG A 123 22.519 -9.607 -22.815 1.00 9.88 N ATOM 1014 CA ARG A 123 22.873 -9.098 -24.133 1.00 8.16 C ATOM 1015 C ARG A 123 22.341 -9.999 -25.248 1.00 11.25 C ATOM 1016 O ARG A 123 21.776 -9.513 -26.234 1.00 12.28 O ATOM 1017 CB ARG A 123 24.396 -8.967 -24.220 1.00 9.28 C ATOM 1018 CG ARG A 123 24.965 -8.765 -25.630 1.00 11.03 C ATOM 1019 CD ARG A 123 26.501 -8.680 -25.561 1.00 7.77 C ATOM 1020 NE ARG A 123 27.105 -8.693 -26.893 1.00 8.32 N ATOM 1021 CZ ARG A 123 27.529 -9.798 -27.501 1.00 12.78 C ATOM 1022 NH1 ARG A 123 27.428 -10.975 -26.879 1.00 10.44 N ATOM 1023 NH2 ARG A 123 28.076 -9.722 -28.718 1.00 10.22 N ATOM 1024 HE ARG A 123 27.209 -7.787 -27.393 1.00 0.00 H ATOM 1025 HH12 ARG A 123 27.758 -11.842 -27.350 1.00 0.00 H ATOM 1026 HH11 ARG A 123 27.019 -11.025 -25.924 1.00 0.00 H ATOM 1027 HH22 ARG A 123 28.408 -10.585 -29.194 1.00 0.00 H ATOM 1028 HH21 ARG A 123 28.170 -8.800 -29.189 1.00 0.00 H ATOM 1029 H ARG A 123 23.254 -10.027 -22.211 1.00 0.00 H ATOM 1030 N SER A 124 22.522 -11.315 -25.114 1.00 8.89 N ATOM 1031 CA SER A 124 22.290 -12.219 -26.239 1.00 10.33 C ATOM 1032 C SER A 124 20.827 -12.646 -26.368 1.00 10.89 C ATOM 1033 O SER A 124 20.317 -12.758 -27.490 1.00 11.82 O ATOM 1034 CB SER A 124 23.187 -13.453 -26.109 1.00 13.98 C ATOM 1035 OG SER A 124 22.999 -14.115 -24.862 1.00 13.55 O ATOM 1036 HG SER A 124 23.594 -14.905 -24.816 1.00 0.00 H ATOM 1037 H SER A 124 22.831 -11.701 -24.199 1.00 0.00 H ATOM 1038 N ASP A 125 20.146 -12.907 -25.254 1.00 9.31 N ATOM 1039 CA ASP A 125 18.896 -13.668 -25.296 1.00 5.70 C ATOM 1040 C ASP A 125 17.695 -12.994 -24.650 1.00 9.37 C ATOM 1041 O ASP A 125 16.565 -13.371 -24.994 1.00 9.23 O ATOM 1042 CB ASP A 125 19.071 -15.038 -24.617 1.00 8.48 C ATOM 1043 CG ASP A 125 20.069 -15.928 -25.331 1.00 11.70 C ATOM 1044 OD1 ASP A 125 20.286 -15.738 -26.539 1.00 12.93 O ATOM 1045 OD2 ASP A 125 20.619 -16.838 -24.680 1.00 15.70 O ATOM 1046 H ASP A 125 20.507 -12.565 -24.341 1.00 0.00 H ATOM 1047 N LEU A 126 17.882 -12.051 -23.720 1.00 7.96 N ATOM 1048 CA LEU A 126 16.754 -11.590 -22.902 1.00 7.42 C ATOM 1049 C LEU A 126 15.623 -11.033 -23.760 1.00 7.17 C ATOM 1050 O LEU A 126 14.455 -11.425 -23.607 1.00 5.59 O ATOM 1051 CB LEU A 126 17.225 -10.541 -21.894 1.00 6.07 C ATOM 1052 CG LEU A 126 16.089 -9.871 -21.096 1.00 6.60 C ATOM 1053 CD1 LEU A 126 15.382 -10.878 -20.184 1.00 7.41 C ATOM 1054 CD2 LEU A 126 16.635 -8.716 -20.290 1.00 8.00 C ATOM 1055 H LEU A 126 18.828 -11.644 -23.576 1.00 0.00 H ATOM 1056 N ASP A 127 15.943 -10.106 -24.661 1.00 6.50 N ATOM 1057 CA ASP A 127 14.882 -9.457 -25.427 1.00 6.15 C ATOM 1058 C ASP A 127 14.246 -10.419 -26.417 1.00 7.97 C ATOM 1059 O ASP A 127 13.028 -10.382 -26.620 1.00 6.92 O ATOM 1060 CB ASP A 127 15.411 -8.229 -26.162 1.00 8.07 C ATOM 1061 CG ASP A 127 15.958 -7.183 -25.224 1.00 9.89 C ATOM 1062 OD1 ASP A 127 15.388 -7.001 -24.119 1.00 6.41 O ATOM 1063 OD2 ASP A 127 16.980 -6.555 -25.595 1.00 10.18 O ATOM 1064 H ASP A 127 16.938 -9.847 -24.818 1.00 0.00 H ATOM 1065 N ARG A 128 15.050 -11.275 -27.058 1.00 6.84 N ATOM 1066 CA ARG A 128 14.493 -12.244 -28.000 1.00 7.02 C ATOM 1067 C ARG A 128 13.561 -13.223 -27.290 1.00 6.72 C ATOM 1068 O ARG A 128 12.473 -13.537 -27.795 1.00 8.61 O ATOM 1069 CB ARG A 128 15.622 -13.005 -28.712 1.00 9.08 C ATOM 1070 CG ARG A 128 15.114 -14.010 -29.759 1.00 20.24 C ATOM 1071 CD ARG A 128 16.265 -14.747 -30.473 1.00 17.42 C ATOM 1072 NE ARG A 128 16.819 -15.883 -29.722 1.00 17.92 N ATOM 1073 CZ ARG A 128 17.945 -15.840 -29.010 1.00 12.67 C ATOM 1074 NH1 ARG A 128 18.635 -14.712 -28.933 1.00 13.92 N ATOM 1075 NH2 ARG A 128 18.378 -16.925 -28.376 1.00 17.07 N ATOM 1076 HE ARG A 128 16.296 -16.782 -29.748 1.00 0.00 H ATOM 1077 HH12 ARG A 128 19.514 -14.677 -28.378 1.00 0.00 H ATOM 1078 HH11 ARG A 128 18.298 -13.861 -29.428 1.00 0.00 H ATOM 1079 HH22 ARG A 128 19.257 -16.887 -27.822 1.00 0.00 H ATOM 1080 HH21 ARG A 128 17.838 -17.812 -28.434 1.00 0.00 H ATOM 1081 H ARG A 128 16.075 -11.251 -26.885 1.00 0.00 H ATOM 1082 N PHE A 129 13.973 -13.713 -26.116 1.00 6.93 N ATOM 1083 CA PHE A 129 13.140 -14.629 -25.339 1.00 6.01 C ATOM 1084 C PHE A 129 11.845 -13.955 -24.887 1.00 5.01 C ATOM 1085 O PHE A 129 10.772 -14.571 -24.916 1.00 4.80 O ATOM 1086 CB PHE A 129 13.903 -15.134 -24.109 1.00 4.74 C ATOM 1087 CG PHE A 129 14.943 -16.199 -24.386 1.00 5.96 C ATOM 1088 CD1 PHE A 129 15.686 -16.712 -23.329 1.00 10.64 C ATOM 1089 CD2 PHE A 129 15.188 -16.682 -25.660 1.00 9.95 C ATOM 1090 CE1 PHE A 129 16.637 -17.691 -23.532 1.00 9.71 C ATOM 1091 CE2 PHE A 129 16.153 -17.666 -25.865 1.00 9.64 C ATOM 1092 CZ PHE A 129 16.874 -18.165 -24.794 1.00 8.82 C ATOM 1093 H PHE A 129 14.906 -13.437 -25.748 1.00 0.00 H ATOM 1094 N TRP A 130 11.921 -12.701 -24.428 1.00 4.82 N ATOM 1095 CA TRP A 130 10.699 -12.050 -23.955 1.00 4.09 C ATOM 1096 C TRP A 130 9.721 -11.828 -25.099 1.00 4.57 C ATOM 1097 O TRP A 130 8.517 -12.080 -24.953 1.00 4.94 O ATOM 1098 CB TRP A 130 11.022 -10.722 -23.266 1.00 4.69 C ATOM 1099 CG TRP A 130 9.802 -9.947 -22.793 1.00 5.47 C ATOM 1100 CD1 TRP A 130 9.458 -8.681 -23.161 1.00 5.78 C ATOM 1101 CD2 TRP A 130 8.781 -10.385 -21.864 1.00 4.02 C ATOM 1102 NE1 TRP A 130 8.296 -8.302 -22.530 1.00 4.60 N ATOM 1103 CE2 TRP A 130 7.856 -9.326 -21.734 1.00 4.43 C ATOM 1104 CE3 TRP A 130 8.555 -11.567 -21.145 1.00 4.85 C ATOM 1105 CZ2 TRP A 130 6.739 -9.398 -20.894 1.00 5.06 C ATOM 1106 CZ3 TRP A 130 7.430 -11.640 -20.313 1.00 4.49 C ATOM 1107 CH2 TRP A 130 6.541 -10.565 -20.204 1.00 5.74 C ATOM 1108 HE1 TRP A 130 7.825 -7.381 -22.640 1.00 0.00 H ATOM 1109 H TRP A 130 12.831 -12.198 -24.408 1.00 0.00 H ATOM 1110 N LEU A 131 10.216 -11.362 -26.252 1.00 4.37 N ATOM 1111 CA LEU A 131 9.315 -11.178 -27.384 1.00 5.05 C ATOM 1112 C LEU A 131 8.705 -12.511 -27.799 1.00 4.81 C ATOM 1113 O LEU A 131 7.507 -12.586 -28.085 1.00 6.00 O ATOM 1114 CB LEU A 131 10.047 -10.517 -28.556 1.00 4.50 C ATOM 1115 CG LEU A 131 9.214 -10.354 -29.835 1.00 5.48 C ATOM 1116 CD1 LEU A 131 7.950 -9.531 -29.587 1.00 6.48 C ATOM 1117 CD2 LEU A 131 10.068 -9.706 -30.941 1.00 10.22 C ATOM 1118 H LEU A 131 11.227 -11.135 -26.339 1.00 0.00 H ATOM 1119 N GLU A 132 9.503 -13.590 -27.794 1.00 3.48 N ATOM 1120 CA GLU A 132 8.936 -14.885 -28.163 1.00 5.46 C ATOM 1121 C GLU A 132 7.855 -15.303 -27.176 1.00 6.69 C ATOM 1122 O GLU A 132 6.840 -15.887 -27.574 1.00 4.99 O ATOM 1123 CB GLU A 132 10.018 -15.963 -28.256 1.00 6.02 C ATOM 1124 CG GLU A 132 9.593 -17.155 -29.119 1.00 8.77 C ATOM 1125 CD GLU A 132 9.443 -16.766 -30.578 1.00 7.96 C ATOM 1126 OE1 GLU A 132 10.290 -15.984 -31.068 1.00 10.77 O ATOM 1127 OE2 GLU A 132 8.469 -17.214 -31.231 1.00 11.23 O ATOM 1128 H GLU A 132 10.506 -13.506 -27.532 1.00 0.00 H ATOM 1129 N THR A 133 8.054 -14.997 -25.890 1.00 5.46 N ATOM 1130 CA THR A 133 7.046 -15.268 -24.871 1.00 5.12 C ATOM 1131 C THR A 133 5.765 -14.499 -25.169 1.00 5.47 C ATOM 1132 O THR A 133 4.664 -15.063 -25.136 1.00 5.96 O ATOM 1133 CB THR A 133 7.604 -14.901 -23.486 1.00 6.31 C ATOM 1134 OG1 THR A 133 8.830 -15.609 -23.257 1.00 5.98 O ATOM 1135 CG2 THR A 133 6.620 -15.282 -22.380 1.00 5.35 C ATOM 1136 HG1 THR A 133 9.488 -15.361 -23.953 1.00 0.00 H ATOM 1137 H THR A 133 8.952 -14.554 -25.608 1.00 0.00 H ATOM 1138 N LEU A 134 5.895 -13.203 -25.491 1.00 5.35 N ATOM 1139 CA LEU A 134 4.729 -12.414 -25.885 1.00 6.01 C ATOM 1140 C LEU A 134 3.998 -13.036 -27.070 1.00 5.91 C ATOM 1141 O LEU A 134 2.760 -13.102 -27.072 1.00 5.47 O ATOM 1142 CB LEU A 134 5.159 -10.979 -26.209 1.00 4.02 C ATOM 1143 CG LEU A 134 5.761 -10.176 -25.049 1.00 5.06 C ATOM 1144 CD1 LEU A 134 6.274 -8.811 -25.562 1.00 6.01 C ATOM 1145 CD2 LEU A 134 4.746 -9.981 -23.941 1.00 6.32 C ATOM 1146 H LEU A 134 6.833 -12.756 -25.460 1.00 0.00 H ATOM 1147 N LEU A 135 4.739 -13.480 -28.098 1.00 5.13 N ATOM 1148 CA LEU A 135 4.099 -14.051 -29.284 1.00 4.08 C ATOM 1149 C LEU A 135 3.374 -15.350 -28.954 1.00 5.96 C ATOM 1150 O LEU A 135 2.316 -15.633 -29.527 1.00 5.27 O ATOM 1151 CB LEU A 135 5.132 -14.279 -30.396 1.00 3.55 C ATOM 1152 CG LEU A 135 5.852 -13.015 -30.881 1.00 6.44 C ATOM 1153 CD1 LEU A 135 6.789 -13.360 -32.018 1.00 9.47 C ATOM 1154 CD2 LEU A 135 4.852 -11.978 -31.355 1.00 8.27 C ATOM 1155 H LEU A 135 5.776 -13.418 -28.051 1.00 0.00 H ATOM 1156 N CYS A 136 3.934 -16.154 -28.047 1.00 6.19 N ATOM 1157 CA CYS A 136 3.275 -17.382 -27.612 1.00 4.99 C ATOM 1158 C CYS A 136 1.960 -17.082 -26.910 1.00 6.84 C ATOM 1159 O CYS A 136 0.966 -17.804 -27.089 1.00 7.30 O ATOM 1160 CB CYS A 136 4.176 -18.161 -26.649 1.00 4.86 C ATOM 1161 SG CYS A 136 5.572 -19.043 -27.399 1.00 7.34 S ATOM 1162 H CYS A 136 4.858 -15.900 -27.642 1.00 0.00 H ATOM 1163 N LEU A 137 1.952 -16.051 -26.067 1.00 4.52 N ATOM 1164 CA LEU A 137 0.720 -15.680 -25.376 1.00 6.91 C ATOM 1165 C LEU A 137 -0.321 -15.157 -26.364 1.00 5.85 C ATOM 1166 O LEU A 137 -1.416 -15.717 -26.481 1.00 5.57 O ATOM 1167 CB LEU A 137 1.005 -14.637 -24.295 1.00 6.86 C ATOM 1168 CG LEU A 137 1.967 -14.970 -23.147 1.00 16.00 C ATOM 1169 CD1 LEU A 137 1.698 -14.119 -21.892 1.00 10.38 C ATOM 1170 CD2 LEU A 137 2.024 -16.451 -22.830 1.00 13.15 C ATOM 1171 H LEU A 137 2.824 -15.509 -25.901 1.00 0.00 H ATOM 1172 N ILE A 138 0.002 -14.079 -27.089 1.00 6.19 N ATOM 1173 CA ILE A 138 -1.044 -13.433 -27.885 1.00 5.84 C ATOM 1174 C ILE A 138 -1.455 -14.295 -29.072 1.00 4.20 C ATOM 1175 O ILE A 138 -2.595 -14.209 -29.529 1.00 6.67 O ATOM 1176 CB ILE A 138 -0.615 -12.020 -28.329 1.00 5.55 C ATOM 1177 CG1 ILE A 138 0.468 -12.063 -29.407 1.00 6.69 C ATOM 1178 CG2 ILE A 138 -0.119 -11.221 -27.115 1.00 5.23 C ATOM 1179 CD1 ILE A 138 0.826 -10.659 -29.937 1.00 6.16 C ATOM 1180 H ILE A 138 0.974 -13.709 -27.087 1.00 0.00 H ATOM 1181 N GLY A 139 -0.568 -15.156 -29.564 1.00 4.87 N ATOM 1182 CA GLY A 139 -0.925 -16.046 -30.650 1.00 6.21 C ATOM 1183 C GLY A 139 -1.595 -17.337 -30.226 1.00 5.43 C ATOM 1184 O GLY A 139 -1.930 -18.147 -31.099 1.00 6.28 O ATOM 1185 H GLY A 139 0.392 -15.191 -29.165 1.00 0.00 H ATOM 1186 N GLU A 140 -1.798 -17.541 -28.918 1.00 5.10 N ATOM 1187 CA GLU A 140 -2.477 -18.725 -28.371 1.00 5.76 C ATOM 1188 C GLU A 140 -1.776 -20.010 -28.817 1.00 6.71 C ATOM 1189 O GLU A 140 -2.401 -20.964 -29.298 1.00 8.20 O ATOM 1190 CB GLU A 140 -3.960 -18.738 -28.744 1.00 7.08 C ATOM 1191 CG GLU A 140 -4.739 -17.467 -28.316 1.00 9.05 C ATOM 1192 CD GLU A 140 -5.003 -17.352 -26.806 1.00 11.15 C ATOM 1193 OE1 GLU A 140 -5.237 -18.382 -26.148 1.00 9.69 O ATOM 1194 OE2 GLU A 140 -4.995 -16.219 -26.266 1.00 9.35 O ATOM 1195 H GLU A 140 -1.456 -16.820 -28.251 1.00 0.00 H ATOM 1196 N SER A 141 -0.459 -20.040 -28.614 1.00 6.55 N ATOM 1197 CA SER A 141 0.394 -21.093 -29.145 1.00 6.61 C ATOM 1198 C SER A 141 0.337 -22.397 -28.357 1.00 9.71 C ATOM 1199 O SER A 141 1.025 -23.349 -28.736 1.00 12.29 O ATOM 1200 CB SER A 141 1.841 -20.601 -29.205 1.00 8.15 C ATOM 1201 OG SER A 141 1.946 -19.458 -30.039 1.00 8.04 O ATOM 1202 HG SER A 141 1.647 -19.690 -30.954 1.00 0.00 H ATOM 1203 H SER A 141 -0.023 -19.280 -28.053 1.00 0.00 H ATOM 1204 N PHE A 142 -0.427 -22.469 -27.269 1.00 8.03 N ATOM 1205 CA PHE A 142 -0.517 -23.694 -26.486 1.00 9.08 C ATOM 1206 C PHE A 142 -1.829 -24.436 -26.732 1.00 13.73 C ATOM 1207 O PHE A 142 -2.181 -25.343 -25.965 1.00 11.47 O ATOM 1208 CB PHE A 142 -0.301 -23.369 -25.005 1.00 9.18 C ATOM 1209 CG PHE A 142 0.988 -22.629 -24.754 1.00 6.22 C ATOM 1210 CD1 PHE A 142 0.989 -21.271 -24.464 1.00 10.70 C ATOM 1211 CD2 PHE A 142 2.202 -23.284 -24.872 1.00 8.99 C ATOM 1212 CE1 PHE A 142 2.191 -20.593 -24.259 1.00 10.48 C ATOM 1213 CE2 PHE A 142 3.404 -22.614 -24.666 1.00 11.94 C ATOM 1214 CZ PHE A 142 3.398 -21.266 -24.356 1.00 9.20 C ATOM 1215 H PHE A 142 -0.971 -21.634 -26.972 1.00 0.00 H ATOM 1216 N ASP A 143 -2.551 -24.063 -27.794 1.00 15.46 N ATOM 1217 CA ASP A 143 -3.663 -24.832 -28.361 1.00 15.99 C ATOM 1218 C ASP A 143 -4.710 -25.093 -27.289 1.00 12.39 C ATOM 1219 O ASP A 143 -5.196 -24.125 -26.683 1.00 13.50 O ATOM 1220 CB ASP A 143 -3.086 -26.072 -29.039 1.00 16.64 C ATOM 1221 CG ASP A 143 -2.288 -25.722 -30.283 1.00 25.71 C ATOM 1222 OD1 ASP A 143 -2.502 -24.607 -30.819 1.00 30.94 O ATOM 1223 OD2 ASP A 143 -1.455 -26.548 -30.710 1.00 24.05 O ATOM 1224 H ASP A 143 -2.306 -23.162 -28.251 1.00 0.00 H ATOM 1225 N ASP A 144 -5.093 -26.344 -27.021 1.00 11.30 N ATOM 1226 CA ASP A 144 -6.195 -26.599 -26.111 1.00 15.11 C ATOM 1227 C ASP A 144 -5.852 -26.286 -24.668 1.00 18.27 C ATOM 1228 O ASP A 144 -6.746 -26.327 -23.816 1.00 21.85 O ATOM 1229 CB ASP A 144 -6.634 -28.052 -26.238 1.00 20.95 C ATOM 1230 CG ASP A 144 -6.992 -28.410 -27.668 1.00 29.27 C ATOM 1231 OD1 ASP A 144 -7.681 -27.587 -28.313 1.00 27.18 O ATOM 1232 OD2 ASP A 144 -6.562 -29.480 -28.148 1.00 34.95 O ATOM 1233 H ASP A 144 -4.598 -27.142 -27.468 1.00 0.00 H ATOM 1234 N TYR A 145 -4.594 -25.998 -24.365 1.00 11.32 N ATOM 1235 CA TYR A 145 -4.231 -25.613 -23.013 1.00 11.67 C ATOM 1236 C TYR A 145 -4.064 -24.108 -22.877 1.00 18.08 C ATOM 1237 O TYR A 145 -3.544 -23.642 -21.861 1.00 11.70 O ATOM 1238 CB TYR A 145 -2.979 -26.364 -22.580 1.00 15.04 C ATOM 1239 CG TYR A 145 -3.195 -27.858 -22.670 1.00 16.71 C ATOM 1240 CD1 TYR A 145 -2.493 -28.628 -23.588 1.00 15.87 C ATOM 1241 CD2 TYR A 145 -4.153 -28.483 -21.879 1.00 21.77 C ATOM 1242 CE1 TYR A 145 -2.706 -29.993 -23.681 1.00 27.88 C ATOM 1243 CE2 TYR A 145 -4.370 -29.847 -21.961 1.00 21.63 C ATOM 1244 CZ TYR A 145 -3.642 -30.594 -22.864 1.00 24.82 C ATOM 1245 OH TYR A 145 -3.854 -31.956 -22.962 1.00 34.28 O ATOM 1246 HH TYR A 145 -3.664 -32.382 -22.089 1.00 0.00 H ATOM 1247 H TYR A 145 -3.861 -26.048 -25.101 1.00 0.00 H ATOM 1248 N SER A 146 -4.531 -23.347 -23.875 1.00 18.42 N ATOM 1249 CA SER A 146 -4.481 -21.884 -23.827 1.00 19.61 C ATOM 1250 C SER A 146 -5.183 -21.330 -22.601 1.00 17.26 C ATOM 1251 O SER A 146 -4.724 -20.339 -22.013 1.00 14.88 O ATOM 1252 CB SER A 146 -5.135 -21.301 -25.081 1.00 20.29 C ATOM 1253 OG SER A 146 -4.436 -21.691 -26.238 1.00 21.98 O ATOM 1254 HG SER A 146 -4.877 -21.303 -27.035 1.00 0.00 H ATOM 1255 H SER A 146 -4.942 -23.810 -24.711 1.00 0.00 H ATOM 1256 N ASP A 147 -6.327 -21.916 -22.231 1.00 15.81 N ATOM 1257 CA ASP A 147 -7.091 -21.408 -21.101 1.00 20.69 C ATOM 1258 C ASP A 147 -6.332 -21.528 -19.793 1.00 17.27 C ATOM 1259 O ASP A 147 -6.641 -20.793 -18.851 1.00 16.78 O ATOM 1260 CB ASP A 147 -8.431 -22.133 -20.983 1.00 26.10 C ATOM 1261 CG ASP A 147 -9.491 -21.558 -21.911 1.00 30.55 C ATOM 1262 OD1 ASP A 147 -9.151 -20.708 -22.764 1.00 34.80 O ATOM 1263 OD2 ASP A 147 -10.664 -21.965 -21.790 1.00 39.81 O ATOM 1264 H ASP A 147 -6.674 -22.744 -22.756 1.00 0.00 H ATOM 1265 N ASP A 148 -5.354 -22.438 -19.705 1.00 13.08 N ATOM 1266 CA ASP A 148 -4.546 -22.520 -18.490 1.00 10.00 C ATOM 1267 C ASP A 148 -3.511 -21.404 -18.391 1.00 8.44 C ATOM 1268 O ASP A 148 -2.992 -21.170 -17.299 1.00 10.91 O ATOM 1269 CB ASP A 148 -3.832 -23.876 -18.368 1.00 9.42 C ATOM 1270 CG ASP A 148 -4.711 -24.951 -17.752 1.00 16.81 C ATOM 1271 OD1 ASP A 148 -5.827 -25.195 -18.244 1.00 17.81 O ATOM 1272 OD2 ASP A 148 -4.306 -25.511 -16.708 1.00 14.39 O ATOM 1273 H ASP A 148 -5.170 -23.084 -20.499 1.00 0.00 H ATOM 1274 N VAL A 149 -3.202 -20.707 -19.484 1.00 7.89 N ATOM 1275 CA VAL A 149 -2.190 -19.656 -19.437 1.00 9.00 C ATOM 1276 C VAL A 149 -2.791 -18.408 -18.794 1.00 9.92 C ATOM 1277 O VAL A 149 -3.864 -17.946 -19.193 1.00 10.97 O ATOM 1278 CB VAL A 149 -1.656 -19.356 -20.850 1.00 9.45 C ATOM 1279 CG1 VAL A 149 -0.696 -18.183 -20.822 1.00 10.05 C ATOM 1280 CG2 VAL A 149 -0.987 -20.596 -21.451 1.00 10.83 C ATOM 1281 H VAL A 149 -3.687 -20.914 -20.380 1.00 0.00 H ATOM 1282 N CYS A 150 -2.096 -17.849 -17.794 1.00 6.39 N ATOM 1283 CA CYS A 150 -2.515 -16.602 -17.163 1.00 4.20 C ATOM 1284 C CYS A 150 -1.770 -15.395 -17.705 1.00 4.97 C ATOM 1285 O CYS A 150 -2.379 -14.362 -17.983 1.00 5.49 O ATOM 1286 CB CYS A 150 -2.301 -16.678 -15.655 1.00 7.52 C ATOM 1287 SG CYS A 150 -3.303 -18.008 -14.933 1.00 8.36 S ATOM 1288 H CYS A 150 -1.231 -18.318 -17.457 1.00 0.00 H ATOM 1289 N GLY A 151 -0.460 -15.516 -17.861 1.00 6.64 N ATOM 1290 CA GLY A 151 0.347 -14.386 -18.265 1.00 6.06 C ATOM 1291 C GLY A 151 1.812 -14.760 -18.190 1.00 5.40 C ATOM 1292 O GLY A 151 2.163 -15.931 -18.022 1.00 6.36 O ATOM 1293 H GLY A 151 -0.006 -16.436 -17.691 1.00 0.00 H ATOM 1294 N ALA A 152 2.657 -13.746 -18.341 1.00 4.36 N ATOM 1295 CA ALA A 152 4.097 -13.947 -18.275 1.00 4.72 C ATOM 1296 C ALA A 152 4.738 -12.729 -17.631 1.00 4.25 C ATOM 1297 O ALA A 152 4.193 -11.623 -17.690 1.00 5.17 O ATOM 1298 CB ALA A 152 4.697 -14.182 -19.666 1.00 6.94 C ATOM 1299 H ALA A 152 2.282 -12.791 -18.510 1.00 0.00 H ATOM 1300 N VAL A 153 5.912 -12.941 -17.036 1.00 4.68 N ATOM 1301 CA VAL A 153 6.649 -11.888 -16.335 1.00 4.72 C ATOM 1302 C VAL A 153 8.115 -11.954 -16.740 1.00 5.43 C ATOM 1303 O VAL A 153 8.698 -13.039 -16.794 1.00 5.49 O ATOM 1304 CB VAL A 153 6.530 -12.037 -14.806 1.00 5.51 C ATOM 1305 CG1 VAL A 153 7.305 -10.915 -14.078 1.00 6.16 C ATOM 1306 CG2 VAL A 153 5.058 -12.073 -14.379 1.00 5.08 C ATOM 1307 H VAL A 153 6.322 -13.896 -17.071 1.00 0.00 H ATOM 1308 N VAL A 154 8.714 -10.796 -17.016 1.00 4.54 N ATOM 1309 CA VAL A 154 10.166 -10.686 -17.153 1.00 5.19 C ATOM 1310 C VAL A 154 10.686 -9.842 -15.992 1.00 6.92 C ATOM 1311 O VAL A 154 10.203 -8.724 -15.752 1.00 6.02 O ATOM 1312 CB VAL A 154 10.588 -10.121 -18.525 1.00 4.40 C ATOM 1313 CG1 VAL A 154 9.864 -8.815 -18.870 1.00 5.84 C ATOM 1314 CG2 VAL A 154 12.126 -9.924 -18.589 1.00 5.46 C ATOM 1315 H VAL A 154 8.131 -9.944 -17.138 1.00 0.00 H ATOM 1316 N ASN A 155 11.643 -10.406 -15.245 1.00 6.57 N ATOM 1317 CA ASN A 155 12.327 -9.723 -14.147 1.00 7.59 C ATOM 1318 C ASN A 155 13.709 -9.308 -14.624 1.00 7.09 C ATOM 1319 O ASN A 155 14.525 -10.167 -14.973 1.00 7.94 O ATOM 1320 CB ASN A 155 12.502 -10.626 -12.919 1.00 8.37 C ATOM 1321 CG ASN A 155 11.239 -11.347 -12.500 1.00 9.60 C ATOM 1322 OD1 ASN A 155 11.217 -12.576 -12.470 1.00 10.51 O ATOM 1323 ND2 ASN A 155 10.214 -10.601 -12.114 1.00 8.87 N ATOM 1324 HD22 ASN A 155 10.280 -9.564 -12.158 1.00 0.00 H ATOM 1325 HD21 ASN A 155 9.344 -11.053 -11.767 1.00 0.00 H ATOM 1326 H ASN A 155 11.916 -11.387 -15.458 1.00 0.00 H ATOM 1327 N VAL A 156 13.987 -8.008 -14.609 1.00 7.48 N ATOM 1328 CA VAL A 156 15.317 -7.514 -14.939 1.00 7.58 C ATOM 1329 C VAL A 156 16.099 -7.383 -13.631 1.00 7.45 C ATOM 1330 O VAL A 156 15.704 -6.627 -12.737 1.00 8.37 O ATOM 1331 CB VAL A 156 15.233 -6.183 -15.698 1.00 8.08 C ATOM 1332 CG1 VAL A 156 16.628 -5.659 -16.011 1.00 8.16 C ATOM 1333 CG2 VAL A 156 14.416 -6.362 -17.000 1.00 9.36 C ATOM 1334 H VAL A 156 13.240 -7.330 -14.357 1.00 0.00 H ATOM 1335 N ARG A 157 17.178 -8.158 -13.498 1.00 8.82 N ATOM 1336 CA ARG A 157 17.877 -8.307 -12.220 1.00 7.89 C ATOM 1337 C ARG A 157 19.380 -8.355 -12.446 1.00 11.41 C ATOM 1338 O ARG A 157 19.856 -9.016 -13.373 1.00 11.57 O ATOM 1339 CB ARG A 157 17.463 -9.591 -11.497 1.00 9.33 C ATOM 1340 CG ARG A 157 15.989 -9.677 -11.129 1.00 9.36 C ATOM 1341 CD ARG A 157 15.613 -8.656 -10.068 1.00 11.35 C ATOM 1342 NE ARG A 157 14.221 -8.818 -9.633 1.00 14.40 N ATOM 1343 CZ ARG A 157 13.170 -8.271 -10.241 1.00 14.62 C ATOM 1344 NH1 ARG A 157 13.343 -7.509 -11.314 1.00 8.40 N ATOM 1345 NH2 ARG A 157 11.941 -8.476 -9.764 1.00 12.60 N ATOM 1346 HE ARG A 157 14.043 -9.401 -8.791 1.00 0.00 H ATOM 1347 HH12 ARG A 157 12.521 -7.083 -11.787 1.00 0.00 H ATOM 1348 HH11 ARG A 157 14.301 -7.338 -11.682 1.00 0.00 H ATOM 1349 HH22 ARG A 157 11.121 -8.048 -10.239 1.00 0.00 H ATOM 1350 HH21 ARG A 157 11.803 -9.063 -8.917 1.00 0.00 H ATOM 1351 H ARG A 157 17.534 -8.672 -14.329 1.00 0.00 H ATOM 1352 N ALA A 158 20.123 -7.696 -11.557 1.00 12.34 N ATOM 1353 CA ALA A 158 21.577 -7.645 -11.703 1.00 13.54 C ATOM 1354 C ALA A 158 22.205 -9.034 -11.604 1.00 15.55 C ATOM 1355 O ALA A 158 23.175 -9.332 -12.311 1.00 15.99 O ATOM 1356 CB ALA A 158 22.171 -6.708 -10.651 1.00 20.55 C ATOM 1357 H ALA A 158 19.666 -7.216 -10.756 1.00 0.00 H ATOM 1358 N LYS A 159 21.677 -9.894 -10.728 1.00 14.60 N ATOM 1359 CA LYS A 159 22.244 -11.233 -10.544 1.00 16.02 C ATOM 1360 C LYS A 159 21.903 -12.174 -11.688 1.00 14.14 C ATOM 1361 O LYS A 159 22.512 -13.247 -11.795 1.00 17.11 O ATOM 1362 CB LYS A 159 21.759 -11.895 -9.244 1.00 21.19 C ATOM 1363 CG LYS A 159 22.196 -11.301 -7.895 1.00 30.87 C ATOM 1364 CD LYS A 159 21.617 -12.050 -6.667 1.00 43.97 C ATOM 1365 CE LYS A 159 22.114 -11.419 -5.350 1.00 51.26 C ATOM 1366 NZ LYS A 159 21.599 -12.046 -4.082 1.00 58.48 N ATOM 1367 HZ1 LYS A 159 20.561 -11.980 -4.061 1.00 0.00 H ATOM 1368 HZ2 LYS A 159 21.885 -13.045 -4.050 1.00 0.00 H ATOM 1369 HZ3 LYS A 159 21.996 -11.544 -3.262 1.00 0.00 H ATOM 1370 H LYS A 159 20.849 -9.608 -10.167 1.00 0.00 H ATOM 1371 N GLY A 160 20.932 -11.815 -12.526 1.00 12.19 N ATOM 1372 CA GLY A 160 20.475 -12.703 -13.578 1.00 9.55 C ATOM 1373 C GLY A 160 19.003 -12.472 -13.861 1.00 10.15 C ATOM 1374 O GLY A 160 18.178 -12.520 -12.946 1.00 10.56 O ATOM 1375 H GLY A 160 20.492 -10.878 -12.424 1.00 0.00 H ATOM 1376 N ASP A 161 18.668 -12.201 -15.116 1.00 8.95 N ATOM 1377 CA ASP A 161 17.281 -11.948 -15.472 1.00 10.60 C ATOM 1378 C ASP A 161 16.478 -13.244 -15.460 1.00 9.75 C ATOM 1379 O ASP A 161 17.023 -14.349 -15.561 1.00 9.36 O ATOM 1380 CB ASP A 161 17.205 -11.290 -16.847 1.00 7.70 C ATOM 1381 CG ASP A 161 18.092 -10.073 -16.944 1.00 9.60 C ATOM 1382 OD1 ASP A 161 17.997 -9.226 -16.038 1.00 9.29 O ATOM 1383 OD2 ASP A 161 18.887 -9.968 -17.919 1.00 10.61 O ATOM 1384 H ASP A 161 19.403 -12.169 -15.851 1.00 0.00 H ATOM 1385 N LYS A 162 15.155 -13.101 -15.330 1.00 6.96 N ATOM 1386 CA LYS A 162 14.258 -14.247 -15.333 1.00 8.34 C ATOM 1387 C LYS A 162 13.060 -13.948 -16.216 1.00 7.11 C ATOM 1388 O LYS A 162 12.615 -12.803 -16.305 1.00 6.16 O ATOM 1389 CB LYS A 162 13.771 -14.595 -13.916 1.00 6.92 C ATOM 1390 CG LYS A 162 14.908 -15.065 -13.003 1.00 11.38 C ATOM 1391 CD LYS A 162 14.438 -15.204 -11.563 1.00 14.91 C ATOM 1392 CE LYS A 162 14.360 -13.848 -10.874 1.00 18.32 C ATOM 1393 NZ LYS A 162 13.957 -13.999 -9.438 1.00 19.11 N ATOM 1394 HZ1 LYS A 162 13.023 -14.454 -9.387 1.00 0.00 H ATOM 1395 HZ2 LYS A 162 14.658 -14.586 -8.942 1.00 0.00 H ATOM 1396 HZ3 LYS A 162 13.911 -13.061 -8.992 1.00 0.00 H ATOM 1397 H LYS A 162 14.757 -12.146 -15.224 1.00 0.00 H ATOM 1398 N ILE A 163 12.555 -14.985 -16.884 1.00 5.76 N ATOM 1399 CA ILE A 163 11.279 -14.910 -17.596 1.00 3.81 C ATOM 1400 C ILE A 163 10.443 -16.100 -17.147 1.00 5.91 C ATOM 1401 O ILE A 163 10.984 -17.178 -16.894 1.00 5.83 O ATOM 1402 CB ILE A 163 11.461 -14.907 -19.129 1.00 5.54 C ATOM 1403 CG1 ILE A 163 12.314 -13.711 -19.563 1.00 3.90 C ATOM 1404 CG2 ILE A 163 10.102 -14.872 -19.837 1.00 6.13 C ATOM 1405 CD1 ILE A 163 12.786 -13.811 -21.008 1.00 9.60 C ATOM 1406 H ILE A 163 13.087 -15.879 -16.900 1.00 0.00 H ATOM 1407 N ALA A 164 9.131 -15.911 -17.032 1.00 6.39 N ATOM 1408 CA ALA A 164 8.283 -17.017 -16.619 1.00 4.54 C ATOM 1409 C ALA A 164 6.916 -16.918 -17.273 1.00 7.35 C ATOM 1410 O ALA A 164 6.380 -15.821 -17.432 1.00 5.81 O ATOM 1411 CB ALA A 164 8.132 -17.032 -15.088 1.00 6.56 C ATOM 1412 H ALA A 164 8.716 -14.980 -17.236 1.00 0.00 H ATOM 1413 N ILE A 165 6.344 -18.067 -17.628 1.00 3.80 N ATOM 1414 CA ILE A 165 4.930 -18.145 -17.994 1.00 3.49 C ATOM 1415 C ILE A 165 4.152 -18.693 -16.803 1.00 5.48 C ATOM 1416 O ILE A 165 4.485 -19.760 -16.271 1.00 7.33 O ATOM 1417 CB ILE A 165 4.715 -19.019 -19.240 1.00 3.51 C ATOM 1418 CG1 ILE A 165 5.262 -18.313 -20.482 1.00 4.31 C ATOM 1419 CG2 ILE A 165 3.213 -19.380 -19.392 1.00 5.87 C ATOM 1420 CD1 ILE A 165 5.028 -19.094 -21.771 1.00 6.64 C ATOM 1421 H ILE A 165 6.919 -18.933 -17.646 1.00 0.00 H ATOM 1422 N TRP A 166 3.119 -17.959 -16.384 1.00 5.04 N ATOM 1423 CA TRP A 166 2.262 -18.338 -15.264 1.00 5.53 C ATOM 1424 C TRP A 166 1.041 -19.101 -15.774 1.00 5.46 C ATOM 1425 O TRP A 166 0.400 -18.671 -16.741 1.00 8.05 O ATOM 1426 CB TRP A 166 1.793 -17.086 -14.513 1.00 5.97 C ATOM 1427 CG TRP A 166 2.852 -16.343 -13.728 1.00 6.42 C ATOM 1428 CD1 TRP A 166 4.193 -16.268 -13.990 1.00 7.13 C ATOM 1429 CD2 TRP A 166 2.629 -15.572 -12.537 1.00 6.03 C ATOM 1430 NE1 TRP A 166 4.820 -15.479 -13.033 1.00 7.61 N ATOM 1431 CE2 TRP A 166 3.882 -15.057 -12.126 1.00 7.22 C ATOM 1432 CE3 TRP A 166 1.491 -15.283 -11.775 1.00 7.90 C ATOM 1433 CZ2 TRP A 166 4.025 -14.258 -10.992 1.00 6.40 C ATOM 1434 CZ3 TRP A 166 1.627 -14.476 -10.660 1.00 9.10 C ATOM 1435 CH2 TRP A 166 2.889 -13.979 -10.270 1.00 6.29 C ATOM 1436 HE1 TRP A 166 5.833 -15.247 -13.009 1.00 0.00 H ATOM 1437 H TRP A 166 2.913 -17.069 -16.882 1.00 0.00 H ATOM 1438 N THR A 167 0.685 -20.204 -15.099 1.00 5.96 N ATOM 1439 CA THR A 167 -0.530 -20.952 -15.430 1.00 6.31 C ATOM 1440 C THR A 167 -1.401 -21.097 -14.186 1.00 9.01 C ATOM 1441 O THR A 167 -0.971 -20.825 -13.062 1.00 7.80 O ATOM 1442 CB THR A 167 -0.227 -22.335 -16.038 1.00 8.48 C ATOM 1443 OG1 THR A 167 0.146 -23.261 -15.007 1.00 9.84 O ATOM 1444 CG2 THR A 167 0.905 -22.243 -17.075 1.00 8.02 C ATOM 1445 HG1 THR A 167 0.954 -22.928 -14.542 1.00 0.00 H ATOM 1446 H THR A 167 1.288 -20.537 -14.320 1.00 0.00 H ATOM 1447 N THR A 168 -2.644 -21.520 -14.402 1.00 8.52 N ATOM 1448 CA THR A 168 -3.686 -21.327 -13.398 1.00 6.93 C ATOM 1449 C THR A 168 -3.768 -22.436 -12.355 1.00 10.60 C ATOM 1450 O THR A 168 -4.257 -22.170 -11.252 1.00 11.83 O ATOM 1451 CB THR A 168 -5.052 -21.156 -14.095 1.00 9.41 C ATOM 1452 OG1 THR A 168 -6.026 -20.646 -13.163 1.00 9.71 O ATOM 1453 CG2 THR A 168 -5.530 -22.482 -14.707 1.00 9.77 C ATOM 1454 HG1 THR A 168 -6.123 -21.280 -12.409 1.00 0.00 H ATOM 1455 H THR A 168 -2.876 -21.994 -15.298 1.00 0.00 H ATOM 1456 N GLU A 169 -3.301 -23.652 -12.649 1.00 11.18 N ATOM 1457 CA GLU A 169 -3.543 -24.789 -11.750 1.00 14.48 C ATOM 1458 C GLU A 169 -2.376 -25.772 -11.808 1.00 14.77 C ATOM 1459 O GLU A 169 -2.152 -26.405 -12.843 1.00 12.78 O ATOM 1460 CB GLU A 169 -4.859 -25.475 -12.122 1.00 18.00 C ATOM 1461 CG GLU A 169 -5.147 -26.756 -11.343 1.00 19.81 C ATOM 1462 CD GLU A 169 -5.191 -26.528 -9.844 1.00 23.71 C ATOM 1463 OE1 GLU A 169 -4.239 -26.965 -9.149 1.00 21.72 O ATOM 1464 OE2 GLU A 169 -6.166 -25.894 -9.372 1.00 22.17 O ATOM 1465 H GLU A 169 -2.759 -23.796 -13.525 1.00 0.00 H ATOM 1466 N CYS A 170 -1.649 -25.916 -10.690 1.00 14.61 N ATOM 1467 CA CYS A 170 -0.479 -26.796 -10.657 1.00 17.26 C ATOM 1468 C CYS A 170 -0.840 -28.248 -10.902 1.00 18.70 C ATOM 1469 O CYS A 170 -0.009 -29.020 -11.391 1.00 19.93 O ATOM 1470 CB CYS A 170 0.231 -26.702 -9.311 1.00 19.52 C ATOM 1471 SG CYS A 170 0.991 -25.152 -8.995 1.00 17.70 S ATOM 1472 H CYS A 170 -1.921 -25.394 -9.832 1.00 0.00 H ATOM 1473 N GLU A 171 -2.046 -28.646 -10.531 1.00 19.09 N ATOM 1474 CA GLU A 171 -2.444 -30.041 -10.618 1.00 22.06 C ATOM 1475 C GLU A 171 -2.925 -30.439 -12.007 1.00 24.87 C ATOM 1476 O GLU A 171 -3.204 -31.623 -12.226 1.00 24.98 O ATOM 1477 CB GLU A 171 -3.521 -30.337 -9.575 1.00 20.26 C ATOM 1478 CG GLU A 171 -3.041 -30.083 -8.156 1.00 30.28 C ATOM 1479 CD GLU A 171 -4.117 -30.386 -7.124 1.00 45.74 C ATOM 1480 OE1 GLU A 171 -5.315 -30.422 -7.485 1.00 49.08 O ATOM 1481 OE2 GLU A 171 -3.765 -30.597 -5.939 1.00 52.76 O ATOM 1482 H GLU A 171 -2.724 -27.945 -10.169 1.00 0.00 H ATOM 1483 N ASN A 172 -3.018 -29.495 -12.949 1.00 19.27 N ATOM 1484 CA ASN A 172 -3.353 -29.812 -14.340 1.00 17.94 C ATOM 1485 C ASN A 172 -2.080 -30.280 -15.031 1.00 18.56 C ATOM 1486 O ASN A 172 -1.446 -29.563 -15.806 1.00 17.79 O ATOM 1487 CB ASN A 172 -3.959 -28.616 -15.054 1.00 16.69 C ATOM 1488 CG ASN A 172 -5.366 -28.309 -14.588 1.00 24.11 C ATOM 1489 OD1 ASN A 172 -5.960 -29.066 -13.806 1.00 23.91 O ATOM 1490 ND2 ASN A 172 -5.919 -27.197 -15.072 1.00 20.72 N ATOM 1491 HD22 ASN A 172 -5.383 -26.592 -15.726 1.00 0.00 H ATOM 1492 HD21 ASN A 172 -6.887 -26.935 -14.796 1.00 0.00 H ATOM 1493 H ASN A 172 -2.847 -28.503 -12.686 1.00 0.00 H ATOM 1494 N ARG A 173 -1.722 -31.528 -14.744 1.00 20.06 N ATOM 1495 CA ARG A 173 -0.435 -32.068 -15.160 1.00 17.80 C ATOM 1496 C ARG A 173 -0.272 -32.044 -16.675 1.00 19.95 C ATOM 1497 O ARG A 173 0.788 -31.657 -17.186 1.00 15.72 O ATOM 1498 CB ARG A 173 -0.291 -33.494 -14.625 1.00 22.32 C ATOM 1499 CG ARG A 173 1.030 -34.148 -14.981 1.00 35.67 C ATOM 1500 CD ARG A 173 1.164 -35.525 -14.374 1.00 44.55 C ATOM 1501 NE ARG A 173 0.169 -36.449 -14.934 1.00 62.04 N ATOM 1502 CZ ARG A 173 0.315 -37.102 -16.085 1.00 70.13 C ATOM 1503 NH1 ARG A 173 1.423 -36.927 -16.813 1.00 72.63 N ATOM 1504 NH2 ARG A 173 -0.651 -37.919 -16.506 1.00 66.87 N ATOM 1505 HE ARG A 173 -0.707 -36.603 -14.396 1.00 0.00 H ATOM 1506 HH12 ARG A 173 1.540 -37.436 -17.713 1.00 0.00 H ATOM 1507 HH11 ARG A 173 2.168 -36.282 -16.480 1.00 0.00 H ATOM 1508 HH22 ARG A 173 -0.543 -38.432 -17.404 1.00 0.00 H ATOM 1509 HH21 ARG A 173 -1.512 -38.043 -15.936 1.00 0.00 H ATOM 1510 H ARG A 173 -2.377 -32.133 -14.209 1.00 0.00 H ATOM 1511 N GLU A 174 -1.307 -32.466 -17.408 1.00 20.03 N ATOM 1512 CA GLU A 174 -1.230 -32.479 -18.867 1.00 19.55 C ATOM 1513 C GLU A 174 -1.017 -31.076 -19.415 1.00 13.92 C ATOM 1514 O GLU A 174 -0.141 -30.850 -20.262 1.00 16.33 O ATOM 1515 CB GLU A 174 -2.504 -33.073 -19.460 1.00 22.53 C ATOM 1516 CG GLU A 174 -2.657 -34.562 -19.285 1.00 35.28 C ATOM 1517 CD GLU A 174 -3.622 -35.139 -20.299 1.00 44.61 C ATOM 1518 OE1 GLU A 174 -4.085 -34.370 -21.173 1.00 49.63 O ATOM 1519 OE2 GLU A 174 -3.912 -36.351 -20.228 1.00 54.14 O ATOM 1520 H GLU A 174 -2.175 -32.788 -16.935 1.00 0.00 H ATOM 1521 N ALA A 175 -1.845 -30.130 -18.963 1.00 13.82 N ATOM 1522 CA ALA A 175 -1.739 -28.745 -19.406 1.00 13.08 C ATOM 1523 C ALA A 175 -0.361 -28.180 -19.096 1.00 12.06 C ATOM 1524 O ALA A 175 0.296 -27.603 -19.972 1.00 11.00 O ATOM 1525 CB ALA A 175 -2.833 -27.905 -18.740 1.00 13.68 C ATOM 1526 H ALA A 175 -2.584 -30.388 -18.278 1.00 0.00 H ATOM 1527 N VAL A 176 0.097 -28.346 -17.850 1.00 9.81 N ATOM 1528 CA VAL A 176 1.361 -27.741 -17.426 1.00 8.52 C ATOM 1529 C VAL A 176 2.517 -28.300 -18.243 1.00 10.54 C ATOM 1530 O VAL A 176 3.382 -27.554 -18.715 1.00 9.88 O ATOM 1531 CB VAL A 176 1.583 -27.952 -15.916 1.00 11.78 C ATOM 1532 CG1 VAL A 176 3.006 -27.543 -15.508 1.00 11.79 C ATOM 1533 CG2 VAL A 176 0.547 -27.171 -15.110 1.00 12.84 C ATOM 1534 H VAL A 176 -0.453 -28.913 -17.173 1.00 0.00 H ATOM 1535 N THR A 177 2.545 -29.629 -18.424 1.00 12.17 N ATOM 1536 CA THR A 177 3.633 -30.264 -19.163 1.00 12.41 C ATOM 1537 C THR A 177 3.643 -29.836 -20.626 1.00 10.55 C ATOM 1538 O THR A 177 4.710 -29.565 -21.190 1.00 11.24 O ATOM 1539 CB THR A 177 3.514 -31.786 -19.042 1.00 17.70 C ATOM 1540 OG1 THR A 177 3.711 -32.161 -17.670 1.00 25.39 O ATOM 1541 CG2 THR A 177 4.555 -32.480 -19.907 1.00 21.80 C ATOM 1542 HG1 THR A 177 3.022 -31.725 -17.108 1.00 0.00 H ATOM 1543 H THR A 177 1.781 -30.216 -18.032 1.00 0.00 H ATOM 1544 N HIS A 178 2.466 -29.765 -21.256 1.00 11.69 N ATOM 1545 CA HIS A 178 2.404 -29.344 -22.654 1.00 13.50 C ATOM 1546 C HIS A 178 2.923 -27.920 -22.821 1.00 11.80 C ATOM 1547 O HIS A 178 3.700 -27.629 -23.738 1.00 11.40 O ATOM 1548 CB HIS A 178 0.969 -29.445 -23.170 1.00 11.47 C ATOM 1549 CG HIS A 178 0.813 -29.039 -24.605 1.00 15.87 C ATOM 1550 ND1 HIS A 178 1.057 -29.902 -25.652 1.00 20.99 N ATOM 1551 CD2 HIS A 178 0.457 -27.858 -25.167 1.00 18.01 C ATOM 1552 CE1 HIS A 178 0.843 -29.276 -26.797 1.00 20.07 C ATOM 1553 NE2 HIS A 178 0.476 -28.036 -26.531 1.00 20.04 N ATOM 1554 H HIS A 178 1.591 -30.010 -20.749 1.00 0.00 H ATOM 1555 N ILE A 179 2.471 -27.013 -21.953 1.00 9.48 N ATOM 1556 CA ILE A 179 2.903 -25.621 -22.030 1.00 7.60 C ATOM 1557 C ILE A 179 4.413 -25.529 -21.887 1.00 8.48 C ATOM 1558 O ILE A 179 5.084 -24.814 -22.645 1.00 7.37 O ATOM 1559 CB ILE A 179 2.170 -24.787 -20.963 1.00 6.08 C ATOM 1560 CG1 ILE A 179 0.676 -24.688 -21.317 1.00 7.01 C ATOM 1561 CG2 ILE A 179 2.814 -23.400 -20.835 1.00 7.42 C ATOM 1562 CD1 ILE A 179 -0.213 -24.091 -20.208 1.00 9.12 C ATOM 1563 H ILE A 179 1.802 -27.302 -21.211 1.00 0.00 H ATOM 1564 N GLY A 180 4.977 -26.271 -20.934 1.00 9.37 N ATOM 1565 CA GLY A 180 6.417 -26.225 -20.725 1.00 9.18 C ATOM 1566 C GLY A 180 7.209 -26.716 -21.925 1.00 11.01 C ATOM 1567 O GLY A 180 8.190 -26.086 -22.343 1.00 8.55 O ATOM 1568 H GLY A 180 4.386 -26.885 -20.338 1.00 0.00 H ATOM 1569 N ARG A 181 6.803 -27.854 -22.494 1.00 9.03 N ATOM 1570 CA ARG A 181 7.552 -28.396 -23.623 1.00 10.69 C ATOM 1571 C ARG A 181 7.477 -27.470 -24.832 1.00 8.48 C ATOM 1572 O ARG A 181 8.491 -27.219 -25.493 1.00 11.82 O ATOM 1573 CB ARG A 181 7.050 -29.781 -24.022 1.00 13.81 C ATOM 1574 CG ARG A 181 7.868 -30.302 -25.213 1.00 20.22 C ATOM 1575 CD ARG A 181 7.349 -31.589 -25.836 1.00 28.88 C ATOM 1576 NE ARG A 181 5.935 -31.537 -26.213 1.00 32.44 N ATOM 1577 CZ ARG A 181 5.431 -30.829 -27.225 1.00 27.16 C ATOM 1578 NH1 ARG A 181 6.206 -30.070 -27.993 1.00 27.56 N ATOM 1579 NH2 ARG A 181 4.129 -30.885 -27.467 1.00 35.50 N ATOM 1580 HE ARG A 181 5.269 -32.098 -25.645 1.00 0.00 H ATOM 1581 HH12 ARG A 181 5.790 -29.527 -28.776 1.00 0.00 H ATOM 1582 HH11 ARG A 181 7.229 -30.019 -27.811 1.00 0.00 H ATOM 1583 HH22 ARG A 181 3.722 -30.338 -28.253 1.00 0.00 H ATOM 1584 HH21 ARG A 181 3.514 -31.476 -26.871 1.00 0.00 H ATOM 1585 H ARG A 181 5.961 -28.349 -22.136 1.00 0.00 H ATOM 1586 N VAL A 182 6.280 -26.966 -25.137 1.00 10.07 N ATOM 1587 CA VAL A 182 6.113 -26.075 -26.286 1.00 11.18 C ATOM 1588 C VAL A 182 6.889 -24.780 -26.075 1.00 8.63 C ATOM 1589 O VAL A 182 7.542 -24.276 -26.999 1.00 9.22 O ATOM 1590 CB VAL A 182 4.622 -25.802 -26.549 1.00 12.69 C ATOM 1591 CG1 VAL A 182 4.454 -24.688 -27.594 1.00 12.60 C ATOM 1592 CG2 VAL A 182 3.919 -27.076 -27.025 1.00 16.93 C ATOM 1593 H VAL A 182 5.456 -27.209 -24.551 1.00 0.00 H ATOM 1594 N TYR A 183 6.835 -24.228 -24.855 1.00 8.79 N ATOM 1595 CA TYR A 183 7.558 -22.994 -24.546 1.00 9.06 C ATOM 1596 C TYR A 183 9.058 -23.174 -24.743 1.00 6.63 C ATOM 1597 O TYR A 183 9.715 -22.367 -25.414 1.00 7.43 O ATOM 1598 CB TYR A 183 7.233 -22.570 -23.115 1.00 8.08 C ATOM 1599 CG TYR A 183 7.773 -21.231 -22.666 1.00 7.81 C ATOM 1600 CD1 TYR A 183 7.835 -20.144 -23.537 1.00 8.96 C ATOM 1601 CD2 TYR A 183 8.185 -21.054 -21.353 1.00 7.86 C ATOM 1602 CE1 TYR A 183 8.302 -18.919 -23.107 1.00 5.91 C ATOM 1603 CE2 TYR A 183 8.659 -19.834 -20.907 1.00 8.26 C ATOM 1604 CZ TYR A 183 8.709 -18.769 -21.787 1.00 7.50 C ATOM 1605 OH TYR A 183 9.178 -17.556 -21.325 1.00 8.11 O ATOM 1606 HH TYR A 183 9.156 -16.893 -22.060 1.00 0.00 H ATOM 1607 H TYR A 183 6.268 -24.686 -24.113 1.00 0.00 H ATOM 1608 N LYS A 184 9.616 -24.247 -24.176 1.00 6.42 N ATOM 1609 CA LYS A 184 11.042 -24.513 -24.334 1.00 7.51 C ATOM 1610 C LYS A 184 11.430 -24.638 -25.809 1.00 9.16 C ATOM 1611 O LYS A 184 12.473 -24.119 -26.227 1.00 11.68 O ATOM 1612 CB LYS A 184 11.409 -25.780 -23.563 1.00 10.07 C ATOM 1613 CG LYS A 184 12.858 -26.230 -23.755 1.00 8.80 C ATOM 1614 CD LYS A 184 13.205 -27.358 -22.783 1.00 11.06 C ATOM 1615 CE LYS A 184 14.557 -27.971 -23.156 1.00 9.63 C ATOM 1616 NZ LYS A 184 14.966 -29.038 -22.190 1.00 11.30 N ATOM 1617 HZ1 LYS A 184 15.043 -28.630 -21.237 1.00 0.00 H ATOM 1618 HZ2 LYS A 184 14.252 -29.794 -22.188 1.00 0.00 H ATOM 1619 HZ3 LYS A 184 15.886 -29.429 -22.476 1.00 0.00 H ATOM 1620 H LYS A 184 9.029 -24.899 -23.617 1.00 0.00 H ATOM 1621 N GLU A 185 10.601 -25.310 -26.614 1.00 8.27 N ATOM 1622 CA GLU A 185 10.894 -25.408 -28.045 1.00 9.94 C ATOM 1623 C GLU A 185 10.854 -24.044 -28.719 1.00 9.97 C ATOM 1624 O GLU A 185 11.700 -23.734 -29.573 1.00 10.18 O ATOM 1625 CB GLU A 185 9.900 -26.334 -28.731 1.00 13.23 C ATOM 1626 CG GLU A 185 10.013 -27.744 -28.300 1.00 22.63 C ATOM 1627 CD GLU A 185 9.079 -28.643 -29.064 1.00 29.45 C ATOM 1628 OE1 GLU A 185 8.226 -28.114 -29.810 1.00 31.02 O ATOM 1629 OE2 GLU A 185 9.198 -29.877 -28.909 1.00 34.60 O ATOM 1630 H GLU A 185 9.749 -25.762 -26.224 1.00 0.00 H ATOM 1631 N ARG A 186 9.852 -23.227 -28.379 1.00 9.27 N ATOM 1632 CA ARG A 186 9.723 -21.926 -29.032 1.00 7.21 C ATOM 1633 C ARG A 186 10.891 -21.007 -28.683 1.00 9.18 C ATOM 1634 O ARG A 186 11.354 -20.233 -29.534 1.00 8.89 O ATOM 1635 CB ARG A 186 8.378 -21.286 -28.659 1.00 7.98 C ATOM 1636 CG ARG A 186 7.196 -21.842 -29.454 1.00 7.94 C ATOM 1637 CD ARG A 186 7.212 -21.360 -30.914 1.00 10.55 C ATOM 1638 NE ARG A 186 7.005 -19.912 -31.011 1.00 7.73 N ATOM 1639 CZ ARG A 186 5.805 -19.334 -31.020 1.00 7.92 C ATOM 1640 NH1 ARG A 186 4.707 -20.080 -30.952 1.00 7.84 N ATOM 1641 NH2 ARG A 186 5.702 -18.006 -31.095 1.00 7.46 N ATOM 1642 HE ARG A 186 7.844 -19.301 -31.077 1.00 0.00 H ATOM 1643 HH12 ARG A 186 3.770 -19.628 -30.959 1.00 0.00 H ATOM 1644 HH11 ARG A 186 4.785 -21.115 -30.892 1.00 0.00 H ATOM 1645 HH22 ARG A 186 4.764 -17.557 -31.102 1.00 0.00 H ATOM 1646 HH21 ARG A 186 6.560 -17.420 -31.147 1.00 0.00 H ATOM 1647 H ARG A 186 9.167 -23.516 -27.652 1.00 0.00 H ATOM 1648 N LEU A 187 11.388 -21.075 -27.443 1.00 8.81 N ATOM 1649 CA LEU A 187 12.584 -20.321 -27.085 1.00 6.96 C ATOM 1650 C LEU A 187 13.828 -20.855 -27.780 1.00 8.43 C ATOM 1651 O LEU A 187 14.824 -20.133 -27.896 1.00 13.61 O ATOM 1652 CB LEU A 187 12.803 -20.343 -25.571 1.00 8.44 C ATOM 1653 CG LEU A 187 11.718 -19.658 -24.740 1.00 10.36 C ATOM 1654 CD1 LEU A 187 11.964 -19.905 -23.257 1.00 10.72 C ATOM 1655 CD2 LEU A 187 11.679 -18.159 -25.037 1.00 7.28 C ATOM 1656 H LEU A 187 10.919 -21.669 -26.730 1.00 0.00 H ATOM 1657 N GLY A 188 13.789 -22.097 -28.255 1.00 10.41 N ATOM 1658 CA GLY A 188 14.958 -22.686 -28.869 1.00 8.70 C ATOM 1659 C GLY A 188 16.014 -23.128 -27.888 1.00 12.96 C ATOM 1660 O GLY A 188 17.184 -23.224 -28.262 1.00 12.94 O ATOM 1661 H GLY A 188 12.910 -22.649 -28.184 1.00 0.00 H ATOM 1662 N LEU A 189 15.645 -23.390 -26.632 1.00 10.61 N ATOM 1663 CA LEU A 189 16.625 -23.874 -25.671 1.00 7.93 C ATOM 1664 C LEU A 189 17.116 -25.257 -26.095 1.00 10.19 C ATOM 1665 O LEU A 189 16.315 -26.084 -26.539 1.00 9.95 O ATOM 1666 CB LEU A 189 16.023 -23.967 -24.270 1.00 9.00 C ATOM 1667 CG LEU A 189 15.308 -22.737 -23.709 1.00 13.23 C ATOM 1668 CD1 LEU A 189 14.861 -23.027 -22.276 1.00 10.54 C ATOM 1669 CD2 LEU A 189 16.190 -21.528 -23.764 1.00 13.62 C ATOM 1670 H LEU A 189 14.657 -23.248 -26.340 1.00 0.00 H ATOM 1671 N PRO A 190 18.417 -25.522 -25.976 1.00 9.09 N ATOM 1672 CA PRO A 190 18.919 -26.870 -26.253 1.00 13.86 C ATOM 1673 C PRO A 190 18.262 -27.879 -25.333 1.00 9.97 C ATOM 1674 O PRO A 190 17.893 -27.551 -24.190 1.00 10.18 O ATOM 1675 CB PRO A 190 20.423 -26.752 -25.960 1.00 15.53 C ATOM 1676 CG PRO A 190 20.735 -25.281 -25.985 1.00 16.79 C ATOM 1677 CD PRO A 190 19.472 -24.569 -25.596 1.00 10.56 C ATOM 1678 N PRO A 191 18.106 -29.131 -25.783 1.00 10.21 N ATOM 1679 CA PRO A 191 17.436 -30.121 -24.921 1.00 8.60 C ATOM 1680 C PRO A 191 18.115 -30.301 -23.574 1.00 9.52 C ATOM 1681 O PRO A 191 17.432 -30.607 -22.589 1.00 11.48 O ATOM 1682 CB PRO A 191 17.466 -31.415 -25.756 1.00 13.19 C ATOM 1683 CG PRO A 191 18.297 -31.117 -26.954 1.00 12.86 C ATOM 1684 CD PRO A 191 18.292 -29.634 -27.153 1.00 9.86 C ATOM 1685 N LYS A 192 19.430 -30.079 -23.494 1.00 10.64 N ATOM 1686 CA LYS A 192 20.150 -30.283 -22.239 1.00 11.65 C ATOM 1687 C LYS A 192 19.767 -29.273 -21.169 1.00 15.66 C ATOM 1688 O LYS A 192 19.969 -29.558 -19.982 1.00 14.34 O ATOM 1689 CB LYS A 192 21.662 -30.215 -22.471 1.00 13.08 C ATOM 1690 CG LYS A 192 22.202 -28.793 -22.452 1.00 19.31 C ATOM 1691 CD LYS A 192 23.707 -28.711 -22.743 1.00 29.69 C ATOM 1692 CE LYS A 192 24.009 -28.989 -24.205 1.00 34.53 C ATOM 1693 NZ LYS A 192 23.917 -27.776 -25.079 1.00 32.68 N ATOM 1694 HZ1 LYS A 192 22.954 -27.387 -25.029 1.00 0.00 H ATOM 1695 HZ2 LYS A 192 24.598 -27.062 -24.751 1.00 0.00 H ATOM 1696 HZ3 LYS A 192 24.135 -28.040 -26.061 1.00 0.00 H ATOM 1697 H LYS A 192 19.948 -29.757 -24.336 1.00 0.00 H ATOM 1698 N ILE A 193 19.237 -28.107 -21.555 1.00 12.11 N ATOM 1699 CA ILE A 193 18.867 -27.062 -20.603 1.00 12.52 C ATOM 1700 C ILE A 193 17.522 -27.418 -19.985 1.00 13.66 C ATOM 1701 O ILE A 193 16.503 -27.460 -20.681 1.00 17.58 O ATOM 1702 CB ILE A 193 18.801 -25.682 -21.280 1.00 12.88 C ATOM 1703 CG1 ILE A 193 20.142 -25.308 -21.900 1.00 15.01 C ATOM 1704 CG2 ILE A 193 18.347 -24.614 -20.270 1.00 17.92 C ATOM 1705 CD1 ILE A 193 21.226 -25.046 -20.875 1.00 20.87 C ATOM 1706 H ILE A 193 19.083 -27.938 -22.570 1.00 0.00 H ATOM 1707 N VAL A 194 17.508 -27.629 -18.671 1.00 13.45 N ATOM 1708 CA VAL A 194 16.297 -28.030 -17.961 1.00 13.83 C ATOM 1709 C VAL A 194 15.639 -26.783 -17.388 1.00 16.72 C ATOM 1710 O VAL A 194 16.300 -25.970 -16.734 1.00 15.98 O ATOM 1711 CB VAL A 194 16.627 -29.039 -16.848 1.00 19.76 C ATOM 1712 CG1 VAL A 194 15.376 -29.404 -16.063 1.00 18.54 C ATOM 1713 CG2 VAL A 194 17.280 -30.291 -17.439 1.00 23.45 C ATOM 1714 H VAL A 194 18.389 -27.504 -18.132 1.00 0.00 H ATOM 1715 N ILE A 195 14.343 -26.622 -17.634 1.00 11.61 N ATOM 1716 CA ILE A 195 13.572 -25.558 -16.999 1.00 11.17 C ATOM 1717 C ILE A 195 12.583 -26.202 -16.038 1.00 11.28 C ATOM 1718 O ILE A 195 12.166 -27.350 -16.224 1.00 11.03 O ATOM 1719 CB ILE A 195 12.840 -24.656 -18.016 1.00 13.66 C ATOM 1720 CG1 ILE A 195 11.833 -25.463 -18.841 1.00 12.02 C ATOM 1721 CG2 ILE A 195 13.850 -23.949 -18.927 1.00 15.31 C ATOM 1722 CD1 ILE A 195 10.955 -24.599 -19.773 1.00 12.91 C ATOM 1723 H ILE A 195 13.867 -27.269 -18.294 1.00 0.00 H ATOM 1724 N GLY A 196 12.191 -25.449 -15.012 1.00 12.48 N ATOM 1725 CA GLY A 196 11.370 -25.980 -13.936 1.00 12.24 C ATOM 1726 C GLY A 196 10.087 -25.197 -13.731 1.00 9.60 C ATOM 1727 O GLY A 196 10.023 -23.993 -13.991 1.00 9.10 O ATOM 1728 H GLY A 196 12.481 -24.451 -14.979 1.00 0.00 H ATOM 1729 N TYR A 197 9.056 -25.902 -13.262 1.00 8.18 N ATOM 1730 CA TYR A 197 7.758 -25.319 -12.927 1.00 7.15 C ATOM 1731 C TYR A 197 7.625 -25.267 -11.412 1.00 9.80 C ATOM 1732 O TYR A 197 7.698 -26.307 -10.748 1.00 11.60 O ATOM 1733 CB TYR A 197 6.620 -26.141 -13.524 1.00 8.54 C ATOM 1734 CG TYR A 197 5.244 -25.549 -13.316 1.00 8.90 C ATOM 1735 CD1 TYR A 197 4.693 -24.689 -14.255 1.00 7.16 C ATOM 1736 CD2 TYR A 197 4.484 -25.872 -12.192 1.00 10.49 C ATOM 1737 CE1 TYR A 197 3.422 -24.156 -14.077 1.00 7.43 C ATOM 1738 CE2 TYR A 197 3.221 -25.345 -12.003 1.00 10.04 C ATOM 1739 CZ TYR A 197 2.692 -24.490 -12.946 1.00 8.33 C ATOM 1740 OH TYR A 197 1.433 -23.964 -12.779 1.00 10.19 O ATOM 1741 HH TYR A 197 1.218 -23.376 -13.546 1.00 0.00 H ATOM 1742 H TYR A 197 9.183 -26.925 -13.127 1.00 0.00 H ATOM 1743 N GLN A 198 7.395 -24.072 -10.875 1.00 9.46 N ATOM 1744 CA GLN A 198 7.307 -23.881 -9.432 1.00 12.62 C ATOM 1745 C GLN A 198 5.916 -23.395 -9.051 1.00 11.91 C ATOM 1746 O GLN A 198 5.416 -22.420 -9.622 1.00 10.05 O ATOM 1747 CB GLN A 198 8.381 -22.902 -8.967 1.00 13.81 C ATOM 1748 CG GLN A 198 9.762 -23.550 -9.035 1.00 19.07 C ATOM 1749 CD GLN A 198 10.896 -22.564 -9.088 1.00 26.80 C ATOM 1750 OE1 GLN A 198 10.782 -21.432 -8.616 1.00 28.77 O ATOM 1751 NE2 GLN A 198 12.013 -22.990 -9.676 1.00 32.58 N ATOM 1752 HE22 GLN A 198 12.063 -23.955 -10.060 1.00 0.00 H ATOM 1753 HE21 GLN A 198 12.835 -22.357 -9.751 1.00 0.00 H ATOM 1754 H GLN A 198 7.275 -23.251 -11.502 1.00 0.00 H ATOM 1755 N SER A 199 5.291 -24.093 -8.102 1.00 9.98 N ATOM 1756 CA SER A 199 3.998 -23.686 -7.571 1.00 11.22 C ATOM 1757 C SER A 199 4.122 -22.382 -6.782 1.00 10.75 C ATOM 1758 O SER A 199 5.078 -22.186 -6.026 1.00 9.97 O ATOM 1759 CB SER A 199 3.459 -24.798 -6.670 1.00 17.89 C ATOM 1760 OG SER A 199 2.791 -24.260 -5.555 1.00 16.66 O ATOM 1761 HG SER A 199 3.420 -23.702 -5.032 1.00 0.00 H ATOM 1762 H SER A 199 5.741 -24.954 -7.730 1.00 0.00 H ATOM 1763 N HIS A 200 3.151 -21.478 -6.963 1.00 8.59 N ATOM 1764 CA HIS A 200 3.186 -20.221 -6.218 1.00 9.79 C ATOM 1765 C HIS A 200 3.038 -20.469 -4.717 1.00 10.31 C ATOM 1766 O HIS A 200 3.712 -19.825 -3.903 1.00 11.11 O ATOM 1767 CB HIS A 200 2.084 -19.271 -6.691 1.00 10.47 C ATOM 1768 CG HIS A 200 2.196 -18.860 -8.131 1.00 8.51 C ATOM 1769 ND1 HIS A 200 3.376 -18.428 -8.701 1.00 9.58 N ATOM 1770 CD2 HIS A 200 1.252 -18.764 -9.098 1.00 9.23 C ATOM 1771 CE1 HIS A 200 3.159 -18.110 -9.967 1.00 10.17 C ATOM 1772 NE2 HIS A 200 1.877 -18.299 -10.231 1.00 8.69 N ATOM 1773 H HIS A 200 2.376 -21.669 -7.630 1.00 0.00 H ATOM 1774 N ALA A 201 2.148 -21.392 -4.341 1.00 10.27 N ATOM 1775 CA ALA A 201 1.957 -21.709 -2.928 1.00 10.44 C ATOM 1776 C ALA A 201 3.226 -22.291 -2.315 1.00 13.58 C ATOM 1777 O ALA A 201 3.567 -21.968 -1.171 1.00 14.24 O ATOM 1778 CB ALA A 201 0.775 -22.666 -2.757 1.00 10.85 C ATOM 1779 H ALA A 201 1.586 -21.889 -5.061 1.00 0.00 H ATOM 1780 N ASP A 202 3.941 -23.149 -3.061 1.00 13.02 N ATOM 1781 CA ASP A 202 5.238 -23.646 -2.594 1.00 13.63 C ATOM 1782 C ASP A 202 6.217 -22.500 -2.368 1.00 14.83 C ATOM 1783 O ASP A 202 6.927 -22.465 -1.358 1.00 14.23 O ATOM 1784 CB ASP A 202 5.845 -24.632 -3.598 1.00 12.50 C ATOM 1785 CG ASP A 202 5.140 -25.972 -3.616 1.00 20.35 C ATOM 1786 OD1 ASP A 202 4.210 -26.178 -2.808 1.00 23.88 O ATOM 1787 OD2 ASP A 202 5.529 -26.828 -4.439 1.00 19.07 O ATOM 1788 H ASP A 202 3.570 -23.464 -3.980 1.00 0.00 H ATOM 1789 N THR A 203 6.299 -21.572 -3.327 1.00 12.54 N ATOM 1790 CA THR A 203 7.191 -20.424 -3.170 1.00 15.32 C ATOM 1791 C THR A 203 6.810 -19.602 -1.945 1.00 17.77 C ATOM 1792 O THR A 203 7.682 -19.136 -1.198 1.00 16.39 O ATOM 1793 CB THR A 203 7.150 -19.562 -4.435 1.00 18.27 C ATOM 1794 OG1 THR A 203 7.510 -20.366 -5.562 1.00 17.86 O ATOM 1795 CG2 THR A 203 8.104 -18.373 -4.334 1.00 17.73 C ATOM 1796 HG1 THR A 203 7.485 -19.812 -6.382 1.00 0.00 H ATOM 1797 H THR A 203 5.725 -21.667 -4.189 1.00 0.00 H ATOM 1798 N ALA A 204 5.507 -19.449 -1.701 1.00 13.09 N ATOM 1799 CA ALA A 204 5.040 -18.606 -0.607 1.00 16.96 C ATOM 1800 C ALA A 204 5.235 -19.249 0.764 1.00 20.31 C ATOM 1801 O ALA A 204 5.172 -18.544 1.779 1.00 22.80 O ATOM 1802 CB ALA A 204 3.565 -18.266 -0.813 1.00 16.75 C ATOM 1803 H ALA A 204 4.813 -19.939 -2.301 1.00 0.00 H ATOM 1804 N THR A 205 5.476 -20.561 0.828 1.00 15.52 N ATOM 1805 CA THR A 205 5.542 -21.257 2.108 1.00 18.44 C ATOM 1806 C THR A 205 6.865 -21.954 2.387 1.00 19.58 C ATOM 1807 O THR A 205 7.051 -22.452 3.500 1.00 26.49 O ATOM 1808 CB THR A 205 4.414 -22.299 2.215 1.00 18.45 C ATOM 1809 OG1 THR A 205 4.514 -23.249 1.140 1.00 19.18 O ATOM 1810 CG2 THR A 205 3.042 -21.625 2.178 1.00 20.44 C ATOM 1811 HG1 THR A 205 4.438 -22.775 0.274 1.00 0.00 H ATOM 1812 H THR A 205 5.619 -21.097 -0.052 1.00 0.00 H ATOM 1813 N LYS A 206 7.783 -22.004 1.428 1.00 24.46 N ATOM 1814 CA LYS A 206 9.005 -22.780 1.593 1.00 25.43 C ATOM 1815 C LYS A 206 9.858 -22.240 2.735 1.00 25.46 C ATOM 1816 O LYS A 206 9.878 -21.038 3.019 1.00 29.66 O ATOM 1817 CB LYS A 206 9.825 -22.749 0.304 1.00 28.40 C ATOM 1818 CG LYS A 206 10.418 -21.374 0.026 1.00 32.40 C ATOM 1819 CD LYS A 206 11.255 -21.352 -1.235 1.00 38.70 C ATOM 1820 CE LYS A 206 11.431 -19.931 -1.757 1.00 38.22 C ATOM 1821 NZ LYS A 206 12.285 -19.099 -0.868 1.00 42.87 N ATOM 1822 HZ1 LYS A 206 11.850 -19.043 0.075 1.00 0.00 H ATOM 1823 HZ2 LYS A 206 13.228 -19.531 -0.791 1.00 0.00 H ATOM 1824 HZ3 LYS A 206 12.372 -18.143 -1.269 1.00 0.00 H ATOM 1825 H LYS A 206 7.627 -21.480 0.544 1.00 0.00 H ATOM 1826 N SER A 207 10.561 -23.153 3.398 1.00 31.78 N ATOM 1827 CA SER A 207 11.678 -22.819 4.269 1.00 38.70 C ATOM 1828 C SER A 207 12.968 -22.983 3.479 1.00 45.02 C ATOM 1829 O SER A 207 13.118 -23.936 2.709 1.00 52.31 O ATOM 1830 CB SER A 207 11.697 -23.717 5.506 1.00 43.17 C ATOM 1831 OG SER A 207 11.447 -25.065 5.148 1.00 43.22 O ATOM 1832 HG SER A 207 12.145 -25.373 4.517 1.00 0.00 H ATOM 1833 H SER A 207 10.300 -24.154 3.289 1.00 0.00 H ATOM 1834 N GLY A 208 13.893 -22.050 3.657 1.00 51.22 N ATOM 1835 CA GLY A 208 15.067 -21.987 2.815 1.00 46.49 C ATOM 1836 C GLY A 208 14.763 -21.295 1.499 1.00 46.72 C ATOM 1837 O GLY A 208 13.615 -20.999 1.158 1.00 44.15 O ATOM 1838 H GLY A 208 13.772 -21.350 4.417 1.00 0.00 H ATOM 1839 N SER A 209 15.826 -21.043 0.737 1.00 48.73 N ATOM 1840 CA SER A 209 15.721 -20.187 -0.435 1.00 51.24 C ATOM 1841 C SER A 209 15.311 -20.926 -1.708 1.00 50.72 C ATOM 1842 O SER A 209 14.904 -20.275 -2.680 1.00 49.66 O ATOM 1843 CB SER A 209 17.046 -19.467 -0.682 1.00 51.12 C ATOM 1844 OG SER A 209 18.102 -20.390 -0.851 1.00 50.14 O ATOM 1845 HG SER A 209 18.947 -19.898 -1.009 1.00 0.00 H ATOM 1846 H SER A 209 16.744 -21.464 0.983 1.00 0.00 H ATOM 1847 N THR A 210 15.396 -22.258 -1.734 1.00 50.49 N ATOM 1848 CA THR A 210 15.021 -23.021 -2.921 1.00 48.85 C ATOM 1849 C THR A 210 13.538 -23.370 -2.882 1.00 42.15 C ATOM 1850 O THR A 210 13.053 -23.875 -1.872 1.00 44.87 O ATOM 1851 CB THR A 210 15.844 -24.306 -3.010 1.00 49.79 C ATOM 1852 OG1 THR A 210 15.780 -24.988 -1.738 1.00 54.28 O ATOM 1853 CG2 THR A 210 17.291 -23.989 -3.348 1.00 47.76 C ATOM 1854 HG1 THR A 210 14.837 -25.206 -1.529 1.00 0.00 H ATOM 1855 H THR A 210 15.737 -22.763 -0.891 1.00 0.00 H ATOM 1856 N THR A 211 12.850 -23.110 -3.989 1.00 38.69 N ATOM 1857 CA THR A 211 11.556 -23.733 -4.245 1.00 36.89 C ATOM 1858 C THR A 211 11.784 -24.971 -5.099 1.00 33.63 C ATOM 1859 O THR A 211 12.475 -24.907 -6.120 1.00 31.19 O ATOM 1860 CB THR A 211 10.603 -22.782 -4.965 1.00 28.44 C ATOM 1861 OG1 THR A 211 10.503 -21.552 -4.244 1.00 29.70 O ATOM 1862 CG2 THR A 211 9.195 -23.412 -5.093 1.00 18.83 C ATOM 1863 HG1 THR A 211 9.884 -20.942 -4.718 1.00 0.00 H ATOM 1864 H THR A 211 13.243 -22.448 -4.688 1.00 0.00 H ATOM 1865 N LYS A 212 11.204 -26.093 -4.685 1.00 25.78 N ATOM 1866 CA LYS A 212 11.327 -27.293 -5.494 1.00 27.87 C ATOM 1867 C LYS A 212 10.554 -27.115 -6.803 1.00 23.51 C ATOM 1868 O LYS A 212 9.685 -26.245 -6.927 1.00 23.06 O ATOM 1869 CB LYS A 212 10.825 -28.508 -4.714 1.00 27.74 C ATOM 1870 CG LYS A 212 11.248 -29.845 -5.313 1.00 37.92 C ATOM 1871 CD LYS A 212 10.286 -30.993 -5.002 1.00 42.56 C ATOM 1872 CE LYS A 212 9.024 -30.884 -5.846 1.00 38.66 C ATOM 1873 NZ LYS A 212 8.692 -32.143 -6.574 1.00 38.67 N ATOM 1874 HZ1 LYS A 212 9.476 -32.391 -7.211 1.00 0.00 H ATOM 1875 HZ2 LYS A 212 8.546 -32.911 -5.888 1.00 0.00 H ATOM 1876 HZ3 LYS A 212 7.824 -32.002 -7.129 1.00 0.00 H ATOM 1877 H LYS A 212 10.669 -26.111 -3.793 1.00 0.00 H ATOM 1878 N ASN A 213 10.909 -27.917 -7.804 1.00 20.69 N ATOM 1879 CA ASN A 213 10.168 -27.952 -9.061 1.00 18.86 C ATOM 1880 C ASN A 213 9.104 -29.040 -9.015 1.00 19.45 C ATOM 1881 O ASN A 213 9.424 -30.209 -8.786 1.00 22.50 O ATOM 1882 CB ASN A 213 11.097 -28.228 -10.243 1.00 17.59 C ATOM 1883 CG ASN A 213 12.037 -27.088 -10.531 1.00 16.89 C ATOM 1884 OD1 ASN A 213 11.663 -25.917 -10.461 1.00 14.03 O ATOM 1885 ND2 ASN A 213 13.269 -27.426 -10.889 1.00 19.09 N ATOM 1886 HD22 ASN A 213 13.541 -28.429 -10.934 1.00 0.00 H ATOM 1887 HD21 ASN A 213 13.963 -26.688 -11.124 1.00 0.00 H ATOM 1888 H ASN A 213 11.737 -28.536 -7.687 1.00 0.00 H ATOM 1889 N ARG A 214 7.849 -28.665 -9.274 1.00 11.48 N ATOM 1890 CA ARG A 214 6.800 -29.673 -9.420 1.00 16.57 C ATOM 1891 C ARG A 214 6.954 -30.468 -10.711 1.00 18.79 C ATOM 1892 O ARG A 214 6.562 -31.639 -10.764 1.00 17.41 O ATOM 1893 CB ARG A 214 5.416 -29.027 -9.392 1.00 16.93 C ATOM 1894 CG ARG A 214 5.068 -28.319 -8.097 1.00 22.59 C ATOM 1895 CD ARG A 214 4.637 -29.293 -7.017 1.00 23.56 C ATOM 1896 NE ARG A 214 3.950 -28.593 -5.932 1.00 31.21 N ATOM 1897 CZ ARG A 214 2.631 -28.417 -5.864 1.00 31.26 C ATOM 1898 NH1 ARG A 214 1.833 -28.901 -6.813 1.00 32.63 N ATOM 1899 NH2 ARG A 214 2.103 -27.756 -4.837 1.00 34.71 N ATOM 1900 HE ARG A 214 4.531 -28.206 -5.161 1.00 0.00 H ATOM 1901 HH12 ARG A 214 0.805 -28.758 -6.751 1.00 0.00 H ATOM 1902 HH11 ARG A 214 2.238 -29.422 -7.617 1.00 0.00 H ATOM 1903 HH22 ARG A 214 1.074 -27.617 -4.782 1.00 0.00 H ATOM 1904 HH21 ARG A 214 2.720 -27.378 -4.090 1.00 0.00 H ATOM 1905 H ARG A 214 7.618 -27.656 -9.372 1.00 0.00 H ATOM 1906 N PHE A 215 7.488 -29.839 -11.762 1.00 13.63 N ATOM 1907 CA PHE A 215 7.702 -30.460 -13.065 1.00 9.91 C ATOM 1908 C PHE A 215 8.989 -29.894 -13.644 1.00 12.54 C ATOM 1909 O PHE A 215 9.396 -28.782 -13.301 1.00 11.70 O ATOM 1910 CB PHE A 215 6.557 -30.179 -14.057 1.00 11.57 C ATOM 1911 CG PHE A 215 5.183 -30.504 -13.536 1.00 14.55 C ATOM 1912 CD1 PHE A 215 4.416 -29.535 -12.912 1.00 15.84 C ATOM 1913 CD2 PHE A 215 4.652 -31.772 -13.690 1.00 21.92 C ATOM 1914 CE1 PHE A 215 3.131 -29.829 -12.446 1.00 21.02 C ATOM 1915 CE2 PHE A 215 3.384 -32.071 -13.220 1.00 21.19 C ATOM 1916 CZ PHE A 215 2.621 -31.100 -12.604 1.00 23.19 C ATOM 1917 H PHE A 215 7.769 -28.845 -11.644 1.00 0.00 H ATOM 1918 N VAL A 216 9.623 -30.660 -14.538 1.00 11.51 N ATOM 1919 CA VAL A 216 10.769 -30.182 -15.306 1.00 11.06 C ATOM 1920 C VAL A 216 10.596 -30.611 -16.756 1.00 14.01 C ATOM 1921 O VAL A 216 9.925 -31.601 -17.063 1.00 13.00 O ATOM 1922 CB VAL A 216 12.127 -30.689 -14.764 1.00 13.54 C ATOM 1923 CG1 VAL A 216 12.417 -30.109 -13.385 1.00 11.21 C ATOM 1924 CG2 VAL A 216 12.152 -32.208 -14.731 1.00 17.37 C ATOM 1925 H VAL A 216 9.287 -31.632 -14.692 1.00 0.00 H ATOM 1926 N VAL A 217 11.203 -29.849 -17.659 1.00 11.31 N ATOM 1927 CA VAL A 217 11.160 -30.216 -19.067 1.00 13.24 C ATOM 1928 C VAL A 217 12.438 -29.710 -19.733 1.00 15.50 C ATOM 1929 O VAL A 217 13.112 -28.810 -19.227 1.00 13.76 O ATOM 1930 CB VAL A 217 9.871 -29.676 -19.748 1.00 18.77 C ATOM 1931 CG1 VAL A 217 9.905 -28.180 -19.889 1.00 12.79 C ATOM 1932 CG2 VAL A 217 9.648 -30.338 -21.080 1.00 27.34 C ATOM 1933 OXT VAL A 217 12.856 -30.205 -20.783 1.00 14.23 O ATOM 1934 H VAL A 217 11.709 -28.991 -17.360 1.00 0.00 H TER 1935 VAL A 217 HETATM 1936 O HOH 1 -1.256 -8.929 -1.361 1.00 35.80 O HETATM 1937 O HOH 2 -0.668 4.185 -19.917 1.00 15.80 O HETATM 1938 O HOH 3 -2.186 -20.776 -25.843 1.00 12.57 O HETATM 1939 O HOH 4 9.450 -19.830 -7.306 1.00 24.04 O HETATM 1940 O HOH 5 16.255 -21.826 -15.572 1.00 26.77 O HETATM 1941 O HOH 6 20.736 -19.113 -25.662 1.00 34.78 O HETATM 1942 O HOH 7 -8.689 -18.423 -1.278 1.00 31.99 O HETATM 1943 O HOH 8 -21.828 -0.214 -50.276 1.00 20.34 O HETATM 1944 O HOH 9 -5.745 -6.512 -47.878 1.00 33.52 O HETATM 1945 O HOH 10 -11.686 -5.197 -20.815 1.00 24.95 O HETATM 1946 O HOH 11 24.966 -19.954 -17.709 1.00 34.43 O HETATM 1947 O HOH 12 -7.734 -24.192 -10.351 1.00 30.28 O HETATM 1948 O HOH 13 24.753 -15.854 -24.351 1.00 25.23 O HETATM 1949 O HOH 14 11.375 -30.240 -27.663 1.00 22.79 O HETATM 1950 O HOH 15 -6.525 -25.314 -20.682 1.00 26.96 O HETATM 1951 O HOH 16 1.698 -30.324 -8.916 1.00 30.65 O HETATM 1952 O HOH 17 -5.243 1.467 -32.862 1.00 26.09 O HETATM 1953 O HOH 18 -4.116 -8.282 -16.443 1.00 8.55 O HETATM 1954 O HOH 19 16.874 -25.894 -14.241 1.00 34.96 O HETATM 1955 O HOH 20 11.142 -14.094 -10.164 1.00 17.11 O HETATM 1956 O HOH 21 8.018 -6.109 -0.672 1.00 36.69 O HETATM 1957 O HOH 22 20.291 -31.701 -18.607 1.00 27.55 O HETATM 1958 O HOH 23 12.461 -6.631 -30.473 1.00 15.31 O HETATM 1959 O HOH 24 -12.405 -16.290 -30.814 1.00 26.91 O HETATM 1960 O HOH 25 13.929 -11.428 -8.380 1.00 25.77 O HETATM 1961 O HOH 26 14.025 -23.033 -14.245 1.00 18.10 O HETATM 1962 O HOH 27 16.765 -32.443 -20.887 1.00 36.37 O HETATM 1963 O HOH 28 -0.821 -26.715 -33.220 1.00 22.86 O HETATM 1964 O HOH 29 -9.258 -28.434 -30.196 1.00 28.52 O HETATM 1965 O HOH 30 -4.971 -10.144 -43.420 1.00 27.35 O HETATM 1966 O HOH 31 -0.276 2.221 -24.323 1.00 16.21 O HETATM 1967 O HOH 32 28.194 -17.001 -16.605 1.00 29.25 O HETATM 1968 O HOH 33 16.541 0.398 -10.187 1.00 32.94 O HETATM 1969 O HOH 34 6.514 3.083 -8.346 1.00 33.92 O HETATM 1970 O HOH 35 -10.716 -15.960 -23.356 1.00 23.80 O HETATM 1971 O HOH 36 8.809 -8.164 -8.569 1.00 17.54 O HETATM 1972 O HOH 37 -8.305 -17.898 -22.241 1.00 27.04 O HETATM 1973 O HOH 38 15.290 2.532 -18.336 1.00 20.10 O HETATM 1974 O HOH 39 -7.956 -21.837 -11.840 1.00 25.55 O HETATM 1975 O HOH 40 -12.870 -5.843 -28.995 1.00 16.41 O HETATM 1976 O HOH 41 -8.783 -21.566 -16.736 1.00 30.44 O HETATM 1977 O HOH 42 -6.230 -18.949 -17.013 1.00 22.45 O HETATM 1978 O HOH 43 19.231 1.453 -19.262 1.00 35.28 O HETATM 1979 O HOH 44 2.083 -23.949 -31.079 1.00 31.73 O HETATM 1980 O HOH 45 12.555 -5.507 -7.696 1.00 20.00 O HETATM 1981 O HOH 46 19.558 -2.478 -18.302 1.00 27.22 O HETATM 1982 O HOH 47 21.292 -20.031 -18.801 1.00 27.75 O HETATM 1983 O HOH 48 -17.829 -4.972 -43.886 1.00 16.79 O HETATM 1984 O HOH 49 19.998 -3.666 -25.105 1.00 17.19 O HETATM 1985 O HOH 50 -7.889 -13.938 -4.613 1.00 29.74 O HETATM 1986 O HOH 51 11.807 -9.417 -5.605 1.00 36.29 O HETATM 1987 O HOH 52 20.366 0.425 -21.296 1.00 34.01 O HETATM 1988 O HOH 53 -3.087 -26.564 -6.782 1.00 27.92 O HETATM 1989 O HOH 54 -8.824 -10.360 -10.308 1.00 28.00 O HETATM 1990 O HOH 55 -0.149 -22.289 -6.142 1.00 11.21 O HETATM 1991 O HOH 56 20.688 -11.790 -17.144 1.00 11.45 O HETATM 1992 O HOH 57 -6.987 -20.134 -27.165 1.00 21.71 O HETATM 1993 O HOH 58 14.406 6.005 -11.319 1.00 34.96 O HETATM 1994 O HOH 59 -8.933 -13.216 -12.254 1.00 15.05 O HETATM 1995 O HOH 60 17.452 -19.797 -28.332 1.00 19.11 O HETATM 1996 O HOH 61 22.230 -16.403 -28.272 1.00 21.60 O HETATM 1997 O HOH 62 -12.096 -22.447 -24.015 1.00 37.98 O HETATM 1998 O HOH 63 4.975 -6.088 -13.920 1.00 10.18 O HETATM 1999 O HOH 64 24.712 -9.383 -20.908 1.00 14.89 O HETATM 2000 O HOH 65 9.864 -8.933 0.588 1.00 37.84 O HETATM 2001 O HOH 66 10.552 -33.910 -18.304 1.00 29.35 O HETATM 2002 O HOH 67 -12.244 -14.563 -26.133 1.00 20.94 O HETATM 2003 O HOH 68 -6.827 -0.302 -25.183 1.00 21.15 O HETATM 2004 O HOH 69 18.088 -6.532 -28.054 1.00 24.50 O HETATM 2005 O HOH 70 -4.777 -13.849 -27.538 1.00 5.56 O HETATM 2006 O HOH 71 1.777 -25.987 -1.656 1.00 33.87 O HETATM 2007 O HOH 72 4.029 2.954 -31.264 1.00 13.44 O HETATM 2008 O HOH 73 18.126 -13.274 -10.350 1.00 22.07 O HETATM 2009 O HOH 74 18.660 -8.941 -25.164 1.00 6.94 O HETATM 2010 O HOH 75 -1.198 -2.723 -8.340 1.00 32.57 O HETATM 2011 O HOH 76 -2.346 -1.004 -25.440 1.00 13.75 O HETATM 2012 O HOH 77 -1.554 -0.298 -28.045 1.00 8.47 O HETATM 2013 O HOH 78 24.323 -7.498 -13.960 1.00 29.62 O HETATM 2014 O HOH 79 0.698 -1.358 -35.177 1.00 10.33 O HETATM 2015 O HOH 80 -0.361 -18.319 -12.181 1.00 7.61 O HETATM 2016 O HOH 81 21.105 -6.926 -26.811 1.00 27.86 O HETATM 2017 O HOH 82 -4.191 -17.982 -23.652 1.00 20.15 O HETATM 2018 O HOH 83 -2.164 -24.885 -15.119 1.00 10.87 O HETATM 2019 O HOH 84 12.861 3.547 -14.415 1.00 23.02 O HETATM 2020 O HOH 85 -10.303 -7.775 -30.950 1.00 13.04 O HETATM 2021 O HOH 86 -11.132 -6.046 -35.579 1.00 9.52 O HETATM 2022 O HOH 87 9.778 -14.127 -14.225 1.00 8.37 O HETATM 2023 O HOH 88 -7.062 -27.649 -18.367 1.00 29.76 O HETATM 2024 O HOH 89 6.840 -25.911 -6.737 1.00 15.29 O HETATM 2025 O HOH 90 -16.441 -4.456 -39.782 1.00 14.15 O HETATM 2026 O HOH 91 12.937 -16.731 -31.201 1.00 19.85 O HETATM 2027 O HOH 92 14.561 -17.359 -29.167 1.00 23.57 O HETATM 2028 O HOH 93 -4.978 -14.675 -30.832 1.00 6.97 O HETATM 2029 O HOH 94 23.289 -17.520 -24.749 1.00 30.94 O HETATM 2030 O HOH 95 17.929 -21.008 -18.791 1.00 25.22 O HETATM 2031 O HOH 96 0.488 -26.188 -28.781 1.00 18.76 O HETATM 2032 O HOH 97 11.738 -7.975 -26.182 1.00 10.82 O HETATM 2033 O HOH 98 13.335 -20.090 -31.460 1.00 32.89 O HETATM 2034 O HOH 99 -10.921 -6.332 -16.760 1.00 27.71 O HETATM 2035 O HOH 100 -8.050 -23.911 -23.427 1.00 29.08 O HETATM 2036 O HOH 101 10.004 -2.863 -27.049 1.00 6.82 O HETATM 2037 O HOH 102 -7.836 -7.301 -41.844 1.00 14.31 O HETATM 2038 O HOH 103 -6.858 -18.459 -23.895 1.00 20.93 O HETATM 2039 O HOH 104 10.487 -31.990 -10.633 1.00 34.03 O HETATM 2040 O HOH 105 4.141 -9.442 -11.740 1.00 9.21 O HETATM 2041 O HOH 106 11.067 -2.386 -5.064 1.00 35.47 O HETATM 2042 O HOH 107 -2.823 -3.701 -40.391 1.00 15.17 O HETATM 2043 O HOH 108 -11.370 -9.418 -21.855 1.00 20.78 O HETATM 2044 O HOH 109 -11.472 -12.580 -30.610 1.00 20.70 O HETATM 2045 O HOH 110 -8.296 -3.813 -26.138 1.00 12.96 O HETATM 2046 O HOH 111 0.000 -13.005 0.000 1.00 16.97 O HETATM 2047 O HOH 112 10.304 -2.198 -31.824 1.00 17.61 O HETATM 2048 O HOH 113 11.647 -6.432 -24.125 1.00 12.02 O HETATM 2049 O HOH 114 4.406 -32.755 -9.370 1.00 34.62 O HETATM 2050 O HOH 115 13.223 -29.464 -7.482 1.00 27.72 O HETATM 2051 O HOH 116 -8.863 -8.464 -51.765 1.00 35.38 O HETATM 2052 O HOH 117 -5.645 -5.360 -44.078 1.00 21.93 O HETATM 2053 O HOH 118 -5.088 -22.057 -28.944 1.00 22.04 O HETATM 2054 O HOH 119 7.351 -25.028 -0.281 1.00 32.27 O HETATM 2055 O HOH 120 -8.201 -23.974 -17.358 1.00 26.49 O HETATM 2056 O HOH 121 21.696 -3.640 -21.351 1.00 28.42 O HETATM 2057 O HOH 122 22.395 -15.804 -12.967 1.00 35.81 O HETATM 2058 O HOH 123 -4.889 -2.952 -9.543 1.00 37.14 O HETATM 2059 O HOH 124 -6.736 -3.101 -28.719 1.00 11.53 O HETATM 2060 O HOH 125 9.669 -13.799 -4.592 1.00 33.81 O HETATM 2061 O HOH 126 4.230 -29.231 -3.195 1.00 32.70 O HETATM 2062 O HOH 127 -5.596 -20.475 -9.432 1.00 12.60 O HETATM 2063 O HOH 128 26.418 -12.217 -24.546 1.00 10.27 O HETATM 2064 O HOH 129 -1.663 -21.487 -31.983 1.00 19.17 O HETATM 2065 O HOH 130 14.348 1.543 -10.416 1.00 27.70 O HETATM 2066 O HOH 131 11.486 -13.463 -30.504 1.00 13.80 O HETATM 2067 O HOH 132 9.813 -4.302 -24.622 1.00 7.06 O HETATM 2068 O HOH 133 0.966 -32.862 -21.963 1.00 21.66 O HETATM 2069 O HOH 134 8.220 5.171 -7.901 1.00 37.66 O HETATM 2070 O HOH 135 -10.575 -18.110 -24.991 1.00 23.20 O HETATM 2071 O HOH 136 -3.118 1.150 -29.804 1.00 19.39 O HETATM 2072 O HOH 137 -7.802 2.136 -33.262 1.00 10.62 O HETATM 2073 O HOH 138 -13.627 -3.532 -49.716 1.00 16.03 O HETATM 2074 O HOH 139 18.377 -0.736 -27.307 1.00 12.04 O HETATM 2075 O HOH 140 -5.360 -15.158 -2.535 1.00 29.93 O HETATM 2076 O HOH 141 -13.566 -11.409 -46.416 1.00 29.66 O HETATM 2077 O HOH 142 19.444 -3.045 -15.379 1.00 25.77 O HETATM 2078 O HOH 143 8.569 -33.340 -14.412 1.00 20.86 O HETATM 2079 O HOH 144 -3.738 -28.861 -27.397 1.00 32.40 O HETATM 2080 O HOH 145 4.341 -12.136 0.070 1.00 20.35 O HETATM 2081 O HOH 146 19.871 -5.109 -13.651 1.00 23.66 O HETATM 2082 O HOH 147 -9.920 -11.690 -23.064 1.00 10.06 O HETATM 2083 O HOH 148 14.045 -32.825 -20.520 1.00 32.17 O HETATM 2084 O HOH 149 -6.488 -6.806 -16.198 1.00 16.84 O HETATM 2085 O HOH 150 14.762 0.176 -25.669 1.00 8.73 O HETATM 2086 O HOH 151 7.062 -31.665 -17.516 1.00 29.28 O HETATM 2087 O HOH 152 4.051 -22.878 -31.342 1.00 20.97 O HETATM 2088 O HOH 153 -2.140 -17.825 -24.625 1.00 15.95 O HETATM 2089 O HOH 154 10.901 -28.833 -25.363 1.00 20.99 O HETATM 2090 O HOH 155 19.052 -20.370 -21.285 1.00 27.71 O HETATM 2091 O HOH 156 18.628 -15.753 -13.360 1.00 18.79 O HETATM 2092 O HOH 157 7.558 -14.649 -12.455 1.00 8.67 O HETATM 2093 O HOH 158 -5.774 -1.500 -46.349 1.00 20.07 O HETATM 2094 O HOH 159 7.658 -5.515 -23.129 1.00 5.86 O HETATM 2095 O HOH 160 -5.726 0.410 -21.780 1.00 14.53 O HETATM 2096 O HOH 161 10.174 -19.782 -32.184 1.00 16.76 O HETATM 2097 O HOH 162 -8.838 -12.282 -7.696 1.00 21.15 O HETATM 2098 O HOH 163 -0.041 -24.160 -32.365 1.00 27.18 O HETATM 2099 O HOH 164 2.983 -17.101 -31.986 1.00 8.27 O HETATM 2100 O HOH 165 18.047 -10.917 -27.163 1.00 8.57 O HETATM 2101 O HOH 166 5.000 1.104 -11.893 1.00 18.44 O HETATM 2102 O HOH 167 12.602 -16.273 -8.151 1.00 31.67 O HETATM 2103 O HOH 168 25.801 -15.096 -14.411 1.00 15.70 O HETATM 2104 O HOH 169 14.382 -30.121 -10.421 1.00 31.78 O HETATM 2105 O HOH 170 25.674 -17.880 -21.911 1.00 34.07 O HETATM 2106 O HOH 171 11.411 -30.627 -23.329 1.00 27.14 O HETATM 2107 O HOH 172 -6.232 -9.875 -7.957 1.00 30.00 O HETATM 2108 O HOH 173 22.225 -28.445 -18.404 1.00 31.86 O HETATM 2109 O HOH 174 6.008 -19.773 -8.407 1.00 11.23 O HETATM 2110 O HOH 175 -4.290 -30.855 -17.436 1.00 24.56 O HETATM 2111 O HOH 176 -3.767 -33.700 -16.268 1.00 29.90 O HETATM 2112 O HOH 177 9.643 -26.064 -2.141 1.00 31.63 O HETATM 2113 O HOH 178 19.960 -27.100 -17.050 1.00 20.90 O HETATM 2114 O HOH 179 -4.307 -31.181 -27.177 1.00 40.16 O HETATM 2115 O HOH 180 5.663 -7.085 -11.486 1.00 10.31 O HETATM 2116 O HOH 181 17.460 -23.265 -17.262 1.00 27.62 O HETATM 2117 O HOH 182 13.592 -25.455 -31.141 1.00 24.35 O HETATM 2118 O HOH 183 2.391 -14.003 -0.303 1.00 14.83 O HETATM 2119 O HOH 184 -11.805 -18.865 -15.433 1.00 31.18 O HETATM 2120 O HOH 185 6.989 -25.187 -29.809 1.00 28.55 O HETATM 2121 O HOH 186 15.167 -25.449 -12.138 1.00 32.38 O HETATM 2122 O HOH 187 21.828 -9.887 -15.500 1.00 16.83 O HETATM 2123 O HOH 188 28.377 -14.138 -14.822 1.00 16.92 O HETATM 2124 O HOH 189 22.452 -5.300 -14.000 1.00 28.92 O HETATM 2125 O HOH 190 23.754 -8.617 -16.874 1.00 21.24 O HETATM 2126 O HOH 191 7.141 -34.175 -12.393 1.00 36.27 O HETATM 2127 O HOH 192 8.002 -12.340 -10.884 1.00 11.08 O HETATM 2128 O HOH 193 -3.554 -0.063 -34.444 1.00 14.17 O HETATM 2129 O HOH 194 -13.194 -7.948 -52.236 1.00 32.11 O HETATM 2130 O HOH 195 6.569 -10.106 -10.558 1.00 14.67 O HETATM 2131 O HOH 196 27.739 -13.149 -10.301 1.00 33.41 O HETATM 2132 O HOH 197 -10.593 -11.387 -48.673 1.00 35.58 O HETATM 2133 O HOH 198 -8.770 -0.196 -29.841 1.00 22.59 O HETATM 2134 O HOH 199 12.728 -14.309 -6.469 1.00 34.06 O HETATM 2135 O HOH 200 -4.330 2.256 -19.974 1.00 20.36 O HETATM 2136 O HOH 201 13.405 -19.714 -7.979 1.00 38.82 O HETATM 2137 O HOH 202 3.615 -8.998 0.438 1.00 32.25 O HETATM 2138 O HOH 203 -6.967 -24.928 -29.957 1.00 33.01 O HETATM 2139 O HOH 204 -3.966 -33.978 -14.274 1.00 36.73 O HETATM 2140 O HOH 205 -11.063 -3.287 -19.533 1.00 33.14 O HETATM 2141 O HOH 206 -14.718 -4.655 -27.191 1.00 28.17 O HETATM 2142 O HOH 207 22.904 -3.907 -18.837 1.00 37.74 O HETATM 2143 O HOH 208 -7.866 -17.642 -18.091 1.00 25.11 O HETATM 2144 O HOH 209 26.172 -8.448 -17.398 1.00 35.25 O HETATM 2145 O HOH 210 -9.734 -30.523 -28.748 1.00 25.09 O HETATM 2146 O HOH 211 13.888 -31.030 -24.764 1.00 24.72 O HETATM 2147 O HOH 212 -11.353 -10.314 -42.336 1.00 20.21 O HETATM 2148 O HOH 213 -12.867 -13.428 -28.779 1.00 34.72 O HETATM 2149 O HOH 214 -11.221 -1.652 -27.440 1.00 34.85 O HETATM 2150 O HOH 215 10.394 -6.183 -4.314 1.00 33.85 O HETATM 2151 O HOH 216 16.311 -19.713 -30.998 1.00 35.49 O HETATM 2152 O HOH 217 10.713 -7.150 -6.761 1.00 17.95 O HETATM 2153 O HOH 218 -13.258 -1.486 -25.330 1.00 35.43 O HETATM 2154 O HOH 219 19.094 2.729 -22.836 1.00 16.80 O HETATM 2155 O HOH 220 0.337 1.768 -27.186 1.00 8.96 O HETATM 2156 O HOH 221 6.628 3.776 -31.770 1.00 20.81 O HETATM 2157 O HOH 222 18.777 -11.932 -31.181 1.00 34.04 O HETATM 2158 O HOH 223 2.748 -15.858 1.849 1.00 23.42 O HETATM 2159 O HOH 224 -8.898 -30.925 -25.759 1.00 34.35 O HETATM 2160 O HOH 225 24.409 -5.813 -18.066 1.00 30.96 O HETATM 2161 O HOH 226 -10.096 -19.595 -18.914 1.00 37.55 O HETATM 2162 O HOH 227 19.308 -20.869 -26.391 1.00 28.52 O HETATM 2163 O HOH 228 9.187 -4.582 -3.370 1.00 37.94 O HETATM 2164 O HOH 229 1.115 -24.556 0.541 1.00 31.06 O HETATM 2165 O HOH 230 -3.464 -6.848 -43.472 1.00 27.90 O HETATM 2166 O HOH 231 14.072 -8.809 -29.797 1.00 24.45 O HETATM 2167 O HOH 232 24.373 -10.884 -29.010 1.00 26.41 O HETATM 2168 O HOH 233 -0.902 -24.836 -5.300 1.00 25.96 O HETATM 2169 O HOH 234 2.835 4.896 -29.946 1.00 21.10 O HETATM 2170 O HOH 235 6.200 -12.653 1.819 1.00 33.92 O HETATM 2171 O HOH 236 -14.126 -6.748 -20.694 1.00 23.66 O HETATM 2172 O HOH 237 -8.885 -1.688 -24.833 1.00 24.75 O HETATM 2173 O HOH 238 -7.230 -11.754 -42.399 1.00 27.25 O HETATM 2174 O HOH 239 -15.072 -4.963 -51.725 1.00 28.49 O HETATM 2175 O HOH 240 -15.861 -5.716 -22.804 1.00 27.70 O HETATM 2176 O HOH 241 -6.545 -0.341 -27.941 1.00 23.01 O HETATM 2177 O HOH 242 2.448 -21.442 -33.798 1.00 17.60 O HETATM 2178 O HOH 243 0.243 4.193 -22.701 1.00 17.75 O HETATM 2179 O HOH 244 24.545 -8.307 -29.829 1.00 23.83 O HETATM 2180 O HOH 245 -8.894 -9.890 -41.307 1.00 16.23 O HETATM 2181 O HOH 246 18.557 -33.175 -19.331 1.00 38.51 O HETATM 2182 O HOH 247 6.666 -21.559 -34.610 1.00 18.39 O HETATM 2183 O HOH 248 17.010 -8.888 -29.590 1.00 25.59 O HETATM 2184 O HOH 249 14.938 -6.114 -6.778 1.00 35.61 O HETATM 2185 O HOH 250 16.809 -17.020 -33.580 1.00 37.89 O HETATM 2186 O HOH 251 0.325 3.866 -28.682 1.00 20.91 O HETATM 2187 O HOH 252 -10.971 -27.498 -30.663 1.00 35.57 O HETATM 2188 O HOH 253 19.592 -33.932 -21.664 1.00 22.47 O HETATM 2189 O HOH 254 -2.967 3.249 -25.013 1.00 31.83 O HETATM 2190 O HOH 255 3.570 7.171 -23.591 1.00 31.90 O HETATM 2191 O HOH 256 21.860 -5.535 -25.136 1.00 33.20 O HETATM 2192 O HOH 257 1.811 -27.335 -33.108 1.00 30.96 O HETATM 2193 O HOH 258 1.638 -35.100 -20.516 1.00 37.98 O HETATM 2194 O HOH 259 -4.882 1.729 -28.143 1.00 34.56 O HETATM 2195 O HOH 260 19.742 -21.774 -23.420 1.00 23.73 O HETATM 2196 O HOH 261 -12.701 -1.087 -23.000 1.00 34.84 O HETATM 2197 O HOH 262 10.166 -35.294 -15.119 1.00 31.47 O HETATM 2198 O HOH 263 24.951 -25.734 -21.508 1.00 35.23 O HETATM 2199 O HOH 264 14.612 -18.106 -8.412 1.00 38.35 O HETATM 2200 O HOH 265 -9.074 -10.744 -38.951 1.00 19.88 O HETATM 2201 O HOH 266 -10.086 -25.286 -19.123 1.00 34.31 O HETATM 2202 O HOH 267 -18.445 -7.749 -43.166 1.00 30.47 O HETATM 2203 O HOH 268 -1.238 -25.697 -3.003 1.00 38.75 O HETATM 2204 O HOH 269 20.321 -24.356 -16.798 1.00 33.06 O HETATM 2205 O HOH 270 -6.125 2.029 -24.074 1.00 30.81 O HETATM 2206 O HOH 271 22.078 -7.359 -30.007 1.00 35.54 O HETATM 2207 O HOH 272 -10.142 -6.137 -14.116 1.00 38.60 O HETATM 2208 O HOH 273 -2.539 5.930 -20.325 1.00 35.68 O HETATM 2209 O HOH 274 2.939 -27.220 -30.623 1.00 23.79 O HETATM 2210 O HOH 275 8.019 6.138 -29.727 1.00 15.51 O HETATM 2211 O HOH 276 25.322 -28.346 -29.262 1.00 33.51 O HETATM 2212 O HOH 277 -4.067 4.275 -22.239 1.00 37.75 O HETATM 2213 O HOH 278 -6.454 -30.151 -18.374 1.00 32.75 O HETATM 2214 O HOH 279 22.782 -32.993 -19.306 1.00 26.31 O HETATM 2215 O HOH 280 2.622 -30.949 -1.687 1.00 43.75 O HETATM 2216 O HOH 281 17.710 4.823 -19.889 1.00 32.69 O HETATM 2217 O HOH 282 -5.277 3.878 -31.649 1.00 25.56 O HETATM 2218 O HOH 283 13.667 -10.862 -31.373 1.00 29.88 O HETATM 2219 O HOH 284 5.812 7.317 -26.657 1.00 20.91 O HETATM 2220 O HOH 285 4.124 6.907 -28.752 1.00 25.57 O HETATM 2221 O HOH 286 -24.442 1.241 -50.134 1.00 33.85 O HETATM 2222 O HOH 287 13.321 -32.062 -10.464 1.00 36.37 O HETATM 2223 O HOH 288 19.831 -2.928 -27.875 1.00 16.33 O HETATM 2224 O HOH 289 3.083 2.640 -34.015 1.00 16.57 O HETATM 2225 O HOH 290 9.874 -32.672 -23.475 1.00 29.39 O HETATM 2226 O HOH 291 18.705 -4.547 -29.536 1.00 24.04 O HETATM 2227 O HOH 292 -3.092 -5.611 -47.046 1.00 38.06 O HETATM 2228 O HOH 293 -8.219 -0.103 -20.825 1.00 34.01 O HETATM 2229 O HOH 294 7.690 -33.440 -22.138 1.00 34.48 O HETATM 2230 O HOH 295 16.511 -18.031 -10.248 1.00 33.35 O HETATM 2231 O HOH 296 -4.300 2.677 -26.183 1.00 38.08 O HETATM 2232 O HOH 297 -1.792 3.540 -31.132 1.00 28.13 O HETATM 2233 O HOH 298 16.392 -11.661 -32.499 1.00 35.38 O HETATM 2234 O HOH 299 25.087 -8.332 -32.596 1.00 29.15 O HETATM 2235 O HOH 300 24.310 -26.916 -18.978 1.00 40.01 O HETATM 2236 O HOH 301 22.403 -22.589 -23.570 1.00 31.68 O HETATM 2237 O HOH 302 16.383 -35.443 -20.378 1.00 36.73 O HETATM 2238 O HOH 303 -6.231 2.848 -18.125 1.00 33.72 O HETATM 2239 O HOH 304 -13.628 -11.008 -40.778 1.00 31.49 O HETATM 2240 O HOH 305 15.173 -33.514 -16.393 1.00 36.46 O HETATM 2241 O HOH 306 20.560 -6.305 -30.947 1.00 31.37 O HETATM 2242 O HOH 307 -15.372 -9.711 -39.649 1.00 28.90 O HETATM 2243 O HOH 308 22.578 -23.839 -17.780 1.00 40.49 O HETATM 2244 O HOH 309 16.166 -5.476 -31.845 1.00 36.49 O HETATM 2245 O HOH 310 16.320 -32.354 -13.792 1.00 38.49 O HETATM 2246 O HOH 311 5.694 -19.310 -40.362 1.00 32.52 O HETATM 2247 O HOH 312 -7.409 -12.660 -38.023 1.00 18.42 O HETATM 2248 O HOH 313 6.454 -20.876 -37.394 1.00 21.15 O HETATM 2249 O HOH 314 6.258 -16.095 -43.473 1.00 35.29 O HETATM 2250 O HOH 315 9.111 -19.146 -37.821 1.00 19.07 O HETATM 2251 O HOH 316 9.166 -7.992 -37.345 1.00 17.17 O HETATM 2252 O HOH 317 6.025 -5.580 -42.396 1.00 28.47 O HETATM 2253 O HOH 318 7.223 -12.172 -40.802 1.00 18.93 O HETATM 2254 O HOH 319 0.617 -19.990 -32.368 1.00 12.43 O HETATM 2255 O HOH 320 11.621 -7.861 -34.152 1.00 32.05 O HETATM 2256 O HOH 321 0.670 -3.304 -37.243 1.00 15.56 O HETATM 2257 O HOH 322 2.102 -10.767 -41.511 1.00 14.95 O HETATM 2258 O HOH 323 4.563 -19.698 -34.221 1.00 11.71 O HETATM 2259 O HOH 324 2.126 -21.990 -36.766 1.00 11.16 O HETATM 2260 O HOH 325 -1.000 -17.416 -38.512 1.00 12.45 O HETATM 2261 O HOH 326 -3.749 -17.629 -38.367 1.00 27.46 O HETATM 2262 O HOH 327 -7.127 -19.152 -35.852 1.00 15.69 O HETATM 2263 O HOH 328 3.112 -17.433 -41.220 1.00 19.44 O HETATM 2264 O HOH 329 7.086 -6.014 -40.149 1.00 23.79 O HETATM 2265 O HOH 330 11.684 -6.623 -32.565 1.00 34.87 O HETATM 2266 O HOH 331 12.716 -14.293 -36.034 1.00 38.52 O HETATM 2267 O HOH 332 12.421 -3.615 -33.107 1.00 29.64 O HETATM 2268 O HOH 333 1.577 -8.203 -42.680 1.00 29.50 O HETATM 2269 O HOH 334 -8.835 -21.369 -26.732 1.00 39.63 O HETATM 2270 O HOH 335 1.865 -3.906 -41.149 1.00 34.51 O HETATM 2271 O HOH 336 3.450 -15.087 -42.492 1.00 23.64 O HETATM 2272 O HOH 337 14.094 -15.805 -33.455 1.00 36.70 O HETATM 2273 O HOH 338 1.260 -5.971 -42.607 1.00 35.10 O HETATM 2274 O HOH 339 12.380 -18.720 -33.496 1.00 31.91 O HETATM 2275 O HOH 340 -9.330 -17.818 -36.932 1.00 29.21 O HETATM 2276 O HOH 341 8.570 -9.866 -41.243 1.00 31.83 O HETATM 2277 O HOH 342 -11.628 -11.519 -38.074 1.00 21.65 O HETATM 2278 O HOH 343 -13.197 -11.291 -32.513 1.00 35.09 O HETATM 2279 O HOH 344 3.905 -8.968 -44.462 1.00 37.78 O HETATM 2280 O HOH 345 12.692 -12.377 -32.357 1.00 33.97 O HETATM 2281 O HOH 346 2.772 -12.934 -43.191 1.00 29.73 O HETATM 2282 O HOH 347 -5.890 -13.319 -40.104 1.00 21.53 O HETATM 2283 O HOH 348 10.986 -9.958 -37.723 1.00 32.44 O HETATM 2284 O HOH 349 -13.525 -9.977 -36.551 1.00 19.61 O HETATM 2285 O HOH 350 12.426 -10.071 -33.959 1.00 29.31 O HETATM 2286 O HOH 351 -0.233 -11.072 -43.175 1.00 39.06 O HETATM 2287 O HOH 352 12.298 -11.168 -35.927 1.00 32.43 O HETATM 2288 O HOH 353 -4.716 -15.576 -40.206 1.00 33.74 O HETATM 2289 O HOH 354 -10.101 -14.361 -40.639 1.00 40.78 O HETATM 2290 O HOH 355 -7.840 -15.707 -40.707 1.00 39.44 O HETATM 2291 C4 UNN A 356 5.288 -10.485 -4.538 1.00 0.46 C HETATM 2292 C5 UNN A 356 4.702 -11.125 -5.621 1.00 0.38 C HETATM 2293 C6 UNN A 356 3.341 -11.388 -5.629 1.00 0.35 C HETATM 2294 N1 UNN A 356 2.583 -10.996 -4.527 1.00 -0.23 N HETATM 2295 C2 UNN A 356 3.223 -10.355 -3.459 1.00 0.24 C HETATM 2296 N2 UNN A 356 2.511 -9.976 -2.402 1.00 -0.32 N HETATM 2297 H3 UNN A 356 2.973 -9.504 -1.612 1.00 0.18 H HETATM 2298 H4 UNN A 356 1.497 -10.155 -2.373 1.00 0.18 H HETATM 2299 N3 UNN A 356 4.543 -10.116 -3.487 1.00 -0.12 N HETATM 2300 H5 UNN A 356 4.990 -9.642 -2.689 1.00 0.29 H HETATM 2301 H2 UNN A 356 1.599 -11.170 -4.499 1.00 0.18 H HETATM 2302 O6 UNN A 356 2.815 -11.954 -6.585 1.00 -0.31 O HETATM 2303 N7 UNN A 356 5.677 -11.354 -6.484 1.00 -0.17 N HETATM 2304 C8 UNN A 356 6.828 -10.905 -6.003 1.00 0.26 C HETATM 2305 N9 UNN A 356 6.588 -10.368 -4.808 1.00 -0.01 N HETATM 2306 CBD UNN A 356 7.635 -9.754 -3.953 1.00 0.24 C HETATM 2307 OAU UNN A 356 8.481 -10.845 -3.457 1.00 -0.33 O HETATM 2308 CBC UNN A 356 8.207 -11.050 -2.052 1.00 0.11 C HETATM 2309 CBA UNN A 356 7.094 -10.048 -1.698 1.00 0.11 C HETATM 2310 CBB UNN A 356 7.149 -8.964 -2.774 1.00 0.14 C HETATM 2311 OAF UNN A 356 8.129 -7.986 -2.417 1.00 -0.38 O HETATM 2312 H15 UNN A 356 7.819 -7.487 -1.670 1.00 0.21 H HETATM 2313 H14 UNN A 356 6.171 -8.494 -2.953 1.00 0.07 H HETATM 2314 OAE UNN A 356 7.439 -9.459 -0.463 1.00 -0.39 O HETATM 2315 H17 UNN A 356 8.316 -9.098 -0.520 1.00 0.21 H HETATM 2316 H16 UNN A 356 6.106 -10.529 -1.653 1.00 0.06 H HETATM 2317 CAP UNN A 356 7.822 -12.542 -1.765 1.00 0.06 C HETATM 2318 NAS UNN A 356 6.354 -12.665 -1.926 1.00 -0.24 N HETATM 2319 SBH UNN A 356 5.875 -13.726 -3.100 1.00 0.14 S HETATM 2320 OAC UNN A 356 6.876 -13.737 -4.217 1.00 -0.15 O HETATM 2321 OAD UNN A 356 4.527 -13.331 -3.626 1.00 -0.15 O HETATM 2322 CBG UNN A 356 5.783 -15.375 -2.334 1.00 0.54 C HETATM 2323 FAH UNN A 356 6.982 -15.716 -1.872 1.00 -0.15 F HETATM 2324 FAI UNN A 356 4.913 -15.348 -1.330 1.00 -0.15 F HETATM 2325 FAG UNN A 356 5.388 -16.264 -3.240 1.00 -0.15 F HETATM 2326 H21 UNN A 356 5.705 -12.147 -1.369 1.00 0.17 H HETATM 2327 H19 UNN A 356 8.111 -12.813 -0.739 1.00 0.05 H HETATM 2328 H20 UNN A 356 8.334 -13.205 -2.478 1.00 0.05 H HETATM 2329 H18 UNN A 356 9.105 -10.812 -1.463 1.00 0.06 H HETATM 2330 H13 UNN A 356 8.235 -9.080 -4.583 1.00 0.10 H HETATM 2331 H1 UNN A 356 7.797 -10.965 -6.497 1.00 0.25 H HETATM 2332 CAQ UNN A 356 5.520 -12.022 -7.779 1.00 0.08 C HETATM 2333 CAW UNN A 356 5.831 -13.504 -7.583 1.00 -0.03 C HETATM 2334 CAM UNN A 356 7.127 -13.976 -7.751 1.00 -0.06 C HETATM 2335 CAK UNN A 356 7.402 -15.327 -7.571 1.00 -0.07 C HETATM 2336 CAJ UNN A 356 6.382 -16.206 -7.223 1.00 -0.07 C HETATM 2337 CAL UNN A 356 5.085 -15.735 -7.054 1.00 -0.07 C HETATM 2338 CAN UNN A 356 4.811 -14.384 -7.235 1.00 -0.06 C HETATM 2339 H10 UNN A 356 3.800 -14.015 -7.105 1.00 0.06 H HETATM 2340 H9 UNN A 356 4.290 -16.419 -6.782 1.00 0.06 H HETATM 2341 H8 UNN A 356 6.598 -17.259 -7.083 1.00 0.06 H HETATM 2342 H7 UNN A 356 8.413 -15.696 -7.702 1.00 0.06 H HETATM 2343 H6 UNN A 356 7.923 -13.292 -8.022 1.00 0.06 H HETATM 2344 H11 UNN A 356 4.488 -11.901 -8.139 1.00 0.06 H HETATM 2345 H12 UNN A 356 6.217 -11.587 -8.511 1.00 0.06 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 2291 2292 2299 2305 CONECT 2292 2291 2293 2303 CONECT 2293 2292 2294 2302 CONECT 2294 2293 2295 2301 CONECT 2295 2294 2296 2299 CONECT 2296 2295 2297 2298 CONECT 2297 2296 CONECT 2298 2296 CONECT 2299 2291 2295 2300 CONECT 2300 2299 CONECT 2301 2294 CONECT 2302 2293 CONECT 2303 2292 2304 2332 CONECT 2304 2303 2305 2331 CONECT 2305 2291 2304 2306 CONECT 2306 2305 2307 2310 2330 CONECT 2307 2306 2308 CONECT 2308 2307 2309 2317 2329 CONECT 2309 2308 2310 2314 2316 CONECT 2310 2306 2309 2311 2313 CONECT 2311 2310 2312 CONECT 2312 2311 CONECT 2313 2310 CONECT 2314 2309 2315 CONECT 2315 2314 CONECT 2316 2309 CONECT 2317 2308 2318 2327 2328 CONECT 2318 2317 2319 2326 CONECT 2319 2318 2320 2321 2322 CONECT 2320 2319 CONECT 2321 2319 CONECT 2322 2319 2323 2324 2325 CONECT 2323 2322 CONECT 2324 2322 CONECT 2325 2322 CONECT 2326 2318 CONECT 2327 2317 CONECT 2328 2317 CONECT 2329 2308 CONECT 2330 2306 CONECT 2331 2304 CONECT 2332 2303 2333 2344 2345 CONECT 2333 2332 2334 2338 CONECT 2334 2333 2335 2343 CONECT 2335 2334 2336 2342 CONECT 2336 2335 2337 2341 CONECT 2337 2336 2338 2340 CONECT 2338 2333 2337 2339 CONECT 2339 2338 CONECT 2340 2337 CONECT 2341 2336 CONECT 2342 2335 CONECT 2343 2334 CONECT 2344 2332 CONECT 2345 2332 MASTER 0 0 0 0 0 0 0 0 2344 1 59 15 END
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Structure:
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Related entries of code: 5ei3
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2w97
RCSB PDB
PDBbind
14aa, >2W97_3|Chains... *
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
5ei3
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Eukaryotic translation initiation factor 4E/4 gamma (elF4E:4G)
Ligand Name
5O8
EC.Number
E.C.-.-.-.-
Resolution
1.71(Å)
Affinity (Kd/Ki/IC50)
Kd=56.5uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Eur.J.Med.Chem. Vol. 124: pp. 200-217
Ligand Properties
Formula
C
1
8
H
2
1
F
3
N
6
O
6
S
Molecular Weight
506.456
Exact Mass
506.120
No. of atoms
55
No. of bonds
58
Polar Surface Area
187.12
LOGP Value
1.28 (
Computed with XLOGP3
)
0.97 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@H](O)[C@H](O[C@H]1n1cn(c2c1[nH]c(N)[nH+]c2=O)Cc1ccccc1)CNS(=O)(=O)C(F)(F)F
InChI String
InChI=1S/C18H20F3N6O6S/c19-18(20,21)34(31,32)23-6-10-12(28)13(29)16(33-10)27-8-26(7-9-4-2-1-3-5-9)11-14(27)24-17(22)25-15(11)30/h1-5,8,10,12-13,16,23,28-29H,6-7H2,(H3,22,24,25,30)/p+1/t10-,12-,13-,16-/m1/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):
P06730
Q04637
Entrez Gene ID
NCBI Entrez Gene ID:
1977
1981
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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