Browse entries in the PDBbind-CN Database
HEADER 3HD3_COMPLEX COMPND 3HD3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 215 ALA PRO ALA ALA VAL ASP TRP ARG ALA ARG GLY ALA VAL SEQRES 2 A 215 THR ALA VAL LYS ASP GLN GLY GLN CYS GLY SER CYS TRP SEQRES 3 A 215 ALA PHE SER ALA ILE GLY ASN VAL GLU CYS GLN TRP PHE SEQRES 4 A 215 LEU ALA GLY HIS PRO LEU THR ASN LEU ALA GLU GLN MET SEQRES 5 A 215 LEU VAL SER CYS ASP LYS THR ASP SER GLY CYS SER GLY SEQRES 6 A 215 GLY LEU MET ASN ASN ALA PHE GLU TRP ILE VAL GLN GLU SEQRES 7 A 215 ASN ASN GLY ALA VAL TYR THR GLU ASP SER TYR PRO TYR SEQRES 8 A 215 ALA SER GLY GLU GLY ILE SER PRO PRO CYS THR THR SER SEQRES 9 A 215 GLY HIS THR VAL GLY ALA THR ILE THR GLY HIS VAL GLU SEQRES 10 A 215 LEU PRO GLN ASP GLU ALA GLN ILE ALA ALA TRP LEU ALA SEQRES 11 A 215 VAL ASN GLY PRO VAL ALA VAL ALA VAL ASP ALA SER SER SEQRES 12 A 215 TRP MET THR TYR THR GLY GLY VAL MET THR SER CYS VAL SEQRES 13 A 215 SER GLU GLN LEU ASP HIS GLY VAL LEU LEU VAL GLY TYR SEQRES 14 A 215 ASN ASP GLY ALA ALA VAL PRO TYR TRP ILE ILE LYS ASN SEQRES 15 A 215 SER TRP THR THR GLN TRP GLY GLU GLU GLY TYR ILE ARG SEQRES 16 A 215 ILE ALA LYS GLY SER ASN GLN CYS LEU VAL LYS GLU GLU SEQRES 17 A 215 ALA SER SER ALA VAL VAL GLY HET UNN A 433 68 SSBOND 1 CYS A 22 CYS A 63 SSBOND 2 CYS A 56 CYS A 101 SSBOND 3 CYS A 155 CYS A 203 ATOM 1 N ALA A 1 5.160 -19.997 7.743 1.00 10.00 N ATOM 2 CA ALA A 1 5.787 -18.783 8.323 1.00 9.55 C ATOM 3 C ALA A 1 4.922 -18.370 9.508 1.00 8.36 C ATOM 4 O ALA A 1 3.738 -18.675 9.545 1.00 7.98 O ATOM 5 CB ALA A 1 5.841 -17.629 7.287 1.00 10.35 C ATOM 6 HA ALA A 1 6.813 -18.994 8.625 1.00 0.00 H ATOM 7 HB1 ALA A 1 6.427 -17.945 6.424 1.00 0.00 H ATOM 8 HB2 ALA A 1 4.828 -17.380 6.969 1.00 0.00 H ATOM 9 HB3 ALA A 1 6.306 -16.755 7.743 1.00 0.00 H ATOM 10 HN3 ALA A 1 4.192 -19.773 7.436 1.00 0.00 H ATOM 11 HN2 ALA A 1 5.132 -20.748 8.462 1.00 0.00 H ATOM 12 HN1 ALA A 1 5.719 -20.318 6.926 1.00 0.00 H ATOM 13 N PRO A 2 5.498 -17.629 10.464 1.00 5.96 N ATOM 14 CA PRO A 2 4.697 -17.125 11.584 1.00 4.83 C ATOM 15 C PRO A 2 3.573 -16.267 11.078 1.00 3.27 C ATOM 16 O PRO A 2 3.684 -15.704 9.966 1.00 3.55 O ATOM 17 CB PRO A 2 5.687 -16.312 12.395 1.00 4.68 C ATOM 18 CG PRO A 2 7.035 -16.783 11.965 1.00 7.63 C ATOM 19 CD PRO A 2 6.879 -17.140 10.529 1.00 6.74 C ATOM 20 HA PRO A 2 4.230 -17.916 12.170 1.00 0.00 H ATOM 21 HD3 PRO A 2 7.018 -16.268 9.890 1.00 0.00 H ATOM 22 HD2 PRO A 2 7.585 -17.918 10.238 1.00 0.00 H ATOM 23 HG3 PRO A 2 7.340 -17.654 12.545 1.00 0.00 H ATOM 24 HG2 PRO A 2 7.774 -15.991 12.085 1.00 0.00 H ATOM 25 HB2 PRO A 2 5.570 -15.249 12.185 1.00 0.00 H ATOM 26 HB3 PRO A 2 5.543 -16.489 13.461 1.00 0.00 H ATOM 27 N ALA A 3 2.484 -16.205 11.854 1.00 3.18 N ATOM 28 CA ALA A 3 1.370 -15.338 11.534 1.00 3.04 C ATOM 29 C ALA A 3 1.769 -13.858 11.488 1.00 2.60 C ATOM 30 O ALA A 3 1.179 -13.076 10.768 1.00 2.89 O ATOM 31 CB ALA A 3 0.184 -15.570 12.548 1.00 2.58 C ATOM 32 HA ALA A 3 1.035 -15.602 10.531 1.00 0.00 H ATOM 33 HB1 ALA A 3 -0.145 -16.608 12.490 1.00 0.00 H ATOM 34 HB2 ALA A 3 0.525 -15.352 13.560 1.00 0.00 H ATOM 35 HB3 ALA A 3 -0.645 -14.910 12.293 1.00 0.00 H ATOM 36 H ALA A 3 2.437 -16.795 12.709 1.00 0.00 H ATOM 37 N ALA A 4 2.734 -13.465 12.319 1.00 3.52 N ATOM 38 CA ALA A 4 3.173 -12.101 12.464 1.00 2.67 C ATOM 39 C ALA A 4 4.646 -12.055 12.943 1.00 2.68 C ATOM 40 O ALA A 4 5.089 -12.918 13.706 1.00 2.00 O ATOM 41 CB ALA A 4 2.193 -11.357 13.434 1.00 2.00 C ATOM 42 HA ALA A 4 3.149 -11.587 11.503 1.00 0.00 H ATOM 43 HB1 ALA A 4 1.186 -11.380 13.018 1.00 0.00 H ATOM 44 HB2 ALA A 4 2.198 -11.853 14.405 1.00 0.00 H ATOM 45 HB3 ALA A 4 2.516 -10.323 13.551 1.00 0.00 H ATOM 46 H ALA A 4 3.200 -14.190 12.900 1.00 0.00 H ATOM 47 N VAL A 5 5.389 -11.059 12.448 1.00 3.53 N ATOM 48 CA VAL A 5 6.775 -10.801 12.802 1.00 3.83 C ATOM 49 C VAL A 5 6.975 -9.307 12.862 1.00 3.91 C ATOM 50 O VAL A 5 6.393 -8.551 12.057 1.00 3.19 O ATOM 51 CB VAL A 5 7.746 -11.426 11.763 1.00 5.15 C ATOM 52 CG1 VAL A 5 9.189 -11.107 12.117 1.00 9.76 C ATOM 53 CG2 VAL A 5 7.561 -12.953 11.665 1.00 5.17 C ATOM 54 HA VAL A 5 6.992 -11.256 13.769 1.00 0.00 H ATOM 55 HB VAL A 5 7.509 -10.988 10.793 1.00 0.00 H ATOM 56 HG11 VAL A 5 9.329 -10.026 12.126 1.00 0.00 H ATOM 57 HG12 VAL A 5 9.418 -11.512 13.103 1.00 0.00 H ATOM 58 HG13 VAL A 5 9.851 -11.555 11.376 1.00 0.00 H ATOM 59 HG21 VAL A 5 7.758 -13.405 12.637 1.00 0.00 H ATOM 60 HG22 VAL A 5 6.538 -13.175 11.360 1.00 0.00 H ATOM 61 HG23 VAL A 5 8.257 -13.355 10.929 1.00 0.00 H ATOM 62 H VAL A 5 4.942 -10.422 11.758 1.00 0.00 H ATOM 63 N ASP A 6 7.787 -8.862 13.786 1.00 3.05 N ATOM 64 CA ASP A 6 8.116 -7.437 13.853 1.00 2.14 C ATOM 65 C ASP A 6 9.540 -7.341 14.392 1.00 2.31 C ATOM 66 O ASP A 6 9.795 -7.492 15.626 1.00 2.07 O ATOM 67 CB ASP A 6 7.144 -6.681 14.789 1.00 3.03 C ATOM 68 CG ASP A 6 7.457 -5.216 14.925 1.00 2.54 C ATOM 69 OD1 ASP A 6 6.611 -4.487 15.484 1.00 3.25 O ATOM 70 OD2 ASP A 6 8.514 -4.749 14.427 1.00 2.69 O ATOM 71 HA ASP A 6 8.029 -6.981 12.867 1.00 0.00 H ATOM 72 HB2 ASP A 6 6.134 -6.783 14.392 1.00 0.00 H ATOM 73 HB3 ASP A 6 7.192 -7.137 15.778 1.00 0.00 H ATOM 74 H ASP A 6 8.200 -9.522 14.475 1.00 0.00 H ATOM 75 N TRP A 7 10.472 -7.149 13.464 1.00 3.26 N ATOM 76 CA TRP A 7 11.899 -7.115 13.843 1.00 2.68 C ATOM 77 C TRP A 7 12.246 -5.957 14.783 1.00 4.28 C ATOM 78 O TRP A 7 13.265 -6.035 15.520 1.00 4.35 O ATOM 79 CB TRP A 7 12.798 -7.152 12.591 1.00 4.18 C ATOM 80 CG TRP A 7 12.810 -8.513 12.010 1.00 2.00 C ATOM 81 CD1 TRP A 7 12.175 -8.955 10.862 1.00 2.91 C ATOM 82 CD2 TRP A 7 13.498 -9.651 12.542 1.00 2.00 C ATOM 83 NE1 TRP A 7 12.424 -10.279 10.693 1.00 2.00 N ATOM 84 CE2 TRP A 7 13.255 -10.722 11.695 1.00 2.00 C ATOM 85 CE3 TRP A 7 14.332 -9.853 13.664 1.00 2.00 C ATOM 86 CZ2 TRP A 7 13.770 -12.000 11.940 1.00 2.80 C ATOM 87 CZ3 TRP A 7 14.861 -11.090 13.888 1.00 3.26 C ATOM 88 CH2 TRP A 7 14.548 -12.188 13.037 1.00 6.29 C ATOM 89 HA TRP A 7 12.098 -8.017 14.422 1.00 0.00 H ATOM 90 HB2 TRP A 7 12.416 -6.448 11.852 1.00 0.00 H ATOM 91 HB3 TRP A 7 13.814 -6.870 12.868 1.00 0.00 H ATOM 92 HE1 TRP A 7 12.045 -10.868 9.924 1.00 0.00 H ATOM 93 HD1 TRP A 7 11.570 -8.337 10.198 1.00 0.00 H ATOM 94 HZ2 TRP A 7 13.551 -12.827 11.265 1.00 0.00 H ATOM 95 HH2 TRP A 7 14.934 -13.181 13.267 1.00 0.00 H ATOM 96 HZ3 TRP A 7 15.534 -11.241 14.732 1.00 0.00 H ATOM 97 HE3 TRP A 7 14.550 -9.029 14.343 1.00 0.00 H ATOM 98 H TRP A 7 10.196 -7.023 12.469 1.00 0.00 H ATOM 99 N ARG A 8 11.415 -4.923 14.807 1.00 4.03 N ATOM 100 CA ARG A 8 11.691 -3.810 15.742 1.00 5.50 C ATOM 101 C ARG A 8 11.668 -4.315 17.199 1.00 5.44 C ATOM 102 O ARG A 8 12.433 -3.880 18.079 1.00 4.38 O ATOM 103 CB ARG A 8 10.661 -2.726 15.588 1.00 5.36 C ATOM 104 CG ARG A 8 10.662 -2.065 14.256 1.00 5.03 C ATOM 105 CD ARG A 8 9.506 -1.120 14.121 1.00 8.77 C ATOM 106 NE ARG A 8 8.249 -1.795 14.308 1.00 5.15 N ATOM 107 CZ ARG A 8 7.059 -1.203 14.279 1.00 6.65 C ATOM 108 NH1 ARG A 8 6.965 0.087 14.036 1.00 8.86 N ATOM 109 NH2 ARG A 8 5.981 -1.891 14.523 1.00 4.95 N ATOM 110 HA ARG A 8 12.678 -3.411 15.508 1.00 0.00 H ATOM 111 HB2 ARG A 8 9.677 -3.165 15.751 1.00 0.00 H ATOM 112 HB3 ARG A 8 10.849 -1.966 16.347 1.00 0.00 H ATOM 113 HG2 ARG A 8 11.592 -1.510 14.135 1.00 0.00 H ATOM 114 HG3 ARG A 8 10.591 -2.827 13.480 1.00 0.00 H ATOM 115 HD2 ARG A 8 9.525 -0.676 13.126 1.00 0.00 H ATOM 116 HD3 ARG A 8 9.601 -0.334 14.870 1.00 0.00 H ATOM 117 HE ARG A 8 8.273 -2.821 14.478 1.00 0.00 H ATOM 118 HH12 ARG A 8 6.032 0.545 14.014 1.00 0.00 H ATOM 119 HH11 ARG A 8 7.824 0.648 13.866 1.00 0.00 H ATOM 120 HH22 ARG A 8 5.051 -1.426 14.500 1.00 0.00 H ATOM 121 HH21 ARG A 8 6.050 -2.906 14.741 1.00 0.00 H ATOM 122 H ARG A 8 10.585 -4.895 14.180 1.00 0.00 H ATOM 123 N ALA A 9 10.765 -5.246 17.477 1.00 6.09 N ATOM 124 CA ALA A 9 10.585 -5.819 18.818 1.00 5.48 C ATOM 125 C ALA A 9 11.669 -6.760 19.279 1.00 6.87 C ATOM 126 O ALA A 9 11.698 -7.175 20.425 1.00 8.84 O ATOM 127 CB ALA A 9 9.150 -6.570 18.887 1.00 6.21 C ATOM 128 HA ALA A 9 10.638 -4.973 19.503 1.00 0.00 H ATOM 129 HB1 ALA A 9 8.355 -5.852 18.685 1.00 0.00 H ATOM 130 HB2 ALA A 9 9.121 -7.365 18.142 1.00 0.00 H ATOM 131 HB3 ALA A 9 9.012 -6.997 19.880 1.00 0.00 H ATOM 132 H ALA A 9 10.154 -5.587 16.708 1.00 0.00 H ATOM 133 N ARG A 10 12.564 -7.138 18.368 1.00 7.75 N ATOM 134 CA ARG A 10 13.754 -7.886 18.677 1.00 7.73 C ATOM 135 C ARG A 10 14.931 -6.994 18.891 1.00 7.39 C ATOM 136 O ARG A 10 15.976 -7.479 19.282 1.00 7.86 O ATOM 137 CB ARG A 10 14.060 -8.850 17.534 1.00 9.62 C ATOM 138 CG ARG A 10 12.849 -9.614 17.078 1.00 13.44 C ATOM 139 CD ARG A 10 12.555 -10.804 18.019 1.00 16.89 C ATOM 140 NE ARG A 10 13.131 -12.057 17.450 1.00 21.60 N ATOM 141 CZ ARG A 10 12.608 -12.752 16.418 1.00 23.72 C ATOM 142 NH1 ARG A 10 11.465 -12.384 15.790 1.00 24.34 N ATOM 143 NH2 ARG A 10 13.219 -13.848 15.994 1.00 27.97 N ATOM 144 HA ARG A 10 13.571 -8.434 19.601 1.00 0.00 H ATOM 145 HB2 ARG A 10 14.450 -8.279 16.691 1.00 0.00 H ATOM 146 HB3 ARG A 10 14.815 -9.561 17.870 1.00 0.00 H ATOM 147 HG2 ARG A 10 11.988 -8.945 17.070 1.00 0.00 H ATOM 148 HG3 ARG A 10 13.024 -9.991 16.071 1.00 0.00 H ATOM 149 HD2 ARG A 10 11.477 -10.920 18.130 1.00 0.00 H ATOM 150 HD3 ARG A 10 13.001 -10.612 18.995 1.00 0.00 H ATOM 151 HE ARG A 10 14.003 -12.423 17.882 1.00 0.00 H ATOM 152 HH12 ARG A 10 11.100 -12.952 14.999 1.00 0.00 H ATOM 153 HH11 ARG A 10 10.952 -11.534 16.099 1.00 0.00 H ATOM 154 HH22 ARG A 10 12.823 -14.390 15.199 1.00 0.00 H ATOM 155 HH21 ARG A 10 14.095 -14.167 16.456 1.00 0.00 H ATOM 156 H ARG A 10 12.393 -6.878 17.376 1.00 0.00 H ATOM 157 N GLY A 11 14.751 -5.692 18.671 1.00 6.78 N ATOM 158 CA GLY A 11 15.843 -4.729 18.822 1.00 6.28 C ATOM 159 C GLY A 11 16.728 -4.649 17.599 1.00 4.61 C ATOM 160 O GLY A 11 17.868 -4.211 17.700 1.00 4.78 O ATOM 161 HA3 GLY A 11 16.453 -5.025 19.675 1.00 0.00 H ATOM 162 HA2 GLY A 11 15.415 -3.744 19.008 1.00 0.00 H ATOM 163 H GLY A 11 13.811 -5.352 18.385 1.00 0.00 H ATOM 164 N ALA A 12 16.214 -5.036 16.436 1.00 4.19 N ATOM 165 CA ALA A 12 17.043 -5.184 15.239 1.00 3.62 C ATOM 166 C ALA A 12 17.035 -3.988 14.304 1.00 3.43 C ATOM 167 O ALA A 12 17.715 -4.057 13.284 1.00 3.78 O ATOM 168 CB ALA A 12 16.593 -6.441 14.421 1.00 3.08 C ATOM 169 HA ALA A 12 18.060 -5.286 15.618 1.00 0.00 H ATOM 170 HB1 ALA A 12 16.697 -7.332 15.040 1.00 0.00 H ATOM 171 HB2 ALA A 12 15.551 -6.324 14.122 1.00 0.00 H ATOM 172 HB3 ALA A 12 17.218 -6.538 13.534 1.00 0.00 H ATOM 173 H ALA A 12 15.196 -5.239 16.375 1.00 0.00 H ATOM 174 N VAL A 13 16.263 -2.925 14.599 1.00 2.63 N ATOM 175 CA VAL A 13 16.088 -1.815 13.656 1.00 3.12 C ATOM 176 C VAL A 13 16.539 -0.484 14.297 1.00 2.75 C ATOM 177 O VAL A 13 16.176 -0.149 15.434 1.00 3.88 O ATOM 178 CB VAL A 13 14.632 -1.693 13.205 1.00 3.25 C ATOM 179 CG1 VAL A 13 14.493 -0.711 12.024 1.00 2.00 C ATOM 180 CG2 VAL A 13 14.027 -3.109 12.860 1.00 2.40 C ATOM 181 HA VAL A 13 16.706 -2.026 12.784 1.00 0.00 H ATOM 182 HB VAL A 13 14.056 -1.283 14.035 1.00 0.00 H ATOM 183 HG11 VAL A 13 14.846 0.274 12.329 1.00 0.00 H ATOM 184 HG12 VAL A 13 15.089 -1.068 11.184 1.00 0.00 H ATOM 185 HG13 VAL A 13 13.446 -0.647 11.728 1.00 0.00 H ATOM 186 HG21 VAL A 13 14.606 -3.564 12.056 1.00 0.00 H ATOM 187 HG22 VAL A 13 14.068 -3.745 13.744 1.00 0.00 H ATOM 188 HG23 VAL A 13 12.991 -2.992 12.542 1.00 0.00 H ATOM 189 H VAL A 13 15.779 -2.890 15.519 1.00 0.00 H ATOM 190 N THR A 14 17.364 0.271 13.591 1.00 3.13 N ATOM 191 CA THR A 14 17.817 1.562 14.124 1.00 2.63 C ATOM 192 C THR A 14 16.678 2.566 14.056 1.00 2.76 C ATOM 193 O THR A 14 15.664 2.309 13.411 1.00 3.28 O ATOM 194 CB THR A 14 18.966 2.136 13.322 1.00 2.33 C ATOM 195 OG1 THR A 14 18.529 2.410 11.998 1.00 2.16 O ATOM 196 CG2 THR A 14 20.195 1.163 13.329 1.00 3.79 C ATOM 197 HA THR A 14 18.144 1.387 15.149 1.00 0.00 H ATOM 198 HB THR A 14 19.292 3.069 13.782 1.00 0.00 H ATOM 199 HG1 THR A 14 18.217 1.571 11.575 1.00 0.00 H ATOM 200 HG23 THR A 14 20.502 0.975 14.358 1.00 0.00 H ATOM 201 HG21 THR A 14 19.915 0.222 12.855 1.00 0.00 H ATOM 202 HG22 THR A 14 21.019 1.617 12.779 1.00 0.00 H ATOM 203 H THR A 14 17.692 -0.050 12.658 1.00 0.00 H ATOM 204 N ALA A 15 16.877 3.707 14.697 1.00 3.51 N ATOM 205 CA ALA A 15 15.911 4.793 14.703 1.00 2.94 C ATOM 206 C ALA A 15 15.610 5.293 13.287 1.00 2.82 C ATOM 207 O ALA A 15 16.438 5.170 12.393 1.00 2.75 O ATOM 208 CB ALA A 15 16.390 5.910 15.595 1.00 2.67 C ATOM 209 HA ALA A 15 14.973 4.411 15.105 1.00 0.00 H ATOM 210 HB1 ALA A 15 16.513 5.535 16.611 1.00 0.00 H ATOM 211 HB2 ALA A 15 17.345 6.283 15.226 1.00 0.00 H ATOM 212 HB3 ALA A 15 15.657 6.717 15.590 1.00 0.00 H ATOM 213 H ALA A 15 17.767 3.832 15.221 1.00 0.00 H ATOM 214 N VAL A 16 14.417 5.833 13.113 1.00 2.14 N ATOM 215 CA VAL A 16 13.994 6.416 11.830 1.00 2.56 C ATOM 216 C VAL A 16 14.859 7.619 11.518 1.00 2.00 C ATOM 217 O VAL A 16 15.103 8.461 12.395 1.00 3.99 O ATOM 218 CB VAL A 16 12.531 6.790 11.896 1.00 3.03 C ATOM 219 CG1 VAL A 16 12.103 7.600 10.662 1.00 2.00 C ATOM 220 CG2 VAL A 16 11.700 5.466 12.019 1.00 4.51 C ATOM 221 HA VAL A 16 14.117 5.687 11.029 1.00 0.00 H ATOM 222 HB VAL A 16 12.351 7.427 12.762 1.00 0.00 H ATOM 223 HG11 VAL A 16 12.692 8.515 10.607 1.00 0.00 H ATOM 224 HG12 VAL A 16 12.268 7.006 9.763 1.00 0.00 H ATOM 225 HG13 VAL A 16 11.046 7.852 10.743 1.00 0.00 H ATOM 226 HG21 VAL A 16 11.890 4.837 11.149 1.00 0.00 H ATOM 227 HG22 VAL A 16 11.996 4.936 12.924 1.00 0.00 H ATOM 228 HG23 VAL A 16 10.638 5.708 12.069 1.00 0.00 H ATOM 229 H VAL A 16 13.752 5.847 13.913 1.00 0.00 H ATOM 230 N LYS A 17 15.322 7.716 10.275 1.00 2.92 N ATOM 231 CA LYS A 17 16.205 8.818 9.824 1.00 3.00 C ATOM 232 C LYS A 17 15.426 9.815 8.948 1.00 3.64 C ATOM 233 O LYS A 17 14.212 9.673 8.702 1.00 4.26 O ATOM 234 CB LYS A 17 17.395 8.230 9.059 1.00 2.83 C ATOM 235 CG LYS A 17 18.201 7.231 9.893 1.00 2.95 C ATOM 236 CD LYS A 17 19.626 6.926 9.350 1.00 2.92 C ATOM 237 CE LYS A 17 20.278 5.739 10.032 1.00 5.78 C ATOM 238 NZ LYS A 17 21.617 5.375 9.385 1.00 3.28 N ATOM 239 HA LYS A 17 16.575 9.363 10.693 1.00 0.00 H ATOM 240 HB2 LYS A 17 17.021 7.721 8.171 1.00 0.00 H ATOM 241 HB3 LYS A 17 18.054 9.045 8.759 1.00 0.00 H ATOM 242 HG2 LYS A 17 18.301 7.634 10.901 1.00 0.00 H ATOM 243 HG3 LYS A 17 17.645 6.294 9.931 1.00 0.00 H ATOM 244 HD2 LYS A 17 19.554 6.717 8.283 1.00 0.00 H ATOM 245 HD3 LYS A 17 20.253 7.804 9.506 1.00 0.00 H ATOM 246 HE2 LYS A 17 19.609 4.881 9.964 1.00 0.00 H ATOM 247 HE3 LYS A 17 20.448 5.984 11.081 1.00 0.00 H ATOM 248 HZ1 LYS A 17 21.463 5.133 8.385 1.00 0.00 H ATOM 249 HZ2 LYS A 17 22.265 6.186 9.451 1.00 0.00 H ATOM 250 HZ3 LYS A 17 22.030 4.559 9.881 1.00 0.00 H ATOM 251 H LYS A 17 15.052 6.984 9.587 1.00 0.00 H ATOM 252 N ASP A 18 16.157 10.796 8.440 1.00 3.56 N ATOM 253 CA ASP A 18 15.579 11.914 7.677 1.00 3.38 C ATOM 254 C ASP A 18 16.454 12.159 6.464 1.00 3.29 C ATOM 255 O ASP A 18 17.523 12.756 6.582 1.00 3.99 O ATOM 256 CB ASP A 18 15.496 13.180 8.517 1.00 4.62 C ATOM 257 CG ASP A 18 14.825 14.355 7.786 1.00 3.46 C ATOM 258 OD1 ASP A 18 14.782 15.438 8.408 1.00 5.73 O ATOM 259 OD2 ASP A 18 14.267 14.155 6.671 1.00 4.61 O ATOM 260 HA ASP A 18 14.564 11.654 7.377 1.00 0.00 H ATOM 261 HB2 ASP A 18 14.923 12.960 9.418 1.00 0.00 H ATOM 262 HB3 ASP A 18 16.507 13.478 8.795 1.00 0.00 H ATOM 263 H ASP A 18 17.186 10.775 8.587 1.00 0.00 H ATOM 264 N GLN A 19 15.965 11.775 5.296 1.00 3.47 N ATOM 265 CA GLN A 19 16.677 12.040 4.051 1.00 3.36 C ATOM 266 C GLN A 19 16.682 13.506 3.654 1.00 3.51 C ATOM 267 O GLN A 19 17.394 13.900 2.754 1.00 4.28 O ATOM 268 CB GLN A 19 16.134 11.184 2.924 1.00 5.66 C ATOM 269 CG GLN A 19 14.786 11.574 2.446 1.00 6.32 C ATOM 270 CD GLN A 19 14.275 10.492 1.408 1.00 7.79 C ATOM 271 OE1 GLN A 19 13.812 9.400 1.739 1.00 3.45 O ATOM 272 NE2 GLN A 19 14.403 10.844 0.142 1.00 5.55 N ATOM 273 HA GLN A 19 17.716 11.770 4.237 1.00 0.00 H ATOM 274 HB2 GLN A 19 16.825 11.250 2.084 1.00 0.00 H ATOM 275 HB3 GLN A 19 16.086 10.153 3.273 1.00 0.00 H ATOM 276 HG2 GLN A 19 14.099 11.624 3.290 1.00 0.00 H ATOM 277 HG3 GLN A 19 14.837 12.549 1.962 1.00 0.00 H ATOM 278 HE22 GLN A 19 14.798 11.775 -0.102 1.00 0.00 H ATOM 279 HE21 GLN A 19 14.109 10.191 -0.612 1.00 0.00 H ATOM 280 H GLN A 19 15.054 11.274 5.265 1.00 0.00 H ATOM 281 N GLY A 20 15.846 14.313 4.289 1.00 2.80 N ATOM 282 CA GLY A 20 15.688 15.713 3.923 1.00 3.90 C ATOM 283 C GLY A 20 15.172 15.872 2.493 1.00 3.85 C ATOM 284 O GLY A 20 14.359 15.069 2.012 1.00 3.45 O ATOM 285 HA3 GLY A 20 16.654 16.211 4.007 1.00 0.00 H ATOM 286 HA2 GLY A 20 14.980 16.179 4.608 1.00 0.00 H ATOM 287 H GLY A 20 15.283 13.933 5.077 1.00 0.00 H ATOM 288 N GLN A 21 15.696 16.872 1.791 1.00 3.84 N ATOM 289 CA GLN A 21 15.219 17.282 0.480 1.00 4.78 C ATOM 290 C GLN A 21 16.012 16.548 -0.657 1.00 6.36 C ATOM 291 O GLN A 21 15.985 16.940 -1.793 1.00 9.58 O ATOM 292 CB GLN A 21 15.322 18.797 0.337 1.00 4.81 C ATOM 293 CG GLN A 21 14.271 19.550 1.169 1.00 9.35 C ATOM 294 CD GLN A 21 14.386 21.059 1.057 1.00 8.07 C ATOM 295 OE1 GLN A 21 15.482 21.605 0.954 1.00 8.15 O ATOM 296 NE2 GLN A 21 13.246 21.742 1.087 1.00 8.41 N ATOM 297 HA GLN A 21 14.171 16.999 0.383 1.00 0.00 H ATOM 298 HB2 GLN A 21 16.314 19.111 0.663 1.00 0.00 H ATOM 299 HB3 GLN A 21 15.187 19.057 -0.713 1.00 0.00 H ATOM 300 HG2 GLN A 21 13.280 19.252 0.827 1.00 0.00 H ATOM 301 HG3 GLN A 21 14.392 19.270 2.215 1.00 0.00 H ATOM 302 HE22 GLN A 21 12.340 21.238 1.175 1.00 0.00 H ATOM 303 HE21 GLN A 21 13.260 22.780 1.022 1.00 0.00 H ATOM 304 H GLN A 21 16.496 17.393 2.205 1.00 0.00 H ATOM 305 N CYS A 22 16.762 15.529 -0.310 1.00 6.76 N ATOM 306 CA CYS A 22 17.564 14.753 -1.276 1.00 4.62 C ATOM 307 C CYS A 22 16.805 13.467 -1.666 1.00 4.06 C ATOM 308 O CYS A 22 16.232 12.826 -0.815 1.00 5.54 O ATOM 309 CB CYS A 22 18.854 14.343 -0.594 1.00 4.74 C ATOM 310 SG CYS A 22 19.995 13.397 -1.434 1.00 3.37 S ATOM 311 HA CYS A 22 17.756 15.356 -2.164 1.00 0.00 H ATOM 312 HB2 CYS A 22 18.575 13.782 0.298 1.00 0.00 H ATOM 313 HB3 CYS A 22 19.361 15.262 -0.300 1.00 0.00 H ATOM 314 H CYS A 22 16.793 15.255 0.693 1.00 0.00 H ATOM 315 N GLY A 23 16.803 13.084 -2.940 1.00 4.04 N ATOM 316 CA GLY A 23 16.262 11.797 -3.395 1.00 2.25 C ATOM 317 C GLY A 23 17.124 10.587 -3.139 1.00 2.58 C ATOM 318 O GLY A 23 17.335 9.776 -4.018 1.00 3.27 O ATOM 319 HA3 GLY A 23 16.096 11.867 -4.470 1.00 0.00 H ATOM 320 HA2 GLY A 23 15.308 11.639 -2.891 1.00 0.00 H ATOM 321 H GLY A 23 17.205 13.729 -3.650 1.00 0.00 H ATOM 322 N SER A 24 17.610 10.481 -1.907 1.00 2.02 N ATOM 323 CA SER A 24 18.554 9.473 -1.488 1.00 2.95 C ATOM 324 C SER A 24 17.859 8.307 -0.783 1.00 3.18 C ATOM 325 O SER A 24 18.498 7.513 -0.094 1.00 2.91 O ATOM 326 CB SER A 24 19.528 10.105 -0.505 1.00 2.84 C ATOM 327 OG SER A 24 18.797 10.861 0.471 1.00 3.73 O ATOM 328 HA SER A 24 19.062 9.092 -2.374 1.00 0.00 H ATOM 329 HB2 SER A 24 20.209 10.766 -1.041 1.00 0.00 H ATOM 330 HB3 SER A 24 20.100 9.323 -0.006 1.00 0.00 H ATOM 331 HG SER A 24 19.431 11.272 1.111 1.00 0.00 H ATOM 332 H SER A 24 17.289 11.170 -1.197 1.00 0.00 H ATOM 333 N CYS A 25 16.553 8.149 -0.970 1.00 3.33 N ATOM 334 CA CYS A 25 15.787 7.043 -0.380 1.00 2.00 C ATOM 335 C CYS A 25 16.404 5.681 -0.540 1.00 2.18 C ATOM 336 O CYS A 25 16.412 4.873 0.383 1.00 2.99 O ATOM 337 CB CYS A 25 14.379 7.011 -0.986 1.00 2.57 C ATOM 338 SG CYS A 25 14.331 6.797 -2.791 1.00 2.00 S ATOM 339 HA CYS A 25 15.771 7.249 0.690 1.00 0.00 H ATOM 340 HB2 CYS A 25 13.883 7.951 -0.742 1.00 0.00 H ATOM 341 HB3 CYS A 25 13.833 6.185 -0.532 1.00 0.00 H ATOM 342 HG CYS A 25 13.018 6.784 -3.216 1.00 0.00 H ATOM 343 H CYS A 25 16.050 8.841 -1.562 1.00 0.00 H ATOM 344 N TRP A 26 16.899 5.426 -1.736 1.00 2.70 N ATOM 345 CA TRP A 26 17.581 4.198 -2.082 1.00 2.04 C ATOM 346 C TRP A 26 18.728 3.849 -1.125 1.00 2.57 C ATOM 347 O TRP A 26 18.944 2.681 -0.806 1.00 2.90 O ATOM 348 CB TRP A 26 18.075 4.258 -3.530 1.00 2.83 C ATOM 349 CG TRP A 26 19.091 5.378 -3.804 1.00 2.00 C ATOM 350 CD1 TRP A 26 18.815 6.705 -4.121 1.00 2.25 C ATOM 351 CD2 TRP A 26 20.522 5.295 -3.705 1.00 3.24 C ATOM 352 NE1 TRP A 26 19.984 7.435 -4.221 1.00 2.00 N ATOM 353 CE2 TRP A 26 21.041 6.600 -3.978 1.00 2.00 C ATOM 354 CE3 TRP A 26 21.426 4.261 -3.407 1.00 2.82 C ATOM 355 CZ2 TRP A 26 22.394 6.874 -4.001 1.00 3.86 C ATOM 356 CZ3 TRP A 26 22.793 4.548 -3.405 1.00 5.49 C ATOM 357 CH2 TRP A 26 23.259 5.853 -3.708 1.00 2.00 C ATOM 358 HA TRP A 26 16.852 3.394 -1.981 1.00 0.00 H ATOM 359 HB2 TRP A 26 18.544 3.304 -3.771 1.00 0.00 H ATOM 360 HB3 TRP A 26 17.213 4.412 -4.179 1.00 0.00 H ATOM 361 HE1 TRP A 26 20.050 8.449 -4.444 1.00 0.00 H ATOM 362 HD1 TRP A 26 17.815 7.112 -4.270 1.00 0.00 H ATOM 363 HZ2 TRP A 26 22.762 7.871 -4.244 1.00 0.00 H ATOM 364 HH2 TRP A 26 24.331 6.048 -3.708 1.00 0.00 H ATOM 365 HZ3 TRP A 26 23.509 3.761 -3.168 1.00 0.00 H ATOM 366 HE3 TRP A 26 21.068 3.256 -3.182 1.00 0.00 H ATOM 367 H TRP A 26 16.793 6.151 -2.474 1.00 0.00 H ATOM 368 N ALA A 27 19.449 4.877 -0.680 1.00 2.00 N ATOM 369 CA ALA A 27 20.597 4.690 0.218 1.00 2.04 C ATOM 370 C ALA A 27 20.103 4.365 1.625 1.00 2.27 C ATOM 371 O ALA A 27 20.655 3.519 2.315 1.00 2.83 O ATOM 372 CB ALA A 27 21.486 5.932 0.194 1.00 2.00 C ATOM 373 HA ALA A 27 21.201 3.849 -0.123 1.00 0.00 H ATOM 374 HB1 ALA A 27 21.847 6.099 -0.821 1.00 0.00 H ATOM 375 HB2 ALA A 27 20.909 6.796 0.523 1.00 0.00 H ATOM 376 HB3 ALA A 27 22.334 5.783 0.863 1.00 0.00 H ATOM 377 H ALA A 27 19.192 5.840 -0.977 1.00 0.00 H ATOM 378 N PHE A 28 19.021 5.021 2.043 1.00 2.50 N ATOM 379 CA PHE A 28 18.414 4.717 3.357 1.00 2.00 C ATOM 380 C PHE A 28 17.840 3.317 3.375 1.00 2.28 C ATOM 381 O PHE A 28 17.978 2.593 4.382 1.00 3.12 O ATOM 382 CB PHE A 28 17.334 5.766 3.758 1.00 2.12 C ATOM 383 CG PHE A 28 17.915 7.087 4.123 1.00 3.64 C ATOM 384 CD1 PHE A 28 18.280 8.010 3.135 1.00 2.30 C ATOM 385 CD2 PHE A 28 18.236 7.355 5.454 1.00 2.17 C ATOM 386 CE1 PHE A 28 18.949 9.202 3.479 1.00 2.00 C ATOM 387 CE2 PHE A 28 18.877 8.534 5.823 1.00 2.00 C ATOM 388 CZ PHE A 28 19.234 9.448 4.839 1.00 2.00 C ATOM 389 HA PHE A 28 19.209 4.773 4.101 1.00 0.00 H ATOM 390 HB2 PHE A 28 16.655 5.905 2.917 1.00 0.00 H ATOM 391 HB3 PHE A 28 16.777 5.383 4.613 1.00 0.00 H ATOM 392 HD2 PHE A 28 17.979 6.625 6.222 1.00 0.00 H ATOM 393 HE2 PHE A 28 19.096 8.738 6.871 1.00 0.00 H ATOM 394 HZ PHE A 28 19.742 10.370 5.122 1.00 0.00 H ATOM 395 HE1 PHE A 28 19.240 9.919 2.711 1.00 0.00 H ATOM 396 HD1 PHE A 28 18.045 7.805 2.091 1.00 0.00 H ATOM 397 H PHE A 28 18.599 5.755 1.439 1.00 0.00 H ATOM 398 N SER A 29 17.199 2.912 2.284 1.00 2.45 N ATOM 399 CA SER A 29 16.714 1.534 2.141 1.00 2.00 C ATOM 400 C SER A 29 17.814 0.514 2.245 1.00 2.00 C ATOM 401 O SER A 29 17.745 -0.453 3.047 1.00 3.98 O ATOM 402 CB SER A 29 15.978 1.397 0.782 1.00 2.78 C ATOM 403 OG SER A 29 15.493 0.088 0.572 1.00 2.42 O ATOM 404 HA SER A 29 16.031 1.334 2.966 1.00 0.00 H ATOM 405 HB2 SER A 29 16.671 1.649 -0.021 1.00 0.00 H ATOM 406 HB3 SER A 29 15.137 2.091 0.765 1.00 0.00 H ATOM 407 HG SER A 29 14.857 -0.147 1.293 1.00 0.00 H ATOM 408 H SER A 29 17.037 3.589 1.511 1.00 0.00 H ATOM 409 N ALA A 30 18.875 0.723 1.478 1.00 2.00 N ATOM 410 CA ALA A 30 20.022 -0.209 1.512 1.00 2.00 C ATOM 411 C ALA A 30 20.741 -0.271 2.861 1.00 2.00 C ATOM 412 O ALA A 30 21.002 -1.364 3.388 1.00 2.00 O ATOM 413 CB ALA A 30 21.033 0.170 0.364 1.00 2.00 C ATOM 414 HA ALA A 30 19.618 -1.209 1.355 1.00 0.00 H ATOM 415 HB1 ALA A 30 20.530 0.097 -0.600 1.00 0.00 H ATOM 416 HB2 ALA A 30 21.386 1.190 0.514 1.00 0.00 H ATOM 417 HB3 ALA A 30 21.880 -0.516 0.387 1.00 0.00 H ATOM 418 H ALA A 30 18.901 1.549 0.847 1.00 0.00 H ATOM 419 N ILE A 31 21.034 0.907 3.401 1.00 2.14 N ATOM 420 CA ILE A 31 21.737 1.012 4.673 1.00 2.00 C ATOM 421 C ILE A 31 20.920 0.476 5.831 1.00 2.29 C ATOM 422 O ILE A 31 21.452 -0.257 6.711 1.00 2.53 O ATOM 423 CB ILE A 31 22.247 2.458 4.924 1.00 2.00 C ATOM 424 CG1 ILE A 31 23.358 2.855 3.921 1.00 3.32 C ATOM 425 CG2 ILE A 31 22.709 2.602 6.384 1.00 2.00 C ATOM 426 CD1 ILE A 31 24.667 1.972 4.005 1.00 4.23 C ATOM 427 HA ILE A 31 22.617 0.372 4.606 1.00 0.00 H ATOM 428 HB ILE A 31 21.423 3.152 4.757 1.00 0.00 H ATOM 429 HG12 ILE A 31 22.953 2.768 2.913 1.00 0.00 H ATOM 430 HG13 ILE A 31 23.634 3.892 4.112 1.00 0.00 H ATOM 431 HD11 ILE A 31 25.097 2.056 5.003 1.00 0.00 H ATOM 432 HD12 ILE A 31 24.415 0.931 3.803 1.00 0.00 H ATOM 433 HD13 ILE A 31 25.388 2.323 3.267 1.00 0.00 H ATOM 434 HG21 ILE A 31 21.872 2.394 7.051 1.00 0.00 H ATOM 435 HG22 ILE A 31 23.516 1.896 6.580 1.00 0.00 H ATOM 436 HG23 ILE A 31 23.065 3.618 6.552 1.00 0.00 H ATOM 437 H ILE A 31 20.754 1.776 2.903 1.00 0.00 H ATOM 438 N GLY A 32 19.628 0.766 5.825 1.00 2.00 N ATOM 439 CA GLY A 32 18.753 0.219 6.862 1.00 2.68 C ATOM 440 C GLY A 32 18.763 -1.282 6.842 1.00 3.17 C ATOM 441 O GLY A 32 18.789 -1.906 7.923 1.00 2.76 O ATOM 442 HA3 GLY A 32 17.735 0.571 6.691 1.00 0.00 H ATOM 443 HA2 GLY A 32 19.097 0.565 7.837 1.00 0.00 H ATOM 444 H GLY A 32 19.236 1.382 5.084 1.00 0.00 H ATOM 445 N ASN A 33 18.714 -1.847 5.622 1.00 2.79 N ATOM 446 CA ASN A 33 18.845 -3.268 5.456 1.00 2.61 C ATOM 447 C ASN A 33 20.172 -3.775 6.003 1.00 2.00 C ATOM 448 O ASN A 33 20.202 -4.739 6.762 1.00 2.90 O ATOM 449 CB ASN A 33 18.584 -3.696 4.022 1.00 2.82 C ATOM 450 CG ASN A 33 19.003 -5.137 3.763 1.00 3.01 C ATOM 451 OD1 ASN A 33 20.104 -5.361 3.244 1.00 2.90 O ATOM 452 ND2 ASN A 33 18.122 -6.123 4.120 1.00 2.00 N ATOM 453 HA ASN A 33 18.069 -3.745 6.054 1.00 0.00 H ATOM 454 HB2 ASN A 33 17.518 -3.598 3.815 1.00 0.00 H ATOM 455 HB3 ASN A 33 19.144 -3.042 3.353 1.00 0.00 H ATOM 456 HD22 ASN A 33 17.210 -5.874 4.553 1.00 0.00 H ATOM 457 HD21 ASN A 33 18.365 -7.121 3.958 1.00 0.00 H ATOM 458 H ASN A 33 18.579 -1.245 4.785 1.00 0.00 H ATOM 459 N VAL A 34 21.279 -3.138 5.654 1.00 2.00 N ATOM 460 CA VAL A 34 22.565 -3.601 6.175 1.00 2.05 C ATOM 461 C VAL A 34 22.610 -3.511 7.687 1.00 2.79 C ATOM 462 O VAL A 34 23.151 -4.411 8.355 1.00 2.00 O ATOM 463 CB VAL A 34 23.715 -2.782 5.558 1.00 2.00 C ATOM 464 CG1 VAL A 34 25.077 -3.177 6.209 1.00 2.00 C ATOM 465 CG2 VAL A 34 23.752 -3.041 4.023 1.00 2.40 C ATOM 466 HA VAL A 34 22.684 -4.648 5.897 1.00 0.00 H ATOM 467 HB VAL A 34 23.547 -1.721 5.746 1.00 0.00 H ATOM 468 HG11 VAL A 34 25.037 -2.981 7.280 1.00 0.00 H ATOM 469 HG12 VAL A 34 25.265 -4.237 6.039 1.00 0.00 H ATOM 470 HG13 VAL A 34 25.877 -2.588 5.760 1.00 0.00 H ATOM 471 HG21 VAL A 34 23.915 -4.103 3.839 1.00 0.00 H ATOM 472 HG22 VAL A 34 22.803 -2.736 3.581 1.00 0.00 H ATOM 473 HG23 VAL A 34 24.563 -2.465 3.578 1.00 0.00 H ATOM 474 H VAL A 34 21.235 -2.318 5.016 1.00 0.00 H ATOM 475 N GLU A 35 22.110 -2.415 8.239 1.00 2.45 N ATOM 476 CA GLU A 35 22.105 -2.215 9.698 1.00 2.35 C ATOM 477 C GLU A 35 21.465 -3.409 10.410 1.00 2.84 C ATOM 478 O GLU A 35 21.989 -3.963 11.385 1.00 2.65 O ATOM 479 CB GLU A 35 21.337 -0.958 10.051 1.00 2.00 C ATOM 480 CG GLU A 35 22.149 0.300 9.780 1.00 2.00 C ATOM 481 CD GLU A 35 21.364 1.551 9.876 1.00 2.48 C ATOM 482 OE1 GLU A 35 20.104 1.525 9.872 1.00 2.00 O ATOM 483 OE2 GLU A 35 22.016 2.610 9.980 1.00 2.76 O ATOM 484 HA GLU A 35 23.140 -2.118 10.026 1.00 0.00 H ATOM 485 HB2 GLU A 35 20.425 -0.924 9.456 1.00 0.00 H ATOM 486 HB3 GLU A 35 21.078 -0.989 11.109 1.00 0.00 H ATOM 487 HG2 GLU A 35 22.962 0.348 10.505 1.00 0.00 H ATOM 488 HG3 GLU A 35 22.564 0.231 8.775 1.00 0.00 H ATOM 489 H GLU A 35 21.710 -1.676 7.626 1.00 0.00 H ATOM 490 N CYS A 36 20.323 -3.817 9.878 1.00 2.00 N ATOM 491 CA CYS A 36 19.581 -4.927 10.444 1.00 2.00 C ATOM 492 C CYS A 36 20.300 -6.238 10.230 1.00 2.82 C ATOM 493 O CYS A 36 20.387 -7.069 11.152 1.00 2.53 O ATOM 494 CB CYS A 36 18.202 -4.979 9.820 1.00 2.00 C ATOM 495 SG CYS A 36 17.164 -3.534 10.141 1.00 2.00 S ATOM 496 HA CYS A 36 19.493 -4.771 11.519 1.00 0.00 H ATOM 497 HB2 CYS A 36 17.688 -5.858 10.208 1.00 0.00 H ATOM 498 HB3 CYS A 36 18.322 -5.077 8.741 1.00 0.00 H ATOM 499 HG CYS A 36 17.782 -2.406 9.643 1.00 0.00 H ATOM 500 H CYS A 36 19.951 -3.331 9.037 1.00 0.00 H ATOM 501 N GLN A 37 20.811 -6.472 9.014 1.00 2.00 N ATOM 502 CA GLN A 37 21.500 -7.705 8.755 1.00 2.70 C ATOM 503 C GLN A 37 22.756 -7.858 9.636 1.00 2.00 C ATOM 504 O GLN A 37 23.062 -8.966 10.110 1.00 2.65 O ATOM 505 CB GLN A 37 21.831 -7.885 7.271 1.00 2.00 C ATOM 506 CG GLN A 37 20.562 -8.020 6.354 1.00 2.18 C ATOM 507 CD GLN A 37 19.747 -9.246 6.744 1.00 2.78 C ATOM 508 OE1 GLN A 37 20.328 -10.296 7.037 1.00 5.64 O ATOM 509 NE2 GLN A 37 18.426 -9.134 6.733 1.00 2.34 N ATOM 510 HA GLN A 37 20.812 -8.506 9.026 1.00 0.00 H ATOM 511 HB2 GLN A 37 22.406 -7.021 6.939 1.00 0.00 H ATOM 512 HB3 GLN A 37 22.434 -8.786 7.159 1.00 0.00 H ATOM 513 HG2 GLN A 37 19.944 -7.129 6.464 1.00 0.00 H ATOM 514 HG3 GLN A 37 20.879 -8.115 5.315 1.00 0.00 H ATOM 515 HE22 GLN A 37 17.983 -8.228 6.479 1.00 0.00 H ATOM 516 HE21 GLN A 37 17.833 -9.952 6.978 1.00 0.00 H ATOM 517 H GLN A 37 20.709 -5.763 8.260 1.00 0.00 H ATOM 518 N TRP A 38 23.497 -6.766 9.825 1.00 2.26 N ATOM 519 CA TRP A 38 24.689 -6.781 10.657 1.00 2.73 C ATOM 520 C TRP A 38 24.353 -7.140 12.082 1.00 2.83 C ATOM 521 O TRP A 38 24.992 -8.006 12.684 1.00 3.26 O ATOM 522 CB TRP A 38 25.333 -5.388 10.592 1.00 3.12 C ATOM 523 CG TRP A 38 26.545 -5.216 11.398 1.00 3.08 C ATOM 524 CD1 TRP A 38 26.679 -4.461 12.535 1.00 5.90 C ATOM 525 CD2 TRP A 38 27.827 -5.807 11.165 1.00 2.00 C ATOM 526 NE1 TRP A 38 27.960 -4.537 13.010 1.00 4.05 N ATOM 527 CE2 TRP A 38 28.675 -5.385 12.212 1.00 2.51 C ATOM 528 CE3 TRP A 38 28.327 -6.683 10.206 1.00 2.00 C ATOM 529 CZ2 TRP A 38 29.997 -5.747 12.259 1.00 5.18 C ATOM 530 CZ3 TRP A 38 29.629 -7.067 10.276 1.00 3.30 C ATOM 531 CH2 TRP A 38 30.447 -6.605 11.296 1.00 4.41 C ATOM 532 HA TRP A 38 25.383 -7.537 10.289 1.00 0.00 H ATOM 533 HB2 TRP A 38 25.589 -5.184 9.552 1.00 0.00 H ATOM 534 HB3 TRP A 38 24.596 -4.661 10.933 1.00 0.00 H ATOM 535 HE1 TRP A 38 28.329 -4.032 13.841 1.00 0.00 H ATOM 536 HD1 TRP A 38 25.878 -3.882 12.995 1.00 0.00 H ATOM 537 HZ2 TRP A 38 30.662 -5.365 13.034 1.00 0.00 H ATOM 538 HH2 TRP A 38 31.484 -6.938 11.331 1.00 0.00 H ATOM 539 HZ3 TRP A 38 30.034 -7.744 9.524 1.00 0.00 H ATOM 540 HE3 TRP A 38 27.683 -7.056 9.410 1.00 0.00 H ATOM 541 H TRP A 38 23.214 -5.878 9.364 1.00 0.00 H ATOM 542 N PHE A 39 23.324 -6.499 12.615 1.00 3.29 N ATOM 543 CA PHE A 39 22.850 -6.857 13.938 1.00 3.75 C ATOM 544 C PHE A 39 22.483 -8.330 14.027 1.00 3.15 C ATOM 545 O PHE A 39 22.885 -9.006 14.978 1.00 3.89 O ATOM 546 CB PHE A 39 21.610 -6.055 14.264 1.00 3.49 C ATOM 547 CG PHE A 39 20.925 -6.483 15.525 1.00 3.86 C ATOM 548 CD1 PHE A 39 19.822 -7.307 15.471 1.00 3.49 C ATOM 549 CD2 PHE A 39 21.406 -6.045 16.768 1.00 6.62 C ATOM 550 CE1 PHE A 39 19.149 -7.676 16.642 1.00 5.73 C ATOM 551 CE2 PHE A 39 20.754 -6.418 17.945 1.00 7.71 C ATOM 552 CZ PHE A 39 19.649 -7.212 17.895 1.00 6.76 C ATOM 553 HA PHE A 39 23.657 -6.647 14.639 1.00 0.00 H ATOM 554 HB2 PHE A 39 21.895 -5.008 14.366 1.00 0.00 H ATOM 555 HB3 PHE A 39 20.906 -6.160 13.438 1.00 0.00 H ATOM 556 HD2 PHE A 39 22.292 -5.411 16.815 1.00 0.00 H ATOM 557 HE2 PHE A 39 21.131 -6.072 18.908 1.00 0.00 H ATOM 558 HZ PHE A 39 19.143 -7.495 18.818 1.00 0.00 H ATOM 559 HE1 PHE A 39 18.260 -8.306 16.597 1.00 0.00 H ATOM 560 HD1 PHE A 39 19.470 -7.675 14.507 1.00 0.00 H ATOM 561 H PHE A 39 22.855 -5.738 12.084 1.00 0.00 H ATOM 562 N LEU A 40 21.749 -8.841 13.035 1.00 3.98 N ATOM 563 CA LEU A 40 21.274 -10.216 13.084 1.00 3.43 C ATOM 564 C LEU A 40 22.396 -11.221 12.896 1.00 4.67 C ATOM 565 O LEU A 40 22.197 -12.407 13.196 1.00 6.03 O ATOM 566 CB LEU A 40 20.175 -10.450 12.012 1.00 2.73 C ATOM 567 CG LEU A 40 18.865 -9.738 12.347 1.00 2.45 C ATOM 568 CD1 LEU A 40 17.781 -9.891 11.178 1.00 2.60 C ATOM 569 CD2 LEU A 40 18.347 -10.284 13.675 1.00 3.32 C ATOM 570 HA LEU A 40 20.854 -10.371 14.078 1.00 0.00 H ATOM 571 HB2 LEU A 40 20.538 -10.080 11.053 1.00 0.00 H ATOM 572 HB3 LEU A 40 19.982 -11.520 11.938 1.00 0.00 H ATOM 573 HG LEU A 40 19.050 -8.668 12.439 1.00 0.00 H ATOM 574 HD21 LEU A 40 18.177 -11.357 13.584 1.00 0.00 H ATOM 575 HD22 LEU A 40 19.084 -10.097 14.456 1.00 0.00 H ATOM 576 HD23 LEU A 40 17.411 -9.787 13.931 1.00 0.00 H ATOM 577 HD11 LEU A 40 18.177 -9.460 10.258 1.00 0.00 H ATOM 578 HD12 LEU A 40 17.564 -10.948 11.022 1.00 0.00 H ATOM 579 HD13 LEU A 40 16.867 -9.369 11.461 1.00 0.00 H ATOM 580 H LEU A 40 21.513 -8.247 12.215 1.00 0.00 H ATOM 581 N ALA A 41 23.545 -10.767 12.397 1.00 4.34 N ATOM 582 CA ALA A 41 24.750 -11.591 12.340 1.00 6.11 C ATOM 583 C ALA A 41 25.472 -11.699 13.698 1.00 7.23 C ATOM 584 O ALA A 41 26.553 -12.314 13.766 1.00 9.86 O ATOM 585 CB ALA A 41 25.715 -11.029 11.290 1.00 4.88 C ATOM 586 HA ALA A 41 24.431 -12.597 12.066 1.00 0.00 H ATOM 587 HB1 ALA A 41 25.230 -11.032 10.314 1.00 0.00 H ATOM 588 HB2 ALA A 41 25.988 -10.009 11.559 1.00 0.00 H ATOM 589 HB3 ALA A 41 26.611 -11.649 11.253 1.00 0.00 H ATOM 590 H ALA A 41 23.585 -9.793 12.036 1.00 0.00 H ATOM 591 N GLY A 42 24.917 -11.108 14.755 1.00 6.58 N ATOM 592 CA GLY A 42 25.458 -11.205 16.101 1.00 7.08 C ATOM 593 C GLY A 42 26.346 -10.034 16.488 1.00 7.78 C ATOM 594 O GLY A 42 27.343 -10.221 17.221 1.00 7.68 O ATOM 595 HA3 GLY A 42 26.045 -12.121 16.171 1.00 0.00 H ATOM 596 HA2 GLY A 42 24.626 -11.254 16.804 1.00 0.00 H ATOM 597 H GLY A 42 24.052 -10.549 14.610 1.00 0.00 H ATOM 598 N HIS A 43 26.019 -8.838 16.003 1.00 7.63 N ATOM 599 CA HIS A 43 26.804 -7.641 16.300 1.00 7.32 C ATOM 600 C HIS A 43 25.905 -6.586 16.934 1.00 8.50 C ATOM 601 O HIS A 43 24.685 -6.581 16.695 1.00 7.64 O ATOM 602 CB HIS A 43 27.472 -7.075 15.037 1.00 7.68 C ATOM 603 CG HIS A 43 28.337 -8.057 14.310 1.00 7.49 C ATOM 604 ND1 HIS A 43 29.619 -8.354 14.722 1.00 9.31 N ATOM 605 CD2 HIS A 43 28.127 -8.781 13.183 1.00 6.63 C ATOM 606 CE1 HIS A 43 30.149 -9.243 13.897 1.00 9.00 C ATOM 607 NE2 HIS A 43 29.270 -9.519 12.950 1.00 4.77 N ATOM 608 HA HIS A 43 27.596 -7.917 16.997 1.00 0.00 H ATOM 609 HB2 HIS A 43 26.689 -6.739 14.357 1.00 0.00 H ATOM 610 HB3 HIS A 43 28.089 -6.225 15.328 1.00 0.00 H ATOM 611 HD2 HIS A 43 27.223 -8.780 12.574 1.00 0.00 H ATOM 612 HE1 HIS A 43 31.146 -9.676 13.984 1.00 0.00 H ATOM 613 H HIS A 43 25.180 -8.753 15.395 1.00 0.00 H ATOM 614 N PRO A 44 26.481 -5.694 17.753 1.00 7.65 N ATOM 615 CA PRO A 44 25.719 -4.580 18.289 1.00 8.01 C ATOM 616 C PRO A 44 25.050 -3.722 17.192 1.00 6.34 C ATOM 617 O PRO A 44 25.655 -3.403 16.148 1.00 8.43 O ATOM 618 CB PRO A 44 26.772 -3.763 19.073 1.00 7.73 C ATOM 619 CG PRO A 44 27.811 -4.802 19.431 1.00 10.02 C ATOM 620 CD PRO A 44 27.871 -5.710 18.271 1.00 9.43 C ATOM 621 HA PRO A 44 24.887 -4.921 18.905 1.00 0.00 H ATOM 622 HD3 PRO A 44 28.572 -5.341 17.522 1.00 0.00 H ATOM 623 HD2 PRO A 44 28.163 -6.715 18.576 1.00 0.00 H ATOM 624 HG3 PRO A 44 27.514 -5.347 20.327 1.00 0.00 H ATOM 625 HG2 PRO A 44 28.780 -4.331 19.598 1.00 0.00 H ATOM 626 HB2 PRO A 44 27.201 -2.977 18.451 1.00 0.00 H ATOM 627 HB3 PRO A 44 26.337 -3.319 19.968 1.00 0.00 H ATOM 628 N LEU A 45 23.808 -3.359 17.444 1.00 5.89 N ATOM 629 CA LEU A 45 23.066 -2.450 16.565 1.00 5.03 C ATOM 630 C LEU A 45 23.856 -1.148 16.383 1.00 4.70 C ATOM 631 O LEU A 45 24.227 -0.498 17.364 1.00 5.43 O ATOM 632 CB LEU A 45 21.679 -2.160 17.107 1.00 5.03 C ATOM 633 CG LEU A 45 20.681 -1.463 16.127 1.00 5.14 C ATOM 634 CD1 LEU A 45 20.381 -2.276 14.924 1.00 6.15 C ATOM 635 CD2 LEU A 45 19.353 -1.064 16.802 1.00 8.24 C ATOM 636 HA LEU A 45 22.942 -2.935 15.597 1.00 0.00 H ATOM 637 HB2 LEU A 45 21.237 -3.109 17.412 1.00 0.00 H ATOM 638 HB3 LEU A 45 21.792 -1.516 17.979 1.00 0.00 H ATOM 639 HG LEU A 45 21.203 -0.558 15.815 1.00 0.00 H ATOM 640 HD21 LEU A 45 18.864 -1.956 17.195 1.00 0.00 H ATOM 641 HD22 LEU A 45 19.556 -0.370 17.618 1.00 0.00 H ATOM 642 HD23 LEU A 45 18.704 -0.585 16.069 1.00 0.00 H ATOM 643 HD11 LEU A 45 21.304 -2.466 14.376 1.00 0.00 H ATOM 644 HD12 LEU A 45 19.937 -3.224 15.229 1.00 0.00 H ATOM 645 HD13 LEU A 45 19.683 -1.734 14.286 1.00 0.00 H ATOM 646 H LEU A 45 23.339 -3.730 18.295 1.00 0.00 H ATOM 647 N THR A 46 24.141 -0.815 15.127 1.00 4.04 N ATOM 648 CA THR A 46 25.024 0.280 14.743 1.00 4.01 C ATOM 649 C THR A 46 24.374 1.107 13.627 1.00 3.89 C ATOM 650 O THR A 46 23.919 0.540 12.620 1.00 3.38 O ATOM 651 CB THR A 46 26.386 -0.274 14.297 1.00 5.32 C ATOM 652 OG1 THR A 46 26.969 -1.059 15.348 1.00 5.90 O ATOM 653 CG2 THR A 46 27.394 0.833 13.947 1.00 5.21 C ATOM 654 HA THR A 46 25.187 0.931 15.602 1.00 0.00 H ATOM 655 HB THR A 46 26.190 -0.872 13.407 1.00 0.00 H ATOM 656 HG1 THR A 46 26.367 -1.814 15.567 1.00 0.00 H ATOM 657 HG23 THR A 46 26.987 1.454 13.149 1.00 0.00 H ATOM 658 HG21 THR A 46 27.578 1.447 14.829 1.00 0.00 H ATOM 659 HG22 THR A 46 28.329 0.380 13.616 1.00 0.00 H ATOM 660 H THR A 46 23.704 -1.374 14.367 1.00 0.00 H ATOM 661 N ASN A 47 24.354 2.439 13.800 1.00 3.34 N ATOM 662 CA ASN A 47 23.923 3.341 12.753 1.00 3.32 C ATOM 663 C ASN A 47 25.033 3.444 11.721 1.00 3.02 C ATOM 664 O ASN A 47 26.185 3.734 12.080 1.00 3.81 O ATOM 665 CB ASN A 47 23.665 4.723 13.303 1.00 4.04 C ATOM 666 CG ASN A 47 22.435 4.801 14.141 1.00 9.21 C ATOM 667 OD1 ASN A 47 21.429 4.262 13.790 1.00 13.08 O ATOM 668 ND2 ASN A 47 22.505 5.576 15.227 1.00 13.62 N ATOM 669 HA ASN A 47 23.003 2.955 12.315 1.00 0.00 H ATOM 670 HB2 ASN A 47 24.519 5.019 13.912 1.00 0.00 H ATOM 671 HB3 ASN A 47 23.560 5.415 12.467 1.00 0.00 H ATOM 672 HD22 ASN A 47 23.407 6.023 15.490 1.00 0.00 H ATOM 673 HD21 ASN A 47 21.658 5.732 15.810 1.00 0.00 H ATOM 674 H ASN A 47 24.657 2.834 14.713 1.00 0.00 H ATOM 675 N LEU A 48 24.688 3.180 10.456 1.00 2.10 N ATOM 676 CA LEU A 48 25.632 3.158 9.365 1.00 2.74 C ATOM 677 C LEU A 48 25.380 4.330 8.411 1.00 2.50 C ATOM 678 O LEU A 48 24.319 4.992 8.477 1.00 3.29 O ATOM 679 CB LEU A 48 25.571 1.791 8.648 1.00 2.89 C ATOM 680 CG LEU A 48 25.938 0.584 9.539 1.00 2.00 C ATOM 681 CD1 LEU A 48 25.579 -0.744 8.783 1.00 2.00 C ATOM 682 CD2 LEU A 48 27.376 0.600 10.033 1.00 3.16 C ATOM 683 HA LEU A 48 26.643 3.281 9.754 1.00 0.00 H ATOM 684 HB2 LEU A 48 24.556 1.645 8.278 1.00 0.00 H ATOM 685 HB3 LEU A 48 26.263 1.816 7.806 1.00 0.00 H ATOM 686 HG LEU A 48 25.343 0.651 10.450 1.00 0.00 H ATOM 687 HD21 LEU A 48 28.053 0.589 9.178 1.00 0.00 H ATOM 688 HD22 LEU A 48 27.547 1.501 10.622 1.00 0.00 H ATOM 689 HD23 LEU A 48 27.556 -0.279 10.651 1.00 0.00 H ATOM 690 HD11 LEU A 48 24.511 -0.760 8.566 1.00 0.00 H ATOM 691 HD12 LEU A 48 26.141 -0.793 7.850 1.00 0.00 H ATOM 692 HD13 LEU A 48 25.837 -1.598 9.409 1.00 0.00 H ATOM 693 H LEU A 48 23.689 2.980 10.248 1.00 0.00 H ATOM 694 N ALA A 49 26.323 4.589 7.477 1.00 3.10 N ATOM 695 CA ALA A 49 26.408 5.910 6.794 1.00 2.76 C ATOM 696 C ALA A 49 25.773 5.939 5.373 1.00 2.00 C ATOM 697 O ALA A 49 26.392 5.522 4.378 1.00 2.16 O ATOM 698 CB ALA A 49 27.863 6.356 6.709 1.00 2.31 C ATOM 699 HA ALA A 49 25.823 6.598 7.404 1.00 0.00 H ATOM 700 HB1 ALA A 49 28.274 6.443 7.715 1.00 0.00 H ATOM 701 HB2 ALA A 49 28.435 5.620 6.143 1.00 0.00 H ATOM 702 HB3 ALA A 49 27.917 7.323 6.208 1.00 0.00 H ATOM 703 H ALA A 49 27.007 3.846 7.229 1.00 0.00 H ATOM 704 N GLU A 50 24.521 6.404 5.268 1.00 2.00 N ATOM 705 CA GLU A 50 23.948 6.665 3.955 1.00 2.36 C ATOM 706 C GLU A 50 24.836 7.587 3.101 1.00 2.00 C ATOM 707 O GLU A 50 24.889 7.445 1.867 1.00 2.66 O ATOM 708 CB GLU A 50 22.578 7.354 4.109 1.00 2.46 C ATOM 709 CG GLU A 50 21.502 6.381 4.473 1.00 2.00 C ATOM 710 CD GLU A 50 21.386 5.982 5.955 1.00 3.06 C ATOM 711 OE1 GLU A 50 22.067 6.564 6.843 1.00 5.05 O ATOM 712 OE2 GLU A 50 20.608 5.038 6.201 1.00 5.55 O ATOM 713 HA GLU A 50 23.857 5.699 3.458 1.00 0.00 H ATOM 714 HB2 GLU A 50 22.649 8.110 4.891 1.00 0.00 H ATOM 715 HB3 GLU A 50 22.316 7.833 3.166 1.00 0.00 H ATOM 716 HG2 GLU A 50 20.549 6.819 4.176 1.00 0.00 H ATOM 717 HG3 GLU A 50 21.676 5.470 3.901 1.00 0.00 H ATOM 718 H GLU A 50 23.958 6.579 6.125 1.00 0.00 H ATOM 719 N GLN A 51 25.489 8.545 3.729 1.00 2.10 N ATOM 720 CA GLN A 51 26.279 9.518 2.984 1.00 2.00 C ATOM 721 C GLN A 51 27.411 8.837 2.193 1.00 2.00 C ATOM 722 O GLN A 51 27.807 9.313 1.122 1.00 2.00 O ATOM 723 CB GLN A 51 26.856 10.605 3.874 1.00 2.19 C ATOM 724 CG GLN A 51 27.383 11.820 3.046 1.00 2.00 C ATOM 725 CD GLN A 51 26.264 12.470 2.228 1.00 2.00 C ATOM 726 OE1 GLN A 51 25.208 12.831 2.781 1.00 2.92 O ATOM 727 NE2 GLN A 51 26.441 12.517 0.899 1.00 3.49 N ATOM 728 HA GLN A 51 25.591 9.991 2.284 1.00 0.00 H ATOM 729 HB2 GLN A 51 26.079 10.953 4.554 1.00 0.00 H ATOM 730 HB3 GLN A 51 27.681 10.187 4.451 1.00 0.00 H ATOM 731 HG2 GLN A 51 27.799 12.561 3.729 1.00 0.00 H ATOM 732 HG3 GLN A 51 28.163 11.475 2.368 1.00 0.00 H ATOM 733 HE22 GLN A 51 27.341 12.204 0.483 1.00 0.00 H ATOM 734 HE21 GLN A 51 25.678 12.866 0.285 1.00 0.00 H ATOM 735 H GLN A 51 25.440 8.607 4.766 1.00 0.00 H ATOM 736 N MET A 52 27.893 7.702 2.695 1.00 2.00 N ATOM 737 CA MET A 52 28.946 6.963 1.986 1.00 2.00 C ATOM 738 C MET A 52 28.405 6.546 0.627 1.00 2.00 C ATOM 739 O MET A 52 29.066 6.698 -0.388 1.00 2.00 O ATOM 740 CB MET A 52 29.387 5.751 2.803 1.00 2.00 C ATOM 741 CG MET A 52 30.344 4.793 2.088 1.00 3.10 C ATOM 742 SD MET A 52 30.447 3.155 2.836 1.00 2.00 S ATOM 743 CE MET A 52 28.876 2.510 2.263 1.00 3.88 C ATOM 744 HA MET A 52 29.823 7.595 1.847 1.00 0.00 H ATOM 745 HB2 MET A 52 29.883 6.114 3.703 1.00 0.00 H ATOM 746 HB3 MET A 52 28.495 5.190 3.082 1.00 0.00 H ATOM 747 HG2 MET A 52 31.340 5.236 2.095 1.00 0.00 H ATOM 748 HG3 MET A 52 30.007 4.678 1.058 1.00 0.00 H ATOM 749 HE1 MET A 52 28.068 3.135 2.643 1.00 0.00 H ATOM 750 HE2 MET A 52 28.859 2.514 1.173 1.00 0.00 H ATOM 751 HE3 MET A 52 28.749 1.490 2.626 1.00 0.00 H ATOM 752 H MET A 52 27.522 7.336 3.595 1.00 0.00 H ATOM 753 N LEU A 53 27.212 5.980 0.588 1.00 2.00 N ATOM 754 CA LEU A 53 26.605 5.646 -0.715 1.00 2.00 C ATOM 755 C LEU A 53 26.257 6.884 -1.555 1.00 2.44 C ATOM 756 O LEU A 53 26.632 6.972 -2.762 1.00 2.40 O ATOM 757 CB LEU A 53 25.305 4.812 -0.542 1.00 3.28 C ATOM 758 CG LEU A 53 25.545 3.434 0.004 1.00 3.15 C ATOM 759 CD1 LEU A 53 24.196 2.756 0.334 1.00 4.40 C ATOM 760 CD2 LEU A 53 26.384 2.594 -0.995 1.00 2.00 C ATOM 761 HA LEU A 53 27.366 5.067 -1.238 1.00 0.00 H ATOM 762 HB2 LEU A 53 24.642 5.343 0.141 1.00 0.00 H ATOM 763 HB3 LEU A 53 24.823 4.719 -1.515 1.00 0.00 H ATOM 764 HG LEU A 53 26.118 3.507 0.928 1.00 0.00 H ATOM 765 HD21 LEU A 53 25.847 2.513 -1.940 1.00 0.00 H ATOM 766 HD22 LEU A 53 27.344 3.082 -1.162 1.00 0.00 H ATOM 767 HD23 LEU A 53 26.548 1.598 -0.583 1.00 0.00 H ATOM 768 HD11 LEU A 53 23.664 3.350 1.077 1.00 0.00 H ATOM 769 HD12 LEU A 53 23.595 2.684 -0.573 1.00 0.00 H ATOM 770 HD13 LEU A 53 24.380 1.757 0.729 1.00 0.00 H ATOM 771 H LEU A 53 26.703 5.771 1.471 1.00 0.00 H ATOM 772 N VAL A 54 25.550 7.849 -0.925 1.00 2.00 N ATOM 773 CA VAL A 54 25.068 9.001 -1.673 1.00 2.00 C ATOM 774 C VAL A 54 26.222 9.718 -2.408 1.00 2.00 C ATOM 775 O VAL A 54 26.111 10.024 -3.568 1.00 2.00 O ATOM 776 CB VAL A 54 24.260 9.945 -0.790 1.00 2.00 C ATOM 777 CG1 VAL A 54 23.652 11.113 -1.632 1.00 2.00 C ATOM 778 CG2 VAL A 54 23.067 9.221 -0.159 1.00 2.91 C ATOM 779 HA VAL A 54 24.386 8.637 -2.441 1.00 0.00 H ATOM 780 HB VAL A 54 24.947 10.316 -0.030 1.00 0.00 H ATOM 781 HG11 VAL A 54 24.457 11.677 -2.104 1.00 0.00 H ATOM 782 HG12 VAL A 54 22.996 10.703 -2.400 1.00 0.00 H ATOM 783 HG13 VAL A 54 23.081 11.772 -0.978 1.00 0.00 H ATOM 784 HG21 VAL A 54 22.418 8.837 -0.947 1.00 0.00 H ATOM 785 HG22 VAL A 54 23.428 8.393 0.452 1.00 0.00 H ATOM 786 HG23 VAL A 54 22.509 9.919 0.465 1.00 0.00 H ATOM 787 H VAL A 54 25.351 7.768 0.093 1.00 0.00 H ATOM 788 N SER A 55 27.348 9.921 -1.717 1.00 2.23 N ATOM 789 CA SER A 55 28.511 10.610 -2.261 1.00 2.22 C ATOM 790 C SER A 55 29.458 9.709 -3.070 1.00 2.25 C ATOM 791 O SER A 55 30.055 10.146 -4.034 1.00 3.14 O ATOM 792 CB SER A 55 29.359 11.265 -1.153 1.00 2.50 C ATOM 793 OG SER A 55 28.691 12.362 -0.570 1.00 2.02 O ATOM 794 HA SER A 55 28.078 11.356 -2.927 1.00 0.00 H ATOM 795 HB2 SER A 55 30.299 11.611 -1.584 1.00 0.00 H ATOM 796 HB3 SER A 55 29.565 10.524 -0.380 1.00 0.00 H ATOM 797 HG SER A 55 28.505 13.041 -1.266 1.00 0.00 H ATOM 798 H SER A 55 27.397 9.569 -0.740 1.00 0.00 H ATOM 799 N CYS A 56 29.650 8.473 -2.654 1.00 2.00 N ATOM 800 CA CYS A 56 30.777 7.665 -3.190 1.00 2.00 C ATOM 801 C CYS A 56 30.390 6.560 -4.177 1.00 2.96 C ATOM 802 O CYS A 56 31.277 6.098 -4.921 1.00 3.35 O ATOM 803 CB CYS A 56 31.589 7.068 -2.081 1.00 2.02 C ATOM 804 SG CYS A 56 32.179 8.240 -0.858 1.00 2.26 S ATOM 805 HA CYS A 56 31.363 8.386 -3.760 1.00 0.00 H ATOM 806 HB2 CYS A 56 32.455 6.575 -2.523 1.00 0.00 H ATOM 807 HB3 CYS A 56 30.973 6.328 -1.571 1.00 0.00 H ATOM 808 H CYS A 56 29.009 8.060 -1.946 1.00 0.00 H ATOM 809 N ASP A 57 29.121 6.153 -4.190 1.00 3.24 N ATOM 810 CA ASP A 57 28.620 5.135 -5.104 1.00 3.82 C ATOM 811 C ASP A 57 28.250 5.806 -6.398 1.00 2.33 C ATOM 812 O ASP A 57 27.167 6.290 -6.537 1.00 3.64 O ATOM 813 CB ASP A 57 27.446 4.389 -4.469 1.00 3.15 C ATOM 814 CG ASP A 57 26.629 3.563 -5.448 1.00 4.26 C ATOM 815 OD1 ASP A 57 27.018 3.326 -6.604 1.00 3.47 O ATOM 816 OD2 ASP A 57 25.548 3.143 -4.984 1.00 5.27 O ATOM 817 HA ASP A 57 29.384 4.386 -5.312 1.00 0.00 H ATOM 818 HB2 ASP A 57 27.840 3.721 -3.703 1.00 0.00 H ATOM 819 HB3 ASP A 57 26.786 5.122 -4.006 1.00 0.00 H ATOM 820 H ASP A 57 28.456 6.583 -3.515 1.00 0.00 H ATOM 821 N LYS A 58 29.169 5.783 -7.362 1.00 4.42 N ATOM 822 CA LYS A 58 28.979 6.449 -8.629 1.00 3.68 C ATOM 823 C LYS A 58 28.181 5.627 -9.662 1.00 3.93 C ATOM 824 O LYS A 58 27.865 6.131 -10.777 1.00 4.51 O ATOM 825 CB LYS A 58 30.318 6.946 -9.144 1.00 4.61 C ATOM 826 CG LYS A 58 31.042 7.865 -8.148 1.00 4.03 C ATOM 827 CD LYS A 58 30.255 9.134 -7.725 1.00 4.02 C ATOM 828 CE LYS A 58 31.127 10.141 -6.956 1.00 5.19 C ATOM 829 NZ LYS A 58 30.406 11.322 -6.516 1.00 2.65 N ATOM 830 HA LYS A 58 28.336 7.313 -8.459 1.00 0.00 H ATOM 831 HB2 LYS A 58 30.954 6.084 -9.347 1.00 0.00 H ATOM 832 HB3 LYS A 58 30.151 7.499 -10.069 1.00 0.00 H ATOM 833 HG2 LYS A 58 31.256 7.286 -7.250 1.00 0.00 H ATOM 834 HG3 LYS A 58 31.979 8.186 -8.604 1.00 0.00 H ATOM 835 HD2 LYS A 58 29.867 9.620 -8.621 1.00 0.00 H ATOM 836 HD3 LYS A 58 29.424 8.833 -7.088 1.00 0.00 H ATOM 837 HE2 LYS A 58 31.942 10.458 -7.607 1.00 0.00 H ATOM 838 HE3 LYS A 58 31.537 9.641 -6.078 1.00 0.00 H ATOM 839 HZ1 LYS A 58 30.017 11.817 -7.343 1.00 0.00 H ATOM 840 HZ2 LYS A 58 29.630 11.038 -5.884 1.00 0.00 H ATOM 841 HZ3 LYS A 58 31.056 11.954 -6.006 1.00 0.00 H ATOM 842 H LYS A 58 30.056 5.266 -7.196 1.00 0.00 H ATOM 843 N THR A 59 27.792 4.412 -9.287 1.00 3.80 N ATOM 844 CA THR A 59 26.826 3.688 -10.124 1.00 5.04 C ATOM 845 C THR A 59 25.450 4.302 -9.969 1.00 6.15 C ATOM 846 O THR A 59 24.679 4.383 -10.947 1.00 10.36 O ATOM 847 CB THR A 59 26.821 2.172 -9.890 1.00 5.34 C ATOM 848 OG1 THR A 59 26.441 1.845 -8.544 1.00 5.96 O ATOM 849 CG2 THR A 59 28.193 1.623 -10.209 1.00 4.90 C ATOM 850 HA THR A 59 27.145 3.801 -11.160 1.00 0.00 H ATOM 851 HB THR A 59 26.080 1.716 -10.547 1.00 0.00 H ATOM 852 HG1 THR A 59 27.082 2.257 -7.912 1.00 0.00 H ATOM 853 HG23 THR A 59 28.458 1.884 -11.234 1.00 0.00 H ATOM 854 HG21 THR A 59 28.923 2.052 -9.523 1.00 0.00 H ATOM 855 HG22 THR A 59 28.183 0.539 -10.100 1.00 0.00 H ATOM 856 H THR A 59 28.165 3.982 -8.417 1.00 0.00 H ATOM 857 N ASP A 60 25.166 4.811 -8.793 1.00 4.08 N ATOM 858 CA ASP A 60 23.909 5.488 -8.503 1.00 3.25 C ATOM 859 C ASP A 60 24.053 6.999 -8.636 1.00 3.31 C ATOM 860 O ASP A 60 25.163 7.513 -8.958 1.00 4.08 O ATOM 861 CB ASP A 60 23.400 5.025 -7.141 1.00 2.00 C ATOM 862 CG ASP A 60 23.068 3.540 -7.168 1.00 2.00 C ATOM 863 OD1 ASP A 60 22.188 3.229 -8.005 1.00 3.50 O ATOM 864 OD2 ASP A 60 23.650 2.719 -6.431 1.00 3.55 O ATOM 865 HA ASP A 60 23.152 5.217 -9.239 1.00 0.00 H ATOM 866 HB2 ASP A 60 24.169 5.207 -6.390 1.00 0.00 H ATOM 867 HB3 ASP A 60 22.503 5.588 -6.883 1.00 0.00 H ATOM 868 H ASP A 60 25.871 4.727 -8.033 1.00 0.00 H ATOM 869 N SER A 61 22.945 7.707 -8.498 1.00 2.37 N ATOM 870 CA SER A 61 22.847 9.141 -8.869 1.00 2.90 C ATOM 871 C SER A 61 22.518 10.081 -7.682 1.00 3.17 C ATOM 872 O SER A 61 21.881 11.135 -7.868 1.00 3.47 O ATOM 873 CB SER A 61 21.876 9.342 -10.069 1.00 3.76 C ATOM 874 OG SER A 61 22.403 8.686 -11.267 1.00 4.57 O ATOM 875 HA SER A 61 23.846 9.440 -9.187 1.00 0.00 H ATOM 876 HB2 SER A 61 21.761 10.408 -10.264 1.00 0.00 H ATOM 877 HB3 SER A 61 20.905 8.913 -9.822 1.00 0.00 H ATOM 878 HG SER A 61 22.505 7.717 -11.093 1.00 0.00 H ATOM 879 H SER A 61 22.102 7.237 -8.111 1.00 0.00 H ATOM 880 N GLY A 62 23.029 9.737 -6.491 1.00 3.82 N ATOM 881 CA GLY A 62 22.941 10.581 -5.284 1.00 3.67 C ATOM 882 C GLY A 62 21.534 11.032 -4.969 1.00 4.36 C ATOM 883 O GLY A 62 20.626 10.204 -4.851 1.00 3.87 O ATOM 884 HA3 GLY A 62 23.562 11.464 -5.434 1.00 0.00 H ATOM 885 HA2 GLY A 62 23.320 10.011 -4.435 1.00 0.00 H ATOM 886 H GLY A 62 23.516 8.821 -6.413 1.00 0.00 H ATOM 887 N CYS A 63 21.353 12.346 -4.922 1.00 4.41 N ATOM 888 CA CYS A 63 20.050 12.955 -4.660 1.00 4.02 C ATOM 889 C CYS A 63 19.086 12.799 -5.846 1.00 3.23 C ATOM 890 O CYS A 63 17.933 13.157 -5.727 1.00 4.26 O ATOM 891 CB CYS A 63 20.229 14.424 -4.336 1.00 5.54 C ATOM 892 SG CYS A 63 21.047 14.633 -2.729 1.00 3.40 S ATOM 893 HA CYS A 63 19.610 12.434 -3.810 1.00 0.00 H ATOM 894 HB2 CYS A 63 19.252 14.905 -4.305 1.00 0.00 H ATOM 895 HB3 CYS A 63 20.838 14.890 -5.111 1.00 0.00 H ATOM 896 H CYS A 63 22.172 12.968 -5.078 1.00 0.00 H ATOM 897 N SER A 64 19.561 12.290 -6.987 1.00 3.17 N ATOM 898 CA SER A 64 18.646 12.054 -8.162 1.00 4.06 C ATOM 899 C SER A 64 18.229 10.602 -8.348 1.00 3.84 C ATOM 900 O SER A 64 17.608 10.254 -9.361 1.00 5.65 O ATOM 901 CB SER A 64 19.284 12.572 -9.456 1.00 5.13 C ATOM 902 OG SER A 64 19.532 13.973 -9.399 1.00 5.08 O ATOM 903 HA SER A 64 17.737 12.611 -7.935 1.00 0.00 H ATOM 904 HB2 SER A 64 18.611 12.366 -10.289 1.00 0.00 H ATOM 905 HB3 SER A 64 20.229 12.052 -9.617 1.00 0.00 H ATOM 906 HG SER A 64 19.943 14.269 -10.250 1.00 0.00 H ATOM 907 H SER A 64 20.571 12.055 -7.065 1.00 0.00 H ATOM 908 N GLY A 65 18.536 9.758 -7.364 1.00 3.11 N ATOM 909 CA GLY A 65 18.014 8.396 -7.289 1.00 2.59 C ATOM 910 C GLY A 65 19.057 7.307 -7.452 1.00 2.73 C ATOM 911 O GLY A 65 20.188 7.562 -7.800 1.00 3.53 O ATOM 912 HA3 GLY A 65 17.269 8.274 -8.076 1.00 0.00 H ATOM 913 HA2 GLY A 65 17.538 8.268 -6.317 1.00 0.00 H ATOM 914 H GLY A 65 19.178 10.084 -6.614 1.00 0.00 H ATOM 915 N GLY A 66 18.649 6.076 -7.178 1.00 2.32 N ATOM 916 CA GLY A 66 19.553 4.933 -7.234 1.00 3.01 C ATOM 917 C GLY A 66 18.816 3.655 -6.980 1.00 2.68 C ATOM 918 O GLY A 66 17.590 3.656 -6.752 1.00 3.21 O ATOM 919 HA3 GLY A 66 20.329 5.054 -6.478 1.00 0.00 H ATOM 920 HA2 GLY A 66 20.013 4.890 -8.221 1.00 0.00 H ATOM 921 H GLY A 66 17.655 5.921 -6.915 1.00 0.00 H ATOM 922 N LEU A 67 19.543 2.558 -7.063 1.00 3.01 N ATOM 923 CA LEU A 67 18.974 1.223 -6.814 1.00 3.03 C ATOM 924 C LEU A 67 19.691 0.572 -5.634 1.00 2.18 C ATOM 925 O LEU A 67 20.929 0.527 -5.564 1.00 2.20 O ATOM 926 CB LEU A 67 19.148 0.318 -8.040 1.00 4.02 C ATOM 927 CG LEU A 67 18.572 0.783 -9.367 1.00 5.72 C ATOM 928 CD1 LEU A 67 18.995 -0.243 -10.469 1.00 6.40 C ATOM 929 CD2 LEU A 67 17.042 1.051 -9.271 1.00 2.22 C ATOM 930 HA LEU A 67 17.912 1.343 -6.600 1.00 0.00 H ATOM 931 HB2 LEU A 67 20.219 0.174 -8.186 1.00 0.00 H ATOM 932 HB3 LEU A 67 18.683 -0.639 -7.804 1.00 0.00 H ATOM 933 HG LEU A 67 18.982 1.753 -9.650 1.00 0.00 H ATOM 934 HD21 LEU A 67 16.531 0.134 -8.978 1.00 0.00 H ATOM 935 HD22 LEU A 67 16.856 1.825 -8.527 1.00 0.00 H ATOM 936 HD23 LEU A 67 16.671 1.381 -10.241 1.00 0.00 H ATOM 937 HD11 LEU A 67 20.083 -0.285 -10.526 1.00 0.00 H ATOM 938 HD12 LEU A 67 18.605 -1.229 -10.215 1.00 0.00 H ATOM 939 HD13 LEU A 67 18.591 0.072 -11.431 1.00 0.00 H ATOM 940 H LEU A 67 20.550 2.638 -7.312 1.00 0.00 H ATOM 941 N MET A 68 18.929 -0.069 -4.761 1.00 2.42 N ATOM 942 CA MET A 68 19.529 -0.711 -3.600 1.00 2.12 C ATOM 943 C MET A 68 20.463 -1.812 -4.038 1.00 2.28 C ATOM 944 O MET A 68 21.500 -2.000 -3.430 1.00 2.23 O ATOM 945 CB MET A 68 18.445 -1.273 -2.683 1.00 2.18 C ATOM 946 CG MET A 68 17.586 -0.191 -2.002 1.00 2.00 C ATOM 947 SD MET A 68 16.302 0.578 -3.006 1.00 2.00 S ATOM 948 CE MET A 68 14.996 -0.698 -2.879 1.00 2.00 C ATOM 949 HA MET A 68 20.100 0.035 -3.047 1.00 0.00 H ATOM 950 HB2 MET A 68 17.789 -1.910 -3.276 1.00 0.00 H ATOM 951 HB3 MET A 68 18.925 -1.870 -1.908 1.00 0.00 H ATOM 952 HG2 MET A 68 18.257 0.598 -1.663 1.00 0.00 H ATOM 953 HG3 MET A 68 17.101 -0.649 -1.140 1.00 0.00 H ATOM 954 HE1 MET A 68 15.370 -1.640 -3.281 1.00 0.00 H ATOM 955 HE2 MET A 68 14.721 -0.832 -1.833 1.00 0.00 H ATOM 956 HE3 MET A 68 14.122 -0.380 -3.448 1.00 0.00 H ATOM 957 H MET A 68 17.900 -0.114 -4.905 1.00 0.00 H ATOM 958 N ASN A 69 20.072 -2.599 -5.051 1.00 2.63 N ATOM 959 CA ASN A 69 20.966 -3.614 -5.546 1.00 3.01 C ATOM 960 C ASN A 69 22.330 -3.051 -6.006 1.00 2.54 C ATOM 961 O ASN A 69 23.365 -3.684 -5.779 1.00 3.32 O ATOM 962 CB ASN A 69 20.325 -4.404 -6.640 1.00 4.52 C ATOM 963 CG ASN A 69 19.222 -5.279 -6.146 1.00 4.09 C ATOM 964 OD1 ASN A 69 19.176 -5.627 -4.968 1.00 6.67 O ATOM 965 ND2 ASN A 69 18.275 -5.589 -7.029 1.00 6.30 N ATOM 966 HA ASN A 69 21.171 -4.276 -4.705 1.00 0.00 H ATOM 967 HB2 ASN A 69 19.918 -3.713 -7.378 1.00 0.00 H ATOM 968 HB3 ASN A 69 21.084 -5.030 -7.110 1.00 0.00 H ATOM 969 HD22 ASN A 69 18.360 -5.271 -8.015 1.00 0.00 H ATOM 970 HD21 ASN A 69 17.451 -6.149 -6.732 1.00 0.00 H ATOM 971 H ASN A 69 19.131 -2.477 -5.476 1.00 0.00 H ATOM 972 N ASN A 70 22.325 -1.911 -6.701 1.00 3.02 N ATOM 973 CA ASN A 70 23.601 -1.308 -7.124 1.00 3.63 C ATOM 974 C ASN A 70 24.397 -0.928 -5.914 1.00 3.04 C ATOM 975 O ASN A 70 25.613 -1.058 -5.916 1.00 3.14 O ATOM 976 CB ASN A 70 23.410 0.008 -7.922 1.00 3.11 C ATOM 977 CG ASN A 70 22.810 -0.195 -9.304 1.00 5.77 C ATOM 978 OD1 ASN A 70 22.580 -1.346 -9.777 1.00 8.65 O ATOM 979 ND2 ASN A 70 22.546 0.927 -9.970 1.00 7.41 N ATOM 980 HA ASN A 70 24.093 -2.053 -7.749 1.00 0.00 H ATOM 981 HB2 ASN A 70 22.750 0.663 -7.353 1.00 0.00 H ATOM 982 HB3 ASN A 70 24.383 0.486 -8.036 1.00 0.00 H ATOM 983 HD22 ASN A 70 22.754 1.850 -9.537 1.00 0.00 H ATOM 984 HD21 ASN A 70 22.132 0.881 -10.923 1.00 0.00 H ATOM 985 H ASN A 70 21.424 -1.451 -6.943 1.00 0.00 H ATOM 986 N ALA A 71 23.712 -0.452 -4.856 1.00 2.44 N ATOM 987 CA ALA A 71 24.420 -0.058 -3.608 1.00 3.20 C ATOM 988 C ALA A 71 25.114 -1.240 -2.966 1.00 2.76 C ATOM 989 O ALA A 71 26.281 -1.133 -2.569 1.00 2.97 O ATOM 990 CB ALA A 71 23.452 0.593 -2.581 1.00 2.00 C ATOM 991 HA ALA A 71 25.171 0.677 -3.897 1.00 0.00 H ATOM 992 HB1 ALA A 71 23.005 1.485 -3.020 1.00 0.00 H ATOM 993 HB2 ALA A 71 22.667 -0.118 -2.322 1.00 0.00 H ATOM 994 HB3 ALA A 71 24.007 0.867 -1.684 1.00 0.00 H ATOM 995 H ALA A 71 22.678 -0.359 -4.912 1.00 0.00 H ATOM 996 N PHE A 72 24.397 -2.361 -2.874 1.00 2.98 N ATOM 997 CA PHE A 72 24.996 -3.563 -2.309 1.00 2.14 C ATOM 998 C PHE A 72 26.165 -3.993 -3.139 1.00 3.06 C ATOM 999 O PHE A 72 27.184 -4.406 -2.584 1.00 3.50 O ATOM 1000 CB PHE A 72 23.982 -4.715 -2.208 1.00 2.47 C ATOM 1001 CG PHE A 72 22.758 -4.408 -1.351 1.00 3.67 C ATOM 1002 CD1 PHE A 72 22.836 -3.767 -0.112 1.00 3.43 C ATOM 1003 CD2 PHE A 72 21.502 -4.847 -1.781 1.00 2.65 C ATOM 1004 CE1 PHE A 72 21.641 -3.555 0.656 1.00 2.00 C ATOM 1005 CE2 PHE A 72 20.365 -4.620 -1.046 1.00 2.68 C ATOM 1006 CZ PHE A 72 20.417 -3.998 0.137 1.00 2.85 C ATOM 1007 HA PHE A 72 25.329 -3.320 -1.300 1.00 0.00 H ATOM 1008 HB2 PHE A 72 23.641 -4.958 -3.214 1.00 0.00 H ATOM 1009 HB3 PHE A 72 24.490 -5.579 -1.780 1.00 0.00 H ATOM 1010 HD2 PHE A 72 21.424 -5.384 -2.726 1.00 0.00 H ATOM 1011 HE2 PHE A 72 19.402 -4.953 -1.434 1.00 0.00 H ATOM 1012 HZ PHE A 72 19.499 -3.834 0.702 1.00 0.00 H ATOM 1013 HE1 PHE A 72 21.685 -3.058 1.625 1.00 0.00 H ATOM 1014 HD1 PHE A 72 23.799 -3.429 0.270 1.00 0.00 H ATOM 1015 H PHE A 72 23.411 -2.377 -3.205 1.00 0.00 H ATOM 1016 N GLU A 73 26.043 -3.951 -4.467 1.00 2.51 N ATOM 1017 CA GLU A 73 27.157 -4.355 -5.324 1.00 3.72 C ATOM 1018 C GLU A 73 28.356 -3.409 -5.184 1.00 2.42 C ATOM 1019 O GLU A 73 29.475 -3.870 -5.170 1.00 2.68 O ATOM 1020 CB GLU A 73 26.688 -4.410 -6.791 1.00 5.38 C ATOM 1021 CG GLU A 73 25.742 -5.615 -6.978 1.00 10.57 C ATOM 1022 CD GLU A 73 25.348 -5.923 -8.404 1.00 19.10 C ATOM 1023 OE1 GLU A 73 25.663 -5.119 -9.284 1.00 20.93 O ATOM 1024 OE2 GLU A 73 24.689 -6.980 -8.633 1.00 23.38 O ATOM 1025 HA GLU A 73 27.485 -5.345 -5.007 1.00 0.00 H ATOM 1026 HB2 GLU A 73 26.160 -3.490 -7.040 1.00 0.00 H ATOM 1027 HB3 GLU A 73 27.552 -4.520 -7.446 1.00 0.00 H ATOM 1028 HG2 GLU A 73 26.236 -6.496 -6.569 1.00 0.00 H ATOM 1029 HG3 GLU A 73 24.831 -5.417 -6.414 1.00 0.00 H ATOM 1030 H GLU A 73 25.151 -3.629 -4.895 1.00 0.00 H ATOM 1031 N TRP A 74 28.093 -2.103 -5.060 1.00 2.41 N ATOM 1032 CA TRP A 74 29.162 -1.115 -4.901 1.00 2.56 C ATOM 1033 C TRP A 74 29.920 -1.408 -3.619 1.00 2.59 C ATOM 1034 O TRP A 74 31.148 -1.362 -3.580 1.00 3.14 O ATOM 1035 CB TRP A 74 28.582 0.314 -4.862 1.00 4.15 C ATOM 1036 CG TRP A 74 29.672 1.338 -4.714 1.00 3.32 C ATOM 1037 CD1 TRP A 74 30.379 1.940 -5.742 1.00 4.50 C ATOM 1038 CD2 TRP A 74 30.216 1.850 -3.494 1.00 3.95 C ATOM 1039 NE1 TRP A 74 31.319 2.793 -5.221 1.00 5.15 N ATOM 1040 CE2 TRP A 74 31.236 2.769 -3.846 1.00 3.37 C ATOM 1041 CE3 TRP A 74 29.948 1.638 -2.132 1.00 3.36 C ATOM 1042 CZ2 TRP A 74 31.998 3.444 -2.881 1.00 4.94 C ATOM 1043 CZ3 TRP A 74 30.717 2.309 -1.165 1.00 3.78 C ATOM 1044 CH2 TRP A 74 31.719 3.228 -1.555 1.00 4.35 C ATOM 1045 HA TRP A 74 29.840 -1.180 -5.752 1.00 0.00 H ATOM 1046 HB2 TRP A 74 28.039 0.503 -5.788 1.00 0.00 H ATOM 1047 HB3 TRP A 74 27.898 0.398 -4.018 1.00 0.00 H ATOM 1048 HE1 TRP A 74 31.987 3.366 -5.775 1.00 0.00 H ATOM 1049 HD1 TRP A 74 30.213 1.763 -6.805 1.00 0.00 H ATOM 1050 HZ2 TRP A 74 32.795 4.126 -3.178 1.00 0.00 H ATOM 1051 HH2 TRP A 74 32.277 3.772 -0.792 1.00 0.00 H ATOM 1052 HZ3 TRP A 74 30.540 2.120 -0.106 1.00 0.00 H ATOM 1053 HE3 TRP A 74 29.151 0.960 -1.827 1.00 0.00 H ATOM 1054 H TRP A 74 27.104 -1.781 -5.077 1.00 0.00 H ATOM 1055 N ILE A 75 29.207 -1.662 -2.536 1.00 2.00 N ATOM 1056 CA ILE A 75 29.891 -1.894 -1.247 1.00 2.00 C ATOM 1057 C ILE A 75 30.855 -3.037 -1.368 1.00 2.04 C ATOM 1058 O ILE A 75 32.013 -2.925 -0.966 1.00 2.00 O ATOM 1059 CB ILE A 75 28.897 -2.197 -0.105 1.00 2.00 C ATOM 1060 CG1 ILE A 75 28.084 -0.943 0.207 1.00 2.71 C ATOM 1061 CG2 ILE A 75 29.599 -2.722 1.164 1.00 2.00 C ATOM 1062 CD1 ILE A 75 26.770 -1.182 0.969 1.00 2.00 C ATOM 1063 HA ILE A 75 30.423 -0.975 -1.002 1.00 0.00 H ATOM 1064 HB ILE A 75 28.232 -2.992 -0.443 1.00 0.00 H ATOM 1065 HG12 ILE A 75 28.706 -0.280 0.808 1.00 0.00 H ATOM 1066 HG13 ILE A 75 27.842 -0.455 -0.737 1.00 0.00 H ATOM 1067 HD11 ILE A 75 26.123 -1.832 0.380 1.00 0.00 H ATOM 1068 HD12 ILE A 75 26.988 -1.656 1.926 1.00 0.00 H ATOM 1069 HD13 ILE A 75 26.271 -0.228 1.139 1.00 0.00 H ATOM 1070 HG21 ILE A 75 30.132 -3.643 0.928 1.00 0.00 H ATOM 1071 HG22 ILE A 75 30.306 -1.974 1.523 1.00 0.00 H ATOM 1072 HG23 ILE A 75 28.854 -2.919 1.935 1.00 0.00 H ATOM 1073 H ILE A 75 28.169 -1.698 -2.591 1.00 0.00 H ATOM 1074 N VAL A 76 30.379 -4.126 -1.949 1.00 2.41 N ATOM 1075 CA VAL A 76 31.215 -5.313 -2.130 1.00 2.93 C ATOM 1076 C VAL A 76 32.327 -5.099 -3.145 1.00 4.52 C ATOM 1077 O VAL A 76 33.527 -5.456 -2.887 1.00 2.16 O ATOM 1078 CB VAL A 76 30.362 -6.555 -2.490 1.00 2.87 C ATOM 1079 CG1 VAL A 76 31.319 -7.768 -2.746 1.00 4.53 C ATOM 1080 CG2 VAL A 76 29.301 -6.894 -1.370 1.00 5.93 C ATOM 1081 HA VAL A 76 31.698 -5.499 -1.171 1.00 0.00 H ATOM 1082 HB VAL A 76 29.793 -6.337 -3.394 1.00 0.00 H ATOM 1083 HG11 VAL A 76 31.992 -7.530 -3.570 1.00 0.00 H ATOM 1084 HG12 VAL A 76 31.900 -7.967 -1.846 1.00 0.00 H ATOM 1085 HG13 VAL A 76 30.728 -8.648 -3.000 1.00 0.00 H ATOM 1086 HG21 VAL A 76 29.817 -7.097 -0.432 1.00 0.00 H ATOM 1087 HG22 VAL A 76 28.628 -6.046 -1.240 1.00 0.00 H ATOM 1088 HG23 VAL A 76 28.728 -7.772 -1.668 1.00 0.00 H ATOM 1089 H VAL A 76 29.394 -4.139 -2.283 1.00 0.00 H ATOM 1090 N GLN A 77 31.968 -4.595 -4.317 1.00 4.36 N ATOM 1091 CA GLN A 77 32.935 -4.544 -5.438 1.00 6.35 C ATOM 1092 C GLN A 77 33.911 -3.380 -5.402 1.00 6.17 C ATOM 1093 O GLN A 77 35.060 -3.521 -5.881 1.00 5.50 O ATOM 1094 CB GLN A 77 32.189 -4.564 -6.778 1.00 7.63 C ATOM 1095 CG GLN A 77 31.296 -5.782 -6.943 1.00 12.64 C ATOM 1096 CD GLN A 77 32.014 -7.142 -7.000 1.00 19.01 C ATOM 1097 OE1 GLN A 77 33.142 -7.258 -7.468 1.00 25.61 O ATOM 1098 NE2 GLN A 77 31.335 -8.181 -6.525 1.00 23.81 N ATOM 1099 HA GLN A 77 33.551 -5.436 -5.322 1.00 0.00 H ATOM 1100 HB2 GLN A 77 31.571 -3.668 -6.845 1.00 0.00 H ATOM 1101 HB3 GLN A 77 32.923 -4.559 -7.584 1.00 0.00 H ATOM 1102 HG2 GLN A 77 30.604 -5.805 -6.101 1.00 0.00 H ATOM 1103 HG3 GLN A 77 30.735 -5.662 -7.870 1.00 0.00 H ATOM 1104 HE22 GLN A 77 30.380 -8.044 -6.136 1.00 0.00 H ATOM 1105 HE21 GLN A 77 31.758 -9.131 -6.543 1.00 0.00 H ATOM 1106 H GLN A 77 31.002 -4.233 -4.450 1.00 0.00 H ATOM 1107 N GLU A 78 33.487 -2.251 -4.814 1.00 4.89 N ATOM 1108 CA GLU A 78 34.303 -1.046 -4.781 1.00 4.74 C ATOM 1109 C GLU A 78 34.771 -0.599 -3.408 1.00 5.76 C ATOM 1110 O GLU A 78 35.625 0.298 -3.319 1.00 6.70 O ATOM 1111 CB GLU A 78 33.572 0.109 -5.436 1.00 6.15 C ATOM 1112 CG GLU A 78 33.147 -0.108 -6.867 1.00 6.93 C ATOM 1113 CD GLU A 78 34.311 -0.046 -7.837 1.00 16.29 C ATOM 1114 OE1 GLU A 78 35.467 0.246 -7.439 1.00 19.66 O ATOM 1115 OE2 GLU A 78 34.065 -0.314 -9.012 1.00 19.89 O ATOM 1116 HA GLU A 78 35.201 -1.326 -5.331 1.00 0.00 H ATOM 1117 HB2 GLU A 78 32.677 0.314 -4.849 1.00 0.00 H ATOM 1118 HB3 GLU A 78 34.229 0.978 -5.410 1.00 0.00 H ATOM 1119 HG2 GLU A 78 32.677 -1.088 -6.947 1.00 0.00 H ATOM 1120 HG3 GLU A 78 32.425 0.663 -7.138 1.00 0.00 H ATOM 1121 H GLU A 78 32.547 -2.236 -4.369 1.00 0.00 H ATOM 1122 N ASN A 79 34.244 -1.178 -2.342 1.00 4.94 N ATOM 1123 CA ASN A 79 34.683 -0.798 -1.008 1.00 3.50 C ATOM 1124 C ASN A 79 35.008 -1.971 -0.102 1.00 3.08 C ATOM 1125 O ASN A 79 34.976 -1.820 1.126 1.00 2.40 O ATOM 1126 CB ASN A 79 33.662 0.132 -0.325 1.00 3.19 C ATOM 1127 CG ASN A 79 34.293 0.997 0.756 1.00 3.46 C ATOM 1128 OD1 ASN A 79 35.367 1.539 0.532 1.00 3.13 O ATOM 1129 ND2 ASN A 79 33.618 1.186 1.881 1.00 2.00 N ATOM 1130 HA ASN A 79 35.619 -0.261 -1.162 1.00 0.00 H ATOM 1131 HB2 ASN A 79 33.221 0.782 -1.081 1.00 0.00 H ATOM 1132 HB3 ASN A 79 32.881 -0.479 0.127 1.00 0.00 H ATOM 1133 HD22 ASN A 79 32.708 0.704 2.029 1.00 0.00 H ATOM 1134 HD21 ASN A 79 33.998 1.816 2.616 1.00 0.00 H ATOM 1135 H ASN A 79 33.513 -1.908 -2.458 1.00 0.00 H ATOM 1136 N ASN A 80 35.400 -3.124 -0.697 1.00 3.55 N ATOM 1137 CA ASN A 80 35.928 -4.251 0.071 1.00 3.12 C ATOM 1138 C ASN A 80 34.926 -4.772 1.090 1.00 2.69 C ATOM 1139 O ASN A 80 35.319 -5.368 2.078 1.00 2.24 O ATOM 1140 CB ASN A 80 37.222 -3.901 0.737 1.00 4.58 C ATOM 1141 CG ASN A 80 38.416 -4.106 -0.168 1.00 7.58 C ATOM 1142 OD1 ASN A 80 38.948 -5.214 -0.297 1.00 8.16 O ATOM 1143 ND2 ASN A 80 38.837 -3.038 -0.802 1.00 8.35 N ATOM 1144 HA ASN A 80 36.116 -5.053 -0.643 1.00 0.00 H ATOM 1145 HB2 ASN A 80 37.188 -2.854 1.039 1.00 0.00 H ATOM 1146 HB3 ASN A 80 37.341 -4.528 1.620 1.00 0.00 H ATOM 1147 HD22 ASN A 80 38.357 -2.126 -0.661 1.00 0.00 H ATOM 1148 HD21 ASN A 80 39.651 -3.103 -1.446 1.00 0.00 H ATOM 1149 H ASN A 80 35.323 -3.210 -1.731 1.00 0.00 H ATOM 1150 N GLY A 81 33.631 -4.585 0.802 1.00 2.00 N ATOM 1151 CA GLY A 81 32.565 -5.002 1.710 1.00 3.30 C ATOM 1152 C GLY A 81 32.225 -4.042 2.824 1.00 2.42 C ATOM 1153 O GLY A 81 31.288 -4.298 3.622 1.00 2.87 O ATOM 1154 HA3 GLY A 81 32.865 -5.946 2.164 1.00 0.00 H ATOM 1155 HA2 GLY A 81 31.664 -5.156 1.117 1.00 0.00 H ATOM 1156 H GLY A 81 33.376 -4.128 -0.097 1.00 0.00 H ATOM 1157 N ALA A 82 32.973 -2.939 2.945 1.00 2.25 N ATOM 1158 CA ALA A 82 32.880 -2.093 4.139 1.00 2.00 C ATOM 1159 C ALA A 82 31.771 -1.057 4.086 1.00 2.28 C ATOM 1160 O ALA A 82 31.550 -0.443 3.037 1.00 3.51 O ATOM 1161 CB ALA A 82 34.235 -1.390 4.424 1.00 2.00 C ATOM 1162 HA ALA A 82 32.629 -2.774 4.952 1.00 0.00 H ATOM 1163 HB1 ALA A 82 35.007 -2.143 4.585 1.00 0.00 H ATOM 1164 HB2 ALA A 82 34.506 -0.767 3.572 1.00 0.00 H ATOM 1165 HB3 ALA A 82 34.140 -0.768 5.314 1.00 0.00 H ATOM 1166 H ALA A 82 33.629 -2.678 2.182 1.00 0.00 H ATOM 1167 N VAL A 83 31.145 -0.827 5.243 1.00 2.00 N ATOM 1168 CA VAL A 83 30.123 0.233 5.414 1.00 2.29 C ATOM 1169 C VAL A 83 30.523 1.044 6.632 1.00 2.67 C ATOM 1170 O VAL A 83 30.754 0.478 7.729 1.00 3.01 O ATOM 1171 CB VAL A 83 28.713 -0.377 5.579 1.00 2.49 C ATOM 1172 CG1 VAL A 83 27.641 0.728 5.697 1.00 2.53 C ATOM 1173 CG2 VAL A 83 28.431 -1.380 4.420 1.00 2.55 C ATOM 1174 HA VAL A 83 30.078 0.872 4.532 1.00 0.00 H ATOM 1175 HB VAL A 83 28.668 -0.939 6.512 1.00 0.00 H ATOM 1176 HG11 VAL A 83 27.857 1.350 6.566 1.00 0.00 H ATOM 1177 HG12 VAL A 83 27.653 1.342 4.796 1.00 0.00 H ATOM 1178 HG13 VAL A 83 26.659 0.269 5.812 1.00 0.00 H ATOM 1179 HG21 VAL A 83 28.488 -0.856 3.466 1.00 0.00 H ATOM 1180 HG22 VAL A 83 29.174 -2.178 4.443 1.00 0.00 H ATOM 1181 HG23 VAL A 83 27.435 -1.806 4.544 1.00 0.00 H ATOM 1182 H VAL A 83 31.386 -1.420 6.063 1.00 0.00 H ATOM 1183 N TYR A 84 30.672 2.357 6.450 1.00 3.56 N ATOM 1184 CA TYR A 84 31.114 3.191 7.551 1.00 2.78 C ATOM 1185 C TYR A 84 29.991 3.456 8.541 1.00 3.05 C ATOM 1186 O TYR A 84 28.789 3.432 8.201 1.00 2.80 O ATOM 1187 CB TYR A 84 31.675 4.512 7.051 1.00 3.89 C ATOM 1188 CG TYR A 84 32.811 4.335 6.065 1.00 2.00 C ATOM 1189 CD1 TYR A 84 33.940 3.597 6.406 1.00 4.04 C ATOM 1190 CD2 TYR A 84 32.752 4.877 4.793 1.00 3.84 C ATOM 1191 CE1 TYR A 84 34.958 3.416 5.508 1.00 4.97 C ATOM 1192 CE2 TYR A 84 33.793 4.685 3.870 1.00 7.20 C ATOM 1193 CZ TYR A 84 34.884 3.928 4.265 1.00 6.02 C ATOM 1194 OH TYR A 84 35.951 3.746 3.438 1.00 7.61 O ATOM 1195 HA TYR A 84 31.904 2.642 8.063 1.00 0.00 H ATOM 1196 HB3 TYR A 84 32.042 5.080 7.906 1.00 0.00 H ATOM 1197 HB2 TYR A 84 30.874 5.068 6.563 1.00 0.00 H ATOM 1198 HD2 TYR A 84 31.881 5.464 4.502 1.00 0.00 H ATOM 1199 HE2 TYR A 84 33.744 5.119 2.871 1.00 0.00 H ATOM 1200 HE1 TYR A 84 35.841 2.849 5.804 1.00 0.00 H ATOM 1201 HD1 TYR A 84 34.015 3.157 7.401 1.00 0.00 H ATOM 1202 HH TYR A 84 36.626 3.181 3.892 1.00 0.00 H ATOM 1203 H TYR A 84 30.472 2.781 5.522 1.00 0.00 H ATOM 1204 N THR A 85 30.382 3.763 9.762 1.00 2.00 N ATOM 1205 CA THR A 85 29.444 4.231 10.787 1.00 2.24 C ATOM 1206 C THR A 85 28.901 5.621 10.371 1.00 2.61 C ATOM 1207 O THR A 85 29.624 6.446 9.808 1.00 2.00 O ATOM 1208 CB THR A 85 30.098 4.415 12.171 1.00 2.99 C ATOM 1209 OG1 THR A 85 31.162 5.399 12.097 1.00 4.02 O ATOM 1210 CG2 THR A 85 30.670 3.100 12.701 1.00 3.49 C ATOM 1211 HA THR A 85 28.666 3.471 10.863 1.00 0.00 H ATOM 1212 HB THR A 85 29.322 4.758 12.855 1.00 0.00 H ATOM 1213 HG1 THR A 85 31.573 5.507 12.991 1.00 0.00 H ATOM 1214 HG23 THR A 85 29.875 2.357 12.759 1.00 0.00 H ATOM 1215 HG21 THR A 85 31.451 2.747 12.027 1.00 0.00 H ATOM 1216 HG22 THR A 85 31.091 3.262 13.693 1.00 0.00 H ATOM 1217 H THR A 85 31.389 3.670 10.006 1.00 0.00 H ATOM 1218 N GLU A 86 27.658 5.875 10.733 1.00 2.30 N ATOM 1219 CA GLU A 86 27.045 7.169 10.515 1.00 3.22 C ATOM 1220 C GLU A 86 27.805 8.228 11.310 1.00 3.13 C ATOM 1221 O GLU A 86 27.972 9.369 10.836 1.00 3.06 O ATOM 1222 CB GLU A 86 25.587 7.160 10.981 1.00 2.60 C ATOM 1223 CG GLU A 86 24.806 8.381 10.452 1.00 3.02 C ATOM 1224 CD GLU A 86 23.315 8.379 10.755 1.00 5.04 C ATOM 1225 OE1 GLU A 86 22.738 7.396 11.218 1.00 3.31 O ATOM 1226 OE2 GLU A 86 22.704 9.437 10.505 1.00 9.07 O ATOM 1227 HA GLU A 86 27.079 7.394 9.449 1.00 0.00 H ATOM 1228 HB2 GLU A 86 25.107 6.251 10.620 1.00 0.00 H ATOM 1229 HB3 GLU A 86 25.565 7.172 12.071 1.00 0.00 H ATOM 1230 HG2 GLU A 86 25.239 9.277 10.897 1.00 0.00 H ATOM 1231 HG3 GLU A 86 24.930 8.418 9.370 1.00 0.00 H ATOM 1232 H GLU A 86 27.102 5.124 11.189 1.00 0.00 H ATOM 1233 N ASP A 87 28.163 7.886 12.557 1.00 3.43 N ATOM 1234 CA ASP A 87 28.936 8.777 13.394 1.00 4.84 C ATOM 1235 C ASP A 87 30.157 9.328 12.670 1.00 3.99 C ATOM 1236 O ASP A 87 30.457 10.495 12.827 1.00 3.39 O ATOM 1237 CB ASP A 87 29.407 8.085 14.658 1.00 5.43 C ATOM 1238 CG ASP A 87 30.379 8.939 15.434 1.00 8.30 C ATOM 1239 OD1 ASP A 87 29.936 9.963 15.963 1.00 10.71 O ATOM 1240 OD2 ASP A 87 31.558 8.586 15.474 1.00 12.41 O ATOM 1241 HA ASP A 87 28.267 9.599 13.649 1.00 0.00 H ATOM 1242 HB2 ASP A 87 28.543 7.872 15.287 1.00 0.00 H ATOM 1243 HB3 ASP A 87 29.897 7.150 14.387 1.00 0.00 H ATOM 1244 H ASP A 87 27.878 6.958 12.931 1.00 0.00 H ATOM 1245 N SER A 88 30.879 8.461 11.945 1.00 2.93 N ATOM 1246 CA SER A 88 32.120 8.859 11.235 1.00 3.06 C ATOM 1247 C SER A 88 31.930 9.462 9.835 1.00 3.30 C ATOM 1248 O SER A 88 32.878 9.932 9.226 1.00 3.01 O ATOM 1249 CB SER A 88 33.060 7.665 11.152 1.00 3.19 C ATOM 1250 OG SER A 88 32.638 6.745 10.161 1.00 3.98 O ATOM 1251 HA SER A 88 32.540 9.668 11.833 1.00 0.00 H ATOM 1252 HB2 SER A 88 33.081 7.161 12.118 1.00 0.00 H ATOM 1253 HB3 SER A 88 34.062 8.018 10.906 1.00 0.00 H ATOM 1254 HG SER A 88 31.730 6.417 10.382 1.00 0.00 H ATOM 1255 H SER A 88 30.558 7.474 11.878 1.00 0.00 H ATOM 1256 N TYR A 89 30.716 9.372 9.294 1.00 2.77 N ATOM 1257 CA TYR A 89 30.423 9.858 7.975 1.00 2.25 C ATOM 1258 C TYR A 89 28.985 10.365 8.019 1.00 2.24 C ATOM 1259 O TYR A 89 28.077 9.762 7.503 1.00 3.58 O ATOM 1260 CB TYR A 89 30.616 8.768 6.923 1.00 2.26 C ATOM 1261 CG TYR A 89 30.828 9.279 5.497 1.00 2.64 C ATOM 1262 CD1 TYR A 89 31.459 8.470 4.527 1.00 2.00 C ATOM 1263 CD2 TYR A 89 30.472 10.580 5.125 1.00 3.93 C ATOM 1264 CE1 TYR A 89 31.738 8.942 3.271 1.00 4.13 C ATOM 1265 CE2 TYR A 89 30.728 11.077 3.811 1.00 5.27 C ATOM 1266 CZ TYR A 89 31.324 10.238 2.880 1.00 4.86 C ATOM 1267 OH TYR A 89 31.595 10.726 1.627 1.00 4.70 O ATOM 1268 HA TYR A 89 31.104 10.659 7.687 1.00 0.00 H ATOM 1269 HB3 TYR A 89 29.730 8.133 6.927 1.00 0.00 H ATOM 1270 HB2 TYR A 89 31.487 8.176 7.204 1.00 0.00 H ATOM 1271 HD2 TYR A 89 29.988 11.229 5.855 1.00 0.00 H ATOM 1272 HE2 TYR A 89 30.460 12.099 3.544 1.00 0.00 H ATOM 1273 HE1 TYR A 89 32.284 8.314 2.567 1.00 0.00 H ATOM 1274 HD1 TYR A 89 31.731 7.446 4.783 1.00 0.00 H ATOM 1275 HH TYR A 89 32.212 11.497 1.701 1.00 0.00 H ATOM 1276 H TYR A 89 29.952 8.934 9.847 1.00 0.00 H ATOM 1277 N PRO A 90 28.786 11.489 8.685 1.00 3.44 N ATOM 1278 CA PRO A 90 27.442 11.986 8.867 1.00 4.47 C ATOM 1279 C PRO A 90 26.742 12.412 7.607 1.00 3.94 C ATOM 1280 O PRO A 90 27.369 12.791 6.620 1.00 3.17 O ATOM 1281 CB PRO A 90 27.607 13.145 9.857 1.00 5.12 C ATOM 1282 CG PRO A 90 29.034 13.232 10.173 1.00 5.93 C ATOM 1283 CD PRO A 90 29.814 12.312 9.384 1.00 3.39 C ATOM 1284 HA PRO A 90 26.789 11.193 9.231 1.00 0.00 H ATOM 1285 HD3 PRO A 90 30.438 12.846 8.668 1.00 0.00 H ATOM 1286 HD2 PRO A 90 30.444 11.690 10.020 1.00 0.00 H ATOM 1287 HG3 PRO A 90 29.177 13.001 11.229 1.00 0.00 H ATOM 1288 HG2 PRO A 90 29.378 14.247 9.975 1.00 0.00 H ATOM 1289 HB2 PRO A 90 27.265 14.076 9.405 1.00 0.00 H ATOM 1290 HB3 PRO A 90 27.033 12.950 10.763 1.00 0.00 H ATOM 1291 N TYR A 91 25.422 12.281 7.627 1.00 4.03 N ATOM 1292 CA TYR A 91 24.626 12.676 6.519 1.00 3.96 C ATOM 1293 C TYR A 91 24.797 14.155 6.264 1.00 4.11 C ATOM 1294 O TYR A 91 24.786 14.993 7.241 1.00 2.96 O ATOM 1295 CB TYR A 91 23.149 12.406 6.791 1.00 4.73 C ATOM 1296 CG TYR A 91 22.237 12.506 5.554 1.00 3.74 C ATOM 1297 CD1 TYR A 91 22.409 11.664 4.462 1.00 3.78 C ATOM 1298 CD2 TYR A 91 21.196 13.422 5.501 1.00 4.06 C ATOM 1299 CE1 TYR A 91 21.630 11.746 3.343 1.00 4.39 C ATOM 1300 CE2 TYR A 91 20.376 13.479 4.393 1.00 4.60 C ATOM 1301 CZ TYR A 91 20.568 12.628 3.331 1.00 2.00 C ATOM 1302 OH TYR A 91 19.751 12.675 2.220 1.00 2.57 O ATOM 1303 HA TYR A 91 24.949 12.100 5.652 1.00 0.00 H ATOM 1304 HB3 TYR A 91 22.802 13.130 7.528 1.00 0.00 H ATOM 1305 HB2 TYR A 91 23.057 11.400 7.200 1.00 0.00 H ATOM 1306 HD2 TYR A 91 21.025 14.099 6.338 1.00 0.00 H ATOM 1307 HE2 TYR A 91 19.566 14.208 4.359 1.00 0.00 H ATOM 1308 HE1 TYR A 91 21.844 11.125 2.473 1.00 0.00 H ATOM 1309 HD1 TYR A 91 23.195 10.910 4.500 1.00 0.00 H ATOM 1310 HH TYR A 91 20.044 11.991 1.567 1.00 0.00 H ATOM 1311 H TYR A 91 24.962 11.882 8.470 1.00 0.00 H ATOM 1312 N ALA A 92 24.959 14.515 4.984 1.00 2.97 N ATOM 1313 CA ALA A 92 25.258 15.905 4.638 1.00 2.02 C ATOM 1314 C ALA A 92 24.541 16.385 3.358 1.00 3.31 C ATOM 1315 O ALA A 92 24.926 17.395 2.722 1.00 3.50 O ATOM 1316 CB ALA A 92 26.826 16.077 4.512 1.00 3.52 C ATOM 1317 HA ALA A 92 24.874 16.537 5.439 1.00 0.00 H ATOM 1318 HB1 ALA A 92 27.295 15.825 5.463 1.00 0.00 H ATOM 1319 HB2 ALA A 92 27.201 15.414 3.733 1.00 0.00 H ATOM 1320 HB3 ALA A 92 27.057 17.111 4.254 1.00 0.00 H ATOM 1321 H ALA A 92 24.872 13.802 4.232 1.00 0.00 H ATOM 1322 N SER A 93 23.450 15.694 3.042 1.00 2.52 N ATOM 1323 CA SER A 93 22.673 15.925 1.819 1.00 2.41 C ATOM 1324 C SER A 93 21.263 16.413 2.073 1.00 2.69 C ATOM 1325 O SER A 93 20.507 16.489 1.124 1.00 3.50 O ATOM 1326 CB SER A 93 22.578 14.688 0.962 1.00 3.23 C ATOM 1327 OG SER A 93 23.848 14.120 0.780 1.00 4.43 O ATOM 1328 HA SER A 93 23.228 16.708 1.302 1.00 0.00 H ATOM 1329 HB2 SER A 93 22.161 14.955 -0.009 1.00 0.00 H ATOM 1330 HB3 SER A 93 21.926 13.963 1.449 1.00 0.00 H ATOM 1331 HG SER A 93 24.228 13.874 1.661 1.00 0.00 H ATOM 1332 H SER A 93 23.131 14.951 3.696 1.00 0.00 H ATOM 1333 N GLY A 94 20.942 16.769 3.315 1.00 2.76 N ATOM 1334 CA GLY A 94 19.527 17.125 3.694 1.00 3.60 C ATOM 1335 C GLY A 94 18.969 18.317 2.949 1.00 3.65 C ATOM 1336 O GLY A 94 17.736 18.483 2.826 1.00 2.94 O ATOM 1337 HA3 GLY A 94 19.504 17.346 4.761 1.00 0.00 H ATOM 1338 HA2 GLY A 94 18.891 16.264 3.489 1.00 0.00 H ATOM 1339 H GLY A 94 21.685 16.802 4.041 1.00 0.00 H ATOM 1340 N GLU A 95 19.847 19.202 2.487 1.00 3.92 N ATOM 1341 CA GLU A 95 19.389 20.341 1.702 1.00 5.08 C ATOM 1342 C GLU A 95 19.192 20.019 0.223 1.00 5.80 C ATOM 1343 O GLU A 95 18.682 20.886 -0.533 1.00 6.71 O ATOM 1344 CB GLU A 95 20.318 21.540 1.852 1.00 5.27 C ATOM 1345 CG GLU A 95 20.454 21.992 3.288 1.00 7.62 C ATOM 1346 CD GLU A 95 21.516 21.228 4.108 1.00 14.91 C ATOM 1347 OE1 GLU A 95 22.246 20.297 3.619 1.00 11.65 O ATOM 1348 OE2 GLU A 95 21.603 21.574 5.300 1.00 22.11 O ATOM 1349 HA GLU A 95 18.411 20.595 2.110 1.00 0.00 H ATOM 1350 HB2 GLU A 95 21.304 21.267 1.476 1.00 0.00 H ATOM 1351 HB3 GLU A 95 19.921 22.366 1.262 1.00 0.00 H ATOM 1352 HG2 GLU A 95 20.721 23.049 3.288 1.00 0.00 H ATOM 1353 HG3 GLU A 95 19.489 21.862 3.778 1.00 0.00 H ATOM 1354 H GLU A 95 20.861 19.081 2.686 1.00 0.00 H ATOM 1355 N GLY A 96 19.562 18.813 -0.210 1.00 5.32 N ATOM 1356 CA GLY A 96 19.348 18.434 -1.608 1.00 4.94 C ATOM 1357 C GLY A 96 20.614 18.424 -2.471 1.00 6.21 C ATOM 1358 O GLY A 96 20.543 18.084 -3.685 1.00 6.86 O ATOM 1359 HA3 GLY A 96 18.643 19.140 -2.047 1.00 0.00 H ATOM 1360 HA2 GLY A 96 18.917 17.433 -1.626 1.00 0.00 H ATOM 1361 H GLY A 96 20.004 18.139 0.448 1.00 0.00 H ATOM 1362 N ILE A 97 21.773 18.790 -1.896 1.00 4.11 N ATOM 1363 CA ILE A 97 23.024 18.676 -2.662 1.00 3.37 C ATOM 1364 C ILE A 97 23.967 17.752 -1.905 1.00 2.57 C ATOM 1365 O ILE A 97 24.345 18.026 -0.757 1.00 2.93 O ATOM 1366 CB ILE A 97 23.719 20.004 -2.882 1.00 2.96 C ATOM 1367 CG1 ILE A 97 22.813 20.966 -3.693 1.00 3.93 C ATOM 1368 CG2 ILE A 97 25.049 19.831 -3.628 1.00 4.58 C ATOM 1369 CD1 ILE A 97 23.505 22.327 -3.901 1.00 7.08 C ATOM 1370 HA ILE A 97 22.767 18.285 -3.646 1.00 0.00 H ATOM 1371 HB ILE A 97 23.920 20.425 -1.897 1.00 0.00 H ATOM 1372 HG12 ILE A 97 22.599 20.521 -4.665 1.00 0.00 H ATOM 1373 HG13 ILE A 97 21.879 21.119 -3.152 1.00 0.00 H ATOM 1374 HD11 ILE A 97 23.717 22.778 -2.931 1.00 0.00 H ATOM 1375 HD12 ILE A 97 24.437 22.180 -4.446 1.00 0.00 H ATOM 1376 HD13 ILE A 97 22.849 22.983 -4.472 1.00 0.00 H ATOM 1377 HG21 ILE A 97 25.710 19.189 -3.046 1.00 0.00 H ATOM 1378 HG22 ILE A 97 24.862 19.375 -4.600 1.00 0.00 H ATOM 1379 HG23 ILE A 97 25.516 20.806 -3.766 1.00 0.00 H ATOM 1380 H ILE A 97 21.785 19.150 -0.920 1.00 0.00 H ATOM 1381 N SER A 98 24.373 16.711 -2.576 1.00 2.40 N ATOM 1382 CA SER A 98 25.226 15.732 -1.927 1.00 3.07 C ATOM 1383 C SER A 98 26.674 16.204 -2.175 1.00 3.51 C ATOM 1384 O SER A 98 27.061 16.422 -3.320 1.00 3.97 O ATOM 1385 CB SER A 98 24.975 14.314 -2.468 1.00 4.69 C ATOM 1386 OG SER A 98 26.016 13.431 -2.013 1.00 4.33 O ATOM 1387 HA SER A 98 25.017 15.667 -0.859 1.00 0.00 H ATOM 1388 HB2 SER A 98 24.969 14.337 -3.558 1.00 0.00 H ATOM 1389 HB3 SER A 98 24.011 13.954 -2.109 1.00 0.00 H ATOM 1390 HG SER A 98 25.851 12.520 -2.363 1.00 0.00 H ATOM 1391 H SER A 98 24.088 16.583 -3.568 1.00 0.00 H ATOM 1392 N PRO A 99 27.464 16.344 -1.102 1.00 2.68 N ATOM 1393 CA PRO A 99 28.842 16.774 -1.293 1.00 3.18 C ATOM 1394 C PRO A 99 29.747 15.719 -1.953 1.00 2.47 C ATOM 1395 O PRO A 99 29.356 14.544 -2.076 1.00 4.29 O ATOM 1396 CB PRO A 99 29.318 17.043 0.130 1.00 4.07 C ATOM 1397 CG PRO A 99 28.328 16.553 1.038 1.00 6.11 C ATOM 1398 CD PRO A 99 27.131 16.131 0.315 1.00 2.86 C ATOM 1399 HA PRO A 99 28.891 17.628 -1.968 1.00 0.00 H ATOM 1400 HD3 PRO A 99 26.915 15.080 0.507 1.00 0.00 H ATOM 1401 HD2 PRO A 99 26.272 16.736 0.605 1.00 0.00 H ATOM 1402 HG3 PRO A 99 28.063 17.344 1.740 1.00 0.00 H ATOM 1403 HG2 PRO A 99 28.734 15.703 1.586 1.00 0.00 H ATOM 1404 HB2 PRO A 99 30.264 16.531 0.305 1.00 0.00 H ATOM 1405 HB3 PRO A 99 29.454 18.115 0.277 1.00 0.00 H ATOM 1406 N PRO A 100 30.937 16.129 -2.417 1.00 2.00 N ATOM 1407 CA PRO A 100 31.909 15.150 -2.955 1.00 2.00 C ATOM 1408 C PRO A 100 32.247 14.071 -1.944 1.00 2.12 C ATOM 1409 O PRO A 100 32.272 14.326 -0.731 1.00 2.67 O ATOM 1410 CB PRO A 100 33.127 16.006 -3.269 1.00 2.82 C ATOM 1411 CG PRO A 100 32.552 17.313 -3.527 1.00 3.12 C ATOM 1412 CD PRO A 100 31.432 17.495 -2.585 1.00 2.00 C ATOM 1413 HA PRO A 100 31.523 14.611 -3.821 1.00 0.00 H ATOM 1414 HD3 PRO A 100 31.777 17.909 -1.637 1.00 0.00 H ATOM 1415 HD2 PRO A 100 30.664 18.144 -3.006 1.00 0.00 H ATOM 1416 HG3 PRO A 100 32.188 17.365 -4.553 1.00 0.00 H ATOM 1417 HG2 PRO A 100 33.302 18.088 -3.369 1.00 0.00 H ATOM 1418 HB2 PRO A 100 33.811 16.039 -2.421 1.00 0.00 H ATOM 1419 HB3 PRO A 100 33.655 15.630 -4.146 1.00 0.00 H ATOM 1420 N CYS A 101 32.441 12.862 -2.449 1.00 2.00 N ATOM 1421 CA CYS A 101 32.926 11.760 -1.632 1.00 3.15 C ATOM 1422 C CYS A 101 34.198 12.128 -0.865 1.00 2.44 C ATOM 1423 O CYS A 101 35.133 12.763 -1.416 1.00 2.94 O ATOM 1424 CB CYS A 101 33.217 10.582 -2.557 1.00 3.86 C ATOM 1425 SG CYS A 101 33.811 9.082 -1.755 1.00 3.92 S ATOM 1426 HA CYS A 101 32.164 11.510 -0.894 1.00 0.00 H ATOM 1427 HB2 CYS A 101 33.973 10.899 -3.275 1.00 0.00 H ATOM 1428 HB3 CYS A 101 32.296 10.336 -3.086 1.00 0.00 H ATOM 1429 H CYS A 101 32.241 12.696 -3.456 1.00 0.00 H ATOM 1430 N THR A 102 34.252 11.700 0.377 1.00 3.89 N ATOM 1431 CA THR A 102 35.470 11.744 1.155 1.00 6.23 C ATOM 1432 C THR A 102 35.871 10.308 1.568 1.00 6.61 C ATOM 1433 O THR A 102 35.070 9.590 2.124 1.00 6.50 O ATOM 1434 CB THR A 102 35.322 12.645 2.374 1.00 7.35 C ATOM 1435 OG1 THR A 102 34.236 12.222 3.156 1.00 10.65 O ATOM 1436 CG2 THR A 102 35.075 14.127 1.934 1.00 10.16 C ATOM 1437 HA THR A 102 36.262 12.171 0.539 1.00 0.00 H ATOM 1438 HB THR A 102 36.244 12.586 2.953 1.00 0.00 H ATOM 1439 HG1 THR A 102 34.389 11.291 3.456 1.00 0.00 H ATOM 1440 HG23 THR A 102 35.912 14.468 1.325 1.00 0.00 H ATOM 1441 HG21 THR A 102 34.155 14.184 1.353 1.00 0.00 H ATOM 1442 HG22 THR A 102 34.987 14.757 2.819 1.00 0.00 H ATOM 1443 H THR A 102 33.390 11.317 0.815 1.00 0.00 H ATOM 1444 N THR A 103 37.076 9.889 1.195 1.00 8.79 N ATOM 1445 CA THR A 103 37.487 8.534 1.497 1.00 9.71 C ATOM 1446 C THR A 103 38.182 8.480 2.867 1.00 9.15 C ATOM 1447 O THR A 103 38.145 7.439 3.494 1.00 11.75 O ATOM 1448 CB THR A 103 38.393 7.929 0.407 1.00 11.16 C ATOM 1449 OG1 THR A 103 39.544 8.746 0.273 1.00 11.46 O ATOM 1450 CG2 THR A 103 37.665 7.787 -0.955 1.00 13.79 C ATOM 1451 HA THR A 103 36.583 7.926 1.526 1.00 0.00 H ATOM 1452 HB THR A 103 38.675 6.921 0.712 1.00 0.00 H ATOM 1453 HG1 THR A 103 40.136 8.368 -0.425 1.00 0.00 H ATOM 1454 HG23 THR A 103 36.785 7.156 -0.831 1.00 0.00 H ATOM 1455 HG21 THR A 103 37.361 8.773 -1.307 1.00 0.00 H ATOM 1456 HG22 THR A 103 38.340 7.332 -1.680 1.00 0.00 H ATOM 1457 H THR A 103 37.720 10.531 0.689 1.00 0.00 H ATOM 1458 N SER A 104 38.721 9.595 3.356 1.00 8.12 N ATOM 1459 CA SER A 104 39.394 9.630 4.667 1.00 7.84 C ATOM 1460 C SER A 104 38.515 9.970 5.872 1.00 7.69 C ATOM 1461 O SER A 104 37.466 10.624 5.762 1.00 6.71 O ATOM 1462 CB SER A 104 40.594 10.572 4.620 1.00 8.46 C ATOM 1463 OG SER A 104 40.193 11.936 4.661 1.00 9.58 O ATOM 1464 HA SER A 104 39.704 8.598 4.835 1.00 0.00 H ATOM 1465 HB2 SER A 104 41.148 10.394 3.698 1.00 0.00 H ATOM 1466 HB3 SER A 104 41.238 10.367 5.475 1.00 0.00 H ATOM 1467 HG SER A 104 40.995 12.516 4.629 1.00 0.00 H ATOM 1468 H SER A 104 38.665 10.469 2.795 1.00 0.00 H ATOM 1469 N GLY A 105 39.002 9.556 7.041 1.00 6.27 N ATOM 1470 CA GLY A 105 38.442 9.978 8.327 1.00 6.52 C ATOM 1471 C GLY A 105 37.198 9.235 8.737 1.00 6.19 C ATOM 1472 O GLY A 105 36.458 9.707 9.600 1.00 6.23 O ATOM 1473 HA3 GLY A 105 38.200 11.039 8.262 1.00 0.00 H ATOM 1474 HA2 GLY A 105 39.200 9.826 9.096 1.00 0.00 H ATOM 1475 H GLY A 105 39.814 8.906 7.040 1.00 0.00 H ATOM 1476 N HIS A 106 36.962 8.083 8.120 1.00 4.46 N ATOM 1477 CA HIS A 106 35.791 7.301 8.484 1.00 5.15 C ATOM 1478 C HIS A 106 36.217 5.985 9.149 1.00 6.11 C ATOM 1479 O HIS A 106 37.400 5.561 9.095 1.00 7.43 O ATOM 1480 CB HIS A 106 34.918 7.072 7.239 1.00 5.20 C ATOM 1481 CG HIS A 106 34.687 8.300 6.415 1.00 2.11 C ATOM 1482 ND1 HIS A 106 34.068 9.428 6.914 1.00 6.33 N ATOM 1483 CD2 HIS A 106 34.961 8.566 5.112 1.00 2.54 C ATOM 1484 CE1 HIS A 106 33.985 10.340 5.953 1.00 7.45 C ATOM 1485 NE2 HIS A 106 34.551 9.858 4.861 1.00 3.64 N ATOM 1486 HA HIS A 106 35.192 7.846 9.213 1.00 0.00 H ATOM 1487 HB2 HIS A 106 35.406 6.326 6.612 1.00 0.00 H ATOM 1488 HB3 HIS A 106 33.950 6.692 7.566 1.00 0.00 H ATOM 1489 HD2 HIS A 106 35.420 7.884 4.397 1.00 0.00 H ATOM 1490 HE1 HIS A 106 33.526 11.324 6.049 1.00 0.00 H ATOM 1491 H HIS A 106 37.610 7.742 7.381 1.00 0.00 H ATOM 1492 N THR A 107 35.251 5.382 9.831 1.00 5.74 N ATOM 1493 CA THR A 107 35.400 4.169 10.625 1.00 4.72 C ATOM 1494 C THR A 107 34.434 3.113 10.122 1.00 4.85 C ATOM 1495 O THR A 107 33.220 3.390 9.952 1.00 4.76 O ATOM 1496 CB THR A 107 35.065 4.449 12.118 1.00 6.54 C ATOM 1497 OG1 THR A 107 35.965 5.477 12.612 1.00 3.95 O ATOM 1498 CG2 THR A 107 35.191 3.196 12.949 1.00 4.03 C ATOM 1499 HA THR A 107 36.431 3.827 10.535 1.00 0.00 H ATOM 1500 HB THR A 107 34.032 4.790 12.196 1.00 0.00 H ATOM 1501 HG1 THR A 107 35.761 5.664 13.563 1.00 0.00 H ATOM 1502 HG23 THR A 107 34.510 2.437 12.565 1.00 0.00 H ATOM 1503 HG21 THR A 107 36.215 2.827 12.895 1.00 0.00 H ATOM 1504 HG22 THR A 107 34.939 3.422 13.985 1.00 0.00 H ATOM 1505 H THR A 107 34.305 5.813 9.796 1.00 0.00 H ATOM 1506 N VAL A 108 34.955 1.908 9.869 1.00 3.33 N ATOM 1507 CA VAL A 108 34.117 0.787 9.455 1.00 3.09 C ATOM 1508 C VAL A 108 33.192 0.386 10.610 1.00 3.35 C ATOM 1509 O VAL A 108 33.646 0.085 11.714 1.00 5.17 O ATOM 1510 CB VAL A 108 34.961 -0.437 8.948 1.00 3.36 C ATOM 1511 CG1 VAL A 108 34.085 -1.612 8.531 1.00 3.59 C ATOM 1512 CG2 VAL A 108 35.846 -0.012 7.760 1.00 3.96 C ATOM 1513 HA VAL A 108 33.514 1.111 8.607 1.00 0.00 H ATOM 1514 HB VAL A 108 35.582 -0.765 9.782 1.00 0.00 H ATOM 1515 HG11 VAL A 108 33.491 -1.941 9.384 1.00 0.00 H ATOM 1516 HG12 VAL A 108 33.422 -1.301 7.723 1.00 0.00 H ATOM 1517 HG13 VAL A 108 34.717 -2.431 8.189 1.00 0.00 H ATOM 1518 HG21 VAL A 108 35.214 0.349 6.949 1.00 0.00 H ATOM 1519 HG22 VAL A 108 36.521 0.783 8.078 1.00 0.00 H ATOM 1520 HG23 VAL A 108 36.427 -0.868 7.417 1.00 0.00 H ATOM 1521 H VAL A 108 35.980 1.766 9.969 1.00 0.00 H ATOM 1522 N GLY A 109 31.896 0.331 10.302 1.00 3.61 N ATOM 1523 CA GLY A 109 30.852 -0.103 11.225 1.00 3.11 C ATOM 1524 C GLY A 109 30.267 -1.486 10.943 1.00 3.93 C ATOM 1525 O GLY A 109 29.680 -2.092 11.849 1.00 3.72 O ATOM 1526 HA3 GLY A 109 30.040 0.622 11.181 1.00 0.00 H ATOM 1527 HA2 GLY A 109 31.273 -0.114 12.230 1.00 0.00 H ATOM 1528 H GLY A 109 31.611 0.615 9.343 1.00 0.00 H ATOM 1529 N ALA A 110 30.434 -1.984 9.709 1.00 3.18 N ATOM 1530 CA ALA A 110 29.862 -3.288 9.291 1.00 3.89 C ATOM 1531 C ALA A 110 30.502 -3.753 7.983 1.00 3.59 C ATOM 1532 O ALA A 110 31.032 -2.956 7.231 1.00 3.02 O ATOM 1533 CB ALA A 110 28.352 -3.166 9.080 1.00 4.32 C ATOM 1534 HA ALA A 110 30.065 -4.013 10.080 1.00 0.00 H ATOM 1535 HB1 ALA A 110 27.880 -2.853 10.012 1.00 0.00 H ATOM 1536 HB2 ALA A 110 28.153 -2.426 8.305 1.00 0.00 H ATOM 1537 HB3 ALA A 110 27.950 -4.132 8.774 1.00 0.00 H ATOM 1538 H ALA A 110 30.985 -1.435 9.019 1.00 0.00 H ATOM 1539 N THR A 111 30.300 -5.010 7.644 1.00 3.71 N ATOM 1540 CA THR A 111 30.691 -5.507 6.358 1.00 2.83 C ATOM 1541 C THR A 111 29.602 -6.397 5.807 1.00 3.02 C ATOM 1542 O THR A 111 28.817 -7.000 6.578 1.00 2.74 O ATOM 1543 CB THR A 111 31.965 -6.353 6.433 1.00 3.78 C ATOM 1544 OG1 THR A 111 31.774 -7.452 7.321 1.00 3.54 O ATOM 1545 CG2 THR A 111 33.170 -5.477 6.916 1.00 2.00 C ATOM 1546 HA THR A 111 30.868 -4.639 5.723 1.00 0.00 H ATOM 1547 HB THR A 111 32.187 -6.738 5.438 1.00 0.00 H ATOM 1548 HG1 THR A 111 32.604 -7.991 7.361 1.00 0.00 H ATOM 1549 HG23 THR A 111 33.307 -4.640 6.231 1.00 0.00 H ATOM 1550 HG21 THR A 111 32.964 -5.098 7.917 1.00 0.00 H ATOM 1551 HG22 THR A 111 34.075 -6.085 6.935 1.00 0.00 H ATOM 1552 H THR A 111 29.848 -5.655 8.323 1.00 0.00 H ATOM 1553 N ILE A 112 29.583 -6.478 4.490 1.00 2.65 N ATOM 1554 CA ILE A 112 28.733 -7.433 3.750 1.00 3.85 C ATOM 1555 C ILE A 112 29.566 -8.202 2.713 1.00 4.13 C ATOM 1556 O ILE A 112 30.645 -7.739 2.311 1.00 3.19 O ATOM 1557 CB ILE A 112 27.455 -6.784 3.130 1.00 3.08 C ATOM 1558 CG1 ILE A 112 27.798 -5.919 1.925 1.00 3.63 C ATOM 1559 CG2 ILE A 112 26.677 -6.015 4.202 1.00 4.21 C ATOM 1560 CD1 ILE A 112 26.590 -5.411 1.039 1.00 2.10 C ATOM 1561 HA ILE A 112 28.351 -8.149 4.478 1.00 0.00 H ATOM 1562 HB ILE A 112 26.806 -7.577 2.760 1.00 0.00 H ATOM 1563 HG12 ILE A 112 28.330 -5.041 2.291 1.00 0.00 H ATOM 1564 HG13 ILE A 112 28.458 -6.499 1.280 1.00 0.00 H ATOM 1565 HD11 ILE A 112 26.048 -6.268 0.640 1.00 0.00 H ATOM 1566 HD12 ILE A 112 25.920 -4.808 1.652 1.00 0.00 H ATOM 1567 HD13 ILE A 112 26.973 -4.807 0.216 1.00 0.00 H ATOM 1568 HG21 ILE A 112 26.380 -6.701 4.995 1.00 0.00 H ATOM 1569 HG22 ILE A 112 27.310 -5.231 4.616 1.00 0.00 H ATOM 1570 HG23 ILE A 112 25.789 -5.568 3.755 1.00 0.00 H ATOM 1571 H ILE A 112 30.197 -5.838 3.946 1.00 0.00 H ATOM 1572 N THR A 113 29.052 -9.387 2.303 1.00 4.75 N ATOM 1573 CA THR A 113 29.708 -10.228 1.323 1.00 4.35 C ATOM 1574 C THR A 113 28.981 -10.294 -0.031 1.00 5.01 C ATOM 1575 O THR A 113 29.581 -10.692 -1.030 1.00 5.18 O ATOM 1576 CB THR A 113 29.945 -11.606 1.877 1.00 5.61 C ATOM 1577 OG1 THR A 113 28.694 -12.201 2.263 1.00 6.66 O ATOM 1578 CG2 THR A 113 30.870 -11.506 3.140 1.00 4.19 C ATOM 1579 HA THR A 113 30.668 -9.755 1.117 1.00 0.00 H ATOM 1580 HB THR A 113 30.420 -12.220 1.112 1.00 0.00 H ATOM 1581 HG1 THR A 113 28.102 -12.264 1.472 1.00 0.00 H ATOM 1582 HG23 THR A 113 31.822 -11.056 2.857 1.00 0.00 H ATOM 1583 HG21 THR A 113 30.385 -10.889 3.896 1.00 0.00 H ATOM 1584 HG22 THR A 113 31.044 -12.504 3.541 1.00 0.00 H ATOM 1585 H THR A 113 28.149 -9.706 2.709 1.00 0.00 H ATOM 1586 N GLY A 114 27.724 -9.858 -0.049 1.00 5.43 N ATOM 1587 CA GLY A 114 26.902 -9.955 -1.259 1.00 4.51 C ATOM 1588 C GLY A 114 25.501 -9.528 -0.976 1.00 3.62 C ATOM 1589 O GLY A 114 25.235 -8.872 0.043 1.00 2.49 O ATOM 1590 HA3 GLY A 114 26.899 -10.987 -1.609 1.00 0.00 H ATOM 1591 HA2 GLY A 114 27.324 -9.312 -2.032 1.00 0.00 H ATOM 1592 H GLY A 114 27.317 -9.440 0.812 1.00 0.00 H ATOM 1593 N HIS A 115 24.580 -9.906 -1.879 1.00 2.70 N ATOM 1594 CA HIS A 115 23.172 -9.618 -1.653 1.00 2.31 C ATOM 1595 C HIS A 115 22.322 -10.637 -2.406 1.00 2.13 C ATOM 1596 O HIS A 115 22.809 -11.219 -3.398 1.00 2.04 O ATOM 1597 CB HIS A 115 22.823 -8.179 -2.084 1.00 2.25 C ATOM 1598 CG HIS A 115 22.767 -7.977 -3.559 1.00 4.68 C ATOM 1599 ND1 HIS A 115 23.882 -7.752 -4.327 1.00 6.79 N ATOM 1600 CD2 HIS A 115 21.712 -7.948 -4.414 1.00 8.72 C ATOM 1601 CE1 HIS A 115 23.516 -7.613 -5.590 1.00 9.31 C ATOM 1602 NE2 HIS A 115 22.217 -7.744 -5.674 1.00 6.56 N ATOM 1603 HA HIS A 115 22.960 -9.695 -0.587 1.00 0.00 H ATOM 1604 HB2 HIS A 115 21.849 -7.924 -1.667 1.00 0.00 H ATOM 1605 HB3 HIS A 115 23.578 -7.507 -1.676 1.00 0.00 H ATOM 1606 HD2 HIS A 115 20.661 -8.065 -4.149 1.00 0.00 H ATOM 1607 HE1 HIS A 115 24.188 -7.420 -6.426 1.00 0.00 H ATOM 1608 H HIS A 115 24.875 -10.406 -2.742 1.00 0.00 H ATOM 1609 N VAL A 116 21.086 -10.833 -1.925 1.00 3.39 N ATOM 1610 CA VAL A 116 20.146 -11.719 -2.557 1.00 3.70 C ATOM 1611 C VAL A 116 18.973 -10.947 -3.101 1.00 4.37 C ATOM 1612 O VAL A 116 18.567 -9.961 -2.522 1.00 4.34 O ATOM 1613 CB VAL A 116 19.649 -12.841 -1.580 1.00 4.74 C ATOM 1614 CG1 VAL A 116 20.835 -13.691 -1.128 1.00 6.90 C ATOM 1615 CG2 VAL A 116 18.955 -12.223 -0.371 1.00 5.05 C ATOM 1616 HA VAL A 116 20.666 -12.206 -3.382 1.00 0.00 H ATOM 1617 HB VAL A 116 18.933 -13.474 -2.103 1.00 0.00 H ATOM 1618 HG11 VAL A 116 21.304 -14.150 -1.998 1.00 0.00 H ATOM 1619 HG12 VAL A 116 21.559 -13.058 -0.615 1.00 0.00 H ATOM 1620 HG13 VAL A 116 20.485 -14.469 -0.450 1.00 0.00 H ATOM 1621 HG21 VAL A 116 19.655 -11.576 0.157 1.00 0.00 H ATOM 1622 HG22 VAL A 116 18.099 -11.637 -0.705 1.00 0.00 H ATOM 1623 HG23 VAL A 116 18.616 -13.015 0.296 1.00 0.00 H ATOM 1624 H VAL A 116 20.797 -10.326 -1.064 1.00 0.00 H ATOM 1625 N GLU A 117 18.442 -11.435 -4.234 1.00 3.66 N ATOM 1626 CA GLU A 117 17.306 -10.875 -4.872 1.00 5.31 C ATOM 1627 C GLU A 117 16.165 -11.900 -4.599 1.00 5.28 C ATOM 1628 O GLU A 117 16.347 -13.121 -4.828 1.00 8.02 O ATOM 1629 CB GLU A 117 17.687 -10.549 -6.371 1.00 7.12 C ATOM 1630 CG GLU A 117 18.771 -9.401 -6.398 1.00 11.52 C ATOM 1631 CD GLU A 117 19.444 -8.932 -7.782 1.00 18.33 C ATOM 1632 OE1 GLU A 117 18.953 -9.352 -8.841 1.00 12.36 O ATOM 1633 OE2 GLU A 117 20.482 -8.142 -7.779 1.00 17.79 O ATOM 1634 HA GLU A 117 16.954 -9.911 -4.504 1.00 0.00 H ATOM 1635 HB2 GLU A 117 18.091 -11.443 -6.847 1.00 0.00 H ATOM 1636 HB3 GLU A 117 16.798 -10.223 -6.910 1.00 0.00 H ATOM 1637 HG2 GLU A 117 18.299 -8.518 -5.967 1.00 0.00 H ATOM 1638 HG3 GLU A 117 19.586 -9.728 -5.752 1.00 0.00 H ATOM 1639 H GLU A 117 18.888 -12.269 -4.667 1.00 0.00 H ATOM 1640 N LEU A 118 15.072 -11.452 -3.976 1.00 3.16 N ATOM 1641 CA LEU A 118 13.961 -12.310 -3.549 1.00 3.26 C ATOM 1642 C LEU A 118 12.851 -12.403 -4.595 1.00 4.38 C ATOM 1643 O LEU A 118 12.788 -11.573 -5.494 1.00 3.72 O ATOM 1644 CB LEU A 118 13.346 -11.833 -2.223 1.00 3.70 C ATOM 1645 CG LEU A 118 14.293 -11.761 -1.026 1.00 4.81 C ATOM 1646 CD1 LEU A 118 13.493 -11.409 0.224 1.00 5.22 C ATOM 1647 CD2 LEU A 118 15.069 -13.105 -0.812 1.00 7.91 C ATOM 1648 HA LEU A 118 14.399 -13.299 -3.415 1.00 0.00 H ATOM 1649 HB2 LEU A 118 12.939 -10.835 -2.385 1.00 0.00 H ATOM 1650 HB3 LEU A 118 12.537 -12.517 -1.966 1.00 0.00 H ATOM 1651 HG LEU A 118 15.036 -10.989 -1.224 1.00 0.00 H ATOM 1652 HD21 LEU A 118 14.356 -13.911 -0.636 1.00 0.00 H ATOM 1653 HD22 LEU A 118 15.659 -13.328 -1.701 1.00 0.00 H ATOM 1654 HD23 LEU A 118 15.730 -13.008 0.049 1.00 0.00 H ATOM 1655 HD11 LEU A 118 13.006 -10.444 0.083 1.00 0.00 H ATOM 1656 HD12 LEU A 118 12.738 -12.176 0.399 1.00 0.00 H ATOM 1657 HD13 LEU A 118 14.165 -11.356 1.081 1.00 0.00 H ATOM 1658 H LEU A 118 15.004 -10.433 -3.782 1.00 0.00 H ATOM 1659 N PRO A 119 12.054 -13.507 -4.553 1.00 4.80 N ATOM 1660 CA PRO A 119 11.044 -13.695 -5.580 1.00 4.65 C ATOM 1661 C PRO A 119 10.046 -12.551 -5.558 1.00 3.67 C ATOM 1662 O PRO A 119 9.856 -11.923 -4.502 1.00 3.62 O ATOM 1663 CB PRO A 119 10.340 -14.991 -5.151 1.00 5.88 C ATOM 1664 CG PRO A 119 11.402 -15.785 -4.486 1.00 5.84 C ATOM 1665 CD PRO A 119 12.244 -14.747 -3.753 1.00 6.57 C ATOM 1666 HA PRO A 119 11.466 -13.734 -6.584 1.00 0.00 H ATOM 1667 HD3 PRO A 119 11.889 -14.609 -2.732 1.00 0.00 H ATOM 1668 HD2 PRO A 119 13.294 -15.041 -3.735 1.00 0.00 H ATOM 1669 HG3 PRO A 119 12.002 -16.320 -5.222 1.00 0.00 H ATOM 1670 HG2 PRO A 119 10.969 -16.498 -3.784 1.00 0.00 H ATOM 1671 HB2 PRO A 119 9.527 -14.777 -4.458 1.00 0.00 H ATOM 1672 HB3 PRO A 119 9.947 -15.522 -6.018 1.00 0.00 H ATOM 1673 N GLN A 120 9.388 -12.350 -6.684 1.00 2.46 N ATOM 1674 CA GLN A 120 8.306 -11.352 -6.776 1.00 2.95 C ATOM 1675 C GLN A 120 6.978 -11.945 -6.291 1.00 3.63 C ATOM 1676 O GLN A 120 6.046 -12.176 -7.064 1.00 4.99 O ATOM 1677 CB GLN A 120 8.243 -10.890 -8.228 1.00 3.32 C ATOM 1678 CG GLN A 120 9.498 -10.108 -8.654 1.00 2.55 C ATOM 1679 CD GLN A 120 9.643 -9.850 -10.149 1.00 4.14 C ATOM 1680 OE1 GLN A 120 9.152 -10.632 -10.994 1.00 5.02 O ATOM 1681 NE2 GLN A 120 10.305 -8.706 -10.504 1.00 2.00 N ATOM 1682 HA GLN A 120 8.502 -10.496 -6.130 1.00 0.00 H ATOM 1683 HB2 GLN A 120 8.142 -11.766 -8.869 1.00 0.00 H ATOM 1684 HB3 GLN A 120 7.371 -10.247 -8.353 1.00 0.00 H ATOM 1685 HG2 GLN A 120 9.479 -9.143 -8.148 1.00 0.00 H ATOM 1686 HG3 GLN A 120 10.371 -10.672 -8.325 1.00 0.00 H ATOM 1687 HE22 GLN A 120 10.698 -8.083 -9.769 1.00 0.00 H ATOM 1688 HE21 GLN A 120 10.415 -8.459 -11.508 1.00 0.00 H ATOM 1689 H GLN A 120 9.638 -12.908 -7.525 1.00 0.00 H ATOM 1690 N ASP A 121 6.930 -12.217 -4.999 1.00 3.18 N ATOM 1691 CA ASP A 121 5.868 -12.990 -4.360 1.00 3.53 C ATOM 1692 C ASP A 121 5.851 -12.602 -2.890 1.00 3.12 C ATOM 1693 O ASP A 121 6.829 -12.791 -2.183 1.00 3.62 O ATOM 1694 CB ASP A 121 6.175 -14.480 -4.534 1.00 3.04 C ATOM 1695 CG ASP A 121 5.135 -15.389 -3.944 1.00 8.14 C ATOM 1696 OD1 ASP A 121 4.903 -15.400 -2.729 1.00 10.73 O ATOM 1697 OD2 ASP A 121 4.583 -16.171 -4.714 1.00 13.61 O ATOM 1698 HA ASP A 121 4.892 -12.789 -4.803 1.00 0.00 H ATOM 1699 HB2 ASP A 121 6.252 -14.693 -5.600 1.00 0.00 H ATOM 1700 HB3 ASP A 121 7.130 -14.692 -4.053 1.00 0.00 H ATOM 1701 H ASP A 121 7.699 -11.857 -4.398 1.00 0.00 H ATOM 1702 N GLU A 122 4.746 -12.000 -2.460 1.00 2.53 N ATOM 1703 CA GLU A 122 4.659 -11.459 -1.096 1.00 2.32 C ATOM 1704 C GLU A 122 4.796 -12.556 -0.041 1.00 2.00 C ATOM 1705 O GLU A 122 5.382 -12.334 1.017 1.00 2.50 O ATOM 1706 CB GLU A 122 3.303 -10.738 -0.904 1.00 2.00 C ATOM 1707 CG GLU A 122 3.248 -9.468 -1.648 1.00 3.50 C ATOM 1708 CD GLU A 122 1.995 -8.673 -1.393 1.00 2.00 C ATOM 1709 OE1 GLU A 122 1.973 -7.863 -0.417 1.00 2.15 O ATOM 1710 OE2 GLU A 122 1.054 -8.852 -2.169 1.00 3.66 O ATOM 1711 HA GLU A 122 5.483 -10.757 -0.967 1.00 0.00 H ATOM 1712 HB2 GLU A 122 2.504 -11.389 -1.258 1.00 0.00 H ATOM 1713 HB3 GLU A 122 3.160 -10.532 0.157 1.00 0.00 H ATOM 1714 HG2 GLU A 122 4.106 -8.861 -1.358 1.00 0.00 H ATOM 1715 HG3 GLU A 122 3.305 -9.690 -2.714 1.00 0.00 H ATOM 1716 H GLU A 122 3.930 -11.911 -3.099 1.00 0.00 H ATOM 1717 N ALA A 123 4.211 -13.736 -0.287 1.00 2.82 N ATOM 1718 CA ALA A 123 4.311 -14.829 0.701 1.00 2.38 C ATOM 1719 C ALA A 123 5.758 -15.302 0.854 1.00 2.22 C ATOM 1720 O ALA A 123 6.224 -15.534 1.981 1.00 2.16 O ATOM 1721 CB ALA A 123 3.387 -16.000 0.331 1.00 3.11 C ATOM 1722 HA ALA A 123 3.982 -14.436 1.663 1.00 0.00 H ATOM 1723 HB1 ALA A 123 2.355 -15.651 0.301 1.00 0.00 H ATOM 1724 HB2 ALA A 123 3.669 -16.389 -0.648 1.00 0.00 H ATOM 1725 HB3 ALA A 123 3.484 -16.788 1.078 1.00 0.00 H ATOM 1726 H ALA A 123 3.687 -13.882 -1.173 1.00 0.00 H ATOM 1727 N GLN A 124 6.496 -15.376 -0.255 1.00 2.00 N ATOM 1728 CA GLN A 124 7.858 -15.859 -0.205 1.00 2.36 C ATOM 1729 C GLN A 124 8.770 -14.804 0.392 1.00 2.41 C ATOM 1730 O GLN A 124 9.690 -15.160 1.080 1.00 2.80 O ATOM 1731 CB GLN A 124 8.357 -16.248 -1.588 1.00 2.74 C ATOM 1732 CG GLN A 124 7.634 -17.428 -2.186 1.00 4.35 C ATOM 1733 CD GLN A 124 8.392 -17.895 -3.397 1.00 14.61 C ATOM 1734 OE1 GLN A 124 8.154 -17.422 -4.499 1.00 23.34 O ATOM 1735 NE2 GLN A 124 9.369 -18.760 -3.183 1.00 22.10 N ATOM 1736 HA GLN A 124 7.872 -16.747 0.427 1.00 0.00 H ATOM 1737 HB2 GLN A 124 8.229 -15.394 -2.253 1.00 0.00 H ATOM 1738 HB3 GLN A 124 9.416 -16.495 -1.515 1.00 0.00 H ATOM 1739 HG2 GLN A 124 7.579 -18.234 -1.454 1.00 0.00 H ATOM 1740 HG3 GLN A 124 6.626 -17.132 -2.476 1.00 0.00 H ATOM 1741 HE22 GLN A 124 9.532 -19.134 -2.226 1.00 0.00 H ATOM 1742 HE21 GLN A 124 9.975 -19.066 -3.971 1.00 0.00 H ATOM 1743 H GLN A 124 6.087 -15.083 -1.165 1.00 0.00 H ATOM 1744 N ILE A 125 8.494 -13.529 0.155 1.00 2.96 N ATOM 1745 CA ILE A 125 9.246 -12.428 0.784 1.00 2.00 C ATOM 1746 C ILE A 125 9.016 -12.459 2.303 1.00 2.85 C ATOM 1747 O ILE A 125 9.961 -12.344 3.094 1.00 2.00 O ATOM 1748 CB ILE A 125 8.863 -11.028 0.183 1.00 2.52 C ATOM 1749 CG1 ILE A 125 9.303 -10.952 -1.266 1.00 2.83 C ATOM 1750 CG2 ILE A 125 9.488 -9.889 1.051 1.00 2.00 C ATOM 1751 CD1 ILE A 125 8.599 -9.834 -2.053 1.00 3.53 C ATOM 1752 HA ILE A 125 10.306 -12.574 0.574 1.00 0.00 H ATOM 1753 HB ILE A 125 7.781 -10.898 0.203 1.00 0.00 H ATOM 1754 HG12 ILE A 125 10.378 -10.772 -1.293 1.00 0.00 H ATOM 1755 HG13 ILE A 125 9.083 -11.906 -1.746 1.00 0.00 H ATOM 1756 HD11 ILE A 125 7.523 -10.007 -2.043 1.00 0.00 H ATOM 1757 HD12 ILE A 125 8.818 -8.872 -1.590 1.00 0.00 H ATOM 1758 HD13 ILE A 125 8.959 -9.834 -3.082 1.00 0.00 H ATOM 1759 HG21 ILE A 125 9.108 -9.960 2.070 1.00 0.00 H ATOM 1760 HG22 ILE A 125 10.573 -9.993 1.059 1.00 0.00 H ATOM 1761 HG23 ILE A 125 9.218 -8.922 0.628 1.00 0.00 H ATOM 1762 H ILE A 125 7.719 -13.297 -0.498 1.00 0.00 H ATOM 1763 N ALA A 126 7.766 -12.656 2.737 1.00 2.00 N ATOM 1764 CA ALA A 126 7.428 -12.718 4.146 1.00 2.00 C ATOM 1765 C ALA A 126 8.119 -13.891 4.843 1.00 2.18 C ATOM 1766 O ALA A 126 8.648 -13.731 5.954 1.00 2.34 O ATOM 1767 CB ALA A 126 5.853 -12.838 4.324 1.00 2.00 C ATOM 1768 HA ALA A 126 7.780 -11.797 4.611 1.00 0.00 H ATOM 1769 HB1 ALA A 126 5.371 -11.968 3.877 1.00 0.00 H ATOM 1770 HB2 ALA A 126 5.501 -13.744 3.830 1.00 0.00 H ATOM 1771 HB3 ALA A 126 5.611 -12.884 5.386 1.00 0.00 H ATOM 1772 H ALA A 126 7.006 -12.769 2.036 1.00 0.00 H ATOM 1773 N ALA A 127 8.124 -15.058 4.190 1.00 2.00 N ATOM 1774 CA ALA A 127 8.703 -16.285 4.760 1.00 2.00 C ATOM 1775 C ALA A 127 10.185 -16.047 4.933 1.00 2.00 C ATOM 1776 O ALA A 127 10.779 -16.479 5.932 1.00 2.00 O ATOM 1777 CB ALA A 127 8.409 -17.487 3.852 1.00 3.74 C ATOM 1778 HA ALA A 127 8.260 -16.518 5.728 1.00 0.00 H ATOM 1779 HB1 ALA A 127 7.331 -17.614 3.757 1.00 0.00 H ATOM 1780 HB2 ALA A 127 8.844 -17.312 2.868 1.00 0.00 H ATOM 1781 HB3 ALA A 127 8.844 -18.386 4.289 1.00 0.00 H ATOM 1782 H ALA A 127 7.701 -15.100 3.241 1.00 0.00 H ATOM 1783 N TRP A 128 10.808 -15.414 3.947 1.00 2.00 N ATOM 1784 CA TRP A 128 12.253 -15.125 4.025 1.00 2.00 C ATOM 1785 C TRP A 128 12.538 -14.131 5.156 1.00 2.00 C ATOM 1786 O TRP A 128 13.442 -14.356 5.939 1.00 2.21 O ATOM 1787 CB TRP A 128 12.787 -14.555 2.705 1.00 2.98 C ATOM 1788 CG TRP A 128 14.257 -14.485 2.597 1.00 2.00 C ATOM 1789 CD1 TRP A 128 15.069 -15.389 1.949 1.00 2.00 C ATOM 1790 CD2 TRP A 128 15.131 -13.436 3.052 1.00 2.00 C ATOM 1791 NE1 TRP A 128 16.356 -14.994 2.004 1.00 4.93 N ATOM 1792 CE2 TRP A 128 16.438 -13.797 2.654 1.00 2.00 C ATOM 1793 CE3 TRP A 128 14.950 -12.237 3.722 1.00 2.38 C ATOM 1794 CZ2 TRP A 128 17.560 -13.024 2.958 1.00 5.06 C ATOM 1795 CZ3 TRP A 128 16.080 -11.467 4.043 1.00 2.10 C ATOM 1796 CH2 TRP A 128 17.362 -11.858 3.643 1.00 5.30 C ATOM 1797 HA TRP A 128 12.762 -16.068 4.226 1.00 0.00 H ATOM 1798 HB2 TRP A 128 12.419 -15.183 1.893 1.00 0.00 H ATOM 1799 HB3 TRP A 128 12.392 -13.546 2.590 1.00 0.00 H ATOM 1800 HE1 TRP A 128 17.163 -15.520 1.612 1.00 0.00 H ATOM 1801 HD1 TRP A 128 14.719 -16.298 1.460 1.00 0.00 H ATOM 1802 HZ2 TRP A 128 18.560 -13.340 2.659 1.00 0.00 H ATOM 1803 HH2 TRP A 128 18.216 -11.223 3.881 1.00 0.00 H ATOM 1804 HZ3 TRP A 128 15.956 -10.547 4.615 1.00 0.00 H ATOM 1805 HE3 TRP A 128 13.951 -11.898 3.995 1.00 0.00 H ATOM 1806 H TRP A 128 10.270 -15.117 3.108 1.00 0.00 H ATOM 1807 N LEU A 129 11.753 -13.054 5.233 1.00 2.00 N ATOM 1808 CA LEU A 129 11.936 -12.056 6.260 1.00 2.00 C ATOM 1809 C LEU A 129 11.737 -12.632 7.670 1.00 2.01 C ATOM 1810 O LEU A 129 12.431 -12.265 8.594 1.00 2.00 O ATOM 1811 CB LEU A 129 10.956 -10.937 6.021 1.00 2.58 C ATOM 1812 CG LEU A 129 10.892 -9.788 7.034 1.00 2.00 C ATOM 1813 CD1 LEU A 129 10.529 -8.443 6.388 1.00 2.00 C ATOM 1814 CD2 LEU A 129 9.818 -10.164 8.106 1.00 2.00 C ATOM 1815 HA LEU A 129 12.961 -11.690 6.206 1.00 0.00 H ATOM 1816 HB2 LEU A 129 11.198 -10.499 5.053 1.00 0.00 H ATOM 1817 HB3 LEU A 129 9.963 -11.383 5.978 1.00 0.00 H ATOM 1818 HG LEU A 129 11.880 -9.660 7.477 1.00 0.00 H ATOM 1819 HD21 LEU A 129 8.852 -10.297 7.619 1.00 0.00 H ATOM 1820 HD22 LEU A 129 10.108 -11.091 8.600 1.00 0.00 H ATOM 1821 HD23 LEU A 129 9.748 -9.365 8.844 1.00 0.00 H ATOM 1822 HD11 LEU A 129 11.279 -8.186 5.640 1.00 0.00 H ATOM 1823 HD12 LEU A 129 9.552 -8.522 5.912 1.00 0.00 H ATOM 1824 HD13 LEU A 129 10.499 -7.669 7.155 1.00 0.00 H ATOM 1825 H LEU A 129 10.991 -12.931 4.536 1.00 0.00 H ATOM 1826 N ALA A 130 10.832 -13.576 7.816 1.00 2.00 N ATOM 1827 CA ALA A 130 10.609 -14.163 9.140 1.00 2.79 C ATOM 1828 C ALA A 130 11.854 -14.806 9.681 1.00 3.10 C ATOM 1829 O ALA A 130 12.060 -14.815 10.902 1.00 5.51 O ATOM 1830 CB ALA A 130 9.477 -15.219 9.106 1.00 2.15 C ATOM 1831 HA ALA A 130 10.319 -13.341 9.795 1.00 0.00 H ATOM 1832 HB1 ALA A 130 8.552 -14.747 8.776 1.00 0.00 H ATOM 1833 HB2 ALA A 130 9.747 -16.017 8.414 1.00 0.00 H ATOM 1834 HB3 ALA A 130 9.339 -15.634 10.104 1.00 0.00 H ATOM 1835 H ALA A 130 10.279 -13.903 6.998 1.00 0.00 H ATOM 1836 N VAL A 131 12.664 -15.392 8.774 1.00 2.23 N ATOM 1837 CA VAL A 131 13.852 -16.117 9.217 1.00 2.00 C ATOM 1838 C VAL A 131 15.078 -15.234 9.221 1.00 2.16 C ATOM 1839 O VAL A 131 15.874 -15.243 10.166 1.00 2.00 O ATOM 1840 CB VAL A 131 14.091 -17.379 8.357 1.00 2.26 C ATOM 1841 CG1 VAL A 131 15.443 -18.033 8.670 1.00 2.62 C ATOM 1842 CG2 VAL A 131 12.938 -18.363 8.556 1.00 2.31 C ATOM 1843 HA VAL A 131 13.669 -16.434 10.244 1.00 0.00 H ATOM 1844 HB VAL A 131 14.123 -17.081 7.309 1.00 0.00 H ATOM 1845 HG11 VAL A 131 16.244 -17.323 8.467 1.00 0.00 H ATOM 1846 HG12 VAL A 131 15.470 -18.323 9.720 1.00 0.00 H ATOM 1847 HG13 VAL A 131 15.571 -18.916 8.044 1.00 0.00 H ATOM 1848 HG21 VAL A 131 12.881 -18.646 9.607 1.00 0.00 H ATOM 1849 HG22 VAL A 131 12.003 -17.891 8.254 1.00 0.00 H ATOM 1850 HG23 VAL A 131 13.111 -19.251 7.948 1.00 0.00 H ATOM 1851 H VAL A 131 12.442 -15.327 7.760 1.00 0.00 H ATOM 1852 N ASN A 132 15.207 -14.466 8.139 1.00 2.70 N ATOM 1853 CA ASN A 132 16.441 -13.755 7.827 1.00 2.00 C ATOM 1854 C ASN A 132 16.446 -12.268 8.016 1.00 2.85 C ATOM 1855 O ASN A 132 17.492 -11.648 7.845 1.00 3.51 O ATOM 1856 CB ASN A 132 16.855 -14.082 6.391 1.00 2.00 C ATOM 1857 CG ASN A 132 16.963 -15.558 6.161 1.00 2.00 C ATOM 1858 OD1 ASN A 132 17.896 -16.161 6.680 1.00 2.00 O ATOM 1859 ND2 ASN A 132 16.094 -16.136 5.339 1.00 2.00 N ATOM 1860 HA ASN A 132 17.152 -14.116 8.570 1.00 0.00 H ATOM 1861 HB2 ASN A 132 16.111 -13.673 5.708 1.00 0.00 H ATOM 1862 HB3 ASN A 132 17.823 -13.622 6.190 1.00 0.00 H ATOM 1863 HD22 ASN A 132 15.320 -15.579 4.925 1.00 0.00 H ATOM 1864 HD21 ASN A 132 16.188 -17.146 5.109 1.00 0.00 H ATOM 1865 H ASN A 132 14.397 -14.370 7.493 1.00 0.00 H ATOM 1866 N GLY A 133 15.324 -11.694 8.395 1.00 2.08 N ATOM 1867 CA GLY A 133 15.279 -10.302 8.767 1.00 2.35 C ATOM 1868 C GLY A 133 14.777 -9.307 7.716 1.00 2.00 C ATOM 1869 O GLY A 133 14.321 -9.667 6.634 1.00 2.08 O ATOM 1870 HA3 GLY A 133 16.291 -10.004 9.043 1.00 0.00 H ATOM 1871 HA2 GLY A 133 14.627 -10.217 9.636 1.00 0.00 H ATOM 1872 H GLY A 133 14.450 -12.257 8.427 1.00 0.00 H ATOM 1873 N PRO A 134 14.898 -8.039 8.026 1.00 2.70 N ATOM 1874 CA PRO A 134 14.300 -6.990 7.185 1.00 2.67 C ATOM 1875 C PRO A 134 14.871 -6.981 5.758 1.00 3.41 C ATOM 1876 O PRO A 134 16.032 -7.351 5.536 1.00 2.36 O ATOM 1877 CB PRO A 134 14.669 -5.692 7.941 1.00 2.30 C ATOM 1878 CG PRO A 134 14.659 -6.159 9.389 1.00 3.29 C ATOM 1879 CD PRO A 134 15.379 -7.511 9.319 1.00 3.57 C ATOM 1880 HA PRO A 134 13.228 -7.129 7.046 1.00 0.00 H ATOM 1881 HD3 PRO A 134 16.462 -7.386 9.319 1.00 0.00 H ATOM 1882 HD2 PRO A 134 15.089 -8.159 10.146 1.00 0.00 H ATOM 1883 HG3 PRO A 134 13.639 -6.276 9.756 1.00 0.00 H ATOM 1884 HG2 PRO A 134 15.197 -5.461 10.030 1.00 0.00 H ATOM 1885 HB2 PRO A 134 15.654 -5.328 7.648 1.00 0.00 H ATOM 1886 HB3 PRO A 134 13.929 -4.910 7.771 1.00 0.00 H ATOM 1887 N VAL A 135 14.055 -6.515 4.819 1.00 2.89 N ATOM 1888 CA VAL A 135 14.269 -6.644 3.380 1.00 2.02 C ATOM 1889 C VAL A 135 14.061 -5.269 2.749 1.00 2.00 C ATOM 1890 O VAL A 135 13.059 -4.578 2.998 1.00 2.00 O ATOM 1891 CB VAL A 135 13.200 -7.647 2.784 1.00 2.91 C ATOM 1892 CG1 VAL A 135 13.117 -7.629 1.245 1.00 2.93 C ATOM 1893 CG2 VAL A 135 13.463 -9.088 3.305 1.00 2.00 C ATOM 1894 HA VAL A 135 15.273 -7.016 3.175 1.00 0.00 H ATOM 1895 HB VAL A 135 12.228 -7.301 3.136 1.00 0.00 H ATOM 1896 HG11 VAL A 135 12.844 -6.629 0.909 1.00 0.00 H ATOM 1897 HG12 VAL A 135 14.086 -7.903 0.827 1.00 0.00 H ATOM 1898 HG13 VAL A 135 12.362 -8.343 0.915 1.00 0.00 H ATOM 1899 HG21 VAL A 135 14.460 -9.407 3.000 1.00 0.00 H ATOM 1900 HG22 VAL A 135 13.394 -9.098 4.393 1.00 0.00 H ATOM 1901 HG23 VAL A 135 12.719 -9.766 2.886 1.00 0.00 H ATOM 1902 H VAL A 135 13.196 -6.019 5.133 1.00 0.00 H ATOM 1903 N ALA A 136 14.992 -4.879 1.906 1.00 2.70 N ATOM 1904 CA ALA A 136 14.845 -3.645 1.162 1.00 2.02 C ATOM 1905 C ALA A 136 13.831 -3.845 0.014 1.00 2.00 C ATOM 1906 O ALA A 136 13.890 -4.833 -0.695 1.00 2.19 O ATOM 1907 CB ALA A 136 16.195 -3.267 0.602 1.00 3.29 C ATOM 1908 HA ALA A 136 14.477 -2.852 1.813 1.00 0.00 H ATOM 1909 HB1 ALA A 136 16.901 -3.129 1.421 1.00 0.00 H ATOM 1910 HB2 ALA A 136 16.550 -4.061 -0.055 1.00 0.00 H ATOM 1911 HB3 ALA A 136 16.106 -2.339 0.037 1.00 0.00 H ATOM 1912 H ALA A 136 15.842 -5.463 1.772 1.00 0.00 H ATOM 1913 N VAL A 137 12.935 -2.884 -0.206 1.00 2.00 N ATOM 1914 CA VAL A 137 11.979 -2.952 -1.281 1.00 2.35 C ATOM 1915 C VAL A 137 11.837 -1.625 -1.983 1.00 2.98 C ATOM 1916 O VAL A 137 11.951 -0.569 -1.331 1.00 2.88 O ATOM 1917 CB VAL A 137 10.577 -3.419 -0.795 1.00 3.04 C ATOM 1918 CG1 VAL A 137 10.660 -4.882 -0.346 1.00 2.00 C ATOM 1919 CG2 VAL A 137 10.090 -2.508 0.352 1.00 2.99 C ATOM 1920 HA VAL A 137 12.370 -3.691 -1.980 1.00 0.00 H ATOM 1921 HB VAL A 137 9.857 -3.347 -1.610 1.00 0.00 H ATOM 1922 HG11 VAL A 137 10.982 -5.500 -1.184 1.00 0.00 H ATOM 1923 HG12 VAL A 137 11.378 -4.970 0.469 1.00 0.00 H ATOM 1924 HG13 VAL A 137 9.679 -5.212 -0.005 1.00 0.00 H ATOM 1925 HG21 VAL A 137 10.795 -2.561 1.181 1.00 0.00 H ATOM 1926 HG22 VAL A 137 10.024 -1.480 -0.005 1.00 0.00 H ATOM 1927 HG23 VAL A 137 9.108 -2.841 0.687 1.00 0.00 H ATOM 1928 H VAL A 137 12.926 -2.055 0.421 1.00 0.00 H ATOM 1929 N ALA A 138 11.514 -1.692 -3.285 1.00 2.96 N ATOM 1930 CA ALA A 138 11.038 -0.546 -4.042 1.00 2.00 C ATOM 1931 C ALA A 138 9.538 -0.512 -4.029 1.00 2.75 C ATOM 1932 O ALA A 138 8.864 -1.551 -4.134 1.00 2.92 O ATOM 1933 CB ALA A 138 11.498 -0.600 -5.468 1.00 3.08 C ATOM 1934 HA ALA A 138 11.446 0.349 -3.571 1.00 0.00 H ATOM 1935 HB1 ALA A 138 12.588 -0.605 -5.497 1.00 0.00 H ATOM 1936 HB2 ALA A 138 11.117 -1.507 -5.937 1.00 0.00 H ATOM 1937 HB3 ALA A 138 11.123 0.273 -6.003 1.00 0.00 H ATOM 1938 H ALA A 138 11.609 -2.605 -3.774 1.00 0.00 H ATOM 1939 N VAL A 139 9.006 0.686 -3.937 1.00 3.47 N ATOM 1940 CA VAL A 139 7.553 0.892 -3.964 1.00 2.00 C ATOM 1941 C VAL A 139 7.174 2.126 -4.782 1.00 2.32 C ATOM 1942 O VAL A 139 8.013 2.965 -5.054 1.00 2.00 O ATOM 1943 CB VAL A 139 6.979 1.106 -2.522 1.00 3.25 C ATOM 1944 CG1 VAL A 139 7.175 -0.155 -1.652 1.00 2.22 C ATOM 1945 CG2 VAL A 139 7.572 2.387 -1.821 1.00 2.97 C ATOM 1946 HA VAL A 139 7.133 -0.007 -4.415 1.00 0.00 H ATOM 1947 HB VAL A 139 5.908 1.279 -2.630 1.00 0.00 H ATOM 1948 HG11 VAL A 139 6.657 -0.997 -2.112 1.00 0.00 H ATOM 1949 HG12 VAL A 139 8.239 -0.380 -1.574 1.00 0.00 H ATOM 1950 HG13 VAL A 139 6.767 0.024 -0.657 1.00 0.00 H ATOM 1951 HG21 VAL A 139 8.654 2.288 -1.741 1.00 0.00 H ATOM 1952 HG22 VAL A 139 7.330 3.269 -2.414 1.00 0.00 H ATOM 1953 HG23 VAL A 139 7.140 2.487 -0.825 1.00 0.00 H ATOM 1954 H VAL A 139 9.632 1.511 -3.842 1.00 0.00 H ATOM 1955 N ASP A 140 5.887 2.211 -5.143 1.00 2.66 N ATOM 1956 CA ASP A 140 5.249 3.452 -5.570 1.00 2.00 C ATOM 1957 C ASP A 140 4.778 4.146 -4.269 1.00 2.21 C ATOM 1958 O ASP A 140 3.844 3.701 -3.618 1.00 2.85 O ATOM 1959 CB ASP A 140 4.087 3.181 -6.520 1.00 2.77 C ATOM 1960 CG ASP A 140 3.479 4.448 -7.110 1.00 2.52 C ATOM 1961 OD1 ASP A 140 2.840 4.341 -8.175 1.00 2.35 O ATOM 1962 OD2 ASP A 140 3.652 5.551 -6.515 1.00 4.52 O ATOM 1963 HA ASP A 140 5.937 4.086 -6.128 1.00 0.00 H ATOM 1964 HB2 ASP A 140 4.447 2.557 -7.338 1.00 0.00 H ATOM 1965 HB3 ASP A 140 3.310 2.647 -5.973 1.00 0.00 H ATOM 1966 H ASP A 140 5.311 1.345 -5.118 1.00 0.00 H ATOM 1967 N ALA A 141 5.488 5.218 -3.886 1.00 2.00 N ATOM 1968 CA ALA A 141 5.134 6.067 -2.743 1.00 2.93 C ATOM 1969 C ALA A 141 4.550 7.400 -3.157 1.00 2.94 C ATOM 1970 O ALA A 141 4.472 8.356 -2.348 1.00 4.24 O ATOM 1971 CB ALA A 141 6.425 6.280 -1.831 1.00 2.00 C ATOM 1972 HA ALA A 141 4.354 5.556 -2.179 1.00 0.00 H ATOM 1973 HB1 ALA A 141 6.780 5.313 -1.474 1.00 0.00 H ATOM 1974 HB2 ALA A 141 7.207 6.762 -2.418 1.00 0.00 H ATOM 1975 HB3 ALA A 141 6.167 6.910 -0.980 1.00 0.00 H ATOM 1976 H ALA A 141 6.339 5.461 -4.431 1.00 0.00 H ATOM 1977 N SER A 142 4.110 7.499 -4.403 1.00 3.66 N ATOM 1978 CA SER A 142 3.532 8.763 -4.915 1.00 4.54 C ATOM 1979 C SER A 142 2.324 9.187 -4.093 1.00 4.22 C ATOM 1980 O SER A 142 2.109 10.414 -3.931 1.00 4.70 O ATOM 1981 CB SER A 142 3.164 8.644 -6.408 1.00 4.89 C ATOM 1982 OG SER A 142 2.161 7.684 -6.651 1.00 4.35 O ATOM 1983 HA SER A 142 4.294 9.536 -4.818 1.00 0.00 H ATOM 1984 HB2 SER A 142 4.057 8.363 -6.965 1.00 0.00 H ATOM 1985 HB3 SER A 142 2.810 9.614 -6.758 1.00 0.00 H ATOM 1986 HG SER A 142 2.475 6.796 -6.346 1.00 0.00 H ATOM 1987 H SER A 142 4.172 6.674 -5.033 1.00 0.00 H ATOM 1988 N SER A 143 1.581 8.220 -3.533 1.00 3.81 N ATOM 1989 CA SER A 143 0.402 8.528 -2.719 1.00 3.97 C ATOM 1990 C SER A 143 0.638 8.605 -1.213 1.00 4.74 C ATOM 1991 O SER A 143 -0.332 8.612 -0.431 1.00 6.08 O ATOM 1992 CB SER A 143 -0.763 7.556 -3.015 1.00 5.04 C ATOM 1993 OG SER A 143 -0.475 6.240 -2.610 1.00 5.19 O ATOM 1994 HA SER A 143 0.138 9.540 -3.027 1.00 0.00 H ATOM 1995 HB2 SER A 143 -0.958 7.558 -4.087 1.00 0.00 H ATOM 1996 HB3 SER A 143 -1.651 7.900 -2.484 1.00 0.00 H ATOM 1997 HG SER A 143 0.326 5.915 -3.092 1.00 0.00 H ATOM 1998 H SER A 143 1.849 7.226 -3.681 1.00 0.00 H ATOM 1999 N TRP A 144 1.904 8.663 -0.797 1.00 4.12 N ATOM 2000 CA TRP A 144 2.257 8.540 0.621 1.00 3.86 C ATOM 2001 C TRP A 144 2.479 9.855 1.324 1.00 5.09 C ATOM 2002 O TRP A 144 2.727 9.857 2.531 1.00 4.31 O ATOM 2003 CB TRP A 144 3.548 7.740 0.725 1.00 3.66 C ATOM 2004 CG TRP A 144 3.431 6.247 0.476 1.00 4.01 C ATOM 2005 CD1 TRP A 144 2.435 5.559 -0.166 1.00 5.87 C ATOM 2006 CD2 TRP A 144 4.360 5.281 0.919 1.00 4.38 C ATOM 2007 NE1 TRP A 144 2.710 4.204 -0.164 1.00 6.83 N ATOM 2008 CE2 TRP A 144 3.890 4.000 0.513 1.00 4.37 C ATOM 2009 CE3 TRP A 144 5.552 5.361 1.635 1.00 6.66 C ATOM 2010 CZ2 TRP A 144 4.593 2.833 0.780 1.00 4.70 C ATOM 2011 CZ3 TRP A 144 6.255 4.194 1.869 1.00 5.27 C ATOM 2012 CH2 TRP A 144 5.752 2.946 1.497 1.00 5.97 C ATOM 2013 HA TRP A 144 1.409 8.056 1.107 1.00 0.00 H ATOM 2014 HB2 TRP A 144 4.251 8.145 -0.003 1.00 0.00 H ATOM 2015 HB3 TRP A 144 3.947 7.880 1.730 1.00 0.00 H ATOM 2016 HE1 TRP A 144 2.124 3.464 -0.601 1.00 0.00 H ATOM 2017 HD1 TRP A 144 1.552 6.015 -0.614 1.00 0.00 H ATOM 2018 HZ2 TRP A 144 4.235 1.864 0.432 1.00 0.00 H ATOM 2019 HH2 TRP A 144 6.293 2.044 1.784 1.00 0.00 H ATOM 2020 HZ3 TRP A 144 7.228 4.250 2.357 1.00 0.00 H ATOM 2021 HE3 TRP A 144 5.921 6.319 2.001 1.00 0.00 H ATOM 2022 H TRP A 144 2.661 8.799 -1.497 1.00 0.00 H ATOM 2023 N MET A 145 2.453 10.962 0.597 1.00 6.53 N ATOM 2024 CA MET A 145 2.882 12.254 1.173 1.00 8.48 C ATOM 2025 C MET A 145 2.085 12.612 2.463 1.00 7.65 C ATOM 2026 O MET A 145 2.663 13.069 3.471 1.00 8.75 O ATOM 2027 CB MET A 145 2.695 13.438 0.207 1.00 11.23 C ATOM 2028 CG MET A 145 3.121 13.330 -1.215 1.00 17.19 C ATOM 2029 SD MET A 145 4.887 13.218 -1.261 1.00 27.58 S ATOM 2030 CE MET A 145 5.017 11.437 -1.320 1.00 26.68 C ATOM 2031 HA MET A 145 3.941 12.111 1.390 1.00 0.00 H ATOM 2032 HB2 MET A 145 1.629 13.667 0.197 1.00 0.00 H ATOM 2033 HB3 MET A 145 3.242 14.278 0.634 1.00 0.00 H ATOM 2034 HG2 MET A 145 2.793 14.211 -1.766 1.00 0.00 H ATOM 2035 HG3 MET A 145 2.683 12.439 -1.664 1.00 0.00 H ATOM 2036 HE1 MET A 145 4.552 11.010 -0.431 1.00 0.00 H ATOM 2037 HE2 MET A 145 4.509 11.066 -2.210 1.00 0.00 H ATOM 2038 HE3 MET A 145 6.068 11.152 -1.354 1.00 0.00 H ATOM 2039 H MET A 145 2.127 10.922 -0.390 1.00 0.00 H ATOM 2040 N THR A 146 0.777 12.387 2.417 1.00 5.45 N ATOM 2041 CA THR A 146 -0.123 12.773 3.485 1.00 5.37 C ATOM 2042 C THR A 146 -0.378 11.731 4.575 1.00 3.41 C ATOM 2043 O THR A 146 -1.202 11.992 5.483 1.00 3.91 O ATOM 2044 CB THR A 146 -1.487 13.118 2.922 1.00 4.28 C ATOM 2045 OG1 THR A 146 -1.984 11.961 2.210 1.00 8.04 O ATOM 2046 CG2 THR A 146 -1.433 14.359 2.003 1.00 8.08 C ATOM 2047 HA THR A 146 0.397 13.613 3.947 1.00 0.00 H ATOM 2048 HB THR A 146 -2.162 13.374 3.739 1.00 0.00 H ATOM 2049 HG1 THR A 146 -2.055 11.196 2.835 1.00 0.00 H ATOM 2050 HG23 THR A 146 -1.055 15.211 2.568 1.00 0.00 H ATOM 2051 HG21 THR A 146 -0.771 14.157 1.161 1.00 0.00 H ATOM 2052 HG22 THR A 146 -2.435 14.581 1.635 1.00 0.00 H ATOM 2053 H THR A 146 0.382 11.914 1.579 1.00 0.00 H ATOM 2054 N TYR A 147 0.331 10.592 4.506 1.00 4.88 N ATOM 2055 CA TYR A 147 0.032 9.431 5.370 1.00 3.65 C ATOM 2056 C TYR A 147 0.318 9.849 6.805 1.00 4.04 C ATOM 2057 O TYR A 147 1.413 10.317 7.115 1.00 2.53 O ATOM 2058 CB TYR A 147 0.920 8.273 4.993 1.00 2.93 C ATOM 2059 CG TYR A 147 0.765 7.069 5.891 1.00 2.37 C ATOM 2060 CD1 TYR A 147 1.729 6.790 6.868 1.00 2.00 C ATOM 2061 CD2 TYR A 147 -0.339 6.251 5.830 1.00 2.84 C ATOM 2062 CE1 TYR A 147 1.628 5.730 7.655 1.00 2.78 C ATOM 2063 CE2 TYR A 147 -0.449 5.145 6.662 1.00 2.91 C ATOM 2064 CZ TYR A 147 0.534 4.921 7.599 1.00 2.30 C ATOM 2065 OH TYR A 147 0.470 3.823 8.436 1.00 3.44 O ATOM 2066 HA TYR A 147 -1.007 9.121 5.255 1.00 0.00 H ATOM 2067 HB3 TYR A 147 1.957 8.605 5.039 1.00 0.00 H ATOM 2068 HB2 TYR A 147 0.681 7.974 3.972 1.00 0.00 H ATOM 2069 HD2 TYR A 147 -1.136 6.473 5.121 1.00 0.00 H ATOM 2070 HE2 TYR A 147 -1.298 4.467 6.575 1.00 0.00 H ATOM 2071 HE1 TYR A 147 2.431 5.502 8.356 1.00 0.00 H ATOM 2072 HD1 TYR A 147 2.581 7.460 6.983 1.00 0.00 H ATOM 2073 HH TYR A 147 -0.361 3.867 8.973 1.00 0.00 H ATOM 2074 H TYR A 147 1.114 10.525 3.824 1.00 0.00 H ATOM 2075 N THR A 148 -0.643 9.613 7.681 1.00 3.58 N ATOM 2076 CA THR A 148 -0.492 9.922 9.121 1.00 4.20 C ATOM 2077 C THR A 148 -0.758 8.712 10.003 1.00 4.46 C ATOM 2078 O THR A 148 -0.835 8.842 11.232 1.00 7.23 O ATOM 2079 CB THR A 148 -1.432 11.095 9.528 1.00 4.72 C ATOM 2080 OG1 THR A 148 -2.811 10.840 9.145 1.00 3.28 O ATOM 2081 CG2 THR A 148 -1.012 12.364 8.798 1.00 4.56 C ATOM 2082 HA THR A 148 0.546 10.218 9.276 1.00 0.00 H ATOM 2083 HB THR A 148 -1.357 11.198 10.611 1.00 0.00 H ATOM 2084 HG1 THR A 148 -3.130 10.016 9.592 1.00 0.00 H ATOM 2085 HG23 THR A 148 0.021 12.602 9.051 1.00 0.00 H ATOM 2086 HG21 THR A 148 -1.097 12.208 7.723 1.00 0.00 H ATOM 2087 HG22 THR A 148 -1.660 13.187 9.100 1.00 0.00 H ATOM 2088 H THR A 148 -1.536 9.196 7.348 1.00 0.00 H ATOM 2089 N GLY A 149 -0.970 7.550 9.397 1.00 4.64 N ATOM 2090 CA GLY A 149 -1.228 6.349 10.148 1.00 3.96 C ATOM 2091 C GLY A 149 -2.345 5.516 9.564 1.00 5.42 C ATOM 2092 O GLY A 149 -3.093 5.975 8.722 1.00 4.75 O ATOM 2093 HA3 GLY A 149 -1.498 6.627 11.167 1.00 0.00 H ATOM 2094 HA2 GLY A 149 -0.319 5.748 10.166 1.00 0.00 H ATOM 2095 H GLY A 149 -0.949 7.506 8.358 1.00 0.00 H ATOM 2096 N GLY A 150 -2.478 4.301 10.085 1.00 5.09 N ATOM 2097 CA GLY A 150 -3.465 3.369 9.624 1.00 6.70 C ATOM 2098 C GLY A 150 -2.891 2.400 8.634 1.00 5.46 C ATOM 2099 O GLY A 150 -1.790 2.561 8.192 1.00 5.96 O ATOM 2100 HA3 GLY A 150 -4.277 3.920 9.150 1.00 0.00 H ATOM 2101 HA2 GLY A 150 -3.854 2.814 10.478 1.00 0.00 H ATOM 2102 H GLY A 150 -1.842 4.015 10.857 1.00 0.00 H ATOM 2103 N VAL A 151 -3.653 1.368 8.298 1.00 5.31 N ATOM 2104 CA VAL A 151 -3.248 0.461 7.229 1.00 5.13 C ATOM 2105 C VAL A 151 -3.661 0.987 5.865 1.00 5.07 C ATOM 2106 O VAL A 151 -4.844 1.164 5.630 1.00 6.37 O ATOM 2107 CB VAL A 151 -3.860 -0.950 7.407 1.00 5.97 C ATOM 2108 CG1 VAL A 151 -3.373 -1.884 6.299 1.00 4.69 C ATOM 2109 CG2 VAL A 151 -3.447 -1.563 8.761 1.00 5.63 C ATOM 2110 HA VAL A 151 -2.161 0.396 7.287 1.00 0.00 H ATOM 2111 HB VAL A 151 -4.944 -0.843 7.365 1.00 0.00 H ATOM 2112 HG11 VAL A 151 -3.674 -1.485 5.331 1.00 0.00 H ATOM 2113 HG12 VAL A 151 -2.286 -1.959 6.340 1.00 0.00 H ATOM 2114 HG13 VAL A 151 -3.812 -2.872 6.439 1.00 0.00 H ATOM 2115 HG21 VAL A 151 -2.361 -1.644 8.806 1.00 0.00 H ATOM 2116 HG22 VAL A 151 -3.799 -0.923 9.570 1.00 0.00 H ATOM 2117 HG23 VAL A 151 -3.890 -2.554 8.860 1.00 0.00 H ATOM 2118 H VAL A 151 -4.548 1.203 8.801 1.00 0.00 H ATOM 2119 N MET A 152 -2.705 1.315 5.001 1.00 4.11 N ATOM 2120 CA MET A 152 -3.012 1.843 3.661 1.00 4.12 C ATOM 2121 C MET A 152 -3.608 0.751 2.790 1.00 4.67 C ATOM 2122 O MET A 152 -3.036 -0.325 2.615 1.00 5.13 O ATOM 2123 CB MET A 152 -1.753 2.404 3.016 1.00 5.17 C ATOM 2124 CG MET A 152 -2.003 3.062 1.736 1.00 4.08 C ATOM 2125 SD MET A 152 -0.554 3.865 1.075 1.00 5.72 S ATOM 2126 CE MET A 152 -0.543 5.404 2.010 1.00 8.44 C ATOM 2127 HA MET A 152 -3.741 2.647 3.760 1.00 0.00 H ATOM 2128 HB2 MET A 152 -1.309 3.130 3.697 1.00 0.00 H ATOM 2129 HB3 MET A 152 -1.053 1.585 2.853 1.00 0.00 H ATOM 2130 HG2 MET A 152 -2.783 3.811 1.876 1.00 0.00 H ATOM 2131 HG3 MET A 152 -2.343 2.314 1.020 1.00 0.00 H ATOM 2132 HE1 MET A 152 -1.466 5.951 1.818 1.00 0.00 H ATOM 2133 HE2 MET A 152 -0.466 5.181 3.074 1.00 0.00 H ATOM 2134 HE3 MET A 152 0.310 6.009 1.702 1.00 0.00 H ATOM 2135 H MET A 152 -1.710 1.195 5.280 1.00 0.00 H ATOM 2136 N THR A 153 -4.839 0.983 2.361 1.00 5.61 N ATOM 2137 CA THR A 153 -5.603 0.021 1.603 1.00 4.58 C ATOM 2138 C THR A 153 -5.845 0.384 0.131 1.00 5.54 C ATOM 2139 O THR A 153 -6.454 -0.397 -0.577 1.00 5.61 O ATOM 2140 CB THR A 153 -6.980 -0.158 2.314 1.00 4.33 C ATOM 2141 OG1 THR A 153 -7.570 1.123 2.543 1.00 3.31 O ATOM 2142 CG2 THR A 153 -6.740 -0.867 3.685 1.00 7.39 C ATOM 2143 HA THR A 153 -5.010 -0.893 1.577 1.00 0.00 H ATOM 2144 HB THR A 153 -7.647 -0.754 1.691 1.00 0.00 H ATOM 2145 HG1 THR A 153 -8.444 1.007 2.994 1.00 0.00 H ATOM 2146 HG23 THR A 153 -6.290 -1.845 3.513 1.00 0.00 H ATOM 2147 HG21 THR A 153 -6.071 -0.260 4.294 1.00 0.00 H ATOM 2148 HG22 THR A 153 -7.692 -0.990 4.201 1.00 0.00 H ATOM 2149 H THR A 153 -5.276 1.901 2.580 1.00 0.00 H ATOM 2150 N SER A 154 -5.427 1.554 -0.331 1.00 5.12 N ATOM 2151 CA SER A 154 -5.676 1.947 -1.744 1.00 6.17 C ATOM 2152 C SER A 154 -4.481 2.654 -2.341 1.00 5.81 C ATOM 2153 O SER A 154 -4.608 3.710 -3.005 1.00 8.51 O ATOM 2154 CB SER A 154 -6.923 2.796 -1.891 1.00 7.01 C ATOM 2155 OG SER A 154 -6.770 4.032 -1.211 1.00 11.69 O ATOM 2156 HA SER A 154 -5.840 1.023 -2.298 1.00 0.00 H ATOM 2157 HB2 SER A 154 -7.774 2.259 -1.471 1.00 0.00 H ATOM 2158 HB3 SER A 154 -7.103 2.989 -2.949 1.00 0.00 H ATOM 2159 HG SER A 154 -6.000 4.524 -1.592 1.00 0.00 H ATOM 2160 H SER A 154 -4.919 2.205 0.302 1.00 0.00 H ATOM 2161 N CYS A 155 -3.310 2.065 -2.097 1.00 4.98 N ATOM 2162 CA CYS A 155 -2.058 2.674 -2.503 1.00 4.06 C ATOM 2163 C CYS A 155 -2.046 2.795 -4.028 1.00 3.48 C ATOM 2164 O CYS A 155 -2.376 1.833 -4.734 1.00 4.69 O ATOM 2165 CB CYS A 155 -0.912 1.790 -2.055 1.00 4.34 C ATOM 2166 SG CYS A 155 0.684 2.440 -2.408 1.00 2.55 S ATOM 2167 HA CYS A 155 -1.952 3.661 -2.053 1.00 0.00 H ATOM 2168 HB2 CYS A 155 -1.007 0.827 -2.556 1.00 0.00 H ATOM 2169 HB3 CYS A 155 -0.992 1.647 -0.977 1.00 0.00 H ATOM 2170 H CYS A 155 -3.294 1.149 -1.605 1.00 0.00 H ATOM 2171 N VAL A 156 -1.600 3.954 -4.529 1.00 2.73 N ATOM 2172 CA VAL A 156 -1.423 4.138 -5.979 1.00 2.52 C ATOM 2173 C VAL A 156 -0.242 3.244 -6.371 1.00 3.92 C ATOM 2174 O VAL A 156 0.859 3.414 -5.834 1.00 3.35 O ATOM 2175 CB VAL A 156 -1.183 5.605 -6.405 1.00 3.84 C ATOM 2176 CG1 VAL A 156 -0.799 5.655 -7.866 1.00 4.55 C ATOM 2177 CG2 VAL A 156 -2.451 6.456 -6.150 1.00 3.70 C ATOM 2178 HA VAL A 156 -2.342 3.864 -6.496 1.00 0.00 H ATOM 2179 HB VAL A 156 -0.369 6.019 -5.810 1.00 0.00 H ATOM 2180 HG11 VAL A 156 0.114 5.079 -8.020 1.00 0.00 H ATOM 2181 HG12 VAL A 156 -1.604 5.231 -8.467 1.00 0.00 H ATOM 2182 HG13 VAL A 156 -0.631 6.691 -8.161 1.00 0.00 H ATOM 2183 HG21 VAL A 156 -3.282 6.050 -6.727 1.00 0.00 H ATOM 2184 HG22 VAL A 156 -2.697 6.430 -5.088 1.00 0.00 H ATOM 2185 HG23 VAL A 156 -2.264 7.485 -6.456 1.00 0.00 H ATOM 2186 H VAL A 156 -1.375 4.737 -3.883 1.00 0.00 H ATOM 2187 N SER A 157 -0.465 2.326 -7.292 1.00 3.09 N ATOM 2188 CA SER A 157 0.490 1.233 -7.528 1.00 3.34 C ATOM 2189 C SER A 157 0.871 1.172 -9.022 1.00 4.07 C ATOM 2190 O SER A 157 0.463 0.250 -9.776 1.00 4.56 O ATOM 2191 CB SER A 157 -0.115 -0.096 -7.045 1.00 4.54 C ATOM 2192 OG SER A 157 -0.567 -0.053 -5.686 1.00 2.81 O ATOM 2193 HA SER A 157 1.403 1.417 -6.962 1.00 0.00 H ATOM 2194 HB2 SER A 157 0.643 -0.874 -7.133 1.00 0.00 H ATOM 2195 HB3 SER A 157 -0.963 -0.343 -7.684 1.00 0.00 H ATOM 2196 HG SER A 157 -1.264 0.644 -5.593 1.00 0.00 H ATOM 2197 H SER A 157 -1.333 2.376 -7.862 1.00 0.00 H ATOM 2198 N GLU A 158 1.548 2.209 -9.487 1.00 4.31 N ATOM 2199 CA GLU A 158 1.763 2.410 -10.891 1.00 4.89 C ATOM 2200 C GLU A 158 3.205 2.443 -11.324 1.00 5.16 C ATOM 2201 O GLU A 158 3.514 1.930 -12.403 1.00 5.37 O ATOM 2202 CB GLU A 158 1.082 3.708 -11.362 1.00 5.29 C ATOM 2203 CG GLU A 158 -0.408 3.689 -11.109 1.00 7.28 C ATOM 2204 CD GLU A 158 -1.138 4.873 -11.643 1.00 13.11 C ATOM 2205 OE1 GLU A 158 -2.368 4.809 -11.607 1.00 14.55 O ATOM 2206 OE2 GLU A 158 -0.535 5.851 -12.103 1.00 18.34 O ATOM 2207 HA GLU A 158 1.320 1.531 -11.358 1.00 0.00 H ATOM 2208 HB2 GLU A 158 1.520 4.550 -10.826 1.00 0.00 H ATOM 2209 HB3 GLU A 158 1.256 3.829 -12.431 1.00 0.00 H ATOM 2210 HG2 GLU A 158 -0.822 2.795 -11.575 1.00 0.00 H ATOM 2211 HG3 GLU A 158 -0.571 3.645 -10.032 1.00 0.00 H ATOM 2212 H GLU A 158 1.936 2.900 -8.814 1.00 0.00 H ATOM 2213 N GLN A 159 4.084 3.109 -10.551 1.00 3.93 N ATOM 2214 CA GLN A 159 5.485 3.202 -10.929 1.00 4.51 C ATOM 2215 C GLN A 159 6.328 3.208 -9.671 1.00 4.25 C ATOM 2216 O GLN A 159 6.024 3.944 -8.721 1.00 3.95 O ATOM 2217 CB GLN A 159 5.768 4.477 -11.725 1.00 5.55 C ATOM 2218 CG GLN A 159 5.023 4.668 -13.027 1.00 6.45 C ATOM 2219 CD GLN A 159 5.160 3.504 -14.029 1.00 12.76 C ATOM 2220 OE1 GLN A 159 6.009 2.576 -13.891 1.00 11.60 O ATOM 2221 NE2 GLN A 159 4.285 3.523 -15.039 1.00 13.28 N ATOM 2222 HA GLN A 159 5.730 2.347 -11.559 1.00 0.00 H ATOM 2223 HB2 GLN A 159 5.526 5.324 -11.083 1.00 0.00 H ATOM 2224 HB3 GLN A 159 6.834 4.490 -11.954 1.00 0.00 H ATOM 2225 HG2 GLN A 159 3.965 4.795 -12.797 1.00 0.00 H ATOM 2226 HG3 GLN A 159 5.401 5.572 -13.504 1.00 0.00 H ATOM 2227 HE22 GLN A 159 3.601 4.303 -15.120 1.00 0.00 H ATOM 2228 HE21 GLN A 159 4.288 2.758 -15.744 1.00 0.00 H ATOM 2229 H GLN A 159 3.757 3.562 -9.674 1.00 0.00 H ATOM 2230 N LEU A 160 7.419 2.441 -9.668 1.00 2.99 N ATOM 2231 CA LEU A 160 8.356 2.469 -8.571 1.00 2.66 C ATOM 2232 C LEU A 160 9.087 3.803 -8.493 1.00 3.09 C ATOM 2233 O LEU A 160 9.636 4.260 -9.539 1.00 4.81 O ATOM 2234 CB LEU A 160 9.428 1.380 -8.832 1.00 2.77 C ATOM 2235 CG LEU A 160 8.865 -0.044 -8.869 1.00 3.41 C ATOM 2236 CD1 LEU A 160 10.045 -0.983 -9.233 1.00 2.00 C ATOM 2237 CD2 LEU A 160 8.283 -0.464 -7.521 1.00 2.00 C ATOM 2238 HA LEU A 160 7.805 2.306 -7.645 1.00 0.00 H ATOM 2239 HB2 LEU A 160 9.903 1.587 -9.791 1.00 0.00 H ATOM 2240 HB3 LEU A 160 10.174 1.435 -8.039 1.00 0.00 H ATOM 2241 HG LEU A 160 8.056 -0.097 -9.597 1.00 0.00 H ATOM 2242 HD21 LEU A 160 9.064 -0.426 -6.762 1.00 0.00 H ATOM 2243 HD22 LEU A 160 7.475 0.215 -7.248 1.00 0.00 H ATOM 2244 HD23 LEU A 160 7.896 -1.480 -7.595 1.00 0.00 H ATOM 2245 HD11 LEU A 160 10.446 -0.700 -10.206 1.00 0.00 H ATOM 2246 HD12 LEU A 160 10.825 -0.894 -8.477 1.00 0.00 H ATOM 2247 HD13 LEU A 160 9.690 -2.013 -9.271 1.00 0.00 H ATOM 2248 H LEU A 160 7.598 1.809 -10.474 1.00 0.00 H ATOM 2249 N ASP A 161 9.063 4.455 -7.330 1.00 2.00 N ATOM 2250 CA ASP A 161 9.723 5.742 -7.177 1.00 2.04 C ATOM 2251 C ASP A 161 10.383 5.901 -5.809 1.00 2.00 C ATOM 2252 O ASP A 161 10.897 6.939 -5.504 1.00 2.00 O ATOM 2253 CB ASP A 161 8.731 6.862 -7.470 1.00 2.92 C ATOM 2254 CG ASP A 161 7.615 6.958 -6.431 1.00 4.33 C ATOM 2255 OD1 ASP A 161 6.685 7.792 -6.636 1.00 4.06 O ATOM 2256 OD2 ASP A 161 7.645 6.240 -5.386 1.00 2.00 O ATOM 2257 HA ASP A 161 10.536 5.798 -7.901 1.00 0.00 H ATOM 2258 HB2 ASP A 161 9.271 7.809 -7.489 1.00 0.00 H ATOM 2259 HB3 ASP A 161 8.282 6.682 -8.447 1.00 0.00 H ATOM 2260 H ASP A 161 8.564 4.036 -6.519 1.00 0.00 H ATOM 2261 N HIS A 162 10.419 4.859 -4.992 1.00 2.72 N ATOM 2262 CA HIS A 162 10.875 5.012 -3.622 1.00 2.46 C ATOM 2263 C HIS A 162 11.410 3.675 -3.116 1.00 2.41 C ATOM 2264 O HIS A 162 10.974 2.614 -3.578 1.00 2.99 O ATOM 2265 CB HIS A 162 9.682 5.501 -2.780 1.00 2.09 C ATOM 2266 CG HIS A 162 10.032 5.885 -1.387 1.00 2.91 C ATOM 2267 ND1 HIS A 162 11.232 6.482 -1.062 1.00 2.09 N ATOM 2268 CD2 HIS A 162 9.353 5.736 -0.229 1.00 2.78 C ATOM 2269 CE1 HIS A 162 11.256 6.723 0.242 1.00 3.90 C ATOM 2270 NE2 HIS A 162 10.129 6.261 0.779 1.00 2.00 N ATOM 2271 HA HIS A 162 11.684 5.739 -3.551 1.00 0.00 H ATOM 2272 HB2 HIS A 162 9.248 6.370 -3.275 1.00 0.00 H ATOM 2273 HB3 HIS A 162 8.943 4.701 -2.738 1.00 0.00 H ATOM 2274 HD2 HIS A 162 8.369 5.282 -0.114 1.00 0.00 H ATOM 2275 HE1 HIS A 162 12.063 7.217 0.783 1.00 0.00 H ATOM 2276 H HIS A 162 10.118 3.924 -5.334 1.00 0.00 H ATOM 2277 N GLY A 163 12.378 3.760 -2.201 1.00 2.93 N ATOM 2278 CA GLY A 163 13.011 2.643 -1.554 1.00 2.85 C ATOM 2279 C GLY A 163 12.804 2.741 -0.054 1.00 2.48 C ATOM 2280 O GLY A 163 13.081 3.789 0.566 1.00 2.78 O ATOM 2281 HA3 GLY A 163 14.078 2.652 -1.775 1.00 0.00 H ATOM 2282 HA2 GLY A 163 12.573 1.715 -1.921 1.00 0.00 H ATOM 2283 H GLY A 163 12.701 4.712 -1.934 1.00 0.00 H ATOM 2284 N VAL A 164 12.332 1.639 0.525 1.00 2.51 N ATOM 2285 CA VAL A 164 11.998 1.571 1.920 1.00 2.50 C ATOM 2286 C VAL A 164 12.434 0.201 2.467 1.00 2.29 C ATOM 2287 O VAL A 164 13.097 -0.569 1.744 1.00 2.69 O ATOM 2288 CB VAL A 164 10.552 1.902 2.202 1.00 2.60 C ATOM 2289 CG1 VAL A 164 10.242 3.334 1.818 1.00 2.38 C ATOM 2290 CG2 VAL A 164 9.579 0.839 1.429 1.00 2.00 C ATOM 2291 HA VAL A 164 12.547 2.347 2.453 1.00 0.00 H ATOM 2292 HB VAL A 164 10.367 1.813 3.272 1.00 0.00 H ATOM 2293 HG11 VAL A 164 10.876 4.009 2.394 1.00 0.00 H ATOM 2294 HG12 VAL A 164 10.433 3.473 0.754 1.00 0.00 H ATOM 2295 HG13 VAL A 164 9.194 3.547 2.031 1.00 0.00 H ATOM 2296 HG21 VAL A 164 9.760 0.897 0.356 1.00 0.00 H ATOM 2297 HG22 VAL A 164 9.793 -0.170 1.781 1.00 0.00 H ATOM 2298 HG23 VAL A 164 8.537 1.084 1.637 1.00 0.00 H ATOM 2299 H VAL A 164 12.199 0.789 -0.059 1.00 0.00 H ATOM 2300 N LEU A 165 11.995 -0.133 3.691 1.00 3.05 N ATOM 2301 CA LEU A 165 12.496 -1.315 4.394 1.00 2.28 C ATOM 2302 C LEU A 165 11.385 -2.069 5.058 1.00 2.70 C ATOM 2303 O LEU A 165 10.721 -1.528 5.932 1.00 2.16 O ATOM 2304 CB LEU A 165 13.606 -0.917 5.415 1.00 2.58 C ATOM 2305 CG LEU A 165 14.276 -2.071 6.175 1.00 3.34 C ATOM 2306 CD1 LEU A 165 15.250 -2.893 5.303 1.00 2.67 C ATOM 2307 CD2 LEU A 165 15.032 -1.550 7.464 1.00 2.00 C ATOM 2308 HA LEU A 165 12.941 -1.983 3.656 1.00 0.00 H ATOM 2309 HB2 LEU A 165 14.384 -0.383 4.869 1.00 0.00 H ATOM 2310 HB3 LEU A 165 13.157 -0.250 6.151 1.00 0.00 H ATOM 2311 HG LEU A 165 13.463 -2.734 6.471 1.00 0.00 H ATOM 2312 HD21 LEU A 165 15.801 -0.836 7.169 1.00 0.00 H ATOM 2313 HD22 LEU A 165 14.319 -1.064 8.130 1.00 0.00 H ATOM 2314 HD23 LEU A 165 15.495 -2.393 7.978 1.00 0.00 H ATOM 2315 HD11 LEU A 165 14.707 -3.324 4.462 1.00 0.00 H ATOM 2316 HD12 LEU A 165 16.041 -2.242 4.931 1.00 0.00 H ATOM 2317 HD13 LEU A 165 15.687 -3.691 5.903 1.00 0.00 H ATOM 2318 H LEU A 165 11.279 0.464 4.152 1.00 0.00 H ATOM 2319 N LEU A 166 11.111 -3.297 4.621 1.00 2.38 N ATOM 2320 CA LEU A 166 10.153 -4.151 5.308 1.00 2.11 C ATOM 2321 C LEU A 166 10.769 -4.624 6.600 1.00 2.26 C ATOM 2322 O LEU A 166 11.882 -5.177 6.576 1.00 2.94 O ATOM 2323 CB LEU A 166 9.803 -5.374 4.465 1.00 2.51 C ATOM 2324 CG LEU A 166 9.247 -5.169 3.065 1.00 2.40 C ATOM 2325 CD1 LEU A 166 8.999 -6.523 2.382 1.00 3.05 C ATOM 2326 CD2 LEU A 166 7.932 -4.344 3.101 1.00 3.06 C ATOM 2327 HA LEU A 166 9.244 -3.577 5.490 1.00 0.00 H ATOM 2328 HB2 LEU A 166 10.714 -5.964 4.364 1.00 0.00 H ATOM 2329 HB3 LEU A 166 9.061 -5.945 5.023 1.00 0.00 H ATOM 2330 HG LEU A 166 9.986 -4.611 2.490 1.00 0.00 H ATOM 2331 HD21 LEU A 166 7.189 -4.873 3.698 1.00 0.00 H ATOM 2332 HD22 LEU A 166 8.129 -3.368 3.545 1.00 0.00 H ATOM 2333 HD23 LEU A 166 7.558 -4.214 2.085 1.00 0.00 H ATOM 2334 HD11 LEU A 166 9.938 -7.072 2.314 1.00 0.00 H ATOM 2335 HD12 LEU A 166 8.282 -7.098 2.968 1.00 0.00 H ATOM 2336 HD13 LEU A 166 8.601 -6.356 1.381 1.00 0.00 H ATOM 2337 H LEU A 166 11.592 -3.653 3.771 1.00 0.00 H ATOM 2338 N VAL A 167 10.092 -4.377 7.737 1.00 2.73 N ATOM 2339 CA VAL A 167 10.594 -4.862 9.047 1.00 2.00 C ATOM 2340 C VAL A 167 9.672 -5.899 9.703 1.00 2.00 C ATOM 2341 O VAL A 167 10.007 -6.489 10.723 1.00 2.20 O ATOM 2342 CB VAL A 167 10.893 -3.734 10.011 1.00 2.00 C ATOM 2343 CG1 VAL A 167 11.871 -2.740 9.359 1.00 2.00 C ATOM 2344 CG2 VAL A 167 9.594 -3.011 10.417 1.00 2.14 C ATOM 2345 HA VAL A 167 11.534 -5.364 8.817 1.00 0.00 H ATOM 2346 HB VAL A 167 11.349 -4.150 10.909 1.00 0.00 H ATOM 2347 HG11 VAL A 167 12.797 -3.256 9.107 1.00 0.00 H ATOM 2348 HG12 VAL A 167 11.423 -2.333 8.453 1.00 0.00 H ATOM 2349 HG13 VAL A 167 12.083 -1.930 10.057 1.00 0.00 H ATOM 2350 HG21 VAL A 167 9.115 -2.600 9.528 1.00 0.00 H ATOM 2351 HG22 VAL A 167 8.921 -3.720 10.899 1.00 0.00 H ATOM 2352 HG23 VAL A 167 9.830 -2.204 11.110 1.00 0.00 H ATOM 2353 H VAL A 167 9.203 -3.838 7.697 1.00 0.00 H ATOM 2354 N GLY A 168 8.553 -6.185 9.082 1.00 2.00 N ATOM 2355 CA GLY A 168 7.577 -7.087 9.686 1.00 2.00 C ATOM 2356 C GLY A 168 6.295 -7.191 8.888 1.00 2.00 C ATOM 2357 O GLY A 168 6.145 -6.571 7.834 1.00 2.35 O ATOM 2358 HA3 GLY A 168 7.336 -6.721 10.684 1.00 0.00 H ATOM 2359 HA2 GLY A 168 8.021 -8.080 9.762 1.00 0.00 H ATOM 2360 H GLY A 168 8.359 -5.765 8.150 1.00 0.00 H ATOM 2361 N TYR A 169 5.403 -8.043 9.362 1.00 2.08 N ATOM 2362 CA TYR A 169 4.101 -8.181 8.759 1.00 2.35 C ATOM 2363 C TYR A 169 3.152 -8.801 9.794 1.00 2.22 C ATOM 2364 O TYR A 169 3.561 -9.319 10.851 1.00 2.13 O ATOM 2365 CB TYR A 169 4.156 -9.062 7.508 1.00 2.00 C ATOM 2366 CG TYR A 169 4.556 -10.484 7.833 1.00 2.36 C ATOM 2367 CD1 TYR A 169 3.602 -11.431 8.233 1.00 2.61 C ATOM 2368 CD2 TYR A 169 5.869 -10.887 7.765 1.00 2.83 C ATOM 2369 CE1 TYR A 169 3.999 -12.742 8.559 1.00 3.29 C ATOM 2370 CE2 TYR A 169 6.251 -12.196 8.110 1.00 3.13 C ATOM 2371 CZ TYR A 169 5.313 -13.106 8.488 1.00 2.92 C ATOM 2372 OH TYR A 169 5.745 -14.395 8.794 1.00 3.22 O ATOM 2373 HA TYR A 169 3.744 -7.198 8.452 1.00 0.00 H ATOM 2374 HB3 TYR A 169 4.883 -8.642 6.813 1.00 0.00 H ATOM 2375 HB2 TYR A 169 3.171 -9.071 7.040 1.00 0.00 H ATOM 2376 HD2 TYR A 169 6.629 -10.178 7.437 1.00 0.00 H ATOM 2377 HE2 TYR A 169 7.302 -12.482 8.074 1.00 0.00 H ATOM 2378 HE1 TYR A 169 3.252 -13.472 8.870 1.00 0.00 H ATOM 2379 HD1 TYR A 169 2.550 -11.151 8.292 1.00 0.00 H ATOM 2380 HH TYR A 169 4.967 -14.950 9.051 1.00 0.00 H ATOM 2381 H TYR A 169 5.646 -8.627 10.188 1.00 0.00 H ATOM 2382 N ASN A 170 1.875 -8.802 9.460 1.00 2.42 N ATOM 2383 CA ASN A 170 0.849 -9.411 10.289 1.00 2.00 C ATOM 2384 C ASN A 170 -0.254 -9.969 9.343 1.00 4.32 C ATOM 2385 O ASN A 170 -1.020 -9.204 8.727 1.00 3.47 O ATOM 2386 CB ASN A 170 0.330 -8.418 11.345 1.00 2.91 C ATOM 2387 CG ASN A 170 -0.752 -8.994 12.250 1.00 4.67 C ATOM 2388 OD1 ASN A 170 -1.334 -10.058 11.986 1.00 7.13 O ATOM 2389 ND2 ASN A 170 -1.094 -8.249 13.255 1.00 5.72 N ATOM 2390 HA ASN A 170 1.249 -10.242 10.869 1.00 0.00 H ATOM 2391 HB2 ASN A 170 1.169 -8.107 11.967 1.00 0.00 H ATOM 2392 HB3 ASN A 170 -0.079 -7.550 10.829 1.00 0.00 H ATOM 2393 HD22 ASN A 170 -0.582 -7.364 13.444 1.00 0.00 H ATOM 2394 HD21 ASN A 170 -1.880 -8.537 13.872 1.00 0.00 H ATOM 2395 H ASN A 170 1.592 -8.349 8.568 1.00 0.00 H ATOM 2396 N ASP A 171 -0.293 -11.295 9.250 1.00 4.01 N ATOM 2397 CA ASP A 171 -1.173 -12.000 8.326 1.00 6.05 C ATOM 2398 C ASP A 171 -2.553 -12.260 8.923 1.00 7.50 C ATOM 2399 O ASP A 171 -3.484 -12.595 8.183 1.00 9.10 O ATOM 2400 CB ASP A 171 -0.543 -13.325 7.879 1.00 5.74 C ATOM 2401 CG ASP A 171 0.455 -13.158 6.786 1.00 6.71 C ATOM 2402 OD1 ASP A 171 1.277 -14.089 6.584 1.00 6.06 O ATOM 2403 OD2 ASP A 171 0.354 -12.150 6.059 1.00 9.52 O ATOM 2404 HA ASP A 171 -1.303 -11.350 7.460 1.00 0.00 H ATOM 2405 HB2 ASP A 171 -0.046 -13.780 8.736 1.00 0.00 H ATOM 2406 HB3 ASP A 171 -1.336 -13.985 7.527 1.00 0.00 H ATOM 2407 H ASP A 171 0.333 -11.854 9.864 1.00 0.00 H ATOM 2408 N GLY A 172 -2.664 -12.106 10.232 1.00 8.27 N ATOM 2409 CA GLY A 172 -3.874 -12.455 10.951 1.00 9.26 C ATOM 2410 C GLY A 172 -4.800 -11.292 11.123 1.00 9.40 C ATOM 2411 O GLY A 172 -5.974 -11.512 11.394 1.00 9.28 O ATOM 2412 HA3 GLY A 172 -3.598 -12.830 11.937 1.00 0.00 H ATOM 2413 HA2 GLY A 172 -4.395 -13.237 10.399 1.00 0.00 H ATOM 2414 H GLY A 172 -1.857 -11.722 10.763 1.00 0.00 H ATOM 2415 N ALA A 173 -4.292 -10.054 10.976 1.00 6.41 N ATOM 2416 CA ALA A 173 -5.136 -8.874 11.148 1.00 7.48 C ATOM 2417 C ALA A 173 -6.311 -8.827 10.150 1.00 6.75 C ATOM 2418 O ALA A 173 -6.283 -9.437 9.073 1.00 6.62 O ATOM 2419 CB ALA A 173 -4.274 -7.577 11.072 1.00 5.98 C ATOM 2420 HA ALA A 173 -5.585 -8.941 12.139 1.00 0.00 H ATOM 2421 HB1 ALA A 173 -3.522 -7.595 11.861 1.00 0.00 H ATOM 2422 HB2 ALA A 173 -3.782 -7.525 10.100 1.00 0.00 H ATOM 2423 HB3 ALA A 173 -4.917 -6.707 11.202 1.00 0.00 H ATOM 2424 H ALA A 173 -3.287 -9.936 10.737 1.00 0.00 H ATOM 2425 N ALA A 174 -7.361 -8.082 10.507 1.00 8.09 N ATOM 2426 CA ALA A 174 -8.546 -7.971 9.636 1.00 7.91 C ATOM 2427 C ALA A 174 -8.128 -7.526 8.254 1.00 6.07 C ATOM 2428 O ALA A 174 -8.623 -8.046 7.277 1.00 6.83 O ATOM 2429 CB ALA A 174 -9.607 -6.992 10.239 1.00 8.53 C ATOM 2430 HA ALA A 174 -9.013 -8.953 9.565 1.00 0.00 H ATOM 2431 HB1 ALA A 174 -9.926 -7.360 11.214 1.00 0.00 H ATOM 2432 HB2 ALA A 174 -9.164 -6.002 10.350 1.00 0.00 H ATOM 2433 HB3 ALA A 174 -10.467 -6.934 9.572 1.00 0.00 H ATOM 2434 H ALA A 174 -7.342 -7.572 11.413 1.00 0.00 H ATOM 2435 N VAL A 175 -7.214 -6.553 8.169 1.00 5.48 N ATOM 2436 CA VAL A 175 -6.546 -6.221 6.911 1.00 4.07 C ATOM 2437 C VAL A 175 -5.091 -6.622 7.125 1.00 3.25 C ATOM 2438 O VAL A 175 -4.382 -5.922 7.834 1.00 2.09 O ATOM 2439 CB VAL A 175 -6.611 -4.737 6.529 1.00 3.75 C ATOM 2440 CG1 VAL A 175 -5.873 -4.496 5.228 1.00 4.31 C ATOM 2441 CG2 VAL A 175 -8.099 -4.271 6.420 1.00 5.72 C ATOM 2442 HA VAL A 175 -7.042 -6.741 6.092 1.00 0.00 H ATOM 2443 HB VAL A 175 -6.126 -4.151 7.309 1.00 0.00 H ATOM 2444 HG11 VAL A 175 -4.829 -4.789 5.344 1.00 0.00 H ATOM 2445 HG12 VAL A 175 -6.332 -5.088 4.436 1.00 0.00 H ATOM 2446 HG13 VAL A 175 -5.928 -3.438 4.971 1.00 0.00 H ATOM 2447 HG21 VAL A 175 -8.607 -4.859 5.656 1.00 0.00 H ATOM 2448 HG22 VAL A 175 -8.595 -4.414 7.380 1.00 0.00 H ATOM 2449 HG23 VAL A 175 -8.129 -3.216 6.148 1.00 0.00 H ATOM 2450 H VAL A 175 -6.971 -6.015 9.025 1.00 0.00 H ATOM 2451 N PRO A 176 -4.653 -7.757 6.580 1.00 3.98 N ATOM 2452 CA PRO A 176 -3.220 -8.137 6.761 1.00 3.78 C ATOM 2453 C PRO A 176 -2.308 -7.054 6.228 1.00 3.71 C ATOM 2454 O PRO A 176 -2.692 -6.367 5.280 1.00 3.43 O ATOM 2455 CB PRO A 176 -3.078 -9.402 5.919 1.00 3.94 C ATOM 2456 CG PRO A 176 -4.429 -10.003 5.954 1.00 5.92 C ATOM 2457 CD PRO A 176 -5.389 -8.843 5.876 1.00 6.14 C ATOM 2458 HA PRO A 176 -2.951 -8.281 7.807 1.00 0.00 H ATOM 2459 HD3 PRO A 176 -5.594 -8.571 4.840 1.00 0.00 H ATOM 2460 HD2 PRO A 176 -6.326 -9.074 6.382 1.00 0.00 H ATOM 2461 HG3 PRO A 176 -4.576 -10.557 6.881 1.00 0.00 H ATOM 2462 HG2 PRO A 176 -4.570 -10.672 5.106 1.00 0.00 H ATOM 2463 HB2 PRO A 176 -2.788 -9.158 4.897 1.00 0.00 H ATOM 2464 HB3 PRO A 176 -2.341 -10.077 6.353 1.00 0.00 H ATOM 2465 N TYR A 177 -1.151 -6.846 6.866 1.00 2.12 N ATOM 2466 CA TYR A 177 -0.284 -5.740 6.470 1.00 2.42 C ATOM 2467 C TYR A 177 1.207 -6.056 6.588 1.00 2.59 C ATOM 2468 O TYR A 177 1.639 -7.016 7.270 1.00 3.36 O ATOM 2469 CB TYR A 177 -0.584 -4.506 7.329 1.00 2.36 C ATOM 2470 CG TYR A 177 -0.513 -4.689 8.802 1.00 3.34 C ATOM 2471 CD1 TYR A 177 0.735 -4.700 9.471 1.00 3.14 C ATOM 2472 CD2 TYR A 177 -1.684 -4.821 9.574 1.00 4.41 C ATOM 2473 CE1 TYR A 177 0.797 -4.824 10.823 1.00 5.14 C ATOM 2474 CE2 TYR A 177 -1.615 -4.961 10.916 1.00 3.85 C ATOM 2475 CZ TYR A 177 -0.359 -4.969 11.555 1.00 5.79 C ATOM 2476 OH TYR A 177 -0.253 -5.127 12.929 1.00 5.48 O ATOM 2477 HA TYR A 177 -0.499 -5.555 5.418 1.00 0.00 H ATOM 2478 HB3 TYR A 177 -1.592 -4.170 7.085 1.00 0.00 H ATOM 2479 HB2 TYR A 177 0.132 -3.731 7.057 1.00 0.00 H ATOM 2480 HD2 TYR A 177 -2.657 -4.810 9.083 1.00 0.00 H ATOM 2481 HE2 TYR A 177 -2.528 -5.067 11.502 1.00 0.00 H ATOM 2482 HE1 TYR A 177 1.763 -4.809 11.328 1.00 0.00 H ATOM 2483 HD1 TYR A 177 1.656 -4.608 8.895 1.00 0.00 H ATOM 2484 HH TYR A 177 -0.736 -4.392 13.383 1.00 0.00 H ATOM 2485 H TYR A 177 -0.868 -7.473 7.646 1.00 0.00 H ATOM 2486 N TRP A 178 1.974 -5.269 5.825 1.00 3.09 N ATOM 2487 CA TRP A 178 3.383 -5.089 6.002 1.00 2.76 C ATOM 2488 C TRP A 178 3.659 -3.912 6.910 1.00 2.45 C ATOM 2489 O TRP A 178 2.860 -2.942 6.937 1.00 2.75 O ATOM 2490 CB TRP A 178 4.040 -4.742 4.701 1.00 2.83 C ATOM 2491 CG TRP A 178 4.038 -5.845 3.653 1.00 2.00 C ATOM 2492 CD1 TRP A 178 3.342 -5.868 2.474 1.00 4.95 C ATOM 2493 CD2 TRP A 178 4.903 -6.982 3.629 1.00 2.00 C ATOM 2494 NE1 TRP A 178 3.668 -6.990 1.753 1.00 2.73 N ATOM 2495 CE2 TRP A 178 4.630 -7.691 2.443 1.00 2.00 C ATOM 2496 CE3 TRP A 178 5.828 -7.516 4.531 1.00 2.59 C ATOM 2497 CZ2 TRP A 178 5.300 -8.860 2.103 1.00 2.00 C ATOM 2498 CZ3 TRP A 178 6.499 -8.664 4.191 1.00 2.45 C ATOM 2499 CH2 TRP A 178 6.216 -9.349 3.003 1.00 2.00 C ATOM 2500 HA TRP A 178 3.766 -6.022 6.415 1.00 0.00 H ATOM 2501 HB2 TRP A 178 3.522 -3.879 4.282 1.00 0.00 H ATOM 2502 HB3 TRP A 178 5.077 -4.477 4.908 1.00 0.00 H ATOM 2503 HE1 TRP A 178 3.256 -7.264 0.838 1.00 0.00 H ATOM 2504 HD1 TRP A 178 2.632 -5.106 2.154 1.00 0.00 H ATOM 2505 HZ2 TRP A 178 5.106 -9.369 1.159 1.00 0.00 H ATOM 2506 HH2 TRP A 178 6.731 -10.286 2.789 1.00 0.00 H ATOM 2507 HZ3 TRP A 178 7.268 -9.051 4.860 1.00 0.00 H ATOM 2508 HE3 TRP A 178 6.013 -7.029 5.488 1.00 0.00 H ATOM 2509 H TRP A 178 1.514 -4.752 5.049 1.00 0.00 H ATOM 2510 N ILE A 179 4.741 -4.037 7.665 1.00 2.22 N ATOM 2511 CA ILE A 179 5.285 -2.973 8.510 1.00 2.00 C ATOM 2512 C ILE A 179 6.538 -2.490 7.823 1.00 2.00 C ATOM 2513 O ILE A 179 7.483 -3.275 7.624 1.00 2.26 O ATOM 2514 CB ILE A 179 5.622 -3.461 9.944 1.00 2.30 C ATOM 2515 CG1 ILE A 179 4.412 -4.156 10.581 1.00 3.15 C ATOM 2516 CG2 ILE A 179 6.089 -2.256 10.825 1.00 5.53 C ATOM 2517 CD1 ILE A 179 4.778 -4.943 11.889 1.00 3.45 C ATOM 2518 HA ILE A 179 4.544 -2.183 8.629 1.00 0.00 H ATOM 2519 HB ILE A 179 6.434 -4.186 9.882 1.00 0.00 H ATOM 2520 HG12 ILE A 179 3.666 -3.400 10.827 1.00 0.00 H ATOM 2521 HG13 ILE A 179 3.993 -4.857 9.859 1.00 0.00 H ATOM 2522 HD11 ILE A 179 5.517 -5.709 11.656 1.00 0.00 H ATOM 2523 HD12 ILE A 179 5.190 -4.252 12.624 1.00 0.00 H ATOM 2524 HD13 ILE A 179 3.881 -5.412 12.292 1.00 0.00 H ATOM 2525 HG21 ILE A 179 6.977 -1.806 10.381 1.00 0.00 H ATOM 2526 HG22 ILE A 179 5.292 -1.515 10.877 1.00 0.00 H ATOM 2527 HG23 ILE A 179 6.323 -2.611 11.829 1.00 0.00 H ATOM 2528 H ILE A 179 5.236 -4.951 7.656 1.00 0.00 H ATOM 2529 N ILE A 180 6.576 -1.189 7.510 1.00 2.00 N ATOM 2530 CA ILE A 180 7.589 -0.598 6.663 1.00 2.08 C ATOM 2531 C ILE A 180 8.202 0.646 7.322 1.00 2.54 C ATOM 2532 O ILE A 180 7.497 1.571 7.720 1.00 2.91 O ATOM 2533 CB ILE A 180 6.969 -0.193 5.313 1.00 2.00 C ATOM 2534 CG1 ILE A 180 6.421 -1.396 4.606 1.00 3.51 C ATOM 2535 CG2 ILE A 180 8.019 0.512 4.453 1.00 3.67 C ATOM 2536 CD1 ILE A 180 5.913 -1.190 3.161 1.00 5.26 C ATOM 2537 HA ILE A 180 8.373 -1.339 6.509 1.00 0.00 H ATOM 2538 HB ILE A 180 6.144 0.496 5.492 1.00 0.00 H ATOM 2539 HG12 ILE A 180 7.211 -2.147 4.573 1.00 0.00 H ATOM 2540 HG13 ILE A 180 5.587 -1.774 5.197 1.00 0.00 H ATOM 2541 HD11 ILE A 180 5.106 -0.457 3.162 1.00 0.00 H ATOM 2542 HD12 ILE A 180 6.731 -0.830 2.537 1.00 0.00 H ATOM 2543 HD13 ILE A 180 5.544 -2.138 2.768 1.00 0.00 H ATOM 2544 HG21 ILE A 180 8.372 1.404 4.971 1.00 0.00 H ATOM 2545 HG22 ILE A 180 8.857 -0.163 4.278 1.00 0.00 H ATOM 2546 HG23 ILE A 180 7.574 0.796 3.499 1.00 0.00 H ATOM 2547 H ILE A 180 5.836 -0.569 7.897 1.00 0.00 H ATOM 2548 N LYS A 181 9.511 0.652 7.394 1.00 2.16 N ATOM 2549 CA LYS A 181 10.301 1.762 7.830 1.00 2.00 C ATOM 2550 C LYS A 181 10.525 2.713 6.663 1.00 2.00 C ATOM 2551 O LYS A 181 10.997 2.320 5.588 1.00 2.28 O ATOM 2552 CB LYS A 181 11.636 1.235 8.405 1.00 2.00 C ATOM 2553 CG LYS A 181 12.464 2.359 9.090 1.00 2.00 C ATOM 2554 CD LYS A 181 13.897 1.888 9.483 1.00 2.00 C ATOM 2555 CE LYS A 181 14.597 2.876 10.455 1.00 2.66 C ATOM 2556 NZ LYS A 181 16.039 2.492 10.479 1.00 3.43 N ATOM 2557 HA LYS A 181 9.786 2.315 8.616 1.00 0.00 H ATOM 2558 HB2 LYS A 181 11.420 0.460 9.140 1.00 0.00 H ATOM 2559 HB3 LYS A 181 12.225 0.810 7.592 1.00 0.00 H ATOM 2560 HG2 LYS A 181 12.548 3.200 8.402 1.00 0.00 H ATOM 2561 HG3 LYS A 181 11.941 2.679 9.991 1.00 0.00 H ATOM 2562 HD2 LYS A 181 13.826 0.913 9.965 1.00 0.00 H ATOM 2563 HD3 LYS A 181 14.498 1.801 8.578 1.00 0.00 H ATOM 2564 HE2 LYS A 181 14.167 2.792 11.453 1.00 0.00 H ATOM 2565 HE3 LYS A 181 14.485 3.900 10.098 1.00 0.00 H ATOM 2566 HZ1 LYS A 181 16.130 1.512 10.814 1.00 0.00 H ATOM 2567 HZ2 LYS A 181 16.433 2.570 9.520 1.00 0.00 H ATOM 2568 HZ3 LYS A 181 16.555 3.128 11.120 1.00 0.00 H ATOM 2569 H LYS A 181 10.012 -0.215 7.113 1.00 0.00 H ATOM 2570 N ASN A 182 10.214 3.997 6.874 1.00 2.27 N ATOM 2571 CA ASN A 182 10.528 5.041 5.933 1.00 2.00 C ATOM 2572 C ASN A 182 11.674 5.929 6.488 1.00 2.00 C ATOM 2573 O ASN A 182 12.187 5.675 7.572 1.00 2.37 O ATOM 2574 CB ASN A 182 9.252 5.867 5.664 1.00 2.00 C ATOM 2575 CG ASN A 182 9.219 6.508 4.308 1.00 2.00 C ATOM 2576 OD1 ASN A 182 10.226 6.550 3.597 1.00 3.15 O ATOM 2577 ND2 ASN A 182 8.084 7.134 3.981 1.00 2.00 N ATOM 2578 HA ASN A 182 10.873 4.611 4.992 1.00 0.00 H ATOM 2579 HB2 ASN A 182 8.390 5.206 5.753 1.00 0.00 H ATOM 2580 HB3 ASN A 182 9.186 6.652 6.417 1.00 0.00 H ATOM 2581 HD22 ASN A 182 7.257 7.073 4.609 1.00 0.00 H ATOM 2582 HD21 ASN A 182 8.028 7.682 3.099 1.00 0.00 H ATOM 2583 H ASN A 182 9.724 4.252 7.755 1.00 0.00 H ATOM 2584 N SER A 183 12.058 6.909 5.683 1.00 3.23 N ATOM 2585 CA SER A 183 13.166 7.802 5.969 1.00 2.80 C ATOM 2586 C SER A 183 12.785 9.266 5.883 1.00 4.24 C ATOM 2587 O SER A 183 13.567 10.124 5.400 1.00 3.84 O ATOM 2588 CB SER A 183 14.318 7.418 5.043 1.00 4.00 C ATOM 2589 OG SER A 183 13.907 7.443 3.698 1.00 3.60 O ATOM 2590 HA SER A 183 13.480 7.682 7.006 1.00 0.00 H ATOM 2591 HB2 SER A 183 14.659 6.414 5.294 1.00 0.00 H ATOM 2592 HB3 SER A 183 15.137 8.124 5.180 1.00 0.00 H ATOM 2593 HG SER A 183 13.600 8.355 3.465 1.00 0.00 H ATOM 2594 H SER A 183 11.535 7.046 4.795 1.00 0.00 H ATOM 2595 N TRP A 184 11.584 9.573 6.392 1.00 3.00 N ATOM 2596 CA TRP A 184 11.015 10.907 6.313 1.00 2.84 C ATOM 2597 C TRP A 184 10.711 11.457 7.703 1.00 2.18 C ATOM 2598 O TRP A 184 9.761 12.202 7.865 1.00 4.16 O ATOM 2599 CB TRP A 184 9.727 10.909 5.484 1.00 3.69 C ATOM 2600 CG TRP A 184 9.869 10.480 4.017 1.00 3.62 C ATOM 2601 CD1 TRP A 184 11.023 10.273 3.305 1.00 3.18 C ATOM 2602 CD2 TRP A 184 8.812 10.157 3.150 1.00 3.52 C ATOM 2603 NE1 TRP A 184 10.741 9.883 2.034 1.00 3.83 N ATOM 2604 CE2 TRP A 184 9.377 9.785 1.908 1.00 2.68 C ATOM 2605 CE3 TRP A 184 7.434 10.173 3.284 1.00 4.89 C ATOM 2606 CZ2 TRP A 184 8.600 9.401 0.818 1.00 4.87 C ATOM 2607 CZ3 TRP A 184 6.647 9.813 2.173 1.00 6.27 C ATOM 2608 CH2 TRP A 184 7.237 9.414 0.976 1.00 7.76 C ATOM 2609 HA TRP A 184 11.756 11.543 5.828 1.00 0.00 H ATOM 2610 HB2 TRP A 184 9.021 10.231 5.963 1.00 0.00 H ATOM 2611 HB3 TRP A 184 9.323 11.921 5.498 1.00 0.00 H ATOM 2612 HE1 TRP A 184 11.438 9.692 1.286 1.00 0.00 H ATOM 2613 HD1 TRP A 184 12.029 10.403 3.704 1.00 0.00 H ATOM 2614 HZ2 TRP A 184 9.057 9.101 -0.125 1.00 0.00 H ATOM 2615 HH2 TRP A 184 6.602 9.105 0.146 1.00 0.00 H ATOM 2616 HZ3 TRP A 184 5.560 9.847 2.251 1.00 0.00 H ATOM 2617 HE3 TRP A 184 6.969 10.458 4.228 1.00 0.00 H ATOM 2618 H TRP A 184 11.036 8.825 6.863 1.00 0.00 H ATOM 2619 N THR A 185 11.578 11.163 8.679 1.00 3.44 N ATOM 2620 CA THR A 185 11.439 11.510 10.086 1.00 2.96 C ATOM 2621 C THR A 185 10.353 10.751 10.831 1.00 3.35 C ATOM 2622 O THR A 185 9.480 10.132 10.220 1.00 3.00 O ATOM 2623 CB THR A 185 11.179 13.027 10.392 1.00 4.63 C ATOM 2624 OG1 THR A 185 9.781 13.365 10.234 1.00 5.94 O ATOM 2625 CG2 THR A 185 12.072 13.927 9.521 1.00 4.39 C ATOM 2626 HA THR A 185 12.428 11.221 10.441 1.00 0.00 H ATOM 2627 HB THR A 185 11.442 13.204 11.435 1.00 0.00 H ATOM 2628 HG1 THR A 185 9.501 13.179 9.303 1.00 0.00 H ATOM 2629 HG23 THR A 185 13.116 13.647 9.663 1.00 0.00 H ATOM 2630 HG21 THR A 185 11.800 13.801 8.473 1.00 0.00 H ATOM 2631 HG22 THR A 185 11.931 14.968 9.812 1.00 0.00 H ATOM 2632 H THR A 185 12.432 10.636 8.406 1.00 0.00 H ATOM 2633 N THR A 186 10.370 10.862 12.148 1.00 3.83 N ATOM 2634 CA THR A 186 9.334 10.213 12.954 1.00 4.06 C ATOM 2635 C THR A 186 8.037 11.001 12.981 1.00 4.66 C ATOM 2636 O THR A 186 7.022 10.513 13.557 1.00 5.82 O ATOM 2637 CB THR A 186 9.751 9.981 14.394 1.00 5.97 C ATOM 2638 OG1 THR A 186 10.091 11.239 14.981 1.00 4.43 O ATOM 2639 CG2 THR A 186 10.927 8.950 14.524 1.00 6.59 C ATOM 2640 HA THR A 186 9.182 9.253 12.460 1.00 0.00 H ATOM 2641 HB THR A 186 8.912 9.538 14.931 1.00 0.00 H ATOM 2642 HG1 THR A 186 10.838 11.647 14.475 1.00 0.00 H ATOM 2643 HG23 THR A 186 10.633 8.005 14.067 1.00 0.00 H ATOM 2644 HG21 THR A 186 11.809 9.341 14.017 1.00 0.00 H ATOM 2645 HG22 THR A 186 11.153 8.790 15.578 1.00 0.00 H ATOM 2646 H THR A 186 11.121 11.411 12.613 1.00 0.00 H ATOM 2647 N GLN A 187 8.051 12.209 12.422 1.00 4.93 N ATOM 2648 CA GLN A 187 6.862 13.046 12.348 1.00 6.38 C ATOM 2649 C GLN A 187 5.869 12.588 11.254 1.00 6.45 C ATOM 2650 O GLN A 187 4.684 13.010 11.267 1.00 6.81 O ATOM 2651 CB GLN A 187 7.251 14.504 12.168 1.00 7.44 C ATOM 2652 CG GLN A 187 8.049 15.034 13.348 1.00 9.62 C ATOM 2653 CD GLN A 187 8.704 16.376 13.063 1.00 8.93 C ATOM 2654 OE1 GLN A 187 9.800 16.657 13.549 1.00 9.11 O ATOM 2655 NE2 GLN A 187 8.038 17.209 12.271 1.00 8.95 N ATOM 2656 HA GLN A 187 6.335 12.938 13.296 1.00 0.00 H ATOM 2657 HB2 GLN A 187 7.854 14.598 11.265 1.00 0.00 H ATOM 2658 HB3 GLN A 187 6.344 15.099 12.061 1.00 0.00 H ATOM 2659 HG2 GLN A 187 7.378 15.148 14.199 1.00 0.00 H ATOM 2660 HG3 GLN A 187 8.827 14.312 13.595 1.00 0.00 H ATOM 2661 HE22 GLN A 187 7.115 16.930 11.882 1.00 0.00 H ATOM 2662 HE21 GLN A 187 8.440 18.140 12.040 1.00 0.00 H ATOM 2663 H GLN A 187 8.943 12.567 12.024 1.00 0.00 H ATOM 2664 N TRP A 188 6.341 11.741 10.332 1.00 4.46 N ATOM 2665 CA TRP A 188 5.532 11.205 9.238 1.00 3.66 C ATOM 2666 C TRP A 188 4.984 9.871 9.648 1.00 2.00 C ATOM 2667 O TRP A 188 5.664 9.097 10.309 1.00 2.17 O ATOM 2668 CB TRP A 188 6.382 11.034 7.976 1.00 3.92 C ATOM 2669 CG TRP A 188 5.647 10.514 6.794 1.00 5.00 C ATOM 2670 CD1 TRP A 188 4.884 11.221 5.874 1.00 3.00 C ATOM 2671 CD2 TRP A 188 5.561 9.156 6.427 1.00 4.05 C ATOM 2672 NE1 TRP A 188 4.394 10.363 4.949 1.00 5.34 N ATOM 2673 CE2 TRP A 188 4.766 9.080 5.275 1.00 4.88 C ATOM 2674 CE3 TRP A 188 6.076 7.987 6.970 1.00 4.95 C ATOM 2675 CZ2 TRP A 188 4.488 7.853 4.634 1.00 6.32 C ATOM 2676 CZ3 TRP A 188 5.780 6.774 6.365 1.00 5.76 C ATOM 2677 CH2 TRP A 188 5.029 6.711 5.200 1.00 3.46 C ATOM 2678 HA TRP A 188 4.720 11.899 9.022 1.00 0.00 H ATOM 2679 HB2 TRP A 188 6.800 12.006 7.715 1.00 0.00 H ATOM 2680 HB3 TRP A 188 7.192 10.341 8.204 1.00 0.00 H ATOM 2681 HE1 TRP A 188 3.825 10.632 4.121 1.00 0.00 H ATOM 2682 HD1 TRP A 188 4.708 12.296 5.894 1.00 0.00 H ATOM 2683 HZ2 TRP A 188 3.875 7.807 3.734 1.00 0.00 H ATOM 2684 HH2 TRP A 188 4.862 5.746 4.722 1.00 0.00 H ATOM 2685 HZ3 TRP A 188 6.145 5.851 6.815 1.00 0.00 H ATOM 2686 HE3 TRP A 188 6.705 8.021 7.860 1.00 0.00 H ATOM 2687 H TRP A 188 7.337 11.448 10.397 1.00 0.00 H ATOM 2688 N GLY A 189 3.771 9.560 9.228 1.00 2.32 N ATOM 2689 CA GLY A 189 3.215 8.226 9.470 1.00 2.00 C ATOM 2690 C GLY A 189 3.057 7.832 10.940 1.00 3.43 C ATOM 2691 O GLY A 189 2.721 8.695 11.780 1.00 3.57 O ATOM 2692 HA3 GLY A 189 3.873 7.497 8.996 1.00 0.00 H ATOM 2693 HA2 GLY A 189 2.231 8.183 9.003 1.00 0.00 H ATOM 2694 H GLY A 189 3.205 10.269 8.720 1.00 0.00 H ATOM 2695 N GLU A 190 3.441 6.587 11.259 1.00 3.76 N ATOM 2696 CA GLU A 190 3.279 6.012 12.591 1.00 4.03 C ATOM 2697 C GLU A 190 4.682 5.999 13.178 1.00 4.13 C ATOM 2698 O GLU A 190 5.419 5.054 13.032 1.00 3.48 O ATOM 2699 CB GLU A 190 2.655 4.625 12.535 1.00 4.74 C ATOM 2700 CG GLU A 190 1.284 4.584 11.868 1.00 5.17 C ATOM 2701 CD GLU A 190 0.595 3.225 11.882 1.00 3.90 C ATOM 2702 OE1 GLU A 190 1.257 2.151 11.745 1.00 6.02 O ATOM 2703 OE2 GLU A 190 -0.665 3.235 11.938 1.00 4.78 O ATOM 2704 HA GLU A 190 2.593 6.590 13.210 1.00 0.00 H ATOM 2705 HB2 GLU A 190 3.326 3.970 11.979 1.00 0.00 H ATOM 2706 HB3 GLU A 190 2.551 4.255 13.555 1.00 0.00 H ATOM 2707 HG2 GLU A 190 0.637 5.295 12.382 1.00 0.00 H ATOM 2708 HG3 GLU A 190 1.405 4.890 10.829 1.00 0.00 H ATOM 2709 H GLU A 190 3.877 6.001 10.519 1.00 0.00 H ATOM 2710 N GLU A 191 5.058 7.118 13.787 1.00 2.79 N ATOM 2711 CA GLU A 191 6.417 7.336 14.295 1.00 4.35 C ATOM 2712 C GLU A 191 7.455 6.973 13.223 1.00 2.61 C ATOM 2713 O GLU A 191 8.484 6.380 13.551 1.00 3.25 O ATOM 2714 CB GLU A 191 6.632 6.538 15.586 1.00 5.95 C ATOM 2715 CG GLU A 191 5.729 6.993 16.734 1.00 10.36 C ATOM 2716 CD GLU A 191 6.097 8.375 17.292 1.00 20.32 C ATOM 2717 OE1 GLU A 191 7.308 8.735 17.390 1.00 21.12 O ATOM 2718 OE2 GLU A 191 5.149 9.121 17.649 1.00 25.76 O ATOM 2719 HA GLU A 191 6.545 8.392 14.531 1.00 0.00 H ATOM 2720 HB2 GLU A 191 6.429 5.487 15.381 1.00 0.00 H ATOM 2721 HB3 GLU A 191 7.671 6.653 15.896 1.00 0.00 H ATOM 2722 HG2 GLU A 191 4.702 7.029 16.372 1.00 0.00 H ATOM 2723 HG3 GLU A 191 5.803 6.264 17.541 1.00 0.00 H ATOM 2724 H GLU A 191 4.356 7.875 13.909 1.00 0.00 H ATOM 2725 N GLY A 192 7.190 7.366 11.962 1.00 2.00 N ATOM 2726 CA GLY A 192 8.115 7.160 10.845 1.00 2.58 C ATOM 2727 C GLY A 192 7.917 5.902 10.001 1.00 2.00 C ATOM 2728 O GLY A 192 8.600 5.679 9.004 1.00 2.41 O ATOM 2729 HA3 GLY A 192 9.124 7.125 11.256 1.00 0.00 H ATOM 2730 HA2 GLY A 192 8.025 8.019 10.181 1.00 0.00 H ATOM 2731 H GLY A 192 6.284 7.839 11.772 1.00 0.00 H ATOM 2732 N TYR A 193 6.990 5.070 10.443 1.00 2.00 N ATOM 2733 CA TYR A 193 6.629 3.790 9.814 1.00 2.53 C ATOM 2734 C TYR A 193 5.294 3.903 9.092 1.00 2.23 C ATOM 2735 O TYR A 193 4.481 4.773 9.377 1.00 2.12 O ATOM 2736 CB TYR A 193 6.517 2.670 10.885 1.00 2.62 C ATOM 2737 CG TYR A 193 7.873 2.262 11.376 1.00 2.00 C ATOM 2738 CD1 TYR A 193 8.500 1.157 10.824 1.00 2.32 C ATOM 2739 CD2 TYR A 193 8.562 2.997 12.345 1.00 2.00 C ATOM 2740 CE1 TYR A 193 9.754 0.804 11.197 1.00 2.49 C ATOM 2741 CE2 TYR A 193 9.816 2.611 12.741 1.00 3.75 C ATOM 2742 CZ TYR A 193 10.424 1.545 12.153 1.00 2.00 C ATOM 2743 OH TYR A 193 11.709 1.148 12.543 1.00 4.69 O ATOM 2744 HA TYR A 193 7.413 3.541 9.099 1.00 0.00 H ATOM 2745 HB3 TYR A 193 6.021 1.804 10.446 1.00 0.00 H ATOM 2746 HB2 TYR A 193 5.928 3.037 11.726 1.00 0.00 H ATOM 2747 HD2 TYR A 193 8.100 3.880 12.787 1.00 0.00 H ATOM 2748 HE2 TYR A 193 10.329 3.160 13.531 1.00 0.00 H ATOM 2749 HE1 TYR A 193 10.234 -0.063 10.744 1.00 0.00 H ATOM 2750 HD1 TYR A 193 7.976 0.561 10.077 1.00 0.00 H ATOM 2751 HH TYR A 193 11.702 0.911 13.504 1.00 0.00 H ATOM 2752 H TYR A 193 6.475 5.342 11.304 1.00 0.00 H ATOM 2753 N ILE A 194 5.079 2.995 8.157 1.00 2.13 N ATOM 2754 CA ILE A 194 3.800 2.861 7.472 1.00 2.64 C ATOM 2755 C ILE A 194 3.406 1.391 7.445 1.00 2.90 C ATOM 2756 O ILE A 194 4.280 0.516 7.273 1.00 2.00 O ATOM 2757 CB ILE A 194 3.887 3.457 6.061 1.00 2.90 C ATOM 2758 CG1 ILE A 194 2.599 3.147 5.272 1.00 3.90 C ATOM 2759 CG2 ILE A 194 5.116 2.984 5.265 1.00 3.34 C ATOM 2760 CD1 ILE A 194 2.388 4.086 4.062 1.00 4.72 C ATOM 2761 HA ILE A 194 3.028 3.415 8.006 1.00 0.00 H ATOM 2762 HB ILE A 194 3.999 4.533 6.192 1.00 0.00 H ATOM 2763 HG12 ILE A 194 2.652 2.120 4.910 1.00 0.00 H ATOM 2764 HG13 ILE A 194 1.747 3.250 5.944 1.00 0.00 H ATOM 2765 HD11 ILE A 194 2.322 5.117 4.411 1.00 0.00 H ATOM 2766 HD12 ILE A 194 3.229 3.986 3.375 1.00 0.00 H ATOM 2767 HD13 ILE A 194 1.465 3.815 3.550 1.00 0.00 H ATOM 2768 HG21 ILE A 194 6.024 3.271 5.796 1.00 0.00 H ATOM 2769 HG22 ILE A 194 5.083 1.900 5.159 1.00 0.00 H ATOM 2770 HG23 ILE A 194 5.109 3.447 4.278 1.00 0.00 H ATOM 2771 H ILE A 194 5.853 2.350 7.900 1.00 0.00 H ATOM 2772 N ARG A 195 2.115 1.123 7.603 1.00 2.13 N ATOM 2773 CA ARG A 195 1.579 -0.184 7.314 1.00 2.78 C ATOM 2774 C ARG A 195 0.782 -0.107 6.002 1.00 2.19 C ATOM 2775 O ARG A 195 -0.049 0.801 5.822 1.00 3.18 O ATOM 2776 CB ARG A 195 0.674 -0.637 8.438 1.00 3.12 C ATOM 2777 CG ARG A 195 1.444 -0.958 9.668 1.00 2.76 C ATOM 2778 CD ARG A 195 0.569 -1.351 10.867 1.00 3.87 C ATOM 2779 NE ARG A 195 -0.221 -0.217 11.329 1.00 4.50 N ATOM 2780 CZ ARG A 195 -1.452 -0.286 11.837 1.00 7.85 C ATOM 2781 NH1 ARG A 195 -2.087 -1.458 11.989 1.00 7.92 N ATOM 2782 NH2 ARG A 195 -2.064 0.839 12.211 1.00 7.17 N ATOM 2783 HA ARG A 195 2.393 -0.902 7.216 1.00 0.00 H ATOM 2784 HB2 ARG A 195 -0.036 0.159 8.663 1.00 0.00 H ATOM 2785 HB3 ARG A 195 0.131 -1.527 8.118 1.00 0.00 H ATOM 2786 HG2 ARG A 195 2.115 -1.788 9.446 1.00 0.00 H ATOM 2787 HG3 ARG A 195 2.031 -0.082 9.944 1.00 0.00 H ATOM 2788 HD2 ARG A 195 1.210 -1.694 11.679 1.00 0.00 H ATOM 2789 HD3 ARG A 195 -0.102 -2.157 10.570 1.00 0.00 H ATOM 2790 HE ARG A 195 0.212 0.726 11.256 1.00 0.00 H ATOM 2791 HH12 ARG A 195 -3.047 -1.481 12.388 1.00 0.00 H ATOM 2792 HH11 ARG A 195 -1.619 -2.343 11.708 1.00 0.00 H ATOM 2793 HH22 ARG A 195 -3.024 0.801 12.609 1.00 0.00 H ATOM 2794 HH21 ARG A 195 -1.581 1.754 12.105 1.00 0.00 H ATOM 2795 H ARG A 195 1.477 1.871 7.942 1.00 0.00 H ATOM 2796 N ILE A 196 1.066 -1.034 5.097 1.00 2.48 N ATOM 2797 CA ILE A 196 0.296 -1.170 3.869 1.00 2.61 C ATOM 2798 C ILE A 196 -0.334 -2.543 3.840 1.00 3.00 C ATOM 2799 O ILE A 196 0.254 -3.482 4.355 1.00 3.91 O ATOM 2800 CB ILE A 196 1.117 -0.951 2.602 1.00 2.00 C ATOM 2801 CG1 ILE A 196 2.169 -2.038 2.330 1.00 2.31 C ATOM 2802 CG2 ILE A 196 1.775 0.501 2.615 1.00 2.00 C ATOM 2803 CD1 ILE A 196 2.908 -1.783 0.975 1.00 2.40 C ATOM 2804 HA ILE A 196 -0.462 -0.387 3.876 1.00 0.00 H ATOM 2805 HB ILE A 196 0.415 -1.026 1.771 1.00 0.00 H ATOM 2806 HG12 ILE A 196 2.899 -2.037 3.139 1.00 0.00 H ATOM 2807 HG13 ILE A 196 1.675 -3.009 2.289 1.00 0.00 H ATOM 2808 HD11 ILE A 196 2.183 -1.788 0.161 1.00 0.00 H ATOM 2809 HD12 ILE A 196 3.408 -0.815 1.012 1.00 0.00 H ATOM 2810 HD13 ILE A 196 3.646 -2.569 0.811 1.00 0.00 H ATOM 2811 HG21 ILE A 196 0.989 1.254 2.666 1.00 0.00 H ATOM 2812 HG22 ILE A 196 2.427 0.595 3.484 1.00 0.00 H ATOM 2813 HG23 ILE A 196 2.358 0.643 1.705 1.00 0.00 H ATOM 2814 H ILE A 196 1.861 -1.682 5.269 1.00 0.00 H ATOM 2815 N ALA A 197 -1.491 -2.651 3.206 1.00 2.47 N ATOM 2816 CA ALA A 197 -2.164 -3.944 3.066 1.00 2.82 C ATOM 2817 C ALA A 197 -1.234 -4.940 2.366 1.00 3.42 C ATOM 2818 O ALA A 197 -0.457 -4.531 1.482 1.00 3.21 O ATOM 2819 CB ALA A 197 -3.498 -3.783 2.307 1.00 4.37 C ATOM 2820 HA ALA A 197 -2.399 -4.335 4.056 1.00 0.00 H ATOM 2821 HB1 ALA A 197 -4.148 -3.104 2.858 1.00 0.00 H ATOM 2822 HB2 ALA A 197 -3.303 -3.376 1.315 1.00 0.00 H ATOM 2823 HB3 ALA A 197 -3.981 -4.756 2.214 1.00 0.00 H ATOM 2824 H ALA A 197 -1.931 -1.801 2.799 1.00 0.00 H ATOM 2825 N LYS A 198 -1.272 -6.200 2.815 1.00 2.15 N ATOM 2826 CA LYS A 198 -0.404 -7.267 2.336 1.00 2.19 C ATOM 2827 C LYS A 198 -1.260 -8.288 1.603 1.00 3.89 C ATOM 2828 O LYS A 198 -2.359 -8.662 2.078 1.00 4.18 O ATOM 2829 CB LYS A 198 0.295 -7.923 3.541 1.00 3.51 C ATOM 2830 CG LYS A 198 1.174 -9.091 3.194 1.00 2.00 C ATOM 2831 CD LYS A 198 2.043 -9.461 4.371 1.00 2.65 C ATOM 2832 CE LYS A 198 2.894 -10.752 4.090 1.00 5.04 C ATOM 2833 NZ LYS A 198 2.082 -11.964 3.922 1.00 2.40 N ATOM 2834 HA LYS A 198 0.354 -6.874 1.659 1.00 0.00 H ATOM 2835 HB2 LYS A 198 0.910 -7.168 4.030 1.00 0.00 H ATOM 2836 HB3 LYS A 198 -0.473 -8.269 4.233 1.00 0.00 H ATOM 2837 HG2 LYS A 198 0.550 -9.943 2.925 1.00 0.00 H ATOM 2838 HG3 LYS A 198 1.808 -8.825 2.348 1.00 0.00 H ATOM 2839 HD2 LYS A 198 2.719 -8.633 4.584 1.00 0.00 H ATOM 2840 HD3 LYS A 198 1.406 -9.640 5.237 1.00 0.00 H ATOM 2841 HE2 LYS A 198 3.575 -10.906 4.927 1.00 0.00 H ATOM 2842 HE3 LYS A 198 3.471 -10.594 3.179 1.00 0.00 H ATOM 2843 HZ1 LYS A 198 1.533 -12.135 4.789 1.00 0.00 H ATOM 2844 HZ2 LYS A 198 1.434 -11.837 3.119 1.00 0.00 H ATOM 2845 HZ3 LYS A 198 2.706 -12.776 3.740 1.00 0.00 H ATOM 2846 H LYS A 198 -1.966 -6.432 3.554 1.00 0.00 H ATOM 2847 N GLY A 199 -0.781 -8.715 0.437 1.00 3.39 N ATOM 2848 CA GLY A 199 -1.432 -9.794 -0.299 1.00 5.24 C ATOM 2849 C GLY A 199 -2.033 -9.340 -1.618 1.00 5.82 C ATOM 2850 O GLY A 199 -2.477 -10.202 -2.403 1.00 6.35 O ATOM 2851 HA3 GLY A 199 -2.228 -10.206 0.321 1.00 0.00 H ATOM 2852 HA2 GLY A 199 -0.694 -10.570 -0.503 1.00 0.00 H ATOM 2853 H GLY A 199 0.073 -8.271 0.043 1.00 0.00 H ATOM 2854 N SER A 200 -2.047 -8.028 -1.880 1.00 4.42 N ATOM 2855 CA SER A 200 -2.624 -7.455 -3.137 1.00 3.85 C ATOM 2856 C SER A 200 -1.611 -6.627 -3.941 1.00 3.13 C ATOM 2857 O SER A 200 -1.950 -5.811 -4.800 1.00 3.16 O ATOM 2858 CB SER A 200 -3.860 -6.646 -2.811 1.00 4.34 C ATOM 2859 OG SER A 200 -3.551 -5.660 -1.855 1.00 6.85 O ATOM 2860 HA SER A 200 -2.900 -8.291 -3.780 1.00 0.00 H ATOM 2861 HB2 SER A 200 -4.630 -7.307 -2.413 1.00 0.00 H ATOM 2862 HB3 SER A 200 -4.228 -6.167 -3.718 1.00 0.00 H ATOM 2863 HG SER A 200 -4.365 -5.136 -1.648 1.00 0.00 H ATOM 2864 H SER A 200 -1.639 -7.377 -1.179 1.00 0.00 H ATOM 2865 N ASN A 201 -0.344 -6.855 -3.625 1.00 3.27 N ATOM 2866 CA ASN A 201 0.778 -6.098 -4.204 1.00 2.83 C ATOM 2867 C ASN A 201 0.585 -4.579 -4.153 1.00 2.87 C ATOM 2868 O ASN A 201 0.883 -3.819 -5.112 1.00 3.38 O ATOM 2869 CB ASN A 201 1.102 -6.558 -5.625 1.00 3.61 C ATOM 2870 CG ASN A 201 2.487 -6.092 -6.095 1.00 3.68 C ATOM 2871 OD1 ASN A 201 3.404 -5.958 -5.278 1.00 3.41 O ATOM 2872 ND2 ASN A 201 2.650 -5.912 -7.434 1.00 2.00 N ATOM 2873 HA ASN A 201 1.634 -6.321 -3.567 1.00 0.00 H ATOM 2874 HB2 ASN A 201 1.071 -7.647 -5.655 1.00 0.00 H ATOM 2875 HB3 ASN A 201 0.349 -6.155 -6.303 1.00 0.00 H ATOM 2876 HD22 ASN A 201 1.843 -6.038 -8.078 1.00 0.00 H ATOM 2877 HD21 ASN A 201 3.582 -5.649 -7.814 1.00 0.00 H ATOM 2878 H ASN A 201 -0.133 -7.604 -2.935 1.00 0.00 H ATOM 2879 N GLN A 202 0.129 -4.129 -2.992 1.00 2.54 N ATOM 2880 CA GLN A 202 0.029 -2.683 -2.719 1.00 3.06 C ATOM 2881 C GLN A 202 1.370 -1.994 -2.926 1.00 2.40 C ATOM 2882 O GLN A 202 2.401 -2.444 -2.431 1.00 2.00 O ATOM 2883 CB GLN A 202 -0.422 -2.457 -1.261 1.00 4.79 C ATOM 2884 CG GLN A 202 -1.902 -2.779 -0.996 1.00 5.72 C ATOM 2885 CD GLN A 202 -2.825 -1.806 -1.693 1.00 9.74 C ATOM 2886 OE1 GLN A 202 -2.918 -0.648 -1.308 1.00 13.50 O ATOM 2887 NE2 GLN A 202 -3.521 -2.284 -2.679 1.00 16.53 N ATOM 2888 HA GLN A 202 -0.699 -2.260 -3.411 1.00 0.00 H ATOM 2889 HB2 GLN A 202 0.186 -3.090 -0.614 1.00 0.00 H ATOM 2890 HB3 GLN A 202 -0.250 -1.410 -1.009 1.00 0.00 H ATOM 2891 HG2 GLN A 202 -2.114 -3.786 -1.356 1.00 0.00 H ATOM 2892 HG3 GLN A 202 -2.086 -2.732 0.077 1.00 0.00 H ATOM 2893 HE22 GLN A 202 -3.403 -3.277 -2.966 1.00 0.00 H ATOM 2894 HE21 GLN A 202 -4.197 -1.674 -3.182 1.00 0.00 H ATOM 2895 H GLN A 202 -0.163 -4.808 -2.261 1.00 0.00 H ATOM 2896 N CYS A 203 1.338 -0.922 -3.730 1.00 2.00 N ATOM 2897 CA CYS A 203 2.440 -0.038 -3.997 1.00 2.00 C ATOM 2898 C CYS A 203 3.538 -0.766 -4.761 1.00 2.00 C ATOM 2899 O CYS A 203 4.645 -0.300 -4.787 1.00 2.00 O ATOM 2900 CB CYS A 203 3.045 0.507 -2.693 1.00 2.48 C ATOM 2901 SG CYS A 203 1.860 1.074 -1.422 1.00 2.37 S ATOM 2902 HA CYS A 203 2.051 0.788 -4.592 1.00 0.00 H ATOM 2903 HB2 CYS A 203 3.684 1.351 -2.951 1.00 0.00 H ATOM 2904 HB3 CYS A 203 3.651 -0.284 -2.252 1.00 0.00 H ATOM 2905 H CYS A 203 0.436 -0.711 -4.203 1.00 0.00 H ATOM 2906 N LEU A 204 3.214 -1.915 -5.355 1.00 2.00 N ATOM 2907 CA LEU A 204 4.172 -2.707 -6.132 1.00 2.00 C ATOM 2908 C LEU A 204 5.301 -3.248 -5.247 1.00 2.65 C ATOM 2909 O LEU A 204 6.428 -3.527 -5.706 1.00 2.38 O ATOM 2910 CB LEU A 204 4.708 -1.916 -7.322 1.00 2.46 C ATOM 2911 CG LEU A 204 3.701 -1.242 -8.274 1.00 2.12 C ATOM 2912 CD1 LEU A 204 4.398 -0.434 -9.363 1.00 5.53 C ATOM 2913 CD2 LEU A 204 2.860 -2.398 -8.930 1.00 2.78 C ATOM 2914 HA LEU A 204 3.641 -3.570 -6.533 1.00 0.00 H ATOM 2915 HB2 LEU A 204 5.349 -1.130 -6.923 1.00 0.00 H ATOM 2916 HB3 LEU A 204 5.307 -2.602 -7.921 1.00 0.00 H ATOM 2917 HG LEU A 204 3.076 -0.545 -7.716 1.00 0.00 H ATOM 2918 HD21 LEU A 204 3.526 -3.065 -9.477 1.00 0.00 H ATOM 2919 HD22 LEU A 204 2.344 -2.958 -8.150 1.00 0.00 H ATOM 2920 HD23 LEU A 204 2.129 -1.970 -9.616 1.00 0.00 H ATOM 2921 HD11 LEU A 204 5.006 0.345 -8.903 1.00 0.00 H ATOM 2922 HD12 LEU A 204 5.035 -1.094 -9.952 1.00 0.00 H ATOM 2923 HD13 LEU A 204 3.649 0.023 -10.010 1.00 0.00 H ATOM 2924 H LEU A 204 2.239 -2.265 -5.263 1.00 0.00 H ATOM 2925 N VAL A 205 4.977 -3.462 -3.978 1.00 2.06 N ATOM 2926 CA VAL A 205 5.948 -3.906 -2.967 1.00 2.00 C ATOM 2927 C VAL A 205 6.700 -5.196 -3.273 1.00 2.58 C ATOM 2928 O VAL A 205 7.814 -5.337 -2.798 1.00 3.54 O ATOM 2929 CB VAL A 205 5.277 -4.005 -1.603 1.00 2.93 C ATOM 2930 CG1 VAL A 205 4.259 -5.184 -1.584 1.00 2.03 C ATOM 2931 CG2 VAL A 205 6.260 -4.030 -0.421 1.00 3.46 C ATOM 2932 HA VAL A 205 6.718 -3.134 -2.976 1.00 0.00 H ATOM 2933 HB VAL A 205 4.720 -3.080 -1.453 1.00 0.00 H ATOM 2934 HG11 VAL A 205 3.496 -5.016 -2.345 1.00 0.00 H ATOM 2935 HG12 VAL A 205 4.782 -6.117 -1.792 1.00 0.00 H ATOM 2936 HG13 VAL A 205 3.789 -5.240 -0.602 1.00 0.00 H ATOM 2937 HG21 VAL A 205 6.921 -4.891 -0.518 1.00 0.00 H ATOM 2938 HG22 VAL A 205 6.852 -3.115 -0.423 1.00 0.00 H ATOM 2939 HG23 VAL A 205 5.702 -4.102 0.513 1.00 0.00 H ATOM 2940 H VAL A 205 3.991 -3.309 -3.685 1.00 0.00 H ATOM 2941 N LYS A 206 6.151 -6.110 -4.089 1.00 2.00 N ATOM 2942 CA LYS A 206 6.875 -7.368 -4.375 1.00 2.00 C ATOM 2943 C LYS A 206 7.919 -7.280 -5.505 1.00 2.00 C ATOM 2944 O LYS A 206 8.630 -8.237 -5.771 1.00 2.26 O ATOM 2945 CB LYS A 206 5.898 -8.501 -4.653 1.00 2.21 C ATOM 2946 CG LYS A 206 5.275 -8.510 -5.982 1.00 2.46 C ATOM 2947 CD LYS A 206 4.050 -9.465 -6.007 1.00 5.54 C ATOM 2948 CE LYS A 206 3.595 -9.637 -7.457 1.00 10.33 C ATOM 2949 NZ LYS A 206 2.619 -10.700 -7.609 1.00 13.55 N ATOM 2950 HA LYS A 206 7.445 -7.572 -3.468 1.00 0.00 H ATOM 2951 HB2 LYS A 206 6.436 -9.441 -4.531 1.00 0.00 H ATOM 2952 HB3 LYS A 206 5.101 -8.442 -3.912 1.00 0.00 H ATOM 2953 HG2 LYS A 206 4.947 -7.501 -6.231 1.00 0.00 H ATOM 2954 HG3 LYS A 206 6.006 -8.845 -6.718 1.00 0.00 H ATOM 2955 HD2 LYS A 206 4.330 -10.433 -5.592 1.00 0.00 H ATOM 2956 HD3 LYS A 206 3.240 -9.039 -5.416 1.00 0.00 H ATOM 2957 HE2 LYS A 206 4.465 -9.870 -8.072 1.00 0.00 H ATOM 2958 HE3 LYS A 206 3.150 -8.702 -7.798 1.00 0.00 H ATOM 2959 HZ1 LYS A 206 3.036 -11.599 -7.294 1.00 0.00 H ATOM 2960 HZ2 LYS A 206 1.781 -10.484 -7.032 1.00 0.00 H ATOM 2961 HZ3 LYS A 206 2.343 -10.776 -8.609 1.00 0.00 H ATOM 2962 H LYS A 206 5.220 -5.934 -4.518 1.00 0.00 H ATOM 2963 N GLU A 207 7.967 -6.152 -6.201 1.00 2.00 N ATOM 2964 CA GLU A 207 8.664 -6.107 -7.491 1.00 2.48 C ATOM 2965 C GLU A 207 10.181 -6.218 -7.361 1.00 3.16 C ATOM 2966 O GLU A 207 10.859 -6.858 -8.196 1.00 2.18 O ATOM 2967 CB GLU A 207 8.363 -4.801 -8.244 1.00 2.95 C ATOM 2968 CG GLU A 207 8.760 -4.876 -9.744 1.00 4.77 C ATOM 2969 CD GLU A 207 7.897 -3.996 -10.630 1.00 3.34 C ATOM 2970 OE1 GLU A 207 6.656 -3.987 -10.444 1.00 3.22 O ATOM 2971 OE2 GLU A 207 8.441 -3.351 -11.543 1.00 2.00 O ATOM 2972 HA GLU A 207 8.290 -6.971 -8.041 1.00 0.00 H ATOM 2973 HB2 GLU A 207 7.295 -4.595 -8.174 1.00 0.00 H ATOM 2974 HB3 GLU A 207 8.920 -3.990 -7.775 1.00 0.00 H ATOM 2975 HG2 GLU A 207 9.798 -4.560 -9.845 1.00 0.00 H ATOM 2976 HG3 GLU A 207 8.662 -5.909 -10.078 1.00 0.00 H ATOM 2977 H GLU A 207 7.508 -5.295 -5.830 1.00 0.00 H ATOM 2978 N GLU A 208 10.722 -5.543 -6.350 1.00 2.28 N ATOM 2979 CA GLU A 208 12.179 -5.424 -6.177 1.00 3.01 C ATOM 2980 C GLU A 208 12.612 -5.544 -4.714 1.00 2.50 C ATOM 2981 O GLU A 208 13.047 -4.595 -4.077 1.00 2.31 O ATOM 2982 CB GLU A 208 12.702 -4.126 -6.784 1.00 2.38 C ATOM 2983 CG GLU A 208 12.467 -3.920 -8.237 1.00 4.00 C ATOM 2984 CD GLU A 208 13.197 -4.872 -9.182 1.00 8.46 C ATOM 2985 OE1 GLU A 208 14.148 -5.599 -8.725 1.00 8.23 O ATOM 2986 OE2 GLU A 208 12.747 -4.973 -10.387 1.00 6.31 O ATOM 2987 HA GLU A 208 12.621 -6.264 -6.712 1.00 0.00 H ATOM 2988 HB2 GLU A 208 12.229 -3.300 -6.253 1.00 0.00 H ATOM 2989 HB3 GLU A 208 13.779 -4.094 -6.617 1.00 0.00 H ATOM 2990 HG2 GLU A 208 11.398 -4.026 -8.419 1.00 0.00 H ATOM 2991 HG3 GLU A 208 12.777 -2.904 -8.483 1.00 0.00 H ATOM 2992 H GLU A 208 10.095 -5.084 -5.659 1.00 0.00 H ATOM 2993 N ALA A 209 12.444 -6.754 -4.173 1.00 2.56 N ATOM 2994 CA ALA A 209 12.798 -7.111 -2.838 1.00 2.07 C ATOM 2995 C ALA A 209 14.178 -7.768 -2.792 1.00 2.00 C ATOM 2996 O ALA A 209 14.452 -8.743 -3.493 1.00 3.67 O ATOM 2997 CB ALA A 209 11.734 -8.068 -2.281 1.00 2.00 C ATOM 2998 HA ALA A 209 12.841 -6.209 -2.228 1.00 0.00 H ATOM 2999 HB1 ALA A 209 10.763 -7.572 -2.286 1.00 0.00 H ATOM 3000 HB2 ALA A 209 11.690 -8.962 -2.903 1.00 0.00 H ATOM 3001 HB3 ALA A 209 11.996 -8.347 -1.260 1.00 0.00 H ATOM 3002 H ALA A 209 12.023 -7.493 -4.771 1.00 0.00 H ATOM 3003 N SER A 210 15.055 -7.223 -1.971 1.00 2.09 N ATOM 3004 CA SER A 210 16.405 -7.747 -1.864 1.00 2.00 C ATOM 3005 C SER A 210 17.015 -7.506 -0.499 1.00 2.00 C ATOM 3006 O SER A 210 16.494 -6.751 0.292 1.00 2.00 O ATOM 3007 CB SER A 210 17.280 -7.175 -2.990 1.00 4.03 C ATOM 3008 OG SER A 210 17.462 -5.802 -2.856 1.00 3.89 O ATOM 3009 HA SER A 210 16.353 -8.830 -1.979 1.00 0.00 H ATOM 3010 HB2 SER A 210 16.799 -7.376 -3.947 1.00 0.00 H ATOM 3011 HB3 SER A 210 18.254 -7.665 -2.964 1.00 0.00 H ATOM 3012 HG SER A 210 18.029 -5.472 -3.597 1.00 0.00 H ATOM 3013 H SER A 210 14.775 -6.406 -1.392 1.00 0.00 H ATOM 3014 N SER A 211 18.141 -8.153 -0.210 1.00 2.00 N ATOM 3015 CA SER A 211 18.822 -7.947 1.070 1.00 2.00 C ATOM 3016 C SER A 211 20.324 -8.204 0.937 1.00 2.34 C ATOM 3017 O SER A 211 20.754 -9.112 0.219 1.00 2.94 O ATOM 3018 CB SER A 211 18.270 -8.891 2.121 1.00 2.00 C ATOM 3019 OG SER A 211 18.974 -8.820 3.359 1.00 3.52 O ATOM 3020 HA SER A 211 18.652 -6.912 1.368 1.00 0.00 H ATOM 3021 HB2 SER A 211 18.336 -9.911 1.742 1.00 0.00 H ATOM 3022 HB3 SER A 211 17.225 -8.639 2.300 1.00 0.00 H ATOM 3023 HG SER A 211 19.924 -9.056 3.211 1.00 0.00 H ATOM 3024 H SER A 211 18.544 -8.815 -0.904 1.00 0.00 H ATOM 3025 N ALA A 212 21.091 -7.396 1.653 1.00 2.17 N ATOM 3026 CA ALA A 212 22.492 -7.675 1.862 1.00 3.81 C ATOM 3027 C ALA A 212 22.680 -8.975 2.630 1.00 2.62 C ATOM 3028 O ALA A 212 21.784 -9.408 3.330 1.00 2.69 O ATOM 3029 CB ALA A 212 23.116 -6.506 2.638 1.00 3.42 C ATOM 3030 HA ALA A 212 22.984 -7.787 0.896 1.00 0.00 H ATOM 3031 HB1 ALA A 212 23.003 -5.588 2.062 1.00 0.00 H ATOM 3032 HB2 ALA A 212 22.612 -6.399 3.598 1.00 0.00 H ATOM 3033 HB3 ALA A 212 24.175 -6.705 2.802 1.00 0.00 H ATOM 3034 H ALA A 212 20.675 -6.541 2.074 1.00 0.00 H ATOM 3035 N VAL A 213 23.839 -9.597 2.443 1.00 2.71 N ATOM 3036 CA VAL A 213 24.259 -10.784 3.172 1.00 2.88 C ATOM 3037 C VAL A 213 25.473 -10.396 3.986 1.00 2.00 C ATOM 3038 O VAL A 213 26.429 -9.917 3.434 1.00 2.31 O ATOM 3039 CB VAL A 213 24.621 -11.910 2.232 1.00 3.90 C ATOM 3040 CG1 VAL A 213 25.196 -13.139 3.010 1.00 3.55 C ATOM 3041 CG2 VAL A 213 23.359 -12.292 1.372 1.00 2.81 C ATOM 3042 HA VAL A 213 23.444 -11.138 3.804 1.00 0.00 H ATOM 3043 HB VAL A 213 25.412 -11.578 1.559 1.00 0.00 H ATOM 3044 HG11 VAL A 213 26.093 -12.837 3.552 1.00 0.00 H ATOM 3045 HG12 VAL A 213 24.449 -13.503 3.715 1.00 0.00 H ATOM 3046 HG13 VAL A 213 25.446 -13.930 2.303 1.00 0.00 H ATOM 3047 HG21 VAL A 213 22.553 -12.611 2.033 1.00 0.00 H ATOM 3048 HG22 VAL A 213 23.036 -11.424 0.797 1.00 0.00 H ATOM 3049 HG23 VAL A 213 23.616 -13.104 0.692 1.00 0.00 H ATOM 3050 H VAL A 213 24.489 -9.210 1.729 1.00 0.00 H ATOM 3051 N VAL A 214 25.399 -10.603 5.296 1.00 3.57 N ATOM 3052 CA VAL A 214 26.570 -10.490 6.204 1.00 3.59 C ATOM 3053 C VAL A 214 27.146 -11.876 6.475 1.00 8.09 C ATOM 3054 O VAL A 214 26.405 -12.790 6.942 1.00 6.76 O ATOM 3055 CB VAL A 214 26.171 -9.831 7.546 1.00 4.21 C ATOM 3056 CG1 VAL A 214 27.363 -9.738 8.493 1.00 3.89 C ATOM 3057 CG2 VAL A 214 25.621 -8.423 7.299 1.00 4.85 C ATOM 3058 HA VAL A 214 27.318 -9.864 5.718 1.00 0.00 H ATOM 3059 HB VAL A 214 25.405 -10.455 8.005 1.00 0.00 H ATOM 3060 HG11 VAL A 214 27.743 -10.739 8.697 1.00 0.00 H ATOM 3061 HG12 VAL A 214 28.147 -9.138 8.031 1.00 0.00 H ATOM 3062 HG13 VAL A 214 27.049 -9.270 9.426 1.00 0.00 H ATOM 3063 HG21 VAL A 214 26.386 -7.815 6.815 1.00 0.00 H ATOM 3064 HG22 VAL A 214 24.743 -8.485 6.656 1.00 0.00 H ATOM 3065 HG23 VAL A 214 25.344 -7.970 8.251 1.00 0.00 H ATOM 3066 H VAL A 214 24.477 -10.856 5.706 1.00 0.00 H ATOM 3067 N GLY A 215 28.448 -12.013 6.225 1.00 10.90 N ATOM 3068 CA GLY A 215 29.136 -13.335 6.398 1.00 13.73 C ATOM 3069 C GLY A 215 30.002 -13.339 7.645 1.00 16.08 C ATOM 3070 O GLY A 215 30.418 -14.404 8.165 1.00 16.69 O ATOM 3071 HA3 GLY A 215 29.763 -13.527 5.528 1.00 0.00 H ATOM 3072 HA2 GLY A 215 28.384 -14.120 6.483 1.00 0.00 H ATOM 3073 OXT GLY A 215 30.311 -12.237 8.152 1.00 17.99 O ATOM 3074 H GLY A 215 28.996 -11.189 5.905 1.00 0.00 H TER 3075 GLY A 215 HETATM 3076 O HOH 1 25.452 9.166 6.558 1.00 2.69 O HETATM 3077 O HOH 2 4.713 -15.258 -7.563 1.00 25.28 O HETATM 3078 O HOH 3 38.310 3.198 7.886 1.00 16.43 O HETATM 3079 O HOH 4 9.810 -4.004 -4.219 1.00 2.00 O HETATM 3080 O HOH 5 7.699 -12.740 -11.218 1.00 13.65 O HETATM 3081 O HOH 6 11.355 -8.946 -5.740 1.00 2.73 O HETATM 3082 O HOH 7 25.285 8.131 -5.585 1.00 2.93 O HETATM 3083 O HOH 8 9.670 8.187 8.126 1.00 3.42 O HETATM 3084 O HOH 9 14.992 -15.326 -5.811 1.00 29.19 O HETATM 3085 O HOH 10 -4.131 12.775 7.563 1.00 16.15 O HETATM 3086 O HOH 11 9.381 6.970 17.689 1.00 20.72 O HETATM 3087 O HOH 12 21.856 5.949 -14.420 1.00 29.04 O HETATM 3088 O HOH 13 11.383 -3.237 -11.873 1.00 2.58 O HETATM 3089 O HOH 14 22.437 5.953 -11.659 1.00 5.74 O HETATM 3090 O HOH 15 25.975 -11.062 -4.272 1.00 9.28 O HETATM 3091 O HOH 16 14.547 -2.185 16.895 1.00 5.24 O HETATM 3092 O HOH 17 8.760 -10.323 16.173 1.00 9.92 O HETATM 3093 O HOH 18 29.699 14.020 6.142 1.00 4.35 O HETATM 3094 O HOH 19 18.183 -20.580 8.408 1.00 18.27 O HETATM 3095 O HOH 20 15.625 -21.667 8.604 1.00 18.09 O HETATM 3096 O HOH 21 13.653 2.824 4.836 1.00 6.60 O HETATM 3097 O HOH 22 9.388 6.231 -11.289 1.00 16.64 O HETATM 3098 O HOH 23 3.202 -1.330 13.808 1.00 15.24 O HETATM 3099 O HOH 24 24.126 11.728 10.155 1.00 5.10 O HETATM 3100 O HOH 25 17.268 -2.463 -5.889 1.00 4.83 O HETATM 3101 O HOH 26 -3.157 8.132 6.858 1.00 5.71 O HETATM 3102 O HOH 27 -2.747 6.157 -0.600 1.00 13.32 O HETATM 3103 O HOH 28 13.651 7.960 17.125 1.00 24.76 O HETATM 3104 O HOH 29 16.916 17.303 6.790 1.00 21.64 O HETATM 3105 O HOH 30 15.496 -6.154 -6.376 1.00 6.68 O HETATM 3106 O HOH 31 -4.086 9.335 11.359 1.00 23.43 O HETATM 3107 O HOH 32 26.679 16.819 8.064 1.00 11.18 O HETATM 3108 O HOH 33 11.065 2.906 -11.474 1.00 13.39 O HETATM 3109 O HOH 34 -3.030 7.731 4.095 1.00 21.57 O HETATM 3110 O HOH 35 13.661 4.777 2.987 1.00 5.56 O HETATM 3111 O HOH 36 28.929 -11.580 -3.400 1.00 23.79 O HETATM 3112 O HOH 37 -0.008 -5.934 -0.730 1.00 3.31 O HETATM 3113 O HOH 38 19.931 6.428 16.844 1.00 16.65 O HETATM 3114 O HOH 39 22.225 17.056 5.856 1.00 7.47 O HETATM 3115 O HOH 40 13.080 2.301 14.500 1.00 6.77 O HETATM 3116 O HOH 41 15.717 -4.193 -4.274 1.00 4.26 O HETATM 3117 O HOH 42 22.606 19.262 1.105 1.00 4.36 O HETATM 3118 O HOH 43 11.807 -16.757 0.055 1.00 16.89 O HETATM 3119 O HOH 44 2.080 12.865 6.860 1.00 16.22 O HETATM 3120 O HOH 45 1.670 11.179 11.448 1.00 12.24 O HETATM 3121 O HOH 46 23.765 -2.364 12.665 1.00 5.98 O HETATM 3122 O HOH 47 19.042 5.806 13.284 1.00 7.71 O HETATM 3123 O HOH 48 22.858 -11.447 6.428 1.00 6.06 O HETATM 3124 O HOH 49 2.151 7.017 -12.039 1.00 14.64 O HETATM 3125 O HOH 50 39.031 4.138 2.793 1.00 17.50 O HETATM 3126 O HOH 51 16.581 3.560 7.916 1.00 7.53 O HETATM 3127 O HOH 52 -5.607 -4.546 9.927 1.00 8.70 O HETATM 3128 O HOH 53 6.850 10.200 -7.361 1.00 19.19 O HETATM 3129 O HOH 54 10.238 -17.058 14.197 1.00 21.84 O HETATM 3130 O HOH 55 23.773 16.607 -5.367 1.00 5.53 O HETATM 3131 O HOH 56 31.730 4.359 -7.783 1.00 8.91 O HETATM 3132 O HOH 57 2.924 6.664 -9.664 1.00 6.76 O HETATM 3133 O HOH 58 26.468 -7.334 -3.402 1.00 8.58 O HETATM 3134 O HOH 59 22.502 -11.618 9.416 1.00 5.66 O HETATM 3135 O HOH 60 26.483 19.856 -0.264 1.00 5.02 O HETATM 3136 O HOH 61 2.412 -18.469 6.561 1.00 17.29 O HETATM 3137 O HOH 62 26.237 -2.616 -10.041 1.00 12.45 O HETATM 3138 O HOH 63 2.450 -12.252 -4.232 1.00 8.33 O HETATM 3139 O HOH 64 3.151 -14.221 -10.475 1.00 25.61 O HETATM 3140 O HOH 65 18.815 19.602 6.348 1.00 22.30 O HETATM 3141 O HOH 66 19.848 -12.638 8.960 1.00 8.16 O HETATM 3142 O HOH 67 16.640 1.306 17.810 1.00 18.10 O HETATM 3143 O HOH 68 -2.811 -5.163 14.238 1.00 25.47 O HETATM 3144 O HOH 69 32.231 5.981 14.482 1.00 6.53 O HETATM 3145 O HOH 70 18.394 -18.897 6.317 1.00 3.98 O HETATM 3146 O HOH 71 -2.643 10.273 -1.199 1.00 23.43 O HETATM 3147 O HOH 72 15.710 -18.965 4.965 1.00 6.05 O HETATM 3148 O HOH 73 20.143 -15.125 7.629 1.00 10.82 O HETATM 3149 O HOH 74 36.950 14.524 -1.448 1.00 25.63 O HETATM 3150 O HOH 75 23.916 -0.994 19.990 1.00 19.35 O HETATM 3151 O HOH 76 7.289 7.856 -11.122 1.00 12.50 O HETATM 3152 O HOH 77 22.872 9.072 7.573 1.00 6.16 O HETATM 3153 O HOH 78 14.728 11.379 11.703 1.00 9.55 O HETATM 3154 O HOH 79 15.048 -23.973 9.053 1.00 17.54 O HETATM 3155 O HOH 80 19.732 -17.867 10.044 1.00 26.63 O HETATM 3156 O HOH 81 13.144 -7.150 -12.025 1.00 6.51 O HETATM 3157 O HOH 82 9.628 -19.399 9.664 1.00 10.16 O HETATM 3158 O HOH 83 11.514 -21.737 9.628 1.00 16.12 O HETATM 3159 O HOH 84 30.270 -9.708 5.988 1.00 9.79 O HETATM 3160 O HOH 85 1.577 5.250 -3.914 1.00 5.07 O HETATM 3161 O HOH 86 32.319 13.127 6.716 1.00 10.69 O HETATM 3162 O HOH 87 -4.461 0.130 -4.499 1.00 13.97 O HETATM 3163 O HOH 88 5.107 2.296 14.181 1.00 11.02 O HETATM 3164 O HOH 89 31.905 12.062 15.623 1.00 13.23 O HETATM 3165 O HOH 90 32.219 -11.109 -1.180 1.00 19.56 O HETATM 3166 O HOH 91 14.640 -8.840 -6.248 1.00 9.92 O HETATM 3167 O HOH 92 4.626 -16.420 4.178 1.00 7.15 O HETATM 3168 O HOH 93 -0.807 -17.102 9.017 1.00 20.29 O HETATM 3169 O HOH 94 -2.510 -15.648 9.989 1.00 18.82 O HETATM 3170 O HOH 95 34.003 5.709 -7.963 1.00 24.76 O HETATM 3171 O HOH 96 27.173 5.416 14.011 1.00 4.26 O HETATM 3172 O HOH 97 7.785 1.394 -12.416 1.00 2.59 O HETATM 3173 O HOH 98 30.966 19.572 1.696 1.00 14.93 O HETATM 3174 O HOH 99 33.623 -9.148 7.649 1.00 14.20 O HETATM 3175 O HOH 100 16.914 15.858 -4.487 1.00 20.66 O HETATM 3176 O HOH 101 16.104 15.186 -6.663 1.00 35.71 O HETATM 3177 O HOH 102 9.565 -14.222 -8.808 1.00 13.20 O HETATM 3178 O HOH 103 0.806 -10.181 -4.437 1.00 9.10 O HETATM 3179 O HOH 104 19.618 -3.960 19.959 1.00 8.49 O HETATM 3180 O HOH 105 23.460 13.933 -5.969 1.00 6.23 O HETATM 3181 O HOH 106 17.751 -0.128 10.550 1.00 4.77 O HETATM 3182 O HOH 107 13.533 11.398 15.773 1.00 16.75 O HETATM 3183 O HOH 108 -7.504 -7.261 13.088 1.00 25.31 O HETATM 3184 O HOH 109 13.033 -8.755 -8.315 1.00 8.43 O HETATM 3185 O HOH 110 26.162 11.417 12.383 1.00 24.19 O HETATM 3186 O HOH 111 20.320 9.992 11.433 1.00 12.83 O HETATM 3187 O HOH 112 33.255 16.704 0.390 1.00 19.01 O HETATM 3188 O HOH 113 36.472 -3.969 -3.235 1.00 15.25 O HETATM 3189 O HOH 114 1.742 -16.270 7.921 1.00 9.28 O HETATM 3190 O HOH 115 3.406 9.258 14.887 1.00 12.28 O HETATM 3191 O HOH 116 -0.392 -15.951 0.641 1.00 19.77 O HETATM 3192 O HOH 117 -4.051 6.514 -2.745 1.00 28.45 O HETATM 3193 O HOH 118 12.699 12.065 13.297 1.00 6.61 O HETATM 3194 O HOH 119 27.457 10.664 16.591 1.00 17.34 O HETATM 3195 O HOH 120 21.047 3.845 -10.501 1.00 5.21 O HETATM 3196 O HOH 121 -5.717 -8.649 14.628 1.00 25.56 O HETATM 3197 O HOH 122 -2.030 -12.796 -2.120 1.00 19.19 O HETATM 3198 O HOH 123 29.949 14.754 3.393 1.00 4.45 O HETATM 3199 O HOH 124 8.809 2.193 16.116 1.00 23.49 O HETATM 3200 O HOH 125 16.159 -0.958 19.163 1.00 20.61 O HETATM 3201 O HOH 126 4.351 10.166 -9.706 1.00 23.82 O HETATM 3202 O HOH 127 36.629 13.167 5.932 1.00 20.10 O HETATM 3203 O HOH 128 22.402 -3.915 20.028 1.00 13.19 O HETATM 3204 O HOH 129 25.497 9.656 13.995 1.00 25.23 O HETATM 3205 O HOH 130 34.608 -7.413 -1.170 1.00 11.20 O HETATM 3206 O HOH 131 28.489 -3.716 15.662 1.00 26.15 O HETATM 3207 O HOH 132 27.544 0.110 18.072 1.00 20.24 O HETATM 3208 O HOH 133 24.917 9.030 -12.465 1.00 26.73 O HETATM 3209 O HOH 134 34.062 10.226 13.916 1.00 22.98 O HETATM 3210 O HOH 135 28.909 20.170 3.228 1.00 22.15 O HETATM 3211 O HOH 136 31.259 0.457 15.171 1.00 21.17 O HETATM 3212 O HOH 137 19.893 -13.416 -5.795 1.00 8.96 O HETATM 3213 O HOH 138 12.869 -11.767 -8.228 1.00 14.87 O HETATM 3214 O HOH 139 -1.994 -11.982 3.100 1.00 31.03 O HETATM 3215 O HOH 140 4.580 -5.753 16.842 1.00 6.48 O HETATM 3216 O HOH 141 3.619 -7.807 13.789 1.00 15.44 O HETATM 3217 O HOH 142 27.097 -0.922 -8.220 1.00 7.51 O HETATM 3218 O HOH 143 3.016 -13.198 -6.924 1.00 10.78 O HETATM 3219 O HOH 144 27.465 -13.113 0.031 1.00 8.04 O HETATM 3220 O HOH 145 0.546 -12.273 1.414 1.00 11.21 O HETATM 3221 O HOH 146 12.659 5.858 15.446 1.00 10.46 O HETATM 3222 O HOH 147 28.446 -8.366 -5.234 1.00 12.63 O HETATM 3223 O HOH 148 19.252 3.537 7.860 1.00 10.42 O HETATM 3224 O HOH 149 26.237 19.725 2.655 1.00 17.41 O HETATM 3225 O HOH 150 5.013 -5.401 -8.705 1.00 6.22 O HETATM 3226 O HOH 151 16.048 -5.965 -10.236 1.00 18.40 O HETATM 3227 O HOH 152 18.048 -4.470 -9.764 1.00 24.32 O HETATM 3228 O HOH 153 14.616 -8.861 -10.679 1.00 20.31 O HETATM 3229 O HOH 154 11.493 -12.485 -11.945 1.00 23.43 O HETATM 3230 O HOH 155 26.629 9.630 -8.118 1.00 8.96 O HETATM 3231 O HOH 156 14.909 5.669 8.408 1.00 5.12 O HETATM 3232 O HOH 157 34.062 13.942 5.324 1.00 18.30 O HETATM 3233 O HOH 158 33.279 13.459 9.484 1.00 23.41 O HETATM 3234 O HOH 159 32.976 -8.539 1.026 1.00 18.61 O HETATM 3235 O HOH 160 7.379 -15.833 -8.174 1.00 25.61 O HETATM 3236 O HOH 161 0.019 8.032 13.722 1.00 24.07 O HETATM 3237 O HOH 162 -7.106 -2.531 9.903 1.00 15.65 O HETATM 3238 O HOH 163 -9.437 4.378 0.311 1.00 22.28 O HETATM 3239 O HOH 164 -3.131 7.757 1.744 1.00 18.78 O HETATM 3240 O HOH 165 -1.557 -9.660 -5.968 1.00 25.13 O HETATM 3241 O HOH 166 33.713 7.055 -5.491 1.00 16.92 O HETATM 3242 O HOH 167 10.864 -14.384 13.462 1.00 20.12 O HETATM 3243 O HOH 168 18.188 -13.528 11.022 1.00 8.90 O HETATM 3244 O HOH 169 6.065 -10.455 16.263 1.00 8.78 O HETATM 3245 O HOH 170 25.310 11.596 -9.488 1.00 20.93 O HETATM 3246 O HOH 171 0.291 -13.392 -0.618 1.00 20.01 O HETATM 3247 O HOH 172 -1.870 -16.124 4.962 1.00 35.21 O HETATM 3248 O HOH 173 -4.854 -4.348 12.506 1.00 8.76 O HETATM 3249 O HOH 174 17.022 -2.763 -8.720 1.00 17.50 O HETATM 3250 O HOH 175 10.907 -18.082 12.010 1.00 26.24 O HETATM 3251 O HOH 176 25.564 3.432 16.233 1.00 12.92 O HETATM 3252 O HOH 177 3.777 -18.426 -3.152 1.00 14.60 O HETATM 3253 O HOH 178 38.155 6.483 5.899 1.00 9.06 O HETATM 3254 O HOH 179 2.716 -14.694 4.316 1.00 9.61 O HETATM 3255 O HOH 180 -1.877 4.944 13.533 1.00 14.32 O HETATM 3256 O HOH 181 15.801 1.861 5.926 1.00 6.42 O HETATM 3257 O HOH 182 5.508 7.091 -8.902 1.00 12.45 O HETATM 3258 O HOH 183 5.292 -12.302 -9.710 1.00 10.92 O HETATM 3259 O HOH 184 18.407 15.392 6.530 1.00 11.30 O HETATM 3260 O HOH 185 3.613 1.015 12.352 1.00 13.01 O HETATM 3261 O HOH 186 19.279 4.039 16.360 1.00 11.33 O HETATM 3262 O HOH 187 2.133 -14.278 -2.318 1.00 14.10 O HETATM 3263 O HOH 188 -2.905 1.914 -8.526 1.00 10.01 O HETATM 3264 O HOH 189 35.710 -0.395 13.100 1.00 8.46 O HETATM 3265 O HOH 190 15.363 -16.601 12.651 1.00 19.15 O HETATM 3266 O HOH 191 2.659 -11.017 -10.738 1.00 9.70 O HETATM 3267 O HOH 192 29.400 16.375 7.502 1.00 15.89 O HETATM 3268 O HOH 193 -0.981 9.303 1.990 1.00 10.51 O HETATM 3269 O HOH 194 2.157 5.875 -14.647 1.00 12.19 O HETATM 3270 O HOH 195 32.096 12.705 11.977 1.00 13.88 O HETATM 3271 O HOH 196 7.342 -2.937 17.795 1.00 12.61 O HETATM 3272 O HOH 197 -4.707 4.327 0.264 1.00 19.36 O HETATM 3273 O HOH 198 12.882 -0.135 16.151 1.00 16.04 O HETATM 3274 O HOH 199 29.879 -1.627 -8.213 1.00 12.62 O HETATM 3275 O HOH 200 21.408 17.601 -6.165 1.00 15.65 O HETATM 3276 O HOH 201 -4.757 -1.544 12.874 1.00 15.72 O HETATM 3277 O HOH 202 30.811 2.506 -9.504 1.00 18.20 O HETATM 3278 O HOH 203 -3.348 -8.986 14.835 1.00 17.96 O HETATM 3279 O HOH 204 0.498 -15.888 3.075 1.00 25.16 O HETATM 3280 O HOH 205 15.743 15.414 11.090 1.00 20.44 O HETATM 3281 O HOH 206 29.116 12.596 14.017 1.00 17.55 O HETATM 3282 O HOH 207 21.938 19.990 -7.506 1.00 10.86 O HETATM 3283 O HOH 208 10.060 5.395 15.433 1.00 8.20 O HETATM 3284 O HOH 209 31.167 17.223 3.497 1.00 15.07 O HETATM 3285 O HOH 210 -4.533 4.876 6.318 1.00 23.76 O HETATM 3286 O HOH 211 -0.170 9.220 -6.894 1.00 10.50 O HETATM 3287 O HOH 212 14.387 -21.018 6.303 1.00 7.56 O HETATM 3288 O HOH 213 29.627 -2.099 14.390 1.00 13.58 O HETATM 3289 O HOH 214 13.582 -18.607 12.343 1.00 20.51 O HETATM 3290 O HOH 215 16.233 11.299 -11.342 1.00 11.78 O HETATM 3291 O HOH 216 14.507 9.270 14.972 1.00 9.04 O HETATM 3292 O HOH 217 31.027 13.343 1.457 1.00 14.00 O HETATM 3293 O38 UNN A 218 11.883 9.861 -1.140 1.00 -0.17 O HETATM 3294 S29 UNN A 218 11.864 10.099 -2.504 1.00 -0.00 S HETATM 3295 O37 UNN A 218 12.637 11.205 -3.004 1.00 -0.17 O HETATM 3296 C29 UNN A 218 10.277 10.400 -2.902 1.00 0.09 C HETATM 3297 C30 UNN A 218 9.773 11.685 -3.047 1.00 -0.04 C HETATM 3298 C31 UNN A 218 8.408 11.915 -3.356 1.00 -0.06 C HETATM 3299 C32 UNN A 218 7.513 10.854 -3.524 1.00 -0.06 C HETATM 3300 C33 UNN A 218 8.006 9.592 -3.383 1.00 -0.06 C HETATM 3301 C34 UNN A 218 9.351 9.385 -3.034 1.00 -0.04 C HETATM 3302 H5 UNN A 218 9.681 8.368 -2.858 1.00 0.06 H HETATM 3303 H4 UNN A 218 7.355 8.740 -3.542 1.00 0.06 H HETATM 3304 H3 UNN A 218 6.469 11.029 -3.757 1.00 0.06 H HETATM 3305 H2 UNN A 218 8.052 12.933 -3.464 1.00 0.06 H HETATM 3306 H1 UNN A 218 10.438 12.532 -2.921 1.00 0.06 H HETATM 3307 C37 UNN A 218 12.280 8.639 -3.292 1.00 0.07 C HETATM 3308 C10 UNN A 218 13.776 8.437 -3.483 1.00 -0.01 C HETATM 3309 C11 UNN A 218 14.277 8.507 -4.936 1.00 0.04 C HETATM 3310 C20 UNN A 218 13.803 9.773 -5.709 1.00 -0.03 C HETATM 3311 C21 UNN A 218 14.588 9.887 -7.000 1.00 -0.05 C HETATM 3312 C23 UNN A 218 14.207 11.079 -7.918 1.00 -0.06 C HETATM 3313 C24 UNN A 218 14.081 12.343 -7.140 1.00 -0.07 C HETATM 3314 H17 UNN A 218 13.811 13.166 -7.818 1.00 0.02 H HETATM 3315 H18 UNN A 218 15.040 12.570 -6.652 1.00 0.02 H HETATM 3316 H19 UNN A 218 13.299 12.226 -6.375 1.00 0.02 H HETATM 3317 H15 UNN A 218 13.246 10.862 -8.407 1.00 0.03 H HETATM 3318 H16 UNN A 218 14.987 11.206 -8.683 1.00 0.03 H HETATM 3319 H13 UNN A 218 14.436 8.959 -7.571 1.00 0.03 H HETATM 3320 H14 UNN A 218 15.652 9.988 -6.740 1.00 0.03 H HETATM 3321 H11 UNN A 218 13.976 10.668 -5.093 1.00 0.03 H HETATM 3322 H12 UNN A 218 12.730 9.686 -5.936 1.00 0.03 H HETATM 3323 N12 UNN A 218 13.807 7.245 -5.564 1.00 -0.28 N HETATM 3324 C13 UNN A 218 14.592 6.259 -6.035 1.00 0.18 C HETATM 3325 O39 UNN A 218 15.895 6.369 -6.058 1.00 -0.40 O HETATM 3326 C14 UNN A 218 13.952 4.983 -6.579 1.00 0.07 C HETATM 3327 C15 UNN A 218 14.092 3.899 -5.499 1.00 -0.03 C HETATM 3328 C16 UNN A 218 13.500 2.565 -5.953 1.00 -0.05 C HETATM 3329 C17 UNN A 218 13.985 2.151 -7.328 1.00 -0.05 C HETATM 3330 C18 UNN A 218 13.859 3.259 -8.350 1.00 -0.03 C HETATM 3331 C19 UNN A 218 14.586 4.567 -7.882 1.00 0.05 C HETATM 3332 C39 UNN A 218 14.500 5.663 -8.888 1.00 0.14 C HETATM 3333 O41 UNN A 218 13.419 6.310 -9.042 1.00 -0.38 O HETATM 3334 C40 UNN A 218 15.719 6.018 -9.690 1.00 0.03 C HETATM 3335 C41 UNN A 218 16.836 5.164 -9.789 1.00 -0.04 C HETATM 3336 C42 UNN A 218 17.929 5.508 -10.566 1.00 -0.04 C HETATM 3337 C43 UNN A 218 17.872 6.707 -11.225 1.00 0.05 C HETATM 3338 C44 UNN A 218 16.814 7.553 -11.134 1.00 -0.04 C HETATM 3339 C45 UNN A 218 15.705 7.206 -10.363 1.00 -0.04 C HETATM 3340 H32 UNN A 218 14.848 7.867 -10.299 1.00 0.07 H HETATM 3341 H33 UNN A 218 16.831 8.500 -11.662 1.00 0.06 H HETATM 3342 CL22 UNN A 218 19.252 7.288 -12.185 1.00 -0.07 CL HETATM 3343 H34 UNN A 218 18.792 4.857 -10.649 1.00 0.06 H HETATM 3344 H31 UNN A 218 16.839 4.224 -9.249 1.00 0.07 H HETATM 3345 H30 UNN A 218 15.649 4.342 -7.712 1.00 0.05 H HETATM 3346 H28 UNN A 218 12.793 3.480 -8.506 1.00 0.03 H HETATM 3347 H29 UNN A 218 14.306 2.922 -9.297 1.00 0.03 H HETATM 3348 H26 UNN A 218 13.389 1.290 -7.667 1.00 0.03 H HETATM 3349 H27 UNN A 218 15.043 1.859 -7.255 1.00 0.03 H HETATM 3350 H24 UNN A 218 12.404 2.656 -5.979 1.00 0.03 H HETATM 3351 H25 UNN A 218 13.787 1.788 -5.229 1.00 0.03 H HETATM 3352 H22 UNN A 218 13.567 4.231 -4.591 1.00 0.03 H HETATM 3353 H23 UNN A 218 15.159 3.757 -5.274 1.00 0.03 H HETATM 3354 H21 UNN A 218 12.883 5.168 -6.762 1.00 0.06 H HETATM 3355 H20 UNN A 218 12.818 7.117 -5.644 1.00 0.19 H HETATM 3356 H10 UNN A 218 15.377 8.519 -4.932 1.00 0.06 H HETATM 3357 H8 UNN A 218 14.037 7.447 -3.083 1.00 0.03 H HETATM 3358 H9 UNN A 218 14.299 9.215 -2.907 1.00 0.03 H HETATM 3359 H6 UNN A 218 11.802 8.633 -4.283 1.00 0.05 H HETATM 3360 H7 UNN A 218 11.893 7.801 -2.693 1.00 0.05 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 310 309 892 CONECT 804 803 1425 CONECT 892 310 891 CONECT 1425 804 1424 CONECT 2166 2165 2901 CONECT 2901 2166 2900 CONECT 3293 3294 CONECT 3294 3293 3295 3296 3307 CONECT 3295 3294 CONECT 3296 3294 3297 3301 CONECT 3297 3296 3298 3306 CONECT 3298 3297 3299 3305 CONECT 3299 3298 3300 3304 CONECT 3300 3299 3301 3303 CONECT 3301 3296 3300 3302 CONECT 3302 3301 CONECT 3303 3300 CONECT 3304 3299 CONECT 3305 3298 CONECT 3306 3297 CONECT 3307 3294 3308 3359 3360 CONECT 3308 3307 3309 3357 3358 CONECT 3309 3308 3310 3323 3356 CONECT 3310 3309 3311 3321 3322 CONECT 3311 3310 3312 3319 3320 CONECT 3312 3311 3313 3317 3318 CONECT 3313 3312 3314 3315 3316 CONECT 3314 3313 CONECT 3315 3313 CONECT 3316 3313 CONECT 3317 3312 CONECT 3318 3312 CONECT 3319 3311 CONECT 3320 3311 CONECT 3321 3310 CONECT 3322 3310 CONECT 3323 3309 3324 3355 CONECT 3324 3323 3325 3326 CONECT 3325 3324 CONECT 3326 3324 3327 3331 3354 CONECT 3327 3326 3328 3352 3353 CONECT 3328 3327 3329 3350 3351 CONECT 3329 3328 3330 3348 3349 CONECT 3330 3329 3331 3346 3347 CONECT 3331 3326 3330 3332 3345 CONECT 3332 3331 3333 3334 CONECT 3333 3332 CONECT 3334 3332 3335 3339 CONECT 3335 3334 3336 3344 CONECT 3336 3335 3337 3343 CONECT 3337 3336 3338 3342 CONECT 3338 3337 3339 3341 CONECT 3339 3334 3338 3340 CONECT 3340 3339 CONECT 3341 3338 CONECT 3342 3337 CONECT 3343 3336 CONECT 3344 3335 CONECT 3345 3331 CONECT 3346 3330 CONECT 3347 3330 CONECT 3348 3329 CONECT 3349 3329 CONECT 3350 3328 CONECT 3351 3328 CONECT 3352 3327 CONECT 3353 3327 CONECT 3354 3326 CONECT 3355 3323 CONECT 3356 3309 CONECT 3357 3308 CONECT 3358 3308 CONECT 3359 3307 CONECT 3360 3307 MASTER 0 0 0 0 0 0 0 0 3359 1 78 17 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 3hd3
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1me3
RCSB PDB
PDBbind
215aa, >1ME3_1|Chain... at 99%
1me4
RCSB PDB
PDBbind
215aa, >1ME4_1|Chain... at 99%
1u9q
RCSB PDB
PDBbind
215aa, >1U9Q_1|Chain... at 99%
2oz2
RCSB PDB
PDBbind
215aa, >2OZ2_1|Chains... at 99%
3i06
RCSB PDB
PDBbind
215aa, >3I06_1|Chain... at 99%
3iut
RCSB PDB
PDBbind
221aa, >3IUT_1|Chain... *
3kku
RCSB PDB
PDBbind
215aa, >3KKU_1|Chain... at 99%
3lxs
RCSB PDB
PDBbind
215aa, >3LXS_1|Chains... at 99%
4klb
RCSB PDB
PDBbind
215aa, >4KLB_1|Chains... at 99%
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
3hd3
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
cruzain mature domain
Ligand Name
25B
EC.Number
E.C.3.4.22.51
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
IC50=0.1uM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Bioorg.Med.Chem.Lett. Vol. 19: pp. 6218-6221
Ligand Properties
Formula
C
2
7
H
3
4
ClNO
4
S
Molecular Weight
504.081
Exact Mass
503.190
No. of atoms
68
No. of bonds
70
Polar Surface Area
88.69
LOGP Value
6.21 (
Computed with XLOGP3
)
7.34 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 3
Canonical SMILES
CCCC[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(=O)c1ccc(cc1)Cl)CCS(=O)(=O)c1ccccc1
InChI String
InChI=1S/C27H34ClNO4S/c1-2-3-9-22(18-19-34(32,33)23-10-5-4-6-11-23)29-27(31)25-13-8-7-12-24(25)26(30)20-14-16-21(28)17-15-20/h4-6,10-11,14-17,22,24-25H,2-3,7-9,12-13,18-19H2,1H3,(H,29,31)/t22-,24+,25+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P25779
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2025 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓