Browse entries in the PDBbind-CN Database
HEADER 3EQS_COMPLEX COMPND 3EQS_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 84 THR LEU VAL ARG PRO LYS PRO LEU LEU LEU LYS LEU LEU SEQRES 2 A 84 LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR MET LYS SEQRES 3 A 84 GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET THR LYS SEQRES 4 A 84 ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL TYR CYS SEQRES 5 A 84 SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL PRO SER SEQRES 6 A 84 PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR MET ILE SEQRES 7 A 84 TYR ARG ASN LEU VAL VAL SEQRES 1 B 84 THR LEU VAL ARG PRO LYS PRO LEU LEU LEU LYS LEU LEU SEQRES 2 B 84 LYS SER VAL GLY ALA GLN LYS ASP THR TYR THR MET LYS SEQRES 3 B 84 GLU VAL LEU PHE TYR LEU GLY GLN TYR ILE MET THR LYS SEQRES 4 B 84 ARG LEU TYR ASP GLU LYS GLN GLN HIS ILE VAL TYR CYS SEQRES 5 B 84 SER ASN ASP LEU LEU GLY ASP LEU PHE GLY VAL PRO SER SEQRES 6 B 84 PHE SER VAL LYS GLU HIS ARG LYS ILE TYR THR MET ILE SEQRES 7 B 84 TYR ARG ASN LEU VAL VAL HET THR A 402 181 ATOM 1 N THR A 26 -6.984 -17.658 -2.160 1.00 25.59 N ATOM 2 CA THR A 26 -7.809 -17.664 -3.423 1.00 25.43 C ATOM 3 C THR A 26 -7.374 -16.504 -4.327 1.00 24.04 C ATOM 4 O THR A 26 -7.364 -15.328 -3.904 1.00 23.94 O ATOM 5 CB THR A 26 -9.350 -17.493 -3.159 1.00 25.62 C ATOM 6 OG1 THR A 26 -9.832 -18.527 -2.293 1.00 29.21 O ATOM 7 CG2 THR A 26 -10.120 -17.584 -4.449 1.00 26.40 C ATOM 8 HA THR A 26 -7.642 -18.636 -3.888 1.00 0.00 H ATOM 9 HB THR A 26 -9.494 -16.516 -2.698 1.00 0.00 H ATOM 10 HG1 THR A 26 -10.802 -18.402 -2.139 1.00 0.00 H ATOM 11 HG23 THR A 26 -9.775 -16.807 -5.132 1.00 0.00 H ATOM 12 HG21 THR A 26 -9.958 -18.563 -4.899 1.00 0.00 H ATOM 13 HG22 THR A 26 -11.182 -17.447 -4.247 1.00 0.00 H ATOM 14 HN3 THR A 26 -7.125 -16.757 -1.660 1.00 0.00 H ATOM 15 HN2 THR A 26 -5.979 -17.767 -2.403 1.00 0.00 H ATOM 16 HN1 THR A 26 -7.281 -18.446 -1.549 1.00 0.00 H ATOM 17 N LEU A 27 -7.001 -16.828 -5.565 1.00 22.21 N ATOM 18 CA LEU A 27 -6.727 -15.773 -6.533 1.00 21.06 C ATOM 19 C LEU A 27 -8.029 -15.256 -7.114 1.00 20.12 C ATOM 20 O LEU A 27 -8.963 -16.027 -7.356 1.00 20.95 O ATOM 21 CB LEU A 27 -5.823 -16.269 -7.652 1.00 20.90 C ATOM 22 CG LEU A 27 -4.411 -16.607 -7.208 1.00 22.01 C ATOM 23 CD1 LEU A 27 -3.684 -17.300 -8.333 1.00 24.09 C ATOM 24 CD2 LEU A 27 -3.654 -15.343 -6.768 1.00 23.96 C ATOM 25 HA LEU A 27 -6.211 -14.965 -6.015 1.00 0.00 H ATOM 26 HB2 LEU A 27 -6.270 -17.165 -8.081 1.00 0.00 H ATOM 27 HB3 LEU A 27 -5.765 -15.492 -8.415 1.00 0.00 H ATOM 28 HG LEU A 27 -4.462 -17.276 -6.349 1.00 0.00 H ATOM 29 HD21 LEU A 27 -3.601 -14.644 -7.603 1.00 0.00 H ATOM 30 HD22 LEU A 27 -4.181 -14.877 -5.935 1.00 0.00 H ATOM 31 HD23 LEU A 27 -2.646 -15.615 -6.455 1.00 0.00 H ATOM 32 HD11 LEU A 27 -4.213 -18.216 -8.596 1.00 0.00 H ATOM 33 HD12 LEU A 27 -3.645 -16.640 -9.200 1.00 0.00 H ATOM 34 HD13 LEU A 27 -2.670 -17.543 -8.014 1.00 0.00 H ATOM 35 H LEU A 27 -6.906 -17.827 -5.839 1.00 0.00 H ATOM 36 N VAL A 28 -8.074 -13.953 -7.353 1.00 17.81 N ATOM 37 CA VAL A 28 -9.233 -13.329 -7.997 1.00 16.78 C ATOM 38 C VAL A 28 -8.769 -12.647 -9.287 1.00 14.80 C ATOM 39 O VAL A 28 -7.575 -12.397 -9.471 1.00 13.94 O ATOM 40 CB VAL A 28 -9.929 -12.321 -7.071 1.00 17.18 C ATOM 41 CG1 VAL A 28 -10.366 -13.033 -5.759 1.00 18.08 C ATOM 42 CG2 VAL A 28 -9.008 -11.109 -6.764 1.00 17.89 C ATOM 43 HA VAL A 28 -9.966 -14.103 -8.226 1.00 0.00 H ATOM 44 HB VAL A 28 -10.814 -11.935 -7.578 1.00 0.00 H ATOM 45 HG11 VAL A 28 -11.056 -13.842 -5.999 1.00 0.00 H ATOM 46 HG12 VAL A 28 -9.488 -13.440 -5.258 1.00 0.00 H ATOM 47 HG13 VAL A 28 -10.860 -12.315 -5.104 1.00 0.00 H ATOM 48 HG21 VAL A 28 -8.099 -11.460 -6.276 1.00 0.00 H ATOM 49 HG22 VAL A 28 -8.750 -10.605 -7.695 1.00 0.00 H ATOM 50 HG23 VAL A 28 -9.531 -10.415 -6.106 1.00 0.00 H ATOM 51 H VAL A 28 -7.267 -13.359 -7.077 1.00 0.00 H ATOM 52 N ARG A 29 -9.706 -12.382 -10.181 1.00 13.99 N ATOM 53 CA ARG A 29 -9.347 -11.919 -11.535 1.00 13.34 C ATOM 54 C ARG A 29 -10.132 -10.652 -11.837 1.00 13.11 C ATOM 55 O ARG A 29 -11.315 -10.720 -12.217 1.00 14.43 O ATOM 56 CB ARG A 29 -9.695 -13.008 -12.534 1.00 13.44 C ATOM 57 CG ARG A 29 -9.331 -12.641 -13.973 1.00 13.47 C ATOM 58 CD ARG A 29 -9.679 -13.786 -14.944 1.00 13.93 C ATOM 59 NE ARG A 29 -8.817 -14.950 -14.716 1.00 14.68 N ATOM 60 CZ ARG A 29 -7.600 -15.092 -15.228 1.00 15.80 C ATOM 61 NH1 ARG A 29 -7.079 -14.153 -16.019 1.00 14.64 N ATOM 62 NH2 ARG A 29 -6.890 -16.181 -14.923 1.00 15.81 N ATOM 63 HA ARG A 29 -8.280 -11.705 -11.601 1.00 0.00 H ATOM 64 HB2 ARG A 29 -9.156 -13.915 -12.260 1.00 0.00 H ATOM 65 HB3 ARG A 29 -10.768 -13.195 -12.484 1.00 0.00 H ATOM 66 HG2 ARG A 29 -9.884 -11.748 -14.263 1.00 0.00 H ATOM 67 HG3 ARG A 29 -8.261 -12.439 -14.029 1.00 0.00 H ATOM 68 HD2 ARG A 29 -9.545 -13.438 -15.968 1.00 0.00 H ATOM 69 HD3 ARG A 29 -10.719 -14.077 -14.794 1.00 0.00 H ATOM 70 HE ARG A 29 -9.183 -15.715 -14.114 1.00 0.00 H ATOM 71 HH12 ARG A 29 -6.125 -14.276 -16.414 1.00 0.00 H ATOM 72 HH11 ARG A 29 -7.627 -13.297 -16.241 1.00 0.00 H ATOM 73 HH22 ARG A 29 -5.935 -16.306 -15.316 1.00 0.00 H ATOM 74 HH21 ARG A 29 -7.292 -16.904 -14.292 1.00 0.00 H ATOM 75 H ARG A 29 -10.707 -12.501 -9.927 1.00 0.00 H ATOM 76 N PRO A 30 -9.493 -9.477 -11.683 1.00 13.33 N ATOM 77 CA PRO A 30 -10.228 -8.223 -11.911 1.00 12.93 C ATOM 78 C PRO A 30 -10.799 -8.096 -13.322 1.00 12.71 C ATOM 79 O PRO A 30 -10.178 -8.545 -14.295 1.00 13.16 O ATOM 80 CB PRO A 30 -9.174 -7.128 -11.651 1.00 13.27 C ATOM 81 CG PRO A 30 -8.242 -7.802 -10.645 1.00 13.03 C ATOM 82 CD PRO A 30 -8.146 -9.241 -11.124 1.00 12.58 C ATOM 83 HA PRO A 30 -11.102 -8.159 -11.263 1.00 0.00 H ATOM 84 HD3 PRO A 30 -7.376 -9.353 -11.888 1.00 0.00 H ATOM 85 HD2 PRO A 30 -7.937 -9.920 -10.297 1.00 0.00 H ATOM 86 HG3 PRO A 30 -8.661 -7.757 -9.640 1.00 0.00 H ATOM 87 HG2 PRO A 30 -7.261 -7.327 -10.650 1.00 0.00 H ATOM 88 HB2 PRO A 30 -8.643 -6.866 -12.566 1.00 0.00 H ATOM 89 HB3 PRO A 30 -9.631 -6.233 -11.228 1.00 0.00 H ATOM 90 N LYS A 31 -12.000 -7.529 -13.424 1.00 11.85 N ATOM 91 CA LYS A 31 -12.540 -7.118 -14.703 1.00 13.05 C ATOM 92 C LYS A 31 -11.713 -5.924 -15.248 1.00 13.25 C ATOM 93 O LYS A 31 -10.837 -5.404 -14.557 1.00 12.83 O ATOM 94 CB LYS A 31 -14.023 -6.753 -14.557 1.00 12.35 C ATOM 95 CG LYS A 31 -14.870 -8.022 -14.333 1.00 15.27 C ATOM 96 CD LYS A 31 -16.308 -7.699 -13.955 1.00 17.60 C ATOM 97 CE LYS A 31 -17.046 -9.043 -13.914 1.00 21.42 C ATOM 98 NZ LYS A 31 -18.383 -8.953 -13.247 1.00 26.97 N ATOM 99 HA LYS A 31 -12.471 -7.940 -15.415 1.00 0.00 H ATOM 100 HB2 LYS A 31 -14.146 -6.084 -13.706 1.00 0.00 H ATOM 101 HB3 LYS A 31 -14.361 -6.251 -15.464 1.00 0.00 H ATOM 102 HG2 LYS A 31 -14.872 -8.609 -15.252 1.00 0.00 H ATOM 103 HG3 LYS A 31 -14.420 -8.607 -13.531 1.00 0.00 H ATOM 104 HD2 LYS A 31 -16.344 -7.217 -12.978 1.00 0.00 H ATOM 105 HD3 LYS A 31 -16.757 -7.042 -14.700 1.00 0.00 H ATOM 106 HE2 LYS A 31 -16.433 -9.760 -13.369 1.00 0.00 H ATOM 107 HE3 LYS A 31 -17.190 -9.393 -14.936 1.00 0.00 H ATOM 108 HZ1 LYS A 31 -18.259 -8.629 -12.267 1.00 0.00 H ATOM 109 HZ2 LYS A 31 -18.982 -8.278 -13.763 1.00 0.00 H ATOM 110 HZ3 LYS A 31 -18.834 -9.890 -13.249 1.00 0.00 H ATOM 111 H LYS A 31 -12.564 -7.378 -12.563 1.00 0.00 H ATOM 112 N PRO A 32 -11.957 -5.522 -16.503 1.00 13.47 N ATOM 113 CA PRO A 32 -11.035 -4.579 -17.141 1.00 13.57 C ATOM 114 C PRO A 32 -10.843 -3.215 -16.475 1.00 14.13 C ATOM 115 O PRO A 32 -9.709 -2.743 -16.388 1.00 12.92 O ATOM 116 CB PRO A 32 -11.636 -4.429 -18.546 1.00 14.15 C ATOM 117 CG PRO A 32 -12.169 -5.822 -18.801 1.00 13.56 C ATOM 118 CD PRO A 32 -12.857 -6.139 -17.502 1.00 13.52 C ATOM 119 HA PRO A 32 -10.019 -4.971 -17.091 1.00 0.00 H ATOM 120 HD3 PRO A 32 -13.852 -5.695 -17.464 1.00 0.00 H ATOM 121 HD2 PRO A 32 -12.935 -7.216 -17.350 1.00 0.00 H ATOM 122 HG3 PRO A 32 -11.360 -6.525 -19.003 1.00 0.00 H ATOM 123 HG2 PRO A 32 -12.872 -5.831 -19.634 1.00 0.00 H ATOM 124 HB2 PRO A 32 -12.436 -3.688 -18.560 1.00 0.00 H ATOM 125 HB3 PRO A 32 -10.875 -4.154 -19.277 1.00 0.00 H ATOM 126 N LEU A 33 -11.916 -2.567 -16.035 1.00 13.55 N ATOM 127 CA LEU A 33 -11.757 -1.259 -15.417 1.00 14.25 C ATOM 128 C LEU A 33 -10.956 -1.369 -14.108 1.00 13.08 C ATOM 129 O LEU A 33 -10.035 -0.545 -13.841 1.00 12.65 O ATOM 130 CB LEU A 33 -13.114 -0.584 -15.193 1.00 14.91 C ATOM 131 CG LEU A 33 -12.999 0.911 -14.913 1.00 17.31 C ATOM 132 CD1 LEU A 33 -12.293 1.648 -16.046 1.00 18.81 C ATOM 133 CD2 LEU A 33 -14.387 1.499 -14.722 1.00 20.53 C ATOM 134 HA LEU A 33 -11.191 -0.626 -16.100 1.00 0.00 H ATOM 135 HB2 LEU A 33 -13.723 -0.724 -16.086 1.00 0.00 H ATOM 136 HB3 LEU A 33 -13.603 -1.060 -14.343 1.00 0.00 H ATOM 137 HG LEU A 33 -12.405 1.035 -14.008 1.00 0.00 H ATOM 138 HD21 LEU A 33 -14.974 1.342 -15.627 1.00 0.00 H ATOM 139 HD22 LEU A 33 -14.876 1.008 -13.881 1.00 0.00 H ATOM 140 HD23 LEU A 33 -14.303 2.567 -14.522 1.00 0.00 H ATOM 141 HD11 LEU A 33 -11.288 1.245 -16.170 1.00 0.00 H ATOM 142 HD12 LEU A 33 -12.855 1.515 -16.970 1.00 0.00 H ATOM 143 HD13 LEU A 33 -12.233 2.709 -15.805 1.00 0.00 H ATOM 144 H LEU A 33 -12.861 -2.991 -16.131 1.00 0.00 H ATOM 145 N LEU A 34 -11.250 -2.385 -13.294 1.00 12.89 N ATOM 146 CA LEU A 34 -10.497 -2.544 -12.067 1.00 12.67 C ATOM 147 C LEU A 34 -9.048 -2.899 -12.408 1.00 12.48 C ATOM 148 O LEU A 34 -8.109 -2.441 -11.732 1.00 12.06 O ATOM 149 CB LEU A 34 -11.120 -3.614 -11.151 1.00 12.83 C ATOM 150 CG LEU A 34 -10.335 -3.958 -9.866 1.00 13.33 C ATOM 151 CD1 LEU A 34 -10.155 -2.724 -8.990 1.00 13.21 C ATOM 152 CD2 LEU A 34 -11.044 -5.092 -9.106 1.00 13.82 C ATOM 153 HA LEU A 34 -10.523 -1.602 -11.519 1.00 0.00 H ATOM 154 HB2 LEU A 34 -12.107 -3.262 -10.853 1.00 0.00 H ATOM 155 HB3 LEU A 34 -11.223 -4.530 -11.733 1.00 0.00 H ATOM 156 HG LEU A 34 -9.339 -4.303 -10.143 1.00 0.00 H ATOM 157 HD21 LEU A 34 -12.051 -4.774 -8.838 1.00 0.00 H ATOM 158 HD22 LEU A 34 -11.098 -5.976 -9.742 1.00 0.00 H ATOM 159 HD23 LEU A 34 -10.483 -5.328 -8.202 1.00 0.00 H ATOM 160 HD11 LEU A 34 -9.604 -1.964 -9.544 1.00 0.00 H ATOM 161 HD12 LEU A 34 -11.133 -2.334 -8.709 1.00 0.00 H ATOM 162 HD13 LEU A 34 -9.599 -2.995 -8.092 1.00 0.00 H ATOM 163 H LEU A 34 -12.009 -3.053 -13.537 1.00 0.00 H ATOM 164 N LEU A 35 -8.849 -3.698 -13.461 1.00 12.60 N ATOM 165 CA LEU A 35 -7.493 -4.003 -13.864 1.00 12.77 C ATOM 166 C LEU A 35 -6.745 -2.735 -14.257 1.00 13.68 C ATOM 167 O LEU A 35 -5.572 -2.588 -13.899 1.00 13.79 O ATOM 168 CB LEU A 35 -7.513 -5.099 -14.973 1.00 14.88 C ATOM 169 CG LEU A 35 -6.162 -5.806 -15.172 1.00 17.29 C ATOM 170 CD1 LEU A 35 -5.708 -6.479 -13.880 1.00 18.73 C ATOM 171 CD2 LEU A 35 -6.232 -6.813 -16.404 1.00 19.53 C ATOM 172 HA LEU A 35 -6.935 -4.417 -13.024 1.00 0.00 H ATOM 173 HB2 LEU A 35 -8.257 -5.848 -14.702 1.00 0.00 H ATOM 174 HB3 LEU A 35 -7.798 -4.630 -15.915 1.00 0.00 H ATOM 175 HG LEU A 35 -5.404 -5.062 -15.418 1.00 0.00 H ATOM 176 HD21 LEU A 35 -6.999 -7.564 -16.215 1.00 0.00 H ATOM 177 HD22 LEU A 35 -6.478 -6.260 -17.310 1.00 0.00 H ATOM 178 HD23 LEU A 35 -5.266 -7.302 -16.527 1.00 0.00 H ATOM 179 HD11 LEU A 35 -5.600 -5.727 -13.098 1.00 0.00 H ATOM 180 HD12 LEU A 35 -6.450 -7.217 -13.576 1.00 0.00 H ATOM 181 HD13 LEU A 35 -4.750 -6.972 -14.046 1.00 0.00 H ATOM 182 H LEU A 35 -9.657 -4.094 -13.983 1.00 0.00 H ATOM 183 N LYS A 36 -7.408 -1.814 -14.967 1.00 12.26 N ATOM 184 CA LYS A 36 -6.778 -0.537 -15.374 1.00 12.87 C ATOM 185 C LYS A 36 -6.333 0.219 -14.119 1.00 13.20 C ATOM 186 O LYS A 36 -5.239 0.785 -14.083 1.00 13.86 O ATOM 187 CB LYS A 36 -7.733 0.326 -16.212 1.00 13.15 C ATOM 188 CG LYS A 36 -7.180 1.727 -16.548 1.00 16.46 C ATOM 189 CD LYS A 36 -8.025 2.515 -17.591 1.00 23.78 C ATOM 190 CE LYS A 36 -7.391 3.934 -17.833 1.00 25.13 C ATOM 191 NZ LYS A 36 -7.853 4.794 -18.986 1.00 27.81 N ATOM 192 HA LYS A 36 -5.914 -0.758 -16.001 1.00 0.00 H ATOM 193 HB2 LYS A 36 -7.936 -0.196 -17.147 1.00 0.00 H ATOM 194 HB3 LYS A 36 -8.663 0.448 -15.656 1.00 0.00 H ATOM 195 HG2 LYS A 36 -7.143 2.310 -15.628 1.00 0.00 H ATOM 196 HG3 LYS A 36 -6.171 1.610 -16.943 1.00 0.00 H ATOM 197 HD2 LYS A 36 -8.046 1.963 -18.531 1.00 0.00 H ATOM 198 HD3 LYS A 36 -9.042 2.632 -17.218 1.00 0.00 H ATOM 199 HE2 LYS A 36 -6.321 3.779 -17.968 1.00 0.00 H ATOM 200 HE3 LYS A 36 -7.562 4.512 -16.924 1.00 0.00 H ATOM 201 HZ1 LYS A 36 -7.684 4.292 -19.881 1.00 0.00 H ATOM 202 HZ2 LYS A 36 -8.869 4.991 -18.884 1.00 0.00 H ATOM 203 HZ3 LYS A 36 -7.323 5.689 -18.984 1.00 0.00 H ATOM 204 H LYS A 36 -8.394 -2.001 -15.241 1.00 0.00 H ATOM 205 N LEU A 37 -7.195 0.245 -13.106 1.00 12.18 N ATOM 206 CA LEU A 37 -6.845 0.935 -11.847 1.00 11.83 C ATOM 207 C LEU A 37 -5.572 0.303 -11.226 1.00 12.57 C ATOM 208 O LEU A 37 -4.633 0.999 -10.850 1.00 12.73 O ATOM 209 CB LEU A 37 -8.044 0.886 -10.867 1.00 10.35 C ATOM 210 CG LEU A 37 -7.800 1.610 -9.524 1.00 11.33 C ATOM 211 CD1 LEU A 37 -9.111 2.063 -8.913 1.00 14.51 C ATOM 212 CD2 LEU A 37 -7.055 0.732 -8.529 1.00 14.43 C ATOM 213 HA LEU A 37 -6.625 1.982 -12.056 1.00 0.00 H ATOM 214 HB2 LEU A 37 -8.902 1.350 -11.354 1.00 0.00 H ATOM 215 HB3 LEU A 37 -8.269 -0.159 -10.655 1.00 0.00 H ATOM 216 HG LEU A 37 -7.179 2.479 -9.743 1.00 0.00 H ATOM 217 HD21 LEU A 37 -7.639 -0.166 -8.330 1.00 0.00 H ATOM 218 HD22 LEU A 37 -6.087 0.453 -8.946 1.00 0.00 H ATOM 219 HD23 LEU A 37 -6.906 1.283 -7.600 1.00 0.00 H ATOM 220 HD11 LEU A 37 -9.612 2.748 -9.597 1.00 0.00 H ATOM 221 HD12 LEU A 37 -9.747 1.195 -8.736 1.00 0.00 H ATOM 222 HD13 LEU A 37 -8.914 2.570 -7.968 1.00 0.00 H ATOM 223 H LEU A 37 -8.119 -0.222 -13.201 1.00 0.00 H ATOM 224 N LEU A 38 -5.540 -1.027 -11.111 1.00 12.28 N ATOM 225 CA LEU A 38 -4.347 -1.687 -10.552 1.00 13.31 C ATOM 226 C LEU A 38 -3.109 -1.418 -11.394 1.00 13.57 C ATOM 227 O LEU A 38 -2.021 -1.117 -10.841 1.00 13.37 O ATOM 228 CB LEU A 38 -4.615 -3.189 -10.403 1.00 14.45 C ATOM 229 CG LEU A 38 -5.882 -3.504 -9.600 1.00 15.77 C ATOM 230 CD1 LEU A 38 -6.210 -4.973 -9.731 1.00 16.46 C ATOM 231 CD2 LEU A 38 -5.832 -3.088 -8.112 1.00 17.01 C ATOM 232 HA LEU A 38 -4.146 -1.268 -9.566 1.00 0.00 H ATOM 233 HB2 LEU A 38 -4.719 -3.622 -11.398 1.00 0.00 H ATOM 234 HB3 LEU A 38 -3.763 -3.644 -9.898 1.00 0.00 H ATOM 235 HG LEU A 38 -6.672 -2.891 -10.033 1.00 0.00 H ATOM 236 HD21 LEU A 38 -5.011 -3.608 -7.618 1.00 0.00 H ATOM 237 HD22 LEU A 38 -5.677 -2.011 -8.042 1.00 0.00 H ATOM 238 HD23 LEU A 38 -6.773 -3.353 -7.630 1.00 0.00 H ATOM 239 HD11 LEU A 38 -6.375 -5.215 -10.781 1.00 0.00 H ATOM 240 HD12 LEU A 38 -5.379 -5.565 -9.347 1.00 0.00 H ATOM 241 HD13 LEU A 38 -7.111 -5.195 -9.159 1.00 0.00 H ATOM 242 H LEU A 38 -6.356 -1.596 -11.415 1.00 0.00 H ATOM 243 N LYS A 39 -3.225 -1.481 -12.716 1.00 13.75 N ATOM 244 CA LYS A 39 -2.053 -1.192 -13.550 1.00 14.23 C ATOM 245 C LYS A 39 -1.540 0.236 -13.363 1.00 13.92 C ATOM 246 O LYS A 39 -0.335 0.517 -13.535 1.00 13.34 O ATOM 247 CB LYS A 39 -2.381 -1.468 -15.023 1.00 14.84 C ATOM 248 CG LYS A 39 -2.466 -2.945 -15.358 1.00 19.19 C ATOM 249 CD LYS A 39 -2.630 -3.093 -16.891 1.00 25.24 C ATOM 250 CE LYS A 39 -2.836 -4.553 -17.265 1.00 29.69 C ATOM 251 NZ LYS A 39 -2.034 -5.471 -16.392 1.00 30.78 N ATOM 252 HA LYS A 39 -1.248 -1.854 -13.230 1.00 0.00 H ATOM 253 HB2 LYS A 39 -3.340 -1.005 -15.256 1.00 0.00 H ATOM 254 HB3 LYS A 39 -1.603 -1.018 -15.640 1.00 0.00 H ATOM 255 HG2 LYS A 39 -1.555 -3.449 -15.035 1.00 0.00 H ATOM 256 HG3 LYS A 39 -3.323 -3.388 -14.852 1.00 0.00 H ATOM 257 HD2 LYS A 39 -3.493 -2.513 -17.218 1.00 0.00 H ATOM 258 HD3 LYS A 39 -1.734 -2.718 -17.386 1.00 0.00 H ATOM 259 HE2 LYS A 39 -2.533 -4.698 -18.302 1.00 0.00 H ATOM 260 HE3 LYS A 39 -3.893 -4.799 -17.159 1.00 0.00 H ATOM 261 HZ1 LYS A 39 -1.023 -5.248 -16.492 1.00 0.00 H ATOM 262 HZ2 LYS A 39 -2.322 -5.344 -15.401 1.00 0.00 H ATOM 263 HZ3 LYS A 39 -2.203 -6.456 -16.680 1.00 0.00 H ATOM 264 H LYS A 39 -4.134 -1.732 -13.154 1.00 0.00 H ATOM 265 N SER A 40 -2.439 1.155 -13.000 1.00 12.16 N ATOM 266 CA SER A 40 -2.063 2.566 -12.923 1.00 13.06 C ATOM 267 C SER A 40 -1.105 2.829 -11.760 1.00 12.63 C ATOM 268 O SER A 40 -0.351 3.824 -11.805 1.00 14.46 O ATOM 269 CB SER A 40 -3.303 3.459 -12.863 1.00 13.91 C ATOM 270 OG SER A 40 -3.825 3.474 -11.557 1.00 14.92 O ATOM 271 HA SER A 40 -1.524 2.821 -13.835 1.00 0.00 H ATOM 272 HB2 SER A 40 -4.058 3.075 -13.549 1.00 0.00 H ATOM 273 HB3 SER A 40 -3.032 4.474 -13.155 1.00 0.00 H ATOM 274 HG SER A 40 -4.074 2.553 -11.292 1.00 0.00 H ATOM 275 H SER A 40 -3.411 0.865 -12.771 1.00 0.00 H ATOM 276 N VAL A 41 -1.099 1.943 -10.749 1.00 12.48 N ATOM 277 CA VAL A 41 -0.098 2.046 -9.674 1.00 12.71 C ATOM 278 C VAL A 41 1.070 1.063 -9.843 1.00 12.59 C ATOM 279 O VAL A 41 1.924 0.956 -8.970 1.00 12.68 O ATOM 280 CB VAL A 41 -0.714 1.903 -8.261 1.00 12.68 C ATOM 281 CG1 VAL A 41 -1.612 3.120 -7.935 1.00 14.54 C ATOM 282 CG2 VAL A 41 -1.479 0.563 -8.139 1.00 15.01 C ATOM 283 HA VAL A 41 0.301 3.056 -9.765 1.00 0.00 H ATOM 284 HB VAL A 41 0.088 1.887 -7.523 1.00 0.00 H ATOM 285 HG11 VAL A 41 -1.014 4.031 -7.971 1.00 0.00 H ATOM 286 HG12 VAL A 41 -2.417 3.183 -8.668 1.00 0.00 H ATOM 287 HG13 VAL A 41 -2.036 3.001 -6.938 1.00 0.00 H ATOM 288 HG21 VAL A 41 -2.278 0.533 -8.880 1.00 0.00 H ATOM 289 HG22 VAL A 41 -0.790 -0.264 -8.312 1.00 0.00 H ATOM 290 HG23 VAL A 41 -1.905 0.479 -7.139 1.00 0.00 H ATOM 291 H VAL A 41 -1.806 1.180 -10.726 1.00 0.00 H ATOM 292 N GLY A 42 1.065 0.329 -10.950 1.00 11.83 N ATOM 293 CA GLY A 42 2.177 -0.571 -11.287 1.00 14.10 C ATOM 294 C GLY A 42 1.957 -2.031 -11.000 1.00 16.23 C ATOM 295 O GLY A 42 2.910 -2.815 -11.051 1.00 17.29 O ATOM 296 HA3 GLY A 42 3.051 -0.248 -10.721 1.00 0.00 H ATOM 297 HA2 GLY A 42 2.378 -0.468 -12.353 1.00 0.00 H ATOM 298 H GLY A 42 0.252 0.393 -11.596 1.00 0.00 H ATOM 299 N ALA A 43 0.733 -2.448 -10.735 1.00 16.17 N ATOM 300 CA ALA A 43 0.502 -3.880 -10.602 1.00 19.32 C ATOM 301 C ALA A 43 0.725 -4.549 -11.972 1.00 22.08 C ATOM 302 O ALA A 43 0.421 -3.998 -13.003 1.00 24.44 O ATOM 303 CB ALA A 43 -0.878 -4.152 -10.026 1.00 18.49 C ATOM 304 HA ALA A 43 1.211 -4.314 -9.897 1.00 0.00 H ATOM 305 HB1 ALA A 43 -0.957 -3.689 -9.042 1.00 0.00 H ATOM 306 HB2 ALA A 43 -1.636 -3.733 -10.688 1.00 0.00 H ATOM 307 HB3 ALA A 43 -1.027 -5.228 -9.936 1.00 0.00 H ATOM 308 H ALA A 43 -0.048 -1.770 -10.624 1.00 0.00 H ATOM 309 N GLN A 44 1.353 -5.700 -11.981 1.00 24.78 N ATOM 310 CA GLN A 44 1.813 -6.271 -13.247 1.00 26.80 C ATOM 311 C GLN A 44 1.167 -7.610 -13.596 1.00 26.52 C ATOM 312 O GLN A 44 1.676 -8.345 -14.462 1.00 27.68 O ATOM 313 CB GLN A 44 3.345 -6.388 -13.222 1.00 27.86 C ATOM 314 CG GLN A 44 4.052 -5.056 -13.528 1.00 33.14 C ATOM 315 CD GLN A 44 5.446 -5.247 -14.106 1.00 39.60 C ATOM 316 OE1 GLN A 44 5.725 -6.264 -14.759 1.00 43.32 O ATOM 317 NE2 GLN A 44 6.334 -4.273 -13.874 1.00 40.09 N ATOM 318 HA GLN A 44 1.499 -5.590 -14.038 1.00 0.00 H ATOM 319 HB2 GLN A 44 3.652 -6.726 -12.232 1.00 0.00 H ATOM 320 HB3 GLN A 44 3.650 -7.123 -13.967 1.00 0.00 H ATOM 321 HG2 GLN A 44 3.450 -4.499 -14.246 1.00 0.00 H ATOM 322 HG3 GLN A 44 4.133 -4.484 -12.604 1.00 0.00 H ATOM 323 HE22 GLN A 44 6.056 -3.437 -13.321 1.00 0.00 H ATOM 324 HE21 GLN A 44 7.302 -4.352 -14.247 1.00 0.00 H ATOM 325 H GLN A 44 1.524 -6.207 -11.089 1.00 0.00 H ATOM 326 N LYS A 45 0.054 -7.940 -12.953 1.00 24.04 N ATOM 327 CA LYS A 45 -0.554 -9.248 -13.171 1.00 22.25 C ATOM 328 C LYS A 45 -2.036 -9.126 -13.510 1.00 20.36 C ATOM 329 O LYS A 45 -2.664 -8.067 -13.307 1.00 20.18 O ATOM 330 CB LYS A 45 -0.374 -10.150 -11.926 1.00 22.51 C ATOM 331 CG LYS A 45 1.088 -10.353 -11.463 1.00 26.18 C ATOM 332 CD LYS A 45 1.242 -11.480 -10.395 1.00 29.52 C ATOM 333 CE LYS A 45 0.287 -11.311 -9.189 1.00 32.81 C ATOM 334 NZ LYS A 45 -0.337 -12.625 -8.705 1.00 31.65 N ATOM 335 HA LYS A 45 -0.045 -9.705 -14.020 1.00 0.00 H ATOM 336 HB2 LYS A 45 -0.929 -9.702 -11.102 1.00 0.00 H ATOM 337 HB3 LYS A 45 -0.794 -11.129 -12.156 1.00 0.00 H ATOM 338 HG2 LYS A 45 1.694 -10.612 -12.331 1.00 0.00 H ATOM 339 HG3 LYS A 45 1.450 -9.418 -11.035 1.00 0.00 H ATOM 340 HD2 LYS A 45 1.034 -12.439 -10.870 1.00 0.00 H ATOM 341 HD3 LYS A 45 2.268 -11.472 -10.028 1.00 0.00 H ATOM 342 HE2 LYS A 45 -0.517 -10.635 -9.479 1.00 0.00 H ATOM 343 HE3 LYS A 45 0.849 -10.873 -8.364 1.00 0.00 H ATOM 344 HZ1 LYS A 45 -0.887 -13.051 -9.478 1.00 0.00 H ATOM 345 HZ2 LYS A 45 0.417 -13.279 -8.413 1.00 0.00 H ATOM 346 HZ3 LYS A 45 -0.963 -12.433 -7.897 1.00 0.00 H ATOM 347 H LYS A 45 -0.385 -7.266 -12.294 1.00 0.00 H ATOM 348 N ASP A 46 -2.626 -10.211 -13.990 1.00 17.76 N ATOM 349 CA ASP A 46 -4.071 -10.202 -14.199 1.00 15.93 C ATOM 350 C ASP A 46 -4.823 -10.972 -13.104 1.00 15.35 C ATOM 351 O ASP A 46 -6.028 -10.974 -13.103 1.00 14.42 O ATOM 352 CB ASP A 46 -4.515 -10.604 -15.641 1.00 16.45 C ATOM 353 CG ASP A 46 -4.188 -12.026 -15.995 1.00 18.43 C ATOM 354 OD1 ASP A 46 -3.676 -12.741 -15.118 1.00 19.80 O ATOM 355 OD2 ASP A 46 -4.416 -12.457 -17.166 1.00 19.51 O ATOM 356 HA ASP A 46 -4.366 -9.157 -14.107 1.00 0.00 H ATOM 357 HB2 ASP A 46 -5.594 -10.468 -15.721 1.00 0.00 H ATOM 358 HB3 ASP A 46 -4.014 -9.947 -16.352 1.00 0.00 H ATOM 359 H ASP A 46 -2.067 -11.058 -14.215 1.00 0.00 H ATOM 360 N THR A 47 -4.100 -11.611 -12.189 1.00 14.26 N ATOM 361 CA THR A 47 -4.735 -12.221 -10.992 1.00 13.90 C ATOM 362 C THR A 47 -3.952 -11.866 -9.724 1.00 13.29 C ATOM 363 O THR A 47 -2.751 -11.693 -9.773 1.00 13.96 O ATOM 364 CB THR A 47 -4.851 -13.749 -11.092 1.00 14.47 C ATOM 365 OG1 THR A 47 -3.543 -14.317 -11.169 1.00 16.61 O ATOM 366 CG2 THR A 47 -5.651 -14.105 -12.353 1.00 13.96 C ATOM 367 HA THR A 47 -5.743 -11.809 -10.942 1.00 0.00 H ATOM 368 HB THR A 47 -5.361 -14.145 -10.214 1.00 0.00 H ATOM 369 HG1 THR A 47 -3.079 -13.966 -11.970 1.00 0.00 H ATOM 370 HG23 THR A 47 -6.647 -13.668 -12.285 1.00 0.00 H ATOM 371 HG21 THR A 47 -5.138 -13.711 -13.230 1.00 0.00 H ATOM 372 HG22 THR A 47 -5.734 -15.189 -12.435 1.00 0.00 H ATOM 373 H THR A 47 -3.070 -11.685 -12.314 1.00 0.00 H ATOM 374 N TYR A 48 -4.677 -11.771 -8.614 1.00 13.52 N ATOM 375 CA TYR A 48 -4.080 -11.353 -7.341 1.00 14.29 C ATOM 376 C TYR A 48 -4.947 -11.947 -6.229 1.00 14.29 C ATOM 377 O TYR A 48 -6.065 -12.408 -6.454 1.00 15.11 O ATOM 378 CB TYR A 48 -4.014 -9.802 -7.205 1.00 15.40 C ATOM 379 CG TYR A 48 -2.879 -9.118 -7.986 1.00 16.10 C ATOM 380 CD1 TYR A 48 -1.545 -9.316 -7.642 1.00 17.91 C ATOM 381 CD2 TYR A 48 -3.158 -8.283 -9.073 1.00 19.40 C ATOM 382 CE1 TYR A 48 -0.514 -8.692 -8.355 1.00 20.74 C ATOM 383 CE2 TYR A 48 -2.154 -7.678 -9.796 1.00 20.34 C ATOM 384 CZ TYR A 48 -0.830 -7.874 -9.426 1.00 20.66 C ATOM 385 OH TYR A 48 0.184 -7.270 -10.137 1.00 21.48 O ATOM 386 HA TYR A 48 -3.051 -11.709 -7.282 1.00 0.00 H ATOM 387 HB3 TYR A 48 -3.888 -9.562 -6.149 1.00 0.00 H ATOM 388 HB2 TYR A 48 -4.960 -9.393 -7.559 1.00 0.00 H ATOM 389 HD2 TYR A 48 -4.196 -8.107 -9.355 1.00 0.00 H ATOM 390 HE2 TYR A 48 -2.397 -7.050 -10.653 1.00 0.00 H ATOM 391 HE1 TYR A 48 0.526 -8.849 -8.070 1.00 0.00 H ATOM 392 HD1 TYR A 48 -1.299 -9.968 -6.804 1.00 0.00 H ATOM 393 HH TYR A 48 1.056 -7.516 -9.739 1.00 0.00 H ATOM 394 H TYR A 48 -5.691 -11.998 -8.649 1.00 0.00 H ATOM 395 N THR A 49 -4.404 -11.962 -5.022 1.00 14.32 N ATOM 396 CA THR A 49 -5.264 -12.254 -3.895 1.00 14.24 C ATOM 397 C THR A 49 -6.122 -11.042 -3.562 1.00 14.59 C ATOM 398 O THR A 49 -5.823 -9.914 -3.986 1.00 14.01 O ATOM 399 CB THR A 49 -4.463 -12.616 -2.632 1.00 15.11 C ATOM 400 OG1 THR A 49 -3.728 -11.460 -2.191 1.00 14.53 O ATOM 401 CG2 THR A 49 -3.507 -13.759 -2.934 1.00 16.14 C ATOM 402 HA THR A 49 -5.879 -13.106 -4.186 1.00 0.00 H ATOM 403 HB THR A 49 -5.147 -12.933 -1.844 1.00 0.00 H ATOM 404 HG1 THR A 49 -3.211 -11.689 -1.378 1.00 0.00 H ATOM 405 HG23 THR A 49 -4.075 -14.628 -3.267 1.00 0.00 H ATOM 406 HG21 THR A 49 -2.814 -13.454 -3.718 1.00 0.00 H ATOM 407 HG22 THR A 49 -2.949 -14.012 -2.033 1.00 0.00 H ATOM 408 H THR A 49 -3.391 -11.770 -4.888 1.00 0.00 H ATOM 409 N MET A 50 -7.158 -11.252 -2.753 1.00 14.99 N ATOM 410 CA MET A 50 -8.008 -10.127 -2.377 1.00 15.78 C ATOM 411 C MET A 50 -7.191 -9.152 -1.546 1.00 15.50 C ATOM 412 O MET A 50 -7.344 -7.944 -1.706 1.00 15.00 O ATOM 413 CB MET A 50 -9.273 -10.551 -1.619 1.00 16.57 C ATOM 414 CG MET A 50 -10.057 -9.358 -1.097 1.00 19.44 C ATOM 415 SD MET A 50 -11.202 -8.660 -2.319 1.00 24.26 S ATOM 416 CE MET A 50 -12.608 -9.719 -2.011 1.00 24.89 C ATOM 417 HA MET A 50 -8.355 -9.652 -3.295 1.00 0.00 H ATOM 418 HB2 MET A 50 -9.911 -11.123 -2.293 1.00 0.00 H ATOM 419 HB3 MET A 50 -8.984 -11.177 -0.775 1.00 0.00 H ATOM 420 HG2 MET A 50 -9.351 -8.582 -0.802 1.00 0.00 H ATOM 421 HG3 MET A 50 -10.631 -9.675 -0.226 1.00 0.00 H ATOM 422 HE1 MET A 50 -12.327 -10.756 -2.194 1.00 0.00 H ATOM 423 HE2 MET A 50 -12.927 -9.605 -0.975 1.00 0.00 H ATOM 424 HE3 MET A 50 -13.425 -9.439 -2.677 1.00 0.00 H ATOM 425 H MET A 50 -7.359 -12.207 -2.393 1.00 0.00 H ATOM 426 N LYS A 51 -6.302 -9.660 -0.713 1.00 15.93 N ATOM 427 CA LYS A 51 -5.430 -8.771 0.071 1.00 15.38 C ATOM 428 C LYS A 51 -4.620 -7.860 -0.845 1.00 14.76 C ATOM 429 O LYS A 51 -4.485 -6.648 -0.596 1.00 14.66 O ATOM 430 CB LYS A 51 -4.475 -9.563 0.974 1.00 16.09 C ATOM 431 CG LYS A 51 -5.010 -9.792 2.368 1.00 17.60 C ATOM 432 CD LYS A 51 -4.137 -10.762 3.166 1.00 19.06 C ATOM 433 CE LYS A 51 -4.899 -11.237 4.412 1.00 21.98 C ATOM 434 NZ LYS A 51 -4.252 -12.361 5.129 1.00 21.16 N ATOM 435 HA LYS A 51 -6.080 -8.165 0.702 1.00 0.00 H ATOM 436 HB2 LYS A 51 -4.289 -10.533 0.513 1.00 0.00 H ATOM 437 HB3 LYS A 51 -3.537 -9.013 1.051 1.00 0.00 H ATOM 438 HG2 LYS A 51 -5.045 -8.837 2.893 1.00 0.00 H ATOM 439 HG3 LYS A 51 -6.017 -10.203 2.295 1.00 0.00 H ATOM 440 HD2 LYS A 51 -3.887 -11.621 2.544 1.00 0.00 H ATOM 441 HD3 LYS A 51 -3.220 -10.258 3.472 1.00 0.00 H ATOM 442 HE2 LYS A 51 -5.894 -11.556 4.103 1.00 0.00 H ATOM 443 HE3 LYS A 51 -4.986 -10.397 5.101 1.00 0.00 H ATOM 444 HZ1 LYS A 51 -4.172 -13.178 4.490 1.00 0.00 H ATOM 445 HZ2 LYS A 51 -3.304 -12.070 5.443 1.00 0.00 H ATOM 446 HZ3 LYS A 51 -4.828 -12.621 5.955 1.00 0.00 H ATOM 447 H LYS A 51 -6.218 -10.691 -0.610 1.00 0.00 H ATOM 448 N GLU A 52 -4.096 -8.428 -1.918 1.00 13.62 N ATOM 449 CA GLU A 52 -3.325 -7.634 -2.855 1.00 12.99 C ATOM 450 C GLU A 52 -4.197 -6.605 -3.561 1.00 12.50 C ATOM 451 O GLU A 52 -3.805 -5.445 -3.718 1.00 12.33 O ATOM 452 CB GLU A 52 -2.558 -8.536 -3.815 1.00 13.29 C ATOM 453 CG GLU A 52 -1.561 -9.371 -3.036 1.00 12.69 C ATOM 454 CD GLU A 52 -0.966 -10.520 -3.813 1.00 14.27 C ATOM 455 OE1 GLU A 52 -1.643 -11.105 -4.695 1.00 15.71 O ATOM 456 OE2 GLU A 52 0.187 -10.864 -3.505 1.00 15.44 O ATOM 457 HA GLU A 52 -2.581 -7.061 -2.302 1.00 0.00 H ATOM 458 HB2 GLU A 52 -3.256 -9.193 -4.333 1.00 0.00 H ATOM 459 HB3 GLU A 52 -2.028 -7.924 -4.544 1.00 0.00 H ATOM 460 HG2 GLU A 52 -0.748 -8.720 -2.715 1.00 0.00 H ATOM 461 HG3 GLU A 52 -2.067 -9.777 -2.160 1.00 0.00 H ATOM 462 H GLU A 52 -4.237 -9.444 -2.090 1.00 0.00 H ATOM 463 N VAL A 53 -5.390 -7.000 -3.977 1.00 12.21 N ATOM 464 CA VAL A 53 -6.282 -6.041 -4.621 1.00 12.22 C ATOM 465 C VAL A 53 -6.512 -4.858 -3.651 1.00 11.40 C ATOM 466 O VAL A 53 -6.485 -3.674 -4.056 1.00 12.59 O ATOM 467 CB VAL A 53 -7.617 -6.724 -5.041 1.00 12.29 C ATOM 468 CG1 VAL A 53 -8.610 -5.672 -5.527 1.00 12.11 C ATOM 469 CG2 VAL A 53 -7.367 -7.746 -6.170 1.00 15.29 C ATOM 470 HA VAL A 53 -5.829 -5.661 -5.537 1.00 0.00 H ATOM 471 HB VAL A 53 -8.027 -7.242 -4.174 1.00 0.00 H ATOM 472 HG11 VAL A 53 -8.807 -4.961 -4.724 1.00 0.00 H ATOM 473 HG12 VAL A 53 -8.190 -5.146 -6.384 1.00 0.00 H ATOM 474 HG13 VAL A 53 -9.540 -6.160 -5.818 1.00 0.00 H ATOM 475 HG21 VAL A 53 -6.942 -7.235 -7.034 1.00 0.00 H ATOM 476 HG22 VAL A 53 -6.672 -8.509 -5.820 1.00 0.00 H ATOM 477 HG23 VAL A 53 -8.311 -8.213 -6.451 1.00 0.00 H ATOM 478 H VAL A 53 -5.690 -7.987 -3.846 1.00 0.00 H ATOM 479 N LEU A 54 -6.802 -5.183 -2.387 1.00 12.53 N ATOM 480 CA LEU A 54 -6.986 -4.120 -1.397 1.00 13.41 C ATOM 481 C LEU A 54 -5.743 -3.262 -1.236 1.00 12.18 C ATOM 482 O LEU A 54 -5.861 -2.051 -1.153 1.00 11.94 O ATOM 483 CB LEU A 54 -7.413 -4.705 -0.049 1.00 13.91 C ATOM 484 CG LEU A 54 -8.863 -5.210 -0.081 1.00 16.16 C ATOM 485 CD1 LEU A 54 -9.093 -6.111 1.145 1.00 17.38 C ATOM 486 CD2 LEU A 54 -9.862 -4.053 -0.096 1.00 19.28 C ATOM 487 HA LEU A 54 -7.780 -3.471 -1.768 1.00 0.00 H ATOM 488 HB2 LEU A 54 -6.754 -5.537 0.199 1.00 0.00 H ATOM 489 HB3 LEU A 54 -7.325 -3.933 0.715 1.00 0.00 H ATOM 490 HG LEU A 54 -9.023 -5.778 -0.998 1.00 0.00 H ATOM 491 HD21 LEU A 54 -9.728 -3.447 0.800 1.00 0.00 H ATOM 492 HD22 LEU A 54 -9.691 -3.439 -0.980 1.00 0.00 H ATOM 493 HD23 LEU A 54 -10.877 -4.451 -0.119 1.00 0.00 H ATOM 494 HD11 LEU A 54 -8.404 -6.955 1.109 1.00 0.00 H ATOM 495 HD12 LEU A 54 -8.918 -5.536 2.055 1.00 0.00 H ATOM 496 HD13 LEU A 54 -10.119 -6.478 1.137 1.00 0.00 H ATOM 497 H LEU A 54 -6.896 -6.181 -2.110 1.00 0.00 H ATOM 498 N PHE A 55 -4.562 -3.877 -1.190 1.00 12.54 N ATOM 499 CA PHE A 55 -3.336 -3.096 -1.071 1.00 12.24 C ATOM 500 C PHE A 55 -3.212 -2.104 -2.250 1.00 12.00 C ATOM 501 O PHE A 55 -2.936 -0.929 -2.043 1.00 12.23 O ATOM 502 CB PHE A 55 -2.086 -3.979 -0.991 1.00 12.55 C ATOM 503 CG PHE A 55 -1.728 -4.455 0.419 1.00 14.83 C ATOM 504 CD1 PHE A 55 -1.502 -3.539 1.449 1.00 15.35 C ATOM 505 CD2 PHE A 55 -1.558 -5.810 0.681 1.00 16.81 C ATOM 506 CE1 PHE A 55 -1.126 -3.987 2.755 1.00 16.55 C ATOM 507 CE2 PHE A 55 -1.172 -6.245 1.969 1.00 16.27 C ATOM 508 CZ PHE A 55 -0.983 -5.323 2.998 1.00 17.66 C ATOM 509 HA PHE A 55 -3.401 -2.541 -0.135 1.00 0.00 H ATOM 510 HB2 PHE A 55 -2.250 -4.858 -1.615 1.00 0.00 H ATOM 511 HB3 PHE A 55 -1.242 -3.410 -1.382 1.00 0.00 H ATOM 512 HD2 PHE A 55 -1.723 -6.540 -0.111 1.00 0.00 H ATOM 513 HE2 PHE A 55 -1.021 -7.308 2.159 1.00 0.00 H ATOM 514 HZ PHE A 55 -0.721 -5.669 3.998 1.00 0.00 H ATOM 515 HE1 PHE A 55 -0.954 -3.264 3.553 1.00 0.00 H ATOM 516 HD1 PHE A 55 -1.613 -2.472 1.256 1.00 0.00 H ATOM 517 H PHE A 55 -4.514 -4.915 -1.239 1.00 0.00 H ATOM 518 N TYR A 56 -3.383 -2.593 -3.471 1.00 11.88 N ATOM 519 CA TYR A 56 -3.264 -1.715 -4.639 1.00 11.32 C ATOM 520 C TYR A 56 -4.311 -0.624 -4.685 1.00 12.09 C ATOM 521 O TYR A 56 -4.014 0.534 -5.035 1.00 12.10 O ATOM 522 CB TYR A 56 -3.313 -2.525 -5.930 1.00 11.93 C ATOM 523 CG TYR A 56 -2.109 -3.412 -6.107 1.00 10.99 C ATOM 524 CD1 TYR A 56 -0.819 -2.856 -6.103 1.00 11.93 C ATOM 525 CD2 TYR A 56 -2.267 -4.803 -6.344 1.00 12.52 C ATOM 526 CE1 TYR A 56 0.327 -3.673 -6.283 1.00 14.55 C ATOM 527 CE2 TYR A 56 -1.155 -5.633 -6.525 1.00 13.20 C ATOM 528 CZ TYR A 56 0.127 -5.064 -6.504 1.00 14.48 C ATOM 529 OH TYR A 56 1.245 -5.857 -6.686 1.00 15.81 O ATOM 530 HA TYR A 56 -2.296 -1.223 -4.542 1.00 0.00 H ATOM 531 HB3 TYR A 56 -3.365 -1.836 -6.773 1.00 0.00 H ATOM 532 HB2 TYR A 56 -4.207 -3.149 -5.917 1.00 0.00 H ATOM 533 HD2 TYR A 56 -3.269 -5.230 -6.386 1.00 0.00 H ATOM 534 HE2 TYR A 56 -1.283 -6.704 -6.680 1.00 0.00 H ATOM 535 HE1 TYR A 56 1.330 -3.248 -6.253 1.00 0.00 H ATOM 536 HD1 TYR A 56 -0.697 -1.782 -5.960 1.00 0.00 H ATOM 537 HH TYR A 56 2.058 -5.294 -6.641 1.00 0.00 H ATOM 538 H TYR A 56 -3.602 -3.601 -3.600 1.00 0.00 H ATOM 539 N LEU A 57 -5.541 -0.959 -4.337 1.00 11.52 N ATOM 540 CA LEU A 57 -6.594 0.049 -4.247 1.00 11.64 C ATOM 541 C LEU A 57 -6.243 1.155 -3.244 1.00 11.41 C ATOM 542 O LEU A 57 -6.455 2.347 -3.506 1.00 11.82 O ATOM 543 CB LEU A 57 -7.926 -0.595 -3.857 1.00 11.82 C ATOM 544 CG LEU A 57 -8.774 -1.249 -4.959 1.00 11.85 C ATOM 545 CD1 LEU A 57 -9.890 -2.032 -4.334 1.00 12.05 C ATOM 546 CD2 LEU A 57 -9.371 -0.149 -5.861 1.00 12.00 C ATOM 547 HA LEU A 57 -6.686 0.503 -5.234 1.00 0.00 H ATOM 548 HB2 LEU A 57 -7.707 -1.366 -3.119 1.00 0.00 H ATOM 549 HB3 LEU A 57 -8.537 0.182 -3.398 1.00 0.00 H ATOM 550 HG LEU A 57 -8.148 -1.915 -5.553 1.00 0.00 H ATOM 551 HD21 LEU A 57 -9.997 0.511 -5.261 1.00 0.00 H ATOM 552 HD22 LEU A 57 -8.563 0.426 -6.313 1.00 0.00 H ATOM 553 HD23 LEU A 57 -9.973 -0.610 -6.644 1.00 0.00 H ATOM 554 HD11 LEU A 57 -9.473 -2.805 -3.689 1.00 0.00 H ATOM 555 HD12 LEU A 57 -10.515 -1.363 -3.743 1.00 0.00 H ATOM 556 HD13 LEU A 57 -10.490 -2.495 -5.117 1.00 0.00 H ATOM 557 H LEU A 57 -5.762 -1.953 -4.125 1.00 0.00 H ATOM 558 N GLY A 58 -5.688 0.776 -2.098 1.00 11.86 N ATOM 559 CA GLY A 58 -5.256 1.770 -1.090 1.00 12.06 C ATOM 560 C GLY A 58 -4.135 2.634 -1.663 1.00 12.02 C ATOM 561 O GLY A 58 -4.110 3.835 -1.449 1.00 11.97 O ATOM 562 HA3 GLY A 58 -4.896 1.252 -0.201 1.00 0.00 H ATOM 563 HA2 GLY A 58 -6.101 2.404 -0.821 1.00 0.00 H ATOM 564 H GLY A 58 -5.555 -0.237 -1.906 1.00 0.00 H ATOM 565 N GLN A 59 -3.191 2.028 -2.376 1.00 11.58 N ATOM 566 CA GLN A 59 -2.123 2.811 -3.018 1.00 11.61 C ATOM 567 C GLN A 59 -2.697 3.800 -4.011 1.00 11.32 C ATOM 568 O GLN A 59 -2.251 4.936 -4.100 1.00 11.79 O ATOM 569 CB GLN A 59 -1.186 1.895 -3.797 1.00 11.56 C ATOM 570 CG GLN A 59 -0.313 1.020 -2.919 1.00 12.08 C ATOM 571 CD GLN A 59 0.583 0.199 -3.765 1.00 13.44 C ATOM 572 OE1 GLN A 59 0.361 0.040 -4.990 1.00 13.44 O ATOM 573 NE2 GLN A 59 1.672 -0.308 -3.148 1.00 16.66 N ATOM 574 HA GLN A 59 -1.590 3.333 -2.223 1.00 0.00 H ATOM 575 HB2 GLN A 59 -1.789 1.249 -4.435 1.00 0.00 H ATOM 576 HB3 GLN A 59 -0.538 2.514 -4.418 1.00 0.00 H ATOM 577 HG2 GLN A 59 0.286 1.650 -2.261 1.00 0.00 H ATOM 578 HG3 GLN A 59 -0.944 0.366 -2.318 1.00 0.00 H ATOM 579 HE22 GLN A 59 1.814 -0.150 -2.130 1.00 0.00 H ATOM 580 HE21 GLN A 59 2.369 -0.856 -3.691 1.00 0.00 H ATOM 581 H GLN A 59 -3.207 0.993 -2.481 1.00 0.00 H ATOM 582 N TYR A 60 -3.711 3.370 -4.768 1.00 11.39 N ATOM 583 CA TYR A 60 -4.352 4.258 -5.744 1.00 11.12 C ATOM 584 C TYR A 60 -5.023 5.457 -5.067 1.00 12.05 C ATOM 585 O TYR A 60 -4.860 6.618 -5.486 1.00 11.93 O ATOM 586 CB TYR A 60 -5.354 3.458 -6.591 1.00 10.58 C ATOM 587 CG TYR A 60 -6.103 4.295 -7.586 1.00 11.11 C ATOM 588 CD1 TYR A 60 -5.623 4.450 -8.866 1.00 10.45 C ATOM 589 CD2 TYR A 60 -7.320 4.898 -7.256 1.00 13.77 C ATOM 590 CE1 TYR A 60 -6.294 5.206 -9.801 1.00 11.78 C ATOM 591 CE2 TYR A 60 -8.014 5.685 -8.197 1.00 11.72 C ATOM 592 CZ TYR A 60 -7.482 5.809 -9.466 1.00 12.87 C ATOM 593 OH TYR A 60 -8.139 6.576 -10.410 1.00 14.18 O ATOM 594 HA TYR A 60 -3.581 4.663 -6.400 1.00 0.00 H ATOM 595 HB3 TYR A 60 -6.076 2.990 -5.921 1.00 0.00 H ATOM 596 HB2 TYR A 60 -4.808 2.685 -7.132 1.00 0.00 H ATOM 597 HD2 TYR A 60 -7.737 4.758 -6.259 1.00 0.00 H ATOM 598 HE2 TYR A 60 -8.946 6.183 -7.930 1.00 0.00 H ATOM 599 HE1 TYR A 60 -5.884 5.326 -10.804 1.00 0.00 H ATOM 600 HD1 TYR A 60 -4.689 3.963 -9.147 1.00 0.00 H ATOM 601 HH TYR A 60 -7.630 6.560 -11.259 1.00 0.00 H ATOM 602 H TYR A 60 -4.050 2.392 -4.664 1.00 0.00 H ATOM 603 N ILE A 61 -5.803 5.176 -4.026 1.00 11.80 N ATOM 604 CA ILE A 61 -6.473 6.270 -3.308 1.00 12.05 C ATOM 605 C ILE A 61 -5.448 7.251 -2.733 1.00 11.98 C ATOM 606 O ILE A 61 -5.658 8.469 -2.779 1.00 11.92 O ATOM 607 CB ILE A 61 -7.401 5.695 -2.217 1.00 12.09 C ATOM 608 CG1 ILE A 61 -8.568 4.959 -2.875 1.00 11.96 C ATOM 609 CG2 ILE A 61 -7.902 6.822 -1.271 1.00 13.23 C ATOM 610 CD1 ILE A 61 -9.316 3.999 -1.933 1.00 13.50 C ATOM 611 HA ILE A 61 -7.091 6.831 -4.009 1.00 0.00 H ATOM 612 HB ILE A 61 -6.842 4.985 -1.607 1.00 0.00 H ATOM 613 HG12 ILE A 61 -9.277 5.701 -3.242 1.00 0.00 H ATOM 614 HG13 ILE A 61 -8.180 4.382 -3.714 1.00 0.00 H ATOM 615 HD11 ILE A 61 -8.624 3.241 -1.565 1.00 0.00 H ATOM 616 HD12 ILE A 61 -9.723 4.561 -1.092 1.00 0.00 H ATOM 617 HD13 ILE A 61 -10.128 3.517 -2.477 1.00 0.00 H ATOM 618 HG21 ILE A 61 -7.047 7.299 -0.791 1.00 0.00 H ATOM 619 HG22 ILE A 61 -8.455 7.562 -1.850 1.00 0.00 H ATOM 620 HG23 ILE A 61 -8.554 6.393 -0.510 1.00 0.00 H ATOM 621 H ILE A 61 -5.938 4.190 -3.723 1.00 0.00 H ATOM 622 N MET A 62 -4.356 6.749 -2.166 1.00 11.98 N ATOM 623 CA MET A 62 -3.383 7.694 -1.606 1.00 11.45 C ATOM 624 C MET A 62 -2.739 8.492 -2.741 1.00 11.74 C ATOM 625 O MET A 62 -2.644 9.727 -2.652 1.00 11.41 O ATOM 626 CB MET A 62 -2.345 7.006 -0.716 1.00 12.57 C ATOM 627 CG MET A 62 -2.954 6.373 0.530 1.00 11.34 C ATOM 628 SD MET A 62 -1.696 5.869 1.713 1.00 15.06 S ATOM 629 CE MET A 62 -1.201 7.471 2.291 1.00 12.13 C ATOM 630 HA MET A 62 -3.911 8.386 -0.950 1.00 0.00 H ATOM 631 HB2 MET A 62 -1.852 6.226 -1.296 1.00 0.00 H ATOM 632 HB3 MET A 62 -1.608 7.747 -0.405 1.00 0.00 H ATOM 633 HG2 MET A 62 -3.530 5.497 0.234 1.00 0.00 H ATOM 634 HG3 MET A 62 -3.615 7.097 1.006 1.00 0.00 H ATOM 635 HE1 MET A 62 -0.823 8.057 1.453 1.00 0.00 H ATOM 636 HE2 MET A 62 -2.059 7.977 2.733 1.00 0.00 H ATOM 637 HE3 MET A 62 -0.417 7.359 3.040 1.00 0.00 H ATOM 638 H MET A 62 -4.197 5.722 -2.121 1.00 0.00 H ATOM 639 N THR A 63 -2.366 7.793 -3.820 1.00 11.66 N ATOM 640 CA THR A 63 -1.649 8.428 -4.921 1.00 12.09 C ATOM 641 C THR A 63 -2.449 9.587 -5.470 1.00 12.54 C ATOM 642 O THR A 63 -1.906 10.680 -5.709 1.00 13.55 O ATOM 643 CB THR A 63 -1.383 7.416 -6.045 1.00 11.92 C ATOM 644 OG1 THR A 63 -0.484 6.411 -5.559 1.00 12.12 O ATOM 645 CG2 THR A 63 -0.711 8.092 -7.237 1.00 12.05 C ATOM 646 HA THR A 63 -0.697 8.796 -4.538 1.00 0.00 H ATOM 647 HB THR A 63 -2.337 6.989 -6.354 1.00 0.00 H ATOM 648 HG1 THR A 63 -0.893 5.952 -4.783 1.00 0.00 H ATOM 649 HG23 THR A 63 -1.369 8.865 -7.633 1.00 0.00 H ATOM 650 HG21 THR A 63 0.228 8.542 -6.916 1.00 0.00 H ATOM 651 HG22 THR A 63 -0.514 7.350 -8.010 1.00 0.00 H ATOM 652 H THR A 63 -2.591 6.779 -3.875 1.00 0.00 H ATOM 653 N LYS A 64 -3.741 9.339 -5.649 1.00 12.90 N ATOM 654 CA LYS A 64 -4.656 10.365 -6.190 1.00 14.42 C ATOM 655 C LYS A 64 -5.214 11.334 -5.136 1.00 14.10 C ATOM 656 O LYS A 64 -5.902 12.287 -5.501 1.00 16.00 O ATOM 657 CB LYS A 64 -5.766 9.666 -6.965 1.00 13.90 C ATOM 658 CG LYS A 64 -5.219 8.916 -8.168 1.00 16.65 C ATOM 659 CD LYS A 64 -6.284 8.754 -9.153 1.00 20.48 C ATOM 660 CE LYS A 64 -6.390 10.000 -10.013 1.00 19.48 C ATOM 661 NZ LYS A 64 -7.382 9.771 -11.134 1.00 20.26 N ATOM 662 HA LYS A 64 -4.077 11.005 -6.856 1.00 0.00 H ATOM 663 HB2 LYS A 64 -6.268 8.959 -6.305 1.00 0.00 H ATOM 664 HB3 LYS A 64 -6.483 10.412 -7.308 1.00 0.00 H ATOM 665 HG2 LYS A 64 -4.397 9.481 -8.608 1.00 0.00 H ATOM 666 HG3 LYS A 64 -4.858 7.936 -7.855 1.00 0.00 H ATOM 667 HD2 LYS A 64 -6.062 7.895 -9.787 1.00 0.00 H ATOM 668 HD3 LYS A 64 -7.230 8.589 -8.638 1.00 0.00 H ATOM 669 HE2 LYS A 64 -5.413 10.231 -10.437 1.00 0.00 H ATOM 670 HE3 LYS A 64 -6.725 10.836 -9.399 1.00 0.00 H ATOM 671 HZ1 LYS A 64 -7.062 8.975 -11.721 1.00 0.00 H ATOM 672 HZ2 LYS A 64 -8.315 9.552 -10.730 1.00 0.00 H ATOM 673 HZ3 LYS A 64 -7.448 10.629 -11.718 1.00 0.00 H ATOM 674 H LYS A 64 -4.117 8.401 -5.403 1.00 0.00 H ATOM 675 N ARG A 65 -4.872 11.093 -3.867 1.00 14.70 N ATOM 676 CA ARG A 65 -5.268 11.919 -2.719 1.00 14.83 C ATOM 677 C ARG A 65 -6.775 12.113 -2.741 1.00 14.44 C ATOM 678 O ARG A 65 -7.309 13.221 -2.628 1.00 15.71 O ATOM 679 CB ARG A 65 -4.468 13.242 -2.623 1.00 15.60 C ATOM 680 CG ARG A 65 -3.091 13.026 -2.008 1.00 16.77 C ATOM 681 CD ARG A 65 -2.166 14.208 -2.177 1.00 23.37 C ATOM 682 NE ARG A 65 -0.790 13.756 -2.002 1.00 26.19 N ATOM 683 CZ ARG A 65 0.285 14.505 -2.196 1.00 28.34 C ATOM 684 NH1 ARG A 65 0.162 15.768 -2.582 1.00 29.49 N ATOM 685 NH2 ARG A 65 1.486 13.979 -2.014 1.00 30.66 N ATOM 686 HA ARG A 65 -5.010 11.394 -1.799 1.00 0.00 H ATOM 687 HB2 ARG A 65 -4.347 13.655 -3.624 1.00 0.00 H ATOM 688 HB3 ARG A 65 -5.024 13.947 -2.005 1.00 0.00 H ATOM 689 HG2 ARG A 65 -3.215 12.833 -0.942 1.00 0.00 H ATOM 690 HG3 ARG A 65 -2.633 12.158 -2.482 1.00 0.00 H ATOM 691 HD2 ARG A 65 -2.401 14.967 -1.431 1.00 0.00 H ATOM 692 HD3 ARG A 65 -2.289 14.631 -3.174 1.00 0.00 H ATOM 693 HE ARG A 65 -0.642 12.771 -1.702 1.00 0.00 H ATOM 694 HH12 ARG A 65 1.010 16.351 -2.733 1.00 0.00 H ATOM 695 HH11 ARG A 65 -0.783 16.176 -2.734 1.00 0.00 H ATOM 696 HH22 ARG A 65 2.336 14.559 -2.164 1.00 0.00 H ATOM 697 HH21 ARG A 65 1.580 12.985 -1.721 1.00 0.00 H ATOM 698 H ARG A 65 -4.281 10.258 -3.678 1.00 0.00 H ATOM 699 N LEU A 66 -7.469 10.984 -2.856 1.00 14.13 N ATOM 700 CA LEU A 66 -8.936 11.040 -2.904 1.00 12.94 C ATOM 701 C LEU A 66 -9.555 11.038 -1.492 1.00 14.22 C ATOM 702 O LEU A 66 -10.757 11.239 -1.356 1.00 15.18 O ATOM 703 CB LEU A 66 -9.504 9.852 -3.693 1.00 13.30 C ATOM 704 CG LEU A 66 -8.982 9.795 -5.127 1.00 12.96 C ATOM 705 CD1 LEU A 66 -9.592 8.531 -5.773 1.00 14.09 C ATOM 706 CD2 LEU A 66 -9.417 11.007 -5.873 1.00 13.60 C ATOM 707 HA LEU A 66 -9.197 11.973 -3.403 1.00 0.00 H ATOM 708 HB2 LEU A 66 -9.226 8.929 -3.183 1.00 0.00 H ATOM 709 HB3 LEU A 66 -10.590 9.938 -3.720 1.00 0.00 H ATOM 710 HG LEU A 66 -7.893 9.759 -5.148 1.00 0.00 H ATOM 711 HD21 LEU A 66 -10.506 11.052 -5.888 1.00 0.00 H ATOM 712 HD22 LEU A 66 -9.022 11.896 -5.381 1.00 0.00 H ATOM 713 HD23 LEU A 66 -9.040 10.958 -6.895 1.00 0.00 H ATOM 714 HD11 LEU A 66 -9.280 7.651 -5.211 1.00 0.00 H ATOM 715 HD12 LEU A 66 -10.679 8.606 -5.759 1.00 0.00 H ATOM 716 HD13 LEU A 66 -9.246 8.448 -6.803 1.00 0.00 H ATOM 717 H LEU A 66 -6.977 10.069 -2.911 1.00 0.00 H ATOM 718 N TYR A 67 -8.732 10.860 -0.462 1.00 13.43 N ATOM 719 CA TYR A 67 -9.222 10.884 0.919 1.00 13.17 C ATOM 720 C TYR A 67 -9.092 12.291 1.488 1.00 13.93 C ATOM 721 O TYR A 67 -8.206 13.090 1.063 1.00 14.36 O ATOM 722 CB TYR A 67 -8.466 9.854 1.767 1.00 13.19 C ATOM 723 CG TYR A 67 -6.992 10.161 1.959 1.00 14.64 C ATOM 724 CD1 TYR A 67 -6.554 11.015 2.974 1.00 15.61 C ATOM 725 CD2 TYR A 67 -6.042 9.619 1.101 1.00 17.12 C ATOM 726 CE1 TYR A 67 -5.221 11.312 3.126 1.00 18.16 C ATOM 727 CE2 TYR A 67 -4.719 9.908 1.246 1.00 18.99 C ATOM 728 CZ TYR A 67 -4.306 10.762 2.253 1.00 21.25 C ATOM 729 OH TYR A 67 -2.961 11.044 2.385 1.00 22.27 O ATOM 730 HA TYR A 67 -10.277 10.612 0.937 1.00 0.00 H ATOM 731 HB3 TYR A 67 -8.552 8.882 1.280 1.00 0.00 H ATOM 732 HB2 TYR A 67 -8.936 9.810 2.749 1.00 0.00 H ATOM 733 HD2 TYR A 67 -6.361 8.952 0.300 1.00 0.00 H ATOM 734 HE2 TYR A 67 -3.987 9.467 0.570 1.00 0.00 H ATOM 735 HE1 TYR A 67 -4.891 11.974 3.927 1.00 0.00 H ATOM 736 HD1 TYR A 67 -7.282 11.453 3.657 1.00 0.00 H ATOM 737 HH TYR A 67 -2.630 11.464 1.552 1.00 0.00 H ATOM 738 H TYR A 67 -7.720 10.701 -0.641 1.00 0.00 H ATOM 739 N ASP A 68 -9.950 12.614 2.452 1.00 12.93 N ATOM 740 CA ASP A 68 -9.899 13.909 3.140 1.00 13.78 C ATOM 741 C ASP A 68 -8.698 13.966 4.081 1.00 13.48 C ATOM 742 O ASP A 68 -8.522 13.065 4.894 1.00 12.89 O ATOM 743 CB ASP A 68 -11.175 14.083 3.956 1.00 13.22 C ATOM 744 CG ASP A 68 -11.171 15.334 4.772 1.00 15.09 C ATOM 745 OD1 ASP A 68 -10.608 16.344 4.307 1.00 14.88 O ATOM 746 OD2 ASP A 68 -11.759 15.294 5.855 1.00 15.16 O ATOM 747 HA ASP A 68 -9.807 14.703 2.399 1.00 0.00 H ATOM 748 HB2 ASP A 68 -12.024 14.114 3.273 1.00 0.00 H ATOM 749 HB3 ASP A 68 -11.280 13.230 4.626 1.00 0.00 H ATOM 750 H ASP A 68 -10.680 11.927 2.727 1.00 0.00 H ATOM 751 N GLU A 69 -7.872 15.000 3.966 1.00 13.68 N ATOM 752 CA GLU A 69 -6.696 15.148 4.820 1.00 14.67 C ATOM 753 C GLU A 69 -7.083 15.214 6.292 1.00 14.98 C ATOM 754 O GLU A 69 -6.343 14.764 7.167 1.00 15.43 O ATOM 755 CB GLU A 69 -5.964 16.436 4.456 1.00 15.61 C ATOM 756 CG GLU A 69 -4.761 16.690 5.310 1.00 18.92 C ATOM 757 CD GLU A 69 -3.626 15.692 5.085 1.00 23.91 C ATOM 758 OE1 GLU A 69 -3.622 14.985 4.058 1.00 24.31 O ATOM 759 OE2 GLU A 69 -2.708 15.645 5.939 1.00 27.52 O ATOM 760 HA GLU A 69 -6.056 14.280 4.662 1.00 0.00 H ATOM 761 HB2 GLU A 69 -5.644 16.371 3.416 1.00 0.00 H ATOM 762 HB3 GLU A 69 -6.654 17.272 4.571 1.00 0.00 H ATOM 763 HG2 GLU A 69 -4.388 17.691 5.091 1.00 0.00 H ATOM 764 HG3 GLU A 69 -5.064 16.637 6.356 1.00 0.00 H ATOM 765 H GLU A 69 -8.068 15.725 3.247 1.00 0.00 H ATOM 766 N LYS A 70 -8.234 15.827 6.581 1.00 13.56 N ATOM 767 CA LYS A 70 -8.655 16.024 7.978 1.00 14.16 C ATOM 768 C LYS A 70 -9.194 14.768 8.667 1.00 14.95 C ATOM 769 O LYS A 70 -8.717 14.371 9.742 1.00 16.83 O ATOM 770 CB LYS A 70 -9.705 17.127 8.059 1.00 13.75 C ATOM 771 CG LYS A 70 -10.057 17.514 9.467 1.00 14.74 C ATOM 772 CD LYS A 70 -10.997 18.707 9.467 1.00 19.25 C ATOM 773 CE LYS A 70 -11.377 19.116 10.882 1.00 22.09 C ATOM 774 NZ LYS A 70 -10.508 20.208 11.413 1.00 26.52 N ATOM 775 HA LYS A 70 -7.747 16.302 8.514 1.00 0.00 H ATOM 776 HB2 LYS A 70 -9.322 18.008 7.544 1.00 0.00 H ATOM 777 HB3 LYS A 70 -10.610 16.781 7.559 1.00 0.00 H ATOM 778 HG2 LYS A 70 -10.543 16.673 9.960 1.00 0.00 H ATOM 779 HG3 LYS A 70 -9.146 17.773 10.007 1.00 0.00 H ATOM 780 HD2 LYS A 70 -10.505 19.546 8.975 1.00 0.00 H ATOM 781 HD3 LYS A 70 -11.902 18.446 8.918 1.00 0.00 H ATOM 782 HE2 LYS A 70 -11.285 18.247 11.534 1.00 0.00 H ATOM 783 HE3 LYS A 70 -12.411 19.461 10.881 1.00 0.00 H ATOM 784 HZ1 LYS A 70 -9.519 19.887 11.426 1.00 0.00 H ATOM 785 HZ2 LYS A 70 -10.594 21.046 10.802 1.00 0.00 H ATOM 786 HZ3 LYS A 70 -10.808 20.449 12.379 1.00 0.00 H ATOM 787 H LYS A 70 -8.841 16.170 5.809 1.00 0.00 H ATOM 788 N GLN A 71 -10.199 14.148 8.053 1.00 13.20 N ATOM 789 CA GLN A 71 -10.788 12.888 8.551 1.00 12.22 C ATOM 790 C GLN A 71 -10.587 11.854 7.468 1.00 12.00 C ATOM 791 O GLN A 71 -11.317 11.798 6.456 1.00 12.41 O ATOM 792 CB GLN A 71 -12.262 13.071 8.860 1.00 12.82 C ATOM 793 CG GLN A 71 -12.531 13.775 10.161 1.00 15.73 C ATOM 794 CD GLN A 71 -14.027 13.686 10.513 1.00 17.11 C ATOM 795 OE1 GLN A 71 -14.685 12.670 10.230 1.00 22.33 O ATOM 796 NE2 GLN A 71 -14.546 14.723 11.125 1.00 23.00 N ATOM 797 HA GLN A 71 -10.309 12.573 9.478 1.00 0.00 H ATOM 798 HB2 GLN A 71 -12.712 13.653 8.056 1.00 0.00 H ATOM 799 HB3 GLN A 71 -12.729 12.087 8.899 1.00 0.00 H ATOM 800 HG2 GLN A 71 -11.946 13.306 10.952 1.00 0.00 H ATOM 801 HG3 GLN A 71 -12.244 14.823 10.070 1.00 0.00 H ATOM 802 HE22 GLN A 71 -13.953 15.550 11.340 1.00 0.00 H ATOM 803 HE21 GLN A 71 -15.550 14.718 11.395 1.00 0.00 H ATOM 804 H GLN A 71 -10.587 14.569 7.185 1.00 0.00 H ATOM 805 N GLN A 72 -9.533 11.061 7.664 1.00 11.93 N ATOM 806 CA GLN A 72 -8.940 10.317 6.544 1.00 11.76 C ATOM 807 C GLN A 72 -9.660 9.025 6.156 1.00 11.59 C ATOM 808 O GLN A 72 -9.183 8.315 5.301 1.00 13.31 O ATOM 809 CB GLN A 72 -7.455 10.051 6.819 1.00 11.72 C ATOM 810 CG GLN A 72 -6.704 11.397 7.005 1.00 12.93 C ATOM 811 CD GLN A 72 -5.184 11.307 6.768 1.00 12.32 C ATOM 812 OE1 GLN A 72 -4.605 10.216 6.604 1.00 12.42 O ATOM 813 NE2 GLN A 72 -4.531 12.465 6.804 1.00 15.21 N ATOM 814 HA GLN A 72 -9.059 10.964 5.675 1.00 0.00 H ATOM 815 HB2 GLN A 72 -7.356 9.453 7.725 1.00 0.00 H ATOM 816 HB3 GLN A 72 -7.023 9.508 5.978 1.00 0.00 H ATOM 817 HG2 GLN A 72 -7.118 12.120 6.303 1.00 0.00 H ATOM 818 HG3 GLN A 72 -6.872 11.745 8.024 1.00 0.00 H ATOM 819 HE22 GLN A 72 -5.054 13.353 6.943 1.00 0.00 H ATOM 820 HE21 GLN A 72 -3.497 12.483 6.693 1.00 0.00 H ATOM 821 H GLN A 72 -9.127 10.968 8.617 1.00 0.00 H ATOM 822 N HIS A 73 -10.827 8.767 6.745 1.00 11.58 N ATOM 823 CA HIS A 73 -11.663 7.661 6.302 1.00 12.14 C ATOM 824 C HIS A 73 -12.591 8.149 5.190 1.00 12.49 C ATOM 825 O HIS A 73 -13.256 7.335 4.547 1.00 12.83 O ATOM 826 CB HIS A 73 -12.533 7.121 7.445 1.00 11.75 C ATOM 827 CG HIS A 73 -13.489 8.133 8.005 1.00 14.79 C ATOM 828 ND1 HIS A 73 -14.804 8.247 7.587 1.00 15.02 N ATOM 829 CD2 HIS A 73 -13.301 9.107 8.923 1.00 14.86 C ATOM 830 CE1 HIS A 73 -15.386 9.227 8.267 1.00 14.48 C ATOM 831 NE2 HIS A 73 -14.492 9.771 9.069 1.00 15.12 N ATOM 832 HA HIS A 73 -11.007 6.865 5.950 1.00 0.00 H ATOM 833 HB2 HIS A 73 -13.108 6.275 7.070 1.00 0.00 H ATOM 834 HB3 HIS A 73 -11.877 6.785 8.248 1.00 0.00 H ATOM 835 HD2 HIS A 73 -12.373 9.325 9.451 1.00 0.00 H ATOM 836 HE1 HIS A 73 -16.429 9.531 8.177 1.00 0.00 H ATOM 837 H HIS A 73 -11.146 9.365 7.534 1.00 0.00 H ATOM 838 N ILE A 74 -12.689 9.459 4.972 1.00 10.85 N ATOM 839 CA ILE A 74 -13.631 9.967 3.952 1.00 11.37 C ATOM 840 C ILE A 74 -13.011 9.947 2.553 1.00 11.49 C ATOM 841 O ILE A 74 -11.948 10.534 2.356 1.00 12.58 O ATOM 842 CB ILE A 74 -14.029 11.429 4.277 1.00 11.84 C ATOM 843 CG1 ILE A 74 -14.655 11.499 5.671 1.00 12.25 C ATOM 844 CG2 ILE A 74 -14.974 12.027 3.177 1.00 12.13 C ATOM 845 CD1 ILE A 74 -14.811 12.962 6.114 1.00 13.05 C ATOM 846 HA ILE A 74 -14.504 9.315 3.968 1.00 0.00 H ATOM 847 HB ILE A 74 -13.129 12.044 4.277 1.00 0.00 H ATOM 848 HG12 ILE A 74 -15.635 11.023 5.649 1.00 0.00 H ATOM 849 HG13 ILE A 74 -14.014 10.975 6.380 1.00 0.00 H ATOM 850 HD11 ILE A 74 -13.831 13.439 6.139 1.00 0.00 H ATOM 851 HD12 ILE A 74 -15.454 13.487 5.408 1.00 0.00 H ATOM 852 HD13 ILE A 74 -15.258 12.994 7.108 1.00 0.00 H ATOM 853 HG21 ILE A 74 -14.463 12.014 2.214 1.00 0.00 H ATOM 854 HG22 ILE A 74 -15.882 11.428 3.115 1.00 0.00 H ATOM 855 HG23 ILE A 74 -15.231 13.053 3.440 1.00 0.00 H ATOM 856 H ILE A 74 -12.104 10.123 5.518 1.00 0.00 H ATOM 857 N VAL A 75 -13.639 9.257 1.601 1.00 11.03 N ATOM 858 CA VAL A 75 -13.079 9.247 0.242 1.00 11.79 C ATOM 859 C VAL A 75 -14.074 9.858 -0.705 1.00 12.13 C ATOM 860 O VAL A 75 -15.249 9.474 -0.683 1.00 13.65 O ATOM 861 CB VAL A 75 -12.781 7.805 -0.176 1.00 11.90 C ATOM 862 CG1 VAL A 75 -12.322 7.727 -1.663 1.00 13.09 C ATOM 863 CG2 VAL A 75 -11.741 7.167 0.743 1.00 14.18 C ATOM 864 HA VAL A 75 -12.154 9.824 0.218 1.00 0.00 H ATOM 865 HB VAL A 75 -13.709 7.241 -0.081 1.00 0.00 H ATOM 866 HG11 VAL A 75 -13.110 8.118 -2.306 1.00 0.00 H ATOM 867 HG12 VAL A 75 -11.417 8.320 -1.794 1.00 0.00 H ATOM 868 HG13 VAL A 75 -12.119 6.689 -1.925 1.00 0.00 H ATOM 869 HG21 VAL A 75 -10.816 7.741 0.696 1.00 0.00 H ATOM 870 HG22 VAL A 75 -12.116 7.162 1.766 1.00 0.00 H ATOM 871 HG23 VAL A 75 -11.551 6.143 0.420 1.00 0.00 H ATOM 872 H VAL A 75 -14.512 8.734 1.816 1.00 0.00 H ATOM 873 N TYR A 76 -13.626 10.811 -1.522 1.00 12.28 N ATOM 874 CA TYR A 76 -14.484 11.419 -2.547 1.00 13.32 C ATOM 875 C TYR A 76 -13.955 11.013 -3.922 1.00 13.51 C ATOM 876 O TYR A 76 -12.814 11.314 -4.255 1.00 14.68 O ATOM 877 CB TYR A 76 -14.546 12.943 -2.420 1.00 12.95 C ATOM 878 CG TYR A 76 -15.579 13.542 -3.357 1.00 13.08 C ATOM 879 CD1 TYR A 76 -16.926 13.612 -3.002 1.00 13.02 C ATOM 880 CD2 TYR A 76 -15.219 13.997 -4.618 1.00 13.48 C ATOM 881 CE1 TYR A 76 -17.846 14.128 -3.867 1.00 12.59 C ATOM 882 CE2 TYR A 76 -16.163 14.542 -5.490 1.00 12.85 C ATOM 883 CZ TYR A 76 -17.467 14.617 -5.100 1.00 14.45 C ATOM 884 OH TYR A 76 -18.432 15.135 -5.946 1.00 15.25 O ATOM 885 HA TYR A 76 -15.503 11.057 -2.411 1.00 0.00 H ATOM 886 HB3 TYR A 76 -13.567 13.358 -2.661 1.00 0.00 H ATOM 887 HB2 TYR A 76 -14.807 13.202 -1.394 1.00 0.00 H ATOM 888 HD2 TYR A 76 -14.178 13.927 -4.934 1.00 0.00 H ATOM 889 HE2 TYR A 76 -15.861 14.904 -6.473 1.00 0.00 H ATOM 890 HE1 TYR A 76 -18.897 14.154 -3.579 1.00 0.00 H ATOM 891 HD1 TYR A 76 -17.246 13.251 -2.025 1.00 0.00 H ATOM 892 HH TYR A 76 -18.203 16.071 -6.172 1.00 0.00 H ATOM 893 H TYR A 76 -12.641 11.133 -1.431 1.00 0.00 H ATOM 894 N CYS A 77 -14.766 10.293 -4.685 1.00 14.54 N ATOM 895 CA CYS A 77 -14.289 9.621 -5.879 1.00 13.99 C ATOM 896 C CYS A 77 -15.125 9.965 -7.126 1.00 14.72 C ATOM 897 O CYS A 77 -14.958 9.331 -8.176 1.00 13.86 O ATOM 898 CB CYS A 77 -14.231 8.099 -5.630 1.00 15.15 C ATOM 899 SG CYS A 77 -15.692 7.332 -5.002 1.00 17.49 S ATOM 900 HA CYS A 77 -13.283 9.983 -6.090 1.00 0.00 H ATOM 901 HB2 CYS A 77 -13.429 7.913 -4.916 1.00 0.00 H ATOM 902 HB3 CYS A 77 -13.990 7.620 -6.579 1.00 0.00 H ATOM 903 HG CYS A 77 -16.729 7.523 -5.892 1.00 0.00 H ATOM 904 H CYS A 77 -15.768 10.208 -4.421 1.00 0.00 H ATOM 905 N SER A 78 -16.026 10.952 -7.020 1.00 12.60 N ATOM 906 CA SER A 78 -16.855 11.312 -8.169 1.00 14.54 C ATOM 907 C SER A 78 -15.980 11.738 -9.327 1.00 15.49 C ATOM 908 O SER A 78 -15.009 12.469 -9.142 1.00 16.98 O ATOM 909 CB SER A 78 -17.831 12.441 -7.829 1.00 14.94 C ATOM 910 OG SER A 78 -18.782 12.602 -8.887 1.00 17.30 O ATOM 911 HA SER A 78 -17.434 10.431 -8.446 1.00 0.00 H ATOM 912 HB2 SER A 78 -17.277 13.370 -7.697 1.00 0.00 H ATOM 913 HB3 SER A 78 -18.356 12.198 -6.905 1.00 0.00 H ATOM 914 HG SER A 78 -19.287 11.759 -9.006 1.00 0.00 H ATOM 915 H SER A 78 -16.135 11.462 -6.120 1.00 0.00 H ATOM 916 N ASN A 79 -16.328 11.286 -10.525 1.00 16.09 N ATOM 917 CA ASN A 79 -15.596 11.605 -11.760 1.00 16.85 C ATOM 918 C ASN A 79 -14.177 11.074 -11.766 1.00 16.26 C ATOM 919 O ASN A 79 -13.364 11.479 -12.587 1.00 15.85 O ATOM 920 CB ASN A 79 -15.622 13.098 -12.092 1.00 17.61 C ATOM 921 CG ASN A 79 -16.961 13.549 -12.648 1.00 19.93 C ATOM 922 OD1 ASN A 79 -17.610 12.839 -13.427 1.00 25.44 O ATOM 923 ND2 ASN A 79 -17.393 14.728 -12.233 1.00 26.11 N ATOM 924 HA ASN A 79 -16.135 11.083 -12.551 1.00 0.00 H ATOM 925 HB2 ASN A 79 -15.413 13.662 -11.183 1.00 0.00 H ATOM 926 HB3 ASN A 79 -14.849 13.305 -12.832 1.00 0.00 H ATOM 927 HD22 ASN A 79 -16.815 15.292 -11.578 1.00 0.00 H ATOM 928 HD21 ASN A 79 -18.310 15.091 -12.562 1.00 0.00 H ATOM 929 H ASN A 79 -17.165 10.672 -10.594 1.00 0.00 H ATOM 930 N ASP A 80 -13.892 10.139 -10.869 1.00 15.48 N ATOM 931 CA ASP A 80 -12.622 9.413 -10.940 1.00 13.87 C ATOM 932 C ASP A 80 -12.966 8.010 -11.413 1.00 14.06 C ATOM 933 O ASP A 80 -14.080 7.526 -11.189 1.00 14.39 O ATOM 934 CB ASP A 80 -11.983 9.311 -9.544 1.00 13.99 C ATOM 935 CG ASP A 80 -10.573 8.797 -9.585 1.00 15.00 C ATOM 936 OD1 ASP A 80 -9.679 9.638 -9.762 1.00 17.87 O ATOM 937 OD2 ASP A 80 -10.370 7.583 -9.476 1.00 15.51 O ATOM 938 HA ASP A 80 -11.923 9.922 -11.604 1.00 0.00 H ATOM 939 HB2 ASP A 80 -11.980 10.302 -9.089 1.00 0.00 H ATOM 940 HB3 ASP A 80 -12.583 8.635 -8.935 1.00 0.00 H ATOM 941 H ASP A 80 -14.572 9.921 -10.113 1.00 0.00 H ATOM 942 N LEU A 81 -11.995 7.342 -12.049 1.00 13.73 N ATOM 943 CA LEU A 81 -12.085 5.915 -12.352 1.00 14.40 C ATOM 944 C LEU A 81 -12.640 5.130 -11.166 1.00 14.14 C ATOM 945 O LEU A 81 -13.474 4.231 -11.294 1.00 14.94 O ATOM 946 CB LEU A 81 -10.686 5.407 -12.730 1.00 15.18 C ATOM 947 CG LEU A 81 -10.474 3.903 -12.926 1.00 16.48 C ATOM 948 CD1 LEU A 81 -11.317 3.401 -14.088 1.00 17.71 C ATOM 949 CD2 LEU A 81 -8.975 3.601 -13.177 1.00 15.53 C ATOM 950 HA LEU A 81 -12.772 5.767 -13.185 1.00 0.00 H ATOM 951 HB2 LEU A 81 -10.410 5.894 -13.665 1.00 0.00 H ATOM 952 HB3 LEU A 81 -10.005 5.726 -11.941 1.00 0.00 H ATOM 953 HG LEU A 81 -10.786 3.384 -12.020 1.00 0.00 H ATOM 954 HD21 LEU A 81 -8.644 4.128 -14.072 1.00 0.00 H ATOM 955 HD22 LEU A 81 -8.390 3.935 -12.320 1.00 0.00 H ATOM 956 HD23 LEU A 81 -8.840 2.528 -13.314 1.00 0.00 H ATOM 957 HD11 LEU A 81 -12.370 3.589 -13.879 1.00 0.00 H ATOM 958 HD12 LEU A 81 -11.027 3.925 -14.999 1.00 0.00 H ATOM 959 HD13 LEU A 81 -11.156 2.331 -14.216 1.00 0.00 H ATOM 960 H LEU A 81 -11.141 7.860 -12.339 1.00 0.00 H ATOM 961 N LEU A 82 -12.179 5.459 -9.960 1.00 12.85 N ATOM 962 CA LEU A 82 -12.653 4.734 -8.789 1.00 13.28 C ATOM 963 C LEU A 82 -14.170 4.930 -8.558 1.00 13.40 C ATOM 964 O LEU A 82 -14.877 3.995 -8.173 1.00 14.35 O ATOM 965 CB LEU A 82 -11.864 5.189 -7.560 1.00 12.20 C ATOM 966 CG LEU A 82 -12.326 4.482 -6.284 1.00 13.64 C ATOM 967 CD1 LEU A 82 -12.158 2.948 -6.462 1.00 16.57 C ATOM 968 CD2 LEU A 82 -11.501 5.030 -5.076 1.00 14.51 C ATOM 969 HA LEU A 82 -12.492 3.670 -8.961 1.00 0.00 H ATOM 970 HB2 LEU A 82 -10.808 4.971 -7.720 1.00 0.00 H ATOM 971 HB3 LEU A 82 -11.997 6.264 -7.435 1.00 0.00 H ATOM 972 HG LEU A 82 -13.380 4.678 -6.087 1.00 0.00 H ATOM 973 HD21 LEU A 82 -10.442 4.836 -5.243 1.00 0.00 H ATOM 974 HD22 LEU A 82 -11.664 6.104 -4.983 1.00 0.00 H ATOM 975 HD23 LEU A 82 -11.823 4.532 -4.162 1.00 0.00 H ATOM 976 HD11 LEU A 82 -12.761 2.613 -7.306 1.00 0.00 H ATOM 977 HD12 LEU A 82 -11.109 2.718 -6.650 1.00 0.00 H ATOM 978 HD13 LEU A 82 -12.486 2.440 -5.555 1.00 0.00 H ATOM 979 H LEU A 82 -11.486 6.227 -9.856 1.00 0.00 H ATOM 980 N GLY A 83 -14.649 6.153 -8.760 1.00 13.33 N ATOM 981 CA GLY A 83 -16.078 6.430 -8.675 1.00 13.66 C ATOM 982 C GLY A 83 -16.876 5.636 -9.709 1.00 15.10 C ATOM 983 O GLY A 83 -17.983 5.186 -9.423 1.00 16.19 O ATOM 984 HA3 GLY A 83 -16.242 7.494 -8.845 1.00 0.00 H ATOM 985 HA2 GLY A 83 -16.430 6.164 -7.678 1.00 0.00 H ATOM 986 H GLY A 83 -13.992 6.928 -8.983 1.00 0.00 H ATOM 987 N ASP A 84 -16.340 5.467 -10.908 1.00 15.60 N ATOM 988 CA ASP A 84 -17.021 4.627 -11.903 1.00 17.57 C ATOM 989 C ASP A 84 -17.110 3.157 -11.458 1.00 19.13 C ATOM 990 O ASP A 84 -18.141 2.508 -11.669 1.00 19.08 O ATOM 991 CB ASP A 84 -16.299 4.690 -13.247 1.00 18.48 C ATOM 992 CG ASP A 84 -16.225 6.089 -13.808 1.00 21.70 C ATOM 993 OD1 ASP A 84 -16.938 6.997 -13.332 1.00 24.63 O ATOM 994 OD2 ASP A 84 -15.413 6.288 -14.738 1.00 29.00 O ATOM 995 HA ASP A 84 -18.032 5.021 -12.002 1.00 0.00 H ATOM 996 HB2 ASP A 84 -15.285 4.313 -13.115 1.00 0.00 H ATOM 997 HB3 ASP A 84 -16.831 4.057 -13.958 1.00 0.00 H ATOM 998 H ASP A 84 -15.438 5.928 -11.145 1.00 0.00 H ATOM 999 N LEU A 85 -16.039 2.612 -10.863 1.00 19.45 N ATOM 1000 CA LEU A 85 -16.067 1.242 -10.315 1.00 19.91 C ATOM 1001 C LEU A 85 -17.116 1.047 -9.239 1.00 20.93 C ATOM 1002 O LEU A 85 -17.828 0.038 -9.229 1.00 21.30 O ATOM 1003 CB LEU A 85 -14.710 0.860 -9.712 1.00 19.69 C ATOM 1004 CG LEU A 85 -13.529 0.594 -10.627 1.00 18.32 C ATOM 1005 CD1 LEU A 85 -12.313 0.351 -9.724 1.00 15.91 C ATOM 1006 CD2 LEU A 85 -13.793 -0.627 -11.526 1.00 15.80 C ATOM 1007 HA LEU A 85 -16.313 0.604 -11.164 1.00 0.00 H ATOM 1008 HB2 LEU A 85 -14.419 1.674 -9.048 1.00 0.00 H ATOM 1009 HB3 LEU A 85 -14.867 -0.046 -9.127 1.00 0.00 H ATOM 1010 HG LEU A 85 -13.357 1.442 -11.290 1.00 0.00 H ATOM 1011 HD21 LEU A 85 -13.959 -1.506 -10.903 1.00 0.00 H ATOM 1012 HD22 LEU A 85 -14.676 -0.442 -12.138 1.00 0.00 H ATOM 1013 HD23 LEU A 85 -12.931 -0.795 -12.171 1.00 0.00 H ATOM 1014 HD11 LEU A 85 -12.136 1.234 -9.110 1.00 0.00 H ATOM 1015 HD12 LEU A 85 -12.505 -0.508 -9.081 1.00 0.00 H ATOM 1016 HD13 LEU A 85 -11.437 0.155 -10.342 1.00 0.00 H ATOM 1017 H LEU A 85 -15.165 3.170 -10.786 1.00 0.00 H ATOM 1018 N PHE A 86 -17.188 1.996 -8.311 1.00 19.63 N ATOM 1019 CA PHE A 86 -18.131 1.965 -7.210 1.00 20.60 C ATOM 1020 C PHE A 86 -19.554 2.293 -7.615 1.00 19.41 C ATOM 1021 O PHE A 86 -20.498 1.810 -7.025 1.00 20.22 O ATOM 1022 CB PHE A 86 -17.726 2.981 -6.107 1.00 21.10 C ATOM 1023 CG PHE A 86 -16.933 2.401 -4.971 1.00 24.21 C ATOM 1024 CD1 PHE A 86 -17.570 1.876 -3.842 1.00 25.62 C ATOM 1025 CD2 PHE A 86 -15.537 2.425 -5.002 1.00 21.81 C ATOM 1026 CE1 PHE A 86 -16.817 1.344 -2.776 1.00 26.11 C ATOM 1027 CE2 PHE A 86 -14.791 1.888 -3.969 1.00 22.09 C ATOM 1028 CZ PHE A 86 -15.408 1.364 -2.856 1.00 24.69 C ATOM 1029 HA PHE A 86 -18.099 0.938 -6.846 1.00 0.00 H ATOM 1030 HB2 PHE A 86 -17.128 3.765 -6.572 1.00 0.00 H ATOM 1031 HB3 PHE A 86 -18.637 3.416 -5.696 1.00 0.00 H ATOM 1032 HD2 PHE A 86 -15.027 2.874 -5.854 1.00 0.00 H ATOM 1033 HE2 PHE A 86 -13.703 1.880 -4.037 1.00 0.00 H ATOM 1034 HZ PHE A 86 -14.809 0.965 -2.037 1.00 0.00 H ATOM 1035 HE1 PHE A 86 -17.315 0.923 -1.903 1.00 0.00 H ATOM 1036 HD1 PHE A 86 -18.659 1.878 -3.786 1.00 0.00 H ATOM 1037 H PHE A 86 -16.534 2.802 -8.378 1.00 0.00 H ATOM 1038 N GLY A 87 -19.722 3.169 -8.600 1.00 17.76 N ATOM 1039 CA GLY A 87 -21.022 3.689 -8.910 1.00 18.13 C ATOM 1040 C GLY A 87 -21.558 4.688 -7.882 1.00 17.68 C ATOM 1041 O GLY A 87 -22.761 4.909 -7.839 1.00 19.59 O ATOM 1042 HA3 GLY A 87 -21.719 2.853 -8.971 1.00 0.00 H ATOM 1043 HA2 GLY A 87 -20.969 4.188 -9.877 1.00 0.00 H ATOM 1044 H GLY A 87 -18.899 3.482 -9.154 1.00 0.00 H ATOM 1045 N VAL A 88 -20.666 5.291 -7.097 1.00 17.68 N ATOM 1046 CA VAL A 88 -21.007 6.248 -6.041 1.00 17.79 C ATOM 1047 C VAL A 88 -19.990 7.409 -6.068 1.00 15.65 C ATOM 1048 O VAL A 88 -18.850 7.256 -6.482 1.00 15.29 O ATOM 1049 CB VAL A 88 -20.963 5.582 -4.609 1.00 19.03 C ATOM 1050 CG1 VAL A 88 -21.831 4.347 -4.577 1.00 22.51 C ATOM 1051 CG2 VAL A 88 -19.581 5.204 -4.244 1.00 21.19 C ATOM 1052 HA VAL A 88 -22.021 6.604 -6.226 1.00 0.00 H ATOM 1053 HB VAL A 88 -21.336 6.314 -3.892 1.00 0.00 H ATOM 1054 HG11 VAL A 88 -22.860 4.621 -4.810 1.00 0.00 H ATOM 1055 HG12 VAL A 88 -21.468 3.630 -5.314 1.00 0.00 H ATOM 1056 HG13 VAL A 88 -21.789 3.901 -3.583 1.00 0.00 H ATOM 1057 HG21 VAL A 88 -19.196 4.492 -4.974 1.00 0.00 H ATOM 1058 HG22 VAL A 88 -18.952 6.094 -4.236 1.00 0.00 H ATOM 1059 HG23 VAL A 88 -19.580 4.748 -3.254 1.00 0.00 H ATOM 1060 H VAL A 88 -19.661 5.068 -7.244 1.00 0.00 H ATOM 1061 N PRO A 89 -20.416 8.595 -5.616 1.00 14.71 N ATOM 1062 CA PRO A 89 -19.483 9.728 -5.610 1.00 13.87 C ATOM 1063 C PRO A 89 -18.544 9.749 -4.406 1.00 13.29 C ATOM 1064 O PRO A 89 -17.564 10.480 -4.424 1.00 13.79 O ATOM 1065 CB PRO A 89 -20.422 10.941 -5.534 1.00 13.91 C ATOM 1066 CG PRO A 89 -21.640 10.390 -4.723 1.00 14.35 C ATOM 1067 CD PRO A 89 -21.804 8.980 -5.280 1.00 14.29 C ATOM 1068 HA PRO A 89 -18.825 9.695 -6.478 1.00 0.00 H ATOM 1069 HD3 PRO A 89 -22.227 8.309 -4.532 1.00 0.00 H ATOM 1070 HD2 PRO A 89 -22.437 8.979 -6.167 1.00 0.00 H ATOM 1071 HG3 PRO A 89 -22.533 10.989 -4.899 1.00 0.00 H ATOM 1072 HG2 PRO A 89 -21.424 10.368 -3.655 1.00 0.00 H ATOM 1073 HB2 PRO A 89 -19.947 11.773 -5.013 1.00 0.00 H ATOM 1074 HB3 PRO A 89 -20.727 11.264 -6.529 1.00 0.00 H ATOM 1075 N SER A 90 -18.827 8.936 -3.380 1.00 12.42 N ATOM 1076 CA SER A 90 -18.112 9.059 -2.119 1.00 13.06 C ATOM 1077 C SER A 90 -18.434 7.835 -1.283 1.00 12.43 C ATOM 1078 O SER A 90 -19.456 7.134 -1.513 1.00 13.23 O ATOM 1079 CB SER A 90 -18.604 10.323 -1.393 1.00 12.57 C ATOM 1080 OG SER A 90 -19.988 10.240 -1.140 1.00 15.86 O ATOM 1081 HA SER A 90 -17.037 9.132 -2.283 1.00 0.00 H ATOM 1082 HB2 SER A 90 -18.405 11.195 -2.016 1.00 0.00 H ATOM 1083 HB3 SER A 90 -18.072 10.424 -0.447 1.00 0.00 H ATOM 1084 HG SER A 90 -20.287 11.060 -0.673 1.00 0.00 H ATOM 1085 H SER A 90 -19.564 8.210 -3.486 1.00 0.00 H ATOM 1086 N PHE A 91 -17.576 7.595 -0.306 1.00 12.76 N ATOM 1087 CA PHE A 91 -17.798 6.516 0.676 1.00 12.11 C ATOM 1088 C PHE A 91 -16.875 6.746 1.833 1.00 12.70 C ATOM 1089 O PHE A 91 -15.888 7.479 1.713 1.00 13.13 O ATOM 1090 CB PHE A 91 -17.597 5.104 0.089 1.00 12.95 C ATOM 1091 CG PHE A 91 -16.199 4.828 -0.397 1.00 11.92 C ATOM 1092 CD1 PHE A 91 -15.262 4.201 0.438 1.00 12.72 C ATOM 1093 CD2 PHE A 91 -15.826 5.180 -1.703 1.00 12.16 C ATOM 1094 CE1 PHE A 91 -13.939 3.930 -0.057 1.00 14.09 C ATOM 1095 CE2 PHE A 91 -14.549 4.940 -2.166 1.00 14.94 C ATOM 1096 CZ PHE A 91 -13.596 4.309 -1.333 1.00 14.14 C ATOM 1097 HA PHE A 91 -18.840 6.552 0.994 1.00 0.00 H ATOM 1098 HB2 PHE A 91 -17.840 4.375 0.862 1.00 0.00 H ATOM 1099 HB3 PHE A 91 -18.281 4.983 -0.751 1.00 0.00 H ATOM 1100 HD2 PHE A 91 -16.556 5.650 -2.362 1.00 0.00 H ATOM 1101 HE2 PHE A 91 -14.273 5.238 -3.178 1.00 0.00 H ATOM 1102 HZ PHE A 91 -12.588 4.123 -1.703 1.00 0.00 H ATOM 1103 HE1 PHE A 91 -13.211 3.426 0.578 1.00 0.00 H ATOM 1104 HD1 PHE A 91 -15.535 3.921 1.455 1.00 0.00 H ATOM 1105 H PHE A 91 -16.721 8.183 -0.227 1.00 0.00 H ATOM 1106 N SER A 92 -17.168 6.120 2.957 1.00 12.21 N ATOM 1107 CA SER A 92 -16.213 6.105 4.062 1.00 12.17 C ATOM 1108 C SER A 92 -15.487 4.747 4.026 1.00 12.75 C ATOM 1109 O SER A 92 -16.102 3.710 3.754 1.00 12.57 O ATOM 1110 CB SER A 92 -16.983 6.235 5.385 1.00 12.84 C ATOM 1111 OG SER A 92 -16.115 5.966 6.495 1.00 13.30 O ATOM 1112 HA SER A 92 -15.500 6.925 3.977 1.00 0.00 H ATOM 1113 HB2 SER A 92 -17.808 5.523 5.393 1.00 0.00 H ATOM 1114 HB3 SER A 92 -17.378 7.247 5.474 1.00 0.00 H ATOM 1115 HG SER A 92 -15.366 6.614 6.491 1.00 0.00 H ATOM 1116 H SER A 92 -18.083 5.635 3.057 1.00 0.00 H ATOM 1117 N VAL A 93 -14.203 4.762 4.330 1.00 12.58 N ATOM 1118 CA VAL A 93 -13.422 3.526 4.483 1.00 12.15 C ATOM 1119 C VAL A 93 -14.023 2.598 5.559 1.00 13.82 C ATOM 1120 O VAL A 93 -13.827 1.390 5.499 1.00 14.98 O ATOM 1121 CB VAL A 93 -11.933 3.863 4.813 1.00 11.68 C ATOM 1122 CG1 VAL A 93 -11.119 2.560 5.055 1.00 11.79 C ATOM 1123 CG2 VAL A 93 -11.350 4.670 3.648 1.00 12.85 C ATOM 1124 HA VAL A 93 -13.460 2.990 3.535 1.00 0.00 H ATOM 1125 HB VAL A 93 -11.878 4.454 5.727 1.00 0.00 H ATOM 1126 HG11 VAL A 93 -11.552 2.013 5.892 1.00 0.00 H ATOM 1127 HG12 VAL A 93 -11.152 1.941 4.159 1.00 0.00 H ATOM 1128 HG13 VAL A 93 -10.085 2.816 5.283 1.00 0.00 H ATOM 1129 HG21 VAL A 93 -11.405 4.078 2.734 1.00 0.00 H ATOM 1130 HG22 VAL A 93 -11.922 5.589 3.522 1.00 0.00 H ATOM 1131 HG23 VAL A 93 -10.309 4.914 3.862 1.00 0.00 H ATOM 1132 H VAL A 93 -13.728 5.677 4.466 1.00 0.00 H ATOM 1133 N LYS A 94 -14.800 3.145 6.489 1.00 12.35 N ATOM 1134 CA LYS A 94 -15.483 2.296 7.469 1.00 13.31 C ATOM 1135 C LYS A 94 -16.602 1.405 6.880 1.00 13.08 C ATOM 1136 O LYS A 94 -17.079 0.499 7.589 1.00 13.47 O ATOM 1137 CB LYS A 94 -16.025 3.166 8.586 1.00 13.78 C ATOM 1138 CG LYS A 94 -14.944 3.934 9.274 1.00 16.01 C ATOM 1139 CD LYS A 94 -15.584 4.600 10.477 1.00 24.82 C ATOM 1140 CE LYS A 94 -15.077 6.014 10.639 1.00 30.32 C ATOM 1141 NZ LYS A 94 -15.506 6.657 11.932 1.00 36.20 N ATOM 1142 HA LYS A 94 -14.738 1.596 7.848 1.00 0.00 H ATOM 1143 HB2 LYS A 94 -16.744 3.870 8.167 1.00 0.00 H ATOM 1144 HB3 LYS A 94 -16.524 2.530 9.317 1.00 0.00 H ATOM 1145 HG2 LYS A 94 -14.150 3.260 9.595 1.00 0.00 H ATOM 1146 HG3 LYS A 94 -14.531 4.687 8.602 1.00 0.00 H ATOM 1147 HD2 LYS A 94 -16.665 4.621 10.341 1.00 0.00 H ATOM 1148 HD3 LYS A 94 -15.342 4.028 11.373 1.00 0.00 H ATOM 1149 HE2 LYS A 94 -15.455 6.614 9.812 1.00 0.00 H ATOM 1150 HE3 LYS A 94 -13.988 5.997 10.606 1.00 0.00 H ATOM 1151 HZ1 LYS A 94 -16.545 6.690 11.974 1.00 0.00 H ATOM 1152 HZ2 LYS A 94 -15.143 6.100 12.732 1.00 0.00 H ATOM 1153 HZ3 LYS A 94 -15.125 7.624 11.980 1.00 0.00 H ATOM 1154 H LYS A 94 -14.923 4.177 6.521 1.00 0.00 H ATOM 1155 N GLU A 95 -17.045 1.695 5.648 1.00 12.84 N ATOM 1156 CA GLU A 95 -18.162 0.947 4.995 1.00 12.85 C ATOM 1157 C GLU A 95 -17.635 -0.310 4.333 1.00 12.33 C ATOM 1158 O GLU A 95 -17.521 -0.397 3.116 1.00 13.49 O ATOM 1159 CB GLU A 95 -18.851 1.847 3.969 1.00 13.86 C ATOM 1160 CG GLU A 95 -19.457 3.093 4.645 1.00 14.89 C ATOM 1161 CD GLU A 95 -20.228 3.885 3.633 1.00 17.82 C ATOM 1162 OE1 GLU A 95 -19.677 4.829 3.080 1.00 15.26 O ATOM 1163 OE2 GLU A 95 -21.403 3.541 3.315 1.00 20.50 O ATOM 1164 HA GLU A 95 -18.889 0.654 5.752 1.00 0.00 H ATOM 1165 HB2 GLU A 95 -18.120 2.165 3.225 1.00 0.00 H ATOM 1166 HB3 GLU A 95 -19.646 1.285 3.479 1.00 0.00 H ATOM 1167 HG2 GLU A 95 -20.124 2.782 5.449 1.00 0.00 H ATOM 1168 HG3 GLU A 95 -18.657 3.709 5.056 1.00 0.00 H ATOM 1169 H GLU A 95 -16.593 2.472 5.126 1.00 0.00 H ATOM 1170 N HIS A 96 -17.287 -1.295 5.163 1.00 13.17 N ATOM 1171 CA HIS A 96 -16.577 -2.482 4.646 1.00 13.26 C ATOM 1172 C HIS A 96 -17.465 -3.315 3.711 1.00 12.78 C ATOM 1173 O HIS A 96 -17.000 -3.776 2.667 1.00 12.90 O ATOM 1174 CB HIS A 96 -16.114 -3.325 5.812 1.00 13.12 C ATOM 1175 CG HIS A 96 -15.038 -2.663 6.612 1.00 15.10 C ATOM 1176 ND1 HIS A 96 -14.386 -3.301 7.651 1.00 18.21 N ATOM 1177 CD2 HIS A 96 -14.491 -1.425 6.516 1.00 17.15 C ATOM 1178 CE1 HIS A 96 -13.500 -2.465 8.175 1.00 19.58 C ATOM 1179 NE2 HIS A 96 -13.527 -1.334 7.490 1.00 17.25 N ATOM 1180 HA HIS A 96 -15.720 -2.145 4.063 1.00 0.00 H ATOM 1181 HB2 HIS A 96 -16.966 -3.516 6.464 1.00 0.00 H ATOM 1182 HB3 HIS A 96 -15.732 -4.271 5.429 1.00 0.00 H ATOM 1183 HD2 HIS A 96 -14.765 -0.649 5.801 1.00 0.00 H ATOM 1184 HE1 HIS A 96 -12.856 -2.675 9.029 1.00 0.00 H ATOM 1185 H HIS A 96 -17.516 -1.227 6.175 1.00 0.00 H ATOM 1186 N ARG A 97 -18.748 -3.455 4.030 1.00 13.68 N ATOM 1187 CA ARG A 97 -19.638 -4.192 3.125 1.00 14.27 C ATOM 1188 C ARG A 97 -19.664 -3.535 1.755 1.00 14.44 C ATOM 1189 O ARG A 97 -19.546 -4.185 0.718 1.00 14.61 O ATOM 1190 CB ARG A 97 -21.062 -4.273 3.685 1.00 14.55 C ATOM 1191 CG ARG A 97 -21.994 -4.962 2.692 1.00 15.19 C ATOM 1192 CD ARG A 97 -23.312 -5.368 3.279 1.00 18.84 C ATOM 1193 NE ARG A 97 -24.119 -6.063 2.244 1.00 20.21 N ATOM 1194 CZ ARG A 97 -25.307 -6.656 2.451 1.00 21.41 C ATOM 1195 NH1 ARG A 97 -25.844 -6.697 3.674 1.00 22.91 N ATOM 1196 NH2 ARG A 97 -25.962 -7.224 1.433 1.00 19.71 N ATOM 1197 HA ARG A 97 -19.247 -5.205 3.032 1.00 0.00 H ATOM 1198 HB2 ARG A 97 -21.049 -4.839 4.616 1.00 0.00 H ATOM 1199 HB3 ARG A 97 -21.428 -3.265 3.880 1.00 0.00 H ATOM 1200 HG2 ARG A 97 -22.182 -4.277 1.865 1.00 0.00 H ATOM 1201 HG3 ARG A 97 -21.496 -5.855 2.316 1.00 0.00 H ATOM 1202 HD2 ARG A 97 -23.846 -4.482 3.623 1.00 0.00 H ATOM 1203 HD3 ARG A 97 -23.144 -6.039 4.121 1.00 0.00 H ATOM 1204 HE ARG A 97 -23.733 -6.093 1.279 1.00 0.00 H ATOM 1205 HH12 ARG A 97 -26.764 -7.159 3.823 1.00 0.00 H ATOM 1206 HH11 ARG A 97 -25.342 -6.267 4.477 1.00 0.00 H ATOM 1207 HH22 ARG A 97 -26.881 -7.682 1.597 1.00 0.00 H ATOM 1208 HH21 ARG A 97 -25.552 -7.208 0.477 1.00 0.00 H ATOM 1209 H ARG A 97 -19.117 -3.046 4.912 1.00 0.00 H ATOM 1210 N LYS A 98 -19.817 -2.213 1.734 1.00 14.83 N ATOM 1211 CA LYS A 98 -19.847 -1.499 0.451 1.00 15.93 C ATOM 1212 C LYS A 98 -18.565 -1.673 -0.392 1.00 15.43 C ATOM 1213 O LYS A 98 -18.598 -1.887 -1.631 1.00 14.87 O ATOM 1214 CB LYS A 98 -20.152 -0.005 0.716 1.00 16.71 C ATOM 1215 CG LYS A 98 -20.339 0.864 -0.533 1.00 21.96 C ATOM 1216 CD LYS A 98 -20.738 2.326 -0.172 1.00 24.56 C ATOM 1217 CE LYS A 98 -22.149 2.393 0.448 1.00 27.13 C ATOM 1218 NZ LYS A 98 -22.568 3.806 0.779 1.00 25.62 N ATOM 1219 HA LYS A 98 -20.638 -1.943 -0.153 1.00 0.00 H ATOM 1220 HB2 LYS A 98 -21.068 0.051 1.304 1.00 0.00 H ATOM 1221 HB3 LYS A 98 -19.325 0.409 1.293 1.00 0.00 H ATOM 1222 HG2 LYS A 98 -19.404 0.882 -1.093 1.00 0.00 H ATOM 1223 HG3 LYS A 98 -21.123 0.427 -1.152 1.00 0.00 H ATOM 1224 HD2 LYS A 98 -20.018 2.723 0.543 1.00 0.00 H ATOM 1225 HD3 LYS A 98 -20.720 2.932 -1.078 1.00 0.00 H ATOM 1226 HE2 LYS A 98 -22.157 1.802 1.364 1.00 0.00 H ATOM 1227 HE3 LYS A 98 -22.863 1.973 -0.261 1.00 0.00 H ATOM 1228 HZ1 LYS A 98 -21.898 4.214 1.461 1.00 0.00 H ATOM 1229 HZ2 LYS A 98 -22.572 4.378 -0.090 1.00 0.00 H ATOM 1230 HZ3 LYS A 98 -23.522 3.795 1.192 1.00 0.00 H ATOM 1231 H LYS A 98 -19.915 -1.686 2.625 1.00 0.00 H ATOM 1232 N ILE A 99 -17.417 -1.569 0.276 1.00 14.69 N ATOM 1233 CA ILE A 99 -16.141 -1.691 -0.405 1.00 14.17 C ATOM 1234 C ILE A 99 -15.917 -3.118 -0.924 1.00 14.15 C ATOM 1235 O ILE A 99 -15.541 -3.315 -2.073 1.00 14.06 O ATOM 1236 CB ILE A 99 -15.011 -1.202 0.529 1.00 14.54 C ATOM 1237 CG1 ILE A 99 -15.235 0.293 0.815 1.00 12.58 C ATOM 1238 CG2 ILE A 99 -13.634 -1.508 -0.056 1.00 15.51 C ATOM 1239 CD1 ILE A 99 -14.414 0.859 2.049 1.00 13.48 C ATOM 1240 HA ILE A 99 -16.139 -1.054 -1.290 1.00 0.00 H ATOM 1241 HB ILE A 99 -15.040 -1.740 1.477 1.00 0.00 H ATOM 1242 HG12 ILE A 99 -14.947 0.856 -0.073 1.00 0.00 H ATOM 1243 HG13 ILE A 99 -16.296 0.447 1.013 1.00 0.00 H ATOM 1244 HD11 ILE A 99 -14.698 0.318 2.952 1.00 0.00 H ATOM 1245 HD12 ILE A 99 -13.348 0.728 1.865 1.00 0.00 H ATOM 1246 HD13 ILE A 99 -14.635 1.919 2.175 1.00 0.00 H ATOM 1247 HG21 ILE A 99 -13.530 -2.584 -0.192 1.00 0.00 H ATOM 1248 HG22 ILE A 99 -13.530 -1.007 -1.018 1.00 0.00 H ATOM 1249 HG23 ILE A 99 -12.863 -1.151 0.627 1.00 0.00 H ATOM 1250 H ILE A 99 -17.435 -1.398 1.302 1.00 0.00 H ATOM 1251 N TYR A 100 -16.148 -4.122 -0.068 1.00 13.95 N ATOM 1252 CA TYR A 100 -16.013 -5.491 -0.525 1.00 13.52 C ATOM 1253 C TYR A 100 -16.965 -5.765 -1.682 1.00 13.66 C ATOM 1254 O TYR A 100 -16.591 -6.440 -2.652 1.00 13.06 O ATOM 1255 CB TYR A 100 -16.304 -6.510 0.603 1.00 13.73 C ATOM 1256 CG TYR A 100 -15.068 -6.928 1.366 1.00 15.70 C ATOM 1257 CD1 TYR A 100 -14.430 -6.048 2.210 1.00 14.61 C ATOM 1258 CD2 TYR A 100 -14.596 -8.243 1.291 1.00 17.41 C ATOM 1259 CE1 TYR A 100 -13.275 -6.440 2.932 1.00 17.01 C ATOM 1260 CE2 TYR A 100 -13.458 -8.650 1.991 1.00 17.42 C ATOM 1261 CZ TYR A 100 -12.798 -7.731 2.796 1.00 18.43 C ATOM 1262 OH TYR A 100 -11.676 -8.110 3.475 1.00 18.50 O ATOM 1263 HA TYR A 100 -14.979 -5.612 -0.849 1.00 0.00 H ATOM 1264 HB3 TYR A 100 -16.754 -7.398 0.159 1.00 0.00 H ATOM 1265 HB2 TYR A 100 -17.007 -6.059 1.303 1.00 0.00 H ATOM 1266 HD2 TYR A 100 -15.128 -8.966 0.673 1.00 0.00 H ATOM 1267 HE2 TYR A 100 -13.093 -9.674 1.907 1.00 0.00 H ATOM 1268 HE1 TYR A 100 -12.768 -5.732 3.587 1.00 0.00 H ATOM 1269 HD1 TYR A 100 -14.818 -5.036 2.325 1.00 0.00 H ATOM 1270 HH TYR A 100 -11.332 -7.342 3.997 1.00 0.00 H ATOM 1271 H TYR A 100 -16.422 -3.921 0.915 1.00 0.00 H ATOM 1272 N THR A 101 -18.200 -5.273 -1.589 1.00 13.02 N ATOM 1273 CA THR A 101 -19.170 -5.520 -2.653 1.00 13.74 C ATOM 1274 C THR A 101 -18.738 -4.891 -3.978 1.00 13.40 C ATOM 1275 O THR A 101 -18.844 -5.527 -5.029 1.00 13.39 O ATOM 1276 CB THR A 101 -20.545 -4.964 -2.241 1.00 12.83 C ATOM 1277 OG1 THR A 101 -20.996 -5.640 -1.064 1.00 15.98 O ATOM 1278 CG2 THR A 101 -21.547 -5.216 -3.381 1.00 15.16 C ATOM 1279 HA THR A 101 -19.231 -6.598 -2.801 1.00 0.00 H ATOM 1280 HB THR A 101 -20.466 -3.895 -2.042 1.00 0.00 H ATOM 1281 HG1 THR A 101 -20.346 -5.494 -0.332 1.00 0.00 H ATOM 1282 HG23 THR A 101 -21.208 -4.703 -4.281 1.00 0.00 H ATOM 1283 HG21 THR A 101 -21.613 -6.287 -3.575 1.00 0.00 H ATOM 1284 HG22 THR A 101 -22.527 -4.836 -3.092 1.00 0.00 H ATOM 1285 H THR A 101 -18.474 -4.712 -0.757 1.00 0.00 H ATOM 1286 N MET A 102 -18.264 -3.637 -3.950 1.00 15.41 N ATOM 1287 CA MET A 102 -17.631 -3.005 -5.146 1.00 15.87 C ATOM 1288 C MET A 102 -16.582 -3.875 -5.796 1.00 16.33 C ATOM 1289 O MET A 102 -16.543 -4.070 -7.032 1.00 16.87 O ATOM 1290 CB MET A 102 -16.908 -1.707 -4.766 1.00 15.31 C ATOM 1291 CG MET A 102 -16.132 -1.060 -5.956 1.00 15.11 C ATOM 1292 SD MET A 102 -14.491 -1.655 -6.464 1.00 14.25 S ATOM 1293 CE MET A 102 -13.559 -0.791 -5.189 1.00 18.87 C ATOM 1294 HA MET A 102 -18.458 -2.834 -5.835 1.00 0.00 H ATOM 1295 HB2 MET A 102 -17.647 -0.992 -4.405 1.00 0.00 H ATOM 1296 HB3 MET A 102 -16.198 -1.927 -3.969 1.00 0.00 H ATOM 1297 HG2 MET A 102 -16.012 -0.006 -5.707 1.00 0.00 H ATOM 1298 HG3 MET A 102 -16.777 -1.155 -6.830 1.00 0.00 H ATOM 1299 HE1 MET A 102 -13.721 0.282 -5.287 1.00 0.00 H ATOM 1300 HE2 MET A 102 -13.896 -1.122 -4.207 1.00 0.00 H ATOM 1301 HE3 MET A 102 -12.498 -1.012 -5.304 1.00 0.00 H ATOM 1302 H MET A 102 -18.339 -3.088 -3.070 1.00 0.00 H ATOM 1303 N ILE A 103 -15.673 -4.395 -4.970 1.00 15.88 N ATOM 1304 CA ILE A 103 -14.616 -5.225 -5.499 1.00 16.85 C ATOM 1305 C ILE A 103 -15.201 -6.447 -6.164 1.00 15.45 C ATOM 1306 O ILE A 103 -14.881 -6.755 -7.293 1.00 15.90 O ATOM 1307 CB ILE A 103 -13.557 -5.558 -4.417 1.00 17.86 C ATOM 1308 CG1 ILE A 103 -13.024 -4.216 -3.884 1.00 19.56 C ATOM 1309 CG2 ILE A 103 -12.525 -6.504 -4.988 1.00 18.99 C ATOM 1310 CD1 ILE A 103 -12.009 -4.307 -2.657 1.00 23.33 C ATOM 1311 HA ILE A 103 -14.078 -4.670 -6.268 1.00 0.00 H ATOM 1312 HB ILE A 103 -13.962 -6.099 -3.562 1.00 0.00 H ATOM 1313 HG12 ILE A 103 -12.513 -3.710 -4.703 1.00 0.00 H ATOM 1314 HG13 ILE A 103 -13.879 -3.619 -3.567 1.00 0.00 H ATOM 1315 HD11 ILE A 103 -12.501 -4.795 -1.815 1.00 0.00 H ATOM 1316 HD12 ILE A 103 -11.134 -4.886 -2.953 1.00 0.00 H ATOM 1317 HD13 ILE A 103 -11.701 -3.303 -2.367 1.00 0.00 H ATOM 1318 HG21 ILE A 103 -13.015 -7.423 -5.310 1.00 0.00 H ATOM 1319 HG22 ILE A 103 -12.036 -6.034 -5.841 1.00 0.00 H ATOM 1320 HG23 ILE A 103 -11.783 -6.735 -4.224 1.00 0.00 H ATOM 1321 H ILE A 103 -15.725 -4.204 -3.949 1.00 0.00 H ATOM 1322 N TYR A 104 -16.077 -7.178 -5.481 1.00 14.70 N ATOM 1323 CA TYR A 104 -16.633 -8.383 -6.091 1.00 14.72 C ATOM 1324 C TYR A 104 -17.386 -8.109 -7.405 1.00 13.73 C ATOM 1325 O TYR A 104 -17.361 -8.920 -8.316 1.00 13.54 O ATOM 1326 CB TYR A 104 -17.589 -9.119 -5.126 1.00 14.70 C ATOM 1327 CG TYR A 104 -16.959 -10.074 -4.130 1.00 14.65 C ATOM 1328 CD1 TYR A 104 -16.410 -9.590 -2.940 1.00 16.55 C ATOM 1329 CD2 TYR A 104 -16.935 -11.426 -4.358 1.00 14.71 C ATOM 1330 CE1 TYR A 104 -15.845 -10.465 -2.006 1.00 16.87 C ATOM 1331 CE2 TYR A 104 -16.382 -12.297 -3.436 1.00 13.48 C ATOM 1332 CZ TYR A 104 -15.844 -11.798 -2.256 1.00 12.96 C ATOM 1333 OH TYR A 104 -15.278 -12.639 -1.308 1.00 13.26 O ATOM 1334 HA TYR A 104 -15.769 -9.009 -6.315 1.00 0.00 H ATOM 1335 HB3 TYR A 104 -18.292 -9.691 -5.731 1.00 0.00 H ATOM 1336 HB2 TYR A 104 -18.132 -8.362 -4.559 1.00 0.00 H ATOM 1337 HD2 TYR A 104 -17.359 -11.821 -5.281 1.00 0.00 H ATOM 1338 HE2 TYR A 104 -16.368 -13.369 -3.634 1.00 0.00 H ATOM 1339 HE1 TYR A 104 -15.409 -10.079 -1.085 1.00 0.00 H ATOM 1340 HD1 TYR A 104 -16.422 -8.519 -2.737 1.00 0.00 H ATOM 1341 HH TYR A 104 -14.520 -13.129 -1.714 1.00 0.00 H ATOM 1342 H TYR A 104 -16.363 -6.895 -4.522 1.00 0.00 H ATOM 1343 N ARG A 105 -18.082 -6.971 -7.471 1.00 13.25 N ATOM 1344 CA ARG A 105 -18.819 -6.627 -8.681 1.00 13.61 C ATOM 1345 C ARG A 105 -17.842 -6.463 -9.846 1.00 14.39 C ATOM 1346 O ARG A 105 -18.219 -6.600 -11.010 1.00 14.63 O ATOM 1347 CB ARG A 105 -19.524 -5.317 -8.469 1.00 13.44 C ATOM 1348 CG ARG A 105 -20.792 -5.420 -7.643 1.00 14.13 C ATOM 1349 CD ARG A 105 -21.459 -4.045 -7.561 1.00 16.97 C ATOM 1350 NE ARG A 105 -22.602 -4.002 -6.672 1.00 14.65 N ATOM 1351 CZ ARG A 105 -23.136 -2.864 -6.245 1.00 19.82 C ATOM 1352 NH1 ARG A 105 -22.598 -1.691 -6.673 1.00 19.80 N ATOM 1353 NH2 ARG A 105 -24.180 -2.877 -5.425 1.00 17.96 N ATOM 1354 HA ARG A 105 -19.537 -7.417 -8.903 1.00 0.00 H ATOM 1355 HB2 ARG A 105 -18.839 -4.638 -7.961 1.00 0.00 H ATOM 1356 HB3 ARG A 105 -19.784 -4.906 -9.445 1.00 0.00 H ATOM 1357 HG2 ARG A 105 -21.475 -6.128 -8.112 1.00 0.00 H ATOM 1358 HG3 ARG A 105 -20.545 -5.765 -6.639 1.00 0.00 H ATOM 1359 HD2 ARG A 105 -21.790 -3.763 -8.561 1.00 0.00 H ATOM 1360 HD3 ARG A 105 -20.721 -3.325 -7.207 1.00 0.00 H ATOM 1361 HE ARG A 105 -23.021 -4.899 -6.355 1.00 0.00 H ATOM 1362 HH12 ARG A 105 -23.000 -0.787 -6.352 1.00 0.00 H ATOM 1363 HH11 ARG A 105 -21.785 -1.698 -7.321 1.00 0.00 H ATOM 1364 HH22 ARG A 105 -24.593 -1.981 -5.095 1.00 0.00 H ATOM 1365 HH21 ARG A 105 -24.585 -3.783 -5.113 1.00 0.00 H ATOM 1366 H ARG A 105 -18.098 -6.327 -6.655 1.00 0.00 H ATOM 1367 N ASN A 106 -16.585 -6.199 -9.496 1.00 13.80 N ATOM 1368 CA ASN A 106 -15.554 -5.933 -10.498 1.00 14.06 C ATOM 1369 C ASN A 106 -14.553 -7.079 -10.621 1.00 14.66 C ATOM 1370 O ASN A 106 -13.425 -6.865 -11.049 1.00 15.14 O ATOM 1371 CB ASN A 106 -14.869 -4.613 -10.174 1.00 13.74 C ATOM 1372 CG ASN A 106 -15.756 -3.406 -10.525 1.00 14.48 C ATOM 1373 OD1 ASN A 106 -15.947 -3.070 -11.713 1.00 15.86 O ATOM 1374 ND2 ASN A 106 -16.369 -2.805 -9.495 1.00 15.02 N ATOM 1375 HA ASN A 106 -16.032 -5.855 -11.474 1.00 0.00 H ATOM 1376 HB2 ASN A 106 -14.642 -4.586 -9.108 1.00 0.00 H ATOM 1377 HB3 ASN A 106 -13.942 -4.547 -10.744 1.00 0.00 H ATOM 1378 HD22 ASN A 106 -16.179 -3.119 -8.522 1.00 0.00 H ATOM 1379 HD21 ASN A 106 -17.035 -2.025 -9.669 1.00 0.00 H ATOM 1380 H ASN A 106 -16.331 -6.182 -8.488 1.00 0.00 H ATOM 1381 N LEU A 107 -14.959 -8.291 -10.228 1.00 13.91 N ATOM 1382 CA LEU A 107 -14.133 -9.522 -10.410 1.00 14.41 C ATOM 1383 C LEU A 107 -14.782 -10.480 -11.373 1.00 16.39 C ATOM 1384 O LEU A 107 -16.019 -10.545 -11.437 1.00 17.05 O ATOM 1385 CB LEU A 107 -13.907 -10.271 -9.092 1.00 14.99 C ATOM 1386 CG LEU A 107 -13.242 -9.549 -7.949 1.00 16.39 C ATOM 1387 CD1 LEU A 107 -13.250 -10.523 -6.761 1.00 18.81 C ATOM 1388 CD2 LEU A 107 -11.811 -9.158 -8.347 1.00 17.33 C ATOM 1389 HA LEU A 107 -13.176 -9.178 -10.801 1.00 0.00 H ATOM 1390 HB2 LEU A 107 -14.885 -10.599 -8.738 1.00 0.00 H ATOM 1391 HB3 LEU A 107 -13.294 -11.143 -9.320 1.00 0.00 H ATOM 1392 HG LEU A 107 -13.762 -8.628 -7.687 1.00 0.00 H ATOM 1393 HD21 LEU A 107 -11.243 -10.057 -8.587 1.00 0.00 H ATOM 1394 HD22 LEU A 107 -11.843 -8.504 -9.219 1.00 0.00 H ATOM 1395 HD23 LEU A 107 -11.334 -8.636 -7.517 1.00 0.00 H ATOM 1396 HD11 LEU A 107 -14.279 -10.784 -6.514 1.00 0.00 H ATOM 1397 HD12 LEU A 107 -12.699 -11.425 -7.028 1.00 0.00 H ATOM 1398 HD13 LEU A 107 -12.778 -10.049 -5.901 1.00 0.00 H ATOM 1399 H LEU A 107 -15.891 -8.380 -9.776 1.00 0.00 H ATOM 1400 N VAL A 108 -13.963 -11.230 -12.113 1.00 16.68 N ATOM 1401 CA VAL A 108 -14.436 -12.356 -12.930 1.00 18.98 C ATOM 1402 C VAL A 108 -14.465 -13.585 -12.050 1.00 20.62 C ATOM 1403 O VAL A 108 -13.436 -14.240 -11.832 1.00 20.95 O ATOM 1404 CB VAL A 108 -13.524 -12.662 -14.110 1.00 18.60 C ATOM 1405 CG1 VAL A 108 -14.091 -13.860 -14.892 1.00 19.05 C ATOM 1406 CG2 VAL A 108 -13.324 -11.426 -15.009 1.00 17.35 C ATOM 1407 HA VAL A 108 -15.416 -12.087 -13.324 1.00 0.00 H ATOM 1408 HB VAL A 108 -12.535 -12.927 -13.737 1.00 0.00 H ATOM 1409 HG11 VAL A 108 -14.144 -14.729 -14.236 1.00 0.00 H ATOM 1410 HG12 VAL A 108 -15.089 -13.616 -15.255 1.00 0.00 H ATOM 1411 HG13 VAL A 108 -13.440 -14.081 -15.738 1.00 0.00 H ATOM 1412 HG21 VAL A 108 -14.289 -11.099 -15.396 1.00 0.00 H ATOM 1413 HG22 VAL A 108 -12.874 -10.623 -14.425 1.00 0.00 H ATOM 1414 HG23 VAL A 108 -12.667 -11.685 -15.840 1.00 0.00 H ATOM 1415 H VAL A 108 -12.947 -11.008 -12.111 1.00 0.00 H ATOM 1416 N VAL A 109 -15.645 -13.914 -11.552 1.00 22.99 N ATOM 1417 CA VAL A 109 -15.768 -15.032 -10.620 1.00 25.24 C ATOM 1418 C VAL A 109 -16.193 -16.335 -11.266 1.00 26.73 C ATOM 1419 O VAL A 109 -17.119 -16.415 -12.112 1.00 26.49 O ATOM 1420 CB VAL A 109 -16.695 -14.711 -9.422 1.00 26.00 C ATOM 1421 CG1 VAL A 109 -16.650 -15.857 -8.412 1.00 27.25 C ATOM 1422 CG2 VAL A 109 -16.268 -13.398 -8.769 1.00 23.92 C ATOM 1423 HA VAL A 109 -14.753 -15.176 -10.249 1.00 0.00 H ATOM 1424 OXT VAL A 109 -15.563 -17.359 -10.920 1.00 28.60 O ATOM 1425 HB VAL A 109 -17.720 -14.601 -9.777 1.00 0.00 H ATOM 1426 HG11 VAL A 109 -16.985 -16.776 -8.892 1.00 0.00 H ATOM 1427 HG12 VAL A 109 -15.628 -15.984 -8.054 1.00 0.00 H ATOM 1428 HG13 VAL A 109 -17.304 -15.625 -7.572 1.00 0.00 H ATOM 1429 HG21 VAL A 109 -15.241 -13.487 -8.415 1.00 0.00 H ATOM 1430 HG22 VAL A 109 -16.333 -12.592 -9.500 1.00 0.00 H ATOM 1431 HG23 VAL A 109 -16.926 -13.181 -7.928 1.00 0.00 H ATOM 1432 H VAL A 109 -16.490 -13.374 -11.826 1.00 0.00 H TER 1433 VAL A 109 ATOM 1434 N THR B 26 6.984 -17.658 2.160 1.00 25.59 N ATOM 1435 CA THR B 26 7.809 -17.664 3.423 1.00 25.43 C ATOM 1436 C THR B 26 7.374 -16.504 4.327 1.00 24.04 C ATOM 1437 O THR B 26 7.364 -15.328 3.904 1.00 23.94 O ATOM 1438 CB THR B 26 9.350 -17.493 3.159 1.00 25.62 C ATOM 1439 OG1 THR B 26 9.832 -18.527 2.293 1.00 29.21 O ATOM 1440 CG2 THR B 26 10.120 -17.584 4.449 1.00 26.40 C ATOM 1441 HA THR B 26 7.642 -18.636 3.888 1.00 0.00 H ATOM 1442 HB THR B 26 9.494 -16.516 2.698 1.00 0.00 H ATOM 1443 HG1 THR B 26 10.802 -18.402 2.139 1.00 0.00 H ATOM 1444 HG23 THR B 26 9.775 -16.807 5.132 1.00 0.00 H ATOM 1445 HG21 THR B 26 9.958 -18.563 4.899 1.00 0.00 H ATOM 1446 HG22 THR B 26 11.182 -17.447 4.247 1.00 0.00 H ATOM 1447 HN3 THR B 26 7.125 -16.757 1.660 1.00 0.00 H ATOM 1448 HN2 THR B 26 5.979 -17.767 2.403 1.00 0.00 H ATOM 1449 HN1 THR B 26 7.281 -18.446 1.549 1.00 0.00 H ATOM 1450 N LEU B 27 7.001 -16.828 5.565 1.00 22.21 N ATOM 1451 CA LEU B 27 6.727 -15.773 6.533 1.00 21.06 C ATOM 1452 C LEU B 27 8.029 -15.256 7.114 1.00 20.12 C ATOM 1453 O LEU B 27 8.963 -16.027 7.356 1.00 20.95 O ATOM 1454 CB LEU B 27 5.823 -16.269 7.652 1.00 20.90 C ATOM 1455 CG LEU B 27 4.411 -16.607 7.208 1.00 22.01 C ATOM 1456 CD1 LEU B 27 3.684 -17.300 8.333 1.00 24.09 C ATOM 1457 CD2 LEU B 27 3.654 -15.343 6.768 1.00 23.96 C ATOM 1458 HA LEU B 27 6.211 -14.965 6.015 1.00 0.00 H ATOM 1459 HB2 LEU B 27 6.270 -17.165 8.081 1.00 0.00 H ATOM 1460 HB3 LEU B 27 5.765 -15.492 8.415 1.00 0.00 H ATOM 1461 HG LEU B 27 4.462 -17.276 6.349 1.00 0.00 H ATOM 1462 HD21 LEU B 27 3.601 -14.644 7.603 1.00 0.00 H ATOM 1463 HD22 LEU B 27 4.181 -14.877 5.935 1.00 0.00 H ATOM 1464 HD23 LEU B 27 2.646 -15.615 6.455 1.00 0.00 H ATOM 1465 HD11 LEU B 27 4.213 -18.216 8.596 1.00 0.00 H ATOM 1466 HD12 LEU B 27 3.645 -16.640 9.200 1.00 0.00 H ATOM 1467 HD13 LEU B 27 2.670 -17.543 8.014 1.00 0.00 H ATOM 1468 H LEU B 27 6.906 -17.827 5.839 1.00 0.00 H ATOM 1469 N VAL B 28 8.074 -13.953 7.353 1.00 17.81 N ATOM 1470 CA VAL B 28 9.233 -13.329 7.997 1.00 16.78 C ATOM 1471 C VAL B 28 8.769 -12.647 9.287 1.00 14.80 C ATOM 1472 O VAL B 28 7.575 -12.397 9.471 1.00 13.94 O ATOM 1473 CB VAL B 28 9.929 -12.321 7.071 1.00 17.18 C ATOM 1474 CG1 VAL B 28 10.366 -13.033 5.759 1.00 18.08 C ATOM 1475 CG2 VAL B 28 9.008 -11.109 6.764 1.00 17.89 C ATOM 1476 HA VAL B 28 9.966 -14.103 8.226 1.00 0.00 H ATOM 1477 HB VAL B 28 10.814 -11.935 7.578 1.00 0.00 H ATOM 1478 HG11 VAL B 28 11.056 -13.842 5.999 1.00 0.00 H ATOM 1479 HG12 VAL B 28 9.488 -13.440 5.258 1.00 0.00 H ATOM 1480 HG13 VAL B 28 10.860 -12.315 5.104 1.00 0.00 H ATOM 1481 HG21 VAL B 28 8.099 -11.460 6.276 1.00 0.00 H ATOM 1482 HG22 VAL B 28 8.750 -10.605 7.695 1.00 0.00 H ATOM 1483 HG23 VAL B 28 9.531 -10.415 6.106 1.00 0.00 H ATOM 1484 H VAL B 28 7.267 -13.359 7.077 1.00 0.00 H ATOM 1485 N ARG B 29 9.706 -12.382 10.181 1.00 13.99 N ATOM 1486 CA ARG B 29 9.347 -11.919 11.535 1.00 13.34 C ATOM 1487 C ARG B 29 10.132 -10.652 11.837 1.00 13.11 C ATOM 1488 O ARG B 29 11.315 -10.720 12.217 1.00 14.43 O ATOM 1489 CB ARG B 29 9.695 -13.008 12.534 1.00 13.44 C ATOM 1490 CG ARG B 29 9.331 -12.641 13.973 1.00 13.47 C ATOM 1491 CD ARG B 29 9.679 -13.786 14.944 1.00 13.93 C ATOM 1492 NE ARG B 29 8.817 -14.950 14.716 1.00 14.68 N ATOM 1493 CZ ARG B 29 7.600 -15.092 15.228 1.00 15.80 C ATOM 1494 NH1 ARG B 29 7.079 -14.153 16.019 1.00 14.64 N ATOM 1495 NH2 ARG B 29 6.890 -16.181 14.923 1.00 15.81 N ATOM 1496 HA ARG B 29 8.280 -11.705 11.601 1.00 0.00 H ATOM 1497 HB2 ARG B 29 9.156 -13.915 12.260 1.00 0.00 H ATOM 1498 HB3 ARG B 29 10.768 -13.195 12.484 1.00 0.00 H ATOM 1499 HG2 ARG B 29 9.884 -11.748 14.263 1.00 0.00 H ATOM 1500 HG3 ARG B 29 8.261 -12.439 14.029 1.00 0.00 H ATOM 1501 HD2 ARG B 29 9.545 -13.438 15.968 1.00 0.00 H ATOM 1502 HD3 ARG B 29 10.719 -14.077 14.794 1.00 0.00 H ATOM 1503 HE ARG B 29 9.183 -15.715 14.114 1.00 0.00 H ATOM 1504 HH12 ARG B 29 6.125 -14.276 16.414 1.00 0.00 H ATOM 1505 HH11 ARG B 29 7.627 -13.297 16.241 1.00 0.00 H ATOM 1506 HH22 ARG B 29 5.935 -16.306 15.316 1.00 0.00 H ATOM 1507 HH21 ARG B 29 7.292 -16.904 14.292 1.00 0.00 H ATOM 1508 H ARG B 29 10.707 -12.501 9.927 1.00 0.00 H ATOM 1509 N PRO B 30 9.493 -9.477 11.683 1.00 13.33 N ATOM 1510 CA PRO B 30 10.228 -8.223 11.911 1.00 12.93 C ATOM 1511 C PRO B 30 10.799 -8.096 13.322 1.00 12.71 C ATOM 1512 O PRO B 30 10.178 -8.545 14.295 1.00 13.16 O ATOM 1513 CB PRO B 30 9.174 -7.128 11.651 1.00 13.27 C ATOM 1514 CG PRO B 30 8.242 -7.802 10.645 1.00 13.03 C ATOM 1515 CD PRO B 30 8.146 -9.241 11.124 1.00 12.58 C ATOM 1516 HA PRO B 30 11.102 -8.159 11.263 1.00 0.00 H ATOM 1517 HD3 PRO B 30 7.376 -9.353 11.888 1.00 0.00 H ATOM 1518 HD2 PRO B 30 7.937 -9.920 10.297 1.00 0.00 H ATOM 1519 HG3 PRO B 30 8.661 -7.757 9.640 1.00 0.00 H ATOM 1520 HG2 PRO B 30 7.261 -7.327 10.650 1.00 0.00 H ATOM 1521 HB2 PRO B 30 8.643 -6.866 12.566 1.00 0.00 H ATOM 1522 HB3 PRO B 30 9.631 -6.233 11.228 1.00 0.00 H ATOM 1523 N LYS B 31 12.000 -7.529 13.424 1.00 11.85 N ATOM 1524 CA LYS B 31 12.540 -7.118 14.703 1.00 13.05 C ATOM 1525 C LYS B 31 11.713 -5.924 15.248 1.00 13.25 C ATOM 1526 O LYS B 31 10.837 -5.404 14.557 1.00 12.83 O ATOM 1527 CB LYS B 31 14.023 -6.753 14.557 1.00 12.35 C ATOM 1528 CG LYS B 31 14.870 -8.022 14.333 1.00 15.27 C ATOM 1529 CD LYS B 31 16.308 -7.699 13.955 1.00 17.60 C ATOM 1530 CE LYS B 31 17.046 -9.043 13.914 1.00 21.42 C ATOM 1531 NZ LYS B 31 18.383 -8.953 13.247 1.00 26.97 N ATOM 1532 HA LYS B 31 12.471 -7.940 15.415 1.00 0.00 H ATOM 1533 HB2 LYS B 31 14.146 -6.084 13.706 1.00 0.00 H ATOM 1534 HB3 LYS B 31 14.361 -6.251 15.464 1.00 0.00 H ATOM 1535 HG2 LYS B 31 14.872 -8.609 15.252 1.00 0.00 H ATOM 1536 HG3 LYS B 31 14.420 -8.607 13.531 1.00 0.00 H ATOM 1537 HD2 LYS B 31 16.344 -7.217 12.978 1.00 0.00 H ATOM 1538 HD3 LYS B 31 16.757 -7.042 14.700 1.00 0.00 H ATOM 1539 HE2 LYS B 31 16.433 -9.760 13.369 1.00 0.00 H ATOM 1540 HE3 LYS B 31 17.190 -9.393 14.936 1.00 0.00 H ATOM 1541 HZ1 LYS B 31 18.259 -8.629 12.267 1.00 0.00 H ATOM 1542 HZ2 LYS B 31 18.982 -8.278 13.763 1.00 0.00 H ATOM 1543 HZ3 LYS B 31 18.834 -9.890 13.249 1.00 0.00 H ATOM 1544 H LYS B 31 12.564 -7.378 12.563 1.00 0.00 H ATOM 1545 N PRO B 32 11.957 -5.522 16.503 1.00 13.47 N ATOM 1546 CA PRO B 32 11.035 -4.579 17.141 1.00 13.57 C ATOM 1547 C PRO B 32 10.843 -3.215 16.475 1.00 14.13 C ATOM 1548 O PRO B 32 9.709 -2.743 16.388 1.00 12.92 O ATOM 1549 CB PRO B 32 11.636 -4.429 18.546 1.00 14.15 C ATOM 1550 CG PRO B 32 12.169 -5.822 18.801 1.00 13.56 C ATOM 1551 CD PRO B 32 12.857 -6.139 17.502 1.00 13.52 C ATOM 1552 HA PRO B 32 10.019 -4.971 17.091 1.00 0.00 H ATOM 1553 HD3 PRO B 32 13.852 -5.695 17.464 1.00 0.00 H ATOM 1554 HD2 PRO B 32 12.935 -7.216 17.350 1.00 0.00 H ATOM 1555 HG3 PRO B 32 11.360 -6.525 19.003 1.00 0.00 H ATOM 1556 HG2 PRO B 32 12.872 -5.831 19.634 1.00 0.00 H ATOM 1557 HB2 PRO B 32 12.436 -3.688 18.560 1.00 0.00 H ATOM 1558 HB3 PRO B 32 10.875 -4.154 19.277 1.00 0.00 H ATOM 1559 N LEU B 33 11.916 -2.567 16.035 1.00 13.55 N ATOM 1560 CA LEU B 33 11.757 -1.259 15.417 1.00 14.25 C ATOM 1561 C LEU B 33 10.956 -1.369 14.108 1.00 13.08 C ATOM 1562 O LEU B 33 10.035 -0.545 13.841 1.00 12.65 O ATOM 1563 CB LEU B 33 13.114 -0.584 15.193 1.00 14.91 C ATOM 1564 CG LEU B 33 12.999 0.911 14.913 1.00 17.31 C ATOM 1565 CD1 LEU B 33 12.293 1.648 16.046 1.00 18.81 C ATOM 1566 CD2 LEU B 33 14.387 1.499 14.722 1.00 20.53 C ATOM 1567 HA LEU B 33 11.191 -0.626 16.100 1.00 0.00 H ATOM 1568 HB2 LEU B 33 13.723 -0.724 16.086 1.00 0.00 H ATOM 1569 HB3 LEU B 33 13.603 -1.060 14.343 1.00 0.00 H ATOM 1570 HG LEU B 33 12.405 1.035 14.008 1.00 0.00 H ATOM 1571 HD21 LEU B 33 14.974 1.342 15.627 1.00 0.00 H ATOM 1572 HD22 LEU B 33 14.876 1.008 13.881 1.00 0.00 H ATOM 1573 HD23 LEU B 33 14.303 2.567 14.522 1.00 0.00 H ATOM 1574 HD11 LEU B 33 11.288 1.245 16.170 1.00 0.00 H ATOM 1575 HD12 LEU B 33 12.855 1.515 16.970 1.00 0.00 H ATOM 1576 HD13 LEU B 33 12.233 2.709 15.805 1.00 0.00 H ATOM 1577 H LEU B 33 12.861 -2.991 16.131 1.00 0.00 H ATOM 1578 N LEU B 34 11.250 -2.385 13.294 1.00 12.89 N ATOM 1579 CA LEU B 34 10.497 -2.544 12.067 1.00 12.67 C ATOM 1580 C LEU B 34 9.048 -2.899 12.408 1.00 12.48 C ATOM 1581 O LEU B 34 8.109 -2.441 11.732 1.00 12.06 O ATOM 1582 CB LEU B 34 11.120 -3.614 11.151 1.00 12.83 C ATOM 1583 CG LEU B 34 10.335 -3.958 9.866 1.00 13.33 C ATOM 1584 CD1 LEU B 34 10.155 -2.724 8.990 1.00 13.21 C ATOM 1585 CD2 LEU B 34 11.044 -5.092 9.106 1.00 13.82 C ATOM 1586 HA LEU B 34 10.523 -1.602 11.519 1.00 0.00 H ATOM 1587 HB2 LEU B 34 12.107 -3.262 10.853 1.00 0.00 H ATOM 1588 HB3 LEU B 34 11.223 -4.530 11.733 1.00 0.00 H ATOM 1589 HG LEU B 34 9.339 -4.303 10.143 1.00 0.00 H ATOM 1590 HD21 LEU B 34 12.051 -4.774 8.838 1.00 0.00 H ATOM 1591 HD22 LEU B 34 11.098 -5.976 9.742 1.00 0.00 H ATOM 1592 HD23 LEU B 34 10.483 -5.328 8.202 1.00 0.00 H ATOM 1593 HD11 LEU B 34 9.604 -1.964 9.544 1.00 0.00 H ATOM 1594 HD12 LEU B 34 11.133 -2.334 8.709 1.00 0.00 H ATOM 1595 HD13 LEU B 34 9.599 -2.995 8.092 1.00 0.00 H ATOM 1596 H LEU B 34 12.009 -3.053 13.537 1.00 0.00 H ATOM 1597 N LEU B 35 8.849 -3.698 13.461 1.00 12.60 N ATOM 1598 CA LEU B 35 7.493 -4.003 13.864 1.00 12.77 C ATOM 1599 C LEU B 35 6.745 -2.735 14.257 1.00 13.68 C ATOM 1600 O LEU B 35 5.572 -2.588 13.899 1.00 13.79 O ATOM 1601 CB LEU B 35 7.513 -5.099 14.973 1.00 14.88 C ATOM 1602 CG LEU B 35 6.162 -5.806 15.172 1.00 17.29 C ATOM 1603 CD1 LEU B 35 5.708 -6.479 13.880 1.00 18.73 C ATOM 1604 CD2 LEU B 35 6.232 -6.813 16.404 1.00 19.53 C ATOM 1605 HA LEU B 35 6.935 -4.417 13.024 1.00 0.00 H ATOM 1606 HB2 LEU B 35 8.257 -5.848 14.702 1.00 0.00 H ATOM 1607 HB3 LEU B 35 7.798 -4.630 15.915 1.00 0.00 H ATOM 1608 HG LEU B 35 5.404 -5.062 15.418 1.00 0.00 H ATOM 1609 HD21 LEU B 35 6.999 -7.564 16.215 1.00 0.00 H ATOM 1610 HD22 LEU B 35 6.478 -6.260 17.310 1.00 0.00 H ATOM 1611 HD23 LEU B 35 5.266 -7.302 16.527 1.00 0.00 H ATOM 1612 HD11 LEU B 35 5.600 -5.727 13.098 1.00 0.00 H ATOM 1613 HD12 LEU B 35 6.450 -7.217 13.576 1.00 0.00 H ATOM 1614 HD13 LEU B 35 4.750 -6.972 14.046 1.00 0.00 H ATOM 1615 H LEU B 35 9.657 -4.094 13.983 1.00 0.00 H ATOM 1616 N LYS B 36 7.408 -1.814 14.967 1.00 12.26 N ATOM 1617 CA LYS B 36 6.778 -0.537 15.374 1.00 12.87 C ATOM 1618 C LYS B 36 6.333 0.219 14.119 1.00 13.20 C ATOM 1619 O LYS B 36 5.239 0.785 14.083 1.00 13.86 O ATOM 1620 CB LYS B 36 7.733 0.326 16.212 1.00 13.15 C ATOM 1621 CG LYS B 36 7.180 1.727 16.548 1.00 16.46 C ATOM 1622 CD LYS B 36 8.025 2.515 17.591 1.00 23.78 C ATOM 1623 CE LYS B 36 7.391 3.934 17.833 1.00 25.13 C ATOM 1624 NZ LYS B 36 7.853 4.794 18.986 1.00 27.81 N ATOM 1625 HA LYS B 36 5.914 -0.758 16.001 1.00 0.00 H ATOM 1626 HB2 LYS B 36 7.936 -0.196 17.147 1.00 0.00 H ATOM 1627 HB3 LYS B 36 8.663 0.448 15.656 1.00 0.00 H ATOM 1628 HG2 LYS B 36 7.143 2.310 15.628 1.00 0.00 H ATOM 1629 HG3 LYS B 36 6.171 1.610 16.943 1.00 0.00 H ATOM 1630 HD2 LYS B 36 8.046 1.963 18.531 1.00 0.00 H ATOM 1631 HD3 LYS B 36 9.042 2.632 17.218 1.00 0.00 H ATOM 1632 HE2 LYS B 36 6.321 3.779 17.968 1.00 0.00 H ATOM 1633 HE3 LYS B 36 7.562 4.512 16.924 1.00 0.00 H ATOM 1634 HZ1 LYS B 36 7.684 4.292 19.881 1.00 0.00 H ATOM 1635 HZ2 LYS B 36 8.869 4.991 18.884 1.00 0.00 H ATOM 1636 HZ3 LYS B 36 7.323 5.689 18.984 1.00 0.00 H ATOM 1637 H LYS B 36 8.394 -2.001 15.241 1.00 0.00 H ATOM 1638 N LEU B 37 7.195 0.245 13.106 1.00 12.18 N ATOM 1639 CA LEU B 37 6.845 0.935 11.847 1.00 11.83 C ATOM 1640 C LEU B 37 5.572 0.303 11.226 1.00 12.57 C ATOM 1641 O LEU B 37 4.633 0.999 10.850 1.00 12.73 O ATOM 1642 CB LEU B 37 8.044 0.886 10.867 1.00 10.35 C ATOM 1643 CG LEU B 37 7.800 1.610 9.524 1.00 11.33 C ATOM 1644 CD1 LEU B 37 9.111 2.063 8.913 1.00 14.51 C ATOM 1645 CD2 LEU B 37 7.055 0.732 8.529 1.00 14.43 C ATOM 1646 HA LEU B 37 6.625 1.982 12.056 1.00 0.00 H ATOM 1647 HB2 LEU B 37 8.902 1.350 11.354 1.00 0.00 H ATOM 1648 HB3 LEU B 37 8.269 -0.159 10.655 1.00 0.00 H ATOM 1649 HG LEU B 37 7.179 2.479 9.743 1.00 0.00 H ATOM 1650 HD21 LEU B 37 7.639 -0.166 8.330 1.00 0.00 H ATOM 1651 HD22 LEU B 37 6.087 0.453 8.946 1.00 0.00 H ATOM 1652 HD23 LEU B 37 6.906 1.283 7.600 1.00 0.00 H ATOM 1653 HD11 LEU B 37 9.612 2.748 9.597 1.00 0.00 H ATOM 1654 HD12 LEU B 37 9.747 1.195 8.736 1.00 0.00 H ATOM 1655 HD13 LEU B 37 8.914 2.570 7.968 1.00 0.00 H ATOM 1656 H LEU B 37 8.119 -0.222 13.201 1.00 0.00 H ATOM 1657 N LEU B 38 5.540 -1.027 11.111 1.00 12.28 N ATOM 1658 CA LEU B 38 4.347 -1.687 10.552 1.00 13.31 C ATOM 1659 C LEU B 38 3.109 -1.418 11.394 1.00 13.57 C ATOM 1660 O LEU B 38 2.021 -1.117 10.841 1.00 13.37 O ATOM 1661 CB LEU B 38 4.615 -3.189 10.403 1.00 14.45 C ATOM 1662 CG LEU B 38 5.882 -3.504 9.600 1.00 15.77 C ATOM 1663 CD1 LEU B 38 6.210 -4.973 9.731 1.00 16.46 C ATOM 1664 CD2 LEU B 38 5.832 -3.088 8.112 1.00 17.01 C ATOM 1665 HA LEU B 38 4.146 -1.268 9.566 1.00 0.00 H ATOM 1666 HB2 LEU B 38 4.719 -3.622 11.398 1.00 0.00 H ATOM 1667 HB3 LEU B 38 3.763 -3.644 9.898 1.00 0.00 H ATOM 1668 HG LEU B 38 6.672 -2.891 10.033 1.00 0.00 H ATOM 1669 HD21 LEU B 38 5.011 -3.608 7.618 1.00 0.00 H ATOM 1670 HD22 LEU B 38 5.677 -2.011 8.042 1.00 0.00 H ATOM 1671 HD23 LEU B 38 6.773 -3.353 7.630 1.00 0.00 H ATOM 1672 HD11 LEU B 38 6.375 -5.215 10.781 1.00 0.00 H ATOM 1673 HD12 LEU B 38 5.379 -5.565 9.347 1.00 0.00 H ATOM 1674 HD13 LEU B 38 7.111 -5.195 9.159 1.00 0.00 H ATOM 1675 H LEU B 38 6.356 -1.596 11.415 1.00 0.00 H ATOM 1676 N LYS B 39 3.225 -1.481 12.716 1.00 13.75 N ATOM 1677 CA LYS B 39 2.053 -1.192 13.550 1.00 14.23 C ATOM 1678 C LYS B 39 1.540 0.236 13.363 1.00 13.92 C ATOM 1679 O LYS B 39 0.335 0.517 13.535 1.00 13.34 O ATOM 1680 CB LYS B 39 2.381 -1.468 15.023 1.00 14.84 C ATOM 1681 CG LYS B 39 2.466 -2.945 15.358 1.00 19.19 C ATOM 1682 CD LYS B 39 2.630 -3.093 16.891 1.00 25.24 C ATOM 1683 CE LYS B 39 2.836 -4.553 17.265 1.00 29.69 C ATOM 1684 NZ LYS B 39 2.034 -5.471 16.392 1.00 30.78 N ATOM 1685 HA LYS B 39 1.248 -1.854 13.230 1.00 0.00 H ATOM 1686 HB2 LYS B 39 3.340 -1.005 15.256 1.00 0.00 H ATOM 1687 HB3 LYS B 39 1.603 -1.018 15.640 1.00 0.00 H ATOM 1688 HG2 LYS B 39 1.555 -3.449 15.035 1.00 0.00 H ATOM 1689 HG3 LYS B 39 3.323 -3.388 14.852 1.00 0.00 H ATOM 1690 HD2 LYS B 39 3.493 -2.513 17.218 1.00 0.00 H ATOM 1691 HD3 LYS B 39 1.734 -2.718 17.386 1.00 0.00 H ATOM 1692 HE2 LYS B 39 2.533 -4.698 18.302 1.00 0.00 H ATOM 1693 HE3 LYS B 39 3.893 -4.799 17.159 1.00 0.00 H ATOM 1694 HZ1 LYS B 39 1.023 -5.248 16.492 1.00 0.00 H ATOM 1695 HZ2 LYS B 39 2.322 -5.344 15.401 1.00 0.00 H ATOM 1696 HZ3 LYS B 39 2.203 -6.456 16.680 1.00 0.00 H ATOM 1697 H LYS B 39 4.134 -1.732 13.154 1.00 0.00 H ATOM 1698 N SER B 40 2.439 1.155 13.000 1.00 12.16 N ATOM 1699 CA SER B 40 2.063 2.566 12.923 1.00 13.06 C ATOM 1700 C SER B 40 1.105 2.829 11.760 1.00 12.63 C ATOM 1701 O SER B 40 0.351 3.824 11.805 1.00 14.46 O ATOM 1702 CB SER B 40 3.303 3.459 12.863 1.00 13.91 C ATOM 1703 OG SER B 40 3.825 3.474 11.557 1.00 14.92 O ATOM 1704 HA SER B 40 1.524 2.821 13.835 1.00 0.00 H ATOM 1705 HB2 SER B 40 4.058 3.075 13.549 1.00 0.00 H ATOM 1706 HB3 SER B 40 3.032 4.474 13.155 1.00 0.00 H ATOM 1707 HG SER B 40 4.074 2.553 11.292 1.00 0.00 H ATOM 1708 H SER B 40 3.411 0.865 12.771 1.00 0.00 H ATOM 1709 N VAL B 41 1.099 1.943 10.749 1.00 12.48 N ATOM 1710 CA VAL B 41 0.098 2.046 9.674 1.00 12.71 C ATOM 1711 C VAL B 41 -1.070 1.063 9.843 1.00 12.59 C ATOM 1712 O VAL B 41 -1.924 0.956 8.970 1.00 12.68 O ATOM 1713 CB VAL B 41 0.714 1.903 8.261 1.00 12.68 C ATOM 1714 CG1 VAL B 41 1.612 3.120 7.935 1.00 14.54 C ATOM 1715 CG2 VAL B 41 1.479 0.563 8.139 1.00 15.01 C ATOM 1716 HA VAL B 41 -0.301 3.056 9.765 1.00 0.00 H ATOM 1717 HB VAL B 41 -0.088 1.887 7.523 1.00 0.00 H ATOM 1718 HG11 VAL B 41 1.014 4.031 7.971 1.00 0.00 H ATOM 1719 HG12 VAL B 41 2.417 3.183 8.668 1.00 0.00 H ATOM 1720 HG13 VAL B 41 2.036 3.001 6.938 1.00 0.00 H ATOM 1721 HG21 VAL B 41 2.278 0.533 8.880 1.00 0.00 H ATOM 1722 HG22 VAL B 41 0.790 -0.264 8.312 1.00 0.00 H ATOM 1723 HG23 VAL B 41 1.905 0.479 7.139 1.00 0.00 H ATOM 1724 H VAL B 41 1.806 1.180 10.726 1.00 0.00 H ATOM 1725 N GLY B 42 -1.065 0.329 10.950 1.00 11.83 N ATOM 1726 CA GLY B 42 -2.177 -0.571 11.287 1.00 14.10 C ATOM 1727 C GLY B 42 -1.957 -2.031 11.000 1.00 16.23 C ATOM 1728 O GLY B 42 -2.910 -2.815 11.051 1.00 17.29 O ATOM 1729 HA3 GLY B 42 -3.051 -0.248 10.721 1.00 0.00 H ATOM 1730 HA2 GLY B 42 -2.378 -0.468 12.353 1.00 0.00 H ATOM 1731 H GLY B 42 -0.252 0.393 11.596 1.00 0.00 H ATOM 1732 N ALA B 43 -0.733 -2.448 10.735 1.00 16.17 N ATOM 1733 CA ALA B 43 -0.502 -3.880 10.602 1.00 19.32 C ATOM 1734 C ALA B 43 -0.725 -4.549 11.972 1.00 22.08 C ATOM 1735 O ALA B 43 -0.421 -3.998 13.003 1.00 24.44 O ATOM 1736 CB ALA B 43 0.878 -4.152 10.026 1.00 18.49 C ATOM 1737 HA ALA B 43 -1.211 -4.314 9.897 1.00 0.00 H ATOM 1738 HB1 ALA B 43 0.957 -3.689 9.042 1.00 0.00 H ATOM 1739 HB2 ALA B 43 1.636 -3.733 10.688 1.00 0.00 H ATOM 1740 HB3 ALA B 43 1.027 -5.228 9.936 1.00 0.00 H ATOM 1741 H ALA B 43 0.048 -1.770 10.624 1.00 0.00 H ATOM 1742 N GLN B 44 -1.353 -5.700 11.981 1.00 24.78 N ATOM 1743 CA GLN B 44 -1.813 -6.271 13.247 1.00 26.80 C ATOM 1744 C GLN B 44 -1.167 -7.610 13.596 1.00 26.52 C ATOM 1745 O GLN B 44 -1.676 -8.345 14.462 1.00 27.68 O ATOM 1746 CB GLN B 44 -3.345 -6.388 13.222 1.00 27.86 C ATOM 1747 CG GLN B 44 -4.052 -5.056 13.528 1.00 33.14 C ATOM 1748 CD GLN B 44 -5.446 -5.247 14.106 1.00 39.60 C ATOM 1749 OE1 GLN B 44 -5.725 -6.264 14.759 1.00 43.32 O ATOM 1750 NE2 GLN B 44 -6.334 -4.273 13.874 1.00 40.09 N ATOM 1751 HA GLN B 44 -1.499 -5.590 14.038 1.00 0.00 H ATOM 1752 HB2 GLN B 44 -3.652 -6.726 12.232 1.00 0.00 H ATOM 1753 HB3 GLN B 44 -3.650 -7.123 13.967 1.00 0.00 H ATOM 1754 HG2 GLN B 44 -3.450 -4.499 14.246 1.00 0.00 H ATOM 1755 HG3 GLN B 44 -4.133 -4.484 12.604 1.00 0.00 H ATOM 1756 HE22 GLN B 44 -6.056 -3.437 13.321 1.00 0.00 H ATOM 1757 HE21 GLN B 44 -7.302 -4.352 14.247 1.00 0.00 H ATOM 1758 H GLN B 44 -1.524 -6.207 11.089 1.00 0.00 H ATOM 1759 N LYS B 45 -0.054 -7.940 12.953 1.00 24.04 N ATOM 1760 CA LYS B 45 0.554 -9.248 13.171 1.00 22.25 C ATOM 1761 C LYS B 45 2.036 -9.126 13.510 1.00 20.36 C ATOM 1762 O LYS B 45 2.664 -8.067 13.307 1.00 20.18 O ATOM 1763 CB LYS B 45 0.374 -10.150 11.926 1.00 22.51 C ATOM 1764 CG LYS B 45 -1.088 -10.353 11.463 1.00 26.18 C ATOM 1765 CD LYS B 45 -1.242 -11.480 10.395 1.00 29.52 C ATOM 1766 CE LYS B 45 -0.287 -11.311 9.189 1.00 32.81 C ATOM 1767 NZ LYS B 45 0.337 -12.625 8.705 1.00 31.65 N ATOM 1768 HA LYS B 45 0.045 -9.705 14.020 1.00 0.00 H ATOM 1769 HB2 LYS B 45 0.929 -9.702 11.102 1.00 0.00 H ATOM 1770 HB3 LYS B 45 0.794 -11.129 12.156 1.00 0.00 H ATOM 1771 HG2 LYS B 45 -1.694 -10.612 12.331 1.00 0.00 H ATOM 1772 HG3 LYS B 45 -1.450 -9.418 11.035 1.00 0.00 H ATOM 1773 HD2 LYS B 45 -1.034 -12.439 10.870 1.00 0.00 H ATOM 1774 HD3 LYS B 45 -2.268 -11.472 10.028 1.00 0.00 H ATOM 1775 HE2 LYS B 45 0.517 -10.635 9.479 1.00 0.00 H ATOM 1776 HE3 LYS B 45 -0.849 -10.873 8.364 1.00 0.00 H ATOM 1777 HZ1 LYS B 45 0.887 -13.051 9.478 1.00 0.00 H ATOM 1778 HZ2 LYS B 45 -0.417 -13.279 8.413 1.00 0.00 H ATOM 1779 HZ3 LYS B 45 0.963 -12.433 7.897 1.00 0.00 H ATOM 1780 H LYS B 45 0.385 -7.266 12.294 1.00 0.00 H ATOM 1781 N ASP B 46 2.626 -10.211 13.990 1.00 17.76 N ATOM 1782 CA ASP B 46 4.071 -10.202 14.199 1.00 15.93 C ATOM 1783 C ASP B 46 4.823 -10.972 13.104 1.00 15.35 C ATOM 1784 O ASP B 46 6.028 -10.974 13.103 1.00 14.42 O ATOM 1785 CB ASP B 46 4.515 -10.604 15.641 1.00 16.45 C ATOM 1786 CG ASP B 46 4.188 -12.026 15.995 1.00 18.43 C ATOM 1787 OD1 ASP B 46 3.676 -12.741 15.118 1.00 19.80 O ATOM 1788 OD2 ASP B 46 4.416 -12.457 17.166 1.00 19.51 O ATOM 1789 HA ASP B 46 4.366 -9.157 14.107 1.00 0.00 H ATOM 1790 HB2 ASP B 46 5.594 -10.468 15.721 1.00 0.00 H ATOM 1791 HB3 ASP B 46 4.014 -9.947 16.352 1.00 0.00 H ATOM 1792 H ASP B 46 2.067 -11.058 14.215 1.00 0.00 H ATOM 1793 N THR B 47 4.100 -11.611 12.189 1.00 14.26 N ATOM 1794 CA THR B 47 4.735 -12.221 10.992 1.00 13.90 C ATOM 1795 C THR B 47 3.952 -11.866 9.724 1.00 13.29 C ATOM 1796 O THR B 47 2.751 -11.693 9.773 1.00 13.96 O ATOM 1797 CB THR B 47 4.851 -13.749 11.092 1.00 14.47 C ATOM 1798 OG1 THR B 47 3.543 -14.317 11.169 1.00 16.61 O ATOM 1799 CG2 THR B 47 5.651 -14.105 12.353 1.00 13.96 C ATOM 1800 HA THR B 47 5.743 -11.809 10.942 1.00 0.00 H ATOM 1801 HB THR B 47 5.361 -14.145 10.214 1.00 0.00 H ATOM 1802 HG1 THR B 47 3.079 -13.966 11.970 1.00 0.00 H ATOM 1803 HG23 THR B 47 6.647 -13.668 12.285 1.00 0.00 H ATOM 1804 HG21 THR B 47 5.138 -13.711 13.230 1.00 0.00 H ATOM 1805 HG22 THR B 47 5.734 -15.189 12.435 1.00 0.00 H ATOM 1806 H THR B 47 3.070 -11.685 12.314 1.00 0.00 H ATOM 1807 N TYR B 48 4.677 -11.771 8.614 1.00 13.52 N ATOM 1808 CA TYR B 48 4.080 -11.353 7.341 1.00 14.29 C ATOM 1809 C TYR B 48 4.947 -11.947 6.229 1.00 14.29 C ATOM 1810 O TYR B 48 6.065 -12.408 6.454 1.00 15.11 O ATOM 1811 CB TYR B 48 4.014 -9.802 7.205 1.00 15.40 C ATOM 1812 CG TYR B 48 2.879 -9.118 7.986 1.00 16.10 C ATOM 1813 CD1 TYR B 48 1.545 -9.316 7.642 1.00 17.91 C ATOM 1814 CD2 TYR B 48 3.158 -8.283 9.073 1.00 19.40 C ATOM 1815 CE1 TYR B 48 0.514 -8.692 8.355 1.00 20.74 C ATOM 1816 CE2 TYR B 48 2.154 -7.678 9.796 1.00 20.34 C ATOM 1817 CZ TYR B 48 0.830 -7.874 9.426 1.00 20.66 C ATOM 1818 OH TYR B 48 -0.184 -7.270 10.137 1.00 21.48 O ATOM 1819 HA TYR B 48 3.051 -11.709 7.282 1.00 0.00 H ATOM 1820 HB3 TYR B 48 3.888 -9.562 6.149 1.00 0.00 H ATOM 1821 HB2 TYR B 48 4.960 -9.393 7.559 1.00 0.00 H ATOM 1822 HD2 TYR B 48 4.196 -8.107 9.355 1.00 0.00 H ATOM 1823 HE2 TYR B 48 2.397 -7.050 10.653 1.00 0.00 H ATOM 1824 HE1 TYR B 48 -0.526 -8.849 8.070 1.00 0.00 H ATOM 1825 HD1 TYR B 48 1.299 -9.968 6.804 1.00 0.00 H ATOM 1826 HH TYR B 48 -1.056 -7.516 9.739 1.00 0.00 H ATOM 1827 H TYR B 48 5.691 -11.998 8.649 1.00 0.00 H ATOM 1828 N THR B 49 4.404 -11.962 5.022 1.00 14.32 N ATOM 1829 CA THR B 49 5.264 -12.254 3.895 1.00 14.24 C ATOM 1830 C THR B 49 6.122 -11.042 3.562 1.00 14.59 C ATOM 1831 O THR B 49 5.823 -9.914 3.986 1.00 14.01 O ATOM 1832 CB THR B 49 4.463 -12.616 2.632 1.00 15.11 C ATOM 1833 OG1 THR B 49 3.728 -11.460 2.191 1.00 14.53 O ATOM 1834 CG2 THR B 49 3.507 -13.759 2.934 1.00 16.14 C ATOM 1835 HA THR B 49 5.879 -13.106 4.186 1.00 0.00 H ATOM 1836 HB THR B 49 5.147 -12.933 1.844 1.00 0.00 H ATOM 1837 HG1 THR B 49 3.211 -11.689 1.378 1.00 0.00 H ATOM 1838 HG23 THR B 49 4.075 -14.628 3.267 1.00 0.00 H ATOM 1839 HG21 THR B 49 2.814 -13.454 3.718 1.00 0.00 H ATOM 1840 HG22 THR B 49 2.949 -14.012 2.033 1.00 0.00 H ATOM 1841 H THR B 49 3.391 -11.770 4.888 1.00 0.00 H ATOM 1842 N MET B 50 7.158 -11.252 2.753 1.00 14.99 N ATOM 1843 CA MET B 50 8.008 -10.127 2.377 1.00 15.78 C ATOM 1844 C MET B 50 7.191 -9.152 1.546 1.00 15.50 C ATOM 1845 O MET B 50 7.344 -7.944 1.706 1.00 15.00 O ATOM 1846 CB MET B 50 9.273 -10.551 1.619 1.00 16.57 C ATOM 1847 CG MET B 50 10.057 -9.358 1.097 1.00 19.44 C ATOM 1848 SD MET B 50 11.202 -8.660 2.319 1.00 24.26 S ATOM 1849 CE MET B 50 12.608 -9.719 2.011 1.00 24.89 C ATOM 1850 HA MET B 50 8.355 -9.652 3.295 1.00 0.00 H ATOM 1851 HB2 MET B 50 9.911 -11.123 2.293 1.00 0.00 H ATOM 1852 HB3 MET B 50 8.984 -11.177 0.775 1.00 0.00 H ATOM 1853 HG2 MET B 50 9.351 -8.582 0.802 1.00 0.00 H ATOM 1854 HG3 MET B 50 10.631 -9.675 0.226 1.00 0.00 H ATOM 1855 HE1 MET B 50 12.327 -10.756 2.194 1.00 0.00 H ATOM 1856 HE2 MET B 50 12.927 -9.605 0.975 1.00 0.00 H ATOM 1857 HE3 MET B 50 13.425 -9.439 2.677 1.00 0.00 H ATOM 1858 H MET B 50 7.359 -12.207 2.393 1.00 0.00 H ATOM 1859 N LYS B 51 6.302 -9.660 0.713 1.00 15.93 N ATOM 1860 CA LYS B 51 5.430 -8.771 -0.071 1.00 15.38 C ATOM 1861 C LYS B 51 4.620 -7.860 0.845 1.00 14.76 C ATOM 1862 O LYS B 51 4.485 -6.648 0.596 1.00 14.66 O ATOM 1863 CB LYS B 51 4.475 -9.563 -0.974 1.00 16.09 C ATOM 1864 CG LYS B 51 5.010 -9.792 -2.368 1.00 17.60 C ATOM 1865 CD LYS B 51 4.137 -10.762 -3.166 1.00 19.06 C ATOM 1866 CE LYS B 51 4.899 -11.237 -4.412 1.00 21.98 C ATOM 1867 NZ LYS B 51 4.252 -12.361 -5.129 1.00 21.16 N ATOM 1868 HA LYS B 51 6.080 -8.165 -0.702 1.00 0.00 H ATOM 1869 HB2 LYS B 51 4.289 -10.533 -0.513 1.00 0.00 H ATOM 1870 HB3 LYS B 51 3.537 -9.013 -1.051 1.00 0.00 H ATOM 1871 HG2 LYS B 51 5.045 -8.837 -2.893 1.00 0.00 H ATOM 1872 HG3 LYS B 51 6.017 -10.203 -2.295 1.00 0.00 H ATOM 1873 HD2 LYS B 51 3.887 -11.621 -2.544 1.00 0.00 H ATOM 1874 HD3 LYS B 51 3.220 -10.258 -3.472 1.00 0.00 H ATOM 1875 HE2 LYS B 51 5.894 -11.556 -4.103 1.00 0.00 H ATOM 1876 HE3 LYS B 51 4.986 -10.397 -5.101 1.00 0.00 H ATOM 1877 HZ1 LYS B 51 4.172 -13.178 -4.490 1.00 0.00 H ATOM 1878 HZ2 LYS B 51 3.304 -12.070 -5.443 1.00 0.00 H ATOM 1879 HZ3 LYS B 51 4.828 -12.621 -5.955 1.00 0.00 H ATOM 1880 H LYS B 51 6.218 -10.691 0.610 1.00 0.00 H ATOM 1881 N GLU B 52 4.096 -8.428 1.918 1.00 13.62 N ATOM 1882 CA GLU B 52 3.325 -7.634 2.855 1.00 12.99 C ATOM 1883 C GLU B 52 4.197 -6.605 3.561 1.00 12.50 C ATOM 1884 O GLU B 52 3.805 -5.445 3.718 1.00 12.33 O ATOM 1885 CB GLU B 52 2.558 -8.536 3.815 1.00 13.29 C ATOM 1886 CG GLU B 52 1.561 -9.371 3.036 1.00 12.69 C ATOM 1887 CD GLU B 52 0.966 -10.520 3.813 1.00 14.27 C ATOM 1888 OE1 GLU B 52 1.643 -11.105 4.695 1.00 15.71 O ATOM 1889 OE2 GLU B 52 -0.187 -10.864 3.505 1.00 15.44 O ATOM 1890 HA GLU B 52 2.581 -7.061 2.302 1.00 0.00 H ATOM 1891 HB2 GLU B 52 3.256 -9.193 4.333 1.00 0.00 H ATOM 1892 HB3 GLU B 52 2.028 -7.924 4.544 1.00 0.00 H ATOM 1893 HG2 GLU B 52 0.748 -8.720 2.715 1.00 0.00 H ATOM 1894 HG3 GLU B 52 2.067 -9.777 2.160 1.00 0.00 H ATOM 1895 H GLU B 52 4.237 -9.444 2.090 1.00 0.00 H ATOM 1896 N VAL B 53 5.390 -7.000 3.977 1.00 12.21 N ATOM 1897 CA VAL B 53 6.282 -6.041 4.621 1.00 12.22 C ATOM 1898 C VAL B 53 6.512 -4.858 3.651 1.00 11.40 C ATOM 1899 O VAL B 53 6.485 -3.674 4.056 1.00 12.59 O ATOM 1900 CB VAL B 53 7.617 -6.724 5.041 1.00 12.29 C ATOM 1901 CG1 VAL B 53 8.610 -5.672 5.527 1.00 12.11 C ATOM 1902 CG2 VAL B 53 7.367 -7.746 6.170 1.00 15.29 C ATOM 1903 HA VAL B 53 5.829 -5.661 5.537 1.00 0.00 H ATOM 1904 HB VAL B 53 8.027 -7.242 4.174 1.00 0.00 H ATOM 1905 HG11 VAL B 53 8.807 -4.961 4.724 1.00 0.00 H ATOM 1906 HG12 VAL B 53 8.190 -5.146 6.384 1.00 0.00 H ATOM 1907 HG13 VAL B 53 9.540 -6.160 5.818 1.00 0.00 H ATOM 1908 HG21 VAL B 53 6.942 -7.235 7.034 1.00 0.00 H ATOM 1909 HG22 VAL B 53 6.672 -8.509 5.820 1.00 0.00 H ATOM 1910 HG23 VAL B 53 8.311 -8.213 6.451 1.00 0.00 H ATOM 1911 H VAL B 53 5.690 -7.987 3.846 1.00 0.00 H ATOM 1912 N LEU B 54 6.802 -5.183 2.387 1.00 12.53 N ATOM 1913 CA LEU B 54 6.986 -4.120 1.397 1.00 13.41 C ATOM 1914 C LEU B 54 5.743 -3.262 1.236 1.00 12.18 C ATOM 1915 O LEU B 54 5.861 -2.051 1.153 1.00 11.94 O ATOM 1916 CB LEU B 54 7.413 -4.705 0.049 1.00 13.91 C ATOM 1917 CG LEU B 54 8.863 -5.210 0.081 1.00 16.16 C ATOM 1918 CD1 LEU B 54 9.093 -6.111 -1.145 1.00 17.38 C ATOM 1919 CD2 LEU B 54 9.862 -4.053 0.096 1.00 19.28 C ATOM 1920 HA LEU B 54 7.780 -3.471 1.768 1.00 0.00 H ATOM 1921 HB2 LEU B 54 6.754 -5.537 -0.199 1.00 0.00 H ATOM 1922 HB3 LEU B 54 7.325 -3.933 -0.715 1.00 0.00 H ATOM 1923 HG LEU B 54 9.023 -5.778 0.998 1.00 0.00 H ATOM 1924 HD21 LEU B 54 9.728 -3.447 -0.800 1.00 0.00 H ATOM 1925 HD22 LEU B 54 9.691 -3.439 0.980 1.00 0.00 H ATOM 1926 HD23 LEU B 54 10.877 -4.451 0.119 1.00 0.00 H ATOM 1927 HD11 LEU B 54 8.404 -6.955 -1.109 1.00 0.00 H ATOM 1928 HD12 LEU B 54 8.918 -5.536 -2.055 1.00 0.00 H ATOM 1929 HD13 LEU B 54 10.119 -6.478 -1.137 1.00 0.00 H ATOM 1930 H LEU B 54 6.896 -6.181 2.110 1.00 0.00 H ATOM 1931 N PHE B 55 4.562 -3.877 1.190 1.00 12.54 N ATOM 1932 CA PHE B 55 3.336 -3.096 1.071 1.00 12.24 C ATOM 1933 C PHE B 55 3.212 -2.104 2.250 1.00 12.00 C ATOM 1934 O PHE B 55 2.936 -0.929 2.043 1.00 12.23 O ATOM 1935 CB PHE B 55 2.086 -3.979 0.991 1.00 12.55 C ATOM 1936 CG PHE B 55 1.728 -4.455 -0.419 1.00 14.83 C ATOM 1937 CD1 PHE B 55 1.502 -3.539 -1.449 1.00 15.35 C ATOM 1938 CD2 PHE B 55 1.558 -5.810 -0.681 1.00 16.81 C ATOM 1939 CE1 PHE B 55 1.126 -3.987 -2.755 1.00 16.55 C ATOM 1940 CE2 PHE B 55 1.172 -6.245 -1.969 1.00 16.27 C ATOM 1941 CZ PHE B 55 0.983 -5.323 -2.998 1.00 17.66 C ATOM 1942 HA PHE B 55 3.401 -2.541 0.135 1.00 0.00 H ATOM 1943 HB2 PHE B 55 2.250 -4.858 1.615 1.00 0.00 H ATOM 1944 HB3 PHE B 55 1.242 -3.410 1.382 1.00 0.00 H ATOM 1945 HD2 PHE B 55 1.723 -6.540 0.111 1.00 0.00 H ATOM 1946 HE2 PHE B 55 1.021 -7.308 -2.159 1.00 0.00 H ATOM 1947 HZ PHE B 55 0.721 -5.669 -3.998 1.00 0.00 H ATOM 1948 HE1 PHE B 55 0.954 -3.264 -3.553 1.00 0.00 H ATOM 1949 HD1 PHE B 55 1.613 -2.472 -1.256 1.00 0.00 H ATOM 1950 H PHE B 55 4.514 -4.915 1.239 1.00 0.00 H ATOM 1951 N TYR B 56 3.383 -2.593 3.471 1.00 11.88 N ATOM 1952 CA TYR B 56 3.264 -1.715 4.639 1.00 11.32 C ATOM 1953 C TYR B 56 4.311 -0.624 4.685 1.00 12.09 C ATOM 1954 O TYR B 56 4.014 0.534 5.035 1.00 12.10 O ATOM 1955 CB TYR B 56 3.313 -2.525 5.930 1.00 11.93 C ATOM 1956 CG TYR B 56 2.109 -3.412 6.107 1.00 10.99 C ATOM 1957 CD1 TYR B 56 0.819 -2.856 6.103 1.00 11.93 C ATOM 1958 CD2 TYR B 56 2.267 -4.803 6.344 1.00 12.52 C ATOM 1959 CE1 TYR B 56 -0.327 -3.673 6.283 1.00 14.55 C ATOM 1960 CE2 TYR B 56 1.155 -5.633 6.525 1.00 13.20 C ATOM 1961 CZ TYR B 56 -0.127 -5.064 6.504 1.00 14.48 C ATOM 1962 OH TYR B 56 -1.245 -5.857 6.686 1.00 15.81 O ATOM 1963 HA TYR B 56 2.296 -1.223 4.542 1.00 0.00 H ATOM 1964 HB3 TYR B 56 3.365 -1.836 6.773 1.00 0.00 H ATOM 1965 HB2 TYR B 56 4.207 -3.149 5.917 1.00 0.00 H ATOM 1966 HD2 TYR B 56 3.269 -5.230 6.386 1.00 0.00 H ATOM 1967 HE2 TYR B 56 1.283 -6.704 6.680 1.00 0.00 H ATOM 1968 HE1 TYR B 56 -1.330 -3.248 6.253 1.00 0.00 H ATOM 1969 HD1 TYR B 56 0.697 -1.782 5.960 1.00 0.00 H ATOM 1970 HH TYR B 56 -2.058 -5.294 6.641 1.00 0.00 H ATOM 1971 H TYR B 56 3.602 -3.601 3.600 1.00 0.00 H ATOM 1972 N LEU B 57 5.541 -0.959 4.337 1.00 11.52 N ATOM 1973 CA LEU B 57 6.594 0.049 4.247 1.00 11.64 C ATOM 1974 C LEU B 57 6.243 1.155 3.244 1.00 11.41 C ATOM 1975 O LEU B 57 6.455 2.347 3.506 1.00 11.82 O ATOM 1976 CB LEU B 57 7.926 -0.595 3.857 1.00 11.82 C ATOM 1977 CG LEU B 57 8.774 -1.249 4.959 1.00 11.85 C ATOM 1978 CD1 LEU B 57 9.890 -2.032 4.334 1.00 12.05 C ATOM 1979 CD2 LEU B 57 9.371 -0.149 5.861 1.00 12.00 C ATOM 1980 HA LEU B 57 6.686 0.503 5.234 1.00 0.00 H ATOM 1981 HB2 LEU B 57 7.707 -1.366 3.119 1.00 0.00 H ATOM 1982 HB3 LEU B 57 8.537 0.182 3.398 1.00 0.00 H ATOM 1983 HG LEU B 57 8.148 -1.915 5.553 1.00 0.00 H ATOM 1984 HD21 LEU B 57 9.997 0.511 5.261 1.00 0.00 H ATOM 1985 HD22 LEU B 57 8.563 0.426 6.313 1.00 0.00 H ATOM 1986 HD23 LEU B 57 9.973 -0.610 6.644 1.00 0.00 H ATOM 1987 HD11 LEU B 57 9.473 -2.805 3.689 1.00 0.00 H ATOM 1988 HD12 LEU B 57 10.515 -1.363 3.743 1.00 0.00 H ATOM 1989 HD13 LEU B 57 10.490 -2.495 5.117 1.00 0.00 H ATOM 1990 H LEU B 57 5.762 -1.953 4.125 1.00 0.00 H ATOM 1991 N GLY B 58 5.688 0.776 2.098 1.00 11.86 N ATOM 1992 CA GLY B 58 5.256 1.770 1.090 1.00 12.06 C ATOM 1993 C GLY B 58 4.135 2.634 1.663 1.00 12.02 C ATOM 1994 O GLY B 58 4.110 3.835 1.449 1.00 11.97 O ATOM 1995 HA3 GLY B 58 4.896 1.252 0.201 1.00 0.00 H ATOM 1996 HA2 GLY B 58 6.101 2.404 0.821 1.00 0.00 H ATOM 1997 H GLY B 58 5.555 -0.237 1.906 1.00 0.00 H ATOM 1998 N GLN B 59 3.191 2.028 2.376 1.00 11.58 N ATOM 1999 CA GLN B 59 2.123 2.811 3.018 1.00 11.61 C ATOM 2000 C GLN B 59 2.697 3.800 4.011 1.00 11.32 C ATOM 2001 O GLN B 59 2.251 4.936 4.100 1.00 11.79 O ATOM 2002 CB GLN B 59 1.186 1.895 3.797 1.00 11.56 C ATOM 2003 CG GLN B 59 0.313 1.020 2.919 1.00 12.08 C ATOM 2004 CD GLN B 59 -0.583 0.199 3.765 1.00 13.44 C ATOM 2005 OE1 GLN B 59 -0.361 0.040 4.990 1.00 13.44 O ATOM 2006 NE2 GLN B 59 -1.672 -0.308 3.148 1.00 16.66 N ATOM 2007 HA GLN B 59 1.590 3.333 2.223 1.00 0.00 H ATOM 2008 HB2 GLN B 59 1.789 1.249 4.435 1.00 0.00 H ATOM 2009 HB3 GLN B 59 0.538 2.514 4.418 1.00 0.00 H ATOM 2010 HG2 GLN B 59 -0.286 1.650 2.261 1.00 0.00 H ATOM 2011 HG3 GLN B 59 0.944 0.366 2.318 1.00 0.00 H ATOM 2012 HE22 GLN B 59 -1.814 -0.150 2.130 1.00 0.00 H ATOM 2013 HE21 GLN B 59 -2.369 -0.856 3.691 1.00 0.00 H ATOM 2014 H GLN B 59 3.207 0.993 2.481 1.00 0.00 H ATOM 2015 N TYR B 60 3.711 3.370 4.768 1.00 11.39 N ATOM 2016 CA TYR B 60 4.352 4.258 5.744 1.00 11.12 C ATOM 2017 C TYR B 60 5.023 5.457 5.067 1.00 12.05 C ATOM 2018 O TYR B 60 4.860 6.618 5.486 1.00 11.93 O ATOM 2019 CB TYR B 60 5.354 3.458 6.591 1.00 10.58 C ATOM 2020 CG TYR B 60 6.103 4.295 7.586 1.00 11.11 C ATOM 2021 CD1 TYR B 60 5.623 4.450 8.866 1.00 10.45 C ATOM 2022 CD2 TYR B 60 7.320 4.898 7.256 1.00 13.77 C ATOM 2023 CE1 TYR B 60 6.294 5.206 9.801 1.00 11.78 C ATOM 2024 CE2 TYR B 60 8.014 5.685 8.197 1.00 11.72 C ATOM 2025 CZ TYR B 60 7.482 5.809 9.466 1.00 12.87 C ATOM 2026 OH TYR B 60 8.139 6.576 10.410 1.00 14.18 O ATOM 2027 HA TYR B 60 3.581 4.663 6.400 1.00 0.00 H ATOM 2028 HB3 TYR B 60 6.076 2.990 5.921 1.00 0.00 H ATOM 2029 HB2 TYR B 60 4.808 2.685 7.132 1.00 0.00 H ATOM 2030 HD2 TYR B 60 7.737 4.758 6.259 1.00 0.00 H ATOM 2031 HE2 TYR B 60 8.946 6.183 7.930 1.00 0.00 H ATOM 2032 HE1 TYR B 60 5.884 5.326 10.804 1.00 0.00 H ATOM 2033 HD1 TYR B 60 4.689 3.963 9.147 1.00 0.00 H ATOM 2034 HH TYR B 60 7.630 6.560 11.259 1.00 0.00 H ATOM 2035 H TYR B 60 4.050 2.392 4.664 1.00 0.00 H ATOM 2036 N ILE B 61 5.803 5.176 4.026 1.00 11.80 N ATOM 2037 CA ILE B 61 6.473 6.270 3.308 1.00 12.05 C ATOM 2038 C ILE B 61 5.448 7.251 2.733 1.00 11.98 C ATOM 2039 O ILE B 61 5.658 8.469 2.779 1.00 11.92 O ATOM 2040 CB ILE B 61 7.401 5.695 2.217 1.00 12.09 C ATOM 2041 CG1 ILE B 61 8.568 4.959 2.875 1.00 11.96 C ATOM 2042 CG2 ILE B 61 7.902 6.822 1.271 1.00 13.23 C ATOM 2043 CD1 ILE B 61 9.316 3.999 1.933 1.00 13.50 C ATOM 2044 HA ILE B 61 7.091 6.831 4.009 1.00 0.00 H ATOM 2045 HB ILE B 61 6.842 4.985 1.607 1.00 0.00 H ATOM 2046 HG12 ILE B 61 9.277 5.701 3.242 1.00 0.00 H ATOM 2047 HG13 ILE B 61 8.180 4.382 3.714 1.00 0.00 H ATOM 2048 HD11 ILE B 61 8.624 3.241 1.565 1.00 0.00 H ATOM 2049 HD12 ILE B 61 9.723 4.561 1.092 1.00 0.00 H ATOM 2050 HD13 ILE B 61 10.128 3.517 2.477 1.00 0.00 H ATOM 2051 HG21 ILE B 61 7.047 7.299 0.791 1.00 0.00 H ATOM 2052 HG22 ILE B 61 8.455 7.562 1.850 1.00 0.00 H ATOM 2053 HG23 ILE B 61 8.554 6.393 0.510 1.00 0.00 H ATOM 2054 H ILE B 61 5.938 4.190 3.723 1.00 0.00 H ATOM 2055 N MET B 62 4.356 6.749 2.166 1.00 11.98 N ATOM 2056 CA MET B 62 3.383 7.694 1.606 1.00 11.45 C ATOM 2057 C MET B 62 2.739 8.492 2.741 1.00 11.74 C ATOM 2058 O MET B 62 2.644 9.727 2.652 1.00 11.41 O ATOM 2059 CB MET B 62 2.345 7.006 0.716 1.00 12.57 C ATOM 2060 CG MET B 62 2.954 6.373 -0.530 1.00 11.34 C ATOM 2061 SD MET B 62 1.696 5.869 -1.713 1.00 15.06 S ATOM 2062 CE MET B 62 1.201 7.471 -2.291 1.00 12.13 C ATOM 2063 HA MET B 62 3.911 8.386 0.950 1.00 0.00 H ATOM 2064 HB2 MET B 62 1.852 6.226 1.296 1.00 0.00 H ATOM 2065 HB3 MET B 62 1.608 7.747 0.405 1.00 0.00 H ATOM 2066 HG2 MET B 62 3.530 5.497 -0.234 1.00 0.00 H ATOM 2067 HG3 MET B 62 3.615 7.097 -1.006 1.00 0.00 H ATOM 2068 HE1 MET B 62 0.823 8.057 -1.453 1.00 0.00 H ATOM 2069 HE2 MET B 62 2.059 7.977 -2.733 1.00 0.00 H ATOM 2070 HE3 MET B 62 0.417 7.359 -3.040 1.00 0.00 H ATOM 2071 H MET B 62 4.197 5.722 2.121 1.00 0.00 H ATOM 2072 N THR B 63 2.366 7.793 3.820 1.00 11.66 N ATOM 2073 CA THR B 63 1.649 8.428 4.921 1.00 12.09 C ATOM 2074 C THR B 63 2.449 9.587 5.470 1.00 12.54 C ATOM 2075 O THR B 63 1.906 10.680 5.709 1.00 13.55 O ATOM 2076 CB THR B 63 1.383 7.416 6.045 1.00 11.92 C ATOM 2077 OG1 THR B 63 0.484 6.411 5.559 1.00 12.12 O ATOM 2078 CG2 THR B 63 0.711 8.092 7.237 1.00 12.05 C ATOM 2079 HA THR B 63 0.697 8.796 4.538 1.00 0.00 H ATOM 2080 HB THR B 63 2.337 6.989 6.354 1.00 0.00 H ATOM 2081 HG1 THR B 63 0.893 5.952 4.783 1.00 0.00 H ATOM 2082 HG23 THR B 63 1.369 8.865 7.633 1.00 0.00 H ATOM 2083 HG21 THR B 63 -0.228 8.542 6.916 1.00 0.00 H ATOM 2084 HG22 THR B 63 0.514 7.350 8.010 1.00 0.00 H ATOM 2085 H THR B 63 2.591 6.779 3.875 1.00 0.00 H ATOM 2086 N LYS B 64 3.741 9.339 5.649 1.00 12.90 N ATOM 2087 CA LYS B 64 4.656 10.365 6.190 1.00 14.42 C ATOM 2088 C LYS B 64 5.214 11.334 5.136 1.00 14.10 C ATOM 2089 O LYS B 64 5.902 12.287 5.501 1.00 16.00 O ATOM 2090 CB LYS B 64 5.766 9.666 6.965 1.00 13.90 C ATOM 2091 CG LYS B 64 5.219 8.916 8.168 1.00 16.65 C ATOM 2092 CD LYS B 64 6.284 8.754 9.153 1.00 20.48 C ATOM 2093 CE LYS B 64 6.390 10.000 10.013 1.00 19.48 C ATOM 2094 NZ LYS B 64 7.382 9.771 11.134 1.00 20.26 N ATOM 2095 HA LYS B 64 4.077 11.005 6.856 1.00 0.00 H ATOM 2096 HB2 LYS B 64 6.268 8.959 6.305 1.00 0.00 H ATOM 2097 HB3 LYS B 64 6.483 10.412 7.308 1.00 0.00 H ATOM 2098 HG2 LYS B 64 4.397 9.481 8.608 1.00 0.00 H ATOM 2099 HG3 LYS B 64 4.858 7.936 7.855 1.00 0.00 H ATOM 2100 HD2 LYS B 64 6.062 7.895 9.787 1.00 0.00 H ATOM 2101 HD3 LYS B 64 7.230 8.589 8.638 1.00 0.00 H ATOM 2102 HE2 LYS B 64 5.413 10.231 10.437 1.00 0.00 H ATOM 2103 HE3 LYS B 64 6.725 10.836 9.399 1.00 0.00 H ATOM 2104 HZ1 LYS B 64 7.062 8.975 11.721 1.00 0.00 H ATOM 2105 HZ2 LYS B 64 8.315 9.552 10.730 1.00 0.00 H ATOM 2106 HZ3 LYS B 64 7.448 10.629 11.718 1.00 0.00 H ATOM 2107 H LYS B 64 4.117 8.401 5.403 1.00 0.00 H ATOM 2108 N ARG B 65 4.872 11.093 3.867 1.00 14.70 N ATOM 2109 CA ARG B 65 5.268 11.919 2.719 1.00 14.83 C ATOM 2110 C ARG B 65 6.775 12.113 2.741 1.00 14.44 C ATOM 2111 O ARG B 65 7.309 13.221 2.628 1.00 15.71 O ATOM 2112 CB ARG B 65 4.468 13.242 2.623 1.00 15.60 C ATOM 2113 CG ARG B 65 3.091 13.026 2.008 1.00 16.77 C ATOM 2114 CD ARG B 65 2.166 14.208 2.177 1.00 23.37 C ATOM 2115 NE ARG B 65 0.790 13.756 2.002 1.00 26.19 N ATOM 2116 CZ ARG B 65 -0.285 14.505 2.196 1.00 28.34 C ATOM 2117 NH1 ARG B 65 -0.162 15.768 2.582 1.00 29.49 N ATOM 2118 NH2 ARG B 65 -1.486 13.979 2.014 1.00 30.66 N ATOM 2119 HA ARG B 65 5.010 11.394 1.799 1.00 0.00 H ATOM 2120 HB2 ARG B 65 4.347 13.655 3.624 1.00 0.00 H ATOM 2121 HB3 ARG B 65 5.024 13.947 2.005 1.00 0.00 H ATOM 2122 HG2 ARG B 65 3.215 12.833 0.942 1.00 0.00 H ATOM 2123 HG3 ARG B 65 2.633 12.158 2.482 1.00 0.00 H ATOM 2124 HD2 ARG B 65 2.401 14.967 1.431 1.00 0.00 H ATOM 2125 HD3 ARG B 65 2.289 14.631 3.174 1.00 0.00 H ATOM 2126 HE ARG B 65 0.642 12.771 1.702 1.00 0.00 H ATOM 2127 HH12 ARG B 65 -1.010 16.351 2.733 1.00 0.00 H ATOM 2128 HH11 ARG B 65 0.783 16.176 2.734 1.00 0.00 H ATOM 2129 HH22 ARG B 65 -2.336 14.559 2.164 1.00 0.00 H ATOM 2130 HH21 ARG B 65 -1.580 12.985 1.721 1.00 0.00 H ATOM 2131 H ARG B 65 4.281 10.258 3.678 1.00 0.00 H ATOM 2132 N LEU B 66 7.469 10.984 2.856 1.00 14.13 N ATOM 2133 CA LEU B 66 8.936 11.040 2.904 1.00 12.94 C ATOM 2134 C LEU B 66 9.555 11.038 1.492 1.00 14.22 C ATOM 2135 O LEU B 66 10.757 11.239 1.356 1.00 15.18 O ATOM 2136 CB LEU B 66 9.504 9.852 3.693 1.00 13.30 C ATOM 2137 CG LEU B 66 8.982 9.795 5.127 1.00 12.96 C ATOM 2138 CD1 LEU B 66 9.592 8.531 5.773 1.00 14.09 C ATOM 2139 CD2 LEU B 66 9.417 11.007 5.873 1.00 13.60 C ATOM 2140 HA LEU B 66 9.197 11.973 3.403 1.00 0.00 H ATOM 2141 HB2 LEU B 66 9.226 8.929 3.183 1.00 0.00 H ATOM 2142 HB3 LEU B 66 10.590 9.938 3.720 1.00 0.00 H ATOM 2143 HG LEU B 66 7.893 9.759 5.148 1.00 0.00 H ATOM 2144 HD21 LEU B 66 10.506 11.052 5.888 1.00 0.00 H ATOM 2145 HD22 LEU B 66 9.022 11.896 5.381 1.00 0.00 H ATOM 2146 HD23 LEU B 66 9.040 10.958 6.895 1.00 0.00 H ATOM 2147 HD11 LEU B 66 9.280 7.651 5.211 1.00 0.00 H ATOM 2148 HD12 LEU B 66 10.679 8.606 5.759 1.00 0.00 H ATOM 2149 HD13 LEU B 66 9.246 8.448 6.803 1.00 0.00 H ATOM 2150 H LEU B 66 6.977 10.069 2.911 1.00 0.00 H ATOM 2151 N TYR B 67 8.732 10.860 0.462 1.00 13.43 N ATOM 2152 CA TYR B 67 9.222 10.884 -0.919 1.00 13.17 C ATOM 2153 C TYR B 67 9.092 12.291 -1.488 1.00 13.93 C ATOM 2154 O TYR B 67 8.206 13.090 -1.063 1.00 14.36 O ATOM 2155 CB TYR B 67 8.466 9.854 -1.767 1.00 13.19 C ATOM 2156 CG TYR B 67 6.992 10.161 -1.959 1.00 14.64 C ATOM 2157 CD1 TYR B 67 6.554 11.015 -2.974 1.00 15.61 C ATOM 2158 CD2 TYR B 67 6.042 9.619 -1.101 1.00 17.12 C ATOM 2159 CE1 TYR B 67 5.221 11.312 -3.126 1.00 18.16 C ATOM 2160 CE2 TYR B 67 4.719 9.908 -1.246 1.00 18.99 C ATOM 2161 CZ TYR B 67 4.306 10.762 -2.253 1.00 21.25 C ATOM 2162 OH TYR B 67 2.961 11.044 -2.385 1.00 22.27 O ATOM 2163 HA TYR B 67 10.277 10.612 -0.937 1.00 0.00 H ATOM 2164 HB3 TYR B 67 8.552 8.882 -1.280 1.00 0.00 H ATOM 2165 HB2 TYR B 67 8.936 9.810 -2.749 1.00 0.00 H ATOM 2166 HD2 TYR B 67 6.361 8.952 -0.300 1.00 0.00 H ATOM 2167 HE2 TYR B 67 3.987 9.467 -0.570 1.00 0.00 H ATOM 2168 HE1 TYR B 67 4.891 11.974 -3.927 1.00 0.00 H ATOM 2169 HD1 TYR B 67 7.282 11.453 -3.657 1.00 0.00 H ATOM 2170 HH TYR B 67 2.630 11.464 -1.552 1.00 0.00 H ATOM 2171 H TYR B 67 7.720 10.701 0.641 1.00 0.00 H ATOM 2172 N ASP B 68 9.950 12.614 -2.452 1.00 12.93 N ATOM 2173 CA ASP B 68 9.899 13.909 -3.140 1.00 13.78 C ATOM 2174 C ASP B 68 8.698 13.966 -4.081 1.00 13.48 C ATOM 2175 O ASP B 68 8.522 13.065 -4.894 1.00 12.89 O ATOM 2176 CB ASP B 68 11.175 14.083 -3.956 1.00 13.22 C ATOM 2177 CG ASP B 68 11.171 15.334 -4.772 1.00 15.09 C ATOM 2178 OD1 ASP B 68 10.608 16.344 -4.307 1.00 14.88 O ATOM 2179 OD2 ASP B 68 11.759 15.294 -5.855 1.00 15.16 O ATOM 2180 HA ASP B 68 9.807 14.703 -2.399 1.00 0.00 H ATOM 2181 HB2 ASP B 68 12.024 14.114 -3.273 1.00 0.00 H ATOM 2182 HB3 ASP B 68 11.280 13.230 -4.626 1.00 0.00 H ATOM 2183 H ASP B 68 10.680 11.927 -2.727 1.00 0.00 H ATOM 2184 N GLU B 69 7.872 15.000 -3.966 1.00 13.68 N ATOM 2185 CA GLU B 69 6.696 15.148 -4.820 1.00 14.67 C ATOM 2186 C GLU B 69 7.083 15.214 -6.292 1.00 14.98 C ATOM 2187 O GLU B 69 6.343 14.764 -7.167 1.00 15.43 O ATOM 2188 CB GLU B 69 5.964 16.436 -4.456 1.00 15.61 C ATOM 2189 CG GLU B 69 4.761 16.690 -5.310 1.00 18.92 C ATOM 2190 CD GLU B 69 3.626 15.692 -5.085 1.00 23.91 C ATOM 2191 OE1 GLU B 69 3.622 14.985 -4.058 1.00 24.31 O ATOM 2192 OE2 GLU B 69 2.708 15.645 -5.939 1.00 27.52 O ATOM 2193 HA GLU B 69 6.056 14.280 -4.662 1.00 0.00 H ATOM 2194 HB2 GLU B 69 5.644 16.371 -3.416 1.00 0.00 H ATOM 2195 HB3 GLU B 69 6.654 17.272 -4.571 1.00 0.00 H ATOM 2196 HG2 GLU B 69 4.388 17.691 -5.091 1.00 0.00 H ATOM 2197 HG3 GLU B 69 5.064 16.637 -6.356 1.00 0.00 H ATOM 2198 H GLU B 69 8.068 15.725 -3.247 1.00 0.00 H ATOM 2199 N LYS B 70 8.234 15.827 -6.581 1.00 13.56 N ATOM 2200 CA LYS B 70 8.655 16.024 -7.978 1.00 14.16 C ATOM 2201 C LYS B 70 9.194 14.768 -8.667 1.00 14.95 C ATOM 2202 O LYS B 70 8.717 14.371 -9.742 1.00 16.83 O ATOM 2203 CB LYS B 70 9.705 17.127 -8.059 1.00 13.75 C ATOM 2204 CG LYS B 70 10.057 17.514 -9.467 1.00 14.74 C ATOM 2205 CD LYS B 70 10.997 18.707 -9.467 1.00 19.25 C ATOM 2206 CE LYS B 70 11.377 19.116 -10.882 1.00 22.09 C ATOM 2207 NZ LYS B 70 10.508 20.208 -11.413 1.00 26.52 N ATOM 2208 HA LYS B 70 7.747 16.302 -8.514 1.00 0.00 H ATOM 2209 HB2 LYS B 70 9.322 18.008 -7.544 1.00 0.00 H ATOM 2210 HB3 LYS B 70 10.610 16.781 -7.559 1.00 0.00 H ATOM 2211 HG2 LYS B 70 10.543 16.673 -9.960 1.00 0.00 H ATOM 2212 HG3 LYS B 70 9.146 17.773 -10.007 1.00 0.00 H ATOM 2213 HD2 LYS B 70 10.505 19.546 -8.975 1.00 0.00 H ATOM 2214 HD3 LYS B 70 11.902 18.446 -8.918 1.00 0.00 H ATOM 2215 HE2 LYS B 70 11.285 18.247 -11.534 1.00 0.00 H ATOM 2216 HE3 LYS B 70 12.411 19.461 -10.881 1.00 0.00 H ATOM 2217 HZ1 LYS B 70 9.519 19.887 -11.426 1.00 0.00 H ATOM 2218 HZ2 LYS B 70 10.594 21.046 -10.802 1.00 0.00 H ATOM 2219 HZ3 LYS B 70 10.808 20.449 -12.379 1.00 0.00 H ATOM 2220 H LYS B 70 8.841 16.170 -5.809 1.00 0.00 H ATOM 2221 N GLN B 71 10.199 14.148 -8.053 1.00 13.20 N ATOM 2222 CA GLN B 71 10.788 12.888 -8.551 1.00 12.22 C ATOM 2223 C GLN B 71 10.587 11.854 -7.468 1.00 12.00 C ATOM 2224 O GLN B 71 11.317 11.798 -6.456 1.00 12.41 O ATOM 2225 CB GLN B 71 12.262 13.071 -8.860 1.00 12.82 C ATOM 2226 CG GLN B 71 12.531 13.775 -10.161 1.00 15.73 C ATOM 2227 CD GLN B 71 14.027 13.686 -10.513 1.00 17.11 C ATOM 2228 OE1 GLN B 71 14.685 12.670 -10.230 1.00 22.33 O ATOM 2229 NE2 GLN B 71 14.546 14.723 -11.125 1.00 23.00 N ATOM 2230 HA GLN B 71 10.309 12.573 -9.478 1.00 0.00 H ATOM 2231 HB2 GLN B 71 12.712 13.653 -8.056 1.00 0.00 H ATOM 2232 HB3 GLN B 71 12.729 12.087 -8.899 1.00 0.00 H ATOM 2233 HG2 GLN B 71 11.946 13.306 -10.952 1.00 0.00 H ATOM 2234 HG3 GLN B 71 12.244 14.823 -10.070 1.00 0.00 H ATOM 2235 HE22 GLN B 71 13.953 15.550 -11.340 1.00 0.00 H ATOM 2236 HE21 GLN B 71 15.550 14.718 -11.395 1.00 0.00 H ATOM 2237 H GLN B 71 10.587 14.569 -7.185 1.00 0.00 H ATOM 2238 N GLN B 72 9.533 11.061 -7.664 1.00 11.93 N ATOM 2239 CA GLN B 72 8.940 10.317 -6.544 1.00 11.76 C ATOM 2240 C GLN B 72 9.660 9.025 -6.156 1.00 11.59 C ATOM 2241 O GLN B 72 9.183 8.315 -5.301 1.00 13.31 O ATOM 2242 CB GLN B 72 7.455 10.051 -6.819 1.00 11.72 C ATOM 2243 CG GLN B 72 6.704 11.397 -7.005 1.00 12.93 C ATOM 2244 CD GLN B 72 5.184 11.307 -6.768 1.00 12.32 C ATOM 2245 OE1 GLN B 72 4.605 10.216 -6.604 1.00 12.42 O ATOM 2246 NE2 GLN B 72 4.531 12.465 -6.804 1.00 15.21 N ATOM 2247 HA GLN B 72 9.059 10.964 -5.675 1.00 0.00 H ATOM 2248 HB2 GLN B 72 7.356 9.453 -7.725 1.00 0.00 H ATOM 2249 HB3 GLN B 72 7.023 9.508 -5.978 1.00 0.00 H ATOM 2250 HG2 GLN B 72 7.118 12.120 -6.303 1.00 0.00 H ATOM 2251 HG3 GLN B 72 6.872 11.745 -8.024 1.00 0.00 H ATOM 2252 HE22 GLN B 72 5.054 13.353 -6.943 1.00 0.00 H ATOM 2253 HE21 GLN B 72 3.497 12.483 -6.693 1.00 0.00 H ATOM 2254 H GLN B 72 9.127 10.968 -8.617 1.00 0.00 H ATOM 2255 N HIS B 73 10.827 8.767 -6.745 1.00 11.58 N ATOM 2256 CA HIS B 73 11.663 7.661 -6.302 1.00 12.14 C ATOM 2257 C HIS B 73 12.591 8.149 -5.190 1.00 12.49 C ATOM 2258 O HIS B 73 13.256 7.335 -4.547 1.00 12.83 O ATOM 2259 CB HIS B 73 12.533 7.121 -7.445 1.00 11.75 C ATOM 2260 CG HIS B 73 13.489 8.133 -8.005 1.00 14.79 C ATOM 2261 ND1 HIS B 73 14.804 8.247 -7.587 1.00 15.02 N ATOM 2262 CD2 HIS B 73 13.301 9.107 -8.923 1.00 14.86 C ATOM 2263 CE1 HIS B 73 15.386 9.227 -8.267 1.00 14.48 C ATOM 2264 NE2 HIS B 73 14.492 9.771 -9.069 1.00 15.12 N ATOM 2265 HA HIS B 73 11.007 6.865 -5.950 1.00 0.00 H ATOM 2266 HB2 HIS B 73 13.108 6.275 -7.070 1.00 0.00 H ATOM 2267 HB3 HIS B 73 11.877 6.785 -8.248 1.00 0.00 H ATOM 2268 HD2 HIS B 73 12.373 9.325 -9.451 1.00 0.00 H ATOM 2269 HE1 HIS B 73 16.429 9.531 -8.177 1.00 0.00 H ATOM 2270 H HIS B 73 11.146 9.365 -7.534 1.00 0.00 H ATOM 2271 N ILE B 74 12.689 9.459 -4.972 1.00 10.85 N ATOM 2272 CA ILE B 74 13.631 9.967 -3.952 1.00 11.37 C ATOM 2273 C ILE B 74 13.011 9.947 -2.553 1.00 11.49 C ATOM 2274 O ILE B 74 11.948 10.534 -2.356 1.00 12.58 O ATOM 2275 CB ILE B 74 14.029 11.429 -4.277 1.00 11.84 C ATOM 2276 CG1 ILE B 74 14.655 11.499 -5.671 1.00 12.25 C ATOM 2277 CG2 ILE B 74 14.974 12.027 -3.177 1.00 12.13 C ATOM 2278 CD1 ILE B 74 14.811 12.962 -6.114 1.00 13.05 C ATOM 2279 HA ILE B 74 14.504 9.315 -3.968 1.00 0.00 H ATOM 2280 HB ILE B 74 13.129 12.044 -4.277 1.00 0.00 H ATOM 2281 HG12 ILE B 74 15.635 11.023 -5.649 1.00 0.00 H ATOM 2282 HG13 ILE B 74 14.014 10.975 -6.380 1.00 0.00 H ATOM 2283 HD11 ILE B 74 13.831 13.439 -6.139 1.00 0.00 H ATOM 2284 HD12 ILE B 74 15.454 13.487 -5.408 1.00 0.00 H ATOM 2285 HD13 ILE B 74 15.258 12.994 -7.108 1.00 0.00 H ATOM 2286 HG21 ILE B 74 14.463 12.014 -2.214 1.00 0.00 H ATOM 2287 HG22 ILE B 74 15.882 11.428 -3.115 1.00 0.00 H ATOM 2288 HG23 ILE B 74 15.231 13.053 -3.440 1.00 0.00 H ATOM 2289 H ILE B 74 12.104 10.123 -5.518 1.00 0.00 H ATOM 2290 N VAL B 75 13.639 9.257 -1.601 1.00 11.03 N ATOM 2291 CA VAL B 75 13.079 9.247 -0.242 1.00 11.79 C ATOM 2292 C VAL B 75 14.074 9.858 0.705 1.00 12.13 C ATOM 2293 O VAL B 75 15.249 9.474 0.683 1.00 13.65 O ATOM 2294 CB VAL B 75 12.781 7.805 0.176 1.00 11.90 C ATOM 2295 CG1 VAL B 75 12.322 7.727 1.663 1.00 13.09 C ATOM 2296 CG2 VAL B 75 11.741 7.167 -0.743 1.00 14.18 C ATOM 2297 HA VAL B 75 12.154 9.824 -0.218 1.00 0.00 H ATOM 2298 HB VAL B 75 13.709 7.241 0.081 1.00 0.00 H ATOM 2299 HG11 VAL B 75 13.110 8.118 2.306 1.00 0.00 H ATOM 2300 HG12 VAL B 75 11.417 8.320 1.794 1.00 0.00 H ATOM 2301 HG13 VAL B 75 12.119 6.689 1.925 1.00 0.00 H ATOM 2302 HG21 VAL B 75 10.816 7.741 -0.696 1.00 0.00 H ATOM 2303 HG22 VAL B 75 12.116 7.162 -1.766 1.00 0.00 H ATOM 2304 HG23 VAL B 75 11.551 6.143 -0.420 1.00 0.00 H ATOM 2305 H VAL B 75 14.512 8.734 -1.816 1.00 0.00 H ATOM 2306 N TYR B 76 13.626 10.811 1.522 1.00 12.28 N ATOM 2307 CA TYR B 76 14.484 11.419 2.547 1.00 13.32 C ATOM 2308 C TYR B 76 13.955 11.013 3.922 1.00 13.51 C ATOM 2309 O TYR B 76 12.814 11.314 4.255 1.00 14.68 O ATOM 2310 CB TYR B 76 14.546 12.943 2.420 1.00 12.95 C ATOM 2311 CG TYR B 76 15.579 13.542 3.357 1.00 13.08 C ATOM 2312 CD1 TYR B 76 16.926 13.612 3.002 1.00 13.02 C ATOM 2313 CD2 TYR B 76 15.219 13.997 4.618 1.00 13.48 C ATOM 2314 CE1 TYR B 76 17.846 14.128 3.867 1.00 12.59 C ATOM 2315 CE2 TYR B 76 16.163 14.542 5.490 1.00 12.85 C ATOM 2316 CZ TYR B 76 17.467 14.617 5.100 1.00 14.45 C ATOM 2317 OH TYR B 76 18.432 15.135 5.946 1.00 15.25 O ATOM 2318 HA TYR B 76 15.503 11.057 2.411 1.00 0.00 H ATOM 2319 HB3 TYR B 76 13.567 13.358 2.661 1.00 0.00 H ATOM 2320 HB2 TYR B 76 14.807 13.202 1.394 1.00 0.00 H ATOM 2321 HD2 TYR B 76 14.178 13.927 4.934 1.00 0.00 H ATOM 2322 HE2 TYR B 76 15.861 14.904 6.473 1.00 0.00 H ATOM 2323 HE1 TYR B 76 18.897 14.154 3.579 1.00 0.00 H ATOM 2324 HD1 TYR B 76 17.246 13.251 2.025 1.00 0.00 H ATOM 2325 HH TYR B 76 18.203 16.071 6.172 1.00 0.00 H ATOM 2326 H TYR B 76 12.641 11.133 1.431 1.00 0.00 H ATOM 2327 N CYS B 77 14.766 10.293 4.685 1.00 14.54 N ATOM 2328 CA CYS B 77 14.289 9.621 5.879 1.00 13.99 C ATOM 2329 C CYS B 77 15.125 9.965 7.126 1.00 14.72 C ATOM 2330 O CYS B 77 14.958 9.331 8.176 1.00 13.86 O ATOM 2331 CB CYS B 77 14.231 8.099 5.630 1.00 15.15 C ATOM 2332 SG CYS B 77 15.692 7.332 5.002 1.00 17.49 S ATOM 2333 HA CYS B 77 13.283 9.983 6.090 1.00 0.00 H ATOM 2334 HB2 CYS B 77 13.429 7.913 4.916 1.00 0.00 H ATOM 2335 HB3 CYS B 77 13.990 7.620 6.579 1.00 0.00 H ATOM 2336 HG CYS B 77 16.729 7.523 5.892 1.00 0.00 H ATOM 2337 H CYS B 77 15.768 10.208 4.421 1.00 0.00 H ATOM 2338 N SER B 78 16.026 10.952 7.020 1.00 12.60 N ATOM 2339 CA SER B 78 16.855 11.312 8.169 1.00 14.54 C ATOM 2340 C SER B 78 15.980 11.738 9.327 1.00 15.49 C ATOM 2341 O SER B 78 15.009 12.469 9.142 1.00 16.98 O ATOM 2342 CB SER B 78 17.831 12.441 7.829 1.00 14.94 C ATOM 2343 OG SER B 78 18.782 12.602 8.887 1.00 17.30 O ATOM 2344 HA SER B 78 17.434 10.431 8.446 1.00 0.00 H ATOM 2345 HB2 SER B 78 17.277 13.370 7.697 1.00 0.00 H ATOM 2346 HB3 SER B 78 18.356 12.198 6.905 1.00 0.00 H ATOM 2347 HG SER B 78 19.287 11.759 9.006 1.00 0.00 H ATOM 2348 H SER B 78 16.135 11.462 6.120 1.00 0.00 H ATOM 2349 N ASN B 79 16.328 11.286 10.525 1.00 16.09 N ATOM 2350 CA ASN B 79 15.596 11.605 11.760 1.00 16.85 C ATOM 2351 C ASN B 79 14.177 11.074 11.766 1.00 16.26 C ATOM 2352 O ASN B 79 13.364 11.479 12.587 1.00 15.85 O ATOM 2353 CB ASN B 79 15.622 13.098 12.092 1.00 17.61 C ATOM 2354 CG ASN B 79 16.961 13.549 12.648 1.00 19.93 C ATOM 2355 OD1 ASN B 79 17.610 12.839 13.427 1.00 25.44 O ATOM 2356 ND2 ASN B 79 17.393 14.728 12.233 1.00 26.11 N ATOM 2357 HA ASN B 79 16.135 11.083 12.551 1.00 0.00 H ATOM 2358 HB2 ASN B 79 15.413 13.662 11.183 1.00 0.00 H ATOM 2359 HB3 ASN B 79 14.849 13.305 12.832 1.00 0.00 H ATOM 2360 HD22 ASN B 79 16.815 15.292 11.578 1.00 0.00 H ATOM 2361 HD21 ASN B 79 18.310 15.091 12.562 1.00 0.00 H ATOM 2362 H ASN B 79 17.165 10.672 10.594 1.00 0.00 H ATOM 2363 N ASP B 80 13.892 10.139 10.869 1.00 15.48 N ATOM 2364 CA ASP B 80 12.622 9.413 10.940 1.00 13.87 C ATOM 2365 C ASP B 80 12.966 8.010 11.413 1.00 14.06 C ATOM 2366 O ASP B 80 14.080 7.526 11.189 1.00 14.39 O ATOM 2367 CB ASP B 80 11.983 9.311 9.544 1.00 13.99 C ATOM 2368 CG ASP B 80 10.573 8.797 9.585 1.00 15.00 C ATOM 2369 OD1 ASP B 80 9.679 9.638 9.762 1.00 17.87 O ATOM 2370 OD2 ASP B 80 10.370 7.583 9.476 1.00 15.51 O ATOM 2371 HA ASP B 80 11.923 9.922 11.604 1.00 0.00 H ATOM 2372 HB2 ASP B 80 11.980 10.302 9.089 1.00 0.00 H ATOM 2373 HB3 ASP B 80 12.583 8.635 8.935 1.00 0.00 H ATOM 2374 H ASP B 80 14.572 9.921 10.113 1.00 0.00 H ATOM 2375 N LEU B 81 11.995 7.342 12.049 1.00 13.73 N ATOM 2376 CA LEU B 81 12.085 5.915 12.352 1.00 14.40 C ATOM 2377 C LEU B 81 12.640 5.130 11.166 1.00 14.14 C ATOM 2378 O LEU B 81 13.474 4.231 11.294 1.00 14.94 O ATOM 2379 CB LEU B 81 10.686 5.407 12.730 1.00 15.18 C ATOM 2380 CG LEU B 81 10.474 3.903 12.926 1.00 16.48 C ATOM 2381 CD1 LEU B 81 11.317 3.401 14.088 1.00 17.71 C ATOM 2382 CD2 LEU B 81 8.975 3.601 13.177 1.00 15.53 C ATOM 2383 HA LEU B 81 12.772 5.767 13.185 1.00 0.00 H ATOM 2384 HB2 LEU B 81 10.410 5.894 13.665 1.00 0.00 H ATOM 2385 HB3 LEU B 81 10.005 5.726 11.941 1.00 0.00 H ATOM 2386 HG LEU B 81 10.786 3.384 12.020 1.00 0.00 H ATOM 2387 HD21 LEU B 81 8.644 4.128 14.072 1.00 0.00 H ATOM 2388 HD22 LEU B 81 8.390 3.935 12.320 1.00 0.00 H ATOM 2389 HD23 LEU B 81 8.840 2.528 13.314 1.00 0.00 H ATOM 2390 HD11 LEU B 81 12.370 3.589 13.879 1.00 0.00 H ATOM 2391 HD12 LEU B 81 11.027 3.925 14.999 1.00 0.00 H ATOM 2392 HD13 LEU B 81 11.156 2.331 14.216 1.00 0.00 H ATOM 2393 H LEU B 81 11.141 7.860 12.339 1.00 0.00 H ATOM 2394 N LEU B 82 12.179 5.459 9.960 1.00 12.85 N ATOM 2395 CA LEU B 82 12.653 4.734 8.789 1.00 13.28 C ATOM 2396 C LEU B 82 14.170 4.930 8.558 1.00 13.40 C ATOM 2397 O LEU B 82 14.877 3.995 8.173 1.00 14.35 O ATOM 2398 CB LEU B 82 11.864 5.189 7.560 1.00 12.20 C ATOM 2399 CG LEU B 82 12.326 4.482 6.284 1.00 13.64 C ATOM 2400 CD1 LEU B 82 12.158 2.948 6.462 1.00 16.57 C ATOM 2401 CD2 LEU B 82 11.501 5.030 5.076 1.00 14.51 C ATOM 2402 HA LEU B 82 12.492 3.670 8.961 1.00 0.00 H ATOM 2403 HB2 LEU B 82 10.808 4.971 7.720 1.00 0.00 H ATOM 2404 HB3 LEU B 82 11.997 6.264 7.435 1.00 0.00 H ATOM 2405 HG LEU B 82 13.380 4.678 6.087 1.00 0.00 H ATOM 2406 HD21 LEU B 82 10.442 4.836 5.243 1.00 0.00 H ATOM 2407 HD22 LEU B 82 11.664 6.104 4.983 1.00 0.00 H ATOM 2408 HD23 LEU B 82 11.823 4.532 4.162 1.00 0.00 H ATOM 2409 HD11 LEU B 82 12.761 2.613 7.306 1.00 0.00 H ATOM 2410 HD12 LEU B 82 11.109 2.718 6.650 1.00 0.00 H ATOM 2411 HD13 LEU B 82 12.486 2.440 5.555 1.00 0.00 H ATOM 2412 H LEU B 82 11.486 6.227 9.856 1.00 0.00 H ATOM 2413 N GLY B 83 14.649 6.153 8.760 1.00 13.33 N ATOM 2414 CA GLY B 83 16.078 6.430 8.675 1.00 13.66 C ATOM 2415 C GLY B 83 16.876 5.636 9.709 1.00 15.10 C ATOM 2416 O GLY B 83 17.983 5.186 9.423 1.00 16.19 O ATOM 2417 HA3 GLY B 83 16.242 7.494 8.845 1.00 0.00 H ATOM 2418 HA2 GLY B 83 16.430 6.164 7.678 1.00 0.00 H ATOM 2419 H GLY B 83 13.992 6.928 8.983 1.00 0.00 H ATOM 2420 N ASP B 84 16.340 5.467 10.908 1.00 15.60 N ATOM 2421 CA ASP B 84 17.021 4.627 11.903 1.00 17.57 C ATOM 2422 C ASP B 84 17.110 3.157 11.458 1.00 19.13 C ATOM 2423 O ASP B 84 18.141 2.508 11.669 1.00 19.08 O ATOM 2424 CB ASP B 84 16.299 4.690 13.247 1.00 18.48 C ATOM 2425 CG ASP B 84 16.225 6.089 13.808 1.00 21.70 C ATOM 2426 OD1 ASP B 84 16.938 6.997 13.332 1.00 24.63 O ATOM 2427 OD2 ASP B 84 15.413 6.288 14.738 1.00 29.00 O ATOM 2428 HA ASP B 84 18.032 5.021 12.002 1.00 0.00 H ATOM 2429 HB2 ASP B 84 15.285 4.313 13.115 1.00 0.00 H ATOM 2430 HB3 ASP B 84 16.831 4.057 13.958 1.00 0.00 H ATOM 2431 H ASP B 84 15.438 5.928 11.145 1.00 0.00 H ATOM 2432 N LEU B 85 16.039 2.612 10.863 1.00 19.45 N ATOM 2433 CA LEU B 85 16.067 1.242 10.315 1.00 19.91 C ATOM 2434 C LEU B 85 17.116 1.047 9.239 1.00 20.93 C ATOM 2435 O LEU B 85 17.828 0.038 9.229 1.00 21.30 O ATOM 2436 CB LEU B 85 14.710 0.860 9.712 1.00 19.69 C ATOM 2437 CG LEU B 85 13.529 0.594 10.627 1.00 18.32 C ATOM 2438 CD1 LEU B 85 12.313 0.351 9.724 1.00 15.91 C ATOM 2439 CD2 LEU B 85 13.793 -0.627 11.526 1.00 15.80 C ATOM 2440 HA LEU B 85 16.313 0.604 11.164 1.00 0.00 H ATOM 2441 HB2 LEU B 85 14.419 1.674 9.048 1.00 0.00 H ATOM 2442 HB3 LEU B 85 14.867 -0.046 9.127 1.00 0.00 H ATOM 2443 HG LEU B 85 13.357 1.442 11.290 1.00 0.00 H ATOM 2444 HD21 LEU B 85 13.959 -1.506 10.903 1.00 0.00 H ATOM 2445 HD22 LEU B 85 14.676 -0.442 12.138 1.00 0.00 H ATOM 2446 HD23 LEU B 85 12.931 -0.795 12.171 1.00 0.00 H ATOM 2447 HD11 LEU B 85 12.136 1.234 9.110 1.00 0.00 H ATOM 2448 HD12 LEU B 85 12.505 -0.508 9.081 1.00 0.00 H ATOM 2449 HD13 LEU B 85 11.437 0.155 10.342 1.00 0.00 H ATOM 2450 H LEU B 85 15.165 3.170 10.786 1.00 0.00 H ATOM 2451 N PHE B 86 17.188 1.996 8.311 1.00 19.63 N ATOM 2452 CA PHE B 86 18.131 1.965 7.210 1.00 20.60 C ATOM 2453 C PHE B 86 19.554 2.293 7.615 1.00 19.41 C ATOM 2454 O PHE B 86 20.498 1.810 7.025 1.00 20.22 O ATOM 2455 CB PHE B 86 17.726 2.981 6.107 1.00 21.10 C ATOM 2456 CG PHE B 86 16.933 2.401 4.971 1.00 24.21 C ATOM 2457 CD1 PHE B 86 17.570 1.876 3.842 1.00 25.62 C ATOM 2458 CD2 PHE B 86 15.537 2.425 5.002 1.00 21.81 C ATOM 2459 CE1 PHE B 86 16.817 1.344 2.776 1.00 26.11 C ATOM 2460 CE2 PHE B 86 14.791 1.888 3.969 1.00 22.09 C ATOM 2461 CZ PHE B 86 15.408 1.364 2.856 1.00 24.69 C ATOM 2462 HA PHE B 86 18.099 0.938 6.846 1.00 0.00 H ATOM 2463 HB2 PHE B 86 17.128 3.765 6.572 1.00 0.00 H ATOM 2464 HB3 PHE B 86 18.637 3.416 5.696 1.00 0.00 H ATOM 2465 HD2 PHE B 86 15.027 2.874 5.854 1.00 0.00 H ATOM 2466 HE2 PHE B 86 13.703 1.880 4.037 1.00 0.00 H ATOM 2467 HZ PHE B 86 14.809 0.965 2.037 1.00 0.00 H ATOM 2468 HE1 PHE B 86 17.315 0.923 1.903 1.00 0.00 H ATOM 2469 HD1 PHE B 86 18.659 1.878 3.786 1.00 0.00 H ATOM 2470 H PHE B 86 16.534 2.802 8.378 1.00 0.00 H ATOM 2471 N GLY B 87 19.722 3.169 8.600 1.00 17.76 N ATOM 2472 CA GLY B 87 21.022 3.689 8.910 1.00 18.13 C ATOM 2473 C GLY B 87 21.558 4.688 7.882 1.00 17.68 C ATOM 2474 O GLY B 87 22.761 4.909 7.839 1.00 19.59 O ATOM 2475 HA3 GLY B 87 21.719 2.853 8.971 1.00 0.00 H ATOM 2476 HA2 GLY B 87 20.969 4.188 9.877 1.00 0.00 H ATOM 2477 H GLY B 87 18.899 3.482 9.154 1.00 0.00 H ATOM 2478 N VAL B 88 20.666 5.291 7.097 1.00 17.68 N ATOM 2479 CA VAL B 88 21.007 6.248 6.041 1.00 17.79 C ATOM 2480 C VAL B 88 19.990 7.409 6.068 1.00 15.65 C ATOM 2481 O VAL B 88 18.850 7.256 6.482 1.00 15.29 O ATOM 2482 CB VAL B 88 20.963 5.582 4.609 1.00 19.03 C ATOM 2483 CG1 VAL B 88 21.831 4.347 4.577 1.00 22.51 C ATOM 2484 CG2 VAL B 88 19.581 5.204 4.244 1.00 21.19 C ATOM 2485 HA VAL B 88 22.021 6.604 6.226 1.00 0.00 H ATOM 2486 HB VAL B 88 21.336 6.314 3.892 1.00 0.00 H ATOM 2487 HG11 VAL B 88 22.860 4.621 4.810 1.00 0.00 H ATOM 2488 HG12 VAL B 88 21.468 3.630 5.314 1.00 0.00 H ATOM 2489 HG13 VAL B 88 21.789 3.901 3.583 1.00 0.00 H ATOM 2490 HG21 VAL B 88 19.196 4.492 4.974 1.00 0.00 H ATOM 2491 HG22 VAL B 88 18.952 6.094 4.236 1.00 0.00 H ATOM 2492 HG23 VAL B 88 19.580 4.748 3.254 1.00 0.00 H ATOM 2493 H VAL B 88 19.661 5.068 7.244 1.00 0.00 H ATOM 2494 N PRO B 89 20.416 8.595 5.616 1.00 14.71 N ATOM 2495 CA PRO B 89 19.483 9.728 5.610 1.00 13.87 C ATOM 2496 C PRO B 89 18.544 9.749 4.406 1.00 13.29 C ATOM 2497 O PRO B 89 17.564 10.480 4.424 1.00 13.79 O ATOM 2498 CB PRO B 89 20.422 10.941 5.534 1.00 13.91 C ATOM 2499 CG PRO B 89 21.640 10.390 4.723 1.00 14.35 C ATOM 2500 CD PRO B 89 21.804 8.980 5.280 1.00 14.29 C ATOM 2501 HA PRO B 89 18.825 9.695 6.478 1.00 0.00 H ATOM 2502 HD3 PRO B 89 22.227 8.309 4.532 1.00 0.00 H ATOM 2503 HD2 PRO B 89 22.437 8.979 6.167 1.00 0.00 H ATOM 2504 HG3 PRO B 89 22.533 10.989 4.899 1.00 0.00 H ATOM 2505 HG2 PRO B 89 21.424 10.368 3.655 1.00 0.00 H ATOM 2506 HB2 PRO B 89 19.947 11.773 5.013 1.00 0.00 H ATOM 2507 HB3 PRO B 89 20.727 11.264 6.529 1.00 0.00 H ATOM 2508 N SER B 90 18.827 8.936 3.380 1.00 12.42 N ATOM 2509 CA SER B 90 18.112 9.059 2.119 1.00 13.06 C ATOM 2510 C SER B 90 18.434 7.835 1.283 1.00 12.43 C ATOM 2511 O SER B 90 19.456 7.134 1.513 1.00 13.23 O ATOM 2512 CB SER B 90 18.604 10.323 1.393 1.00 12.57 C ATOM 2513 OG SER B 90 19.988 10.240 1.140 1.00 15.86 O ATOM 2514 HA SER B 90 17.037 9.132 2.283 1.00 0.00 H ATOM 2515 HB2 SER B 90 18.405 11.195 2.016 1.00 0.00 H ATOM 2516 HB3 SER B 90 18.072 10.424 0.447 1.00 0.00 H ATOM 2517 HG SER B 90 20.287 11.060 0.673 1.00 0.00 H ATOM 2518 H SER B 90 19.564 8.210 3.486 1.00 0.00 H ATOM 2519 N PHE B 91 17.576 7.595 0.306 1.00 12.76 N ATOM 2520 CA PHE B 91 17.798 6.516 -0.676 1.00 12.11 C ATOM 2521 C PHE B 91 16.875 6.746 -1.833 1.00 12.70 C ATOM 2522 O PHE B 91 15.888 7.479 -1.713 1.00 13.13 O ATOM 2523 CB PHE B 91 17.597 5.104 -0.089 1.00 12.95 C ATOM 2524 CG PHE B 91 16.199 4.828 0.397 1.00 11.92 C ATOM 2525 CD1 PHE B 91 15.262 4.201 -0.438 1.00 12.72 C ATOM 2526 CD2 PHE B 91 15.826 5.180 1.703 1.00 12.16 C ATOM 2527 CE1 PHE B 91 13.939 3.930 0.057 1.00 14.09 C ATOM 2528 CE2 PHE B 91 14.549 4.940 2.166 1.00 14.94 C ATOM 2529 CZ PHE B 91 13.596 4.309 1.333 1.00 14.14 C ATOM 2530 HA PHE B 91 18.840 6.552 -0.994 1.00 0.00 H ATOM 2531 HB2 PHE B 91 17.840 4.375 -0.862 1.00 0.00 H ATOM 2532 HB3 PHE B 91 18.281 4.983 0.751 1.00 0.00 H ATOM 2533 HD2 PHE B 91 16.556 5.650 2.362 1.00 0.00 H ATOM 2534 HE2 PHE B 91 14.273 5.238 3.178 1.00 0.00 H ATOM 2535 HZ PHE B 91 12.588 4.123 1.703 1.00 0.00 H ATOM 2536 HE1 PHE B 91 13.211 3.426 -0.578 1.00 0.00 H ATOM 2537 HD1 PHE B 91 15.535 3.921 -1.455 1.00 0.00 H ATOM 2538 H PHE B 91 16.721 8.183 0.227 1.00 0.00 H ATOM 2539 N SER B 92 17.168 6.120 -2.957 1.00 12.21 N ATOM 2540 CA SER B 92 16.213 6.105 -4.062 1.00 12.17 C ATOM 2541 C SER B 92 15.487 4.747 -4.026 1.00 12.75 C ATOM 2542 O SER B 92 16.102 3.710 -3.754 1.00 12.57 O ATOM 2543 CB SER B 92 16.983 6.235 -5.385 1.00 12.84 C ATOM 2544 OG SER B 92 16.115 5.966 -6.495 1.00 13.30 O ATOM 2545 HA SER B 92 15.500 6.925 -3.977 1.00 0.00 H ATOM 2546 HB2 SER B 92 17.808 5.523 -5.393 1.00 0.00 H ATOM 2547 HB3 SER B 92 17.378 7.247 -5.474 1.00 0.00 H ATOM 2548 HG SER B 92 15.366 6.614 -6.491 1.00 0.00 H ATOM 2549 H SER B 92 18.083 5.635 -3.057 1.00 0.00 H ATOM 2550 N VAL B 93 14.203 4.762 -4.330 1.00 12.58 N ATOM 2551 CA VAL B 93 13.422 3.526 -4.483 1.00 12.15 C ATOM 2552 C VAL B 93 14.023 2.598 -5.559 1.00 13.82 C ATOM 2553 O VAL B 93 13.827 1.390 -5.499 1.00 14.98 O ATOM 2554 CB VAL B 93 11.933 3.863 -4.813 1.00 11.68 C ATOM 2555 CG1 VAL B 93 11.119 2.560 -5.055 1.00 11.79 C ATOM 2556 CG2 VAL B 93 11.350 4.670 -3.648 1.00 12.85 C ATOM 2557 HA VAL B 93 13.460 2.990 -3.535 1.00 0.00 H ATOM 2558 HB VAL B 93 11.878 4.454 -5.727 1.00 0.00 H ATOM 2559 HG11 VAL B 93 11.552 2.013 -5.892 1.00 0.00 H ATOM 2560 HG12 VAL B 93 11.152 1.941 -4.159 1.00 0.00 H ATOM 2561 HG13 VAL B 93 10.085 2.816 -5.283 1.00 0.00 H ATOM 2562 HG21 VAL B 93 11.405 4.078 -2.734 1.00 0.00 H ATOM 2563 HG22 VAL B 93 11.922 5.589 -3.522 1.00 0.00 H ATOM 2564 HG23 VAL B 93 10.309 4.914 -3.862 1.00 0.00 H ATOM 2565 H VAL B 93 13.728 5.677 -4.466 1.00 0.00 H ATOM 2566 N LYS B 94 14.800 3.145 -6.489 1.00 12.35 N ATOM 2567 CA LYS B 94 15.483 2.296 -7.469 1.00 13.31 C ATOM 2568 C LYS B 94 16.602 1.405 -6.880 1.00 13.08 C ATOM 2569 O LYS B 94 17.079 0.499 -7.589 1.00 13.47 O ATOM 2570 CB LYS B 94 16.025 3.166 -8.586 1.00 13.78 C ATOM 2571 CG LYS B 94 14.944 3.934 -9.274 1.00 16.01 C ATOM 2572 CD LYS B 94 15.584 4.600 -10.477 1.00 24.82 C ATOM 2573 CE LYS B 94 15.077 6.014 -10.639 1.00 30.32 C ATOM 2574 NZ LYS B 94 15.506 6.657 -11.932 1.00 36.20 N ATOM 2575 HA LYS B 94 14.738 1.596 -7.848 1.00 0.00 H ATOM 2576 HB2 LYS B 94 16.744 3.870 -8.167 1.00 0.00 H ATOM 2577 HB3 LYS B 94 16.524 2.530 -9.317 1.00 0.00 H ATOM 2578 HG2 LYS B 94 14.150 3.260 -9.595 1.00 0.00 H ATOM 2579 HG3 LYS B 94 14.531 4.687 -8.602 1.00 0.00 H ATOM 2580 HD2 LYS B 94 16.665 4.621 -10.341 1.00 0.00 H ATOM 2581 HD3 LYS B 94 15.342 4.028 -11.373 1.00 0.00 H ATOM 2582 HE2 LYS B 94 15.455 6.614 -9.812 1.00 0.00 H ATOM 2583 HE3 LYS B 94 13.988 5.997 -10.606 1.00 0.00 H ATOM 2584 HZ1 LYS B 94 16.545 6.690 -11.974 1.00 0.00 H ATOM 2585 HZ2 LYS B 94 15.143 6.100 -12.732 1.00 0.00 H ATOM 2586 HZ3 LYS B 94 15.125 7.624 -11.980 1.00 0.00 H ATOM 2587 H LYS B 94 14.923 4.177 -6.521 1.00 0.00 H ATOM 2588 N GLU B 95 17.045 1.695 -5.648 1.00 12.84 N ATOM 2589 CA GLU B 95 18.162 0.947 -4.995 1.00 12.85 C ATOM 2590 C GLU B 95 17.635 -0.310 -4.333 1.00 12.33 C ATOM 2591 O GLU B 95 17.521 -0.397 -3.116 1.00 13.49 O ATOM 2592 CB GLU B 95 18.851 1.847 -3.969 1.00 13.86 C ATOM 2593 CG GLU B 95 19.457 3.093 -4.645 1.00 14.89 C ATOM 2594 CD GLU B 95 20.228 3.885 -3.633 1.00 17.82 C ATOM 2595 OE1 GLU B 95 19.677 4.829 -3.080 1.00 15.26 O ATOM 2596 OE2 GLU B 95 21.403 3.541 -3.315 1.00 20.50 O ATOM 2597 HA GLU B 95 18.889 0.654 -5.752 1.00 0.00 H ATOM 2598 HB2 GLU B 95 18.120 2.165 -3.225 1.00 0.00 H ATOM 2599 HB3 GLU B 95 19.646 1.285 -3.479 1.00 0.00 H ATOM 2600 HG2 GLU B 95 20.124 2.782 -5.449 1.00 0.00 H ATOM 2601 HG3 GLU B 95 18.657 3.709 -5.056 1.00 0.00 H ATOM 2602 H GLU B 95 16.593 2.472 -5.126 1.00 0.00 H ATOM 2603 N HIS B 96 17.287 -1.295 -5.163 1.00 13.17 N ATOM 2604 CA HIS B 96 16.577 -2.482 -4.646 1.00 13.26 C ATOM 2605 C HIS B 96 17.465 -3.315 -3.711 1.00 12.78 C ATOM 2606 O HIS B 96 17.000 -3.776 -2.667 1.00 12.90 O ATOM 2607 CB HIS B 96 16.114 -3.325 -5.812 1.00 13.12 C ATOM 2608 CG HIS B 96 15.038 -2.663 -6.612 1.00 15.10 C ATOM 2609 ND1 HIS B 96 14.386 -3.301 -7.651 1.00 18.21 N ATOM 2610 CD2 HIS B 96 14.491 -1.425 -6.516 1.00 17.15 C ATOM 2611 CE1 HIS B 96 13.500 -2.465 -8.175 1.00 19.58 C ATOM 2612 NE2 HIS B 96 13.527 -1.334 -7.490 1.00 17.25 N ATOM 2613 HA HIS B 96 15.720 -2.145 -4.063 1.00 0.00 H ATOM 2614 HB2 HIS B 96 16.966 -3.516 -6.464 1.00 0.00 H ATOM 2615 HB3 HIS B 96 15.732 -4.271 -5.429 1.00 0.00 H ATOM 2616 HD2 HIS B 96 14.765 -0.649 -5.801 1.00 0.00 H ATOM 2617 HE1 HIS B 96 12.856 -2.675 -9.029 1.00 0.00 H ATOM 2618 H HIS B 96 17.516 -1.227 -6.175 1.00 0.00 H ATOM 2619 N ARG B 97 18.748 -3.455 -4.030 1.00 13.68 N ATOM 2620 CA ARG B 97 19.638 -4.192 -3.125 1.00 14.27 C ATOM 2621 C ARG B 97 19.664 -3.535 -1.755 1.00 14.44 C ATOM 2622 O ARG B 97 19.546 -4.185 -0.718 1.00 14.61 O ATOM 2623 CB ARG B 97 21.062 -4.273 -3.685 1.00 14.55 C ATOM 2624 CG ARG B 97 21.994 -4.962 -2.692 1.00 15.19 C ATOM 2625 CD ARG B 97 23.312 -5.368 -3.279 1.00 18.84 C ATOM 2626 NE ARG B 97 24.119 -6.063 -2.244 1.00 20.21 N ATOM 2627 CZ ARG B 97 25.307 -6.656 -2.451 1.00 21.41 C ATOM 2628 NH1 ARG B 97 25.844 -6.697 -3.674 1.00 22.91 N ATOM 2629 NH2 ARG B 97 25.962 -7.224 -1.433 1.00 19.71 N ATOM 2630 HA ARG B 97 19.247 -5.205 -3.032 1.00 0.00 H ATOM 2631 HB2 ARG B 97 21.049 -4.839 -4.616 1.00 0.00 H ATOM 2632 HB3 ARG B 97 21.428 -3.265 -3.880 1.00 0.00 H ATOM 2633 HG2 ARG B 97 22.182 -4.277 -1.865 1.00 0.00 H ATOM 2634 HG3 ARG B 97 21.496 -5.855 -2.316 1.00 0.00 H ATOM 2635 HD2 ARG B 97 23.846 -4.482 -3.623 1.00 0.00 H ATOM 2636 HD3 ARG B 97 23.144 -6.039 -4.121 1.00 0.00 H ATOM 2637 HE ARG B 97 23.733 -6.093 -1.279 1.00 0.00 H ATOM 2638 HH12 ARG B 97 26.764 -7.159 -3.823 1.00 0.00 H ATOM 2639 HH11 ARG B 97 25.342 -6.267 -4.477 1.00 0.00 H ATOM 2640 HH22 ARG B 97 26.881 -7.682 -1.597 1.00 0.00 H ATOM 2641 HH21 ARG B 97 25.552 -7.208 -0.477 1.00 0.00 H ATOM 2642 H ARG B 97 19.117 -3.046 -4.912 1.00 0.00 H ATOM 2643 N LYS B 98 19.817 -2.213 -1.734 1.00 14.83 N ATOM 2644 CA LYS B 98 19.847 -1.499 -0.451 1.00 15.93 C ATOM 2645 C LYS B 98 18.565 -1.673 0.392 1.00 15.43 C ATOM 2646 O LYS B 98 18.598 -1.887 1.631 1.00 14.87 O ATOM 2647 CB LYS B 98 20.152 -0.005 -0.716 1.00 16.71 C ATOM 2648 CG LYS B 98 20.339 0.864 0.533 1.00 21.96 C ATOM 2649 CD LYS B 98 20.738 2.326 0.172 1.00 24.56 C ATOM 2650 CE LYS B 98 22.149 2.393 -0.448 1.00 27.13 C ATOM 2651 NZ LYS B 98 22.568 3.806 -0.779 1.00 25.62 N ATOM 2652 HA LYS B 98 20.638 -1.943 0.153 1.00 0.00 H ATOM 2653 HB2 LYS B 98 21.068 0.051 -1.304 1.00 0.00 H ATOM 2654 HB3 LYS B 98 19.325 0.409 -1.293 1.00 0.00 H ATOM 2655 HG2 LYS B 98 19.404 0.882 1.093 1.00 0.00 H ATOM 2656 HG3 LYS B 98 21.123 0.427 1.152 1.00 0.00 H ATOM 2657 HD2 LYS B 98 20.018 2.723 -0.543 1.00 0.00 H ATOM 2658 HD3 LYS B 98 20.720 2.932 1.078 1.00 0.00 H ATOM 2659 HE2 LYS B 98 22.157 1.802 -1.364 1.00 0.00 H ATOM 2660 HE3 LYS B 98 22.863 1.973 0.261 1.00 0.00 H ATOM 2661 HZ1 LYS B 98 21.898 4.214 -1.461 1.00 0.00 H ATOM 2662 HZ2 LYS B 98 22.572 4.378 0.090 1.00 0.00 H ATOM 2663 HZ3 LYS B 98 23.522 3.795 -1.192 1.00 0.00 H ATOM 2664 H LYS B 98 19.915 -1.686 -2.625 1.00 0.00 H ATOM 2665 N ILE B 99 17.417 -1.569 -0.276 1.00 14.69 N ATOM 2666 CA ILE B 99 16.141 -1.691 0.405 1.00 14.17 C ATOM 2667 C ILE B 99 15.917 -3.118 0.924 1.00 14.15 C ATOM 2668 O ILE B 99 15.541 -3.315 2.073 1.00 14.06 O ATOM 2669 CB ILE B 99 15.011 -1.202 -0.529 1.00 14.54 C ATOM 2670 CG1 ILE B 99 15.235 0.293 -0.815 1.00 12.58 C ATOM 2671 CG2 ILE B 99 13.634 -1.508 0.056 1.00 15.51 C ATOM 2672 CD1 ILE B 99 14.414 0.859 -2.049 1.00 13.48 C ATOM 2673 HA ILE B 99 16.139 -1.054 1.290 1.00 0.00 H ATOM 2674 HB ILE B 99 15.040 -1.740 -1.477 1.00 0.00 H ATOM 2675 HG12 ILE B 99 14.947 0.856 0.073 1.00 0.00 H ATOM 2676 HG13 ILE B 99 16.296 0.447 -1.013 1.00 0.00 H ATOM 2677 HD11 ILE B 99 14.698 0.318 -2.952 1.00 0.00 H ATOM 2678 HD12 ILE B 99 13.348 0.728 -1.865 1.00 0.00 H ATOM 2679 HD13 ILE B 99 14.635 1.919 -2.175 1.00 0.00 H ATOM 2680 HG21 ILE B 99 13.530 -2.584 0.192 1.00 0.00 H ATOM 2681 HG22 ILE B 99 13.530 -1.007 1.018 1.00 0.00 H ATOM 2682 HG23 ILE B 99 12.863 -1.151 -0.627 1.00 0.00 H ATOM 2683 H ILE B 99 17.435 -1.398 -1.302 1.00 0.00 H ATOM 2684 N TYR B 100 16.148 -4.122 0.068 1.00 13.95 N ATOM 2685 CA TYR B 100 16.013 -5.491 0.525 1.00 13.52 C ATOM 2686 C TYR B 100 16.965 -5.765 1.682 1.00 13.66 C ATOM 2687 O TYR B 100 16.591 -6.440 2.652 1.00 13.06 O ATOM 2688 CB TYR B 100 16.304 -6.510 -0.603 1.00 13.73 C ATOM 2689 CG TYR B 100 15.068 -6.928 -1.366 1.00 15.70 C ATOM 2690 CD1 TYR B 100 14.430 -6.048 -2.210 1.00 14.61 C ATOM 2691 CD2 TYR B 100 14.596 -8.243 -1.291 1.00 17.41 C ATOM 2692 CE1 TYR B 100 13.275 -6.440 -2.932 1.00 17.01 C ATOM 2693 CE2 TYR B 100 13.458 -8.650 -1.991 1.00 17.42 C ATOM 2694 CZ TYR B 100 12.798 -7.731 -2.796 1.00 18.43 C ATOM 2695 OH TYR B 100 11.676 -8.110 -3.475 1.00 18.50 O ATOM 2696 HA TYR B 100 14.979 -5.612 0.849 1.00 0.00 H ATOM 2697 HB3 TYR B 100 16.754 -7.398 -0.159 1.00 0.00 H ATOM 2698 HB2 TYR B 100 17.007 -6.059 -1.303 1.00 0.00 H ATOM 2699 HD2 TYR B 100 15.128 -8.966 -0.673 1.00 0.00 H ATOM 2700 HE2 TYR B 100 13.093 -9.674 -1.907 1.00 0.00 H ATOM 2701 HE1 TYR B 100 12.768 -5.732 -3.587 1.00 0.00 H ATOM 2702 HD1 TYR B 100 14.818 -5.036 -2.325 1.00 0.00 H ATOM 2703 HH TYR B 100 11.332 -7.342 -3.997 1.00 0.00 H ATOM 2704 H TYR B 100 16.422 -3.921 -0.915 1.00 0.00 H ATOM 2705 N THR B 101 18.200 -5.273 1.589 1.00 13.02 N ATOM 2706 CA THR B 101 19.170 -5.520 2.653 1.00 13.74 C ATOM 2707 C THR B 101 18.738 -4.891 3.978 1.00 13.40 C ATOM 2708 O THR B 101 18.844 -5.527 5.029 1.00 13.39 O ATOM 2709 CB THR B 101 20.545 -4.964 2.241 1.00 12.83 C ATOM 2710 OG1 THR B 101 20.996 -5.640 1.064 1.00 15.98 O ATOM 2711 CG2 THR B 101 21.547 -5.216 3.381 1.00 15.16 C ATOM 2712 HA THR B 101 19.231 -6.598 2.801 1.00 0.00 H ATOM 2713 HB THR B 101 20.466 -3.895 2.042 1.00 0.00 H ATOM 2714 HG1 THR B 101 20.346 -5.494 0.332 1.00 0.00 H ATOM 2715 HG23 THR B 101 21.208 -4.703 4.281 1.00 0.00 H ATOM 2716 HG21 THR B 101 21.613 -6.287 3.575 1.00 0.00 H ATOM 2717 HG22 THR B 101 22.527 -4.836 3.092 1.00 0.00 H ATOM 2718 H THR B 101 18.474 -4.712 0.757 1.00 0.00 H ATOM 2719 N MET B 102 18.264 -3.637 3.950 1.00 15.41 N ATOM 2720 CA MET B 102 17.631 -3.005 5.146 1.00 15.87 C ATOM 2721 C MET B 102 16.582 -3.875 5.796 1.00 16.33 C ATOM 2722 O MET B 102 16.543 -4.070 7.032 1.00 16.87 O ATOM 2723 CB MET B 102 16.908 -1.707 4.766 1.00 15.31 C ATOM 2724 CG MET B 102 16.132 -1.060 5.956 1.00 15.11 C ATOM 2725 SD MET B 102 14.491 -1.655 6.464 1.00 14.25 S ATOM 2726 CE MET B 102 13.559 -0.791 5.189 1.00 18.87 C ATOM 2727 HA MET B 102 18.458 -2.834 5.835 1.00 0.00 H ATOM 2728 HB2 MET B 102 17.647 -0.992 4.405 1.00 0.00 H ATOM 2729 HB3 MET B 102 16.198 -1.927 3.969 1.00 0.00 H ATOM 2730 HG2 MET B 102 16.012 -0.006 5.707 1.00 0.00 H ATOM 2731 HG3 MET B 102 16.777 -1.155 6.830 1.00 0.00 H ATOM 2732 HE1 MET B 102 13.721 0.282 5.287 1.00 0.00 H ATOM 2733 HE2 MET B 102 13.896 -1.122 4.207 1.00 0.00 H ATOM 2734 HE3 MET B 102 12.498 -1.012 5.304 1.00 0.00 H ATOM 2735 H MET B 102 18.339 -3.088 3.070 1.00 0.00 H ATOM 2736 N ILE B 103 15.673 -4.395 4.970 1.00 15.88 N ATOM 2737 CA ILE B 103 14.616 -5.225 5.499 1.00 16.85 C ATOM 2738 C ILE B 103 15.201 -6.447 6.164 1.00 15.45 C ATOM 2739 O ILE B 103 14.881 -6.755 7.293 1.00 15.90 O ATOM 2740 CB ILE B 103 13.557 -5.558 4.417 1.00 17.86 C ATOM 2741 CG1 ILE B 103 13.024 -4.216 3.884 1.00 19.56 C ATOM 2742 CG2 ILE B 103 12.525 -6.504 4.988 1.00 18.99 C ATOM 2743 CD1 ILE B 103 12.009 -4.307 2.657 1.00 23.33 C ATOM 2744 HA ILE B 103 14.078 -4.670 6.268 1.00 0.00 H ATOM 2745 HB ILE B 103 13.962 -6.099 3.562 1.00 0.00 H ATOM 2746 HG12 ILE B 103 12.513 -3.710 4.703 1.00 0.00 H ATOM 2747 HG13 ILE B 103 13.879 -3.619 3.567 1.00 0.00 H ATOM 2748 HD11 ILE B 103 12.501 -4.795 1.815 1.00 0.00 H ATOM 2749 HD12 ILE B 103 11.134 -4.886 2.953 1.00 0.00 H ATOM 2750 HD13 ILE B 103 11.701 -3.303 2.367 1.00 0.00 H ATOM 2751 HG21 ILE B 103 13.015 -7.423 5.310 1.00 0.00 H ATOM 2752 HG22 ILE B 103 12.036 -6.034 5.841 1.00 0.00 H ATOM 2753 HG23 ILE B 103 11.783 -6.735 4.224 1.00 0.00 H ATOM 2754 H ILE B 103 15.725 -4.204 3.949 1.00 0.00 H ATOM 2755 N TYR B 104 16.077 -7.178 5.481 1.00 14.70 N ATOM 2756 CA TYR B 104 16.633 -8.383 6.091 1.00 14.72 C ATOM 2757 C TYR B 104 17.386 -8.109 7.405 1.00 13.73 C ATOM 2758 O TYR B 104 17.361 -8.920 8.316 1.00 13.54 O ATOM 2759 CB TYR B 104 17.589 -9.119 5.126 1.00 14.70 C ATOM 2760 CG TYR B 104 16.959 -10.074 4.130 1.00 14.65 C ATOM 2761 CD1 TYR B 104 16.410 -9.590 2.940 1.00 16.55 C ATOM 2762 CD2 TYR B 104 16.935 -11.426 4.358 1.00 14.71 C ATOM 2763 CE1 TYR B 104 15.845 -10.465 2.006 1.00 16.87 C ATOM 2764 CE2 TYR B 104 16.382 -12.297 3.436 1.00 13.48 C ATOM 2765 CZ TYR B 104 15.844 -11.798 2.256 1.00 12.96 C ATOM 2766 OH TYR B 104 15.278 -12.639 1.308 1.00 13.26 O ATOM 2767 HA TYR B 104 15.769 -9.009 6.315 1.00 0.00 H ATOM 2768 HB3 TYR B 104 18.292 -9.691 5.731 1.00 0.00 H ATOM 2769 HB2 TYR B 104 18.132 -8.362 4.559 1.00 0.00 H ATOM 2770 HD2 TYR B 104 17.359 -11.821 5.281 1.00 0.00 H ATOM 2771 HE2 TYR B 104 16.368 -13.369 3.634 1.00 0.00 H ATOM 2772 HE1 TYR B 104 15.409 -10.079 1.085 1.00 0.00 H ATOM 2773 HD1 TYR B 104 16.422 -8.519 2.737 1.00 0.00 H ATOM 2774 HH TYR B 104 14.520 -13.129 1.714 1.00 0.00 H ATOM 2775 H TYR B 104 16.363 -6.895 4.522 1.00 0.00 H ATOM 2776 N ARG B 105 18.082 -6.971 7.471 1.00 13.25 N ATOM 2777 CA ARG B 105 18.819 -6.627 8.681 1.00 13.61 C ATOM 2778 C ARG B 105 17.842 -6.463 9.846 1.00 14.39 C ATOM 2779 O ARG B 105 18.219 -6.600 11.010 1.00 14.63 O ATOM 2780 CB ARG B 105 19.524 -5.317 8.469 1.00 13.44 C ATOM 2781 CG ARG B 105 20.792 -5.420 7.643 1.00 14.13 C ATOM 2782 CD ARG B 105 21.459 -4.045 7.561 1.00 16.97 C ATOM 2783 NE ARG B 105 22.602 -4.002 6.672 1.00 14.65 N ATOM 2784 CZ ARG B 105 23.136 -2.864 6.245 1.00 19.82 C ATOM 2785 NH1 ARG B 105 22.598 -1.691 6.673 1.00 19.80 N ATOM 2786 NH2 ARG B 105 24.180 -2.877 5.425 1.00 17.96 N ATOM 2787 HA ARG B 105 19.537 -7.417 8.903 1.00 0.00 H ATOM 2788 HB2 ARG B 105 18.839 -4.638 7.961 1.00 0.00 H ATOM 2789 HB3 ARG B 105 19.784 -4.906 9.445 1.00 0.00 H ATOM 2790 HG2 ARG B 105 21.475 -6.128 8.112 1.00 0.00 H ATOM 2791 HG3 ARG B 105 20.545 -5.765 6.639 1.00 0.00 H ATOM 2792 HD2 ARG B 105 21.790 -3.763 8.561 1.00 0.00 H ATOM 2793 HD3 ARG B 105 20.721 -3.325 7.207 1.00 0.00 H ATOM 2794 HE ARG B 105 23.021 -4.899 6.355 1.00 0.00 H ATOM 2795 HH12 ARG B 105 23.000 -0.787 6.352 1.00 0.00 H ATOM 2796 HH11 ARG B 105 21.785 -1.698 7.321 1.00 0.00 H ATOM 2797 HH22 ARG B 105 24.593 -1.981 5.095 1.00 0.00 H ATOM 2798 HH21 ARG B 105 24.585 -3.783 5.113 1.00 0.00 H ATOM 2799 H ARG B 105 18.098 -6.327 6.655 1.00 0.00 H ATOM 2800 N ASN B 106 16.585 -6.199 9.496 1.00 13.80 N ATOM 2801 CA ASN B 106 15.554 -5.933 10.498 1.00 14.06 C ATOM 2802 C ASN B 106 14.553 -7.079 10.621 1.00 14.66 C ATOM 2803 O ASN B 106 13.425 -6.865 11.049 1.00 15.14 O ATOM 2804 CB ASN B 106 14.869 -4.613 10.174 1.00 13.74 C ATOM 2805 CG ASN B 106 15.756 -3.406 10.525 1.00 14.48 C ATOM 2806 OD1 ASN B 106 15.947 -3.070 11.713 1.00 15.86 O ATOM 2807 ND2 ASN B 106 16.369 -2.805 9.495 1.00 15.02 N ATOM 2808 HA ASN B 106 16.032 -5.855 11.474 1.00 0.00 H ATOM 2809 HB2 ASN B 106 14.642 -4.586 9.108 1.00 0.00 H ATOM 2810 HB3 ASN B 106 13.942 -4.547 10.744 1.00 0.00 H ATOM 2811 HD22 ASN B 106 16.179 -3.119 8.522 1.00 0.00 H ATOM 2812 HD21 ASN B 106 17.035 -2.025 9.669 1.00 0.00 H ATOM 2813 H ASN B 106 16.331 -6.182 8.488 1.00 0.00 H ATOM 2814 N LEU B 107 14.959 -8.291 10.228 1.00 13.91 N ATOM 2815 CA LEU B 107 14.133 -9.522 10.410 1.00 14.41 C ATOM 2816 C LEU B 107 14.782 -10.480 11.373 1.00 16.39 C ATOM 2817 O LEU B 107 16.019 -10.545 11.437 1.00 17.05 O ATOM 2818 CB LEU B 107 13.907 -10.271 9.092 1.00 14.99 C ATOM 2819 CG LEU B 107 13.242 -9.549 7.949 1.00 16.39 C ATOM 2820 CD1 LEU B 107 13.250 -10.523 6.761 1.00 18.81 C ATOM 2821 CD2 LEU B 107 11.811 -9.158 8.347 1.00 17.33 C ATOM 2822 HA LEU B 107 13.176 -9.178 10.801 1.00 0.00 H ATOM 2823 HB2 LEU B 107 14.885 -10.599 8.738 1.00 0.00 H ATOM 2824 HB3 LEU B 107 13.294 -11.143 9.320 1.00 0.00 H ATOM 2825 HG LEU B 107 13.762 -8.628 7.687 1.00 0.00 H ATOM 2826 HD21 LEU B 107 11.243 -10.057 8.587 1.00 0.00 H ATOM 2827 HD22 LEU B 107 11.843 -8.504 9.219 1.00 0.00 H ATOM 2828 HD23 LEU B 107 11.334 -8.636 7.517 1.00 0.00 H ATOM 2829 HD11 LEU B 107 14.279 -10.784 6.514 1.00 0.00 H ATOM 2830 HD12 LEU B 107 12.699 -11.425 7.028 1.00 0.00 H ATOM 2831 HD13 LEU B 107 12.778 -10.049 5.901 1.00 0.00 H ATOM 2832 H LEU B 107 15.891 -8.380 9.776 1.00 0.00 H ATOM 2833 N VAL B 108 13.963 -11.230 12.113 1.00 16.68 N ATOM 2834 CA VAL B 108 14.436 -12.356 12.930 1.00 18.98 C ATOM 2835 C VAL B 108 14.465 -13.585 12.050 1.00 20.62 C ATOM 2836 O VAL B 108 13.436 -14.240 11.832 1.00 20.95 O ATOM 2837 CB VAL B 108 13.524 -12.662 14.110 1.00 18.60 C ATOM 2838 CG1 VAL B 108 14.091 -13.860 14.892 1.00 19.05 C ATOM 2839 CG2 VAL B 108 13.324 -11.426 15.009 1.00 17.35 C ATOM 2840 HA VAL B 108 15.416 -12.087 13.324 1.00 0.00 H ATOM 2841 HB VAL B 108 12.535 -12.927 13.737 1.00 0.00 H ATOM 2842 HG11 VAL B 108 14.144 -14.729 14.236 1.00 0.00 H ATOM 2843 HG12 VAL B 108 15.089 -13.616 15.255 1.00 0.00 H ATOM 2844 HG13 VAL B 108 13.440 -14.081 15.738 1.00 0.00 H ATOM 2845 HG21 VAL B 108 14.289 -11.099 15.396 1.00 0.00 H ATOM 2846 HG22 VAL B 108 12.874 -10.623 14.425 1.00 0.00 H ATOM 2847 HG23 VAL B 108 12.667 -11.685 15.840 1.00 0.00 H ATOM 2848 H VAL B 108 12.947 -11.008 12.111 1.00 0.00 H ATOM 2849 N VAL B 109 15.645 -13.914 11.552 1.00 22.99 N ATOM 2850 CA VAL B 109 15.768 -15.032 10.620 1.00 25.24 C ATOM 2851 C VAL B 109 16.193 -16.335 11.266 1.00 26.73 C ATOM 2852 O VAL B 109 17.119 -16.415 12.112 1.00 26.49 O ATOM 2853 CB VAL B 109 16.695 -14.711 9.422 1.00 26.00 C ATOM 2854 CG1 VAL B 109 16.650 -15.857 8.412 1.00 27.25 C ATOM 2855 CG2 VAL B 109 16.268 -13.398 8.769 1.00 23.92 C ATOM 2856 HA VAL B 109 14.753 -15.176 10.249 1.00 0.00 H ATOM 2857 OXT VAL B 109 15.563 -17.359 10.920 1.00 28.60 O ATOM 2858 HB VAL B 109 17.720 -14.601 9.777 1.00 0.00 H ATOM 2859 HG11 VAL B 109 16.985 -16.776 8.892 1.00 0.00 H ATOM 2860 HG12 VAL B 109 15.628 -15.984 8.054 1.00 0.00 H ATOM 2861 HG13 VAL B 109 17.304 -15.625 7.572 1.00 0.00 H ATOM 2862 HG21 VAL B 109 15.241 -13.487 8.415 1.00 0.00 H ATOM 2863 HG22 VAL B 109 16.333 -12.592 9.500 1.00 0.00 H ATOM 2864 HG23 VAL B 109 16.926 -13.181 7.928 1.00 0.00 H ATOM 2865 H VAL B 109 16.490 -13.374 11.826 1.00 0.00 H TER 2866 VAL B 109 HETATM 2867 O HOH 1 -12.020 0.796 8.183 1.00 14.37 O HETATM 2868 O HOH 2 -14.901 -3.471 -16.238 1.00 17.24 O HETATM 2869 O HOH 3 2.208 7.061 -5.401 1.00 13.35 O HETATM 2870 O HOH 4 -7.749 -9.696 -14.856 1.00 13.83 O HETATM 2871 O HOH 5 -9.738 8.851 -13.031 1.00 17.17 O HETATM 2872 O HOH 6 -13.885 -3.633 -13.516 1.00 15.70 O HETATM 2873 O HOH 7 -20.839 -0.836 4.192 1.00 15.94 O HETATM 2874 O HOH 8 -11.409 13.393 -12.237 1.00 20.29 O HETATM 2875 O HOH 9 -11.999 10.031 -14.560 1.00 15.53 O HETATM 2876 O HOH 10 -12.150 -13.686 -9.591 1.00 19.69 O HETATM 2877 O HOH 11 0.354 5.877 -10.190 1.00 20.24 O HETATM 2878 O HOH 12 -7.304 7.251 -12.995 1.00 25.44 O HETATM 2879 O HOH 13 -20.037 -2.666 6.606 1.00 21.67 O HETATM 2880 O HOH 14 -22.564 1.307 4.180 1.00 24.98 O HETATM 2881 O HOH 15 -17.414 16.417 -8.126 1.00 23.52 O HETATM 2882 O HOH 16 -10.668 17.432 1.914 1.00 23.28 O HETATM 2883 O HOH 17 -2.322 9.713 5.206 1.00 21.40 O HETATM 2884 O HOH 18 -10.622 -8.537 -17.164 1.00 19.30 O HETATM 2885 O HOH 19 1.813 0.216 -0.382 1.00 24.84 O HETATM 2886 O HOH 20 -21.891 6.108 -0.842 1.00 22.94 O HETATM 2887 O HOH 21 -3.727 1.794 -16.087 1.00 23.30 O HETATM 2888 O HOH 22 -20.480 3.365 -12.441 1.00 28.22 O HETATM 2889 O HOH 23 -6.386 -12.510 0.350 1.00 20.08 O HETATM 2890 O HOH 24 -8.044 16.818 1.541 1.00 31.00 O HETATM 2891 O HOH 25 -8.263 -5.832 -19.761 1.00 26.23 O HETATM 2892 O HOH 26 -5.653 13.559 0.270 1.00 37.23 O HETATM 2893 O HOH 27 -13.219 0.698 10.551 1.00 24.55 O HETATM 2894 O HOH 28 -10.232 12.247 -9.938 1.00 24.66 O HETATM 2895 O HOH 29 -15.917 -0.227 9.984 1.00 24.85 O HETATM 2896 O HOH 30 -12.707 12.446 -7.618 1.00 25.99 O HETATM 2897 O HOH 31 -23.466 1.405 -3.190 1.00 45.24 O HETATM 2898 O HOH 32 -7.920 -3.342 -18.466 1.00 22.47 O HETATM 2899 O HOH 33 -2.233 -12.085 -0.167 1.00 18.49 O HETATM 2900 O HOH 34 -23.747 -6.041 -0.435 1.00 21.30 O HETATM 2901 O HOH 35 -18.128 -12.790 -12.059 1.00 34.00 O HETATM 2902 O HOH 36 -3.396 12.704 -9.268 1.00 40.94 O HETATM 2903 O HOH 37 5.276 -2.298 -12.402 1.00 25.76 O HETATM 2904 O HOH 38 -14.359 9.074 13.184 1.00 48.44 O HETATM 2905 O HOH 39 -17.610 8.846 -11.084 1.00 32.55 O HETATM 2906 O HOH 40 -4.059 -13.725 1.054 1.00 27.31 O HETATM 2907 O HOH 41 -7.497 11.992 -12.683 1.00 30.49 O HETATM 2908 O HOH 42 -17.053 11.327 10.437 1.00 25.65 O HETATM 2909 O HOH 43 -2.613 6.171 -10.218 1.00 33.22 O HETATM 2910 O HOH 44 3.595 -4.961 -6.768 1.00 30.46 O HETATM 2911 O HOH 45 -4.564 -0.006 -18.519 1.00 38.55 O HETATM 2912 O HOH 46 -0.529 -12.092 -15.027 1.00 26.91 O HETATM 2913 O HOH 47 -22.948 -1.947 -2.002 1.00 28.62 O HETATM 2914 O HOH 48 -10.765 4.704 -18.639 1.00 26.83 O HETATM 2915 O HOH 49 -1.301 10.325 0.169 1.00 36.29 O HETATM 2916 O HOH 50 -17.481 -12.487 -15.290 1.00 34.06 O HETATM 2917 O HOH 51 -14.472 -14.907 -2.093 1.00 17.35 O HETATM 2918 O HOH 52 -7.827 -13.857 -1.771 1.00 20.02 O HETATM 2919 O HOH 53 -15.949 -17.128 -14.793 1.00 28.30 O HETATM 2920 O HOH 54 -0.040 5.398 -14.257 1.00 26.82 O HETATM 2921 O HOH 55 -1.321 -18.547 -10.883 1.00 37.95 O HETATM 2922 O HOH 56 -21.265 5.896 -11.806 1.00 44.97 O HETATM 2923 O HOH 57 -20.629 -1.550 -3.577 1.00 35.32 O HETATM 2924 O HOH 58 -12.071 -15.794 -8.040 1.00 34.65 O HETATM 2925 O HOH 59 -21.020 0.983 -4.207 1.00 26.76 O HETATM 2926 O HOH 60 -3.334 -17.137 -11.828 1.00 26.31 O HETATM 2927 O HOH 61 -19.510 8.120 -9.660 1.00 37.67 O HETATM 2928 O HOH 62 -5.502 -2.857 -18.035 1.00 44.77 O HETATM 2929 O HOH 63 1.660 -2.080 -14.875 1.00 35.70 O HETATM 2930 O HOH 64 -10.376 -5.267 -21.831 1.00 34.56 O HETATM 2931 O HOH 65 -23.793 -7.229 6.038 1.00 41.80 O HETATM 2932 O HOH 66 -16.408 -5.301 -17.752 1.00 40.18 O HETATM 2933 O HOH 67 -19.599 -11.312 -15.048 1.00 38.34 O HETATM 2934 O HOH 68 -5.446 14.569 9.817 1.00 32.76 O HETATM 2935 O HOH 69 -0.765 -13.323 -5.903 1.00 26.05 O HETATM 2936 O HOH 70 -6.203 13.129 -8.094 1.00 41.33 O HETATM 2937 O HOH 71 -23.428 1.222 -7.077 1.00 37.13 O HETATM 2938 O HOH 72 -22.319 -10.065 -13.861 1.00 54.20 O HETATM 2939 O HOH 73 1.982 1.716 -14.278 1.00 36.14 O HETATM 2940 O HOH 74 -20.390 -1.074 -8.784 1.00 34.66 O HETATM 2941 O HOH 75 -20.546 10.071 -8.996 1.00 30.74 O HETATM 2942 O HOH 76 -11.634 -7.664 -22.420 1.00 34.09 O HETATM 2943 O HOH 77 -6.830 -19.546 -6.592 1.00 34.94 O HETATM 2944 O HOH 78 -28.527 -6.685 5.005 1.00 30.20 O HETATM 2945 O HOH 79 -14.254 15.634 -9.114 1.00 42.49 O HETATM 2946 O HOH 80 -0.886 2.353 -16.521 1.00 38.95 O HETATM 2947 O HOH 81 0.435 11.591 -4.910 1.00 32.65 O HETATM 2948 O HOH 82 0.793 -10.132 -0.790 1.00 18.63 O HETATM 2949 O HOH 83 -5.572 5.559 -13.729 1.00 37.00 O HETATM 2950 O HOH 84 -17.267 -15.061 -16.195 1.00 27.23 O HETATM 2951 O HOH 85 -17.801 -1.779 -13.021 1.00 41.30 O HETATM 2952 O HOH 86 -24.596 7.338 -7.363 1.00 37.81 O HETATM 2953 O HOH 87 -1.756 13.341 6.278 1.00 37.01 O HETATM 2954 O HOH 88 -22.829 0.298 -9.779 1.00 40.50 O HETATM 2955 O HOH 89 2.459 -7.200 -9.536 1.00 31.82 O HETATM 2956 O HOH 90 -4.133 7.130 -12.913 1.00 46.24 O HETATM 2957 O HOH 91 0.545 -0.366 -17.211 1.00 32.66 O HETATM 2958 O HOH 92 1.896 -8.150 -5.333 1.00 29.67 O HETATM 2959 O HOH 93 -5.255 -18.805 -11.526 1.00 30.82 O HETATM 2960 O HOH 94 -9.248 14.448 12.346 1.00 42.79 O HETATM 2961 O HOH 95 -1.872 -14.825 -14.871 1.00 38.16 O HETATM 2962 O HOH 96 -1.380 -13.442 -12.735 1.00 31.60 O HETATM 2963 O HOH 97 -19.535 -6.343 -14.296 1.00 36.84 O HETATM 2964 O HOH 98 -8.147 11.015 10.234 1.00 14.14 O HETATM 2965 O HOH 99 -4.592 -5.622 2.299 1.00 31.47 O HETATM 2966 O HOH 100 -10.934 10.498 11.278 1.00 22.55 O HETATM 2967 O HOH 101 -10.965 -5.641 10.611 1.00 23.98 O HETATM 2968 O HOH 102 -4.597 -2.986 2.587 1.00 32.16 O HETATM 2969 O HOH 103 -9.547 8.542 15.094 1.00 22.02 O HETATM 2970 O HOH 104 -2.205 7.718 13.456 1.00 34.43 O HETATM 2971 O HOH 105 -3.834 10.219 12.506 1.00 31.77 O HETATM 2972 O HOH 106 -8.629 10.188 13.600 1.00 32.52 O HETATM 2973 O HOH 107 -3.871 11.082 10.138 1.00 36.67 O HETATM 2974 O HOH 108 -5.783 0.251 12.007 1.00 27.06 O HETATM 2975 O HOH 109 -4.098 -6.913 4.288 1.00 30.26 O HETATM 2976 O HOH 110 -13.136 7.144 13.164 1.00 37.79 O HETATM 2977 O HOH 111 -1.373 10.784 8.831 1.00 39.18 O HETATM 2978 O HOH 112 0.012 8.232 11.538 1.00 37.06 O HETATM 2979 O HOH 113 -6.929 -3.570 3.440 1.00 37.10 O HETATM 2980 O HOH 114 -8.882 -5.564 13.035 1.00 32.86 O HETATM 2981 O HOH 115 -6.607 -10.274 8.016 1.00 32.08 O HETATM 2982 O HOH 116 -12.842 -2.951 11.639 1.00 33.90 O HETATM 2983 O HOH 117 -8.160 -9.067 2.850 1.00 48.86 O HETATM 2984 O HOH 118 12.020 0.796 -8.183 1.00 14.37 O HETATM 2985 O HOH 119 14.901 -3.471 16.238 1.00 17.24 O HETATM 2986 O HOH 120 -2.208 7.061 5.401 1.00 13.35 O HETATM 2987 O HOH 121 7.749 -9.696 14.856 1.00 13.83 O HETATM 2988 O HOH 122 9.738 8.851 13.031 1.00 17.17 O HETATM 2989 O HOH 123 13.885 -3.633 13.516 1.00 15.70 O HETATM 2990 O HOH 124 20.839 -0.836 -4.192 1.00 15.94 O HETATM 2991 O HOH 125 11.409 13.393 12.237 1.00 20.29 O HETATM 2992 O HOH 126 11.999 10.031 14.560 1.00 15.53 O HETATM 2993 O HOH 127 12.150 -13.686 9.591 1.00 19.69 O HETATM 2994 O HOH 128 -0.354 5.877 10.190 1.00 20.24 O HETATM 2995 O HOH 129 7.304 7.251 12.995 1.00 25.44 O HETATM 2996 O HOH 130 20.037 -2.666 -6.606 1.00 21.67 O HETATM 2997 O HOH 131 22.564 1.307 -4.180 1.00 24.98 O HETATM 2998 O HOH 132 17.414 16.417 8.126 1.00 23.52 O HETATM 2999 O HOH 133 10.668 17.432 -1.914 1.00 23.28 O HETATM 3000 O HOH 134 2.322 9.713 -5.206 1.00 21.40 O HETATM 3001 O HOH 135 10.622 -8.537 17.164 1.00 19.30 O HETATM 3002 O HOH 136 -1.813 0.216 0.382 1.00 24.84 O HETATM 3003 O HOH 137 21.891 6.108 0.842 1.00 22.94 O HETATM 3004 O HOH 138 3.727 1.794 16.087 1.00 23.30 O HETATM 3005 O HOH 139 20.480 3.365 12.441 1.00 28.22 O HETATM 3006 O HOH 140 6.386 -12.510 -0.350 1.00 20.08 O HETATM 3007 O HOH 141 8.044 16.818 -1.541 1.00 31.00 O HETATM 3008 O HOH 142 8.263 -5.832 19.761 1.00 26.23 O HETATM 3009 O HOH 143 5.653 13.559 -0.270 1.00 37.23 O HETATM 3010 O HOH 144 13.219 0.698 -10.551 1.00 24.55 O HETATM 3011 O HOH 145 10.232 12.247 9.938 1.00 24.66 O HETATM 3012 O HOH 146 15.917 -0.227 -9.984 1.00 24.85 O HETATM 3013 O HOH 147 12.707 12.446 7.618 1.00 25.99 O HETATM 3014 O HOH 148 23.466 1.405 3.190 1.00 45.24 O HETATM 3015 O HOH 149 7.920 -3.342 18.466 1.00 22.47 O HETATM 3016 O HOH 150 2.233 -12.085 0.167 1.00 18.49 O HETATM 3017 O HOH 151 23.747 -6.041 0.435 1.00 21.30 O HETATM 3018 O HOH 152 18.128 -12.790 12.059 1.00 34.00 O HETATM 3019 O HOH 153 3.396 12.704 9.268 1.00 40.94 O HETATM 3020 O HOH 154 -5.276 -2.298 12.402 1.00 25.76 O HETATM 3021 O HOH 155 14.359 9.074 -13.184 1.00 48.44 O HETATM 3022 O HOH 156 17.610 8.846 11.084 1.00 32.55 O HETATM 3023 O HOH 157 4.059 -13.725 -1.054 1.00 27.31 O HETATM 3024 O HOH 158 7.497 11.992 12.683 1.00 30.49 O HETATM 3025 O HOH 159 17.053 11.327 -10.437 1.00 25.65 O HETATM 3026 O HOH 160 2.613 6.171 10.218 1.00 33.22 O HETATM 3027 O HOH 161 -3.595 -4.961 6.768 1.00 30.46 O HETATM 3028 O HOH 162 4.564 -0.006 18.519 1.00 38.55 O HETATM 3029 O HOH 163 0.529 -12.092 15.027 1.00 26.91 O HETATM 3030 O HOH 164 22.948 -1.947 2.002 1.00 28.62 O HETATM 3031 O HOH 165 10.765 4.704 18.639 1.00 26.83 O HETATM 3032 O HOH 166 1.301 10.325 -0.169 1.00 36.29 O HETATM 3033 O HOH 167 17.481 -12.487 15.290 1.00 34.06 O HETATM 3034 O HOH 168 14.472 -14.907 2.093 1.00 17.35 O HETATM 3035 O HOH 169 7.827 -13.857 1.771 1.00 20.02 O HETATM 3036 O HOH 170 15.949 -17.128 14.793 1.00 28.30 O HETATM 3037 O HOH 171 0.040 5.398 14.257 1.00 26.82 O HETATM 3038 O HOH 172 1.321 -18.547 10.883 1.00 37.95 O HETATM 3039 O HOH 173 21.265 5.896 11.806 1.00 44.97 O HETATM 3040 O HOH 174 20.629 -1.550 3.577 1.00 35.32 O HETATM 3041 O HOH 175 12.071 -15.794 8.040 1.00 34.65 O HETATM 3042 O HOH 176 21.020 0.983 4.207 1.00 26.76 O HETATM 3043 O HOH 177 3.334 -17.137 11.828 1.00 26.31 O HETATM 3044 O HOH 178 19.510 8.120 9.660 1.00 37.67 O HETATM 3045 O HOH 179 5.502 -2.857 18.035 1.00 44.77 O HETATM 3046 O HOH 180 -1.660 -2.080 14.875 1.00 35.70 O HETATM 3047 O HOH 181 10.376 -5.267 21.831 1.00 34.56 O HETATM 3048 O HOH 182 23.793 -7.229 -6.038 1.00 41.80 O HETATM 3049 O HOH 183 16.408 -5.301 17.752 1.00 40.18 O HETATM 3050 O HOH 184 19.599 -11.312 15.048 1.00 38.34 O HETATM 3051 O HOH 185 5.446 14.569 -9.817 1.00 32.76 O HETATM 3052 O HOH 186 0.765 -13.323 5.903 1.00 26.05 O HETATM 3053 O HOH 187 6.203 13.129 8.094 1.00 41.33 O HETATM 3054 O HOH 188 23.428 1.222 7.077 1.00 37.13 O HETATM 3055 O HOH 189 22.319 -10.065 13.861 1.00 54.20 O HETATM 3056 O HOH 190 -1.982 1.716 14.278 1.00 36.14 O HETATM 3057 O HOH 191 20.390 -1.074 8.784 1.00 34.66 O HETATM 3058 O HOH 192 20.546 10.071 8.996 1.00 30.74 O HETATM 3059 O HOH 193 11.634 -7.664 22.420 1.00 34.09 O HETATM 3060 O HOH 194 6.830 -19.546 6.592 1.00 34.94 O HETATM 3061 O HOH 195 28.527 -6.685 -5.005 1.00 30.20 O HETATM 3062 O HOH 196 14.254 15.634 9.114 1.00 42.49 O HETATM 3063 O HOH 197 0.886 2.353 16.521 1.00 38.95 O HETATM 3064 O HOH 198 -0.435 11.591 4.910 1.00 32.65 O HETATM 3065 O HOH 199 5.572 5.559 13.729 1.00 37.00 O HETATM 3066 O HOH 200 17.267 -15.061 16.195 1.00 27.23 O HETATM 3067 O HOH 201 17.801 -1.779 13.021 1.00 41.30 O HETATM 3068 O HOH 202 24.596 7.338 7.363 1.00 37.81 O HETATM 3069 O HOH 203 1.756 13.341 -6.278 1.00 37.01 O HETATM 3070 O HOH 204 22.829 0.298 9.779 1.00 40.50 O HETATM 3071 O HOH 205 -2.459 -7.200 9.536 1.00 31.82 O HETATM 3072 O HOH 206 4.133 7.130 12.913 1.00 46.24 O HETATM 3073 O HOH 207 -0.545 -0.366 17.211 1.00 32.66 O HETATM 3074 O HOH 208 -1.896 -8.150 5.333 1.00 29.67 O HETATM 3075 O HOH 209 5.255 -18.805 11.526 1.00 30.82 O HETATM 3076 O HOH 210 9.248 14.448 -12.346 1.00 42.79 O HETATM 3077 O HOH 211 1.872 -14.825 14.871 1.00 38.16 O HETATM 3078 O HOH 212 1.380 -13.442 12.735 1.00 31.60 O HETATM 3079 O HOH 213 19.535 -6.343 14.296 1.00 36.84 O HETATM 3080 O HOH 214 8.147 11.015 -10.234 1.00 14.14 O HETATM 3081 O HOH 215 4.592 -5.622 -2.299 1.00 31.47 O HETATM 3082 O HOH 216 10.934 10.498 -11.278 1.00 22.55 O HETATM 3083 O HOH 217 10.965 -5.641 -10.611 1.00 23.98 O HETATM 3084 O HOH 218 4.597 -2.986 -2.587 1.00 32.16 O HETATM 3085 O HOH 219 9.547 8.542 -15.094 1.00 22.02 O HETATM 3086 O HOH 220 2.205 7.718 -13.456 1.00 34.43 O HETATM 3087 O HOH 221 3.834 10.219 -12.506 1.00 31.77 O HETATM 3088 O HOH 222 8.629 10.188 -13.600 1.00 32.52 O HETATM 3089 O HOH 223 3.871 11.082 -10.138 1.00 36.67 O HETATM 3090 O HOH 224 5.783 0.251 -12.007 1.00 27.06 O HETATM 3091 O HOH 225 4.098 -6.913 -4.288 1.00 30.26 O HETATM 3092 O HOH 226 13.136 7.144 -13.164 1.00 37.79 O HETATM 3093 O HOH 227 1.373 10.784 -8.831 1.00 39.18 O HETATM 3094 O HOH 228 -0.012 8.232 -11.538 1.00 37.06 O HETATM 3095 O HOH 229 6.929 -3.570 -3.440 1.00 37.10 O HETATM 3096 O HOH 230 8.882 -5.564 -13.035 1.00 32.86 O HETATM 3097 O HOH 231 6.607 -10.274 -8.016 1.00 32.08 O HETATM 3098 O HOH 232 12.842 -2.951 -11.639 1.00 33.90 O HETATM 3099 O HOH 233 8.160 -9.067 -2.850 1.00 48.86 O HETATM 3100 N THR A 234 -6.180 8.978 13.372 1.00 0.24 N HETATM 3101 CA THR A 234 -6.127 7.735 12.551 1.00 0.09 C HETATM 3102 C THR A 234 -5.849 8.077 11.073 1.00 0.23 C HETATM 3103 O THR A 234 -6.563 8.869 10.460 1.00 -0.39 O HETATM 3104 N THR A 234 -4.792 7.505 10.507 1.00 -0.26 N HETATM 3105 CA THR A 234 -4.455 7.809 9.108 1.00 0.15 C HETATM 3106 C THR A 234 -5.306 6.997 8.135 1.00 0.21 C HETATM 3107 O THR A 234 -5.908 5.986 8.498 1.00 -0.39 O HETATM 3108 N THR A 234 -5.345 7.427 6.875 1.00 -0.26 N HETATM 3109 CA THR A 234 -5.976 6.640 5.847 1.00 0.14 C HETATM 3110 C THR A 234 -5.506 5.194 5.861 1.00 0.21 C HETATM 3111 O THR A 234 -6.345 4.275 5.831 1.00 -0.39 O HETATM 3112 N THR A 234 -4.191 4.973 5.940 1.00 -0.26 N HETATM 3113 CA THR A 234 -3.697 3.603 5.856 1.00 0.13 C HETATM 3114 C THR A 234 -4.229 2.810 7.046 1.00 0.20 C HETATM 3115 O THR A 234 -4.539 1.617 6.919 1.00 -0.39 O HETATM 3116 N THR A 234 -4.306 3.449 8.222 1.00 -0.26 N HETATM 3117 CA THR A 234 -4.839 2.746 9.401 1.00 0.13 C HETATM 3118 C THR A 234 -6.266 2.325 9.169 1.00 0.20 C HETATM 3119 O THR A 234 -6.618 1.168 9.467 1.00 -0.39 O HETATM 3120 N THR A 234 -7.093 3.221 8.640 1.00 -0.26 N HETATM 3121 CA THR A 234 -8.482 2.835 8.363 1.00 0.14 C HETATM 3122 C THR A 234 -8.534 1.747 7.291 1.00 0.21 C HETATM 3123 O THR A 234 -9.274 0.758 7.397 1.00 -0.39 O HETATM 3124 N THR A 234 -7.719 1.918 6.264 1.00 -0.26 N HETATM 3125 CA THR A 234 -7.802 1.016 5.103 1.00 0.14 C HETATM 3126 C THR A 234 -7.373 -0.417 5.484 1.00 0.21 C HETATM 3127 O THR A 234 -7.940 -1.418 4.989 1.00 -0.39 O HETATM 3128 N THR A 234 -6.377 -0.521 6.356 1.00 -0.26 N HETATM 3129 CA THR A 234 -5.865 -1.830 6.733 1.00 0.15 C HETATM 3130 C THR A 234 -6.848 -2.637 7.549 1.00 0.21 C HETATM 3131 O THR A 234 -6.713 -3.857 7.642 1.00 -0.39 O HETATM 3132 N THR A 234 -7.850 -1.977 8.134 1.00 -0.26 N HETATM 3133 CA THR A 234 -8.902 -2.730 8.824 1.00 0.13 C HETATM 3134 C THR A 234 -9.773 -3.558 7.856 1.00 0.20 C HETATM 3135 O THR A 234 -10.564 -4.377 8.308 1.00 -0.39 O HETATM 3136 N THR A 234 -9.667 -3.320 6.539 1.00 -0.26 N HETATM 3137 CA THR A 234 -10.442 -4.110 5.573 1.00 0.13 C HETATM 3138 C THR A 234 -9.931 -5.512 5.454 1.00 0.20 C HETATM 3139 O THR A 234 -10.665 -6.405 5.020 1.00 -0.39 O HETATM 3140 N THR A 234 -8.674 -5.731 5.801 1.00 -0.26 N HETATM 3141 CA THR A 234 -8.117 -7.053 5.629 1.00 0.14 C HETATM 3142 C THR A 234 -8.037 -7.736 6.982 1.00 0.13 C HETATM 3143 O THR A 234 -7.178 -7.400 7.781 1.00 -0.37 O HETATM 3144 H84 THR A 234 -8.744 -8.524 7.239 1.00 0.14 H HETATM 3145 CB THR A 234 -6.716 -6.978 4.993 1.00 0.08 C HETATM 3146 OG THR A 234 -6.671 -6.215 3.766 1.00 -0.39 O HETATM 3147 H87 THR A 234 -5.782 -6.210 3.430 1.00 0.21 H HETATM 3148 H85 THR A 234 -6.378 -8.002 4.777 1.00 0.06 H HETATM 3149 H86 THR A 234 -6.031 -6.511 5.717 1.00 0.06 H HETATM 3150 H83 THR A 234 -8.776 -7.636 4.968 1.00 0.08 H HETATM 3151 H82 THR A 234 -8.116 -4.991 6.178 1.00 0.19 H HETATM 3152 CB THR A 234 -10.392 -3.490 4.183 1.00 -0.01 C HETATM 3153 CG THR A 234 -11.228 -2.227 4.009 1.00 -0.04 C HETATM 3154 CD1 THR A 234 -10.688 -1.395 2.866 1.00 -0.06 C HETATM 3155 H76 THR A 234 -11.300 -0.488 2.752 1.00 0.02 H HETATM 3156 H77 THR A 234 -10.725 -1.982 1.936 1.00 0.02 H HETATM 3157 H78 THR A 234 -9.647 -1.111 3.079 1.00 0.02 H HETATM 3158 CD2 THR A 234 -12.694 -2.645 3.773 1.00 -0.06 C HETATM 3159 H79 THR A 234 -13.046 -3.246 4.625 1.00 0.02 H HETATM 3160 H80 THR A 234 -12.761 -3.241 2.851 1.00 0.02 H HETATM 3161 H81 THR A 234 -13.320 -1.746 3.675 1.00 0.02 H HETATM 3162 H75 THR A 234 -11.174 -1.629 4.931 1.00 0.03 H HETATM 3163 H73 THR A 234 -10.752 -4.239 3.462 1.00 0.03 H HETATM 3164 H74 THR A 234 -9.345 -3.239 3.959 1.00 0.03 H HETATM 3165 H72 THR A 234 -11.487 -4.139 5.915 1.00 0.08 H HETATM 3166 H71 THR A 234 -9.056 -2.599 6.213 1.00 0.19 H HETATM 3167 CB THR A 234 -9.787 -1.778 9.643 1.00 -0.01 C HETATM 3168 CG THR A 234 -9.015 -1.167 10.800 1.00 -0.04 C HETATM 3169 CD1 THR A 234 -9.804 0.006 11.364 1.00 -0.06 C HETATM 3170 H65 THR A 234 -9.249 0.452 12.202 1.00 0.02 H HETATM 3171 H66 THR A 234 -10.783 -0.348 11.719 1.00 0.02 H HETATM 3172 H67 THR A 234 -9.950 0.761 10.578 1.00 0.02 H HETATM 3173 CD2 THR A 234 -8.766 -2.174 11.853 1.00 -0.06 C HETATM 3174 H68 THR A 234 -8.196 -3.014 11.430 1.00 0.02 H HETATM 3175 H69 THR A 234 -9.726 -2.542 12.242 1.00 0.02 H HETATM 3176 H70 THR A 234 -8.191 -1.715 12.671 1.00 0.02 H HETATM 3177 H64 THR A 234 -8.047 -0.800 10.428 1.00 0.03 H HETATM 3178 H62 THR A 234 -10.645 -2.340 10.041 1.00 0.03 H HETATM 3179 H63 THR A 234 -10.149 -0.972 8.988 1.00 0.03 H HETATM 3180 H61 THR A 234 -8.413 -3.429 9.518 1.00 0.08 H HETATM 3181 H60 THR A 234 -7.883 -0.978 8.102 1.00 0.19 H HETATM 3182 CB THR A 234 -4.504 -1.687 7.392 1.00 0.08 C HETATM 3183 CG THR A 234 -3.401 -1.429 6.372 1.00 0.18 C HETATM 3184 OD1 THR A 234 -3.470 -1.926 5.237 1.00 -0.40 O HETATM 3185 ND2 THR A 234 -2.363 -0.690 6.773 1.00 -0.30 N HETATM 3186 H58 THR A 234 -1.615 -0.494 6.139 1.00 0.18 H HETATM 3187 H59 THR A 234 -2.334 -0.333 7.707 1.00 0.18 H HETATM 3188 H56 THR A 234 -4.274 -2.614 7.937 1.00 0.06 H HETATM 3189 H57 THR A 234 -4.538 -0.845 8.099 1.00 0.06 H HETATM 3190 H55 THR A 234 -5.708 -2.391 5.800 1.00 0.08 H HETATM 3191 H54 THR A 234 -5.977 0.304 6.755 1.00 0.19 H HETATM 3192 CB THR A 234 -6.894 1.547 3.964 1.00 0.00 C HETATM 3193 CG THR A 234 -7.135 0.840 2.675 1.00 -0.04 C HETATM 3194 CD1 THR A 234 -6.345 -0.142 2.083 1.00 0.02 C HETATM 3195 NE1 THR A 234 -6.938 -0.578 0.921 1.00 -0.29 N HETATM 3196 CE2 THR A 234 -8.125 0.093 0.739 1.00 0.06 C HETATM 3197 CD2 THR A 234 -8.281 0.997 1.822 1.00 -0.02 C HETATM 3198 CE3 THR A 234 -9.411 1.846 1.848 1.00 -0.07 C HETATM 3199 CZ3 THR A 234 -10.366 1.729 0.829 1.00 -0.08 C HETATM 3200 CH2 THR A 234 -10.181 0.795 -0.231 1.00 -0.08 C HETATM 3201 CZ2 THR A 234 -9.053 -0.003 -0.294 1.00 -0.04 C HETATM 3202 H51 THR A 234 -8.896 -0.683 -1.123 1.00 0.05 H HETATM 3203 H53 THR A 234 -10.938 0.708 -1.002 1.00 0.05 H HETATM 3204 H52 THR A 234 -11.252 2.354 0.847 1.00 0.05 H HETATM 3205 H50 THR A 234 -9.537 2.574 2.641 1.00 0.05 H HETATM 3206 H49 THR A 234 -6.554 -1.294 0.287 1.00 0.22 H HETATM 3207 H48 THR A 234 -5.400 -0.509 2.480 1.00 0.08 H HETATM 3208 H46 THR A 234 -5.843 1.405 4.254 1.00 0.04 H HETATM 3209 H47 THR A 234 -7.094 2.619 3.822 1.00 0.04 H HETATM 3210 H45 THR A 234 -8.843 0.991 4.749 1.00 0.08 H HETATM 3211 H44 THR A 234 -7.047 2.659 6.276 1.00 0.19 H HETATM 3212 CB THR A 234 -9.254 4.025 7.819 1.00 0.02 C HETATM 3213 CG THR A 234 -9.692 5.004 8.901 1.00 -0.05 C HETATM 3214 CD1 THR A 234 -10.615 4.640 9.871 1.00 -0.07 C HETATM 3215 CE1 THR A 234 -11.049 5.571 10.855 1.00 -0.04 C HETATM 3216 CZ THR A 234 -10.569 6.870 10.814 1.00 0.08 C HETATM 3217 CE2 THR A 234 -9.654 7.257 9.843 1.00 -0.04 C HETATM 3218 CD2 THR A 234 -9.239 6.330 8.875 1.00 -0.07 C HETATM 3219 H40 THR A 234 -8.556 6.645 8.094 1.00 0.05 H HETATM 3220 H42 THR A 234 -9.263 8.268 9.833 1.00 0.05 H HETATM 3221 OH THR A 234 -10.992 7.779 11.757 1.00 -0.34 O HETATM 3222 H43 THR A 234 -11.611 7.360 12.343 1.00 0.25 H HETATM 3223 H41 THR A 234 -11.747 5.268 11.627 1.00 0.05 H HETATM 3224 H39 THR A 234 -11.011 3.631 9.879 1.00 0.05 H HETATM 3225 H37 THR A 234 -10.150 3.653 7.301 1.00 0.05 H HETATM 3226 H38 THR A 234 -8.613 4.560 7.103 1.00 0.05 H HETATM 3227 H36 THR A 234 -8.951 2.472 9.290 1.00 0.08 H HETATM 3228 H35 THR A 234 -6.773 4.146 8.433 1.00 0.19 H HETATM 3229 CB THR A 234 -4.716 3.592 10.660 1.00 -0.00 C HETATM 3230 CG THR A 234 -3.274 3.649 11.165 1.00 0.00 C HETATM 3231 CD THR A 234 -3.151 4.562 12.343 1.00 0.04 C HETATM 3232 OE1 THR A 234 -3.242 5.777 12.130 1.00 -0.57 O HETATM 3233 OE2 THR A 234 -2.916 4.082 13.476 1.00 -0.57 O HETATM 3234 H33 THR A 234 -2.625 4.016 10.357 1.00 0.04 H HETATM 3235 H34 THR A 234 -2.956 2.638 11.460 1.00 0.04 H HETATM 3236 H31 THR A 234 -5.352 3.157 11.445 1.00 0.03 H HETATM 3237 H32 THR A 234 -5.056 4.614 10.437 1.00 0.03 H HETATM 3238 H30 THR A 234 -4.239 1.836 9.550 1.00 0.08 H HETATM 3239 H29 THR A 234 -4.003 4.399 8.298 1.00 0.19 H HETATM 3240 CB THR A 234 -2.189 3.604 5.836 1.00 -0.02 C HETATM 3241 H26 THR A 234 -1.823 2.569 5.773 1.00 0.03 H HETATM 3242 H27 THR A 234 -1.810 4.071 6.757 1.00 0.03 H HETATM 3243 H28 THR A 234 -1.834 4.173 4.964 1.00 0.03 H HETATM 3244 H25 THR A 234 -4.064 3.142 4.927 1.00 0.08 H HETATM 3245 H24 THR A 234 -3.554 5.736 6.055 1.00 0.19 H HETATM 3246 CB THR A 234 -5.758 7.255 4.463 1.00 0.02 C HETATM 3247 CG THR A 234 -6.254 6.363 3.368 1.00 -0.04 C HETATM 3248 CD1 THR A 234 -7.615 6.363 3.025 1.00 -0.06 C HETATM 3249 CE1 THR A 234 -8.081 5.465 2.053 1.00 -0.07 C HETATM 3250 CZ THR A 234 -7.220 4.570 1.417 1.00 -0.07 C HETATM 3251 CE2 THR A 234 -5.877 4.560 1.768 1.00 -0.07 C HETATM 3252 CD2 THR A 234 -5.402 5.443 2.742 1.00 -0.06 C HETATM 3253 H20 THR A 234 -4.354 5.416 3.018 1.00 0.06 H HETATM 3254 H22 THR A 234 -5.196 3.867 1.287 1.00 0.06 H HETATM 3255 H23 THR A 234 -7.595 3.892 0.659 1.00 0.06 H HETATM 3256 H21 THR A 234 -9.133 5.466 1.790 1.00 0.06 H HETATM 3257 H19 THR A 234 -8.300 7.051 3.507 1.00 0.06 H HETATM 3258 H17 THR A 234 -4.682 7.430 4.318 1.00 0.05 H HETATM 3259 H18 THR A 234 -6.296 8.213 4.412 1.00 0.05 H HETATM 3260 H16 THR A 234 -7.057 6.641 6.049 1.00 0.08 H HETATM 3261 H15 THR A 234 -4.931 8.307 6.640 1.00 0.19 H HETATM 3262 CB THR A 234 -2.977 7.483 8.835 1.00 0.08 C HETATM 3263 OG THR A 234 -2.775 6.065 8.899 1.00 -0.39 O HETATM 3264 H14 THR A 234 -1.861 5.869 8.730 1.00 0.21 H HETATM 3265 H12 THR A 234 -2.348 7.976 9.591 1.00 0.06 H HETATM 3266 H13 THR A 234 -2.701 7.847 7.834 1.00 0.06 H HETATM 3267 H11 THR A 234 -4.630 8.880 8.930 1.00 0.08 H HETATM 3268 H10 THR A 234 -4.226 6.869 11.031 1.00 0.19 H HETATM 3269 CB THR A 234 -7.444 6.970 12.671 1.00 0.11 C HETATM 3270 OG1 THR A 234 -7.720 6.772 14.077 1.00 -0.38 O HETATM 3271 H6 THR A 234 -7.790 7.616 14.507 1.00 0.21 H HETATM 3272 CG2 THR A 234 -7.330 5.615 11.958 1.00 -0.03 C HETATM 3273 H7 THR A 234 -8.282 5.071 12.049 1.00 0.03 H HETATM 3274 H8 THR A 234 -6.525 5.024 12.419 1.00 0.03 H HETATM 3275 H9 THR A 234 -7.102 5.778 10.894 1.00 0.03 H HETATM 3276 H5 THR A 234 -8.256 7.554 12.213 1.00 0.07 H HETATM 3277 H4 THR A 234 -5.312 7.099 12.926 1.00 0.11 H HETATM 3278 H1 THR A 234 -5.307 9.475 13.286 1.00 0.20 H HETATM 3279 H2 THR A 234 -6.335 8.736 14.338 1.00 0.20 H HETATM 3280 H3 THR A 234 -6.933 9.563 13.047 1.00 0.20 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 1434 1435 1447 1448 1449 CONECT 1447 1434 CONECT 1448 1434 CONECT 1449 1434 CONECT 3100 3101 3278 3279 3280 CONECT 3101 3100 3102 3269 3277 CONECT 3102 3101 3103 3104 CONECT 3103 3102 CONECT 3104 3102 3105 3268 CONECT 3105 3104 3106 3262 3267 CONECT 3106 3105 3107 3108 CONECT 3107 3106 CONECT 3108 3106 3109 3261 CONECT 3109 3108 3110 3246 3260 CONECT 3110 3109 3111 3112 CONECT 3111 3110 CONECT 3112 3110 3113 3245 CONECT 3113 3112 3114 3240 3244 CONECT 3114 3113 3115 3116 CONECT 3115 3114 CONECT 3116 3114 3117 3239 CONECT 3117 3116 3118 3229 3238 CONECT 3118 3117 3119 3120 CONECT 3119 3118 CONECT 3120 3118 3121 3228 CONECT 3121 3120 3122 3212 3227 CONECT 3122 3121 3123 3124 CONECT 3123 3122 CONECT 3124 3122 3125 3211 CONECT 3125 3124 3126 3192 3210 CONECT 3126 3125 3127 3128 CONECT 3127 3126 CONECT 3128 3126 3129 3191 CONECT 3129 3128 3130 3182 3190 CONECT 3130 3129 3131 3132 CONECT 3131 3130 CONECT 3132 3130 3133 3181 CONECT 3133 3132 3134 3167 3180 CONECT 3134 3133 3135 3136 CONECT 3135 3134 CONECT 3136 3134 3137 3166 CONECT 3137 3136 3138 3152 3165 CONECT 3138 3137 3139 3140 CONECT 3139 3138 CONECT 3140 3138 3141 3151 CONECT 3141 3140 3142 3145 3150 CONECT 3142 3141 3143 3144 CONECT 3143 3142 CONECT 3144 3142 CONECT 3145 3141 3146 3148 3149 CONECT 3146 3145 3147 CONECT 3147 3146 CONECT 3148 3145 CONECT 3149 3145 CONECT 3150 3141 CONECT 3151 3140 CONECT 3152 3137 3153 3163 3164 CONECT 3153 3152 3154 3158 3162 CONECT 3154 3153 3155 3156 3157 CONECT 3155 3154 CONECT 3156 3154 CONECT 3157 3154 CONECT 3158 3153 3159 3160 3161 CONECT 3159 3158 CONECT 3160 3158 CONECT 3161 3158 CONECT 3162 3153 CONECT 3163 3152 CONECT 3164 3152 CONECT 3165 3137 CONECT 3166 3136 CONECT 3167 3133 3168 3178 3179 CONECT 3168 3167 3169 3173 3177 CONECT 3169 3168 3170 3171 3172 CONECT 3170 3169 CONECT 3171 3169 CONECT 3172 3169 CONECT 3173 3168 3174 3175 3176 CONECT 3174 3173 CONECT 3175 3173 CONECT 3176 3173 CONECT 3177 3168 CONECT 3178 3167 CONECT 3179 3167 CONECT 3180 3133 CONECT 3181 3132 CONECT 3182 3129 3183 3188 3189 CONECT 3183 3182 3184 3185 CONECT 3184 3183 CONECT 3185 3183 3186 3187 CONECT 3186 3185 CONECT 3187 3185 CONECT 3188 3182 CONECT 3189 3182 CONECT 3190 3129 CONECT 3191 3128 CONECT 3192 3125 3193 3208 3209 CONECT 3193 3192 3194 3197 CONECT 3194 3193 3195 3207 CONECT 3195 3194 3196 3206 CONECT 3196 3195 3197 3201 CONECT 3197 3193 3196 3198 CONECT 3198 3197 3199 3205 CONECT 3199 3198 3200 3204 CONECT 3200 3199 3201 3203 CONECT 3201 3196 3200 3202 CONECT 3202 3201 CONECT 3203 3200 CONECT 3204 3199 CONECT 3205 3198 CONECT 3206 3195 CONECT 3207 3194 CONECT 3208 3192 CONECT 3209 3192 CONECT 3210 3125 CONECT 3211 3124 CONECT 3212 3121 3213 3225 3226 CONECT 3213 3212 3214 3218 CONECT 3214 3213 3215 3224 CONECT 3215 3214 3216 3223 CONECT 3216 3215 3217 3221 CONECT 3217 3216 3218 3220 CONECT 3218 3213 3217 3219 CONECT 3219 3218 CONECT 3220 3217 CONECT 3221 3216 3222 CONECT 3222 3221 CONECT 3223 3215 CONECT 3224 3214 CONECT 3225 3212 CONECT 3226 3212 CONECT 3227 3121 CONECT 3228 3120 CONECT 3229 3117 3230 3236 3237 CONECT 3230 3229 3231 3234 3235 CONECT 3231 3230 3232 3233 CONECT 3232 3231 CONECT 3233 3231 CONECT 3234 3230 CONECT 3235 3230 CONECT 3236 3229 CONECT 3237 3229 CONECT 3238 3117 CONECT 3239 3116 CONECT 3240 3113 3241 3242 3243 CONECT 3241 3240 CONECT 3242 3240 CONECT 3243 3240 CONECT 3244 3113 CONECT 3245 3112 CONECT 3246 3109 3247 3258 3259 CONECT 3247 3246 3248 3252 CONECT 3248 3247 3249 3257 CONECT 3249 3248 3250 3256 CONECT 3250 3249 3251 3255 CONECT 3251 3250 3252 3254 CONECT 3252 3247 3251 3253 CONECT 3253 3252 CONECT 3254 3251 CONECT 3255 3250 CONECT 3256 3249 CONECT 3257 3248 CONECT 3258 3246 CONECT 3259 3246 CONECT 3260 3109 CONECT 3261 3108 CONECT 3262 3105 3263 3265 3266 CONECT 3263 3262 3264 CONECT 3264 3263 CONECT 3265 3262 CONECT 3266 3262 CONECT 3267 3105 CONECT 3268 3104 CONECT 3269 3101 3270 3272 3276 CONECT 3270 3269 3271 CONECT 3271 3270 CONECT 3272 3269 3273 3274 3275 CONECT 3273 3272 CONECT 3274 3272 CONECT 3275 3272 CONECT 3276 3269 CONECT 3277 3101 CONECT 3278 3100 CONECT 3279 3100 CONECT 3280 3100 MASTER 0 0 0 0 0 0 0 0 3278 2 189 14 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: 3eqs
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5swk
RCSB PDB
PDBbind
110aa, >5SWK_2|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1abt
RCSB PDB
PDBbind
12-mer
1br8
RCSB PDB
PDBbind
12-mer
1dkd
RCSB PDB
PDBbind
12-mer
1gwr
RCSB PDB
PDBbind
12-mer
1hgt
RCSB PDB
PDBbind
12-mer
1i8i
RCSB PDB
PDBbind
12-mer
1jpl
RCSB PDB
PDBbind
12-mer
1jyi
RCSB PDB
PDBbind
12-mer
1ka7
RCSB PDB
PDBbind
12-mer
1lf8
RCSB PDB
PDBbind
12-mer
1mq1
RCSB PDB
PDBbind
12-mer
1mwn
RCSB PDB
PDBbind
12-mer
1osg
RCSB PDB
PDBbind
12-mer
1qwe
RCSB PDB
PDBbind
12-mer
1qwf
RCSB PDB
PDBbind
12-mer
1shc
RCSB PDB
PDBbind
12-mer
1ujj
RCSB PDB
PDBbind
12-mer
1ujk
RCSB PDB
PDBbind
12-mer
1upk
RCSB PDB
PDBbind
12-mer
1w80
RCSB PDB
PDBbind
12-mer
1x8s
RCSB PDB
PDBbind
12-mer
1xb7
RCSB PDB
PDBbind
12-mer
1y98
RCSB PDB
PDBbind
12-mer
2a3i
RCSB PDB
PDBbind
12-mer
2byp
RCSB PDB
PDBbind
12-mer
2ci9
RCSB PDB
PDBbind
12-mer
2fx8
RCSB PDB
PDBbind
12-mer
2g6q
RCSB PDB
PDBbind
12-mer
2iv9
RCSB PDB
PDBbind
12-mer
2jbu
RCSB PDB
PDBbind
12-mer
2kff
RCSB PDB
PDBbind
12-mer
2kfg
RCSB PDB
PDBbind
12-mer
2kfh
RCSB PDB
PDBbind
12-mer
2ltv
RCSB PDB
PDBbind
12-mer
2mow
RCSB PDB
PDBbind
12-mer
2mwp
RCSB PDB
PDBbind
12-mer
2ncz
RCSB PDB
PDBbind
12-mer
2nwn
RCSB PDB
PDBbind
12-mer
2ovq
RCSB PDB
PDBbind
12-mer
2pnx
RCSB PDB
PDBbind
12-mer
2pv2
RCSB PDB
PDBbind
12-mer
2pv3
RCSB PDB
PDBbind
12-mer
2qbx
RCSB PDB
PDBbind
12-mer
2qic
RCSB PDB
PDBbind
12-mer
2rol
RCSB PDB
PDBbind
12-mer
2v85
RCSB PDB
PDBbind
12-mer
2w10
RCSB PDB
PDBbind
12-mer
2w85
RCSB PDB
PDBbind
12-mer
2xzq
RCSB PDB
PDBbind
12-mer
2y06
RCSB PDB
PDBbind
12-mer
2y07
RCSB PDB
PDBbind
12-mer
2y1n
RCSB PDB
PDBbind
12-mer
2y36
RCSB PDB
PDBbind
12-mer
2ynr
RCSB PDB
PDBbind
12-mer
2yns
RCSB PDB
PDBbind
12-mer
3c6w
RCSB PDB
PDBbind
12-mer
3cs8
RCSB PDB
PDBbind
12-mer
3d32
RCSB PDB
PDBbind
12-mer
3dow
RCSB PDB
PDBbind
12-mer
3ds0
RCSB PDB
PDBbind
12-mer
3ds1
RCSB PDB
PDBbind
12-mer
3ds3
RCSB PDB
PDBbind
12-mer
3ds4
RCSB PDB
PDBbind
12-mer
3eqy
RCSB PDB
PDBbind
12-mer
3ggw
RCSB PDB
PDBbind
12-mer
3hs8
RCSB PDB
PDBbind
12-mer
3hs9
RCSB PDB
PDBbind
12-mer
3i5r
RCSB PDB
PDBbind
12-mer
3iqq
RCSB PDB
PDBbind
12-mer
3ivq
RCSB PDB
PDBbind
12-mer
3iwy
RCSB PDB
PDBbind
12-mer
3jzo
RCSB PDB
PDBbind
12-mer
3jzp
RCSB PDB
PDBbind
12-mer
3jzq
RCSB PDB
PDBbind
12-mer
3jzr
RCSB PDB
PDBbind
12-mer
3jzs
RCSB PDB
PDBbind
12-mer
3k26
RCSB PDB
PDBbind
12-mer
3l3x
RCSB PDB
PDBbind
12-mer
3l3z
RCSB PDB
PDBbind
12-mer
3lnj
RCSB PDB
PDBbind
12-mer
3lnz
RCSB PDB
PDBbind
12-mer
3mo8
RCSB PDB
PDBbind
12-mer
3ob1
RCSB PDB
PDBbind
12-mer
3ob2
RCSB PDB
PDBbind
12-mer
3poa
RCSB PDB
PDBbind
12-mer
3shb
RCSB PDB
PDBbind
12-mer
3sw9
RCSB PDB
PDBbind
12-mer
3tpx
RCSB PDB
PDBbind
12-mer
3tsz
RCSB PDB
PDBbind
12-mer
3u2q
RCSB PDB
PDBbind
12-mer
3ued
RCSB PDB
PDBbind
12-mer
3uef
RCSB PDB
PDBbind
12-mer
3ueo
RCSB PDB
PDBbind
12-mer
3uvw
RCSB PDB
PDBbind
12-mer
4a4c
RCSB PDB
PDBbind
12-mer
4b8p
RCSB PDB
PDBbind
12-mer
4ba3
RCSB PDB
PDBbind
12-mer
4cc2
RCSB PDB
PDBbind
12-mer
4cc3
RCSB PDB
PDBbind
12-mer
4cc7
RCSB PDB
PDBbind
12-mer
4dow
RCSB PDB
PDBbind
12-mer
4gao
RCSB PDB
PDBbind
12-mer
4gq6
RCSB PDB
PDBbind
12-mer
4gw1
RCSB PDB
PDBbind
12-mer
4gw5
RCSB PDB
PDBbind
12-mer
4hy9
RCSB PDB
PDBbind
12-mer
4j26
RCSB PDB
PDBbind
12-mer
4jfx
RCSB PDB
PDBbind
12-mer
4jfz
RCSB PDB
PDBbind
12-mer
4jg0
RCSB PDB
PDBbind
12-mer
4jg1
RCSB PDB
PDBbind
12-mer
4l58
RCSB PDB
PDBbind
12-mer
4qh7
RCSB PDB
PDBbind
12-mer
4rxz
RCSB PDB
PDBbind
12-mer
4twt
RCSB PDB
PDBbind
12-mer
4u7t
RCSB PDB
PDBbind
12-mer
4ux9
RCSB PDB
PDBbind
12-mer
4w50
RCSB PDB
PDBbind
12-mer
4wht
RCSB PDB
PDBbind
12-mer
4why
RCSB PDB
PDBbind
12-mer
4x8p
RCSB PDB
PDBbind
12-mer
4yhz
RCSB PDB
PDBbind
12-mer
4ym4
RCSB PDB
PDBbind
12-mer
4z2o
RCSB PDB
PDBbind
12-mer
4z2p
RCSB PDB
PDBbind
12-mer
4z68
RCSB PDB
PDBbind
12-mer
4znx
RCSB PDB
PDBbind
12-mer
5b56
RCSB PDB
PDBbind
12-mer
5d2a
RCSB PDB
PDBbind
12-mer
5eeq
RCSB PDB
PDBbind
12-mer
5esq
RCSB PDB
PDBbind
12-mer
5etu
RCSB PDB
PDBbind
12-mer
5euk
RCSB PDB
PDBbind
12-mer
5f88
RCSB PDB
PDBbind
12-mer
5ff6
RCSB PDB
PDBbind
12-mer
5ggp
RCSB PDB
PDBbind
12-mer
5gr9
RCSB PDB
PDBbind
12-mer
5huw
RCSB PDB
PDBbind
12-mer
5huy
RCSB PDB
PDBbind
12-mer
5hyq
RCSB PDB
PDBbind
12-mer
5i2i
RCSB PDB
PDBbind
12-mer
5icy
RCSB PDB
PDBbind
12-mer
5icz
RCSB PDB
PDBbind
12-mer
5id1
RCSB PDB
PDBbind
12-mer
5ih2
RCSB PDB
PDBbind
12-mer
5iop
RCSB PDB
PDBbind
12-mer
5ir1
RCSB PDB
PDBbind
12-mer
5itf
RCSB PDB
PDBbind
12-mer
5iv2
RCSB PDB
PDBbind
12-mer
5ivn
RCSB PDB
PDBbind
12-mer
5ivz
RCSB PDB
PDBbind
12-mer
5ixq
RCSB PDB
PDBbind
12-mer
5iyv
RCSB PDB
PDBbind
12-mer
5lgr
RCSB PDB
PDBbind
12-mer
5moc
RCSB PDB
PDBbind
12-mer
5n7x
RCSB PDB
PDBbind
12-mer
5n8j
RCSB PDB
PDBbind
12-mer
5t1k
RCSB PDB
PDBbind
12-mer
5t1l
RCSB PDB
PDBbind
12-mer
5t1m
RCSB PDB
PDBbind
12-mer
5tbn
RCSB PDB
PDBbind
12-mer
5th2
RCSB PDB
PDBbind
12-mer
5v1d
RCSB PDB
PDBbind
12-mer
5w4s
RCSB PDB
PDBbind
12-mer
5w5s
RCSB PDB
PDBbind
12-mer
5w5u
RCSB PDB
PDBbind
12-mer
5w6i
RCSB PDB
PDBbind
12-mer
5w6r
RCSB PDB
PDBbind
12-mer
5w6t
RCSB PDB
PDBbind
12-mer
5w6u
RCSB PDB
PDBbind
12-mer
5wle
RCSB PDB
PDBbind
12-mer
5wxf
RCSB PDB
PDBbind
12-mer
5wxo
RCSB PDB
PDBbind
12-mer
5xup
RCSB PDB
PDBbind
12-mer
5xwr
RCSB PDB
PDBbind
12-mer
5xxk
RCSB PDB
PDBbind
12-mer
5y1u
RCSB PDB
PDBbind
12-mer
5y59
RCSB PDB
PDBbind
12-mer
6bgg
RCSB PDB
PDBbind
12-mer
6e83
RCSB PDB
PDBbind
12-mer
6f7t
RCSB PDB
PDBbind
12-mer
6f8g
RCSB PDB
PDBbind
12-mer
6rr0
RCSB PDB
PDBbind
12-mer
6qtr
RCSB PDB
PDBbind
12-mer
6qto
RCSB PDB
PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
6peu
RCSB PDB
PDBbind
12-mer
6o3x
RCSB PDB
PDBbind
12-mer
6nk0
RCSB PDB
PDBbind
12-mer
6mm5
RCSB PDB
PDBbind
12-mer
6k5t
RCSB PDB
PDBbind
12-mer
6k5r
RCSB PDB
PDBbind
12-mer
6iam
RCSB PDB
PDBbind
12-mer
6hy2
RCSB PDB
PDBbind
12-mer
6byk
RCSB PDB
PDBbind
12-mer
6bw4
RCSB PDB
PDBbind
12-mer
6bw3
RCSB PDB
PDBbind
12-mer
6a8g
RCSB PDB
PDBbind
12-mer
5zop
RCSB PDB
PDBbind
12-mer
Entry Information
PDB ID
3eqs
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
E3 ubiquitin-protein ligase Mdm2
Ligand Name
12-mer
EC.Number
E.C.6.3.2.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=3.3nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Proc.Natl.Acad.Sci.USA Vol. 106: pp. 4665-4670
Ligand Properties
Formula
C
6
3
H
8
8
N
1
3
O
1
8
Molecular Weight
1315.450
Exact Mass
1314.640
No. of atoms
182
No. of bonds
185
Polar Surface Area
512.81
LOGP Value
-1.72 (
Computed with XLOGP3
)
0.39 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 52
No. of Nitrogen and Oxygen Atoms: 31
No. of Rings: 4
Canonical SMILES
OC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)[NH3+])CO)Cc1ccccc1)C)CCC(=O)O)Cc1ccc(cc1)O)CC(=O)N)CC(C)C)CC(C)C)C=O
InChI String
InChI=1S/C63H87N13O18/c1-32(2)22-44(57(88)68-39(29-77)30-78)70-58(89)45(23-33(3)4)71-61(92)49(27-51(64)82)75-60(91)48(26-38-28-66-42-15-11-10-14-41(38)42)74-59(90)47(25-37-16-18-40(81)19-17-37)72-55(86)43(20-21-52(83)84)69-54(85)34(5)67-56(87)46(24-36-12-8-7-9-13-36)73-62(93)50(31-79)76-63(94)53(65)35(6)80/h7-19,28-29,32-35,39,43-50,53,66,78-81H,20-27,30-31,65H2,1-6H3,(H2,64,82)(H,67,87)(H,68,88)(H,69,85)(H,70,89)(H,71,92)(H,72,86)(H,73,93)(H,74,90)(H,75,91)(H,76,94)(H,83,84)/p+1/t34-,35+,39+,43-,44-,45-,46-,47-,48-,49-,50-,53-/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):
Q00987
Entrez Gene ID
NCBI Entrez Gene ID:
4193
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 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