Browse entries in the PDBbind-CN Database
HEADER 3DGO_COMPLEX COMPND 3DGO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 69 ASP ASP ASP ASP LYS LYS THR ASN TRP LEU LYS ARG ILE SEQRES 2 A 69 TYR ARG VAL ARG PRO CYS VAL LYS CYS LYS VAL ALA PRO SEQRES 3 A 69 ARG ASP TRP LYS VAL LYS ASN LYS HIS LEU ARG ILE PHE SEQRES 4 A 69 ASN MET CYS LYS THR CYS PHE ASN ASN SER ILE ASP ILE SEQRES 5 A 69 GLY ASP ASP THR TYR HIS GLY HIS VAL ASP TRP LEU MET SEQRES 6 A 69 TYR ALA ASP SER SEQRES 1 B 69 ASP ASP ASP ASP LYS LYS THR ASN TRP LEU LYS ARG ILE SEQRES 2 B 69 TYR ARG VAL ARG PRO CYS VAL LYS CYS LYS VAL ALA PRO SEQRES 3 B 69 ARG ASP TRP LYS VAL LYS ASN LYS HIS LEU ARG ILE PHE SEQRES 4 B 69 ASN MET CYS LYS THR CYS PHE ASN ASN SER ILE ASP ILE SEQRES 5 B 69 GLY ASP ASP THR TYR HIS GLY HIS VAL ASP TRP LEU MET SEQRES 6 B 69 TYR ALA ASP SER HET ZN A 1 1 HET ZN A 2 1 HET ATP A 203 43 ATOM 1 N ASP A 5 -14.184 31.103 7.245 1.00 51.83 N ATOM 2 CA ASP A 5 -13.834 29.689 6.826 1.00 51.35 C ATOM 3 C ASP A 5 -13.893 29.539 5.286 1.00 49.72 C ATOM 4 O ASP A 5 -14.847 29.974 4.650 1.00 49.66 O ATOM 5 CB ASP A 5 -14.736 28.686 7.544 1.00 52.05 C ATOM 6 CG ASP A 5 -14.656 27.292 6.939 1.00 54.59 C ATOM 7 OD1 ASP A 5 -15.025 27.173 5.774 1.00 59.88 O ATOM 8 OD2 ASP A 5 -14.250 26.308 7.586 1.00 56.04 O ATOM 9 HA ASP A 5 -12.807 29.474 7.123 1.00 0.00 H ATOM 10 HB2 ASP A 5 -14.435 28.631 8.590 1.00 0.00 H ATOM 11 HB3 ASP A 5 -15.767 29.036 7.482 1.00 0.00 H ATOM 12 HN3 ASP A 5 -15.146 31.331 6.923 1.00 0.00 H ATOM 13 HN2 ASP A 5 -13.508 31.767 6.817 1.00 0.00 H ATOM 14 HN1 ASP A 5 -14.137 31.178 8.281 1.00 0.00 H ATOM 15 N ASP A 6 -12.863 28.944 4.688 1.00 48.28 N ATOM 16 CA ASP A 6 -12.701 28.992 3.202 1.00 46.56 C ATOM 17 C ASP A 6 -13.742 28.175 2.410 1.00 45.98 C ATOM 18 O ASP A 6 -14.126 28.605 1.316 1.00 45.13 O ATOM 19 CB ASP A 6 -11.255 28.670 2.708 1.00 45.19 C ATOM 20 CG ASP A 6 -10.198 29.658 3.218 1.00 44.05 C ATOM 21 OD1 ASP A 6 -10.520 30.883 3.423 1.00 37.42 O ATOM 22 OD2 ASP A 6 -9.032 29.182 3.386 1.00 43.32 O ATOM 23 HA ASP A 6 -12.896 30.041 2.978 1.00 0.00 H ATOM 24 HB2 ASP A 6 -10.988 27.671 3.052 1.00 0.00 H ATOM 25 HB3 ASP A 6 -11.250 28.691 1.618 1.00 0.00 H ATOM 26 H ASP A 6 -12.160 28.438 5.263 1.00 0.00 H ATOM 27 N ASP A 7 -14.176 27.015 2.949 1.00 44.92 N ATOM 28 CA ASP A 7 -15.225 26.181 2.309 1.00 44.35 C ATOM 29 C ASP A 7 -16.521 26.941 2.202 1.00 44.19 C ATOM 30 O ASP A 7 -17.298 26.690 1.283 1.00 44.84 O ATOM 31 CB ASP A 7 -15.523 24.910 3.084 1.00 43.88 C ATOM 32 CG ASP A 7 -14.388 23.878 3.019 1.00 47.46 C ATOM 33 OD1 ASP A 7 -14.124 23.216 4.067 1.00 49.16 O ATOM 34 OD2 ASP A 7 -13.764 23.709 1.935 1.00 47.03 O ATOM 35 HA ASP A 7 -14.830 25.923 1.327 1.00 0.00 H ATOM 36 HB2 ASP A 7 -15.692 25.173 4.128 1.00 0.00 H ATOM 37 HB3 ASP A 7 -16.426 24.458 2.673 1.00 0.00 H ATOM 38 H ASP A 7 -13.760 26.694 3.846 1.00 0.00 H ATOM 39 N ASP A 8 -16.766 27.858 3.142 1.00 43.47 N ATOM 40 CA ASP A 8 -17.989 28.657 3.116 1.00 43.67 C ATOM 41 C ASP A 8 -17.935 29.705 2.029 1.00 42.17 C ATOM 42 O ASP A 8 -18.995 30.141 1.543 1.00 41.79 O ATOM 43 CB ASP A 8 -18.276 29.373 4.461 1.00 44.49 C ATOM 44 CG ASP A 8 -18.669 28.390 5.621 1.00 50.43 C ATOM 45 OD1 ASP A 8 -18.452 28.812 6.785 1.00 57.53 O ATOM 46 OD2 ASP A 8 -19.143 27.220 5.411 1.00 52.94 O ATOM 47 HA ASP A 8 -18.792 27.946 2.922 1.00 0.00 H ATOM 48 HB2 ASP A 8 -17.381 29.919 4.759 1.00 0.00 H ATOM 49 HB3 ASP A 8 -19.096 30.075 4.311 1.00 0.00 H ATOM 50 H ASP A 8 -16.075 28.006 3.905 1.00 0.00 H ATOM 51 N LYS A 9 -16.724 30.159 1.686 1.00 40.43 N ATOM 52 CA LYS A 9 -16.588 31.149 0.634 1.00 39.09 C ATOM 53 C LYS A 9 -17.015 30.449 -0.638 1.00 39.05 C ATOM 54 O LYS A 9 -17.736 31.022 -1.470 1.00 40.89 O ATOM 55 CB LYS A 9 -15.147 31.616 0.481 1.00 38.80 C ATOM 56 CG LYS A 9 -14.520 32.303 1.661 1.00 38.92 C ATOM 57 CD LYS A 9 -13.218 33.007 1.137 1.00 41.47 C ATOM 58 CE LYS A 9 -12.634 34.006 2.106 1.00 39.96 C ATOM 59 NZ LYS A 9 -12.411 33.422 3.410 1.00 35.64 N ATOM 60 HA LYS A 9 -17.188 32.030 0.861 1.00 0.00 H ATOM 61 HB2 LYS A 9 -14.541 30.740 0.251 1.00 0.00 H ATOM 62 HB3 LYS A 9 -15.114 32.310 -0.359 1.00 0.00 H ATOM 63 HG2 LYS A 9 -15.207 33.042 2.074 1.00 0.00 H ATOM 64 HG3 LYS A 9 -14.269 31.573 2.431 1.00 0.00 H ATOM 65 HD2 LYS A 9 -12.468 32.241 0.939 1.00 0.00 H ATOM 66 HD3 LYS A 9 -13.458 33.527 0.209 1.00 0.00 H ATOM 67 HE2 LYS A 9 -13.324 34.844 2.208 1.00 0.00 H ATOM 68 HE3 LYS A 9 -11.683 34.365 1.713 1.00 0.00 H ATOM 69 HZ1 LYS A 9 -13.315 33.082 3.796 1.00 0.00 H ATOM 70 HZ2 LYS A 9 -11.749 32.625 3.323 1.00 0.00 H ATOM 71 HZ3 LYS A 9 -12.009 34.140 4.046 1.00 0.00 H ATOM 72 H LYS A 9 -15.878 29.801 2.175 1.00 0.00 H ATOM 73 N LYS A 10 -16.561 29.205 -0.790 1.00 38.07 N ATOM 74 CA LYS A 10 -16.831 28.388 -1.956 1.00 37.34 C ATOM 75 C LYS A 10 -18.348 28.111 -2.079 1.00 37.49 C ATOM 76 O LYS A 10 -18.959 28.398 -3.121 1.00 37.62 O ATOM 77 CB LYS A 10 -16.006 27.086 -1.916 1.00 36.50 C ATOM 78 CG LYS A 10 -16.374 26.098 -3.026 1.00 35.96 C ATOM 79 CD LYS A 10 -16.140 26.655 -4.471 1.00 34.12 C ATOM 80 CE LYS A 10 -14.672 26.814 -4.818 1.00 36.07 C ATOM 81 NZ LYS A 10 -14.179 25.752 -5.737 1.00 36.12 N ATOM 82 HA LYS A 10 -16.523 28.934 -2.848 1.00 0.00 H ATOM 83 HB2 LYS A 10 -14.951 27.342 -2.017 1.00 0.00 H ATOM 84 HB3 LYS A 10 -16.171 26.602 -0.954 1.00 0.00 H ATOM 85 HG2 LYS A 10 -15.769 25.200 -2.901 1.00 0.00 H ATOM 86 HG3 LYS A 10 -17.428 25.842 -2.923 1.00 0.00 H ATOM 87 HD2 LYS A 10 -16.593 25.968 -5.185 1.00 0.00 H ATOM 88 HD3 LYS A 10 -16.623 27.629 -4.550 1.00 0.00 H ATOM 89 HE2 LYS A 10 -14.090 26.776 -3.897 1.00 0.00 H ATOM 90 HE3 LYS A 10 -14.530 27.783 -5.297 1.00 0.00 H ATOM 91 HZ1 LYS A 10 -14.301 24.822 -5.288 1.00 0.00 H ATOM 92 HZ2 LYS A 10 -14.721 25.784 -6.624 1.00 0.00 H ATOM 93 HZ3 LYS A 10 -13.171 25.911 -5.939 1.00 0.00 H ATOM 94 H LYS A 10 -15.980 28.798 -0.029 1.00 0.00 H ATOM 95 N THR A 11 -18.939 27.567 -1.023 1.00 37.82 N ATOM 96 CA THR A 11 -20.378 27.324 -0.956 1.00 37.50 C ATOM 97 C THR A 11 -21.224 28.597 -1.247 1.00 39.08 C ATOM 98 O THR A 11 -22.224 28.515 -2.016 1.00 38.09 O ATOM 99 CB THR A 11 -20.747 26.742 0.441 1.00 38.52 C ATOM 100 OG1 THR A 11 -20.101 25.475 0.566 1.00 32.94 O ATOM 101 CG2 THR A 11 -22.314 26.566 0.627 1.00 34.95 C ATOM 102 HA THR A 11 -20.619 26.604 -1.738 1.00 0.00 H ATOM 103 HB THR A 11 -20.416 27.438 1.212 1.00 0.00 H ATOM 104 HG1 THR A 11 -20.417 24.873 -0.153 1.00 0.00 H ATOM 105 HG23 THR A 11 -22.801 27.536 0.531 1.00 0.00 H ATOM 106 HG21 THR A 11 -22.696 25.889 -0.137 1.00 0.00 H ATOM 107 HG22 THR A 11 -22.517 26.153 1.615 1.00 0.00 H ATOM 108 H THR A 11 -18.352 27.302 -0.207 1.00 0.00 H ATOM 109 N ASN A 12 -20.850 29.766 -0.686 1.00 39.07 N ATOM 110 CA ASN A 12 -21.687 30.957 -0.967 1.00 40.26 C ATOM 111 C ASN A 12 -21.512 31.311 -2.397 1.00 39.17 C ATOM 112 O ASN A 12 -22.494 31.611 -3.073 1.00 39.68 O ATOM 113 CB ASN A 12 -21.458 32.193 -0.065 1.00 41.23 C ATOM 114 CG ASN A 12 -21.612 31.853 1.446 1.00 48.57 C ATOM 115 OD1 ASN A 12 -22.309 30.881 1.830 1.00 53.83 O ATOM 116 ND2 ASN A 12 -20.918 32.625 2.307 1.00 53.37 N ATOM 117 HA ASN A 12 -22.711 30.668 -0.731 1.00 0.00 H ATOM 118 HB2 ASN A 12 -20.452 32.574 -0.239 1.00 0.00 H ATOM 119 HB3 ASN A 12 -22.186 32.960 -0.329 1.00 0.00 H ATOM 120 HD22 ASN A 12 -20.352 33.421 1.951 1.00 0.00 H ATOM 121 HD21 ASN A 12 -20.949 32.424 3.327 1.00 0.00 H ATOM 122 H ASN A 12 -20.007 29.829 -0.080 1.00 0.00 H ATOM 123 N TRP A 13 -20.288 31.222 -2.899 1.00 37.79 N ATOM 124 CA TRP A 13 -20.135 31.465 -4.319 1.00 36.91 C ATOM 125 C TRP A 13 -21.030 30.544 -5.138 1.00 36.46 C ATOM 126 O TRP A 13 -21.695 31.014 -6.026 1.00 37.25 O ATOM 127 CB TRP A 13 -18.696 31.332 -4.789 1.00 36.86 C ATOM 128 CG TRP A 13 -18.064 32.641 -4.909 1.00 37.37 C ATOM 129 CD1 TRP A 13 -16.973 33.068 -4.242 1.00 35.09 C ATOM 130 CD2 TRP A 13 -18.500 33.744 -5.742 1.00 36.16 C ATOM 131 NE1 TRP A 13 -16.675 34.366 -4.601 1.00 32.84 N ATOM 132 CE2 TRP A 13 -17.598 34.815 -5.507 1.00 34.77 C ATOM 133 CE3 TRP A 13 -19.566 33.927 -6.666 1.00 35.14 C ATOM 134 CZ2 TRP A 13 -17.688 36.064 -6.188 1.00 33.27 C ATOM 135 CZ3 TRP A 13 -19.667 35.172 -7.349 1.00 34.40 C ATOM 136 CH2 TRP A 13 -18.707 36.210 -7.107 1.00 34.46 C ATOM 137 HA TRP A 13 -20.440 32.499 -4.479 1.00 0.00 H ATOM 138 HB2 TRP A 13 -18.139 30.731 -4.070 1.00 0.00 H ATOM 139 HB3 TRP A 13 -18.682 30.838 -5.761 1.00 0.00 H ATOM 140 HE1 TRP A 13 -15.872 34.919 -4.239 1.00 0.00 H ATOM 141 HD1 TRP A 13 -16.408 32.474 -3.523 1.00 0.00 H ATOM 142 HZ2 TRP A 13 -16.981 36.870 -5.991 1.00 0.00 H ATOM 143 HH2 TRP A 13 -18.785 37.142 -7.666 1.00 0.00 H ATOM 144 HZ3 TRP A 13 -20.477 35.337 -8.059 1.00 0.00 H ATOM 145 HE3 TRP A 13 -20.289 33.132 -6.847 1.00 0.00 H ATOM 146 H TRP A 13 -19.472 30.988 -2.298 1.00 0.00 H ATOM 147 N LEU A 14 -21.050 29.237 -4.854 1.00 35.48 N ATOM 148 CA LEU A 14 -21.778 28.273 -5.716 1.00 34.42 C ATOM 149 C LEU A 14 -23.264 28.529 -5.615 1.00 35.29 C ATOM 150 O LEU A 14 -24.026 28.352 -6.589 1.00 34.53 O ATOM 151 CB LEU A 14 -21.487 26.853 -5.293 1.00 32.38 C ATOM 152 CG LEU A 14 -20.061 26.402 -5.618 1.00 32.19 C ATOM 153 CD1 LEU A 14 -19.963 24.915 -5.305 1.00 30.60 C ATOM 154 CD2 LEU A 14 -19.569 26.697 -7.079 1.00 24.94 C ATOM 155 HA LEU A 14 -21.445 28.408 -6.745 1.00 0.00 H ATOM 156 HB2 LEU A 14 -21.637 26.775 -4.216 1.00 0.00 H ATOM 157 HB3 LEU A 14 -22.184 26.190 -5.805 1.00 0.00 H ATOM 158 HG LEU A 14 -19.392 26.999 -4.998 1.00 0.00 H ATOM 159 HD21 LEU A 14 -20.220 26.188 -7.790 1.00 0.00 H ATOM 160 HD22 LEU A 14 -19.599 27.771 -7.261 1.00 0.00 H ATOM 161 HD23 LEU A 14 -18.547 26.336 -7.197 1.00 0.00 H ATOM 162 HD11 LEU A 14 -20.181 24.752 -4.250 1.00 0.00 H ATOM 163 HD12 LEU A 14 -20.682 24.368 -5.915 1.00 0.00 H ATOM 164 HD13 LEU A 14 -18.955 24.564 -5.527 1.00 0.00 H ATOM 165 H LEU A 14 -20.546 28.890 -4.013 1.00 0.00 H ATOM 166 N LYS A 15 -23.664 28.978 -4.424 1.00 36.41 N ATOM 167 CA LYS A 15 -25.054 29.344 -4.158 1.00 38.37 C ATOM 168 C LYS A 15 -25.465 30.537 -5.021 1.00 37.71 C ATOM 169 O LYS A 15 -26.505 30.477 -5.707 1.00 38.35 O ATOM 170 CB LYS A 15 -25.207 29.583 -2.689 1.00 38.96 C ATOM 171 CG LYS A 15 -26.562 30.084 -2.221 1.00 47.39 C ATOM 172 CD LYS A 15 -26.652 29.761 -0.699 1.00 56.78 C ATOM 173 CE LYS A 15 -25.874 28.388 -0.484 1.00 58.38 C ATOM 174 NZ LYS A 15 -26.441 27.372 0.499 1.00 61.22 N ATOM 175 HA LYS A 15 -25.733 28.537 -4.433 1.00 0.00 H ATOM 176 HB2 LYS A 15 -25.007 28.641 -2.178 1.00 0.00 H ATOM 177 HB3 LYS A 15 -24.461 30.321 -2.394 1.00 0.00 H ATOM 178 HG2 LYS A 15 -26.643 31.159 -2.384 1.00 0.00 H ATOM 179 HG3 LYS A 15 -27.359 29.575 -2.762 1.00 0.00 H ATOM 180 HD2 LYS A 15 -26.184 30.555 -0.117 1.00 0.00 H ATOM 181 HD3 LYS A 15 -27.694 29.656 -0.397 1.00 0.00 H ATOM 182 HE2 LYS A 15 -24.869 28.638 -0.143 1.00 0.00 H ATOM 183 HE3 LYS A 15 -25.815 27.897 -1.455 1.00 0.00 H ATOM 184 HZ1 LYS A 15 -26.491 27.798 1.446 1.00 0.00 H ATOM 185 HZ2 LYS A 15 -27.394 27.090 0.193 1.00 0.00 H ATOM 186 HZ3 LYS A 15 -25.823 26.536 0.526 1.00 0.00 H ATOM 187 H LYS A 15 -22.964 29.071 -3.660 1.00 0.00 H ATOM 188 N ARG A 16 -24.608 31.563 -5.081 1.00 36.62 N ATOM 189 CA ARG A 16 -24.831 32.690 -5.966 1.00 35.74 C ATOM 190 C ARG A 16 -24.790 32.382 -7.479 1.00 35.72 C ATOM 191 O ARG A 16 -25.691 32.838 -8.208 1.00 36.63 O ATOM 192 CB ARG A 16 -23.821 33.773 -5.674 1.00 36.42 C ATOM 193 CG ARG A 16 -24.049 35.001 -6.487 1.00 38.49 C ATOM 194 CD ARG A 16 -23.125 36.089 -6.008 1.00 47.89 C ATOM 195 NE ARG A 16 -23.291 37.245 -6.883 1.00 54.63 N ATOM 196 CZ ARG A 16 -24.289 38.113 -6.747 1.00 58.81 C ATOM 197 NH1 ARG A 16 -25.167 37.973 -5.744 1.00 58.88 N ATOM 198 NH2 ARG A 16 -24.410 39.112 -7.610 1.00 57.75 N ATOM 199 HA ARG A 16 -25.854 33.002 -5.754 1.00 0.00 H ATOM 200 HB2 ARG A 16 -23.885 34.036 -4.618 1.00 0.00 H ATOM 201 HB3 ARG A 16 -22.824 33.390 -5.892 1.00 0.00 H ATOM 202 HG2 ARG A 16 -23.847 34.787 -7.537 1.00 0.00 H ATOM 203 HG3 ARG A 16 -25.084 35.326 -6.376 1.00 0.00 H ATOM 204 HD2 ARG A 16 -22.093 35.741 -6.047 1.00 0.00 H ATOM 205 HD3 ARG A 16 -23.376 36.362 -4.983 1.00 0.00 H ATOM 206 HE ARG A 16 -22.600 37.396 -7.645 1.00 0.00 H ATOM 207 HH12 ARG A 16 -25.948 38.652 -5.638 1.00 0.00 H ATOM 208 HH11 ARG A 16 -25.068 37.185 -5.072 1.00 0.00 H ATOM 209 HH22 ARG A 16 -25.188 39.795 -7.510 1.00 0.00 H ATOM 210 HH21 ARG A 16 -23.727 39.213 -8.387 1.00 0.00 H ATOM 211 H ARG A 16 -23.761 31.552 -4.478 1.00 0.00 H ATOM 212 N ILE A 17 -23.736 31.682 -7.949 1.00 34.03 N ATOM 213 CA ILE A 17 -23.588 31.252 -9.313 1.00 32.77 C ATOM 214 C ILE A 17 -24.910 30.543 -9.721 1.00 33.34 C ATOM 215 O ILE A 17 -25.444 30.811 -10.785 1.00 34.67 O ATOM 216 CB ILE A 17 -22.372 30.279 -9.484 1.00 32.62 C ATOM 217 CG1 ILE A 17 -21.082 31.043 -9.697 1.00 33.69 C ATOM 218 CG2 ILE A 17 -22.526 29.391 -10.672 1.00 28.92 C ATOM 219 CD1 ILE A 17 -19.877 30.442 -8.921 1.00 28.63 C ATOM 220 HA ILE A 17 -23.392 32.113 -9.952 1.00 0.00 H ATOM 221 HB ILE A 17 -22.341 29.692 -8.566 1.00 0.00 H ATOM 222 HG12 ILE A 17 -20.847 31.036 -10.761 1.00 0.00 H ATOM 223 HG13 ILE A 17 -21.229 32.071 -9.366 1.00 0.00 H ATOM 224 HD11 ILE A 17 -20.093 30.452 -7.853 1.00 0.00 H ATOM 225 HD12 ILE A 17 -19.710 29.416 -9.250 1.00 0.00 H ATOM 226 HD13 ILE A 17 -18.986 31.038 -9.118 1.00 0.00 H ATOM 227 HG21 ILE A 17 -23.429 28.790 -10.561 1.00 0.00 H ATOM 228 HG22 ILE A 17 -22.603 30.001 -11.572 1.00 0.00 H ATOM 229 HG23 ILE A 17 -21.659 28.735 -10.749 1.00 0.00 H ATOM 230 H ILE A 17 -22.979 31.437 -7.279 1.00 0.00 H ATOM 231 N TYR A 18 -25.461 29.695 -8.866 1.00 32.62 N ATOM 232 CA TYR A 18 -26.619 28.918 -9.231 1.00 32.50 C ATOM 233 C TYR A 18 -27.854 29.816 -9.280 1.00 34.43 C ATOM 234 O TYR A 18 -28.724 29.632 -10.127 1.00 34.36 O ATOM 235 CB TYR A 18 -26.801 27.753 -8.250 1.00 30.71 C ATOM 236 CG TYR A 18 -27.972 26.883 -8.637 1.00 33.55 C ATOM 237 CD1 TYR A 18 -27.889 25.996 -9.732 1.00 33.01 C ATOM 238 CD2 TYR A 18 -29.215 26.998 -7.972 1.00 33.84 C ATOM 239 CE1 TYR A 18 -28.949 25.210 -10.109 1.00 28.89 C ATOM 240 CE2 TYR A 18 -30.303 26.213 -8.349 1.00 29.06 C ATOM 241 CZ TYR A 18 -30.161 25.342 -9.409 1.00 32.06 C ATOM 242 OH TYR A 18 -31.235 24.571 -9.764 1.00 30.19 O ATOM 243 HA TYR A 18 -26.476 28.494 -10.225 1.00 0.00 H ATOM 244 HB3 TYR A 18 -26.972 28.154 -7.251 1.00 0.00 H ATOM 245 HB2 TYR A 18 -25.895 27.147 -8.247 1.00 0.00 H ATOM 246 HD2 TYR A 18 -29.323 27.710 -7.154 1.00 0.00 H ATOM 247 HE2 TYR A 18 -31.250 26.286 -7.815 1.00 0.00 H ATOM 248 HE1 TYR A 18 -28.853 24.501 -10.931 1.00 0.00 H ATOM 249 HD1 TYR A 18 -26.957 25.934 -10.294 1.00 0.00 H ATOM 250 HH TYR A 18 -30.989 23.999 -10.534 1.00 0.00 H ATOM 251 H TYR A 18 -25.052 29.588 -7.916 1.00 0.00 H ATOM 252 N ARG A 19 -27.928 30.805 -8.376 1.00 36.90 N ATOM 253 CA ARG A 19 -29.149 31.593 -8.233 1.00 38.50 C ATOM 254 C ARG A 19 -29.225 32.560 -9.411 1.00 39.29 C ATOM 255 O ARG A 19 -30.253 32.604 -10.060 1.00 40.63 O ATOM 256 CB ARG A 19 -29.273 32.267 -6.841 1.00 38.60 C ATOM 257 CG ARG A 19 -30.439 33.253 -6.701 1.00 41.10 C ATOM 258 CD ARG A 19 -30.316 34.255 -5.464 1.00 49.49 C ATOM 259 NE ARG A 19 -29.040 35.018 -5.268 1.00 55.40 N ATOM 260 CZ ARG A 19 -28.012 34.667 -4.411 1.00 60.71 C ATOM 261 NH1 ARG A 19 -27.996 33.535 -3.634 1.00 54.55 N ATOM 262 NH2 ARG A 19 -26.932 35.459 -4.313 1.00 59.45 N ATOM 263 HA ARG A 19 -30.021 30.940 -8.267 1.00 0.00 H ATOM 264 HB2 ARG A 19 -29.402 31.483 -6.095 1.00 0.00 H ATOM 265 HB3 ARG A 19 -28.347 32.807 -6.643 1.00 0.00 H ATOM 266 HG2 ARG A 19 -30.496 33.845 -7.614 1.00 0.00 H ATOM 267 HG3 ARG A 19 -31.358 32.679 -6.584 1.00 0.00 H ATOM 268 HD2 ARG A 19 -30.479 33.668 -4.560 1.00 0.00 H ATOM 269 HD3 ARG A 19 -31.115 34.990 -5.568 1.00 0.00 H ATOM 270 HE ARG A 19 -28.917 35.887 -5.825 1.00 0.00 H ATOM 271 HH12 ARG A 19 -27.184 33.341 -3.014 1.00 0.00 H ATOM 272 HH11 ARG A 19 -28.796 32.871 -3.666 1.00 0.00 H ATOM 273 HH22 ARG A 19 -26.155 35.202 -3.671 1.00 0.00 H ATOM 274 HH21 ARG A 19 -26.872 36.329 -4.879 1.00 0.00 H ATOM 275 H ARG A 19 -27.108 31.012 -7.771 1.00 0.00 H ATOM 276 N VAL A 20 -28.147 33.269 -9.756 1.00 39.02 N ATOM 277 CA VAL A 20 -28.221 34.378 -10.771 1.00 39.07 C ATOM 278 C VAL A 20 -28.103 34.059 -12.316 1.00 40.05 C ATOM 279 O VAL A 20 -28.225 34.964 -13.159 1.00 39.82 O ATOM 280 CB VAL A 20 -27.198 35.524 -10.408 1.00 38.80 C ATOM 281 CG1 VAL A 20 -27.348 35.915 -8.917 1.00 37.93 C ATOM 282 CG2 VAL A 20 -25.761 35.097 -10.738 1.00 37.08 C ATOM 283 HA VAL A 20 -29.268 34.666 -10.673 1.00 0.00 H ATOM 284 HB VAL A 20 -27.421 36.403 -11.013 1.00 0.00 H ATOM 285 HG11 VAL A 20 -28.363 36.269 -8.736 1.00 0.00 H ATOM 286 HG12 VAL A 20 -27.148 35.044 -8.292 1.00 0.00 H ATOM 287 HG13 VAL A 20 -26.638 36.706 -8.677 1.00 0.00 H ATOM 288 HG21 VAL A 20 -25.508 34.205 -10.165 1.00 0.00 H ATOM 289 HG22 VAL A 20 -25.683 34.880 -11.803 1.00 0.00 H ATOM 290 HG23 VAL A 20 -25.075 35.904 -10.479 1.00 0.00 H ATOM 291 H VAL A 20 -27.233 33.049 -9.312 1.00 0.00 H ATOM 292 N ARG A 21 -27.819 32.798 -12.691 1.00 40.72 N ATOM 293 CA ARG A 21 -27.830 32.412 -14.094 1.00 40.20 C ATOM 294 C ARG A 21 -28.767 31.280 -14.277 1.00 39.44 C ATOM 295 O ARG A 21 -28.377 30.140 -14.116 1.00 40.77 O ATOM 296 CB ARG A 21 -26.444 32.045 -14.543 1.00 40.41 C ATOM 297 CG ARG A 21 -25.661 33.316 -14.705 1.00 45.61 C ATOM 298 CD ARG A 21 -24.462 33.162 -15.576 1.00 53.56 C ATOM 299 NE ARG A 21 -24.675 33.610 -16.956 1.00 60.05 N ATOM 300 CZ ARG A 21 -24.768 34.891 -17.344 1.00 63.97 C ATOM 301 NH1 ARG A 21 -24.725 35.879 -16.451 1.00 67.33 N ATOM 302 NH2 ARG A 21 -24.928 35.199 -18.635 1.00 62.91 N ATOM 303 HA ARG A 21 -28.165 33.250 -14.705 1.00 0.00 H ATOM 304 HB2 ARG A 21 -25.968 31.409 -13.796 1.00 0.00 H ATOM 305 HB3 ARG A 21 -26.491 31.514 -15.494 1.00 0.00 H ATOM 306 HG2 ARG A 21 -26.313 34.071 -15.144 1.00 0.00 H ATOM 307 HG3 ARG A 21 -25.333 33.649 -13.720 1.00 0.00 H ATOM 308 HD2 ARG A 21 -24.183 32.108 -15.595 1.00 0.00 H ATOM 309 HD3 ARG A 21 -23.647 33.745 -15.147 1.00 0.00 H ATOM 310 HE ARG A 21 -24.761 32.879 -17.690 1.00 0.00 H ATOM 311 HH12 ARG A 21 -24.798 36.868 -16.765 1.00 0.00 H ATOM 312 HH11 ARG A 21 -24.618 35.662 -15.440 1.00 0.00 H ATOM 313 HH22 ARG A 21 -24.999 36.195 -18.927 1.00 0.00 H ATOM 314 HH21 ARG A 21 -24.981 34.443 -19.347 1.00 0.00 H ATOM 315 H ARG A 21 -27.588 32.088 -11.967 1.00 0.00 H ATOM 316 N PRO A 22 -30.022 31.591 -14.599 1.00 39.17 N ATOM 317 CA PRO A 22 -31.108 30.613 -14.909 1.00 38.16 C ATOM 318 C PRO A 22 -30.871 29.819 -16.205 1.00 37.78 C ATOM 319 O PRO A 22 -29.922 30.097 -16.991 1.00 36.29 O ATOM 320 CB PRO A 22 -32.356 31.503 -15.073 1.00 37.54 C ATOM 321 CG PRO A 22 -31.802 32.834 -15.514 1.00 39.74 C ATOM 322 CD PRO A 22 -30.458 32.994 -14.787 1.00 39.75 C ATOM 323 HA PRO A 22 -31.183 29.858 -14.127 1.00 0.00 H ATOM 324 HD3 PRO A 22 -29.745 33.550 -15.396 1.00 0.00 H ATOM 325 HD2 PRO A 22 -30.586 33.498 -13.829 1.00 0.00 H ATOM 326 HG3 PRO A 22 -32.482 33.639 -15.235 1.00 0.00 H ATOM 327 HG2 PRO A 22 -31.653 32.844 -16.594 1.00 0.00 H ATOM 328 HB2 PRO A 22 -33.027 31.094 -15.828 1.00 0.00 H ATOM 329 HB3 PRO A 22 -32.890 31.600 -14.128 1.00 0.00 H ATOM 330 N CYS A 23 -31.727 28.820 -16.428 1.00 37.25 N ATOM 331 CA CYS A 23 -31.702 28.024 -17.631 1.00 36.98 C ATOM 332 C CYS A 23 -31.305 28.880 -18.865 1.00 37.84 C ATOM 333 O CYS A 23 -31.997 29.845 -19.170 1.00 39.05 O ATOM 334 CB CYS A 23 -33.115 27.460 -17.816 1.00 36.28 C ATOM 335 SG CYS A 23 -33.269 26.591 -19.377 1.00 36.51 S ATOM 336 HA CYS A 23 -30.962 27.229 -17.543 1.00 0.00 H ATOM 337 HB2 CYS A 23 -33.831 28.281 -17.794 1.00 0.00 H ATOM 338 HB3 CYS A 23 -33.331 26.769 -17.001 1.00 0.00 H ATOM 339 HG CYS A 23 -34.553 26.100 -19.504 1.00 0.00 H ATOM 340 H CYS A 23 -32.442 28.606 -15.704 1.00 0.00 H ATOM 341 N VAL A 24 -30.231 28.544 -19.592 1.00 38.65 N ATOM 342 CA VAL A 24 -29.868 29.306 -20.811 1.00 38.37 C ATOM 343 C VAL A 24 -30.983 29.410 -21.881 1.00 40.56 C ATOM 344 O VAL A 24 -30.866 30.252 -22.790 1.00 41.81 O ATOM 345 CB VAL A 24 -28.585 28.779 -21.565 1.00 38.24 C ATOM 346 CG1 VAL A 24 -27.343 28.811 -20.681 1.00 37.38 C ATOM 347 CG2 VAL A 24 -28.831 27.396 -22.167 1.00 34.51 C ATOM 348 HA VAL A 24 -29.677 30.287 -20.376 1.00 0.00 H ATOM 349 HB VAL A 24 -28.387 29.463 -22.390 1.00 0.00 H ATOM 350 HG11 VAL A 24 -27.152 29.836 -20.362 1.00 0.00 H ATOM 351 HG12 VAL A 24 -27.505 28.181 -19.806 1.00 0.00 H ATOM 352 HG13 VAL A 24 -26.488 28.439 -21.245 1.00 0.00 H ATOM 353 HG21 VAL A 24 -29.082 26.694 -21.372 1.00 0.00 H ATOM 354 HG22 VAL A 24 -29.656 27.452 -22.877 1.00 0.00 H ATOM 355 HG23 VAL A 24 -27.930 27.059 -22.680 1.00 0.00 H ATOM 356 H VAL A 24 -29.644 27.738 -19.297 1.00 0.00 H ATOM 357 N LYS A 25 -32.024 28.566 -21.799 1.00 40.66 N ATOM 358 CA LYS A 25 -33.066 28.460 -22.843 1.00 40.99 C ATOM 359 C LYS A 25 -34.359 29.172 -22.489 1.00 42.60 C ATOM 360 O LYS A 25 -34.811 30.024 -23.250 1.00 44.63 O ATOM 361 CB LYS A 25 -33.399 27.004 -23.168 1.00 40.38 C ATOM 362 CG LYS A 25 -34.495 26.820 -24.178 1.00 36.90 C ATOM 363 CD LYS A 25 -34.045 27.131 -25.590 1.00 32.54 C ATOM 364 CE LYS A 25 -35.265 27.169 -26.492 1.00 30.47 C ATOM 365 NZ LYS A 25 -34.847 27.712 -27.824 1.00 28.51 N ATOM 366 HA LYS A 25 -32.629 28.952 -23.712 1.00 0.00 H ATOM 367 HB2 LYS A 25 -32.498 26.528 -23.554 1.00 0.00 H ATOM 368 HB3 LYS A 25 -33.702 26.511 -22.244 1.00 0.00 H ATOM 369 HG2 LYS A 25 -34.835 25.785 -24.140 1.00 0.00 H ATOM 370 HG3 LYS A 25 -35.322 27.482 -23.921 1.00 0.00 H ATOM 371 HD2 LYS A 25 -33.543 28.098 -25.611 1.00 0.00 H ATOM 372 HD3 LYS A 25 -33.357 26.359 -25.935 1.00 0.00 H ATOM 373 HE2 LYS A 25 -36.028 27.813 -26.054 1.00 0.00 H ATOM 374 HE3 LYS A 25 -35.666 26.163 -26.613 1.00 0.00 H ATOM 375 HZ1 LYS A 25 -34.463 28.671 -27.701 1.00 0.00 H ATOM 376 HZ2 LYS A 25 -34.117 27.095 -28.235 1.00 0.00 H ATOM 377 HZ3 LYS A 25 -35.671 27.746 -28.457 1.00 0.00 H ATOM 378 H LYS A 25 -32.101 27.957 -20.960 1.00 0.00 H ATOM 379 N CYS A 26 -34.995 28.834 -21.377 1.00 42.97 N ATOM 380 CA CYS A 26 -36.207 29.584 -21.034 1.00 43.12 C ATOM 381 C CYS A 26 -35.848 30.846 -20.273 1.00 43.10 C ATOM 382 O CYS A 26 -36.705 31.662 -20.063 1.00 44.05 O ATOM 383 CB CYS A 26 -37.193 28.734 -20.228 1.00 42.68 C ATOM 384 SG CYS A 26 -36.467 28.271 -18.613 1.00 42.40 S ATOM 385 HA CYS A 26 -36.700 29.860 -21.966 1.00 0.00 H ATOM 386 HB2 CYS A 26 -37.429 27.829 -20.788 1.00 0.00 H ATOM 387 HB3 CYS A 26 -38.106 29.305 -20.061 1.00 0.00 H ATOM 388 HG CYS A 26 -35.312 27.544 -18.821 1.00 0.00 H ATOM 389 H CYS A 26 -34.647 28.065 -20.770 1.00 0.00 H ATOM 390 N LYS A 27 -34.608 30.975 -19.801 1.00 43.60 N ATOM 391 CA LYS A 27 -34.153 32.196 -19.205 1.00 44.10 C ATOM 392 C LYS A 27 -34.850 32.525 -17.874 1.00 45.01 C ATOM 393 O LYS A 27 -34.611 33.566 -17.299 1.00 45.64 O ATOM 394 CB LYS A 27 -34.366 33.343 -20.207 1.00 44.60 C ATOM 395 CG LYS A 27 -33.500 33.291 -21.516 1.00 45.64 C ATOM 396 CD LYS A 27 -32.092 33.828 -21.254 1.00 53.43 C ATOM 397 CE LYS A 27 -31.218 33.617 -22.497 1.00 58.74 C ATOM 398 NZ LYS A 27 -32.260 33.695 -23.577 1.00 54.42 N ATOM 399 HA LYS A 27 -33.096 32.071 -18.970 1.00 0.00 H ATOM 400 HB2 LYS A 27 -35.415 33.337 -20.502 1.00 0.00 H ATOM 401 HB3 LYS A 27 -34.139 34.278 -19.695 1.00 0.00 H ATOM 402 HG2 LYS A 27 -33.432 32.259 -21.859 1.00 0.00 H ATOM 403 HG3 LYS A 27 -33.977 33.898 -22.286 1.00 0.00 H ATOM 404 HD2 LYS A 27 -32.147 34.892 -21.026 1.00 0.00 H ATOM 405 HD3 LYS A 27 -31.653 33.298 -20.408 1.00 0.00 H ATOM 406 HE2 LYS A 27 -30.724 32.645 -22.483 1.00 0.00 H ATOM 407 HE3 LYS A 27 -30.469 34.402 -22.602 1.00 0.00 H ATOM 408 HZ1 LYS A 27 -32.968 32.947 -23.429 1.00 0.00 H ATOM 409 HZ2 LYS A 27 -32.724 34.625 -23.543 1.00 0.00 H ATOM 410 HZ3 LYS A 27 -31.807 33.566 -24.504 1.00 0.00 H ATOM 411 H LYS A 27 -33.954 30.169 -19.867 1.00 0.00 H ATOM 412 N VAL A 28 -35.710 31.648 -17.369 1.00 45.66 N ATOM 413 CA VAL A 28 -36.435 31.875 -16.091 1.00 44.78 C ATOM 414 C VAL A 28 -36.247 30.768 -15.026 1.00 43.78 C ATOM 415 O VAL A 28 -35.852 31.072 -13.888 1.00 44.70 O ATOM 416 CB VAL A 28 -37.970 32.085 -16.308 1.00 45.07 C ATOM 417 CG1 VAL A 28 -38.638 32.334 -14.962 1.00 45.18 C ATOM 418 CG2 VAL A 28 -38.189 33.299 -17.160 1.00 45.02 C ATOM 419 HA VAL A 28 -35.974 32.785 -15.707 1.00 0.00 H ATOM 420 HB VAL A 28 -38.388 31.200 -16.787 1.00 0.00 H ATOM 421 HG11 VAL A 28 -38.475 31.474 -14.312 1.00 0.00 H ATOM 422 HG12 VAL A 28 -38.208 33.225 -14.504 1.00 0.00 H ATOM 423 HG13 VAL A 28 -39.708 32.481 -15.110 1.00 0.00 H ATOM 424 HG21 VAL A 28 -37.768 34.172 -16.661 1.00 0.00 H ATOM 425 HG22 VAL A 28 -37.700 33.158 -18.124 1.00 0.00 H ATOM 426 HG23 VAL A 28 -39.258 33.447 -17.312 1.00 0.00 H ATOM 427 H VAL A 28 -35.884 30.765 -17.890 1.00 0.00 H ATOM 428 N ALA A 29 -36.564 29.506 -15.362 1.00 41.32 N ATOM 429 CA ALA A 29 -36.315 28.355 -14.464 1.00 38.08 C ATOM 430 C ALA A 29 -34.819 28.195 -14.155 1.00 36.99 C ATOM 431 O ALA A 29 -33.947 28.518 -14.989 1.00 35.52 O ATOM 432 CB ALA A 29 -36.884 27.058 -15.052 1.00 38.70 C ATOM 433 HA ALA A 29 -36.832 28.560 -13.527 1.00 0.00 H ATOM 434 HB1 ALA A 29 -37.960 27.165 -15.191 1.00 0.00 H ATOM 435 HB2 ALA A 29 -36.411 26.858 -16.013 1.00 0.00 H ATOM 436 HB3 ALA A 29 -36.685 26.233 -14.369 1.00 0.00 H ATOM 437 H ALA A 29 -37.001 29.331 -16.289 1.00 0.00 H ATOM 438 N PRO A 30 -34.513 27.746 -12.928 1.00 36.32 N ATOM 439 CA PRO A 30 -33.101 27.511 -12.580 1.00 35.54 C ATOM 440 C PRO A 30 -32.596 26.218 -13.223 1.00 34.29 C ATOM 441 O PRO A 30 -33.392 25.399 -13.678 1.00 33.82 O ATOM 442 CB PRO A 30 -33.155 27.403 -11.049 1.00 35.66 C ATOM 443 CG PRO A 30 -34.531 26.945 -10.752 1.00 35.31 C ATOM 444 CD PRO A 30 -35.387 27.654 -11.743 1.00 35.36 C ATOM 445 HA PRO A 30 -32.420 28.287 -12.929 1.00 0.00 H ATOM 446 HD3 PRO A 30 -36.288 27.082 -11.964 1.00 0.00 H ATOM 447 HD2 PRO A 30 -35.666 28.644 -11.383 1.00 0.00 H ATOM 448 HG3 PRO A 30 -34.815 27.215 -9.735 1.00 0.00 H ATOM 449 HG2 PRO A 30 -34.612 25.865 -10.876 1.00 0.00 H ATOM 450 HB2 PRO A 30 -32.423 26.680 -10.688 1.00 0.00 H ATOM 451 HB3 PRO A 30 -32.964 28.372 -10.588 1.00 0.00 H ATOM 452 N ARG A 31 -31.287 26.028 -13.272 1.00 34.19 N ATOM 453 CA ARG A 31 -30.734 24.919 -14.043 1.00 33.31 C ATOM 454 C ARG A 31 -30.875 23.570 -13.330 1.00 33.90 C ATOM 455 O ARG A 31 -30.922 23.510 -12.073 1.00 33.91 O ATOM 456 CB ARG A 31 -29.283 25.198 -14.342 1.00 32.90 C ATOM 457 CG ARG A 31 -29.121 26.281 -15.378 1.00 33.92 C ATOM 458 CD ARG A 31 -27.697 26.743 -15.464 1.00 33.19 C ATOM 459 NE ARG A 31 -27.676 28.043 -16.112 1.00 37.08 N ATOM 460 CZ ARG A 31 -26.637 28.547 -16.772 1.00 39.40 C ATOM 461 NH1 ARG A 31 -25.477 27.863 -16.891 1.00 33.45 N ATOM 462 NH2 ARG A 31 -26.765 29.749 -17.314 1.00 37.61 N ATOM 463 HA ARG A 31 -31.306 24.844 -14.968 1.00 0.00 H ATOM 464 HB2 ARG A 31 -28.788 25.512 -13.423 1.00 0.00 H ATOM 465 HB3 ARG A 31 -28.817 24.284 -14.711 1.00 0.00 H ATOM 466 HG2 ARG A 31 -29.428 25.893 -16.349 1.00 0.00 H ATOM 467 HG3 ARG A 31 -29.754 27.127 -15.110 1.00 0.00 H ATOM 468 HD2 ARG A 31 -27.113 26.031 -16.047 1.00 0.00 H ATOM 469 HD3 ARG A 31 -27.274 26.823 -14.462 1.00 0.00 H ATOM 470 HE ARG A 31 -28.538 28.623 -16.056 1.00 0.00 H ATOM 471 HH12 ARG A 31 -24.679 28.279 -17.412 1.00 0.00 H ATOM 472 HH11 ARG A 31 -25.383 26.921 -16.461 1.00 0.00 H ATOM 473 HH22 ARG A 31 -25.971 30.171 -17.837 1.00 0.00 H ATOM 474 HH21 ARG A 31 -27.659 30.271 -17.217 1.00 0.00 H ATOM 475 H ARG A 31 -30.650 26.671 -12.759 1.00 0.00 H ATOM 476 N ASP A 32 -30.928 22.493 -14.120 1.00 32.80 N ATOM 477 CA ASP A 32 -30.713 21.214 -13.572 1.00 33.49 C ATOM 478 C ASP A 32 -29.268 21.082 -13.065 1.00 34.79 C ATOM 479 O ASP A 32 -28.386 21.843 -13.454 1.00 34.99 O ATOM 480 CB ASP A 32 -30.970 20.146 -14.609 1.00 34.25 C ATOM 481 CG ASP A 32 -31.364 18.801 -13.959 1.00 35.65 C ATOM 482 OD1 ASP A 32 -31.486 18.699 -12.720 1.00 37.45 O ATOM 483 OD2 ASP A 32 -31.587 17.840 -14.688 1.00 39.89 O ATOM 484 HA ASP A 32 -31.403 21.085 -12.738 1.00 0.00 H ATOM 485 HB2 ASP A 32 -31.779 20.474 -15.261 1.00 0.00 H ATOM 486 HB3 ASP A 32 -30.065 20.002 -15.199 1.00 0.00 H ATOM 487 H ASP A 32 -31.127 22.599 -15.135 1.00 0.00 H ATOM 488 N TRP A 33 -29.021 20.094 -12.209 1.00 35.92 N ATOM 489 CA TRP A 33 -27.712 19.944 -11.548 1.00 36.40 C ATOM 490 C TRP A 33 -27.619 18.551 -10.907 1.00 37.43 C ATOM 491 O TRP A 33 -28.652 17.934 -10.612 1.00 37.01 O ATOM 492 CB TRP A 33 -27.545 21.025 -10.470 1.00 35.19 C ATOM 493 CG TRP A 33 -28.568 20.903 -9.344 1.00 32.61 C ATOM 494 CD1 TRP A 33 -29.806 21.466 -9.313 1.00 30.68 C ATOM 495 CD2 TRP A 33 -28.420 20.191 -8.082 1.00 31.39 C ATOM 496 NE1 TRP A 33 -30.451 21.131 -8.139 1.00 28.60 N ATOM 497 CE2 TRP A 33 -29.625 20.366 -7.362 1.00 27.92 C ATOM 498 CE3 TRP A 33 -27.378 19.417 -7.494 1.00 30.84 C ATOM 499 CZ2 TRP A 33 -29.823 19.829 -6.078 1.00 29.05 C ATOM 500 CZ3 TRP A 33 -27.569 18.876 -6.223 1.00 29.96 C ATOM 501 CH2 TRP A 33 -28.803 19.062 -5.535 1.00 31.79 C ATOM 502 HA TRP A 33 -26.919 20.056 -12.288 1.00 0.00 H ATOM 503 HB2 TRP A 33 -26.546 20.940 -10.043 1.00 0.00 H ATOM 504 HB3 TRP A 33 -27.657 22.003 -10.938 1.00 0.00 H ATOM 505 HE1 TRP A 33 -31.418 21.417 -7.884 1.00 0.00 H ATOM 506 HD1 TRP A 33 -30.228 22.091 -10.100 1.00 0.00 H ATOM 507 HZ2 TRP A 33 -30.747 20.009 -5.528 1.00 0.00 H ATOM 508 HH2 TRP A 33 -28.948 18.592 -4.562 1.00 0.00 H ATOM 509 HZ3 TRP A 33 -26.768 18.306 -5.752 1.00 0.00 H ATOM 510 HE3 TRP A 33 -26.444 19.250 -8.031 1.00 0.00 H ATOM 511 H TRP A 33 -29.774 19.407 -12.000 1.00 0.00 H ATOM 512 N LYS A 34 -26.402 18.040 -10.715 1.00 38.50 N ATOM 513 CA LYS A 34 -26.226 16.799 -9.931 1.00 40.23 C ATOM 514 C LYS A 34 -24.914 16.867 -9.168 1.00 42.13 C ATOM 515 O LYS A 34 -24.026 17.644 -9.554 1.00 42.02 O ATOM 516 CB LYS A 34 -26.481 15.485 -10.733 1.00 39.16 C ATOM 517 CG LYS A 34 -25.445 14.908 -11.721 1.00 40.82 C ATOM 518 CD LYS A 34 -26.056 13.634 -12.318 1.00 49.83 C ATOM 519 CE LYS A 34 -25.051 12.475 -12.639 1.00 56.63 C ATOM 520 NZ LYS A 34 -24.571 12.298 -14.134 1.00 60.75 N ATOM 521 HA LYS A 34 -27.022 16.741 -9.189 1.00 0.00 H ATOM 522 HB2 LYS A 34 -26.661 14.706 -9.992 1.00 0.00 H ATOM 523 HB3 LYS A 34 -27.391 15.653 -11.310 1.00 0.00 H ATOM 524 HG2 LYS A 34 -25.238 15.630 -12.511 1.00 0.00 H ATOM 525 HG3 LYS A 34 -24.520 14.670 -11.197 1.00 0.00 H ATOM 526 HD2 LYS A 34 -26.790 13.252 -11.609 1.00 0.00 H ATOM 527 HD3 LYS A 34 -26.557 13.908 -13.246 1.00 0.00 H ATOM 528 HE2 LYS A 34 -25.527 11.541 -12.339 1.00 0.00 H ATOM 529 HE3 LYS A 34 -24.162 12.640 -12.031 1.00 0.00 H ATOM 530 HZ1 LYS A 34 -25.395 12.117 -14.742 1.00 0.00 H ATOM 531 HZ2 LYS A 34 -24.091 13.166 -14.448 1.00 0.00 H ATOM 532 HZ3 LYS A 34 -23.912 11.495 -14.193 1.00 0.00 H ATOM 533 H LYS A 34 -25.571 18.518 -11.119 1.00 0.00 H ATOM 534 N VAL A 35 -24.835 16.155 -8.035 1.00 44.35 N ATOM 535 CA VAL A 35 -23.578 15.996 -7.290 1.00 47.58 C ATOM 536 C VAL A 35 -22.756 14.824 -7.871 1.00 49.44 C ATOM 537 O VAL A 35 -23.297 13.788 -8.146 1.00 50.24 O ATOM 538 CB VAL A 35 -23.876 15.784 -5.815 1.00 47.22 C ATOM 539 CG1 VAL A 35 -22.629 15.252 -5.075 1.00 50.32 C ATOM 540 CG2 VAL A 35 -24.391 17.073 -5.209 1.00 47.07 C ATOM 541 HA VAL A 35 -22.982 16.903 -7.391 1.00 0.00 H ATOM 542 HB VAL A 35 -24.653 15.027 -5.708 1.00 0.00 H ATOM 543 HG11 VAL A 35 -22.326 14.301 -5.513 1.00 0.00 H ATOM 544 HG12 VAL A 35 -21.817 15.973 -5.170 1.00 0.00 H ATOM 545 HG13 VAL A 35 -22.867 15.108 -4.021 1.00 0.00 H ATOM 546 HG21 VAL A 35 -23.636 17.851 -5.318 1.00 0.00 H ATOM 547 HG22 VAL A 35 -25.303 17.376 -5.723 1.00 0.00 H ATOM 548 HG23 VAL A 35 -24.603 16.916 -4.151 1.00 0.00 H ATOM 549 H VAL A 35 -25.695 15.698 -7.670 1.00 0.00 H ATOM 550 N LYS A 36 -21.451 14.998 -8.044 1.00 53.16 N ATOM 551 CA LYS A 36 -20.593 14.160 -8.955 1.00 56.30 C ATOM 552 C LYS A 36 -19.312 13.838 -8.137 1.00 57.82 C ATOM 553 O LYS A 36 -18.194 14.272 -8.515 1.00 58.39 O ATOM 554 CB LYS A 36 -20.272 15.003 -10.262 1.00 56.67 C ATOM 555 CG LYS A 36 -19.606 14.351 -11.507 1.00 57.62 C ATOM 556 CD LYS A 36 -20.661 13.696 -12.442 1.00 60.81 C ATOM 557 CE LYS A 36 -20.055 12.646 -13.391 1.00 61.92 C ATOM 558 NZ LYS A 36 -21.189 11.816 -13.921 1.00 63.49 N ATOM 559 HA LYS A 36 -21.073 13.236 -9.279 1.00 0.00 H ATOM 560 HB2 LYS A 36 -21.221 15.417 -10.602 1.00 0.00 H ATOM 561 HB3 LYS A 36 -19.614 15.815 -9.951 1.00 0.00 H ATOM 562 HG2 LYS A 36 -19.068 15.118 -12.063 1.00 0.00 H ATOM 563 HG3 LYS A 36 -18.905 13.586 -11.174 1.00 0.00 H ATOM 564 HD2 LYS A 36 -21.418 13.212 -11.826 1.00 0.00 H ATOM 565 HD3 LYS A 36 -21.128 14.478 -13.041 1.00 0.00 H ATOM 566 HE2 LYS A 36 -19.352 12.014 -12.849 1.00 0.00 H ATOM 567 HE3 LYS A 36 -19.538 13.140 -14.213 1.00 0.00 H ATOM 568 HZ1 LYS A 36 -21.678 11.353 -13.128 1.00 0.00 H ATOM 569 HZ2 LYS A 36 -21.856 12.429 -14.432 1.00 0.00 H ATOM 570 HZ3 LYS A 36 -20.815 11.093 -14.568 1.00 0.00 H ATOM 571 H LYS A 36 -20.990 15.765 -7.514 1.00 0.00 H ATOM 572 N ASN A 37 -19.493 13.126 -7.011 1.00 58.90 N ATOM 573 CA ASN A 37 -18.409 12.805 -6.062 1.00 60.17 C ATOM 574 C ASN A 37 -17.947 14.058 -5.228 1.00 58.84 C ATOM 575 O ASN A 37 -18.525 14.352 -4.162 1.00 59.23 O ATOM 576 CB ASN A 37 -17.306 11.890 -6.739 1.00 61.70 C ATOM 577 CG ASN A 37 -15.852 12.515 -6.707 1.00 69.57 C ATOM 578 OD1 ASN A 37 -15.583 13.659 -7.243 1.00 76.18 O ATOM 579 ND2 ASN A 37 -14.913 11.775 -6.077 1.00 70.96 N ATOM 580 HA ASN A 37 -18.785 12.162 -5.266 1.00 0.00 H ATOM 581 HB2 ASN A 37 -17.282 10.935 -6.214 1.00 0.00 H ATOM 582 HB3 ASN A 37 -17.587 11.725 -7.779 1.00 0.00 H ATOM 583 HD22 ASN A 37 -15.168 10.858 -5.658 1.00 0.00 H ATOM 584 HD21 ASN A 37 -13.935 12.122 -6.012 1.00 0.00 H ATOM 585 H ASN A 37 -20.451 12.782 -6.797 1.00 0.00 H ATOM 586 N LYS A 38 -16.983 14.836 -5.722 1.00 56.62 N ATOM 587 CA LYS A 38 -16.576 16.075 -5.040 1.00 54.87 C ATOM 588 C LYS A 38 -16.931 17.368 -5.825 1.00 50.85 C ATOM 589 O LYS A 38 -16.604 18.467 -5.368 1.00 49.30 O ATOM 590 CB LYS A 38 -15.062 16.025 -4.669 1.00 56.70 C ATOM 591 CG LYS A 38 -14.723 15.157 -3.378 1.00 62.57 C ATOM 592 CD LYS A 38 -13.252 14.599 -3.346 1.00 71.54 C ATOM 593 CE LYS A 38 -12.500 14.717 -4.755 1.00 76.17 C ATOM 594 NZ LYS A 38 -11.379 13.703 -4.939 1.00 76.64 N ATOM 595 HA LYS A 38 -17.161 16.127 -4.122 1.00 0.00 H ATOM 596 HB2 LYS A 38 -14.518 15.603 -5.515 1.00 0.00 H ATOM 597 HB3 LYS A 38 -14.721 17.045 -4.492 1.00 0.00 H ATOM 598 HG2 LYS A 38 -14.872 15.781 -2.497 1.00 0.00 H ATOM 599 HG3 LYS A 38 -15.411 14.312 -3.343 1.00 0.00 H ATOM 600 HD2 LYS A 38 -12.685 15.159 -2.603 1.00 0.00 H ATOM 601 HD3 LYS A 38 -13.286 13.548 -3.059 1.00 0.00 H ATOM 602 HE2 LYS A 38 -12.076 15.718 -4.836 1.00 0.00 H ATOM 603 HE3 LYS A 38 -13.232 14.569 -5.549 1.00 0.00 H ATOM 604 HZ1 LYS A 38 -10.665 13.838 -4.195 1.00 0.00 H ATOM 605 HZ2 LYS A 38 -11.769 12.741 -4.876 1.00 0.00 H ATOM 606 HZ3 LYS A 38 -10.939 13.840 -5.872 1.00 0.00 H ATOM 607 H LYS A 38 -16.510 14.562 -6.606 1.00 0.00 H ATOM 608 N HIS A 39 -17.579 17.212 -6.990 1.00 46.71 N ATOM 609 CA HIS A 39 -18.052 18.318 -7.855 1.00 43.68 C ATOM 610 C HIS A 39 -19.555 18.449 -7.942 1.00 40.77 C ATOM 611 O HIS A 39 -20.281 17.468 -7.849 1.00 39.97 O ATOM 612 CB HIS A 39 -17.515 18.177 -9.266 1.00 43.35 C ATOM 613 CG HIS A 39 -16.036 18.118 -9.288 1.00 48.46 C ATOM 614 ND1 HIS A 39 -15.335 17.029 -8.786 1.00 52.54 N ATOM 615 CD2 HIS A 39 -15.108 19.056 -9.616 1.00 48.36 C ATOM 616 CE1 HIS A 39 -14.038 17.291 -8.840 1.00 50.62 C ATOM 617 NE2 HIS A 39 -13.875 18.505 -9.350 1.00 50.53 N ATOM 618 HA HIS A 39 -17.668 19.217 -7.372 1.00 0.00 H ATOM 619 HB2 HIS A 39 -17.912 17.261 -9.705 1.00 0.00 H ATOM 620 HB3 HIS A 39 -17.843 19.033 -9.856 1.00 0.00 H ATOM 621 HD2 HIS A 39 -15.303 20.052 -10.013 1.00 0.00 H ATOM 622 HE1 HIS A 39 -13.239 16.622 -8.520 1.00 0.00 H ATOM 623 H HIS A 39 -17.763 16.240 -7.310 1.00 0.00 H ATOM 624 N LEU A 40 -19.993 19.683 -8.141 1.00 37.98 N ATOM 625 CA LEU A 40 -21.359 20.012 -8.496 1.00 35.38 C ATOM 626 C LEU A 40 -21.348 20.293 -9.980 1.00 34.83 C ATOM 627 O LEU A 40 -20.637 21.181 -10.474 1.00 34.17 O ATOM 628 CB LEU A 40 -21.794 21.252 -7.710 1.00 34.95 C ATOM 629 CG LEU A 40 -23.083 22.003 -8.081 1.00 33.37 C ATOM 630 CD1 LEU A 40 -24.412 21.214 -7.773 1.00 24.91 C ATOM 631 CD2 LEU A 40 -23.045 23.386 -7.387 1.00 32.04 C ATOM 632 HA LEU A 40 -22.056 19.207 -8.261 1.00 0.00 H ATOM 633 HB2 LEU A 40 -21.903 20.940 -6.671 1.00 0.00 H ATOM 634 HB3 LEU A 40 -20.980 21.972 -7.789 1.00 0.00 H ATOM 635 HG LEU A 40 -23.107 22.120 -9.164 1.00 0.00 H ATOM 636 HD21 LEU A 40 -22.986 23.248 -6.307 1.00 0.00 H ATOM 637 HD22 LEU A 40 -22.172 23.940 -7.732 1.00 0.00 H ATOM 638 HD23 LEU A 40 -23.950 23.940 -7.635 1.00 0.00 H ATOM 639 HD11 LEU A 40 -24.417 20.280 -8.334 1.00 0.00 H ATOM 640 HD12 LEU A 40 -24.466 20.999 -6.706 1.00 0.00 H ATOM 641 HD13 LEU A 40 -25.269 21.820 -8.067 1.00 0.00 H ATOM 642 H LEU A 40 -19.315 20.464 -8.036 1.00 0.00 H ATOM 643 N ARG A 41 -22.079 19.485 -10.722 1.00 34.38 N ATOM 644 CA ARG A 41 -22.260 19.710 -12.152 1.00 33.57 C ATOM 645 C ARG A 41 -23.533 20.571 -12.277 1.00 33.63 C ATOM 646 O ARG A 41 -24.619 20.067 -11.942 1.00 33.49 O ATOM 647 CB ARG A 41 -22.500 18.358 -12.796 1.00 33.09 C ATOM 648 CG ARG A 41 -22.990 18.347 -14.273 1.00 36.66 C ATOM 649 CD ARG A 41 -22.601 17.049 -14.940 1.00 35.54 C ATOM 650 NE ARG A 41 -21.138 16.987 -14.981 1.00 40.58 N ATOM 651 CZ ARG A 41 -20.432 15.980 -15.499 1.00 40.75 C ATOM 652 NH1 ARG A 41 -21.064 14.938 -16.006 1.00 39.64 N ATOM 653 NH2 ARG A 41 -19.111 15.995 -15.498 1.00 34.06 N ATOM 654 HA ARG A 41 -21.405 20.194 -12.624 1.00 0.00 H ATOM 655 HB2 ARG A 41 -21.561 17.806 -12.758 1.00 0.00 H ATOM 656 HB3 ARG A 41 -23.249 17.839 -12.198 1.00 0.00 H ATOM 657 HG2 ARG A 41 -24.075 18.452 -14.294 1.00 0.00 H ATOM 658 HG3 ARG A 41 -22.535 19.179 -14.810 1.00 0.00 H ATOM 659 HD2 ARG A 41 -23.002 17.018 -15.953 1.00 0.00 H ATOM 660 HD3 ARG A 41 -22.992 16.207 -14.369 1.00 0.00 H ATOM 661 HE ARG A 41 -20.611 17.787 -14.577 1.00 0.00 H ATOM 662 HH12 ARG A 41 -20.522 14.148 -16.412 1.00 0.00 H ATOM 663 HH11 ARG A 41 -22.104 14.907 -16.000 1.00 0.00 H ATOM 664 HH22 ARG A 41 -18.582 15.199 -15.907 1.00 0.00 H ATOM 665 HH21 ARG A 41 -18.600 16.803 -15.088 1.00 0.00 H ATOM 666 H ARG A 41 -22.539 18.666 -10.276 1.00 0.00 H ATOM 667 N ILE A 42 -23.424 21.856 -12.699 1.00 33.55 N ATOM 668 CA ILE A 42 -24.635 22.660 -13.066 1.00 33.04 C ATOM 669 C ILE A 42 -24.921 22.487 -14.576 1.00 32.99 C ATOM 670 O ILE A 42 -24.094 22.910 -15.392 1.00 32.77 O ATOM 671 CB ILE A 42 -24.482 24.174 -12.709 1.00 32.85 C ATOM 672 CG1 ILE A 42 -24.365 24.369 -11.194 1.00 33.11 C ATOM 673 CG2 ILE A 42 -25.678 24.964 -13.190 1.00 30.41 C ATOM 674 CD1 ILE A 42 -23.498 25.609 -10.807 1.00 30.45 C ATOM 675 HA ILE A 42 -25.475 22.287 -12.480 1.00 0.00 H ATOM 676 HB ILE A 42 -23.577 24.529 -13.202 1.00 0.00 H ATOM 677 HG12 ILE A 42 -25.365 24.501 -10.782 1.00 0.00 H ATOM 678 HG13 ILE A 42 -23.910 23.478 -10.762 1.00 0.00 H ATOM 679 HD11 ILE A 42 -22.491 25.485 -11.206 1.00 0.00 H ATOM 680 HD12 ILE A 42 -23.948 26.510 -11.225 1.00 0.00 H ATOM 681 HD13 ILE A 42 -23.452 25.694 -9.721 1.00 0.00 H ATOM 682 HG21 ILE A 42 -25.766 24.865 -14.272 1.00 0.00 H ATOM 683 HG22 ILE A 42 -26.581 24.580 -12.714 1.00 0.00 H ATOM 684 HG23 ILE A 42 -25.547 26.014 -12.929 1.00 0.00 H ATOM 685 H ILE A 42 -22.482 22.292 -12.769 1.00 0.00 H ATOM 686 N PHE A 43 -26.060 21.867 -14.976 1.00 32.88 N ATOM 687 CA PHE A 43 -26.382 21.711 -16.437 1.00 30.76 C ATOM 688 C PHE A 43 -26.847 23.012 -17.044 1.00 31.15 C ATOM 689 O PHE A 43 -27.257 23.911 -16.323 1.00 32.09 O ATOM 690 CB PHE A 43 -27.416 20.646 -16.658 1.00 30.81 C ATOM 691 CG PHE A 43 -26.944 19.251 -16.280 1.00 27.45 C ATOM 692 CD1 PHE A 43 -26.166 18.486 -17.165 1.00 27.43 C ATOM 693 CD2 PHE A 43 -27.332 18.678 -15.098 1.00 24.86 C ATOM 694 CE1 PHE A 43 -25.739 17.154 -16.857 1.00 25.55 C ATOM 695 CE2 PHE A 43 -26.858 17.331 -14.748 1.00 24.64 C ATOM 696 CZ PHE A 43 -26.070 16.598 -15.646 1.00 22.34 C ATOM 697 HA PHE A 43 -25.460 21.409 -16.934 1.00 0.00 H ATOM 698 HB2 PHE A 43 -28.293 20.888 -16.058 1.00 0.00 H ATOM 699 HB3 PHE A 43 -27.688 20.644 -17.713 1.00 0.00 H ATOM 700 HD2 PHE A 43 -27.990 19.219 -14.419 1.00 0.00 H ATOM 701 HE2 PHE A 43 -27.121 16.899 -13.783 1.00 0.00 H ATOM 702 HZ PHE A 43 -25.724 15.598 -15.386 1.00 0.00 H ATOM 703 HE1 PHE A 43 -25.155 16.585 -17.580 1.00 0.00 H ATOM 704 HD1 PHE A 43 -25.877 18.922 -18.121 1.00 0.00 H ATOM 705 H PHE A 43 -26.719 21.495 -14.263 1.00 0.00 H ATOM 706 N ASN A 44 -26.792 23.154 -18.353 1.00 31.19 N ATOM 707 CA ASN A 44 -27.154 24.439 -18.921 1.00 32.03 C ATOM 708 C ASN A 44 -28.646 24.820 -18.869 1.00 32.89 C ATOM 709 O ASN A 44 -29.002 26.037 -18.859 1.00 33.54 O ATOM 710 CB ASN A 44 -26.599 24.542 -20.339 1.00 31.73 C ATOM 711 CG ASN A 44 -25.069 24.543 -20.367 1.00 34.86 C ATOM 712 OD1 ASN A 44 -24.375 24.787 -19.344 1.00 35.89 O ATOM 713 ND2 ASN A 44 -24.533 24.269 -21.528 1.00 34.37 N ATOM 714 HA ASN A 44 -26.693 25.180 -18.267 1.00 0.00 H ATOM 715 HB2 ASN A 44 -26.960 23.693 -20.919 1.00 0.00 H ATOM 716 HB3 ASN A 44 -26.958 25.467 -20.790 1.00 0.00 H ATOM 717 HD22 ASN A 44 -25.141 24.073 -22.348 1.00 0.00 H ATOM 718 HD21 ASN A 44 -23.498 24.247 -21.631 1.00 0.00 H ATOM 719 H ASN A 44 -26.497 22.365 -18.963 1.00 0.00 H ATOM 720 N MET A 45 -29.495 23.778 -18.830 1.00 32.71 N ATOM 721 CA MET A 45 -30.916 23.933 -18.864 1.00 33.30 C ATOM 722 C MET A 45 -31.637 23.280 -17.696 1.00 34.27 C ATOM 723 O MET A 45 -31.109 22.327 -17.073 1.00 35.11 O ATOM 724 CB MET A 45 -31.448 23.336 -20.145 1.00 32.87 C ATOM 725 CG MET A 45 -31.020 24.107 -21.364 1.00 34.14 C ATOM 726 SD MET A 45 -31.796 23.407 -22.885 1.00 35.56 S ATOM 727 CE MET A 45 -30.917 21.837 -23.145 1.00 30.44 C ATOM 728 HA MET A 45 -31.108 25.004 -18.800 1.00 0.00 H ATOM 729 HB2 MET A 45 -31.082 22.313 -20.232 1.00 0.00 H ATOM 730 HB3 MET A 45 -32.537 23.328 -20.101 1.00 0.00 H ATOM 731 HG2 MET A 45 -29.935 24.054 -21.459 1.00 0.00 H ATOM 732 HG3 MET A 45 -31.323 25.148 -21.254 1.00 0.00 H ATOM 733 HE1 MET A 45 -29.854 22.035 -23.280 1.00 0.00 H ATOM 734 HE2 MET A 45 -31.061 21.194 -22.277 1.00 0.00 H ATOM 735 HE3 MET A 45 -31.312 21.344 -24.033 1.00 0.00 H ATOM 736 H MET A 45 -29.101 22.817 -18.773 1.00 0.00 H ATOM 737 N CYS A 46 -32.851 23.768 -17.410 1.00 33.68 N ATOM 738 CA CYS A 46 -33.718 23.072 -16.441 1.00 35.16 C ATOM 739 C CYS A 46 -34.111 21.687 -17.049 1.00 35.67 C ATOM 740 O CYS A 46 -33.837 21.406 -18.256 1.00 34.73 O ATOM 741 CB CYS A 46 -34.956 23.944 -16.068 1.00 35.07 C ATOM 742 SG CYS A 46 -36.023 24.203 -17.453 1.00 35.33 S ATOM 743 HA CYS A 46 -33.187 22.904 -15.504 1.00 0.00 H ATOM 744 HB2 CYS A 46 -34.609 24.911 -15.705 1.00 0.00 H ATOM 745 HB3 CYS A 46 -35.517 23.441 -15.280 1.00 0.00 H ATOM 746 HG CYS A 46 -37.097 24.978 -17.066 1.00 0.00 H ATOM 747 H CYS A 46 -33.183 24.639 -17.872 1.00 0.00 H ATOM 748 N LYS A 47 -34.728 20.802 -16.264 1.00 36.18 N ATOM 749 CA LYS A 47 -35.031 19.498 -16.866 1.00 37.11 C ATOM 750 C LYS A 47 -36.095 19.588 -18.012 1.00 37.00 C ATOM 751 O LYS A 47 -35.980 18.853 -19.029 1.00 37.33 O ATOM 752 CB LYS A 47 -35.360 18.404 -15.829 1.00 37.91 C ATOM 753 CG LYS A 47 -35.843 17.130 -16.509 1.00 42.14 C ATOM 754 CD LYS A 47 -35.595 15.885 -15.731 1.00 53.00 C ATOM 755 CE LYS A 47 -34.072 15.764 -15.438 1.00 57.51 C ATOM 756 NZ LYS A 47 -33.233 15.549 -16.656 1.00 57.94 N ATOM 757 HA LYS A 47 -34.103 19.178 -17.340 1.00 0.00 H ATOM 758 HB2 LYS A 47 -34.464 18.181 -15.250 1.00 0.00 H ATOM 759 HB3 LYS A 47 -36.140 18.769 -15.161 1.00 0.00 H ATOM 760 HG2 LYS A 47 -36.916 17.219 -16.677 1.00 0.00 H ATOM 761 HG3 LYS A 47 -35.332 17.040 -17.468 1.00 0.00 H ATOM 762 HD2 LYS A 47 -36.146 15.925 -14.791 1.00 0.00 H ATOM 763 HD3 LYS A 47 -35.926 15.021 -16.308 1.00 0.00 H ATOM 764 HE2 LYS A 47 -33.919 14.922 -14.763 1.00 0.00 H ATOM 765 HE3 LYS A 47 -33.742 16.682 -14.952 1.00 0.00 H ATOM 766 HZ1 LYS A 47 -33.526 14.669 -17.127 1.00 0.00 H ATOM 767 HZ2 LYS A 47 -33.358 16.350 -17.307 1.00 0.00 H ATOM 768 HZ3 LYS A 47 -32.233 15.479 -16.379 1.00 0.00 H ATOM 769 H LYS A 47 -34.980 21.024 -15.280 1.00 0.00 H ATOM 770 N THR A 48 -37.072 20.489 -17.872 1.00 35.77 N ATOM 771 CA THR A 48 -38.126 20.614 -18.822 1.00 36.55 C ATOM 772 C THR A 48 -37.608 21.070 -20.170 1.00 36.94 C ATOM 773 O THR A 48 -37.936 20.470 -21.203 1.00 37.88 O ATOM 774 CB THR A 48 -39.185 21.615 -18.328 1.00 37.68 C ATOM 775 OG1 THR A 48 -39.760 21.135 -17.109 1.00 41.03 O ATOM 776 CG2 THR A 48 -40.326 21.743 -19.332 1.00 36.17 C ATOM 777 HA THR A 48 -38.576 19.627 -18.934 1.00 0.00 H ATOM 778 HB THR A 48 -38.692 22.578 -18.192 1.00 0.00 H ATOM 779 HG1 THR A 48 -40.441 21.779 -16.791 1.00 0.00 H ATOM 780 HG23 THR A 48 -39.934 22.108 -20.281 1.00 0.00 H ATOM 781 HG21 THR A 48 -40.790 20.768 -19.480 1.00 0.00 H ATOM 782 HG22 THR A 48 -41.067 22.445 -18.950 1.00 0.00 H ATOM 783 H THR A 48 -37.062 21.118 -17.044 1.00 0.00 H ATOM 784 N CYS A 49 -36.813 22.140 -20.196 1.00 37.39 N ATOM 785 CA CYS A 49 -36.228 22.569 -21.467 1.00 37.24 C ATOM 786 C CYS A 49 -35.293 21.527 -22.053 1.00 37.01 C ATOM 787 O CYS A 49 -35.243 21.377 -23.271 1.00 37.19 O ATOM 788 CB CYS A 49 -35.462 23.853 -21.313 1.00 37.34 C ATOM 789 SG CYS A 49 -36.547 25.258 -21.046 1.00 39.47 S ATOM 790 HA CYS A 49 -37.069 22.714 -22.145 1.00 0.00 H ATOM 791 HB2 CYS A 49 -34.879 24.026 -22.218 1.00 0.00 H ATOM 792 HB3 CYS A 49 -34.789 23.761 -20.461 1.00 0.00 H ATOM 793 HG CYS A 49 -35.789 26.404 -20.912 1.00 0.00 H ATOM 794 H CYS A 49 -36.611 22.665 -19.321 1.00 0.00 H ATOM 795 N PHE A 50 -34.535 20.819 -21.208 1.00 36.90 N ATOM 796 CA PHE A 50 -33.659 19.764 -21.720 1.00 36.75 C ATOM 797 C PHE A 50 -34.473 18.642 -22.426 1.00 36.80 C ATOM 798 O PHE A 50 -34.213 18.299 -23.613 1.00 35.96 O ATOM 799 CB PHE A 50 -32.761 19.192 -20.621 1.00 37.25 C ATOM 800 CG PHE A 50 -31.881 18.086 -21.099 1.00 39.16 C ATOM 801 CD1 PHE A 50 -30.788 18.359 -21.964 1.00 40.69 C ATOM 802 CD2 PHE A 50 -32.143 16.752 -20.724 1.00 39.94 C ATOM 803 CE1 PHE A 50 -29.946 17.323 -22.450 1.00 40.20 C ATOM 804 CE2 PHE A 50 -31.294 15.691 -21.197 1.00 40.01 C ATOM 805 CZ PHE A 50 -30.195 15.992 -22.083 1.00 40.58 C ATOM 806 HA PHE A 50 -33.009 20.219 -22.467 1.00 0.00 H ATOM 807 HB2 PHE A 50 -32.132 19.994 -20.235 1.00 0.00 H ATOM 808 HB3 PHE A 50 -33.394 18.810 -19.820 1.00 0.00 H ATOM 809 HD2 PHE A 50 -32.989 16.525 -20.076 1.00 0.00 H ATOM 810 HE2 PHE A 50 -31.480 14.663 -20.887 1.00 0.00 H ATOM 811 HZ PHE A 50 -29.563 15.190 -22.464 1.00 0.00 H ATOM 812 HE1 PHE A 50 -29.109 17.562 -23.106 1.00 0.00 H ATOM 813 HD1 PHE A 50 -30.590 19.389 -22.262 1.00 0.00 H ATOM 814 H PHE A 50 -34.568 21.018 -20.188 1.00 0.00 H ATOM 815 N ASN A 51 -35.468 18.081 -21.724 1.00 36.49 N ATOM 816 CA ASN A 51 -36.297 17.060 -22.378 1.00 37.82 C ATOM 817 C ASN A 51 -36.859 17.560 -23.683 1.00 38.01 C ATOM 818 O ASN A 51 -36.770 16.853 -24.730 1.00 38.60 O ATOM 819 CB ASN A 51 -37.386 16.563 -21.467 1.00 37.86 C ATOM 820 CG ASN A 51 -36.803 15.795 -20.275 1.00 40.16 C ATOM 821 OD1 ASN A 51 -35.705 15.227 -20.375 1.00 40.10 O ATOM 822 ND2 ASN A 51 -37.499 15.829 -19.126 1.00 41.68 N ATOM 823 HA ASN A 51 -35.649 16.213 -22.602 1.00 0.00 H ATOM 824 HB2 ASN A 51 -37.957 17.415 -21.097 1.00 0.00 H ATOM 825 HB3 ASN A 51 -38.046 15.901 -22.029 1.00 0.00 H ATOM 826 HD22 ASN A 51 -38.416 16.317 -19.088 1.00 0.00 H ATOM 827 HD21 ASN A 51 -37.120 15.367 -18.275 1.00 0.00 H ATOM 828 H ASN A 51 -35.649 18.362 -20.739 1.00 0.00 H ATOM 829 N ASN A 52 -37.340 18.808 -23.643 1.00 36.49 N ATOM 830 CA ASN A 52 -37.873 19.427 -24.813 1.00 35.31 C ATOM 831 C ASN A 52 -36.859 19.510 -25.962 1.00 34.66 C ATOM 832 O ASN A 52 -37.163 19.154 -27.105 1.00 33.38 O ATOM 833 CB ASN A 52 -38.449 20.772 -24.414 1.00 36.13 C ATOM 834 CG ASN A 52 -38.957 21.566 -25.608 1.00 37.43 C ATOM 835 OD1 ASN A 52 -39.993 21.212 -26.288 1.00 34.25 O ATOM 836 ND2 ASN A 52 -38.241 22.652 -25.884 1.00 32.02 N ATOM 837 HA ASN A 52 -38.672 18.808 -25.221 1.00 0.00 H ATOM 838 HB2 ASN A 52 -39.278 20.607 -23.725 1.00 0.00 H ATOM 839 HB3 ASN A 52 -37.672 21.351 -23.914 1.00 0.00 H ATOM 840 HD22 ASN A 52 -37.413 22.891 -25.302 1.00 0.00 H ATOM 841 HD21 ASN A 52 -38.509 23.262 -26.682 1.00 0.00 H ATOM 842 H ASN A 52 -37.325 19.334 -22.746 1.00 0.00 H ATOM 843 N SER A 53 -35.638 19.916 -25.668 1.00 35.09 N ATOM 844 CA SER A 53 -34.619 20.021 -26.713 1.00 36.40 C ATOM 845 C SER A 53 -34.411 18.694 -27.464 1.00 38.14 C ATOM 846 O SER A 53 -34.211 18.684 -28.699 1.00 39.48 O ATOM 847 CB SER A 53 -33.283 20.556 -26.137 1.00 37.22 C ATOM 848 OG SER A 53 -32.519 19.575 -25.417 1.00 36.38 O ATOM 849 HA SER A 53 -34.987 20.741 -27.444 1.00 0.00 H ATOM 850 HB2 SER A 53 -33.508 21.380 -25.460 1.00 0.00 H ATOM 851 HB3 SER A 53 -32.676 20.923 -26.965 1.00 0.00 H ATOM 852 HG SER A 53 -33.052 19.239 -24.653 1.00 0.00 H ATOM 853 H SER A 53 -35.398 20.163 -24.687 1.00 0.00 H ATOM 854 N ILE A 54 -34.465 17.573 -26.749 1.00 38.23 N ATOM 855 CA ILE A 54 -34.361 16.283 -27.387 1.00 39.22 C ATOM 856 C ILE A 54 -35.517 16.088 -28.383 1.00 39.47 C ATOM 857 O ILE A 54 -35.311 15.732 -29.563 1.00 39.51 O ATOM 858 CB ILE A 54 -34.390 15.108 -26.317 1.00 41.10 C ATOM 859 CG1 ILE A 54 -33.231 15.230 -25.292 1.00 42.11 C ATOM 860 CG2 ILE A 54 -34.322 13.705 -27.019 1.00 39.15 C ATOM 861 CD1 ILE A 54 -31.861 15.150 -25.987 1.00 45.01 C ATOM 862 HA ILE A 54 -33.409 16.251 -27.916 1.00 0.00 H ATOM 863 HB ILE A 54 -35.334 15.196 -25.780 1.00 0.00 H ATOM 864 HG12 ILE A 54 -33.312 16.186 -24.775 1.00 0.00 H ATOM 865 HG13 ILE A 54 -33.310 14.419 -24.568 1.00 0.00 H ATOM 866 HD11 ILE A 54 -31.771 14.193 -26.501 1.00 0.00 H ATOM 867 HD12 ILE A 54 -31.773 15.962 -26.709 1.00 0.00 H ATOM 868 HD13 ILE A 54 -31.071 15.239 -25.241 1.00 0.00 H ATOM 869 HG21 ILE A 54 -35.177 13.592 -27.686 1.00 0.00 H ATOM 870 HG22 ILE A 54 -33.399 13.632 -27.594 1.00 0.00 H ATOM 871 HG23 ILE A 54 -34.344 12.920 -26.263 1.00 0.00 H ATOM 872 H ILE A 54 -34.584 17.627 -25.717 1.00 0.00 H ATOM 873 N ASP A 55 -36.739 16.293 -27.901 1.00 38.81 N ATOM 874 CA ASP A 55 -37.913 16.228 -28.765 1.00 38.69 C ATOM 875 C ASP A 55 -37.858 17.165 -29.992 1.00 38.95 C ATOM 876 O ASP A 55 -38.324 16.798 -31.078 1.00 39.35 O ATOM 877 CB ASP A 55 -39.124 16.587 -27.975 1.00 38.98 C ATOM 878 CG ASP A 55 -39.403 15.601 -26.863 1.00 41.38 C ATOM 879 OD1 ASP A 55 -38.869 14.465 -26.936 1.00 41.99 O ATOM 880 OD2 ASP A 55 -40.196 15.957 -25.937 1.00 46.88 O ATOM 881 HA ASP A 55 -37.944 15.205 -29.141 1.00 0.00 H ATOM 882 HB2 ASP A 55 -38.977 17.575 -27.538 1.00 0.00 H ATOM 883 HB3 ASP A 55 -39.984 16.612 -28.644 1.00 0.00 H ATOM 884 H ASP A 55 -36.860 16.504 -26.890 1.00 0.00 H ATOM 885 N ILE A 56 -37.277 18.358 -29.865 1.00 38.09 N ATOM 886 CA ILE A 56 -37.296 19.221 -31.017 1.00 37.55 C ATOM 887 C ILE A 56 -36.079 19.004 -31.923 1.00 37.32 C ATOM 888 O ILE A 56 -36.002 19.561 -33.020 1.00 37.38 O ATOM 889 CB ILE A 56 -37.575 20.700 -30.620 1.00 38.44 C ATOM 890 CG1 ILE A 56 -36.341 21.364 -30.014 1.00 40.03 C ATOM 891 CG2 ILE A 56 -38.760 20.787 -29.660 1.00 35.13 C ATOM 892 CD1 ILE A 56 -36.696 22.706 -29.455 1.00 44.01 C ATOM 893 HA ILE A 56 -38.143 18.939 -31.643 1.00 0.00 H ATOM 894 HB ILE A 56 -37.826 21.242 -31.532 1.00 0.00 H ATOM 895 HG12 ILE A 56 -35.948 20.734 -29.216 1.00 0.00 H ATOM 896 HG13 ILE A 56 -35.581 21.485 -30.786 1.00 0.00 H ATOM 897 HD11 ILE A 56 -37.086 23.339 -30.252 1.00 0.00 H ATOM 898 HD12 ILE A 56 -37.454 22.587 -28.680 1.00 0.00 H ATOM 899 HD13 ILE A 56 -35.806 23.167 -29.027 1.00 0.00 H ATOM 900 HG21 ILE A 56 -39.648 20.378 -30.142 1.00 0.00 H ATOM 901 HG22 ILE A 56 -38.539 20.215 -28.759 1.00 0.00 H ATOM 902 HG23 ILE A 56 -38.937 21.830 -29.396 1.00 0.00 H ATOM 903 H ILE A 56 -36.830 18.652 -28.973 1.00 0.00 H ATOM 904 N GLY A 57 -35.119 18.214 -31.442 1.00 37.34 N ATOM 905 CA GLY A 57 -33.910 17.907 -32.207 1.00 35.94 C ATOM 906 C GLY A 57 -32.837 18.941 -32.116 1.00 36.73 C ATOM 907 O GLY A 57 -32.063 19.116 -33.086 1.00 37.80 O ATOM 908 HA3 GLY A 57 -34.189 17.798 -33.255 1.00 0.00 H ATOM 909 HA2 GLY A 57 -33.505 16.964 -31.840 1.00 0.00 H ATOM 910 H GLY A 57 -35.233 17.803 -30.493 1.00 0.00 H ATOM 911 N ASP A 58 -32.780 19.668 -30.991 1.00 36.74 N ATOM 912 CA ASP A 58 -31.789 20.764 -30.863 1.00 38.23 C ATOM 913 C ASP A 58 -30.793 20.502 -29.755 1.00 38.96 C ATOM 914 O ASP A 58 -31.152 20.441 -28.558 1.00 40.66 O ATOM 915 CB ASP A 58 -32.461 22.148 -30.616 1.00 38.56 C ATOM 916 CG ASP A 58 -31.462 23.344 -30.774 1.00 40.50 C ATOM 917 OD1 ASP A 58 -30.314 23.115 -31.229 1.00 44.14 O ATOM 918 OD2 ASP A 58 -31.802 24.532 -30.475 1.00 41.18 O ATOM 919 HA ASP A 58 -31.265 20.792 -31.819 1.00 0.00 H ATOM 920 HB2 ASP A 58 -33.272 22.274 -31.333 1.00 0.00 H ATOM 921 HB3 ASP A 58 -32.866 22.163 -29.604 1.00 0.00 H ATOM 922 H ASP A 58 -33.432 19.463 -30.207 1.00 0.00 H ATOM 923 N ASP A 59 -29.543 20.391 -30.124 1.00 39.15 N ATOM 924 CA ASP A 59 -28.556 20.079 -29.137 1.00 42.10 C ATOM 925 C ASP A 59 -27.674 21.315 -28.789 1.00 41.25 C ATOM 926 O ASP A 59 -26.658 21.232 -28.091 1.00 42.04 O ATOM 927 CB ASP A 59 -27.753 18.823 -29.599 1.00 43.59 C ATOM 928 CG ASP A 59 -26.675 19.162 -30.660 1.00 50.26 C ATOM 929 OD1 ASP A 59 -26.625 20.335 -31.186 1.00 54.65 O ATOM 930 OD2 ASP A 59 -25.843 18.260 -30.945 1.00 55.13 O ATOM 931 HA ASP A 59 -29.039 19.823 -28.194 1.00 0.00 H ATOM 932 HB2 ASP A 59 -27.263 18.383 -28.731 1.00 0.00 H ATOM 933 HB3 ASP A 59 -28.449 18.101 -30.026 1.00 0.00 H ATOM 934 H ASP A 59 -29.271 20.527 -31.119 1.00 0.00 H ATOM 935 N THR A 60 -28.096 22.477 -29.243 1.00 41.34 N ATOM 936 CA THR A 60 -27.316 23.729 -29.091 1.00 39.91 C ATOM 937 C THR A 60 -26.998 24.034 -27.658 1.00 40.61 C ATOM 938 O THR A 60 -25.927 24.569 -27.414 1.00 40.73 O ATOM 939 CB THR A 60 -28.129 24.968 -29.586 1.00 39.96 C ATOM 940 OG1 THR A 60 -28.425 24.807 -30.954 1.00 36.87 O ATOM 941 CG2 THR A 60 -27.370 26.298 -29.410 1.00 38.48 C ATOM 942 HA THR A 60 -26.410 23.564 -29.674 1.00 0.00 H ATOM 943 HB THR A 60 -29.032 25.018 -28.978 1.00 0.00 H ATOM 944 HG1 THR A 60 -28.961 23.984 -31.080 1.00 0.00 H ATOM 945 HG23 THR A 60 -27.131 26.442 -28.356 1.00 0.00 H ATOM 946 HG21 THR A 60 -26.449 26.269 -29.992 1.00 0.00 H ATOM 947 HG22 THR A 60 -27.995 27.120 -29.758 1.00 0.00 H ATOM 948 H THR A 60 -29.015 22.518 -29.728 1.00 0.00 H ATOM 949 N TYR A 61 -27.940 23.781 -26.722 1.00 39.65 N ATOM 950 CA TYR A 61 -27.751 24.224 -25.333 1.00 38.61 C ATOM 951 C TYR A 61 -27.275 23.126 -24.376 1.00 38.63 C ATOM 952 O TYR A 61 -27.209 23.356 -23.167 1.00 39.08 O ATOM 953 CB TYR A 61 -29.008 24.935 -24.805 1.00 38.50 C ATOM 954 CG TYR A 61 -29.344 26.180 -25.625 1.00 39.44 C ATOM 955 CD1 TYR A 61 -28.560 27.344 -25.533 1.00 40.25 C ATOM 956 CD2 TYR A 61 -30.392 26.162 -26.552 1.00 42.32 C ATOM 957 CE1 TYR A 61 -28.846 28.468 -26.312 1.00 41.31 C ATOM 958 CE2 TYR A 61 -30.716 27.285 -27.338 1.00 43.34 C ATOM 959 CZ TYR A 61 -29.937 28.428 -27.214 1.00 45.86 C ATOM 960 OH TYR A 61 -30.254 29.520 -28.000 1.00 51.05 O ATOM 961 HA TYR A 61 -26.931 24.941 -25.363 1.00 0.00 H ATOM 962 HB3 TYR A 61 -28.838 25.230 -23.769 1.00 0.00 H ATOM 963 HB2 TYR A 61 -29.850 24.244 -24.851 1.00 0.00 H ATOM 964 HD2 TYR A 61 -30.976 25.250 -26.670 1.00 0.00 H ATOM 965 HE2 TYR A 61 -31.559 27.258 -28.028 1.00 0.00 H ATOM 966 HE1 TYR A 61 -28.235 29.367 -26.226 1.00 0.00 H ATOM 967 HD1 TYR A 61 -27.716 27.370 -24.843 1.00 0.00 H ATOM 968 HH TYR A 61 -31.177 29.815 -27.797 1.00 0.00 H ATOM 969 H TYR A 61 -28.806 23.269 -26.987 1.00 0.00 H ATOM 970 N HIS A 62 -26.973 21.953 -24.933 1.00 36.92 N ATOM 971 CA HIS A 62 -26.551 20.782 -24.193 1.00 37.31 C ATOM 972 C HIS A 62 -25.211 21.021 -23.575 1.00 36.53 C ATOM 973 O HIS A 62 -24.318 21.453 -24.257 1.00 36.48 O ATOM 974 CB HIS A 62 -26.497 19.545 -25.127 1.00 36.32 C ATOM 975 CG HIS A 62 -27.860 19.042 -25.484 1.00 38.73 C ATOM 976 ND1 HIS A 62 -28.081 17.838 -26.115 1.00 39.03 N ATOM 977 CD2 HIS A 62 -29.087 19.590 -25.262 1.00 38.74 C ATOM 978 CE1 HIS A 62 -29.383 17.676 -26.296 1.00 39.67 C ATOM 979 NE2 HIS A 62 -30.013 18.722 -25.781 1.00 40.48 N ATOM 980 HA HIS A 62 -27.275 20.589 -23.401 1.00 0.00 H ATOM 981 HB2 HIS A 62 -25.974 19.820 -26.043 1.00 0.00 H ATOM 982 HB3 HIS A 62 -25.950 18.748 -24.623 1.00 0.00 H ATOM 983 HD2 HIS A 62 -29.294 20.538 -24.766 1.00 0.00 H ATOM 984 HE1 HIS A 62 -29.857 16.825 -26.786 1.00 0.00 H ATOM 985 H HIS A 62 -27.045 21.874 -25.967 1.00 0.00 H ATOM 986 N GLY A 63 -25.063 20.726 -22.285 1.00 36.54 N ATOM 987 CA GLY A 63 -23.749 20.863 -21.638 1.00 34.89 C ATOM 988 C GLY A 63 -23.889 21.148 -20.167 1.00 35.41 C ATOM 989 O GLY A 63 -25.030 21.179 -19.599 1.00 33.90 O ATOM 990 HA3 GLY A 63 -23.205 21.682 -22.108 1.00 0.00 H ATOM 991 HA2 GLY A 63 -23.191 19.936 -21.769 1.00 0.00 H ATOM 992 H GLY A 63 -25.880 20.397 -21.732 1.00 0.00 H ATOM 993 N HIS A 64 -22.728 21.392 -19.555 1.00 34.65 N ATOM 994 CA HIS A 64 -22.661 21.583 -18.122 1.00 34.96 C ATOM 995 C HIS A 64 -21.366 22.269 -17.779 1.00 34.86 C ATOM 996 O HIS A 64 -20.481 22.434 -18.626 1.00 35.44 O ATOM 997 CB HIS A 64 -22.722 20.250 -17.411 1.00 33.90 C ATOM 998 CG HIS A 64 -21.618 19.330 -17.815 1.00 37.49 C ATOM 999 ND1 HIS A 64 -21.702 18.506 -18.918 1.00 40.46 N ATOM 1000 CD2 HIS A 64 -20.392 19.103 -17.269 1.00 40.68 C ATOM 1001 CE1 HIS A 64 -20.591 17.791 -19.019 1.00 39.66 C ATOM 1002 NE2 HIS A 64 -19.786 18.126 -18.022 1.00 41.22 N ATOM 1003 HA HIS A 64 -23.506 22.192 -17.803 1.00 0.00 H ATOM 1004 HB2 HIS A 64 -22.656 20.424 -16.337 1.00 0.00 H ATOM 1005 HB3 HIS A 64 -23.675 19.774 -17.643 1.00 0.00 H ATOM 1006 HD2 HIS A 64 -19.970 19.603 -16.397 1.00 0.00 H ATOM 1007 HE1 HIS A 64 -20.376 17.053 -19.791 1.00 0.00 H ATOM 1008 H HIS A 64 -21.855 21.446 -20.118 1.00 0.00 H ATOM 1009 N VAL A 65 -21.282 22.694 -16.520 1.00 34.35 N ATOM 1010 CA VAL A 65 -20.074 23.252 -15.957 1.00 33.84 C ATOM 1011 C VAL A 65 -19.952 22.590 -14.565 1.00 34.61 C ATOM 1012 O VAL A 65 -20.943 22.591 -13.787 1.00 36.16 O ATOM 1013 CB VAL A 65 -20.177 24.825 -15.835 1.00 33.89 C ATOM 1014 CG1 VAL A 65 -18.929 25.386 -15.212 1.00 31.24 C ATOM 1015 CG2 VAL A 65 -20.413 25.492 -17.225 1.00 32.48 C ATOM 1016 HA VAL A 65 -19.201 23.060 -16.581 1.00 0.00 H ATOM 1017 HB VAL A 65 -21.033 25.048 -15.198 1.00 0.00 H ATOM 1018 HG11 VAL A 65 -18.798 24.960 -14.217 1.00 0.00 H ATOM 1019 HG12 VAL A 65 -18.069 25.133 -15.833 1.00 0.00 H ATOM 1020 HG13 VAL A 65 -19.018 26.470 -15.136 1.00 0.00 H ATOM 1021 HG21 VAL A 65 -19.582 25.250 -17.888 1.00 0.00 H ATOM 1022 HG22 VAL A 65 -21.343 25.117 -17.653 1.00 0.00 H ATOM 1023 HG23 VAL A 65 -20.478 26.573 -17.101 1.00 0.00 H ATOM 1024 H VAL A 65 -22.124 22.621 -15.914 1.00 0.00 H ATOM 1025 N ASP A 66 -18.780 22.005 -14.281 1.00 33.06 N ATOM 1026 CA ASP A 66 -18.440 21.423 -12.998 1.00 32.77 C ATOM 1027 C ASP A 66 -17.681 22.405 -12.099 1.00 32.35 C ATOM 1028 O ASP A 66 -16.765 23.140 -12.547 1.00 31.85 O ATOM 1029 CB ASP A 66 -17.553 20.190 -13.193 1.00 32.47 C ATOM 1030 CG ASP A 66 -18.257 19.087 -13.929 1.00 34.12 C ATOM 1031 OD1 ASP A 66 -19.482 19.056 -13.886 1.00 35.40 O ATOM 1032 OD2 ASP A 66 -17.588 18.257 -14.579 1.00 37.08 O ATOM 1033 HA ASP A 66 -19.383 21.157 -12.520 1.00 0.00 H ATOM 1034 HB2 ASP A 66 -16.669 20.481 -13.761 1.00 0.00 H ATOM 1035 HB3 ASP A 66 -17.249 19.819 -12.214 1.00 0.00 H ATOM 1036 H ASP A 66 -18.064 21.966 -15.034 1.00 0.00 H ATOM 1037 N TRP A 67 -18.017 22.314 -10.817 1.00 31.30 N ATOM 1038 CA TRP A 67 -17.522 23.162 -9.785 1.00 32.20 C ATOM 1039 C TRP A 67 -17.044 22.309 -8.639 1.00 34.30 C ATOM 1040 O TRP A 67 -17.799 21.487 -8.122 1.00 34.96 O ATOM 1041 CB TRP A 67 -18.639 24.035 -9.259 1.00 30.48 C ATOM 1042 CG TRP A 67 -19.153 24.924 -10.283 1.00 30.96 C ATOM 1043 CD1 TRP A 67 -20.199 24.677 -11.103 1.00 32.16 C ATOM 1044 CD2 TRP A 67 -18.637 26.225 -10.649 1.00 32.69 C ATOM 1045 NE1 TRP A 67 -20.401 25.745 -11.962 1.00 33.96 N ATOM 1046 CE2 TRP A 67 -19.461 26.714 -11.709 1.00 33.12 C ATOM 1047 CE3 TRP A 67 -17.588 27.048 -10.153 1.00 31.73 C ATOM 1048 CZ2 TRP A 67 -19.251 27.985 -12.336 1.00 32.49 C ATOM 1049 CZ3 TRP A 67 -17.379 28.320 -10.778 1.00 26.85 C ATOM 1050 CH2 TRP A 67 -18.205 28.762 -11.856 1.00 30.75 C ATOM 1051 HA TRP A 67 -16.716 23.775 -10.188 1.00 0.00 H ATOM 1052 HB2 TRP A 67 -19.449 23.397 -8.905 1.00 0.00 H ATOM 1053 HB3 TRP A 67 -18.260 24.633 -8.430 1.00 0.00 H ATOM 1054 HE1 TRP A 67 -21.147 25.804 -12.684 1.00 0.00 H ATOM 1055 HD1 TRP A 67 -20.798 23.767 -11.090 1.00 0.00 H ATOM 1056 HZ2 TRP A 67 -19.885 28.327 -13.154 1.00 0.00 H ATOM 1057 HH2 TRP A 67 -18.010 29.732 -12.313 1.00 0.00 H ATOM 1058 HZ3 TRP A 67 -16.574 28.963 -10.424 1.00 0.00 H ATOM 1059 HE3 TRP A 67 -16.962 26.721 -9.323 1.00 0.00 H ATOM 1060 H TRP A 67 -18.691 21.569 -10.547 1.00 0.00 H ATOM 1061 N LEU A 68 -15.798 22.521 -8.220 1.00 36.22 N ATOM 1062 CA LEU A 68 -15.273 21.883 -6.991 1.00 38.27 C ATOM 1063 C LEU A 68 -16.028 22.394 -5.776 1.00 39.33 C ATOM 1064 O LEU A 68 -16.164 23.618 -5.584 1.00 41.01 O ATOM 1065 CB LEU A 68 -13.748 22.091 -6.852 1.00 37.23 C ATOM 1066 CG LEU A 68 -13.096 21.538 -5.591 1.00 38.88 C ATOM 1067 CD1 LEU A 68 -13.167 20.028 -5.449 1.00 33.48 C ATOM 1068 CD2 LEU A 68 -11.690 21.951 -5.644 1.00 38.31 C ATOM 1069 HA LEU A 68 -15.434 20.807 -7.062 1.00 0.00 H ATOM 1070 HB2 LEU A 68 -13.270 21.615 -7.708 1.00 0.00 H ATOM 1071 HB3 LEU A 68 -13.556 23.164 -6.881 1.00 0.00 H ATOM 1072 HG LEU A 68 -13.637 21.929 -4.730 1.00 0.00 H ATOM 1073 HD21 LEU A 68 -11.225 21.539 -6.540 1.00 0.00 H ATOM 1074 HD22 LEU A 68 -11.633 23.039 -5.671 1.00 0.00 H ATOM 1075 HD23 LEU A 68 -11.170 21.581 -4.760 1.00 0.00 H ATOM 1076 HD11 LEU A 68 -14.211 19.715 -5.428 1.00 0.00 H ATOM 1077 HD12 LEU A 68 -12.664 19.561 -6.295 1.00 0.00 H ATOM 1078 HD13 LEU A 68 -12.677 19.728 -4.523 1.00 0.00 H ATOM 1079 H LEU A 68 -15.178 23.150 -8.769 1.00 0.00 H ATOM 1080 N MET A 69 -16.548 21.477 -4.970 1.00 39.60 N ATOM 1081 CA MET A 69 -17.404 21.895 -3.860 1.00 40.26 C ATOM 1082 C MET A 69 -16.672 22.364 -2.623 1.00 41.07 C ATOM 1083 O MET A 69 -17.318 22.874 -1.699 1.00 40.79 O ATOM 1084 CB MET A 69 -18.384 20.801 -3.497 1.00 39.62 C ATOM 1085 CG MET A 69 -19.435 20.776 -4.526 1.00 40.82 C ATOM 1086 SD MET A 69 -20.764 19.621 -4.235 1.00 43.70 S ATOM 1087 CE MET A 69 -20.072 17.953 -4.221 1.00 41.11 C ATOM 1088 HA MET A 69 -17.933 22.771 -4.235 1.00 0.00 H ATOM 1089 HB2 MET A 69 -17.872 19.839 -3.467 1.00 0.00 H ATOM 1090 HB3 MET A 69 -18.825 21.007 -2.522 1.00 0.00 H ATOM 1091 HG2 MET A 69 -18.969 20.520 -5.477 1.00 0.00 H ATOM 1092 HG3 MET A 69 -19.866 21.775 -4.591 1.00 0.00 H ATOM 1093 HE1 MET A 69 -19.602 17.748 -5.183 1.00 0.00 H ATOM 1094 HE2 MET A 69 -19.329 17.876 -3.428 1.00 0.00 H ATOM 1095 HE3 MET A 69 -20.870 17.232 -4.044 1.00 0.00 H ATOM 1096 H MET A 69 -16.348 20.468 -5.126 1.00 0.00 H ATOM 1097 N TYR A 70 -15.341 22.204 -2.616 1.00 42.34 N ATOM 1098 CA TYR A 70 -14.471 22.576 -1.482 1.00 43.46 C ATOM 1099 C TYR A 70 -13.517 23.673 -1.858 1.00 41.85 C ATOM 1100 O TYR A 70 -13.308 23.929 -3.041 1.00 42.51 O ATOM 1101 CB TYR A 70 -13.690 21.336 -1.006 1.00 45.68 C ATOM 1102 CG TYR A 70 -14.621 20.209 -0.655 1.00 53.69 C ATOM 1103 CD1 TYR A 70 -14.722 19.089 -1.485 1.00 60.23 C ATOM 1104 CD2 TYR A 70 -15.486 20.305 0.466 1.00 63.31 C ATOM 1105 CE1 TYR A 70 -15.600 18.058 -1.196 1.00 65.70 C ATOM 1106 CE2 TYR A 70 -16.400 19.279 0.763 1.00 69.36 C ATOM 1107 CZ TYR A 70 -16.420 18.154 -0.080 1.00 70.83 C ATOM 1108 OH TYR A 70 -17.278 17.120 0.169 1.00 78.29 O ATOM 1109 HA TYR A 70 -15.101 22.948 -0.674 1.00 0.00 H ATOM 1110 HB3 TYR A 70 -13.104 21.601 -0.126 1.00 0.00 H ATOM 1111 HB2 TYR A 70 -13.021 21.010 -1.802 1.00 0.00 H ATOM 1112 HD2 TYR A 70 -15.441 21.186 1.106 1.00 0.00 H ATOM 1113 HE2 TYR A 70 -17.071 19.353 1.619 1.00 0.00 H ATOM 1114 HE1 TYR A 70 -15.647 17.179 -1.839 1.00 0.00 H ATOM 1115 HD1 TYR A 70 -14.098 19.026 -2.376 1.00 0.00 H ATOM 1116 HH TYR A 70 -17.157 16.419 -0.519 1.00 0.00 H ATOM 1117 H TYR A 70 -14.894 21.793 -3.460 1.00 0.00 H ATOM 1118 N ALA A 71 -12.928 24.312 -0.860 1.00 41.39 N ATOM 1119 CA ALA A 71 -11.972 25.406 -1.079 1.00 41.58 C ATOM 1120 C ALA A 71 -10.590 24.858 -1.436 1.00 42.47 C ATOM 1121 O ALA A 71 -9.850 25.496 -2.162 1.00 43.39 O ATOM 1122 CB ALA A 71 -11.897 26.355 0.144 1.00 40.62 C ATOM 1123 HA ALA A 71 -12.333 25.994 -1.923 1.00 0.00 H ATOM 1124 HB1 ALA A 71 -12.880 26.789 0.326 1.00 0.00 H ATOM 1125 HB2 ALA A 71 -11.579 25.791 1.021 1.00 0.00 H ATOM 1126 HB3 ALA A 71 -11.179 27.150 -0.058 1.00 0.00 H ATOM 1127 H ALA A 71 -13.150 24.029 0.116 1.00 0.00 H ATOM 1128 N ASP A 72 -10.243 23.660 -0.994 1.00 42.77 N ATOM 1129 CA ASP A 72 -8.935 23.164 -1.292 1.00 44.69 C ATOM 1130 C ASP A 72 -8.912 21.929 -2.209 1.00 45.26 C ATOM 1131 O ASP A 72 -9.647 20.999 -1.910 1.00 45.93 O ATOM 1132 CB ASP A 72 -8.310 22.809 0.037 1.00 45.37 C ATOM 1133 CG ASP A 72 -6.835 22.676 -0.080 1.00 49.71 C ATOM 1134 OD1 ASP A 72 -6.325 21.855 -0.888 1.00 54.65 O ATOM 1135 OD2 ASP A 72 -6.170 23.446 0.589 1.00 55.76 O ATOM 1136 HA ASP A 72 -8.393 23.934 -1.840 1.00 0.00 H ATOM 1137 HB2 ASP A 72 -8.540 23.593 0.759 1.00 0.00 H ATOM 1138 HB3 ASP A 72 -8.726 21.863 0.384 1.00 0.00 H ATOM 1139 H ASP A 72 -10.911 23.088 -0.439 1.00 0.00 H ATOM 1140 N SER A 73 -8.064 21.846 -3.256 1.00 45.68 N ATOM 1141 CA SER A 73 -8.064 20.624 -4.168 1.00 46.59 C ATOM 1142 C SER A 73 -7.165 19.402 -3.866 1.00 46.66 C ATOM 1143 O SER A 73 -6.412 19.418 -2.875 1.00 48.78 O ATOM 1144 CB SER A 73 -7.850 21.053 -5.611 1.00 46.27 C ATOM 1145 OG SER A 73 -7.028 22.179 -5.639 1.00 46.18 O ATOM 1146 HA SER A 73 -9.054 20.221 -3.955 1.00 0.00 H ATOM 1147 HB2 SER A 73 -8.811 21.292 -6.067 1.00 0.00 H ATOM 1148 HB3 SER A 73 -7.377 20.243 -6.166 1.00 0.00 H ATOM 1149 HG SER A 73 -7.459 22.914 -5.134 1.00 0.00 H ATOM 1150 H SER A 73 -7.402 22.626 -3.443 1.00 0.00 H TER 1151 SER A 73 ATOM 1152 N ASP B 5 -19.844 27.835 -25.741 1.00 51.83 N ATOM 1153 CA ASP B 5 -18.794 26.825 -25.322 1.00 51.35 C ATOM 1154 C ASP B 5 -18.635 26.801 -23.782 1.00 49.72 C ATOM 1155 O ASP B 5 -18.535 27.845 -23.146 1.00 49.66 O ATOM 1156 CB ASP B 5 -17.475 27.105 -26.040 1.00 52.05 C ATOM 1157 CG ASP B 5 -16.308 26.338 -25.435 1.00 54.59 C ATOM 1158 OD1 ASP B 5 -16.020 26.599 -24.270 1.00 59.88 O ATOM 1159 OD2 ASP B 5 -15.658 25.495 -26.082 1.00 56.04 O ATOM 1160 HA ASP B 5 -19.121 25.828 -25.619 1.00 0.00 H ATOM 1161 HB2 ASP B 5 -17.578 26.817 -27.086 1.00 0.00 H ATOM 1162 HB3 ASP B 5 -17.262 28.172 -25.977 1.00 0.00 H ATOM 1163 HN3 ASP B 5 -19.560 28.782 -25.419 1.00 0.00 H ATOM 1164 HN2 ASP B 5 -20.758 27.581 -25.314 1.00 0.00 H ATOM 1165 HN1 ASP B 5 -19.932 27.832 -26.777 1.00 0.00 H ATOM 1166 N ASP B 6 -18.635 25.612 -23.184 1.00 48.28 N ATOM 1167 CA ASP B 6 -18.757 25.495 -21.698 1.00 46.56 C ATOM 1168 C ASP B 6 -17.529 25.988 -20.906 1.00 45.98 C ATOM 1169 O ASP B 6 -17.710 26.536 -19.812 1.00 45.13 O ATOM 1170 CB ASP B 6 -19.201 24.082 -21.204 1.00 45.19 C ATOM 1171 CG ASP B 6 -20.586 23.661 -21.714 1.00 44.05 C ATOM 1172 OD1 ASP B 6 -21.485 24.552 -21.919 1.00 37.42 O ATOM 1173 OD2 ASP B 6 -20.756 22.413 -21.882 1.00 43.32 O ATOM 1174 HA ASP B 6 -19.568 26.188 -21.474 1.00 0.00 H ATOM 1175 HB2 ASP B 6 -18.470 23.351 -21.548 1.00 0.00 H ATOM 1176 HB3 ASP B 6 -19.222 24.088 -20.114 1.00 0.00 H ATOM 1177 H ASP B 6 -18.549 24.750 -23.760 1.00 0.00 H ATOM 1178 N ASP B 7 -16.308 25.784 -21.445 1.00 44.92 N ATOM 1179 CA ASP B 7 -15.061 26.276 -20.805 1.00 44.35 C ATOM 1180 C ASP B 7 -15.071 27.778 -20.698 1.00 44.19 C ATOM 1181 O ASP B 7 -14.465 28.326 -19.779 1.00 44.84 O ATOM 1182 CB ASP B 7 -13.811 25.898 -21.580 1.00 43.88 C ATOM 1183 CG ASP B 7 -13.485 24.399 -21.515 1.00 47.46 C ATOM 1184 OD1 ASP B 7 -13.044 23.840 -22.563 1.00 49.16 O ATOM 1185 OD2 ASP B 7 -13.651 23.774 -20.431 1.00 47.03 O ATOM 1186 HA ASP B 7 -15.035 25.805 -19.822 1.00 0.00 H ATOM 1187 HB2 ASP B 7 -13.954 26.176 -22.624 1.00 0.00 H ATOM 1188 HB3 ASP B 7 -12.968 26.454 -21.169 1.00 0.00 H ATOM 1189 H ASP B 7 -16.238 25.263 -22.342 1.00 0.00 H ATOM 1190 N ASP B 8 -15.743 28.449 -21.638 1.00 43.47 N ATOM 1191 CA ASP B 8 -15.823 29.907 -21.612 1.00 43.67 C ATOM 1192 C ASP B 8 -16.758 30.385 -20.525 1.00 42.17 C ATOM 1193 O ASP B 8 -16.605 31.521 -20.039 1.00 41.79 O ATOM 1194 CB ASP B 8 -16.300 30.514 -22.957 1.00 44.49 C ATOM 1195 CG ASP B 8 -15.252 30.363 -24.117 1.00 50.43 C ATOM 1196 OD1 ASP B 8 -15.726 30.386 -25.281 1.00 57.53 O ATOM 1197 OD2 ASP B 8 -14.002 30.188 -23.907 1.00 52.94 O ATOM 1198 HA ASP B 8 -14.805 30.246 -21.418 1.00 0.00 H ATOM 1199 HB2 ASP B 8 -17.221 30.012 -23.255 1.00 0.00 H ATOM 1200 HB3 ASP B 8 -16.498 31.575 -22.806 1.00 0.00 H ATOM 1201 H ASP B 8 -16.217 27.924 -22.401 1.00 0.00 H ATOM 1202 N LYS B 9 -17.756 29.563 -20.182 1.00 40.43 N ATOM 1203 CA LYS B 9 -18.682 29.940 -19.130 1.00 39.09 C ATOM 1204 C LYS B 9 -17.862 29.960 -17.858 1.00 39.05 C ATOM 1205 O LYS B 9 -17.998 30.871 -17.026 1.00 40.89 O ATOM 1206 CB LYS B 9 -19.807 28.926 -18.977 1.00 38.80 C ATOM 1207 CG LYS B 9 -20.715 28.726 -20.157 1.00 38.92 C ATOM 1208 CD LYS B 9 -21.976 27.951 -19.633 1.00 41.47 C ATOM 1209 CE LYS B 9 -23.133 27.944 -20.602 1.00 39.96 C ATOM 1210 NZ LYS B 9 -22.739 27.459 -21.906 1.00 35.64 N ATOM 1211 HA LYS B 9 -19.146 30.900 -19.357 1.00 0.00 H ATOM 1212 HB2 LYS B 9 -19.352 27.963 -18.746 1.00 0.00 H ATOM 1213 HB3 LYS B 9 -20.425 29.245 -18.138 1.00 0.00 H ATOM 1214 HG2 LYS B 9 -21.012 29.690 -20.570 1.00 0.00 H ATOM 1215 HG3 LYS B 9 -20.208 28.143 -20.926 1.00 0.00 H ATOM 1216 HD2 LYS B 9 -21.687 26.919 -19.435 1.00 0.00 H ATOM 1217 HD3 LYS B 9 -22.307 28.419 -18.706 1.00 0.00 H ATOM 1218 HE2 LYS B 9 -23.514 28.960 -20.704 1.00 0.00 H ATOM 1219 HE3 LYS B 9 -23.919 27.300 -20.208 1.00 0.00 H ATOM 1220 HZ1 LYS B 9 -21.993 28.072 -22.292 1.00 0.00 H ATOM 1221 HZ2 LYS B 9 -22.380 26.487 -21.819 1.00 0.00 H ATOM 1222 HZ3 LYS B 9 -23.562 27.470 -22.542 1.00 0.00 H ATOM 1223 H LYS B 9 -17.869 28.652 -20.670 1.00 0.00 H ATOM 1224 N LYS B 10 -17.012 28.945 -17.706 1.00 38.07 N ATOM 1225 CA LYS B 10 -16.169 28.770 -16.540 1.00 37.34 C ATOM 1226 C LYS B 10 -15.171 29.945 -16.417 1.00 37.49 C ATOM 1227 O LYS B 10 -15.114 30.618 -15.375 1.00 37.62 O ATOM 1228 CB LYS B 10 -15.454 27.405 -16.580 1.00 36.50 C ATOM 1229 CG LYS B 10 -14.415 27.229 -15.470 1.00 35.96 C ATOM 1230 CD LYS B 10 -15.014 27.305 -14.025 1.00 34.12 C ATOM 1231 CE LYS B 10 -15.886 26.113 -13.678 1.00 36.07 C ATOM 1232 NZ LYS B 10 -15.212 25.155 -12.759 1.00 36.12 N ATOM 1233 HA LYS B 10 -16.796 28.776 -15.648 1.00 0.00 H ATOM 1234 HB2 LYS B 10 -16.203 26.619 -16.480 1.00 0.00 H ATOM 1235 HB3 LYS B 10 -14.952 27.306 -17.542 1.00 0.00 H ATOM 1236 HG2 LYS B 10 -13.940 26.256 -15.595 1.00 0.00 H ATOM 1237 HG3 LYS B 10 -13.665 28.014 -15.573 1.00 0.00 H ATOM 1238 HD2 LYS B 10 -14.192 27.353 -13.311 1.00 0.00 H ATOM 1239 HD3 LYS B 10 -15.616 28.210 -13.946 1.00 0.00 H ATOM 1240 HE2 LYS B 10 -16.144 25.590 -14.599 1.00 0.00 H ATOM 1241 HE3 LYS B 10 -16.796 26.474 -13.199 1.00 0.00 H ATOM 1242 HZ1 LYS B 10 -14.346 24.796 -13.209 1.00 0.00 H ATOM 1243 HZ2 LYS B 10 -14.968 25.640 -11.872 1.00 0.00 H ATOM 1244 HZ3 LYS B 10 -15.853 24.362 -12.556 1.00 0.00 H ATOM 1245 H LYS B 10 -16.950 28.239 -18.467 1.00 0.00 H ATOM 1246 N THR B 11 -14.404 30.185 -17.473 1.00 37.82 N ATOM 1247 CA THR B 11 -13.474 31.310 -17.540 1.00 37.50 C ATOM 1248 C THR B 11 -14.154 32.679 -17.249 1.00 39.08 C ATOM 1249 O THR B 11 -13.583 33.504 -16.480 1.00 38.09 O ATOM 1250 CB THR B 11 -12.786 31.338 -18.937 1.00 38.52 C ATOM 1251 OG1 THR B 11 -12.011 30.145 -19.062 1.00 32.94 O ATOM 1252 CG2 THR B 11 -11.850 32.608 -19.123 1.00 34.95 C ATOM 1253 HA THR B 11 -12.730 31.159 -16.758 1.00 0.00 H ATOM 1254 HB THR B 11 -13.554 31.398 -19.708 1.00 0.00 H ATOM 1255 HG1 THR B 11 -11.331 30.118 -18.343 1.00 0.00 H ATOM 1256 HG23 THR B 11 -12.447 33.515 -19.027 1.00 0.00 H ATOM 1257 HG21 THR B 11 -11.073 32.600 -18.359 1.00 0.00 H ATOM 1258 HG22 THR B 11 -11.390 32.577 -20.111 1.00 0.00 H ATOM 1259 H THR B 11 -14.468 29.544 -18.289 1.00 0.00 H ATOM 1260 N ASN B 12 -15.353 32.940 -17.810 1.00 39.07 N ATOM 1261 CA ASN B 12 -15.966 34.260 -17.529 1.00 40.26 C ATOM 1262 C ASN B 12 -16.360 34.285 -16.099 1.00 39.17 C ATOM 1263 O ASN B 12 -16.129 35.286 -15.423 1.00 39.68 O ATOM 1264 CB ASN B 12 -17.151 34.680 -18.431 1.00 41.23 C ATOM 1265 CG ASN B 12 -16.779 34.643 -19.942 1.00 48.57 C ATOM 1266 OD1 ASN B 12 -15.589 34.761 -20.326 1.00 53.83 O ATOM 1267 ND2 ASN B 12 -17.795 34.428 -20.803 1.00 53.37 N ATOM 1268 HA ASN B 12 -15.204 35.003 -17.765 1.00 0.00 H ATOM 1269 HB2 ASN B 12 -17.984 33.999 -18.257 1.00 0.00 H ATOM 1270 HB3 ASN B 12 -17.451 35.694 -18.167 1.00 0.00 H ATOM 1271 HD22 ASN B 12 -18.768 34.336 -20.447 1.00 0.00 H ATOM 1272 HD21 ASN B 12 -17.606 34.355 -21.823 1.00 0.00 H ATOM 1273 H ASN B 12 -15.829 32.242 -18.416 1.00 0.00 H ATOM 1274 N TRP B 13 -16.895 33.181 -15.597 1.00 37.79 N ATOM 1275 CA TRP B 13 -17.182 33.170 -14.177 1.00 36.91 C ATOM 1276 C TRP B 13 -15.937 33.484 -13.358 1.00 36.46 C ATOM 1277 O TRP B 13 -16.011 34.295 -12.470 1.00 37.25 O ATOM 1278 CB TRP B 13 -17.786 31.857 -13.707 1.00 36.86 C ATOM 1279 CG TRP B 13 -19.236 31.964 -13.587 1.00 37.37 C ATOM 1280 CD1 TRP B 13 -20.151 31.233 -14.254 1.00 35.09 C ATOM 1281 CD2 TRP B 13 -19.973 32.894 -12.754 1.00 36.16 C ATOM 1282 NE1 TRP B 13 -21.424 31.624 -13.895 1.00 32.84 N ATOM 1283 CE2 TRP B 13 -21.352 32.648 -12.989 1.00 34.77 C ATOM 1284 CE3 TRP B 13 -19.599 33.908 -11.830 1.00 35.14 C ATOM 1285 CZ2 TRP B 13 -22.388 33.350 -12.308 1.00 33.27 C ATOM 1286 CZ3 TRP B 13 -20.626 34.618 -11.147 1.00 34.40 C ATOM 1287 CH2 TRP B 13 -22.005 34.306 -11.389 1.00 34.46 C ATOM 1288 HA TRP B 13 -17.925 33.951 -14.017 1.00 0.00 H ATOM 1289 HB2 TRP B 13 -17.544 31.075 -14.426 1.00 0.00 H ATOM 1290 HB3 TRP B 13 -17.365 31.598 -12.735 1.00 0.00 H ATOM 1291 HE1 TRP B 13 -22.304 31.205 -14.257 1.00 0.00 H ATOM 1292 HD1 TRP B 13 -19.919 30.447 -14.973 1.00 0.00 H ATOM 1293 HZ2 TRP B 13 -23.440 33.141 -12.505 1.00 0.00 H ATOM 1294 HH2 TRP B 13 -22.774 34.840 -10.830 1.00 0.00 H ATOM 1295 HZ3 TRP B 13 -20.364 35.402 -10.437 1.00 0.00 H ATOM 1296 HE3 TRP B 13 -18.549 34.136 -11.649 1.00 0.00 H ATOM 1297 H TRP B 13 -17.100 32.357 -16.197 1.00 0.00 H ATOM 1298 N LEU B 14 -14.795 32.848 -13.642 1.00 35.48 N ATOM 1299 CA LEU B 14 -13.596 32.997 -12.780 1.00 34.42 C ATOM 1300 C LEU B 14 -13.075 34.412 -12.881 1.00 35.29 C ATOM 1301 O LEU B 14 -12.541 34.983 -11.907 1.00 34.53 O ATOM 1302 CB LEU B 14 -12.512 32.035 -13.203 1.00 32.38 C ATOM 1303 CG LEU B 14 -12.834 30.574 -12.878 1.00 32.19 C ATOM 1304 CD1 LEU B 14 -11.595 29.746 -13.191 1.00 30.60 C ATOM 1305 CD2 LEU B 14 -13.336 30.296 -11.417 1.00 24.94 C ATOM 1306 HA LEU B 14 -13.879 32.777 -11.751 1.00 0.00 H ATOM 1307 HB2 LEU B 14 -12.370 32.126 -14.280 1.00 0.00 H ATOM 1308 HB3 LEU B 14 -11.589 32.308 -12.691 1.00 0.00 H ATOM 1309 HG LEU B 14 -13.685 30.292 -13.498 1.00 0.00 H ATOM 1310 HD21 LEU B 14 -12.570 30.606 -10.706 1.00 0.00 H ATOM 1311 HD22 LEU B 14 -14.252 30.859 -11.236 1.00 0.00 H ATOM 1312 HD23 LEU B 14 -13.533 29.231 -11.299 1.00 0.00 H ATOM 1313 HD11 LEU B 14 -11.345 29.854 -14.246 1.00 0.00 H ATOM 1314 HD12 LEU B 14 -10.762 30.096 -12.581 1.00 0.00 H ATOM 1315 HD13 LEU B 14 -11.794 28.698 -12.969 1.00 0.00 H ATOM 1316 H LEU B 14 -14.746 32.238 -14.483 1.00 0.00 H ATOM 1317 N LYS B 15 -13.264 34.983 -14.072 1.00 36.41 N ATOM 1318 CA LYS B 15 -12.886 36.369 -14.338 1.00 38.37 C ATOM 1319 C LYS B 15 -13.713 37.322 -13.475 1.00 37.71 C ATOM 1320 O LYS B 15 -13.141 38.193 -12.789 1.00 38.35 O ATOM 1321 CB LYS B 15 -13.016 36.621 -15.807 1.00 38.96 C ATOM 1322 CG LYS B 15 -12.773 38.045 -16.275 1.00 47.39 C ATOM 1323 CD LYS B 15 -12.448 37.962 -17.797 1.00 56.78 C ATOM 1324 CE LYS B 15 -11.648 36.602 -18.012 1.00 58.38 C ATOM 1325 NZ LYS B 15 -10.484 36.585 -18.995 1.00 61.22 N ATOM 1326 HA LYS B 15 -11.848 36.553 -14.062 1.00 0.00 H ATOM 1327 HB2 LYS B 15 -12.300 35.978 -16.318 1.00 0.00 H ATOM 1328 HB3 LYS B 15 -14.028 36.343 -16.103 1.00 0.00 H ATOM 1329 HG2 LYS B 15 -13.664 38.652 -16.112 1.00 0.00 H ATOM 1330 HG3 LYS B 15 -11.934 38.481 -15.734 1.00 0.00 H ATOM 1331 HD2 LYS B 15 -13.369 37.954 -18.380 1.00 0.00 H ATOM 1332 HD3 LYS B 15 -11.836 38.812 -18.099 1.00 0.00 H ATOM 1333 HE2 LYS B 15 -12.367 35.857 -18.353 1.00 0.00 H ATOM 1334 HE3 LYS B 15 -11.252 36.305 -17.041 1.00 0.00 H ATOM 1335 HZ1 LYS B 15 -10.828 36.842 -19.942 1.00 0.00 H ATOM 1336 HZ2 LYS B 15 -9.764 37.270 -18.689 1.00 0.00 H ATOM 1337 HZ3 LYS B 15 -10.069 35.632 -19.022 1.00 0.00 H ATOM 1338 H LYS B 15 -13.694 34.423 -14.836 1.00 0.00 H ATOM 1339 N ARG B 16 -15.030 37.093 -13.415 1.00 36.62 N ATOM 1340 CA ARG B 16 -15.895 37.849 -12.530 1.00 35.74 C ATOM 1341 C ARG B 16 -15.649 37.660 -11.017 1.00 35.72 C ATOM 1342 O ARG B 16 -15.593 38.668 -10.288 1.00 36.63 O ATOM 1343 CB ARG B 16 -17.338 37.516 -12.822 1.00 36.42 C ATOM 1344 CG ARG B 16 -18.287 38.328 -12.009 1.00 38.49 C ATOM 1345 CD ARG B 16 -19.692 38.071 -12.488 1.00 47.89 C ATOM 1346 NE ARG B 16 -20.610 38.793 -11.613 1.00 54.63 N ATOM 1347 CZ ARG B 16 -20.862 40.091 -11.749 1.00 58.81 C ATOM 1348 NH1 ARG B 16 -20.302 40.782 -12.752 1.00 58.88 N ATOM 1349 NH2 ARG B 16 -21.667 40.696 -10.886 1.00 57.75 N ATOM 1350 HA ARG B 16 -15.654 38.891 -12.742 1.00 0.00 H ATOM 1351 HB2 ARG B 16 -17.533 37.703 -13.878 1.00 0.00 H ATOM 1352 HB3 ARG B 16 -17.505 36.461 -12.604 1.00 0.00 H ATOM 1353 HG2 ARG B 16 -18.202 38.047 -10.959 1.00 0.00 H ATOM 1354 HG3 ARG B 16 -18.051 39.386 -12.121 1.00 0.00 H ATOM 1355 HD2 ARG B 16 -19.906 37.003 -12.448 1.00 0.00 H ATOM 1356 HD3 ARG B 16 -19.803 38.425 -13.513 1.00 0.00 H ATOM 1357 HE ARG B 16 -21.087 38.270 -10.851 1.00 0.00 H ATOM 1358 HH12 ARG B 16 -20.500 41.798 -12.858 1.00 0.00 H ATOM 1359 HH11 ARG B 16 -19.670 40.303 -13.424 1.00 0.00 H ATOM 1360 HH22 ARG B 16 -21.868 41.711 -10.987 1.00 0.00 H ATOM 1361 HH21 ARG B 16 -22.097 40.155 -10.109 1.00 0.00 H ATOM 1362 H ARG B 16 -15.444 36.354 -14.018 1.00 0.00 H ATOM 1363 N ILE B 17 -15.569 36.397 -10.547 1.00 34.03 N ATOM 1364 CA ILE B 17 -15.271 36.054 -9.183 1.00 32.77 C ATOM 1365 C ILE B 17 -13.996 36.844 -8.775 1.00 33.34 C ATOM 1366 O ILE B 17 -13.961 37.441 -7.711 1.00 34.67 O ATOM 1367 CB ILE B 17 -15.036 34.514 -9.012 1.00 32.62 C ATOM 1368 CG1 ILE B 17 -16.343 33.779 -8.799 1.00 33.69 C ATOM 1369 CG2 ILE B 17 -14.190 34.204 -7.824 1.00 28.92 C ATOM 1370 CD1 ILE B 17 -16.425 32.435 -9.575 1.00 28.63 C ATOM 1371 HA ILE B 17 -16.115 36.315 -8.545 1.00 0.00 H ATOM 1372 HB ILE B 17 -14.543 34.193 -9.929 1.00 0.00 H ATOM 1373 HG12 ILE B 17 -16.455 33.572 -7.735 1.00 0.00 H ATOM 1374 HG13 ILE B 17 -17.159 34.421 -9.130 1.00 0.00 H ATOM 1375 HD11 ILE B 17 -16.326 32.627 -10.643 1.00 0.00 H ATOM 1376 HD12 ILE B 17 -15.620 31.777 -9.246 1.00 0.00 H ATOM 1377 HD13 ILE B 17 -17.387 31.961 -9.378 1.00 0.00 H ATOM 1378 HG21 ILE B 17 -13.219 34.686 -7.936 1.00 0.00 H ATOM 1379 HG22 ILE B 17 -14.680 34.575 -6.924 1.00 0.00 H ATOM 1380 HG23 ILE B 17 -14.055 33.125 -7.747 1.00 0.00 H ATOM 1381 H ILE B 17 -15.734 35.619 -11.217 1.00 0.00 H ATOM 1382 N TYR B 18 -12.986 36.897 -9.630 1.00 32.62 N ATOM 1383 CA TYR B 18 -11.734 37.512 -9.265 1.00 32.50 C ATOM 1384 C TYR B 18 -11.894 39.030 -9.216 1.00 34.43 C ATOM 1385 O TYR B 18 -11.300 39.692 -8.369 1.00 34.36 O ATOM 1386 CB TYR B 18 -10.634 37.087 -10.246 1.00 30.71 C ATOM 1387 CG TYR B 18 -9.295 37.666 -9.859 1.00 33.55 C ATOM 1388 CD1 TYR B 18 -8.569 37.151 -8.764 1.00 33.01 C ATOM 1389 CD2 TYR B 18 -8.774 38.800 -10.524 1.00 33.84 C ATOM 1390 CE1 TYR B 18 -7.358 37.676 -8.387 1.00 28.89 C ATOM 1391 CE2 TYR B 18 -7.550 39.350 -10.147 1.00 29.06 C ATOM 1392 CZ TYR B 18 -6.866 38.791 -9.087 1.00 32.06 C ATOM 1393 OH TYR B 18 -5.662 39.336 -8.732 1.00 30.19 O ATOM 1394 HA TYR B 18 -11.438 37.177 -8.271 1.00 0.00 H ATOM 1395 HB3 TYR B 18 -10.896 37.436 -11.245 1.00 0.00 H ATOM 1396 HB2 TYR B 18 -10.563 35.999 -10.249 1.00 0.00 H ATOM 1397 HD2 TYR B 18 -9.337 39.250 -11.342 1.00 0.00 H ATOM 1398 HE2 TYR B 18 -7.140 40.207 -10.681 1.00 0.00 H ATOM 1399 HE1 TYR B 18 -6.792 37.239 -7.565 1.00 0.00 H ATOM 1400 HD1 TYR B 18 -8.981 36.313 -8.202 1.00 0.00 H ATOM 1401 HH TYR B 18 -5.289 38.837 -7.962 1.00 0.00 H ATOM 1402 H TYR B 18 -13.098 36.488 -10.580 1.00 0.00 H ATOM 1403 N ARG B 19 -12.714 39.589 -10.120 1.00 36.90 N ATOM 1404 CA ARG B 19 -12.786 41.040 -10.263 1.00 38.50 C ATOM 1405 C ARG B 19 -13.585 41.590 -9.085 1.00 39.29 C ATOM 1406 O ARG B 19 -13.109 42.502 -8.436 1.00 40.63 O ATOM 1407 CB ARG B 19 -13.307 41.485 -11.655 1.00 38.60 C ATOM 1408 CG ARG B 19 -13.578 42.987 -11.795 1.00 41.10 C ATOM 1409 CD ARG B 19 -14.508 43.382 -13.032 1.00 49.49 C ATOM 1410 NE ARG B 19 -15.806 42.658 -13.228 1.00 55.40 N ATOM 1411 CZ ARG B 19 -16.017 41.593 -14.085 1.00 60.71 C ATOM 1412 NH1 ARG B 19 -15.044 41.013 -14.862 1.00 54.55 N ATOM 1413 NH2 ARG B 19 -17.242 41.053 -14.183 1.00 59.45 N ATOM 1414 HA ARG B 19 -11.784 41.469 -10.229 1.00 0.00 H ATOM 1415 HB2 ARG B 19 -12.563 41.204 -12.400 1.00 0.00 H ATOM 1416 HB3 ARG B 19 -14.237 40.953 -11.854 1.00 0.00 H ATOM 1417 HG2 ARG B 19 -14.062 43.332 -10.881 1.00 0.00 H ATOM 1418 HG3 ARG B 19 -12.621 43.496 -11.912 1.00 0.00 H ATOM 1419 HD2 ARG B 19 -13.918 43.231 -13.936 1.00 0.00 H ATOM 1420 HD3 ARG B 19 -14.745 44.441 -12.928 1.00 0.00 H ATOM 1421 HE ARG B 19 -16.620 42.986 -12.670 1.00 0.00 H ATOM 1422 HH12 ARG B 19 -15.282 40.213 -15.483 1.00 0.00 H ATOM 1423 HH11 ARG B 19 -14.069 41.374 -14.830 1.00 0.00 H ATOM 1424 HH22 ARG B 19 -17.407 40.252 -14.825 1.00 0.00 H ATOM 1425 HH21 ARG B 19 -18.026 41.436 -13.616 1.00 0.00 H ATOM 1426 H ARG B 19 -13.304 38.982 -10.725 1.00 0.00 H ATOM 1427 N VAL B 20 -14.738 41.011 -8.740 1.00 39.02 N ATOM 1428 CA VAL B 20 -15.662 41.629 -7.725 1.00 39.07 C ATOM 1429 C VAL B 20 -15.444 41.367 -6.180 1.00 40.05 C ATOM 1430 O VAL B 20 -16.167 41.926 -5.337 1.00 39.82 O ATOM 1431 CB VAL B 20 -17.166 41.316 -8.088 1.00 38.80 C ATOM 1432 CG1 VAL B 20 -17.429 41.642 -9.579 1.00 37.93 C ATOM 1433 CG2 VAL B 20 -17.514 39.858 -7.758 1.00 37.08 C ATOM 1434 HA VAL B 20 -15.389 42.680 -7.823 1.00 0.00 H ATOM 1435 HB VAL B 20 -17.816 41.948 -7.483 1.00 0.00 H ATOM 1436 HG11 VAL B 20 -17.228 42.698 -9.760 1.00 0.00 H ATOM 1437 HG12 VAL B 20 -16.774 41.034 -10.203 1.00 0.00 H ATOM 1438 HG13 VAL B 20 -18.469 41.423 -9.820 1.00 0.00 H ATOM 1439 HG21 VAL B 20 -16.868 39.193 -8.331 1.00 0.00 H ATOM 1440 HG22 VAL B 20 -17.365 39.682 -6.693 1.00 0.00 H ATOM 1441 HG23 VAL B 20 -18.555 39.667 -8.017 1.00 0.00 H ATOM 1442 H VAL B 20 -15.005 40.109 -9.184 1.00 0.00 H ATOM 1443 N ARG B 21 -14.494 40.491 -5.805 1.00 40.72 N ATOM 1444 CA ARG B 21 -14.155 40.307 -4.402 1.00 40.20 C ATOM 1445 C ARG B 21 -12.706 40.553 -4.219 1.00 39.44 C ATOM 1446 O ARG B 21 -11.914 39.645 -4.380 1.00 40.77 O ATOM 1447 CB ARG B 21 -14.530 38.924 -3.953 1.00 40.41 C ATOM 1448 CG ARG B 21 -16.022 38.881 -3.791 1.00 45.61 C ATOM 1449 CD ARG B 21 -16.488 37.766 -2.920 1.00 53.56 C ATOM 1450 NE ARG B 21 -16.770 38.174 -1.540 1.00 60.05 N ATOM 1451 CZ ARG B 21 -17.832 38.895 -1.152 1.00 63.97 C ATOM 1452 NH1 ARG B 21 -18.710 39.352 -2.045 1.00 67.33 N ATOM 1453 NH2 ARG B 21 -18.019 39.188 0.139 1.00 62.91 N ATOM 1454 HA ARG B 21 -14.714 41.016 -3.791 1.00 0.00 H ATOM 1455 HB2 ARG B 21 -14.217 38.194 -4.700 1.00 0.00 H ATOM 1456 HB3 ARG B 21 -14.047 38.699 -3.002 1.00 0.00 H ATOM 1457 HG2 ARG B 21 -16.350 39.823 -3.352 1.00 0.00 H ATOM 1458 HG3 ARG B 21 -16.474 38.763 -4.776 1.00 0.00 H ATOM 1459 HD2 ARG B 21 -15.715 36.998 -2.901 1.00 0.00 H ATOM 1460 HD3 ARG B 21 -17.400 37.351 -3.350 1.00 0.00 H ATOM 1461 HE ARG B 21 -16.094 37.882 -0.806 1.00 0.00 H ATOM 1462 HH12 ARG B 21 -19.529 39.910 -1.730 1.00 0.00 H ATOM 1463 HH11 ARG B 21 -18.576 39.151 -3.056 1.00 0.00 H ATOM 1464 HH22 ARG B 21 -18.846 39.748 0.431 1.00 0.00 H ATOM 1465 HH21 ARG B 21 -17.338 38.856 0.851 1.00 0.00 H ATOM 1466 H ARG B 21 -13.994 39.937 -6.529 1.00 0.00 H ATOM 1467 N PRO B 22 -12.348 41.795 -3.897 1.00 39.17 N ATOM 1468 CA PRO B 22 -10.958 42.247 -3.587 1.00 38.16 C ATOM 1469 C PRO B 22 -10.389 41.645 -2.291 1.00 37.78 C ATOM 1470 O PRO B 22 -11.104 40.962 -1.505 1.00 36.29 O ATOM 1471 CB PRO B 22 -11.104 43.773 -3.423 1.00 37.54 C ATOM 1472 CG PRO B 22 -12.534 43.958 -2.982 1.00 39.74 C ATOM 1473 CD PRO B 22 -13.345 42.874 -3.709 1.00 39.75 C ATOM 1474 HA PRO B 22 -10.267 41.935 -4.370 1.00 0.00 H ATOM 1475 HD3 PRO B 22 -14.183 42.534 -3.100 1.00 0.00 H ATOM 1476 HD2 PRO B 22 -13.718 43.237 -4.667 1.00 0.00 H ATOM 1477 HG3 PRO B 22 -12.891 44.949 -3.260 1.00 0.00 H ATOM 1478 HG2 PRO B 22 -12.617 43.833 -1.902 1.00 0.00 H ATOM 1479 HB2 PRO B 22 -10.414 44.150 -2.668 1.00 0.00 H ATOM 1480 HB3 PRO B 22 -10.921 44.284 -4.368 1.00 0.00 H ATOM 1481 N CYS B 23 -9.095 41.886 -2.068 1.00 37.25 N ATOM 1482 CA CYS B 23 -8.418 41.467 -0.865 1.00 36.98 C ATOM 1483 C CYS B 23 -9.358 41.551 0.369 1.00 37.84 C ATOM 1484 O CYS B 23 -9.848 42.633 0.674 1.00 39.05 O ATOM 1485 CB CYS B 23 -7.224 42.408 -0.680 1.00 36.28 C ATOM 1486 SG CYS B 23 -6.394 42.107 0.881 1.00 36.51 S ATOM 1487 HA CYS B 23 -8.099 40.428 -0.953 1.00 0.00 H ATOM 1488 HB2 CYS B 23 -7.577 43.439 -0.702 1.00 0.00 H ATOM 1489 HB3 CYS B 23 -6.517 42.250 -1.495 1.00 0.00 H ATOM 1490 HG CYS B 23 -5.327 42.973 1.008 1.00 0.00 H ATOM 1491 H CYS B 23 -8.552 42.398 -2.792 1.00 0.00 H ATOM 1492 N VAL B 24 -9.604 40.453 1.096 1.00 38.65 N ATOM 1493 CA VAL B 24 -10.446 40.519 2.315 1.00 38.37 C ATOM 1494 C VAL B 24 -9.978 41.537 3.385 1.00 40.56 C ATOM 1495 O VAL B 24 -10.766 41.857 4.294 1.00 41.81 O ATOM 1496 CB VAL B 24 -10.631 39.145 3.069 1.00 38.24 C ATOM 1497 CG1 VAL B 24 -11.280 38.085 2.185 1.00 37.38 C ATOM 1498 CG2 VAL B 24 -9.310 38.666 3.671 1.00 34.51 C ATOM 1499 HA VAL B 24 -11.391 40.843 1.880 1.00 0.00 H ATOM 1500 HB VAL B 24 -11.322 39.316 3.894 1.00 0.00 H ATOM 1501 HG11 VAL B 24 -12.263 38.432 1.866 1.00 0.00 H ATOM 1502 HG12 VAL B 24 -10.654 37.910 1.310 1.00 0.00 H ATOM 1503 HG13 VAL B 24 -11.386 37.158 2.749 1.00 0.00 H ATOM 1504 HG21 VAL B 24 -8.577 38.532 2.875 1.00 0.00 H ATOM 1505 HG22 VAL B 24 -8.946 39.408 4.381 1.00 0.00 H ATOM 1506 HG23 VAL B 24 -9.469 37.717 4.184 1.00 0.00 H ATOM 1507 H VAL B 24 -9.199 39.542 0.801 1.00 0.00 H ATOM 1508 N LYS B 25 -8.727 42.017 3.303 1.00 40.66 N ATOM 1509 CA LYS B 25 -8.114 42.866 4.347 1.00 40.99 C ATOM 1510 C LYS B 25 -8.084 44.342 3.993 1.00 42.60 C ATOM 1511 O LYS B 25 -8.596 45.159 4.754 1.00 44.63 O ATOM 1512 CB LYS B 25 -6.687 42.426 4.672 1.00 40.38 C ATOM 1513 CG LYS B 25 -5.979 43.283 5.682 1.00 36.90 C ATOM 1514 CD LYS B 25 -6.474 43.049 7.094 1.00 32.54 C ATOM 1515 CE LYS B 25 -5.896 44.125 7.996 1.00 30.47 C ATOM 1516 NZ LYS B 25 -6.576 44.034 9.328 1.00 28.51 N ATOM 1517 HA LYS B 25 -8.759 42.734 5.216 1.00 0.00 H ATOM 1518 HB2 LYS B 25 -6.725 41.407 5.058 1.00 0.00 H ATOM 1519 HB3 LYS B 25 -6.108 42.441 3.748 1.00 0.00 H ATOM 1520 HG2 LYS B 25 -4.913 43.059 5.644 1.00 0.00 H ATOM 1521 HG3 LYS B 25 -6.139 44.330 5.425 1.00 0.00 H ATOM 1522 HD2 LYS B 25 -7.563 43.098 7.114 1.00 0.00 H ATOM 1523 HD3 LYS B 25 -6.150 42.067 7.439 1.00 0.00 H ATOM 1524 HE2 LYS B 25 -6.072 45.108 7.558 1.00 0.00 H ATOM 1525 HE3 LYS B 25 -4.824 43.969 8.117 1.00 0.00 H ATOM 1526 HZ1 LYS B 25 -7.598 44.181 9.205 1.00 0.00 H ATOM 1527 HZ2 LYS B 25 -6.407 43.094 9.739 1.00 0.00 H ATOM 1528 HZ3 LYS B 25 -6.193 44.764 9.962 1.00 0.00 H ATOM 1529 H LYS B 25 -8.161 41.780 2.463 1.00 0.00 H ATOM 1530 N CYS B 26 -7.473 44.724 2.881 1.00 42.97 N ATOM 1531 CA CYS B 26 -7.517 46.148 2.538 1.00 43.12 C ATOM 1532 C CYS B 26 -8.789 46.468 1.777 1.00 43.10 C ATOM 1533 O CYS B 26 -9.068 47.618 1.567 1.00 44.05 O ATOM 1534 CB CYS B 26 -6.288 46.577 1.732 1.00 42.68 C ATOM 1535 SG CYS B 26 -6.250 45.717 0.117 1.00 42.40 S ATOM 1536 HA CYS B 26 -7.510 46.712 3.471 1.00 0.00 H ATOM 1537 HB2 CYS B 26 -5.387 46.329 2.292 1.00 0.00 H ATOM 1538 HB3 CYS B 26 -6.326 47.653 1.565 1.00 0.00 H ATOM 1539 HG CYS B 26 -6.198 44.354 0.325 1.00 0.00 H ATOM 1540 H CYS B 26 -6.980 44.038 2.274 1.00 0.00 H ATOM 1541 N LYS B 27 -9.521 45.459 1.305 1.00 43.60 N ATOM 1542 CA LYS B 27 -10.806 45.675 0.709 1.00 44.10 C ATOM 1543 C LYS B 27 -10.742 46.444 -0.622 1.00 45.01 C ATOM 1544 O LYS B 27 -11.764 46.757 -1.197 1.00 45.64 O ATOM 1545 CB LYS B 27 -11.693 46.433 1.711 1.00 44.60 C ATOM 1546 CG LYS B 27 -12.081 45.657 3.020 1.00 45.64 C ATOM 1547 CD LYS B 27 -13.250 44.706 2.758 1.00 53.43 C ATOM 1548 CE LYS B 27 -13.504 43.844 4.001 1.00 58.74 C ATOM 1549 NZ LYS B 27 -13.051 44.785 5.081 1.00 54.42 N ATOM 1550 HA LYS B 27 -11.226 44.697 0.474 1.00 0.00 H ATOM 1551 HB2 LYS B 27 -11.163 47.339 2.006 1.00 0.00 H ATOM 1552 HB3 LYS B 27 -12.616 46.704 1.199 1.00 0.00 H ATOM 1553 HG2 LYS B 27 -11.221 45.082 3.363 1.00 0.00 H ATOM 1554 HG3 LYS B 27 -12.368 46.374 3.790 1.00 0.00 H ATOM 1555 HD2 LYS B 27 -14.145 45.285 2.530 1.00 0.00 H ATOM 1556 HD3 LYS B 27 -13.010 44.061 1.912 1.00 0.00 H ATOM 1557 HE2 LYS B 27 -12.909 42.931 3.987 1.00 0.00 H ATOM 1558 HE3 LYS B 27 -14.558 43.588 4.105 1.00 0.00 H ATOM 1559 HZ1 LYS B 27 -12.050 45.024 4.933 1.00 0.00 H ATOM 1560 HZ2 LYS B 27 -13.624 45.652 5.047 1.00 0.00 H ATOM 1561 HZ3 LYS B 27 -13.166 44.328 6.008 1.00 0.00 H ATOM 1562 H LYS B 27 -9.150 44.490 1.371 1.00 0.00 H ATOM 1563 N VAL B 28 -9.553 46.750 -1.127 1.00 45.66 N ATOM 1564 CA VAL B 28 -9.387 47.491 -2.405 1.00 44.78 C ATOM 1565 C VAL B 28 -8.522 46.775 -3.470 1.00 43.78 C ATOM 1566 O VAL B 28 -8.983 46.585 -4.608 1.00 44.70 O ATOM 1567 CB VAL B 28 -8.801 48.925 -2.188 1.00 45.07 C ATOM 1568 CG1 VAL B 28 -8.683 49.629 -3.534 1.00 45.18 C ATOM 1569 CG2 VAL B 28 -9.743 49.722 -1.336 1.00 45.02 C ATOM 1570 HA VAL B 28 -10.405 47.546 -2.789 1.00 0.00 H ATOM 1571 HB VAL B 28 -7.825 48.844 -1.709 1.00 0.00 H ATOM 1572 HG11 VAL B 28 -8.021 49.058 -4.185 1.00 0.00 H ATOM 1573 HG12 VAL B 28 -9.669 49.702 -3.992 1.00 0.00 H ATOM 1574 HG13 VAL B 28 -8.275 50.629 -3.385 1.00 0.00 H ATOM 1575 HG21 VAL B 28 -10.710 49.794 -1.835 1.00 0.00 H ATOM 1576 HG22 VAL B 28 -9.866 49.228 -0.372 1.00 0.00 H ATOM 1577 HG23 VAL B 28 -9.336 50.722 -1.184 1.00 0.00 H ATOM 1578 H VAL B 28 -8.701 46.459 -0.606 1.00 0.00 H ATOM 1579 N ALA B 29 -7.271 46.418 -3.134 1.00 41.32 N ATOM 1580 CA ALA B 29 -6.399 45.627 -4.032 1.00 38.08 C ATOM 1581 C ALA B 29 -7.008 44.252 -4.341 1.00 36.99 C ATOM 1582 O ALA B 29 -7.724 43.658 -3.507 1.00 35.52 O ATOM 1583 CB ALA B 29 -4.991 45.471 -3.444 1.00 38.70 C ATOM 1584 HA ALA B 29 -6.319 46.177 -4.969 1.00 0.00 H ATOM 1585 HB1 ALA B 29 -4.545 46.456 -3.305 1.00 0.00 H ATOM 1586 HB2 ALA B 29 -5.055 44.961 -2.483 1.00 0.00 H ATOM 1587 HB3 ALA B 29 -4.376 44.886 -4.127 1.00 0.00 H ATOM 1588 H ALA B 29 -6.901 46.709 -2.207 1.00 0.00 H ATOM 1589 N PRO B 30 -6.772 43.762 -5.568 1.00 36.32 N ATOM 1590 CA PRO B 30 -7.275 42.422 -5.916 1.00 35.54 C ATOM 1591 C PRO B 30 -6.407 41.338 -5.273 1.00 34.29 C ATOM 1592 O PRO B 30 -5.300 41.618 -4.818 1.00 33.82 O ATOM 1593 CB PRO B 30 -7.154 42.415 -7.447 1.00 35.66 C ATOM 1594 CG PRO B 30 -6.070 43.377 -7.744 1.00 35.31 C ATOM 1595 CD PRO B 30 -6.256 44.473 -6.753 1.00 35.36 C ATOM 1596 HA PRO B 30 -8.288 42.220 -5.567 1.00 0.00 H ATOM 1597 HD3 PRO B 30 -5.310 44.968 -6.533 1.00 0.00 H ATOM 1598 HD2 PRO B 30 -6.975 45.209 -7.113 1.00 0.00 H ATOM 1599 HG3 PRO B 30 -6.162 43.758 -8.761 1.00 0.00 H ATOM 1600 HG2 PRO B 30 -5.094 42.908 -7.620 1.00 0.00 H ATOM 1601 HB2 PRO B 30 -6.894 41.420 -7.808 1.00 0.00 H ATOM 1602 HB3 PRO B 30 -8.089 42.735 -7.908 1.00 0.00 H ATOM 1603 N ARG B 31 -6.897 40.109 -5.224 1.00 34.19 N ATOM 1604 CA ARG B 31 -6.213 39.076 -4.453 1.00 33.31 C ATOM 1605 C ARG B 31 -4.975 38.523 -5.166 1.00 33.90 C ATOM 1606 O ARG B 31 -4.899 38.534 -6.423 1.00 33.91 O ATOM 1607 CB ARG B 31 -7.181 37.959 -4.154 1.00 32.90 C ATOM 1608 CG ARG B 31 -8.200 38.360 -3.118 1.00 33.92 C ATOM 1609 CD ARG B 31 -9.312 37.358 -3.032 1.00 33.19 C ATOM 1610 NE ARG B 31 -10.448 37.990 -2.384 1.00 37.08 N ATOM 1611 CZ ARG B 31 -11.404 37.342 -1.724 1.00 39.40 C ATOM 1612 NH1 ARG B 31 -11.392 35.995 -1.605 1.00 33.45 N ATOM 1613 NH2 ARG B 31 -12.381 38.054 -1.182 1.00 37.61 N ATOM 1614 HA ARG B 31 -5.861 39.534 -3.528 1.00 0.00 H ATOM 1615 HB2 ARG B 31 -7.701 37.687 -5.073 1.00 0.00 H ATOM 1616 HB3 ARG B 31 -6.623 37.098 -3.785 1.00 0.00 H ATOM 1617 HG2 ARG B 31 -7.710 38.432 -2.147 1.00 0.00 H ATOM 1618 HG3 ARG B 31 -8.616 39.331 -3.386 1.00 0.00 H ATOM 1619 HD2 ARG B 31 -8.987 36.496 -2.449 1.00 0.00 H ATOM 1620 HD3 ARG B 31 -9.593 37.032 -4.034 1.00 0.00 H ATOM 1621 HE ARG B 31 -10.519 39.026 -2.440 1.00 0.00 H ATOM 1622 HH12 ARG B 31 -12.151 35.512 -1.084 1.00 0.00 H ATOM 1623 HH11 ARG B 31 -10.623 35.442 -2.035 1.00 0.00 H ATOM 1624 HH22 ARG B 31 -13.144 37.577 -0.659 1.00 0.00 H ATOM 1625 HH21 ARG B 31 -12.385 39.089 -1.279 1.00 0.00 H ATOM 1626 H ARG B 31 -7.772 39.879 -5.737 1.00 0.00 H ATOM 1627 N ASP B 32 -4.016 38.031 -4.376 1.00 32.80 N ATOM 1628 CA ASP B 32 -3.015 37.205 -4.924 1.00 33.49 C ATOM 1629 C ASP B 32 -3.623 35.888 -5.431 1.00 34.79 C ATOM 1630 O ASP B 32 -4.724 35.505 -5.042 1.00 34.99 O ATOM 1631 CB ASP B 32 -1.962 36.894 -3.887 1.00 34.25 C ATOM 1632 CG ASP B 32 -0.600 36.562 -4.537 1.00 35.65 C ATOM 1633 OD1 ASP B 32 -0.451 36.617 -5.776 1.00 37.45 O ATOM 1634 OD2 ASP B 32 0.344 36.275 -3.808 1.00 39.89 O ATOM 1635 HA ASP B 32 -2.558 37.738 -5.758 1.00 0.00 H ATOM 1636 HB2 ASP B 32 -1.841 37.759 -3.235 1.00 0.00 H ATOM 1637 HB3 ASP B 32 -2.290 36.039 -3.296 1.00 0.00 H ATOM 1638 H ASP B 32 -4.009 38.257 -3.361 1.00 0.00 H ATOM 1639 N TRP B 33 -2.891 35.180 -6.287 1.00 35.92 N ATOM 1640 CA TRP B 33 -3.416 33.971 -6.948 1.00 36.40 C ATOM 1641 C TRP B 33 -2.256 33.194 -7.589 1.00 37.43 C ATOM 1642 O TRP B 33 -1.205 33.780 -7.884 1.00 37.01 O ATOM 1643 CB TRP B 33 -4.436 34.367 -8.026 1.00 35.19 C ATOM 1644 CG TRP B 33 -3.818 35.192 -9.152 1.00 32.61 C ATOM 1645 CD1 TRP B 33 -3.687 36.546 -9.183 1.00 30.68 C ATOM 1646 CD2 TRP B 33 -3.276 34.708 -10.414 1.00 31.39 C ATOM 1647 NE1 TRP B 33 -3.075 36.937 -10.357 1.00 28.60 N ATOM 1648 CE2 TRP B 33 -2.825 35.839 -11.134 1.00 27.92 C ATOM 1649 CE3 TRP B 33 -3.127 33.419 -11.002 1.00 30.84 C ATOM 1650 CZ2 TRP B 33 -2.261 35.742 -12.418 1.00 29.05 C ATOM 1651 CZ3 TRP B 33 -2.563 33.313 -12.273 1.00 29.96 C ATOM 1652 CH2 TRP B 33 -2.107 34.475 -12.961 1.00 31.79 C ATOM 1653 HA TRP B 33 -3.909 33.340 -6.208 1.00 0.00 H ATOM 1654 HB2 TRP B 33 -4.862 33.459 -8.453 1.00 0.00 H ATOM 1655 HB3 TRP B 33 -5.227 34.953 -7.558 1.00 0.00 H ATOM 1656 HE1 TRP B 33 -2.840 37.917 -10.612 1.00 0.00 H ATOM 1657 HD1 TRP B 33 -4.017 37.223 -8.395 1.00 0.00 H ATOM 1658 HZ2 TRP B 33 -1.955 36.632 -12.968 1.00 0.00 H ATOM 1659 HH2 TRP B 33 -1.627 34.366 -13.934 1.00 0.00 H ATOM 1660 HZ3 TRP B 33 -2.470 32.334 -12.744 1.00 0.00 H ATOM 1661 HE3 TRP B 33 -3.450 32.527 -10.465 1.00 0.00 H ATOM 1662 H TRP B 33 -1.920 35.488 -6.496 1.00 0.00 H ATOM 1663 N LYS B 34 -2.422 31.885 -7.781 1.00 38.50 N ATOM 1664 CA LYS B 34 -1.435 31.112 -8.565 1.00 40.23 C ATOM 1665 C LYS B 34 -2.150 30.010 -9.328 1.00 42.13 C ATOM 1666 O LYS B 34 -3.267 29.629 -8.942 1.00 42.02 O ATOM 1667 CB LYS B 34 -0.170 30.676 -7.763 1.00 39.16 C ATOM 1668 CG LYS B 34 -0.188 29.490 -6.775 1.00 40.82 C ATOM 1669 CD LYS B 34 1.221 29.382 -6.178 1.00 49.83 C ATOM 1670 CE LYS B 34 1.722 27.932 -5.857 1.00 56.63 C ATOM 1671 NZ LYS B 34 1.635 27.428 -4.362 1.00 60.75 N ATOM 1672 HA LYS B 34 -0.987 31.772 -9.307 1.00 0.00 H ATOM 1673 HB2 LYS B 34 0.594 30.443 -8.504 1.00 0.00 H ATOM 1674 HB3 LYS B 34 0.139 31.548 -7.186 1.00 0.00 H ATOM 1675 HG2 LYS B 34 -0.917 29.672 -5.985 1.00 0.00 H ATOM 1676 HG3 LYS B 34 -0.444 28.569 -7.299 1.00 0.00 H ATOM 1677 HD2 LYS B 34 1.919 29.827 -6.887 1.00 0.00 H ATOM 1678 HD3 LYS B 34 1.235 29.953 -5.250 1.00 0.00 H ATOM 1679 HE2 LYS B 34 2.769 27.877 -6.157 1.00 0.00 H ATOM 1680 HE3 LYS B 34 1.135 27.244 -6.465 1.00 0.00 H ATOM 1681 HZ1 LYS B 34 2.204 28.051 -3.754 1.00 0.00 H ATOM 1682 HZ2 LYS B 34 0.644 27.447 -4.048 1.00 0.00 H ATOM 1683 HZ3 LYS B 34 2.000 26.456 -4.303 1.00 0.00 H ATOM 1684 H LYS B 34 -3.251 31.405 -7.377 1.00 0.00 H ATOM 1685 N VAL B 35 -1.573 29.585 -10.461 1.00 44.35 N ATOM 1686 CA VAL B 35 -2.064 28.417 -11.206 1.00 47.58 C ATOM 1687 C VAL B 35 -1.460 27.119 -10.625 1.00 49.44 C ATOM 1688 O VAL B 35 -0.292 27.070 -10.350 1.00 50.24 O ATOM 1689 CB VAL B 35 -1.731 28.569 -12.681 1.00 47.22 C ATOM 1690 CG1 VAL B 35 -1.894 27.223 -13.421 1.00 50.32 C ATOM 1691 CG2 VAL B 35 -2.590 29.660 -13.287 1.00 47.07 C ATOM 1692 HA VAL B 35 -3.148 28.354 -11.105 1.00 0.00 H ATOM 1693 HB VAL B 35 -0.687 28.863 -12.788 1.00 0.00 H ATOM 1694 HG11 VAL B 35 -1.222 26.485 -12.982 1.00 0.00 H ATOM 1695 HG12 VAL B 35 -2.924 26.880 -13.326 1.00 0.00 H ATOM 1696 HG13 VAL B 35 -1.650 27.357 -14.475 1.00 0.00 H ATOM 1697 HG21 VAL B 35 -3.642 29.395 -13.178 1.00 0.00 H ATOM 1698 HG22 VAL B 35 -2.396 30.601 -12.773 1.00 0.00 H ATOM 1699 HG23 VAL B 35 -2.348 29.766 -14.345 1.00 0.00 H ATOM 1700 H VAL B 35 -0.747 30.101 -10.826 1.00 0.00 H ATOM 1701 N LYS B 36 -2.263 26.076 -10.452 1.00 53.16 N ATOM 1702 CA LYS B 36 -1.966 24.914 -9.541 1.00 56.30 C ATOM 1703 C LYS B 36 -2.328 23.644 -10.359 1.00 57.82 C ATOM 1704 O LYS B 36 -3.263 22.892 -9.981 1.00 58.39 O ATOM 1705 CB LYS B 36 -2.857 25.058 -8.234 1.00 56.67 C ATOM 1706 CG LYS B 36 -2.625 24.155 -6.989 1.00 57.62 C ATOM 1707 CD LYS B 36 -1.531 24.741 -6.054 1.00 60.81 C ATOM 1708 CE LYS B 36 -0.924 23.691 -5.105 1.00 61.92 C ATOM 1709 NZ LYS B 36 0.361 24.258 -4.575 1.00 63.49 N ATOM 1710 HA LYS B 36 -0.926 24.867 -9.217 1.00 0.00 H ATOM 1711 HB2 LYS B 36 -2.741 26.087 -7.894 1.00 0.00 H ATOM 1712 HB3 LYS B 36 -3.889 24.894 -8.545 1.00 0.00 H ATOM 1713 HG2 LYS B 36 -3.559 24.072 -6.433 1.00 0.00 H ATOM 1714 HG3 LYS B 36 -2.313 23.165 -7.323 1.00 0.00 H ATOM 1715 HD2 LYS B 36 -0.733 25.155 -6.670 1.00 0.00 H ATOM 1716 HD3 LYS B 36 -1.975 25.536 -5.455 1.00 0.00 H ATOM 1717 HE2 LYS B 36 -0.728 22.766 -5.648 1.00 0.00 H ATOM 1718 HE3 LYS B 36 -1.611 23.490 -4.283 1.00 0.00 H ATOM 1719 HZ1 LYS B 36 1.006 24.451 -5.367 1.00 0.00 H ATOM 1720 HZ2 LYS B 36 0.164 25.142 -4.064 1.00 0.00 H ATOM 1721 HZ3 LYS B 36 0.800 23.573 -3.928 1.00 0.00 H ATOM 1722 H LYS B 36 -3.158 26.060 -10.982 1.00 0.00 H ATOM 1723 N ASN B 37 -1.621 23.444 -11.485 1.00 58.90 N ATOM 1724 CA ASN B 37 -1.885 22.345 -12.434 1.00 60.17 C ATOM 1725 C ASN B 37 -3.201 22.572 -13.268 1.00 58.84 C ATOM 1726 O ASN B 37 -3.167 23.219 -14.334 1.00 59.23 O ATOM 1727 CB ASN B 37 -1.644 20.932 -11.757 1.00 61.70 C ATOM 1728 CG ASN B 37 -2.912 19.986 -11.789 1.00 69.57 C ATOM 1729 OD1 ASN B 37 -4.037 20.325 -11.253 1.00 76.18 O ATOM 1730 ND2 ASN B 37 -2.741 18.802 -12.419 1.00 70.96 N ATOM 1731 HA ASN B 37 -1.141 22.349 -13.230 1.00 0.00 H ATOM 1732 HB2 ASN B 37 -0.829 20.433 -12.282 1.00 0.00 H ATOM 1733 HB3 ASN B 37 -1.360 21.092 -10.717 1.00 0.00 H ATOM 1734 HD22 ASN B 37 -1.819 18.565 -12.839 1.00 0.00 H ATOM 1735 HD21 ASN B 37 -3.531 18.129 -12.484 1.00 0.00 H ATOM 1736 H ASN B 37 -0.844 24.101 -11.699 1.00 0.00 H ATOM 1737 N LYS B 38 -4.357 22.126 -12.774 1.00 56.62 N ATOM 1738 CA LYS B 38 -5.633 22.393 -13.456 1.00 54.87 C ATOM 1739 C LYS B 38 -6.576 23.347 -12.671 1.00 50.85 C ATOM 1740 O LYS B 38 -7.691 23.613 -13.128 1.00 49.30 O ATOM 1741 CB LYS B 38 -6.347 21.057 -13.827 1.00 56.70 C ATOM 1742 CG LYS B 38 -5.765 20.329 -15.118 1.00 62.57 C ATOM 1743 CD LYS B 38 -6.017 18.776 -15.150 1.00 71.54 C ATOM 1744 CE LYS B 38 -6.495 18.184 -13.741 1.00 76.17 C ATOM 1745 NZ LYS B 38 -6.178 16.706 -13.557 1.00 76.64 N ATOM 1746 HA LYS B 38 -5.385 22.926 -14.374 1.00 0.00 H ATOM 1747 HB2 LYS B 38 -6.254 20.376 -12.981 1.00 0.00 H ATOM 1748 HB3 LYS B 38 -7.401 21.272 -14.004 1.00 0.00 H ATOM 1749 HG2 LYS B 38 -6.231 20.770 -15.999 1.00 0.00 H ATOM 1750 HG3 LYS B 38 -4.689 20.502 -15.153 1.00 0.00 H ATOM 1751 HD2 LYS B 38 -6.786 18.565 -15.893 1.00 0.00 H ATOM 1752 HD3 LYS B 38 -5.090 18.280 -15.437 1.00 0.00 H ATOM 1753 HE2 LYS B 38 -7.574 18.317 -13.660 1.00 0.00 H ATOM 1754 HE3 LYS B 38 -6.000 18.743 -12.947 1.00 0.00 H ATOM 1755 HZ1 LYS B 38 -6.652 16.156 -14.301 1.00 0.00 H ATOM 1756 HZ2 LYS B 38 -5.150 16.563 -13.620 1.00 0.00 H ATOM 1757 HZ3 LYS B 38 -6.516 16.394 -12.624 1.00 0.00 H ATOM 1758 H LYS B 38 -4.356 21.579 -11.890 1.00 0.00 H ATOM 1759 N HIS B 39 -6.117 23.830 -11.506 1.00 46.71 N ATOM 1760 CA HIS B 39 -6.838 24.793 -10.641 1.00 43.68 C ATOM 1761 C HIS B 39 -6.200 26.160 -10.554 1.00 40.77 C ATOM 1762 O HIS B 39 -4.987 26.298 -10.647 1.00 39.97 O ATOM 1763 CB HIS B 39 -6.984 24.257 -9.230 1.00 43.35 C ATOM 1764 CG HIS B 39 -7.673 22.947 -9.208 1.00 48.46 C ATOM 1765 ND1 HIS B 39 -7.080 21.795 -9.710 1.00 52.54 N ATOM 1766 CD2 HIS B 39 -8.949 22.612 -8.880 1.00 48.36 C ATOM 1767 CE1 HIS B 39 -7.955 20.803 -9.656 1.00 50.62 C ATOM 1768 NE2 HIS B 39 -9.088 21.269 -9.146 1.00 50.53 N ATOM 1769 HA HIS B 39 -7.808 24.911 -11.124 1.00 0.00 H ATOM 1770 HB2 HIS B 39 -5.993 24.142 -8.792 1.00 0.00 H ATOM 1771 HB3 HIS B 39 -7.561 24.969 -8.640 1.00 0.00 H ATOM 1772 HD2 HIS B 39 -9.714 23.279 -8.483 1.00 0.00 H ATOM 1773 HE1 HIS B 39 -7.775 19.777 -9.976 1.00 0.00 H ATOM 1774 H HIS B 39 -5.183 23.503 -11.186 1.00 0.00 H ATOM 1775 N LEU B 40 -7.050 27.156 -10.355 1.00 37.98 N ATOM 1776 CA LEU B 40 -6.651 28.503 -10.000 1.00 35.38 C ATOM 1777 C LEU B 40 -6.900 28.634 -8.516 1.00 34.83 C ATOM 1778 O LEU B 40 -8.025 28.463 -8.022 1.00 34.17 O ATOM 1779 CB LEU B 40 -7.508 29.500 -10.786 1.00 34.95 C ATOM 1780 CG LEU B 40 -7.514 30.992 -10.415 1.00 33.37 C ATOM 1781 CD1 LEU B 40 -6.166 31.748 -10.723 1.00 24.91 C ATOM 1782 CD2 LEU B 40 -8.730 31.651 -11.109 1.00 32.04 C ATOM 1783 HA LEU B 40 -5.606 28.704 -10.235 1.00 0.00 H ATOM 1784 HB2 LEU B 40 -7.184 29.438 -11.825 1.00 0.00 H ATOM 1785 HB3 LEU B 40 -8.539 29.155 -10.707 1.00 0.00 H ATOM 1786 HG LEU B 40 -7.604 31.071 -9.332 1.00 0.00 H ATOM 1787 HD21 LEU B 40 -8.640 31.531 -12.189 1.00 0.00 H ATOM 1788 HD22 LEU B 40 -9.647 31.173 -10.764 1.00 0.00 H ATOM 1789 HD23 LEU B 40 -8.757 32.712 -10.861 1.00 0.00 H ATOM 1790 HD11 LEU B 40 -5.355 31.285 -10.162 1.00 0.00 H ATOM 1791 HD12 LEU B 40 -5.952 31.687 -11.790 1.00 0.00 H ATOM 1792 HD13 LEU B 40 -6.262 32.793 -10.429 1.00 0.00 H ATOM 1793 H LEU B 40 -8.066 26.959 -10.460 1.00 0.00 H ATOM 1794 N ARG B 41 -5.835 28.863 -7.774 1.00 34.38 N ATOM 1795 CA ARG B 41 -5.939 29.133 -6.344 1.00 33.57 C ATOM 1796 C ARG B 41 -6.048 30.666 -6.219 1.00 33.63 C ATOM 1797 O ARG B 41 -5.069 31.354 -6.554 1.00 33.49 O ATOM 1798 CB ARG B 41 -4.649 28.665 -5.700 1.00 33.09 C ATOM 1799 CG ARG B 41 -4.394 29.083 -4.223 1.00 36.66 C ATOM 1800 CD ARG B 41 -3.464 28.098 -3.556 1.00 35.54 C ATOM 1801 NE ARG B 41 -4.142 26.799 -3.515 1.00 40.58 N ATOM 1802 CZ ARG B 41 -3.623 25.685 -2.997 1.00 40.75 C ATOM 1803 NH1 ARG B 41 -2.405 25.711 -2.490 1.00 39.64 N ATOM 1804 NH2 ARG B 41 -4.297 24.548 -2.998 1.00 34.06 N ATOM 1805 HA ARG B 41 -6.786 28.635 -5.872 1.00 0.00 H ATOM 1806 HB2 ARG B 41 -4.641 27.576 -5.738 1.00 0.00 H ATOM 1807 HB3 ARG B 41 -3.825 29.055 -6.297 1.00 0.00 H ATOM 1808 HG2 ARG B 41 -3.943 30.075 -4.202 1.00 0.00 H ATOM 1809 HG3 ARG B 41 -5.342 29.104 -3.686 1.00 0.00 H ATOM 1810 HD2 ARG B 41 -3.236 28.430 -2.543 1.00 0.00 H ATOM 1811 HD3 ARG B 41 -2.539 28.016 -4.127 1.00 0.00 H ATOM 1812 HE ARG B 41 -5.098 26.742 -3.920 1.00 0.00 H ATOM 1813 HH12 ARG B 41 -1.992 24.847 -2.084 1.00 0.00 H ATOM 1814 HH11 ARG B 41 -1.858 26.595 -2.496 1.00 0.00 H ATOM 1815 HH22 ARG B 41 -3.872 23.691 -2.588 1.00 0.00 H ATOM 1816 HH21 ARG B 41 -5.252 24.510 -3.408 1.00 0.00 H ATOM 1817 H ARG B 41 -4.895 28.851 -8.220 1.00 0.00 H ATOM 1818 N ILE B 42 -7.216 31.214 -5.797 1.00 33.55 N ATOM 1819 CA ILE B 42 -7.307 32.664 -5.430 1.00 33.04 C ATOM 1820 C ILE B 42 -7.014 32.826 -3.920 1.00 32.99 C ATOM 1821 O ILE B 42 -7.794 32.321 -3.104 1.00 32.77 O ATOM 1822 CB ILE B 42 -8.694 33.289 -5.787 1.00 32.85 C ATOM 1823 CG1 ILE B 42 -8.922 33.285 -7.302 1.00 33.11 C ATOM 1824 CG2 ILE B 42 -8.780 34.720 -5.306 1.00 30.41 C ATOM 1825 CD1 ILE B 42 -10.429 33.154 -7.689 1.00 30.45 C ATOM 1826 HA ILE B 42 -6.564 33.204 -6.017 1.00 0.00 H ATOM 1827 HB ILE B 42 -9.454 32.683 -5.294 1.00 0.00 H ATOM 1828 HG12 ILE B 42 -8.536 34.217 -7.715 1.00 0.00 H ATOM 1829 HG13 ILE B 42 -8.377 32.445 -7.734 1.00 0.00 H ATOM 1830 HD11 ILE B 42 -10.825 32.220 -7.290 1.00 0.00 H ATOM 1831 HD12 ILE B 42 -10.984 33.994 -7.271 1.00 0.00 H ATOM 1832 HD13 ILE B 42 -10.526 33.157 -8.775 1.00 0.00 H ATOM 1833 HG21 ILE B 42 -8.651 34.747 -4.224 1.00 0.00 H ATOM 1834 HG22 ILE B 42 -7.996 35.310 -5.782 1.00 0.00 H ATOM 1835 HG23 ILE B 42 -9.755 35.132 -5.567 1.00 0.00 H ATOM 1836 H ILE B 42 -8.064 30.616 -5.727 1.00 0.00 H ATOM 1837 N PHE B 43 -5.907 33.502 -3.520 1.00 32.88 N ATOM 1838 CA PHE B 43 -5.611 33.703 -2.059 1.00 30.76 C ATOM 1839 C PHE B 43 -6.505 34.756 -1.452 1.00 31.15 C ATOM 1840 O PHE B 43 -7.079 35.561 -2.173 1.00 32.09 O ATOM 1841 CB PHE B 43 -4.172 34.066 -1.838 1.00 30.81 C ATOM 1842 CG PHE B 43 -3.200 32.960 -2.216 1.00 27.45 C ATOM 1843 CD1 PHE B 43 -2.926 31.903 -1.331 1.00 27.43 C ATOM 1844 CD2 PHE B 43 -2.510 33.009 -3.398 1.00 24.86 C ATOM 1845 CE1 PHE B 43 -1.986 30.868 -1.639 1.00 25.55 C ATOM 1846 CE2 PHE B 43 -1.580 31.925 -3.748 1.00 24.64 C ATOM 1847 CZ PHE B 43 -1.339 30.876 -2.850 1.00 22.34 C ATOM 1848 HA PHE B 43 -5.811 32.754 -1.562 1.00 0.00 H ATOM 1849 HB2 PHE B 43 -3.942 34.947 -2.438 1.00 0.00 H ATOM 1850 HB3 PHE B 43 -4.034 34.301 -0.783 1.00 0.00 H ATOM 1851 HD2 PHE B 43 -2.650 33.850 -4.078 1.00 0.00 H ATOM 1852 HE2 PHE B 43 -1.074 31.937 -4.713 1.00 0.00 H ATOM 1853 HZ PHE B 43 -0.646 30.076 -3.110 1.00 0.00 H ATOM 1854 HE1 PHE B 43 -1.785 30.078 -0.916 1.00 0.00 H ATOM 1855 HD1 PHE B 43 -3.448 31.870 -0.375 1.00 0.00 H ATOM 1856 H PHE B 43 -5.255 33.886 -4.233 1.00 0.00 H ATOM 1857 N ASN B 44 -6.656 34.780 -0.143 1.00 31.19 N ATOM 1858 CA ASN B 44 -7.588 35.736 0.425 1.00 32.03 C ATOM 1859 C ASN B 44 -7.172 37.218 0.373 1.00 32.89 C ATOM 1860 O ASN B 44 -8.048 38.135 0.363 1.00 33.54 O ATOM 1861 CB ASN B 44 -7.955 35.306 1.843 1.00 31.73 C ATOM 1862 CG ASN B 44 -8.720 33.982 1.871 1.00 34.86 C ATOM 1863 OD1 ASN B 44 -9.279 33.503 0.848 1.00 35.89 O ATOM 1864 ND2 ASN B 44 -8.751 33.381 3.032 1.00 34.37 N ATOM 1865 HA ASN B 44 -8.460 35.708 -0.228 1.00 0.00 H ATOM 1866 HB2 ASN B 44 -7.039 35.194 2.423 1.00 0.00 H ATOM 1867 HB3 ASN B 44 -8.577 36.079 2.294 1.00 0.00 H ATOM 1868 HD22 ASN B 44 -8.277 33.810 3.852 1.00 0.00 H ATOM 1869 HD21 ASN B 44 -9.250 32.474 3.135 1.00 0.00 H ATOM 1870 H ASN B 44 -6.121 34.130 0.467 1.00 0.00 H ATOM 1871 N MET B 45 -5.845 37.432 0.334 1.00 32.71 N ATOM 1872 CA MET B 45 -5.269 38.740 0.368 1.00 33.30 C ATOM 1873 C MET B 45 -4.343 39.038 -0.800 1.00 34.27 C ATOM 1874 O MET B 45 -3.781 38.105 -1.423 1.00 35.11 O ATOM 1875 CB MET B 45 -4.486 38.903 1.649 1.00 32.87 C ATOM 1876 CG MET B 45 -5.367 38.918 2.868 1.00 34.14 C ATOM 1877 SD MET B 45 -4.373 39.240 4.389 1.00 35.56 S ATOM 1878 CE MET B 45 -3.453 37.693 4.649 1.00 30.44 C ATOM 1879 HA MET B 45 -6.101 39.441 0.304 1.00 0.00 H ATOM 1880 HB2 MET B 45 -3.783 38.075 1.736 1.00 0.00 H ATOM 1881 HB3 MET B 45 -3.935 39.842 1.605 1.00 0.00 H ATOM 1882 HG2 MET B 45 -5.863 37.952 2.963 1.00 0.00 H ATOM 1883 HG3 MET B 45 -6.117 39.701 2.758 1.00 0.00 H ATOM 1884 HE1 MET B 45 -4.157 36.872 4.784 1.00 0.00 H ATOM 1885 HE2 MET B 45 -2.824 37.495 3.781 1.00 0.00 H ATOM 1886 HE3 MET B 45 -2.829 37.788 5.537 1.00 0.00 H ATOM 1887 H MET B 45 -5.210 36.610 0.277 1.00 0.00 H ATOM 1888 N CYS B 46 -4.158 40.334 -1.086 1.00 33.68 N ATOM 1889 CA CYS B 46 -3.122 40.737 -2.055 1.00 35.16 C ATOM 1890 C CYS B 46 -1.726 40.385 -1.447 1.00 35.67 C ATOM 1891 O CYS B 46 -1.620 40.007 -0.240 1.00 34.73 O ATOM 1892 CB CYS B 46 -3.258 42.245 -2.428 1.00 35.07 C ATOM 1893 SG CYS B 46 -2.949 43.298 -1.043 1.00 35.33 S ATOM 1894 HA CYS B 46 -3.242 40.193 -2.992 1.00 0.00 H ATOM 1895 HB2 CYS B 46 -4.269 42.428 -2.792 1.00 0.00 H ATOM 1896 HB3 CYS B 46 -2.542 42.479 -3.216 1.00 0.00 H ATOM 1897 HG CYS B 46 -3.083 44.616 -1.430 1.00 0.00 H ATOM 1898 H CYS B 46 -4.746 41.057 -0.624 1.00 0.00 H ATOM 1899 N LYS B 47 -0.651 40.476 -2.232 1.00 36.18 N ATOM 1900 CA LYS B 47 0.630 40.087 -1.630 1.00 37.11 C ATOM 1901 C LYS B 47 1.084 41.053 -0.484 1.00 37.00 C ATOM 1902 O LYS B 47 1.663 40.586 0.533 1.00 37.33 O ATOM 1903 CB LYS B 47 1.742 39.825 -2.667 1.00 37.91 C ATOM 1904 CG LYS B 47 3.087 39.606 -1.987 1.00 42.14 C ATOM 1905 CD LYS B 47 4.041 38.769 -2.765 1.00 53.00 C ATOM 1906 CE LYS B 47 3.384 37.389 -3.058 1.00 57.51 C ATOM 1907 NZ LYS B 47 3.151 36.555 -1.840 1.00 57.94 N ATOM 1908 HA LYS B 47 0.443 39.123 -1.156 1.00 0.00 H ATOM 1909 HB2 LYS B 47 1.487 38.937 -3.246 1.00 0.00 H ATOM 1910 HB3 LYS B 47 1.816 40.684 -3.334 1.00 0.00 H ATOM 1911 HG2 LYS B 47 3.547 40.580 -1.819 1.00 0.00 H ATOM 1912 HG3 LYS B 47 2.909 39.119 -1.028 1.00 0.00 H ATOM 1913 HD2 LYS B 47 4.281 39.266 -3.705 1.00 0.00 H ATOM 1914 HD3 LYS B 47 4.954 38.624 -2.188 1.00 0.00 H ATOM 1915 HE2 LYS B 47 4.036 36.835 -3.733 1.00 0.00 H ATOM 1916 HE3 LYS B 47 2.424 37.563 -3.544 1.00 0.00 H ATOM 1917 HZ1 LYS B 47 4.060 36.369 -1.370 1.00 0.00 H ATOM 1918 HZ2 LYS B 47 2.520 37.064 -1.189 1.00 0.00 H ATOM 1919 HZ3 LYS B 47 2.712 35.654 -2.117 1.00 0.00 H ATOM 1920 H LYS B 47 -0.717 40.805 -3.217 1.00 0.00 H ATOM 1921 N THR B 48 0.792 42.350 -0.624 1.00 35.77 N ATOM 1922 CA THR B 48 1.211 43.325 0.326 1.00 36.55 C ATOM 1923 C THR B 48 0.557 43.105 1.674 1.00 36.94 C ATOM 1924 O THR B 48 1.240 43.089 2.707 1.00 37.88 O ATOM 1925 CB THR B 48 0.873 44.743 -0.168 1.00 37.68 C ATOM 1926 OG1 THR B 48 1.577 45.001 -1.387 1.00 41.03 O ATOM 1927 CG2 THR B 48 1.333 45.795 0.836 1.00 36.17 C ATOM 1928 HA THR B 48 2.290 43.221 0.438 1.00 0.00 H ATOM 1929 HB THR B 48 -0.207 44.798 -0.304 1.00 0.00 H ATOM 1930 HG1 THR B 48 1.360 45.913 -1.705 1.00 0.00 H ATOM 1931 HG23 THR B 48 0.821 45.638 1.785 1.00 0.00 H ATOM 1932 HG21 THR B 48 2.409 45.708 0.984 1.00 0.00 H ATOM 1933 HG22 THR B 48 1.096 46.788 0.454 1.00 0.00 H ATOM 1934 H THR B 48 0.242 42.656 -1.452 1.00 0.00 H ATOM 1935 N CYS B 49 -0.767 42.951 1.700 1.00 37.39 N ATOM 1936 CA CYS B 49 -1.431 42.659 2.971 1.00 37.24 C ATOM 1937 C CYS B 49 -0.996 41.328 3.557 1.00 37.01 C ATOM 1938 O CYS B 49 -0.891 41.210 4.775 1.00 37.19 O ATOM 1939 CB CYS B 49 -2.926 42.638 2.817 1.00 37.34 C ATOM 1940 SG CYS B 49 -3.601 44.280 2.550 1.00 39.47 S ATOM 1941 HA CYS B 49 -1.136 43.460 3.649 1.00 0.00 H ATOM 1942 HB2 CYS B 49 -3.367 42.219 3.722 1.00 0.00 H ATOM 1943 HB3 CYS B 49 -3.183 42.009 1.965 1.00 0.00 H ATOM 1944 HG CYS B 49 -4.972 44.196 2.417 1.00 0.00 H ATOM 1945 H CYS B 49 -1.323 43.038 0.825 1.00 0.00 H ATOM 1946 N PHE B 50 -0.762 40.318 2.712 1.00 36.90 N ATOM 1947 CA PHE B 50 -0.287 39.032 3.224 1.00 36.75 C ATOM 1948 C PHE B 50 1.092 39.175 3.930 1.00 36.80 C ATOM 1949 O PHE B 50 1.259 38.779 5.117 1.00 35.96 O ATOM 1950 CB PHE B 50 -0.240 37.968 2.125 1.00 37.25 C ATOM 1951 CG PHE B 50 0.278 36.653 2.603 1.00 39.16 C ATOM 1952 CD1 PHE B 50 -0.505 35.843 3.468 1.00 40.69 C ATOM 1953 CD2 PHE B 50 1.564 36.213 2.228 1.00 39.94 C ATOM 1954 CE1 PHE B 50 -0.029 34.596 3.954 1.00 40.20 C ATOM 1955 CE2 PHE B 50 2.058 34.947 2.701 1.00 40.01 C ATOM 1956 CZ PHE B 50 1.248 34.146 3.587 1.00 40.58 C ATOM 1957 HA PHE B 50 -1.007 38.697 3.971 1.00 0.00 H ATOM 1958 HB2 PHE B 50 -1.249 37.824 1.739 1.00 0.00 H ATOM 1959 HB3 PHE B 50 0.407 38.325 1.324 1.00 0.00 H ATOM 1960 HD2 PHE B 50 2.184 36.832 1.580 1.00 0.00 H ATOM 1961 HE2 PHE B 50 3.041 34.594 2.391 1.00 0.00 H ATOM 1962 HZ PHE B 50 1.626 33.198 3.969 1.00 0.00 H ATOM 1963 HE1 PHE B 50 -0.654 33.991 4.610 1.00 0.00 H ATOM 1964 HD1 PHE B 50 -1.495 36.187 3.766 1.00 0.00 H ATOM 1965 H PHE B 50 -0.918 40.446 1.692 1.00 0.00 H ATOM 1966 N ASN B 51 2.075 39.757 3.228 1.00 36.49 N ATOM 1967 CA ASN B 51 3.374 39.964 3.882 1.00 37.82 C ATOM 1968 C ASN B 51 3.222 40.701 5.187 1.00 38.01 C ATOM 1969 O ASN B 51 3.790 40.270 6.234 1.00 38.60 O ATOM 1970 CB ASN B 51 4.349 40.659 2.971 1.00 37.86 C ATOM 1971 CG ASN B 51 4.723 39.770 1.779 1.00 40.16 C ATOM 1972 OD1 ASN B 51 4.665 38.535 1.879 1.00 40.10 O ATOM 1973 ND2 ASN B 51 5.041 40.390 0.630 1.00 41.68 N ATOM 1974 HA ASN B 51 3.784 38.979 4.106 1.00 0.00 H ATOM 1975 HB2 ASN B 51 3.897 41.579 2.601 1.00 0.00 H ATOM 1976 HB3 ASN B 51 5.252 40.900 3.533 1.00 0.00 H ATOM 1977 HD22 ASN B 51 5.078 41.429 0.592 1.00 0.00 H ATOM 1978 HD21 ASN B 51 5.251 39.831 -0.222 1.00 0.00 H ATOM 1979 H ASN B 51 1.921 40.055 2.243 1.00 0.00 H ATOM 1980 N ASN B 52 2.382 41.741 5.147 1.00 36.49 N ATOM 1981 CA ASN B 52 2.112 42.513 6.317 1.00 35.31 C ATOM 1982 C ASN B 52 1.533 41.676 7.466 1.00 34.66 C ATOM 1983 O ASN B 52 1.994 41.761 8.609 1.00 33.38 O ATOM 1984 CB ASN B 52 1.235 43.684 5.918 1.00 36.13 C ATOM 1985 CG ASN B 52 0.802 44.521 7.112 1.00 37.43 C ATOM 1986 OD1 ASN B 52 1.626 45.241 7.792 1.00 34.25 O ATOM 1987 ND2 ASN B 52 -0.497 44.444 7.388 1.00 32.02 N ATOM 1988 HA ASN B 52 3.047 42.896 6.725 1.00 0.00 H ATOM 1989 HB2 ASN B 52 1.792 44.319 5.229 1.00 0.00 H ATOM 1990 HB3 ASN B 52 0.345 43.301 5.419 1.00 0.00 H ATOM 1991 HD22 ASN B 52 -1.118 43.847 6.806 1.00 0.00 H ATOM 1992 HD21 ASN B 52 -0.892 44.981 8.186 1.00 0.00 H ATOM 1993 H ASN B 52 1.919 41.991 4.250 1.00 0.00 H ATOM 1994 N SER B 53 0.571 40.821 7.172 1.00 35.09 N ATOM 1995 CA SER B 53 -0.029 39.991 8.217 1.00 36.40 C ATOM 1996 C SER B 53 1.016 39.148 8.968 1.00 38.14 C ATOM 1997 O SER B 53 0.925 38.970 10.203 1.00 39.48 O ATOM 1998 CB SER B 53 -1.161 39.102 7.641 1.00 37.22 C ATOM 1999 OG SER B 53 -0.693 37.950 6.921 1.00 36.38 O ATOM 2000 HA SER B 53 -0.469 40.669 8.948 1.00 0.00 H ATOM 2001 HB2 SER B 53 -1.762 39.709 6.964 1.00 0.00 H ATOM 2002 HB3 SER B 53 -1.783 38.760 8.468 1.00 0.00 H ATOM 2003 HG SER B 53 -0.135 38.244 6.158 1.00 0.00 H ATOM 2004 H SER B 53 0.237 40.737 6.191 1.00 0.00 H ATOM 2005 N ILE B 54 2.014 38.634 8.253 1.00 38.23 N ATOM 2006 CA ILE B 54 3.079 37.899 8.891 1.00 39.22 C ATOM 2007 C ILE B 54 3.826 38.803 9.887 1.00 39.47 C ATOM 2008 O ILE B 54 4.031 38.446 11.067 1.00 39.51 O ATOM 2009 CB ILE B 54 4.111 37.337 7.821 1.00 41.10 C ATOM 2010 CG1 ILE B 54 3.426 36.394 6.796 1.00 42.11 C ATOM 2011 CG2 ILE B 54 5.292 36.576 8.523 1.00 39.15 C ATOM 2012 CD1 ILE B 54 2.810 35.167 7.491 1.00 45.01 C ATOM 2013 HA ILE B 54 2.630 37.058 9.420 1.00 0.00 H ATOM 2014 HB ILE B 54 4.506 38.199 7.284 1.00 0.00 H ATOM 2015 HG12 ILE B 54 2.638 36.943 6.279 1.00 0.00 H ATOM 2016 HG13 ILE B 54 4.168 36.057 6.072 1.00 0.00 H ATOM 2017 HD11 ILE B 54 3.594 34.611 8.005 1.00 0.00 H ATOM 2018 HD12 ILE B 54 2.063 35.497 8.213 1.00 0.00 H ATOM 2019 HD13 ILE B 54 2.338 34.527 6.745 1.00 0.00 H ATOM 2020 HG21 ILE B 54 5.817 37.259 9.190 1.00 0.00 H ATOM 2021 HG22 ILE B 54 4.893 35.740 9.097 1.00 0.00 H ATOM 2022 HG23 ILE B 54 5.982 36.203 7.767 1.00 0.00 H ATOM 2023 H ILE B 54 2.026 38.764 7.221 1.00 0.00 H ATOM 2024 N ASP B 55 4.259 39.963 9.405 1.00 38.81 N ATOM 2025 CA ASP B 55 4.903 40.948 10.269 1.00 38.69 C ATOM 2026 C ASP B 55 4.064 41.368 11.496 1.00 38.95 C ATOM 2027 O ASP B 55 4.614 41.589 12.582 1.00 39.35 O ATOM 2028 CB ASP B 55 5.197 42.176 9.479 1.00 38.98 C ATOM 2029 CG ASP B 55 6.191 41.925 8.367 1.00 41.38 C ATOM 2030 OD1 ASP B 55 6.907 40.894 8.440 1.00 41.99 O ATOM 2031 OD2 ASP B 55 6.279 42.789 7.441 1.00 46.88 O ATOM 2032 HA ASP B 55 5.805 40.465 10.645 1.00 0.00 H ATOM 2033 HB2 ASP B 55 4.268 42.542 9.042 1.00 0.00 H ATOM 2034 HB3 ASP B 55 5.605 42.933 10.148 1.00 0.00 H ATOM 2035 H ASP B 55 4.137 40.173 8.394 1.00 0.00 H ATOM 2036 N ILE B 56 2.740 41.462 11.369 1.00 38.09 N ATOM 2037 CA ILE B 56 2.002 41.910 12.521 1.00 37.55 C ATOM 2038 C ILE B 56 1.582 40.747 13.427 1.00 37.32 C ATOM 2039 O ILE B 56 1.061 40.959 14.524 1.00 37.38 O ATOM 2040 CB ILE B 56 0.861 42.891 12.124 1.00 38.44 C ATOM 2041 CG1 ILE B 56 -0.331 42.154 11.518 1.00 40.03 C ATOM 2042 CG2 ILE B 56 1.378 43.961 11.164 1.00 35.13 C ATOM 2043 CD1 ILE B 56 -1.316 43.133 10.959 1.00 44.01 C ATOM 2044 HA ILE B 56 2.669 42.503 13.147 1.00 0.00 H ATOM 2045 HB ILE B 56 0.517 43.379 13.036 1.00 0.00 H ATOM 2046 HG12 ILE B 56 0.018 41.499 10.720 1.00 0.00 H ATOM 2047 HG13 ILE B 56 -0.816 41.557 12.290 1.00 0.00 H ATOM 2048 HD11 ILE B 56 -1.669 43.787 11.756 1.00 0.00 H ATOM 2049 HD12 ILE B 56 -0.834 43.729 10.185 1.00 0.00 H ATOM 2050 HD13 ILE B 56 -2.160 42.593 10.531 1.00 0.00 H ATOM 2051 HG21 ILE B 56 2.176 44.525 11.646 1.00 0.00 H ATOM 2052 HG22 ILE B 56 1.762 43.484 10.263 1.00 0.00 H ATOM 2053 HG23 ILE B 56 0.563 44.635 10.900 1.00 0.00 H ATOM 2054 H ILE B 56 2.262 41.222 10.477 1.00 0.00 H ATOM 2055 N GLY B 57 1.786 39.521 12.946 1.00 37.34 N ATOM 2056 CA GLY B 57 1.447 38.320 13.711 1.00 35.94 C ATOM 2057 C GLY B 57 0.015 37.908 13.620 1.00 36.73 C ATOM 2058 O GLY B 57 -0.523 37.325 14.590 1.00 37.80 O ATOM 2059 HA3 GLY B 57 1.681 38.507 14.759 1.00 0.00 H ATOM 2060 HA2 GLY B 57 2.061 37.498 13.344 1.00 0.00 H ATOM 2061 H GLY B 57 2.199 39.414 11.997 1.00 0.00 H ATOM 2062 N ASP B 58 -0.643 38.222 12.495 1.00 36.74 N ATOM 2063 CA ASP B 58 -2.088 37.912 12.367 1.00 38.23 C ATOM 2064 C ASP B 58 -2.359 36.919 11.259 1.00 38.96 C ATOM 2065 O ASP B 58 -2.126 37.199 10.062 1.00 40.66 O ATOM 2066 CB ASP B 58 -2.950 39.186 12.120 1.00 38.56 C ATOM 2067 CG ASP B 58 -4.486 38.919 12.278 1.00 40.50 C ATOM 2068 OD1 ASP B 58 -4.861 37.810 12.733 1.00 44.14 O ATOM 2069 OD2 ASP B 58 -5.344 39.807 11.979 1.00 41.18 O ATOM 2070 HA ASP B 58 -2.375 37.473 13.322 1.00 0.00 H ATOM 2071 HB2 ASP B 58 -2.654 39.952 12.837 1.00 0.00 H ATOM 2072 HB3 ASP B 58 -2.761 39.544 11.108 1.00 0.00 H ATOM 2073 H ASP B 58 -0.140 38.684 11.711 1.00 0.00 H ATOM 2074 N ASP B 59 -2.888 35.781 11.628 1.00 39.15 N ATOM 2075 CA ASP B 59 -3.111 34.770 10.641 1.00 42.10 C ATOM 2076 C ASP B 59 -4.622 34.624 10.293 1.00 41.25 C ATOM 2077 O ASP B 59 -5.059 33.703 9.595 1.00 42.04 O ATOM 2078 CB ASP B 59 -2.425 33.446 11.103 1.00 43.59 C ATOM 2079 CG ASP B 59 -3.257 32.682 12.164 1.00 50.26 C ATOM 2080 OD1 ASP B 59 -4.298 33.225 12.690 1.00 54.65 O ATOM 2081 OD2 ASP B 59 -2.892 31.511 12.449 1.00 55.13 O ATOM 2082 HA ASP B 59 -2.648 35.061 9.698 1.00 0.00 H ATOM 2083 HB2 ASP B 59 -2.290 32.801 10.235 1.00 0.00 H ATOM 2084 HB3 ASP B 59 -1.452 33.687 11.530 1.00 0.00 H ATOM 2085 H ASP B 59 -3.142 35.614 12.623 1.00 0.00 H ATOM 2086 N THR B 60 -5.418 35.570 10.747 1.00 41.34 N ATOM 2087 CA THR B 60 -6.892 35.521 10.595 1.00 39.91 C ATOM 2088 C THR B 60 -7.315 35.398 9.162 1.00 40.61 C ATOM 2089 O THR B 60 -8.314 34.738 8.918 1.00 40.73 O ATOM 2090 CB THR B 60 -7.558 36.844 11.090 1.00 39.96 C ATOM 2091 OG1 THR B 60 -7.271 37.020 12.458 1.00 36.87 O ATOM 2092 CG2 THR B 60 -9.090 36.852 10.914 1.00 38.48 C ATOM 2093 HA THR B 60 -7.202 34.654 11.178 1.00 0.00 H ATOM 2094 HB THR B 60 -7.149 37.651 10.482 1.00 0.00 H ATOM 2095 HG1 THR B 60 -6.290 37.072 12.584 1.00 0.00 H ATOM 2096 HG23 THR B 60 -9.334 36.717 9.860 1.00 0.00 H ATOM 2097 HG21 THR B 60 -9.526 36.040 11.496 1.00 0.00 H ATOM 2098 HG22 THR B 60 -9.489 37.805 11.262 1.00 0.00 H ATOM 2099 H THR B 60 -4.995 36.386 11.233 1.00 0.00 H ATOM 2100 N TYR B 61 -6.625 36.087 8.226 1.00 39.65 N ATOM 2101 CA TYR B 61 -7.103 36.145 6.837 1.00 38.61 C ATOM 2102 C TYR B 61 -6.390 35.184 5.880 1.00 38.63 C ATOM 2103 O TYR B 61 -6.622 35.242 4.671 1.00 39.08 O ATOM 2104 CB TYR B 61 -7.090 37.589 6.309 1.00 38.50 C ATOM 2105 CG TYR B 61 -8.001 38.503 7.129 1.00 39.44 C ATOM 2106 CD1 TYR B 61 -9.401 38.406 7.037 1.00 40.25 C ATOM 2107 CD2 TYR B 61 -7.461 39.401 8.056 1.00 42.32 C ATOM 2108 CE1 TYR B 61 -10.231 39.215 7.816 1.00 41.31 C ATOM 2109 CE2 TYR B 61 -8.271 40.243 8.842 1.00 43.34 C ATOM 2110 CZ TYR B 61 -9.651 40.140 8.718 1.00 45.86 C ATOM 2111 OH TYR B 61 -10.438 40.961 9.504 1.00 51.05 O ATOM 2112 HA TYR B 61 -8.134 35.793 6.867 1.00 0.00 H ATOM 2113 HB3 TYR B 61 -7.430 37.589 5.273 1.00 0.00 H ATOM 2114 HB2 TYR B 61 -6.071 37.973 6.356 1.00 0.00 H ATOM 2115 HD2 TYR B 61 -6.378 39.450 8.174 1.00 0.00 H ATOM 2116 HE2 TYR B 61 -7.825 40.959 9.532 1.00 0.00 H ATOM 2117 HE1 TYR B 61 -11.315 39.135 7.731 1.00 0.00 H ATOM 2118 HD1 TYR B 61 -9.845 37.688 6.347 1.00 0.00 H ATOM 2119 HH TYR B 61 -10.231 41.908 9.300 1.00 0.00 H ATOM 2120 H TYR B 61 -5.749 36.580 8.491 1.00 0.00 H ATOM 2121 N HIS B 62 -5.525 34.336 6.437 1.00 36.92 N ATOM 2122 CA HIS B 62 -4.722 33.385 5.697 1.00 37.31 C ATOM 2123 C HIS B 62 -5.599 32.344 5.079 1.00 36.53 C ATOM 2124 O HIS B 62 -6.420 31.787 5.761 1.00 36.48 O ATOM 2125 CB HIS B 62 -3.678 32.720 6.631 1.00 36.32 C ATOM 2126 CG HIS B 62 -2.561 33.648 6.988 1.00 38.73 C ATOM 2127 ND1 HIS B 62 -1.408 33.238 7.619 1.00 39.03 N ATOM 2128 CD2 HIS B 62 -2.422 34.985 6.766 1.00 38.74 C ATOM 2129 CE1 HIS B 62 -0.616 34.284 7.800 1.00 39.67 C ATOM 2130 NE2 HIS B 62 -1.207 35.353 7.285 1.00 40.48 N ATOM 2131 HA HIS B 62 -4.193 33.915 4.905 1.00 0.00 H ATOM 2132 HB2 HIS B 62 -4.178 32.404 7.547 1.00 0.00 H ATOM 2133 HB3 HIS B 62 -3.262 31.848 6.127 1.00 0.00 H ATOM 2134 HD2 HIS B 62 -3.140 35.638 6.270 1.00 0.00 H ATOM 2135 HE1 HIS B 62 0.358 34.268 8.290 1.00 0.00 H ATOM 2136 H HIS B 62 -5.420 34.359 7.471 1.00 0.00 H ATOM 2137 N GLY B 63 -5.418 32.068 3.789 1.00 36.54 N ATOM 2138 CA GLY B 63 -6.193 30.999 3.142 1.00 34.89 C ATOM 2139 C GLY B 63 -6.370 31.262 1.671 1.00 35.41 C ATOM 2140 O GLY B 63 -5.827 32.266 1.103 1.00 33.90 O ATOM 2141 HA3 GLY B 63 -7.174 30.938 3.612 1.00 0.00 H ATOM 2142 HA2 GLY B 63 -5.669 30.052 3.273 1.00 0.00 H ATOM 2143 H GLY B 63 -4.725 32.611 3.236 1.00 0.00 H ATOM 2144 N HIS B 64 -7.162 30.379 1.059 1.00 34.65 N ATOM 2145 CA HIS B 64 -7.361 30.416 -0.374 1.00 34.96 C ATOM 2146 C HIS B 64 -8.602 29.638 -0.717 1.00 34.86 C ATOM 2147 O HIS B 64 -9.188 28.954 0.130 1.00 35.44 O ATOM 2148 CB HIS B 64 -6.176 29.803 -1.085 1.00 33.90 C ATOM 2149 CG HIS B 64 -5.931 28.387 -0.681 1.00 37.49 C ATOM 2150 ND1 HIS B 64 -5.176 28.047 0.422 1.00 40.46 N ATOM 2151 CD2 HIS B 64 -6.348 27.212 -1.227 1.00 40.68 C ATOM 2152 CE1 HIS B 64 -5.112 26.728 0.523 1.00 39.66 C ATOM 2153 NE2 HIS B 64 -5.805 26.198 -0.474 1.00 41.22 N ATOM 2154 HA HIS B 64 -7.466 31.453 -0.693 1.00 0.00 H ATOM 2155 HB2 HIS B 64 -6.360 29.833 -2.159 1.00 0.00 H ATOM 2156 HB3 HIS B 64 -5.288 30.391 -0.853 1.00 0.00 H ATOM 2157 HD2 HIS B 64 -6.992 27.097 -2.099 1.00 0.00 H ATOM 2158 HE1 HIS B 64 -4.580 26.173 1.295 1.00 0.00 H ATOM 2159 H HIS B 64 -7.645 29.651 1.623 1.00 0.00 H ATOM 2160 N VAL B 65 -9.013 29.778 -1.976 1.00 34.35 N ATOM 2161 CA VAL B 65 -10.100 29.011 -2.539 1.00 33.84 C ATOM 2162 C VAL B 65 -9.588 28.574 -3.931 1.00 34.61 C ATOM 2163 O VAL B 65 -9.093 29.433 -4.709 1.00 36.16 O ATOM 2164 CB VAL B 65 -11.411 29.886 -2.661 1.00 33.89 C ATOM 2165 CG1 VAL B 65 -12.520 29.086 -3.284 1.00 31.24 C ATOM 2166 CG2 VAL B 65 -11.870 30.424 -1.271 1.00 32.48 C ATOM 2167 HA VAL B 65 -10.370 28.159 -1.915 1.00 0.00 H ATOM 2168 HB VAL B 65 -11.177 30.739 -3.298 1.00 0.00 H ATOM 2169 HG11 VAL B 65 -12.217 28.760 -4.279 1.00 0.00 H ATOM 2170 HG12 VAL B 65 -12.731 28.215 -2.664 1.00 0.00 H ATOM 2171 HG13 VAL B 65 -13.414 29.705 -3.360 1.00 0.00 H ATOM 2172 HG21 VAL B 65 -12.075 29.584 -0.607 1.00 0.00 H ATOM 2173 HG22 VAL B 65 -11.080 31.042 -0.843 1.00 0.00 H ATOM 2174 HG23 VAL B 65 -12.774 31.021 -1.394 1.00 0.00 H ATOM 2175 H VAL B 65 -8.529 30.471 -2.582 1.00 0.00 H ATOM 2176 N ASP B 66 -9.667 27.267 -4.215 1.00 33.06 N ATOM 2177 CA ASP B 66 -9.333 26.681 -5.498 1.00 32.77 C ATOM 2178 C ASP B 66 -10.563 26.515 -6.397 1.00 32.35 C ATOM 2179 O ASP B 66 -11.657 26.089 -5.949 1.00 31.85 O ATOM 2180 CB ASP B 66 -8.709 25.296 -5.303 1.00 32.47 C ATOM 2181 CG ASP B 66 -7.401 25.355 -4.567 1.00 34.12 C ATOM 2182 OD1 ASP B 66 -6.762 26.400 -4.610 1.00 35.40 O ATOM 2183 OD2 ASP B 66 -7.017 24.360 -3.917 1.00 37.08 O ATOM 2184 HA ASP B 66 -8.631 27.364 -5.976 1.00 0.00 H ATOM 2185 HB2 ASP B 66 -9.403 24.676 -4.735 1.00 0.00 H ATOM 2186 HB3 ASP B 66 -8.540 24.847 -6.282 1.00 0.00 H ATOM 2187 H ASP B 66 -9.991 26.628 -3.461 1.00 0.00 H ATOM 2188 N TRP B 67 -10.316 26.760 -7.679 1.00 31.30 N ATOM 2189 CA TRP B 67 -11.298 26.756 -8.711 1.00 32.20 C ATOM 2190 C TRP B 67 -10.798 25.915 -9.857 1.00 34.30 C ATOM 2191 O TRP B 67 -9.709 26.158 -10.374 1.00 34.96 O ATOM 2192 CB TRP B 67 -11.495 28.159 -9.237 1.00 30.48 C ATOM 2193 CG TRP B 67 -12.008 29.049 -8.213 1.00 30.96 C ATOM 2194 CD1 TRP B 67 -11.271 29.831 -7.393 1.00 32.16 C ATOM 2195 CD2 TRP B 67 -13.393 29.253 -7.847 1.00 32.69 C ATOM 2196 NE1 TRP B 67 -12.095 30.540 -6.534 1.00 33.96 N ATOM 2197 CE2 TRP B 67 -13.405 30.211 -6.787 1.00 33.12 C ATOM 2198 CE3 TRP B 67 -14.630 28.756 -8.343 1.00 31.73 C ATOM 2199 CZ2 TRP B 67 -14.610 30.664 -6.160 1.00 32.49 C ATOM 2200 CZ3 TRP B 67 -15.836 29.211 -7.718 1.00 26.85 C ATOM 2201 CH2 TRP B 67 -15.806 30.147 -6.640 1.00 30.75 C ATOM 2202 HA TRP B 67 -12.232 26.365 -8.308 1.00 0.00 H ATOM 2203 HB2 TRP B 67 -10.538 28.542 -9.591 1.00 0.00 H ATOM 2204 HB3 TRP B 67 -12.202 28.130 -10.066 1.00 0.00 H ATOM 2205 HE1 TRP B 67 -11.773 31.215 -5.811 1.00 0.00 H ATOM 2206 HD1 TRP B 67 -10.183 29.895 -7.406 1.00 0.00 H ATOM 2207 HZ2 TRP B 67 -14.589 31.383 -5.341 1.00 0.00 H ATOM 2208 HH2 TRP B 67 -16.744 30.463 -6.183 1.00 0.00 H ATOM 2209 HZ3 TRP B 67 -16.796 28.835 -8.072 1.00 0.00 H ATOM 2210 HE3 TRP B 67 -14.659 28.050 -9.173 1.00 0.00 H ATOM 2211 H TRP B 67 -9.334 26.970 -7.949 1.00 0.00 H ATOM 2212 N LEU B 68 -11.605 24.942 -10.276 1.00 36.22 N ATOM 2213 CA LEU B 68 -11.315 24.168 -11.505 1.00 38.27 C ATOM 2214 C LEU B 68 -11.380 25.078 -12.720 1.00 39.33 C ATOM 2215 O LEU B 68 -12.372 25.807 -12.912 1.00 41.01 O ATOM 2216 CB LEU B 68 -12.257 22.952 -11.644 1.00 37.23 C ATOM 2217 CG LEU B 68 -12.104 22.110 -12.905 1.00 38.88 C ATOM 2218 CD1 LEU B 68 -10.761 21.417 -13.047 1.00 33.48 C ATOM 2219 CD2 LEU B 68 -13.165 21.099 -12.852 1.00 38.31 C ATOM 2220 HA LEU B 68 -10.303 23.769 -11.434 1.00 0.00 H ATOM 2221 HB2 LEU B 68 -12.084 22.300 -10.788 1.00 0.00 H ATOM 2222 HB3 LEU B 68 -13.282 23.322 -11.616 1.00 0.00 H ATOM 2223 HG LEU B 68 -12.172 22.774 -13.767 1.00 0.00 H ATOM 2224 HD21 LEU B 68 -13.041 20.491 -11.956 1.00 0.00 H ATOM 2225 HD22 LEU B 68 -14.136 21.594 -12.825 1.00 0.00 H ATOM 2226 HD23 LEU B 68 -13.104 20.463 -13.735 1.00 0.00 H ATOM 2227 HD11 LEU B 68 -9.968 22.165 -13.069 1.00 0.00 H ATOM 2228 HD12 LEU B 68 -10.608 20.748 -12.200 1.00 0.00 H ATOM 2229 HD13 LEU B 68 -10.746 20.843 -13.973 1.00 0.00 H ATOM 2230 H LEU B 68 -12.460 24.720 -9.727 1.00 0.00 H ATOM 2231 N MET B 69 -10.326 25.070 -13.526 1.00 39.60 N ATOM 2232 CA MET B 69 -10.260 26.020 -14.636 1.00 40.26 C ATOM 2233 C MET B 69 -11.032 25.620 -15.873 1.00 41.07 C ATOM 2234 O MET B 69 -11.150 26.435 -16.797 1.00 40.79 O ATOM 2235 CB MET B 69 -8.822 26.322 -14.999 1.00 39.62 C ATOM 2236 CG MET B 69 -8.275 27.219 -13.970 1.00 40.82 C ATOM 2237 SD MET B 69 -6.610 27.793 -14.261 1.00 43.70 S ATOM 2238 CE MET B 69 -5.512 26.359 -14.275 1.00 41.11 C ATOM 2239 HA MET B 69 -10.755 26.916 -14.261 1.00 0.00 H ATOM 2240 HB2 MET B 69 -8.245 25.398 -15.029 1.00 0.00 H ATOM 2241 HB3 MET B 69 -8.780 26.807 -15.974 1.00 0.00 H ATOM 2242 HG2 MET B 69 -8.286 26.687 -13.019 1.00 0.00 H ATOM 2243 HG3 MET B 69 -8.925 28.091 -13.904 1.00 0.00 H ATOM 2244 HE1 MET B 69 -5.570 25.849 -13.313 1.00 0.00 H ATOM 2245 HE2 MET B 69 -5.817 25.677 -15.068 1.00 0.00 H ATOM 2246 HE3 MET B 69 -4.488 26.689 -14.452 1.00 0.00 H ATOM 2247 H MET B 69 -9.552 24.393 -13.370 1.00 0.00 H ATOM 2248 N TYR B 70 -11.559 24.388 -15.880 1.00 42.34 N ATOM 2249 CA TYR B 70 -12.316 23.820 -17.014 1.00 43.46 C ATOM 2250 C TYR B 70 -13.743 23.543 -16.638 1.00 41.85 C ATOM 2251 O TYR B 70 -14.069 23.490 -15.455 1.00 42.51 O ATOM 2252 CB TYR B 70 -11.633 22.524 -17.490 1.00 45.68 C ATOM 2253 CG TYR B 70 -10.191 22.767 -17.841 1.00 53.69 C ATOM 2254 CD1 TYR B 70 -9.171 22.294 -17.011 1.00 60.23 C ATOM 2255 CD2 TYR B 70 -9.842 23.564 -18.962 1.00 63.31 C ATOM 2256 CE1 TYR B 70 -7.839 22.539 -17.300 1.00 65.70 C ATOM 2257 CE2 TYR B 70 -8.496 23.842 -19.259 1.00 69.36 C ATOM 2258 CZ TYR B 70 -7.512 23.297 -18.416 1.00 70.83 C ATOM 2259 OH TYR B 70 -6.187 23.523 -18.665 1.00 78.29 O ATOM 2260 HA TYR B 70 -12.322 24.551 -17.822 1.00 0.00 H ATOM 2261 HB3 TYR B 70 -12.155 22.149 -18.370 1.00 0.00 H ATOM 2262 HB2 TYR B 70 -11.685 21.781 -16.694 1.00 0.00 H ATOM 2263 HD2 TYR B 70 -10.628 23.966 -19.601 1.00 0.00 H ATOM 2264 HE2 TYR B 70 -8.225 24.460 -20.115 1.00 0.00 H ATOM 2265 HE1 TYR B 70 -7.054 22.140 -16.657 1.00 0.00 H ATOM 2266 HD1 TYR B 70 -9.429 21.722 -16.120 1.00 0.00 H ATOM 2267 HH TYR B 70 -5.641 23.067 -17.976 1.00 0.00 H ATOM 2268 H TYR B 70 -11.427 23.796 -15.035 1.00 0.00 H ATOM 2269 N ALA B 71 -14.591 23.352 -17.636 1.00 41.39 N ATOM 2270 CA ALA B 71 -16.016 23.071 -17.417 1.00 41.58 C ATOM 2271 C ALA B 71 -16.233 21.600 -17.060 1.00 42.47 C ATOM 2272 O ALA B 71 -17.155 21.278 -16.334 1.00 43.39 O ATOM 2273 CB ALA B 71 -16.876 23.481 -18.640 1.00 40.62 C ATOM 2274 HA ALA B 71 -16.344 23.678 -16.573 1.00 0.00 H ATOM 2275 HB1 ALA B 71 -16.760 24.549 -18.822 1.00 0.00 H ATOM 2276 HB2 ALA B 71 -16.547 22.924 -19.517 1.00 0.00 H ATOM 2277 HB3 ALA B 71 -17.923 23.257 -18.438 1.00 0.00 H ATOM 2278 H ALA B 71 -14.235 23.403 -18.612 1.00 0.00 H ATOM 2279 N ASP B 72 -15.369 20.701 -17.502 1.00 42.77 N ATOM 2280 CA ASP B 72 -15.593 19.320 -17.204 1.00 44.69 C ATOM 2281 C ASP B 72 -14.535 18.683 -16.287 1.00 45.26 C ATOM 2282 O ASP B 72 -13.362 18.854 -16.586 1.00 45.93 O ATOM 2283 CB ASP B 72 -15.598 18.601 -18.533 1.00 45.37 C ATOM 2284 CG ASP B 72 -16.221 17.257 -18.416 1.00 49.71 C ATOM 2285 OD1 ASP B 72 -15.764 16.405 -17.608 1.00 54.65 O ATOM 2286 OD2 ASP B 72 -17.220 17.066 -19.085 1.00 55.76 O ATOM 2287 HA ASP B 72 -16.531 19.236 -16.656 1.00 0.00 H ATOM 2288 HB2 ASP B 72 -16.161 19.192 -19.255 1.00 0.00 H ATOM 2289 HB3 ASP B 72 -14.571 18.488 -18.880 1.00 0.00 H ATOM 2290 H ASP B 72 -14.540 20.994 -18.057 1.00 0.00 H ATOM 2291 N SER B 73 -14.887 17.907 -15.240 1.00 45.68 N ATOM 2292 CA SER B 73 -13.829 17.296 -14.328 1.00 46.59 C ATOM 2293 C SER B 73 -13.220 15.906 -14.630 1.00 46.66 C ATOM 2294 O SER B 73 -13.611 15.262 -15.621 1.00 48.78 O ATOM 2295 CB SER B 73 -14.307 17.325 -12.885 1.00 46.27 C ATOM 2296 OG SER B 73 -15.694 17.176 -12.857 1.00 46.18 O ATOM 2297 HA SER B 73 -12.986 17.953 -14.542 1.00 0.00 H ATOM 2298 HB2 SER B 73 -14.033 18.276 -12.429 1.00 0.00 H ATOM 2299 HB3 SER B 73 -13.841 16.510 -12.330 1.00 0.00 H ATOM 2300 HG SER B 73 -16.115 17.917 -13.361 1.00 0.00 H ATOM 2301 H SER B 73 -15.893 17.723 -15.053 1.00 0.00 H TER 2302 SER B 73 HETATM 2303 ZN ZN A 1 -35.530 26.205 -19.126 1.00 45.86 ZN HETATM 2304 ZN ZN A 2 -4.929 43.872 0.630 1.00 45.86 ZN HETATM 2305 O HOH 3 -12.488 25.595 5.188 1.00 52.22 O HETATM 2306 O HOH 4 -27.365 14.855 -7.463 1.00 41.04 O HETATM 2307 O HOH 5 -25.227 36.558 -21.248 1.00 60.19 O HETATM 2308 O HOH 6 -11.349 22.540 1.529 1.00 43.34 O HETATM 2309 O HOH 7 -19.127 26.054 9.555 1.00 59.45 O HETATM 2310 O HOH 8 -32.757 15.098 -30.586 1.00 45.45 O HETATM 2311 O HOH 9 -22.535 32.646 4.981 1.00 61.11 O HETATM 2312 O HOH 10 -24.065 25.269 -16.587 1.00 29.96 O HETATM 2313 O HOH 11 -19.917 23.865 -1.319 1.00 45.04 O HETATM 2314 O HOH 12 -33.499 13.591 -18.903 1.00 56.11 O HETATM 2315 O HOH 13 -33.099 30.089 -27.711 1.00 36.22 O HETATM 2316 O HOH 14 -28.849 29.261 -5.009 1.00 33.67 O HETATM 2317 O HOH 15 -34.218 31.142 -11.364 1.00 38.20 O HETATM 2318 O HOH 16 -17.503 25.269 6.466 1.00 56.98 O HETATM 2319 O HOH 17 -14.976 23.549 6.485 1.00 57.96 O HETATM 2320 O HOH 18 -30.021 30.904 -3.295 1.00 49.21 O HETATM 2321 O HOH 19 -22.494 37.725 -9.811 1.00 47.10 O HETATM 2322 O HOH 20 -12.474 15.745 -0.294 1.00 58.94 O HETATM 2323 O HOH 21 -22.502 26.893 -14.143 1.00 39.21 O HETATM 2324 O HOH 22 -16.314 29.846 11.151 1.00 66.94 O HETATM 2325 O HOH 23 -41.245 18.495 -25.341 1.00 40.65 O HETATM 2326 O HOH 24 -21.752 11.489 -5.327 1.00 39.19 O HETATM 2327 O HOH 25 -29.900 28.233 -12.302 1.00 38.98 O HETATM 2328 O HOH 26 -23.537 29.396 -14.517 1.00 31.65 O HETATM 2329 O HOH 27 -23.401 30.327 -17.427 1.00 27.36 O HETATM 2330 O HOH 28 -32.956 29.243 -7.210 1.00 40.24 O HETATM 2331 O HOH 29 -30.606 22.768 -26.971 1.00 42.10 O HETATM 2332 O HOH 30 -43.208 15.457 -26.224 1.00 46.43 O HETATM 2333 O HOH 31 -28.503 13.085 -24.212 1.00 54.90 O HETATM 2334 O HOH 32 -10.905 35.293 5.334 1.00 32.85 O HETATM 2335 O HOH 33 -35.801 23.375 -25.280 1.00 32.19 O HETATM 2336 O HOH 34 -15.922 23.612 -23.684 1.00 52.22 O HETATM 2337 O HOH 35 0.818 31.126 -11.033 1.00 41.04 O HETATM 2338 O HOH 36 -19.047 40.126 2.752 1.00 60.19 O HETATM 2339 O HOH 37 -13.846 21.099 -20.025 1.00 43.34 O HETATM 2340 O HOH 38 -13.000 29.591 -28.051 1.00 59.45 O HETATM 2341 O HOH 39 3.303 35.917 12.090 1.00 45.45 O HETATM 2342 O HOH 40 -17.005 35.839 -23.477 1.00 61.11 O HETATM 2343 O HOH 41 -9.851 33.475 -1.909 1.00 29.96 O HETATM 2344 O HOH 42 -10.709 29.181 -17.177 1.00 45.04 O HETATM 2345 O HOH 43 4.979 35.806 0.407 1.00 56.11 O HETATM 2346 O HOH 44 -9.508 43.709 9.215 1.00 36.22 O HETATM 2347 O HOH 45 -10.916 39.614 -13.487 1.00 33.67 O HETATM 2348 O HOH 46 -9.861 45.205 -7.132 1.00 38.20 O HETATM 2349 O HOH 47 -13.132 27.793 -24.962 1.00 56.98 O HETATM 2350 O HOH 48 -12.906 24.744 -24.981 1.00 57.96 O HETATM 2351 O HOH 49 -11.753 41.451 -15.201 1.00 49.21 O HETATM 2352 O HOH 50 -21.424 38.343 -8.685 1.00 47.10 O HETATM 2353 O HOH 51 -7.399 18.675 -18.202 1.00 58.94 O HETATM 2354 O HOH 52 -12.039 32.934 -4.353 1.00 39.21 O HETATM 2355 O HOH 53 -17.690 29.051 -29.647 1.00 66.94 O HETATM 2356 O HOH 54 4.605 44.967 6.845 1.00 40.65 O HETATM 2357 O HOH 55 0.926 24.582 -13.169 1.00 39.19 O HETATM 2358 O HOH 56 -9.501 40.011 -6.194 1.00 38.98 O HETATM 2359 O HOH 57 -13.689 35.082 -3.979 1.00 31.65 O HETATM 2360 O HOH 58 -14.563 35.429 -1.069 1.00 27.36 O HETATM 2361 O HOH 59 -8.847 43.162 -11.286 1.00 40.24 O HETATM 2362 O HOH 60 -4.415 37.890 8.475 1.00 42.10 O HETATM 2363 O HOH 61 8.218 45.148 7.728 1.00 46.43 O HETATM 2364 O HOH 62 2.920 31.227 5.716 1.00 54.90 O HETATM 2365 O HOH 63 -25.112 27.090 -23.830 1.00 32.85 O HETATM 2366 O HOH 64 -2.343 42.692 6.784 1.00 32.19 O HETATM 2367 PG ATP A 65 -24.541 10.227 -17.460 1.00 0.19 P HETATM 2368 O1G ATP A 65 -24.204 9.967 -18.922 1.00 -0.61 O HETATM 2369 O2G ATP A 65 -25.807 9.515 -17.000 1.00 -0.61 O HETATM 2370 O3G ATP A 65 -23.360 10.191 -16.473 1.00 -0.61 O HETATM 2371 O3B ATP A 65 -24.983 11.809 -17.458 1.00 -0.15 O HETATM 2372 PB ATP A 65 -23.983 13.073 -17.787 1.00 0.36 P HETATM 2373 O1B ATP A 65 -22.692 12.417 -18.305 1.00 -0.57 O HETATM 2374 O2B ATP A 65 -24.003 13.984 -16.566 1.00 -0.57 O HETATM 2375 O3A ATP A 65 -24.668 13.812 -19.069 1.00 -0.12 O HETATM 2376 PA ATP A 65 -25.588 12.903 -20.067 1.00 0.33 P HETATM 2377 O1A ATP A 65 -26.816 12.521 -19.241 1.00 -0.57 O HETATM 2378 O2A ATP A 65 -24.771 11.789 -20.767 1.00 -0.57 O HETATM 2379 O5' ATP A 65 -26.001 13.939 -21.241 1.00 -0.24 O HETATM 2380 C5' ATP A 65 -25.430 13.876 -22.546 1.00 0.11 C HETATM 2381 C4' ATP A 65 -25.194 15.345 -22.778 1.00 0.12 C HETATM 2382 O4' ATP A 65 -26.413 15.961 -22.353 1.00 -0.34 O HETATM 2383 C1' ATP A 65 -26.066 16.994 -21.495 1.00 0.20 C HETATM 2384 C2' ATP A 65 -24.850 16.491 -20.748 1.00 0.14 C HETATM 2385 C3' ATP A 65 -24.102 15.821 -21.843 1.00 0.11 C HETATM 2386 O3' ATP A 65 -23.387 16.863 -22.500 1.00 -0.39 O HETATM 2387 H5 ATP A 65 -22.695 17.178 -21.931 1.00 0.21 H HETATM 2388 H4 ATP A 65 -23.446 15.008 -21.497 1.00 0.06 H HETATM 2389 O2' ATP A 65 -24.070 17.614 -20.373 1.00 -0.38 O HETATM 2390 H7 ATP A 65 -23.966 18.190 -21.121 1.00 0.21 H HETATM 2391 H6 ATP A 65 -25.090 15.836 -19.898 1.00 0.07 H HETATM 2392 N9 ATP A 65 -27.146 17.281 -20.592 1.00 -0.19 N HETATM 2393 C8 ATP A 65 -27.743 16.451 -19.729 1.00 0.11 C HETATM 2394 N7 ATP A 65 -28.701 17.140 -19.020 1.00 -0.30 N HETATM 2395 C5 ATP A 65 -28.707 18.423 -19.427 1.00 0.10 C HETATM 2396 C6 ATP A 65 -29.443 19.637 -19.093 1.00 0.13 C HETATM 2397 N6 ATP A 65 -30.412 19.612 -18.142 1.00 -0.32 N HETATM 2398 H10 ATP A 65 -30.928 20.473 -17.910 1.00 0.18 H HETATM 2399 H11 ATP A 65 -30.631 18.733 -17.652 1.00 0.18 H HETATM 2400 N1 ATP A 65 -29.132 20.784 -19.749 1.00 -0.27 N HETATM 2401 C2 ATP A 65 -28.198 20.767 -20.691 1.00 0.05 C HETATM 2402 N3 ATP A 65 -27.485 19.683 -21.064 1.00 -0.27 N HETATM 2403 C4 ATP A 65 -27.684 18.508 -20.458 1.00 0.16 C HETATM 2404 H12 ATP A 65 -27.990 21.700 -21.203 1.00 0.10 H HETATM 2405 H9 ATP A 65 -27.508 15.395 -19.607 1.00 0.13 H HETATM 2406 H8 ATP A 65 -25.817 17.901 -22.065 1.00 0.10 H HETATM 2407 H3 ATP A 65 -24.952 15.567 -23.828 1.00 0.07 H HETATM 2408 H1 ATP A 65 -26.129 13.451 -23.281 1.00 0.06 H HETATM 2409 H2 ATP A 65 -24.492 13.302 -22.557 1.00 0.06 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 335 334 339 2303 CONECT 384 383 388 2303 CONECT 742 741 746 2303 CONECT 789 788 793 2303 CONECT 1152 1153 1163 1164 1165 CONECT 1163 1152 CONECT 1164 1152 CONECT 1165 1152 CONECT 1486 1485 1490 2304 CONECT 1535 1534 1539 2304 CONECT 1893 1892 1897 2304 CONECT 1940 1939 1944 2304 CONECT 2303 335 384 742 789 CONECT 2304 1486 1535 1893 1940 CONECT 2367 2368 2369 2370 2371 CONECT 2368 2367 CONECT 2369 2367 CONECT 2370 2367 CONECT 2371 2367 2372 CONECT 2372 2371 2373 2374 2375 CONECT 2373 2372 CONECT 2374 2372 CONECT 2375 2372 2376 CONECT 2376 2375 2377 2378 2379 CONECT 2377 2376 CONECT 2378 2376 CONECT 2379 2376 2380 CONECT 2380 2379 2381 2408 2409 CONECT 2381 2380 2382 2385 2407 CONECT 2382 2381 2383 CONECT 2383 2382 2384 2392 2406 CONECT 2384 2383 2385 2389 2391 CONECT 2385 2381 2384 2386 2388 CONECT 2386 2385 2387 CONECT 2387 2386 CONECT 2388 2385 CONECT 2389 2384 2390 CONECT 2390 2389 CONECT 2391 2384 CONECT 2392 2383 2393 2403 CONECT 2393 2392 2394 2405 CONECT 2394 2393 2395 CONECT 2395 2394 2396 2403 CONECT 2396 2395 2397 2400 CONECT 2397 2396 2398 2399 CONECT 2398 2397 CONECT 2399 2397 CONECT 2400 2396 2401 CONECT 2401 2400 2402 2404 CONECT 2402 2401 2403 CONECT 2403 2392 2395 2402 CONECT 2404 2401 CONECT 2405 2393 CONECT 2406 2383 CONECT 2407 2381 CONECT 2408 2380 CONECT 2409 2380 MASTER 0 0 0 0 0 0 0 0 2407 2 61 12 END
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Related entries of code: 3dgo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2p09
RCSB PDB
PDBbind
81aa, >2P09_1|Chain... *
3dgl
RCSB PDB
PDBbind
81aa, >3DGL_1|Chain... at 100%
3dgn
RCSB PDB
PDBbind
81aa, >3DGN_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1b38
RCSB PDB
PDBbind
ATP
1b39
RCSB PDB
PDBbind
ATP
1gz3
RCSB PDB
PDBbind
ATP
1gz4
RCSB PDB
PDBbind
ATP
1m83
RCSB PDB
PDBbind
ATP
1mau
RCSB PDB
PDBbind
ATP
1maw
RCSB PDB
PDBbind
ATP
1r0x
RCSB PDB
PDBbind
ATP
1r10
RCSB PDB
PDBbind
ATP
1vjc
RCSB PDB
PDBbind
ATP
1vjd
RCSB PDB
PDBbind
ATP
1xsc
RCSB PDB
PDBbind
ATP
1y8p
RCSB PDB
PDBbind
ATP
1yid
RCSB PDB
PDBbind
ATP
2cbz
RCSB PDB
PDBbind
ATP
2e5y
RCSB PDB
PDBbind
ATP
2fgh
RCSB PDB
PDBbind
ATP
2hmu
RCSB PDB
PDBbind
ATP
2hmw
RCSB PDB
PDBbind
ATP
2j9l
RCSB PDB
PDBbind
ATP
2kmx
RCSB PDB
PDBbind
ATP
2p09
RCSB PDB
PDBbind
ATP
2p0x
RCSB PDB
PDBbind
ATP
2pze
RCSB PDB
PDBbind
ATP
2vhq
RCSB PDB
PDBbind
ATP
2vt3
RCSB PDB
PDBbind
ATP
2w5g
RCSB PDB
PDBbind
ATP
2w5i
RCSB PDB
PDBbind
ATP
2xbp
RCSB PDB
PDBbind
ATP
2ych
RCSB PDB
PDBbind
ATP
3b2q
RCSB PDB
PDBbind
ATP
3d2e
RCSB PDB
PDBbind
ATP
3dgl
RCSB PDB
PDBbind
ATP
3dnt
RCSB PDB
PDBbind
ATP
3efs
RCSB PDB
PDBbind
ATP
3lf0
RCSB PDB
PDBbind
ATP
3ncq
RCSB PDB
PDBbind
ATP
3qo3
RCSB PDB
PDBbind
ATP
3qx9
RCSB PDB
PDBbind
ATP
3qxc
RCSB PDB
PDBbind
ATP
3ta0
RCSB PDB
PDBbind
ATP
3umo
RCSB PDB
PDBbind
ATP
3ump
RCSB PDB
PDBbind
ATP
4fut
RCSB PDB
PDBbind
ATP
4fvq
RCSB PDB
PDBbind
ATP
4fvr
RCSB PDB
PDBbind
ATP
4jn4
RCSB PDB
PDBbind
ATP
4jne
RCSB PDB
PDBbind
ATP
4k8o
RCSB PDB
PDBbind
ATP
4ozn
RCSB PDB
PDBbind
ATP
4usw
RCSB PDB
PDBbind
ATP
4wz6
RCSB PDB
PDBbind
ATP
4yb7
RCSB PDB
PDBbind
ATP
5d6j
RCSB PDB
PDBbind
ATP
5eou
RCSB PDB
PDBbind
ATP
5f1c
RCSB PDB
PDBbind
ATP
5f1x
RCSB PDB
PDBbind
ATP
5ldk
RCSB PDB
PDBbind
ATP
5ldp
RCSB PDB
PDBbind
ATP
5svk
RCSB PDB
PDBbind
ATP
5svl
RCSB PDB
PDBbind
ATP
5tgc
RCSB PDB
PDBbind
ATP
5v2l
RCSB PDB
PDBbind
ATP
5wrs
RCSB PDB
PDBbind
ATP
5x9h
RCSB PDB
PDBbind
ATP
5z68
RCSB PDB
PDBbind
ATP
6cvv
RCSB PDB
PDBbind
ATP
6r4s
RCSB PDB
PDBbind
ATP
6ntb
RCSB PDB
PDBbind
ATP
6mm2
RCSB PDB
PDBbind
ATP
6h78
RCSB PDB
PDBbind
ATP
6h77
RCSB PDB
PDBbind
ATP
6aec
RCSB PDB
PDBbind
ATP
5xvu
RCSB PDB
PDBbind
ATP
Entry Information
PDB ID
3dgo
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
ATP Binding Protein-DX(Y43F)
Ligand Name
ATP
EC.Number
E.C.-.-.-.-
Resolution
2.5(Å)
Affinity (Kd/Ki/IC50)
Kd=180nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Acs Chem.Biol. Vol. 4: pp. 649-658
Ligand Properties
Formula
C
1
0
H
1
9
N
5
O
1
3
P
3
Molecular Weight
510.205
Exact Mass
510.019
No. of atoms
50
No. of bonds
52
Polar Surface Area
329.38
LOGP Value
-6.07 (
Computed with XLOGP3
)
-2.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 12
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 18
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(OP(O)(O)O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C10H22N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-24,29-31H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
No matched UniProt accession number (AC) found!
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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