Browse entries in the PDBbind-CN Database
HEADER 2Y9G_COMPLEX COMPND 2Y9G_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 147 ASP ILE TYR ILE PRO PRO GLU GLY LEU TYR PHE ARG LEU SEQRES 2 A 147 LEU GLY PHE ALA SER ARG GLN VAL ILE PHE ALA ARG ASN SEQRES 3 A 147 SER PRO SER PRO ASP VAL GLY LEU SER PRO VAL ASN ASP SEQRES 4 A 147 GLN ALA THR ASP GLN TYR PHE SER LEU ILE TYR GLY THR SEQRES 5 A 147 GLY GLU HIS ALA GLY LEU TYR ALA ILE LYS SER LYS ALA SEQRES 6 A 147 THR GLY LYS VAL LEU PHE SER ARG ARG PRO ALA GLU PRO SEQRES 7 A 147 TYR VAL GLY GLN ILE ASP GLY ASP GLY ARG TYR PRO ASP SEQRES 8 A 147 ASN TRP PHE LYS ILE GLU PRO GLY LYS THR TYR LEU SER SEQRES 9 A 147 LYS TYR PHE ARG LEU VAL GLN PRO SER THR GLY THR ALA SEQRES 10 A 147 LEU VAL SER ARG THR HIS LEU GLN PRO TYR PHE TRP ASN SEQRES 11 A 147 HIS PRO GLN THR GLU VAL PHE ASP ASP GLN TYR PHE THR SEQRES 12 A 147 PHE LEU PHE GLU HET LBT A 410 45 ATOM 1 N ASP A 3 28.468 18.149 -11.287 1.00 41.34 N ATOM 2 CA ASP A 3 29.447 17.332 -10.508 1.00 38.34 C ATOM 3 C ASP A 3 28.911 17.016 -9.071 1.00 33.16 C ATOM 4 O ASP A 3 29.720 16.862 -8.141 1.00 34.15 O ATOM 5 CB ASP A 3 30.810 18.033 -10.472 1.00 43.15 C ATOM 6 CG ASP A 3 30.861 19.214 -9.509 1.00 42.77 C ATOM 7 OD1 ASP A 3 29.790 19.844 -9.258 1.00 44.17 O ATOM 8 OD2 ASP A 3 31.984 19.514 -9.000 1.00 46.68 O ATOM 9 HA ASP A 3 29.577 16.373 -11.010 1.00 0.00 H ATOM 10 HB2 ASP A 3 31.564 17.307 -10.168 1.00 0.00 H ATOM 11 HB3 ASP A 3 31.039 18.395 -11.474 1.00 0.00 H ATOM 12 HN3 ASP A 3 28.297 19.048 -10.792 1.00 0.00 H ATOM 13 HN2 ASP A 3 27.574 17.625 -11.375 1.00 0.00 H ATOM 14 HN1 ASP A 3 28.854 18.341 -12.234 1.00 0.00 H ATOM 15 N ILE A 4 27.601 16.898 -8.901 1.00 27.54 N ATOM 16 CA ILE A 4 27.057 16.256 -7.689 1.00 23.01 C ATOM 17 C ILE A 4 27.238 14.758 -7.828 1.00 22.53 C ATOM 18 O ILE A 4 26.707 14.136 -8.761 1.00 22.26 O ATOM 19 CB ILE A 4 25.664 16.648 -7.325 1.00 20.73 C ATOM 20 CG1 ILE A 4 25.770 18.137 -6.864 1.00 23.56 C ATOM 21 CG2 ILE A 4 25.112 15.709 -6.235 1.00 20.29 C ATOM 22 CD1 ILE A 4 24.589 18.661 -6.399 1.00 23.70 C ATOM 23 HA ILE A 4 27.625 16.627 -6.836 1.00 0.00 H ATOM 24 HB ILE A 4 24.961 16.560 -8.154 1.00 0.00 H ATOM 25 HG12 ILE A 4 26.510 18.198 -6.066 1.00 0.00 H ATOM 26 HG13 ILE A 4 26.101 18.736 -7.712 1.00 0.00 H ATOM 27 HD11 ILE A 4 23.839 18.620 -7.189 1.00 0.00 H ATOM 28 HD12 ILE A 4 24.248 18.081 -5.542 1.00 0.00 H ATOM 29 HD13 ILE A 4 24.746 19.697 -6.099 1.00 0.00 H ATOM 30 HG21 ILE A 4 25.108 14.685 -6.607 1.00 0.00 H ATOM 31 HG22 ILE A 4 25.743 15.772 -5.349 1.00 0.00 H ATOM 32 HG23 ILE A 4 24.095 16.008 -5.980 1.00 0.00 H ATOM 33 H ILE A 4 26.952 17.261 -9.628 1.00 0.00 H ATOM 34 N TYR A 5 28.072 14.201 -6.942 1.00 20.54 N ATOM 35 CA TYR A 5 28.255 12.739 -6.943 1.00 20.56 C ATOM 36 C TYR A 5 26.959 12.054 -6.575 1.00 18.22 C ATOM 37 O TYR A 5 26.352 12.343 -5.527 1.00 16.42 O ATOM 38 CB TYR A 5 29.379 12.344 -5.972 1.00 21.60 C ATOM 39 CG TYR A 5 29.523 10.877 -5.784 1.00 21.86 C ATOM 40 CD1 TYR A 5 30.282 10.124 -6.676 1.00 24.18 C ATOM 41 CD2 TYR A 5 28.841 10.231 -4.719 1.00 19.98 C ATOM 42 CE1 TYR A 5 30.450 8.729 -6.483 1.00 24.68 C ATOM 43 CE2 TYR A 5 28.953 8.867 -4.541 1.00 20.39 C ATOM 44 CZ TYR A 5 29.711 8.127 -5.422 1.00 22.62 C ATOM 45 OH TYR A 5 29.848 6.779 -5.230 1.00 23.26 O ATOM 46 HA TYR A 5 28.541 12.417 -7.944 1.00 0.00 H ATOM 47 HB3 TYR A 5 29.170 12.796 -5.002 1.00 0.00 H ATOM 48 HB2 TYR A 5 30.320 12.735 -6.358 1.00 0.00 H ATOM 49 HD2 TYR A 5 28.225 10.817 -4.037 1.00 0.00 H ATOM 50 HE2 TYR A 5 28.445 8.379 -3.709 1.00 0.00 H ATOM 51 HE1 TYR A 5 31.115 8.143 -7.118 1.00 0.00 H ATOM 52 HD1 TYR A 5 30.751 10.611 -7.531 1.00 0.00 H ATOM 53 HH TYR A 5 30.419 6.401 -5.945 1.00 0.00 H ATOM 54 H TYR A 5 28.586 14.794 -6.260 1.00 0.00 H ATOM 55 N ILE A 6 26.523 11.112 -7.434 1.00 18.48 N ATOM 56 CA ILE A 6 25.380 10.269 -7.103 1.00 16.70 C ATOM 57 C ILE A 6 25.884 8.860 -6.871 1.00 17.56 C ATOM 58 O ILE A 6 26.519 8.289 -7.715 1.00 19.48 O ATOM 59 CB ILE A 6 24.290 10.257 -8.251 1.00 16.41 C ATOM 60 CG1 ILE A 6 23.843 11.687 -8.536 1.00 17.45 C ATOM 61 CG2 ILE A 6 23.102 9.414 -7.871 1.00 14.81 C ATOM 62 CD1 ILE A 6 22.942 11.816 -9.820 1.00 18.98 C ATOM 63 HA ILE A 6 24.902 10.671 -6.210 1.00 0.00 H ATOM 64 HB ILE A 6 24.735 9.821 -9.145 1.00 0.00 H ATOM 65 HG12 ILE A 6 23.277 12.050 -7.678 1.00 0.00 H ATOM 66 HG13 ILE A 6 24.730 12.306 -8.672 1.00 0.00 H ATOM 67 HD11 ILE A 6 23.499 11.467 -10.690 1.00 0.00 H ATOM 68 HD12 ILE A 6 22.044 11.211 -9.695 1.00 0.00 H ATOM 69 HD13 ILE A 6 22.661 12.860 -9.962 1.00 0.00 H ATOM 70 HG21 ILE A 6 23.428 8.389 -7.691 1.00 0.00 H ATOM 71 HG22 ILE A 6 22.647 9.816 -6.966 1.00 0.00 H ATOM 72 HG23 ILE A 6 22.374 9.428 -8.682 1.00 0.00 H ATOM 73 H ILE A 6 27.008 10.984 -8.345 1.00 0.00 H ATOM 74 N PRO A 7 25.478 8.273 -5.723 1.00 16.21 N ATOM 75 CA PRO A 7 26.102 6.991 -5.389 1.00 17.33 C ATOM 76 C PRO A 7 25.502 5.837 -6.172 1.00 17.70 C ATOM 77 O PRO A 7 24.334 5.935 -6.639 1.00 16.53 O ATOM 78 CB PRO A 7 25.742 6.823 -3.898 1.00 15.88 C ATOM 79 CG PRO A 7 24.425 7.585 -3.709 1.00 13.75 C ATOM 80 CD PRO A 7 24.693 8.818 -4.611 1.00 14.19 C ATOM 81 HA PRO A 7 27.169 6.984 -5.614 1.00 0.00 H ATOM 82 HD3 PRO A 7 23.758 9.248 -4.969 1.00 0.00 H ATOM 83 HD2 PRO A 7 25.258 9.578 -4.072 1.00 0.00 H ATOM 84 HG3 PRO A 7 24.269 7.871 -2.669 1.00 0.00 H ATOM 85 HG2 PRO A 7 23.569 7.007 -4.058 1.00 0.00 H ATOM 86 HB2 PRO A 7 25.612 5.769 -3.653 1.00 0.00 H ATOM 87 HB3 PRO A 7 26.523 7.247 -3.267 1.00 0.00 H ATOM 88 N PRO A 8 26.253 4.733 -6.291 1.00 19.48 N ATOM 89 CA PRO A 8 25.710 3.496 -6.883 1.00 20.07 C ATOM 90 C PRO A 8 24.704 2.891 -5.910 1.00 18.32 C ATOM 91 O PRO A 8 24.641 3.294 -4.762 1.00 17.08 O ATOM 92 CB PRO A 8 26.937 2.589 -6.966 1.00 22.59 C ATOM 93 CG PRO A 8 27.790 3.032 -5.835 1.00 22.55 C ATOM 94 CD PRO A 8 27.632 4.558 -5.790 1.00 21.22 C ATOM 95 HA PRO A 8 25.213 3.644 -7.842 1.00 0.00 H ATOM 96 HD3 PRO A 8 27.737 4.939 -4.774 1.00 0.00 H ATOM 97 HD2 PRO A 8 28.356 5.052 -6.438 1.00 0.00 H ATOM 98 HG3 PRO A 8 28.831 2.760 -6.010 1.00 0.00 H ATOM 99 HG2 PRO A 8 27.451 2.584 -4.901 1.00 0.00 H ATOM 100 HB2 PRO A 8 26.654 1.543 -6.851 1.00 0.00 H ATOM 101 HB3 PRO A 8 27.454 2.722 -7.916 1.00 0.00 H ATOM 102 N GLU A 9 23.952 1.905 -6.365 1.00 18.55 N ATOM 103 CA GLU A 9 23.062 1.167 -5.431 1.00 17.39 C ATOM 104 C GLU A 9 23.952 0.557 -4.312 1.00 18.17 C ATOM 105 O GLU A 9 25.095 0.175 -4.547 1.00 20.08 O ATOM 106 CB GLU A 9 22.412 0.006 -6.181 1.00 18.35 C ATOM 107 CG GLU A 9 21.404 0.587 -7.184 1.00 17.68 C ATOM 108 CD GLU A 9 20.475 -0.452 -7.747 1.00 18.35 C ATOM 109 OE1 GLU A 9 20.819 -1.660 -7.699 1.00 19.87 O ATOM 110 OE2 GLU A 9 19.404 -0.095 -8.298 1.00 17.67 O ATOM 111 HA GLU A 9 22.303 1.835 -5.024 1.00 0.00 H ATOM 112 HB2 GLU A 9 23.175 -0.564 -6.712 1.00 0.00 H ATOM 113 HB3 GLU A 9 21.897 -0.647 -5.476 1.00 0.00 H ATOM 114 HG2 GLU A 9 20.810 1.349 -6.679 1.00 0.00 H ATOM 115 HG3 GLU A 9 21.955 1.044 -8.006 1.00 0.00 H ATOM 116 H GLU A 9 23.983 1.646 -7.372 1.00 0.00 H ATOM 117 N GLY A 10 23.376 0.477 -3.100 1.00 16.88 N ATOM 118 CA GLY A 10 24.051 -0.271 -2.046 1.00 17.86 C ATOM 119 C GLY A 10 24.968 0.591 -1.169 1.00 17.82 C ATOM 120 O GLY A 10 25.504 0.072 -0.173 1.00 18.69 O ATOM 121 HA3 GLY A 10 24.653 -1.053 -2.510 1.00 0.00 H ATOM 122 HA2 GLY A 10 23.294 -0.727 -1.408 1.00 0.00 H ATOM 123 H GLY A 10 22.464 0.941 -2.917 1.00 0.00 H ATOM 124 N LEU A 11 25.190 1.845 -1.553 1.00 17.16 N ATOM 125 CA LEU A 11 26.018 2.727 -0.773 1.00 17.29 C ATOM 126 C LEU A 11 25.102 3.654 0.012 1.00 15.26 C ATOM 127 O LEU A 11 24.282 4.399 -0.575 1.00 13.92 O ATOM 128 CB LEU A 11 26.938 3.534 -1.698 1.00 18.31 C ATOM 129 CG LEU A 11 28.009 4.403 -1.093 1.00 19.93 C ATOM 130 CD1 LEU A 11 28.822 3.626 -0.064 1.00 25.27 C ATOM 131 CD2 LEU A 11 28.949 4.888 -2.200 1.00 24.27 C ATOM 132 HA LEU A 11 26.647 2.158 -0.088 1.00 0.00 H ATOM 133 HB2 LEU A 11 27.439 2.820 -2.352 1.00 0.00 H ATOM 134 HB3 LEU A 11 26.299 4.185 -2.295 1.00 0.00 H ATOM 135 HG LEU A 11 27.530 5.249 -0.599 1.00 0.00 H ATOM 136 HD21 LEU A 11 29.407 4.028 -2.688 1.00 0.00 H ATOM 137 HD22 LEU A 11 28.381 5.463 -2.932 1.00 0.00 H ATOM 138 HD23 LEU A 11 29.726 5.517 -1.766 1.00 0.00 H ATOM 139 HD11 LEU A 11 28.162 3.277 0.730 1.00 0.00 H ATOM 140 HD12 LEU A 11 29.295 2.771 -0.547 1.00 0.00 H ATOM 141 HD13 LEU A 11 29.588 4.276 0.358 1.00 0.00 H ATOM 142 H LEU A 11 24.758 2.194 -2.432 1.00 0.00 H ATOM 143 N TYR A 12 25.302 3.689 1.334 1.00 15.31 N ATOM 144 CA TYR A 12 24.343 4.426 2.207 1.00 13.69 C ATOM 145 C TYR A 12 24.739 5.868 2.449 1.00 13.34 C ATOM 146 O TYR A 12 25.933 6.189 2.441 1.00 14.65 O ATOM 147 CB TYR A 12 24.267 3.737 3.580 1.00 14.20 C ATOM 148 CG TYR A 12 23.639 2.371 3.480 1.00 14.48 C ATOM 149 CD1 TYR A 12 22.238 2.258 3.261 1.00 13.16 C ATOM 150 CD2 TYR A 12 24.426 1.207 3.588 1.00 18.56 C ATOM 151 CE1 TYR A 12 21.648 0.980 3.153 1.00 13.67 C ATOM 152 CE2 TYR A 12 23.848 -0.045 3.504 1.00 18.84 C ATOM 153 CZ TYR A 12 22.455 -0.129 3.279 1.00 20.67 C ATOM 154 OH TYR A 12 21.899 -1.404 3.235 1.00 27.36 O ATOM 155 HA TYR A 12 23.387 4.415 1.684 1.00 0.00 H ATOM 156 HB3 TYR A 12 23.670 4.353 4.253 1.00 0.00 H ATOM 157 HB2 TYR A 12 25.275 3.635 3.981 1.00 0.00 H ATOM 158 HD2 TYR A 12 25.502 1.295 3.739 1.00 0.00 H ATOM 159 HE2 TYR A 12 24.452 -0.946 3.609 1.00 0.00 H ATOM 160 HE1 TYR A 12 20.578 0.873 2.974 1.00 0.00 H ATOM 161 HD1 TYR A 12 21.623 3.154 3.177 1.00 0.00 H ATOM 162 HH TYR A 12 20.925 -1.333 3.073 1.00 0.00 H ATOM 163 H TYR A 12 26.122 3.205 1.751 1.00 0.00 H ATOM 164 N PHE A 13 23.723 6.701 2.680 1.00 11.83 N ATOM 165 CA PHE A 13 23.946 8.117 2.929 1.00 11.53 C ATOM 166 C PHE A 13 22.785 8.632 3.700 1.00 10.31 C ATOM 167 O PHE A 13 21.821 7.924 3.975 1.00 9.74 O ATOM 168 CB PHE A 13 24.009 8.893 1.566 1.00 11.27 C ATOM 169 CG PHE A 13 22.814 8.577 0.694 1.00 10.15 C ATOM 170 CD1 PHE A 13 21.628 9.228 0.869 1.00 8.83 C ATOM 171 CD2 PHE A 13 22.900 7.562 -0.257 1.00 10.73 C ATOM 172 CE1 PHE A 13 20.505 8.941 0.108 1.00 8.04 C ATOM 173 CE2 PHE A 13 21.780 7.255 -1.060 1.00 9.95 C ATOM 174 CZ PHE A 13 20.541 7.928 -0.859 1.00 8.58 C ATOM 175 HA PHE A 13 24.880 8.255 3.473 1.00 0.00 H ATOM 176 HB2 PHE A 13 24.027 9.964 1.768 1.00 0.00 H ATOM 177 HB3 PHE A 13 24.919 8.609 1.038 1.00 0.00 H ATOM 178 HD2 PHE A 13 23.830 7.006 -0.381 1.00 0.00 H ATOM 179 HE2 PHE A 13 21.864 6.498 -1.839 1.00 0.00 H ATOM 180 HZ PHE A 13 19.654 7.665 -1.436 1.00 0.00 H ATOM 181 HE1 PHE A 13 19.587 9.508 0.263 1.00 0.00 H ATOM 182 HD1 PHE A 13 21.561 10.001 1.634 1.00 0.00 H ATOM 183 H PHE A 13 22.751 6.331 2.682 1.00 0.00 H ATOM 184 N ARG A 14 22.885 9.913 4.091 1.00 10.17 N ATOM 185 CA ARG A 14 21.768 10.618 4.745 1.00 9.23 C ATOM 186 C ARG A 14 21.513 11.830 3.848 1.00 8.59 C ATOM 187 O ARG A 14 22.374 12.195 3.035 1.00 9.15 O ATOM 188 CB ARG A 14 22.152 11.070 6.152 1.00 10.10 C ATOM 189 CG ARG A 14 22.568 9.854 7.092 1.00 11.18 C ATOM 190 CD ARG A 14 22.752 10.284 8.522 1.00 12.21 C ATOM 191 NE ARG A 14 24.048 10.929 8.584 1.00 13.41 N ATOM 192 CZ ARG A 14 24.436 11.720 9.588 1.00 14.52 C ATOM 193 NH1 ARG A 14 23.602 11.972 10.631 1.00 16.39 N ATOM 194 NH2 ARG A 14 25.637 12.284 9.533 1.00 15.78 N ATOM 195 HA ARG A 14 20.890 9.982 4.858 1.00 0.00 H ATOM 196 HB2 ARG A 14 22.993 11.760 6.080 1.00 0.00 H ATOM 197 HB3 ARG A 14 21.300 11.582 6.599 1.00 0.00 H ATOM 198 HG2 ARG A 14 21.788 9.094 7.050 1.00 0.00 H ATOM 199 HG3 ARG A 14 23.505 9.432 6.728 1.00 0.00 H ATOM 200 HD2 ARG A 14 22.728 9.418 9.184 1.00 0.00 H ATOM 201 HD3 ARG A 14 21.967 10.983 8.811 1.00 0.00 H ATOM 202 HE ARG A 14 24.714 10.767 7.802 1.00 0.00 H ATOM 203 HH12 ARG A 14 23.913 12.589 11.408 1.00 0.00 H ATOM 204 HH11 ARG A 14 22.653 11.548 10.652 1.00 0.00 H ATOM 205 HH22 ARG A 14 25.957 12.903 10.305 1.00 0.00 H ATOM 206 HH21 ARG A 14 26.258 12.107 8.718 1.00 0.00 H ATOM 207 H ARG A 14 23.777 10.422 3.927 1.00 0.00 H ATOM 208 N LEU A 15 20.322 12.365 3.943 1.00 7.98 N ATOM 209 CA LEU A 15 19.934 13.503 3.160 1.00 7.19 C ATOM 210 C LEU A 15 19.806 14.708 4.052 1.00 7.45 C ATOM 211 O LEU A 15 18.814 14.827 4.778 1.00 7.12 O ATOM 212 CB LEU A 15 18.642 13.168 2.383 1.00 6.66 C ATOM 213 CG LEU A 15 18.828 12.195 1.212 1.00 6.26 C ATOM 214 CD1 LEU A 15 17.503 11.537 0.806 1.00 8.08 C ATOM 215 CD2 LEU A 15 19.463 12.942 0.006 1.00 8.11 C ATOM 216 HA LEU A 15 20.694 13.747 2.418 1.00 0.00 H ATOM 217 HB2 LEU A 15 17.931 12.726 3.081 1.00 0.00 H ATOM 218 HB3 LEU A 15 18.232 14.098 1.989 1.00 0.00 H ATOM 219 HG LEU A 15 19.498 11.398 1.534 1.00 0.00 H ATOM 220 HD21 LEU A 15 18.807 13.757 -0.301 1.00 0.00 H ATOM 221 HD22 LEU A 15 20.432 13.345 0.299 1.00 0.00 H ATOM 222 HD23 LEU A 15 19.593 12.246 -0.823 1.00 0.00 H ATOM 223 HD11 LEU A 15 17.100 10.982 1.653 1.00 0.00 H ATOM 224 HD12 LEU A 15 16.794 12.308 0.504 1.00 0.00 H ATOM 225 HD13 LEU A 15 17.677 10.855 -0.026 1.00 0.00 H ATOM 226 H LEU A 15 19.636 11.952 4.607 1.00 0.00 H ATOM 227 N LEU A 16 20.818 15.599 3.954 1.00 8.28 N ATOM 228 CA LEU A 16 20.865 16.791 4.802 1.00 8.89 C ATOM 229 C LEU A 16 20.178 17.918 4.061 1.00 8.49 C ATOM 230 O LEU A 16 20.514 18.180 2.896 1.00 8.53 O ATOM 231 CB LEU A 16 22.307 17.110 5.116 1.00 10.31 C ATOM 232 CG LEU A 16 22.542 18.457 5.852 1.00 11.33 C ATOM 233 CD1 LEU A 16 21.996 18.216 7.312 1.00 11.57 C ATOM 234 CD2 LEU A 16 23.989 18.743 5.861 1.00 12.88 C ATOM 235 HA LEU A 16 20.349 16.635 5.749 1.00 0.00 H ATOM 236 HB2 LEU A 16 22.701 16.310 5.743 1.00 0.00 H ATOM 237 HB3 LEU A 16 22.859 17.138 4.176 1.00 0.00 H ATOM 238 HG LEU A 16 22.045 19.306 5.382 1.00 0.00 H ATOM 239 HD21 LEU A 16 24.514 17.940 6.379 1.00 0.00 H ATOM 240 HD22 LEU A 16 24.351 18.812 4.835 1.00 0.00 H ATOM 241 HD23 LEU A 16 24.168 19.687 6.375 1.00 0.00 H ATOM 242 HD11 LEU A 16 20.938 17.959 7.265 1.00 0.00 H ATOM 243 HD12 LEU A 16 22.549 17.399 7.775 1.00 0.00 H ATOM 244 HD13 LEU A 16 22.125 19.124 7.901 1.00 0.00 H ATOM 245 H LEU A 16 21.578 15.434 3.263 1.00 0.00 H ATOM 246 N GLY A 17 19.334 18.663 4.772 1.00 8.49 N ATOM 247 CA GLY A 17 18.649 19.826 4.107 1.00 8.37 C ATOM 248 C GLY A 17 19.468 21.079 4.331 1.00 9.62 C ATOM 249 O GLY A 17 19.952 21.378 5.444 1.00 10.58 O ATOM 250 HA3 GLY A 17 17.655 19.958 4.535 1.00 0.00 H ATOM 251 HA2 GLY A 17 18.560 19.634 3.038 1.00 0.00 H ATOM 252 H GLY A 17 19.151 18.444 5.772 1.00 0.00 H ATOM 253 N PHE A 18 19.632 21.870 3.264 1.00 9.88 N ATOM 254 CA PHE A 18 20.235 23.176 3.401 1.00 11.23 C ATOM 255 C PHE A 18 19.545 24.053 4.458 1.00 11.79 C ATOM 256 O PHE A 18 20.198 24.585 5.317 1.00 13.03 O ATOM 257 CB PHE A 18 20.145 23.870 2.009 1.00 11.43 C ATOM 258 CG PHE A 18 20.639 25.306 2.053 1.00 13.01 C ATOM 259 CD1 PHE A 18 21.963 25.634 2.242 1.00 14.45 C ATOM 260 CD2 PHE A 18 19.699 26.339 2.035 1.00 13.28 C ATOM 261 CE1 PHE A 18 22.404 26.952 2.361 1.00 16.14 C ATOM 262 CE2 PHE A 18 20.118 27.649 2.105 1.00 14.91 C ATOM 263 CZ PHE A 18 21.503 27.977 2.289 1.00 16.39 C ATOM 264 HA PHE A 18 21.265 23.051 3.736 1.00 0.00 H ATOM 265 HB2 PHE A 18 20.752 23.311 1.297 1.00 0.00 H ATOM 266 HB3 PHE A 18 19.106 23.865 1.680 1.00 0.00 H ATOM 267 HD2 PHE A 18 18.636 26.109 1.966 1.00 0.00 H ATOM 268 HE2 PHE A 18 19.385 28.451 2.019 1.00 0.00 H ATOM 269 HZ PHE A 18 21.827 29.015 2.369 1.00 0.00 H ATOM 270 HE1 PHE A 18 23.463 27.163 2.511 1.00 0.00 H ATOM 271 HD1 PHE A 18 22.697 24.830 2.301 1.00 0.00 H ATOM 272 H PHE A 18 19.322 21.542 2.327 1.00 0.00 H ATOM 273 N ALA A 19 18.214 24.182 4.376 1.00 11.10 N ATOM 274 CA ALA A 19 17.536 25.161 5.225 1.00 12.00 C ATOM 275 C ALA A 19 17.413 24.664 6.715 1.00 12.37 C ATOM 276 O ALA A 19 17.304 25.481 7.606 1.00 13.68 O ATOM 277 CB ALA A 19 16.114 25.477 4.611 1.00 11.48 C ATOM 278 HA ALA A 19 18.133 26.073 5.252 1.00 0.00 H ATOM 279 HB1 ALA A 19 16.235 25.882 3.606 1.00 0.00 H ATOM 280 HB2 ALA A 19 15.527 24.560 4.566 1.00 0.00 H ATOM 281 HB3 ALA A 19 15.602 26.206 5.239 1.00 0.00 H ATOM 282 H ALA A 19 17.669 23.592 3.716 1.00 0.00 H ATOM 283 N SER A 20 17.282 23.342 6.883 1.00 11.37 N ATOM 284 CA SER A 20 16.982 22.772 8.184 1.00 11.80 C ATOM 285 C SER A 20 18.210 22.314 8.934 1.00 12.58 C ATOM 286 O SER A 20 18.190 22.228 10.153 1.00 13.65 O ATOM 287 CB SER A 20 16.070 21.548 7.988 1.00 10.55 C ATOM 288 OG SER A 20 16.744 20.603 7.173 1.00 9.57 O ATOM 289 HA SER A 20 16.506 23.558 8.771 1.00 0.00 H ATOM 290 HB2 SER A 20 15.143 21.855 7.504 1.00 0.00 H ATOM 291 HB3 SER A 20 15.842 21.101 8.956 1.00 0.00 H ATOM 292 HG SER A 20 16.165 19.811 7.041 1.00 0.00 H ATOM 293 H SER A 20 17.398 22.711 6.065 1.00 0.00 H ATOM 294 N ARG A 21 19.295 21.981 8.209 1.00 12.30 N ATOM 295 CA ARG A 21 20.494 21.384 8.844 1.00 13.17 C ATOM 296 C ARG A 21 20.047 20.097 9.574 1.00 12.77 C ATOM 297 O ARG A 21 20.674 19.719 10.576 1.00 13.93 O ATOM 298 CB ARG A 21 21.281 22.341 9.789 1.00 15.18 C ATOM 299 CG ARG A 21 22.752 21.931 9.930 1.00 16.23 C ATOM 300 CD ARG A 21 23.406 22.680 11.027 1.00 18.42 C ATOM 301 NE ARG A 21 22.857 22.400 12.365 1.00 19.19 N ATOM 302 CZ ARG A 21 23.269 21.414 13.162 1.00 23.86 C ATOM 303 NH1 ARG A 21 24.245 20.596 12.767 1.00 22.61 N ATOM 304 NH2 ARG A 21 22.756 21.290 14.403 1.00 23.06 N ATOM 305 HA ARG A 21 21.213 21.161 8.056 1.00 0.00 H ATOM 306 HB2 ARG A 21 21.235 23.352 9.384 1.00 0.00 H ATOM 307 HB3 ARG A 21 20.815 22.324 10.774 1.00 0.00 H ATOM 308 HG2 ARG A 21 22.806 20.864 10.144 1.00 0.00 H ATOM 309 HG3 ARG A 21 23.272 22.140 8.995 1.00 0.00 H ATOM 310 HD2 ARG A 21 23.293 23.746 10.828 1.00 0.00 H ATOM 311 HD3 ARG A 21 24.465 22.423 11.032 1.00 0.00 H ATOM 312 HE ARG A 21 22.094 23.015 12.712 1.00 0.00 H ATOM 313 HH12 ARG A 21 24.564 19.828 13.391 1.00 0.00 H ATOM 314 HH11 ARG A 21 24.687 20.726 11.835 1.00 0.00 H ATOM 315 HH22 ARG A 21 23.078 20.521 15.024 1.00 0.00 H ATOM 316 HH21 ARG A 21 22.039 21.964 14.739 1.00 0.00 H ATOM 317 H ARG A 21 19.292 22.146 7.182 1.00 0.00 H ATOM 318 N GLN A 22 19.018 19.405 9.078 1.00 11.39 N ATOM 319 CA GLN A 22 18.640 18.121 9.694 1.00 11.20 C ATOM 320 C GLN A 22 18.555 17.100 8.587 1.00 9.83 C ATOM 321 O GLN A 22 18.503 17.455 7.437 1.00 9.05 O ATOM 322 CB GLN A 22 17.252 18.229 10.342 1.00 11.32 C ATOM 323 CG GLN A 22 17.306 19.129 11.613 1.00 13.10 C ATOM 324 CD GLN A 22 15.895 19.700 11.891 1.00 15.16 C ATOM 325 OE1 GLN A 22 15.577 20.788 11.456 1.00 25.72 O ATOM 326 NE2 GLN A 22 15.039 18.902 12.488 1.00 15.17 N ATOM 327 HA GLN A 22 19.372 17.846 10.453 1.00 0.00 H ATOM 328 HB2 GLN A 22 16.555 18.663 9.625 1.00 0.00 H ATOM 329 HB3 GLN A 22 16.909 17.233 10.623 1.00 0.00 H ATOM 330 HG2 GLN A 22 17.635 18.536 12.467 1.00 0.00 H ATOM 331 HG3 GLN A 22 18.006 19.949 11.451 1.00 0.00 H ATOM 332 HE22 GLN A 22 15.353 17.978 12.846 1.00 0.00 H ATOM 333 HE21 GLN A 22 14.048 19.195 12.602 1.00 0.00 H ATOM 334 H GLN A 22 18.487 19.770 8.262 1.00 0.00 H ATOM 335 N VAL A 23 18.461 15.824 8.952 1.00 9.75 N ATOM 336 CA VAL A 23 18.399 14.774 7.959 1.00 8.74 C ATOM 337 C VAL A 23 17.047 14.101 7.958 1.00 8.11 C ATOM 338 O VAL A 23 16.358 14.085 8.979 1.00 8.74 O ATOM 339 CB VAL A 23 19.517 13.752 8.125 1.00 9.34 C ATOM 340 CG1 VAL A 23 20.970 14.420 7.798 1.00 10.12 C ATOM 341 CG2 VAL A 23 19.475 13.076 9.525 1.00 10.43 C ATOM 342 HA VAL A 23 18.544 15.250 6.989 1.00 0.00 H ATOM 343 HB VAL A 23 19.357 12.957 7.397 1.00 0.00 H ATOM 344 HG11 VAL A 23 20.978 14.785 6.771 1.00 0.00 H ATOM 345 HG12 VAL A 23 21.149 15.250 8.481 1.00 0.00 H ATOM 346 HG13 VAL A 23 21.750 13.669 7.924 1.00 0.00 H ATOM 347 HG21 VAL A 23 19.587 13.837 10.298 1.00 0.00 H ATOM 348 HG22 VAL A 23 18.521 12.565 9.652 1.00 0.00 H ATOM 349 HG23 VAL A 23 20.288 12.354 9.603 1.00 0.00 H ATOM 350 H VAL A 23 18.432 15.579 9.962 1.00 0.00 H ATOM 351 N ILE A 24 16.644 13.590 6.787 1.00 7.12 N ATOM 352 CA ILE A 24 15.358 12.847 6.715 1.00 6.74 C ATOM 353 C ILE A 24 15.496 11.542 7.541 1.00 7.40 C ATOM 354 O ILE A 24 16.596 10.946 7.544 1.00 7.73 O ATOM 355 CB ILE A 24 15.039 12.466 5.248 1.00 5.85 C ATOM 356 CG1 ILE A 24 14.931 13.756 4.413 1.00 7.18 C ATOM 357 CG2 ILE A 24 13.732 11.683 5.256 1.00 5.77 C ATOM 358 CD1 ILE A 24 14.604 13.548 2.992 1.00 4.92 C ATOM 359 HA ILE A 24 14.558 13.476 7.106 1.00 0.00 H ATOM 360 HB ILE A 24 15.821 11.850 4.804 1.00 0.00 H ATOM 361 HG12 ILE A 24 14.153 14.380 4.852 1.00 0.00 H ATOM 362 HG13 ILE A 24 15.887 14.277 4.468 1.00 0.00 H ATOM 363 HD11 ILE A 24 15.378 12.937 2.528 1.00 0.00 H ATOM 364 HD12 ILE A 24 13.643 13.041 2.912 1.00 0.00 H ATOM 365 HD13 ILE A 24 14.550 14.513 2.488 1.00 0.00 H ATOM 366 HG21 ILE A 24 13.850 10.788 5.867 1.00 0.00 H ATOM 367 HG22 ILE A 24 12.939 12.306 5.671 1.00 0.00 H ATOM 368 HG23 ILE A 24 13.475 11.397 4.236 1.00 0.00 H ATOM 369 H ILE A 24 17.227 13.712 5.934 1.00 0.00 H ATOM 370 N PHE A 25 14.468 11.207 8.328 1.00 7.92 N ATOM 371 CA PHE A 25 14.391 9.862 8.853 1.00 8.58 C ATOM 372 C PHE A 25 13.175 9.100 8.305 1.00 8.30 C ATOM 373 O PHE A 25 12.182 9.698 7.854 1.00 7.89 O ATOM 374 CB PHE A 25 14.427 9.831 10.336 1.00 10.02 C ATOM 375 CG PHE A 25 13.156 10.335 10.951 1.00 10.60 C ATOM 376 CD1 PHE A 25 11.999 9.485 11.062 1.00 11.08 C ATOM 377 CD2 PHE A 25 13.119 11.595 11.522 1.00 11.10 C ATOM 378 CE1 PHE A 25 10.857 9.907 11.691 1.00 12.04 C ATOM 379 CE2 PHE A 25 11.945 12.041 12.047 1.00 11.91 C ATOM 380 CZ PHE A 25 10.817 11.192 12.166 1.00 12.45 C ATOM 381 HA PHE A 25 15.284 9.345 8.503 1.00 0.00 H ATOM 382 HB2 PHE A 25 14.589 8.803 10.661 1.00 0.00 H ATOM 383 HB3 PHE A 25 15.253 10.454 10.679 1.00 0.00 H ATOM 384 HD2 PHE A 25 14.013 12.218 11.551 1.00 0.00 H ATOM 385 HE2 PHE A 25 11.871 13.075 12.384 1.00 0.00 H ATOM 386 HZ PHE A 25 9.909 11.564 12.640 1.00 0.00 H ATOM 387 HE1 PHE A 25 10.004 9.239 11.810 1.00 0.00 H ATOM 388 HD1 PHE A 25 12.032 8.482 10.636 1.00 0.00 H ATOM 389 H PHE A 25 13.733 11.905 8.560 1.00 0.00 H ATOM 390 N ALA A 26 13.343 7.770 8.281 1.00 8.69 N ATOM 391 CA ALA A 26 12.220 6.837 7.943 1.00 8.90 C ATOM 392 C ALA A 26 12.383 5.684 8.957 1.00 10.29 C ATOM 393 O ALA A 26 13.407 4.958 8.942 1.00 10.57 O ATOM 394 CB ALA A 26 12.372 6.322 6.564 1.00 8.11 C ATOM 395 HA ALA A 26 11.243 7.318 7.994 1.00 0.00 H ATOM 396 HB1 ALA A 26 12.363 7.157 5.863 1.00 0.00 H ATOM 397 HB2 ALA A 26 13.317 5.785 6.480 1.00 0.00 H ATOM 398 HB3 ALA A 26 11.547 5.646 6.337 1.00 0.00 H ATOM 399 H ALA A 26 14.279 7.375 8.503 1.00 0.00 H ATOM 400 N ARG A 27 11.378 5.472 9.807 1.00 11.42 N ATOM 401 CA ARG A 27 11.515 4.538 10.970 1.00 13.15 C ATOM 402 C ARG A 27 10.257 3.714 11.118 1.00 14.24 C ATOM 403 O ARG A 27 9.284 3.939 10.378 1.00 13.69 O ATOM 404 CB ARG A 27 11.799 5.280 12.304 1.00 14.24 C ATOM 405 CG ARG A 27 10.657 6.232 12.677 1.00 14.60 C ATOM 406 CD ARG A 27 11.095 7.044 13.941 1.00 15.84 C ATOM 407 NE ARG A 27 10.001 7.982 14.261 1.00 16.39 N ATOM 408 CZ ARG A 27 10.193 9.202 14.785 1.00 23.64 C ATOM 409 NH1 ARG A 27 11.412 9.576 15.135 1.00 21.46 N ATOM 410 NH2 ARG A 27 9.164 10.022 14.999 1.00 19.11 N ATOM 411 HA ARG A 27 12.371 3.896 10.761 1.00 0.00 H ATOM 412 HB2 ARG A 27 11.920 4.544 13.099 1.00 0.00 H ATOM 413 HB3 ARG A 27 12.719 5.855 12.200 1.00 0.00 H ATOM 414 HG2 ARG A 27 10.459 6.914 11.850 1.00 0.00 H ATOM 415 HG3 ARG A 27 9.756 5.660 12.899 1.00 0.00 H ATOM 416 HD2 ARG A 27 12.011 7.596 13.731 1.00 0.00 H ATOM 417 HD3 ARG A 27 11.264 6.368 14.779 1.00 0.00 H ATOM 418 HE ARG A 27 9.025 7.680 14.069 1.00 0.00 H ATOM 419 HH12 ARG A 27 11.570 10.520 15.542 1.00 0.00 H ATOM 420 HH11 ARG A 27 12.213 8.926 15.003 1.00 0.00 H ATOM 421 HH22 ARG A 27 9.327 10.965 15.406 1.00 0.00 H ATOM 422 HH21 ARG A 27 8.199 9.719 14.759 1.00 0.00 H ATOM 423 H ARG A 27 10.476 5.968 9.659 1.00 0.00 H ATOM 424 N ASN A 28 10.303 2.700 11.989 1.00 15.96 N ATOM 425 CA ASN A 28 9.175 1.875 12.227 1.00 17.40 C ATOM 426 C ASN A 28 8.267 2.563 13.215 1.00 18.71 C ATOM 427 O ASN A 28 7.053 2.534 13.092 1.00 19.39 O ATOM 428 CB ASN A 28 9.608 0.470 12.770 1.00 19.07 C ATOM 429 CG ASN A 28 8.407 -0.422 13.065 1.00 20.93 C ATOM 430 OD1 ASN A 28 7.724 -0.900 12.117 1.00 21.33 O ATOM 431 ND2 ASN A 28 8.112 -0.608 14.283 1.00 23.04 N ATOM 432 HA ASN A 28 8.646 1.715 11.288 1.00 0.00 H ATOM 433 HB2 ASN A 28 10.235 -0.018 12.024 1.00 0.00 H ATOM 434 HB3 ASN A 28 10.179 0.608 13.688 1.00 0.00 H ATOM 435 HD22 ASN A 28 8.705 -0.194 15.031 1.00 0.00 H ATOM 436 HD21 ASN A 28 7.277 -1.175 14.535 1.00 0.00 H ATOM 437 H ASN A 28 11.187 2.512 12.504 1.00 0.00 H ATOM 438 N SER A 29 8.904 3.164 14.237 1.00 19.39 N ATOM 439 CA SER A 29 8.207 3.782 15.346 1.00 21.13 C ATOM 440 C SER A 29 9.223 4.728 16.032 1.00 23.13 C ATOM 441 O SER A 29 10.463 4.609 15.809 1.00 21.92 O ATOM 442 CB SER A 29 7.743 2.698 16.316 1.00 23.80 C ATOM 443 OG SER A 29 8.836 2.090 17.000 1.00 24.73 O ATOM 444 HA SER A 29 7.328 4.336 15.016 1.00 0.00 H ATOM 445 HB2 SER A 29 7.207 1.931 15.757 1.00 0.00 H ATOM 446 HB3 SER A 29 7.073 3.146 17.050 1.00 0.00 H ATOM 447 HG SER A 29 9.447 1.675 16.341 1.00 0.00 H ATOM 448 H SER A 29 9.944 3.186 14.230 1.00 0.00 H ATOM 449 N PRO A 30 8.724 5.723 16.808 1.00 23.63 N ATOM 450 CA PRO A 30 7.293 6.038 17.033 1.00 24.19 C ATOM 451 C PRO A 30 6.764 6.833 15.804 1.00 21.32 C ATOM 452 O PRO A 30 7.475 7.050 14.824 1.00 19.08 O ATOM 453 CB PRO A 30 7.348 6.938 18.269 1.00 25.31 C ATOM 454 CG PRO A 30 8.677 7.735 18.047 1.00 25.39 C ATOM 455 CD PRO A 30 9.632 6.738 17.435 1.00 23.81 C ATOM 456 HA PRO A 30 6.646 5.171 17.164 1.00 0.00 H ATOM 457 HD3 PRO A 30 10.263 7.213 16.684 1.00 0.00 H ATOM 458 HD2 PRO A 30 10.260 6.280 18.199 1.00 0.00 H ATOM 459 HG3 PRO A 30 9.065 8.105 18.996 1.00 0.00 H ATOM 460 HG2 PRO A 30 8.513 8.574 17.371 1.00 0.00 H ATOM 461 HB2 PRO A 30 6.489 7.607 18.308 1.00 0.00 H ATOM 462 HB3 PRO A 30 7.390 6.348 19.185 1.00 0.00 H ATOM 463 N SER A 31 5.510 7.273 15.906 1.00 22.40 N ATOM 464 CA SER A 31 4.858 8.105 14.896 1.00 21.04 C ATOM 465 C SER A 31 5.351 9.576 15.139 1.00 21.09 C ATOM 466 O SER A 31 5.536 9.929 16.317 1.00 23.77 O ATOM 467 CB SER A 31 3.345 8.037 15.219 1.00 25.18 C ATOM 468 OG SER A 31 2.646 8.824 14.261 1.00 34.19 O ATOM 469 HA SER A 31 5.069 7.791 13.874 1.00 0.00 H ATOM 470 HB2 SER A 31 3.164 8.428 16.220 1.00 0.00 H ATOM 471 HB3 SER A 31 3.003 7.003 15.167 1.00 0.00 H ATOM 472 HG SER A 31 1.675 8.791 14.454 1.00 0.00 H ATOM 473 H SER A 31 4.965 7.010 16.752 1.00 0.00 H ATOM 474 N PRO A 32 5.481 10.408 14.085 1.00 20.84 N ATOM 475 CA PRO A 32 5.326 9.997 12.674 1.00 18.06 C ATOM 476 C PRO A 32 6.464 9.151 12.193 1.00 17.74 C ATOM 477 O PRO A 32 7.603 9.279 12.702 1.00 18.02 O ATOM 478 CB PRO A 32 5.424 11.327 11.880 1.00 18.62 C ATOM 479 CG PRO A 32 6.312 12.212 12.885 1.00 17.44 C ATOM 480 CD PRO A 32 5.848 11.850 14.223 1.00 22.45 C ATOM 481 HA PRO A 32 4.403 9.430 12.553 1.00 0.00 H ATOM 482 HD3 PRO A 32 6.640 11.982 14.960 1.00 0.00 H ATOM 483 HD2 PRO A 32 4.983 12.447 14.511 1.00 0.00 H ATOM 484 HG3 PRO A 32 6.155 13.275 12.700 1.00 0.00 H ATOM 485 HG2 PRO A 32 7.370 11.976 12.770 1.00 0.00 H ATOM 486 HB2 PRO A 32 5.923 11.186 10.921 1.00 0.00 H ATOM 487 HB3 PRO A 32 4.442 11.770 11.716 1.00 0.00 H ATOM 488 N ASP A 33 6.227 8.367 11.136 1.00 14.38 N ATOM 489 CA ASP A 33 7.257 7.406 10.730 1.00 13.48 C ATOM 490 C ASP A 33 8.257 7.998 9.756 1.00 11.56 C ATOM 491 O ASP A 33 9.228 7.353 9.401 1.00 10.93 O ATOM 492 CB ASP A 33 6.686 6.030 10.324 1.00 14.03 C ATOM 493 CG ASP A 33 5.919 6.042 8.982 1.00 13.20 C ATOM 494 OD1 ASP A 33 6.360 6.593 8.034 1.00 11.71 O ATOM 495 OD2 ASP A 33 4.834 5.444 8.893 1.00 21.07 O ATOM 496 HA ASP A 33 7.843 7.186 11.622 1.00 0.00 H ATOM 497 HB2 ASP A 33 7.514 5.326 10.240 1.00 0.00 H ATOM 498 HB3 ASP A 33 6.004 5.696 11.106 1.00 0.00 H ATOM 499 H ASP A 33 5.331 8.437 10.613 1.00 0.00 H ATOM 500 N VAL A 34 7.987 9.221 9.251 1.00 10.83 N ATOM 501 CA VAL A 34 9.012 9.978 8.471 1.00 9.36 C ATOM 502 C VAL A 34 9.091 11.370 9.125 1.00 9.72 C ATOM 503 O VAL A 34 8.113 11.830 9.728 1.00 10.81 O ATOM 504 CB VAL A 34 8.791 10.065 6.943 1.00 8.18 C ATOM 505 CG1 VAL A 34 8.791 8.634 6.349 1.00 8.23 C ATOM 506 CG2 VAL A 34 7.505 10.842 6.528 1.00 8.44 C ATOM 507 HA VAL A 34 9.953 9.430 8.521 1.00 0.00 H ATOM 508 HB VAL A 34 9.616 10.647 6.533 1.00 0.00 H ATOM 509 HG11 VAL A 34 9.749 8.156 6.555 1.00 0.00 H ATOM 510 HG12 VAL A 34 7.989 8.053 6.804 1.00 0.00 H ATOM 511 HG13 VAL A 34 8.636 8.689 5.272 1.00 0.00 H ATOM 512 HG21 VAL A 34 6.631 10.347 6.951 1.00 0.00 H ATOM 513 HG22 VAL A 34 7.563 11.864 6.903 1.00 0.00 H ATOM 514 HG23 VAL A 34 7.425 10.856 5.441 1.00 0.00 H ATOM 515 H VAL A 34 7.050 9.643 9.408 1.00 0.00 H ATOM 516 N GLY A 35 10.207 12.043 8.854 1.00 8.93 N ATOM 517 CA GLY A 35 10.305 13.446 9.331 1.00 9.35 C ATOM 518 C GLY A 35 11.781 13.822 9.222 1.00 8.84 C ATOM 519 O GLY A 35 12.554 13.242 8.412 1.00 7.95 O ATOM 520 HA3 GLY A 35 9.970 13.519 10.366 1.00 0.00 H ATOM 521 HA2 GLY A 35 9.699 14.102 8.707 1.00 0.00 H ATOM 522 H GLY A 35 10.985 11.600 8.325 1.00 0.00 H ATOM 523 N LEU A 36 12.088 14.850 10.008 1.00 9.68 N ATOM 524 CA LEU A 36 13.500 15.293 10.151 1.00 9.74 C ATOM 525 C LEU A 36 14.038 14.988 11.538 1.00 11.21 C ATOM 526 O LEU A 36 13.313 15.110 12.521 1.00 12.48 O ATOM 527 CB LEU A 36 13.636 16.782 9.918 1.00 9.85 C ATOM 528 CG LEU A 36 13.101 17.351 8.587 1.00 8.78 C ATOM 529 CD1 LEU A 36 13.343 18.884 8.528 1.00 10.48 C ATOM 530 CD2 LEU A 36 13.519 16.586 7.331 1.00 9.16 C ATOM 531 HA LEU A 36 14.071 14.745 9.402 1.00 0.00 H ATOM 532 HB2 LEU A 36 13.106 17.288 10.725 1.00 0.00 H ATOM 533 HB3 LEU A 36 14.697 17.025 9.973 1.00 0.00 H ATOM 534 HG LEU A 36 12.023 17.187 8.583 1.00 0.00 H ATOM 535 HD21 LEU A 36 14.606 16.586 7.252 1.00 0.00 H ATOM 536 HD22 LEU A 36 13.158 15.560 7.395 1.00 0.00 H ATOM 537 HD23 LEU A 36 13.090 17.069 6.453 1.00 0.00 H ATOM 538 HD11 LEU A 36 12.825 19.365 9.358 1.00 0.00 H ATOM 539 HD12 LEU A 36 14.412 19.085 8.600 1.00 0.00 H ATOM 540 HD13 LEU A 36 12.962 19.275 7.585 1.00 0.00 H ATOM 541 H LEU A 36 11.336 15.347 10.526 1.00 0.00 H ATOM 542 N SER A 37 15.339 14.643 11.603 1.00 11.30 N ATOM 543 CA SER A 37 15.987 14.452 12.914 1.00 12.98 C ATOM 544 C SER A 37 17.460 15.048 12.929 1.00 13.45 C ATOM 545 O SER A 37 17.999 15.363 11.852 1.00 12.38 O ATOM 546 CB SER A 37 15.888 12.993 13.357 1.00 13.44 C ATOM 547 OG SER A 37 16.519 12.150 12.407 1.00 12.34 O ATOM 548 HA SER A 37 15.447 15.027 13.667 1.00 0.00 H ATOM 549 HB2 SER A 37 14.838 12.714 13.446 1.00 0.00 H ATOM 550 HB3 SER A 37 16.377 12.876 14.324 1.00 0.00 H ATOM 551 HG SER A 37 16.448 11.208 12.705 1.00 0.00 H ATOM 552 H SER A 37 15.886 14.511 10.728 1.00 0.00 H ATOM 553 N PRO A 38 18.064 15.129 14.103 1.00 15.24 N ATOM 554 CA PRO A 38 19.380 15.853 14.262 1.00 16.17 C ATOM 555 C PRO A 38 20.510 15.138 13.503 1.00 17.18 C ATOM 556 O PRO A 38 20.755 13.941 13.722 1.00 16.04 O ATOM 557 CB PRO A 38 19.618 15.875 15.776 1.00 19.32 C ATOM 558 CG PRO A 38 18.190 15.891 16.365 1.00 18.87 C ATOM 559 CD PRO A 38 17.374 15.006 15.419 1.00 16.93 C ATOM 560 HA PRO A 38 19.360 16.858 13.842 1.00 0.00 H ATOM 561 HD3 PRO A 38 17.377 13.971 15.761 1.00 0.00 H ATOM 562 HD2 PRO A 38 16.346 15.361 15.350 1.00 0.00 H ATOM 563 HG3 PRO A 38 17.792 16.906 16.383 1.00 0.00 H ATOM 564 HG2 PRO A 38 18.185 15.482 17.375 1.00 0.00 H ATOM 565 HB2 PRO A 38 20.163 14.988 16.098 1.00 0.00 H ATOM 566 HB3 PRO A 38 20.172 16.767 16.071 1.00 0.00 H ATOM 567 N VAL A 39 21.267 15.895 12.706 1.00 15.27 N ATOM 568 CA VAL A 39 22.442 15.342 12.011 1.00 17.14 C ATOM 569 C VAL A 39 23.343 14.650 12.978 1.00 17.03 C ATOM 570 O VAL A 39 23.938 13.650 12.608 1.00 17.03 O ATOM 571 CB VAL A 39 23.446 16.375 11.383 1.00 20.61 C ATOM 572 CG1 VAL A 39 23.784 15.994 9.969 1.00 17.43 C ATOM 573 CG2 VAL A 39 23.160 17.809 11.682 1.00 23.97 C ATOM 574 HA VAL A 39 21.966 14.734 11.241 1.00 0.00 H ATOM 575 HB VAL A 39 24.393 16.297 11.916 1.00 0.00 H ATOM 576 HG11 VAL A 39 24.243 15.005 9.960 1.00 0.00 H ATOM 577 HG12 VAL A 39 22.873 15.978 9.371 1.00 0.00 H ATOM 578 HG13 VAL A 39 24.480 16.723 9.554 1.00 0.00 H ATOM 579 HG21 VAL A 39 22.172 18.068 11.302 1.00 0.00 H ATOM 580 HG22 VAL A 39 23.189 17.967 12.760 1.00 0.00 H ATOM 581 HG23 VAL A 39 23.911 18.436 11.202 1.00 0.00 H ATOM 582 H VAL A 39 21.022 16.897 12.573 1.00 0.00 H ATOM 583 N ASN A 40 23.481 15.144 14.195 1.00 18.79 N ATOM 584 CA ASN A 40 24.536 14.583 15.019 1.00 20.83 C ATOM 585 C ASN A 40 24.290 13.132 15.442 1.00 21.05 C ATOM 586 O ASN A 40 25.255 12.384 15.760 1.00 23.47 O ATOM 587 CB ASN A 40 24.878 15.565 16.161 1.00 26.52 C ATOM 588 CG ASN A 40 25.688 16.813 15.605 1.00 33.82 C ATOM 589 OD1 ASN A 40 26.896 16.681 15.293 1.00 43.66 O ATOM 590 ND2 ASN A 40 25.010 18.012 15.434 1.00 39.70 N ATOM 591 HA ASN A 40 25.437 14.482 14.413 1.00 0.00 H ATOM 592 HB2 ASN A 40 23.954 15.914 16.622 1.00 0.00 H ATOM 593 HB3 ASN A 40 25.482 15.050 16.907 1.00 0.00 H ATOM 594 HD22 ASN A 40 24.008 18.086 15.704 1.00 0.00 H ATOM 595 HD21 ASN A 40 25.504 18.836 15.036 1.00 0.00 H ATOM 596 H ASN A 40 22.861 15.901 14.547 1.00 0.00 H ATOM 597 N ASP A 41 23.024 12.701 15.360 1.00 19.91 N ATOM 598 CA ASP A 41 22.597 11.404 15.976 1.00 20.38 C ATOM 599 C ASP A 41 23.146 10.201 15.219 1.00 19.86 C ATOM 600 O ASP A 41 23.577 9.247 15.844 1.00 21.45 O ATOM 601 CB ASP A 41 21.053 11.385 15.950 1.00 20.35 C ATOM 602 CG ASP A 41 20.456 12.288 17.033 1.00 21.91 C ATOM 603 OD1 ASP A 41 21.200 12.972 17.792 1.00 27.04 O ATOM 604 OD2 ASP A 41 19.219 12.272 17.132 1.00 26.75 O ATOM 605 HA ASP A 41 22.986 11.334 16.992 1.00 0.00 H ATOM 606 HB2 ASP A 41 20.712 11.731 14.974 1.00 0.00 H ATOM 607 HB3 ASP A 41 20.709 10.363 16.113 1.00 0.00 H ATOM 608 H ASP A 41 22.322 13.280 14.857 1.00 0.00 H ATOM 609 N GLN A 42 23.201 10.296 13.901 1.00 18.09 N ATOM 610 CA GLN A 42 23.709 9.216 13.004 1.00 17.65 C ATOM 611 C GLN A 42 23.011 7.895 13.298 1.00 17.76 C ATOM 612 O GLN A 42 23.671 6.820 13.416 1.00 18.91 O ATOM 613 CB GLN A 42 25.244 9.082 13.181 1.00 19.45 C ATOM 614 CG GLN A 42 25.952 10.350 12.705 1.00 19.43 C ATOM 615 CD GLN A 42 27.368 10.408 13.222 1.00 21.77 C ATOM 616 OE1 GLN A 42 28.259 9.844 12.602 1.00 22.90 O ATOM 617 NE2 GLN A 42 27.604 11.065 14.392 1.00 24.53 N ATOM 618 HA GLN A 42 23.491 9.479 11.969 1.00 0.00 H ATOM 619 HB2 GLN A 42 25.471 8.919 14.235 1.00 0.00 H ATOM 620 HB3 GLN A 42 25.600 8.232 12.598 1.00 0.00 H ATOM 621 HG2 GLN A 42 25.970 10.360 11.615 1.00 0.00 H ATOM 622 HG3 GLN A 42 25.405 11.221 13.066 1.00 0.00 H ATOM 623 HE22 GLN A 42 26.822 11.534 14.892 1.00 0.00 H ATOM 624 HE21 GLN A 42 28.566 11.098 14.785 1.00 0.00 H ATOM 625 H GLN A 42 22.870 11.179 13.462 1.00 0.00 H ATOM 626 N ALA A 43 21.681 8.022 13.469 1.00 16.88 N ATOM 627 CA ALA A 43 20.881 6.861 13.817 1.00 17.21 C ATOM 628 C ALA A 43 20.566 6.103 12.514 1.00 15.73 C ATOM 629 O ALA A 43 20.505 6.693 11.445 1.00 14.22 O ATOM 630 CB ALA A 43 19.583 7.293 14.560 1.00 17.31 C ATOM 631 HA ALA A 43 21.426 6.207 14.498 1.00 0.00 H ATOM 632 HB1 ALA A 43 19.849 7.826 15.473 1.00 0.00 H ATOM 633 HB2 ALA A 43 18.996 7.946 13.914 1.00 0.00 H ATOM 634 HB3 ALA A 43 18.998 6.408 14.812 1.00 0.00 H ATOM 635 H ALA A 43 21.227 8.951 13.352 1.00 0.00 H ATOM 636 N THR A 44 20.417 4.792 12.636 1.00 16.46 N ATOM 637 CA THR A 44 20.230 3.938 11.465 1.00 15.54 C ATOM 638 C THR A 44 19.060 4.431 10.566 1.00 13.67 C ATOM 639 O THR A 44 19.095 4.364 9.294 1.00 12.56 O ATOM 640 CB THR A 44 19.993 2.490 11.927 1.00 16.89 C ATOM 641 OG1 THR A 44 21.087 2.038 12.721 1.00 18.92 O ATOM 642 CG2 THR A 44 19.809 1.591 10.611 1.00 18.64 C ATOM 643 HA THR A 44 21.133 3.984 10.857 1.00 0.00 H ATOM 644 HB THR A 44 19.101 2.419 12.550 1.00 0.00 H ATOM 645 HG1 THR A 44 21.179 2.620 13.516 1.00 0.00 H ATOM 646 HG23 THR A 44 18.966 1.966 10.031 1.00 0.00 H ATOM 647 HG21 THR A 44 20.716 1.641 10.009 1.00 0.00 H ATOM 648 HG22 THR A 44 19.621 0.558 10.902 1.00 0.00 H ATOM 649 H THR A 44 20.433 4.363 13.583 1.00 0.00 H ATOM 650 N ASP A 45 18.031 4.961 11.219 1.00 13.58 N ATOM 651 CA ASP A 45 16.812 5.372 10.481 1.00 12.19 C ATOM 652 C ASP A 45 17.003 6.678 9.732 1.00 10.88 C ATOM 653 O ASP A 45 16.110 7.085 8.974 1.00 9.79 O ATOM 654 CB ASP A 45 15.603 5.423 11.403 1.00 12.89 C ATOM 655 CG ASP A 45 15.682 6.534 12.479 1.00 13.63 C ATOM 656 OD1 ASP A 45 16.514 7.472 12.367 1.00 13.25 O ATOM 657 OD2 ASP A 45 14.930 6.395 13.468 1.00 14.89 O ATOM 658 HA ASP A 45 16.623 4.609 9.726 1.00 0.00 H ATOM 659 HB2 ASP A 45 14.715 5.595 10.796 1.00 0.00 H ATOM 660 HB3 ASP A 45 15.515 4.461 11.908 1.00 0.00 H ATOM 661 H ASP A 45 18.081 5.088 12.250 1.00 0.00 H ATOM 662 N GLN A 46 18.200 7.264 9.872 1.00 11.20 N ATOM 663 CA GLN A 46 18.559 8.379 8.947 1.00 10.15 C ATOM 664 C GLN A 46 19.237 7.919 7.654 1.00 9.67 C ATOM 665 O GLN A 46 19.498 8.737 6.767 1.00 8.99 O ATOM 666 CB GLN A 46 19.535 9.348 9.662 1.00 11.00 C ATOM 667 CG GLN A 46 18.929 9.971 10.914 1.00 11.76 C ATOM 668 CD GLN A 46 19.906 10.761 11.742 1.00 13.03 C ATOM 669 OE1 GLN A 46 21.100 10.586 11.622 1.00 13.68 O ATOM 670 NE2 GLN A 46 19.380 11.679 12.582 1.00 13.63 N ATOM 671 HA GLN A 46 17.617 8.857 8.679 1.00 0.00 H ATOM 672 HB2 GLN A 46 20.431 8.796 9.945 1.00 0.00 H ATOM 673 HB3 GLN A 46 19.805 10.146 8.970 1.00 0.00 H ATOM 674 HG2 GLN A 46 18.122 10.637 10.609 1.00 0.00 H ATOM 675 HG3 GLN A 46 18.524 9.171 11.533 1.00 0.00 H ATOM 676 HE22 GLN A 46 18.348 11.791 12.649 1.00 0.00 H ATOM 677 HE21 GLN A 46 20.007 12.273 13.161 1.00 0.00 H ATOM 678 H GLN A 46 18.864 6.949 10.608 1.00 0.00 H ATOM 679 N TYR A 47 19.493 6.624 7.521 1.00 10.24 N ATOM 680 CA TYR A 47 20.258 6.148 6.351 1.00 10.24 C ATOM 681 C TYR A 47 19.407 5.613 5.248 1.00 9.44 C ATOM 682 O TYR A 47 18.414 4.891 5.509 1.00 9.41 O ATOM 683 CB TYR A 47 21.336 5.145 6.775 1.00 11.78 C ATOM 684 CG TYR A 47 22.417 5.796 7.553 1.00 12.78 C ATOM 685 CD1 TYR A 47 22.303 5.974 8.944 1.00 13.58 C ATOM 686 CD2 TYR A 47 23.621 6.248 6.903 1.00 13.31 C ATOM 687 CE1 TYR A 47 23.285 6.627 9.662 1.00 14.73 C ATOM 688 CE2 TYR A 47 24.632 6.879 7.650 1.00 16.58 C ATOM 689 CZ TYR A 47 24.452 7.079 9.021 1.00 15.19 C ATOM 690 OH TYR A 47 25.497 7.664 9.760 1.00 22.30 O ATOM 691 HA TYR A 47 20.748 7.027 5.931 1.00 0.00 H ATOM 692 HB3 TYR A 47 21.767 4.691 5.883 1.00 0.00 H ATOM 693 HB2 TYR A 47 20.876 4.371 7.389 1.00 0.00 H ATOM 694 HD2 TYR A 47 23.748 6.101 5.831 1.00 0.00 H ATOM 695 HE2 TYR A 47 25.549 7.210 7.163 1.00 0.00 H ATOM 696 HE1 TYR A 47 23.155 6.793 10.731 1.00 0.00 H ATOM 697 HD1 TYR A 47 21.425 5.590 9.463 1.00 0.00 H ATOM 698 HH TYR A 47 26.306 7.097 9.692 1.00 0.00 H ATOM 699 H TYR A 47 19.157 5.948 8.236 1.00 0.00 H ATOM 700 N PHE A 48 19.805 5.943 4.007 1.00 9.08 N ATOM 701 CA PHE A 48 19.073 5.485 2.811 1.00 8.58 C ATOM 702 C PHE A 48 20.099 5.019 1.762 1.00 9.40 C ATOM 703 O PHE A 48 21.270 5.291 1.880 1.00 10.15 O ATOM 704 CB PHE A 48 18.250 6.644 2.188 1.00 7.45 C ATOM 705 CG PHE A 48 17.191 7.149 3.067 1.00 6.89 C ATOM 706 CD1 PHE A 48 17.476 8.112 4.054 1.00 6.91 C ATOM 707 CD2 PHE A 48 15.923 6.587 3.017 1.00 6.69 C ATOM 708 CE1 PHE A 48 16.432 8.598 4.945 1.00 6.71 C ATOM 709 CE2 PHE A 48 14.873 7.038 3.937 1.00 6.52 C ATOM 710 CZ PHE A 48 15.158 8.043 4.881 1.00 6.91 C ATOM 711 HA PHE A 48 18.398 4.680 3.101 1.00 0.00 H ATOM 712 HB2 PHE A 48 18.929 7.465 1.959 1.00 0.00 H ATOM 713 HB3 PHE A 48 17.792 6.285 1.266 1.00 0.00 H ATOM 714 HD2 PHE A 48 15.706 5.805 2.289 1.00 0.00 H ATOM 715 HE2 PHE A 48 13.877 6.597 3.890 1.00 0.00 H ATOM 716 HZ PHE A 48 14.380 8.387 5.562 1.00 0.00 H ATOM 717 HE1 PHE A 48 16.648 9.393 5.659 1.00 0.00 H ATOM 718 HD1 PHE A 48 18.491 8.498 4.152 1.00 0.00 H ATOM 719 H PHE A 48 20.651 6.536 3.887 1.00 0.00 H ATOM 720 N SER A 49 19.621 4.230 0.772 1.00 9.54 N ATOM 721 CA SER A 49 20.449 4.023 -0.440 1.00 10.42 C ATOM 722 C SER A 49 19.486 4.180 -1.635 1.00 9.90 C ATOM 723 O SER A 49 18.301 4.352 -1.460 1.00 8.99 O ATOM 724 CB SER A 49 21.046 2.614 -0.448 1.00 11.90 C ATOM 725 OG SER A 49 19.997 1.587 -0.398 1.00 11.88 O ATOM 726 HA SER A 49 21.276 4.732 -0.479 1.00 0.00 H ATOM 727 HB2 SER A 49 21.697 2.499 0.419 1.00 0.00 H ATOM 728 HB3 SER A 49 21.630 2.481 -1.359 1.00 0.00 H ATOM 729 HG SER A 49 19.466 1.699 0.430 1.00 0.00 H ATOM 730 H SER A 49 18.689 3.777 0.860 1.00 0.00 H ATOM 731 N LEU A 50 20.059 4.208 -2.824 1.00 10.74 N ATOM 732 CA LEU A 50 19.228 4.507 -4.012 1.00 10.52 C ATOM 733 C LEU A 50 18.925 3.242 -4.739 1.00 11.60 C ATOM 734 O LEU A 50 19.783 2.307 -4.823 1.00 12.97 O ATOM 735 CB LEU A 50 19.991 5.404 -5.012 1.00 11.16 C ATOM 736 CG LEU A 50 20.216 6.834 -4.445 1.00 10.25 C ATOM 737 CD1 LEU A 50 21.114 7.563 -5.470 1.00 11.37 C ATOM 738 CD2 LEU A 50 18.964 7.611 -4.179 1.00 8.83 C ATOM 739 HA LEU A 50 18.325 5.005 -3.659 1.00 0.00 H ATOM 740 HB2 LEU A 50 20.960 4.952 -5.225 1.00 0.00 H ATOM 741 HB3 LEU A 50 19.414 5.476 -5.934 1.00 0.00 H ATOM 742 HG LEU A 50 20.679 6.752 -3.461 1.00 0.00 H ATOM 743 HD21 LEU A 50 18.405 7.726 -5.108 1.00 0.00 H ATOM 744 HD22 LEU A 50 18.354 7.077 -3.450 1.00 0.00 H ATOM 745 HD23 LEU A 50 19.224 8.594 -3.786 1.00 0.00 H ATOM 746 HD11 LEU A 50 22.057 7.026 -5.571 1.00 0.00 H ATOM 747 HD12 LEU A 50 20.608 7.597 -6.435 1.00 0.00 H ATOM 748 HD13 LEU A 50 21.308 8.578 -5.124 1.00 0.00 H ATOM 749 H LEU A 50 21.077 4.023 -2.924 1.00 0.00 H ATOM 750 N ILE A 51 17.724 3.236 -5.352 1.00 11.25 N ATOM 751 CA ILE A 51 17.441 2.205 -6.338 1.00 12.60 C ATOM 752 C ILE A 51 17.406 2.919 -7.683 1.00 13.16 C ATOM 753 O ILE A 51 16.687 3.914 -7.826 1.00 12.20 O ATOM 754 CB ILE A 51 16.007 1.590 -6.062 1.00 12.22 C ATOM 755 CG1 ILE A 51 15.953 1.046 -4.648 1.00 11.74 C ATOM 756 CG2 ILE A 51 15.740 0.497 -7.135 1.00 13.93 C ATOM 757 CD1 ILE A 51 14.598 0.330 -4.272 1.00 13.31 C ATOM 758 HA ILE A 51 18.183 1.407 -6.307 1.00 0.00 H ATOM 759 HB ILE A 51 15.225 2.345 -6.139 1.00 0.00 H ATOM 760 HG12 ILE A 51 16.763 0.326 -4.529 1.00 0.00 H ATOM 761 HG13 ILE A 51 16.102 1.876 -3.958 1.00 0.00 H ATOM 762 HD11 ILE A 51 13.775 1.038 -4.371 1.00 0.00 H ATOM 763 HD12 ILE A 51 14.436 -0.514 -4.943 1.00 0.00 H ATOM 764 HD13 ILE A 51 14.650 -0.027 -3.243 1.00 0.00 H ATOM 765 HG21 ILE A 51 15.773 0.948 -8.127 1.00 0.00 H ATOM 766 HG22 ILE A 51 16.504 -0.277 -7.061 1.00 0.00 H ATOM 767 HG23 ILE A 51 14.757 0.057 -6.967 1.00 0.00 H ATOM 768 H ILE A 51 17.011 3.958 -5.123 1.00 0.00 H ATOM 769 N TYR A 52 18.150 2.405 -8.658 1.00 14.95 N ATOM 770 CA TYR A 52 18.179 3.041 -9.941 1.00 15.88 C ATOM 771 C TYR A 52 16.938 2.618 -10.738 1.00 16.40 C ATOM 772 O TYR A 52 16.756 1.420 -10.997 1.00 17.61 O ATOM 773 CB TYR A 52 19.477 2.583 -10.683 1.00 18.08 C ATOM 774 CG TYR A 52 20.708 3.416 -10.291 1.00 18.03 C ATOM 775 CD1 TYR A 52 21.004 3.668 -8.943 1.00 16.57 C ATOM 776 CD2 TYR A 52 21.604 3.886 -11.288 1.00 19.86 C ATOM 777 CE1 TYR A 52 22.159 4.456 -8.600 1.00 16.82 C ATOM 778 CE2 TYR A 52 22.722 4.639 -10.951 1.00 20.12 C ATOM 779 CZ TYR A 52 22.989 4.897 -9.599 1.00 18.57 C ATOM 780 OH TYR A 52 24.089 5.649 -9.289 1.00 19.09 O ATOM 781 HA TYR A 52 18.178 4.126 -9.836 1.00 0.00 H ATOM 782 HB3 TYR A 52 19.318 2.679 -11.757 1.00 0.00 H ATOM 783 HB2 TYR A 52 19.669 1.539 -10.438 1.00 0.00 H ATOM 784 HD2 TYR A 52 21.411 3.652 -12.335 1.00 0.00 H ATOM 785 HE2 TYR A 52 23.383 5.024 -11.728 1.00 0.00 H ATOM 786 HE1 TYR A 52 22.371 4.699 -7.559 1.00 0.00 H ATOM 787 HD1 TYR A 52 20.362 3.269 -8.158 1.00 0.00 H ATOM 788 HH TYR A 52 24.152 5.749 -8.306 1.00 0.00 H ATOM 789 H TYR A 52 18.709 1.544 -8.490 1.00 0.00 H ATOM 790 N GLY A 53 16.192 3.590 -11.235 1.00 15.91 N ATOM 791 CA GLY A 53 15.060 3.310 -12.142 1.00 16.81 C ATOM 792 C GLY A 53 15.491 2.813 -13.491 1.00 19.29 C ATOM 793 O GLY A 53 16.552 3.205 -14.042 1.00 20.36 O ATOM 794 HA3 GLY A 53 14.489 4.229 -12.277 1.00 0.00 H ATOM 795 HA2 GLY A 53 14.425 2.554 -11.681 1.00 0.00 H ATOM 796 H GLY A 53 16.407 4.575 -10.981 1.00 0.00 H ATOM 797 N THR A 54 14.637 1.965 -14.107 1.00 20.57 N ATOM 798 CA THR A 54 14.856 1.372 -15.388 1.00 23.59 C ATOM 799 C THR A 54 13.502 1.486 -16.103 1.00 23.92 C ATOM 800 O THR A 54 12.467 1.736 -15.417 1.00 22.31 O ATOM 801 CB THR A 54 15.292 -0.161 -15.304 1.00 26.26 C ATOM 802 OG1 THR A 54 14.238 -0.907 -14.678 1.00 26.28 O ATOM 803 CG2 THR A 54 16.533 -0.330 -14.385 1.00 25.94 C ATOM 804 HA THR A 54 15.672 1.876 -15.906 1.00 0.00 H ATOM 805 HB THR A 54 15.509 -0.505 -16.315 1.00 0.00 H ATOM 806 HG1 THR A 54 13.411 -0.822 -15.215 1.00 0.00 H ATOM 807 HG23 THR A 54 17.375 0.218 -14.809 1.00 0.00 H ATOM 808 HG21 THR A 54 16.305 0.062 -13.394 1.00 0.00 H ATOM 809 HG22 THR A 54 16.787 -1.387 -14.310 1.00 0.00 H ATOM 810 H THR A 54 13.755 1.727 -13.611 1.00 0.00 H ATOM 811 N GLY A 55 13.549 1.273 -17.408 1.00 28.14 N ATOM 812 CA GLY A 55 12.429 1.341 -18.302 1.00 29.13 C ATOM 813 C GLY A 55 11.777 2.670 -18.177 1.00 28.49 C ATOM 814 O GLY A 55 12.387 3.724 -18.530 1.00 28.45 O ATOM 815 HA3 GLY A 55 11.713 0.559 -18.048 1.00 0.00 H ATOM 816 HA2 GLY A 55 12.772 1.199 -19.327 1.00 0.00 H ATOM 817 H GLY A 55 14.474 1.037 -17.820 1.00 0.00 H ATOM 818 N GLU A 56 10.554 2.664 -17.655 1.00 25.84 N ATOM 819 CA GLU A 56 9.852 3.951 -17.545 1.00 26.83 C ATOM 820 C GLU A 56 10.372 4.916 -16.525 1.00 24.09 C ATOM 821 O GLU A 56 10.093 6.141 -16.572 1.00 24.49 O ATOM 822 CB GLU A 56 8.360 3.759 -17.438 1.00 28.06 C ATOM 823 CG GLU A 56 7.728 3.586 -16.065 1.00 30.73 C ATOM 824 CD GLU A 56 6.273 3.196 -16.271 1.00 42.00 C ATOM 825 OE1 GLU A 56 5.931 2.816 -17.425 1.00 47.27 O ATOM 826 OE2 GLU A 56 5.474 3.275 -15.318 1.00 44.83 O ATOM 827 HA GLU A 56 10.081 4.449 -18.487 1.00 0.00 H ATOM 828 HB2 GLU A 56 7.893 4.631 -17.896 1.00 0.00 H ATOM 829 HB3 GLU A 56 8.111 2.870 -18.017 1.00 0.00 H ATOM 830 HG2 GLU A 56 8.248 2.803 -15.513 1.00 0.00 H ATOM 831 HG3 GLU A 56 7.787 4.521 -15.509 1.00 0.00 H ATOM 832 H GLU A 56 10.110 1.780 -17.336 1.00 0.00 H ATOM 833 N HIS A 57 11.086 4.375 -15.540 1.00 20.36 N ATOM 834 CA HIS A 57 11.717 5.196 -14.543 1.00 18.26 C ATOM 835 C HIS A 57 13.229 5.426 -14.829 1.00 18.81 C ATOM 836 O HIS A 57 13.893 5.860 -13.891 1.00 17.27 O ATOM 837 CB HIS A 57 11.509 4.584 -13.135 1.00 17.64 C ATOM 838 CG HIS A 57 10.056 4.310 -12.820 1.00 18.50 C ATOM 839 ND1 HIS A 57 9.082 5.287 -12.870 1.00 25.19 N ATOM 840 CD2 HIS A 57 9.413 3.142 -12.572 1.00 23.80 C ATOM 841 CE1 HIS A 57 7.904 4.740 -12.604 1.00 22.81 C ATOM 842 NE2 HIS A 57 8.081 3.438 -12.420 1.00 25.23 N ATOM 843 HA HIS A 57 11.240 6.175 -14.581 1.00 0.00 H ATOM 844 HB2 HIS A 57 12.060 3.645 -13.079 1.00 0.00 H ATOM 845 HB3 HIS A 57 11.901 5.279 -12.392 1.00 0.00 H ATOM 846 HD2 HIS A 57 9.868 2.154 -12.506 1.00 0.00 H ATOM 847 HE1 HIS A 57 6.953 5.269 -12.546 1.00 0.00 H ATOM 848 H HIS A 57 11.189 3.341 -15.491 1.00 0.00 H ATOM 849 N ALA A 58 13.711 5.146 -16.049 1.00 21.15 N ATOM 850 CA ALA A 58 15.113 5.394 -16.472 1.00 22.27 C ATOM 851 C ALA A 58 15.457 6.872 -16.150 1.00 21.98 C ATOM 852 O ALA A 58 14.676 7.783 -16.503 1.00 22.87 O ATOM 853 CB ALA A 58 15.346 5.041 -17.935 1.00 27.23 C ATOM 854 HA ALA A 58 15.786 4.739 -15.918 1.00 0.00 H ATOM 855 HB1 ALA A 58 15.127 3.985 -18.092 1.00 0.00 H ATOM 856 HB2 ALA A 58 14.691 5.646 -18.562 1.00 0.00 H ATOM 857 HB3 ALA A 58 16.386 5.240 -18.194 1.00 0.00 H ATOM 858 H ALA A 58 13.060 4.728 -16.744 1.00 0.00 H ATOM 859 N GLY A 59 16.555 7.105 -15.423 1.00 20.25 N ATOM 860 CA GLY A 59 16.962 8.428 -15.051 1.00 19.30 C ATOM 861 C GLY A 59 16.483 8.905 -13.715 1.00 16.72 C ATOM 862 O GLY A 59 16.912 9.996 -13.268 1.00 17.67 O ATOM 863 HA3 GLY A 59 16.588 9.118 -15.807 1.00 0.00 H ATOM 864 HA2 GLY A 59 18.052 8.454 -15.045 1.00 0.00 H ATOM 865 H GLY A 59 17.134 6.297 -15.117 1.00 0.00 H ATOM 866 N LEU A 60 15.604 8.141 -13.067 1.00 15.60 N ATOM 867 CA LEU A 60 15.045 8.506 -11.806 1.00 13.50 C ATOM 868 C LEU A 60 15.511 7.508 -10.751 1.00 12.76 C ATOM 869 O LEU A 60 16.111 6.459 -11.088 1.00 13.93 O ATOM 870 CB LEU A 60 13.475 8.589 -11.782 1.00 12.97 C ATOM 871 CG LEU A 60 12.897 9.424 -12.944 1.00 14.13 C ATOM 872 CD1 LEU A 60 11.375 9.267 -12.776 1.00 13.80 C ATOM 873 CD2 LEU A 60 13.322 10.900 -12.777 1.00 14.78 C ATOM 874 HA LEU A 60 15.400 9.515 -11.598 1.00 0.00 H ATOM 875 HB2 LEU A 60 13.072 7.578 -11.847 1.00 0.00 H ATOM 876 HB3 LEU A 60 13.165 9.043 -10.840 1.00 0.00 H ATOM 877 HG LEU A 60 13.241 9.107 -13.929 1.00 0.00 H ATOM 878 HD21 LEU A 60 12.941 11.281 -11.830 1.00 0.00 H ATOM 879 HD22 LEU A 60 14.410 10.967 -12.786 1.00 0.00 H ATOM 880 HD23 LEU A 60 12.914 11.489 -13.598 1.00 0.00 H ATOM 881 HD11 LEU A 60 11.109 8.212 -12.850 1.00 0.00 H ATOM 882 HD12 LEU A 60 11.077 9.651 -11.800 1.00 0.00 H ATOM 883 HD13 LEU A 60 10.865 9.827 -13.559 1.00 0.00 H ATOM 884 H LEU A 60 15.313 7.241 -13.499 1.00 0.00 H ATOM 885 N TYR A 61 15.323 7.880 -9.504 1.00 11.12 N ATOM 886 CA TYR A 61 15.850 7.063 -8.387 1.00 10.55 C ATOM 887 C TYR A 61 14.771 6.948 -7.388 1.00 9.32 C ATOM 888 O TYR A 61 14.079 7.915 -7.097 1.00 8.49 O ATOM 889 CB TYR A 61 17.102 7.793 -7.757 1.00 10.24 C ATOM 890 CG TYR A 61 18.215 8.017 -8.755 1.00 11.78 C ATOM 891 CD1 TYR A 61 19.144 7.004 -9.013 1.00 13.13 C ATOM 892 CD2 TYR A 61 18.295 9.238 -9.511 1.00 12.22 C ATOM 893 CE1 TYR A 61 20.139 7.168 -9.963 1.00 14.93 C ATOM 894 CE2 TYR A 61 19.306 9.424 -10.405 1.00 13.93 C ATOM 895 CZ TYR A 61 20.205 8.349 -10.649 1.00 15.34 C ATOM 896 OH TYR A 61 21.256 8.423 -11.536 1.00 17.45 O ATOM 897 HA TYR A 61 16.162 6.075 -8.727 1.00 0.00 H ATOM 898 HB3 TYR A 61 17.485 7.183 -6.939 1.00 0.00 H ATOM 899 HB2 TYR A 61 16.782 8.760 -7.369 1.00 0.00 H ATOM 900 HD2 TYR A 61 17.545 10.016 -9.368 1.00 0.00 H ATOM 901 HE2 TYR A 61 19.423 10.376 -10.922 1.00 0.00 H ATOM 902 HE1 TYR A 61 20.856 6.371 -10.160 1.00 0.00 H ATOM 903 HD1 TYR A 61 19.084 6.069 -8.457 1.00 0.00 H ATOM 904 HH TYR A 61 20.908 8.613 -12.443 1.00 0.00 H ATOM 905 H TYR A 61 14.800 8.755 -9.300 1.00 0.00 H ATOM 906 N ALA A 62 14.713 5.768 -6.760 1.00 9.39 N ATOM 907 CA ALA A 62 13.925 5.583 -5.535 1.00 8.44 C ATOM 908 C ALA A 62 14.835 5.630 -4.333 1.00 7.93 C ATOM 909 O ALA A 62 16.038 5.362 -4.425 1.00 8.51 O ATOM 910 CB ALA A 62 13.202 4.233 -5.641 1.00 9.22 C ATOM 911 HA ALA A 62 13.189 6.378 -5.418 1.00 0.00 H ATOM 912 HB1 ALA A 62 12.549 4.239 -6.514 1.00 0.00 H ATOM 913 HB2 ALA A 62 13.938 3.435 -5.742 1.00 0.00 H ATOM 914 HB3 ALA A 62 12.608 4.069 -4.742 1.00 0.00 H ATOM 915 H ALA A 62 15.240 4.961 -7.150 1.00 0.00 H ATOM 916 N ILE A 63 14.301 6.003 -3.204 1.00 7.44 N ATOM 917 CA ILE A 63 15.105 6.311 -2.017 1.00 6.71 C ATOM 918 C ILE A 63 14.704 5.292 -0.932 1.00 6.91 C ATOM 919 O ILE A 63 13.641 5.440 -0.347 1.00 6.60 O ATOM 920 CB ILE A 63 14.994 7.829 -1.572 1.00 5.90 C ATOM 921 CG1 ILE A 63 15.355 8.810 -2.766 1.00 6.00 C ATOM 922 CG2 ILE A 63 15.841 8.106 -0.337 1.00 5.93 C ATOM 923 CD1 ILE A 63 14.912 10.251 -2.461 1.00 7.19 C ATOM 924 HA ILE A 63 16.169 6.207 -2.229 1.00 0.00 H ATOM 925 HB ILE A 63 13.955 8.020 -1.302 1.00 0.00 H ATOM 926 HG12 ILE A 63 16.433 8.796 -2.923 1.00 0.00 H ATOM 927 HG13 ILE A 63 14.853 8.468 -3.671 1.00 0.00 H ATOM 928 HD11 ILE A 63 13.833 10.273 -2.308 1.00 0.00 H ATOM 929 HD12 ILE A 63 15.415 10.601 -1.560 1.00 0.00 H ATOM 930 HD13 ILE A 63 15.175 10.896 -3.300 1.00 0.00 H ATOM 931 HG21 ILE A 63 15.499 7.477 0.485 1.00 0.00 H ATOM 932 HG22 ILE A 63 16.885 7.884 -0.557 1.00 0.00 H ATOM 933 HG23 ILE A 63 15.743 9.155 -0.058 1.00 0.00 H ATOM 934 H ILE A 63 13.266 6.085 -3.143 1.00 0.00 H ATOM 935 N LYS A 64 15.541 4.300 -0.678 1.00 7.68 N ATOM 936 CA LYS A 64 15.186 3.153 0.183 1.00 8.27 C ATOM 937 C LYS A 64 15.778 3.285 1.607 1.00 8.35 C ATOM 938 O LYS A 64 17.018 3.512 1.758 1.00 8.63 O ATOM 939 CB LYS A 64 15.732 1.916 -0.423 1.00 9.42 C ATOM 940 CG LYS A 64 15.285 0.627 0.263 1.00 10.34 C ATOM 941 CD LYS A 64 15.789 -0.562 -0.526 1.00 11.68 C ATOM 942 CE LYS A 64 15.334 -1.895 0.177 1.00 18.13 C ATOM 943 NZ LYS A 64 16.267 -3.001 -0.232 1.00 29.10 N ATOM 944 HA LYS A 64 14.099 3.124 0.262 1.00 0.00 H ATOM 945 HB2 LYS A 64 15.413 1.877 -1.464 1.00 0.00 H ATOM 946 HB3 LYS A 64 16.820 1.966 -0.379 1.00 0.00 H ATOM 947 HG2 LYS A 64 15.692 0.592 1.274 1.00 0.00 H ATOM 948 HG3 LYS A 64 14.196 0.598 0.310 1.00 0.00 H ATOM 949 HD2 LYS A 64 15.381 -0.527 -1.536 1.00 0.00 H ATOM 950 HD3 LYS A 64 16.877 -0.530 -0.574 1.00 0.00 H ATOM 951 HE2 LYS A 64 14.317 -2.142 -0.128 1.00 0.00 H ATOM 952 HE3 LYS A 64 15.367 -1.769 1.259 1.00 0.00 H ATOM 953 HZ1 LYS A 64 16.233 -3.117 -1.265 1.00 0.00 H ATOM 954 HZ2 LYS A 64 17.236 -2.761 0.060 1.00 0.00 H ATOM 955 HZ3 LYS A 64 15.975 -3.887 0.228 1.00 0.00 H ATOM 956 H LYS A 64 16.490 4.329 -1.103 1.00 0.00 H ATOM 957 N SER A 65 14.869 3.212 2.603 1.00 8.33 N ATOM 958 CA SER A 65 15.276 3.285 4.031 1.00 8.75 C ATOM 959 C SER A 65 16.085 2.072 4.528 1.00 10.02 C ATOM 960 O SER A 65 15.683 0.893 4.323 1.00 10.82 O ATOM 961 CB SER A 65 13.968 3.375 4.856 1.00 8.84 C ATOM 962 OG SER A 65 14.272 3.116 6.232 1.00 9.75 O ATOM 963 HA SER A 65 15.933 4.147 4.148 1.00 0.00 H ATOM 964 HB2 SER A 65 13.254 2.636 4.493 1.00 0.00 H ATOM 965 HB3 SER A 65 13.539 4.372 4.756 1.00 0.00 H ATOM 966 HG SER A 65 14.922 3.788 6.557 1.00 0.00 H ATOM 967 H SER A 65 13.862 3.102 2.366 1.00 0.00 H ATOM 968 N LYS A 66 17.224 2.318 5.198 1.00 10.48 N ATOM 969 CA LYS A 66 18.037 1.223 5.739 1.00 11.95 C ATOM 970 C LYS A 66 17.300 0.620 6.936 1.00 12.82 C ATOM 971 O LYS A 66 17.375 -0.572 7.171 1.00 14.10 O ATOM 972 CB LYS A 66 19.413 1.772 6.208 1.00 12.45 C ATOM 973 CG LYS A 66 20.321 0.675 6.661 1.00 14.18 C ATOM 974 CD LYS A 66 21.698 1.225 7.090 1.00 14.97 C ATOM 975 CE LYS A 66 22.595 0.070 7.424 1.00 20.06 C ATOM 976 NZ LYS A 66 23.893 0.643 8.099 1.00 24.58 N ATOM 977 HA LYS A 66 18.198 0.466 4.971 1.00 0.00 H ATOM 978 HB2 LYS A 66 19.884 2.301 5.379 1.00 0.00 H ATOM 979 HB3 LYS A 66 19.254 2.464 7.035 1.00 0.00 H ATOM 980 HG2 LYS A 66 19.864 0.163 7.508 1.00 0.00 H ATOM 981 HG3 LYS A 66 20.460 -0.031 5.843 1.00 0.00 H ATOM 982 HD2 LYS A 66 22.132 1.803 6.275 1.00 0.00 H ATOM 983 HD3 LYS A 66 21.581 1.864 7.965 1.00 0.00 H ATOM 984 HE2 LYS A 66 22.858 -0.470 6.514 1.00 0.00 H ATOM 985 HE3 LYS A 66 22.087 -0.606 8.112 1.00 0.00 H ATOM 986 HZ1 LYS A 66 24.370 1.289 7.438 1.00 0.00 H ATOM 987 HZ2 LYS A 66 23.634 1.159 8.964 1.00 0.00 H ATOM 988 HZ3 LYS A 66 24.532 -0.141 8.340 1.00 0.00 H ATOM 989 H LYS A 66 17.534 3.301 5.335 1.00 0.00 H ATOM 990 N ALA A 67 16.614 1.501 7.677 1.00 12.34 N ATOM 991 CA ALA A 67 15.883 1.021 8.885 1.00 13.50 C ATOM 992 C ALA A 67 14.631 0.201 8.620 1.00 13.83 C ATOM 993 O ALA A 67 14.338 -0.767 9.393 1.00 15.40 O ATOM 994 CB ALA A 67 15.478 2.233 9.800 1.00 13.27 C ATOM 995 HA ALA A 67 16.596 0.354 9.370 1.00 0.00 H ATOM 996 HB1 ALA A 67 16.376 2.764 10.116 1.00 0.00 H ATOM 997 HB2 ALA A 67 14.832 2.910 9.240 1.00 0.00 H ATOM 998 HB3 ALA A 67 14.946 1.863 10.676 1.00 0.00 H ATOM 999 H ALA A 67 16.592 2.507 7.413 1.00 0.00 H ATOM 1000 N THR A 68 13.911 0.559 7.555 1.00 12.65 N ATOM 1001 CA THR A 68 12.648 -0.149 7.338 1.00 13.19 C ATOM 1002 C THR A 68 12.521 -0.925 6.020 1.00 13.11 C ATOM 1003 O THR A 68 11.604 -1.659 5.887 1.00 13.92 O ATOM 1004 CB THR A 68 11.458 0.846 7.292 1.00 12.46 C ATOM 1005 OG1 THR A 68 11.543 1.608 6.090 1.00 11.00 O ATOM 1006 CG2 THR A 68 11.544 1.816 8.498 1.00 12.58 C ATOM 1007 HA THR A 68 12.633 -0.848 8.174 1.00 0.00 H ATOM 1008 HB THR A 68 10.519 0.293 7.330 1.00 0.00 H ATOM 1009 HG1 THR A 68 12.398 2.106 6.076 1.00 0.00 H ATOM 1010 HG23 THR A 68 11.480 1.247 9.426 1.00 0.00 H ATOM 1011 HG21 THR A 68 12.492 2.353 8.464 1.00 0.00 H ATOM 1012 HG22 THR A 68 10.720 2.528 8.450 1.00 0.00 H ATOM 1013 H THR A 68 14.233 1.307 6.908 1.00 0.00 H ATOM 1014 N GLY A 69 13.417 -0.632 5.081 1.00 12.28 N ATOM 1015 CA GLY A 69 13.379 -1.288 3.765 1.00 12.42 C ATOM 1016 C GLY A 69 12.415 -0.592 2.828 1.00 11.48 C ATOM 1017 O GLY A 69 12.340 -0.947 1.643 1.00 11.62 O ATOM 1018 HA3 GLY A 69 13.064 -2.323 3.894 1.00 0.00 H ATOM 1019 HA2 GLY A 69 14.377 -1.265 3.328 1.00 0.00 H ATOM 1020 H GLY A 69 14.156 0.072 5.281 1.00 0.00 H ATOM 1021 N LYS A 70 11.626 0.349 3.354 1.00 10.82 N ATOM 1022 CA LYS A 70 10.614 0.998 2.510 1.00 10.22 C ATOM 1023 C LYS A 70 11.224 2.064 1.643 1.00 9.03 C ATOM 1024 O LYS A 70 12.344 2.535 1.953 1.00 8.58 O ATOM 1025 CB LYS A 70 9.458 1.572 3.363 1.00 10.34 C ATOM 1026 CG LYS A 70 8.691 0.484 4.160 1.00 11.91 C ATOM 1027 CD LYS A 70 7.663 1.183 5.088 1.00 12.29 C ATOM 1028 CE LYS A 70 6.886 0.125 5.840 1.00 14.15 C ATOM 1029 NZ LYS A 70 5.806 0.785 6.684 1.00 14.92 N ATOM 1030 HA LYS A 70 10.198 0.234 1.853 1.00 0.00 H ATOM 1031 HB2 LYS A 70 9.872 2.292 4.069 1.00 0.00 H ATOM 1032 HB3 LYS A 70 8.755 2.077 2.700 1.00 0.00 H ATOM 1033 HG2 LYS A 70 8.171 -0.180 3.469 1.00 0.00 H ATOM 1034 HG3 LYS A 70 9.393 -0.096 4.760 1.00 0.00 H ATOM 1035 HD2 LYS A 70 8.186 1.826 5.796 1.00 0.00 H ATOM 1036 HD3 LYS A 70 6.979 1.784 4.490 1.00 0.00 H ATOM 1037 HE2 LYS A 70 7.564 -0.431 6.488 1.00 0.00 H ATOM 1038 HE3 LYS A 70 6.423 -0.559 5.129 1.00 0.00 H ATOM 1039 HZ1 LYS A 70 6.248 1.437 7.363 1.00 0.00 H ATOM 1040 HZ2 LYS A 70 5.159 1.314 6.065 1.00 0.00 H ATOM 1041 HZ3 LYS A 70 5.275 0.054 7.199 1.00 0.00 H ATOM 1042 H LYS A 70 11.727 0.620 4.353 1.00 0.00 H ATOM 1043 N VAL A 71 10.480 2.569 0.646 1.00 8.70 N ATOM 1044 CA VAL A 71 10.984 3.677 -0.217 1.00 7.79 C ATOM 1045 C VAL A 71 10.136 4.941 0.103 1.00 7.17 C ATOM 1046 O VAL A 71 8.960 4.819 0.475 1.00 7.63 O ATOM 1047 CB VAL A 71 10.984 3.339 -1.711 1.00 8.22 C ATOM 1048 CG1 VAL A 71 11.989 2.244 -2.024 1.00 9.01 C ATOM 1049 CG2 VAL A 71 9.550 2.986 -2.258 1.00 8.92 C ATOM 1050 HA VAL A 71 12.035 3.856 0.011 1.00 0.00 H ATOM 1051 HB VAL A 71 11.294 4.242 -2.237 1.00 0.00 H ATOM 1052 HG11 VAL A 71 12.988 2.577 -1.741 1.00 0.00 H ATOM 1053 HG12 VAL A 71 11.732 1.346 -1.463 1.00 0.00 H ATOM 1054 HG13 VAL A 71 11.966 2.026 -3.092 1.00 0.00 H ATOM 1055 HG21 VAL A 71 9.160 2.121 -1.721 1.00 0.00 H ATOM 1056 HG22 VAL A 71 8.886 3.837 -2.109 1.00 0.00 H ATOM 1057 HG23 VAL A 71 9.615 2.756 -3.321 1.00 0.00 H ATOM 1058 H VAL A 71 9.532 2.179 0.471 1.00 0.00 H ATOM 1059 N LEU A 72 10.751 6.094 -0.031 1.00 6.39 N ATOM 1060 CA LEU A 72 10.068 7.368 0.178 1.00 5.96 C ATOM 1061 C LEU A 72 9.061 7.588 -0.958 1.00 6.23 C ATOM 1062 O LEU A 72 9.207 7.040 -2.101 1.00 6.59 O ATOM 1063 CB LEU A 72 11.048 8.526 0.154 1.00 5.31 C ATOM 1064 CG LEU A 72 11.990 8.533 1.384 1.00 5.26 C ATOM 1065 CD1 LEU A 72 12.795 9.750 1.287 1.00 6.07 C ATOM 1066 CD2 LEU A 72 11.286 8.422 2.819 1.00 5.68 C ATOM 1067 HA LEU A 72 9.575 7.331 1.149 1.00 0.00 H ATOM 1068 HB2 LEU A 72 11.653 8.453 -0.750 1.00 0.00 H ATOM 1069 HB3 LEU A 72 10.486 9.460 0.139 1.00 0.00 H ATOM 1070 HG LEU A 72 12.587 7.622 1.341 1.00 0.00 H ATOM 1071 HD21 LEU A 72 10.608 9.264 2.956 1.00 0.00 H ATOM 1072 HD22 LEU A 72 10.725 7.489 2.876 1.00 0.00 H ATOM 1073 HD23 LEU A 72 12.048 8.437 3.598 1.00 0.00 H ATOM 1074 HD11 LEU A 72 13.367 9.733 0.359 1.00 0.00 H ATOM 1075 HD12 LEU A 72 12.138 10.620 1.295 1.00 0.00 H ATOM 1076 HD13 LEU A 72 13.478 9.801 2.135 1.00 0.00 H ATOM 1077 H LEU A 72 11.757 6.100 -0.295 1.00 0.00 H ATOM 1078 N PHE A 73 8.014 8.317 -0.644 1.00 6.36 N ATOM 1079 CA PHE A 73 7.124 8.849 -1.692 1.00 6.73 C ATOM 1080 C PHE A 73 6.895 10.339 -1.469 1.00 6.44 C ATOM 1081 O PHE A 73 7.031 10.878 -0.321 1.00 6.20 O ATOM 1082 CB PHE A 73 5.764 8.142 -1.744 1.00 7.81 C ATOM 1083 CG PHE A 73 4.866 8.370 -0.540 1.00 8.31 C ATOM 1084 CD1 PHE A 73 4.075 9.532 -0.419 1.00 8.61 C ATOM 1085 CD2 PHE A 73 4.770 7.356 0.412 1.00 8.83 C ATOM 1086 CE1 PHE A 73 3.137 9.706 0.679 1.00 9.53 C ATOM 1087 CE2 PHE A 73 3.877 7.485 1.549 1.00 9.74 C ATOM 1088 CZ PHE A 73 3.041 8.721 1.686 1.00 10.12 C ATOM 1089 HA PHE A 73 7.625 8.669 -2.643 1.00 0.00 H ATOM 1090 HB2 PHE A 73 5.235 8.494 -2.630 1.00 0.00 H ATOM 1091 HB3 PHE A 73 5.944 7.071 -1.831 1.00 0.00 H ATOM 1092 HD2 PHE A 73 5.373 6.455 0.301 1.00 0.00 H ATOM 1093 HE2 PHE A 73 3.815 6.692 2.294 1.00 0.00 H ATOM 1094 HZ PHE A 73 2.377 8.856 2.540 1.00 0.00 H ATOM 1095 HE1 PHE A 73 2.509 10.596 0.724 1.00 0.00 H ATOM 1096 HD1 PHE A 73 4.169 10.319 -1.167 1.00 0.00 H ATOM 1097 H PHE A 73 7.811 8.521 0.355 1.00 0.00 H ATOM 1098 N SER A 74 6.545 11.009 -2.566 1.00 6.99 N ATOM 1099 CA SER A 74 6.214 12.453 -2.558 1.00 6.74 C ATOM 1100 C SER A 74 5.058 12.498 -3.491 1.00 7.75 C ATOM 1101 O SER A 74 5.153 12.109 -4.658 1.00 8.12 O ATOM 1102 CB SER A 74 7.401 13.349 -3.031 1.00 6.17 C ATOM 1103 OG SER A 74 6.924 14.669 -3.103 1.00 6.50 O ATOM 1104 HA SER A 74 5.995 12.846 -1.565 1.00 0.00 H ATOM 1105 HB2 SER A 74 7.747 13.023 -4.012 1.00 0.00 H ATOM 1106 HB3 SER A 74 8.223 13.287 -2.318 1.00 0.00 H ATOM 1107 HG SER A 74 6.175 14.713 -3.749 1.00 0.00 H ATOM 1108 H SER A 74 6.502 10.495 -3.469 1.00 0.00 H ATOM 1109 N ARG A 75 3.935 13.022 -3.016 1.00 8.48 N ATOM 1110 CA ARG A 75 2.736 13.074 -3.872 1.00 9.78 C ATOM 1111 C ARG A 75 1.786 14.226 -3.585 1.00 10.68 C ATOM 1112 O ARG A 75 1.811 14.823 -2.493 1.00 10.49 O ATOM 1113 CB ARG A 75 1.892 11.774 -3.775 1.00 10.68 C ATOM 1114 CG ARG A 75 1.249 11.644 -2.371 1.00 11.10 C ATOM 1115 CD ARG A 75 0.727 10.194 -2.162 1.00 13.20 C ATOM 1116 NE ARG A 75 0.211 10.141 -0.802 1.00 12.51 N ATOM 1117 CZ ARG A 75 0.048 9.031 -0.071 1.00 13.07 C ATOM 1118 NH1 ARG A 75 0.216 7.789 -0.603 1.00 13.25 N ATOM 1119 NH2 ARG A 75 -0.395 9.151 1.173 1.00 13.85 N ATOM 1120 HA ARG A 75 3.160 13.211 -4.867 1.00 0.00 H ATOM 1121 HB2 ARG A 75 1.105 11.801 -4.529 1.00 0.00 H ATOM 1122 HB3 ARG A 75 2.537 10.914 -3.955 1.00 0.00 H ATOM 1123 HG2 ARG A 75 1.994 11.874 -1.609 1.00 0.00 H ATOM 1124 HG3 ARG A 75 0.417 12.344 -2.287 1.00 0.00 H ATOM 1125 HD2 ARG A 75 1.539 9.478 -2.287 1.00 0.00 H ATOM 1126 HD3 ARG A 75 -0.065 9.971 -2.876 1.00 0.00 H ATOM 1127 HE ARG A 75 -0.054 11.044 -0.359 1.00 0.00 H ATOM 1128 HH12 ARG A 75 0.082 6.946 -0.009 1.00 0.00 H ATOM 1129 HH11 ARG A 75 0.478 7.683 -1.604 1.00 0.00 H ATOM 1130 HH22 ARG A 75 -0.530 8.304 1.761 1.00 0.00 H ATOM 1131 HH21 ARG A 75 -0.608 10.092 1.561 1.00 0.00 H ATOM 1132 H ARG A 75 3.901 13.394 -2.045 1.00 0.00 H ATOM 1133 N ARG A 76 0.954 14.556 -4.573 1.00 11.91 N ATOM 1134 CA ARG A 76 -0.266 15.317 -4.391 1.00 13.38 C ATOM 1135 C ARG A 76 -1.228 14.780 -5.462 1.00 14.94 C ATOM 1136 O ARG A 76 -0.796 14.337 -6.507 1.00 14.84 O ATOM 1137 CB ARG A 76 -0.044 16.830 -4.630 1.00 13.48 C ATOM 1138 CG ARG A 76 0.843 17.474 -3.588 1.00 12.30 C ATOM 1139 CD ARG A 76 0.850 18.998 -3.640 1.00 12.85 C ATOM 1140 NE ARG A 76 1.783 19.458 -2.607 1.00 11.82 N ATOM 1141 CZ ARG A 76 1.675 20.656 -2.008 1.00 12.45 C ATOM 1142 NH1 ARG A 76 0.716 21.499 -2.404 1.00 14.04 N ATOM 1143 NH2 ARG A 76 2.492 20.949 -1.049 1.00 11.73 N ATOM 1144 HA ARG A 76 -0.640 15.210 -3.373 1.00 0.00 H ATOM 1145 HB2 ARG A 76 0.418 16.962 -5.608 1.00 0.00 H ATOM 1146 HB3 ARG A 76 -1.013 17.329 -4.617 1.00 0.00 H ATOM 1147 HG2 ARG A 76 0.495 17.165 -2.602 1.00 0.00 H ATOM 1148 HG3 ARG A 76 1.863 17.120 -3.739 1.00 0.00 H ATOM 1149 HD2 ARG A 76 -0.150 19.384 -3.441 1.00 0.00 H ATOM 1150 HD3 ARG A 76 1.181 19.338 -4.622 1.00 0.00 H ATOM 1151 HE ARG A 76 2.562 18.830 -2.325 1.00 0.00 H ATOM 1152 HH12 ARG A 76 0.621 22.429 -1.949 1.00 0.00 H ATOM 1153 HH11 ARG A 76 0.065 21.224 -3.167 1.00 0.00 H ATOM 1154 HH22 ARG A 76 2.425 21.871 -0.572 1.00 0.00 H ATOM 1155 HH21 ARG A 76 3.216 20.263 -0.755 1.00 0.00 H ATOM 1156 H ARG A 76 1.196 14.248 -5.536 1.00 0.00 H ATOM 1157 N PRO A 77 -2.562 14.770 -5.210 1.00 16.71 N ATOM 1158 CA PRO A 77 -3.163 15.429 -4.023 1.00 17.32 C ATOM 1159 C PRO A 77 -3.427 14.554 -2.798 1.00 17.42 C ATOM 1160 O PRO A 77 -3.999 15.062 -1.818 1.00 18.34 O ATOM 1161 CB PRO A 77 -4.538 15.837 -4.542 1.00 19.73 C ATOM 1162 CG PRO A 77 -4.908 14.744 -5.541 1.00 20.54 C ATOM 1163 CD PRO A 77 -3.566 14.348 -6.206 1.00 18.61 C ATOM 1164 HA PRO A 77 -2.475 16.199 -3.675 1.00 0.00 H ATOM 1165 HD3 PRO A 77 -3.517 13.273 -6.380 1.00 0.00 H ATOM 1166 HD2 PRO A 77 -3.426 14.874 -7.150 1.00 0.00 H ATOM 1167 HG3 PRO A 77 -5.609 15.124 -6.285 1.00 0.00 H ATOM 1168 HG2 PRO A 77 -5.351 13.889 -5.030 1.00 0.00 H ATOM 1169 HB2 PRO A 77 -5.262 15.876 -3.728 1.00 0.00 H ATOM 1170 HB3 PRO A 77 -4.492 16.809 -5.033 1.00 0.00 H ATOM 1171 N ALA A 78 -3.040 13.261 -2.848 1.00 16.77 N ATOM 1172 CA ALA A 78 -3.427 12.388 -1.739 1.00 17.34 C ATOM 1173 C ALA A 78 -2.548 12.757 -0.490 1.00 16.02 C ATOM 1174 O ALA A 78 -1.409 12.852 -0.539 1.00 14.34 O ATOM 1175 CB ALA A 78 -3.264 10.913 -2.108 1.00 17.27 C ATOM 1176 HA ALA A 78 -4.481 12.539 -1.508 1.00 0.00 H ATOM 1177 HB1 ALA A 78 -3.894 10.683 -2.967 1.00 0.00 H ATOM 1178 HB2 ALA A 78 -2.222 10.715 -2.358 1.00 0.00 H ATOM 1179 HB3 ALA A 78 -3.560 10.293 -1.262 1.00 0.00 H ATOM 1180 H ALA A 78 -2.485 12.897 -3.649 1.00 0.00 H ATOM 1181 N GLU A 79 -3.210 12.905 0.656 1.00 17.69 N ATOM 1182 CA GLU A 79 -2.511 13.272 1.889 1.00 16.98 C ATOM 1183 C GLU A 79 -2.360 11.966 2.765 1.00 16.71 C ATOM 1184 O GLU A 79 -3.285 11.157 2.773 1.00 19.49 O ATOM 1185 CB GLU A 79 -3.550 14.172 2.609 1.00 19.59 C ATOM 1186 CG GLU A 79 -3.315 15.659 2.326 1.00 24.32 C ATOM 1187 CD GLU A 79 -4.157 16.516 3.196 1.00 35.13 C ATOM 1188 OE1 GLU A 79 -5.341 16.690 2.818 1.00 36.52 O ATOM 1189 OE2 GLU A 79 -3.601 16.993 4.231 1.00 40.61 O ATOM 1190 HA GLU A 79 -1.537 13.733 1.726 1.00 0.00 H ATOM 1191 HB2 GLU A 79 -4.548 13.902 2.265 1.00 0.00 H ATOM 1192 HB3 GLU A 79 -3.479 14.002 3.683 1.00 0.00 H ATOM 1193 HG2 GLU A 79 -2.266 15.893 2.506 1.00 0.00 H ATOM 1194 HG3 GLU A 79 -3.558 15.864 1.283 1.00 0.00 H ATOM 1195 H GLU A 79 -4.239 12.758 0.675 1.00 0.00 H ATOM 1196 N PRO A 80 -1.299 11.908 3.595 1.00 15.79 N ATOM 1197 CA PRO A 80 -0.283 12.931 3.631 1.00 14.07 C ATOM 1198 C PRO A 80 0.673 12.957 2.415 1.00 12.29 C ATOM 1199 O PRO A 80 0.791 11.971 1.674 1.00 11.94 O ATOM 1200 CB PRO A 80 0.542 12.594 4.883 1.00 15.61 C ATOM 1201 CG PRO A 80 0.287 11.129 5.097 1.00 18.18 C ATOM 1202 CD PRO A 80 -1.062 10.839 4.582 1.00 17.90 C ATOM 1203 HA PRO A 80 -0.766 13.908 3.627 1.00 0.00 H ATOM 1204 HD3 PRO A 80 -1.094 9.858 4.108 1.00 0.00 H ATOM 1205 HD2 PRO A 80 -1.801 10.879 5.383 1.00 0.00 H ATOM 1206 HG3 PRO A 80 0.340 10.892 6.160 1.00 0.00 H ATOM 1207 HG2 PRO A 80 1.027 10.539 4.557 1.00 0.00 H ATOM 1208 HB2 PRO A 80 1.602 12.783 4.712 1.00 0.00 H ATOM 1209 HB3 PRO A 80 0.204 13.177 5.740 1.00 0.00 H ATOM 1210 N TYR A 81 1.364 14.070 2.173 1.00 11.40 N ATOM 1211 CA TYR A 81 2.060 14.247 0.903 1.00 10.28 C ATOM 1212 C TYR A 81 3.372 13.506 0.810 1.00 8.89 C ATOM 1213 O TYR A 81 3.922 13.279 -0.289 1.00 8.26 O ATOM 1214 CB TYR A 81 2.315 15.728 0.679 1.00 10.15 C ATOM 1215 CG TYR A 81 1.105 16.537 0.327 1.00 11.60 C ATOM 1216 CD1 TYR A 81 -0.138 15.938 -0.040 1.00 12.94 C ATOM 1217 CD2 TYR A 81 1.153 17.936 0.464 1.00 12.92 C ATOM 1218 CE1 TYR A 81 -1.300 16.709 -0.328 1.00 14.63 C ATOM 1219 CE2 TYR A 81 0.003 18.706 0.214 1.00 13.62 C ATOM 1220 CZ TYR A 81 -1.196 18.114 -0.211 1.00 14.93 C ATOM 1221 OH TYR A 81 -2.280 18.931 -0.416 1.00 16.77 O ATOM 1222 HA TYR A 81 1.410 13.826 0.135 1.00 0.00 H ATOM 1223 HB3 TYR A 81 3.035 15.827 -0.133 1.00 0.00 H ATOM 1224 HB2 TYR A 81 2.742 16.139 1.594 1.00 0.00 H ATOM 1225 HD2 TYR A 81 2.081 18.423 0.764 1.00 0.00 H ATOM 1226 HE2 TYR A 81 0.044 19.786 0.353 1.00 0.00 H ATOM 1227 HE1 TYR A 81 -2.234 16.234 -0.627 1.00 0.00 H ATOM 1228 HD1 TYR A 81 -0.200 14.852 -0.102 1.00 0.00 H ATOM 1229 HH TYR A 81 -3.052 18.386 -0.711 1.00 0.00 H ATOM 1230 H TYR A 81 1.408 14.818 2.894 1.00 0.00 H ATOM 1231 N VAL A 82 3.988 13.234 1.972 1.00 8.60 N ATOM 1232 CA VAL A 82 5.228 12.475 1.969 1.00 7.57 C ATOM 1233 C VAL A 82 5.139 11.338 3.008 1.00 8.08 C ATOM 1234 O VAL A 82 4.377 11.400 3.976 1.00 9.14 O ATOM 1235 CB VAL A 82 6.498 13.344 2.252 1.00 6.73 C ATOM 1236 CG1 VAL A 82 6.615 14.416 1.180 1.00 6.46 C ATOM 1237 CG2 VAL A 82 6.438 13.972 3.634 1.00 7.30 C ATOM 1238 HA VAL A 82 5.344 12.075 0.962 1.00 0.00 H ATOM 1239 HB VAL A 82 7.379 12.703 2.225 1.00 0.00 H ATOM 1240 HG11 VAL A 82 6.704 13.942 0.202 1.00 0.00 H ATOM 1241 HG12 VAL A 82 5.726 15.047 1.200 1.00 0.00 H ATOM 1242 HG13 VAL A 82 7.498 15.025 1.372 1.00 0.00 H ATOM 1243 HG21 VAL A 82 5.557 14.610 3.704 1.00 0.00 H ATOM 1244 HG22 VAL A 82 6.379 13.186 4.387 1.00 0.00 H ATOM 1245 HG23 VAL A 82 7.335 14.569 3.800 1.00 0.00 H ATOM 1246 H VAL A 82 3.580 13.565 2.870 1.00 0.00 H ATOM 1247 N GLY A 83 5.919 10.303 2.727 1.00 7.56 N ATOM 1248 CA GLY A 83 5.937 9.157 3.672 1.00 8.19 C ATOM 1249 C GLY A 83 6.806 8.103 3.048 1.00 7.69 C ATOM 1250 O GLY A 83 7.687 8.405 2.275 1.00 6.82 O ATOM 1251 HA3 GLY A 83 4.927 8.774 3.819 1.00 0.00 H ATOM 1252 HA2 GLY A 83 6.350 9.467 4.632 1.00 0.00 H ATOM 1253 H GLY A 83 6.503 10.294 1.867 1.00 0.00 H ATOM 1254 N GLN A 84 6.582 6.876 3.482 1.00 8.49 N ATOM 1255 CA GLN A 84 7.353 5.692 2.992 1.00 8.41 C ATOM 1256 C GLN A 84 6.382 4.539 2.766 1.00 9.61 C ATOM 1257 O GLN A 84 5.304 4.431 3.465 1.00 10.72 O ATOM 1258 CB GLN A 84 8.475 5.359 4.024 1.00 8.40 C ATOM 1259 CG GLN A 84 7.909 5.008 5.383 1.00 9.58 C ATOM 1260 CD GLN A 84 8.993 4.560 6.382 1.00 9.92 C ATOM 1261 OE1 GLN A 84 8.884 4.846 7.612 1.00 10.71 O ATOM 1262 NE2 GLN A 84 9.941 3.786 5.916 1.00 9.73 N ATOM 1263 HA GLN A 84 7.844 5.894 2.040 1.00 0.00 H ATOM 1264 HB2 GLN A 84 9.054 4.513 3.654 1.00 0.00 H ATOM 1265 HB3 GLN A 84 9.127 6.226 4.127 1.00 0.00 H ATOM 1266 HG2 GLN A 84 7.403 5.885 5.787 1.00 0.00 H ATOM 1267 HG3 GLN A 84 7.189 4.198 5.263 1.00 0.00 H ATOM 1268 HE22 GLN A 84 9.990 3.579 4.898 1.00 0.00 H ATOM 1269 HE21 GLN A 84 10.645 3.378 6.564 1.00 0.00 H ATOM 1270 H GLN A 84 5.839 6.727 4.194 1.00 0.00 H ATOM 1271 N ILE A 85 6.751 3.571 1.909 1.00 9.76 N ATOM 1272 CA ILE A 85 5.945 2.475 1.612 1.00 11.03 C ATOM 1273 C ILE A 85 6.778 1.274 1.104 1.00 11.37 C ATOM 1274 O ILE A 85 7.837 1.481 0.467 1.00 10.54 O ATOM 1275 CB ILE A 85 4.856 2.841 0.516 1.00 11.41 C ATOM 1276 CG1 ILE A 85 3.802 1.729 0.436 1.00 13.17 C ATOM 1277 CG2 ILE A 85 5.502 3.059 -0.891 1.00 10.72 C ATOM 1278 CD1 ILE A 85 2.562 2.200 -0.361 1.00 13.93 C ATOM 1279 HA ILE A 85 5.447 2.196 2.541 1.00 0.00 H ATOM 1280 HB ILE A 85 4.384 3.776 0.816 1.00 0.00 H ATOM 1281 HG12 ILE A 85 4.236 0.860 -0.059 1.00 0.00 H ATOM 1282 HG13 ILE A 85 3.495 1.455 1.445 1.00 0.00 H ATOM 1283 HD11 ILE A 85 2.122 3.066 0.133 1.00 0.00 H ATOM 1284 HD12 ILE A 85 2.864 2.471 -1.373 1.00 0.00 H ATOM 1285 HD13 ILE A 85 1.830 1.393 -0.403 1.00 0.00 H ATOM 1286 HG21 ILE A 85 6.222 3.875 -0.836 1.00 0.00 H ATOM 1287 HG22 ILE A 85 6.009 2.146 -1.202 1.00 0.00 H ATOM 1288 HG23 ILE A 85 4.723 3.307 -1.612 1.00 0.00 H ATOM 1289 H ILE A 85 7.680 3.644 1.447 1.00 0.00 H ATOM 1290 N ASP A 86 6.263 0.079 1.374 1.00 12.82 N ATOM 1291 CA ASP A 86 6.883 -1.135 0.816 1.00 13.55 C ATOM 1292 C ASP A 86 6.931 -1.175 -0.716 1.00 13.53 C ATOM 1293 O ASP A 86 6.153 -0.482 -1.430 1.00 13.37 O ATOM 1294 CB ASP A 86 6.174 -2.356 1.367 1.00 15.39 C ATOM 1295 CG ASP A 86 6.597 -2.646 2.801 1.00 18.22 C ATOM 1296 OD1 ASP A 86 7.820 -2.639 3.082 1.00 27.62 O ATOM 1297 OD2 ASP A 86 5.733 -2.891 3.617 1.00 23.50 O ATOM 1298 HA ASP A 86 7.927 -1.126 1.129 1.00 0.00 H ATOM 1299 HB2 ASP A 86 5.098 -2.183 1.343 1.00 0.00 H ATOM 1300 HB3 ASP A 86 6.416 -3.218 0.745 1.00 0.00 H ATOM 1301 H ASP A 86 5.421 0.001 1.980 1.00 0.00 H ATOM 1302 N GLY A 87 7.856 -1.970 -1.262 1.00 13.94 N ATOM 1303 CA GLY A 87 7.629 -2.345 -2.711 1.00 14.77 C ATOM 1304 C GLY A 87 8.759 -1.975 -3.698 1.00 14.22 C ATOM 1305 O GLY A 87 8.658 -2.325 -4.913 1.00 15.21 O ATOM 1306 HA3 GLY A 87 6.719 -1.846 -3.045 1.00 0.00 H ATOM 1307 HA2 GLY A 87 7.488 -3.425 -2.757 1.00 0.00 H ATOM 1308 H GLY A 87 8.680 -2.310 -0.725 1.00 0.00 H ATOM 1309 N ASP A 88 9.819 -1.373 -3.173 1.00 13.04 N ATOM 1310 CA ASP A 88 11.030 -1.030 -3.996 1.00 12.78 C ATOM 1311 C ASP A 88 10.701 -0.205 -5.256 1.00 12.65 C ATOM 1312 O ASP A 88 11.342 -0.386 -6.331 1.00 13.92 O ATOM 1313 CB ASP A 88 11.810 -2.303 -4.389 1.00 14.28 C ATOM 1314 CG ASP A 88 12.461 -2.973 -3.193 1.00 14.49 C ATOM 1315 OD1 ASP A 88 12.979 -2.272 -2.311 1.00 19.02 O ATOM 1316 OD2 ASP A 88 12.482 -4.210 -3.143 1.00 20.93 O ATOM 1317 HA ASP A 88 11.653 -0.402 -3.359 1.00 0.00 H ATOM 1318 HB2 ASP A 88 11.120 -3.008 -4.853 1.00 0.00 H ATOM 1319 HB3 ASP A 88 12.586 -2.032 -5.104 1.00 0.00 H ATOM 1320 H ASP A 88 9.812 -1.131 -2.162 1.00 0.00 H ATOM 1321 N GLY A 89 9.676 0.663 -5.133 1.00 11.96 N ATOM 1322 CA GLY A 89 9.347 1.606 -6.175 1.00 11.84 C ATOM 1323 C GLY A 89 8.241 1.113 -7.066 1.00 13.24 C ATOM 1324 O GLY A 89 8.253 1.302 -8.287 1.00 14.05 O ATOM 1325 HA3 GLY A 89 10.235 1.781 -6.783 1.00 0.00 H ATOM 1326 HA2 GLY A 89 9.034 2.543 -5.714 1.00 0.00 H ATOM 1327 H GLY A 89 9.107 0.653 -4.263 1.00 0.00 H ATOM 1328 N ARG A 90 7.255 0.466 -6.431 1.00 13.80 N ATOM 1329 CA ARG A 90 6.136 -0.068 -7.161 1.00 15.41 C ATOM 1330 C ARG A 90 5.183 1.053 -7.603 1.00 15.28 C ATOM 1331 O ARG A 90 4.344 0.819 -8.503 1.00 16.80 O ATOM 1332 CB ARG A 90 5.399 -1.116 -6.271 1.00 16.33 C ATOM 1333 CG ARG A 90 3.960 -1.422 -6.657 1.00 17.95 C ATOM 1334 CD ARG A 90 3.512 -2.337 -5.554 1.00 23.50 C ATOM 1335 NE ARG A 90 2.108 -2.474 -5.693 1.00 27.42 N ATOM 1336 CZ ARG A 90 1.380 -3.337 -5.031 1.00 28.84 C ATOM 1337 NH1 ARG A 90 1.942 -4.193 -4.147 1.00 29.32 N ATOM 1338 NH2 ARG A 90 0.075 -3.334 -5.290 1.00 34.18 N ATOM 1339 HA ARG A 90 6.496 -0.559 -8.065 1.00 0.00 H ATOM 1340 HB2 ARG A 90 5.962 -2.048 -6.316 1.00 0.00 H ATOM 1341 HB3 ARG A 90 5.398 -0.743 -5.247 1.00 0.00 H ATOM 1342 HG2 ARG A 90 3.358 -0.514 -6.684 1.00 0.00 H ATOM 1343 HG3 ARG A 90 3.909 -1.919 -7.626 1.00 0.00 H ATOM 1344 HD2 ARG A 90 3.755 -1.905 -4.583 1.00 0.00 H ATOM 1345 HD3 ARG A 90 3.997 -3.308 -5.649 1.00 0.00 H ATOM 1346 HE ARG A 90 1.624 -1.847 -6.366 1.00 0.00 H ATOM 1347 HH12 ARG A 90 1.347 -4.872 -3.630 1.00 0.00 H ATOM 1348 HH11 ARG A 90 2.969 -4.172 -3.984 1.00 0.00 H ATOM 1349 HH22 ARG A 90 -0.555 -3.997 -4.795 1.00 0.00 H ATOM 1350 HH21 ARG A 90 -0.315 -2.668 -5.987 1.00 0.00 H ATOM 1351 H ARG A 90 7.299 0.348 -5.399 1.00 0.00 H ATOM 1352 N TYR A 91 5.245 2.226 -6.979 1.00 13.79 N ATOM 1353 CA TYR A 91 4.324 3.320 -7.339 1.00 13.85 C ATOM 1354 C TYR A 91 5.059 4.445 -8.077 1.00 13.11 C ATOM 1355 O TYR A 91 6.218 4.739 -7.779 1.00 11.97 O ATOM 1356 CB TYR A 91 3.608 3.838 -6.035 1.00 13.22 C ATOM 1357 CG TYR A 91 3.086 2.692 -5.190 1.00 14.08 C ATOM 1358 CD1 TYR A 91 1.840 2.186 -5.412 1.00 22.55 C ATOM 1359 CD2 TYR A 91 3.894 2.164 -4.133 1.00 16.18 C ATOM 1360 CE1 TYR A 91 1.330 1.127 -4.629 1.00 16.89 C ATOM 1361 CE2 TYR A 91 3.427 1.084 -3.359 1.00 18.14 C ATOM 1362 CZ TYR A 91 2.152 0.601 -3.599 1.00 16.14 C ATOM 1363 OH TYR A 91 1.595 -0.476 -2.872 1.00 22.93 O ATOM 1364 HA TYR A 91 3.567 2.946 -8.028 1.00 0.00 H ATOM 1365 HB3 TYR A 91 2.772 4.476 -6.320 1.00 0.00 H ATOM 1366 HB2 TYR A 91 4.320 4.416 -5.446 1.00 0.00 H ATOM 1367 HD2 TYR A 91 4.872 2.598 -3.927 1.00 0.00 H ATOM 1368 HE2 TYR A 91 4.056 0.638 -2.588 1.00 0.00 H ATOM 1369 HE1 TYR A 91 0.333 0.725 -4.811 1.00 0.00 H ATOM 1370 HD1 TYR A 91 1.226 2.606 -6.208 1.00 0.00 H ATOM 1371 HH TYR A 91 0.680 -0.658 -3.203 1.00 0.00 H ATOM 1372 H TYR A 91 5.951 2.373 -6.229 1.00 0.00 H ATOM 1373 N PRO A 92 4.360 5.166 -8.964 1.00 13.89 N ATOM 1374 CA PRO A 92 5.018 6.239 -9.738 1.00 13.54 C ATOM 1375 C PRO A 92 5.573 7.334 -8.874 1.00 11.86 C ATOM 1376 O PRO A 92 6.635 7.896 -9.174 1.00 11.31 O ATOM 1377 CB PRO A 92 3.903 6.833 -10.630 1.00 14.92 C ATOM 1378 CG PRO A 92 2.714 6.086 -10.285 1.00 16.70 C ATOM 1379 CD PRO A 92 3.025 4.859 -9.452 1.00 15.57 C ATOM 1380 HA PRO A 92 5.862 5.828 -10.292 1.00 0.00 H ATOM 1381 HD3 PRO A 92 2.317 4.746 -8.631 1.00 0.00 H ATOM 1382 HD2 PRO A 92 3.022 3.954 -10.060 1.00 0.00 H ATOM 1383 HG3 PRO A 92 2.220 5.770 -11.204 1.00 0.00 H ATOM 1384 HG2 PRO A 92 2.045 6.734 -9.719 1.00 0.00 H ATOM 1385 HB2 PRO A 92 3.765 7.893 -10.418 1.00 0.00 H ATOM 1386 HB3 PRO A 92 4.145 6.703 -11.685 1.00 0.00 H ATOM 1387 N ASP A 93 4.958 7.566 -7.711 1.00 11.21 N ATOM 1388 CA ASP A 93 5.418 8.615 -6.789 1.00 9.85 C ATOM 1389 C ASP A 93 6.576 8.218 -5.842 1.00 8.72 C ATOM 1390 O ASP A 93 6.845 8.964 -4.915 1.00 7.84 O ATOM 1391 CB ASP A 93 4.252 9.258 -6.004 1.00 10.00 C ATOM 1392 CG ASP A 93 3.471 8.236 -5.125 1.00 10.54 C ATOM 1393 OD1 ASP A 93 3.990 7.120 -4.923 1.00 10.47 O ATOM 1394 OD2 ASP A 93 2.302 8.512 -4.787 1.00 11.37 O ATOM 1395 HA ASP A 93 5.849 9.363 -7.454 1.00 0.00 H ATOM 1396 HB2 ASP A 93 4.657 10.036 -5.356 1.00 0.00 H ATOM 1397 HB3 ASP A 93 3.558 9.705 -6.716 1.00 0.00 H ATOM 1398 H ASP A 93 4.132 6.990 -7.451 1.00 0.00 H ATOM 1399 N ASN A 94 7.230 7.089 -6.149 1.00 9.04 N ATOM 1400 CA ASN A 94 8.444 6.637 -5.449 1.00 8.33 C ATOM 1401 C ASN A 94 9.693 7.051 -6.242 1.00 8.25 C ATOM 1402 O ASN A 94 10.816 6.807 -5.745 1.00 8.31 O ATOM 1403 CB ASN A 94 8.461 5.118 -5.279 1.00 9.05 C ATOM 1404 CG ASN A 94 7.299 4.596 -4.474 1.00 9.47 C ATOM 1405 OD1 ASN A 94 6.805 5.341 -3.547 1.00 11.68 O ATOM 1406 ND2 ASN A 94 6.856 3.417 -4.746 1.00 10.62 N ATOM 1407 HA ASN A 94 8.444 7.104 -4.464 1.00 0.00 H ATOM 1408 HB2 ASN A 94 8.432 4.659 -6.267 1.00 0.00 H ATOM 1409 HB3 ASN A 94 9.386 4.836 -4.775 1.00 0.00 H ATOM 1410 HD22 ASN A 94 7.294 2.859 -5.507 1.00 0.00 H ATOM 1411 HD21 ASN A 94 6.060 3.023 -4.205 1.00 0.00 H ATOM 1412 H ASN A 94 6.860 6.501 -6.923 1.00 0.00 H ATOM 1413 N TRP A 95 9.520 7.777 -7.313 1.00 8.73 N ATOM 1414 CA TRP A 95 10.629 7.995 -8.317 1.00 9.28 C ATOM 1415 C TRP A 95 10.963 9.477 -8.377 1.00 10.97 C ATOM 1416 O TRP A 95 10.107 10.312 -8.746 1.00 9.02 O ATOM 1417 CB TRP A 95 10.299 7.369 -9.661 1.00 11.00 C ATOM 1418 CG TRP A 95 10.189 5.866 -9.506 1.00 11.93 C ATOM 1419 CD1 TRP A 95 9.037 5.120 -9.410 1.00 13.79 C ATOM 1420 CD2 TRP A 95 11.292 4.929 -9.390 1.00 11.80 C ATOM 1421 NE1 TRP A 95 9.353 3.773 -9.202 1.00 12.62 N ATOM 1422 CE2 TRP A 95 10.729 3.632 -9.209 1.00 12.51 C ATOM 1423 CE3 TRP A 95 12.702 5.067 -9.466 1.00 12.22 C ATOM 1424 CZ2 TRP A 95 11.514 2.487 -9.075 1.00 14.77 C ATOM 1425 CZ3 TRP A 95 13.482 3.942 -9.261 1.00 12.48 C ATOM 1426 CH2 TRP A 95 12.897 2.664 -9.073 1.00 13.14 C ATOM 1427 HA TRP A 95 11.533 7.478 -7.995 1.00 0.00 H ATOM 1428 HB2 TRP A 95 9.352 7.767 -10.025 1.00 0.00 H ATOM 1429 HB3 TRP A 95 11.088 7.604 -10.375 1.00 0.00 H ATOM 1430 HE1 TRP A 95 8.666 3.004 -9.065 1.00 0.00 H ATOM 1431 HD1 TRP A 95 8.026 5.520 -9.485 1.00 0.00 H ATOM 1432 HZ2 TRP A 95 11.066 1.498 -8.976 1.00 0.00 H ATOM 1433 HH2 TRP A 95 13.544 1.800 -8.923 1.00 0.00 H ATOM 1434 HZ3 TRP A 95 14.567 4.040 -9.244 1.00 0.00 H ATOM 1435 HE3 TRP A 95 13.159 6.033 -9.680 1.00 0.00 H ATOM 1436 H TRP A 95 8.593 8.218 -7.480 1.00 0.00 H ATOM 1437 N PHE A 96 12.255 9.765 -8.166 1.00 8.53 N ATOM 1438 CA PHE A 96 12.749 11.173 -8.029 1.00 8.15 C ATOM 1439 C PHE A 96 13.834 11.468 -9.030 1.00 9.21 C ATOM 1440 O PHE A 96 14.632 10.596 -9.370 1.00 9.92 O ATOM 1441 CB PHE A 96 13.328 11.349 -6.667 1.00 7.10 C ATOM 1442 CG PHE A 96 12.330 11.322 -5.554 1.00 6.27 C ATOM 1443 CD1 PHE A 96 11.671 12.503 -5.172 1.00 5.93 C ATOM 1444 CD2 PHE A 96 11.974 10.084 -4.980 1.00 6.18 C ATOM 1445 CE1 PHE A 96 10.661 12.485 -4.125 1.00 5.52 C ATOM 1446 CE2 PHE A 96 10.988 10.043 -3.958 1.00 5.75 C ATOM 1447 CZ PHE A 96 10.344 11.219 -3.554 1.00 5.47 C ATOM 1448 HA PHE A 96 11.909 11.847 -8.199 1.00 0.00 H ATOM 1449 HB2 PHE A 96 14.047 10.548 -6.498 1.00 0.00 H ATOM 1450 HB3 PHE A 96 13.843 12.309 -6.638 1.00 0.00 H ATOM 1451 HD2 PHE A 96 12.452 9.165 -5.318 1.00 0.00 H ATOM 1452 HE2 PHE A 96 10.732 9.094 -3.487 1.00 0.00 H ATOM 1453 HZ PHE A 96 9.578 11.164 -2.780 1.00 0.00 H ATOM 1454 HE1 PHE A 96 10.169 13.399 -3.792 1.00 0.00 H ATOM 1455 HD1 PHE A 96 11.919 13.443 -5.665 1.00 0.00 H ATOM 1456 H PHE A 96 12.938 8.984 -8.095 1.00 0.00 H ATOM 1457 N LYS A 97 13.770 12.705 -9.566 1.00 9.62 N ATOM 1458 CA LYS A 97 14.820 13.339 -10.331 1.00 10.73 C ATOM 1459 C LYS A 97 15.736 14.145 -9.382 1.00 10.07 C ATOM 1460 O LYS A 97 15.224 14.908 -8.529 1.00 9.08 O ATOM 1461 CB LYS A 97 14.211 14.301 -11.331 1.00 11.74 C ATOM 1462 CG LYS A 97 15.166 14.916 -12.237 1.00 16.29 C ATOM 1463 CD LYS A 97 14.435 15.954 -13.101 1.00 25.27 C ATOM 1464 CE LYS A 97 15.471 16.934 -13.756 1.00 26.70 C ATOM 1465 NZ LYS A 97 16.386 16.068 -14.653 1.00 37.71 N ATOM 1466 HA LYS A 97 15.394 12.570 -10.849 1.00 0.00 H ATOM 1467 HB2 LYS A 97 13.480 13.755 -11.927 1.00 0.00 H ATOM 1468 HB3 LYS A 97 13.708 15.094 -10.778 1.00 0.00 H ATOM 1469 HG2 LYS A 97 15.952 15.406 -11.663 1.00 0.00 H ATOM 1470 HG3 LYS A 97 15.608 14.152 -12.877 1.00 0.00 H ATOM 1471 HD2 LYS A 97 13.876 15.442 -13.885 1.00 0.00 H ATOM 1472 HD3 LYS A 97 13.745 16.522 -12.477 1.00 0.00 H ATOM 1473 HE2 LYS A 97 16.060 17.431 -12.985 1.00 0.00 H ATOM 1474 HE3 LYS A 97 14.954 17.683 -14.356 1.00 0.00 H ATOM 1475 HZ1 LYS A 97 16.866 15.354 -14.069 1.00 0.00 H ATOM 1476 HZ2 LYS A 97 15.811 15.595 -15.379 1.00 0.00 H ATOM 1477 HZ3 LYS A 97 17.094 16.675 -15.112 1.00 0.00 H ATOM 1478 H LYS A 97 12.894 13.246 -9.417 1.00 0.00 H ATOM 1479 N ILE A 98 17.039 14.020 -9.582 1.00 10.91 N ATOM 1480 CA ILE A 98 17.987 14.780 -8.736 1.00 10.65 C ATOM 1481 C ILE A 98 18.394 16.022 -9.541 1.00 11.94 C ATOM 1482 O ILE A 98 18.937 15.926 -10.658 1.00 13.60 O ATOM 1483 CB ILE A 98 19.247 13.888 -8.402 1.00 11.13 C ATOM 1484 CG1 ILE A 98 18.853 12.788 -7.416 1.00 9.93 C ATOM 1485 CG2 ILE A 98 20.409 14.770 -7.737 1.00 11.51 C ATOM 1486 CD1 ILE A 98 19.944 11.774 -7.190 1.00 11.30 C ATOM 1487 HA ILE A 98 17.534 15.068 -7.788 1.00 0.00 H ATOM 1488 HB ILE A 98 19.610 13.454 -9.334 1.00 0.00 H ATOM 1489 HG12 ILE A 98 18.607 13.251 -6.460 1.00 0.00 H ATOM 1490 HG13 ILE A 98 17.975 12.272 -7.805 1.00 0.00 H ATOM 1491 HD11 ILE A 98 20.194 11.294 -8.136 1.00 0.00 H ATOM 1492 HD12 ILE A 98 20.826 12.274 -6.790 1.00 0.00 H ATOM 1493 HD13 ILE A 98 19.598 11.022 -6.480 1.00 0.00 H ATOM 1494 HG21 ILE A 98 20.708 15.556 -8.430 1.00 0.00 H ATOM 1495 HG22 ILE A 98 20.040 15.218 -6.814 1.00 0.00 H ATOM 1496 HG23 ILE A 98 21.266 14.133 -7.516 1.00 0.00 H ATOM 1497 H ILE A 98 17.395 13.391 -10.330 1.00 0.00 H ATOM 1498 N GLU A 99 18.043 17.195 -8.985 1.00 11.39 N ATOM 1499 CA GLU A 99 18.144 18.435 -9.729 1.00 12.64 C ATOM 1500 C GLU A 99 19.132 19.409 -9.025 1.00 12.99 C ATOM 1501 O GLU A 99 18.730 20.156 -8.150 1.00 12.18 O ATOM 1502 CB GLU A 99 16.749 19.083 -9.819 1.00 12.15 C ATOM 1503 CG GLU A 99 16.729 20.304 -10.657 1.00 16.80 C ATOM 1504 CD GLU A 99 15.512 21.171 -10.338 1.00 23.69 C ATOM 1505 OE1 GLU A 99 14.408 20.714 -10.746 1.00 15.81 O ATOM 1506 OE2 GLU A 99 15.692 22.233 -9.635 1.00 21.11 O ATOM 1507 HA GLU A 99 18.519 18.224 -10.730 1.00 0.00 H ATOM 1508 HB2 GLU A 99 16.056 18.358 -10.245 1.00 0.00 H ATOM 1509 HB3 GLU A 99 16.423 19.347 -8.813 1.00 0.00 H ATOM 1510 HG2 GLU A 99 17.635 20.880 -10.469 1.00 0.00 H ATOM 1511 HG3 GLU A 99 16.695 20.015 -11.707 1.00 0.00 H ATOM 1512 H GLU A 99 17.694 17.213 -8.006 1.00 0.00 H ATOM 1513 N PRO A 100 20.400 19.449 -9.476 1.00 14.54 N ATOM 1514 CA PRO A 100 21.400 20.288 -8.822 1.00 15.17 C ATOM 1515 C PRO A 100 21.017 21.765 -8.850 1.00 15.65 C ATOM 1516 O PRO A 100 20.476 22.274 -9.858 1.00 16.56 O ATOM 1517 CB PRO A 100 22.665 20.102 -9.719 1.00 17.40 C ATOM 1518 CG PRO A 100 22.430 18.645 -10.225 1.00 17.27 C ATOM 1519 CD PRO A 100 20.971 18.768 -10.640 1.00 16.14 C ATOM 1520 HA PRO A 100 21.527 20.012 -7.775 1.00 0.00 H ATOM 1521 HD3 PRO A 100 20.862 19.365 -11.546 1.00 0.00 H ATOM 1522 HD2 PRO A 100 20.515 17.790 -10.794 1.00 0.00 H ATOM 1523 HG3 PRO A 100 22.569 17.910 -9.433 1.00 0.00 H ATOM 1524 HG2 PRO A 100 23.075 18.396 -11.068 1.00 0.00 H ATOM 1525 HB2 PRO A 100 22.686 20.817 -10.541 1.00 0.00 H ATOM 1526 HB3 PRO A 100 23.586 20.186 -9.142 1.00 0.00 H ATOM 1527 N GLY A 101 21.355 22.443 -7.760 1.00 15.34 N ATOM 1528 CA GLY A 101 21.293 23.909 -7.738 1.00 16.30 C ATOM 1529 C GLY A 101 22.501 24.638 -8.289 1.00 18.64 C ATOM 1530 O GLY A 101 23.415 24.051 -8.930 1.00 19.88 O ATOM 1531 HA3 GLY A 101 21.160 24.221 -6.702 1.00 0.00 H ATOM 1532 HA2 GLY A 101 20.425 24.214 -8.322 1.00 0.00 H ATOM 1533 H GLY A 101 21.667 21.929 -6.912 1.00 0.00 H ATOM 1534 N LYS A 102 22.488 25.962 -8.073 1.00 19.57 N ATOM 1535 CA LYS A 102 23.582 26.822 -8.486 1.00 22.04 C ATOM 1536 C LYS A 102 24.012 27.767 -7.346 1.00 22.43 C ATOM 1537 O LYS A 102 23.429 27.692 -6.238 1.00 20.73 O ATOM 1538 CB LYS A 102 23.164 27.642 -9.704 1.00 23.68 C ATOM 1539 CG LYS A 102 22.815 26.746 -10.864 1.00 23.77 C ATOM 1540 CD LYS A 102 22.420 27.514 -12.138 1.00 26.16 C ATOM 1541 CE LYS A 102 21.809 26.486 -13.104 1.00 33.22 C ATOM 1542 NZ LYS A 102 20.629 27.089 -13.791 1.00 42.64 N ATOM 1543 HA LYS A 102 24.432 26.189 -8.743 1.00 0.00 H ATOM 1544 HB2 LYS A 102 22.294 28.246 -9.446 1.00 0.00 H ATOM 1545 HB3 LYS A 102 23.987 28.296 -9.993 1.00 0.00 H ATOM 1546 HG2 LYS A 102 23.680 26.123 -11.091 1.00 0.00 H ATOM 1547 HG3 LYS A 102 21.979 26.111 -10.570 1.00 0.00 H ATOM 1548 HD2 LYS A 102 21.689 28.286 -11.900 1.00 0.00 H ATOM 1549 HD3 LYS A 102 23.300 27.975 -12.587 1.00 0.00 H ATOM 1550 HE2 LYS A 102 21.493 25.605 -12.545 1.00 0.00 H ATOM 1551 HE3 LYS A 102 22.553 26.197 -13.846 1.00 0.00 H ATOM 1552 HZ1 LYS A 102 19.920 27.364 -13.082 1.00 0.00 H ATOM 1553 HZ2 LYS A 102 20.932 27.929 -14.324 1.00 0.00 H ATOM 1554 HZ3 LYS A 102 20.217 26.393 -14.444 1.00 0.00 H ATOM 1555 H LYS A 102 21.668 26.386 -7.594 1.00 0.00 H ATOM 1556 N THR A 103 25.056 28.540 -7.623 1.00 24.86 N ATOM 1557 CA THR A 103 25.738 29.429 -6.677 1.00 25.96 C ATOM 1558 C THR A 103 25.862 28.703 -5.309 1.00 24.24 C ATOM 1559 O THR A 103 26.523 27.643 -5.254 1.00 24.00 O ATOM 1560 CB THR A 103 25.066 30.814 -6.580 1.00 26.66 C ATOM 1561 OG1 THR A 103 23.776 30.749 -5.960 1.00 24.46 O ATOM 1562 CG2 THR A 103 24.958 31.468 -7.992 1.00 28.62 C ATOM 1563 HA THR A 103 26.742 29.644 -7.042 1.00 0.00 H ATOM 1564 HB THR A 103 25.699 31.435 -5.946 1.00 0.00 H ATOM 1565 HG1 THR A 103 23.384 31.657 -5.920 1.00 0.00 H ATOM 1566 HG23 THR A 103 25.947 31.509 -8.448 1.00 0.00 H ATOM 1567 HG21 THR A 103 24.293 30.872 -8.617 1.00 0.00 H ATOM 1568 HG22 THR A 103 24.559 32.478 -7.894 1.00 0.00 H ATOM 1569 H THR A 103 25.422 28.512 -8.596 1.00 0.00 H ATOM 1570 N TYR A 104 25.239 29.236 -4.245 1.00 23.32 N ATOM 1571 CA TYR A 104 25.398 28.608 -2.897 1.00 22.12 C ATOM 1572 C TYR A 104 24.731 27.278 -2.749 1.00 19.77 C ATOM 1573 O TYR A 104 24.963 26.590 -1.772 1.00 19.00 O ATOM 1574 CB TYR A 104 25.094 29.585 -1.708 1.00 22.40 C ATOM 1575 CG TYR A 104 23.694 30.025 -1.654 1.00 21.23 C ATOM 1576 CD1 TYR A 104 22.713 29.233 -1.039 1.00 20.38 C ATOM 1577 CD2 TYR A 104 23.340 31.226 -2.208 1.00 22.83 C ATOM 1578 CE1 TYR A 104 21.398 29.625 -1.035 1.00 18.27 C ATOM 1579 CE2 TYR A 104 22.021 31.630 -2.212 1.00 21.70 C ATOM 1580 CZ TYR A 104 21.083 30.849 -1.569 1.00 20.22 C ATOM 1581 OH TYR A 104 19.801 31.296 -1.600 1.00 24.95 O ATOM 1582 HA TYR A 104 26.464 28.389 -2.834 1.00 0.00 H ATOM 1583 HB3 TYR A 104 25.729 30.465 -1.813 1.00 0.00 H ATOM 1584 HB2 TYR A 104 25.332 29.076 -0.774 1.00 0.00 H ATOM 1585 HD2 TYR A 104 24.104 31.866 -2.648 1.00 0.00 H ATOM 1586 HE2 TYR A 104 21.725 32.551 -2.715 1.00 0.00 H ATOM 1587 HE1 TYR A 104 20.624 28.981 -0.618 1.00 0.00 H ATOM 1588 HD1 TYR A 104 22.998 28.297 -0.559 1.00 0.00 H ATOM 1589 HH TYR A 104 19.220 30.661 -1.111 1.00 0.00 H ATOM 1590 H TYR A 104 24.647 30.084 -4.358 1.00 0.00 H ATOM 1591 N LEU A 105 23.916 26.896 -3.761 1.00 18.88 N ATOM 1592 CA LEU A 105 23.260 25.613 -3.799 1.00 16.93 C ATOM 1593 C LEU A 105 23.919 24.688 -4.827 1.00 17.49 C ATOM 1594 O LEU A 105 23.351 23.654 -5.123 1.00 16.20 O ATOM 1595 CB LEU A 105 21.792 25.823 -4.152 1.00 15.78 C ATOM 1596 CG LEU A 105 21.101 26.619 -3.016 1.00 15.35 C ATOM 1597 CD1 LEU A 105 19.600 26.845 -3.411 1.00 14.51 C ATOM 1598 CD2 LEU A 105 21.157 25.778 -1.682 1.00 14.15 C ATOM 1599 HA LEU A 105 23.347 25.140 -2.821 1.00 0.00 H ATOM 1600 HB2 LEU A 105 21.718 26.381 -5.085 1.00 0.00 H ATOM 1601 HB3 LEU A 105 21.303 24.856 -4.269 1.00 0.00 H ATOM 1602 HG LEU A 105 21.604 27.574 -2.868 1.00 0.00 H ATOM 1603 HD21 LEU A 105 20.641 24.829 -1.830 1.00 0.00 H ATOM 1604 HD22 LEU A 105 22.197 25.590 -1.416 1.00 0.00 H ATOM 1605 HD23 LEU A 105 20.671 26.336 -0.881 1.00 0.00 H ATOM 1606 HD11 LEU A 105 19.552 27.407 -4.344 1.00 0.00 H ATOM 1607 HD12 LEU A 105 19.111 25.880 -3.541 1.00 0.00 H ATOM 1608 HD13 LEU A 105 19.098 27.404 -2.622 1.00 0.00 H ATOM 1609 H LEU A 105 23.756 27.559 -4.547 1.00 0.00 H ATOM 1610 N SER A 106 25.082 25.093 -5.356 1.00 19.64 N ATOM 1611 CA SER A 106 25.767 24.231 -6.356 1.00 20.63 C ATOM 1612 C SER A 106 26.116 22.827 -5.866 1.00 19.68 C ATOM 1613 O SER A 106 26.226 21.893 -6.683 1.00 19.89 O ATOM 1614 CB SER A 106 26.986 24.916 -6.952 1.00 23.48 C ATOM 1615 OG SER A 106 28.036 24.986 -6.014 1.00 24.39 O ATOM 1616 HA SER A 106 25.024 24.086 -7.140 1.00 0.00 H ATOM 1617 HB2 SER A 106 26.713 25.926 -7.258 1.00 0.00 H ATOM 1618 HB3 SER A 106 27.322 24.352 -7.822 1.00 0.00 H ATOM 1619 HG SER A 106 27.737 25.501 -5.223 1.00 0.00 H ATOM 1620 H SER A 106 25.501 26.001 -5.070 1.00 0.00 H ATOM 1621 N LYS A 107 26.253 22.673 -4.552 1.00 18.83 N ATOM 1622 CA LYS A 107 26.506 21.368 -3.980 1.00 18.00 C ATOM 1623 C LYS A 107 25.300 20.734 -3.412 1.00 15.66 C ATOM 1624 O LYS A 107 25.395 19.695 -2.722 1.00 14.92 O ATOM 1625 CB LYS A 107 27.626 21.479 -2.909 1.00 19.14 C ATOM 1626 CG LYS A 107 28.932 22.039 -3.397 1.00 22.98 C ATOM 1627 CD LYS A 107 29.948 21.849 -2.299 1.00 34.48 C ATOM 1628 CE LYS A 107 30.760 23.107 -2.042 1.00 38.97 C ATOM 1629 NZ LYS A 107 31.737 23.486 -3.073 1.00 40.70 N ATOM 1630 HA LYS A 107 26.830 20.717 -4.792 1.00 0.00 H ATOM 1631 HB2 LYS A 107 27.263 22.122 -2.108 1.00 0.00 H ATOM 1632 HB3 LYS A 107 27.814 20.481 -2.515 1.00 0.00 H ATOM 1633 HG2 LYS A 107 29.251 21.510 -4.295 1.00 0.00 H ATOM 1634 HG3 LYS A 107 28.821 23.100 -3.622 1.00 0.00 H ATOM 1635 HD2 LYS A 107 29.427 21.574 -1.382 1.00 0.00 H ATOM 1636 HD3 LYS A 107 30.627 21.045 -2.584 1.00 0.00 H ATOM 1637 HE2 LYS A 107 31.304 22.964 -1.108 1.00 0.00 H ATOM 1638 HE3 LYS A 107 30.060 23.935 -1.930 1.00 0.00 H ATOM 1639 HZ1 LYS A 107 32.431 22.720 -3.189 1.00 0.00 H ATOM 1640 HZ2 LYS A 107 31.243 23.648 -3.974 1.00 0.00 H ATOM 1641 HZ3 LYS A 107 32.225 24.357 -2.783 1.00 0.00 H ATOM 1642 H LYS A 107 26.177 23.501 -3.928 1.00 0.00 H ATOM 1643 N TYR A 108 24.119 21.245 -3.769 1.00 14.66 N ATOM 1644 CA TYR A 108 22.902 20.678 -3.265 1.00 12.71 C ATOM 1645 C TYR A 108 22.016 20.360 -4.488 1.00 12.28 C ATOM 1646 O TYR A 108 22.345 20.693 -5.628 1.00 13.53 O ATOM 1647 CB TYR A 108 22.186 21.727 -2.383 1.00 12.21 C ATOM 1648 CG TYR A 108 22.838 21.970 -1.053 1.00 12.62 C ATOM 1649 CD1 TYR A 108 23.973 22.810 -0.926 1.00 14.39 C ATOM 1650 CD2 TYR A 108 22.270 21.348 0.100 1.00 11.46 C ATOM 1651 CE1 TYR A 108 24.566 23.058 0.340 1.00 15.04 C ATOM 1652 CE2 TYR A 108 22.914 21.554 1.373 1.00 12.16 C ATOM 1653 CZ TYR A 108 23.961 22.376 1.485 1.00 13.81 C ATOM 1654 OH TYR A 108 24.555 22.635 2.694 1.00 14.76 O ATOM 1655 HA TYR A 108 23.096 19.783 -2.674 1.00 0.00 H ATOM 1656 HB3 TYR A 108 21.167 21.384 -2.205 1.00 0.00 H ATOM 1657 HB2 TYR A 108 22.161 22.671 -2.928 1.00 0.00 H ATOM 1658 HD2 TYR A 108 21.373 20.734 0.020 1.00 0.00 H ATOM 1659 HE2 TYR A 108 22.542 21.033 2.255 1.00 0.00 H ATOM 1660 HE1 TYR A 108 25.425 23.720 0.453 1.00 0.00 H ATOM 1661 HD1 TYR A 108 24.398 23.274 -1.816 1.00 0.00 H ATOM 1662 HH TYR A 108 24.894 21.790 3.082 1.00 0.00 H ATOM 1663 H TYR A 108 24.082 22.058 -4.416 1.00 0.00 H ATOM 1664 N PHE A 109 20.894 19.737 -4.203 1.00 10.76 N ATOM 1665 CA PHE A 109 19.934 19.420 -5.260 1.00 10.44 C ATOM 1666 C PHE A 109 18.551 19.331 -4.679 1.00 9.05 C ATOM 1667 O PHE A 109 18.296 19.094 -3.494 1.00 8.19 O ATOM 1668 CB PHE A 109 20.279 18.046 -5.924 1.00 10.64 C ATOM 1669 CG PHE A 109 20.533 16.948 -4.898 1.00 9.82 C ATOM 1670 CD1 PHE A 109 19.497 16.226 -4.340 1.00 8.98 C ATOM 1671 CD2 PHE A 109 21.855 16.747 -4.447 1.00 10.70 C ATOM 1672 CE1 PHE A 109 19.704 15.225 -3.373 1.00 7.97 C ATOM 1673 CE2 PHE A 109 22.136 15.734 -3.463 1.00 10.21 C ATOM 1674 CZ PHE A 109 21.039 14.967 -2.949 1.00 8.83 C ATOM 1675 HA PHE A 109 19.982 20.209 -6.010 1.00 0.00 H ATOM 1676 HB2 PHE A 109 19.445 17.745 -6.559 1.00 0.00 H ATOM 1677 HB3 PHE A 109 21.174 18.168 -6.535 1.00 0.00 H ATOM 1678 HD2 PHE A 109 22.665 17.359 -4.844 1.00 0.00 H ATOM 1679 HE2 PHE A 109 23.155 15.555 -3.118 1.00 0.00 H ATOM 1680 HZ PHE A 109 21.229 14.176 -2.224 1.00 0.00 H ATOM 1681 HE1 PHE A 109 18.866 14.663 -2.960 1.00 0.00 H ATOM 1682 HD1 PHE A 109 18.478 16.440 -4.661 1.00 0.00 H ATOM 1683 H PHE A 109 20.688 19.468 -3.220 1.00 0.00 H ATOM 1684 N ARG A 110 17.582 19.521 -5.616 1.00 9.13 N ATOM 1685 CA ARG A 110 16.205 19.217 -5.248 1.00 8.09 C ATOM 1686 C ARG A 110 15.955 17.715 -5.550 1.00 7.61 C ATOM 1687 O ARG A 110 16.660 17.099 -6.398 1.00 8.31 O ATOM 1688 CB ARG A 110 15.217 20.108 -6.056 1.00 8.64 C ATOM 1689 CG ARG A 110 15.488 21.614 -5.762 1.00 9.36 C ATOM 1690 CD ARG A 110 14.247 22.421 -6.065 1.00 9.70 C ATOM 1691 NE ARG A 110 13.777 22.196 -7.467 1.00 10.47 N ATOM 1692 CZ ARG A 110 12.528 22.434 -7.919 1.00 10.81 C ATOM 1693 NH1 ARG A 110 11.545 22.886 -7.092 1.00 10.44 N ATOM 1694 NH2 ARG A 110 12.206 22.193 -9.190 1.00 11.77 N ATOM 1695 HA ARG A 110 16.042 19.421 -4.190 1.00 0.00 H ATOM 1696 HB2 ARG A 110 15.350 19.919 -7.121 1.00 0.00 H ATOM 1697 HB3 ARG A 110 14.194 19.863 -5.770 1.00 0.00 H ATOM 1698 HG2 ARG A 110 15.754 21.737 -4.712 1.00 0.00 H ATOM 1699 HG3 ARG A 110 16.310 21.964 -6.387 1.00 0.00 H ATOM 1700 HD2 ARG A 110 14.471 23.479 -5.931 1.00 0.00 H ATOM 1701 HD3 ARG A 110 13.456 22.128 -5.374 1.00 0.00 H ATOM 1702 HE ARG A 110 14.469 21.826 -8.149 1.00 0.00 H ATOM 1703 HH12 ARG A 110 10.591 23.061 -7.466 1.00 0.00 H ATOM 1704 HH11 ARG A 110 11.749 23.056 -6.086 1.00 0.00 H ATOM 1705 HH22 ARG A 110 11.240 22.381 -9.526 1.00 0.00 H ATOM 1706 HH21 ARG A 110 12.921 21.817 -9.845 1.00 0.00 H ATOM 1707 H ARG A 110 17.817 19.873 -6.566 1.00 0.00 H ATOM 1708 N LEU A 111 14.953 17.197 -4.896 1.00 7.61 N ATOM 1709 CA LEU A 111 14.465 15.830 -5.167 1.00 6.42 C ATOM 1710 C LEU A 111 13.035 16.030 -5.703 1.00 6.53 C ATOM 1711 O LEU A 111 12.078 16.222 -4.937 1.00 6.55 O ATOM 1712 CB LEU A 111 14.500 14.983 -3.864 1.00 6.46 C ATOM 1713 CG LEU A 111 15.897 14.551 -3.455 1.00 5.82 C ATOM 1714 CD1 LEU A 111 15.862 13.924 -1.927 1.00 5.23 C ATOM 1715 CD2 LEU A 111 16.532 13.567 -4.500 1.00 7.55 C ATOM 1716 HA LEU A 111 15.078 15.286 -5.885 1.00 0.00 H ATOM 1717 HB2 LEU A 111 14.072 15.576 -3.056 1.00 0.00 H ATOM 1718 HB3 LEU A 111 13.894 14.090 -4.017 1.00 0.00 H ATOM 1719 HG LEU A 111 16.547 15.426 -3.443 1.00 0.00 H ATOM 1720 HD21 LEU A 111 15.909 12.677 -4.584 1.00 0.00 H ATOM 1721 HD22 LEU A 111 16.596 14.061 -5.470 1.00 0.00 H ATOM 1722 HD23 LEU A 111 17.531 13.283 -4.169 1.00 0.00 H ATOM 1723 HD11 LEU A 111 15.500 14.682 -1.233 1.00 0.00 H ATOM 1724 HD12 LEU A 111 15.196 13.062 -1.905 1.00 0.00 H ATOM 1725 HD13 LEU A 111 16.867 13.616 -1.639 1.00 0.00 H ATOM 1726 H LEU A 111 14.483 17.764 -4.161 1.00 0.00 H ATOM 1727 N VAL A 112 12.921 15.929 -7.003 1.00 7.39 N ATOM 1728 CA VAL A 112 11.663 16.297 -7.676 1.00 7.93 C ATOM 1729 C VAL A 112 11.019 14.999 -8.070 1.00 8.06 C ATOM 1730 O VAL A 112 11.627 14.185 -8.782 1.00 8.63 O ATOM 1731 CB VAL A 112 11.937 17.201 -8.906 1.00 9.22 C ATOM 1732 CG1 VAL A 112 10.642 17.369 -9.695 1.00 10.06 C ATOM 1733 CG2 VAL A 112 12.554 18.545 -8.445 1.00 10.28 C ATOM 1734 HA VAL A 112 11.008 16.875 -7.024 1.00 0.00 H ATOM 1735 HB VAL A 112 12.666 16.742 -9.573 1.00 0.00 H ATOM 1736 HG11 VAL A 112 10.291 16.392 -10.026 1.00 0.00 H ATOM 1737 HG12 VAL A 112 9.888 17.831 -9.058 1.00 0.00 H ATOM 1738 HG13 VAL A 112 10.826 18.004 -10.562 1.00 0.00 H ATOM 1739 HG21 VAL A 112 11.860 19.051 -7.774 1.00 0.00 H ATOM 1740 HG22 VAL A 112 13.491 18.353 -7.923 1.00 0.00 H ATOM 1741 HG23 VAL A 112 12.743 19.174 -9.315 1.00 0.00 H ATOM 1742 H VAL A 112 13.725 15.586 -7.566 1.00 0.00 H ATOM 1743 N GLN A 113 9.744 14.849 -7.717 1.00 7.93 N ATOM 1744 CA GLN A 113 8.985 13.688 -8.149 1.00 8.39 C ATOM 1745 C GLN A 113 8.155 14.123 -9.348 1.00 9.72 C ATOM 1746 O GLN A 113 7.183 14.934 -9.206 1.00 10.03 O ATOM 1747 CB GLN A 113 8.081 13.296 -6.968 1.00 7.78 C ATOM 1748 CG GLN A 113 7.646 11.798 -7.144 1.00 8.17 C ATOM 1749 CD GLN A 113 6.757 11.553 -8.293 1.00 9.49 C ATOM 1750 OE1 GLN A 113 5.633 12.105 -8.358 1.00 10.09 O ATOM 1751 NE2 GLN A 113 7.265 10.768 -9.304 1.00 10.27 N ATOM 1752 HA GLN A 113 9.609 12.840 -8.432 1.00 0.00 H ATOM 1753 HB2 GLN A 113 8.628 13.412 -6.032 1.00 0.00 H ATOM 1754 HB3 GLN A 113 7.198 13.935 -6.953 1.00 0.00 H ATOM 1755 HG2 GLN A 113 8.545 11.195 -7.273 1.00 0.00 H ATOM 1756 HG3 GLN A 113 7.127 11.485 -6.238 1.00 0.00 H ATOM 1757 HE22 GLN A 113 8.204 10.332 -9.202 1.00 0.00 H ATOM 1758 HE21 GLN A 113 6.710 10.611 -10.170 1.00 0.00 H ATOM 1759 H GLN A 113 9.286 15.571 -7.125 1.00 0.00 H ATOM 1760 N PRO A 114 8.616 13.760 -10.572 1.00 10.80 N ATOM 1761 CA PRO A 114 8.100 14.493 -11.741 1.00 12.32 C ATOM 1762 C PRO A 114 6.630 14.207 -12.027 1.00 13.21 C ATOM 1763 O PRO A 114 5.900 15.156 -12.453 1.00 14.17 O ATOM 1764 CB PRO A 114 9.020 14.011 -12.905 1.00 13.52 C ATOM 1765 CG PRO A 114 10.369 13.512 -12.150 1.00 12.34 C ATOM 1766 CD PRO A 114 9.749 12.851 -10.915 1.00 10.95 C ATOM 1767 HA PRO A 114 8.126 15.572 -11.589 1.00 0.00 H ATOM 1768 HD3 PRO A 114 9.389 11.849 -11.147 1.00 0.00 H ATOM 1769 HD2 PRO A 114 10.468 12.797 -10.098 1.00 0.00 H ATOM 1770 HG3 PRO A 114 11.016 14.347 -11.881 1.00 0.00 H ATOM 1771 HG2 PRO A 114 10.931 12.798 -12.753 1.00 0.00 H ATOM 1772 HB2 PRO A 114 8.556 13.192 -13.454 1.00 0.00 H ATOM 1773 HB3 PRO A 114 9.239 14.829 -13.592 1.00 0.00 H ATOM 1774 N SER A 115 6.160 12.963 -11.775 1.00 13.14 N ATOM 1775 CA SER A 115 4.786 12.661 -12.325 1.00 14.76 C ATOM 1776 C SER A 115 3.729 13.420 -11.432 1.00 14.27 C ATOM 1777 O SER A 115 2.663 13.842 -11.961 1.00 15.73 O ATOM 1778 CB SER A 115 4.498 11.166 -12.343 1.00 15.65 C ATOM 1779 OG SER A 115 4.532 10.674 -11.014 1.00 13.54 O ATOM 1780 HA SER A 115 4.729 13.000 -13.359 1.00 0.00 H ATOM 1781 HB2 SER A 115 5.252 10.655 -12.942 1.00 0.00 H ATOM 1782 HB3 SER A 115 3.513 10.988 -12.774 1.00 0.00 H ATOM 1783 HG SER A 115 3.846 11.140 -10.473 1.00 0.00 H ATOM 1784 H SER A 115 6.709 12.261 -11.238 1.00 0.00 H ATOM 1785 N THR A 116 4.005 13.595 -10.158 1.00 12.74 N ATOM 1786 CA THR A 116 3.078 14.429 -9.296 1.00 12.70 C ATOM 1787 C THR A 116 3.491 15.902 -9.284 1.00 12.88 C ATOM 1788 O THR A 116 2.746 16.790 -8.782 1.00 13.61 O ATOM 1789 CB THR A 116 2.956 13.938 -7.812 1.00 11.60 C ATOM 1790 OG1 THR A 116 4.219 14.011 -7.134 1.00 10.10 O ATOM 1791 CG2 THR A 116 2.460 12.421 -7.773 1.00 12.06 C ATOM 1792 HA THR A 116 2.101 14.308 -9.765 1.00 0.00 H ATOM 1793 HB THR A 116 2.238 14.589 -7.313 1.00 0.00 H ATOM 1794 HG1 THR A 116 4.877 13.439 -7.603 1.00 0.00 H ATOM 1795 HG23 THR A 116 1.500 12.341 -8.283 1.00 0.00 H ATOM 1796 HG21 THR A 116 3.193 11.788 -8.273 1.00 0.00 H ATOM 1797 HG22 THR A 116 2.350 12.103 -6.736 1.00 0.00 H ATOM 1798 H THR A 116 4.856 13.163 -9.744 1.00 0.00 H ATOM 1799 N GLY A 117 4.658 16.206 -9.868 1.00 12.25 N ATOM 1800 CA GLY A 117 5.102 17.598 -9.934 1.00 12.36 C ATOM 1801 C GLY A 117 5.446 18.241 -8.616 1.00 11.17 C ATOM 1802 O GLY A 117 5.167 19.458 -8.460 1.00 11.70 O ATOM 1803 HA3 GLY A 117 4.304 18.182 -10.393 1.00 0.00 H ATOM 1804 HA2 GLY A 117 5.989 17.637 -10.567 1.00 0.00 H ATOM 1805 H GLY A 117 5.248 15.452 -10.274 1.00 0.00 H ATOM 1806 N THR A 118 6.055 17.452 -7.714 1.00 9.86 N ATOM 1807 CA THR A 118 6.332 17.950 -6.384 1.00 8.97 C ATOM 1808 C THR A 118 7.805 17.893 -6.111 1.00 8.33 C ATOM 1809 O THR A 118 8.523 17.077 -6.693 1.00 9.42 O ATOM 1810 CB THR A 118 5.583 17.103 -5.282 1.00 8.57 C ATOM 1811 OG1 THR A 118 5.856 15.695 -5.451 1.00 8.17 O ATOM 1812 CG2 THR A 118 4.065 17.278 -5.470 1.00 11.71 C ATOM 1813 HA THR A 118 5.977 18.980 -6.340 1.00 0.00 H ATOM 1814 HB THR A 118 5.920 17.442 -4.303 1.00 0.00 H ATOM 1815 HG1 THR A 118 5.546 15.405 -6.345 1.00 0.00 H ATOM 1816 HG23 THR A 118 3.804 18.330 -5.352 1.00 0.00 H ATOM 1817 HG21 THR A 118 3.783 16.942 -6.468 1.00 0.00 H ATOM 1818 HG22 THR A 118 3.537 16.685 -4.723 1.00 0.00 H ATOM 1819 H THR A 118 6.327 16.482 -7.972 1.00 0.00 H ATOM 1820 N ALA A 119 8.236 18.680 -5.143 1.00 7.66 N ATOM 1821 CA ALA A 119 9.631 18.662 -4.727 1.00 7.01 C ATOM 1822 C ALA A 119 9.636 18.460 -3.212 1.00 6.35 C ATOM 1823 O ALA A 119 8.865 19.128 -2.462 1.00 6.65 O ATOM 1824 CB ALA A 119 10.342 19.962 -5.145 1.00 9.50 C ATOM 1825 HA ALA A 119 10.181 17.854 -5.211 1.00 0.00 H ATOM 1826 HB1 ALA A 119 10.299 20.066 -6.229 1.00 0.00 H ATOM 1827 HB2 ALA A 119 9.846 20.812 -4.677 1.00 0.00 H ATOM 1828 HB3 ALA A 119 11.383 19.925 -4.823 1.00 0.00 H ATOM 1829 H ALA A 119 7.569 19.323 -4.670 1.00 0.00 H ATOM 1830 N LEU A 120 10.552 17.673 -2.724 1.00 5.73 N ATOM 1831 CA LEU A 120 10.676 17.505 -1.231 1.00 5.36 C ATOM 1832 C LEU A 120 11.150 18.800 -0.534 1.00 5.70 C ATOM 1833 O LEU A 120 11.813 19.673 -1.207 1.00 6.62 O ATOM 1834 CB LEU A 120 11.603 16.320 -0.785 1.00 4.87 C ATOM 1835 CG LEU A 120 11.156 14.922 -1.266 1.00 4.72 C ATOM 1836 CD1 LEU A 120 12.329 13.923 -0.779 1.00 5.05 C ATOM 1837 CD2 LEU A 120 9.759 14.634 -0.590 1.00 4.93 C ATOM 1838 HA LEU A 120 9.662 17.263 -0.914 1.00 0.00 H ATOM 1839 HB2 LEU A 120 12.603 16.508 -1.175 1.00 0.00 H ATOM 1840 HB3 LEU A 120 11.636 16.308 0.304 1.00 0.00 H ATOM 1841 HG LEU A 120 11.021 14.814 -2.342 1.00 0.00 H ATOM 1842 HD21 LEU A 120 9.870 14.654 0.494 1.00 0.00 H ATOM 1843 HD22 LEU A 120 9.044 15.397 -0.897 1.00 0.00 H ATOM 1844 HD23 LEU A 120 9.401 13.653 -0.902 1.00 0.00 H ATOM 1845 HD11 LEU A 120 13.273 14.224 -1.233 1.00 0.00 H ATOM 1846 HD12 LEU A 120 12.416 13.969 0.307 1.00 0.00 H ATOM 1847 HD13 LEU A 120 12.087 12.905 -1.083 1.00 0.00 H ATOM 1848 H LEU A 120 11.195 17.162 -3.362 1.00 0.00 H ATOM 1849 N VAL A 121 10.652 18.956 0.724 1.00 5.88 N ATOM 1850 CA VAL A 121 10.923 20.141 1.538 1.00 6.49 C ATOM 1851 C VAL A 121 11.542 19.672 2.849 1.00 6.47 C ATOM 1852 O VAL A 121 10.986 18.707 3.506 1.00 6.37 O ATOM 1853 CB VAL A 121 9.592 20.879 1.779 1.00 7.28 C ATOM 1854 CG1 VAL A 121 9.688 22.013 2.865 1.00 8.24 C ATOM 1855 CG2 VAL A 121 9.097 21.554 0.487 1.00 7.64 C ATOM 1856 HA VAL A 121 11.612 20.826 1.044 1.00 0.00 H ATOM 1857 HB VAL A 121 8.906 20.106 2.126 1.00 0.00 H ATOM 1858 HG11 VAL A 121 9.997 21.579 3.816 1.00 0.00 H ATOM 1859 HG12 VAL A 121 10.420 22.756 2.549 1.00 0.00 H ATOM 1860 HG13 VAL A 121 8.713 22.487 2.980 1.00 0.00 H ATOM 1861 HG21 VAL A 121 9.841 22.274 0.147 1.00 0.00 H ATOM 1862 HG22 VAL A 121 8.944 20.796 -0.282 1.00 0.00 H ATOM 1863 HG23 VAL A 121 8.156 22.068 0.684 1.00 0.00 H ATOM 1864 H VAL A 121 10.055 18.203 1.122 1.00 0.00 H ATOM 1865 N SER A 122 12.561 20.405 3.307 1.00 6.89 N ATOM 1866 CA SER A 122 13.200 20.167 4.632 1.00 7.29 C ATOM 1867 C SER A 122 13.480 21.521 5.254 1.00 8.38 C ATOM 1868 O SER A 122 14.311 22.265 4.786 1.00 8.67 O ATOM 1869 CB SER A 122 14.473 19.339 4.396 1.00 6.85 C ATOM 1870 OG SER A 122 15.186 19.102 5.646 1.00 7.47 O ATOM 1871 HA SER A 122 12.565 19.608 5.319 1.00 0.00 H ATOM 1872 HB2 SER A 122 15.126 19.878 3.710 1.00 0.00 H ATOM 1873 HB3 SER A 122 14.198 18.381 3.956 1.00 0.00 H ATOM 1874 HG SER A 122 15.442 19.970 6.048 1.00 0.00 H ATOM 1875 H SER A 122 12.925 21.176 2.712 1.00 0.00 H ATOM 1876 N ARG A 123 12.717 21.901 6.279 1.00 9.25 N ATOM 1877 CA ARG A 123 12.707 23.297 6.729 1.00 10.54 C ATOM 1878 C ARG A 123 12.471 23.364 8.243 1.00 11.81 C ATOM 1879 O ARG A 123 12.106 22.352 8.927 1.00 11.75 O ATOM 1880 CB ARG A 123 11.648 24.115 6.004 1.00 10.82 C ATOM 1881 CG ARG A 123 10.200 23.548 6.376 1.00 10.99 C ATOM 1882 CD ARG A 123 9.134 24.201 5.481 1.00 11.31 C ATOM 1883 NE ARG A 123 7.854 23.466 5.639 1.00 11.46 N ATOM 1884 CZ ARG A 123 6.773 23.752 4.900 1.00 11.90 C ATOM 1885 NH1 ARG A 123 6.795 24.747 4.001 1.00 12.17 N ATOM 1886 NH2 ARG A 123 5.647 23.071 5.105 1.00 12.27 N ATOM 1887 HA ARG A 123 13.681 23.725 6.493 1.00 0.00 H ATOM 1888 HB2 ARG A 123 11.721 25.159 6.309 1.00 0.00 H ATOM 1889 HB3 ARG A 123 11.803 24.041 4.928 1.00 0.00 H ATOM 1890 HG2 ARG A 123 10.185 22.468 6.226 1.00 0.00 H ATOM 1891 HG3 ARG A 123 9.982 23.772 7.420 1.00 0.00 H ATOM 1892 HD2 ARG A 123 9.454 24.158 4.440 1.00 0.00 H ATOM 1893 HD3 ARG A 123 8.997 25.242 5.775 1.00 0.00 H ATOM 1894 HE ARG A 123 7.794 22.705 6.345 1.00 0.00 H ATOM 1895 HH12 ARG A 123 5.947 24.956 3.436 1.00 0.00 H ATOM 1896 HH11 ARG A 123 7.660 25.310 3.869 1.00 0.00 H ATOM 1897 HH22 ARG A 123 4.801 23.283 4.539 1.00 0.00 H ATOM 1898 HH21 ARG A 123 5.614 22.327 5.831 1.00 0.00 H ATOM 1899 H ARG A 123 12.122 21.200 6.765 1.00 0.00 H ATOM 1900 N THR A 124 12.723 24.535 8.792 1.00 13.22 N ATOM 1901 CA THR A 124 12.410 24.748 10.178 1.00 14.83 C ATOM 1902 C THR A 124 11.361 25.795 10.404 1.00 16.24 C ATOM 1903 O THR A 124 10.970 25.951 11.560 1.00 17.87 O ATOM 1904 CB THR A 124 13.665 25.173 10.968 1.00 16.45 C ATOM 1905 OG1 THR A 124 14.189 26.368 10.354 1.00 16.50 O ATOM 1906 CG2 THR A 124 14.635 24.008 11.004 1.00 16.70 C ATOM 1907 HA THR A 124 12.025 23.790 10.528 1.00 0.00 H ATOM 1908 HB THR A 124 13.449 25.418 12.008 1.00 0.00 H ATOM 1909 HG1 THR A 124 13.504 27.082 10.387 1.00 0.00 H ATOM 1910 HG23 THR A 124 14.157 23.153 11.482 1.00 0.00 H ATOM 1911 HG21 THR A 124 14.921 23.743 9.986 1.00 0.00 H ATOM 1912 HG22 THR A 124 15.522 24.293 11.569 1.00 0.00 H ATOM 1913 H THR A 124 13.145 25.299 8.227 1.00 0.00 H ATOM 1914 N HIS A 125 10.953 26.583 9.387 1.00 16.03 N ATOM 1915 CA HIS A 125 10.157 27.749 9.730 1.00 17.86 C ATOM 1916 C HIS A 125 8.640 27.565 9.727 1.00 18.33 C ATOM 1917 O HIS A 125 7.893 28.480 10.183 1.00 22.05 O ATOM 1918 CB HIS A 125 10.487 28.921 8.810 1.00 18.23 C ATOM 1919 CG HIS A 125 10.282 28.581 7.380 1.00 19.43 C ATOM 1920 ND1 HIS A 125 11.136 27.736 6.705 1.00 21.83 N ATOM 1921 CD2 HIS A 125 9.311 28.931 6.493 1.00 20.30 C ATOM 1922 CE1 HIS A 125 10.733 27.633 5.452 1.00 19.04 C ATOM 1923 NE2 HIS A 125 9.633 28.351 5.301 1.00 18.22 N ATOM 1924 HA HIS A 125 10.439 27.940 10.766 1.00 0.00 H ATOM 1925 HB2 HIS A 125 9.844 29.763 9.067 1.00 0.00 H ATOM 1926 HB3 HIS A 125 11.529 29.203 8.959 1.00 0.00 H ATOM 1927 HD2 HIS A 125 8.441 29.556 6.696 1.00 0.00 H ATOM 1928 HE1 HIS A 125 11.225 27.053 4.672 1.00 0.00 H ATOM 1929 H HIS A 125 11.198 26.365 8.400 1.00 0.00 H ATOM 1930 N LEU A 126 8.223 26.450 9.168 1.00 16.82 N ATOM 1931 CA LEU A 126 6.793 26.163 9.036 1.00 17.31 C ATOM 1932 C LEU A 126 6.659 24.624 9.044 1.00 16.02 C ATOM 1933 O LEU A 126 7.550 23.900 8.604 1.00 14.39 O ATOM 1934 CB LEU A 126 6.325 26.698 7.711 1.00 16.88 C ATOM 1935 CG LEU A 126 4.964 27.259 7.415 1.00 23.28 C ATOM 1936 CD1 LEU A 126 4.585 26.739 6.079 1.00 17.54 C ATOM 1937 CD2 LEU A 126 3.906 27.052 8.499 1.00 28.68 C ATOM 1938 HA LEU A 126 6.205 26.615 9.835 1.00 0.00 H ATOM 1939 HB2 LEU A 126 7.023 27.497 7.463 1.00 0.00 H ATOM 1940 HB3 LEU A 126 6.453 25.874 7.009 1.00 0.00 H ATOM 1941 HG LEU A 126 5.016 28.348 7.408 1.00 0.00 H ATOM 1942 HD21 LEU A 126 3.765 25.984 8.668 1.00 0.00 H ATOM 1943 HD22 LEU A 126 4.236 27.527 9.423 1.00 0.00 H ATOM 1944 HD23 LEU A 126 2.965 27.498 8.176 1.00 0.00 H ATOM 1945 HD11 LEU A 126 5.316 27.070 5.341 1.00 0.00 H ATOM 1946 HD12 LEU A 126 4.563 25.650 6.107 1.00 0.00 H ATOM 1947 HD13 LEU A 126 3.598 27.116 5.810 1.00 0.00 H ATOM 1948 H LEU A 126 8.919 25.762 8.815 1.00 0.00 H ATOM 1949 N GLN A 127 5.539 24.158 9.592 1.00 17.08 N ATOM 1950 CA GLN A 127 5.219 22.730 9.594 1.00 16.26 C ATOM 1951 C GLN A 127 4.250 22.426 8.464 1.00 15.74 C ATOM 1952 O GLN A 127 3.441 23.315 8.090 1.00 16.81 O ATOM 1953 CB GLN A 127 4.563 22.296 10.931 1.00 18.12 C ATOM 1954 CG GLN A 127 5.519 22.472 12.183 1.00 19.02 C ATOM 1955 CD GLN A 127 4.803 22.292 13.509 1.00 30.23 C ATOM 1956 OE1 GLN A 127 4.731 21.203 14.028 1.00 34.83 O ATOM 1957 NE2 GLN A 127 4.295 23.365 14.060 1.00 34.01 N ATOM 1958 HA GLN A 127 6.152 22.181 9.465 1.00 0.00 H ATOM 1959 HB2 GLN A 127 3.669 22.899 11.090 1.00 0.00 H ATOM 1960 HB3 GLN A 127 4.282 21.246 10.854 1.00 0.00 H ATOM 1961 HG2 GLN A 127 6.318 21.733 12.117 1.00 0.00 H ATOM 1962 HG3 GLN A 127 5.949 23.473 12.154 1.00 0.00 H ATOM 1963 HE22 GLN A 127 4.378 24.284 13.581 1.00 0.00 H ATOM 1964 HE21 GLN A 127 3.808 23.298 14.977 1.00 0.00 H ATOM 1965 H GLN A 127 4.874 24.826 10.030 1.00 0.00 H ATOM 1966 N PRO A 128 4.273 21.165 7.937 1.00 14.40 N ATOM 1967 CA PRO A 128 5.216 20.079 8.315 1.00 13.31 C ATOM 1968 C PRO A 128 6.634 20.382 7.929 1.00 12.00 C ATOM 1969 O PRO A 128 6.908 21.046 6.882 1.00 11.30 O ATOM 1970 CB PRO A 128 4.749 18.854 7.470 1.00 12.36 C ATOM 1971 CG PRO A 128 3.233 19.138 7.344 1.00 13.83 C ATOM 1972 CD PRO A 128 3.234 20.656 7.001 1.00 14.29 C ATOM 1973 HA PRO A 128 5.204 19.929 9.394 1.00 0.00 H ATOM 1974 HD3 PRO A 128 3.513 20.831 5.962 1.00 0.00 H ATOM 1975 HD2 PRO A 128 2.263 21.110 7.197 1.00 0.00 H ATOM 1976 HG3 PRO A 128 2.711 18.941 8.280 1.00 0.00 H ATOM 1977 HG2 PRO A 128 2.781 18.549 6.546 1.00 0.00 H ATOM 1978 HB2 PRO A 128 5.234 18.833 6.494 1.00 0.00 H ATOM 1979 HB3 PRO A 128 4.938 17.914 7.989 1.00 0.00 H ATOM 1980 N TYR A 129 7.584 19.955 8.791 1.00 11.96 N ATOM 1981 CA TYR A 129 8.983 20.271 8.557 1.00 11.14 C ATOM 1982 C TYR A 129 9.568 19.483 7.413 1.00 9.48 C ATOM 1983 O TYR A 129 10.352 20.060 6.623 1.00 8.88 O ATOM 1984 CB TYR A 129 9.837 20.076 9.813 1.00 11.91 C ATOM 1985 CG TYR A 129 9.440 20.934 10.936 1.00 13.82 C ATOM 1986 CD1 TYR A 129 9.300 22.332 10.787 1.00 14.61 C ATOM 1987 CD2 TYR A 129 9.192 20.380 12.218 1.00 15.23 C ATOM 1988 CE1 TYR A 129 8.954 23.147 11.933 1.00 16.79 C ATOM 1989 CE2 TYR A 129 8.846 21.184 13.312 1.00 17.40 C ATOM 1990 CZ TYR A 129 8.698 22.553 13.135 1.00 18.13 C ATOM 1991 OH TYR A 129 8.346 23.326 14.154 1.00 22.51 O ATOM 1992 HA TYR A 129 9.004 21.327 8.287 1.00 0.00 H ATOM 1993 HB3 TYR A 129 10.875 20.296 9.562 1.00 0.00 H ATOM 1994 HB2 TYR A 129 9.754 19.036 10.128 1.00 0.00 H ATOM 1995 HD2 TYR A 129 9.273 19.302 12.355 1.00 0.00 H ATOM 1996 HE2 TYR A 129 8.694 20.738 14.295 1.00 0.00 H ATOM 1997 HE1 TYR A 129 8.898 24.231 11.836 1.00 0.00 H ATOM 1998 HD1 TYR A 129 9.452 22.796 9.812 1.00 0.00 H ATOM 1999 HH TYR A 129 9.023 23.252 14.872 1.00 0.00 H ATOM 2000 H TYR A 129 7.312 19.398 9.626 1.00 0.00 H ATOM 2001 N PHE A 130 9.173 18.214 7.298 1.00 9.01 N ATOM 2002 CA PHE A 130 9.424 17.406 6.126 1.00 7.75 C ATOM 2003 C PHE A 130 8.141 17.313 5.328 1.00 7.81 C ATOM 2004 O PHE A 130 7.124 16.886 5.839 1.00 8.59 O ATOM 2005 CB PHE A 130 9.851 15.993 6.576 1.00 7.51 C ATOM 2006 CG PHE A 130 10.137 15.060 5.433 1.00 6.53 C ATOM 2007 CD1 PHE A 130 10.913 15.515 4.329 1.00 5.78 C ATOM 2008 CD2 PHE A 130 9.651 13.740 5.484 1.00 6.56 C ATOM 2009 CE1 PHE A 130 11.209 14.661 3.206 1.00 5.22 C ATOM 2010 CE2 PHE A 130 9.897 12.832 4.340 1.00 6.33 C ATOM 2011 CZ PHE A 130 10.658 13.278 3.241 1.00 5.23 C ATOM 2012 HA PHE A 130 10.212 17.849 5.517 1.00 0.00 H ATOM 2013 HB2 PHE A 130 10.752 16.082 7.183 1.00 0.00 H ATOM 2014 HB3 PHE A 130 9.049 15.566 7.178 1.00 0.00 H ATOM 2015 HD2 PHE A 130 9.099 13.390 6.356 1.00 0.00 H ATOM 2016 HE2 PHE A 130 9.490 11.821 4.348 1.00 0.00 H ATOM 2017 HZ PHE A 130 10.846 12.602 2.406 1.00 0.00 H ATOM 2018 HE1 PHE A 130 11.810 15.012 2.367 1.00 0.00 H ATOM 2019 HD1 PHE A 130 11.293 16.536 4.333 1.00 0.00 H ATOM 2020 H PHE A 130 8.658 17.784 8.093 1.00 0.00 H ATOM 2021 N TRP A 131 8.187 17.794 4.067 1.00 7.26 N ATOM 2022 CA TRP A 131 6.940 17.956 3.267 1.00 7.66 C ATOM 2023 C TRP A 131 7.263 17.980 1.796 1.00 7.15 C ATOM 2024 O TRP A 131 8.333 17.529 1.430 1.00 6.22 O ATOM 2025 CB TRP A 131 6.181 19.213 3.758 1.00 8.88 C ATOM 2026 CG TRP A 131 4.664 19.198 3.550 1.00 9.95 C ATOM 2027 CD1 TRP A 131 3.911 20.178 2.942 1.00 10.81 C ATOM 2028 CD2 TRP A 131 3.745 18.185 3.979 1.00 10.57 C ATOM 2029 NE1 TRP A 131 2.546 19.832 2.986 1.00 12.00 N ATOM 2030 CE2 TRP A 131 2.429 18.592 3.577 1.00 11.85 C ATOM 2031 CE3 TRP A 131 3.902 16.939 4.633 1.00 10.38 C ATOM 2032 CZ2 TRP A 131 1.249 17.835 3.857 1.00 13.06 C ATOM 2033 CZ3 TRP A 131 2.715 16.186 4.922 1.00 11.55 C ATOM 2034 CH2 TRP A 131 1.430 16.611 4.530 1.00 12.86 C ATOM 2035 HA TRP A 131 6.276 17.104 3.412 1.00 0.00 H ATOM 2036 HB2 TRP A 131 6.372 19.324 4.825 1.00 0.00 H ATOM 2037 HB3 TRP A 131 6.583 20.076 3.227 1.00 0.00 H ATOM 2038 HE1 TRP A 131 1.760 20.414 2.632 1.00 0.00 H ATOM 2039 HD1 TRP A 131 4.312 21.087 2.493 1.00 0.00 H ATOM 2040 HZ2 TRP A 131 0.260 18.187 3.565 1.00 0.00 H ATOM 2041 HH2 TRP A 131 0.565 15.985 4.750 1.00 0.00 H ATOM 2042 HZ3 TRP A 131 2.811 15.247 5.467 1.00 0.00 H ATOM 2043 HE3 TRP A 131 4.889 16.565 4.907 1.00 0.00 H ATOM 2044 H TRP A 131 9.103 18.054 3.649 1.00 0.00 H ATOM 2045 N ASN A 132 6.333 18.464 0.967 1.00 7.57 N ATOM 2046 CA ASN A 132 6.666 18.690 -0.431 1.00 7.32 C ATOM 2047 C ASN A 132 6.016 20.009 -0.862 1.00 8.31 C ATOM 2048 O ASN A 132 5.381 20.719 -0.022 1.00 9.21 O ATOM 2049 CB ASN A 132 6.299 17.501 -1.316 1.00 7.49 C ATOM 2050 CG ASN A 132 4.837 17.272 -1.509 1.00 8.10 C ATOM 2051 OD1 ASN A 132 3.963 18.132 -1.230 1.00 9.08 O ATOM 2052 ND2 ASN A 132 4.539 16.083 -2.102 1.00 8.10 N ATOM 2053 HA ASN A 132 7.746 18.778 -0.552 1.00 0.00 H ATOM 2054 HB2 ASN A 132 6.747 17.661 -2.297 1.00 0.00 H ATOM 2055 HB3 ASN A 132 6.723 16.603 -0.866 1.00 0.00 H ATOM 2056 HD22 ASN A 132 5.297 15.403 -2.313 1.00 0.00 H ATOM 2057 HD21 ASN A 132 3.553 15.855 -2.343 1.00 0.00 H ATOM 2058 H ASN A 132 5.378 18.678 1.319 1.00 0.00 H ATOM 2059 N HIS A 133 6.310 20.434 -2.083 1.00 8.47 N ATOM 2060 CA HIS A 133 5.804 21.697 -2.608 1.00 9.55 C ATOM 2061 C HIS A 133 5.693 21.556 -4.092 1.00 9.94 C ATOM 2062 O HIS A 133 6.460 20.792 -4.676 1.00 9.26 O ATOM 2063 CB HIS A 133 6.788 22.829 -2.295 1.00 9.64 C ATOM 2064 CG HIS A 133 6.165 24.191 -2.448 1.00 11.04 C ATOM 2065 ND1 HIS A 133 5.247 24.701 -1.547 1.00 11.96 N ATOM 2066 CD2 HIS A 133 6.333 25.132 -3.416 1.00 11.93 C ATOM 2067 CE1 HIS A 133 4.894 25.915 -1.954 1.00 15.32 C ATOM 2068 NE2 HIS A 133 5.546 26.202 -3.082 1.00 13.30 N ATOM 2069 HA HIS A 133 4.840 21.930 -2.156 1.00 0.00 H ATOM 2070 HB2 HIS A 133 7.136 22.716 -1.268 1.00 0.00 H ATOM 2071 HB3 HIS A 133 7.636 22.754 -2.975 1.00 0.00 H ATOM 2072 HD2 HIS A 133 6.974 25.050 -4.294 1.00 0.00 H ATOM 2073 HE1 HIS A 133 4.186 26.571 -1.448 1.00 0.00 H ATOM 2074 H HIS A 133 6.921 19.847 -2.686 1.00 0.00 H ATOM 2075 N PRO A 134 4.722 22.259 -4.736 1.00 11.28 N ATOM 2076 CA PRO A 134 4.747 22.184 -6.201 1.00 11.91 C ATOM 2077 C PRO A 134 6.127 22.626 -6.737 1.00 11.63 C ATOM 2078 O PRO A 134 6.651 23.666 -6.364 1.00 11.85 O ATOM 2079 CB PRO A 134 3.645 23.190 -6.654 1.00 13.69 C ATOM 2080 CG PRO A 134 2.650 23.150 -5.383 1.00 13.88 C ATOM 2081 CD PRO A 134 3.608 23.109 -4.219 1.00 12.55 C ATOM 2082 HA PRO A 134 4.573 21.174 -6.572 1.00 0.00 H ATOM 2083 HD3 PRO A 134 3.961 24.109 -3.966 1.00 0.00 H ATOM 2084 HD2 PRO A 134 3.143 22.657 -3.343 1.00 0.00 H ATOM 2085 HG3 PRO A 134 2.018 22.262 -5.405 1.00 0.00 H ATOM 2086 HG2 PRO A 134 2.022 24.040 -5.346 1.00 0.00 H ATOM 2087 HB2 PRO A 134 4.054 24.188 -6.811 1.00 0.00 H ATOM 2088 HB3 PRO A 134 3.147 22.855 -7.564 1.00 0.00 H ATOM 2089 N GLN A 135 6.663 21.817 -7.643 1.00 11.43 N ATOM 2090 CA GLN A 135 8.047 21.827 -8.111 1.00 11.89 C ATOM 2091 C GLN A 135 8.294 23.131 -8.857 1.00 13.25 C ATOM 2092 O GLN A 135 9.431 23.590 -8.976 1.00 12.72 O ATOM 2093 CB GLN A 135 7.977 20.640 -9.127 1.00 16.89 C ATOM 2094 CG GLN A 135 8.981 20.225 -10.010 1.00 23.28 C ATOM 2095 CD GLN A 135 9.237 21.126 -11.168 1.00 13.40 C ATOM 2096 OE1 GLN A 135 10.312 21.654 -11.207 1.00 21.41 O ATOM 2097 NE2 GLN A 135 8.290 21.317 -12.142 1.00 15.89 N ATOM 2098 HA GLN A 135 8.820 21.742 -7.347 1.00 0.00 H ATOM 2099 HB2 GLN A 135 7.758 19.762 -8.519 1.00 0.00 H ATOM 2100 HB3 GLN A 135 7.120 20.864 -9.762 1.00 0.00 H ATOM 2101 HG2 GLN A 135 9.908 20.135 -9.444 1.00 0.00 H ATOM 2102 HG3 GLN A 135 8.699 19.248 -10.402 1.00 0.00 H ATOM 2103 HE22 GLN A 135 7.368 20.840 -12.072 1.00 0.00 H ATOM 2104 HE21 GLN A 135 8.494 21.938 -12.951 1.00 0.00 H ATOM 2105 H GLN A 135 6.033 21.103 -8.062 1.00 0.00 H ATOM 2106 N THR A 136 7.239 23.747 -9.417 1.00 13.93 N ATOM 2107 CA THR A 136 7.338 24.969 -10.221 1.00 15.61 C ATOM 2108 C THR A 136 7.692 26.203 -9.394 1.00 15.76 C ATOM 2109 O THR A 136 8.120 27.221 -9.949 1.00 17.79 O ATOM 2110 CB THR A 136 6.021 25.289 -10.954 1.00 17.55 C ATOM 2111 OG1 THR A 136 4.930 25.085 -10.036 1.00 19.09 O ATOM 2112 CG2 THR A 136 5.749 24.277 -12.052 1.00 20.92 C ATOM 2113 HA THR A 136 8.137 24.758 -10.932 1.00 0.00 H ATOM 2114 HB THR A 136 6.103 26.304 -11.343 1.00 0.00 H ATOM 2115 HG1 THR A 136 5.039 25.685 -9.257 1.00 0.00 H ATOM 2116 HG23 THR A 136 6.528 24.348 -12.811 1.00 0.00 H ATOM 2117 HG21 THR A 136 5.745 23.273 -11.627 1.00 0.00 H ATOM 2118 HG22 THR A 136 4.779 24.485 -12.504 1.00 0.00 H ATOM 2119 H THR A 136 6.296 23.332 -9.271 1.00 0.00 H ATOM 2120 N GLU A 137 7.495 26.134 -8.091 1.00 14.68 N ATOM 2121 CA GLU A 137 7.835 27.254 -7.215 1.00 14.98 C ATOM 2122 C GLU A 137 9.030 26.884 -6.303 1.00 13.62 C ATOM 2123 O GLU A 137 8.921 26.034 -5.417 1.00 12.35 O ATOM 2124 CB GLU A 137 6.632 27.732 -6.381 1.00 15.48 C ATOM 2125 CG GLU A 137 7.023 28.970 -5.514 1.00 17.26 C ATOM 2126 CD GLU A 137 5.795 29.574 -4.731 1.00 17.24 C ATOM 2127 OE1 GLU A 137 4.978 28.737 -4.286 1.00 17.42 O ATOM 2128 OE2 GLU A 137 5.707 30.832 -4.546 1.00 21.93 O ATOM 2129 HA GLU A 137 8.126 28.088 -7.853 1.00 0.00 H ATOM 2130 HB2 GLU A 137 5.817 28.006 -7.051 1.00 0.00 H ATOM 2131 HB3 GLU A 137 6.306 26.924 -5.726 1.00 0.00 H ATOM 2132 HG2 GLU A 137 7.782 28.666 -4.793 1.00 0.00 H ATOM 2133 HG3 GLU A 137 7.433 29.739 -6.168 1.00 0.00 H ATOM 2134 H GLU A 137 7.091 25.268 -7.680 1.00 0.00 H ATOM 2135 N VAL A 138 10.182 27.478 -6.590 1.00 14.14 N ATOM 2136 CA VAL A 138 11.417 26.988 -5.941 1.00 13.11 C ATOM 2137 C VAL A 138 11.757 27.828 -4.708 1.00 13.30 C ATOM 2138 O VAL A 138 11.706 29.079 -4.747 1.00 14.69 O ATOM 2139 CB VAL A 138 12.567 27.119 -7.008 1.00 13.97 C ATOM 2140 CG1 VAL A 138 13.918 26.589 -6.455 1.00 13.26 C ATOM 2141 CG2 VAL A 138 12.175 26.284 -8.222 1.00 16.04 C ATOM 2142 HA VAL A 138 11.291 25.958 -5.609 1.00 0.00 H ATOM 2143 HB VAL A 138 12.694 28.171 -7.265 1.00 0.00 H ATOM 2144 HG11 VAL A 138 14.198 27.163 -5.572 1.00 0.00 H ATOM 2145 HG12 VAL A 138 13.812 25.538 -6.188 1.00 0.00 H ATOM 2146 HG13 VAL A 138 14.688 26.695 -7.219 1.00 0.00 H ATOM 2147 HG21 VAL A 138 12.054 25.243 -7.922 1.00 0.00 H ATOM 2148 HG22 VAL A 138 11.236 26.657 -8.630 1.00 0.00 H ATOM 2149 HG23 VAL A 138 12.956 26.357 -8.979 1.00 0.00 H ATOM 2150 H VAL A 138 10.215 28.273 -7.259 1.00 0.00 H ATOM 2151 N PHE A 139 12.159 27.102 -3.650 1.00 12.11 N ATOM 2152 CA PHE A 139 12.681 27.703 -2.422 1.00 12.36 C ATOM 2153 C PHE A 139 13.926 26.956 -1.990 1.00 11.62 C ATOM 2154 O PHE A 139 14.089 25.744 -2.293 1.00 10.56 O ATOM 2155 CB PHE A 139 11.604 27.581 -1.293 1.00 12.22 C ATOM 2156 CG PHE A 139 10.408 28.519 -1.536 1.00 13.27 C ATOM 2157 CD1 PHE A 139 10.494 29.866 -1.151 1.00 14.78 C ATOM 2158 CD2 PHE A 139 9.189 28.040 -2.038 1.00 13.14 C ATOM 2159 CE1 PHE A 139 9.455 30.795 -1.357 1.00 16.21 C ATOM 2160 CE2 PHE A 139 8.105 28.923 -2.254 1.00 14.55 C ATOM 2161 CZ PHE A 139 8.197 30.268 -1.910 1.00 16.05 C ATOM 2162 HA PHE A 139 12.919 28.752 -2.601 1.00 0.00 H ATOM 2163 HB2 PHE A 139 11.244 26.553 -1.259 1.00 0.00 H ATOM 2164 HB3 PHE A 139 12.064 27.836 -0.338 1.00 0.00 H ATOM 2165 HD2 PHE A 139 9.076 26.980 -2.263 1.00 0.00 H ATOM 2166 HE2 PHE A 139 7.184 28.544 -2.697 1.00 0.00 H ATOM 2167 HZ PHE A 139 7.341 30.928 -2.049 1.00 0.00 H ATOM 2168 HE1 PHE A 139 9.577 31.852 -1.119 1.00 0.00 H ATOM 2169 HD1 PHE A 139 11.409 30.210 -0.669 1.00 0.00 H ATOM 2170 H PHE A 139 12.096 26.065 -3.707 1.00 0.00 H ATOM 2171 N ASP A 140 14.754 27.671 -1.232 1.00 12.38 N ATOM 2172 CA ASP A 140 15.983 27.095 -0.646 1.00 12.07 C ATOM 2173 C ASP A 140 15.751 25.854 0.177 1.00 10.75 C ATOM 2174 O ASP A 140 16.605 24.960 0.181 1.00 10.25 O ATOM 2175 CB ASP A 140 16.687 28.135 0.259 1.00 13.37 C ATOM 2176 CG ASP A 140 17.462 29.222 -0.565 1.00 14.99 C ATOM 2177 OD1 ASP A 140 17.358 29.252 -1.816 1.00 15.18 O ATOM 2178 OD2 ASP A 140 18.057 30.132 0.030 1.00 16.35 O ATOM 2179 HA ASP A 140 16.600 26.818 -1.501 1.00 0.00 H ATOM 2180 HB2 ASP A 140 15.935 28.631 0.872 1.00 0.00 H ATOM 2181 HB3 ASP A 140 17.395 27.615 0.905 1.00 0.00 H ATOM 2182 H ASP A 140 14.529 28.669 -1.046 1.00 0.00 H ATOM 2183 N ASP A 141 14.553 25.732 0.810 1.00 10.36 N ATOM 2184 CA ASP A 141 14.358 24.604 1.715 1.00 9.45 C ATOM 2185 C ASP A 141 13.939 23.369 0.926 1.00 8.32 C ATOM 2186 O ASP A 141 13.652 22.335 1.516 1.00 7.62 O ATOM 2187 CB ASP A 141 13.274 24.915 2.804 1.00 9.86 C ATOM 2188 CG ASP A 141 11.897 25.192 2.199 1.00 9.99 C ATOM 2189 OD1 ASP A 141 11.617 24.965 0.990 1.00 9.60 O ATOM 2190 OD2 ASP A 141 11.054 25.729 2.953 1.00 10.82 O ATOM 2191 HA ASP A 141 15.306 24.420 2.220 1.00 0.00 H ATOM 2192 HB2 ASP A 141 13.196 24.059 3.474 1.00 0.00 H ATOM 2193 HB3 ASP A 141 13.589 25.791 3.371 1.00 0.00 H ATOM 2194 H ASP A 141 13.794 26.426 0.653 1.00 0.00 H ATOM 2195 N GLN A 142 13.956 23.426 -0.417 1.00 8.34 N ATOM 2196 CA GLN A 142 13.793 22.198 -1.215 1.00 7.54 C ATOM 2197 C GLN A 142 15.169 21.602 -1.557 1.00 7.50 C ATOM 2198 O GLN A 142 15.221 20.627 -2.325 1.00 7.13 O ATOM 2199 CB GLN A 142 13.035 22.541 -2.528 1.00 7.96 C ATOM 2200 CG GLN A 142 11.641 22.998 -2.252 1.00 8.21 C ATOM 2201 CD GLN A 142 11.025 23.802 -3.413 1.00 9.19 C ATOM 2202 OE1 GLN A 142 11.622 23.894 -4.537 1.00 10.64 O ATOM 2203 NE2 GLN A 142 9.833 24.401 -3.171 1.00 9.80 N ATOM 2204 HA GLN A 142 13.225 21.467 -0.639 1.00 0.00 H ATOM 2205 HB2 GLN A 142 13.571 23.334 -3.050 1.00 0.00 H ATOM 2206 HB3 GLN A 142 12.998 21.653 -3.159 1.00 0.00 H ATOM 2207 HG2 GLN A 142 11.019 22.122 -2.068 1.00 0.00 H ATOM 2208 HG3 GLN A 142 11.652 23.627 -1.362 1.00 0.00 H ATOM 2209 HE22 GLN A 142 9.380 24.301 -2.240 1.00 0.00 H ATOM 2210 HE21 GLN A 142 9.372 24.961 -3.916 1.00 0.00 H ATOM 2211 H GLN A 142 14.085 24.341 -0.895 1.00 0.00 H ATOM 2212 N TYR A 143 16.256 22.052 -0.933 1.00 8.02 N ATOM 2213 CA TYR A 143 17.641 21.628 -1.373 1.00 8.45 C ATOM 2214 C TYR A 143 18.215 20.682 -0.300 1.00 8.04 C ATOM 2215 O TYR A 143 18.110 20.974 0.923 1.00 8.10 O ATOM 2216 CB TYR A 143 18.548 22.830 -1.647 1.00 9.81 C ATOM 2217 CG TYR A 143 18.168 23.377 -3.028 1.00 10.41 C ATOM 2218 CD1 TYR A 143 17.064 24.232 -3.185 1.00 10.54 C ATOM 2219 CD2 TYR A 143 18.852 22.915 -4.200 1.00 11.04 C ATOM 2220 CE1 TYR A 143 16.754 24.751 -4.432 1.00 11.37 C ATOM 2221 CE2 TYR A 143 18.460 23.351 -5.493 1.00 11.84 C ATOM 2222 CZ TYR A 143 17.394 24.255 -5.581 1.00 11.95 C ATOM 2223 OH TYR A 143 17.039 24.725 -6.809 1.00 13.00 O ATOM 2224 HA TYR A 143 17.582 21.097 -2.323 1.00 0.00 H ATOM 2225 HB3 TYR A 143 19.593 22.519 -1.642 1.00 0.00 H ATOM 2226 HB2 TYR A 143 18.395 23.595 -0.886 1.00 0.00 H ATOM 2227 HD2 TYR A 143 19.685 22.219 -4.097 1.00 0.00 H ATOM 2228 HE2 TYR A 143 18.971 22.994 -6.387 1.00 0.00 H ATOM 2229 HE1 TYR A 143 16.013 25.545 -4.522 1.00 0.00 H ATOM 2230 HD1 TYR A 143 16.449 24.488 -2.322 1.00 0.00 H ATOM 2231 HH TYR A 143 16.776 23.966 -7.388 1.00 0.00 H ATOM 2232 H TYR A 143 16.152 22.705 -0.130 1.00 0.00 H ATOM 2233 N PHE A 144 18.895 19.649 -0.795 1.00 7.98 N ATOM 2234 CA PHE A 144 19.442 18.568 0.035 1.00 7.76 C ATOM 2235 C PHE A 144 20.833 18.277 -0.461 1.00 8.84 C ATOM 2236 O PHE A 144 21.213 18.631 -1.579 1.00 9.46 O ATOM 2237 CB PHE A 144 18.609 17.308 -0.189 1.00 6.81 C ATOM 2238 CG PHE A 144 17.170 17.395 0.286 1.00 6.05 C ATOM 2239 CD1 PHE A 144 16.197 17.943 -0.570 1.00 5.91 C ATOM 2240 CD2 PHE A 144 16.816 16.937 1.578 1.00 6.58 C ATOM 2241 CE1 PHE A 144 14.843 18.005 -0.140 1.00 5.50 C ATOM 2242 CE2 PHE A 144 15.518 17.041 2.054 1.00 6.08 C ATOM 2243 CZ PHE A 144 14.492 17.634 1.167 1.00 5.33 C ATOM 2244 HA PHE A 144 19.436 18.853 1.087 1.00 0.00 H ATOM 2245 HB2 PHE A 144 18.600 17.094 -1.258 1.00 0.00 H ATOM 2246 HB3 PHE A 144 19.091 16.486 0.340 1.00 0.00 H ATOM 2247 HD2 PHE A 144 17.582 16.492 2.213 1.00 0.00 H ATOM 2248 HE2 PHE A 144 15.260 16.695 3.055 1.00 0.00 H ATOM 2249 HZ PHE A 144 13.473 17.781 1.526 1.00 0.00 H ATOM 2250 HE1 PHE A 144 14.071 18.344 -0.831 1.00 0.00 H ATOM 2251 HD1 PHE A 144 16.479 18.317 -1.554 1.00 0.00 H ATOM 2252 H PHE A 144 19.046 19.606 -1.823 1.00 0.00 H ATOM 2253 N THR A 145 21.603 17.569 0.379 1.00 9.06 N ATOM 2254 CA THR A 145 22.928 17.144 -0.070 1.00 10.25 C ATOM 2255 C THR A 145 23.148 15.753 0.541 1.00 10.06 C ATOM 2256 O THR A 145 22.507 15.426 1.545 1.00 9.32 O ATOM 2257 CB THR A 145 24.025 18.136 0.307 1.00 11.72 C ATOM 2258 OG1 THR A 145 25.279 17.724 -0.294 1.00 14.49 O ATOM 2259 CG2 THR A 145 24.217 18.313 1.842 1.00 13.15 C ATOM 2260 HA THR A 145 22.978 17.105 -1.158 1.00 0.00 H ATOM 2261 HB THR A 145 23.707 19.105 -0.076 1.00 0.00 H ATOM 2262 HG1 THR A 145 25.521 16.823 0.036 1.00 0.00 H ATOM 2263 HG23 THR A 145 23.274 18.623 2.292 1.00 0.00 H ATOM 2264 HG21 THR A 145 24.536 17.366 2.279 1.00 0.00 H ATOM 2265 HG22 THR A 145 24.976 19.073 2.027 1.00 0.00 H ATOM 2266 H THR A 145 21.264 17.327 1.332 1.00 0.00 H ATOM 2267 N PHE A 146 23.882 14.906 -0.177 1.00 10.81 N ATOM 2268 CA PHE A 146 24.171 13.575 0.337 1.00 10.94 C ATOM 2269 C PHE A 146 25.293 13.723 1.373 1.00 12.20 C ATOM 2270 O PHE A 146 26.345 14.328 1.121 1.00 13.63 O ATOM 2271 CB PHE A 146 24.707 12.677 -0.764 1.00 11.78 C ATOM 2272 CG PHE A 146 23.689 12.322 -1.810 1.00 10.92 C ATOM 2273 CD1 PHE A 146 22.607 11.494 -1.535 1.00 9.75 C ATOM 2274 CD2 PHE A 146 23.939 12.677 -3.160 1.00 13.53 C ATOM 2275 CE1 PHE A 146 21.679 11.103 -2.562 1.00 9.66 C ATOM 2276 CE2 PHE A 146 23.011 12.288 -4.178 1.00 11.30 C ATOM 2277 CZ PHE A 146 21.897 11.502 -3.883 1.00 10.06 C ATOM 2278 HA PHE A 146 23.260 13.144 0.751 1.00 0.00 H ATOM 2279 HB2 PHE A 146 25.536 13.189 -1.252 1.00 0.00 H ATOM 2280 HB3 PHE A 146 25.068 11.755 -0.309 1.00 0.00 H ATOM 2281 HD2 PHE A 146 24.833 13.243 -3.421 1.00 0.00 H ATOM 2282 HE2 PHE A 146 23.178 12.613 -5.205 1.00 0.00 H ATOM 2283 HZ PHE A 146 21.207 11.203 -4.672 1.00 0.00 H ATOM 2284 HE1 PHE A 146 20.808 10.497 -2.310 1.00 0.00 H ATOM 2285 HD1 PHE A 146 22.458 11.133 -0.517 1.00 0.00 H ATOM 2286 H PHE A 146 24.249 15.195 -1.106 1.00 0.00 H ATOM 2287 N LEU A 147 25.073 13.124 2.553 1.00 11.95 N ATOM 2288 CA LEU A 147 26.110 13.003 3.571 1.00 14.57 C ATOM 2289 C LEU A 147 26.563 11.579 3.747 1.00 14.33 C ATOM 2290 O LEU A 147 25.721 10.748 4.063 1.00 15.49 O ATOM 2291 CB LEU A 147 25.534 13.403 4.925 1.00 14.95 C ATOM 2292 CG LEU A 147 25.514 14.838 5.334 1.00 20.27 C ATOM 2293 CD1 LEU A 147 24.891 14.855 6.739 1.00 17.83 C ATOM 2294 CD2 LEU A 147 26.988 15.235 5.455 1.00 20.52 C ATOM 2295 HA LEU A 147 26.938 13.635 3.249 1.00 0.00 H ATOM 2296 HB2 LEU A 147 24.501 13.056 4.942 1.00 0.00 H ATOM 2297 HB3 LEU A 147 26.108 12.868 5.682 1.00 0.00 H ATOM 2298 HG LEU A 147 24.973 15.494 4.652 1.00 0.00 H ATOM 2299 HD21 LEU A 147 27.471 14.609 6.205 1.00 0.00 H ATOM 2300 HD22 LEU A 147 27.480 15.097 4.492 1.00 0.00 H ATOM 2301 HD23 LEU A 147 27.058 16.281 5.754 1.00 0.00 H ATOM 2302 HD11 LEU A 147 23.885 14.439 6.694 1.00 0.00 H ATOM 2303 HD12 LEU A 147 25.503 14.256 7.414 1.00 0.00 H ATOM 2304 HD13 LEU A 147 24.845 15.882 7.102 1.00 0.00 H ATOM 2305 H LEU A 147 24.130 12.732 2.749 1.00 0.00 H ATOM 2306 N PHE A 148 27.793 11.287 3.407 1.00 16.58 N ATOM 2307 CA PHE A 148 28.322 9.911 3.503 1.00 18.04 C ATOM 2308 C PHE A 148 29.205 9.768 4.740 1.00 22.72 C ATOM 2309 O PHE A 148 29.743 10.753 5.224 1.00 24.13 O ATOM 2310 CB PHE A 148 29.163 9.599 2.281 1.00 19.01 C ATOM 2311 CG PHE A 148 28.387 9.692 0.995 1.00 16.93 C ATOM 2312 CD1 PHE A 148 27.706 8.576 0.511 1.00 16.31 C ATOM 2313 CD2 PHE A 148 28.358 10.883 0.275 1.00 16.77 C ATOM 2314 CE1 PHE A 148 26.953 8.657 -0.662 1.00 15.41 C ATOM 2315 CE2 PHE A 148 27.637 10.941 -0.920 1.00 17.19 C ATOM 2316 CZ PHE A 148 26.885 9.817 -1.332 1.00 15.20 C ATOM 2317 HA PHE A 148 27.479 9.224 3.569 1.00 0.00 H ATOM 2318 HB2 PHE A 148 29.992 10.306 2.239 1.00 0.00 H ATOM 2319 HB3 PHE A 148 29.555 8.587 2.378 1.00 0.00 H ATOM 2320 HD2 PHE A 148 28.892 11.761 0.640 1.00 0.00 H ATOM 2321 HE2 PHE A 148 27.654 11.845 -1.529 1.00 0.00 H ATOM 2322 HZ PHE A 148 26.240 9.894 -2.207 1.00 0.00 H ATOM 2323 HE1 PHE A 148 26.422 7.780 -1.032 1.00 0.00 H ATOM 2324 HD1 PHE A 148 27.762 7.632 1.053 1.00 0.00 H ATOM 2325 H PHE A 148 28.415 12.045 3.060 1.00 0.00 H ATOM 2326 N GLU A 149 29.331 8.561 5.229 1.00 26.61 N ATOM 2327 CA GLU A 149 30.352 8.268 6.263 1.00 33.38 C ATOM 2328 C GLU A 149 31.712 8.419 5.633 1.00 37.06 C ATOM 2329 O GLU A 149 32.032 7.647 4.719 1.00 40.04 O ATOM 2330 CB GLU A 149 30.192 6.833 6.725 1.00 34.46 C ATOM 2331 CG GLU A 149 30.759 6.566 8.118 1.00 43.08 C ATOM 2332 CD GLU A 149 30.042 5.403 8.778 1.00 49.50 C ATOM 2333 OE1 GLU A 149 28.810 5.223 8.522 1.00 50.52 O ATOM 2334 OE2 GLU A 149 30.713 4.662 9.539 1.00 54.63 O ATOM 2335 HA GLU A 149 30.239 8.945 7.110 1.00 0.00 H ATOM 2336 HB2 GLU A 149 29.129 6.591 6.734 1.00 0.00 H ATOM 2337 HB3 GLU A 149 30.705 6.184 6.015 1.00 0.00 H ATOM 2338 HG2 GLU A 149 31.820 6.330 8.033 1.00 0.00 H ATOM 2339 HG3 GLU A 149 30.634 7.458 8.732 1.00 0.00 H ATOM 2340 H GLU A 149 28.709 7.800 4.889 1.00 0.00 H TER 2341 GLU A 149 HETATM 2342 O HOH 1 11.043 32.805 0.985 1.00 25.64 O HETATM 2343 O HOH 2 6.312 30.731 6.512 1.00 20.87 O HETATM 2344 O HOH 3 1.621 1.749 3.734 1.00 7.05 O HETATM 2345 O HOH 4 6.957 33.201 -0.069 1.00 8.62 O HETATM 2346 O HOH 5 1.558 28.928 5.497 1.00 10.93 O HETATM 2347 O HOH 6 -1.451 20.347 4.934 1.00 18.36 O HETATM 2348 O HOH 7 2.139 32.109 0.603 1.00 18.33 O HETATM 2349 O HOH 8 0.576 26.890 9.133 1.00 21.55 O HETATM 2350 O HOH 9 -0.705 22.862 6.608 1.00 21.88 O HETATM 2351 O HOH 10 25.773 20.425 -11.401 1.00 13.95 O HETATM 2352 O HOH 11 31.843 14.661 -8.286 1.00 5.32 O HETATM 2353 O HOH 12 29.743 17.630 -13.331 1.00 12.44 O HETATM 2354 O HOH 13 28.432 20.436 -7.105 1.00 14.67 O HETATM 2355 O HOH 14 25.838 17.648 -10.975 1.00 16.29 O HETATM 2356 O HOH 15 23.321 20.572 -13.144 1.00 9.05 O HETATM 2357 O HOH 16 29.969 17.822 -15.862 1.00 15.23 O HETATM 2358 O HOH 17 24.641 15.455 -10.809 1.00 22.33 O HETATM 2359 O HOH 18 29.365 18.337 -4.643 1.00 14.22 O HETATM 2360 O HOH 19 32.207 15.058 -5.691 1.00 11.13 O HETATM 2361 O HOH 20 33.389 16.932 -4.401 1.00 16.32 O HETATM 2362 O HOH 21 29.480 15.681 -4.903 1.00 4.82 O HETATM 2363 O HOH 22 27.429 13.793 -3.427 1.00 8.66 O HETATM 2364 O HOH 23 15.077 -3.026 -6.870 1.00 25.38 O HETATM 2365 O HOH 24 27.628 9.640 -9.658 1.00 2.00 O HETATM 2366 O HOH 25 17.702 -2.724 -8.220 1.00 26.83 O HETATM 2367 O HOH 26 27.585 -0.397 -3.461 1.00 2.00 O HETATM 2368 O HOH 27 26.105 -1.280 -6.639 1.00 3.18 O HETATM 2369 O HOH 28 16.289 29.105 4.643 1.00 22.53 O HETATM 2370 O HOH 29 28.794 0.678 -1.170 1.00 15.98 O HETATM 2371 O HOH 30 27.842 -0.059 1.564 1.00 16.79 O HETATM 2372 O HOH 31 25.978 18.654 9.003 1.00 14.79 O HETATM 2373 O HOH 32 18.391 19.415 15.059 1.00 17.27 O HETATM 2374 O HOH 33 25.760 6.559 -0.479 1.00 98.77 O HETATM 2375 O HOH 34 22.924 4.372 -2.938 1.00 2.00 O HETATM 2376 O HOH 35 27.615 2.252 2.612 1.00 3.55 O HETATM 2377 O HOH 36 18.683 -1.190 2.782 1.00 12.05 O HETATM 2378 O HOH 37 26.177 10.097 6.834 1.00 4.04 O HETATM 2379 O HOH 38 27.837 11.808 8.061 1.00 9.14 O HETATM 2380 O HOH 39 27.355 13.642 11.681 1.00 5.70 O HETATM 2381 O HOH 40 3.126 11.890 8.618 1.00 24.50 O HETATM 2382 O HOH 41 8.911 14.558 13.236 1.00 22.39 O HETATM 2383 O HOH 42 22.052 18.162 17.790 1.00 18.82 O HETATM 2384 O HOH 43 28.044 32.545 -7.221 1.00 18.22 O HETATM 2385 O HOH 44 16.129 28.012 7.392 1.00 3.98 O HETATM 2386 O HOH 45 31.449 10.002 9.427 1.00 27.88 O HETATM 2387 O HOH 46 18.357 23.708 12.474 1.00 2.00 O HETATM 2388 O HOH 47 19.145 5.345 17.537 1.00 6.00 O HETATM 2389 O HOH 48 14.892 22.114 15.102 1.00 14.21 O HETATM 2390 O HOH 49 20.623 18.818 13.129 1.00 2.00 O HETATM 2391 O HOH 50 26.375 20.581 10.645 1.00 20.01 O HETATM 2392 O HOH 51 20.914 23.736 13.744 1.00 6.39 O HETATM 2393 O HOH 52 19.495 -1.862 -3.445 1.00 18.93 O HETATM 2394 O HOH 53 1.443 20.168 10.757 1.00 18.39 O HETATM 2395 O HOH 54 11.898 18.513 12.508 1.00 12.74 O HETATM 2396 O HOH 55 15.770 17.421 14.384 1.00 13.87 O HETATM 2397 O HOH 56 8.675 10.702 -15.086 1.00 7.01 O HETATM 2398 O HOH 57 18.706 11.174 5.936 1.00 2.09 O HETATM 2399 O HOH 58 13.106 7.586 17.471 1.00 17.54 O HETATM 2400 O HOH 59 8.751 -0.223 9.381 1.00 2.00 O HETATM 2401 O HOH 60 9.641 -1.031 16.146 1.00 9.16 O HETATM 2402 O HOH 61 12.861 1.916 12.831 1.00 6.90 O HETATM 2403 O HOH 62 5.019 4.219 14.098 1.00 7.56 O HETATM 2404 O HOH 63 6.417 0.482 18.280 1.00 24.71 O HETATM 2405 O HOH 64 11.536 1.677 16.118 1.00 12.70 O HETATM 2406 O HOH 65 -4.542 16.790 -8.776 1.00 14.56 O HETATM 2407 O HOH 66 -2.930 19.117 -4.432 1.00 17.28 O HETATM 2408 O HOH 67 4.161 5.841 18.211 1.00 4.16 O HETATM 2409 O HOH 68 -2.554 13.461 6.689 1.00 27.98 O HETATM 2410 O HOH 69 0.529 16.401 7.931 1.00 12.82 O HETATM 2411 O HOH 70 4.469 9.835 8.817 1.00 16.53 O HETATM 2412 O HOH 71 3.795 3.906 10.831 1.00 5.58 O HETATM 2413 O HOH 72 4.792 7.045 5.830 1.00 2.00 O HETATM 2414 O HOH 73 2.283 6.842 8.640 1.00 12.53 O HETATM 2415 O HOH 74 5.673 -4.457 -7.731 1.00 17.16 O HETATM 2416 O HOH 75 2.206 -1.609 1.398 1.00 12.31 O HETATM 2417 O HOH 76 6.732 14.286 9.696 1.00 4.19 O HETATM 2418 O HOH 77 10.100 16.136 11.604 1.00 8.04 O HETATM 2419 O HOH 78 12.778 14.232 15.008 1.00 8.54 O HETATM 2420 O HOH 79 4.743 8.029 -13.950 1.00 8.54 O HETATM 2421 O HOH 80 18.449 18.872 -13.480 1.00 22.97 O HETATM 2422 O HOH 81 20.384 12.913 -12.730 1.00 12.68 O HETATM 2423 O HOH 82 19.189 27.115 -9.777 1.00 11.74 O HETATM 2424 O HOH 83 11.886 16.860 -12.930 1.00 23.48 O HETATM 2425 O HOH 84 22.518 17.771 15.093 1.00 2.00 O HETATM 2426 O HOH 85 28.732 30.577 -5.218 1.00 13.70 O HETATM 2427 O HOH 86 20.876 31.036 -9.609 1.00 12.89 O HETATM 2428 O HOH 87 25.331 34.455 -4.809 1.00 13.45 O HETATM 2429 O HOH 88 21.444 13.113 20.922 1.00 23.82 O HETATM 2430 O HOH 89 17.449 10.472 15.929 1.00 7.27 O HETATM 2431 O HOH 90 20.931 15.306 19.056 1.00 12.33 O HETATM 2432 O HOH 91 28.061 24.711 -0.068 1.00 18.18 O HETATM 2433 O HOH 92 28.771 9.948 9.820 1.00 8.26 O HETATM 2434 O HOH 93 30.491 8.370 13.356 1.00 6.10 O HETATM 2435 O HOH 94 23.588 4.266 13.518 1.00 6.89 O HETATM 2436 O HOH 95 9.633 17.712 -13.610 1.00 23.33 O HETATM 2437 O HOH 96 20.052 3.685 15.482 1.00 2.00 O HETATM 2438 O HOH 97 1.787 8.391 -13.096 1.00 16.31 O HETATM 2439 O HOH 98 16.230 9.769 13.582 1.00 2.00 O HETATM 2440 O HOH 99 17.549 4.039 13.968 1.00 6.15 O HETATM 2441 O HOH 100 16.360 5.527 16.404 1.00 17.05 O HETATM 2442 O HOH 101 14.164 8.554 14.901 1.00 7.68 O HETATM 2443 O HOH 102 14.179 3.888 14.422 1.00 4.81 O HETATM 2444 O HOH 103 12.330 22.461 13.930 1.00 13.17 O HETATM 2445 O HOH 104 16.664 25.250 13.860 1.00 13.21 O HETATM 2446 O HOH 105 27.786 8.079 8.323 1.00 14.32 O HETATM 2447 O HOH 106 3.739 17.947 10.710 1.00 8.56 O HETATM 2448 O HOH 107 4.229 14.185 10.582 1.00 12.44 O HETATM 2449 O HOH 108 3.238 15.876 8.629 1.00 6.88 O HETATM 2450 O HOH 109 18.644 1.213 1.970 1.00 5.45 O HETATM 2451 O HOH 110 20.521 0.582 -2.963 1.00 2.00 O HETATM 2452 O HOH 111 4.201 21.840 -14.716 1.00 24.58 O HETATM 2453 O HOH 112 5.386 29.783 -9.032 1.00 12.31 O HETATM 2454 O HOH 113 7.949 34.066 -2.580 1.00 14.72 O HETATM 2455 O HOH 114 14.339 -0.429 -10.844 1.00 12.50 O HETATM 2456 O HOH 115 17.976 -0.906 -10.468 1.00 6.45 O HETATM 2457 O HOH 116 23.935 7.921 -10.873 1.00 2.00 O HETATM 2458 O HOH 117 12.463 29.913 -9.898 1.00 18.00 O HETATM 2459 O HOH 118 17.825 5.617 -13.209 1.00 2.00 O HETATM 2460 O HOH 119 19.416 2.433 -14.430 1.00 17.64 O HETATM 2461 O HOH 120 12.473 0.918 -12.335 1.00 8.57 O HETATM 2462 O HOH 121 10.494 0.063 -14.019 1.00 25.92 O HETATM 2463 O HOH 122 12.533 -1.724 -16.522 1.00 13.26 O HETATM 2464 O HOH 123 29.408 19.006 -0.432 1.00 33.87 O HETATM 2465 O HOH 124 16.167 29.083 -8.517 1.00 18.76 O HETATM 2466 O HOH 125 12.826 4.939 -20.722 1.00 3.42 O HETATM 2467 O HOH 126 16.801 1.393 -18.289 1.00 12.60 O HETATM 2468 O HOH 127 8.421 7.796 -15.873 1.00 21.07 O HETATM 2469 O HOH 128 4.565 4.669 -13.785 1.00 16.63 O HETATM 2470 O HOH 129 9.683 0.058 -16.739 1.00 15.06 O HETATM 2471 O HOH 130 5.319 2.589 -11.120 1.00 17.85 O HETATM 2472 O HOH 131 12.245 7.961 -17.373 1.00 13.38 O HETATM 2473 O HOH 132 21.582 10.540 -13.059 1.00 4.19 O HETATM 2474 O HOH 133 20.312 6.692 -13.703 1.00 6.16 O HETATM 2475 O HOH 134 14.466 -4.400 2.357 1.00 12.67 O HETATM 2476 O HOH 135 16.171 4.821 7.162 1.00 2.00 O HETATM 2477 O HOH 136 16.384 -1.945 3.615 1.00 45.32 O HETATM 2478 O HOH 137 24.993 2.862 7.454 1.00 23.62 O HETATM 2479 O HOH 138 18.347 -2.411 5.457 1.00 7.27 O HETATM 2480 O HOH 139 15.650 -1.302 11.774 1.00 13.29 O HETATM 2481 O HOH 140 10.873 -1.011 -0.521 1.00 9.32 O HETATM 2482 O HOH 141 7.334 2.092 8.685 1.00 2.00 O HETATM 2483 O HOH 142 4.698 3.443 6.502 1.00 14.74 O HETATM 2484 O HOH 143 4.028 1.319 4.415 1.00 14.15 O HETATM 2485 O HOH 144 -0.931 21.436 -4.895 1.00 20.32 O HETATM 2486 O HOH 145 -1.396 13.270 -8.929 1.00 8.63 O HETATM 2487 O HOH 146 -2.295 17.668 -6.921 1.00 16.92 O HETATM 2488 O HOH 147 -1.826 11.592 -4.984 1.00 2.00 O HETATM 2489 O HOH 148 -6.546 11.854 3.722 1.00 26.37 O HETATM 2490 O HOH 149 -4.317 11.833 6.193 1.00 6.63 O HETATM 2491 O HOH 150 -6.089 11.817 0.936 1.00 10.70 O HETATM 2492 O HOH 151 -1.518 15.465 5.806 1.00 12.00 O HETATM 2493 O HOH 152 -4.435 17.679 -1.130 1.00 5.58 O HETATM 2494 O HOH 153 -1.845 21.673 0.554 1.00 11.38 O HETATM 2495 O HOH 154 3.537 9.493 5.881 1.00 4.40 O HETATM 2496 O HOH 155 4.008 13.071 6.126 1.00 7.42 O HETATM 2497 O HOH 156 2.515 5.554 5.298 1.00 10.57 O HETATM 2498 O HOH 157 10.301 -3.165 3.837 1.00 5.99 O HETATM 2499 O HOH 158 4.110 -0.890 3.064 1.00 15.70 O HETATM 2500 O HOH 159 5.140 -4.070 5.620 1.00 6.06 O HETATM 2501 O HOH 160 7.241 0.832 -3.643 1.00 2.00 O HETATM 2502 O HOH 161 9.647 -3.409 0.637 1.00 12.40 O HETATM 2503 O HOH 162 8.799 -2.614 -7.833 1.00 16.99 O HETATM 2504 O HOH 163 6.455 -4.338 -5.222 1.00 10.31 O HETATM 2505 O HOH 164 9.348 -5.147 -2.548 1.00 20.40 O HETATM 2506 O HOH 165 12.799 -1.273 -8.379 1.00 13.79 O HETATM 2507 O HOH 166 10.544 3.273 -4.934 1.00 95.63 O HETATM 2508 O HOH 167 4.567 -1.680 -10.037 1.00 25.30 O HETATM 2509 O HOH 168 4.104 -4.116 -1.627 1.00 14.38 O HETATM 2510 O HOH 169 -1.044 -0.408 -2.252 1.00 12.08 O HETATM 2511 O HOH 170 3.376 -1.681 -1.338 1.00 7.72 O HETATM 2512 O HOH 171 7.176 7.961 -11.929 1.00 7.82 O HETATM 2513 O HOH 172 0.323 9.806 -5.999 1.00 5.48 O HETATM 2514 O HOH 173 11.611 6.461 -3.188 1.00 3.07 O HETATM 2515 O HOH 174 18.330 15.752 -13.213 1.00 30.91 O HETATM 2516 O HOH 175 17.870 12.282 -11.624 1.00 4.31 O HETATM 2517 O HOH 176 21.320 14.955 -11.622 1.00 13.87 O HETATM 2518 O HOH 177 13.760 19.035 -12.126 1.00 19.11 O HETATM 2519 O HOH 178 17.930 23.222 -8.781 1.00 3.71 O HETATM 2520 O HOH 179 19.723 21.508 -12.403 1.00 9.24 O HETATM 2521 O HOH 180 19.515 24.866 -11.093 1.00 11.58 O HETATM 2522 O HOH 181 20.069 27.366 -7.363 1.00 2.00 O HETATM 2523 O HOH 182 21.133 29.849 -6.586 1.00 11.39 O HETATM 2524 O HOH 183 22.985 33.314 -5.554 1.00 9.21 O HETATM 2525 O HOH 184 29.344 27.856 -5.212 1.00 28.07 O HETATM 2526 O HOH 185 26.590 32.551 -3.646 1.00 4.57 O HETATM 2527 O HOH 186 18.990 30.960 -5.109 1.00 18.82 O HETATM 2528 O HOH 187 26.136 26.679 0.789 1.00 2.00 O HETATM 2529 O HOH 188 26.727 24.546 -2.403 1.00 2.00 O HETATM 2530 O HOH 189 29.031 26.159 -3.257 1.00 14.31 O HETATM 2531 O HOH 190 30.289 23.631 -7.445 1.00 27.32 O HETATM 2532 O HOH 191 25.612 22.110 -9.254 1.00 3.10 O HETATM 2533 O HOH 192 27.309 17.792 -2.895 1.00 9.62 O HETATM 2534 O HOH 193 26.771 21.004 2.825 1.00 4.15 O HETATM 2535 O HOH 194 7.077 17.721 -12.730 1.00 10.18 O HETATM 2536 O HOH 195 3.777 16.812 -13.404 1.00 21.66 O HETATM 2537 O HOH 196 0.290 12.361 -10.865 1.00 15.60 O HETATM 2538 O HOH 197 1.785 13.654 -14.426 1.00 19.22 O HETATM 2539 O HOH 198 2.006 10.050 -10.427 1.00 6.61 O HETATM 2540 O HOH 199 7.726 10.509 -12.400 1.00 3.83 O HETATM 2541 O HOH 200 6.244 12.918 -15.367 1.00 16.88 O HETATM 2542 O HOH 201 -0.004 16.469 -8.359 1.00 10.37 O HETATM 2543 O HOH 202 4.076 21.458 -10.277 1.00 17.70 O HETATM 2544 O HOH 203 16.649 16.752 5.495 1.00 5.03 O HETATM 2545 O HOH 204 16.507 22.194 3.053 1.00 2.16 O HETATM 2546 O HOH 205 12.659 21.374 11.560 1.00 9.41 O HETATM 2547 O HOH 206 13.607 26.546 7.138 1.00 3.74 O HETATM 2548 O HOH 207 17.057 25.861 10.557 1.00 14.78 O HETATM 2549 O HOH 208 13.243 28.783 11.055 1.00 20.11 O HETATM 2550 O HOH 209 12.706 30.647 5.638 1.00 23.54 O HETATM 2551 O HOH 210 1.676 24.702 9.875 1.00 11.36 O HETATM 2552 O HOH 211 3.799 25.998 11.410 1.00 4.29 O HETATM 2553 O HOH 212 8.318 22.231 16.963 1.00 7.95 O HETATM 2554 O HOH 213 6.322 18.591 11.199 1.00 2.00 O HETATM 2555 O HOH 214 5.599 14.919 7.283 1.00 4.79 O HETATM 2556 O HOH 215 8.069 16.664 9.837 1.00 2.00 O HETATM 2557 O HOH 216 5.325 20.279 -12.663 1.00 14.42 O HETATM 2558 O HOH 217 10.901 24.883 -11.403 1.00 17.98 O HETATM 2559 O HOH 218 2.495 23.456 -9.889 1.00 21.27 O HETATM 2560 O HOH 219 8.512 27.427 -12.791 1.00 27.62 O HETATM 2561 O HOH 220 7.725 30.485 -9.216 1.00 16.57 O HETATM 2562 O HOH 221 3.745 27.066 -8.767 1.00 20.68 O HETATM 2563 O HOH 222 7.918 32.423 -4.968 1.00 5.94 O HETATM 2564 O HOH 223 3.115 26.965 -5.796 1.00 26.16 O HETATM 2565 O HOH 224 10.259 31.165 -5.452 1.00 14.15 O HETATM 2566 O HOH 225 14.315 30.443 -5.048 1.00 9.39 O HETATM 2567 O HOH 226 10.182 29.612 -8.434 1.00 5.28 O HETATM 2568 O HOH 227 17.521 30.611 2.584 1.00 2.51 O HETATM 2569 O HOH 228 16.055 28.416 -4.271 1.00 5.70 O HETATM 2570 O HOH 229 14.152 30.542 -0.582 1.00 3.01 O HETATM 2571 O HOH 230 13.272 28.376 1.836 1.00 10.09 O HETATM 2572 O HOH 231 13.389 19.012 -3.389 1.00 3.66 O HETATM 2573 O HOH 232 17.490 27.514 -6.443 1.00 4.04 O HETATM 2574 O HOH 233 27.260 19.944 0.320 1.00 23.84 O HETATM 2575 O HOH 234 25.679 15.674 -2.355 1.00 8.92 O HETATM 2576 O HOH 235 27.367 16.282 0.508 1.00 26.48 O HETATM 2577 O HOH 236 29.350 13.662 2.652 1.00 10.74 O HETATM 2578 O HOH 237 33.968 7.702 6.511 1.00 29.41 O HETATM 2579 O HOH 238 31.357 6.269 11.428 1.00 28.14 O HETATM 2580 O HOH 239 -2.522 1.371 -4.016 1.00 6.09 O HETATM 2581 O HOH 240 -1.603 8.263 -4.383 1.00 11.17 O HETATM 2582 O HOH 241 0.347 0.070 2.183 1.00 10.09 O HETATM 2583 O HOH 242 2.434 4.387 2.754 1.00 3.53 O HETATM 2584 O HOH 243 -0.033 4.360 6.359 1.00 28.57 O HETATM 2585 O HOH 244 -0.433 7.731 3.723 1.00 19.00 O HETATM 2586 O HOH 245 -4.665 3.978 -1.749 1.00 2.00 O HETATM 2587 O HOH 246 0.185 1.933 6.122 1.00 14.27 O HETATM 2588 O HOH 247 1.036 26.209 -1.905 1.00 25.24 O HETATM 2589 O HOH 248 1.665 23.979 6.100 1.00 5.13 O HETATM 2590 O HOH 249 0.756 26.657 6.303 1.00 8.50 O HETATM 2591 O HOH 250 5.141 31.155 0.050 1.00 6.86 O HETATM 2592 O HOH 251 4.238 23.110 0.446 1.00 2.00 O HETATM 2593 O HOH 252 -1.014 29.091 3.514 1.00 14.48 O HETATM 2594 O HOH 253 7.336 31.616 4.457 1.00 17.77 O HETATM 2595 O HOH 254 3.894 29.662 -1.855 1.00 10.65 O HETATM 2596 O HOH 255 0.008 21.374 2.748 1.00 3.95 O HETATM 2597 O HOH 256 3.641 30.177 4.079 1.00 2.00 O HETATM 2598 O HOH 257 -2.601 24.570 0.452 1.00 70.40 O HETATM 2599 O HOH 258 8.023 32.190 1.920 1.00 13.78 O HETATM 2600 O HOH 259 -1.218 27.373 -0.564 1.00 22.00 O HETATM 2601 O HOH 260 11.122 29.804 2.353 1.00 18.28 O HETATM 2602 O HOH 261 0.692 23.742 -0.737 1.00 14.94 O HETATM 2603 O HOH 262 20.710 37.232 -0.420 1.00 15.47 O HETATM 2604 C1 LBT A 263 -0.455 4.345 -1.586 1.00 0.19 C HETATM 2605 C2 LBT A 263 -1.168 4.816 -2.859 1.00 0.13 C HETATM 2606 C3 LBT A 263 -0.208 4.770 -4.044 1.00 0.11 C HETATM 2607 C4 LBT A 263 1.046 5.568 -3.666 1.00 0.11 C HETATM 2608 C5 LBT A 263 1.685 4.925 -2.388 1.00 0.11 C HETATM 2609 C6 LBT A 263 2.990 5.641 -1.934 1.00 0.07 C HETATM 2610 O6 LBT A 263 4.062 5.514 -2.938 1.00 -0.39 O HETATM 2611 H11 LBT A 263 3.776 5.904 -3.756 1.00 0.21 H HETATM 2612 H6 LBT A 263 3.332 5.193 -0.990 1.00 0.06 H HETATM 2613 H7 LBT A 263 2.774 6.708 -1.776 1.00 0.06 H HETATM 2614 O5 LBT A 263 0.691 5.161 -1.366 1.00 -0.34 O HETATM 2615 H5 LBT A 263 1.875 3.853 -2.541 1.00 0.06 H HETATM 2616 O4 LBT A 263 0.699 6.980 -3.323 1.00 -0.39 O HETATM 2617 H10 LBT A 263 0.308 7.401 -4.079 1.00 0.21 H HETATM 2618 H4 LBT A 263 1.761 5.550 -4.502 1.00 0.06 H HETATM 2619 O3 LBT A 263 -0.883 5.403 -5.190 1.00 -0.39 O HETATM 2620 H9 LBT A 263 -1.135 6.289 -4.958 1.00 0.21 H HETATM 2621 H3 LBT A 263 0.061 3.731 -4.287 1.00 0.06 H HETATM 2622 O2 LBT A 263 -2.348 4.032 -3.173 1.00 -0.38 O HETATM 2623 H8 LBT A 263 -2.949 4.058 -2.438 1.00 0.21 H HETATM 2624 H2 LBT A 263 -1.484 5.858 -2.703 1.00 0.07 H HETATM 2625 O1 LBT A 263 -1.281 4.703 -0.497 1.00 -0.34 O HETATM 2626 C4' LBT A 263 -1.087 3.977 0.732 1.00 0.12 C HETATM 2627 C3' LBT A 263 -0.988 4.987 1.891 1.00 0.11 C HETATM 2628 C2' LBT A 263 -1.002 4.356 3.263 1.00 0.13 C HETATM 2629 C1' LBT A 263 -2.177 3.366 3.354 1.00 0.19 C HETATM 2630 O1' LBT A 263 -3.424 4.013 3.431 1.00 -0.36 O HETATM 2631 H19 LBT A 263 -3.409 4.644 4.141 1.00 0.21 H HETATM 2632 O5' LBT A 263 -2.220 2.443 2.304 1.00 -0.34 O HETATM 2633 C5' LBT A 263 -2.303 3.041 0.947 1.00 0.11 C HETATM 2634 C6' LBT A 263 -2.333 1.841 0.026 1.00 0.07 C HETATM 2635 O6' LBT A 263 -1.010 1.218 -0.060 1.00 -0.39 O HETATM 2636 H22 LBT A 263 -1.052 0.468 -0.642 1.00 0.21 H HETATM 2637 H17 LBT A 263 -2.645 2.165 -0.978 1.00 0.06 H HETATM 2638 H18 LBT A 263 -3.053 1.106 0.415 1.00 0.06 H HETATM 2639 H16 LBT A 263 -3.227 3.626 0.830 1.00 0.06 H HETATM 2640 H12 LBT A 263 -2.038 2.798 4.286 1.00 0.09 H HETATM 2641 O2' LBT A 263 -1.171 5.389 4.279 1.00 -0.38 O HETATM 2642 H20 LBT A 263 -0.451 6.007 4.224 1.00 0.21 H HETATM 2643 H13 LBT A 263 -0.055 3.823 3.433 1.00 0.07 H HETATM 2644 O3' LBT A 263 0.148 5.869 1.823 1.00 -0.39 O HETATM 2645 H21 LBT A 263 0.136 6.457 2.569 1.00 0.21 H HETATM 2646 H14 LBT A 263 -1.887 5.616 1.816 1.00 0.06 H HETATM 2647 H15 LBT A 263 -0.164 3.382 0.677 1.00 0.07 H HETATM 2648 H1 LBT A 263 -0.217 3.272 -1.621 1.00 0.09 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 2604 2605 2614 2625 2648 CONECT 2605 2604 2606 2622 2624 CONECT 2606 2605 2607 2619 2621 CONECT 2607 2606 2608 2616 2618 CONECT 2608 2607 2609 2614 2615 CONECT 2609 2608 2610 2612 2613 CONECT 2610 2609 2611 CONECT 2611 2610 CONECT 2612 2609 CONECT 2613 2609 CONECT 2614 2604 2608 CONECT 2615 2608 CONECT 2616 2607 2617 CONECT 2617 2616 CONECT 2618 2607 CONECT 2619 2606 2620 CONECT 2620 2619 CONECT 2621 2606 CONECT 2622 2605 2623 CONECT 2623 2622 CONECT 2624 2605 CONECT 2625 2604 2626 CONECT 2626 2625 2627 2633 2647 CONECT 2627 2626 2628 2644 2646 CONECT 2628 2627 2629 2641 2643 CONECT 2629 2628 2630 2632 2640 CONECT 2630 2629 2631 CONECT 2631 2630 CONECT 2632 2629 2633 CONECT 2633 2626 2632 2634 2639 CONECT 2634 2633 2635 2637 2638 CONECT 2635 2634 2636 CONECT 2636 2635 CONECT 2637 2634 CONECT 2638 2634 CONECT 2639 2633 CONECT 2640 2629 CONECT 2641 2628 2642 CONECT 2642 2641 CONECT 2643 2628 CONECT 2644 2627 2645 CONECT 2645 2644 CONECT 2646 2627 CONECT 2647 2626 CONECT 2648 2604 MASTER 0 0 0 0 0 0 0 0 2647 1 49 12 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 2y9g
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1gwv
RCSB PDB
PDBbind
LAT
1gzc
RCSB PDB
PDBbind
LAT
1z3v
RCSB PDB
PDBbind
LAT
2nn8
RCSB PDB
PDBbind
LAT
2zgm
RCSB PDB
PDBbind
LAT
5y97
RCSB PDB
PDBbind
LAT
Entry Information
PDB ID
2y9g
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HEMOLYTIC LECTIN LSLA
Ligand Name
LAT
EC.Number
E.C.-.-.-.-
Resolution
1.67(Å)
Affinity (Kd/Ki/IC50)
Kd=170uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Glycobiology Vol. 21: pp. 1349
Ligand Properties
Formula
C
1
2
H
2
2
O
1
1
Molecular Weight
342.296
Exact Mass
342.116
No. of atoms
45
No. of bonds
46
Polar Surface Area
189.53
LOGP Value
-4.73 (
Computed with XLOGP3
)
-5.40 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 12
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@H](O)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)O)O
InChI String
InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11+,12+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q7Z8V1
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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