Browse entries in the PDBbind-CN Database
HEADER 2P3A_COMPLEX COMPND 2P3A_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 66 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 A 66 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 A 66 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ALA LEU PRO SEQRES 4 A 66 GLY LYS TRP LYS PRO ARG MET ILE GLY GLY ILE GLY GLY SEQRES 5 A 66 PHE VAL LYS VAL ARG GLN TYR ASP GLN ILE PRO ILE GLU SEQRES 6 A 66 ILE SEQRES 1 A 32 GLY HIS LYS VAL ILE GLY THR VAL LEU VAL GLY PRO THR SEQRES 2 A 32 PRO ALA ASN ILE ILE GLY ARG ASN LEU MET THR GLN ILE SEQRES 3 A 32 GLY CYS THR LEU ASN PHE SEQRES 1 B 66 PRO GLN ILE THR LEU TRP LYS ARG PRO LEU VAL THR ILE SEQRES 2 B 66 LYS ILE GLY GLY GLN LEU LYS GLU ALA LEU LEU ASP THR SEQRES 3 B 66 GLY ALA ASP ASP THR VAL LEU GLU GLU MET ALA LEU PRO SEQRES 4 B 66 GLY LYS TRP LYS PRO ARG MET ILE GLY GLY ILE GLY GLY SEQRES 5 B 66 PHE VAL LYS VAL ARG GLN TYR ASP GLN ILE PRO ILE GLU SEQRES 6 B 66 ILE SEQRES 1 B 32 GLY HIS LYS VAL ILE GLY THR VAL LEU VAL GLY PRO THR SEQRES 2 B 32 PRO ALA ASN ILE ILE GLY ARG ASN LEU MET THR GLN ILE SEQRES 3 B 32 GLY CYS THR LEU ASN PHE HET UNN A 383 130 ATOM 1 N PRO A 1 38.984 -8.284 3.573 1.00 31.94 N ATOM 2 CA PRO A 1 38.900 -8.467 2.145 1.00 32.07 C ATOM 3 C PRO A 1 38.568 -7.165 1.405 1.00 31.76 C ATOM 4 O PRO A 1 38.000 -6.245 1.978 1.00 31.24 O ATOM 5 CB PRO A 1 37.713 -9.419 2.005 1.00 32.55 C ATOM 6 CG PRO A 1 36.939 -9.227 3.232 1.00 32.67 C ATOM 7 CD PRO A 1 37.994 -9.123 4.278 1.00 32.50 C ATOM 8 HA PRO A 1 39.841 -8.822 1.726 1.00 0.00 H ATOM 9 HD3 PRO A 1 37.622 -8.636 5.180 1.00 0.00 H ATOM 10 HD2 PRO A 1 38.404 -10.099 4.536 1.00 0.00 H ATOM 11 HG3 PRO A 1 36.283 -10.077 3.419 1.00 0.00 H ATOM 12 HG2 PRO A 1 36.344 -8.315 3.182 1.00 0.00 H ATOM 13 HB2 PRO A 1 37.116 -9.164 1.129 1.00 0.00 H ATOM 14 HB3 PRO A 1 38.055 -10.451 1.923 1.00 0.00 H ATOM 15 N GLN A 2 38.928 -7.109 0.131 1.00 31.42 N ATOM 16 CA GLN A 2 38.427 -6.064 -0.732 1.00 31.28 C ATOM 17 C GLN A 2 37.320 -6.712 -1.543 1.00 30.53 C ATOM 18 O GLN A 2 37.510 -7.807 -2.072 1.00 32.85 O ATOM 19 CB GLN A 2 39.525 -5.562 -1.651 1.00 32.08 C ATOM 20 CG GLN A 2 39.052 -4.446 -2.571 1.00 34.26 C ATOM 21 CD GLN A 2 40.194 -3.625 -3.134 1.00 36.20 C ATOM 22 OE1 GLN A 2 40.902 -4.073 -4.033 1.00 39.99 O ATOM 23 NE2 GLN A 2 40.362 -2.400 -2.620 1.00 36.78 N ATOM 24 HA GLN A 2 38.070 -5.206 -0.163 1.00 0.00 H ATOM 25 HB2 GLN A 2 40.347 -5.188 -1.041 1.00 0.00 H ATOM 26 HB3 GLN A 2 39.877 -6.393 -2.262 1.00 0.00 H ATOM 27 HG2 GLN A 2 38.499 -4.888 -3.400 1.00 0.00 H ATOM 28 HG3 GLN A 2 38.393 -3.786 -2.007 1.00 0.00 H ATOM 29 HE22 GLN A 2 39.737 -2.065 -1.859 1.00 0.00 H ATOM 30 HE21 GLN A 2 41.118 -1.784 -2.981 1.00 0.00 H ATOM 31 H GLN A 2 39.578 -7.825 -0.252 1.00 0.00 H ATOM 32 N ILE A 3 36.171 -6.056 -1.635 1.00 28.41 N ATOM 33 CA ILE A 3 35.011 -6.601 -2.337 1.00 26.27 C ATOM 34 C ILE A 3 34.670 -5.638 -3.479 1.00 26.61 C ATOM 35 O ILE A 3 34.319 -4.492 -3.252 1.00 25.74 O ATOM 36 CB ILE A 3 33.814 -6.744 -1.347 1.00 25.33 C ATOM 37 CG1 ILE A 3 34.182 -7.663 -0.164 1.00 26.77 C ATOM 38 CG2 ILE A 3 32.579 -7.313 -2.031 1.00 25.40 C ATOM 39 CD1 ILE A 3 33.051 -7.884 0.830 1.00 24.85 C ATOM 40 HA ILE A 3 35.224 -7.591 -2.739 1.00 0.00 H ATOM 41 HB ILE A 3 33.592 -5.740 -0.984 1.00 0.00 H ATOM 42 HG12 ILE A 3 34.480 -8.632 -0.564 1.00 0.00 H ATOM 43 HG13 ILE A 3 35.022 -7.216 0.368 1.00 0.00 H ATOM 44 HD11 ILE A 3 32.747 -6.926 1.251 1.00 0.00 H ATOM 45 HD12 ILE A 3 32.205 -8.343 0.319 1.00 0.00 H ATOM 46 HD13 ILE A 3 33.394 -8.541 1.629 1.00 0.00 H ATOM 47 HG21 ILE A 3 32.276 -6.650 -2.841 1.00 0.00 H ATOM 48 HG22 ILE A 3 32.810 -8.299 -2.434 1.00 0.00 H ATOM 49 HG23 ILE A 3 31.769 -7.396 -1.306 1.00 0.00 H ATOM 50 H ILE A 3 36.093 -5.119 -1.191 1.00 0.00 H ATOM 51 N THR A 4 34.756 -6.090 -4.723 1.00 27.34 N ATOM 52 CA THR A 4 34.279 -5.216 -5.797 1.00 27.25 C ATOM 53 C THR A 4 32.746 -5.373 -5.846 1.00 26.25 C ATOM 54 O THR A 4 32.157 -6.165 -5.110 1.00 26.12 O ATOM 55 CB THR A 4 34.854 -5.611 -7.136 1.00 27.99 C ATOM 56 OG1 THR A 4 34.502 -6.967 -7.368 1.00 28.28 O ATOM 57 CG2 THR A 4 36.394 -5.553 -7.133 1.00 29.38 C ATOM 58 HA THR A 4 34.587 -4.189 -5.599 1.00 0.00 H ATOM 59 HB THR A 4 34.468 -4.928 -7.892 1.00 0.00 H ATOM 60 HG1 THR A 4 33.516 -7.054 -7.375 1.00 0.00 H ATOM 61 HG23 THR A 4 36.717 -4.527 -6.958 1.00 0.00 H ATOM 62 HG21 THR A 4 36.779 -6.197 -6.342 1.00 0.00 H ATOM 63 HG22 THR A 4 36.771 -5.894 -8.097 1.00 0.00 H ATOM 64 H THR A 4 35.148 -7.031 -4.928 1.00 0.00 H ATOM 65 N LEU A 5 32.102 -4.623 -6.722 1.00 24.75 N ATOM 66 CA LEU A 5 30.656 -4.549 -6.639 1.00 23.42 C ATOM 67 C LEU A 5 29.983 -4.995 -7.921 1.00 24.18 C ATOM 68 O LEU A 5 28.830 -4.693 -8.137 1.00 22.83 O ATOM 69 CB LEU A 5 30.220 -3.127 -6.288 1.00 21.86 C ATOM 70 CG LEU A 5 30.675 -2.684 -4.886 1.00 19.84 C ATOM 71 CD1 LEU A 5 30.509 -1.154 -4.797 1.00 19.87 C ATOM 72 CD2 LEU A 5 29.905 -3.404 -3.805 1.00 18.64 C ATOM 73 HA LEU A 5 30.343 -5.234 -5.851 1.00 0.00 H ATOM 74 HB2 LEU A 5 30.644 -2.443 -7.023 1.00 0.00 H ATOM 75 HB3 LEU A 5 29.132 -3.077 -6.332 1.00 0.00 H ATOM 76 HG LEU A 5 31.722 -2.945 -4.729 1.00 0.00 H ATOM 77 HD21 LEU A 5 28.842 -3.185 -3.910 1.00 0.00 H ATOM 78 HD22 LEU A 5 30.067 -4.478 -3.899 1.00 0.00 H ATOM 79 HD23 LEU A 5 30.252 -3.067 -2.828 1.00 0.00 H ATOM 80 HD11 LEU A 5 31.123 -0.678 -5.562 1.00 0.00 H ATOM 81 HD12 LEU A 5 29.462 -0.894 -4.955 1.00 0.00 H ATOM 82 HD13 LEU A 5 30.825 -0.812 -3.811 1.00 0.00 H ATOM 83 H LEU A 5 32.620 -4.097 -7.455 1.00 0.00 H ATOM 84 N TRP A 6 30.703 -5.768 -8.729 1.00 25.21 N ATOM 85 CA TRP A 6 30.113 -6.380 -9.919 1.00 27.48 C ATOM 86 C TRP A 6 28.985 -7.322 -9.547 1.00 26.87 C ATOM 87 O TRP A 6 28.052 -7.545 -10.316 1.00 27.66 O ATOM 88 CB TRP A 6 31.189 -7.100 -10.735 1.00 28.76 C ATOM 89 CG TRP A 6 32.233 -6.134 -11.144 1.00 30.34 C ATOM 90 CD1 TRP A 6 33.388 -5.867 -10.499 1.00 32.07 C ATOM 91 CD2 TRP A 6 32.184 -5.261 -12.267 1.00 32.08 C ATOM 92 NE1 TRP A 6 34.082 -4.878 -11.156 1.00 33.59 N ATOM 93 CE2 TRP A 6 33.365 -4.495 -12.257 1.00 32.73 C ATOM 94 CE3 TRP A 6 31.253 -5.038 -13.281 1.00 31.70 C ATOM 95 CZ2 TRP A 6 33.639 -3.532 -13.212 1.00 32.61 C ATOM 96 CZ3 TRP A 6 31.538 -4.107 -14.240 1.00 33.19 C ATOM 97 CH2 TRP A 6 32.712 -3.344 -14.192 1.00 32.59 C ATOM 98 HA TRP A 6 29.687 -5.589 -10.537 1.00 0.00 H ATOM 99 HB2 TRP A 6 31.639 -7.886 -10.128 1.00 0.00 H ATOM 100 HB3 TRP A 6 30.736 -7.542 -11.622 1.00 0.00 H ATOM 101 HE1 TRP A 6 35.000 -4.486 -10.864 1.00 0.00 H ATOM 102 HD1 TRP A 6 33.723 -6.364 -9.588 1.00 0.00 H ATOM 103 HZ2 TRP A 6 34.559 -2.948 -13.181 1.00 0.00 H ATOM 104 HH2 TRP A 6 32.887 -2.585 -14.954 1.00 0.00 H ATOM 105 HZ3 TRP A 6 30.836 -3.955 -15.060 1.00 0.00 H ATOM 106 HE3 TRP A 6 30.317 -5.595 -13.308 1.00 0.00 H ATOM 107 H TRP A 6 31.705 -5.941 -8.510 1.00 0.00 H ATOM 108 N LYS A 7 29.050 -7.859 -8.329 1.00 26.18 N ATOM 109 CA LYS A 7 27.990 -8.690 -7.741 1.00 25.37 C ATOM 110 C LYS A 7 27.434 -8.024 -6.469 1.00 24.00 C ATOM 111 O LYS A 7 28.068 -7.100 -5.956 1.00 22.85 O ATOM 112 CB LYS A 7 28.565 -10.071 -7.402 1.00 26.36 C ATOM 113 CG LYS A 7 29.022 -10.835 -8.648 1.00 28.97 C ATOM 114 CD LYS A 7 27.815 -11.297 -9.449 1.00 32.52 C ATOM 115 CE LYS A 7 28.210 -11.933 -10.768 1.00 35.60 C ATOM 116 NZ LYS A 7 28.596 -10.893 -11.742 1.00 37.11 N ATOM 117 HA LYS A 7 27.176 -8.798 -8.458 1.00 0.00 H ATOM 118 HB2 LYS A 7 29.419 -9.941 -6.738 1.00 0.00 H ATOM 119 HB3 LYS A 7 27.797 -10.655 -6.895 1.00 0.00 H ATOM 120 HG2 LYS A 7 29.637 -10.182 -9.267 1.00 0.00 H ATOM 121 HG3 LYS A 7 29.608 -11.703 -8.345 1.00 0.00 H ATOM 122 HD2 LYS A 7 27.261 -12.027 -8.859 1.00 0.00 H ATOM 123 HD3 LYS A 7 27.178 -10.436 -9.651 1.00 0.00 H ATOM 124 HE2 LYS A 7 27.366 -12.499 -11.162 1.00 0.00 H ATOM 125 HE3 LYS A 7 29.053 -12.605 -10.606 1.00 0.00 H ATOM 126 HZ1 LYS A 7 27.792 -10.252 -11.900 1.00 0.00 H ATOM 127 HZ2 LYS A 7 29.403 -10.353 -11.369 1.00 0.00 H ATOM 128 HZ3 LYS A 7 28.864 -11.343 -12.640 1.00 0.00 H ATOM 129 H LYS A 7 29.902 -7.679 -7.760 1.00 0.00 H ATOM 130 N ARG A 8 26.288 -8.483 -5.941 1.00 23.05 N ATOM 131 CA ARG A 8 25.875 -8.023 -4.614 1.00 21.71 C ATOM 132 C ARG A 8 26.929 -8.501 -3.624 1.00 21.10 C ATOM 133 O ARG A 8 27.328 -9.676 -3.635 1.00 20.83 O ATOM 134 CB ARG A 8 24.484 -8.512 -4.224 1.00 22.35 C ATOM 135 CG ARG A 8 23.395 -7.948 -5.115 1.00 23.39 C ATOM 136 CD ARG A 8 22.022 -8.424 -4.762 1.00 24.19 C ATOM 137 NE ARG A 8 21.030 -8.042 -5.770 1.00 26.15 N ATOM 138 CZ ARG A 8 20.261 -8.897 -6.410 1.00 27.91 C ATOM 139 NH1 ARG A 8 20.376 -10.207 -6.178 1.00 28.97 N ATOM 140 NH2 ARG A 8 19.386 -8.454 -7.293 1.00 29.86 N ATOM 141 HA ARG A 8 25.804 -6.935 -4.613 1.00 0.00 H ATOM 142 HB2 ARG A 8 24.464 -9.600 -4.294 1.00 0.00 H ATOM 143 HB3 ARG A 8 24.284 -8.212 -3.195 1.00 0.00 H ATOM 144 HG2 ARG A 8 23.414 -6.861 -5.035 1.00 0.00 H ATOM 145 HG3 ARG A 8 23.607 -8.239 -6.144 1.00 0.00 H ATOM 146 HD2 ARG A 8 21.735 -7.991 -3.804 1.00 0.00 H ATOM 147 HD3 ARG A 8 22.037 -9.511 -4.678 1.00 0.00 H ATOM 148 HE ARG A 8 20.927 -7.032 -5.994 1.00 0.00 H ATOM 149 HH12 ARG A 8 19.767 -10.880 -6.685 1.00 0.00 H ATOM 150 HH11 ARG A 8 21.075 -10.554 -5.490 1.00 0.00 H ATOM 151 HH22 ARG A 8 18.776 -9.125 -7.802 1.00 0.00 H ATOM 152 HH21 ARG A 8 19.307 -7.434 -7.480 1.00 0.00 H ATOM 153 H ARG A 8 25.700 -9.158 -6.469 1.00 0.00 H ATOM 154 N PRO A 9 27.395 -7.561 -2.804 1.00 19.98 N ATOM 155 CA PRO A 9 28.397 -7.818 -1.780 1.00 19.22 C ATOM 156 C PRO A 9 27.787 -8.615 -0.638 1.00 17.55 C ATOM 157 O PRO A 9 27.472 -8.064 0.420 1.00 17.53 O ATOM 158 CB PRO A 9 28.837 -6.412 -1.363 1.00 18.99 C ATOM 159 CG PRO A 9 27.535 -5.608 -1.493 1.00 17.75 C ATOM 160 CD PRO A 9 26.895 -6.169 -2.789 1.00 19.55 C ATOM 161 HA PRO A 9 29.242 -8.419 -2.117 1.00 0.00 H ATOM 162 HD3 PRO A 9 25.807 -6.140 -2.738 1.00 0.00 H ATOM 163 HD2 PRO A 9 27.231 -5.618 -3.667 1.00 0.00 H ATOM 164 HG3 PRO A 9 27.742 -4.542 -1.589 1.00 0.00 H ATOM 165 HG2 PRO A 9 26.886 -5.774 -0.633 1.00 0.00 H ATOM 166 HB2 PRO A 9 29.207 -6.402 -0.338 1.00 0.00 H ATOM 167 HB3 PRO A 9 29.608 -6.026 -2.030 1.00 0.00 H ATOM 168 N LEU A 10 27.662 -9.930 -0.847 1.00 18.31 N ATOM 169 CA LEU A 10 27.103 -10.807 0.155 1.00 19.00 C ATOM 170 C LEU A 10 28.202 -11.346 1.068 1.00 19.95 C ATOM 171 O LEU A 10 29.334 -11.648 0.648 1.00 22.33 O ATOM 172 CB LEU A 10 26.387 -11.980 -0.523 1.00 19.99 C ATOM 173 CG LEU A 10 25.223 -11.567 -1.422 1.00 20.70 C ATOM 174 CD1 LEU A 10 24.534 -12.766 -2.047 1.00 27.23 C ATOM 175 CD2 LEU A 10 24.232 -10.842 -0.573 1.00 24.03 C ATOM 176 HA LEU A 10 26.392 -10.238 0.754 1.00 0.00 H ATOM 177 HB2 LEU A 10 27.114 -12.520 -1.130 1.00 0.00 H ATOM 178 HB3 LEU A 10 26.002 -12.641 0.254 1.00 0.00 H ATOM 179 HG LEU A 10 25.609 -10.944 -2.229 1.00 0.00 H ATOM 180 HD21 LEU A 10 23.884 -11.502 0.221 1.00 0.00 H ATOM 181 HD22 LEU A 10 24.705 -9.963 -0.135 1.00 0.00 H ATOM 182 HD23 LEU A 10 23.386 -10.533 -1.187 1.00 0.00 H ATOM 183 HD11 LEU A 10 25.251 -13.321 -2.651 1.00 0.00 H ATOM 184 HD12 LEU A 10 24.144 -13.411 -1.259 1.00 0.00 H ATOM 185 HD13 LEU A 10 23.713 -12.424 -2.678 1.00 0.00 H ATOM 186 H LEU A 10 27.975 -10.331 -1.754 1.00 0.00 H ATOM 187 N VAL A 11 27.884 -11.434 2.337 1.00 19.34 N ATOM 188 CA VAL A 11 28.804 -12.010 3.319 1.00 19.34 C ATOM 189 C VAL A 11 28.035 -12.999 4.143 1.00 19.25 C ATOM 190 O VAL A 11 26.810 -12.906 4.259 1.00 18.99 O ATOM 191 CB VAL A 11 29.427 -10.950 4.300 1.00 18.89 C ATOM 192 CG1 VAL A 11 30.445 -10.046 3.581 1.00 20.77 C ATOM 193 CG2 VAL A 11 28.339 -10.130 5.016 1.00 19.23 C ATOM 194 HA VAL A 11 29.627 -12.460 2.764 1.00 0.00 H ATOM 195 HB VAL A 11 29.970 -11.499 5.069 1.00 0.00 H ATOM 196 HG11 VAL A 11 31.251 -10.658 3.177 1.00 0.00 H ATOM 197 HG12 VAL A 11 29.948 -9.515 2.769 1.00 0.00 H ATOM 198 HG13 VAL A 11 30.854 -9.326 4.290 1.00 0.00 H ATOM 199 HG21 VAL A 11 27.738 -9.602 4.276 1.00 0.00 H ATOM 200 HG22 VAL A 11 27.702 -10.800 5.593 1.00 0.00 H ATOM 201 HG23 VAL A 11 28.810 -9.409 5.684 1.00 0.00 H ATOM 202 H VAL A 11 26.956 -11.086 2.653 1.00 0.00 H ATOM 203 N THR A 12 28.744 -13.958 4.732 1.00 19.97 N ATOM 204 CA THR A 12 28.121 -14.913 5.638 1.00 20.68 C ATOM 205 C THR A 12 28.229 -14.418 7.074 1.00 20.82 C ATOM 206 O THR A 12 29.330 -14.136 7.552 1.00 21.29 O ATOM 207 CB THR A 12 28.751 -16.305 5.491 1.00 21.13 C ATOM 208 OG1 THR A 12 28.547 -16.783 4.155 1.00 22.55 O ATOM 209 CG2 THR A 12 28.003 -17.306 6.363 1.00 21.31 C ATOM 210 HA THR A 12 27.066 -14.999 5.377 1.00 0.00 H ATOM 211 HB THR A 12 29.805 -16.221 5.757 1.00 0.00 H ATOM 212 HG1 THR A 12 28.954 -17.681 4.061 1.00 0.00 H ATOM 213 HG23 THR A 12 28.103 -17.020 7.410 1.00 0.00 H ATOM 214 HG21 THR A 12 26.949 -17.311 6.086 1.00 0.00 H ATOM 215 HG22 THR A 12 28.424 -18.301 6.215 1.00 0.00 H ATOM 216 H THR A 12 29.764 -14.027 4.542 1.00 0.00 H ATOM 217 N ILE A 13 27.087 -14.317 7.754 1.00 20.55 N ATOM 218 CA ILE A 13 27.039 -13.813 9.107 1.00 19.85 C ATOM 219 C ILE A 13 26.626 -14.970 9.979 1.00 21.20 C ATOM 220 O ILE A 13 26.024 -15.960 9.509 1.00 21.08 O ATOM 221 CB ILE A 13 26.091 -12.644 9.243 1.00 19.55 C ATOM 222 CG1 ILE A 13 24.640 -13.099 9.030 1.00 18.61 C ATOM 223 CG2 ILE A 13 26.471 -11.529 8.228 1.00 20.55 C ATOM 224 CD1 ILE A 13 23.573 -12.046 9.375 1.00 19.53 C ATOM 225 HA ILE A 13 28.013 -13.428 9.407 1.00 0.00 H ATOM 226 HB ILE A 13 26.175 -12.240 10.252 1.00 0.00 H ATOM 227 HG12 ILE A 13 24.521 -13.371 7.981 1.00 0.00 H ATOM 228 HG13 ILE A 13 24.465 -13.976 9.654 1.00 0.00 H ATOM 229 HD11 ILE A 13 23.664 -11.769 10.425 1.00 0.00 H ATOM 230 HD12 ILE A 13 23.720 -11.164 8.752 1.00 0.00 H ATOM 231 HD13 ILE A 13 22.582 -12.461 9.192 1.00 0.00 H ATOM 232 HG21 ILE A 13 27.488 -11.191 8.426 1.00 0.00 H ATOM 233 HG22 ILE A 13 26.409 -11.925 7.215 1.00 0.00 H ATOM 234 HG23 ILE A 13 25.781 -10.692 8.335 1.00 0.00 H ATOM 235 H ILE A 13 26.201 -14.611 7.295 1.00 0.00 H ATOM 236 N LYS A 14 26.979 -14.851 11.243 1.00 21.80 N ATOM 237 CA LYS A 14 26.545 -15.796 12.245 1.00 22.99 C ATOM 238 C LYS A 14 25.842 -14.901 13.236 1.00 22.64 C ATOM 239 O LYS A 14 26.373 -13.855 13.638 1.00 22.11 O ATOM 240 CB LYS A 14 27.715 -16.535 12.887 1.00 22.84 C ATOM 241 CG LYS A 14 27.251 -17.564 13.940 1.00 23.89 C ATOM 242 CD LYS A 14 28.358 -18.508 14.423 1.00 25.29 C ATOM 243 CE LYS A 14 29.239 -17.856 15.460 1.00 28.00 C ATOM 244 NZ LYS A 14 30.245 -18.781 16.115 1.00 30.48 N ATOM 245 HA LYS A 14 25.917 -16.592 11.845 1.00 0.00 H ATOM 246 HB2 LYS A 14 28.271 -17.057 12.108 1.00 0.00 H ATOM 247 HB3 LYS A 14 28.367 -15.807 13.371 1.00 0.00 H ATOM 248 HG2 LYS A 14 26.864 -17.021 14.802 1.00 0.00 H ATOM 249 HG3 LYS A 14 26.454 -18.166 13.503 1.00 0.00 H ATOM 250 HD2 LYS A 14 27.900 -19.396 14.857 1.00 0.00 H ATOM 251 HD3 LYS A 14 28.972 -18.798 13.570 1.00 0.00 H ATOM 252 HE2 LYS A 14 28.598 -17.446 16.240 1.00 0.00 H ATOM 253 HE3 LYS A 14 29.787 -17.046 14.978 1.00 0.00 H ATOM 254 HZ1 LYS A 14 29.742 -19.555 16.593 1.00 0.00 H ATOM 255 HZ2 LYS A 14 30.877 -19.173 15.389 1.00 0.00 H ATOM 256 HZ3 LYS A 14 30.804 -18.247 16.811 1.00 0.00 H ATOM 257 H LYS A 14 27.586 -14.056 11.526 1.00 0.00 H ATOM 258 N ILE A 15 24.615 -15.279 13.565 1.00 22.20 N ATOM 259 CA ILE A 15 23.863 -14.561 14.543 1.00 23.64 C ATOM 260 C ILE A 15 22.887 -15.520 15.174 1.00 24.85 C ATOM 261 O ILE A 15 22.216 -16.322 14.468 1.00 24.43 O ATOM 262 CB ILE A 15 23.102 -13.391 13.906 1.00 22.82 C ATOM 263 CG1 ILE A 15 22.282 -12.664 14.988 1.00 23.93 C ATOM 264 CG2 ILE A 15 22.285 -13.836 12.622 1.00 24.69 C ATOM 265 CD1 ILE A 15 21.644 -11.372 14.530 1.00 24.05 C ATOM 266 HA ILE A 15 24.540 -14.148 15.291 1.00 0.00 H ATOM 267 HB ILE A 15 23.808 -12.660 13.512 1.00 0.00 H ATOM 268 HG12 ILE A 15 21.491 -13.334 15.323 1.00 0.00 H ATOM 269 HG13 ILE A 15 22.945 -12.439 15.824 1.00 0.00 H ATOM 270 HD11 ILE A 15 22.421 -10.681 14.203 1.00 0.00 H ATOM 271 HD12 ILE A 15 20.966 -11.577 13.702 1.00 0.00 H ATOM 272 HD13 ILE A 15 21.087 -10.930 15.357 1.00 0.00 H ATOM 273 HG21 ILE A 15 22.972 -14.239 11.878 1.00 0.00 H ATOM 274 HG22 ILE A 15 21.560 -14.600 12.901 1.00 0.00 H ATOM 275 HG23 ILE A 15 21.764 -12.973 12.207 1.00 0.00 H ATOM 276 H ILE A 15 24.194 -16.111 13.104 1.00 0.00 H ATOM 277 N GLY A 16 22.805 -15.426 16.491 1.00 26.08 N ATOM 278 CA GLY A 16 21.905 -16.284 17.263 1.00 27.56 C ATOM 279 C GLY A 16 22.143 -17.746 16.961 1.00 27.91 C ATOM 280 O GLY A 16 21.185 -18.530 16.922 1.00 29.29 O ATOM 281 HA3 GLY A 16 20.874 -16.033 17.013 1.00 0.00 H ATOM 282 HA2 GLY A 16 22.073 -16.109 18.326 1.00 0.00 H ATOM 283 H GLY A 16 23.393 -14.727 16.989 1.00 0.00 H ATOM 284 N GLY A 17 23.413 -18.103 16.736 1.00 27.27 N ATOM 285 CA GLY A 17 23.824 -19.463 16.419 1.00 27.09 C ATOM 286 C GLY A 17 23.474 -19.931 15.024 1.00 25.95 C ATOM 287 O GLY A 17 23.630 -21.097 14.705 1.00 26.95 O ATOM 288 HA3 GLY A 17 23.345 -20.135 17.131 1.00 0.00 H ATOM 289 HA2 GLY A 17 24.906 -19.524 16.534 1.00 0.00 H ATOM 290 H GLY A 17 24.147 -17.368 16.791 1.00 0.00 H ATOM 291 N GLN A 18 22.973 -19.019 14.197 1.00 24.83 N ATOM 292 CA GLN A 18 22.521 -19.368 12.857 1.00 24.29 C ATOM 293 C GLN A 18 23.379 -18.694 11.834 1.00 22.69 C ATOM 294 O GLN A 18 23.796 -17.548 12.014 1.00 21.53 O ATOM 295 CB GLN A 18 21.086 -18.926 12.641 1.00 25.57 C ATOM 296 CG GLN A 18 20.135 -19.588 13.581 1.00 26.93 C ATOM 297 CD GLN A 18 18.805 -18.971 13.499 1.00 29.67 C ATOM 298 OE1 GLN A 18 18.115 -19.153 12.502 1.00 29.48 O ATOM 299 NE2 GLN A 18 18.407 -18.240 14.556 1.00 31.07 N ATOM 300 HA GLN A 18 22.589 -20.451 12.754 1.00 0.00 H ATOM 301 HB2 GLN A 18 21.027 -17.847 12.786 1.00 0.00 H ATOM 302 HB3 GLN A 18 20.795 -19.170 11.619 1.00 0.00 H ATOM 303 HG2 GLN A 18 20.056 -20.644 13.324 1.00 0.00 H ATOM 304 HG3 GLN A 18 20.512 -19.490 14.599 1.00 0.00 H ATOM 305 HE22 GLN A 18 19.038 -18.122 15.374 1.00 0.00 H ATOM 306 HE21 GLN A 18 17.468 -17.793 14.555 1.00 0.00 H ATOM 307 H GLN A 18 22.902 -18.031 14.515 1.00 0.00 H ATOM 308 N LEU A 19 23.553 -19.366 10.716 1.00 21.68 N ATOM 309 CA LEU A 19 24.335 -18.810 9.634 1.00 22.49 C ATOM 310 C LEU A 19 23.389 -18.253 8.629 1.00 21.51 C ATOM 311 O LEU A 19 22.420 -18.913 8.265 1.00 21.81 O ATOM 312 CB LEU A 19 25.141 -19.910 8.955 1.00 23.21 C ATOM 313 CG LEU A 19 25.972 -20.693 9.940 1.00 24.57 C ATOM 314 CD1 LEU A 19 26.690 -21.789 9.133 1.00 28.00 C ATOM 315 CD2 LEU A 19 26.936 -19.725 10.637 1.00 26.99 C ATOM 316 HA LEU A 19 25.009 -18.047 10.022 1.00 0.00 H ATOM 317 HB2 LEU A 19 24.454 -20.592 8.454 1.00 0.00 H ATOM 318 HB3 LEU A 19 25.803 -19.457 8.217 1.00 0.00 H ATOM 319 HG LEU A 19 25.382 -21.168 10.724 1.00 0.00 H ATOM 320 HD21 LEU A 19 27.581 -19.258 9.893 1.00 0.00 H ATOM 321 HD22 LEU A 19 26.364 -18.957 11.158 1.00 0.00 H ATOM 322 HD23 LEU A 19 27.546 -20.275 11.354 1.00 0.00 H ATOM 323 HD11 LEU A 19 25.950 -22.429 8.652 1.00 0.00 H ATOM 324 HD12 LEU A 19 27.320 -21.326 8.373 1.00 0.00 H ATOM 325 HD13 LEU A 19 27.308 -22.386 9.804 1.00 0.00 H ATOM 326 H LEU A 19 23.123 -20.307 10.609 1.00 0.00 H ATOM 327 N LYS A 20 23.705 -17.067 8.146 1.00 20.45 N ATOM 328 CA LYS A 20 22.882 -16.375 7.180 1.00 20.80 C ATOM 329 C LYS A 20 23.789 -15.706 6.193 1.00 19.82 C ATOM 330 O LYS A 20 24.985 -15.507 6.472 1.00 20.45 O ATOM 331 CB LYS A 20 21.992 -15.344 7.897 1.00 20.71 C ATOM 332 CG LYS A 20 20.983 -16.045 8.758 1.00 22.35 C ATOM 333 CD LYS A 20 19.881 -15.151 9.360 1.00 25.82 C ATOM 334 CE LYS A 20 18.744 -16.049 9.924 1.00 28.50 C ATOM 335 NZ LYS A 20 18.119 -16.931 8.844 1.00 32.44 N ATOM 336 HA LYS A 20 22.228 -17.074 6.659 1.00 0.00 H ATOM 337 HB2 LYS A 20 22.614 -14.702 8.520 1.00 0.00 H ATOM 338 HB3 LYS A 20 21.474 -14.737 7.155 1.00 0.00 H ATOM 339 HG2 LYS A 20 20.499 -16.811 8.152 1.00 0.00 H ATOM 340 HG3 LYS A 20 21.517 -16.519 9.582 1.00 0.00 H ATOM 341 HD2 LYS A 20 20.301 -14.546 10.164 1.00 0.00 H ATOM 342 HD3 LYS A 20 19.479 -14.497 8.586 1.00 0.00 H ATOM 343 HE2 LYS A 20 17.969 -15.411 10.349 1.00 0.00 H ATOM 344 HE3 LYS A 20 19.155 -16.688 10.706 1.00 0.00 H ATOM 345 HZ1 LYS A 20 17.717 -16.330 8.097 1.00 0.00 H ATOM 346 HZ2 LYS A 20 18.850 -17.549 8.438 1.00 0.00 H ATOM 347 HZ3 LYS A 20 17.366 -17.512 9.265 1.00 0.00 H ATOM 348 H LYS A 20 24.581 -16.612 8.473 1.00 0.00 H ATOM 349 N GLU A 21 23.270 -15.434 5.011 1.00 19.09 N ATOM 350 CA GLU A 21 23.987 -14.575 4.092 1.00 20.06 C ATOM 351 C GLU A 21 23.331 -13.208 4.209 1.00 18.86 C ATOM 352 O GLU A 21 22.103 -13.094 4.375 1.00 18.61 O ATOM 353 CB GLU A 21 23.822 -15.095 2.684 1.00 21.36 C ATOM 354 CG GLU A 21 24.773 -14.505 1.682 1.00 25.97 C ATOM 355 CD GLU A 21 24.990 -15.444 0.507 1.00 30.52 C ATOM 356 OE1 GLU A 21 26.020 -16.206 0.499 1.00 34.11 O ATOM 357 OE2 GLU A 21 24.109 -15.424 -0.404 1.00 33.91 O ATOM 358 HA GLU A 21 25.052 -14.535 4.319 1.00 0.00 H ATOM 359 HB2 GLU A 21 23.972 -16.174 2.701 1.00 0.00 H ATOM 360 HB3 GLU A 21 22.805 -14.876 2.358 1.00 0.00 H ATOM 361 HG2 GLU A 21 24.363 -13.564 1.314 1.00 0.00 H ATOM 362 HG3 GLU A 21 25.730 -14.317 2.168 1.00 0.00 H ATOM 363 H GLU A 21 22.349 -15.835 4.740 1.00 0.00 H ATOM 364 N ALA A 22 24.137 -12.173 4.082 1.00 17.49 N ATOM 365 CA ALA A 22 23.643 -10.823 4.265 1.00 15.90 C ATOM 366 C ALA A 22 24.349 -9.902 3.328 1.00 15.84 C ATOM 367 O ALA A 22 25.489 -10.157 2.915 1.00 15.40 O ATOM 368 CB ALA A 22 23.818 -10.387 5.680 1.00 15.92 C ATOM 369 HA ALA A 22 22.576 -10.798 4.042 1.00 0.00 H ATOM 370 HB1 ALA A 22 23.264 -11.058 6.337 1.00 0.00 H ATOM 371 HB2 ALA A 22 24.876 -10.414 5.939 1.00 0.00 H ATOM 372 HB3 ALA A 22 23.441 -9.371 5.795 1.00 0.00 H ATOM 373 H ALA A 22 25.139 -12.327 3.848 1.00 0.00 H ATOM 374 N LEU A 23 23.648 -8.845 2.959 1.00 14.56 N ATOM 375 CA LEU A 23 24.199 -7.890 2.041 1.00 15.50 C ATOM 376 C LEU A 23 24.900 -6.776 2.802 1.00 15.07 C ATOM 377 O LEU A 23 24.319 -6.159 3.691 1.00 16.35 O ATOM 378 CB LEU A 23 23.035 -7.351 1.251 1.00 17.16 C ATOM 379 CG LEU A 23 23.264 -6.287 0.209 1.00 19.96 C ATOM 380 CD1 LEU A 23 24.035 -6.950 -0.914 1.00 24.03 C ATOM 381 CD2 LEU A 23 21.883 -5.786 -0.230 1.00 21.09 C ATOM 382 HA LEU A 23 24.941 -8.343 1.384 1.00 0.00 H ATOM 383 HB2 LEU A 23 22.580 -8.200 0.741 1.00 0.00 H ATOM 384 HB3 LEU A 23 22.328 -6.940 1.972 1.00 0.00 H ATOM 385 HG LEU A 23 23.835 -5.429 0.562 1.00 0.00 H ATOM 386 HD21 LEU A 23 21.312 -6.616 -0.645 1.00 0.00 H ATOM 387 HD22 LEU A 23 21.356 -5.376 0.631 1.00 0.00 H ATOM 388 HD23 LEU A 23 22.003 -5.011 -0.987 1.00 0.00 H ATOM 389 HD11 LEU A 23 24.981 -7.331 -0.528 1.00 0.00 H ATOM 390 HD12 LEU A 23 23.448 -7.775 -1.319 1.00 0.00 H ATOM 391 HD13 LEU A 23 24.229 -6.220 -1.700 1.00 0.00 H ATOM 392 H LEU A 23 22.689 -8.704 3.337 1.00 0.00 H ATOM 393 N LEU A 24 26.161 -6.535 2.472 1.00 15.12 N ATOM 394 CA LEU A 24 26.880 -5.373 3.048 1.00 15.01 C ATOM 395 C LEU A 24 26.309 -4.178 2.335 1.00 15.30 C ATOM 396 O LEU A 24 26.462 -4.031 1.109 1.00 16.68 O ATOM 397 CB LEU A 24 28.364 -5.443 2.792 1.00 15.61 C ATOM 398 CG LEU A 24 29.104 -6.605 3.471 1.00 16.62 C ATOM 399 CD1 LEU A 24 30.532 -6.483 2.937 1.00 17.95 C ATOM 400 CD2 LEU A 24 29.020 -6.370 4.947 1.00 18.20 C ATOM 401 HA LEU A 24 26.754 -5.336 4.130 1.00 0.00 H ATOM 402 HB2 LEU A 24 28.514 -5.533 1.716 1.00 0.00 H ATOM 403 HB3 LEU A 24 28.809 -4.512 3.143 1.00 0.00 H ATOM 404 HG LEU A 24 28.707 -7.601 3.276 1.00 0.00 H ATOM 405 HD21 LEU A 24 29.491 -5.417 5.189 1.00 0.00 H ATOM 406 HD22 LEU A 24 27.974 -6.347 5.251 1.00 0.00 H ATOM 407 HD23 LEU A 24 29.535 -7.175 5.472 1.00 0.00 H ATOM 408 HD11 LEU A 24 30.522 -6.576 1.851 1.00 0.00 H ATOM 409 HD12 LEU A 24 30.941 -5.512 3.216 1.00 0.00 H ATOM 410 HD13 LEU A 24 31.147 -7.274 3.365 1.00 0.00 H ATOM 411 H LEU A 24 26.650 -7.165 1.804 1.00 0.00 H ATOM 412 N ASP A 25 25.609 -3.357 3.089 1.00 14.92 N ATOM 413 CA ASP A 25 24.742 -2.399 2.457 1.00 14.00 C ATOM 414 C ASP A 25 25.048 -0.990 2.974 1.00 14.51 C ATOM 415 O ASP A 25 24.560 -0.577 4.007 1.00 12.88 O ATOM 416 CB ASP A 25 23.319 -2.762 2.786 1.00 14.48 C ATOM 417 CG ASP A 25 22.322 -1.848 2.106 1.00 16.85 C ATOM 418 OD1 ASP A 25 22.709 -0.880 1.420 1.00 15.76 O ATOM 419 OD2 ASP A 25 21.125 -2.032 2.238 1.00 21.44 O ATOM 420 HA ASP A 25 24.897 -2.413 1.378 1.00 0.00 H ATOM 421 HB2 ASP A 25 23.134 -3.786 2.462 1.00 0.00 H ATOM 422 HB3 ASP A 25 23.180 -2.693 3.865 1.00 0.00 H ATOM 423 H ASP A 25 25.682 -3.400 4.126 1.00 0.00 H ATOM 424 N THR A 26 25.817 -0.235 2.201 1.00 14.43 N ATOM 425 CA THR A 26 26.195 1.106 2.647 1.00 14.55 C ATOM 426 C THR A 26 25.016 2.092 2.601 1.00 14.72 C ATOM 427 O THR A 26 25.128 3.163 3.163 1.00 16.15 O ATOM 428 CB THR A 26 27.317 1.680 1.807 1.00 13.96 C ATOM 429 OG1 THR A 26 26.946 1.604 0.424 1.00 14.98 O ATOM 430 CG2 THR A 26 28.607 0.825 1.915 1.00 14.04 C ATOM 431 HA THR A 26 26.525 0.986 3.679 1.00 0.00 H ATOM 432 HB THR A 26 27.491 2.697 2.159 1.00 0.00 H ATOM 433 HG1 THR A 26 26.117 2.124 0.277 1.00 0.00 H ATOM 434 HG23 THR A 26 28.959 0.830 2.946 1.00 0.00 H ATOM 435 HG21 THR A 26 28.390 -0.198 1.609 1.00 0.00 H ATOM 436 HG22 THR A 26 29.375 1.245 1.265 1.00 0.00 H ATOM 437 H THR A 26 26.149 -0.594 1.283 1.00 0.00 H ATOM 438 N GLY A 27 23.926 1.747 1.931 1.00 14.59 N ATOM 439 CA GLY A 27 22.735 2.593 1.892 1.00 17.18 C ATOM 440 C GLY A 27 21.755 2.273 3.014 1.00 18.65 C ATOM 441 O GLY A 27 20.588 2.737 2.993 1.00 20.36 O ATOM 442 HA3 GLY A 27 22.232 2.446 0.936 1.00 0.00 H ATOM 443 HA2 GLY A 27 23.043 3.635 1.983 1.00 0.00 H ATOM 444 H GLY A 27 23.918 0.844 1.416 1.00 0.00 H ATOM 445 N ALA A 28 22.197 1.454 3.959 1.00 17.56 N ATOM 446 CA ALA A 28 21.362 0.993 5.089 1.00 18.05 C ATOM 447 C ALA A 28 21.998 1.552 6.360 1.00 18.37 C ATOM 448 O ALA A 28 23.160 1.281 6.658 1.00 17.31 O ATOM 449 CB ALA A 28 21.307 -0.538 5.139 1.00 17.53 C ATOM 450 HA ALA A 28 20.335 1.342 4.980 1.00 0.00 H ATOM 451 HB1 ALA A 28 20.880 -0.915 4.210 1.00 0.00 H ATOM 452 HB2 ALA A 28 22.315 -0.933 5.264 1.00 0.00 H ATOM 453 HB3 ALA A 28 20.687 -0.851 5.979 1.00 0.00 H ATOM 454 H ALA A 28 23.180 1.119 3.902 1.00 0.00 H ATOM 455 N ASP A 29 21.243 2.355 7.103 1.00 20.23 N ATOM 456 CA ASP A 29 21.742 2.931 8.338 1.00 21.34 C ATOM 457 C ASP A 29 21.889 1.805 9.346 1.00 22.29 C ATOM 458 O ASP A 29 22.882 1.721 10.077 1.00 23.06 O ATOM 459 CB ASP A 29 20.705 3.902 8.931 1.00 22.49 C ATOM 460 CG ASP A 29 20.345 5.046 8.013 1.00 23.83 C ATOM 461 OD1 ASP A 29 21.115 5.351 7.072 1.00 24.11 O ATOM 462 OD2 ASP A 29 19.299 5.717 8.223 1.00 25.76 O ATOM 463 HA ASP A 29 22.680 3.448 8.136 1.00 0.00 H ATOM 464 HB2 ASP A 29 19.797 3.341 9.154 1.00 0.00 H ATOM 465 HB3 ASP A 29 21.110 4.316 9.854 1.00 0.00 H ATOM 466 H ASP A 29 20.275 2.575 6.793 1.00 0.00 H ATOM 467 N ASP A 30 20.893 0.914 9.318 1.00 22.09 N ATOM 468 CA ASP A 30 20.678 -0.119 10.287 1.00 22.04 C ATOM 469 C ASP A 30 20.826 -1.489 9.633 1.00 20.90 C ATOM 470 O ASP A 30 20.866 -1.629 8.407 1.00 21.22 O ATOM 471 CB ASP A 30 19.260 0.041 10.850 1.00 22.78 C ATOM 472 CG ASP A 30 18.981 1.473 11.300 1.00 27.45 C ATOM 473 OD1 ASP A 30 19.699 1.965 12.195 1.00 30.97 O ATOM 474 OD2 ASP A 30 18.087 2.200 10.791 1.00 29.64 O ATOM 475 HA ASP A 30 21.413 -0.040 11.088 1.00 0.00 H ATOM 476 HB2 ASP A 30 18.541 -0.232 10.077 1.00 0.00 H ATOM 477 HB3 ASP A 30 19.143 -0.626 11.704 1.00 0.00 H ATOM 478 H ASP A 30 20.219 0.976 8.528 1.00 0.00 H ATOM 479 N THR A 31 20.831 -2.505 10.463 1.00 20.35 N ATOM 480 CA THR A 31 20.976 -3.859 10.030 1.00 19.84 C ATOM 481 C THR A 31 19.605 -4.513 10.156 1.00 20.37 C ATOM 482 O THR A 31 18.959 -4.390 11.188 1.00 20.40 O ATOM 483 CB THR A 31 22.000 -4.519 10.921 1.00 20.46 C ATOM 484 OG1 THR A 31 23.300 -4.051 10.509 1.00 19.76 O ATOM 485 CG2 THR A 31 22.015 -6.060 10.699 1.00 19.72 C ATOM 486 HA THR A 31 21.317 -3.945 8.998 1.00 0.00 H ATOM 487 HB THR A 31 21.763 -4.287 11.959 1.00 0.00 H ATOM 488 HG1 THR A 31 23.341 -3.067 10.605 1.00 0.00 H ATOM 489 HG23 THR A 31 21.052 -6.478 10.994 1.00 0.00 H ATOM 490 HG21 THR A 31 22.197 -6.272 9.645 1.00 0.00 H ATOM 491 HG22 THR A 31 22.806 -6.505 11.303 1.00 0.00 H ATOM 492 H THR A 31 20.725 -2.317 11.480 1.00 0.00 H ATOM 493 N VAL A 32 19.142 -5.123 9.074 1.00 19.98 N ATOM 494 CA VAL A 32 17.789 -5.684 9.023 1.00 21.38 C ATOM 495 C VAL A 32 17.901 -7.112 8.551 1.00 21.49 C ATOM 496 O VAL A 32 18.425 -7.368 7.471 1.00 21.59 O ATOM 497 CB VAL A 32 16.840 -4.967 8.051 1.00 21.18 C ATOM 498 CG1 VAL A 32 15.443 -5.393 8.409 1.00 21.92 C ATOM 499 CG2 VAL A 32 16.963 -3.464 8.136 1.00 23.94 C ATOM 500 HA VAL A 32 17.372 -5.577 10.024 1.00 0.00 H ATOM 501 HB VAL A 32 17.094 -5.238 7.026 1.00 0.00 H ATOM 502 HG11 VAL A 32 15.357 -6.475 8.306 1.00 0.00 H ATOM 503 HG12 VAL A 32 15.230 -5.107 9.439 1.00 0.00 H ATOM 504 HG13 VAL A 32 14.733 -4.905 7.741 1.00 0.00 H ATOM 505 HG21 VAL A 32 16.722 -3.138 9.148 1.00 0.00 H ATOM 506 HG22 VAL A 32 17.984 -3.170 7.892 1.00 0.00 H ATOM 507 HG23 VAL A 32 16.272 -3.004 7.430 1.00 0.00 H ATOM 508 H VAL A 32 19.756 -5.206 8.238 1.00 0.00 H ATOM 509 N LEU A 33 17.422 -8.035 9.378 1.00 21.97 N ATOM 510 CA LEU A 33 17.469 -9.427 9.044 1.00 23.33 C ATOM 511 C LEU A 33 16.077 -9.945 8.868 1.00 24.97 C ATOM 512 O LEU A 33 15.113 -9.430 9.490 1.00 25.11 O ATOM 513 CB LEU A 33 18.147 -10.238 10.157 1.00 23.28 C ATOM 514 CG LEU A 33 19.590 -9.816 10.374 1.00 23.37 C ATOM 515 CD1 LEU A 33 20.196 -10.781 11.326 1.00 25.27 C ATOM 516 CD2 LEU A 33 20.330 -9.795 9.024 1.00 22.19 C ATOM 517 HA LEU A 33 18.041 -9.534 8.122 1.00 0.00 H ATOM 518 HB2 LEU A 33 17.594 -10.092 11.085 1.00 0.00 H ATOM 519 HB3 LEU A 33 18.126 -11.293 9.886 1.00 0.00 H ATOM 520 HG LEU A 33 19.657 -8.811 10.790 1.00 0.00 H ATOM 521 HD21 LEU A 33 20.306 -10.791 8.582 1.00 0.00 H ATOM 522 HD22 LEU A 33 19.842 -9.087 8.354 1.00 0.00 H ATOM 523 HD23 LEU A 33 21.365 -9.492 9.183 1.00 0.00 H ATOM 524 HD11 LEU A 33 19.645 -10.757 12.266 1.00 0.00 H ATOM 525 HD12 LEU A 33 20.151 -11.784 10.903 1.00 0.00 H ATOM 526 HD13 LEU A 33 21.236 -10.508 11.506 1.00 0.00 H ATOM 527 H LEU A 33 17.005 -7.741 10.284 1.00 0.00 H ATOM 528 N GLU A 34 15.972 -10.967 8.019 1.00 27.13 N ATOM 529 CA GLU A 34 14.702 -11.682 7.842 1.00 31.28 C ATOM 530 C GLU A 34 14.282 -12.275 9.180 1.00 34.13 C ATOM 531 O GLU A 34 15.087 -12.401 10.137 1.00 32.57 O ATOM 532 CB GLU A 34 14.824 -12.774 6.755 1.00 31.01 C ATOM 533 CG GLU A 34 15.246 -12.230 5.384 1.00 32.25 C ATOM 534 CD GLU A 34 15.634 -13.314 4.374 1.00 34.10 C ATOM 535 OE1 GLU A 34 16.421 -14.233 4.722 1.00 36.73 O ATOM 536 OE2 GLU A 34 15.162 -13.237 3.211 1.00 38.24 O ATOM 537 HA GLU A 34 13.936 -10.984 7.503 1.00 0.00 H ATOM 538 HB2 GLU A 34 15.566 -13.503 7.080 1.00 0.00 H ATOM 539 HB3 GLU A 34 13.857 -13.265 6.649 1.00 0.00 H ATOM 540 HG2 GLU A 34 14.414 -11.659 4.971 1.00 0.00 H ATOM 541 HG3 GLU A 34 16.103 -11.571 5.526 1.00 0.00 H ATOM 542 H GLU A 34 16.805 -11.264 7.472 1.00 0.00 H ATOM 543 N GLU A 35 12.998 -12.609 9.265 1.00 39.01 N ATOM 544 CA GLU A 35 12.453 -13.263 10.439 1.00 43.86 C ATOM 545 C GLU A 35 13.337 -14.396 10.932 1.00 45.70 C ATOM 546 O GLU A 35 13.677 -15.343 10.203 1.00 47.18 O ATOM 547 CB GLU A 35 11.035 -13.788 10.180 1.00 44.37 C ATOM 548 CG GLU A 35 10.413 -14.435 11.409 1.00 47.42 C ATOM 549 CD GLU A 35 10.417 -13.503 12.606 1.00 50.10 C ATOM 550 OE1 GLU A 35 10.097 -12.302 12.437 1.00 50.84 O ATOM 551 OE2 GLU A 35 10.750 -13.979 13.711 1.00 51.90 O ATOM 552 HA GLU A 35 12.413 -12.503 11.219 1.00 0.00 H ATOM 553 HB2 GLU A 35 10.406 -12.954 9.869 1.00 0.00 H ATOM 554 HB3 GLU A 35 11.078 -14.528 9.380 1.00 0.00 H ATOM 555 HG2 GLU A 35 9.383 -14.709 11.180 1.00 0.00 H ATOM 556 HG3 GLU A 35 10.979 -15.332 11.659 1.00 0.00 H ATOM 557 H GLU A 35 12.366 -12.395 8.467 1.00 0.00 H ATOM 558 N MET A 36 13.714 -14.276 12.187 1.00 46.73 N ATOM 559 CA MET A 36 14.587 -15.233 12.783 1.00 47.36 C ATOM 560 C MET A 36 14.363 -15.184 14.265 1.00 49.26 C ATOM 561 O MET A 36 14.045 -14.125 14.837 1.00 49.35 O ATOM 562 CB MET A 36 16.040 -14.923 12.453 1.00 47.12 C ATOM 563 CG MET A 36 16.553 -13.668 13.122 1.00 45.72 C ATOM 564 SD MET A 36 18.317 -13.658 13.003 1.00 42.74 S ATOM 565 CE MET A 36 18.756 -15.212 13.840 1.00 43.32 C ATOM 566 HA MET A 36 14.375 -16.229 12.395 1.00 0.00 H ATOM 567 HB2 MET A 36 16.655 -15.763 12.776 1.00 0.00 H ATOM 568 HB3 MET A 36 16.131 -14.801 11.374 1.00 0.00 H ATOM 569 HG2 MET A 36 16.254 -13.660 14.170 1.00 0.00 H ATOM 570 HG3 MET A 36 16.144 -12.790 12.622 1.00 0.00 H ATOM 571 HE1 MET A 36 18.395 -15.184 14.868 1.00 0.00 H ATOM 572 HE2 MET A 36 18.295 -16.049 13.315 1.00 0.00 H ATOM 573 HE3 MET A 36 19.839 -15.331 13.837 1.00 0.00 H ATOM 574 H MET A 36 13.371 -13.473 12.751 1.00 0.00 H ATOM 575 N ALA A 37 14.516 -16.355 14.871 1.00 50.96 N ATOM 576 CA ALA A 37 14.464 -16.486 16.302 1.00 52.20 C ATOM 577 C ALA A 37 15.690 -15.833 16.911 1.00 52.10 C ATOM 578 O ALA A 37 16.811 -16.364 16.813 1.00 52.70 O ATOM 579 CB ALA A 37 14.392 -17.953 16.699 1.00 52.41 C ATOM 580 HA ALA A 37 13.569 -15.989 16.676 1.00 0.00 H ATOM 581 HB1 ALA A 37 13.496 -18.401 16.268 1.00 0.00 H ATOM 582 HB2 ALA A 37 15.275 -18.473 16.327 1.00 0.00 H ATOM 583 HB3 ALA A 37 14.353 -18.033 17.785 1.00 0.00 H ATOM 584 H ALA A 37 14.679 -17.204 14.293 1.00 0.00 H ATOM 585 N LEU A 38 15.485 -14.664 17.503 1.00 51.71 N ATOM 586 CA LEU A 38 16.505 -14.077 18.350 1.00 51.41 C ATOM 587 C LEU A 38 16.018 -14.207 19.771 1.00 53.05 C ATOM 588 O LEU A 38 14.824 -14.136 20.022 1.00 53.06 O ATOM 589 CB LEU A 38 16.782 -12.605 18.016 1.00 50.71 C ATOM 590 CG LEU A 38 17.738 -12.335 16.851 1.00 46.95 C ATOM 591 CD1 LEU A 38 17.959 -10.849 16.692 1.00 42.74 C ATOM 592 CD2 LEU A 38 19.059 -13.055 17.028 1.00 44.06 C ATOM 593 HA LEU A 38 17.449 -14.599 18.193 1.00 0.00 H ATOM 594 HB2 LEU A 38 15.828 -12.135 17.777 1.00 0.00 H ATOM 595 HB3 LEU A 38 17.204 -12.137 18.906 1.00 0.00 H ATOM 596 HG LEU A 38 17.276 -12.725 15.944 1.00 0.00 H ATOM 597 HD21 LEU A 38 19.536 -12.716 17.948 1.00 0.00 H ATOM 598 HD22 LEU A 38 18.881 -14.129 17.084 1.00 0.00 H ATOM 599 HD23 LEU A 38 19.707 -12.836 16.179 1.00 0.00 H ATOM 600 HD11 LEU A 38 17.005 -10.360 16.493 1.00 0.00 H ATOM 601 HD12 LEU A 38 18.390 -10.447 17.609 1.00 0.00 H ATOM 602 HD13 LEU A 38 18.641 -10.671 15.860 1.00 0.00 H ATOM 603 H LEU A 38 14.585 -14.164 17.358 1.00 0.00 H ATOM 604 N PRO A 39 16.939 -14.425 20.700 1.00 54.28 N ATOM 605 CA PRO A 39 16.567 -14.451 22.097 1.00 56.12 C ATOM 606 C PRO A 39 16.439 -13.005 22.588 1.00 57.49 C ATOM 607 O PRO A 39 16.996 -12.096 21.955 1.00 57.30 O ATOM 608 CB PRO A 39 17.748 -15.168 22.757 1.00 55.51 C ATOM 609 CG PRO A 39 18.924 -14.862 21.894 1.00 55.04 C ATOM 610 CD PRO A 39 18.385 -14.660 20.502 1.00 54.17 C ATOM 611 HA PRO A 39 15.620 -14.945 22.312 1.00 0.00 H ATOM 612 HD3 PRO A 39 18.855 -13.799 20.027 1.00 0.00 H ATOM 613 HD2 PRO A 39 18.552 -15.547 19.891 1.00 0.00 H ATOM 614 HG3 PRO A 39 19.630 -15.692 21.909 1.00 0.00 H ATOM 615 HG2 PRO A 39 19.422 -13.957 22.241 1.00 0.00 H ATOM 616 HB2 PRO A 39 17.907 -14.792 23.768 1.00 0.00 H ATOM 617 HB3 PRO A 39 17.570 -16.243 22.794 1.00 0.00 H ATOM 618 N GLY A 40 15.683 -12.815 23.675 1.00 59.63 N ATOM 619 CA GLY A 40 15.666 -11.552 24.415 1.00 61.11 C ATOM 620 C GLY A 40 14.548 -10.579 24.088 1.00 61.78 C ATOM 621 O GLY A 40 13.653 -10.877 23.289 1.00 62.04 O ATOM 622 HA3 GLY A 40 16.611 -11.045 24.222 1.00 0.00 H ATOM 623 HA2 GLY A 40 15.594 -11.793 25.476 1.00 0.00 H ATOM 624 H GLY A 40 15.083 -13.596 24.008 1.00 0.00 H ATOM 625 N LYS A 41 14.628 -9.406 24.720 1.00 61.72 N ATOM 626 CA LYS A 41 13.645 -8.329 24.586 1.00 60.84 C ATOM 627 C LYS A 41 13.826 -7.610 23.265 1.00 59.81 C ATOM 628 O LYS A 41 14.871 -7.739 22.634 1.00 59.20 O ATOM 629 CB LYS A 41 13.827 -7.306 25.710 1.00 61.38 C ATOM 630 CG LYS A 41 15.141 -6.503 25.644 1.00 61.37 C ATOM 631 CD LYS A 41 16.002 -6.771 27.097 1.00 57.97 C ATOM 632 CE LYS A 41 17.065 -5.724 27.375 1.00 56.90 C ATOM 633 NZ LYS A 41 18.133 -6.241 28.271 1.00 58.93 N ATOM 634 HA LYS A 41 12.651 -8.774 24.636 1.00 0.00 H ATOM 635 HB2 LYS A 41 12.996 -6.602 25.666 1.00 0.00 H ATOM 636 HB3 LYS A 41 13.801 -7.838 26.661 1.00 0.00 H ATOM 637 HG2 LYS A 41 15.736 -6.838 24.794 1.00 0.00 H ATOM 638 HG3 LYS A 41 14.920 -5.441 25.536 1.00 0.00 H ATOM 639 HD2 LYS A 41 15.292 -6.770 27.924 1.00 0.00 H ATOM 640 HD3 LYS A 41 16.486 -7.746 27.037 1.00 0.00 H ATOM 641 HE2 LYS A 41 16.595 -4.862 27.848 1.00 0.00 H ATOM 642 HE3 LYS A 41 17.515 -5.419 26.430 1.00 0.00 H ATOM 643 HZ1 LYS A 41 17.714 -6.529 29.178 1.00 0.00 H ATOM 644 HZ2 LYS A 41 18.592 -7.061 27.825 1.00 0.00 H ATOM 645 HZ3 LYS A 41 18.838 -5.494 28.435 1.00 0.00 H ATOM 646 H LYS A 41 15.441 -9.247 25.348 1.00 0.00 H ATOM 647 N TRP A 42 12.822 -6.825 22.882 1.00 58.48 N ATOM 648 CA TRP A 42 12.893 -5.992 21.679 1.00 57.27 C ATOM 649 C TRP A 42 11.995 -4.773 21.812 1.00 56.63 C ATOM 650 O TRP A 42 11.205 -4.676 22.749 1.00 56.53 O ATOM 651 CB TRP A 42 12.537 -6.798 20.430 1.00 58.21 C ATOM 652 CG TRP A 42 11.218 -7.513 20.481 1.00 58.42 C ATOM 653 CD1 TRP A 42 10.987 -8.772 20.961 1.00 59.46 C ATOM 654 CD2 TRP A 42 9.951 -7.028 20.007 1.00 58.43 C ATOM 655 NE1 TRP A 42 9.658 -9.098 20.821 1.00 58.89 N ATOM 656 CE2 TRP A 42 8.996 -8.046 20.243 1.00 59.36 C ATOM 657 CE3 TRP A 42 9.519 -5.829 19.418 1.00 58.90 C ATOM 658 CZ2 TRP A 42 7.641 -7.904 19.909 1.00 58.57 C ATOM 659 CZ3 TRP A 42 8.168 -5.692 19.080 1.00 58.22 C ATOM 660 CH2 TRP A 42 7.250 -6.726 19.329 1.00 58.05 C ATOM 661 HA TRP A 42 13.921 -5.646 21.571 1.00 0.00 H ATOM 662 HB2 TRP A 42 12.517 -6.114 19.582 1.00 0.00 H ATOM 663 HB3 TRP A 42 13.318 -7.543 20.276 1.00 0.00 H ATOM 664 HE1 TRP A 42 9.225 -9.999 21.108 1.00 0.00 H ATOM 665 HD1 TRP A 42 11.747 -9.424 21.393 1.00 0.00 H ATOM 666 HZ2 TRP A 42 6.925 -8.702 20.104 1.00 0.00 H ATOM 667 HH2 TRP A 42 6.204 -6.588 19.055 1.00 0.00 H ATOM 668 HZ3 TRP A 42 7.822 -4.768 18.616 1.00 0.00 H ATOM 669 HE3 TRP A 42 10.223 -5.019 19.227 1.00 0.00 H ATOM 670 H TRP A 42 11.956 -6.802 23.457 1.00 0.00 H ATOM 671 N LYS A 43 12.144 -3.826 20.894 1.00 54.88 N ATOM 672 CA LYS A 43 11.258 -2.680 20.813 1.00 53.29 C ATOM 673 C LYS A 43 10.761 -2.573 19.365 1.00 51.89 C ATOM 674 O LYS A 43 11.499 -2.877 18.428 1.00 51.13 O ATOM 675 CB LYS A 43 11.974 -1.395 21.244 1.00 53.90 C ATOM 676 CG LYS A 43 12.283 -1.277 22.756 1.00 54.68 C ATOM 677 CD LYS A 43 11.239 -0.462 23.518 1.00 55.08 C ATOM 678 CE LYS A 43 11.849 -1.053 25.128 1.00 59.04 C ATOM 679 NZ LYS A 43 11.313 -0.031 26.072 1.00 65.28 N ATOM 680 HA LYS A 43 10.415 -2.812 21.491 1.00 0.00 H ATOM 681 HB2 LYS A 43 12.919 -1.339 20.703 1.00 0.00 H ATOM 682 HB3 LYS A 43 11.345 -0.550 20.963 1.00 0.00 H ATOM 683 HG2 LYS A 43 12.320 -2.279 23.182 1.00 0.00 H ATOM 684 HG3 LYS A 43 13.254 -0.796 22.876 1.00 0.00 H ATOM 685 HD2 LYS A 43 11.340 0.615 23.381 1.00 0.00 H ATOM 686 HD3 LYS A 43 10.212 -0.759 23.304 1.00 0.00 H ATOM 687 HE2 LYS A 43 12.938 -1.078 25.152 1.00 0.00 H ATOM 688 HE3 LYS A 43 11.459 -2.045 25.357 1.00 0.00 H ATOM 689 HZ1 LYS A 43 11.688 0.905 25.817 1.00 0.00 H ATOM 690 HZ2 LYS A 43 10.275 -0.018 26.014 1.00 0.00 H ATOM 691 HZ3 LYS A 43 11.604 -0.270 27.041 1.00 0.00 H ATOM 692 H LYS A 43 12.923 -3.908 20.209 1.00 0.00 H ATOM 693 N PRO A 44 9.506 -2.173 19.176 1.00 50.64 N ATOM 694 CA PRO A 44 8.962 -2.024 17.833 1.00 48.74 C ATOM 695 C PRO A 44 9.555 -0.796 17.179 1.00 46.83 C ATOM 696 O PRO A 44 9.699 0.247 17.808 1.00 46.59 O ATOM 697 CB PRO A 44 7.458 -1.871 18.079 1.00 48.82 C ATOM 698 CG PRO A 44 7.375 -1.277 19.423 1.00 49.33 C ATOM 699 CD PRO A 44 8.514 -1.834 20.215 1.00 50.44 C ATOM 700 HA PRO A 44 9.184 -2.856 17.165 1.00 0.00 H ATOM 701 HD3 PRO A 44 8.910 -1.092 20.908 1.00 0.00 H ATOM 702 HD2 PRO A 44 8.209 -2.721 20.770 1.00 0.00 H ATOM 703 HG3 PRO A 44 6.427 -1.541 19.892 1.00 0.00 H ATOM 704 HG2 PRO A 44 7.457 -0.192 19.359 1.00 0.00 H ATOM 705 HB2 PRO A 44 7.009 -1.212 17.336 1.00 0.00 H ATOM 706 HB3 PRO A 44 6.960 -2.840 18.052 1.00 0.00 H ATOM 707 N ARG A 45 9.945 -0.942 15.921 1.00 44.40 N ATOM 708 CA ARG A 45 10.600 0.121 15.197 1.00 41.98 C ATOM 709 C ARG A 45 10.065 0.059 13.767 1.00 40.43 C ATOM 710 O ARG A 45 9.447 -0.922 13.370 1.00 39.42 O ATOM 711 CB ARG A 45 12.120 -0.119 15.227 1.00 42.04 C ATOM 712 CG ARG A 45 13.020 1.107 15.105 1.00 44.04 C ATOM 713 CD ARG A 45 14.076 0.957 14.009 1.00 44.98 C ATOM 714 NE ARG A 45 15.328 1.683 14.263 1.00 46.57 N ATOM 715 CZ ARG A 45 15.568 2.914 13.839 1.00 45.60 C ATOM 716 NH1 ARG A 45 14.633 3.574 13.158 1.00 46.31 N ATOM 717 NH2 ARG A 45 16.733 3.496 14.107 1.00 47.70 N ATOM 718 HA ARG A 45 10.407 1.101 15.633 1.00 0.00 H ATOM 719 HB2 ARG A 45 12.357 -0.608 16.172 1.00 0.00 H ATOM 720 HB3 ARG A 45 12.363 -0.789 14.402 1.00 0.00 H ATOM 721 HG2 ARG A 45 12.400 1.974 14.876 1.00 0.00 H ATOM 722 HG3 ARG A 45 13.526 1.265 16.058 1.00 0.00 H ATOM 723 HD2 ARG A 45 13.652 1.326 13.075 1.00 0.00 H ATOM 724 HD3 ARG A 45 14.312 -0.102 13.906 1.00 0.00 H ATOM 725 HE ARG A 45 16.070 1.201 14.809 1.00 0.00 H ATOM 726 HH12 ARG A 45 14.819 4.541 12.824 1.00 0.00 H ATOM 727 HH11 ARG A 45 13.717 3.122 12.961 1.00 0.00 H ATOM 728 HH22 ARG A 45 16.920 4.463 13.773 1.00 0.00 H ATOM 729 HH21 ARG A 45 17.457 2.984 14.650 1.00 0.00 H ATOM 730 H ARG A 45 9.774 -1.849 15.441 1.00 0.00 H ATOM 731 N MET A 46 10.268 1.119 13.007 1.00 39.14 N ATOM 732 CA MET A 46 9.877 1.112 11.608 1.00 39.32 C ATOM 733 C MET A 46 11.068 1.559 10.782 1.00 36.61 C ATOM 734 O MET A 46 11.822 2.430 11.192 1.00 37.05 O ATOM 735 CB MET A 46 8.644 1.990 11.373 1.00 39.87 C ATOM 736 CG MET A 46 7.347 1.444 12.021 1.00 42.25 C ATOM 737 SD MET A 46 5.794 1.810 11.161 1.00 44.57 S ATOM 738 CE MET A 46 4.632 1.600 12.508 1.00 42.28 C ATOM 739 HA MET A 46 9.589 0.106 11.302 1.00 0.00 H ATOM 740 HB2 MET A 46 8.844 2.979 11.786 1.00 0.00 H ATOM 741 HB3 MET A 46 8.482 2.073 10.298 1.00 0.00 H ATOM 742 HG2 MET A 46 7.276 1.863 13.025 1.00 0.00 H ATOM 743 HG3 MET A 46 7.441 0.360 12.087 1.00 0.00 H ATOM 744 HE1 MET A 46 4.698 0.580 12.888 1.00 0.00 H ATOM 745 HE2 MET A 46 4.872 2.302 13.306 1.00 0.00 H ATOM 746 HE3 MET A 46 3.621 1.790 12.147 1.00 0.00 H ATOM 747 H MET A 46 10.712 1.967 13.414 1.00 0.00 H ATOM 748 N ILE A 47 11.267 0.937 9.634 1.00 34.04 N ATOM 749 CA ILE A 47 12.323 1.388 8.747 1.00 32.14 C ATOM 750 C ILE A 47 11.689 1.730 7.433 1.00 31.15 C ATOM 751 O ILE A 47 10.702 1.121 7.035 1.00 30.75 O ATOM 752 CB ILE A 47 13.434 0.351 8.535 1.00 32.40 C ATOM 753 CG1 ILE A 47 12.842 -1.045 8.348 1.00 32.46 C ATOM 754 CG2 ILE A 47 14.475 0.451 9.648 1.00 32.26 C ATOM 755 CD1 ILE A 47 13.784 -2.001 7.706 1.00 33.40 C ATOM 756 HA ILE A 47 12.808 2.250 9.206 1.00 0.00 H ATOM 757 HB ILE A 47 13.968 0.565 7.609 1.00 0.00 H ATOM 758 HG12 ILE A 47 12.563 -1.437 9.326 1.00 0.00 H ATOM 759 HG13 ILE A 47 11.952 -0.963 7.724 1.00 0.00 H ATOM 760 HD11 ILE A 47 14.064 -1.627 6.721 1.00 0.00 H ATOM 761 HD12 ILE A 47 14.676 -2.101 8.325 1.00 0.00 H ATOM 762 HD13 ILE A 47 13.300 -2.972 7.603 1.00 0.00 H ATOM 763 HG21 ILE A 47 14.914 1.449 9.644 1.00 0.00 H ATOM 764 HG22 ILE A 47 13.996 0.267 10.610 1.00 0.00 H ATOM 765 HG23 ILE A 47 15.255 -0.292 9.482 1.00 0.00 H ATOM 766 H ILE A 47 10.670 0.128 9.367 1.00 0.00 H ATOM 767 N GLY A 48 12.271 2.686 6.739 1.00 30.15 N ATOM 768 CA GLY A 48 11.726 3.073 5.467 1.00 30.72 C ATOM 769 C GLY A 48 12.677 2.695 4.369 1.00 31.35 C ATOM 770 O GLY A 48 13.886 2.752 4.527 1.00 29.79 O ATOM 771 HA3 GLY A 48 11.568 4.151 5.454 1.00 0.00 H ATOM 772 HA2 GLY A 48 10.774 2.566 5.312 1.00 0.00 H ATOM 773 H GLY A 48 13.120 3.158 7.109 1.00 0.00 H ATOM 774 N GLY A 49 12.103 2.301 3.245 1.00 32.83 N ATOM 775 CA GLY A 49 12.891 1.936 2.108 1.00 34.62 C ATOM 776 C GLY A 49 12.313 2.619 0.911 1.00 36.62 C ATOM 777 O GLY A 49 11.529 3.594 1.016 1.00 35.87 O ATOM 778 HA3 GLY A 49 12.862 0.855 1.968 1.00 0.00 H ATOM 779 HA2 GLY A 49 13.923 2.255 2.254 1.00 0.00 H ATOM 780 H GLY A 49 11.066 2.256 3.187 1.00 0.00 H ATOM 781 N ILE A 50 12.716 2.102 -0.239 1.00 37.66 N ATOM 782 CA ILE A 50 12.068 2.407 -1.494 1.00 40.18 C ATOM 783 C ILE A 50 10.636 1.879 -1.381 1.00 40.87 C ATOM 784 O ILE A 50 10.403 0.727 -0.962 1.00 41.72 O ATOM 785 CB ILE A 50 12.879 1.779 -2.683 1.00 39.45 C ATOM 786 CG1 ILE A 50 13.626 2.868 -3.458 1.00 40.25 C ATOM 787 CG2 ILE A 50 11.969 1.123 -3.688 1.00 41.99 C ATOM 788 CD1 ILE A 50 14.445 3.794 -2.604 1.00 40.65 C ATOM 789 HA ILE A 50 12.035 3.477 -1.701 1.00 0.00 H ATOM 790 HB ILE A 50 13.559 1.053 -2.236 1.00 0.00 H ATOM 791 HG12 ILE A 50 14.293 2.382 -4.170 1.00 0.00 H ATOM 792 HG13 ILE A 50 12.892 3.465 -3.999 1.00 0.00 H ATOM 793 HD11 ILE A 50 13.793 4.302 -1.893 1.00 0.00 H ATOM 794 HD12 ILE A 50 15.196 3.218 -2.063 1.00 0.00 H ATOM 795 HD13 ILE A 50 14.937 4.531 -3.238 1.00 0.00 H ATOM 796 HG21 ILE A 50 11.402 0.330 -3.200 1.00 0.00 H ATOM 797 HG22 ILE A 50 11.282 1.866 -4.093 1.00 0.00 H ATOM 798 HG23 ILE A 50 12.567 0.700 -4.496 1.00 0.00 H ATOM 799 H ILE A 50 13.528 1.453 -0.239 1.00 0.00 H ATOM 800 N GLY A 51 9.692 2.763 -1.671 1.00 41.88 N ATOM 801 CA GLY A 51 8.270 2.436 -1.702 1.00 42.20 C ATOM 802 C GLY A 51 7.574 2.437 -0.363 1.00 42.05 C ATOM 803 O GLY A 51 6.633 3.214 -0.136 1.00 43.64 O ATOM 804 HA3 GLY A 51 8.163 1.442 -2.136 1.00 0.00 H ATOM 805 HA2 GLY A 51 7.771 3.165 -2.341 1.00 0.00 H ATOM 806 H GLY A 51 9.979 3.739 -1.887 1.00 0.00 H ATOM 807 N GLY A 52 8.034 1.589 0.540 1.00 41.00 N ATOM 808 CA GLY A 52 7.305 1.394 1.772 1.00 39.35 C ATOM 809 C GLY A 52 8.072 1.544 3.069 1.00 38.43 C ATOM 810 O GLY A 52 9.252 1.938 3.098 1.00 37.73 O ATOM 811 HA3 GLY A 52 6.892 0.385 1.751 1.00 0.00 H ATOM 812 HA2 GLY A 52 6.491 2.118 1.788 1.00 0.00 H ATOM 813 H GLY A 52 8.915 1.065 0.365 1.00 0.00 H ATOM 814 N PHE A 53 7.375 1.222 4.173 1.00 38.16 N ATOM 815 CA PHE A 53 7.858 1.322 5.583 1.00 37.85 C ATOM 816 C PHE A 53 7.440 0.045 6.365 1.00 38.19 C ATOM 817 O PHE A 53 6.235 -0.164 6.553 1.00 38.25 O ATOM 818 CB PHE A 53 7.208 2.534 6.280 1.00 37.34 C ATOM 819 CG PHE A 53 8.096 3.774 6.399 1.00 37.08 C ATOM 820 CD1 PHE A 53 7.983 4.823 5.488 1.00 36.02 C ATOM 821 CD2 PHE A 53 8.988 3.916 7.464 1.00 37.03 C ATOM 822 CE1 PHE A 53 8.779 5.980 5.602 1.00 34.65 C ATOM 823 CE2 PHE A 53 9.800 5.063 7.586 1.00 35.96 C ATOM 824 CZ PHE A 53 9.694 6.094 6.650 1.00 36.31 C ATOM 825 HA PHE A 53 8.942 1.431 5.571 1.00 0.00 H ATOM 826 HB2 PHE A 53 6.318 2.810 5.715 1.00 0.00 H ATOM 827 HB3 PHE A 53 6.919 2.229 7.286 1.00 0.00 H ATOM 828 HD2 PHE A 53 9.058 3.128 8.213 1.00 0.00 H ATOM 829 HE2 PHE A 53 10.509 5.144 8.410 1.00 0.00 H ATOM 830 HZ PHE A 53 10.321 6.981 6.737 1.00 0.00 H ATOM 831 HE1 PHE A 53 8.680 6.785 4.873 1.00 0.00 H ATOM 832 HD1 PHE A 53 7.265 4.747 4.672 1.00 0.00 H ATOM 833 H PHE A 53 6.407 0.870 4.032 1.00 0.00 H ATOM 834 N VAL A 54 8.392 -0.786 6.827 1.00 38.33 N ATOM 835 CA VAL A 54 8.049 -2.034 7.486 1.00 38.84 C ATOM 836 C VAL A 54 8.290 -1.893 8.962 1.00 38.70 C ATOM 837 O VAL A 54 9.248 -1.248 9.378 1.00 37.52 O ATOM 838 CB VAL A 54 8.812 -3.276 6.965 1.00 39.14 C ATOM 839 CG1 VAL A 54 8.330 -3.677 5.568 1.00 40.62 C ATOM 840 CG2 VAL A 54 10.319 -3.090 7.014 1.00 38.82 C ATOM 841 HA VAL A 54 6.998 -2.212 7.259 1.00 0.00 H ATOM 842 HB VAL A 54 8.583 -4.100 7.641 1.00 0.00 H ATOM 843 HG11 VAL A 54 7.266 -3.912 5.606 1.00 0.00 H ATOM 844 HG12 VAL A 54 8.496 -2.851 4.877 1.00 0.00 H ATOM 845 HG13 VAL A 54 8.885 -4.552 5.231 1.00 0.00 H ATOM 846 HG21 VAL A 54 10.599 -2.237 6.395 1.00 0.00 H ATOM 847 HG22 VAL A 54 10.628 -2.911 8.044 1.00 0.00 H ATOM 848 HG23 VAL A 54 10.807 -3.989 6.638 1.00 0.00 H ATOM 849 H VAL A 54 9.393 -0.530 6.710 1.00 0.00 H ATOM 850 N LYS A 55 7.386 -2.486 9.737 1.00 39.21 N ATOM 851 CA LYS A 55 7.591 -2.638 11.154 1.00 39.62 C ATOM 852 C LYS A 55 8.625 -3.717 11.368 1.00 38.93 C ATOM 853 O LYS A 55 8.629 -4.758 10.698 1.00 38.45 O ATOM 854 CB LYS A 55 6.293 -2.998 11.880 1.00 40.30 C ATOM 855 CG LYS A 55 5.126 -2.043 11.618 1.00 41.65 C ATOM 856 CD LYS A 55 3.820 -2.605 12.206 1.00 42.00 C ATOM 857 CE LYS A 55 2.654 -1.665 11.938 1.00 44.07 C ATOM 858 NZ LYS A 55 2.400 -1.460 10.465 1.00 48.80 N ATOM 859 HA LYS A 55 7.934 -1.690 11.567 1.00 0.00 H ATOM 860 HB2 LYS A 55 5.992 -3.997 11.563 1.00 0.00 H ATOM 861 HB3 LYS A 55 6.493 -3.003 12.951 1.00 0.00 H ATOM 862 HG2 LYS A 55 5.341 -1.080 12.080 1.00 0.00 H ATOM 863 HG3 LYS A 55 5.007 -1.910 10.543 1.00 0.00 H ATOM 864 HD2 LYS A 55 3.611 -3.573 11.750 1.00 0.00 H ATOM 865 HD3 LYS A 55 3.938 -2.730 13.282 1.00 0.00 H ATOM 866 HE2 LYS A 55 2.873 -0.699 12.393 1.00 0.00 H ATOM 867 HE3 LYS A 55 1.756 -2.084 12.392 1.00 0.00 H ATOM 868 HZ1 LYS A 55 3.248 -1.052 10.022 1.00 0.00 H ATOM 869 HZ2 LYS A 55 2.181 -2.375 10.022 1.00 0.00 H ATOM 870 HZ3 LYS A 55 1.596 -0.812 10.340 1.00 0.00 H ATOM 871 H LYS A 55 6.510 -2.849 9.309 1.00 0.00 H ATOM 872 N VAL A 56 9.528 -3.444 12.295 1.00 37.93 N ATOM 873 CA VAL A 56 10.568 -4.378 12.622 1.00 37.49 C ATOM 874 C VAL A 56 10.707 -4.448 14.120 1.00 38.67 C ATOM 875 O VAL A 56 10.198 -3.596 14.841 1.00 38.35 O ATOM 876 CB VAL A 56 11.937 -3.979 11.982 1.00 37.00 C ATOM 877 CG1 VAL A 56 11.853 -4.003 10.457 1.00 35.94 C ATOM 878 CG2 VAL A 56 12.412 -2.631 12.477 1.00 35.73 C ATOM 879 HA VAL A 56 10.292 -5.352 12.217 1.00 0.00 H ATOM 880 HB VAL A 56 12.673 -4.719 12.294 1.00 0.00 H ATOM 881 HG11 VAL A 56 11.589 -5.007 10.125 1.00 0.00 H ATOM 882 HG12 VAL A 56 11.091 -3.297 10.125 1.00 0.00 H ATOM 883 HG13 VAL A 56 12.819 -3.722 10.037 1.00 0.00 H ATOM 884 HG21 VAL A 56 11.676 -1.870 12.218 1.00 0.00 H ATOM 885 HG22 VAL A 56 12.535 -2.666 13.559 1.00 0.00 H ATOM 886 HG23 VAL A 56 13.366 -2.389 12.009 1.00 0.00 H ATOM 887 H VAL A 56 9.484 -2.534 12.797 1.00 0.00 H ATOM 888 N ARG A 57 11.392 -5.485 14.576 1.00 38.95 N ATOM 889 CA ARG A 57 11.708 -5.639 15.979 1.00 39.75 C ATOM 890 C ARG A 57 13.148 -5.200 16.158 1.00 38.65 C ATOM 891 O ARG A 57 14.034 -5.689 15.474 1.00 37.50 O ATOM 892 CB ARG A 57 11.506 -7.093 16.407 1.00 39.28 C ATOM 893 CG ARG A 57 10.088 -7.620 16.095 1.00 41.04 C ATOM 894 CD ARG A 57 9.662 -8.911 16.828 1.00 41.60 C ATOM 895 NE ARG A 57 10.634 -9.999 16.725 1.00 45.30 N ATOM 896 CZ ARG A 57 10.732 -10.847 15.707 1.00 45.99 C ATOM 897 NH1 ARG A 57 9.919 -10.759 14.660 1.00 47.15 N ATOM 898 NH2 ARG A 57 11.660 -11.786 15.734 1.00 46.51 N ATOM 899 HA ARG A 57 11.053 -5.032 16.604 1.00 0.00 H ATOM 900 HB2 ARG A 57 12.232 -7.714 15.882 1.00 0.00 H ATOM 901 HB3 ARG A 57 11.676 -7.167 17.481 1.00 0.00 H ATOM 902 HG2 ARG A 57 9.377 -6.837 16.359 1.00 0.00 H ATOM 903 HG3 ARG A 57 10.033 -7.812 15.024 1.00 0.00 H ATOM 904 HD2 ARG A 57 8.718 -9.252 16.403 1.00 0.00 H ATOM 905 HD3 ARG A 57 9.520 -8.676 17.883 1.00 0.00 H ATOM 906 HE ARG A 57 11.303 -10.119 17.513 1.00 0.00 H ATOM 907 HH12 ARG A 57 10.011 -11.432 13.872 1.00 0.00 H ATOM 908 HH11 ARG A 57 9.191 -10.017 14.628 1.00 0.00 H ATOM 909 HH22 ARG A 57 11.746 -12.455 14.943 1.00 0.00 H ATOM 910 HH21 ARG A 57 12.305 -11.856 16.547 1.00 0.00 H ATOM 911 H ARG A 57 11.713 -6.211 13.905 1.00 0.00 H ATOM 912 N GLN A 58 13.369 -4.248 17.050 1.00 38.58 N ATOM 913 CA GLN A 58 14.705 -3.800 17.339 1.00 38.45 C ATOM 914 C GLN A 58 15.302 -4.543 18.520 1.00 38.85 C ATOM 915 O GLN A 58 14.780 -4.498 19.648 1.00 39.24 O ATOM 916 CB GLN A 58 14.766 -2.297 17.571 1.00 39.02 C ATOM 917 CG GLN A 58 16.204 -1.859 17.745 1.00 40.07 C ATOM 918 CD GLN A 58 16.380 -0.422 18.098 1.00 40.26 C ATOM 919 OE1 GLN A 58 17.176 -0.104 18.990 1.00 43.80 O ATOM 920 NE2 GLN A 58 15.667 0.462 17.406 1.00 43.40 N ATOM 921 HA GLN A 58 15.304 -4.025 16.457 1.00 0.00 H ATOM 922 HB2 GLN A 58 14.332 -1.781 16.714 1.00 0.00 H ATOM 923 HB3 GLN A 58 14.201 -2.047 18.469 1.00 0.00 H ATOM 924 HG2 GLN A 58 16.649 -2.460 18.538 1.00 0.00 H ATOM 925 HG3 GLN A 58 16.732 -2.046 16.810 1.00 0.00 H ATOM 926 HE22 GLN A 58 15.012 0.137 16.666 1.00 0.00 H ATOM 927 HE21 GLN A 58 15.764 1.478 17.605 1.00 0.00 H ATOM 928 H GLN A 58 12.565 -3.817 17.550 1.00 0.00 H ATOM 929 N TYR A 59 16.391 -5.246 18.247 1.00 37.89 N ATOM 930 CA TYR A 59 17.171 -5.902 19.274 1.00 38.51 C ATOM 931 C TYR A 59 18.480 -5.152 19.449 1.00 37.99 C ATOM 932 O TYR A 59 19.191 -4.918 18.481 1.00 36.21 O ATOM 933 CB TYR A 59 17.445 -7.345 18.905 1.00 38.83 C ATOM 934 CG TYR A 59 16.232 -8.224 18.828 1.00 40.82 C ATOM 935 CD1 TYR A 59 15.475 -8.300 17.659 1.00 40.71 C ATOM 936 CD2 TYR A 59 15.844 -9.005 19.919 1.00 40.87 C ATOM 937 CE1 TYR A 59 14.359 -9.118 17.583 1.00 41.15 C ATOM 938 CE2 TYR A 59 14.745 -9.834 19.840 1.00 41.22 C ATOM 939 CZ TYR A 59 14.003 -9.877 18.677 1.00 41.59 C ATOM 940 OH TYR A 59 12.910 -10.700 18.590 1.00 41.80 O ATOM 941 HA TYR A 59 16.610 -5.896 20.208 1.00 0.00 H ATOM 942 HB3 TYR A 59 18.118 -7.763 19.653 1.00 0.00 H ATOM 943 HB2 TYR A 59 17.934 -7.358 17.931 1.00 0.00 H ATOM 944 HD2 TYR A 59 16.417 -8.959 20.845 1.00 0.00 H ATOM 945 HE2 TYR A 59 14.463 -10.453 20.692 1.00 0.00 H ATOM 946 HE1 TYR A 59 13.769 -9.161 16.668 1.00 0.00 H ATOM 947 HD1 TYR A 59 15.766 -7.707 16.792 1.00 0.00 H ATOM 948 HH TYR A 59 13.193 -11.639 18.728 1.00 0.00 H ATOM 949 H TYR A 59 16.697 -5.330 17.257 1.00 0.00 H ATOM 950 N ASP A 60 18.767 -4.741 20.682 1.00 38.79 N ATOM 951 CA ASP A 60 20.025 -4.068 20.981 1.00 39.33 C ATOM 952 C ASP A 60 21.078 -5.065 21.457 1.00 38.97 C ATOM 953 O ASP A 60 20.763 -6.174 21.930 1.00 38.47 O ATOM 954 CB ASP A 60 19.829 -2.920 21.987 1.00 40.01 C ATOM 955 CG ASP A 60 19.054 -1.750 21.390 1.00 42.43 C ATOM 956 OD1 ASP A 60 19.026 -1.633 20.140 1.00 41.77 O ATOM 957 OD2 ASP A 60 18.447 -0.892 22.079 1.00 43.64 O ATOM 958 HA ASP A 60 20.390 -3.620 20.057 1.00 0.00 H ATOM 959 HB2 ASP A 60 19.281 -3.300 22.849 1.00 0.00 H ATOM 960 HB3 ASP A 60 20.808 -2.564 22.308 1.00 0.00 H ATOM 961 H ASP A 60 18.081 -4.903 21.447 1.00 0.00 H ATOM 962 N GLN A 61 22.333 -4.686 21.251 1.00 38.45 N ATOM 963 CA GLN A 61 23.480 -5.431 21.773 1.00 38.25 C ATOM 964 C GLN A 61 23.430 -6.920 21.425 1.00 36.54 C ATOM 965 O GLN A 61 23.618 -7.793 22.289 1.00 36.59 O ATOM 966 CB GLN A 61 23.632 -5.213 23.296 1.00 38.51 C ATOM 967 CG GLN A 61 23.582 -3.758 23.708 1.00 42.04 C ATOM 968 CD GLN A 61 23.014 -3.568 25.113 1.00 42.51 C ATOM 969 OE1 GLN A 61 21.842 -3.895 25.391 1.00 47.44 O ATOM 970 NE2 GLN A 61 23.830 -3.027 25.989 1.00 46.16 N ATOM 971 HA GLN A 61 24.366 -5.032 21.278 1.00 0.00 H ATOM 972 HB2 GLN A 61 22.825 -5.743 23.802 1.00 0.00 H ATOM 973 HB3 GLN A 61 24.590 -5.627 23.610 1.00 0.00 H ATOM 974 HG2 GLN A 61 24.593 -3.352 23.681 1.00 0.00 H ATOM 975 HG3 GLN A 61 22.955 -3.215 23.001 1.00 0.00 H ATOM 976 HE22 GLN A 61 24.798 -2.772 25.709 1.00 0.00 H ATOM 977 HE21 GLN A 61 23.508 -2.854 26.963 1.00 0.00 H ATOM 978 H GLN A 61 22.509 -3.824 20.696 1.00 0.00 H ATOM 979 N ILE A 62 23.170 -7.208 20.152 1.00 33.24 N ATOM 980 CA ILE A 62 23.178 -8.571 19.643 1.00 30.79 C ATOM 981 C ILE A 62 24.537 -8.891 19.037 1.00 29.48 C ATOM 982 O ILE A 62 25.042 -8.120 18.220 1.00 27.92 O ATOM 983 CB ILE A 62 22.065 -8.750 18.563 1.00 30.60 C ATOM 984 CG1 ILE A 62 20.674 -8.466 19.173 1.00 31.13 C ATOM 985 CG2 ILE A 62 22.193 -10.097 17.875 1.00 29.90 C ATOM 986 CD1 ILE A 62 20.357 -9.232 20.480 1.00 32.50 C ATOM 987 HA ILE A 62 22.983 -9.254 20.470 1.00 0.00 H ATOM 988 HB ILE A 62 22.194 -8.013 17.770 1.00 0.00 H ATOM 989 HG12 ILE A 62 20.610 -7.398 19.384 1.00 0.00 H ATOM 990 HG13 ILE A 62 19.920 -8.735 18.433 1.00 0.00 H ATOM 991 HD11 ILE A 62 20.400 -10.305 20.291 1.00 0.00 H ATOM 992 HD12 ILE A 62 21.090 -8.967 21.242 1.00 0.00 H ATOM 993 HD13 ILE A 62 19.359 -8.962 20.825 1.00 0.00 H ATOM 994 HG21 ILE A 62 23.167 -10.165 17.391 1.00 0.00 H ATOM 995 HG22 ILE A 62 22.097 -10.892 18.615 1.00 0.00 H ATOM 996 HG23 ILE A 62 21.406 -10.198 17.127 1.00 0.00 H ATOM 997 H ILE A 62 22.953 -6.430 19.497 1.00 0.00 H ATOM 998 N PRO A 63 25.128 -10.017 19.430 1.00 28.04 N ATOM 999 CA PRO A 63 26.361 -10.491 18.830 1.00 26.47 C ATOM 1000 C PRO A 63 26.153 -11.022 17.425 1.00 25.49 C ATOM 1001 O PRO A 63 25.233 -11.789 17.169 1.00 24.19 O ATOM 1002 CB PRO A 63 26.794 -11.636 19.762 1.00 26.38 C ATOM 1003 CG PRO A 63 26.017 -11.412 21.007 1.00 26.18 C ATOM 1004 CD PRO A 63 24.679 -10.902 20.525 1.00 27.59 C ATOM 1005 HA PRO A 63 27.096 -9.692 18.733 1.00 0.00 H ATOM 1006 HD3 PRO A 63 24.044 -11.710 20.160 1.00 0.00 H ATOM 1007 HD2 PRO A 63 24.151 -10.350 21.303 1.00 0.00 H ATOM 1008 HG3 PRO A 63 26.507 -10.673 21.641 1.00 0.00 H ATOM 1009 HG2 PRO A 63 25.899 -12.343 21.562 1.00 0.00 H ATOM 1010 HB2 PRO A 63 26.550 -12.604 19.324 1.00 0.00 H ATOM 1011 HB3 PRO A 63 27.865 -11.588 19.961 1.00 0.00 H ATOM 1012 N ILE A 64 26.980 -10.543 16.503 1.00 24.53 N ATOM 1013 CA ILE A 64 26.981 -11.004 15.120 1.00 24.44 C ATOM 1014 C ILE A 64 28.404 -11.175 14.685 1.00 24.63 C ATOM 1015 O ILE A 64 29.268 -10.393 15.054 1.00 24.22 O ATOM 1016 CB ILE A 64 26.335 -10.007 14.147 1.00 24.61 C ATOM 1017 CG1 ILE A 64 24.955 -9.554 14.609 1.00 25.57 C ATOM 1018 CG2 ILE A 64 26.252 -10.639 12.731 1.00 23.28 C ATOM 1019 CD1 ILE A 64 24.089 -9.139 13.441 1.00 27.49 C ATOM 1020 HA ILE A 64 26.406 -11.930 15.093 1.00 0.00 H ATOM 1021 HB ILE A 64 26.965 -9.118 14.118 1.00 0.00 H ATOM 1022 HG12 ILE A 64 24.470 -10.376 15.136 1.00 0.00 H ATOM 1023 HG13 ILE A 64 25.068 -8.707 15.285 1.00 0.00 H ATOM 1024 HD11 ILE A 64 24.565 -8.313 12.913 1.00 0.00 H ATOM 1025 HD12 ILE A 64 23.967 -9.984 12.763 1.00 0.00 H ATOM 1026 HD13 ILE A 64 23.113 -8.822 13.809 1.00 0.00 H ATOM 1027 HG21 ILE A 64 27.256 -10.885 12.385 1.00 0.00 H ATOM 1028 HG22 ILE A 64 25.649 -11.546 12.774 1.00 0.00 H ATOM 1029 HG23 ILE A 64 25.793 -9.928 12.044 1.00 0.00 H ATOM 1030 H ILE A 64 27.658 -9.805 16.780 1.00 0.00 H ATOM 1031 N GLU A 65 28.661 -12.201 13.903 1.00 24.85 N ATOM 1032 CA GLU A 65 29.993 -12.357 13.372 1.00 28.46 C ATOM 1033 C GLU A 65 29.767 -12.134 11.894 1.00 28.02 C ATOM 1034 O GLU A 65 28.928 -12.808 11.284 1.00 28.82 O ATOM 1035 CB GLU A 65 30.610 -13.708 13.713 1.00 28.25 C ATOM 1036 CG GLU A 65 32.076 -13.841 13.278 1.00 32.38 C ATOM 1037 CD GLU A 65 32.759 -15.078 13.834 1.00 33.95 C ATOM 1038 OE1 GLU A 65 33.965 -15.277 13.539 1.00 38.82 O ATOM 1039 OE2 GLU A 65 32.096 -15.858 14.576 1.00 40.04 O ATOM 1040 HA GLU A 65 30.724 -11.667 13.794 1.00 0.00 H ATOM 1041 HB2 GLU A 65 30.556 -13.849 14.792 1.00 0.00 H ATOM 1042 HB3 GLU A 65 30.031 -14.487 13.217 1.00 0.00 H ATOM 1043 HG2 GLU A 65 32.111 -13.886 12.190 1.00 0.00 H ATOM 1044 HG3 GLU A 65 32.620 -12.961 13.622 1.00 0.00 H ATOM 1045 H GLU A 65 27.916 -12.889 13.671 1.00 0.00 H ATOM 1046 N ILE A 66 30.437 -11.124 11.349 1.00 27.47 N ATOM 1047 CA ILE A 66 30.230 -10.768 9.942 1.00 26.90 C ATOM 1048 C ILE A 66 31.559 -11.036 9.277 1.00 28.51 C ATOM 1049 O ILE A 66 32.572 -10.417 9.633 1.00 27.76 O ATOM 1050 CB ILE A 66 29.845 -9.318 9.801 1.00 26.65 C ATOM 1051 CG1 ILE A 66 28.529 -9.026 10.531 1.00 25.28 C ATOM 1052 CG2 ILE A 66 29.784 -8.924 8.304 1.00 25.22 C ATOM 1053 CD1 ILE A 66 28.304 -7.572 10.840 1.00 25.42 C ATOM 1054 HA ILE A 66 29.420 -11.341 9.492 1.00 0.00 H ATOM 1055 HB ILE A 66 30.610 -8.702 10.273 1.00 0.00 H ATOM 1056 HG12 ILE A 66 27.707 -9.374 9.906 1.00 0.00 H ATOM 1057 HG13 ILE A 66 28.529 -9.579 11.470 1.00 0.00 H ATOM 1058 HD11 ILE A 66 29.111 -7.208 11.476 1.00 0.00 H ATOM 1059 HD12 ILE A 66 28.288 -7.003 9.911 1.00 0.00 H ATOM 1060 HD13 ILE A 66 27.351 -7.455 11.356 1.00 0.00 H ATOM 1061 HG21 ILE A 66 30.762 -9.080 7.848 1.00 0.00 H ATOM 1062 HG22 ILE A 66 29.043 -9.542 7.797 1.00 0.00 H ATOM 1063 HG23 ILE A 66 29.505 -7.874 8.217 1.00 0.00 H ATOM 1064 H ILE A 66 31.113 -10.582 11.925 1.00 0.00 H TER 1065 ILE A 66 ATOM 1066 N GLY A 68 33.708 -13.186 9.791 1.00 32.19 N ATOM 1067 CA GLY A 68 34.803 -13.507 10.736 1.00 33.98 C ATOM 1068 C GLY A 68 35.162 -12.360 11.673 1.00 34.31 C ATOM 1069 O GLY A 68 36.171 -12.401 12.389 1.00 36.52 O ATOM 1070 HA3 GLY A 68 35.689 -13.770 10.159 1.00 0.00 H ATOM 1071 HA2 GLY A 68 34.497 -14.362 11.340 1.00 0.00 H ATOM 1072 HN3 GLY A 68 33.989 -12.379 9.199 1.00 0.00 H ATOM 1073 HN2 GLY A 68 32.850 -12.943 10.326 1.00 0.00 H ATOM 1074 HN1 GLY A 68 33.520 -14.012 9.187 1.00 0.00 H ATOM 1075 N HIS A 69 34.355 -11.314 11.645 1.00 33.16 N ATOM 1076 CA HIS A 69 34.578 -10.208 12.523 1.00 32.01 C ATOM 1077 C HIS A 69 33.412 -10.232 13.458 1.00 30.77 C ATOM 1078 O HIS A 69 32.279 -10.080 13.029 1.00 29.51 O ATOM 1079 CB HIS A 69 34.623 -8.919 11.732 1.00 31.99 C ATOM 1080 CG HIS A 69 35.766 -8.870 10.775 1.00 32.43 C ATOM 1081 ND1 HIS A 69 36.836 -8.016 10.942 1.00 35.32 N ATOM 1082 CD2 HIS A 69 36.029 -9.597 9.666 1.00 33.03 C ATOM 1083 CE1 HIS A 69 37.704 -8.211 9.964 1.00 33.32 C ATOM 1084 NE2 HIS A 69 37.240 -9.167 9.177 1.00 32.34 N ATOM 1085 HA HIS A 69 35.526 -10.273 13.058 1.00 0.00 H ATOM 1086 HB2 HIS A 69 33.694 -8.821 11.171 1.00 0.00 H ATOM 1087 HB3 HIS A 69 34.715 -8.085 12.428 1.00 0.00 H ATOM 1088 HD2 HIS A 69 35.399 -10.378 9.239 1.00 0.00 H ATOM 1089 HE1 HIS A 69 38.643 -7.675 9.829 1.00 0.00 H ATOM 1090 H HIS A 69 33.554 -11.295 10.982 1.00 0.00 H ATOM 1091 N LYS A 70 33.700 -10.445 14.733 1.00 30.38 N ATOM 1092 CA LYS A 70 32.665 -10.401 15.753 1.00 30.25 C ATOM 1093 C LYS A 70 32.412 -8.962 16.105 1.00 29.47 C ATOM 1094 O LYS A 70 33.349 -8.200 16.391 1.00 29.18 O ATOM 1095 CB LYS A 70 33.084 -11.191 16.988 1.00 32.25 C ATOM 1096 CG LYS A 70 33.145 -12.680 16.742 1.00 35.04 C ATOM 1097 CD LYS A 70 33.674 -13.418 17.949 1.00 39.09 C ATOM 1098 CE LYS A 70 33.556 -14.959 17.823 1.00 42.11 C ATOM 1099 NZ LYS A 70 34.450 -15.581 16.779 1.00 44.35 N ATOM 1100 HA LYS A 70 31.752 -10.857 15.371 1.00 0.00 H ATOM 1101 HB2 LYS A 70 34.071 -10.849 17.301 1.00 0.00 H ATOM 1102 HB3 LYS A 70 32.365 -10.999 17.784 1.00 0.00 H ATOM 1103 HG2 LYS A 70 32.143 -13.043 16.515 1.00 0.00 H ATOM 1104 HG3 LYS A 70 33.801 -12.873 15.893 1.00 0.00 H ATOM 1105 HD2 LYS A 70 34.725 -13.160 18.080 1.00 0.00 H ATOM 1106 HD3 LYS A 70 33.111 -13.098 18.826 1.00 0.00 H ATOM 1107 HE2 LYS A 70 32.523 -15.200 17.572 1.00 0.00 H ATOM 1108 HE3 LYS A 70 33.806 -15.398 18.789 1.00 0.00 H ATOM 1109 HZ1 LYS A 70 34.218 -15.186 15.846 1.00 0.00 H ATOM 1110 HZ2 LYS A 70 35.443 -15.374 17.007 1.00 0.00 H ATOM 1111 HZ3 LYS A 70 34.303 -16.610 16.767 1.00 0.00 H ATOM 1112 H LYS A 70 34.682 -10.647 15.009 1.00 0.00 H ATOM 1113 N VAL A 71 31.145 -8.594 16.048 1.00 27.50 N ATOM 1114 CA VAL A 71 30.684 -7.278 16.436 1.00 27.37 C ATOM 1115 C VAL A 71 29.431 -7.488 17.256 1.00 26.77 C ATOM 1116 O VAL A 71 28.928 -8.607 17.375 1.00 25.72 O ATOM 1117 CB VAL A 71 30.405 -6.370 15.224 1.00 27.52 C ATOM 1118 CG1 VAL A 71 31.658 -6.250 14.387 1.00 28.29 C ATOM 1119 CG2 VAL A 71 29.258 -6.906 14.449 1.00 27.22 C ATOM 1120 HA VAL A 71 31.457 -6.766 17.009 1.00 0.00 H ATOM 1121 HB VAL A 71 30.132 -5.368 15.556 1.00 0.00 H ATOM 1122 HG11 VAL A 71 32.456 -5.818 14.990 1.00 0.00 H ATOM 1123 HG12 VAL A 71 31.958 -7.239 14.040 1.00 0.00 H ATOM 1124 HG13 VAL A 71 31.460 -5.607 13.529 1.00 0.00 H ATOM 1125 HG21 VAL A 71 29.495 -7.911 14.101 1.00 0.00 H ATOM 1126 HG22 VAL A 71 28.374 -6.940 15.086 1.00 0.00 H ATOM 1127 HG23 VAL A 71 29.066 -6.259 13.593 1.00 0.00 H ATOM 1128 H VAL A 71 30.444 -9.283 15.708 1.00 0.00 H ATOM 1129 N ILE A 72 28.937 -6.417 17.844 1.00 27.47 N ATOM 1130 CA ILE A 72 27.765 -6.513 18.700 1.00 27.82 C ATOM 1131 C ILE A 72 27.016 -5.248 18.454 1.00 27.95 C ATOM 1132 O ILE A 72 27.572 -4.164 18.545 1.00 28.84 O ATOM 1133 CB ILE A 72 28.162 -6.603 20.193 1.00 28.89 C ATOM 1134 CG1 ILE A 72 28.624 -8.017 20.549 1.00 31.05 C ATOM 1135 CG2 ILE A 72 26.982 -6.282 21.096 1.00 29.39 C ATOM 1136 CD1 ILE A 72 28.838 -8.211 22.039 1.00 33.77 C ATOM 1137 HA ILE A 72 27.181 -7.407 18.480 1.00 0.00 H ATOM 1138 HB ILE A 72 28.966 -5.882 20.345 1.00 0.00 H ATOM 1139 HG12 ILE A 72 27.868 -8.726 20.211 1.00 0.00 H ATOM 1140 HG13 ILE A 72 29.564 -8.216 20.034 1.00 0.00 H ATOM 1141 HD11 ILE A 72 29.600 -7.514 22.389 1.00 0.00 H ATOM 1142 HD12 ILE A 72 27.903 -8.024 22.566 1.00 0.00 H ATOM 1143 HD13 ILE A 72 29.165 -9.234 22.228 1.00 0.00 H ATOM 1144 HG21 ILE A 72 26.632 -5.271 20.889 1.00 0.00 H ATOM 1145 HG22 ILE A 72 26.177 -6.992 20.906 1.00 0.00 H ATOM 1146 HG23 ILE A 72 27.293 -6.354 22.138 1.00 0.00 H ATOM 1147 H ILE A 72 29.390 -5.493 17.694 1.00 0.00 H ATOM 1148 N GLY A 73 25.750 -5.352 18.115 1.00 26.80 N ATOM 1149 CA GLY A 73 25.048 -4.136 17.858 1.00 26.96 C ATOM 1150 C GLY A 73 23.588 -4.368 17.718 1.00 25.89 C ATOM 1151 O GLY A 73 23.088 -5.457 17.968 1.00 25.45 O ATOM 1152 HA3 GLY A 73 25.427 -3.696 16.935 1.00 0.00 H ATOM 1153 HA2 GLY A 73 25.219 -3.446 18.685 1.00 0.00 H ATOM 1154 H GLY A 73 25.282 -6.277 18.038 1.00 0.00 H ATOM 1155 N THR A 74 22.922 -3.319 17.276 1.00 26.46 N ATOM 1156 CA THR A 74 21.499 -3.370 17.062 1.00 25.20 C ATOM 1157 C THR A 74 21.182 -4.083 15.760 1.00 24.86 C ATOM 1158 O THR A 74 21.768 -3.821 14.701 1.00 23.68 O ATOM 1159 CB THR A 74 20.956 -1.961 17.020 1.00 26.36 C ATOM 1160 OG1 THR A 74 21.198 -1.326 18.292 1.00 26.17 O ATOM 1161 CG2 THR A 74 19.439 -1.982 16.819 1.00 26.60 C ATOM 1162 HA THR A 74 21.034 -3.922 17.878 1.00 0.00 H ATOM 1163 HB THR A 74 21.443 -1.430 16.203 1.00 0.00 H ATOM 1164 HG1 THR A 74 20.744 -1.838 19.007 1.00 0.00 H ATOM 1165 HG23 THR A 74 19.207 -2.455 15.865 1.00 0.00 H ATOM 1166 HG21 THR A 74 18.974 -2.545 17.628 1.00 0.00 H ATOM 1167 HG22 THR A 74 19.059 -0.960 16.821 1.00 0.00 H ATOM 1168 H THR A 74 23.435 -2.436 17.078 1.00 0.00 H ATOM 1169 N VAL A 75 20.230 -4.981 15.859 1.00 24.05 N ATOM 1170 CA VAL A 75 19.751 -5.744 14.729 1.00 25.21 C ATOM 1171 C VAL A 75 18.244 -5.573 14.679 1.00 26.13 C ATOM 1172 O VAL A 75 17.569 -5.660 15.704 1.00 26.09 O ATOM 1173 CB VAL A 75 20.173 -7.210 14.870 1.00 26.33 C ATOM 1174 CG1 VAL A 75 19.488 -8.112 13.857 1.00 25.41 C ATOM 1175 CG2 VAL A 75 21.658 -7.291 14.676 1.00 24.97 C ATOM 1176 HA VAL A 75 20.181 -5.392 13.792 1.00 0.00 H ATOM 1177 HB VAL A 75 19.879 -7.555 15.861 1.00 0.00 H ATOM 1178 HG11 VAL A 75 18.408 -8.058 13.996 1.00 0.00 H ATOM 1179 HG12 VAL A 75 19.743 -7.784 12.849 1.00 0.00 H ATOM 1180 HG13 VAL A 75 19.823 -9.139 14.002 1.00 0.00 H ATOM 1181 HG21 VAL A 75 21.914 -6.921 13.683 1.00 0.00 H ATOM 1182 HG22 VAL A 75 22.156 -6.683 15.432 1.00 0.00 H ATOM 1183 HG23 VAL A 75 21.980 -8.328 14.773 1.00 0.00 H ATOM 1184 H VAL A 75 19.802 -5.151 16.791 1.00 0.00 H ATOM 1185 N LEU A 76 17.745 -5.254 13.494 1.00 26.54 N ATOM 1186 CA LEU A 76 16.328 -5.176 13.243 1.00 27.03 C ATOM 1187 C LEU A 76 15.841 -6.465 12.586 1.00 27.30 C ATOM 1188 O LEU A 76 16.485 -7.028 11.685 1.00 27.67 O ATOM 1189 CB LEU A 76 15.994 -3.960 12.384 1.00 25.66 C ATOM 1190 CG LEU A 76 16.602 -2.618 12.822 1.00 24.51 C ATOM 1191 CD1 LEU A 76 16.133 -1.491 11.905 1.00 25.17 C ATOM 1192 CD2 LEU A 76 16.288 -2.262 14.280 1.00 26.51 C ATOM 1193 HA LEU A 76 15.810 -5.058 14.195 1.00 0.00 H ATOM 1194 HB2 LEU A 76 16.341 -4.165 11.371 1.00 0.00 H ATOM 1195 HB3 LEU A 76 14.910 -3.846 12.379 1.00 0.00 H ATOM 1196 HG LEU A 76 17.683 -2.734 12.744 1.00 0.00 H ATOM 1197 HD21 LEU A 76 15.208 -2.194 14.412 1.00 0.00 H ATOM 1198 HD22 LEU A 76 16.688 -3.036 14.936 1.00 0.00 H ATOM 1199 HD23 LEU A 76 16.746 -1.304 14.525 1.00 0.00 H ATOM 1200 HD11 LEU A 76 16.444 -1.703 10.882 1.00 0.00 H ATOM 1201 HD12 LEU A 76 15.046 -1.418 11.948 1.00 0.00 H ATOM 1202 HD13 LEU A 76 16.575 -0.550 12.233 1.00 0.00 H ATOM 1203 H LEU A 76 18.402 -5.052 12.714 1.00 0.00 H ATOM 1204 N VAL A 77 14.707 -6.956 13.062 1.00 27.60 N ATOM 1205 CA VAL A 77 14.177 -8.166 12.487 1.00 29.60 C ATOM 1206 C VAL A 77 12.787 -7.903 11.945 1.00 31.07 C ATOM 1207 O VAL A 77 11.926 -7.376 12.639 1.00 31.80 O ATOM 1208 CB VAL A 77 14.160 -9.346 13.496 1.00 30.10 C ATOM 1209 CG1 VAL A 77 13.739 -10.634 12.789 1.00 31.35 C ATOM 1210 CG2 VAL A 77 15.531 -9.492 14.173 1.00 29.55 C ATOM 1211 HA VAL A 77 14.837 -8.465 11.673 1.00 0.00 H ATOM 1212 HB VAL A 77 13.429 -9.139 14.278 1.00 0.00 H ATOM 1213 HG11 VAL A 77 12.741 -10.507 12.369 1.00 0.00 H ATOM 1214 HG12 VAL A 77 14.446 -10.856 11.989 1.00 0.00 H ATOM 1215 HG13 VAL A 77 13.731 -11.455 13.506 1.00 0.00 H ATOM 1216 HG21 VAL A 77 16.291 -9.683 13.415 1.00 0.00 H ATOM 1217 HG22 VAL A 77 15.771 -8.572 14.706 1.00 0.00 H ATOM 1218 HG23 VAL A 77 15.501 -10.324 14.877 1.00 0.00 H ATOM 1219 H VAL A 77 14.207 -6.476 13.838 1.00 0.00 H ATOM 1220 N GLY A 78 12.562 -8.262 10.693 1.00 32.23 N ATOM 1221 CA GLY A 78 11.241 -8.070 10.122 1.00 33.55 C ATOM 1222 C GLY A 78 11.162 -8.604 8.719 1.00 34.59 C ATOM 1223 O GLY A 78 12.102 -9.258 8.249 1.00 34.04 O ATOM 1224 HA3 GLY A 78 11.012 -7.004 10.109 1.00 0.00 H ATOM 1225 HA2 GLY A 78 10.509 -8.590 10.740 1.00 0.00 H ATOM 1226 H GLY A 78 13.325 -8.678 10.122 1.00 0.00 H ATOM 1227 N PRO A 79 10.054 -8.305 8.036 1.00 35.71 N ATOM 1228 CA PRO A 79 9.765 -8.888 6.718 1.00 35.61 C ATOM 1229 C PRO A 79 10.562 -8.239 5.590 1.00 34.35 C ATOM 1230 O PRO A 79 9.999 -7.723 4.614 1.00 35.95 O ATOM 1231 CB PRO A 79 8.253 -8.655 6.562 1.00 36.15 C ATOM 1232 CG PRO A 79 8.018 -7.366 7.299 1.00 36.52 C ATOM 1233 CD PRO A 79 8.981 -7.391 8.482 1.00 36.53 C ATOM 1234 HA PRO A 79 10.050 -9.938 6.658 1.00 0.00 H ATOM 1235 HD3 PRO A 79 9.376 -6.395 8.684 1.00 0.00 H ATOM 1236 HD2 PRO A 79 8.490 -7.774 9.376 1.00 0.00 H ATOM 1237 HG3 PRO A 79 6.987 -7.309 7.648 1.00 0.00 H ATOM 1238 HG2 PRO A 79 8.229 -6.514 6.653 1.00 0.00 H ATOM 1239 HB2 PRO A 79 7.980 -8.559 5.511 1.00 0.00 H ATOM 1240 HB3 PRO A 79 7.685 -9.470 7.011 1.00 0.00 H ATOM 1241 N THR A 80 11.880 -8.274 5.721 1.00 31.75 N ATOM 1242 CA THR A 80 12.748 -7.748 4.681 1.00 28.96 C ATOM 1243 C THR A 80 13.028 -8.882 3.717 1.00 29.07 C ATOM 1244 O THR A 80 13.083 -10.059 4.127 1.00 28.71 O ATOM 1245 CB THR A 80 14.071 -7.229 5.321 1.00 28.18 C ATOM 1246 OG1 THR A 80 15.025 -6.970 4.298 1.00 25.48 O ATOM 1247 CG2 THR A 80 14.747 -8.330 6.107 1.00 27.39 C ATOM 1248 HA THR A 80 12.280 -6.915 4.156 1.00 0.00 H ATOM 1249 HB THR A 80 13.805 -6.361 5.924 1.00 0.00 H ATOM 1250 HG1 THR A 80 15.206 -7.805 3.798 1.00 0.00 H ATOM 1251 HG23 THR A 80 14.107 -8.627 6.938 1.00 0.00 H ATOM 1252 HG21 THR A 80 14.919 -9.187 5.455 1.00 0.00 H ATOM 1253 HG22 THR A 80 15.700 -7.967 6.492 1.00 0.00 H ATOM 1254 H THR A 80 12.299 -8.684 6.580 1.00 0.00 H ATOM 1255 N PRO A 81 13.217 -8.546 2.448 1.00 29.34 N ATOM 1256 CA PRO A 81 13.468 -9.565 1.421 1.00 29.18 C ATOM 1257 C PRO A 81 14.940 -9.994 1.353 1.00 28.68 C ATOM 1258 O PRO A 81 15.313 -10.852 0.580 1.00 28.26 O ATOM 1259 CB PRO A 81 13.047 -8.871 0.140 1.00 30.03 C ATOM 1260 CG PRO A 81 13.363 -7.423 0.384 1.00 29.64 C ATOM 1261 CD PRO A 81 13.180 -7.181 1.885 1.00 29.53 C ATOM 1262 HA PRO A 81 12.927 -10.490 1.622 1.00 0.00 H ATOM 1263 HD3 PRO A 81 13.989 -6.570 2.285 1.00 0.00 H ATOM 1264 HD2 PRO A 81 12.225 -6.698 2.091 1.00 0.00 H ATOM 1265 HG3 PRO A 81 12.683 -6.789 -0.185 1.00 0.00 H ATOM 1266 HG2 PRO A 81 14.390 -7.208 0.091 1.00 0.00 H ATOM 1267 HB2 PRO A 81 13.612 -9.252 -0.710 1.00 0.00 H ATOM 1268 HB3 PRO A 81 11.981 -9.009 -0.042 1.00 0.00 H ATOM 1269 N ALA A 82 15.777 -9.369 2.168 1.00 27.46 N ATOM 1270 CA ALA A 82 17.186 -9.682 2.194 1.00 25.35 C ATOM 1271 C ALA A 82 17.726 -9.347 3.557 1.00 23.64 C ATOM 1272 O ALA A 82 17.306 -8.391 4.177 1.00 23.03 O ATOM 1273 CB ALA A 82 17.920 -8.853 1.114 1.00 26.31 C ATOM 1274 HA ALA A 82 17.341 -10.741 1.988 1.00 0.00 H ATOM 1275 HB1 ALA A 82 17.512 -9.095 0.133 1.00 0.00 H ATOM 1276 HB2 ALA A 82 17.780 -7.791 1.315 1.00 0.00 H ATOM 1277 HB3 ALA A 82 18.983 -9.091 1.136 1.00 0.00 H ATOM 1278 H ALA A 82 15.409 -8.634 2.805 1.00 0.00 H ATOM 1279 N ASN A 83 18.678 -10.138 4.046 1.00 21.83 N ATOM 1280 CA ASN A 83 19.391 -9.773 5.231 1.00 20.32 C ATOM 1281 C ASN A 83 20.336 -8.677 4.841 1.00 18.46 C ATOM 1282 O ASN A 83 21.082 -8.811 3.871 1.00 18.63 O ATOM 1283 CB ASN A 83 20.193 -10.963 5.722 1.00 20.12 C ATOM 1284 CG ASN A 83 19.299 -12.076 6.155 1.00 23.75 C ATOM 1285 OD1 ASN A 83 18.325 -11.812 6.851 1.00 24.73 O ATOM 1286 ND2 ASN A 83 19.577 -13.300 5.731 1.00 22.73 N ATOM 1287 HA ASN A 83 18.709 -9.455 6.020 1.00 0.00 H ATOM 1288 HB2 ASN A 83 20.835 -11.316 4.915 1.00 0.00 H ATOM 1289 HB3 ASN A 83 20.809 -10.653 6.566 1.00 0.00 H ATOM 1290 HD22 ASN A 83 20.418 -13.468 5.142 1.00 0.00 H ATOM 1291 HD21 ASN A 83 18.955 -14.093 5.987 1.00 0.00 H ATOM 1292 H ASN A 83 18.906 -11.030 3.562 1.00 0.00 H ATOM 1293 N ILE A 84 20.294 -7.594 5.603 1.00 18.03 N ATOM 1294 CA ILE A 84 21.041 -6.405 5.244 1.00 17.44 C ATOM 1295 C ILE A 84 21.910 -6.001 6.410 1.00 17.59 C ATOM 1296 O ILE A 84 21.423 -5.827 7.549 1.00 18.32 O ATOM 1297 CB ILE A 84 20.081 -5.260 4.874 1.00 17.80 C ATOM 1298 CG1 ILE A 84 19.465 -5.513 3.509 1.00 19.05 C ATOM 1299 CG2 ILE A 84 20.828 -3.926 4.894 1.00 18.21 C ATOM 1300 CD1 ILE A 84 18.110 -4.937 3.405 1.00 22.15 C ATOM 1301 HA ILE A 84 21.667 -6.617 4.377 1.00 0.00 H ATOM 1302 HB ILE A 84 19.277 -5.217 5.608 1.00 0.00 H ATOM 1303 HG12 ILE A 84 20.100 -5.063 2.746 1.00 0.00 H ATOM 1304 HG13 ILE A 84 19.406 -6.588 3.342 1.00 0.00 H ATOM 1305 HD11 ILE A 84 17.466 -5.387 4.161 1.00 0.00 H ATOM 1306 HD12 ILE A 84 18.161 -3.860 3.564 1.00 0.00 H ATOM 1307 HD13 ILE A 84 17.705 -5.140 2.414 1.00 0.00 H ATOM 1308 HG21 ILE A 84 21.229 -3.751 5.892 1.00 0.00 H ATOM 1309 HG22 ILE A 84 21.645 -3.958 4.173 1.00 0.00 H ATOM 1310 HG23 ILE A 84 20.141 -3.122 4.631 1.00 0.00 H ATOM 1311 H ILE A 84 19.718 -7.597 6.469 1.00 0.00 H ATOM 1312 N ILE A 85 23.204 -5.904 6.136 1.00 16.14 N ATOM 1313 CA ILE A 85 24.129 -5.400 7.141 1.00 15.94 C ATOM 1314 C ILE A 85 24.325 -3.938 6.890 1.00 15.39 C ATOM 1315 O ILE A 85 24.853 -3.543 5.846 1.00 15.62 O ATOM 1316 CB ILE A 85 25.507 -6.088 7.058 1.00 16.18 C ATOM 1317 CG1 ILE A 85 25.357 -7.618 7.159 1.00 17.01 C ATOM 1318 CG2 ILE A 85 26.409 -5.545 8.176 1.00 16.75 C ATOM 1319 CD1 ILE A 85 24.522 -8.101 8.360 1.00 20.91 C ATOM 1320 HA ILE A 85 23.709 -5.600 8.127 1.00 0.00 H ATOM 1321 HB ILE A 85 25.966 -5.868 6.094 1.00 0.00 H ATOM 1322 HG12 ILE A 85 24.879 -7.974 6.247 1.00 0.00 H ATOM 1323 HG13 ILE A 85 26.353 -8.053 7.240 1.00 0.00 H ATOM 1324 HD11 ILE A 85 24.991 -7.766 9.285 1.00 0.00 H ATOM 1325 HD12 ILE A 85 23.516 -7.687 8.291 1.00 0.00 H ATOM 1326 HD13 ILE A 85 24.470 -9.190 8.350 1.00 0.00 H ATOM 1327 HG21 ILE A 85 26.528 -4.468 8.054 1.00 0.00 H ATOM 1328 HG22 ILE A 85 25.952 -5.754 9.143 1.00 0.00 H ATOM 1329 HG23 ILE A 85 27.384 -6.029 8.121 1.00 0.00 H ATOM 1330 H ILE A 85 23.559 -6.189 5.201 1.00 0.00 H ATOM 1331 N GLY A 86 23.897 -3.125 7.832 1.00 15.47 N ATOM 1332 CA GLY A 86 23.957 -1.697 7.626 1.00 15.24 C ATOM 1333 C GLY A 86 25.182 -1.080 8.229 1.00 16.09 C ATOM 1334 O GLY A 86 26.084 -1.776 8.719 1.00 16.62 O ATOM 1335 HA3 GLY A 86 23.077 -1.241 8.079 1.00 0.00 H ATOM 1336 HA2 GLY A 86 23.957 -1.498 6.554 1.00 0.00 H ATOM 1337 H GLY A 86 23.517 -3.509 8.721 1.00 0.00 H ATOM 1338 N ARG A 87 25.256 0.238 8.121 1.00 16.50 N ATOM 1339 CA ARG A 87 26.443 0.955 8.519 1.00 17.67 C ATOM 1340 C ARG A 87 26.693 0.806 9.981 1.00 19.16 C ATOM 1341 O ARG A 87 27.839 0.836 10.403 1.00 19.45 O ATOM 1342 CB ARG A 87 26.345 2.429 8.135 1.00 18.69 C ATOM 1343 CG ARG A 87 26.335 2.691 6.621 1.00 17.41 C ATOM 1344 CD ARG A 87 26.371 4.207 6.322 1.00 18.70 C ATOM 1345 NE ARG A 87 25.117 4.835 6.777 1.00 20.47 N ATOM 1346 CZ ARG A 87 24.962 5.489 7.936 1.00 24.23 C ATOM 1347 NH1 ARG A 87 25.976 5.630 8.793 1.00 22.82 N ATOM 1348 NH2 ARG A 87 23.774 6.004 8.242 1.00 24.31 N ATOM 1349 HA ARG A 87 27.289 0.521 7.986 1.00 0.00 H ATOM 1350 HB2 ARG A 87 25.424 2.831 8.557 1.00 0.00 H ATOM 1351 HB3 ARG A 87 27.199 2.951 8.566 1.00 0.00 H ATOM 1352 HG2 ARG A 87 27.208 2.218 6.171 1.00 0.00 H ATOM 1353 HG3 ARG A 87 25.429 2.264 6.191 1.00 0.00 H ATOM 1354 HD2 ARG A 87 26.485 4.362 5.249 1.00 0.00 H ATOM 1355 HD3 ARG A 87 27.213 4.660 6.845 1.00 0.00 H ATOM 1356 HE ARG A 87 24.290 4.765 6.151 1.00 0.00 H ATOM 1357 HH12 ARG A 87 25.834 6.142 9.687 1.00 0.00 H ATOM 1358 HH11 ARG A 87 26.908 5.228 8.566 1.00 0.00 H ATOM 1359 HH22 ARG A 87 23.644 6.513 9.139 1.00 0.00 H ATOM 1360 HH21 ARG A 87 22.976 5.897 7.584 1.00 0.00 H ATOM 1361 H ARG A 87 24.444 0.766 7.742 1.00 0.00 H ATOM 1362 N ASN A 88 25.633 0.548 10.760 1.00 19.02 N ATOM 1363 CA ASN A 88 25.811 0.440 12.189 1.00 19.98 C ATOM 1364 C ASN A 88 26.785 -0.683 12.548 1.00 20.59 C ATOM 1365 O ASN A 88 27.505 -0.590 13.527 1.00 22.52 O ATOM 1366 CB ASN A 88 24.478 0.236 12.894 1.00 20.90 C ATOM 1367 CG ASN A 88 23.891 -1.129 12.677 1.00 20.34 C ATOM 1368 OD1 ASN A 88 23.637 -1.548 11.544 1.00 19.95 O ATOM 1369 ND2 ASN A 88 23.604 -1.819 13.777 1.00 23.60 N ATOM 1370 HA ASN A 88 26.240 1.380 12.534 1.00 0.00 H ATOM 1371 HB2 ASN A 88 24.627 0.382 13.964 1.00 0.00 H ATOM 1372 HB3 ASN A 88 23.773 0.979 12.522 1.00 0.00 H ATOM 1373 HD22 ASN A 88 23.836 -1.427 14.712 1.00 0.00 H ATOM 1374 HD21 ASN A 88 23.148 -2.750 13.702 1.00 0.00 H ATOM 1375 H ASN A 88 24.690 0.427 10.339 1.00 0.00 H ATOM 1376 N LEU A 89 26.776 -1.741 11.751 1.00 19.45 N ATOM 1377 CA LEU A 89 27.670 -2.852 11.935 1.00 19.20 C ATOM 1378 C LEU A 89 28.887 -2.773 11.061 1.00 18.61 C ATOM 1379 O LEU A 89 29.933 -3.232 11.474 1.00 19.82 O ATOM 1380 CB LEU A 89 26.962 -4.196 11.727 1.00 19.05 C ATOM 1381 CG LEU A 89 25.737 -4.437 12.603 1.00 20.97 C ATOM 1382 CD1 LEU A 89 25.276 -5.864 12.372 1.00 22.15 C ATOM 1383 CD2 LEU A 89 26.032 -4.185 14.114 1.00 22.17 C ATOM 1384 HA LEU A 89 28.003 -2.789 12.971 1.00 0.00 H ATOM 1385 HB2 LEU A 89 26.646 -4.251 10.685 1.00 0.00 H ATOM 1386 HB3 LEU A 89 27.681 -4.989 11.930 1.00 0.00 H ATOM 1387 HG LEU A 89 24.954 -3.731 12.328 1.00 0.00 H ATOM 1388 HD21 LEU A 89 26.823 -4.858 14.446 1.00 0.00 H ATOM 1389 HD22 LEU A 89 26.350 -3.152 14.253 1.00 0.00 H ATOM 1390 HD23 LEU A 89 25.129 -4.370 14.695 1.00 0.00 H ATOM 1391 HD11 LEU A 89 25.022 -5.997 11.320 1.00 0.00 H ATOM 1392 HD12 LEU A 89 26.077 -6.552 12.643 1.00 0.00 H ATOM 1393 HD13 LEU A 89 24.399 -6.065 12.987 1.00 0.00 H ATOM 1394 H LEU A 89 26.097 -1.769 10.963 1.00 0.00 H ATOM 1395 N MET A 90 28.754 -2.218 9.855 1.00 18.06 N ATOM 1396 CA MET A 90 29.895 -2.122 8.945 1.00 18.64 C ATOM 1397 C MET A 90 31.007 -1.281 9.542 1.00 19.06 C ATOM 1398 O MET A 90 32.199 -1.580 9.360 1.00 19.70 O ATOM 1399 CB MET A 90 29.459 -1.589 7.577 1.00 18.15 C ATOM 1400 CG MET A 90 28.577 -2.610 6.808 1.00 17.72 C ATOM 1401 SD MET A 90 28.090 -1.952 5.214 1.00 19.68 S ATOM 1402 CE MET A 90 29.622 -1.974 4.318 1.00 18.83 C ATOM 1403 HA MET A 90 30.293 -3.126 8.798 1.00 0.00 H ATOM 1404 HB2 MET A 90 28.890 -0.671 7.722 1.00 0.00 H ATOM 1405 HB3 MET A 90 30.348 -1.374 6.983 1.00 0.00 H ATOM 1406 HG2 MET A 90 27.684 -2.825 7.395 1.00 0.00 H ATOM 1407 HG3 MET A 90 29.142 -3.530 6.658 1.00 0.00 H ATOM 1408 HE1 MET A 90 30.352 -1.349 4.833 1.00 0.00 H ATOM 1409 HE2 MET A 90 29.994 -2.997 4.262 1.00 0.00 H ATOM 1410 HE3 MET A 90 29.458 -1.590 3.311 1.00 0.00 H ATOM 1411 H MET A 90 27.828 -1.849 9.558 1.00 0.00 H ATOM 1412 N THR A 91 30.622 -0.248 10.283 1.00 19.63 N ATOM 1413 CA THR A 91 31.617 0.595 10.989 1.00 22.13 C ATOM 1414 C THR A 91 32.442 -0.242 11.977 1.00 23.38 C ATOM 1415 O THR A 91 33.663 -0.060 12.097 1.00 23.48 O ATOM 1416 CB THR A 91 30.952 1.788 11.712 1.00 22.59 C ATOM 1417 OG1 THR A 91 29.845 1.359 12.482 1.00 22.47 O ATOM 1418 CG2 THR A 91 30.335 2.737 10.714 1.00 22.41 C ATOM 1419 HA THR A 91 32.288 1.002 10.233 1.00 0.00 H ATOM 1420 HB THR A 91 31.736 2.248 12.314 1.00 0.00 H ATOM 1421 HG1 THR A 91 29.437 2.139 12.934 1.00 0.00 H ATOM 1422 HG23 THR A 91 31.113 3.132 10.061 1.00 0.00 H ATOM 1423 HG21 THR A 91 29.594 2.204 10.118 1.00 0.00 H ATOM 1424 HG22 THR A 91 29.854 3.558 11.245 1.00 0.00 H ATOM 1425 H THR A 91 29.609 -0.027 10.369 1.00 0.00 H ATOM 1426 N GLN A 92 31.776 -1.198 12.632 1.00 23.30 N ATOM 1427 CA GLN A 92 32.390 -2.047 13.663 1.00 23.94 C ATOM 1428 C GLN A 92 33.339 -3.085 13.114 1.00 24.60 C ATOM 1429 O GLN A 92 34.103 -3.702 13.845 1.00 24.96 O ATOM 1430 CB GLN A 92 31.301 -2.770 14.432 1.00 23.76 C ATOM 1431 CG GLN A 92 30.323 -1.853 15.073 1.00 23.06 C ATOM 1432 CD GLN A 92 29.492 -2.598 16.048 1.00 24.87 C ATOM 1433 OE1 GLN A 92 29.999 -3.487 16.750 1.00 26.94 O ATOM 1434 NE2 GLN A 92 28.216 -2.279 16.095 1.00 26.47 N ATOM 1435 HA GLN A 92 32.969 -1.378 14.300 1.00 0.00 H ATOM 1436 HB2 GLN A 92 30.764 -3.421 13.742 1.00 0.00 H ATOM 1437 HB3 GLN A 92 31.769 -3.374 15.209 1.00 0.00 H ATOM 1438 HG2 GLN A 92 30.859 -1.057 15.589 1.00 0.00 H ATOM 1439 HG3 GLN A 92 29.680 -1.419 14.308 1.00 0.00 H ATOM 1440 HE22 GLN A 92 27.846 -1.524 15.483 1.00 0.00 H ATOM 1441 HE21 GLN A 92 27.578 -2.782 16.745 1.00 0.00 H ATOM 1442 H GLN A 92 30.773 -1.349 12.401 1.00 0.00 H ATOM 1443 N ILE A 93 33.253 -3.332 11.819 1.00 24.22 N ATOM 1444 CA ILE A 93 34.213 -4.202 11.204 1.00 25.66 C ATOM 1445 C ILE A 93 35.211 -3.406 10.379 1.00 25.68 C ATOM 1446 O ILE A 93 36.110 -3.972 9.758 1.00 27.54 O ATOM 1447 CB ILE A 93 33.542 -5.361 10.449 1.00 25.98 C ATOM 1448 CG1 ILE A 93 32.875 -4.849 9.192 1.00 25.84 C ATOM 1449 CG2 ILE A 93 32.529 -6.028 11.318 1.00 26.71 C ATOM 1450 CD1 ILE A 93 32.482 -5.957 8.213 1.00 25.22 C ATOM 1451 HA ILE A 93 34.794 -4.689 11.987 1.00 0.00 H ATOM 1452 HB ILE A 93 34.309 -6.086 10.177 1.00 0.00 H ATOM 1453 HG12 ILE A 93 31.975 -4.305 9.476 1.00 0.00 H ATOM 1454 HG13 ILE A 93 33.564 -4.171 8.688 1.00 0.00 H ATOM 1455 HD11 ILE A 93 33.374 -6.505 7.909 1.00 0.00 H ATOM 1456 HD12 ILE A 93 31.783 -6.638 8.699 1.00 0.00 H ATOM 1457 HD13 ILE A 93 32.010 -5.514 7.336 1.00 0.00 H ATOM 1458 HG21 ILE A 93 33.019 -6.420 12.210 1.00 0.00 H ATOM 1459 HG22 ILE A 93 31.768 -5.304 11.608 1.00 0.00 H ATOM 1460 HG23 ILE A 93 32.063 -6.846 10.769 1.00 0.00 H ATOM 1461 H ILE A 93 32.497 -2.900 11.251 1.00 0.00 H ATOM 1462 N GLY A 94 35.046 -2.086 10.382 1.00 25.17 N ATOM 1463 CA GLY A 94 36.011 -1.201 9.780 1.00 24.13 C ATOM 1464 C GLY A 94 35.834 -1.143 8.272 1.00 24.12 C ATOM 1465 O GLY A 94 36.797 -0.918 7.539 1.00 25.02 O ATOM 1466 HA3 GLY A 94 37.015 -1.560 10.007 1.00 0.00 H ATOM 1467 HA2 GLY A 94 35.883 -0.200 10.193 1.00 0.00 H ATOM 1468 H GLY A 94 34.199 -1.682 10.830 1.00 0.00 H ATOM 1469 N CYS A 95 34.606 -1.308 7.817 1.00 22.54 N ATOM 1470 CA CYS A 95 34.347 -1.377 6.404 1.00 22.54 C ATOM 1471 C CYS A 95 34.281 0.002 5.737 1.00 22.50 C ATOM 1472 O CYS A 95 33.514 0.860 6.171 1.00 22.27 O ATOM 1473 CB CYS A 95 33.053 -2.147 6.211 1.00 22.60 C ATOM 1474 SG CYS A 95 32.723 -2.461 4.509 1.00 21.12 S ATOM 1475 HA CYS A 95 35.177 -1.888 5.916 1.00 0.00 H ATOM 1476 HB2 CYS A 95 32.231 -1.565 6.628 1.00 0.00 H ATOM 1477 HB3 CYS A 95 33.127 -3.099 6.737 1.00 0.00 H ATOM 1478 HG CYS A 95 31.539 -3.161 4.393 1.00 0.00 H ATOM 1479 H CYS A 95 33.816 -1.389 8.489 1.00 0.00 H ATOM 1480 N THR A 96 35.086 0.201 4.686 1.00 22.46 N ATOM 1481 CA THR A 96 35.132 1.452 3.957 1.00 23.56 C ATOM 1482 C THR A 96 34.771 1.219 2.520 1.00 22.36 C ATOM 1483 O THR A 96 34.963 0.121 1.985 1.00 22.46 O ATOM 1484 CB THR A 96 36.531 2.086 4.020 1.00 23.02 C ATOM 1485 OG1 THR A 96 37.493 1.161 3.489 1.00 25.15 O ATOM 1486 CG2 THR A 96 36.969 2.364 5.499 1.00 26.81 C ATOM 1487 HA THR A 96 34.417 2.132 4.421 1.00 0.00 H ATOM 1488 HB THR A 96 36.490 3.017 3.455 1.00 0.00 H ATOM 1489 HG1 THR A 96 37.264 0.952 2.549 1.00 0.00 H ATOM 1490 HG23 THR A 96 36.271 3.065 5.958 1.00 0.00 H ATOM 1491 HG21 THR A 96 36.967 1.429 6.059 1.00 0.00 H ATOM 1492 HG22 THR A 96 37.972 2.791 5.505 1.00 0.00 H ATOM 1493 H THR A 96 35.705 -0.576 4.380 1.00 0.00 H ATOM 1494 N LEU A 97 34.257 2.273 1.901 1.00 22.21 N ATOM 1495 CA LEU A 97 34.146 2.362 0.457 1.00 22.49 C ATOM 1496 C LEU A 97 35.402 3.009 -0.095 1.00 24.19 C ATOM 1497 O LEU A 97 35.979 3.917 0.494 1.00 25.02 O ATOM 1498 CB LEU A 97 32.927 3.187 0.044 1.00 23.00 C ATOM 1499 CG LEU A 97 31.595 2.469 0.056 1.00 21.33 C ATOM 1500 CD1 LEU A 97 30.452 3.505 -0.125 1.00 22.60 C ATOM 1501 CD2 LEU A 97 31.584 1.435 -1.059 1.00 22.78 C ATOM 1502 HA LEU A 97 34.027 1.356 0.055 1.00 0.00 H ATOM 1503 HB2 LEU A 97 32.853 4.035 0.725 1.00 0.00 H ATOM 1504 HB3 LEU A 97 33.099 3.550 -0.969 1.00 0.00 H ATOM 1505 HG LEU A 97 31.443 1.958 1.006 1.00 0.00 H ATOM 1506 HD21 LEU A 97 31.726 1.934 -2.017 1.00 0.00 H ATOM 1507 HD22 LEU A 97 32.391 0.720 -0.898 1.00 0.00 H ATOM 1508 HD23 LEU A 97 30.628 0.912 -1.058 1.00 0.00 H ATOM 1509 HD11 LEU A 97 30.485 4.227 0.691 1.00 0.00 H ATOM 1510 HD12 LEU A 97 30.580 4.023 -1.076 1.00 0.00 H ATOM 1511 HD13 LEU A 97 29.492 2.990 -0.117 1.00 0.00 H ATOM 1512 H LEU A 97 33.919 3.071 2.476 1.00 0.00 H ATOM 1513 N ASN A 98 35.870 2.508 -1.214 1.00 25.43 N ATOM 1514 CA ASN A 98 37.119 3.011 -1.745 1.00 28.06 C ATOM 1515 C ASN A 98 37.009 3.082 -3.228 1.00 28.69 C ATOM 1516 O ASN A 98 36.515 2.157 -3.854 1.00 27.63 O ATOM 1517 CB ASN A 98 38.285 2.086 -1.422 1.00 29.22 C ATOM 1518 CG ASN A 98 38.471 1.887 0.043 1.00 29.72 C ATOM 1519 OD1 ASN A 98 37.703 1.171 0.673 1.00 34.31 O ATOM 1520 ND2 ASN A 98 39.485 2.487 0.595 1.00 32.55 N ATOM 1521 HA ASN A 98 37.303 3.987 -1.296 1.00 0.00 H ATOM 1522 HB2 ASN A 98 38.101 1.117 -1.885 1.00 0.00 H ATOM 1523 HB3 ASN A 98 39.197 2.517 -1.834 1.00 0.00 H ATOM 1524 HD22 ASN A 98 40.111 3.086 0.020 1.00 0.00 H ATOM 1525 HD21 ASN A 98 39.670 2.368 1.612 1.00 0.00 H ATOM 1526 H ASN A 98 35.350 1.759 -1.713 1.00 0.00 H ATOM 1527 N PHE A 99 37.467 4.193 -3.775 1.00 29.22 N ATOM 1528 CA PHE A 99 37.580 4.329 -5.209 1.00 31.12 C ATOM 1529 C PHE A 99 38.551 5.469 -5.508 1.00 32.46 C ATOM 1530 O PHE A 99 38.962 6.187 -4.607 1.00 33.92 O ATOM 1531 CB PHE A 99 36.213 4.558 -5.841 1.00 30.47 C ATOM 1532 CG PHE A 99 35.565 5.862 -5.473 1.00 31.00 C ATOM 1533 CD1 PHE A 99 35.767 7.017 -6.251 1.00 32.38 C ATOM 1534 CD2 PHE A 99 34.696 5.930 -4.399 1.00 30.64 C ATOM 1535 CE1 PHE A 99 35.138 8.225 -5.919 1.00 31.83 C ATOM 1536 CE2 PHE A 99 34.064 7.124 -4.069 1.00 30.88 C ATOM 1537 CZ PHE A 99 34.284 8.269 -4.822 1.00 31.14 C ATOM 1538 HA PHE A 99 37.969 3.410 -5.646 1.00 0.00 H ATOM 1539 OXT PHE A 99 38.961 5.702 -6.629 1.00 33.48 O ATOM 1540 HB2 PHE A 99 36.330 4.530 -6.924 1.00 0.00 H ATOM 1541 HB3 PHE A 99 35.553 3.749 -5.527 1.00 0.00 H ATOM 1542 HD2 PHE A 99 34.504 5.037 -3.804 1.00 0.00 H ATOM 1543 HE2 PHE A 99 33.391 7.161 -3.213 1.00 0.00 H ATOM 1544 HZ PHE A 99 33.788 9.202 -4.554 1.00 0.00 H ATOM 1545 HE1 PHE A 99 35.316 9.120 -6.514 1.00 0.00 H ATOM 1546 HD1 PHE A 99 36.420 6.972 -7.122 1.00 0.00 H ATOM 1547 H PHE A 99 37.751 4.984 -3.163 1.00 0.00 H TER 1548 PHE A 99 ATOM 1549 N PRO B 1 39.011 8.306 -3.125 1.00 31.97 N ATOM 1550 CA PRO B 1 38.900 8.477 -1.694 1.00 32.04 C ATOM 1551 C PRO B 1 38.554 7.162 -0.982 1.00 31.79 C ATOM 1552 O PRO B 1 37.987 6.259 -1.576 1.00 31.27 O ATOM 1553 CB PRO B 1 37.717 9.443 -1.566 1.00 32.41 C ATOM 1554 CG PRO B 1 36.965 9.258 -2.800 1.00 32.79 C ATOM 1555 CD PRO B 1 38.019 9.123 -3.837 1.00 32.48 C ATOM 1556 HA PRO B 1 39.831 8.826 -1.246 1.00 0.00 H ATOM 1557 HD3 PRO B 1 37.644 8.614 -4.725 1.00 0.00 H ATOM 1558 HD2 PRO B 1 38.428 10.093 -4.121 1.00 0.00 H ATOM 1559 HG3 PRO B 1 36.329 10.120 -3.001 1.00 0.00 H ATOM 1560 HG2 PRO B 1 36.351 8.359 -2.750 1.00 0.00 H ATOM 1561 HB2 PRO B 1 37.105 9.192 -0.699 1.00 0.00 H ATOM 1562 HB3 PRO B 1 38.066 10.472 -1.477 1.00 0.00 H ATOM 1563 N GLN B 2 38.934 7.074 0.282 1.00 31.46 N ATOM 1564 CA GLN B 2 38.421 6.044 1.160 1.00 31.28 C ATOM 1565 C GLN B 2 37.328 6.693 1.994 1.00 30.54 C ATOM 1566 O GLN B 2 37.537 7.770 2.551 1.00 32.59 O ATOM 1567 CB GLN B 2 39.533 5.542 2.064 1.00 32.02 C ATOM 1568 CG GLN B 2 39.060 4.483 3.050 1.00 34.32 C ATOM 1569 CD GLN B 2 40.200 3.639 3.593 1.00 36.07 C ATOM 1570 OE1 GLN B 2 40.902 4.055 4.510 1.00 40.04 O ATOM 1571 NE2 GLN B 2 40.378 2.443 3.030 1.00 36.68 N ATOM 1572 HA GLN B 2 38.035 5.195 0.596 1.00 0.00 H ATOM 1573 HB2 GLN B 2 40.320 5.113 1.443 1.00 0.00 H ATOM 1574 HB3 GLN B 2 39.934 6.386 2.625 1.00 0.00 H ATOM 1575 HG2 GLN B 2 38.564 4.979 3.884 1.00 0.00 H ATOM 1576 HG3 GLN B 2 38.350 3.828 2.545 1.00 0.00 H ATOM 1577 HE22 GLN B 2 39.756 2.135 2.255 1.00 0.00 H ATOM 1578 HE21 GLN B 2 41.138 1.818 3.366 1.00 0.00 H ATOM 1579 H GLN B 2 39.619 7.762 0.654 1.00 0.00 H ATOM 1580 N ILE B 3 36.168 6.050 2.080 1.00 28.34 N ATOM 1581 CA ILE B 3 35.001 6.616 2.762 1.00 26.32 C ATOM 1582 C ILE B 3 34.649 5.639 3.892 1.00 26.57 C ATOM 1583 O ILE B 3 34.299 4.504 3.649 1.00 25.73 O ATOM 1584 CB ILE B 3 33.805 6.762 1.767 1.00 25.35 C ATOM 1585 CG1 ILE B 3 34.175 7.688 0.601 1.00 26.68 C ATOM 1586 CG2 ILE B 3 32.546 7.280 2.448 1.00 25.47 C ATOM 1587 CD1 ILE B 3 33.052 7.892 -0.415 1.00 24.88 C ATOM 1588 HA ILE B 3 35.213 7.611 3.154 1.00 0.00 H ATOM 1589 HB ILE B 3 33.594 5.763 1.386 1.00 0.00 H ATOM 1590 HG12 ILE B 3 34.448 8.661 1.010 1.00 0.00 H ATOM 1591 HG13 ILE B 3 35.033 7.260 0.082 1.00 0.00 H ATOM 1592 HD11 ILE B 3 32.773 6.930 -0.845 1.00 0.00 H ATOM 1593 HD12 ILE B 3 32.188 8.332 0.083 1.00 0.00 H ATOM 1594 HD13 ILE B 3 33.396 8.559 -1.206 1.00 0.00 H ATOM 1595 HG21 ILE B 3 32.248 6.587 3.235 1.00 0.00 H ATOM 1596 HG22 ILE B 3 32.746 8.260 2.882 1.00 0.00 H ATOM 1597 HG23 ILE B 3 31.745 7.363 1.713 1.00 0.00 H ATOM 1598 H ILE B 3 36.085 5.108 1.646 1.00 0.00 H ATOM 1599 N THR B 4 34.755 6.077 5.143 1.00 27.34 N ATOM 1600 CA THR B 4 34.277 5.212 6.227 1.00 27.25 C ATOM 1601 C THR B 4 32.747 5.382 6.289 1.00 26.26 C ATOM 1602 O THR B 4 32.172 6.206 5.603 1.00 26.15 O ATOM 1603 CB THR B 4 34.859 5.623 7.558 1.00 28.08 C ATOM 1604 OG1 THR B 4 34.520 6.985 7.774 1.00 28.27 O ATOM 1605 CG2 THR B 4 36.399 5.574 7.540 1.00 29.37 C ATOM 1606 HA THR B 4 34.576 4.182 6.033 1.00 0.00 H ATOM 1607 HB THR B 4 34.472 4.948 8.322 1.00 0.00 H ATOM 1608 HG1 THR B 4 33.535 7.081 7.784 1.00 0.00 H ATOM 1609 HG23 THR B 4 36.727 4.547 7.377 1.00 0.00 H ATOM 1610 HG21 THR B 4 36.772 6.208 6.736 1.00 0.00 H ATOM 1611 HG22 THR B 4 36.784 5.932 8.495 1.00 0.00 H ATOM 1612 H THR B 4 35.167 7.010 5.348 1.00 0.00 H ATOM 1613 N LEU B 5 32.103 4.617 7.151 1.00 24.63 N ATOM 1614 CA LEU B 5 30.666 4.544 7.088 1.00 23.64 C ATOM 1615 C LEU B 5 29.977 5.029 8.355 1.00 24.05 C ATOM 1616 O LEU B 5 28.792 4.742 8.579 1.00 23.10 O ATOM 1617 CB LEU B 5 30.269 3.106 6.761 1.00 21.60 C ATOM 1618 CG LEU B 5 30.708 2.647 5.351 1.00 20.17 C ATOM 1619 CD1 LEU B 5 30.557 1.129 5.251 1.00 19.62 C ATOM 1620 CD2 LEU B 5 29.918 3.333 4.280 1.00 18.47 C ATOM 1621 HA LEU B 5 30.329 5.222 6.304 1.00 0.00 H ATOM 1622 HB2 LEU B 5 30.728 2.446 7.497 1.00 0.00 H ATOM 1623 HB3 LEU B 5 29.184 3.024 6.828 1.00 0.00 H ATOM 1624 HG LEU B 5 31.752 2.920 5.201 1.00 0.00 H ATOM 1625 HD21 LEU B 5 28.860 3.101 4.405 1.00 0.00 H ATOM 1626 HD22 LEU B 5 30.066 4.410 4.355 1.00 0.00 H ATOM 1627 HD23 LEU B 5 30.254 2.985 3.303 1.00 0.00 H ATOM 1628 HD11 LEU B 5 31.184 0.652 6.005 1.00 0.00 H ATOM 1629 HD12 LEU B 5 29.515 0.857 5.418 1.00 0.00 H ATOM 1630 HD13 LEU B 5 30.865 0.799 4.259 1.00 0.00 H ATOM 1631 H LEU B 5 32.627 4.074 7.867 1.00 0.00 H ATOM 1632 N TRP B 6 30.708 5.806 9.158 1.00 25.57 N ATOM 1633 CA TRP B 6 30.139 6.395 10.361 1.00 27.35 C ATOM 1634 C TRP B 6 29.004 7.329 9.992 1.00 26.77 C ATOM 1635 O TRP B 6 28.072 7.512 10.756 1.00 27.74 O ATOM 1636 CB TRP B 6 31.223 7.123 11.162 1.00 28.92 C ATOM 1637 CG TRP B 6 32.259 6.149 11.574 1.00 30.21 C ATOM 1638 CD1 TRP B 6 33.407 5.870 10.928 1.00 32.24 C ATOM 1639 CD2 TRP B 6 32.198 5.274 12.694 1.00 32.18 C ATOM 1640 NE1 TRP B 6 34.095 4.877 11.587 1.00 33.62 N ATOM 1641 CE2 TRP B 6 33.374 4.500 12.686 1.00 32.78 C ATOM 1642 CE3 TRP B 6 31.260 5.055 13.706 1.00 31.67 C ATOM 1643 CZ2 TRP B 6 33.646 3.538 13.650 1.00 32.67 C ATOM 1644 CZ3 TRP B 6 31.539 4.110 14.672 1.00 32.93 C ATOM 1645 CH2 TRP B 6 32.715 3.353 14.631 1.00 32.40 C ATOM 1646 HA TRP B 6 29.736 5.603 10.992 1.00 0.00 H ATOM 1647 HB2 TRP B 6 31.676 7.898 10.543 1.00 0.00 H ATOM 1648 HB3 TRP B 6 30.779 7.580 12.046 1.00 0.00 H ATOM 1649 HE1 TRP B 6 35.011 4.479 11.297 1.00 0.00 H ATOM 1650 HD1 TRP B 6 33.743 6.360 10.014 1.00 0.00 H ATOM 1651 HZ2 TRP B 6 34.566 2.954 13.624 1.00 0.00 H ATOM 1652 HH2 TRP B 6 32.891 2.600 15.399 1.00 0.00 H ATOM 1653 HZ3 TRP B 6 30.829 3.950 15.483 1.00 0.00 H ATOM 1654 HE3 TRP B 6 30.327 5.619 13.732 1.00 0.00 H ATOM 1655 H TRP B 6 31.703 5.994 8.919 1.00 0.00 H ATOM 1656 N LYS B 7 29.066 7.878 8.776 1.00 26.17 N ATOM 1657 CA LYS B 7 27.994 8.700 8.177 1.00 25.42 C ATOM 1658 C LYS B 7 27.442 8.031 6.908 1.00 23.98 C ATOM 1659 O LYS B 7 28.077 7.103 6.406 1.00 22.84 O ATOM 1660 CB LYS B 7 28.553 10.078 7.811 1.00 26.32 C ATOM 1661 CG LYS B 7 29.011 10.862 9.027 1.00 28.97 C ATOM 1662 CD LYS B 7 27.810 11.351 9.830 1.00 32.59 C ATOM 1663 CE LYS B 7 28.218 11.971 11.157 1.00 35.56 C ATOM 1664 NZ LYS B 7 28.568 10.918 12.136 1.00 37.10 N ATOM 1665 HA LYS B 7 27.188 8.801 8.904 1.00 0.00 H ATOM 1666 HB2 LYS B 7 29.402 9.944 7.141 1.00 0.00 H ATOM 1667 HB3 LYS B 7 27.775 10.647 7.301 1.00 0.00 H ATOM 1668 HG2 LYS B 7 29.627 10.220 9.657 1.00 0.00 H ATOM 1669 HG3 LYS B 7 29.598 11.720 8.701 1.00 0.00 H ATOM 1670 HD2 LYS B 7 27.276 12.098 9.243 1.00 0.00 H ATOM 1671 HD3 LYS B 7 27.151 10.505 10.026 1.00 0.00 H ATOM 1672 HE2 LYS B 7 27.389 12.562 11.547 1.00 0.00 H ATOM 1673 HE3 LYS B 7 29.082 12.617 11.001 1.00 0.00 H ATOM 1674 HZ1 LYS B 7 27.745 10.302 12.290 1.00 0.00 H ATOM 1675 HZ2 LYS B 7 29.361 10.354 11.768 1.00 0.00 H ATOM 1676 HZ3 LYS B 7 28.844 11.361 13.036 1.00 0.00 H ATOM 1677 H LYS B 7 29.926 7.716 8.213 1.00 0.00 H ATOM 1678 N ARG B 8 26.296 8.493 6.379 1.00 22.99 N ATOM 1679 CA ARG B 8 25.876 8.039 5.055 1.00 21.75 C ATOM 1680 C ARG B 8 26.928 8.499 4.054 1.00 21.27 C ATOM 1681 O ARG B 8 27.338 9.671 4.055 1.00 20.69 O ATOM 1682 CB ARG B 8 24.495 8.540 4.666 1.00 22.19 C ATOM 1683 CG ARG B 8 23.394 7.967 5.527 1.00 23.32 C ATOM 1684 CD ARG B 8 22.019 8.428 5.135 1.00 24.24 C ATOM 1685 NE ARG B 8 21.014 8.046 6.129 1.00 26.45 N ATOM 1686 CZ ARG B 8 20.265 8.898 6.805 1.00 27.47 C ATOM 1687 NH1 ARG B 8 20.406 10.215 6.620 1.00 29.16 N ATOM 1688 NH2 ARG B 8 19.381 8.443 7.674 1.00 29.76 N ATOM 1689 HA ARG B 8 25.796 6.952 5.063 1.00 0.00 H ATOM 1690 HB2 ARG B 8 24.480 9.626 4.760 1.00 0.00 H ATOM 1691 HB3 ARG B 8 24.305 8.264 3.629 1.00 0.00 H ATOM 1692 HG2 ARG B 8 23.428 6.880 5.451 1.00 0.00 H ATOM 1693 HG3 ARG B 8 23.575 8.263 6.560 1.00 0.00 H ATOM 1694 HD2 ARG B 8 21.756 7.980 4.177 1.00 0.00 H ATOM 1695 HD3 ARG B 8 22.025 9.514 5.038 1.00 0.00 H ATOM 1696 HE ARG B 8 20.881 7.032 6.316 1.00 0.00 H ATOM 1697 HH12 ARG B 8 19.814 10.882 7.155 1.00 0.00 H ATOM 1698 HH11 ARG B 8 21.108 10.573 5.941 1.00 0.00 H ATOM 1699 HH22 ARG B 8 18.788 9.109 8.210 1.00 0.00 H ATOM 1700 HH21 ARG B 8 19.278 7.419 7.823 1.00 0.00 H ATOM 1701 H ARG B 8 25.711 9.170 6.909 1.00 0.00 H ATOM 1702 N PRO B 9 27.393 7.550 3.240 1.00 20.02 N ATOM 1703 CA PRO B 9 28.385 7.812 2.197 1.00 19.05 C ATOM 1704 C PRO B 9 27.764 8.593 1.058 1.00 17.69 C ATOM 1705 O PRO B 9 27.438 8.049 0.010 1.00 17.34 O ATOM 1706 CB PRO B 9 28.836 6.417 1.788 1.00 19.16 C ATOM 1707 CG PRO B 9 27.562 5.612 1.903 1.00 17.59 C ATOM 1708 CD PRO B 9 26.941 6.142 3.235 1.00 19.54 C ATOM 1709 HA PRO B 9 29.224 8.426 2.523 1.00 0.00 H ATOM 1710 HD3 PRO B 9 25.853 6.074 3.221 1.00 0.00 H ATOM 1711 HD2 PRO B 9 27.327 5.598 4.097 1.00 0.00 H ATOM 1712 HG3 PRO B 9 27.775 4.545 1.965 1.00 0.00 H ATOM 1713 HG2 PRO B 9 26.900 5.800 1.058 1.00 0.00 H ATOM 1714 HB2 PRO B 9 29.216 6.410 0.766 1.00 0.00 H ATOM 1715 HB3 PRO B 9 29.604 6.038 2.462 1.00 0.00 H ATOM 1716 N LEU B 10 27.638 9.901 1.275 1.00 18.21 N ATOM 1717 CA LEU B 10 27.123 10.810 0.268 1.00 19.01 C ATOM 1718 C LEU B 10 28.232 11.343 -0.634 1.00 19.89 C ATOM 1719 O LEU B 10 29.373 11.619 -0.199 1.00 22.29 O ATOM 1720 CB LEU B 10 26.412 11.982 0.958 1.00 19.87 C ATOM 1721 CG LEU B 10 25.234 11.560 1.846 1.00 20.97 C ATOM 1722 CD1 LEU B 10 24.490 12.740 2.404 1.00 27.30 C ATOM 1723 CD2 LEU B 10 24.278 10.775 1.009 1.00 23.98 C ATOM 1724 HA LEU B 10 26.422 10.258 -0.358 1.00 0.00 H ATOM 1725 HB2 LEU B 10 27.138 12.507 1.578 1.00 0.00 H ATOM 1726 HB3 LEU B 10 26.037 12.657 0.189 1.00 0.00 H ATOM 1727 HG LEU B 10 25.633 10.980 2.678 1.00 0.00 H ATOM 1728 HD21 LEU B 10 23.924 11.395 0.185 1.00 0.00 H ATOM 1729 HD22 LEU B 10 24.783 9.895 0.612 1.00 0.00 H ATOM 1730 HD23 LEU B 10 23.431 10.464 1.621 1.00 0.00 H ATOM 1731 HD11 LEU B 10 25.169 13.344 3.006 1.00 0.00 H ATOM 1732 HD12 LEU B 10 24.097 13.341 1.584 1.00 0.00 H ATOM 1733 HD13 LEU B 10 23.666 12.388 3.025 1.00 0.00 H ATOM 1734 H LEU B 10 27.919 10.285 2.200 1.00 0.00 H ATOM 1735 N VAL B 11 27.915 11.463 -1.907 1.00 19.40 N ATOM 1736 CA VAL B 11 28.822 12.032 -2.885 1.00 19.36 C ATOM 1737 C VAL B 11 28.038 13.010 -3.720 1.00 19.37 C ATOM 1738 O VAL B 11 26.810 12.902 -3.864 1.00 19.11 O ATOM 1739 CB VAL B 11 29.447 10.954 -3.869 1.00 19.10 C ATOM 1740 CG1 VAL B 11 30.443 10.033 -3.165 1.00 20.70 C ATOM 1741 CG2 VAL B 11 28.368 10.127 -4.609 1.00 19.21 C ATOM 1742 HA VAL B 11 29.645 12.493 -2.339 1.00 0.00 H ATOM 1743 HB VAL B 11 29.994 11.525 -4.619 1.00 0.00 H ATOM 1744 HG11 VAL B 11 31.258 10.628 -2.754 1.00 0.00 H ATOM 1745 HG12 VAL B 11 29.937 9.501 -2.359 1.00 0.00 H ATOM 1746 HG13 VAL B 11 30.841 9.315 -3.882 1.00 0.00 H ATOM 1747 HG21 VAL B 11 27.753 9.599 -3.880 1.00 0.00 H ATOM 1748 HG22 VAL B 11 27.741 10.795 -5.199 1.00 0.00 H ATOM 1749 HG23 VAL B 11 28.853 9.406 -5.268 1.00 0.00 H ATOM 1750 H VAL B 11 26.979 11.137 -2.222 1.00 0.00 H ATOM 1751 N THR B 12 28.740 13.965 -4.308 1.00 19.87 N ATOM 1752 CA THR B 12 28.107 14.912 -5.212 1.00 20.81 C ATOM 1753 C THR B 12 28.212 14.408 -6.645 1.00 20.77 C ATOM 1754 O THR B 12 29.314 14.135 -7.129 1.00 21.28 O ATOM 1755 CB THR B 12 28.752 16.300 -5.088 1.00 21.05 C ATOM 1756 OG1 THR B 12 28.562 16.804 -3.761 1.00 22.56 O ATOM 1757 CG2 THR B 12 28.003 17.305 -5.960 1.00 21.32 C ATOM 1758 HA THR B 12 27.055 15.001 -4.940 1.00 0.00 H ATOM 1759 HB THR B 12 29.801 16.193 -5.364 1.00 0.00 H ATOM 1760 HG1 THR B 12 28.979 17.699 -3.686 1.00 0.00 H ATOM 1761 HG23 THR B 12 28.086 17.010 -7.006 1.00 0.00 H ATOM 1762 HG21 THR B 12 26.953 17.325 -5.669 1.00 0.00 H ATOM 1763 HG22 THR B 12 28.437 18.296 -5.825 1.00 0.00 H ATOM 1764 H THR B 12 29.760 14.040 -4.121 1.00 0.00 H ATOM 1765 N ILE B 13 27.070 14.312 -7.326 1.00 20.60 N ATOM 1766 CA ILE B 13 27.029 13.812 -8.677 1.00 19.87 C ATOM 1767 C ILE B 13 26.606 14.973 -9.548 1.00 21.09 C ATOM 1768 O ILE B 13 25.945 15.944 -9.087 1.00 21.07 O ATOM 1769 CB ILE B 13 26.070 12.645 -8.826 1.00 19.39 C ATOM 1770 CG1 ILE B 13 24.619 13.105 -8.610 1.00 18.71 C ATOM 1771 CG2 ILE B 13 26.398 11.504 -7.808 1.00 20.47 C ATOM 1772 CD1 ILE B 13 23.546 12.051 -8.930 1.00 19.50 C ATOM 1773 HA ILE B 13 28.007 13.429 -8.968 1.00 0.00 H ATOM 1774 HB ILE B 13 26.186 12.260 -9.839 1.00 0.00 H ATOM 1775 HG12 ILE B 13 24.508 13.394 -7.565 1.00 0.00 H ATOM 1776 HG13 ILE B 13 24.441 13.972 -9.246 1.00 0.00 H ATOM 1777 HD11 ILE B 13 23.628 11.757 -9.977 1.00 0.00 H ATOM 1778 HD12 ILE B 13 23.695 11.178 -8.294 1.00 0.00 H ATOM 1779 HD13 ILE B 13 22.558 12.473 -8.746 1.00 0.00 H ATOM 1780 HG21 ILE B 13 27.412 11.144 -7.982 1.00 0.00 H ATOM 1781 HG22 ILE B 13 26.318 11.891 -6.792 1.00 0.00 H ATOM 1782 HG23 ILE B 13 25.692 10.685 -7.943 1.00 0.00 H ATOM 1783 H ILE B 13 26.183 14.606 -6.869 1.00 0.00 H ATOM 1784 N LYS B 14 27.000 14.879 -10.802 1.00 21.72 N ATOM 1785 CA LYS B 14 26.541 15.797 -11.816 1.00 22.85 C ATOM 1786 C LYS B 14 25.832 14.896 -12.801 1.00 22.70 C ATOM 1787 O LYS B 14 26.357 13.841 -13.202 1.00 22.13 O ATOM 1788 CB LYS B 14 27.701 16.555 -12.456 1.00 22.90 C ATOM 1789 CG LYS B 14 27.250 17.563 -13.536 1.00 23.78 C ATOM 1790 CD LYS B 14 28.377 18.485 -13.989 1.00 25.34 C ATOM 1791 CE LYS B 14 29.290 17.826 -15.001 1.00 27.83 C ATOM 1792 NZ LYS B 14 30.288 18.760 -15.630 1.00 30.51 N ATOM 1793 HA LYS B 14 25.892 16.580 -11.424 1.00 0.00 H ATOM 1794 HB2 LYS B 14 28.232 17.099 -11.675 1.00 0.00 H ATOM 1795 HB3 LYS B 14 28.375 15.832 -12.916 1.00 0.00 H ATOM 1796 HG2 LYS B 14 26.885 17.008 -14.400 1.00 0.00 H ATOM 1797 HG3 LYS B 14 26.443 18.172 -13.129 1.00 0.00 H ATOM 1798 HD2 LYS B 14 27.941 19.377 -14.439 1.00 0.00 H ATOM 1799 HD3 LYS B 14 28.967 18.771 -13.118 1.00 0.00 H ATOM 1800 HE2 LYS B 14 28.673 17.401 -15.793 1.00 0.00 H ATOM 1801 HE3 LYS B 14 29.837 17.028 -14.500 1.00 0.00 H ATOM 1802 HZ1 LYS B 14 29.783 19.523 -16.124 1.00 0.00 H ATOM 1803 HZ2 LYS B 14 30.895 19.167 -14.890 1.00 0.00 H ATOM 1804 HZ3 LYS B 14 30.874 18.233 -16.309 1.00 0.00 H ATOM 1805 H LYS B 14 27.661 14.121 -11.068 1.00 0.00 H ATOM 1806 N ILE B 15 24.605 15.277 -13.135 1.00 22.16 N ATOM 1807 CA ILE B 15 23.857 14.552 -14.109 1.00 23.56 C ATOM 1808 C ILE B 15 22.882 15.508 -14.757 1.00 24.86 C ATOM 1809 O ILE B 15 22.205 16.295 -14.073 1.00 24.24 O ATOM 1810 CB ILE B 15 23.099 13.376 -13.482 1.00 22.98 C ATOM 1811 CG1 ILE B 15 22.250 12.677 -14.569 1.00 24.02 C ATOM 1812 CG2 ILE B 15 22.311 13.796 -12.196 1.00 24.82 C ATOM 1813 CD1 ILE B 15 21.572 11.428 -14.114 1.00 24.04 C ATOM 1814 HA ILE B 15 24.542 14.136 -14.848 1.00 0.00 H ATOM 1815 HB ILE B 15 23.808 12.635 -13.113 1.00 0.00 H ATOM 1816 HG12 ILE B 15 21.485 13.377 -14.907 1.00 0.00 H ATOM 1817 HG13 ILE B 15 22.904 12.425 -15.403 1.00 0.00 H ATOM 1818 HD11 ILE B 15 22.322 10.709 -13.784 1.00 0.00 H ATOM 1819 HD12 ILE B 15 20.901 11.661 -13.287 1.00 0.00 H ATOM 1820 HD13 ILE B 15 21.000 11.005 -14.940 1.00 0.00 H ATOM 1821 HG21 ILE B 15 23.009 14.183 -11.454 1.00 0.00 H ATOM 1822 HG22 ILE B 15 21.586 14.568 -12.452 1.00 0.00 H ATOM 1823 HG23 ILE B 15 21.791 12.928 -11.790 1.00 0.00 H ATOM 1824 H ILE B 15 24.185 16.113 -12.681 1.00 0.00 H ATOM 1825 N GLY B 16 22.808 15.413 -16.072 1.00 26.04 N ATOM 1826 CA GLY B 16 21.923 16.279 -16.846 1.00 27.70 C ATOM 1827 C GLY B 16 22.149 17.740 -16.544 1.00 27.83 C ATOM 1828 O GLY B 16 21.183 18.538 -16.518 1.00 29.28 O ATOM 1829 HA3 GLY B 16 20.889 16.027 -16.609 1.00 0.00 H ATOM 1830 HA2 GLY B 16 22.103 16.107 -17.907 1.00 0.00 H ATOM 1831 H GLY B 16 23.391 14.708 -16.566 1.00 0.00 H ATOM 1832 N GLY B 17 23.414 18.095 -16.318 1.00 27.05 N ATOM 1833 CA GLY B 17 23.815 19.453 -15.992 1.00 27.14 C ATOM 1834 C GLY B 17 23.460 19.920 -14.597 1.00 25.88 C ATOM 1835 O GLY B 17 23.619 21.089 -14.282 1.00 26.95 O ATOM 1836 HA3 GLY B 17 23.335 20.125 -16.704 1.00 0.00 H ATOM 1837 HA2 GLY B 17 24.897 19.520 -16.104 1.00 0.00 H ATOM 1838 H GLY B 17 24.151 17.363 -16.378 1.00 0.00 H ATOM 1839 N GLN B 18 22.951 19.012 -13.771 1.00 24.71 N ATOM 1840 CA GLN B 18 22.510 19.362 -12.432 1.00 24.35 C ATOM 1841 C GLN B 18 23.383 18.686 -11.416 1.00 22.78 C ATOM 1842 O GLN B 18 23.805 17.543 -11.606 1.00 21.56 O ATOM 1843 CB GLN B 18 21.091 18.893 -12.218 1.00 25.51 C ATOM 1844 CG GLN B 18 20.110 19.610 -13.106 1.00 26.97 C ATOM 1845 CD GLN B 18 18.786 18.986 -13.018 1.00 29.65 C ATOM 1846 OE1 GLN B 18 18.106 19.175 -12.020 1.00 29.62 O ATOM 1847 NE2 GLN B 18 18.380 18.242 -14.061 1.00 31.03 N ATOM 1848 HA GLN B 18 22.569 20.445 -12.321 1.00 0.00 H ATOM 1849 HB2 GLN B 18 21.039 17.825 -12.429 1.00 0.00 H ATOM 1850 HB3 GLN B 18 20.817 19.070 -11.178 1.00 0.00 H ATOM 1851 HG2 GLN B 18 20.037 20.652 -12.793 1.00 0.00 H ATOM 1852 HG3 GLN B 18 20.460 19.565 -14.137 1.00 0.00 H ATOM 1853 HE22 GLN B 18 19.003 18.117 -14.884 1.00 0.00 H ATOM 1854 HE21 GLN B 18 17.443 17.792 -14.045 1.00 0.00 H ATOM 1855 H GLN B 18 22.866 18.026 -14.091 1.00 0.00 H ATOM 1856 N LEU B 19 23.584 19.366 -10.306 1.00 21.73 N ATOM 1857 CA LEU B 19 24.344 18.807 -9.210 1.00 22.68 C ATOM 1858 C LEU B 19 23.392 18.247 -8.195 1.00 21.36 C ATOM 1859 O LEU B 19 22.431 18.910 -7.813 1.00 21.69 O ATOM 1860 CB LEU B 19 25.141 19.914 -8.525 1.00 23.11 C ATOM 1861 CG LEU B 19 25.970 20.685 -9.513 1.00 24.63 C ATOM 1862 CD1 LEU B 19 26.702 21.768 -8.708 1.00 28.07 C ATOM 1863 CD2 LEU B 19 26.921 19.715 -10.230 1.00 26.86 C ATOM 1864 HA LEU B 19 25.011 18.035 -9.594 1.00 0.00 H ATOM 1865 HB2 LEU B 19 24.449 20.597 -8.033 1.00 0.00 H ATOM 1866 HB3 LEU B 19 25.800 19.468 -7.780 1.00 0.00 H ATOM 1867 HG LEU B 19 25.377 21.164 -10.292 1.00 0.00 H ATOM 1868 HD21 LEU B 19 27.571 19.237 -9.497 1.00 0.00 H ATOM 1869 HD22 LEU B 19 26.338 18.955 -10.751 1.00 0.00 H ATOM 1870 HD23 LEU B 19 27.526 20.267 -10.949 1.00 0.00 H ATOM 1871 HD11 LEU B 19 25.971 22.414 -8.221 1.00 0.00 H ATOM 1872 HD12 LEU B 19 27.331 21.295 -7.953 1.00 0.00 H ATOM 1873 HD13 LEU B 19 27.322 22.361 -9.380 1.00 0.00 H ATOM 1874 H LEU B 19 23.188 20.324 -10.216 1.00 0.00 H ATOM 1875 N LYS B 20 23.713 17.064 -7.708 1.00 20.57 N ATOM 1876 CA LYS B 20 22.889 16.374 -6.759 1.00 20.46 C ATOM 1877 C LYS B 20 23.788 15.701 -5.768 1.00 19.66 C ATOM 1878 O LYS B 20 24.977 15.506 -6.030 1.00 20.53 O ATOM 1879 CB LYS B 20 21.986 15.351 -7.469 1.00 20.68 C ATOM 1880 CG LYS B 20 20.958 16.062 -8.301 1.00 22.29 C ATOM 1881 CD LYS B 20 19.893 15.160 -8.894 1.00 26.15 C ATOM 1882 CE LYS B 20 18.746 16.062 -9.461 1.00 28.49 C ATOM 1883 NZ LYS B 20 18.040 16.844 -8.400 1.00 32.48 N ATOM 1884 HA LYS B 20 22.235 17.078 -6.245 1.00 0.00 H ATOM 1885 HB2 LYS B 20 22.596 14.717 -8.113 1.00 0.00 H ATOM 1886 HB3 LYS B 20 21.484 14.734 -6.724 1.00 0.00 H ATOM 1887 HG2 LYS B 20 20.465 16.803 -7.672 1.00 0.00 H ATOM 1888 HG3 LYS B 20 21.472 16.566 -9.120 1.00 0.00 H ATOM 1889 HD2 LYS B 20 20.322 14.561 -9.697 1.00 0.00 H ATOM 1890 HD3 LYS B 20 19.496 14.500 -8.122 1.00 0.00 H ATOM 1891 HE2 LYS B 20 18.019 15.425 -9.965 1.00 0.00 H ATOM 1892 HE3 LYS B 20 19.175 16.760 -10.180 1.00 0.00 H ATOM 1893 HZ1 LYS B 20 17.617 16.189 -7.712 1.00 0.00 H ATOM 1894 HZ2 LYS B 20 18.721 17.464 -7.917 1.00 0.00 H ATOM 1895 HZ3 LYS B 20 17.293 17.421 -8.836 1.00 0.00 H ATOM 1896 H LYS B 20 24.596 16.615 -8.024 1.00 0.00 H ATOM 1897 N GLU B 21 23.273 15.456 -4.588 1.00 18.97 N ATOM 1898 CA GLU B 21 23.982 14.581 -3.665 1.00 19.88 C ATOM 1899 C GLU B 21 23.324 13.214 -3.778 1.00 18.85 C ATOM 1900 O GLU B 21 22.108 13.099 -3.964 1.00 18.30 O ATOM 1901 CB GLU B 21 23.824 15.114 -2.263 1.00 21.28 C ATOM 1902 CG GLU B 21 24.756 14.519 -1.246 1.00 25.83 C ATOM 1903 CD GLU B 21 24.938 15.463 -0.075 1.00 30.75 C ATOM 1904 OE1 GLU B 21 25.977 16.195 -0.031 1.00 33.92 O ATOM 1905 OE2 GLU B 21 24.012 15.471 0.794 1.00 33.82 O ATOM 1906 HA GLU B 21 25.046 14.523 -3.895 1.00 0.00 H ATOM 1907 HB2 GLU B 21 23.995 16.190 -2.289 1.00 0.00 H ATOM 1908 HB3 GLU B 21 22.802 14.918 -1.940 1.00 0.00 H ATOM 1909 HG2 GLU B 21 24.341 13.577 -0.887 1.00 0.00 H ATOM 1910 HG3 GLU B 21 25.724 14.334 -1.711 1.00 0.00 H ATOM 1911 H GLU B 21 22.365 15.883 -4.313 1.00 0.00 H ATOM 1912 N ALA B 22 24.133 12.175 -3.676 1.00 17.40 N ATOM 1913 CA ALA B 22 23.627 10.837 -3.851 1.00 15.99 C ATOM 1914 C ALA B 22 24.361 9.924 -2.894 1.00 16.06 C ATOM 1915 O ALA B 22 25.514 10.182 -2.528 1.00 15.76 O ATOM 1916 CB ALA B 22 23.832 10.393 -5.256 1.00 15.68 C ATOM 1917 HA ALA B 22 22.558 10.808 -3.642 1.00 0.00 H ATOM 1918 HB1 ALA B 22 23.303 11.067 -5.930 1.00 0.00 H ATOM 1919 HB2 ALA B 22 24.897 10.407 -5.488 1.00 0.00 H ATOM 1920 HB3 ALA B 22 23.446 9.381 -5.376 1.00 0.00 H ATOM 1921 H ALA B 22 25.141 12.323 -3.468 1.00 0.00 H ATOM 1922 N LEU B 23 23.674 8.850 -2.526 1.00 14.70 N ATOM 1923 CA LEU B 23 24.194 7.882 -1.615 1.00 15.67 C ATOM 1924 C LEU B 23 24.899 6.789 -2.394 1.00 14.92 C ATOM 1925 O LEU B 23 24.321 6.176 -3.293 1.00 16.32 O ATOM 1926 CB LEU B 23 23.015 7.347 -0.844 1.00 17.13 C ATOM 1927 CG LEU B 23 23.241 6.255 0.174 1.00 19.92 C ATOM 1928 CD1 LEU B 23 24.059 6.834 1.326 1.00 23.75 C ATOM 1929 CD2 LEU B 23 21.879 5.662 0.625 1.00 20.72 C ATOM 1930 HA LEU B 23 24.925 8.309 -0.928 1.00 0.00 H ATOM 1931 HB2 LEU B 23 22.570 8.190 -0.315 1.00 0.00 H ATOM 1932 HB3 LEU B 23 22.304 6.961 -1.574 1.00 0.00 H ATOM 1933 HG LEU B 23 23.806 5.426 -0.253 1.00 0.00 H ATOM 1934 HD21 LEU B 23 21.271 6.449 1.071 1.00 0.00 H ATOM 1935 HD22 LEU B 23 21.361 5.247 -0.239 1.00 0.00 H ATOM 1936 HD23 LEU B 23 22.052 4.875 1.359 1.00 0.00 H ATOM 1937 HD11 LEU B 23 25.015 7.195 0.946 1.00 0.00 H ATOM 1938 HD12 LEU B 23 23.512 7.660 1.779 1.00 0.00 H ATOM 1939 HD13 LEU B 23 24.233 6.059 2.072 1.00 0.00 H ATOM 1940 H LEU B 23 22.720 8.708 -2.916 1.00 0.00 H ATOM 1941 N LEU B 24 26.164 6.536 -2.062 1.00 15.03 N ATOM 1942 CA LEU B 24 26.861 5.362 -2.622 1.00 14.87 C ATOM 1943 C LEU B 24 26.281 4.171 -1.923 1.00 15.52 C ATOM 1944 O LEU B 24 26.422 4.021 -0.693 1.00 16.50 O ATOM 1945 CB LEU B 24 28.347 5.439 -2.338 1.00 15.72 C ATOM 1946 CG LEU B 24 29.101 6.575 -3.056 1.00 16.51 C ATOM 1947 CD1 LEU B 24 30.523 6.492 -2.514 1.00 17.98 C ATOM 1948 CD2 LEU B 24 29.028 6.385 -4.544 1.00 18.33 C ATOM 1949 HA LEU B 24 26.734 5.308 -3.703 1.00 0.00 H ATOM 1950 HB2 LEU B 24 28.478 5.575 -1.264 1.00 0.00 H ATOM 1951 HB3 LEU B 24 28.797 4.493 -2.641 1.00 0.00 H ATOM 1952 HG LEU B 24 28.676 7.562 -2.874 1.00 0.00 H ATOM 1953 HD21 LEU B 24 29.482 5.430 -4.810 1.00 0.00 H ATOM 1954 HD22 LEU B 24 27.985 6.393 -4.859 1.00 0.00 H ATOM 1955 HD23 LEU B 24 29.565 7.194 -5.039 1.00 0.00 H ATOM 1956 HD11 LEU B 24 30.507 6.633 -1.433 1.00 0.00 H ATOM 1957 HD12 LEU B 24 30.943 5.514 -2.748 1.00 0.00 H ATOM 1958 HD13 LEU B 24 31.132 7.270 -2.975 1.00 0.00 H ATOM 1959 H LEU B 24 26.663 7.169 -1.405 1.00 0.00 H ATOM 1960 N ASP B 25 25.589 3.342 -2.678 1.00 14.98 N ATOM 1961 CA ASP B 25 24.711 2.390 -2.028 1.00 14.05 C ATOM 1962 C ASP B 25 25.024 0.976 -2.534 1.00 14.52 C ATOM 1963 O ASP B 25 24.534 0.560 -3.584 1.00 13.00 O ATOM 1964 CB ASP B 25 23.286 2.740 -2.386 1.00 14.79 C ATOM 1965 CG ASP B 25 22.292 1.868 -1.685 1.00 16.50 C ATOM 1966 OD1 ASP B 25 22.687 0.939 -0.955 1.00 15.89 O ATOM 1967 OD2 ASP B 25 21.083 2.057 -1.815 1.00 21.59 O ATOM 1968 HA ASP B 25 24.853 2.425 -0.948 1.00 0.00 H ATOM 1969 HB2 ASP B 25 23.100 3.777 -2.108 1.00 0.00 H ATOM 1970 HB3 ASP B 25 23.156 2.624 -3.462 1.00 0.00 H ATOM 1971 H ASP B 25 25.671 3.370 -3.714 1.00 0.00 H ATOM 1972 N THR B 26 25.830 0.243 -1.776 1.00 14.06 N ATOM 1973 CA THR B 26 26.206 -1.095 -2.209 1.00 14.71 C ATOM 1974 C THR B 26 25.030 -2.083 -2.174 1.00 14.28 C ATOM 1975 O THR B 26 25.141 -3.177 -2.731 1.00 16.41 O ATOM 1976 CB THR B 26 27.349 -1.671 -1.383 1.00 14.11 C ATOM 1977 OG1 THR B 26 26.985 -1.632 0.003 1.00 14.49 O ATOM 1978 CG2 THR B 26 28.625 -0.817 -1.456 1.00 13.95 C ATOM 1979 HA THR B 26 26.533 -0.973 -3.241 1.00 0.00 H ATOM 1980 HB THR B 26 27.530 -2.672 -1.776 1.00 0.00 H ATOM 1981 HG1 THR B 26 26.166 -2.170 0.143 1.00 0.00 H ATOM 1982 HG23 THR B 26 28.982 -0.787 -2.485 1.00 0.00 H ATOM 1983 HG21 THR B 26 28.403 0.195 -1.117 1.00 0.00 H ATOM 1984 HG22 THR B 26 29.391 -1.256 -0.817 1.00 0.00 H ATOM 1985 H THR B 26 26.191 0.622 -0.878 1.00 0.00 H ATOM 1986 N GLY B 27 23.943 -1.737 -1.495 1.00 14.33 N ATOM 1987 CA GLY B 27 22.754 -2.572 -1.475 1.00 17.18 C ATOM 1988 C GLY B 27 21.790 -2.250 -2.598 1.00 18.52 C ATOM 1989 O GLY B 27 20.628 -2.726 -2.597 1.00 20.64 O ATOM 1990 HA3 GLY B 27 22.242 -2.426 -0.524 1.00 0.00 H ATOM 1991 HA2 GLY B 27 23.059 -3.615 -1.566 1.00 0.00 H ATOM 1992 H GLY B 27 23.942 -0.844 -0.963 1.00 0.00 H ATOM 1993 N ALA B 28 22.233 -1.404 -3.528 1.00 17.40 N ATOM 1994 CA ALA B 28 21.386 -0.993 -4.659 1.00 17.96 C ATOM 1995 C ALA B 28 21.994 -1.575 -5.921 1.00 18.39 C ATOM 1996 O ALA B 28 23.144 -1.309 -6.236 1.00 17.35 O ATOM 1997 CB ALA B 28 21.297 0.541 -4.752 1.00 17.46 C ATOM 1998 HA ALA B 28 20.370 -1.362 -4.522 1.00 0.00 H ATOM 1999 HB1 ALA B 28 20.867 0.935 -3.831 1.00 0.00 H ATOM 2000 HB2 ALA B 28 22.296 0.954 -4.894 1.00 0.00 H ATOM 2001 HB3 ALA B 28 20.665 0.816 -5.596 1.00 0.00 H ATOM 2002 H ALA B 28 23.199 -1.026 -3.453 1.00 0.00 H ATOM 2003 N ASP B 29 21.224 -2.381 -6.659 1.00 20.16 N ATOM 2004 CA ASP B 29 21.728 -2.924 -7.904 1.00 21.39 C ATOM 2005 C ASP B 29 21.870 -1.797 -8.914 1.00 22.22 C ATOM 2006 O ASP B 29 22.852 -1.725 -9.664 1.00 23.09 O ATOM 2007 CB ASP B 29 20.701 -3.891 -8.496 1.00 22.43 C ATOM 2008 CG ASP B 29 20.350 -5.052 -7.569 1.00 23.44 C ATOM 2009 OD1 ASP B 29 21.136 -5.354 -6.652 1.00 24.44 O ATOM 2010 OD2 ASP B 29 19.298 -5.729 -7.744 1.00 26.07 O ATOM 2011 HA ASP B 29 22.678 -3.421 -7.707 1.00 0.00 H ATOM 2012 HB2 ASP B 29 19.789 -3.335 -8.713 1.00 0.00 H ATOM 2013 HB3 ASP B 29 21.105 -4.299 -9.422 1.00 0.00 H ATOM 2014 H ASP B 29 20.263 -2.618 -6.339 1.00 0.00 H ATOM 2015 N ASP B 30 20.867 -0.918 -8.901 1.00 21.80 N ATOM 2016 CA ASP B 30 20.655 0.117 -9.862 1.00 22.05 C ATOM 2017 C ASP B 30 20.798 1.492 -9.220 1.00 20.90 C ATOM 2018 O ASP B 30 20.799 1.641 -7.999 1.00 21.06 O ATOM 2019 CB ASP B 30 19.239 -0.034 -10.423 1.00 22.78 C ATOM 2020 CG ASP B 30 18.971 -1.444 -10.903 1.00 27.44 C ATOM 2021 OD1 ASP B 30 19.692 -1.875 -11.832 1.00 30.98 O ATOM 2022 OD2 ASP B 30 18.112 -2.218 -10.392 1.00 29.71 O ATOM 2023 HA ASP B 30 21.399 0.031 -10.654 1.00 0.00 H ATOM 2024 HB2 ASP B 30 18.521 0.215 -9.641 1.00 0.00 H ATOM 2025 HB3 ASP B 30 19.116 0.653 -11.260 1.00 0.00 H ATOM 2026 H ASP B 30 20.180 -0.993 -8.124 1.00 0.00 H ATOM 2027 N THR B 31 20.857 2.499 -10.063 1.00 20.34 N ATOM 2028 CA THR B 31 20.965 3.847 -9.621 1.00 19.93 C ATOM 2029 C THR B 31 19.602 4.510 -9.753 1.00 20.32 C ATOM 2030 O THR B 31 18.945 4.356 -10.783 1.00 20.20 O ATOM 2031 CB THR B 31 22.001 4.506 -10.502 1.00 20.53 C ATOM 2032 OG1 THR B 31 23.287 4.013 -10.095 1.00 19.63 O ATOM 2033 CG2 THR B 31 22.029 6.038 -10.264 1.00 19.58 C ATOM 2034 HA THR B 31 21.270 3.927 -8.578 1.00 0.00 H ATOM 2035 HB THR B 31 21.768 4.293 -11.545 1.00 0.00 H ATOM 2036 HG1 THR B 31 23.312 3.030 -10.205 1.00 0.00 H ATOM 2037 HG23 THR B 31 21.071 6.468 -10.558 1.00 0.00 H ATOM 2038 HG21 THR B 31 22.209 6.237 -9.208 1.00 0.00 H ATOM 2039 HG22 THR B 31 22.826 6.482 -10.860 1.00 0.00 H ATOM 2040 H THR B 31 20.824 2.304 -11.084 1.00 0.00 H ATOM 2041 N VAL B 32 19.148 5.152 -8.676 1.00 19.88 N ATOM 2042 CA VAL B 32 17.781 5.695 -8.601 1.00 21.41 C ATOM 2043 C VAL B 32 17.889 7.122 -8.111 1.00 21.51 C ATOM 2044 O VAL B 32 18.429 7.398 -7.026 1.00 21.70 O ATOM 2045 CB VAL B 32 16.845 4.978 -7.629 1.00 21.11 C ATOM 2046 CG1 VAL B 32 15.442 5.424 -7.952 1.00 21.92 C ATOM 2047 CG2 VAL B 32 16.979 3.454 -7.700 1.00 23.97 C ATOM 2048 HA VAL B 32 17.356 5.579 -9.598 1.00 0.00 H ATOM 2049 HB VAL B 32 17.109 5.241 -6.605 1.00 0.00 H ATOM 2050 HG11 VAL B 32 15.368 6.505 -7.830 1.00 0.00 H ATOM 2051 HG12 VAL B 32 15.205 5.156 -8.982 1.00 0.00 H ATOM 2052 HG13 VAL B 32 14.741 4.932 -7.277 1.00 0.00 H ATOM 2053 HG21 VAL B 32 16.739 3.116 -8.708 1.00 0.00 H ATOM 2054 HG22 VAL B 32 18.002 3.169 -7.453 1.00 0.00 H ATOM 2055 HG23 VAL B 32 16.291 2.997 -6.989 1.00 0.00 H ATOM 2056 H VAL B 32 19.782 5.274 -7.860 1.00 0.00 H ATOM 2057 N LEU B 33 17.406 8.031 -8.936 1.00 22.10 N ATOM 2058 CA LEU B 33 17.483 9.413 -8.623 1.00 23.43 C ATOM 2059 C LEU B 33 16.096 9.946 -8.463 1.00 24.95 C ATOM 2060 O LEU B 33 15.150 9.456 -9.110 1.00 25.01 O ATOM 2061 CB LEU B 33 18.160 10.190 -9.756 1.00 23.34 C ATOM 2062 CG LEU B 33 19.619 9.799 -9.955 1.00 23.38 C ATOM 2063 CD1 LEU B 33 20.207 10.800 -10.876 1.00 25.34 C ATOM 2064 CD2 LEU B 33 20.370 9.762 -8.618 1.00 22.31 C ATOM 2065 HA LEU B 33 18.063 9.531 -7.708 1.00 0.00 H ATOM 2066 HB2 LEU B 33 17.619 9.997 -10.682 1.00 0.00 H ATOM 2067 HB3 LEU B 33 18.113 11.254 -9.524 1.00 0.00 H ATOM 2068 HG LEU B 33 19.698 8.796 -10.375 1.00 0.00 H ATOM 2069 HD21 LEU B 33 20.333 10.748 -8.155 1.00 0.00 H ATOM 2070 HD22 LEU B 33 19.900 9.032 -7.959 1.00 0.00 H ATOM 2071 HD23 LEU B 33 21.408 9.480 -8.794 1.00 0.00 H ATOM 2072 HD11 LEU B 33 19.668 10.782 -11.823 1.00 0.00 H ATOM 2073 HD12 LEU B 33 20.128 11.792 -10.431 1.00 0.00 H ATOM 2074 HD13 LEU B 33 21.256 10.560 -11.049 1.00 0.00 H ATOM 2075 H LEU B 33 16.963 7.731 -9.828 1.00 0.00 H ATOM 2076 N GLU B 34 15.988 10.956 -7.608 1.00 27.20 N ATOM 2077 CA GLU B 34 14.730 11.681 -7.410 1.00 31.34 C ATOM 2078 C GLU B 34 14.284 12.282 -8.740 1.00 34.08 C ATOM 2079 O GLU B 34 15.076 12.416 -9.701 1.00 32.66 O ATOM 2080 CB GLU B 34 14.893 12.779 -6.332 1.00 31.02 C ATOM 2081 CG GLU B 34 15.297 12.247 -4.951 1.00 32.33 C ATOM 2082 CD GLU B 34 15.704 13.337 -3.945 1.00 33.85 C ATOM 2083 OE1 GLU B 34 16.472 14.266 -4.310 1.00 36.80 O ATOM 2084 OE2 GLU B 34 15.262 13.263 -2.769 1.00 38.13 O ATOM 2085 HA GLU B 34 13.966 10.988 -7.057 1.00 0.00 H ATOM 2086 HB2 GLU B 34 15.660 13.477 -6.668 1.00 0.00 H ATOM 2087 HB3 GLU B 34 13.943 13.305 -6.232 1.00 0.00 H ATOM 2088 HG2 GLU B 34 14.452 11.698 -4.536 1.00 0.00 H ATOM 2089 HG3 GLU B 34 16.141 11.569 -5.080 1.00 0.00 H ATOM 2090 H GLU B 34 16.824 11.242 -7.060 1.00 0.00 H ATOM 2091 N GLU B 35 12.998 12.623 -8.813 1.00 39.07 N ATOM 2092 CA GLU B 35 12.449 13.278 -9.995 1.00 43.80 C ATOM 2093 C GLU B 35 13.350 14.385 -10.503 1.00 45.73 C ATOM 2094 O GLU B 35 13.709 15.327 -9.781 1.00 47.11 O ATOM 2095 CB GLU B 35 11.044 13.836 -9.725 1.00 44.39 C ATOM 2096 CG GLU B 35 10.389 14.458 -10.952 1.00 47.44 C ATOM 2097 CD GLU B 35 10.341 13.502 -12.129 1.00 50.65 C ATOM 2098 OE1 GLU B 35 9.975 12.321 -11.936 1.00 51.38 O ATOM 2099 OE2 GLU B 35 10.680 13.936 -13.248 1.00 52.43 O ATOM 2100 HA GLU B 35 12.382 12.512 -10.768 1.00 0.00 H ATOM 2101 HB2 GLU B 35 10.411 13.022 -9.372 1.00 0.00 H ATOM 2102 HB3 GLU B 35 11.119 14.599 -8.950 1.00 0.00 H ATOM 2103 HG2 GLU B 35 9.370 14.749 -10.696 1.00 0.00 H ATOM 2104 HG3 GLU B 35 10.957 15.342 -11.242 1.00 0.00 H ATOM 2105 H GLU B 35 12.371 12.417 -8.009 1.00 0.00 H ATOM 2106 N MET B 36 13.718 14.256 -11.759 1.00 46.69 N ATOM 2107 CA MET B 36 14.605 15.202 -12.361 1.00 47.37 C ATOM 2108 C MET B 36 14.372 15.159 -13.835 1.00 49.33 C ATOM 2109 O MET B 36 14.068 14.099 -14.413 1.00 49.30 O ATOM 2110 CB MET B 36 16.060 14.864 -12.072 1.00 46.97 C ATOM 2111 CG MET B 36 16.504 13.543 -12.678 1.00 45.51 C ATOM 2112 SD MET B 36 18.261 13.520 -12.879 1.00 42.78 S ATOM 2113 CE MET B 36 18.782 14.259 -11.371 1.00 42.66 C ATOM 2114 HA MET B 36 14.410 16.193 -11.952 1.00 0.00 H ATOM 2115 HB2 MET B 36 16.687 15.658 -12.477 1.00 0.00 H ATOM 2116 HB3 MET B 36 16.195 14.812 -10.992 1.00 0.00 H ATOM 2117 HG2 MET B 36 16.029 13.415 -13.651 1.00 0.00 H ATOM 2118 HG3 MET B 36 16.206 12.727 -12.020 1.00 0.00 H ATOM 2119 HE1 MET B 36 18.365 15.264 -11.297 1.00 0.00 H ATOM 2120 HE2 MET B 36 18.432 13.657 -10.533 1.00 0.00 H ATOM 2121 HE3 MET B 36 19.870 14.313 -11.351 1.00 0.00 H ATOM 2122 H MET B 36 13.360 13.457 -12.320 1.00 0.00 H ATOM 2123 N ALA B 37 14.513 16.340 -14.423 1.00 50.92 N ATOM 2124 CA ALA B 37 14.450 16.516 -15.845 1.00 52.22 C ATOM 2125 C ALA B 37 15.677 15.866 -16.467 1.00 52.06 C ATOM 2126 O ALA B 37 16.796 16.387 -16.357 1.00 52.67 O ATOM 2127 CB ALA B 37 14.403 18.006 -16.164 1.00 52.05 C ATOM 2128 HA ALA B 37 13.554 16.049 -16.253 1.00 0.00 H ATOM 2129 HB1 ALA B 37 13.521 18.448 -15.701 1.00 0.00 H ATOM 2130 HB2 ALA B 37 15.300 18.488 -15.774 1.00 0.00 H ATOM 2131 HB3 ALA B 37 14.355 18.144 -17.244 1.00 0.00 H ATOM 2132 H ALA B 37 14.677 17.176 -13.826 1.00 0.00 H ATOM 2133 N LEU B 38 15.473 14.704 -17.074 1.00 51.69 N ATOM 2134 CA LEU B 38 16.500 14.120 -17.916 1.00 51.42 C ATOM 2135 C LEU B 38 16.003 14.214 -19.334 1.00 53.02 C ATOM 2136 O LEU B 38 14.807 14.117 -19.576 1.00 53.00 O ATOM 2137 CB LEU B 38 16.807 12.659 -17.559 1.00 50.58 C ATOM 2138 CG LEU B 38 17.751 12.412 -16.383 1.00 46.87 C ATOM 2139 CD1 LEU B 38 17.995 10.921 -16.252 1.00 42.82 C ATOM 2140 CD2 LEU B 38 19.062 13.176 -16.536 1.00 43.95 C ATOM 2141 HA LEU B 38 17.434 14.663 -17.772 1.00 0.00 H ATOM 2142 HB2 LEU B 38 15.860 12.171 -17.328 1.00 0.00 H ATOM 2143 HB3 LEU B 38 17.249 12.192 -18.439 1.00 0.00 H ATOM 2144 HG LEU B 38 17.283 12.785 -15.472 1.00 0.00 H ATOM 2145 HD21 LEU B 38 19.563 12.856 -17.450 1.00 0.00 H ATOM 2146 HD22 LEU B 38 18.854 14.245 -16.589 1.00 0.00 H ATOM 2147 HD23 LEU B 38 19.703 12.971 -15.678 1.00 0.00 H ATOM 2148 HD11 LEU B 38 17.047 10.413 -16.076 1.00 0.00 H ATOM 2149 HD12 LEU B 38 18.445 10.546 -17.171 1.00 0.00 H ATOM 2150 HD13 LEU B 38 18.668 10.736 -15.415 1.00 0.00 H ATOM 2151 H LEU B 38 14.568 14.207 -16.945 1.00 0.00 H ATOM 2152 N PRO B 39 16.918 14.443 -20.270 1.00 54.34 N ATOM 2153 CA PRO B 39 16.541 14.463 -21.670 1.00 56.09 C ATOM 2154 C PRO B 39 16.425 13.018 -22.165 1.00 57.48 C ATOM 2155 O PRO B 39 16.985 12.113 -21.537 1.00 57.36 O ATOM 2156 CB PRO B 39 17.717 15.183 -22.329 1.00 55.57 C ATOM 2157 CG PRO B 39 18.904 14.869 -21.464 1.00 54.97 C ATOM 2158 CD PRO B 39 18.358 14.708 -20.075 1.00 54.17 C ATOM 2159 HA PRO B 39 15.588 14.949 -21.881 1.00 0.00 H ATOM 2160 HD3 PRO B 39 18.838 13.872 -19.567 1.00 0.00 H ATOM 2161 HD2 PRO B 39 18.507 15.618 -19.494 1.00 0.00 H ATOM 2162 HG3 PRO B 39 19.626 15.685 -21.497 1.00 0.00 H ATOM 2163 HG2 PRO B 39 19.383 13.947 -21.794 1.00 0.00 H ATOM 2164 HB2 PRO B 39 17.873 14.813 -23.342 1.00 0.00 H ATOM 2165 HB3 PRO B 39 17.539 16.258 -22.359 1.00 0.00 H ATOM 2166 N GLY B 40 15.678 12.819 -23.255 1.00 59.61 N ATOM 2167 CA GLY B 40 15.676 11.549 -23.980 1.00 61.10 C ATOM 2168 C GLY B 40 14.554 10.585 -23.651 1.00 61.80 C ATOM 2169 O GLY B 40 13.666 10.892 -22.848 1.00 61.97 O ATOM 2170 HA3 GLY B 40 16.619 11.045 -23.768 1.00 0.00 H ATOM 2171 HA2 GLY B 40 15.617 11.775 -25.045 1.00 0.00 H ATOM 2172 H GLY B 40 15.077 13.595 -23.600 1.00 0.00 H ATOM 2173 N LYS B 41 14.615 9.414 -24.287 1.00 61.72 N ATOM 2174 CA LYS B 41 13.609 8.360 -24.143 1.00 60.81 C ATOM 2175 C LYS B 41 13.810 7.620 -22.834 1.00 59.81 C ATOM 2176 O LYS B 41 14.857 7.754 -22.203 1.00 59.19 O ATOM 2177 CB LYS B 41 13.715 7.360 -25.297 1.00 61.33 C ATOM 2178 CG LYS B 41 14.977 6.488 -25.269 1.00 61.44 C ATOM 2179 CD LYS B 41 15.771 6.239 -26.619 1.00 55.63 C ATOM 2180 CE LYS B 41 17.251 5.885 -26.566 1.00 52.36 C ATOM 2181 NZ LYS B 41 17.864 5.833 -27.917 1.00 57.39 N ATOM 2182 HA LYS B 41 12.624 8.827 -24.155 1.00 0.00 H ATOM 2183 HB2 LYS B 41 12.846 6.703 -25.260 1.00 0.00 H ATOM 2184 HB3 LYS B 41 13.707 7.918 -26.233 1.00 0.00 H ATOM 2185 HG2 LYS B 41 15.672 6.954 -24.571 1.00 0.00 H ATOM 2186 HG3 LYS B 41 14.682 5.511 -24.887 1.00 0.00 H ATOM 2187 HD2 LYS B 41 15.268 5.422 -27.136 1.00 0.00 H ATOM 2188 HD3 LYS B 41 15.684 7.150 -27.211 1.00 0.00 H ATOM 2189 HE2 LYS B 41 17.362 4.910 -26.092 1.00 0.00 H ATOM 2190 HE3 LYS B 41 17.771 6.637 -25.973 1.00 0.00 H ATOM 2191 HZ1 LYS B 41 17.379 5.112 -28.489 1.00 0.00 H ATOM 2192 HZ2 LYS B 41 17.770 6.762 -28.375 1.00 0.00 H ATOM 2193 HZ3 LYS B 41 18.871 5.589 -27.830 1.00 0.00 H ATOM 2194 H LYS B 41 15.422 9.240 -24.920 1.00 0.00 H ATOM 2195 N TRP B 42 12.815 6.824 -22.453 1.00 58.48 N ATOM 2196 CA TRP B 42 12.894 5.990 -21.254 1.00 57.33 C ATOM 2197 C TRP B 42 11.988 4.776 -21.373 1.00 56.68 C ATOM 2198 O TRP B 42 11.173 4.689 -22.294 1.00 56.47 O ATOM 2199 CB TRP B 42 12.553 6.798 -20.005 1.00 57.55 C ATOM 2200 CG TRP B 42 11.247 7.515 -20.051 1.00 58.48 C ATOM 2201 CD1 TRP B 42 11.026 8.790 -20.504 1.00 58.07 C ATOM 2202 CD2 TRP B 42 9.974 7.026 -19.599 1.00 58.72 C ATOM 2203 NE1 TRP B 42 9.696 9.117 -20.367 1.00 59.13 N ATOM 2204 CE2 TRP B 42 9.025 8.055 -19.818 1.00 59.01 C ATOM 2205 CE3 TRP B 42 9.532 5.815 -19.042 1.00 58.21 C ATOM 2206 CZ2 TRP B 42 7.667 7.913 -19.495 1.00 58.44 C ATOM 2207 CZ3 TRP B 42 8.175 5.678 -18.718 1.00 59.00 C ATOM 2208 CH2 TRP B 42 7.265 6.724 -18.950 1.00 58.56 C ATOM 2209 HA TRP B 42 13.921 5.637 -21.160 1.00 0.00 H ATOM 2210 HB2 TRP B 42 12.533 6.115 -19.156 1.00 0.00 H ATOM 2211 HB3 TRP B 42 13.339 7.538 -19.856 1.00 0.00 H ATOM 2212 HE1 TRP B 42 9.268 10.026 -20.637 1.00 0.00 H ATOM 2213 HD1 TRP B 42 11.792 9.449 -20.913 1.00 0.00 H ATOM 2214 HZ2 TRP B 42 6.957 8.721 -19.672 1.00 0.00 H ATOM 2215 HH2 TRP B 42 6.216 6.585 -18.690 1.00 0.00 H ATOM 2216 HZ3 TRP B 42 7.820 4.746 -18.279 1.00 0.00 H ATOM 2217 HE3 TRP B 42 10.231 4.997 -18.865 1.00 0.00 H ATOM 2218 H TRP B 42 11.949 6.793 -23.029 1.00 0.00 H ATOM 2219 N LYS B 43 12.153 3.826 -20.458 1.00 54.87 N ATOM 2220 CA LYS B 43 11.272 2.674 -20.353 1.00 53.36 C ATOM 2221 C LYS B 43 10.759 2.592 -18.912 1.00 51.90 C ATOM 2222 O LYS B 43 11.502 2.885 -17.966 1.00 51.11 O ATOM 2223 CB LYS B 43 12.007 1.382 -20.719 1.00 53.92 C ATOM 2224 CG LYS B 43 12.587 1.322 -22.139 1.00 54.38 C ATOM 2225 CD LYS B 43 11.567 0.887 -23.174 1.00 57.06 C ATOM 2226 CE LYS B 43 12.154 0.986 -24.578 1.00 57.43 C ATOM 2227 NZ LYS B 43 11.240 0.425 -25.605 1.00 59.68 N ATOM 2228 HA LYS B 43 10.441 2.790 -21.049 1.00 0.00 H ATOM 2229 HB2 LYS B 43 12.830 1.254 -20.016 1.00 0.00 H ATOM 2230 HB3 LYS B 43 11.305 0.555 -20.609 1.00 0.00 H ATOM 2231 HG2 LYS B 43 12.955 2.312 -22.407 1.00 0.00 H ATOM 2232 HG3 LYS B 43 13.415 0.614 -22.147 1.00 0.00 H ATOM 2233 HD2 LYS B 43 11.275 -0.145 -22.979 1.00 0.00 H ATOM 2234 HD3 LYS B 43 10.690 1.530 -23.106 1.00 0.00 H ATOM 2235 HE2 LYS B 43 13.095 0.436 -24.606 1.00 0.00 H ATOM 2236 HE3 LYS B 43 12.341 2.035 -24.808 1.00 0.00 H ATOM 2237 HZ1 LYS B 43 11.061 -0.578 -25.397 1.00 0.00 H ATOM 2238 HZ2 LYS B 43 10.341 0.949 -25.591 1.00 0.00 H ATOM 2239 HZ3 LYS B 43 11.679 0.513 -26.544 1.00 0.00 H ATOM 2240 H LYS B 43 12.945 3.910 -19.789 1.00 0.00 H ATOM 2241 N PRO B 44 9.490 2.224 -18.736 1.00 50.64 N ATOM 2242 CA PRO B 44 8.931 2.029 -17.399 1.00 48.76 C ATOM 2243 C PRO B 44 9.539 0.804 -16.754 1.00 46.79 C ATOM 2244 O PRO B 44 9.741 -0.220 -17.395 1.00 46.53 O ATOM 2245 CB PRO B 44 7.439 1.822 -17.671 1.00 48.88 C ATOM 2246 CG PRO B 44 7.411 1.255 -19.025 1.00 49.24 C ATOM 2247 CD PRO B 44 8.485 1.973 -19.788 1.00 50.32 C ATOM 2248 HA PRO B 44 9.125 2.859 -16.719 1.00 0.00 H ATOM 2249 HD3 PRO B 44 8.891 1.349 -20.584 1.00 0.00 H ATOM 2250 HD2 PRO B 44 8.114 2.906 -20.213 1.00 0.00 H ATOM 2251 HG3 PRO B 44 6.439 1.423 -19.488 1.00 0.00 H ATOM 2252 HG2 PRO B 44 7.617 0.185 -18.994 1.00 0.00 H ATOM 2253 HB2 PRO B 44 7.004 1.130 -16.950 1.00 0.00 H ATOM 2254 HB3 PRO B 44 6.901 2.769 -17.634 1.00 0.00 H ATOM 2255 N ARG B 45 9.865 0.924 -15.480 1.00 44.41 N ATOM 2256 CA ARG B 45 10.541 -0.137 -14.787 1.00 41.93 C ATOM 2257 C ARG B 45 10.045 -0.063 -13.347 1.00 40.48 C ATOM 2258 O ARG B 45 9.416 0.912 -12.949 1.00 39.41 O ATOM 2259 CB ARG B 45 12.046 0.123 -14.885 1.00 42.06 C ATOM 2260 CG ARG B 45 12.952 -1.076 -14.865 1.00 44.24 C ATOM 2261 CD ARG B 45 14.109 -0.872 -13.906 1.00 44.76 C ATOM 2262 NE ARG B 45 15.248 -1.766 -14.120 1.00 46.29 N ATOM 2263 CZ ARG B 45 15.337 -2.981 -13.608 1.00 47.22 C ATOM 2264 NH1 ARG B 45 14.338 -3.469 -12.868 1.00 46.26 N ATOM 2265 NH2 ARG B 45 16.411 -3.722 -13.846 1.00 46.97 N ATOM 2266 HA ARG B 45 10.347 -1.127 -15.199 1.00 0.00 H ATOM 2267 HB2 ARG B 45 12.227 0.656 -15.818 1.00 0.00 H ATOM 2268 HB3 ARG B 45 12.325 0.759 -14.045 1.00 0.00 H ATOM 2269 HG2 ARG B 45 12.380 -1.949 -14.552 1.00 0.00 H ATOM 2270 HG3 ARG B 45 13.346 -1.241 -15.868 1.00 0.00 H ATOM 2271 HD2 ARG B 45 13.741 -1.028 -12.892 1.00 0.00 H ATOM 2272 HD3 ARG B 45 14.459 0.155 -14.010 1.00 0.00 H ATOM 2273 HE ARG B 45 16.034 -1.425 -14.710 1.00 0.00 H ATOM 2274 HH12 ARG B 45 14.408 -4.425 -12.465 1.00 0.00 H ATOM 2275 HH11 ARG B 45 13.490 -2.893 -12.695 1.00 0.00 H ATOM 2276 HH22 ARG B 45 16.482 -4.678 -13.444 1.00 0.00 H ATOM 2277 HH21 ARG B 45 17.182 -3.347 -14.435 1.00 0.00 H ATOM 2278 H ARG B 45 9.629 1.800 -14.971 1.00 0.00 H ATOM 2279 N MET B 46 10.278 -1.112 -12.577 1.00 39.15 N ATOM 2280 CA MET B 46 9.879 -1.094 -11.174 1.00 39.24 C ATOM 2281 C MET B 46 11.074 -1.527 -10.348 1.00 36.59 C ATOM 2282 O MET B 46 11.851 -2.372 -10.769 1.00 36.98 O ATOM 2283 CB MET B 46 8.660 -1.986 -10.934 1.00 39.81 C ATOM 2284 CG MET B 46 7.373 -1.528 -11.658 1.00 42.26 C ATOM 2285 SD MET B 46 5.839 -1.837 -10.743 1.00 44.58 S ATOM 2286 CE MET B 46 4.625 -1.482 -12.007 1.00 42.13 C ATOM 2287 HA MET B 46 9.577 -0.089 -10.878 1.00 0.00 H ATOM 2288 HB2 MET B 46 8.903 -2.992 -11.276 1.00 0.00 H ATOM 2289 HB3 MET B 46 8.459 -2.006 -9.863 1.00 0.00 H ATOM 2290 HG2 MET B 46 7.313 -2.055 -12.610 1.00 0.00 H ATOM 2291 HG3 MET B 46 7.449 -0.456 -11.842 1.00 0.00 H ATOM 2292 HE1 MET B 46 4.738 -0.450 -12.338 1.00 0.00 H ATOM 2293 HE2 MET B 46 4.775 -2.154 -12.852 1.00 0.00 H ATOM 2294 HE3 MET B 46 3.625 -1.627 -11.599 1.00 0.00 H ATOM 2295 H MET B 46 10.747 -1.952 -12.972 1.00 0.00 H ATOM 2296 N ILE B 47 11.266 -0.907 -9.200 1.00 33.98 N ATOM 2297 CA ILE B 47 12.329 -1.349 -8.313 1.00 32.13 C ATOM 2298 C ILE B 47 11.695 -1.697 -6.994 1.00 31.20 C ATOM 2299 O ILE B 47 10.703 -1.096 -6.601 1.00 30.84 O ATOM 2300 CB ILE B 47 13.429 -0.285 -8.122 1.00 32.56 C ATOM 2301 CG1 ILE B 47 12.816 1.071 -7.773 1.00 32.68 C ATOM 2302 CG2 ILE B 47 14.326 -0.214 -9.352 1.00 32.67 C ATOM 2303 CD1 ILE B 47 13.760 1.987 -7.057 1.00 33.32 C ATOM 2304 HA ILE B 47 12.827 -2.212 -8.755 1.00 0.00 H ATOM 2305 HB ILE B 47 14.058 -0.577 -7.281 1.00 0.00 H ATOM 2306 HG12 ILE B 47 12.499 1.555 -8.697 1.00 0.00 H ATOM 2307 HG13 ILE B 47 11.947 0.904 -7.136 1.00 0.00 H ATOM 2308 HD11 ILE B 47 14.078 1.522 -6.124 1.00 0.00 H ATOM 2309 HD12 ILE B 47 14.630 2.174 -7.686 1.00 0.00 H ATOM 2310 HD13 ILE B 47 13.257 2.930 -6.842 1.00 0.00 H ATOM 2311 HG21 ILE B 47 14.796 -1.184 -9.514 1.00 0.00 H ATOM 2312 HG22 ILE B 47 13.726 0.050 -10.223 1.00 0.00 H ATOM 2313 HG23 ILE B 47 15.095 0.543 -9.196 1.00 0.00 H ATOM 2314 H ILE B 47 10.660 -0.106 -8.931 1.00 0.00 H ATOM 2315 N GLY B 48 12.264 -2.657 -6.299 1.00 30.05 N ATOM 2316 CA GLY B 48 11.706 -3.068 -5.035 1.00 30.73 C ATOM 2317 C GLY B 48 12.667 -2.686 -3.938 1.00 31.36 C ATOM 2318 O GLY B 48 13.877 -2.773 -4.096 1.00 29.74 O ATOM 2319 HA3 GLY B 48 11.556 -4.148 -5.033 1.00 0.00 H ATOM 2320 HA2 GLY B 48 10.750 -2.570 -4.876 1.00 0.00 H ATOM 2321 H GLY B 48 13.120 -3.122 -6.663 1.00 0.00 H ATOM 2322 N GLY B 49 12.105 -2.246 -2.825 1.00 32.72 N ATOM 2323 CA GLY B 49 12.900 -1.929 -1.678 1.00 34.64 C ATOM 2324 C GLY B 49 12.304 -2.616 -0.493 1.00 36.65 C ATOM 2325 O GLY B 49 11.498 -3.571 -0.618 1.00 35.84 O ATOM 2326 HA3 GLY B 49 12.903 -0.851 -1.517 1.00 0.00 H ATOM 2327 HA2 GLY B 49 13.922 -2.275 -1.830 1.00 0.00 H ATOM 2328 H GLY B 49 11.072 -2.129 -2.783 1.00 0.00 H ATOM 2329 N ILE B 50 12.721 -2.123 0.661 1.00 37.60 N ATOM 2330 CA ILE B 50 12.050 -2.372 1.914 1.00 40.17 C ATOM 2331 C ILE B 50 10.623 -1.875 1.785 1.00 40.85 C ATOM 2332 O ILE B 50 10.383 -0.722 1.382 1.00 41.60 O ATOM 2333 CB ILE B 50 12.807 -1.634 3.066 1.00 39.28 C ATOM 2334 CG1 ILE B 50 14.067 -2.407 3.417 1.00 40.79 C ATOM 2335 CG2 ILE B 50 11.963 -1.538 4.323 1.00 41.27 C ATOM 2336 CD1 ILE B 50 13.842 -3.850 3.702 1.00 40.76 C ATOM 2337 HA ILE B 50 12.041 -3.436 2.151 1.00 0.00 H ATOM 2338 HB ILE B 50 13.038 -0.629 2.712 1.00 0.00 H ATOM 2339 HG12 ILE B 50 14.760 -2.328 2.580 1.00 0.00 H ATOM 2340 HG13 ILE B 50 14.513 -1.950 4.300 1.00 0.00 H ATOM 2341 HD11 ILE B 50 13.160 -3.950 4.547 1.00 0.00 H ATOM 2342 HD12 ILE B 50 13.408 -4.329 2.824 1.00 0.00 H ATOM 2343 HD13 ILE B 50 14.793 -4.324 3.943 1.00 0.00 H ATOM 2344 HG21 ILE B 50 11.049 -0.986 4.104 1.00 0.00 H ATOM 2345 HG22 ILE B 50 11.710 -2.541 4.666 1.00 0.00 H ATOM 2346 HG23 ILE B 50 12.526 -1.019 5.098 1.00 0.00 H ATOM 2347 H ILE B 50 13.573 -1.527 0.666 1.00 0.00 H ATOM 2348 N GLY B 51 9.689 -2.771 2.089 1.00 41.89 N ATOM 2349 CA GLY B 51 8.269 -2.449 2.135 1.00 42.22 C ATOM 2350 C GLY B 51 7.565 -2.417 0.797 1.00 42.18 C ATOM 2351 O GLY B 51 6.591 -3.152 0.583 1.00 43.54 O ATOM 2352 HA3 GLY B 51 8.162 -1.467 2.595 1.00 0.00 H ATOM 2353 HA2 GLY B 51 7.775 -3.196 2.757 1.00 0.00 H ATOM 2354 H GLY B 51 9.985 -3.745 2.303 1.00 0.00 H ATOM 2355 N GLY B 52 8.062 -1.597 -0.121 1.00 41.04 N ATOM 2356 CA GLY B 52 7.333 -1.362 -1.344 1.00 39.37 C ATOM 2357 C GLY B 52 8.084 -1.530 -2.645 1.00 38.36 C ATOM 2358 O GLY B 52 9.265 -1.941 -2.684 1.00 37.86 O ATOM 2359 HA3 GLY B 52 6.960 -0.338 -1.311 1.00 0.00 H ATOM 2360 HA2 GLY B 52 6.491 -2.054 -1.361 1.00 0.00 H ATOM 2361 H GLY B 52 8.975 -1.125 0.041 1.00 0.00 H ATOM 2362 N PHE B 53 7.374 -1.241 -3.712 1.00 38.46 N ATOM 2363 CA PHE B 53 8.035 -1.034 -4.953 1.00 38.30 C ATOM 2364 C PHE B 53 7.774 0.397 -5.324 1.00 38.40 C ATOM 2365 O PHE B 53 7.009 1.128 -4.678 1.00 38.40 O ATOM 2366 CB PHE B 53 7.501 -1.969 -6.028 1.00 38.24 C ATOM 2367 CG PHE B 53 6.067 -1.738 -6.367 1.00 38.07 C ATOM 2368 CD1 PHE B 53 5.709 -0.838 -7.369 1.00 38.37 C ATOM 2369 CD2 PHE B 53 5.072 -2.427 -5.693 1.00 38.20 C ATOM 2370 CE1 PHE B 53 4.390 -0.628 -7.683 1.00 38.18 C ATOM 2371 CE2 PHE B 53 3.739 -2.226 -6.008 1.00 38.31 C ATOM 2372 CZ PHE B 53 3.398 -1.320 -7.001 1.00 38.87 C ATOM 2373 HA PHE B 53 9.101 -1.242 -4.866 1.00 0.00 H ATOM 2374 HB2 PHE B 53 8.095 -1.830 -6.931 1.00 0.00 H ATOM 2375 HB3 PHE B 53 7.611 -2.995 -5.677 1.00 0.00 H ATOM 2376 HD2 PHE B 53 5.341 -3.134 -4.908 1.00 0.00 H ATOM 2377 HE2 PHE B 53 2.962 -2.777 -5.478 1.00 0.00 H ATOM 2378 HZ PHE B 53 2.350 -1.151 -7.247 1.00 0.00 H ATOM 2379 HE1 PHE B 53 4.121 0.081 -8.466 1.00 0.00 H ATOM 2380 HD1 PHE B 53 6.485 -0.295 -7.909 1.00 0.00 H ATOM 2381 H PHE B 53 6.339 -1.164 -3.649 1.00 0.00 H ATOM 2382 N VAL B 54 8.427 0.794 -6.388 1.00 38.30 N ATOM 2383 CA VAL B 54 8.105 2.060 -7.027 1.00 38.86 C ATOM 2384 C VAL B 54 8.307 1.918 -8.514 1.00 38.63 C ATOM 2385 O VAL B 54 9.259 1.287 -8.960 1.00 37.51 O ATOM 2386 CB VAL B 54 8.932 3.281 -6.512 1.00 39.10 C ATOM 2387 CG1 VAL B 54 8.517 3.686 -5.101 1.00 40.85 C ATOM 2388 CG2 VAL B 54 10.431 3.064 -6.589 1.00 39.00 C ATOM 2389 HA VAL B 54 7.067 2.275 -6.772 1.00 0.00 H ATOM 2390 HB VAL B 54 8.699 4.102 -7.190 1.00 0.00 H ATOM 2391 HG11 VAL B 54 7.462 3.959 -5.098 1.00 0.00 H ATOM 2392 HG12 VAL B 54 8.679 2.849 -4.422 1.00 0.00 H ATOM 2393 HG13 VAL B 54 9.115 4.538 -4.778 1.00 0.00 H ATOM 2394 HG21 VAL B 54 10.704 2.201 -5.981 1.00 0.00 H ATOM 2395 HG22 VAL B 54 10.718 2.885 -7.625 1.00 0.00 H ATOM 2396 HG23 VAL B 54 10.945 3.950 -6.216 1.00 0.00 H ATOM 2397 H VAL B 54 9.184 0.198 -6.780 1.00 0.00 H ATOM 2398 N LYS B 55 7.389 2.504 -9.271 1.00 39.16 N ATOM 2399 CA LYS B 55 7.587 2.627 -10.692 1.00 39.54 C ATOM 2400 C LYS B 55 8.597 3.725 -10.939 1.00 38.85 C ATOM 2401 O LYS B 55 8.586 4.770 -10.289 1.00 38.40 O ATOM 2402 CB LYS B 55 6.266 2.894 -11.413 1.00 39.97 C ATOM 2403 CG LYS B 55 5.140 1.921 -11.020 1.00 40.85 C ATOM 2404 CD LYS B 55 3.902 2.530 -11.814 1.00 40.22 C ATOM 2405 CE LYS B 55 2.720 1.628 -11.502 1.00 42.34 C ATOM 2406 NZ LYS B 55 2.660 1.252 -10.035 1.00 40.13 N ATOM 2407 HA LYS B 55 7.971 1.690 -11.096 1.00 0.00 H ATOM 2408 HB2 LYS B 55 5.943 3.908 -11.177 1.00 0.00 H ATOM 2409 HB3 LYS B 55 6.436 2.809 -12.486 1.00 0.00 H ATOM 2410 HG2 LYS B 55 5.361 0.904 -11.345 1.00 0.00 H ATOM 2411 HG3 LYS B 55 4.965 1.927 -9.944 1.00 0.00 H ATOM 2412 HD2 LYS B 55 3.701 3.548 -11.480 1.00 0.00 H ATOM 2413 HD3 LYS B 55 4.104 2.534 -12.885 1.00 0.00 H ATOM 2414 HE2 LYS B 55 2.806 0.718 -12.095 1.00 0.00 H ATOM 2415 HE3 LYS B 55 1.800 2.148 -11.769 1.00 0.00 H ATOM 2416 HZ1 LYS B 55 3.531 0.748 -9.772 1.00 0.00 H ATOM 2417 HZ2 LYS B 55 2.570 2.114 -9.461 1.00 0.00 H ATOM 2418 HZ3 LYS B 55 1.838 0.637 -9.869 1.00 0.00 H ATOM 2419 H LYS B 55 6.521 2.877 -8.836 1.00 0.00 H ATOM 2420 N VAL B 56 9.500 3.459 -11.872 1.00 37.85 N ATOM 2421 CA VAL B 56 10.541 4.392 -12.210 1.00 37.46 C ATOM 2422 C VAL B 56 10.687 4.465 -13.708 1.00 38.64 C ATOM 2423 O VAL B 56 10.175 3.618 -14.442 1.00 38.33 O ATOM 2424 CB VAL B 56 11.915 3.993 -11.592 1.00 36.55 C ATOM 2425 CG1 VAL B 56 11.857 3.999 -10.069 1.00 35.63 C ATOM 2426 CG2 VAL B 56 12.381 2.662 -12.119 1.00 34.98 C ATOM 2427 HA VAL B 56 10.253 5.360 -11.800 1.00 0.00 H ATOM 2428 HB VAL B 56 12.647 4.742 -11.895 1.00 0.00 H ATOM 2429 HG11 VAL B 56 11.595 4.998 -9.721 1.00 0.00 H ATOM 2430 HG12 VAL B 56 11.104 3.287 -9.733 1.00 0.00 H ATOM 2431 HG13 VAL B 56 12.831 3.717 -9.668 1.00 0.00 H ATOM 2432 HG21 VAL B 56 11.649 1.896 -11.865 1.00 0.00 H ATOM 2433 HG22 VAL B 56 12.489 2.719 -13.202 1.00 0.00 H ATOM 2434 HG23 VAL B 56 13.342 2.411 -11.670 1.00 0.00 H ATOM 2435 H VAL B 56 9.454 2.549 -12.374 1.00 0.00 H ATOM 2436 N ARG B 57 11.393 5.491 -14.155 1.00 38.95 N ATOM 2437 CA ARG B 57 11.709 5.628 -15.555 1.00 39.69 C ATOM 2438 C ARG B 57 13.150 5.207 -15.738 1.00 38.67 C ATOM 2439 O ARG B 57 14.036 5.717 -15.073 1.00 37.51 O ATOM 2440 CB ARG B 57 11.490 7.073 -16.011 1.00 39.39 C ATOM 2441 CG ARG B 57 10.049 7.554 -15.806 1.00 40.73 C ATOM 2442 CD ARG B 57 9.666 8.856 -16.526 1.00 41.96 C ATOM 2443 NE ARG B 57 10.655 9.928 -16.404 1.00 45.34 N ATOM 2444 CZ ARG B 57 10.778 10.751 -15.367 1.00 45.66 C ATOM 2445 NH1 ARG B 57 9.982 10.647 -14.308 1.00 47.11 N ATOM 2446 NH2 ARG B 57 11.722 11.679 -15.383 1.00 46.70 N ATOM 2447 HA ARG B 57 11.058 5.000 -16.163 1.00 0.00 H ATOM 2448 HB2 ARG B 57 12.157 7.722 -15.443 1.00 0.00 H ATOM 2449 HB3 ARG B 57 11.732 7.143 -17.071 1.00 0.00 H ATOM 2450 HG2 ARG B 57 9.381 6.768 -16.159 1.00 0.00 H ATOM 2451 HG3 ARG B 57 9.896 7.706 -14.737 1.00 0.00 H ATOM 2452 HD2 ARG B 57 8.724 9.212 -16.109 1.00 0.00 H ATOM 2453 HD3 ARG B 57 9.533 8.634 -17.585 1.00 0.00 H ATOM 2454 HE ARG B 57 11.317 10.057 -17.195 1.00 0.00 H ATOM 2455 HH12 ARG B 57 10.094 11.301 -13.507 1.00 0.00 H ATOM 2456 HH11 ARG B 57 9.247 9.912 -14.280 1.00 0.00 H ATOM 2457 HH22 ARG B 57 11.827 12.328 -14.577 1.00 0.00 H ATOM 2458 HH21 ARG B 57 12.359 11.759 -16.201 1.00 0.00 H ATOM 2459 H ARG B 57 11.726 6.212 -13.484 1.00 0.00 H ATOM 2460 N GLN B 58 13.367 4.252 -16.623 1.00 38.62 N ATOM 2461 CA GLN B 58 14.700 3.803 -16.921 1.00 38.53 C ATOM 2462 C GLN B 58 15.280 4.557 -18.097 1.00 38.89 C ATOM 2463 O GLN B 58 14.746 4.522 -19.215 1.00 39.08 O ATOM 2464 CB GLN B 58 14.759 2.298 -17.167 1.00 39.03 C ATOM 2465 CG GLN B 58 16.182 1.860 -17.453 1.00 39.81 C ATOM 2466 CD GLN B 58 16.355 0.391 -17.716 1.00 45.10 C ATOM 2467 OE1 GLN B 58 17.209 0.008 -18.536 1.00 42.89 O ATOM 2468 NE2 GLN B 58 15.582 -0.445 -17.027 1.00 42.03 N ATOM 2469 HA GLN B 58 15.308 4.014 -16.041 1.00 0.00 H ATOM 2470 HB2 GLN B 58 14.394 1.776 -16.283 1.00 0.00 H ATOM 2471 HB3 GLN B 58 14.129 2.049 -18.021 1.00 0.00 H ATOM 2472 HG2 GLN B 58 16.534 2.404 -18.330 1.00 0.00 H ATOM 2473 HG3 GLN B 58 16.797 2.124 -16.592 1.00 0.00 H ATOM 2474 HE22 GLN B 58 14.883 -0.071 -16.353 1.00 0.00 H ATOM 2475 HE21 GLN B 58 15.677 -1.472 -17.162 1.00 0.00 H ATOM 2476 H GLN B 58 12.560 3.817 -17.113 1.00 0.00 H ATOM 2477 N TYR B 59 16.375 5.250 -17.828 1.00 37.86 N ATOM 2478 CA TYR B 59 17.158 5.896 -18.856 1.00 38.56 C ATOM 2479 C TYR B 59 18.470 5.142 -19.040 1.00 37.94 C ATOM 2480 O TYR B 59 19.189 4.918 -18.082 1.00 36.26 O ATOM 2481 CB TYR B 59 17.430 7.338 -18.476 1.00 39.18 C ATOM 2482 CG TYR B 59 16.211 8.224 -18.381 1.00 40.14 C ATOM 2483 CD1 TYR B 59 15.421 8.245 -17.229 1.00 41.16 C ATOM 2484 CD2 TYR B 59 15.860 9.066 -19.440 1.00 41.87 C ATOM 2485 CE1 TYR B 59 14.310 9.072 -17.141 1.00 41.31 C ATOM 2486 CE2 TYR B 59 14.771 9.898 -19.353 1.00 41.11 C ATOM 2487 CZ TYR B 59 13.992 9.893 -18.212 1.00 41.15 C ATOM 2488 OH TYR B 59 12.906 10.726 -18.123 1.00 42.02 O ATOM 2489 HA TYR B 59 16.603 5.885 -19.794 1.00 0.00 H ATOM 2490 HB3 TYR B 59 18.098 7.763 -19.225 1.00 0.00 H ATOM 2491 HB2 TYR B 59 17.926 7.342 -17.505 1.00 0.00 H ATOM 2492 HD2 TYR B 59 16.460 9.062 -20.350 1.00 0.00 H ATOM 2493 HE2 TYR B 59 14.522 10.561 -20.182 1.00 0.00 H ATOM 2494 HE1 TYR B 59 13.695 9.076 -16.241 1.00 0.00 H ATOM 2495 HD1 TYR B 59 15.681 7.603 -16.387 1.00 0.00 H ATOM 2496 HH TYR B 59 12.463 10.596 -17.247 1.00 0.00 H ATOM 2497 H TYR B 59 16.684 5.333 -16.838 1.00 0.00 H ATOM 2498 N ASP B 60 18.748 4.724 -20.272 1.00 38.71 N ATOM 2499 CA ASP B 60 20.008 4.054 -20.580 1.00 39.26 C ATOM 2500 C ASP B 60 21.057 5.059 -21.033 1.00 38.94 C ATOM 2501 O ASP B 60 20.736 6.169 -21.498 1.00 38.36 O ATOM 2502 CB ASP B 60 19.816 2.936 -21.614 1.00 40.03 C ATOM 2503 CG ASP B 60 19.045 1.742 -21.050 1.00 42.65 C ATOM 2504 OD1 ASP B 60 19.027 1.571 -19.803 1.00 41.72 O ATOM 2505 OD2 ASP B 60 18.435 0.916 -21.772 1.00 43.83 O ATOM 2506 HA ASP B 60 20.368 3.583 -19.665 1.00 0.00 H ATOM 2507 HB2 ASP B 60 19.266 3.337 -22.465 1.00 0.00 H ATOM 2508 HB3 ASP B 60 20.796 2.594 -21.946 1.00 0.00 H ATOM 2509 H ASP B 60 18.054 4.878 -21.031 1.00 0.00 H ATOM 2510 N GLN B 61 22.313 4.679 -20.834 1.00 38.51 N ATOM 2511 CA GLN B 61 23.455 5.418 -21.357 1.00 38.18 C ATOM 2512 C GLN B 61 23.415 6.910 -20.995 1.00 36.63 C ATOM 2513 O GLN B 61 23.592 7.790 -21.848 1.00 36.58 O ATOM 2514 CB GLN B 61 23.642 5.142 -22.877 1.00 38.58 C ATOM 2515 CG GLN B 61 23.665 3.631 -23.187 1.00 39.86 C ATOM 2516 CD GLN B 61 24.102 3.305 -24.605 1.00 42.78 C ATOM 2517 OE1 GLN B 61 23.265 3.029 -25.453 1.00 43.93 O ATOM 2518 NE2 GLN B 61 25.417 3.338 -24.860 1.00 43.46 N ATOM 2519 HA GLN B 61 24.351 5.045 -20.860 1.00 0.00 H ATOM 2520 HB2 GLN B 61 22.818 5.602 -23.423 1.00 0.00 H ATOM 2521 HB3 GLN B 61 24.584 5.584 -23.203 1.00 0.00 H ATOM 2522 HG2 GLN B 61 24.354 3.148 -22.495 1.00 0.00 H ATOM 2523 HG3 GLN B 61 22.662 3.233 -23.036 1.00 0.00 H ATOM 2524 HE22 GLN B 61 26.088 3.579 -24.103 1.00 0.00 H ATOM 2525 HE21 GLN B 61 25.767 3.123 -25.815 1.00 0.00 H ATOM 2526 H GLN B 61 22.490 3.816 -20.281 1.00 0.00 H ATOM 2527 N ILE B 62 23.191 7.189 -19.706 1.00 33.26 N ATOM 2528 CA ILE B 62 23.201 8.548 -19.208 1.00 30.78 C ATOM 2529 C ILE B 62 24.549 8.875 -18.609 1.00 29.53 C ATOM 2530 O ILE B 62 25.025 8.128 -17.770 1.00 28.14 O ATOM 2531 CB ILE B 62 22.106 8.736 -18.112 1.00 30.53 C ATOM 2532 CG1 ILE B 62 20.694 8.420 -18.686 1.00 30.26 C ATOM 2533 CG2 ILE B 62 22.240 10.109 -17.457 1.00 28.92 C ATOM 2534 CD1 ILE B 62 20.238 9.379 -19.795 1.00 32.18 C ATOM 2535 HA ILE B 62 22.997 9.216 -20.045 1.00 0.00 H ATOM 2536 HB ILE B 62 22.253 8.015 -17.308 1.00 0.00 H ATOM 2537 HG12 ILE B 62 20.708 7.409 -19.092 1.00 0.00 H ATOM 2538 HG13 ILE B 62 19.973 8.472 -17.870 1.00 0.00 H ATOM 2539 HD11 ILE B 62 20.205 10.396 -19.404 1.00 0.00 H ATOM 2540 HD12 ILE B 62 20.941 9.331 -20.627 1.00 0.00 H ATOM 2541 HD13 ILE B 62 19.245 9.089 -20.139 1.00 0.00 H ATOM 2542 HG21 ILE B 62 23.224 10.196 -16.996 1.00 0.00 H ATOM 2543 HG22 ILE B 62 22.123 10.884 -18.214 1.00 0.00 H ATOM 2544 HG23 ILE B 62 21.469 10.224 -16.695 1.00 0.00 H ATOM 2545 H ILE B 62 23.005 6.409 -19.044 1.00 0.00 H ATOM 2546 N PRO B 63 25.152 9.994 -19.013 1.00 28.15 N ATOM 2547 CA PRO B 63 26.380 10.461 -18.403 1.00 26.59 C ATOM 2548 C PRO B 63 26.159 11.013 -17.009 1.00 25.49 C ATOM 2549 O PRO B 63 25.229 11.807 -16.762 1.00 24.32 O ATOM 2550 CB PRO B 63 26.852 11.584 -19.347 1.00 26.54 C ATOM 2551 CG PRO B 63 26.064 11.383 -20.582 1.00 26.86 C ATOM 2552 CD PRO B 63 24.730 10.862 -20.130 1.00 27.77 C ATOM 2553 HA PRO B 63 27.101 9.652 -18.284 1.00 0.00 H ATOM 2554 HD3 PRO B 63 24.076 11.666 -19.792 1.00 0.00 H ATOM 2555 HD2 PRO B 63 24.231 10.295 -20.916 1.00 0.00 H ATOM 2556 HG3 PRO B 63 26.555 10.660 -21.233 1.00 0.00 H ATOM 2557 HG2 PRO B 63 25.944 12.326 -21.115 1.00 0.00 H ATOM 2558 HB2 PRO B 63 26.648 12.563 -18.914 1.00 0.00 H ATOM 2559 HB3 PRO B 63 27.919 11.494 -19.551 1.00 0.00 H ATOM 2560 N ILE B 64 26.987 10.541 -16.086 1.00 24.58 N ATOM 2561 CA ILE B 64 26.983 11.007 -14.706 1.00 24.49 C ATOM 2562 C ILE B 64 28.402 11.179 -14.256 1.00 24.64 C ATOM 2563 O ILE B 64 29.267 10.374 -14.584 1.00 24.35 O ATOM 2564 CB ILE B 64 26.324 10.008 -13.749 1.00 24.76 C ATOM 2565 CG1 ILE B 64 24.929 9.591 -14.221 1.00 25.57 C ATOM 2566 CG2 ILE B 64 26.284 10.605 -12.325 1.00 23.57 C ATOM 2567 CD1 ILE B 64 24.068 9.112 -13.088 1.00 26.74 C ATOM 2568 HA ILE B 64 26.418 11.939 -14.681 1.00 0.00 H ATOM 2569 HB ILE B 64 26.926 9.099 -13.736 1.00 0.00 H ATOM 2570 HG12 ILE B 64 24.446 10.448 -14.692 1.00 0.00 H ATOM 2571 HG13 ILE B 64 25.030 8.787 -14.950 1.00 0.00 H ATOM 2572 HD11 ILE B 64 24.538 8.250 -12.615 1.00 0.00 H ATOM 2573 HD12 ILE B 64 23.954 9.912 -12.357 1.00 0.00 H ATOM 2574 HD13 ILE B 64 23.089 8.828 -13.473 1.00 0.00 H ATOM 2575 HG21 ILE B 64 27.301 10.812 -11.990 1.00 0.00 H ATOM 2576 HG22 ILE B 64 25.708 11.531 -12.336 1.00 0.00 H ATOM 2577 HG23 ILE B 64 25.815 9.892 -11.647 1.00 0.00 H ATOM 2578 H ILE B 64 27.669 9.806 -16.360 1.00 0.00 H ATOM 2579 N GLU B 65 28.657 12.224 -13.499 1.00 24.97 N ATOM 2580 CA GLU B 65 29.984 12.376 -12.947 1.00 28.41 C ATOM 2581 C GLU B 65 29.766 12.156 -11.468 1.00 28.14 C ATOM 2582 O GLU B 65 28.971 12.877 -10.840 1.00 28.84 O ATOM 2583 CB GLU B 65 30.603 13.726 -13.281 1.00 28.39 C ATOM 2584 CG GLU B 65 32.058 13.877 -12.826 1.00 32.38 C ATOM 2585 CD GLU B 65 32.748 15.104 -13.407 1.00 34.12 C ATOM 2586 OE1 GLU B 65 33.961 15.302 -13.135 1.00 38.79 O ATOM 2587 OE2 GLU B 65 32.093 15.872 -14.164 1.00 39.92 O ATOM 2588 HA GLU B 65 30.707 11.675 -13.363 1.00 0.00 H ATOM 2589 HB2 GLU B 65 30.566 13.862 -14.362 1.00 0.00 H ATOM 2590 HB3 GLU B 65 30.011 14.503 -12.798 1.00 0.00 H ATOM 2591 HG2 GLU B 65 32.074 13.953 -11.739 1.00 0.00 H ATOM 2592 HG3 GLU B 65 32.611 12.990 -13.135 1.00 0.00 H ATOM 2593 H GLU B 65 27.917 12.928 -13.301 1.00 0.00 H ATOM 2594 N ILE B 66 30.439 11.147 -10.934 1.00 27.37 N ATOM 2595 CA ILE B 66 30.246 10.766 -9.522 1.00 26.92 C ATOM 2596 C ILE B 66 31.565 11.057 -8.843 1.00 28.41 C ATOM 2597 O ILE B 66 32.594 10.456 -9.185 1.00 27.78 O ATOM 2598 CB ILE B 66 29.893 9.318 -9.404 1.00 26.57 C ATOM 2599 CG1 ILE B 66 28.600 9.021 -10.177 1.00 25.32 C ATOM 2600 CG2 ILE B 66 29.816 8.913 -7.911 1.00 25.23 C ATOM 2601 CD1 ILE B 66 28.340 7.543 -10.408 1.00 25.31 C ATOM 2602 HA ILE B 66 29.426 11.319 -9.064 1.00 0.00 H ATOM 2603 HB ILE B 66 30.673 8.707 -9.858 1.00 0.00 H ATOM 2604 HG12 ILE B 66 27.762 9.432 -9.614 1.00 0.00 H ATOM 2605 HG13 ILE B 66 28.660 9.514 -11.147 1.00 0.00 H ATOM 2606 HD11 ILE B 66 29.162 7.116 -10.982 1.00 0.00 H ATOM 2607 HD12 ILE B 66 28.263 7.034 -9.447 1.00 0.00 H ATOM 2608 HD13 ILE B 66 27.408 7.421 -10.960 1.00 0.00 H ATOM 2609 HG21 ILE B 66 30.783 9.087 -7.438 1.00 0.00 H ATOM 2610 HG22 ILE B 66 29.053 9.511 -7.413 1.00 0.00 H ATOM 2611 HG23 ILE B 66 29.558 7.857 -7.835 1.00 0.00 H ATOM 2612 H ILE B 66 31.114 10.615 -11.520 1.00 0.00 H TER 2613 ILE B 66 ATOM 2614 N GLY B 68 33.695 13.214 -9.373 1.00 32.15 N ATOM 2615 CA GLY B 68 34.801 13.514 -10.318 1.00 33.94 C ATOM 2616 C GLY B 68 35.186 12.339 -11.212 1.00 34.44 C ATOM 2617 O GLY B 68 36.247 12.327 -11.860 1.00 36.46 O ATOM 2618 HA3 GLY B 68 35.677 13.807 -9.740 1.00 0.00 H ATOM 2619 HA2 GLY B 68 34.493 14.344 -10.955 1.00 0.00 H ATOM 2620 HN3 GLY B 68 33.977 12.431 -8.749 1.00 0.00 H ATOM 2621 HN2 GLY B 68 32.846 12.943 -9.909 1.00 0.00 H ATOM 2622 HN1 GLY B 68 33.491 14.058 -8.801 1.00 0.00 H ATOM 2623 N HIS B 69 34.337 11.329 -11.238 1.00 33.20 N ATOM 2624 CA HIS B 69 34.574 10.218 -12.113 1.00 31.96 C ATOM 2625 C HIS B 69 33.413 10.237 -13.048 1.00 30.84 C ATOM 2626 O HIS B 69 32.277 10.133 -12.623 1.00 29.49 O ATOM 2627 CB HIS B 69 34.615 8.915 -11.328 1.00 31.92 C ATOM 2628 CG HIS B 69 35.752 8.846 -10.366 1.00 32.59 C ATOM 2629 ND1 HIS B 69 36.825 7.997 -10.547 1.00 35.15 N ATOM 2630 CD2 HIS B 69 35.998 9.537 -9.230 1.00 33.01 C ATOM 2631 CE1 HIS B 69 37.690 8.177 -9.561 1.00 33.30 C ATOM 2632 NE2 HIS B 69 37.204 9.094 -8.739 1.00 32.33 N ATOM 2633 HA HIS B 69 35.529 10.290 -12.633 1.00 0.00 H ATOM 2634 HB2 HIS B 69 33.683 8.816 -10.771 1.00 0.00 H ATOM 2635 HB3 HIS B 69 34.706 8.088 -12.032 1.00 0.00 H ATOM 2636 HD2 HIS B 69 35.360 10.302 -8.787 1.00 0.00 H ATOM 2637 HE1 HIS B 69 38.641 7.658 -9.446 1.00 0.00 H ATOM 2638 H HIS B 69 33.497 11.339 -10.625 1.00 0.00 H ATOM 2639 N LYS B 70 33.712 10.414 -14.322 1.00 30.40 N ATOM 2640 CA LYS B 70 32.689 10.382 -15.339 1.00 30.35 C ATOM 2641 C LYS B 70 32.404 8.946 -15.699 1.00 29.47 C ATOM 2642 O LYS B 70 33.313 8.163 -15.979 1.00 29.27 O ATOM 2643 CB LYS B 70 33.128 11.175 -16.561 1.00 32.21 C ATOM 2644 CG LYS B 70 33.227 12.656 -16.290 1.00 35.20 C ATOM 2645 CD LYS B 70 33.645 13.404 -17.536 1.00 38.93 C ATOM 2646 CE LYS B 70 33.500 14.920 -17.388 1.00 42.22 C ATOM 2647 NZ LYS B 70 34.376 15.489 -16.313 1.00 44.30 N ATOM 2648 HA LYS B 70 31.777 10.843 -14.959 1.00 0.00 H ATOM 2649 HB2 LYS B 70 34.105 10.812 -16.880 1.00 0.00 H ATOM 2650 HB3 LYS B 70 32.404 11.014 -17.360 1.00 0.00 H ATOM 2651 HG2 LYS B 70 32.256 13.025 -15.961 1.00 0.00 H ATOM 2652 HG3 LYS B 70 33.964 12.827 -15.506 1.00 0.00 H ATOM 2653 HD2 LYS B 70 34.688 13.172 -17.749 1.00 0.00 H ATOM 2654 HD3 LYS B 70 33.023 13.073 -18.368 1.00 0.00 H ATOM 2655 HE2 LYS B 70 32.462 15.148 -17.148 1.00 0.00 H ATOM 2656 HE3 LYS B 70 33.764 15.389 -18.336 1.00 0.00 H ATOM 2657 HZ1 LYS B 70 34.128 15.056 -15.400 1.00 0.00 H ATOM 2658 HZ2 LYS B 70 35.372 15.286 -16.535 1.00 0.00 H ATOM 2659 HZ3 LYS B 70 34.234 16.518 -16.260 1.00 0.00 H ATOM 2660 H LYS B 70 34.701 10.579 -14.597 1.00 0.00 H ATOM 2661 N VAL B 71 31.136 8.596 -15.632 1.00 27.46 N ATOM 2662 CA VAL B 71 30.678 7.278 -16.000 1.00 27.43 C ATOM 2663 C VAL B 71 29.425 7.486 -16.822 1.00 26.67 C ATOM 2664 O VAL B 71 28.924 8.601 -16.928 1.00 25.52 O ATOM 2665 CB VAL B 71 30.408 6.381 -14.773 1.00 27.39 C ATOM 2666 CG1 VAL B 71 31.647 6.292 -13.931 1.00 28.35 C ATOM 2667 CG2 VAL B 71 29.274 6.912 -13.985 1.00 27.25 C ATOM 2668 HA VAL B 71 31.446 6.752 -16.567 1.00 0.00 H ATOM 2669 HB VAL B 71 30.142 5.380 -15.113 1.00 0.00 H ATOM 2670 HG11 VAL B 71 32.456 5.864 -14.522 1.00 0.00 H ATOM 2671 HG12 VAL B 71 31.929 7.290 -13.595 1.00 0.00 H ATOM 2672 HG13 VAL B 71 31.452 5.658 -13.066 1.00 0.00 H ATOM 2673 HG21 VAL B 71 29.511 7.920 -13.643 1.00 0.00 H ATOM 2674 HG22 VAL B 71 28.381 6.939 -14.609 1.00 0.00 H ATOM 2675 HG23 VAL B 71 29.098 6.267 -13.124 1.00 0.00 H ATOM 2676 H VAL B 71 30.440 9.295 -15.302 1.00 0.00 H ATOM 2677 N ILE B 72 28.929 6.415 -17.408 1.00 27.35 N ATOM 2678 CA ILE B 72 27.760 6.504 -18.276 1.00 27.76 C ATOM 2679 C ILE B 72 27.027 5.231 -18.030 1.00 28.00 C ATOM 2680 O ILE B 72 27.607 4.156 -18.096 1.00 28.71 O ATOM 2681 CB ILE B 72 28.158 6.601 -19.771 1.00 28.93 C ATOM 2682 CG1 ILE B 72 28.563 8.031 -20.125 1.00 31.21 C ATOM 2683 CG2 ILE B 72 26.989 6.213 -20.681 1.00 29.44 C ATOM 2684 CD1 ILE B 72 28.802 8.233 -21.589 1.00 33.71 C ATOM 2685 HA ILE B 72 27.169 7.395 -18.063 1.00 0.00 H ATOM 2686 HB ILE B 72 28.992 5.916 -19.924 1.00 0.00 H ATOM 2687 HG12 ILE B 72 27.767 8.705 -19.808 1.00 0.00 H ATOM 2688 HG13 ILE B 72 29.480 8.275 -19.588 1.00 0.00 H ATOM 2689 HD11 ILE B 72 29.604 7.573 -21.920 1.00 0.00 H ATOM 2690 HD12 ILE B 72 27.890 8.003 -22.140 1.00 0.00 H ATOM 2691 HD13 ILE B 72 29.086 9.270 -21.770 1.00 0.00 H ATOM 2692 HG21 ILE B 72 26.688 5.188 -20.466 1.00 0.00 H ATOM 2693 HG22 ILE B 72 26.150 6.885 -20.499 1.00 0.00 H ATOM 2694 HG23 ILE B 72 27.300 6.291 -21.723 1.00 0.00 H ATOM 2695 H ILE B 72 29.379 5.491 -17.249 1.00 0.00 H ATOM 2696 N GLY B 73 25.751 5.321 -17.724 1.00 26.84 N ATOM 2697 CA GLY B 73 25.053 4.098 -17.472 1.00 26.91 C ATOM 2698 C GLY B 73 23.594 4.340 -17.331 1.00 25.90 C ATOM 2699 O GLY B 73 23.101 5.418 -17.585 1.00 25.14 O ATOM 2700 HA3 GLY B 73 25.432 3.653 -16.552 1.00 0.00 H ATOM 2701 HA2 GLY B 73 25.223 3.412 -18.302 1.00 0.00 H ATOM 2702 H GLY B 73 25.270 6.242 -17.668 1.00 0.00 H ATOM 2703 N THR B 74 22.923 3.305 -16.856 1.00 26.49 N ATOM 2704 CA THR B 74 21.503 3.362 -16.630 1.00 25.31 C ATOM 2705 C THR B 74 21.176 4.081 -15.330 1.00 24.76 C ATOM 2706 O THR B 74 21.789 3.875 -14.294 1.00 23.66 O ATOM 2707 CB THR B 74 20.982 1.944 -16.612 1.00 26.31 C ATOM 2708 OG1 THR B 74 21.208 1.364 -17.912 1.00 26.14 O ATOM 2709 CG2 THR B 74 19.449 1.926 -16.390 1.00 26.56 C ATOM 2710 HA THR B 74 21.023 3.930 -17.427 1.00 0.00 H ATOM 2711 HB THR B 74 21.488 1.401 -15.814 1.00 0.00 H ATOM 2712 HG1 THR B 74 22.178 1.368 -18.110 1.00 0.00 H ATOM 2713 HG23 THR B 74 19.219 2.356 -15.415 1.00 0.00 H ATOM 2714 HG21 THR B 74 18.963 2.512 -17.171 1.00 0.00 H ATOM 2715 HG22 THR B 74 19.090 0.898 -16.429 1.00 0.00 H ATOM 2716 H THR B 74 23.435 2.426 -16.640 1.00 0.00 H ATOM 2717 N VAL B 75 20.200 4.946 -15.414 1.00 23.83 N ATOM 2718 CA VAL B 75 19.742 5.731 -14.298 1.00 25.23 C ATOM 2719 C VAL B 75 18.239 5.579 -14.246 1.00 26.06 C ATOM 2720 O VAL B 75 17.564 5.718 -15.260 1.00 26.00 O ATOM 2721 CB VAL B 75 20.160 7.202 -14.477 1.00 26.20 C ATOM 2722 CG1 VAL B 75 19.532 8.117 -13.427 1.00 25.43 C ATOM 2723 CG2 VAL B 75 21.649 7.279 -14.363 1.00 25.03 C ATOM 2724 HA VAL B 75 20.184 5.393 -13.361 1.00 0.00 H ATOM 2725 HB VAL B 75 19.812 7.540 -15.453 1.00 0.00 H ATOM 2726 HG11 VAL B 75 18.446 8.063 -13.503 1.00 0.00 H ATOM 2727 HG12 VAL B 75 19.845 7.796 -12.433 1.00 0.00 H ATOM 2728 HG13 VAL B 75 19.859 9.143 -13.598 1.00 0.00 H ATOM 2729 HG21 VAL B 75 21.956 6.917 -13.382 1.00 0.00 H ATOM 2730 HG22 VAL B 75 22.104 6.662 -15.138 1.00 0.00 H ATOM 2731 HG23 VAL B 75 21.969 8.314 -14.487 1.00 0.00 H ATOM 2732 H VAL B 75 19.731 5.074 -16.333 1.00 0.00 H ATOM 2733 N LEU B 76 17.737 5.249 -13.064 1.00 26.54 N ATOM 2734 CA LEU B 76 16.323 5.166 -12.824 1.00 26.95 C ATOM 2735 C LEU B 76 15.840 6.452 -12.160 1.00 27.17 C ATOM 2736 O LEU B 76 16.507 7.028 -11.278 1.00 27.48 O ATOM 2737 CB LEU B 76 15.992 3.948 -11.969 1.00 25.74 C ATOM 2738 CG LEU B 76 16.618 2.612 -12.395 1.00 24.80 C ATOM 2739 CD1 LEU B 76 16.129 1.532 -11.452 1.00 25.07 C ATOM 2740 CD2 LEU B 76 16.300 2.237 -13.838 1.00 26.33 C ATOM 2741 HA LEU B 76 15.805 5.049 -13.776 1.00 0.00 H ATOM 2742 HB2 LEU B 76 16.324 4.159 -10.952 1.00 0.00 H ATOM 2743 HB3 LEU B 76 14.909 3.823 -11.978 1.00 0.00 H ATOM 2744 HG LEU B 76 17.702 2.715 -12.341 1.00 0.00 H ATOM 2745 HD21 LEU B 76 15.220 2.151 -13.960 1.00 0.00 H ATOM 2746 HD22 LEU B 76 16.682 3.010 -14.505 1.00 0.00 H ATOM 2747 HD23 LEU B 76 16.771 1.284 -14.077 1.00 0.00 H ATOM 2748 HD11 LEU B 76 16.430 1.777 -10.433 1.00 0.00 H ATOM 2749 HD12 LEU B 76 15.042 1.469 -11.506 1.00 0.00 H ATOM 2750 HD13 LEU B 76 16.564 0.575 -11.740 1.00 0.00 H ATOM 2751 H LEU B 76 18.391 5.043 -12.282 1.00 0.00 H ATOM 2752 N VAL B 77 14.693 6.935 -12.611 1.00 27.43 N ATOM 2753 CA VAL B 77 14.170 8.158 -12.049 1.00 29.59 C ATOM 2754 C VAL B 77 12.788 7.898 -11.519 1.00 31.05 C ATOM 2755 O VAL B 77 11.925 7.384 -12.226 1.00 31.75 O ATOM 2756 CB VAL B 77 14.163 9.350 -13.066 1.00 30.22 C ATOM 2757 CG1 VAL B 77 13.762 10.666 -12.349 1.00 31.24 C ATOM 2758 CG2 VAL B 77 15.525 9.506 -13.722 1.00 29.60 C ATOM 2759 HA VAL B 77 14.833 8.464 -11.240 1.00 0.00 H ATOM 2760 HB VAL B 77 13.429 9.133 -13.842 1.00 0.00 H ATOM 2761 HG11 VAL B 77 12.765 10.556 -11.921 1.00 0.00 H ATOM 2762 HG12 VAL B 77 14.478 10.879 -11.555 1.00 0.00 H ATOM 2763 HG13 VAL B 77 13.762 11.485 -13.069 1.00 0.00 H ATOM 2764 HG21 VAL B 77 16.276 9.701 -12.956 1.00 0.00 H ATOM 2765 HG22 VAL B 77 15.777 8.589 -14.255 1.00 0.00 H ATOM 2766 HG23 VAL B 77 15.496 10.340 -14.424 1.00 0.00 H ATOM 2767 H VAL B 77 14.174 6.438 -13.363 1.00 0.00 H ATOM 2768 N GLY B 78 12.573 8.233 -10.260 1.00 32.31 N ATOM 2769 CA GLY B 78 11.247 8.083 -9.705 1.00 33.53 C ATOM 2770 C GLY B 78 11.185 8.616 -8.306 1.00 34.64 C ATOM 2771 O GLY B 78 12.139 9.271 -7.852 1.00 34.00 O ATOM 2772 HA3 GLY B 78 10.982 7.026 -9.696 1.00 0.00 H ATOM 2773 HA2 GLY B 78 10.537 8.629 -10.326 1.00 0.00 H ATOM 2774 H GLY B 78 13.349 8.601 -9.674 1.00 0.00 H ATOM 2775 N PRO B 79 10.076 8.316 -7.617 1.00 35.75 N ATOM 2776 CA PRO B 79 9.783 8.892 -6.292 1.00 35.55 C ATOM 2777 C PRO B 79 10.563 8.239 -5.161 1.00 34.38 C ATOM 2778 O PRO B 79 9.990 7.741 -4.181 1.00 35.96 O ATOM 2779 CB PRO B 79 8.268 8.671 -6.144 1.00 36.18 C ATOM 2780 CG PRO B 79 8.015 7.390 -6.893 1.00 36.53 C ATOM 2781 CD PRO B 79 8.999 7.407 -8.073 1.00 36.51 C ATOM 2782 HA PRO B 79 10.080 9.939 -6.228 1.00 0.00 H ATOM 2783 HD3 PRO B 79 9.389 6.408 -8.269 1.00 0.00 H ATOM 2784 HD2 PRO B 79 8.520 7.792 -8.974 1.00 0.00 H ATOM 2785 HG3 PRO B 79 6.987 7.355 -7.254 1.00 0.00 H ATOM 2786 HG2 PRO B 79 8.203 6.529 -6.251 1.00 0.00 H ATOM 2787 HB2 PRO B 79 7.991 8.568 -5.095 1.00 0.00 H ATOM 2788 HB3 PRO B 79 7.710 9.496 -6.587 1.00 0.00 H ATOM 2789 N THR B 80 11.879 8.252 -5.291 1.00 31.69 N ATOM 2790 CA THR B 80 12.743 7.744 -4.247 1.00 28.95 C ATOM 2791 C THR B 80 13.023 8.879 -3.270 1.00 28.97 C ATOM 2792 O THR B 80 13.080 10.057 -3.664 1.00 28.79 O ATOM 2793 CB THR B 80 14.064 7.231 -4.867 1.00 28.11 C ATOM 2794 OG1 THR B 80 14.997 6.990 -3.821 1.00 25.39 O ATOM 2795 CG2 THR B 80 14.723 8.345 -5.670 1.00 27.44 C ATOM 2796 HA THR B 80 12.265 6.915 -3.725 1.00 0.00 H ATOM 2797 HB THR B 80 13.833 6.351 -5.467 1.00 0.00 H ATOM 2798 HG1 THR B 80 15.162 7.832 -3.327 1.00 0.00 H ATOM 2799 HG23 THR B 80 14.083 8.613 -6.511 1.00 0.00 H ATOM 2800 HG21 THR B 80 14.868 9.216 -5.030 1.00 0.00 H ATOM 2801 HG22 THR B 80 15.688 8.001 -6.042 1.00 0.00 H ATOM 2802 H THR B 80 12.301 8.635 -6.161 1.00 0.00 H ATOM 2803 N PRO B 81 13.202 8.545 -2.006 1.00 29.30 N ATOM 2804 CA PRO B 81 13.454 9.571 -0.979 1.00 29.20 C ATOM 2805 C PRO B 81 14.921 9.990 -0.909 1.00 28.74 C ATOM 2806 O PRO B 81 15.289 10.855 -0.137 1.00 28.30 O ATOM 2807 CB PRO B 81 13.047 8.865 0.303 1.00 29.99 C ATOM 2808 CG PRO B 81 13.412 7.419 0.053 1.00 29.58 C ATOM 2809 CD PRO B 81 13.145 7.189 -1.425 1.00 29.54 C ATOM 2810 HA PRO B 81 12.911 10.494 -1.180 1.00 0.00 H ATOM 2811 HD3 PRO B 81 13.908 6.546 -1.863 1.00 0.00 H ATOM 2812 HD2 PRO B 81 12.163 6.741 -1.578 1.00 0.00 H ATOM 2813 HG3 PRO B 81 12.794 6.758 0.661 1.00 0.00 H ATOM 2814 HG2 PRO B 81 14.463 7.245 0.283 1.00 0.00 H ATOM 2815 HB2 PRO B 81 13.597 9.262 1.156 1.00 0.00 H ATOM 2816 HB3 PRO B 81 11.977 8.970 0.481 1.00 0.00 H ATOM 2817 N ALA B 82 15.763 9.349 -1.707 1.00 27.44 N ATOM 2818 CA ALA B 82 17.166 9.698 -1.765 1.00 25.34 C ATOM 2819 C ALA B 82 17.715 9.360 -3.130 1.00 23.60 C ATOM 2820 O ALA B 82 17.298 8.399 -3.761 1.00 23.06 O ATOM 2821 CB ALA B 82 17.942 8.929 -0.667 1.00 26.37 C ATOM 2822 HA ALA B 82 17.283 10.768 -1.592 1.00 0.00 H ATOM 2823 HB1 ALA B 82 17.543 9.195 0.312 1.00 0.00 H ATOM 2824 HB2 ALA B 82 17.829 7.857 -0.827 1.00 0.00 H ATOM 2825 HB3 ALA B 82 18.998 9.196 -0.716 1.00 0.00 H ATOM 2826 H ALA B 82 15.407 8.577 -2.306 1.00 0.00 H ATOM 2827 N ASN B 83 18.669 10.153 -3.613 1.00 21.96 N ATOM 2828 CA ASN B 83 19.402 9.771 -4.797 1.00 20.26 C ATOM 2829 C ASN B 83 20.339 8.669 -4.409 1.00 18.72 C ATOM 2830 O ASN B 83 21.094 8.800 -3.446 1.00 18.83 O ATOM 2831 CB ASN B 83 20.207 10.964 -5.287 1.00 20.39 C ATOM 2832 CG ASN B 83 19.322 12.072 -5.731 1.00 23.55 C ATOM 2833 OD1 ASN B 83 18.359 11.815 -6.439 1.00 24.62 O ATOM 2834 ND2 ASN B 83 19.604 13.304 -5.310 1.00 22.52 N ATOM 2835 HA ASN B 83 18.726 9.444 -5.587 1.00 0.00 H ATOM 2836 HB2 ASN B 83 20.842 11.321 -4.476 1.00 0.00 H ATOM 2837 HB3 ASN B 83 20.831 10.651 -6.124 1.00 0.00 H ATOM 2838 HD22 ASN B 83 20.436 13.470 -4.709 1.00 0.00 H ATOM 2839 HD21 ASN B 83 18.992 14.100 -5.583 1.00 0.00 H ATOM 2840 H ASN B 83 18.887 11.051 -3.136 1.00 0.00 H ATOM 2841 N ILE B 84 20.280 7.576 -5.155 1.00 18.00 N ATOM 2842 CA ILE B 84 21.040 6.393 -4.821 1.00 17.53 C ATOM 2843 C ILE B 84 21.911 6.008 -5.998 1.00 17.90 C ATOM 2844 O ILE B 84 21.421 5.840 -7.134 1.00 18.70 O ATOM 2845 CB ILE B 84 20.070 5.257 -4.456 1.00 17.92 C ATOM 2846 CG1 ILE B 84 19.455 5.556 -3.107 1.00 19.06 C ATOM 2847 CG2 ILE B 84 20.779 3.924 -4.443 1.00 18.39 C ATOM 2848 CD1 ILE B 84 18.123 4.934 -2.958 1.00 21.89 C ATOM 2849 HA ILE B 84 21.686 6.587 -3.964 1.00 0.00 H ATOM 2850 HB ILE B 84 19.283 5.196 -5.208 1.00 0.00 H ATOM 2851 HG12 ILE B 84 20.113 5.172 -2.327 1.00 0.00 H ATOM 2852 HG13 ILE B 84 19.354 6.636 -2.997 1.00 0.00 H ATOM 2853 HD11 ILE B 84 17.456 5.317 -3.730 1.00 0.00 H ATOM 2854 HD12 ILE B 84 18.215 3.853 -3.060 1.00 0.00 H ATOM 2855 HD13 ILE B 84 17.719 5.175 -1.975 1.00 0.00 H ATOM 2856 HG21 ILE B 84 21.195 3.726 -5.431 1.00 0.00 H ATOM 2857 HG22 ILE B 84 21.583 3.949 -3.707 1.00 0.00 H ATOM 2858 HG23 ILE B 84 20.069 3.139 -4.182 1.00 0.00 H ATOM 2859 H ILE B 84 19.673 7.569 -6.000 1.00 0.00 H ATOM 2860 N ILE B 85 23.203 5.891 -5.719 1.00 16.32 N ATOM 2861 CA ILE B 85 24.136 5.380 -6.724 1.00 15.82 C ATOM 2862 C ILE B 85 24.334 3.915 -6.468 1.00 15.26 C ATOM 2863 O ILE B 85 24.845 3.521 -5.414 1.00 15.60 O ATOM 2864 CB ILE B 85 25.498 6.098 -6.646 1.00 16.10 C ATOM 2865 CG1 ILE B 85 25.334 7.631 -6.716 1.00 17.20 C ATOM 2866 CG2 ILE B 85 26.413 5.581 -7.772 1.00 16.70 C ATOM 2867 CD1 ILE B 85 24.471 8.147 -7.880 1.00 20.92 C ATOM 2868 HA ILE B 85 23.723 5.557 -7.717 1.00 0.00 H ATOM 2869 HB ILE B 85 25.958 5.875 -5.684 1.00 0.00 H ATOM 2870 HG12 ILE B 85 24.877 7.964 -5.784 1.00 0.00 H ATOM 2871 HG13 ILE B 85 26.326 8.072 -6.811 1.00 0.00 H ATOM 2872 HD11 ILE B 85 24.917 7.839 -8.826 1.00 0.00 H ATOM 2873 HD12 ILE B 85 23.467 7.731 -7.798 1.00 0.00 H ATOM 2874 HD13 ILE B 85 24.420 9.235 -7.838 1.00 0.00 H ATOM 2875 HG21 ILE B 85 26.559 4.507 -7.655 1.00 0.00 H ATOM 2876 HG22 ILE B 85 25.949 5.783 -8.737 1.00 0.00 H ATOM 2877 HG23 ILE B 85 27.376 6.088 -7.717 1.00 0.00 H ATOM 2878 H ILE B 85 23.555 6.164 -4.779 1.00 0.00 H ATOM 2879 N GLY B 86 23.881 3.108 -7.402 1.00 15.42 N ATOM 2880 CA GLY B 86 23.934 1.672 -7.232 1.00 15.12 C ATOM 2881 C GLY B 86 25.172 1.084 -7.801 1.00 16.31 C ATOM 2882 O GLY B 86 26.074 1.797 -8.253 1.00 16.72 O ATOM 2883 HA3 GLY B 86 23.073 1.227 -7.731 1.00 0.00 H ATOM 2884 HA2 GLY B 86 23.894 1.443 -6.167 1.00 0.00 H ATOM 2885 H GLY B 86 23.479 3.507 -8.274 1.00 0.00 H ATOM 2886 N ARG B 87 25.254 -0.236 -7.707 1.00 16.42 N ATOM 2887 CA ARG B 87 26.434 -0.952 -8.106 1.00 17.80 C ATOM 2888 C ARG B 87 26.703 -0.793 -9.566 1.00 19.24 C ATOM 2889 O ARG B 87 27.863 -0.807 -9.966 1.00 19.45 O ATOM 2890 CB ARG B 87 26.288 -2.420 -7.751 1.00 18.73 C ATOM 2891 CG ARG B 87 26.328 -2.681 -6.236 1.00 17.40 C ATOM 2892 CD ARG B 87 26.412 -4.185 -5.935 1.00 18.20 C ATOM 2893 NE ARG B 87 25.167 -4.852 -6.361 1.00 21.23 N ATOM 2894 CZ ARG B 87 24.982 -5.490 -7.517 1.00 23.26 C ATOM 2895 NH1 ARG B 87 25.961 -5.614 -8.419 1.00 22.82 N ATOM 2896 NH2 ARG B 87 23.778 -6.023 -7.780 1.00 24.98 N ATOM 2897 HA ARG B 87 27.285 -0.534 -7.568 1.00 0.00 H ATOM 2898 HB2 ARG B 87 25.335 -2.778 -8.140 1.00 0.00 H ATOM 2899 HB3 ARG B 87 27.101 -2.973 -8.220 1.00 0.00 H ATOM 2900 HG2 ARG B 87 27.200 -2.184 -5.812 1.00 0.00 H ATOM 2901 HG3 ARG B 87 25.424 -2.277 -5.781 1.00 0.00 H ATOM 2902 HD2 ARG B 87 26.553 -4.332 -4.864 1.00 0.00 H ATOM 2903 HD3 ARG B 87 27.256 -4.615 -6.474 1.00 0.00 H ATOM 2904 HE ARG B 87 24.363 -4.822 -5.702 1.00 0.00 H ATOM 2905 HH12 ARG B 87 25.785 -6.118 -9.312 1.00 0.00 H ATOM 2906 HH11 ARG B 87 26.899 -5.207 -8.228 1.00 0.00 H ATOM 2907 HH22 ARG B 87 23.616 -6.524 -8.677 1.00 0.00 H ATOM 2908 HH21 ARG B 87 23.008 -5.935 -7.087 1.00 0.00 H ATOM 2909 H ARG B 87 24.442 -0.768 -7.334 1.00 0.00 H ATOM 2910 N ASN B 88 25.642 -0.563 -10.348 1.00 18.94 N ATOM 2911 CA ASN B 88 25.798 -0.404 -11.776 1.00 20.10 C ATOM 2912 C ASN B 88 26.772 0.712 -12.135 1.00 20.54 C ATOM 2913 O ASN B 88 27.506 0.596 -13.102 1.00 22.55 O ATOM 2914 CB ASN B 88 24.455 -0.220 -12.464 1.00 20.87 C ATOM 2915 CG ASN B 88 23.871 1.138 -12.262 1.00 20.35 C ATOM 2916 OD1 ASN B 88 23.636 1.561 -11.129 1.00 19.65 O ATOM 2917 ND2 ASN B 88 23.586 1.829 -13.367 1.00 23.53 N ATOM 2918 HA ASN B 88 26.237 -1.329 -12.149 1.00 0.00 H ATOM 2919 HB2 ASN B 88 24.588 -0.384 -13.533 1.00 0.00 H ATOM 2920 HB3 ASN B 88 23.759 -0.959 -12.068 1.00 0.00 H ATOM 2921 HD22 ASN B 88 23.804 1.428 -14.302 1.00 0.00 H ATOM 2922 HD21 ASN B 88 23.146 2.768 -13.294 1.00 0.00 H ATOM 2923 H ASN B 88 24.695 -0.498 -9.924 1.00 0.00 H ATOM 2924 N LEU B 89 26.772 1.768 -11.332 1.00 19.51 N ATOM 2925 CA LEU B 89 27.668 2.880 -11.522 1.00 19.09 C ATOM 2926 C LEU B 89 28.904 2.788 -10.644 1.00 18.50 C ATOM 2927 O LEU B 89 29.965 3.222 -11.067 1.00 19.85 O ATOM 2928 CB LEU B 89 26.936 4.214 -11.315 1.00 19.12 C ATOM 2929 CG LEU B 89 25.731 4.433 -12.228 1.00 20.82 C ATOM 2930 CD1 LEU B 89 25.268 5.871 -12.031 1.00 22.25 C ATOM 2931 CD2 LEU B 89 26.051 4.155 -13.723 1.00 22.30 C ATOM 2932 HA LEU B 89 28.016 2.836 -12.554 1.00 0.00 H ATOM 2933 HB2 LEU B 89 26.591 4.255 -10.282 1.00 0.00 H ATOM 2934 HB3 LEU B 89 27.646 5.022 -11.491 1.00 0.00 H ATOM 2935 HG LEU B 89 24.945 3.726 -11.961 1.00 0.00 H ATOM 2936 HD21 LEU B 89 26.846 4.823 -14.053 1.00 0.00 H ATOM 2937 HD22 LEU B 89 26.373 3.120 -13.838 1.00 0.00 H ATOM 2938 HD23 LEU B 89 25.157 4.327 -14.323 1.00 0.00 H ATOM 2939 HD11 LEU B 89 24.991 6.022 -10.988 1.00 0.00 H ATOM 2940 HD12 LEU B 89 26.077 6.551 -12.295 1.00 0.00 H ATOM 2941 HD13 LEU B 89 24.406 6.064 -12.669 1.00 0.00 H ATOM 2942 H LEU B 89 26.102 1.794 -10.537 1.00 0.00 H ATOM 2943 N MET B 90 28.769 2.239 -9.437 1.00 18.09 N ATOM 2944 CA MET B 90 29.907 2.136 -8.521 1.00 18.61 C ATOM 2945 C MET B 90 31.018 1.274 -9.125 1.00 19.08 C ATOM 2946 O MET B 90 32.211 1.555 -8.952 1.00 19.77 O ATOM 2947 CB MET B 90 29.458 1.595 -7.156 1.00 18.21 C ATOM 2948 CG MET B 90 28.546 2.596 -6.385 1.00 17.68 C ATOM 2949 SD MET B 90 28.061 1.956 -4.794 1.00 19.75 S ATOM 2950 CE MET B 90 29.608 1.984 -3.893 1.00 18.67 C ATOM 2951 HA MET B 90 30.313 3.136 -8.366 1.00 0.00 H ATOM 2952 HB2 MET B 90 28.906 0.668 -7.312 1.00 0.00 H ATOM 2953 HB3 MET B 90 30.343 1.392 -6.552 1.00 0.00 H ATOM 2954 HG2 MET B 90 27.651 2.787 -6.977 1.00 0.00 H ATOM 2955 HG3 MET B 90 29.090 3.530 -6.240 1.00 0.00 H ATOM 2956 HE1 MET B 90 30.336 1.353 -4.403 1.00 0.00 H ATOM 2957 HE2 MET B 90 29.981 3.007 -3.846 1.00 0.00 H ATOM 2958 HE3 MET B 90 29.445 1.609 -2.883 1.00 0.00 H ATOM 2959 H MET B 90 27.840 1.878 -9.141 1.00 0.00 H ATOM 2960 N THR B 91 30.628 0.241 -9.857 1.00 19.59 N ATOM 2961 CA THR B 91 31.616 -0.605 -10.553 1.00 22.12 C ATOM 2962 C THR B 91 32.422 0.246 -11.543 1.00 23.43 C ATOM 2963 O THR B 91 33.640 0.079 -11.678 1.00 23.62 O ATOM 2964 CB THR B 91 30.952 -1.788 -11.293 1.00 22.77 C ATOM 2965 OG1 THR B 91 29.875 -1.334 -12.109 1.00 22.51 O ATOM 2966 CG2 THR B 91 30.313 -2.764 -10.287 1.00 22.45 C ATOM 2967 HA THR B 91 32.281 -1.025 -9.798 1.00 0.00 H ATOM 2968 HB THR B 91 31.734 -2.264 -11.884 1.00 0.00 H ATOM 2969 HG1 THR B 91 29.465 -2.107 -12.573 1.00 0.00 H ATOM 2970 HG23 THR B 91 31.084 -3.156 -9.623 1.00 0.00 H ATOM 2971 HG21 THR B 91 29.560 -2.238 -9.701 1.00 0.00 H ATOM 2972 HG22 THR B 91 29.845 -3.587 -10.828 1.00 0.00 H ATOM 2973 H THR B 91 29.614 0.024 -9.942 1.00 0.00 H ATOM 2974 N GLN B 92 31.748 1.201 -12.190 1.00 23.34 N ATOM 2975 CA GLN B 92 32.364 2.042 -13.233 1.00 23.94 C ATOM 2976 C GLN B 92 33.316 3.080 -12.696 1.00 24.69 C ATOM 2977 O GLN B 92 34.110 3.668 -13.423 1.00 24.88 O ATOM 2978 CB GLN B 92 31.281 2.771 -14.001 1.00 23.74 C ATOM 2979 CG GLN B 92 30.334 1.853 -14.664 1.00 22.99 C ATOM 2980 CD GLN B 92 29.508 2.586 -15.637 1.00 24.89 C ATOM 2981 OE1 GLN B 92 30.021 3.462 -16.360 1.00 26.83 O ATOM 2982 NE2 GLN B 92 28.234 2.251 -15.691 1.00 26.40 N ATOM 2983 HA GLN B 92 32.933 1.361 -13.865 1.00 0.00 H ATOM 2984 HB2 GLN B 92 30.726 3.403 -13.307 1.00 0.00 H ATOM 2985 HB3 GLN B 92 31.752 3.395 -14.761 1.00 0.00 H ATOM 2986 HG2 GLN B 92 30.892 1.072 -15.181 1.00 0.00 H ATOM 2987 HG3 GLN B 92 29.688 1.399 -13.913 1.00 0.00 H ATOM 2988 HE22 GLN B 92 27.864 1.511 -15.061 1.00 0.00 H ATOM 2989 HE21 GLN B 92 27.599 2.727 -16.364 1.00 0.00 H ATOM 2990 H GLN B 92 30.749 1.358 -11.948 1.00 0.00 H ATOM 2991 N ILE B 93 33.217 3.341 -11.410 1.00 24.21 N ATOM 2992 CA ILE B 93 34.188 4.199 -10.793 1.00 25.77 C ATOM 2993 C ILE B 93 35.199 3.422 -9.966 1.00 25.66 C ATOM 2994 O ILE B 93 36.098 4.013 -9.370 1.00 27.57 O ATOM 2995 CB ILE B 93 33.529 5.345 -10.035 1.00 25.75 C ATOM 2996 CG1 ILE B 93 32.893 4.825 -8.768 1.00 25.86 C ATOM 2997 CG2 ILE B 93 32.478 5.996 -10.881 1.00 26.61 C ATOM 2998 CD1 ILE B 93 32.511 5.924 -7.838 1.00 25.31 C ATOM 2999 HA ILE B 93 34.767 4.665 -11.591 1.00 0.00 H ATOM 3000 HB ILE B 93 34.295 6.080 -9.787 1.00 0.00 H ATOM 3001 HG12 ILE B 93 31.999 4.260 -9.030 1.00 0.00 H ATOM 3002 HG13 ILE B 93 33.601 4.168 -8.263 1.00 0.00 H ATOM 3003 HD11 ILE B 93 33.400 6.491 -7.563 1.00 0.00 H ATOM 3004 HD12 ILE B 93 31.796 6.583 -8.331 1.00 0.00 H ATOM 3005 HD13 ILE B 93 32.058 5.499 -6.942 1.00 0.00 H ATOM 3006 HG21 ILE B 93 32.936 6.388 -11.789 1.00 0.00 H ATOM 3007 HG22 ILE B 93 31.718 5.260 -11.144 1.00 0.00 H ATOM 3008 HG23 ILE B 93 32.018 6.812 -10.323 1.00 0.00 H ATOM 3009 H ILE B 93 32.444 2.930 -10.848 1.00 0.00 H ATOM 3010 N GLY B 94 35.030 2.101 -9.934 1.00 25.27 N ATOM 3011 CA GLY B 94 35.991 1.178 -9.352 1.00 24.23 C ATOM 3012 C GLY B 94 35.836 1.091 -7.847 1.00 24.11 C ATOM 3013 O GLY B 94 36.812 0.855 -7.130 1.00 24.79 O ATOM 3014 HA3 GLY B 94 36.999 1.522 -9.585 1.00 0.00 H ATOM 3015 HA2 GLY B 94 35.837 0.188 -9.782 1.00 0.00 H ATOM 3016 H GLY B 94 34.161 1.708 -10.349 1.00 0.00 H ATOM 3017 N CYS B 95 34.617 1.269 -7.378 1.00 22.57 N ATOM 3018 CA CYS B 95 34.351 1.358 -5.970 1.00 22.46 C ATOM 3019 C CYS B 95 34.298 -0.018 -5.300 1.00 22.52 C ATOM 3020 O CYS B 95 33.545 -0.888 -5.740 1.00 22.20 O ATOM 3021 CB CYS B 95 33.038 2.110 -5.812 1.00 22.63 C ATOM 3022 SG CYS B 95 32.652 2.439 -4.125 1.00 20.97 S ATOM 3023 HA CYS B 95 35.161 1.888 -5.470 1.00 0.00 H ATOM 3024 HB2 CYS B 95 32.237 1.511 -6.244 1.00 0.00 H ATOM 3025 HB3 CYS B 95 33.110 3.057 -6.346 1.00 0.00 H ATOM 3026 HG CYS B 95 31.454 3.120 -4.053 1.00 0.00 H ATOM 3027 H CYS B 95 33.825 1.347 -8.047 1.00 0.00 H ATOM 3028 N THR B 96 35.099 -0.205 -4.241 1.00 22.46 N ATOM 3029 CA THR B 96 35.153 -1.457 -3.506 1.00 23.58 C ATOM 3030 C THR B 96 34.785 -1.227 -2.068 1.00 22.37 C ATOM 3031 O THR B 96 34.954 -0.120 -1.527 1.00 22.50 O ATOM 3032 CB THR B 96 36.559 -2.091 -3.577 1.00 23.09 C ATOM 3033 OG1 THR B 96 37.520 -1.167 -3.033 1.00 25.13 O ATOM 3034 CG2 THR B 96 36.987 -2.347 -5.052 1.00 26.81 C ATOM 3035 HA THR B 96 34.441 -2.142 -3.966 1.00 0.00 H ATOM 3036 HB THR B 96 36.526 -3.030 -3.024 1.00 0.00 H ATOM 3037 HG1 THR B 96 37.290 -0.970 -2.090 1.00 0.00 H ATOM 3038 HG23 THR B 96 36.289 -3.044 -5.516 1.00 0.00 H ATOM 3039 HG21 THR B 96 36.979 -1.405 -5.600 1.00 0.00 H ATOM 3040 HG22 THR B 96 37.991 -2.770 -5.069 1.00 0.00 H ATOM 3041 H THR B 96 35.708 0.580 -3.933 1.00 0.00 H ATOM 3042 N LEU B 97 34.246 -2.271 -1.461 1.00 22.02 N ATOM 3043 CA LEU B 97 34.153 -2.358 -0.021 1.00 22.45 C ATOM 3044 C LEU B 97 35.406 -3.009 0.518 1.00 24.15 C ATOM 3045 O LEU B 97 35.996 -3.907 -0.095 1.00 25.40 O ATOM 3046 CB LEU B 97 32.924 -3.170 0.414 1.00 23.11 C ATOM 3047 CG LEU B 97 31.579 -2.498 0.373 1.00 21.38 C ATOM 3048 CD1 LEU B 97 30.485 -3.557 0.608 1.00 22.46 C ATOM 3049 CD2 LEU B 97 31.533 -1.412 1.454 1.00 22.84 C ATOM 3050 HA LEU B 97 34.048 -1.349 0.379 1.00 0.00 H ATOM 3051 HB2 LEU B 97 32.869 -4.045 -0.233 1.00 0.00 H ATOM 3052 HB3 LEU B 97 33.095 -3.490 1.442 1.00 0.00 H ATOM 3053 HG LEU B 97 31.410 -2.031 -0.597 1.00 0.00 H ATOM 3054 HD21 LEU B 97 31.688 -1.868 2.432 1.00 0.00 H ATOM 3055 HD22 LEU B 97 32.317 -0.679 1.265 1.00 0.00 H ATOM 3056 HD23 LEU B 97 30.561 -0.919 1.431 1.00 0.00 H ATOM 3057 HD11 LEU B 97 30.542 -4.316 -0.172 1.00 0.00 H ATOM 3058 HD12 LEU B 97 30.635 -4.023 1.582 1.00 0.00 H ATOM 3059 HD13 LEU B 97 29.506 -3.079 0.580 1.00 0.00 H ATOM 3060 H LEU B 97 33.877 -3.054 -2.038 1.00 0.00 H ATOM 3061 N ASN B 98 35.877 -2.529 1.650 1.00 25.49 N ATOM 3062 CA ASN B 98 37.116 -3.043 2.179 1.00 28.01 C ATOM 3063 C ASN B 98 36.995 -3.121 3.668 1.00 28.73 C ATOM 3064 O ASN B 98 36.490 -2.202 4.288 1.00 27.68 O ATOM 3065 CB ASN B 98 38.277 -2.100 1.885 1.00 29.17 C ATOM 3066 CG ASN B 98 38.491 -1.894 0.432 1.00 29.92 C ATOM 3067 OD1 ASN B 98 37.759 -1.155 -0.198 1.00 34.10 O ATOM 3068 ND2 ASN B 98 39.504 -2.506 -0.104 1.00 32.25 N ATOM 3069 HA ASN B 98 37.304 -4.014 1.721 1.00 0.00 H ATOM 3070 HB2 ASN B 98 38.069 -1.135 2.348 1.00 0.00 H ATOM 3071 HB3 ASN B 98 39.186 -2.520 2.316 1.00 0.00 H ATOM 3072 HD22 ASN B 98 40.102 -3.129 0.476 1.00 0.00 H ATOM 3073 HD21 ASN B 98 39.717 -2.373 -1.113 1.00 0.00 H ATOM 3074 H ASN B 98 35.359 -1.784 2.159 1.00 0.00 H ATOM 3075 N PHE B 99 37.437 -4.234 4.222 1.00 29.17 N ATOM 3076 CA PHE B 99 37.574 -4.350 5.653 1.00 31.13 C ATOM 3077 C PHE B 99 38.555 -5.479 5.953 1.00 32.47 C ATOM 3078 O PHE B 99 38.975 -6.194 5.051 1.00 33.83 O ATOM 3079 CB PHE B 99 36.215 -4.583 6.302 1.00 30.53 C ATOM 3080 CG PHE B 99 35.553 -5.873 5.909 1.00 30.82 C ATOM 3081 CD1 PHE B 99 35.717 -7.029 6.695 1.00 32.45 C ATOM 3082 CD2 PHE B 99 34.715 -5.932 4.802 1.00 30.83 C ATOM 3083 CE1 PHE B 99 35.083 -8.228 6.344 1.00 31.84 C ATOM 3084 CE2 PHE B 99 34.069 -7.132 4.457 1.00 30.89 C ATOM 3085 CZ PHE B 99 34.250 -8.265 5.222 1.00 30.99 C ATOM 3086 HA PHE B 99 37.966 -3.424 6.074 1.00 0.00 H ATOM 3087 OXT PHE B 99 38.981 -5.689 7.079 1.00 33.46 O ATOM 3088 HB2 PHE B 99 36.349 -4.584 7.384 1.00 0.00 H ATOM 3089 HB3 PHE B 99 35.557 -3.762 6.019 1.00 0.00 H ATOM 3090 HD2 PHE B 99 34.557 -5.040 4.196 1.00 0.00 H ATOM 3091 HE2 PHE B 99 33.422 -7.167 3.581 1.00 0.00 H ATOM 3092 HZ PHE B 99 33.743 -9.191 4.951 1.00 0.00 H ATOM 3093 HE1 PHE B 99 35.238 -9.126 6.942 1.00 0.00 H ATOM 3094 HD1 PHE B 99 36.344 -6.991 7.586 1.00 0.00 H ATOM 3095 H PHE B 99 37.691 -5.041 3.617 1.00 0.00 H TER 3096 PHE B 99 HETATM 3097 O HOH 1 14.525 -0.056 0.220 1.00 25.58 O HETATM 3098 O HOH 2 23.656 4.933 4.496 1.00 22.48 O HETATM 3099 O HOH 3 20.357 -2.098 13.134 1.00 25.08 O HETATM 3100 O HOH 4 20.982 5.163 4.436 1.00 27.27 O HETATM 3101 O HOH 5 24.408 -0.931 16.422 1.00 25.87 O HETATM 3102 O HOH 6 33.532 2.509 8.317 1.00 26.90 O HETATM 3103 O HOH 7 25.925 -16.856 17.052 1.00 17.36 O HETATM 3104 O HOH 8 19.716 -12.160 2.479 1.00 29.29 O HETATM 3105 O HOH 9 22.490 -21.924 10.607 1.00 34.13 O HETATM 3106 O HOH 10 20.654 -16.461 4.444 1.00 26.77 O HETATM 3107 O HOH 11 24.092 -13.741 18.259 1.00 23.76 O HETATM 3108 O HOH 12 35.513 -6.548 14.371 1.00 25.42 O HETATM 3109 O HOH 13 38.546 -0.371 5.433 1.00 35.55 O HETATM 3110 O HOH 14 35.857 -2.954 -9.263 1.00 50.50 O HETATM 3111 O HOH 15 31.748 -15.056 10.234 1.00 38.68 O HETATM 3112 O HOH 16 23.098 -2.202 20.257 1.00 38.49 O HETATM 3113 O HOH 17 27.161 -12.024 -4.784 1.00 36.51 O HETATM 3114 O HOH 18 25.625 -13.309 -9.229 1.00 47.26 O HETATM 3115 O HOH 19 19.880 -19.589 8.696 1.00 42.06 O HETATM 3116 O HOH 20 29.945 -11.030 18.415 1.00 37.04 O HETATM 3117 O HOH 21 40.358 -9.489 -0.652 1.00 40.02 O HETATM 3118 O HOH 22 18.817 6.047 10.850 1.00 35.20 O HETATM 3119 O HOH 23 19.073 -17.562 17.938 1.00 35.64 O HETATM 3120 O HOH 24 32.266 -8.345 -7.540 1.00 33.09 O HETATM 3121 O HOH 25 29.348 -13.495 17.589 1.00 31.80 O HETATM 3122 O HOH 26 17.310 -12.584 -0.174 1.00 36.30 O HETATM 3123 O HOH 27 21.164 0.525 13.723 1.00 42.83 O HETATM 3124 O HOH 28 29.592 -11.967 -2.244 1.00 34.01 O HETATM 3125 O HOH 29 27.663 -14.930 16.137 1.00 36.39 O HETATM 3126 O HOH 30 30.439 -7.797 -4.345 1.00 30.42 O HETATM 3127 O HOH 31 8.523 2.606 18.368 1.00 43.04 O HETATM 3128 O HOH 32 18.302 1.656 8.434 1.00 36.37 O HETATM 3129 O HOH 33 6.951 2.503 21.304 1.00 41.66 O HETATM 3130 O HOH 34 34.818 -9.155 -4.781 1.00 34.62 O HETATM 3131 O HOH 35 20.982 -16.500 20.254 1.00 42.47 O HETATM 3132 O HOH 36 38.388 -4.505 9.342 1.00 39.09 O HETATM 3133 O HOH 37 18.964 -20.888 10.664 1.00 38.56 O HETATM 3134 O HOH 38 11.169 -12.831 7.217 1.00 45.41 O HETATM 3135 O HOH 39 19.572 -7.559 -3.027 1.00 37.60 O HETATM 3136 O HOH 40 9.001 -11.875 8.092 1.00 37.45 O HETATM 3137 O HOH 41 21.809 -13.517 20.129 1.00 33.90 O HETATM 3138 O HOH 42 15.532 -18.592 12.715 1.00 34.33 O HETATM 3139 O HOH 43 4.746 0.512 3.324 1.00 43.71 O HETATM 3140 O HOH 44 17.516 4.660 12.300 1.00 54.94 O HETATM 3141 O HOH 45 34.474 0.439 16.038 1.00 43.57 O HETATM 3142 O HOH 46 28.353 -15.122 1.313 1.00 48.22 O HETATM 3143 O HOH 47 36.672 -10.416 -2.756 1.00 50.51 O HETATM 3144 O HOH 48 23.395 3.853 11.640 1.00 38.26 O HETATM 3145 O HOH 49 6.041 5.036 -1.904 1.00 50.62 O HETATM 3146 O HOH 50 15.885 -0.581 21.825 1.00 44.17 O HETATM 3147 O HOH 51 9.251 -10.662 10.277 1.00 52.58 O HETATM 3148 O HOH 52 38.076 -10.456 -0.800 1.00 46.82 O HETATM 3149 O HOH 53 8.031 -7.494 12.752 1.00 49.33 O HETATM 3150 O HOH 54 25.794 2.286 15.280 1.00 50.79 O HETATM 3151 O HOH 55 35.831 -0.087 13.657 1.00 44.69 O HETATM 3152 O HOH 56 27.920 -18.850 18.529 1.00 59.15 O HETATM 3153 O HOH 57 13.135 -16.699 20.725 1.00 46.15 O HETATM 3154 O HOH 58 40.053 7.701 -7.449 1.00 46.92 O HETATM 3155 O HOH 59 41.010 -10.556 4.816 1.00 54.92 O HETATM 3156 O HOH 60 13.125 -19.222 14.495 1.00 53.36 O HETATM 3157 O HOH 61 3.876 1.325 -0.561 1.00 40.20 O HETATM 3158 O HOH 62 9.515 5.801 0.667 1.00 52.28 O HETATM 3159 O HOH 63 21.046 -1.164 25.095 1.00 53.10 O HETATM 3160 O HOH 64 18.392 -5.323 25.282 1.00 50.45 O HETATM 3161 O HOH 65 19.093 1.582 20.960 1.00 46.82 O HETATM 3162 O HOH 66 30.617 -15.871 16.496 1.00 59.02 O HETATM 3163 O HOH 67 34.755 -11.429 0.157 1.00 51.22 O HETATM 3164 O HOH 68 28.160 3.140 13.261 1.00 41.96 O HETATM 3165 O HOH 69 26.483 -20.216 20.798 1.00 52.16 O HETATM 3166 O HOH 70 31.001 -17.986 3.200 1.00 47.06 O HETATM 3167 O HOH 71 26.904 0.094 16.105 1.00 42.60 O HETATM 3168 O HOH 72 36.708 -10.259 15.472 1.00 45.42 O HETATM 3169 O HOH 73 26.321 4.306 12.273 1.00 50.85 O HETATM 3170 O HOH 74 39.840 -11.967 3.342 1.00 47.39 O HETATM 3171 O HOH 75 10.269 5.188 -2.266 1.00 51.60 O HETATM 3172 O HOH 76 12.755 -15.489 18.442 1.00 57.22 O HETATM 3173 O HOH 77 21.788 5.910 11.435 1.00 52.63 O HETATM 3174 O HOH 78 28.407 -14.853 20.381 1.00 51.56 O HETATM 3175 O HOH 79 12.657 -13.154 19.688 1.00 40.80 O HETATM 3176 O HOH 80 39.887 -2.113 8.477 1.00 52.79 O HETATM 3177 O HOH 81 28.014 -13.954 -3.188 1.00 48.57 O HETATM 3178 O HOH 82 18.297 -14.385 2.821 1.00 53.70 O HETATM 3179 O HOH 83 16.327 -10.080 -2.738 1.00 49.27 O HETATM 3180 O HOH 84 34.752 1.810 10.724 1.00 43.74 O HETATM 3181 O HOH 85 20.338 -12.330 0.430 1.00 44.54 O HETATM 3182 O HOH 86 17.889 -15.434 6.286 1.00 42.21 O HETATM 3183 O HOH 87 26.085 -17.044 18.345 1.00 22.74 O HETATM 3184 O HOH 88 36.390 -6.324 13.238 1.00 24.66 O HETATM 3185 O HOH 89 16.873 -1.553 24.319 1.00 42.96 O HETATM 3186 O HOH 90 17.763 -7.725 22.690 1.00 50.76 O HETATM 3187 O HOH 91 11.673 -12.293 4.896 1.00 44.46 O HETATM 3188 O HOH 92 22.528 1.410 15.853 1.00 41.98 O HETATM 3189 O HOH 93 33.051 -15.343 5.806 1.00 43.93 O HETATM 3190 O HOH 94 17.231 -13.747 8.460 1.00 43.41 O HETATM 3191 O HOH 95 37.843 -12.661 5.143 1.00 56.39 O HETATM 3192 O HOH 96 25.807 -2.016 20.787 1.00 52.78 O HETATM 3193 O HOH 97 23.708 -4.903 -4.064 1.00 22.03 O HETATM 3194 O HOH 98 20.290 1.982 -12.772 1.00 24.54 O HETATM 3195 O HOH 99 20.909 -5.213 -3.911 1.00 22.92 O HETATM 3196 O HOH 100 24.344 0.967 -16.024 1.00 23.58 O HETATM 3197 O HOH 101 33.497 -2.532 -7.950 1.00 26.35 O HETATM 3198 O HOH 102 26.051 16.941 -16.568 1.00 15.13 O HETATM 3199 O HOH 103 22.320 21.874 -10.167 1.00 34.65 O HETATM 3200 O HOH 104 19.643 12.098 -2.081 1.00 32.03 O HETATM 3201 O HOH 105 27.169 12.097 5.129 1.00 33.76 O HETATM 3202 O HOH 106 20.645 16.500 -4.026 1.00 28.35 O HETATM 3203 O HOH 107 24.064 13.708 -17.853 1.00 22.71 O HETATM 3204 O HOH 108 35.961 3.203 9.760 1.00 39.82 O HETATM 3205 O HOH 109 22.937 2.263 -19.718 1.00 40.04 O HETATM 3206 O HOH 110 30.470 7.849 4.848 1.00 28.67 O HETATM 3207 O HOH 111 38.602 0.430 -4.963 1.00 33.74 O HETATM 3208 O HOH 112 36.015 6.364 -13.342 1.00 45.82 O HETATM 3209 O HOH 113 30.041 11.172 -17.868 1.00 34.56 O HETATM 3210 O HOH 114 18.709 -5.938 -10.376 1.00 36.09 O HETATM 3211 O HOH 115 31.150 18.060 -2.903 1.00 53.14 O HETATM 3212 O HOH 116 20.002 19.815 -8.238 1.00 43.47 O HETATM 3213 O HOH 117 19.097 17.509 -17.604 1.00 35.68 O HETATM 3214 O HOH 118 32.322 8.304 7.882 1.00 34.54 O HETATM 3215 O HOH 119 29.218 13.484 -17.132 1.00 34.83 O HETATM 3216 O HOH 120 35.032 8.961 5.290 1.00 31.76 O HETATM 3217 O HOH 121 21.760 17.604 -19.851 1.00 27.36 O HETATM 3218 O HOH 122 23.972 -3.794 -10.848 1.00 36.67 O HETATM 3219 O HOH 123 30.902 15.132 -9.458 1.00 41.33 O HETATM 3220 O HOH 124 8.467 -2.696 -18.016 1.00 40.93 O HETATM 3221 O HOH 125 26.489 -4.225 -11.567 1.00 47.71 O HETATM 3222 O HOH 126 17.564 12.513 0.744 1.00 36.80 O HETATM 3223 O HOH 127 27.030 5.516 -24.345 1.00 43.63 O HETATM 3224 O HOH 128 42.084 8.246 0.342 1.00 49.41 O HETATM 3225 O HOH 129 9.021 11.825 -7.900 1.00 43.86 O HETATM 3226 O HOH 130 33.607 5.145 -16.571 1.00 44.11 O HETATM 3227 O HOH 131 18.813 20.835 -10.189 1.00 47.08 O HETATM 3228 O HOH 132 16.085 0.309 -21.473 1.00 43.39 O HETATM 3229 O HOH 133 27.508 14.872 -15.814 1.00 39.73 O HETATM 3230 O HOH 134 38.380 4.540 -8.915 1.00 37.55 O HETATM 3231 O HOH 135 18.004 9.932 -22.361 1.00 43.66 O HETATM 3232 O HOH 136 29.509 11.958 2.695 1.00 35.21 O HETATM 3233 O HOH 137 36.615 10.234 2.894 1.00 45.61 O HETATM 3234 O HOH 138 28.543 15.079 -0.852 1.00 46.85 O HETATM 3235 O HOH 139 21.881 13.645 -19.752 1.00 33.45 O HETATM 3236 O HOH 140 5.505 3.927 -8.305 1.00 45.90 O HETATM 3237 O HOH 141 4.777 -0.382 -2.833 1.00 48.66 O HETATM 3238 O HOH 142 19.463 7.653 3.580 1.00 38.51 O HETATM 3239 O HOH 143 30.389 15.596 -15.998 1.00 64.74 O HETATM 3240 O HOH 144 15.484 18.627 -12.517 1.00 38.79 O HETATM 3241 O HOH 145 18.188 18.930 -6.971 1.00 49.95 O HETATM 3242 O HOH 146 11.142 12.865 -6.764 1.00 46.68 O HETATM 3243 O HOH 147 34.996 -0.627 -15.544 1.00 47.04 O HETATM 3244 O HOH 148 21.092 -0.332 -13.260 1.00 43.68 O HETATM 3245 O HOH 149 35.970 0.067 -12.908 1.00 50.35 O HETATM 3246 O HOH 150 10.019 11.746 -22.107 1.00 46.81 O HETATM 3247 O HOH 151 17.539 -4.763 -12.027 1.00 54.91 O HETATM 3248 O HOH 152 20.348 12.197 -0.064 1.00 48.73 O HETATM 3249 O HOH 153 21.055 8.302 -23.529 1.00 44.18 O HETATM 3250 O HOH 154 21.770 14.705 0.735 1.00 38.30 O HETATM 3251 O HOH 155 22.549 -1.292 -15.533 1.00 48.27 O HETATM 3252 O HOH 156 30.435 11.637 -20.370 1.00 44.49 O HETATM 3253 O HOH 157 5.987 -4.887 2.126 1.00 49.52 O HETATM 3254 O HOH 158 25.664 9.977 11.233 1.00 48.01 O HETATM 3255 O HOH 159 19.020 -1.644 -20.309 1.00 40.72 O HETATM 3256 O HOH 160 28.316 -3.032 -13.055 1.00 44.44 O HETATM 3257 O HOH 161 6.339 6.913 -10.106 1.00 49.67 O HETATM 3258 O HOH 162 31.021 10.171 3.589 1.00 35.82 O HETATM 3259 O HOH 163 17.395 9.280 4.768 1.00 50.21 O HETATM 3260 O HOH 164 23.298 2.899 -28.036 1.00 50.28 O HETATM 3261 O HOH 165 9.260 10.722 -10.051 1.00 50.14 O HETATM 3262 O HOH 166 20.917 3.716 -25.078 1.00 50.79 O HETATM 3263 O HOH 167 21.094 -4.557 -12.480 1.00 45.02 O HETATM 3264 O HOH 168 28.062 3.857 -23.110 1.00 49.42 O HETATM 3265 O HOH 169 2.352 -0.212 -3.877 1.00 50.38 O HETATM 3266 O HOH 170 7.792 7.477 -12.246 1.00 50.53 O HETATM 3267 O HOH 171 39.683 12.226 -2.913 1.00 52.02 O HETATM 3268 O HOH 172 11.578 -4.164 -14.319 1.00 57.26 O HETATM 3269 O HOH 173 23.775 -7.731 -9.875 1.00 45.10 O HETATM 3270 O HOH 174 16.340 9.850 2.872 1.00 47.95 O HETATM 3271 O HOH 175 19.338 14.659 -2.234 1.00 43.22 O HETATM 3272 O HOH 176 18.937 1.423 -25.773 1.00 51.11 O HETATM 3273 O HOH 177 21.620 21.162 -5.846 1.00 50.27 O HETATM 3274 O HOH 178 6.817 6.317 -14.331 1.00 53.76 O HETATM 3275 O HOH 179 40.156 9.618 1.429 1.00 43.55 O HETATM 3276 O HOH 180 26.066 17.004 -17.950 1.00 23.07 O HETATM 3277 O HOH 181 17.898 15.480 -5.726 1.00 40.22 O HETATM 3278 O HOH 182 20.931 16.521 -19.738 1.00 25.17 O HETATM 3279 O HOH 183 25.581 15.108 -20.329 1.00 47.78 O HETATM 3280 O HOH 184 37.906 7.530 -14.777 1.00 47.83 O HETATM 3281 O HOH 185 22.190 12.818 -21.923 1.00 41.88 O HETATM 3282 O HOH 186 16.494 9.200 7.330 1.00 51.31 O HETATM 3283 N1 UNN A 187 18.219 1.275 1.974 1.00 -0.28 N HETATM 3284 C1 UNN A 187 18.240 1.290 0.524 1.00 0.08 C HETATM 3285 C2 UNN A 187 19.162 0.219 -0.029 1.00 0.11 C HETATM 3286 O1 UNN A 187 20.463 0.495 0.465 1.00 -0.39 O HETATM 3287 H8 UNN A 187 21.070 -0.158 0.138 1.00 0.21 H HETATM 3288 C52 UNN A 187 18.752 -1.177 0.429 1.00 0.11 C HETATM 3289 C51 UNN A 187 17.473 -1.692 -0.197 1.00 0.08 C HETATM 3290 N51 UNN A 187 17.587 -1.687 -1.645 1.00 -0.28 N HETATM 3291 C61 UNN A 187 16.850 -0.957 -2.491 1.00 0.20 C HETATM 3292 C60 UNN A 187 17.308 -0.979 -3.929 1.00 0.13 C HETATM 3293 N52 UNN A 187 16.887 -2.282 -4.417 1.00 -0.26 N HETATM 3294 C69 UNN A 187 17.604 -3.085 -5.199 1.00 0.20 C HETATM 3295 C68 UNN A 187 16.890 -4.335 -5.610 1.00 0.13 C HETATM 3296 N54 UNN A 187 16.979 -4.421 -7.054 1.00 -0.24 N HETATM 3297 C81 UNN A 187 15.889 -4.397 -7.794 1.00 0.32 C HETATM 3298 O58 UNN A 187 14.848 -3.832 -7.494 1.00 -0.38 O HETATM 3299 O59 UNN A 187 15.936 -5.073 -9.063 1.00 -0.25 O HETATM 3300 CA5 UNN A 187 14.699 -5.086 -9.797 1.00 0.11 C HETATM 3301 C50 UNN A 187 13.822 -6.286 -9.506 1.00 -0.01 C HETATM 3302 C63 UNN A 187 12.772 -6.571 -10.393 1.00 -0.06 C HETATM 3303 C64 UNN A 187 11.927 -7.661 -10.174 1.00 -0.07 C HETATM 3304 C65 UNN A 187 12.119 -8.492 -9.067 1.00 -0.07 C HETATM 3305 C66 UNN A 187 13.169 -8.211 -8.171 1.00 -0.07 C HETATM 3306 C67 UNN A 187 14.024 -7.118 -8.397 1.00 -0.06 C HETATM 3307 H31 UNN A 187 14.841 -6.919 -7.712 1.00 0.06 H HETATM 3308 H30 UNN A 187 13.319 -8.841 -7.302 1.00 0.06 H HETATM 3309 H29 UNN A 187 11.468 -9.342 -8.900 1.00 0.06 H HETATM 3310 H28 UNN A 187 11.118 -7.864 -10.866 1.00 0.06 H HETATM 3311 H27 UNN A 187 12.615 -5.937 -11.258 1.00 0.06 H HETATM 3312 H25 UNN A 187 14.934 -5.082 -10.871 1.00 0.08 H HETATM 3313 H26 UNN A 187 14.136 -4.176 -9.542 1.00 0.08 H HETATM 3314 H32 UNN A 187 17.875 -4.499 -7.492 1.00 0.19 H HETATM 3315 C70 UNN A 187 17.483 -5.586 -4.982 1.00 -0.02 C HETATM 3316 H34 UNN A 187 17.413 -5.515 -3.887 1.00 0.03 H HETATM 3317 H35 UNN A 187 18.539 -5.679 -5.276 1.00 0.03 H HETATM 3318 H36 UNN A 187 16.927 -6.469 -5.329 1.00 0.03 H HETATM 3319 H33 UNN A 187 15.835 -4.260 -5.309 1.00 0.08 H HETATM 3320 O54 UNN A 187 18.734 -2.862 -5.630 1.00 -0.39 O HETATM 3321 H37 UNN A 187 15.981 -2.602 -4.141 1.00 0.19 H HETATM 3322 C62 UNN A 187 16.727 0.151 -4.816 1.00 -0.01 C HETATM 3323 CG6 UNN A 187 16.858 -0.059 -6.312 1.00 -0.06 C HETATM 3324 H40 UNN A 187 16.416 0.797 -6.843 1.00 0.02 H HETATM 3325 H41 UNN A 187 16.331 -0.981 -6.600 1.00 0.02 H HETATM 3326 H42 UNN A 187 17.922 -0.146 -6.578 1.00 0.02 H HETATM 3327 CG5 UNN A 187 17.280 1.542 -4.462 1.00 -0.06 C HETATM 3328 H43 UNN A 187 17.191 1.707 -3.378 1.00 0.02 H HETATM 3329 H44 UNN A 187 16.706 2.312 -4.999 1.00 0.02 H HETATM 3330 H45 UNN A 187 18.338 1.602 -4.756 1.00 0.02 H HETATM 3331 H39 UNN A 187 15.649 0.171 -4.599 1.00 0.03 H HETATM 3332 H38 UNN A 187 18.405 -0.902 -3.959 1.00 0.08 H HETATM 3333 O52 UNN A 187 15.831 -0.387 -2.161 1.00 -0.39 O HETATM 3334 H46 UNN A 187 18.281 -2.284 -2.047 1.00 0.19 H HETATM 3335 C53 UNN A 187 17.322 -3.095 0.409 1.00 0.01 C HETATM 3336 C54 UNN A 187 16.722 -4.183 -0.447 1.00 -0.04 C HETATM 3337 C55 UNN A 187 15.424 -4.052 -0.920 1.00 -0.06 C HETATM 3338 C56 UNN A 187 14.877 -5.063 -1.692 1.00 -0.07 C HETATM 3339 C57 UNN A 187 15.608 -6.226 -1.975 1.00 -0.07 C HETATM 3340 C58 UNN A 187 16.916 -6.371 -1.502 1.00 -0.07 C HETATM 3341 C59 UNN A 187 17.464 -5.345 -0.729 1.00 -0.06 C HETATM 3342 H54 UNN A 187 18.472 -5.445 -0.342 1.00 0.06 H HETATM 3343 H53 UNN A 187 17.492 -7.260 -1.730 1.00 0.06 H HETATM 3344 H52 UNN A 187 15.157 -7.017 -2.563 1.00 0.06 H HETATM 3345 H51 UNN A 187 13.872 -4.954 -2.082 1.00 0.06 H HETATM 3346 H50 UNN A 187 14.844 -3.167 -0.687 1.00 0.06 H HETATM 3347 H48 UNN A 187 16.688 -2.997 1.303 1.00 0.04 H HETATM 3348 H49 UNN A 187 18.326 -3.431 0.706 1.00 0.04 H HETATM 3349 H47 UNN A 187 16.617 -1.064 0.091 1.00 0.06 H HETATM 3350 O51 UNN A 187 19.783 -2.079 0.065 1.00 -0.39 O HETATM 3351 H56 UNN A 187 20.605 -1.787 0.442 1.00 0.21 H HETATM 3352 H55 UNN A 187 18.630 -1.165 1.522 1.00 0.06 H HETATM 3353 H4 UNN A 187 19.155 0.258 -1.128 1.00 0.06 H HETATM 3354 C3 UNN A 187 18.802 2.618 0.065 1.00 0.01 C HETATM 3355 C4 UNN A 187 17.876 3.717 0.489 1.00 -0.04 C HETATM 3356 C5 UNN A 187 18.402 4.831 1.174 1.00 -0.06 C HETATM 3357 C6 UNN A 187 17.537 5.858 1.566 1.00 -0.07 C HETATM 3358 C7 UNN A 187 16.167 5.753 1.267 1.00 -0.07 C HETATM 3359 C8 UNN A 187 15.656 4.635 0.591 1.00 -0.07 C HETATM 3360 C9 UNN A 187 16.511 3.615 0.194 1.00 -0.06 C HETATM 3361 H12 UNN A 187 16.127 2.752 -0.337 1.00 0.06 H HETATM 3362 H11 UNN A 187 14.595 4.567 0.379 1.00 0.06 H HETATM 3363 H10 UNN A 187 15.494 6.550 1.564 1.00 0.06 H HETATM 3364 H9 UNN A 187 17.918 6.724 2.094 1.00 0.06 H HETATM 3365 H7 UNN A 187 19.462 4.891 1.394 1.00 0.06 H HETATM 3366 H5 UNN A 187 18.896 2.619 -1.031 1.00 0.04 H HETATM 3367 H6 UNN A 187 19.792 2.775 0.518 1.00 0.04 H HETATM 3368 H2 UNN A 187 17.220 1.146 0.138 1.00 0.06 H HETATM 3369 C11 UNN A 187 17.111 1.043 2.675 1.00 0.20 C HETATM 3370 O2 UNN A 187 16.030 0.809 2.163 1.00 -0.39 O HETATM 3371 C10 UNN A 187 17.255 1.107 4.168 1.00 0.13 C HETATM 3372 N2 UNN A 187 16.344 2.122 4.685 1.00 -0.26 N HETATM 3373 C19 UNN A 187 16.892 3.084 5.430 1.00 0.20 C HETATM 3374 O4 UNN A 187 18.054 3.041 5.789 1.00 -0.39 O HETATM 3375 C18 UNN A 187 16.004 4.250 5.787 1.00 0.13 C HETATM 3376 N4 UNN A 187 16.104 4.600 7.175 1.00 -0.24 N HETATM 3377 C31 UNN A 187 15.152 4.393 8.064 1.00 0.32 C HETATM 3378 O8 UNN A 187 13.989 4.139 7.816 1.00 -0.38 O HETATM 3379 O9 UNN A 187 15.574 4.507 9.445 1.00 -0.25 O HETATM 3380 CA UNN A 187 14.592 4.453 10.469 1.00 0.11 C HETATM 3381 C UNN A 187 13.742 5.696 10.412 1.00 -0.01 C HETATM 3382 C13 UNN A 187 12.510 5.696 11.064 1.00 -0.06 C HETATM 3383 C14 UNN A 187 11.714 6.848 11.030 1.00 -0.07 C HETATM 3384 C15 UNN A 187 12.150 7.993 10.357 1.00 -0.07 C HETATM 3385 C16 UNN A 187 13.393 7.984 9.711 1.00 -0.07 C HETATM 3386 C17 UNN A 187 14.196 6.839 9.746 1.00 -0.06 C HETATM 3387 H20 UNN A 187 15.165 6.838 9.260 1.00 0.06 H HETATM 3388 H19 UNN A 187 13.734 8.867 9.182 1.00 0.06 H HETATM 3389 H18 UNN A 187 11.530 8.882 10.335 1.00 0.06 H HETATM 3390 H16 UNN A 187 10.752 6.852 11.530 1.00 0.06 H HETATM 3391 H15 UNN A 187 12.171 4.812 11.593 1.00 0.06 H HETATM 3392 H63 UNN A 187 15.087 4.391 11.449 1.00 0.08 H HETATM 3393 H64 UNN A 187 13.957 3.567 10.322 1.00 0.08 H HETATM 3394 H17 UNN A 187 16.951 5.029 7.489 1.00 0.19 H HETATM 3395 C20 UNN A 187 16.403 5.468 4.977 1.00 -0.02 C HETATM 3396 H22 UNN A 187 16.337 5.233 3.905 1.00 0.03 H HETATM 3397 H23 UNN A 187 17.436 5.753 5.227 1.00 0.03 H HETATM 3398 H24 UNN A 187 15.726 6.302 5.212 1.00 0.03 H HETATM 3399 H21 UNN A 187 14.962 3.981 5.558 1.00 0.08 H HETATM 3400 H3 UNN A 187 15.363 2.098 4.492 1.00 0.19 H HETATM 3401 C12 UNN A 187 17.046 -0.227 4.897 1.00 -0.01 C HETATM 3402 CG2 UNN A 187 17.569 -0.169 6.329 1.00 -0.06 C HETATM 3403 H57 UNN A 187 17.403 -1.139 6.819 1.00 0.02 H HETATM 3404 H58 UNN A 187 17.035 0.618 6.883 1.00 0.02 H HETATM 3405 H59 UNN A 187 18.646 0.057 6.317 1.00 0.02 H HETATM 3406 CG1 UNN A 187 17.697 -1.379 4.116 1.00 -0.06 C HETATM 3407 H60 UNN A 187 17.301 -1.396 3.090 1.00 0.02 H HETATM 3408 H61 UNN A 187 17.469 -2.334 4.612 1.00 0.02 H HETATM 3409 H62 UNN A 187 18.787 -1.232 4.087 1.00 0.02 H HETATM 3410 H14 UNN A 187 15.964 -0.419 4.943 1.00 0.03 H HETATM 3411 H13 UNN A 187 18.284 1.430 4.382 1.00 0.08 H HETATM 3412 H1 UNN A 187 19.072 1.446 2.468 1.00 0.19 H CONECT 1066 1067 1072 1073 1074 CONECT 1072 1066 CONECT 1073 1066 CONECT 1074 1066 CONECT 2614 2615 2620 2621 2622 CONECT 2620 2614 CONECT 2621 2614 CONECT 2622 2614 CONECT 3283 3284 3369 3412 CONECT 3284 3283 3285 3354 3368 CONECT 3285 3284 3286 3288 3353 CONECT 3286 3285 3287 CONECT 3287 3286 CONECT 3288 3285 3289 3350 3352 CONECT 3289 3288 3290 3335 3349 CONECT 3290 3289 3291 3334 CONECT 3291 3290 3292 3333 CONECT 3292 3291 3293 3322 3332 CONECT 3293 3292 3294 3321 CONECT 3294 3293 3295 3320 CONECT 3295 3294 3296 3315 3319 CONECT 3296 3295 3297 3314 CONECT 3297 3296 3298 3299 CONECT 3298 3297 CONECT 3299 3297 3300 CONECT 3300 3299 3301 3312 3313 CONECT 3301 3300 3302 3306 CONECT 3302 3301 3303 3311 CONECT 3303 3302 3304 3310 CONECT 3304 3303 3305 3309 CONECT 3305 3304 3306 3308 CONECT 3306 3301 3305 3307 CONECT 3307 3306 CONECT 3308 3305 CONECT 3309 3304 CONECT 3310 3303 CONECT 3311 3302 CONECT 3312 3300 CONECT 3313 3300 CONECT 3314 3296 CONECT 3315 3295 3316 3317 3318 CONECT 3316 3315 CONECT 3317 3315 CONECT 3318 3315 CONECT 3319 3295 CONECT 3320 3294 CONECT 3321 3293 CONECT 3322 3292 3323 3327 3331 CONECT 3323 3322 3324 3325 3326 CONECT 3324 3323 CONECT 3325 3323 CONECT 3326 3323 CONECT 3327 3322 3328 3329 3330 CONECT 3328 3327 CONECT 3329 3327 CONECT 3330 3327 CONECT 3331 3322 CONECT 3332 3292 CONECT 3333 3291 CONECT 3334 3290 CONECT 3335 3289 3336 3347 3348 CONECT 3336 3335 3337 3341 CONECT 3337 3336 3338 3346 CONECT 3338 3337 3339 3345 CONECT 3339 3338 3340 3344 CONECT 3340 3339 3341 3343 CONECT 3341 3336 3340 3342 CONECT 3342 3341 CONECT 3343 3340 CONECT 3344 3339 CONECT 3345 3338 CONECT 3346 3337 CONECT 3347 3335 CONECT 3348 3335 CONECT 3349 3289 CONECT 3350 3288 3351 CONECT 3351 3350 CONECT 3352 3288 CONECT 3353 3285 CONECT 3354 3284 3355 3366 3367 CONECT 3355 3354 3356 3360 CONECT 3356 3355 3357 3365 CONECT 3357 3356 3358 3364 CONECT 3358 3357 3359 3363 CONECT 3359 3358 3360 3362 CONECT 3360 3355 3359 3361 CONECT 3361 3360 CONECT 3362 3359 CONECT 3363 3358 CONECT 3364 3357 CONECT 3365 3356 CONECT 3366 3354 CONECT 3367 3354 CONECT 3368 3284 CONECT 3369 3283 3370 3371 CONECT 3370 3369 CONECT 3371 3369 3372 3401 3411 CONECT 3372 3371 3373 3400 CONECT 3373 3372 3374 3375 CONECT 3374 3373 CONECT 3375 3373 3376 3395 3399 CONECT 3376 3375 3377 3394 CONECT 3377 3376 3378 3379 CONECT 3378 3377 CONECT 3379 3377 3380 CONECT 3380 3379 3381 3392 3393 CONECT 3381 3380 3382 3386 CONECT 3382 3381 3383 3391 CONECT 3383 3382 3384 3390 CONECT 3384 3383 3385 3389 CONECT 3385 3384 3386 3388 CONECT 3386 3381 3385 3387 CONECT 3387 3386 CONECT 3388 3385 CONECT 3389 3384 CONECT 3390 3383 CONECT 3391 3382 CONECT 3392 3380 CONECT 3393 3380 CONECT 3394 3376 CONECT 3395 3375 3396 3397 3398 CONECT 3396 3395 CONECT 3397 3395 CONECT 3398 3395 CONECT 3399 3375 CONECT 3400 3372 CONECT 3401 3371 3402 3406 3410 CONECT 3402 3401 3403 3404 3405 CONECT 3403 3402 CONECT 3404 3402 CONECT 3405 3402 CONECT 3406 3401 3407 3408 3409 CONECT 3407 3406 CONECT 3408 3406 CONECT 3409 3406 CONECT 3410 3401 CONECT 3411 3371 CONECT 3412 3283 MASTER 0 0 0 0 0 0 0 0 3408 4 138 18 END
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Related entries of code: 2p3a
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
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Ligand Name
1b11
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3TL
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3TL
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3TL
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Entry Information
PDB ID
2p3a
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Pol protein
Ligand Name
3TL
EC.Number
E.C.3.4.23.16
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
Ki=11nM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
J.Mol.Biol. 369: 1029-1040
Ligand Properties
Formula
C
5
0
H
6
4
N
6
O
1
0
Molecular Weight
909.077
Exact Mass
908.468
No. of atoms
130
No. of bonds
133
Polar Surface Area
233.52
LOGP Value
6.38 (
Computed with XLOGP3
)
6.42 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 33
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 4
Canonical SMILES
O[C@@H]([C@@H]([C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C)O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C
InChI String
InChI=1S/C50H64N6O10/c1-31(2)41(55-45(59)33(5)51-49(63)65-29-37-23-15-9-16-24-37)47(61)53-39(27-35-19-11-7-12-20-35)43(57)44(58)40(28-36-21-13-8-14-22-36)54-48(62)42(32(3)4)56-46(60)34(6)52-50(64)66-30-38-25-17-10-18-26-38/h7-26,31-34,39-44,57-58H,27-30H2,1-6H3,(H,51,63)(H,52,64)(H,53,61)(H,54,62)(H,55,59)(H,56,60)/t33-,34-,39-,40-,41-,42-,43+,44+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q6BB74
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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