Browse entries in the PDBbind-CN Database
HEADER 1QPL_COMPLEX COMPND 1QPL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 107 GLY VAL GLN VAL GLU THR ILE SER PRO GLY ASP GLY ARG SEQRES 2 A 107 THR PHE PRO LYS ARG GLY GLN THR CYS VAL VAL HIS TYR SEQRES 3 A 107 THR GLY MET LEU GLU ASP GLY LYS LYS PHE ASP SER SER SEQRES 4 A 107 ARG ASP ARG ASN LYS PRO PHE LYS PHE MET LEU GLY LYS SEQRES 5 A 107 GLN GLU VAL ILE ARG GLY TRP GLU GLU GLY VAL ALA GLN SEQRES 6 A 107 MET SER VAL GLY GLN ARG ALA LYS LEU THR ILE SER PRO SEQRES 7 A 107 ASP TYR ALA TYR GLY ALA THR GLY HIS PRO GLY ILE ILE SEQRES 8 A 107 PRO PRO HIS ALA THR LEU VAL PHE ASP VAL GLU LEU LEU SEQRES 9 A 107 LYS LEU GLU SEQRES 1 C 107 GLY VAL GLN VAL GLU THR ILE SER PRO GLY ASP GLY ARG SEQRES 2 C 107 THR PHE PRO LYS ARG GLY GLN THR CYS VAL VAL HIS TYR SEQRES 3 C 107 THR GLY MET LEU GLU ASP GLY LYS LYS PHE ASP SER SER SEQRES 4 C 107 ARG ASP ARG ASN LYS PRO PHE LYS PHE MET LEU GLY LYS SEQRES 5 C 107 GLN GLU VAL ILE ARG GLY TRP GLU GLU GLY VAL ALA GLN SEQRES 6 C 107 MET SER VAL GLY GLN ARG ALA LYS LEU THR ILE SER PRO SEQRES 7 C 107 ASP TYR ALA TYR GLY ALA THR GLY HIS PRO GLY ILE ILE SEQRES 8 C 107 PRO PRO HIS ALA THR LEU VAL PHE ASP VAL GLU LEU LEU SEQRES 9 C 107 LYS LEU GLU HET UNN A 229 143 ATOM 1 N GLY A 1 57.302 16.682 1.428 1.00 99.84 N ATOM 2 CA GLY A 1 58.255 17.819 1.345 1.00 99.84 C ATOM 3 C GLY A 1 57.680 18.993 0.575 1.00 99.84 C ATOM 4 O GLY A 1 56.463 19.100 0.417 1.00 65.03 O ATOM 5 HA3 GLY A 1 59.162 17.481 0.845 1.00 0.00 H ATOM 6 HA2 GLY A 1 58.499 18.147 2.355 1.00 0.00 H ATOM 7 HN3 GLY A 1 57.068 16.357 0.468 1.00 0.00 H ATOM 8 HN2 GLY A 1 56.435 16.993 1.911 1.00 0.00 H ATOM 9 HN1 GLY A 1 57.738 15.904 1.963 1.00 0.00 H ATOM 10 N VAL A 2 58.550 19.882 0.111 1.00 79.41 N ATOM 11 CA VAL A 2 58.121 21.051 -0.648 1.00 79.41 C ATOM 12 C VAL A 2 59.121 21.383 -1.759 1.00 79.41 C ATOM 13 O VAL A 2 60.338 21.398 -1.538 1.00 60.00 O ATOM 14 CB VAL A 2 57.910 22.279 0.277 1.00 60.00 C ATOM 15 CG1 VAL A 2 59.204 22.647 0.986 1.00 60.00 C ATOM 16 CG2 VAL A 2 57.363 23.458 -0.516 1.00 60.00 C ATOM 17 HA VAL A 2 57.164 20.807 -1.109 1.00 0.00 H ATOM 18 HB VAL A 2 57.176 22.016 1.038 1.00 0.00 H ATOM 19 HG11 VAL A 2 59.538 21.804 1.590 1.00 0.00 H ATOM 20 HG12 VAL A 2 59.966 22.890 0.246 1.00 0.00 H ATOM 21 HG13 VAL A 2 59.032 23.510 1.629 1.00 0.00 H ATOM 22 HG21 VAL A 2 58.069 23.724 -1.302 1.00 0.00 H ATOM 23 HG22 VAL A 2 56.407 23.182 -0.962 1.00 0.00 H ATOM 24 HG23 VAL A 2 57.222 24.309 0.151 1.00 0.00 H ATOM 25 H VAL A 2 59.564 19.741 0.294 1.00 0.00 H ATOM 26 N GLN A 3 58.598 21.583 -2.964 1.00 47.32 N ATOM 27 CA GLN A 3 59.422 21.907 -4.121 1.00 47.32 C ATOM 28 C GLN A 3 59.288 23.378 -4.481 1.00 47.32 C ATOM 29 O GLN A 3 58.184 23.932 -4.475 1.00110.82 O ATOM 30 CB GLN A 3 59.053 21.029 -5.323 1.00110.82 C ATOM 31 CG GLN A 3 59.525 19.581 -5.218 1.00110.82 C ATOM 32 CD GLN A 3 58.384 18.596 -5.050 1.00110.82 C ATOM 33 OE1 GLN A 3 58.178 18.039 -3.970 1.00110.82 O ATOM 34 NE2 GLN A 3 57.642 18.367 -6.124 1.00110.82 N ATOM 35 HA GLN A 3 60.461 21.706 -3.858 1.00 0.00 H ATOM 36 HB2 GLN A 3 57.968 21.027 -5.423 1.00 0.00 H ATOM 37 HB3 GLN A 3 59.498 21.469 -6.216 1.00 0.00 H ATOM 38 HG2 GLN A 3 60.072 19.327 -6.126 1.00 0.00 H ATOM 39 HG3 GLN A 3 60.189 19.493 -4.358 1.00 0.00 H ATOM 40 HE22 GLN A 3 57.852 18.860 -7.016 1.00 0.00 H ATOM 41 HE21 GLN A 3 56.850 17.695 -6.075 1.00 0.00 H ATOM 42 H GLN A 3 57.568 21.506 -3.085 1.00 0.00 H ATOM 43 N VAL A 4 60.424 23.995 -4.792 1.00 41.78 N ATOM 44 CA VAL A 4 60.489 25.409 -5.145 1.00 41.78 C ATOM 45 C VAL A 4 60.999 25.590 -6.576 1.00 41.78 C ATOM 46 O VAL A 4 62.158 25.294 -6.870 1.00 63.28 O ATOM 47 CB VAL A 4 61.433 26.174 -4.182 1.00 63.28 C ATOM 48 CG1 VAL A 4 61.350 27.669 -4.438 1.00 63.28 C ATOM 49 CG2 VAL A 4 61.095 25.858 -2.733 1.00 63.28 C ATOM 50 HA VAL A 4 59.479 25.811 -5.064 1.00 0.00 H ATOM 51 HB VAL A 4 62.456 25.847 -4.370 1.00 0.00 H ATOM 52 HG11 VAL A 4 61.645 27.877 -5.466 1.00 0.00 H ATOM 53 HG12 VAL A 4 60.327 28.008 -4.277 1.00 0.00 H ATOM 54 HG13 VAL A 4 62.019 28.191 -3.754 1.00 0.00 H ATOM 55 HG21 VAL A 4 60.066 26.155 -2.528 1.00 0.00 H ATOM 56 HG22 VAL A 4 61.207 24.788 -2.560 1.00 0.00 H ATOM 57 HG23 VAL A 4 61.770 26.406 -2.076 1.00 0.00 H ATOM 58 H VAL A 4 61.306 23.445 -4.783 1.00 0.00 H ATOM 59 N GLU A 5 60.128 26.064 -7.462 1.00 48.31 N ATOM 60 CA GLU A 5 60.485 26.285 -8.864 1.00 48.31 C ATOM 61 C GLU A 5 60.633 27.785 -9.160 1.00 48.31 C ATOM 62 O GLU A 5 59.637 28.501 -9.279 1.00 91.69 O ATOM 63 CB GLU A 5 59.420 25.654 -9.771 1.00 91.69 C ATOM 64 CG GLU A 5 59.227 24.152 -9.541 1.00 91.69 C ATOM 65 CD GLU A 5 58.014 23.587 -10.260 1.00 91.69 C ATOM 66 OE1 GLU A 5 58.025 23.545 -11.511 1.00 91.69 O ATOM 67 OE2 GLU A 5 57.050 23.177 -9.572 1.00 91.69 O ATOM 68 HA GLU A 5 61.446 25.812 -9.063 1.00 0.00 H ATOM 69 HB2 GLU A 5 58.470 26.156 -9.587 1.00 0.00 H ATOM 70 HB3 GLU A 5 59.716 25.808 -10.809 1.00 0.00 H ATOM 71 HG2 GLU A 5 60.115 23.630 -9.897 1.00 0.00 H ATOM 72 HG3 GLU A 5 59.109 23.977 -8.472 1.00 0.00 H ATOM 73 H GLU A 5 59.161 26.285 -7.148 1.00 0.00 H ATOM 74 N THR A 6 61.875 28.255 -9.252 1.00 19.72 N ATOM 75 CA THR A 6 62.166 29.662 -9.526 1.00 19.72 C ATOM 76 C THR A 6 61.607 30.083 -10.874 1.00 19.72 C ATOM 77 O THR A 6 62.113 29.679 -11.917 1.00 58.71 O ATOM 78 CB THR A 6 63.683 29.934 -9.549 1.00 58.71 C ATOM 79 OG1 THR A 6 64.322 29.200 -8.495 1.00 58.71 O ATOM 80 CG2 THR A 6 63.956 31.421 -9.370 1.00 58.71 C ATOM 81 HA THR A 6 61.698 30.232 -8.724 1.00 0.00 H ATOM 82 HB THR A 6 64.082 29.614 -10.511 1.00 0.00 H ATOM 83 HG1 THR A 6 65.296 29.378 -8.514 1.00 0.00 H ATOM 84 HG23 THR A 6 63.470 31.977 -10.171 1.00 0.00 H ATOM 85 HG21 THR A 6 63.562 31.748 -8.408 1.00 0.00 H ATOM 86 HG22 THR A 6 65.031 31.598 -9.403 1.00 0.00 H ATOM 87 H THR A 6 62.669 27.596 -9.124 1.00 0.00 H ATOM 88 N ILE A 7 60.527 30.847 -10.850 1.00 48.17 N ATOM 89 CA ILE A 7 59.933 31.334 -12.084 1.00 48.17 C ATOM 90 C ILE A 7 60.689 32.596 -12.483 1.00 48.17 C ATOM 91 O ILE A 7 61.258 32.665 -13.568 1.00 47.71 O ATOM 92 CB ILE A 7 58.420 31.616 -11.916 1.00 47.71 C ATOM 93 CG1 ILE A 7 57.672 30.288 -11.801 1.00 47.71 C ATOM 94 CG2 ILE A 7 57.888 32.438 -13.084 1.00 47.71 C ATOM 95 CD1 ILE A 7 56.202 30.427 -11.540 1.00 47.71 C ATOM 96 HA ILE A 7 60.014 30.577 -12.864 1.00 0.00 H ATOM 97 HB ILE A 7 58.262 32.197 -11.008 1.00 0.00 H ATOM 98 HG12 ILE A 7 57.803 29.741 -12.734 1.00 0.00 H ATOM 99 HG13 ILE A 7 58.112 29.718 -10.982 1.00 0.00 H ATOM 100 HD11 ILE A 7 56.050 30.961 -10.602 1.00 0.00 H ATOM 101 HD12 ILE A 7 55.740 30.984 -12.356 1.00 0.00 H ATOM 102 HD13 ILE A 7 55.751 29.437 -11.473 1.00 0.00 H ATOM 103 HG21 ILE A 7 58.420 33.388 -13.130 1.00 0.00 H ATOM 104 HG22 ILE A 7 58.042 31.889 -14.013 1.00 0.00 H ATOM 105 HG23 ILE A 7 56.823 32.622 -12.942 1.00 0.00 H ATOM 106 H ILE A 7 60.098 31.102 -9.938 1.00 0.00 H ATOM 107 N SER A 8 60.740 33.572 -11.584 1.00 38.76 N ATOM 108 CA SER A 8 61.450 34.814 -11.858 1.00 38.76 C ATOM 109 C SER A 8 62.687 34.904 -10.972 1.00 38.76 C ATOM 110 O SER A 8 62.656 34.517 -9.801 1.00 53.47 O ATOM 111 CB SER A 8 60.543 36.019 -11.612 1.00 53.47 C ATOM 112 OG SER A 8 61.195 37.235 -11.939 1.00 53.47 O ATOM 113 HA SER A 8 61.753 34.820 -12.905 1.00 0.00 H ATOM 114 HB2 SER A 8 60.260 36.040 -10.560 1.00 0.00 H ATOM 115 HB3 SER A 8 59.648 35.920 -12.226 1.00 0.00 H ATOM 116 HG SER A 8 60.582 37.993 -11.769 1.00 0.00 H ATOM 117 H SER A 8 60.264 33.447 -10.668 1.00 0.00 H ATOM 118 N PRO A 9 63.817 35.349 -11.542 1.00 41.06 N ATOM 119 CA PRO A 9 65.069 35.485 -10.797 1.00 41.06 C ATOM 120 C PRO A 9 64.918 36.564 -9.740 1.00 41.06 C ATOM 121 O PRO A 9 64.482 37.677 -10.033 1.00127.34 O ATOM 122 CB PRO A 9 66.059 35.923 -11.875 1.00127.34 C ATOM 123 CG PRO A 9 65.513 35.287 -13.111 1.00127.34 C ATOM 124 CD PRO A 9 64.041 35.580 -12.977 1.00127.34 C ATOM 125 HA PRO A 9 65.377 34.578 -10.277 1.00 0.00 H ATOM 126 HD3 PRO A 9 63.814 36.610 -13.254 1.00 0.00 H ATOM 127 HD2 PRO A 9 63.444 34.902 -13.586 1.00 0.00 H ATOM 128 HG3 PRO A 9 65.706 34.214 -13.125 1.00 0.00 H ATOM 129 HG2 PRO A 9 65.929 35.742 -14.010 1.00 0.00 H ATOM 130 HB2 PRO A 9 66.081 37.009 -11.970 1.00 0.00 H ATOM 131 HB3 PRO A 9 67.063 35.558 -11.657 1.00 0.00 H ATOM 132 N GLY A 10 65.230 36.214 -8.501 1.00 44.24 N ATOM 133 CA GLY A 10 65.131 37.183 -7.435 1.00 44.24 C ATOM 134 C GLY A 10 66.420 37.957 -7.267 1.00 44.24 C ATOM 135 O GLY A 10 67.285 37.992 -8.143 1.00 75.12 O ATOM 136 HA3 GLY A 10 64.906 36.663 -6.504 1.00 0.00 H ATOM 137 HA2 GLY A 10 64.326 37.881 -7.664 1.00 0.00 H ATOM 138 H GLY A 10 65.545 35.244 -8.297 1.00 0.00 H ATOM 139 N ASP A 11 66.545 38.557 -6.096 1.00 45.76 N ATOM 140 CA ASP A 11 67.698 39.344 -5.721 1.00 45.76 C ATOM 141 C ASP A 11 68.931 38.442 -5.695 1.00 45.76 C ATOM 142 O ASP A 11 70.031 38.857 -6.064 1.00 46.70 O ATOM 143 CB ASP A 11 67.429 39.916 -4.336 1.00 46.70 C ATOM 144 CG ASP A 11 68.460 40.901 -3.904 1.00 46.70 C ATOM 145 OD1 ASP A 11 68.572 41.971 -4.530 1.00 46.70 O ATOM 146 OD2 ASP A 11 69.150 40.610 -2.919 1.00 46.70 O ATOM 147 HA ASP A 11 67.876 40.152 -6.431 1.00 0.00 H ATOM 148 HB2 ASP A 11 66.458 40.411 -4.347 1.00 0.00 H ATOM 149 HB3 ASP A 11 67.409 39.096 -3.619 1.00 0.00 H ATOM 150 H ASP A 11 65.772 38.458 -5.407 1.00 0.00 H ATOM 151 N GLY A 12 68.734 37.207 -5.240 1.00 38.37 N ATOM 152 CA GLY A 12 69.822 36.251 -5.159 1.00 38.37 C ATOM 153 C GLY A 12 70.637 36.371 -3.885 1.00 38.37 C ATOM 154 O GLY A 12 71.429 35.484 -3.574 1.00 50.00 O ATOM 155 HA3 GLY A 12 70.485 36.409 -6.010 1.00 0.00 H ATOM 156 HA2 GLY A 12 69.403 35.246 -5.208 1.00 0.00 H ATOM 157 H GLY A 12 67.781 36.922 -4.936 1.00 0.00 H ATOM 158 N ARG A 13 70.421 37.446 -3.130 1.00 27.70 N ATOM 159 CA ARG A 13 71.164 37.685 -1.887 1.00 27.70 C ATOM 160 C ARG A 13 70.318 37.913 -0.632 1.00 27.70 C ATOM 161 O ARG A 13 70.616 37.374 0.435 1.00 68.46 O ATOM 162 CB ARG A 13 72.088 38.897 -2.044 1.00 68.46 C ATOM 163 CG ARG A 13 73.235 38.723 -3.016 1.00 68.46 C ATOM 164 CD ARG A 13 74.232 39.863 -2.870 1.00 68.46 C ATOM 165 NE ARG A 13 74.763 39.979 -1.506 1.00 68.46 N ATOM 166 CZ ARG A 13 75.949 39.519 -1.111 1.00 68.46 C ATOM 167 NH1 ARG A 13 76.753 38.902 -1.969 1.00 68.46 N ATOM 168 NH2 ARG A 13 76.331 39.676 0.150 1.00 68.46 N ATOM 169 HA ARG A 13 71.710 36.754 -1.732 1.00 0.00 H ATOM 170 HB2 ARG A 13 71.484 39.738 -2.385 1.00 0.00 H ATOM 171 HB3 ARG A 13 72.509 39.127 -1.065 1.00 0.00 H ATOM 172 HG2 ARG A 13 73.738 37.778 -2.813 1.00 0.00 H ATOM 173 HG3 ARG A 13 72.845 38.714 -4.034 1.00 0.00 H ATOM 174 HD2 ARG A 13 73.735 40.797 -3.132 1.00 0.00 H ATOM 175 HD3 ARG A 13 75.062 39.690 -3.555 1.00 0.00 H ATOM 176 HE ARG A 13 74.170 40.455 -0.797 1.00 0.00 H ATOM 177 HH12 ARG A 13 77.677 38.546 -1.652 1.00 0.00 H ATOM 178 HH11 ARG A 13 76.458 38.775 -2.958 1.00 0.00 H ATOM 179 HH22 ARG A 13 77.256 39.318 0.461 1.00 0.00 H ATOM 180 HH21 ARG A 13 75.705 40.157 0.827 1.00 0.00 H ATOM 181 H ARG A 13 69.704 38.137 -3.430 1.00 0.00 H ATOM 182 N THR A 14 69.296 38.755 -0.751 1.00 57.83 N ATOM 183 CA THR A 14 68.440 39.080 0.382 1.00 57.83 C ATOM 184 C THR A 14 67.387 38.020 0.624 1.00 57.83 C ATOM 185 O THR A 14 66.500 37.805 -0.213 1.00 41.11 O ATOM 186 CB THR A 14 67.741 40.433 0.186 1.00 41.11 C ATOM 187 OG1 THR A 14 68.623 41.338 -0.495 1.00 41.11 O ATOM 188 CG2 THR A 14 67.351 41.033 1.534 1.00 41.11 C ATOM 189 HA THR A 14 69.096 39.129 1.251 1.00 0.00 H ATOM 190 HB THR A 14 66.840 40.275 -0.407 1.00 0.00 H ATOM 191 HG1 THR A 14 68.863 40.961 -1.378 1.00 0.00 H ATOM 192 HG23 THR A 14 66.681 40.349 2.055 1.00 0.00 H ATOM 193 HG21 THR A 14 68.248 41.191 2.133 1.00 0.00 H ATOM 194 HG22 THR A 14 66.847 41.986 1.374 1.00 0.00 H ATOM 195 H THR A 14 69.103 39.192 -1.675 1.00 0.00 H ATOM 196 N PHE A 15 67.496 37.358 1.770 1.00 24.75 N ATOM 197 CA PHE A 15 66.551 36.315 2.152 1.00 24.75 C ATOM 198 C PHE A 15 65.887 36.692 3.473 1.00 24.75 C ATOM 199 O PHE A 15 66.491 37.365 4.308 1.00 56.89 O ATOM 200 CB PHE A 15 67.256 34.959 2.257 1.00 56.89 C ATOM 201 CG PHE A 15 67.619 34.362 0.923 1.00 56.89 C ATOM 202 CD1 PHE A 15 66.703 33.584 0.223 1.00 56.89 C ATOM 203 CD2 PHE A 15 68.864 34.595 0.354 1.00 56.89 C ATOM 204 CE1 PHE A 15 67.026 33.047 -1.030 1.00 56.89 C ATOM 205 CE2 PHE A 15 69.192 34.065 -0.895 1.00 56.89 C ATOM 206 CZ PHE A 15 68.270 33.289 -1.587 1.00 56.89 C ATOM 207 HA PHE A 15 65.782 36.227 1.384 1.00 0.00 H ATOM 208 HB2 PHE A 15 68.170 35.090 2.836 1.00 0.00 H ATOM 209 HB3 PHE A 15 66.594 34.266 2.776 1.00 0.00 H ATOM 210 HD2 PHE A 15 69.595 35.200 0.890 1.00 0.00 H ATOM 211 HE2 PHE A 15 70.173 34.260 -1.328 1.00 0.00 H ATOM 212 HZ PHE A 15 68.525 32.874 -2.562 1.00 0.00 H ATOM 213 HE1 PHE A 15 66.298 32.439 -1.566 1.00 0.00 H ATOM 214 HD1 PHE A 15 65.721 33.390 0.655 1.00 0.00 H ATOM 215 H PHE A 15 68.279 37.590 2.414 1.00 0.00 H ATOM 216 N PRO A 16 64.620 36.289 3.658 1.00 51.03 N ATOM 217 CA PRO A 16 63.833 36.569 4.865 1.00 51.03 C ATOM 218 C PRO A 16 64.474 36.063 6.161 1.00 51.03 C ATOM 219 O PRO A 16 64.957 34.926 6.219 1.00 43.50 O ATOM 220 CB PRO A 16 62.515 35.846 4.579 1.00 43.50 C ATOM 221 CG PRO A 16 62.419 35.892 3.083 1.00 43.50 C ATOM 222 CD PRO A 16 63.816 35.529 2.685 1.00 43.50 C ATOM 223 HA PRO A 16 63.732 37.640 5.041 1.00 0.00 H ATOM 224 HD3 PRO A 16 63.989 34.457 2.779 1.00 0.00 H ATOM 225 HD2 PRO A 16 64.031 35.842 1.663 1.00 0.00 H ATOM 226 HG3 PRO A 16 62.150 36.888 2.731 1.00 0.00 H ATOM 227 HG2 PRO A 16 61.696 35.168 2.707 1.00 0.00 H ATOM 228 HB2 PRO A 16 62.547 34.817 4.938 1.00 0.00 H ATOM 229 HB3 PRO A 16 61.675 36.365 5.041 1.00 0.00 H ATOM 230 N LYS A 17 64.481 36.915 7.187 1.00 60.78 N ATOM 231 CA LYS A 17 65.034 36.566 8.497 1.00 60.78 C ATOM 232 C LYS A 17 63.906 36.183 9.460 1.00 60.78 C ATOM 233 O LYS A 17 62.797 36.711 9.366 1.00112.69 O ATOM 234 CB LYS A 17 65.842 37.734 9.081 1.00112.69 C ATOM 235 CG LYS A 17 66.473 37.425 10.440 1.00112.69 C ATOM 236 CD LYS A 17 67.260 38.601 11.007 1.00112.69 C ATOM 237 CE LYS A 17 67.862 38.245 12.366 1.00112.69 C ATOM 238 NZ LYS A 17 68.686 39.344 12.949 1.00112.69 N ATOM 239 HA LYS A 17 65.702 35.715 8.367 1.00 0.00 H ATOM 240 HB2 LYS A 17 66.638 37.986 8.381 1.00 0.00 H ATOM 241 HB3 LYS A 17 65.177 38.590 9.196 1.00 0.00 H ATOM 242 HG2 LYS A 17 65.680 37.166 11.142 1.00 0.00 H ATOM 243 HG3 LYS A 17 67.148 36.577 10.326 1.00 0.00 H ATOM 244 HD2 LYS A 17 68.063 38.860 10.317 1.00 0.00 H ATOM 245 HD3 LYS A 17 66.593 39.455 11.124 1.00 0.00 H ATOM 246 HE2 LYS A 17 68.493 37.364 12.246 1.00 0.00 H ATOM 247 HE3 LYS A 17 67.050 38.017 13.056 1.00 0.00 H ATOM 248 HZ1 LYS A 17 69.472 39.566 12.305 1.00 0.00 H ATOM 249 HZ2 LYS A 17 68.093 40.189 13.078 1.00 0.00 H ATOM 250 HZ3 LYS A 17 69.065 39.041 13.869 1.00 0.00 H ATOM 251 H LYS A 17 64.078 37.864 7.051 1.00 0.00 H ATOM 252 N ARG A 18 64.195 35.260 10.374 1.00 59.40 N ATOM 253 CA ARG A 18 63.218 34.801 11.358 1.00 59.40 C ATOM 254 C ARG A 18 62.786 35.987 12.223 1.00 59.40 C ATOM 255 O ARG A 18 63.495 36.387 13.145 1.00129.69 O ATOM 256 CB ARG A 18 63.828 33.693 12.232 1.00129.69 C ATOM 257 CG ARG A 18 62.821 32.943 13.100 1.00129.69 C ATOM 258 CD ARG A 18 63.502 32.035 14.126 1.00129.69 C ATOM 259 NE ARG A 18 64.244 30.922 13.523 1.00129.69 N ATOM 260 CZ ARG A 18 65.573 30.855 13.435 1.00129.69 C ATOM 261 NH1 ARG A 18 66.331 31.843 13.905 1.00129.69 N ATOM 262 NH2 ARG A 18 66.153 29.780 12.909 1.00129.69 N ATOM 263 HA ARG A 18 62.347 34.391 10.846 1.00 0.00 H ATOM 264 HB2 ARG A 18 64.316 32.972 11.576 1.00 0.00 H ATOM 265 HB3 ARG A 18 64.571 34.147 12.888 1.00 0.00 H ATOM 266 HG2 ARG A 18 62.204 33.669 13.629 1.00 0.00 H ATOM 267 HG3 ARG A 18 62.189 32.332 12.456 1.00 0.00 H ATOM 268 HD2 ARG A 18 62.737 31.623 14.784 1.00 0.00 H ATOM 269 HD3 ARG A 18 64.197 32.637 14.711 1.00 0.00 H ATOM 270 HE ARG A 18 63.694 30.128 13.136 1.00 0.00 H ATOM 271 HH12 ARG A 18 67.367 31.783 13.833 1.00 0.00 H ATOM 272 HH11 ARG A 18 65.888 32.675 14.345 1.00 0.00 H ATOM 273 HH22 ARG A 18 67.190 29.729 12.841 1.00 0.00 H ATOM 274 HH21 ARG A 18 65.570 28.990 12.566 1.00 0.00 H ATOM 275 H ARG A 18 65.151 34.851 10.388 1.00 0.00 H ATOM 276 N GLY A 19 61.656 36.588 11.861 1.00 50.64 N ATOM 277 CA GLY A 19 61.144 37.730 12.597 1.00 50.64 C ATOM 278 C GLY A 19 60.719 38.885 11.702 1.00 50.64 C ATOM 279 O GLY A 19 60.054 39.819 12.156 1.00 80.93 O ATOM 280 HA3 GLY A 19 61.923 38.084 13.272 1.00 0.00 H ATOM 281 HA2 GLY A 19 60.280 37.408 13.179 1.00 0.00 H ATOM 282 H GLY A 19 61.130 36.234 11.037 1.00 0.00 H ATOM 283 N GLN A 20 61.124 38.843 10.437 1.00 68.21 N ATOM 284 CA GLN A 20 60.782 39.890 9.477 1.00 68.21 C ATOM 285 C GLN A 20 59.409 39.665 8.861 1.00 68.21 C ATOM 286 O GLN A 20 58.829 38.583 8.979 1.00 82.82 O ATOM 287 CB GLN A 20 61.809 39.951 8.344 1.00 82.82 C ATOM 288 CG GLN A 20 63.129 40.599 8.694 1.00 82.82 C ATOM 289 CD GLN A 20 63.945 40.919 7.460 1.00 82.82 C ATOM 290 OE1 GLN A 20 64.236 40.039 6.649 1.00 82.82 O ATOM 291 NE2 GLN A 20 64.290 42.188 7.292 1.00 82.82 N ATOM 292 HA GLN A 20 60.779 40.828 10.032 1.00 0.00 H ATOM 293 HB2 GLN A 20 62.012 38.930 8.019 1.00 0.00 H ATOM 294 HB3 GLN A 20 61.367 40.512 7.520 1.00 0.00 H ATOM 295 HG2 GLN A 20 62.935 41.523 9.238 1.00 0.00 H ATOM 296 HG3 GLN A 20 63.699 39.919 9.327 1.00 0.00 H ATOM 297 HE22 GLN A 20 64.023 42.898 8.003 1.00 0.00 H ATOM 298 HE21 GLN A 20 64.828 42.473 6.449 1.00 0.00 H ATOM 299 H GLN A 20 61.703 38.039 10.120 1.00 0.00 H ATOM 300 N THR A 21 58.911 40.689 8.179 1.00 57.83 N ATOM 301 CA THR A 21 57.619 40.611 7.521 1.00 57.83 C ATOM 302 C THR A 21 57.798 40.423 6.018 1.00 57.83 C ATOM 303 O THR A 21 58.498 41.195 5.358 1.00 61.94 O ATOM 304 CB THR A 21 56.761 41.872 7.804 1.00 61.94 C ATOM 305 OG1 THR A 21 56.363 41.880 9.179 1.00 61.94 O ATOM 306 CG2 THR A 21 55.520 41.897 6.921 1.00 61.94 C ATOM 307 HA THR A 21 57.092 39.748 7.927 1.00 0.00 H ATOM 308 HB THR A 21 57.363 42.754 7.583 1.00 0.00 H ATOM 309 HG1 THR A 21 55.816 42.685 9.358 1.00 0.00 H ATOM 310 HG23 THR A 21 55.821 41.891 5.873 1.00 0.00 H ATOM 311 HG21 THR A 21 54.909 41.019 7.130 1.00 0.00 H ATOM 312 HG22 THR A 21 54.945 42.799 7.130 1.00 0.00 H ATOM 313 H THR A 21 59.460 41.570 8.114 1.00 0.00 H ATOM 314 N CYS A 22 57.207 39.358 5.495 1.00 19.70 N ATOM 315 CA CYS A 22 57.277 39.077 4.076 1.00 19.70 C ATOM 316 C CYS A 22 55.998 39.601 3.440 1.00 19.70 C ATOM 317 O CYS A 22 54.895 39.273 3.876 1.00 39.14 O ATOM 318 CB CYS A 22 57.379 37.576 3.829 1.00 39.14 C ATOM 319 SG CYS A 22 58.678 36.782 4.751 1.00 39.14 S ATOM 320 HA CYS A 22 58.158 39.555 3.648 1.00 0.00 H ATOM 321 HB2 CYS A 22 57.563 37.414 2.767 1.00 0.00 H ATOM 322 HB3 CYS A 22 56.430 37.117 4.106 1.00 0.00 H ATOM 323 HG CYS A 22 58.688 35.433 4.460 1.00 0.00 H ATOM 324 H CYS A 22 56.682 38.711 6.117 1.00 0.00 H ATOM 325 N VAL A 23 56.152 40.448 2.435 1.00 17.15 N ATOM 326 CA VAL A 23 55.017 41.003 1.732 1.00 17.15 C ATOM 327 C VAL A 23 54.982 40.284 0.394 1.00 17.15 C ATOM 328 O VAL A 23 55.882 40.456 -0.434 1.00 35.97 O ATOM 329 CB VAL A 23 55.198 42.521 1.531 1.00 35.97 C ATOM 330 CG1 VAL A 23 53.960 43.129 0.907 1.00 35.97 C ATOM 331 CG2 VAL A 23 55.491 43.185 2.864 1.00 35.97 C ATOM 332 HA VAL A 23 54.088 40.868 2.286 1.00 0.00 H ATOM 333 HB VAL A 23 56.038 42.686 0.856 1.00 0.00 H ATOM 334 HG11 VAL A 23 53.777 42.664 -0.062 1.00 0.00 H ATOM 335 HG12 VAL A 23 53.104 42.959 1.560 1.00 0.00 H ATOM 336 HG13 VAL A 23 54.110 44.200 0.774 1.00 0.00 H ATOM 337 HG21 VAL A 23 54.660 43.008 3.547 1.00 0.00 H ATOM 338 HG22 VAL A 23 56.405 42.765 3.285 1.00 0.00 H ATOM 339 HG23 VAL A 23 55.618 44.257 2.714 1.00 0.00 H ATOM 340 H VAL A 23 57.112 40.721 2.144 1.00 0.00 H ATOM 341 N VAL A 24 53.971 39.447 0.199 1.00 32.23 N ATOM 342 CA VAL A 24 53.865 38.688 -1.036 1.00 32.23 C ATOM 343 C VAL A 24 52.514 38.764 -1.730 1.00 32.23 C ATOM 344 O VAL A 24 51.520 39.246 -1.182 1.00 33.08 O ATOM 345 CB VAL A 24 54.172 37.197 -0.797 1.00 33.08 C ATOM 346 CG1 VAL A 24 55.538 37.025 -0.146 1.00 33.08 C ATOM 347 CG2 VAL A 24 53.081 36.569 0.058 1.00 33.08 C ATOM 348 HA VAL A 24 54.599 39.159 -1.689 1.00 0.00 H ATOM 349 HB VAL A 24 54.194 36.687 -1.760 1.00 0.00 H ATOM 350 HG11 VAL A 24 56.305 37.443 -0.798 1.00 0.00 H ATOM 351 HG12 VAL A 24 55.551 37.545 0.812 1.00 0.00 H ATOM 352 HG13 VAL A 24 55.732 35.964 0.013 1.00 0.00 H ATOM 353 HG21 VAL A 24 53.032 37.083 1.018 1.00 0.00 H ATOM 354 HG22 VAL A 24 52.123 36.660 -0.453 1.00 0.00 H ATOM 355 HG23 VAL A 24 53.309 35.516 0.220 1.00 0.00 H ATOM 356 H VAL A 24 53.247 39.333 0.937 1.00 0.00 H ATOM 357 N HIS A 25 52.505 38.268 -2.958 1.00 25.35 N ATOM 358 CA HIS A 25 51.321 38.215 -3.792 1.00 25.35 C ATOM 359 C HIS A 25 51.303 36.766 -4.229 1.00 25.35 C ATOM 360 O HIS A 25 52.356 36.200 -4.531 1.00 54.82 O ATOM 361 CB HIS A 25 51.482 39.130 -5.001 1.00 54.82 C ATOM 362 CG HIS A 25 50.458 40.216 -5.072 1.00 54.82 C ATOM 363 ND1 HIS A 25 49.314 40.209 -4.305 1.00 54.82 N ATOM 364 CD2 HIS A 25 50.408 41.349 -5.812 1.00 54.82 C ATOM 365 CE1 HIS A 25 48.603 41.292 -4.567 1.00 54.82 C ATOM 366 NE2 HIS A 25 49.245 41.999 -5.478 1.00 54.82 N ATOM 367 HA HIS A 25 50.410 38.536 -3.286 1.00 0.00 H ATOM 368 HB2 HIS A 25 52.469 39.590 -4.956 1.00 0.00 H ATOM 369 HB3 HIS A 25 51.405 38.524 -5.904 1.00 0.00 H ATOM 370 HD2 HIS A 25 51.151 41.682 -6.536 1.00 0.00 H ATOM 371 HE1 HIS A 25 47.650 41.556 -4.109 1.00 0.00 H ATOM 372 H HIS A 25 53.396 37.896 -3.345 1.00 0.00 H ATOM 373 N TYR A 26 50.125 36.159 -4.279 1.00 32.23 N ATOM 374 CA TYR A 26 50.064 34.763 -4.648 1.00 32.23 C ATOM 375 C TYR A 26 48.714 34.338 -5.150 1.00 32.23 C ATOM 376 O TYR A 26 47.715 35.035 -4.957 1.00 29.06 O ATOM 377 CB TYR A 26 50.366 33.909 -3.416 1.00 29.06 C ATOM 378 CG TYR A 26 49.242 33.922 -2.404 1.00 29.06 C ATOM 379 CD1 TYR A 26 49.158 34.919 -1.439 1.00 29.06 C ATOM 380 CD2 TYR A 26 48.237 32.954 -2.438 1.00 29.06 C ATOM 381 CE1 TYR A 26 48.096 34.956 -0.530 1.00 29.06 C ATOM 382 CE2 TYR A 26 47.175 32.979 -1.541 1.00 29.06 C ATOM 383 CZ TYR A 26 47.107 33.981 -0.588 1.00 29.06 C ATOM 384 OH TYR A 26 46.052 34.008 0.299 1.00 29.06 O ATOM 385 HA TYR A 26 50.791 34.626 -5.449 1.00 0.00 H ATOM 386 HB3 TYR A 26 51.269 34.292 -2.939 1.00 0.00 H ATOM 387 HB2 TYR A 26 50.534 32.881 -3.737 1.00 0.00 H ATOM 388 HD2 TYR A 26 48.286 32.161 -3.184 1.00 0.00 H ATOM 389 HE2 TYR A 26 46.400 32.214 -1.588 1.00 0.00 H ATOM 390 HE1 TYR A 26 48.044 35.745 0.220 1.00 0.00 H ATOM 391 HD1 TYR A 26 49.933 35.684 -1.390 1.00 0.00 H ATOM 392 HH TYR A 26 45.203 34.092 -0.203 1.00 0.00 H ATOM 393 H TYR A 26 49.254 36.682 -4.055 1.00 0.00 H ATOM 394 N THR A 27 48.702 33.153 -5.745 1.00 29.84 N ATOM 395 CA THR A 27 47.486 32.506 -6.214 1.00 29.84 C ATOM 396 C THR A 27 47.657 31.077 -5.712 1.00 29.84 C ATOM 397 O THR A 27 48.786 30.606 -5.518 1.00 42.72 O ATOM 398 CB THR A 27 47.325 32.520 -7.756 1.00 42.72 C ATOM 399 OG1 THR A 27 48.448 31.884 -8.373 1.00 42.72 O ATOM 400 CG2 THR A 27 47.196 33.940 -8.272 1.00 42.72 C ATOM 401 HA THR A 27 46.594 33.017 -5.852 1.00 0.00 H ATOM 402 HB THR A 27 46.416 31.974 -8.008 1.00 0.00 H ATOM 403 HG1 THR A 27 48.508 30.947 -8.060 1.00 0.00 H ATOM 404 HG23 THR A 27 46.339 34.421 -7.799 1.00 0.00 H ATOM 405 HG21 THR A 27 48.103 34.496 -8.034 1.00 0.00 H ATOM 406 HG22 THR A 27 47.053 33.921 -9.352 1.00 0.00 H ATOM 407 H THR A 27 49.608 32.661 -5.883 1.00 0.00 H ATOM 408 N GLY A 28 46.547 30.416 -5.431 1.00 35.89 N ATOM 409 CA GLY A 28 46.617 29.063 -4.936 1.00 35.89 C ATOM 410 C GLY A 28 45.732 28.170 -5.766 1.00 35.89 C ATOM 411 O GLY A 28 44.578 28.510 -6.034 1.00 41.58 O ATOM 412 HA3 GLY A 28 46.284 29.039 -3.898 1.00 0.00 H ATOM 413 HA2 GLY A 28 47.646 28.709 -4.995 1.00 0.00 H ATOM 414 H GLY A 28 45.622 30.872 -5.567 1.00 0.00 H ATOM 415 N MET A 29 46.275 27.039 -6.196 1.00 47.57 N ATOM 416 CA MET A 29 45.532 26.084 -6.999 1.00 47.57 C ATOM 417 C MET A 29 45.893 24.657 -6.585 1.00 47.57 C ATOM 418 O MET A 29 46.845 24.440 -5.832 1.00 66.03 O ATOM 419 CB MET A 29 45.808 26.324 -8.489 1.00 66.03 C ATOM 420 CG MET A 29 47.284 26.349 -8.867 1.00 66.03 C ATOM 421 SD MET A 29 47.759 27.789 -9.867 1.00 66.03 S ATOM 422 CE MET A 29 46.899 27.441 -11.435 1.00 66.03 C ATOM 423 HA MET A 29 44.464 26.221 -6.829 1.00 0.00 H ATOM 424 HB2 MET A 29 45.325 25.528 -9.057 1.00 0.00 H ATOM 425 HB3 MET A 29 45.370 27.283 -8.766 1.00 0.00 H ATOM 426 HG2 MET A 29 47.509 25.446 -9.435 1.00 0.00 H ATOM 427 HG3 MET A 29 47.874 26.357 -7.950 1.00 0.00 H ATOM 428 HE1 MET A 29 47.257 26.495 -11.842 1.00 0.00 H ATOM 429 HE2 MET A 29 45.826 27.377 -11.253 1.00 0.00 H ATOM 430 HE3 MET A 29 47.101 28.243 -12.145 1.00 0.00 H ATOM 431 H MET A 29 47.264 26.830 -5.950 1.00 0.00 H ATOM 432 N LEU A 30 45.094 23.695 -7.034 1.00 68.38 N ATOM 433 CA LEU A 30 45.313 22.283 -6.729 1.00 68.38 C ATOM 434 C LEU A 30 45.976 21.628 -7.939 1.00 68.38 C ATOM 435 O LEU A 30 46.001 22.211 -9.024 1.00 73.38 O ATOM 436 CB LEU A 30 43.973 21.592 -6.467 1.00 73.38 C ATOM 437 CG LEU A 30 43.036 22.197 -5.420 1.00 73.38 C ATOM 438 CD1 LEU A 30 41.628 21.647 -5.595 1.00 73.38 C ATOM 439 CD2 LEU A 30 43.563 21.913 -4.033 1.00 73.38 C ATOM 440 HA LEU A 30 45.943 22.191 -5.845 1.00 0.00 H ATOM 441 HB2 LEU A 30 43.430 21.571 -7.412 1.00 0.00 H ATOM 442 HB3 LEU A 30 44.192 20.572 -6.153 1.00 0.00 H ATOM 443 HG LEU A 30 42.995 23.278 -5.556 1.00 0.00 H ATOM 444 HD21 LEU A 30 43.623 20.835 -3.882 1.00 0.00 H ATOM 445 HD22 LEU A 30 44.555 22.352 -3.926 1.00 0.00 H ATOM 446 HD23 LEU A 30 42.890 22.347 -3.294 1.00 0.00 H ATOM 447 HD11 LEU A 30 41.262 21.899 -6.590 1.00 0.00 H ATOM 448 HD12 LEU A 30 41.645 20.564 -5.476 1.00 0.00 H ATOM 449 HD13 LEU A 30 40.972 22.086 -4.843 1.00 0.00 H ATOM 450 H LEU A 30 44.280 23.958 -7.626 1.00 0.00 H ATOM 451 N GLU A 31 46.465 20.401 -7.767 1.00 79.70 N ATOM 452 CA GLU A 31 47.106 19.664 -8.859 1.00 79.70 C ATOM 453 C GLU A 31 46.179 19.610 -10.076 1.00 79.70 C ATOM 454 O GLU A 31 46.623 19.753 -11.219 1.00106.51 O ATOM 455 CB GLU A 31 47.437 18.233 -8.423 1.00106.51 C ATOM 456 CG GLU A 31 48.472 18.123 -7.318 1.00106.51 C ATOM 457 CD GLU A 31 48.815 16.683 -6.986 1.00106.51 C ATOM 458 OE1 GLU A 31 48.043 16.046 -6.239 1.00106.51 O ATOM 459 OE2 GLU A 31 49.860 16.194 -7.467 1.00106.51 O ATOM 460 HA GLU A 31 48.028 20.184 -9.121 1.00 0.00 H ATOM 461 HB2 GLU A 31 46.517 17.764 -8.073 1.00 0.00 H ATOM 462 HB3 GLU A 31 47.811 17.692 -9.292 1.00 0.00 H ATOM 463 HG2 GLU A 31 49.380 18.635 -7.637 1.00 0.00 H ATOM 464 HG3 GLU A 31 48.080 18.605 -6.422 1.00 0.00 H ATOM 465 H GLU A 31 46.390 19.954 -6.831 1.00 0.00 H ATOM 466 N ASP A 32 44.888 19.421 -9.813 1.00 79.66 N ATOM 467 CA ASP A 32 43.885 19.350 -10.867 1.00 79.66 C ATOM 468 C ASP A 32 43.476 20.723 -11.404 1.00 79.66 C ATOM 469 O ASP A 32 42.305 20.948 -11.725 1.00101.11 O ATOM 470 CB ASP A 32 42.657 18.551 -10.398 1.00101.11 C ATOM 471 CG ASP A 32 42.181 18.958 -9.020 1.00101.11 C ATOM 472 OD1 ASP A 32 41.406 19.929 -8.919 1.00101.11 O ATOM 473 OD2 ASP A 32 42.580 18.300 -8.036 1.00101.11 O ATOM 474 HA ASP A 32 44.349 18.824 -11.701 1.00 0.00 H ATOM 475 HB2 ASP A 32 41.846 18.711 -11.108 1.00 0.00 H ATOM 476 HB3 ASP A 32 42.917 17.493 -10.378 1.00 0.00 H ATOM 477 H ASP A 32 44.586 19.321 -8.823 1.00 0.00 H ATOM 478 N GLY A 33 44.442 21.640 -11.463 1.00103.98 N ATOM 479 CA GLY A 33 44.212 22.979 -11.984 1.00103.98 C ATOM 480 C GLY A 33 43.398 23.960 -11.160 1.00103.98 C ATOM 481 O GLY A 33 43.840 25.094 -10.944 1.00 89.04 O ATOM 482 HA3 GLY A 33 43.703 22.866 -12.941 1.00 0.00 H ATOM 483 HA2 GLY A 33 45.190 23.432 -12.145 1.00 0.00 H ATOM 484 H GLY A 33 45.393 21.390 -11.125 1.00 0.00 H ATOM 485 N LYS A 34 42.205 23.540 -10.740 1.00 98.88 N ATOM 486 CA LYS A 34 41.279 24.356 -9.954 1.00 98.88 C ATOM 487 C LYS A 34 41.948 25.322 -8.971 1.00 98.88 C ATOM 488 O LYS A 34 42.673 24.899 -8.066 1.00110.74 O ATOM 489 CB LYS A 34 40.296 23.454 -9.192 1.00110.74 C ATOM 490 CG LYS A 34 39.482 22.501 -10.062 1.00110.74 C ATOM 491 CD LYS A 34 38.550 21.652 -9.206 1.00110.74 C ATOM 492 CE LYS A 34 37.789 20.624 -10.035 1.00110.74 C ATOM 493 NZ LYS A 34 36.881 19.792 -9.194 1.00110.74 N ATOM 494 HA LYS A 34 40.758 24.979 -10.681 1.00 0.00 H ATOM 495 HB2 LYS A 34 40.867 22.857 -8.481 1.00 0.00 H ATOM 496 HB3 LYS A 34 39.600 24.095 -8.651 1.00 0.00 H ATOM 497 HG2 LYS A 34 38.889 23.080 -10.770 1.00 0.00 H ATOM 498 HG3 LYS A 34 40.161 21.847 -10.609 1.00 0.00 H ATOM 499 HD2 LYS A 34 39.141 21.130 -8.454 1.00 0.00 H ATOM 500 HD3 LYS A 34 37.832 22.307 -8.712 1.00 0.00 H ATOM 501 HE2 LYS A 34 38.506 19.971 -10.532 1.00 0.00 H ATOM 502 HE3 LYS A 34 37.195 21.146 -10.785 1.00 0.00 H ATOM 503 HZ1 LYS A 34 37.441 19.285 -8.479 1.00 0.00 H ATOM 504 HZ2 LYS A 34 36.188 20.407 -8.721 1.00 0.00 H ATOM 505 HZ3 LYS A 34 36.383 19.106 -9.797 1.00 0.00 H ATOM 506 H LYS A 34 41.914 22.572 -10.986 1.00 0.00 H ATOM 507 N LYS A 35 41.713 26.618 -9.171 1.00 65.20 N ATOM 508 CA LYS A 35 42.273 27.648 -8.297 1.00 65.20 C ATOM 509 C LYS A 35 41.286 27.835 -7.156 1.00 65.20 C ATOM 510 O LYS A 35 40.091 27.587 -7.320 1.00 56.22 O ATOM 511 CB LYS A 35 42.439 28.983 -9.038 1.00 56.22 C ATOM 512 CG LYS A 35 43.041 28.880 -10.428 1.00 56.22 C ATOM 513 CD LYS A 35 43.358 30.247 -11.024 1.00 56.22 C ATOM 514 CE LYS A 35 44.615 30.847 -10.413 1.00 56.22 C ATOM 515 NZ LYS A 35 45.154 31.960 -11.245 1.00 56.22 N ATOM 516 HA LYS A 35 43.258 27.341 -7.946 1.00 0.00 H ATOM 517 HB2 LYS A 35 41.455 29.443 -9.130 1.00 0.00 H ATOM 518 HB3 LYS A 35 43.084 29.624 -8.437 1.00 0.00 H ATOM 519 HG2 LYS A 35 43.962 28.301 -10.369 1.00 0.00 H ATOM 520 HG3 LYS A 35 42.333 28.369 -11.080 1.00 0.00 H ATOM 521 HD2 LYS A 35 43.504 30.139 -12.099 1.00 0.00 H ATOM 522 HD3 LYS A 35 42.519 30.918 -10.838 1.00 0.00 H ATOM 523 HE2 LYS A 35 45.374 30.069 -10.329 1.00 0.00 H ATOM 524 HE3 LYS A 35 44.378 31.230 -9.421 1.00 0.00 H ATOM 525 HZ1 LYS A 35 45.389 31.601 -12.192 1.00 0.00 H ATOM 526 HZ2 LYS A 35 44.438 32.710 -11.325 1.00 0.00 H ATOM 527 HZ3 LYS A 35 46.010 32.343 -10.796 1.00 0.00 H ATOM 528 H LYS A 35 41.114 26.905 -9.971 1.00 0.00 H ATOM 529 N PHE A 36 41.776 28.277 -6.006 1.00 39.47 N ATOM 530 CA PHE A 36 40.907 28.486 -4.860 1.00 39.47 C ATOM 531 C PHE A 36 41.115 29.825 -4.152 1.00 39.47 C ATOM 532 O PHE A 36 40.344 30.168 -3.256 1.00 39.26 O ATOM 533 CB PHE A 36 41.072 27.345 -3.853 1.00 39.26 C ATOM 534 CG PHE A 36 42.426 27.290 -3.218 1.00 39.26 C ATOM 535 CD1 PHE A 36 42.692 28.005 -2.058 1.00 39.26 C ATOM 536 CD2 PHE A 36 43.436 26.520 -3.775 1.00 39.26 C ATOM 537 CE1 PHE A 36 43.945 27.954 -1.463 1.00 39.26 C ATOM 538 CE2 PHE A 36 44.693 26.461 -3.188 1.00 39.26 C ATOM 539 CZ PHE A 36 44.949 27.179 -2.030 1.00 39.26 C ATOM 540 HA PHE A 36 39.893 28.502 -5.260 1.00 0.00 H ATOM 541 HB2 PHE A 36 40.328 27.471 -3.066 1.00 0.00 H ATOM 542 HB3 PHE A 36 40.896 26.402 -4.370 1.00 0.00 H ATOM 543 HD2 PHE A 36 43.241 25.954 -4.686 1.00 0.00 H ATOM 544 HE2 PHE A 36 45.477 25.851 -3.637 1.00 0.00 H ATOM 545 HZ PHE A 36 45.934 27.136 -1.566 1.00 0.00 H ATOM 546 HE1 PHE A 36 44.141 28.521 -0.553 1.00 0.00 H ATOM 547 HD1 PHE A 36 41.907 28.614 -1.609 1.00 0.00 H ATOM 548 H PHE A 36 42.793 28.476 -5.923 1.00 0.00 H ATOM 549 N ASP A 37 42.138 30.582 -4.545 1.00 42.42 N ATOM 550 CA ASP A 37 42.422 31.871 -3.908 1.00 42.42 C ATOM 551 C ASP A 37 43.454 32.645 -4.717 1.00 42.42 C ATOM 552 O ASP A 37 44.294 32.042 -5.384 1.00 26.09 O ATOM 553 CB ASP A 37 42.946 31.645 -2.482 1.00 26.09 C ATOM 554 CG ASP A 37 42.947 32.910 -1.643 1.00 26.09 C ATOM 555 OD1 ASP A 37 42.202 33.856 -1.972 1.00 26.09 O ATOM 556 OD2 ASP A 37 43.685 32.947 -0.640 1.00 26.09 O ATOM 557 HA ASP A 37 41.500 32.450 -3.866 1.00 0.00 H ATOM 558 HB2 ASP A 37 42.314 30.904 -1.993 1.00 0.00 H ATOM 559 HB3 ASP A 37 43.967 31.267 -2.542 1.00 0.00 H ATOM 560 H ASP A 37 42.748 30.252 -5.320 1.00 0.00 H ATOM 561 N SER A 38 43.394 33.974 -4.634 1.00 27.38 N ATOM 562 CA SER A 38 44.310 34.861 -5.354 1.00 27.38 C ATOM 563 C SER A 38 44.288 36.259 -4.751 1.00 27.38 C ATOM 564 O SER A 38 43.265 36.946 -4.811 1.00 54.24 O ATOM 565 CB SER A 38 43.907 34.949 -6.832 1.00 54.24 C ATOM 566 OG SER A 38 44.691 35.902 -7.527 1.00 54.24 O ATOM 567 HA SER A 38 45.316 34.449 -5.270 1.00 0.00 H ATOM 568 HB2 SER A 38 42.858 35.238 -6.897 1.00 0.00 H ATOM 569 HB3 SER A 38 44.043 33.972 -7.296 1.00 0.00 H ATOM 570 HG SER A 38 44.406 35.934 -8.475 1.00 0.00 H ATOM 571 H SER A 38 42.663 34.401 -4.030 1.00 0.00 H ATOM 572 N SER A 39 45.407 36.682 -4.167 1.00 24.56 N ATOM 573 CA SER A 39 45.495 38.013 -3.568 1.00 24.56 C ATOM 574 C SER A 39 45.587 39.067 -4.653 1.00 24.56 C ATOM 575 O SER A 39 45.207 40.213 -4.443 1.00 17.82 O ATOM 576 CB SER A 39 46.696 38.126 -2.624 1.00 17.82 C ATOM 577 OG SER A 39 47.922 37.878 -3.299 1.00 17.82 O ATOM 578 HA SER A 39 44.591 38.175 -2.981 1.00 0.00 H ATOM 579 HB2 SER A 39 46.582 37.400 -1.819 1.00 0.00 H ATOM 580 HB3 SER A 39 46.721 39.131 -2.203 1.00 0.00 H ATOM 581 HG SER A 39 48.035 38.538 -4.028 1.00 0.00 H ATOM 582 H SER A 39 46.235 36.053 -4.136 1.00 0.00 H ATOM 583 N ARG A 40 46.103 38.681 -5.813 1.00 15.75 N ATOM 584 CA ARG A 40 46.228 39.612 -6.930 1.00 15.75 C ATOM 585 C ARG A 40 44.864 40.139 -7.376 1.00 15.75 C ATOM 586 O ARG A 40 44.710 41.322 -7.680 1.00 55.27 O ATOM 587 CB ARG A 40 46.951 38.947 -8.104 1.00 55.27 C ATOM 588 CG ARG A 40 48.368 38.523 -7.779 1.00 55.27 C ATOM 589 CD ARG A 40 49.031 37.833 -8.951 1.00 55.27 C ATOM 590 NE ARG A 40 50.323 37.261 -8.578 1.00 55.27 N ATOM 591 CZ ARG A 40 51.472 37.927 -8.593 1.00 55.27 C ATOM 592 NH1 ARG A 40 51.501 39.201 -8.968 1.00 55.27 N ATOM 593 NH2 ARG A 40 52.591 37.322 -8.214 1.00 55.27 N ATOM 594 HA ARG A 40 46.818 40.462 -6.587 1.00 0.00 H ATOM 595 HB2 ARG A 40 46.386 38.064 -8.402 1.00 0.00 H ATOM 596 HB3 ARG A 40 46.984 39.653 -8.934 1.00 0.00 H ATOM 597 HG2 ARG A 40 48.949 39.406 -7.515 1.00 0.00 H ATOM 598 HG3 ARG A 40 48.346 37.837 -6.932 1.00 0.00 H ATOM 599 HD2 ARG A 40 49.183 38.559 -9.750 1.00 0.00 H ATOM 600 HD3 ARG A 40 48.380 37.035 -9.306 1.00 0.00 H ATOM 601 HE ARG A 40 50.344 36.265 -8.281 1.00 0.00 H ATOM 602 HH12 ARG A 40 52.402 39.720 -8.979 1.00 0.00 H ATOM 603 HH11 ARG A 40 50.622 39.680 -9.251 1.00 0.00 H ATOM 604 HH22 ARG A 40 53.492 37.841 -8.225 1.00 0.00 H ATOM 605 HH21 ARG A 40 52.567 36.329 -7.906 1.00 0.00 H ATOM 606 H ARG A 40 46.424 37.698 -5.928 1.00 0.00 H ATOM 607 N ASP A 41 43.873 39.257 -7.388 1.00 47.01 N ATOM 608 CA ASP A 41 42.525 39.640 -7.784 1.00 47.01 C ATOM 609 C ASP A 41 41.895 40.616 -6.785 1.00 47.01 C ATOM 610 O ASP A 41 41.085 41.463 -7.168 1.00 77.93 O ATOM 611 CB ASP A 41 41.647 38.400 -7.981 1.00 77.93 C ATOM 612 CG ASP A 41 41.973 37.657 -9.268 1.00 77.93 C ATOM 613 OD1 ASP A 41 43.140 37.249 -9.451 1.00 77.93 O ATOM 614 OD2 ASP A 41 41.065 37.487 -10.105 1.00 77.93 O ATOM 615 HA ASP A 41 42.595 40.162 -8.738 1.00 0.00 H ATOM 616 HB2 ASP A 41 41.800 37.725 -7.139 1.00 0.00 H ATOM 617 HB3 ASP A 41 40.603 38.711 -8.011 1.00 0.00 H ATOM 618 H ASP A 41 44.063 38.273 -7.109 1.00 0.00 H ATOM 619 N ARG A 42 42.272 40.519 -5.512 1.00 24.45 N ATOM 620 CA ARG A 42 41.727 41.434 -4.510 1.00 24.45 C ATOM 621 C ARG A 42 42.642 42.634 -4.226 1.00 24.45 C ATOM 622 O ARG A 42 42.454 43.339 -3.238 1.00 35.23 O ATOM 623 CB ARG A 42 41.367 40.695 -3.209 1.00 35.23 C ATOM 624 CG ARG A 42 42.525 40.042 -2.480 1.00 35.23 C ATOM 625 CD ARG A 42 42.067 39.355 -1.192 1.00 35.23 C ATOM 626 NE ARG A 42 43.134 38.543 -0.610 1.00 35.23 N ATOM 627 CZ ARG A 42 43.182 37.216 -0.662 1.00 35.23 C ATOM 628 NH1 ARG A 42 42.219 36.530 -1.258 1.00 35.23 N ATOM 629 NH2 ARG A 42 44.227 36.576 -0.158 1.00 35.23 N ATOM 630 HA ARG A 42 40.811 41.839 -4.940 1.00 0.00 H ATOM 631 HB2 ARG A 42 40.908 41.415 -2.531 1.00 0.00 H ATOM 632 HB3 ARG A 42 40.644 39.917 -3.455 1.00 0.00 H ATOM 633 HG2 ARG A 42 42.981 39.299 -3.134 1.00 0.00 H ATOM 634 HG3 ARG A 42 43.262 40.806 -2.231 1.00 0.00 H ATOM 635 HD2 ARG A 42 41.215 38.713 -1.416 1.00 0.00 H ATOM 636 HD3 ARG A 42 41.767 40.116 -0.471 1.00 0.00 H ATOM 637 HE ARG A 42 43.908 39.037 -0.122 1.00 0.00 H ATOM 638 HH12 ARG A 42 42.266 35.492 -1.293 1.00 0.00 H ATOM 639 HH11 ARG A 42 41.416 37.030 -1.691 1.00 0.00 H ATOM 640 HH22 ARG A 42 44.269 35.538 -0.196 1.00 0.00 H ATOM 641 HH21 ARG A 42 45.005 37.112 0.276 1.00 0.00 H ATOM 642 H ARG A 42 42.957 39.789 -5.229 1.00 0.00 H ATOM 643 N ASN A 43 43.640 42.846 -5.084 1.00 35.96 N ATOM 644 CA ASN A 43 44.589 43.960 -4.959 1.00 35.96 C ATOM 645 C ASN A 43 45.273 44.179 -3.602 1.00 35.96 C ATOM 646 O ASN A 43 45.933 45.199 -3.400 1.00 95.06 O ATOM 647 CB ASN A 43 43.940 45.263 -5.430 1.00 95.06 C ATOM 648 CG ASN A 43 43.533 45.212 -6.886 1.00 95.06 C ATOM 649 OD1 ASN A 43 44.334 45.490 -7.776 1.00 95.06 O ATOM 650 ND2 ASN A 43 42.288 44.833 -7.138 1.00 95.06 N ATOM 651 HA ASN A 43 45.411 43.650 -5.605 1.00 0.00 H ATOM 652 HB2 ASN A 43 43.053 45.451 -4.825 1.00 0.00 H ATOM 653 HB3 ASN A 43 44.651 46.078 -5.293 1.00 0.00 H ATOM 654 HD22 ASN A 43 41.644 44.607 -6.353 1.00 0.00 H ATOM 655 HD21 ASN A 43 41.955 44.761 -8.121 1.00 0.00 H ATOM 656 H ASN A 43 43.752 42.189 -5.882 1.00 0.00 H ATOM 657 N LYS A 44 45.160 43.211 -2.696 1.00 46.28 N ATOM 658 CA LYS A 44 45.776 43.310 -1.372 1.00 46.28 C ATOM 659 C LYS A 44 46.789 42.178 -1.153 1.00 46.28 C ATOM 660 O LYS A 44 46.424 41.000 -1.072 1.00 97.78 O ATOM 661 CB LYS A 44 44.699 43.287 -0.276 1.00 97.78 C ATOM 662 CG LYS A 44 45.228 43.459 1.149 1.00 97.78 C ATOM 663 CD LYS A 44 44.102 43.390 2.174 1.00 97.78 C ATOM 664 CE LYS A 44 44.633 43.368 3.610 1.00 97.78 C ATOM 665 NZ LYS A 44 45.359 44.613 4.011 1.00 97.78 N ATOM 666 HA LYS A 44 46.310 44.259 -1.316 1.00 0.00 H ATOM 667 HB2 LYS A 44 43.994 44.094 -0.476 1.00 0.00 H ATOM 668 HB3 LYS A 44 44.179 42.331 -0.332 1.00 0.00 H ATOM 669 HG2 LYS A 44 45.947 42.667 1.358 1.00 0.00 H ATOM 670 HG3 LYS A 44 45.722 44.427 1.229 1.00 0.00 H ATOM 671 HD2 LYS A 44 43.459 44.261 2.050 1.00 0.00 H ATOM 672 HD3 LYS A 44 43.522 42.484 1.999 1.00 0.00 H ATOM 673 HE2 LYS A 44 45.317 42.525 3.710 1.00 0.00 H ATOM 674 HE3 LYS A 44 43.789 43.231 4.286 1.00 0.00 H ATOM 675 HZ1 LYS A 44 46.176 44.754 3.384 1.00 0.00 H ATOM 676 HZ2 LYS A 44 44.717 45.427 3.934 1.00 0.00 H ATOM 677 HZ3 LYS A 44 45.687 44.521 4.994 1.00 0.00 H ATOM 678 H LYS A 44 44.617 42.357 -2.936 1.00 0.00 H ATOM 679 N PRO A 45 48.085 42.520 -1.119 1.00 33.82 N ATOM 680 CA PRO A 45 49.189 41.576 -0.920 1.00 33.82 C ATOM 681 C PRO A 45 49.137 40.958 0.463 1.00 33.82 C ATOM 682 O PRO A 45 48.783 41.627 1.430 1.00 36.26 O ATOM 683 CB PRO A 45 50.420 42.461 -1.069 1.00 36.26 C ATOM 684 CG PRO A 45 49.947 43.546 -1.986 1.00 36.26 C ATOM 685 CD PRO A 45 48.604 43.864 -1.409 1.00 36.26 C ATOM 686 HA PRO A 45 49.168 40.738 -1.616 1.00 0.00 H ATOM 687 HD3 PRO A 45 48.691 44.462 -0.502 1.00 0.00 H ATOM 688 HD2 PRO A 45 47.975 44.388 -2.129 1.00 0.00 H ATOM 689 HG3 PRO A 45 49.865 43.191 -3.013 1.00 0.00 H ATOM 690 HG2 PRO A 45 50.609 44.411 -1.954 1.00 0.00 H ATOM 691 HB2 PRO A 45 50.729 42.868 -0.106 1.00 0.00 H ATOM 692 HB3 PRO A 45 51.249 41.908 -1.511 1.00 0.00 H ATOM 693 N PHE A 46 49.516 39.690 0.560 1.00 32.24 N ATOM 694 CA PHE A 46 49.497 38.994 1.832 1.00 32.24 C ATOM 695 C PHE A 46 50.740 39.296 2.662 1.00 32.24 C ATOM 696 O PHE A 46 51.866 39.098 2.204 1.00 22.05 O ATOM 697 CB PHE A 46 49.363 37.489 1.613 1.00 22.05 C ATOM 698 CG PHE A 46 49.384 36.692 2.885 1.00 22.05 C ATOM 699 CD1 PHE A 46 48.339 36.781 3.795 1.00 22.05 C ATOM 700 CD2 PHE A 46 50.455 35.863 3.183 1.00 22.05 C ATOM 701 CE1 PHE A 46 48.365 36.058 4.977 1.00 22.05 C ATOM 702 CE2 PHE A 46 50.482 35.138 4.368 1.00 22.05 C ATOM 703 CZ PHE A 46 49.439 35.236 5.263 1.00 22.05 C ATOM 704 HA PHE A 46 48.632 39.354 2.389 1.00 0.00 H ATOM 705 HB2 PHE A 46 48.420 37.298 1.102 1.00 0.00 H ATOM 706 HB3 PHE A 46 50.189 37.157 0.984 1.00 0.00 H ATOM 707 HD2 PHE A 46 51.284 35.779 2.480 1.00 0.00 H ATOM 708 HE2 PHE A 46 51.330 34.490 4.590 1.00 0.00 H ATOM 709 HZ PHE A 46 49.461 34.668 6.193 1.00 0.00 H ATOM 710 HE1 PHE A 46 47.538 36.138 5.682 1.00 0.00 H ATOM 711 HD1 PHE A 46 47.488 37.427 3.577 1.00 0.00 H ATOM 712 H PHE A 46 49.833 39.186 -0.293 1.00 0.00 H ATOM 713 N LYS A 47 50.519 39.770 3.885 1.00 22.95 N ATOM 714 CA LYS A 47 51.593 40.101 4.814 1.00 22.95 C ATOM 715 C LYS A 47 51.605 39.111 5.978 1.00 22.95 C ATOM 716 O LYS A 47 50.559 38.792 6.552 1.00 71.72 O ATOM 717 CB LYS A 47 51.408 41.522 5.366 1.00 71.72 C ATOM 718 CG LYS A 47 51.394 42.642 4.319 1.00 71.72 C ATOM 719 CD LYS A 47 51.390 44.029 4.978 1.00 71.72 C ATOM 720 CE LYS A 47 51.347 45.154 3.942 1.00 71.72 C ATOM 721 NZ LYS A 47 51.440 46.516 4.550 1.00 71.72 N ATOM 722 HA LYS A 47 52.539 40.045 4.275 1.00 0.00 H ATOM 723 HB2 LYS A 47 50.460 41.553 5.903 1.00 0.00 H ATOM 724 HB3 LYS A 47 52.224 41.721 6.060 1.00 0.00 H ATOM 725 HG2 LYS A 47 52.280 42.551 3.691 1.00 0.00 H ATOM 726 HG3 LYS A 47 50.501 42.540 3.703 1.00 0.00 H ATOM 727 HD2 LYS A 47 50.515 44.110 5.623 1.00 0.00 H ATOM 728 HD3 LYS A 47 52.294 44.137 5.578 1.00 0.00 H ATOM 729 HE2 LYS A 47 50.409 45.083 3.391 1.00 0.00 H ATOM 730 HE3 LYS A 47 52.182 45.024 3.253 1.00 0.00 H ATOM 731 HZ1 LYS A 47 50.643 46.658 5.203 1.00 0.00 H ATOM 732 HZ2 LYS A 47 52.336 46.601 5.071 1.00 0.00 H ATOM 733 HZ3 LYS A 47 51.405 47.233 3.798 1.00 0.00 H ATOM 734 H LYS A 47 49.536 39.911 4.193 1.00 0.00 H ATOM 735 N PHE A 48 52.790 38.634 6.330 1.00 27.74 N ATOM 736 CA PHE A 48 52.937 37.697 7.430 1.00 27.74 C ATOM 737 C PHE A 48 54.390 37.708 7.886 1.00 27.74 C ATOM 738 O PHE A 48 55.297 37.935 7.082 1.00 30.09 O ATOM 739 CB PHE A 48 52.568 36.282 6.988 1.00 30.09 C ATOM 740 CG PHE A 48 53.591 35.650 6.088 1.00 30.09 C ATOM 741 CD1 PHE A 48 53.648 35.981 4.740 1.00 30.09 C ATOM 742 CD2 PHE A 48 54.518 34.750 6.595 1.00 30.09 C ATOM 743 CE1 PHE A 48 54.613 35.429 3.911 1.00 30.09 C ATOM 744 CE2 PHE A 48 55.487 34.193 5.772 1.00 30.09 C ATOM 745 CZ PHE A 48 55.533 34.533 4.429 1.00 30.09 C ATOM 746 HA PHE A 48 52.273 37.994 8.242 1.00 0.00 H ATOM 747 HB2 PHE A 48 52.458 35.660 7.876 1.00 0.00 H ATOM 748 HB3 PHE A 48 51.618 36.323 6.455 1.00 0.00 H ATOM 749 HD2 PHE A 48 54.485 34.478 7.650 1.00 0.00 H ATOM 750 HE2 PHE A 48 56.211 33.489 6.181 1.00 0.00 H ATOM 751 HZ PHE A 48 56.293 34.095 3.781 1.00 0.00 H ATOM 752 HE1 PHE A 48 54.647 35.699 2.856 1.00 0.00 H ATOM 753 HD1 PHE A 48 52.924 36.684 4.328 1.00 0.00 H ATOM 754 H PHE A 48 53.635 38.938 5.806 1.00 0.00 H ATOM 755 N MET A 49 54.599 37.460 9.174 1.00 46.70 N ATOM 756 CA MET A 49 55.939 37.412 9.747 1.00 46.70 C ATOM 757 C MET A 49 56.439 35.975 9.695 1.00 46.70 C ATOM 758 O MET A 49 55.665 35.029 9.860 1.00 91.32 O ATOM 759 CB MET A 49 55.935 37.903 11.198 1.00 91.32 C ATOM 760 CG MET A 49 55.586 39.373 11.379 1.00 91.32 C ATOM 761 SD MET A 49 55.801 39.915 13.093 1.00 91.32 S ATOM 762 CE MET A 49 57.314 40.873 12.964 1.00 91.32 C ATOM 763 HA MET A 49 56.595 38.065 9.172 1.00 0.00 H ATOM 764 HB2 MET A 49 55.207 37.312 11.753 1.00 0.00 H ATOM 765 HB3 MET A 49 56.929 37.738 11.614 1.00 0.00 H ATOM 766 HG2 MET A 49 54.547 39.527 11.089 1.00 0.00 H ATOM 767 HG3 MET A 49 56.233 39.970 10.737 1.00 0.00 H ATOM 768 HE1 MET A 49 58.119 40.231 12.606 1.00 0.00 H ATOM 769 HE2 MET A 49 57.164 41.694 12.264 1.00 0.00 H ATOM 770 HE3 MET A 49 57.574 41.273 13.944 1.00 0.00 H ATOM 771 H MET A 49 53.780 37.295 9.794 1.00 0.00 H ATOM 772 N LEU A 50 57.736 35.816 9.475 1.00 46.66 N ATOM 773 CA LEU A 50 58.334 34.496 9.390 1.00 46.66 C ATOM 774 C LEU A 50 58.643 33.931 10.776 1.00 46.66 C ATOM 775 O LEU A 50 59.103 34.649 11.664 1.00 49.41 O ATOM 776 CB LEU A 50 59.614 34.557 8.548 1.00 49.41 C ATOM 777 CG LEU A 50 60.102 33.258 7.896 1.00 49.41 C ATOM 778 CD1 LEU A 50 59.099 32.789 6.855 1.00 49.41 C ATOM 779 CD2 LEU A 50 61.456 33.486 7.249 1.00 49.41 C ATOM 780 HA LEU A 50 57.616 33.830 8.912 1.00 0.00 H ATOM 781 HB2 LEU A 50 59.444 35.279 7.749 1.00 0.00 H ATOM 782 HB3 LEU A 50 60.413 34.916 9.196 1.00 0.00 H ATOM 783 HG LEU A 50 60.198 32.489 8.662 1.00 0.00 H ATOM 784 HD21 LEU A 50 61.368 34.261 6.488 1.00 0.00 H ATOM 785 HD22 LEU A 50 62.172 33.800 8.008 1.00 0.00 H ATOM 786 HD23 LEU A 50 61.797 32.559 6.787 1.00 0.00 H ATOM 787 HD11 LEU A 50 58.136 32.610 7.334 1.00 0.00 H ATOM 788 HD12 LEU A 50 58.988 33.556 6.088 1.00 0.00 H ATOM 789 HD13 LEU A 50 59.456 31.866 6.398 1.00 0.00 H ATOM 790 H LEU A 50 58.339 36.656 9.361 1.00 0.00 H ATOM 791 N GLY A 51 58.351 32.647 10.957 1.00 48.05 N ATOM 792 CA GLY A 51 58.624 31.978 12.217 1.00 48.05 C ATOM 793 C GLY A 51 57.694 32.276 13.374 1.00 48.05 C ATOM 794 O GLY A 51 57.912 31.784 14.479 1.00 77.13 O ATOM 795 HA3 GLY A 51 59.631 32.257 12.525 1.00 0.00 H ATOM 796 HA2 GLY A 51 58.586 30.904 12.033 1.00 0.00 H ATOM 797 H GLY A 51 57.918 32.110 10.179 1.00 0.00 H ATOM 798 N LYS A 52 56.651 33.062 13.130 1.00 58.69 N ATOM 799 CA LYS A 52 55.696 33.403 14.183 1.00 58.69 C ATOM 800 C LYS A 52 54.442 32.521 14.129 1.00 58.69 C ATOM 801 O LYS A 52 53.430 32.819 14.769 1.00116.73 O ATOM 802 CB LYS A 52 55.315 34.884 14.094 1.00116.73 C ATOM 803 CG LYS A 52 56.459 35.855 14.387 1.00116.73 C ATOM 804 CD LYS A 52 56.859 35.843 15.863 1.00116.73 C ATOM 805 CE LYS A 52 57.946 36.874 16.153 1.00116.73 C ATOM 806 NZ LYS A 52 58.264 36.999 17.607 1.00116.73 N ATOM 807 HA LYS A 52 56.182 33.216 15.141 1.00 0.00 H ATOM 808 HB2 LYS A 52 54.951 35.082 13.086 1.00 0.00 H ATOM 809 HB3 LYS A 52 54.516 35.073 14.811 1.00 0.00 H ATOM 810 HG2 LYS A 52 57.323 35.572 13.786 1.00 0.00 H ATOM 811 HG3 LYS A 52 56.143 36.863 14.116 1.00 0.00 H ATOM 812 HD2 LYS A 52 55.983 36.070 16.470 1.00 0.00 H ATOM 813 HD3 LYS A 52 57.232 34.852 16.122 1.00 0.00 H ATOM 814 HE2 LYS A 52 57.611 37.844 15.787 1.00 0.00 H ATOM 815 HE3 LYS A 52 58.853 36.581 15.624 1.00 0.00 H ATOM 816 HZ1 LYS A 52 57.409 37.288 18.124 1.00 0.00 H ATOM 817 HZ2 LYS A 52 58.595 36.082 17.968 1.00 0.00 H ATOM 818 HZ3 LYS A 52 59.008 37.714 17.738 1.00 0.00 H ATOM 819 H LYS A 52 56.511 33.442 12.172 1.00 0.00 H ATOM 820 N GLN A 53 54.522 31.440 13.354 1.00 55.45 N ATOM 821 CA GLN A 53 53.420 30.495 13.196 1.00 55.45 C ATOM 822 C GLN A 53 52.165 31.177 12.637 1.00 55.45 C ATOM 823 O GLN A 53 51.044 30.880 13.050 1.00130.79 O ATOM 824 CB GLN A 53 53.113 29.809 14.534 1.00130.79 C ATOM 825 CG GLN A 53 52.209 28.589 14.427 1.00130.79 C ATOM 826 CD GLN A 53 51.642 28.158 15.768 1.00130.79 C ATOM 827 OE1 GLN A 53 50.669 28.737 16.262 1.00130.79 O ATOM 828 NE2 GLN A 53 52.231 27.121 16.354 1.00130.79 N ATOM 829 HA GLN A 53 53.729 29.739 12.474 1.00 0.00 H ATOM 830 HB2 GLN A 53 54.057 29.495 14.980 1.00 0.00 H ATOM 831 HB3 GLN A 53 52.628 30.536 15.186 1.00 0.00 H ATOM 832 HG2 GLN A 53 51.381 28.826 13.758 1.00 0.00 H ATOM 833 HG3 GLN A 53 52.786 27.763 14.011 1.00 0.00 H ATOM 834 HE22 GLN A 53 53.048 26.663 15.902 1.00 0.00 H ATOM 835 HE21 GLN A 53 51.875 26.767 17.265 1.00 0.00 H ATOM 836 H GLN A 53 55.408 31.262 12.839 1.00 0.00 H ATOM 837 N GLU A 54 52.363 32.112 11.712 1.00 44.08 N ATOM 838 CA GLU A 54 51.248 32.819 11.092 1.00 44.08 C ATOM 839 C GLU A 54 50.831 32.124 9.798 1.00 44.08 C ATOM 840 O GLU A 54 49.790 32.444 9.234 1.00 51.61 O ATOM 841 CB GLU A 54 51.613 34.281 10.792 1.00 51.61 C ATOM 842 CG GLU A 54 51.664 35.200 12.009 1.00 51.61 C ATOM 843 CD GLU A 54 51.765 36.687 11.642 1.00 51.61 C ATOM 844 OE1 GLU A 54 51.596 37.048 10.455 1.00 51.61 O ATOM 845 OE2 GLU A 54 51.998 37.508 12.555 1.00 51.61 O ATOM 846 HA GLU A 54 50.416 32.806 11.797 1.00 0.00 H ATOM 847 HB2 GLU A 54 52.594 34.294 10.318 1.00 0.00 H ATOM 848 HB3 GLU A 54 50.871 34.679 10.099 1.00 0.00 H ATOM 849 HG2 GLU A 54 50.758 35.049 12.596 1.00 0.00 H ATOM 850 HG3 GLU A 54 52.533 34.932 12.610 1.00 0.00 H ATOM 851 H GLU A 54 53.335 32.344 11.424 1.00 0.00 H ATOM 852 N VAL A 55 51.642 31.173 9.340 1.00 35.56 N ATOM 853 CA VAL A 55 51.366 30.437 8.105 1.00 35.56 C ATOM 854 C VAL A 55 51.753 28.962 8.190 1.00 35.56 C ATOM 855 O VAL A 55 52.489 28.547 9.089 1.00 54.82 O ATOM 856 CB VAL A 55 52.110 31.042 6.894 1.00 54.82 C ATOM 857 CG1 VAL A 55 51.459 32.342 6.466 1.00 54.82 C ATOM 858 CG2 VAL A 55 53.572 31.267 7.237 1.00 54.82 C ATOM 859 HA VAL A 55 50.288 30.520 7.970 1.00 0.00 H ATOM 860 HB VAL A 55 52.051 30.340 6.062 1.00 0.00 H ATOM 861 HG11 VAL A 55 50.422 32.153 6.187 1.00 0.00 H ATOM 862 HG12 VAL A 55 51.491 33.052 7.292 1.00 0.00 H ATOM 863 HG13 VAL A 55 51.997 32.753 5.612 1.00 0.00 H ATOM 864 HG21 VAL A 55 53.644 31.953 8.081 1.00 0.00 H ATOM 865 HG22 VAL A 55 54.033 30.315 7.501 1.00 0.00 H ATOM 866 HG23 VAL A 55 54.085 31.694 6.375 1.00 0.00 H ATOM 867 H VAL A 55 52.502 30.945 9.878 1.00 0.00 H ATOM 868 N ILE A 56 51.255 28.185 7.235 1.00 25.71 N ATOM 869 CA ILE A 56 51.524 26.751 7.152 1.00 25.71 C ATOM 870 C ILE A 56 53.001 26.438 6.868 1.00 25.71 C ATOM 871 O ILE A 56 53.710 27.244 6.255 1.00 38.15 O ATOM 872 CB ILE A 56 50.636 26.094 6.063 1.00 38.15 C ATOM 873 CG1 ILE A 56 50.987 26.649 4.679 1.00 38.15 C ATOM 874 CG2 ILE A 56 49.168 26.383 6.346 1.00 38.15 C ATOM 875 CD1 ILE A 56 50.087 26.154 3.570 1.00 38.15 C ATOM 876 HA ILE A 56 51.283 26.334 8.130 1.00 0.00 H ATOM 877 HB ILE A 56 50.815 25.019 6.080 1.00 0.00 H ATOM 878 HG12 ILE A 56 50.917 27.736 4.718 1.00 0.00 H ATOM 879 HG13 ILE A 56 52.011 26.360 4.444 1.00 0.00 H ATOM 880 HD11 ILE A 56 50.153 25.068 3.507 1.00 0.00 H ATOM 881 HD12 ILE A 56 49.058 26.445 3.782 1.00 0.00 H ATOM 882 HD13 ILE A 56 50.403 26.594 2.624 1.00 0.00 H ATOM 883 HG21 ILE A 56 48.901 25.977 7.322 1.00 0.00 H ATOM 884 HG22 ILE A 56 49.004 27.461 6.342 1.00 0.00 H ATOM 885 HG23 ILE A 56 48.552 25.918 5.576 1.00 0.00 H ATOM 886 H ILE A 56 50.645 28.617 6.512 1.00 0.00 H ATOM 887 N ARG A 57 53.439 25.250 7.284 1.00 61.53 N ATOM 888 CA ARG A 57 54.821 24.792 7.104 1.00 61.53 C ATOM 889 C ARG A 57 55.429 25.030 5.727 1.00 61.53 C ATOM 890 O ARG A 57 56.536 25.562 5.614 1.00101.66 O ATOM 891 CB ARG A 57 54.931 23.305 7.435 1.00101.66 C ATOM 892 CG ARG A 57 55.159 23.010 8.897 1.00101.66 C ATOM 893 CD ARG A 57 56.344 22.070 9.059 1.00101.66 C ATOM 894 NE ARG A 57 57.552 22.624 8.445 1.00101.66 N ATOM 895 CZ ARG A 57 58.706 21.972 8.322 1.00101.66 C ATOM 896 NH1 ARG A 57 58.821 20.727 8.775 1.00101.66 N ATOM 897 NH2 ARG A 57 59.742 22.564 7.734 1.00101.66 N ATOM 898 HA ARG A 57 55.397 25.409 7.793 1.00 0.00 H ATOM 899 HB2 ARG A 57 54.006 22.817 7.128 1.00 0.00 H ATOM 900 HB3 ARG A 57 55.764 22.890 6.869 1.00 0.00 H ATOM 901 HG2 ARG A 57 55.361 23.941 9.426 1.00 0.00 H ATOM 902 HG3 ARG A 57 54.267 22.543 9.315 1.00 0.00 H ATOM 903 HD2 ARG A 57 56.109 21.117 8.584 1.00 0.00 H ATOM 904 HD3 ARG A 57 56.527 21.909 10.121 1.00 0.00 H ATOM 905 HE ARG A 57 57.505 23.596 8.079 1.00 0.00 H ATOM 906 HH12 ARG A 57 59.724 20.220 8.678 1.00 0.00 H ATOM 907 HH11 ARG A 57 58.008 20.261 9.226 1.00 0.00 H ATOM 908 HH22 ARG A 57 60.645 22.056 7.637 1.00 0.00 H ATOM 909 HH21 ARG A 57 59.649 23.534 7.371 1.00 0.00 H ATOM 910 H ARG A 57 52.767 24.615 7.760 1.00 0.00 H ATOM 911 N GLY A 58 54.727 24.592 4.688 1.00 36.48 N ATOM 912 CA GLY A 58 55.217 24.773 3.335 1.00 36.48 C ATOM 913 C GLY A 58 55.609 26.211 3.083 1.00 36.48 C ATOM 914 O GLY A 58 56.703 26.477 2.598 1.00 58.60 O ATOM 915 HA3 GLY A 58 54.434 24.489 2.632 1.00 0.00 H ATOM 916 HA2 GLY A 58 56.088 24.135 3.184 1.00 0.00 H ATOM 917 H GLY A 58 53.817 24.114 4.846 1.00 0.00 H ATOM 918 N TRP A 59 54.727 27.143 3.423 1.00 30.95 N ATOM 919 CA TRP A 59 55.026 28.553 3.231 1.00 30.95 C ATOM 920 C TRP A 59 56.239 28.920 4.069 1.00 30.95 C ATOM 921 O TRP A 59 57.184 29.515 3.563 1.00 24.29 O ATOM 922 CB TRP A 59 53.828 29.430 3.612 1.00 24.29 C ATOM 923 CG TRP A 59 52.953 29.766 2.449 1.00 24.29 C ATOM 924 CD1 TRP A 59 52.303 28.888 1.638 1.00 24.29 C ATOM 925 CD2 TRP A 59 52.649 31.077 1.946 1.00 24.29 C ATOM 926 NE1 TRP A 59 51.619 29.564 0.658 1.00 24.29 N ATOM 927 CE2 TRP A 59 51.813 30.907 0.822 1.00 24.29 C ATOM 928 CE3 TRP A 59 53.002 32.375 2.336 1.00 24.29 C ATOM 929 CZ2 TRP A 59 51.322 31.987 0.081 1.00 24.29 C ATOM 930 CZ3 TRP A 59 52.513 33.448 1.599 1.00 24.29 C ATOM 931 CH2 TRP A 59 51.681 33.245 0.482 1.00 24.29 C ATOM 932 HA TRP A 59 55.240 28.729 2.177 1.00 0.00 H ATOM 933 HB2 TRP A 59 53.231 28.899 4.353 1.00 0.00 H ATOM 934 HB3 TRP A 59 54.201 30.358 4.045 1.00 0.00 H ATOM 935 HE1 TRP A 59 51.045 29.124 -0.090 1.00 0.00 H ATOM 936 HD1 TRP A 59 52.322 27.804 1.750 1.00 0.00 H ATOM 937 HZ2 TRP A 59 50.677 31.832 -0.784 1.00 0.00 H ATOM 938 HH2 TRP A 59 51.315 34.108 -0.075 1.00 0.00 H ATOM 939 HZ3 TRP A 59 52.779 34.464 1.891 1.00 0.00 H ATOM 940 HE3 TRP A 59 53.647 32.541 3.199 1.00 0.00 H ATOM 941 H TRP A 59 53.813 26.862 3.831 1.00 0.00 H ATOM 942 N GLU A 60 56.231 28.499 5.330 1.00 35.01 N ATOM 943 CA GLU A 60 57.326 28.778 6.250 1.00 35.01 C ATOM 944 C GLU A 60 58.697 28.466 5.667 1.00 35.01 C ATOM 945 O GLU A 60 59.563 29.340 5.624 1.00 74.83 O ATOM 946 CB GLU A 60 57.138 28.000 7.556 1.00 74.83 C ATOM 947 CG GLU A 60 56.230 28.680 8.578 1.00 74.83 C ATOM 948 CD GLU A 60 56.943 29.746 9.398 1.00 74.83 C ATOM 949 OE1 GLU A 60 58.047 30.182 9.003 1.00 74.83 O ATOM 950 OE2 GLU A 60 56.397 30.141 10.452 1.00 74.83 O ATOM 951 HA GLU A 60 57.295 29.851 6.442 1.00 0.00 H ATOM 952 HB2 GLU A 60 56.709 27.028 7.314 1.00 0.00 H ATOM 953 HB3 GLU A 60 58.118 27.860 8.012 1.00 0.00 H ATOM 954 HG2 GLU A 60 55.400 29.148 8.048 1.00 0.00 H ATOM 955 HG3 GLU A 60 55.843 27.921 9.258 1.00 0.00 H ATOM 956 H GLU A 60 55.415 27.952 5.672 1.00 0.00 H ATOM 957 N GLU A 61 58.895 27.230 5.213 1.00 51.34 N ATOM 958 CA GLU A 61 60.183 26.834 4.649 1.00 51.34 C ATOM 959 C GLU A 61 60.369 27.300 3.207 1.00 51.34 C ATOM 960 O GLU A 61 61.403 27.878 2.859 1.00153.98 O ATOM 961 CB GLU A 61 60.384 25.316 4.761 1.00153.98 C ATOM 962 CG GLU A 61 61.677 24.778 4.123 1.00153.98 C ATOM 963 CD GLU A 61 62.956 25.367 4.722 1.00153.98 C ATOM 964 OE1 GLU A 61 63.310 24.994 5.862 1.00153.98 O ATOM 965 OE2 GLU A 61 63.619 26.185 4.044 1.00153.98 O ATOM 966 HA GLU A 61 60.949 27.336 5.240 1.00 0.00 H ATOM 967 HB2 GLU A 61 60.395 25.054 5.819 1.00 0.00 H ATOM 968 HB3 GLU A 61 59.539 24.827 4.276 1.00 0.00 H ATOM 969 HG2 GLU A 61 61.702 23.696 4.257 1.00 0.00 H ATOM 970 HG3 GLU A 61 61.657 25.011 3.058 1.00 0.00 H ATOM 971 H GLU A 61 58.121 26.537 5.261 1.00 0.00 H ATOM 972 N GLY A 62 59.355 27.074 2.383 1.00 44.97 N ATOM 973 CA GLY A 62 59.424 27.462 0.986 1.00 44.97 C ATOM 974 C GLY A 62 59.732 28.930 0.786 1.00 44.97 C ATOM 975 O GLY A 62 60.565 29.295 -0.038 1.00 47.29 O ATOM 976 HA3 GLY A 62 58.464 27.243 0.518 1.00 0.00 H ATOM 977 HA2 GLY A 62 60.205 26.875 0.502 1.00 0.00 H ATOM 978 H GLY A 62 58.496 26.611 2.744 1.00 0.00 H ATOM 979 N VAL A 63 59.074 29.778 1.560 1.00 38.58 N ATOM 980 CA VAL A 63 59.296 31.206 1.447 1.00 38.58 C ATOM 981 C VAL A 63 60.620 31.615 2.091 1.00 38.58 C ATOM 982 O VAL A 63 61.305 32.506 1.593 1.00 33.03 O ATOM 983 CB VAL A 63 58.124 32.000 2.059 1.00 33.03 C ATOM 984 CG1 VAL A 63 58.379 33.495 1.974 1.00 33.03 C ATOM 985 CG2 VAL A 63 56.843 31.659 1.327 1.00 33.03 C ATOM 986 HA VAL A 63 59.351 31.446 0.385 1.00 0.00 H ATOM 987 HB VAL A 63 58.032 31.726 3.110 1.00 0.00 H ATOM 988 HG11 VAL A 63 59.291 33.738 2.520 1.00 0.00 H ATOM 989 HG12 VAL A 63 58.491 33.784 0.929 1.00 0.00 H ATOM 990 HG13 VAL A 63 57.537 34.031 2.412 1.00 0.00 H ATOM 991 HG21 VAL A 63 56.947 31.920 0.274 1.00 0.00 H ATOM 992 HG22 VAL A 63 56.646 30.591 1.420 1.00 0.00 H ATOM 993 HG23 VAL A 63 56.017 32.222 1.762 1.00 0.00 H ATOM 994 H VAL A 63 58.391 29.416 2.256 1.00 0.00 H ATOM 995 N ALA A 64 61.016 30.920 3.154 1.00 52.43 N ATOM 996 CA ALA A 64 62.261 31.242 3.849 1.00 52.43 C ATOM 997 C ALA A 64 63.489 31.162 2.945 1.00 52.43 C ATOM 998 O ALA A 64 64.524 31.764 3.242 1.00 85.84 O ATOM 999 CB ALA A 64 62.440 30.334 5.059 1.00 85.84 C ATOM 1000 HA ALA A 64 62.177 32.279 4.175 1.00 0.00 H ATOM 1001 HB1 ALA A 64 61.603 30.473 5.743 1.00 0.00 H ATOM 1002 HB2 ALA A 64 62.473 29.295 4.730 1.00 0.00 H ATOM 1003 HB3 ALA A 64 63.371 30.586 5.566 1.00 0.00 H ATOM 1004 H ALA A 64 60.429 30.133 3.497 1.00 0.00 H ATOM 1005 N GLN A 65 63.378 30.412 1.851 1.00 29.89 N ATOM 1006 CA GLN A 65 64.491 30.250 0.919 1.00 29.89 C ATOM 1007 C GLN A 65 64.241 30.899 -0.436 1.00 29.89 C ATOM 1008 O GLN A 65 64.790 30.485 -1.458 1.00 61.10 O ATOM 1009 CB GLN A 65 64.841 28.767 0.747 1.00 61.10 C ATOM 1010 CG GLN A 65 63.718 27.897 0.209 1.00 61.10 C ATOM 1011 CD GLN A 65 64.121 26.441 0.086 1.00 61.10 C ATOM 1012 OE1 GLN A 65 64.521 25.979 -0.983 1.00 61.10 O ATOM 1013 NE2 GLN A 65 64.017 25.709 1.183 1.00 61.10 N ATOM 1014 HA GLN A 65 65.339 30.773 1.361 1.00 0.00 H ATOM 1015 HB2 GLN A 65 65.683 28.696 0.058 1.00 0.00 H ATOM 1016 HB3 GLN A 65 65.136 28.374 1.720 1.00 0.00 H ATOM 1017 HG2 GLN A 65 62.866 27.968 0.885 1.00 0.00 H ATOM 1018 HG3 GLN A 65 63.431 28.265 -0.776 1.00 0.00 H ATOM 1019 HE22 GLN A 65 63.674 26.140 2.065 1.00 0.00 H ATOM 1020 HE21 GLN A 65 64.278 24.702 1.163 1.00 0.00 H ATOM 1021 H GLN A 65 62.478 29.930 1.655 1.00 0.00 H ATOM 1022 N MET A 66 63.456 31.963 -0.417 1.00 47.50 N ATOM 1023 CA MET A 66 63.118 32.701 -1.621 1.00 47.50 C ATOM 1024 C MET A 66 63.720 34.084 -1.427 1.00 47.50 C ATOM 1025 O MET A 66 63.501 34.707 -0.396 1.00 25.94 O ATOM 1026 CB MET A 66 61.598 32.792 -1.702 1.00 25.94 C ATOM 1027 CG MET A 66 61.027 33.137 -3.047 1.00 25.94 C ATOM 1028 SD MET A 66 59.260 32.809 -3.032 1.00 25.94 S ATOM 1029 CE MET A 66 59.285 31.099 -2.472 1.00 25.94 C ATOM 1030 HA MET A 66 63.490 32.235 -2.534 1.00 0.00 H ATOM 1031 HB2 MET A 66 61.190 31.826 -1.405 1.00 0.00 H ATOM 1032 HB3 MET A 66 61.272 33.556 -0.996 1.00 0.00 H ATOM 1033 HG2 MET A 66 61.506 32.529 -3.815 1.00 0.00 H ATOM 1034 HG3 MET A 66 61.202 34.192 -3.259 1.00 0.00 H ATOM 1035 HE1 MET A 66 59.847 30.493 -3.183 1.00 0.00 H ATOM 1036 HE2 MET A 66 59.759 31.046 -1.492 1.00 0.00 H ATOM 1037 HE3 MET A 66 58.263 30.726 -2.403 1.00 0.00 H ATOM 1038 H MET A 66 63.067 32.283 0.493 1.00 0.00 H ATOM 1039 N SER A 67 64.550 34.534 -2.361 1.00 30.73 N ATOM 1040 CA SER A 67 65.153 35.857 -2.219 1.00 30.73 C ATOM 1041 C SER A 67 64.155 36.902 -2.678 1.00 30.73 C ATOM 1042 O SER A 67 63.241 36.594 -3.446 1.00 51.91 O ATOM 1043 CB SER A 67 66.466 35.961 -3.005 1.00 51.91 C ATOM 1044 OG SER A 67 66.398 35.310 -4.265 1.00 51.91 O ATOM 1045 HA SER A 67 65.400 36.028 -1.171 1.00 0.00 H ATOM 1046 HB2 SER A 67 67.263 35.504 -2.418 1.00 0.00 H ATOM 1047 HB3 SER A 67 66.694 37.014 -3.167 1.00 0.00 H ATOM 1048 HG SER A 67 66.199 34.350 -4.129 1.00 0.00 H ATOM 1049 H SER A 67 64.770 33.947 -3.191 1.00 0.00 H ATOM 1050 N VAL A 68 64.309 38.132 -2.204 1.00 24.64 N ATOM 1051 CA VAL A 68 63.376 39.188 -2.588 1.00 24.64 C ATOM 1052 C VAL A 68 63.315 39.417 -4.101 1.00 24.64 C ATOM 1053 O VAL A 68 64.313 39.273 -4.798 1.00 39.77 O ATOM 1054 CB VAL A 68 63.663 40.511 -1.839 1.00 39.77 C ATOM 1055 CG1 VAL A 68 65.060 40.974 -2.107 1.00 39.77 C ATOM 1056 CG2 VAL A 68 62.656 41.579 -2.238 1.00 39.77 C ATOM 1057 HA VAL A 68 62.390 38.834 -2.285 1.00 0.00 H ATOM 1058 HB VAL A 68 63.563 40.330 -0.769 1.00 0.00 H ATOM 1059 HG11 VAL A 68 65.764 40.215 -1.767 1.00 0.00 H ATOM 1060 HG12 VAL A 68 65.188 41.138 -3.177 1.00 0.00 H ATOM 1061 HG13 VAL A 68 65.242 41.906 -1.571 1.00 0.00 H ATOM 1062 HG21 VAL A 68 62.723 41.757 -3.311 1.00 0.00 H ATOM 1063 HG22 VAL A 68 61.651 41.241 -1.987 1.00 0.00 H ATOM 1064 HG23 VAL A 68 62.875 42.502 -1.701 1.00 0.00 H ATOM 1065 H VAL A 68 65.096 38.344 -1.558 1.00 0.00 H ATOM 1066 N GLY A 69 62.125 39.739 -4.599 1.00 44.43 N ATOM 1067 CA GLY A 69 61.936 39.963 -6.020 1.00 44.43 C ATOM 1068 C GLY A 69 61.676 38.658 -6.751 1.00 44.43 C ATOM 1069 O GLY A 69 61.153 38.656 -7.868 1.00 72.32 O ATOM 1070 HA3 GLY A 69 62.833 40.428 -6.429 1.00 0.00 H ATOM 1071 HA2 GLY A 69 61.085 40.628 -6.165 1.00 0.00 H ATOM 1072 H GLY A 69 61.313 39.832 -3.956 1.00 0.00 H ATOM 1073 N GLN A 70 62.000 37.546 -6.098 1.00 32.23 N ATOM 1074 CA GLN A 70 61.826 36.223 -6.679 1.00 32.23 C ATOM 1075 C GLN A 70 60.372 35.755 -6.729 1.00 32.23 C ATOM 1076 O GLN A 70 59.597 35.980 -5.798 1.00 53.01 O ATOM 1077 CB GLN A 70 62.663 35.202 -5.900 1.00 53.01 C ATOM 1078 CG GLN A 70 62.764 33.829 -6.544 1.00 53.01 C ATOM 1079 CD GLN A 70 63.496 32.831 -5.674 1.00 53.01 C ATOM 1080 OE1 GLN A 70 63.006 31.737 -5.426 1.00 53.01 O ATOM 1081 NE2 GLN A 70 64.673 33.206 -5.203 1.00 53.01 N ATOM 1082 HA GLN A 70 62.164 36.298 -7.713 1.00 0.00 H ATOM 1083 HB2 GLN A 70 63.672 35.601 -5.794 1.00 0.00 H ATOM 1084 HB3 GLN A 70 62.216 35.081 -4.913 1.00 0.00 H ATOM 1085 HG2 GLN A 70 61.757 33.456 -6.732 1.00 0.00 H ATOM 1086 HG3 GLN A 70 63.297 33.925 -7.490 1.00 0.00 H ATOM 1087 HE22 GLN A 70 65.052 34.145 -5.439 1.00 0.00 H ATOM 1088 HE21 GLN A 70 65.220 32.562 -4.597 1.00 0.00 H ATOM 1089 H GLN A 70 62.392 37.624 -5.138 1.00 0.00 H ATOM 1090 N ARG A 71 60.013 35.114 -7.835 1.00 27.46 N ATOM 1091 CA ARG A 71 58.678 34.565 -8.021 1.00 27.46 C ATOM 1092 C ARG A 71 58.889 33.066 -8.166 1.00 27.46 C ATOM 1093 O ARG A 71 59.646 32.630 -9.034 1.00 76.30 O ATOM 1094 CB ARG A 71 58.023 35.126 -9.283 1.00 76.30 C ATOM 1095 CG ARG A 71 56.620 34.602 -9.525 1.00 76.30 C ATOM 1096 CD ARG A 71 55.943 35.321 -10.667 1.00 76.30 C ATOM 1097 NE ARG A 71 54.550 34.907 -10.815 1.00 76.30 N ATOM 1098 CZ ARG A 71 53.582 35.681 -11.305 1.00 76.30 C ATOM 1099 NH1 ARG A 71 53.846 36.923 -11.702 1.00 76.30 N ATOM 1100 NH2 ARG A 71 52.339 35.216 -11.389 1.00 76.30 N ATOM 1101 HA ARG A 71 58.020 34.818 -7.190 1.00 0.00 H ATOM 1102 HB2 ARG A 71 57.975 36.211 -9.193 1.00 0.00 H ATOM 1103 HB3 ARG A 71 58.642 34.861 -10.140 1.00 0.00 H ATOM 1104 HG2 ARG A 71 56.676 33.539 -9.760 1.00 0.00 H ATOM 1105 HG3 ARG A 71 56.029 34.742 -8.620 1.00 0.00 H ATOM 1106 HD2 ARG A 71 56.478 35.100 -11.591 1.00 0.00 H ATOM 1107 HD3 ARG A 71 55.975 36.394 -10.478 1.00 0.00 H ATOM 1108 HE ARG A 71 54.296 33.943 -10.518 1.00 0.00 H ATOM 1109 HH12 ARG A 71 53.085 37.520 -12.083 1.00 0.00 H ATOM 1110 HH11 ARG A 71 54.814 37.297 -11.631 1.00 0.00 H ATOM 1111 HH22 ARG A 71 51.583 35.819 -11.771 1.00 0.00 H ATOM 1112 HH21 ARG A 71 52.123 34.249 -11.072 1.00 0.00 H ATOM 1113 H ARG A 71 60.712 35.000 -8.597 1.00 0.00 H ATOM 1114 N ALA A 72 58.254 32.282 -7.302 1.00 58.71 N ATOM 1115 CA ALA A 72 58.403 30.831 -7.341 1.00 58.71 C ATOM 1116 C ALA A 72 57.085 30.075 -7.253 1.00 58.71 C ATOM 1117 O ALA A 72 56.077 30.589 -6.763 1.00 45.61 O ATOM 1118 CB ALA A 72 59.349 30.367 -6.242 1.00 45.61 C ATOM 1119 HA ALA A 72 58.824 30.597 -8.319 1.00 0.00 H ATOM 1120 HB1 ALA A 72 60.325 30.830 -6.386 1.00 0.00 H ATOM 1121 HB2 ALA A 72 58.947 30.658 -5.272 1.00 0.00 H ATOM 1122 HB3 ALA A 72 59.449 29.282 -6.285 1.00 0.00 H ATOM 1123 H ALA A 72 57.638 32.711 -6.583 1.00 0.00 H ATOM 1124 N LYS A 73 57.113 28.846 -7.745 1.00 33.39 N ATOM 1125 CA LYS A 73 55.954 27.971 -7.748 1.00 33.39 C ATOM 1126 C LYS A 73 56.219 26.998 -6.611 1.00 33.39 C ATOM 1127 O LYS A 73 57.238 26.308 -6.614 1.00 76.40 O ATOM 1128 CB LYS A 73 55.902 27.239 -9.091 1.00 76.40 C ATOM 1129 CG LYS A 73 54.603 26.540 -9.437 1.00 76.40 C ATOM 1130 CD LYS A 73 54.664 26.096 -10.899 1.00 76.40 C ATOM 1131 CE LYS A 73 53.429 25.331 -11.357 1.00 76.40 C ATOM 1132 NZ LYS A 73 53.510 25.017 -12.817 1.00 76.40 N ATOM 1133 HA LYS A 73 55.006 28.492 -7.619 1.00 0.00 H ATOM 1134 HB2 LYS A 73 56.102 27.971 -9.874 1.00 0.00 H ATOM 1135 HB3 LYS A 73 56.691 26.487 -9.088 1.00 0.00 H ATOM 1136 HG2 LYS A 73 54.471 25.670 -8.794 1.00 0.00 H ATOM 1137 HG3 LYS A 73 53.767 27.225 -9.295 1.00 0.00 H ATOM 1138 HD2 LYS A 73 54.772 26.982 -11.524 1.00 0.00 H ATOM 1139 HD3 LYS A 73 55.535 25.454 -11.028 1.00 0.00 H ATOM 1140 HE2 LYS A 73 52.543 25.938 -11.170 1.00 0.00 H ATOM 1141 HE3 LYS A 73 53.356 24.400 -10.794 1.00 0.00 H ATOM 1142 HZ1 LYS A 73 53.576 25.903 -13.358 1.00 0.00 H ATOM 1143 HZ2 LYS A 73 54.352 24.435 -12.999 1.00 0.00 H ATOM 1144 HZ3 LYS A 73 52.658 24.496 -13.106 1.00 0.00 H ATOM 1145 H LYS A 73 58.004 28.492 -8.147 1.00 0.00 H ATOM 1146 N LEU A 74 55.358 27.003 -5.603 1.00 40.00 N ATOM 1147 CA LEU A 74 55.534 26.110 -4.470 1.00 40.00 C ATOM 1148 C LEU A 74 54.631 24.895 -4.581 1.00 40.00 C ATOM 1149 O LEU A 74 53.423 25.025 -4.795 1.00 43.36 O ATOM 1150 CB LEU A 74 55.253 26.837 -3.158 1.00 43.36 C ATOM 1151 CG LEU A 74 56.040 28.121 -2.906 1.00 43.36 C ATOM 1152 CD1 LEU A 74 55.813 28.586 -1.480 1.00 43.36 C ATOM 1153 CD2 LEU A 74 57.509 27.880 -3.151 1.00 43.36 C ATOM 1154 HA LEU A 74 56.571 25.775 -4.478 1.00 0.00 H ATOM 1155 HB2 LEU A 74 54.193 27.090 -3.140 1.00 0.00 H ATOM 1156 HB3 LEU A 74 55.475 26.148 -2.343 1.00 0.00 H ATOM 1157 HG LEU A 74 55.695 28.896 -3.590 1.00 0.00 H ATOM 1158 HD21 LEU A 74 57.865 27.101 -2.477 1.00 0.00 H ATOM 1159 HD22 LEU A 74 57.657 27.564 -4.184 1.00 0.00 H ATOM 1160 HD23 LEU A 74 58.062 28.801 -2.969 1.00 0.00 H ATOM 1161 HD11 LEU A 74 54.751 28.776 -1.326 1.00 0.00 H ATOM 1162 HD12 LEU A 74 56.149 27.813 -0.789 1.00 0.00 H ATOM 1163 HD13 LEU A 74 56.376 29.502 -1.304 1.00 0.00 H ATOM 1164 H LEU A 74 54.547 27.654 -5.623 1.00 0.00 H ATOM 1165 N THR A 75 55.221 23.715 -4.450 1.00 32.81 N ATOM 1166 CA THR A 75 54.458 22.483 -4.524 1.00 32.81 C ATOM 1167 C THR A 75 54.507 21.831 -3.135 1.00 32.81 C ATOM 1168 O THR A 75 55.330 20.955 -2.852 1.00 61.67 O ATOM 1169 CB THR A 75 55.038 21.575 -5.614 1.00 61.67 C ATOM 1170 OG1 THR A 75 55.604 22.393 -6.654 1.00 61.67 O ATOM 1171 CG2 THR A 75 53.936 20.707 -6.213 1.00 61.67 C ATOM 1172 HA THR A 75 53.419 22.670 -4.795 1.00 0.00 H ATOM 1173 HB THR A 75 55.804 20.935 -5.177 1.00 0.00 H ATOM 1174 HG1 THR A 75 55.980 21.812 -7.361 1.00 0.00 H ATOM 1175 HG23 THR A 75 53.501 20.084 -5.432 1.00 0.00 H ATOM 1176 HG21 THR A 75 53.164 21.346 -6.641 1.00 0.00 H ATOM 1177 HG22 THR A 75 54.358 20.073 -6.993 1.00 0.00 H ATOM 1178 H THR A 75 56.248 23.672 -4.292 1.00 0.00 H ATOM 1179 N ILE A 76 53.633 22.315 -2.259 1.00 44.18 N ATOM 1180 CA ILE A 76 53.557 21.866 -0.874 1.00 44.18 C ATOM 1181 C ILE A 76 52.851 20.533 -0.689 1.00 44.18 C ATOM 1182 O ILE A 76 51.746 20.332 -1.197 1.00 40.14 O ATOM 1183 CB ILE A 76 52.810 22.900 -0.015 1.00 40.14 C ATOM 1184 CG1 ILE A 76 53.377 24.295 -0.260 1.00 40.14 C ATOM 1185 CG2 ILE A 76 52.908 22.538 1.452 1.00 40.14 C ATOM 1186 CD1 ILE A 76 52.568 25.396 0.375 1.00 40.14 C ATOM 1187 HA ILE A 76 54.595 21.747 -0.562 1.00 0.00 H ATOM 1188 HB ILE A 76 51.758 22.897 -0.300 1.00 0.00 H ATOM 1189 HG12 ILE A 76 54.388 24.332 0.146 1.00 0.00 H ATOM 1190 HG13 ILE A 76 53.412 24.469 -1.335 1.00 0.00 H ATOM 1191 HD11 ILE A 76 51.556 25.380 -0.029 1.00 0.00 H ATOM 1192 HD12 ILE A 76 52.533 25.243 1.454 1.00 0.00 H ATOM 1193 HD13 ILE A 76 53.032 26.358 0.158 1.00 0.00 H ATOM 1194 HG21 ILE A 76 52.464 21.555 1.613 1.00 0.00 H ATOM 1195 HG22 ILE A 76 53.956 22.518 1.751 1.00 0.00 H ATOM 1196 HG23 ILE A 76 52.374 23.281 2.045 1.00 0.00 H ATOM 1197 H ILE A 76 52.970 23.051 -2.577 1.00 0.00 H ATOM 1198 N SER A 77 53.483 19.630 0.053 1.00 80.45 N ATOM 1199 CA SER A 77 52.881 18.330 0.329 1.00 80.45 C ATOM 1200 C SER A 77 51.876 18.501 1.469 1.00 80.45 C ATOM 1201 O SER A 77 52.081 19.330 2.356 1.00 69.85 O ATOM 1202 CB SER A 77 53.957 17.299 0.701 1.00 69.85 C ATOM 1203 OG SER A 77 54.721 17.700 1.829 1.00 69.85 O ATOM 1204 HA SER A 77 52.372 17.960 -0.561 1.00 0.00 H ATOM 1205 HB2 SER A 77 54.627 17.170 -0.149 1.00 0.00 H ATOM 1206 HB3 SER A 77 53.470 16.350 0.926 1.00 0.00 H ATOM 1207 HG SER A 77 55.173 18.558 1.632 1.00 0.00 H ATOM 1208 H SER A 77 54.421 19.853 0.443 1.00 0.00 H ATOM 1209 N PRO A 78 50.787 17.712 1.464 1.00 43.87 N ATOM 1210 CA PRO A 78 49.721 17.745 2.474 1.00 43.87 C ATOM 1211 C PRO A 78 50.197 17.838 3.924 1.00 43.87 C ATOM 1212 O PRO A 78 49.655 18.614 4.704 1.00 61.74 O ATOM 1213 CB PRO A 78 48.977 16.439 2.211 1.00 61.74 C ATOM 1214 CG PRO A 78 49.051 16.330 0.735 1.00 61.74 C ATOM 1215 CD PRO A 78 50.497 16.682 0.449 1.00 61.74 C ATOM 1216 HA PRO A 78 49.115 18.646 2.377 1.00 0.00 H ATOM 1217 HD3 PRO A 78 51.145 15.814 0.573 1.00 0.00 H ATOM 1218 HD2 PRO A 78 50.613 17.080 -0.559 1.00 0.00 H ATOM 1219 HG3 PRO A 78 48.372 17.034 0.254 1.00 0.00 H ATOM 1220 HG2 PRO A 78 48.819 15.318 0.403 1.00 0.00 H ATOM 1221 HB2 PRO A 78 49.472 15.597 2.695 1.00 0.00 H ATOM 1222 HB3 PRO A 78 47.943 16.497 2.552 1.00 0.00 H ATOM 1223 N ASP A 79 51.204 17.050 4.284 1.00 71.74 N ATOM 1224 CA ASP A 79 51.731 17.071 5.645 1.00 71.74 C ATOM 1225 C ASP A 79 52.365 18.414 6.040 1.00 71.74 C ATOM 1226 O ASP A 79 52.567 18.687 7.220 1.00 64.83 O ATOM 1227 CB ASP A 79 52.707 15.904 5.861 1.00 64.83 C ATOM 1228 CG ASP A 79 53.833 15.877 4.842 1.00 64.83 C ATOM 1229 OD1 ASP A 79 53.562 15.943 3.623 1.00 64.83 O ATOM 1230 OD2 ASP A 79 55.001 15.765 5.268 1.00 64.83 O ATOM 1231 HA ASP A 79 50.877 16.947 6.310 1.00 0.00 H ATOM 1232 HB2 ASP A 79 53.141 15.993 6.857 1.00 0.00 H ATOM 1233 HB3 ASP A 79 52.152 14.969 5.791 1.00 0.00 H ATOM 1234 H ASP A 79 51.624 16.407 3.583 1.00 0.00 H ATOM 1235 N TYR A 80 52.675 19.242 5.045 1.00 46.98 N ATOM 1236 CA TYR A 80 53.258 20.566 5.271 1.00 46.98 C ATOM 1237 C TYR A 80 52.171 21.637 5.162 1.00 46.98 C ATOM 1238 O TYR A 80 52.387 22.809 5.493 1.00 88.23 O ATOM 1239 CB TYR A 80 54.363 20.842 4.252 1.00 88.23 C ATOM 1240 CG TYR A 80 55.709 20.253 4.615 1.00 88.23 C ATOM 1241 CD1 TYR A 80 55.906 18.874 4.657 1.00 88.23 C ATOM 1242 CD2 TYR A 80 56.793 21.079 4.913 1.00 88.23 C ATOM 1243 CE1 TYR A 80 57.153 18.331 4.987 1.00 88.23 C ATOM 1244 CE2 TYR A 80 58.043 20.549 5.242 1.00 88.23 C ATOM 1245 CZ TYR A 80 58.216 19.177 5.276 1.00 88.23 C ATOM 1246 OH TYR A 80 59.453 18.655 5.582 1.00 88.23 O ATOM 1247 HA TYR A 80 53.690 20.592 6.271 1.00 0.00 H ATOM 1248 HB3 TYR A 80 54.477 21.922 4.157 1.00 0.00 H ATOM 1249 HB2 TYR A 80 54.055 20.425 3.293 1.00 0.00 H ATOM 1250 HD2 TYR A 80 56.662 22.161 4.889 1.00 0.00 H ATOM 1251 HE2 TYR A 80 58.877 21.213 5.471 1.00 0.00 H ATOM 1252 HE1 TYR A 80 57.289 17.250 5.017 1.00 0.00 H ATOM 1253 HD1 TYR A 80 55.075 18.207 4.429 1.00 0.00 H ATOM 1254 HH TYR A 80 59.406 17.666 5.564 1.00 0.00 H ATOM 1255 H TYR A 80 52.496 18.936 4.067 1.00 0.00 H ATOM 1256 N ALA A 81 51.018 21.222 4.649 1.00 55.62 N ATOM 1257 CA ALA A 81 49.864 22.090 4.482 1.00 55.62 C ATOM 1258 C ALA A 81 48.739 21.613 5.411 1.00 55.62 C ATOM 1259 O ALA A 81 48.900 21.605 6.633 1.00 57.43 O ATOM 1260 CB ALA A 81 49.410 22.082 3.027 1.00 57.43 C ATOM 1261 HA ALA A 81 50.130 23.114 4.745 1.00 0.00 H ATOM 1262 HB1 ALA A 81 50.222 22.438 2.393 1.00 0.00 H ATOM 1263 HB2 ALA A 81 49.140 21.066 2.738 1.00 0.00 H ATOM 1264 HB3 ALA A 81 48.545 22.736 2.914 1.00 0.00 H ATOM 1265 H ALA A 81 50.937 20.228 4.353 1.00 0.00 H ATOM 1266 N TYR A 82 47.618 21.183 4.840 1.00 71.78 N ATOM 1267 CA TYR A 82 46.489 20.718 5.636 1.00 71.78 C ATOM 1268 C TYR A 82 46.267 19.242 5.321 1.00 71.78 C ATOM 1269 O TYR A 82 45.203 18.850 4.839 1.00 56.76 O ATOM 1270 CB TYR A 82 45.225 21.510 5.281 1.00 56.76 C ATOM 1271 CG TYR A 82 45.418 23.001 5.079 1.00 56.76 C ATOM 1272 CD1 TYR A 82 45.929 23.500 3.882 1.00 56.76 C ATOM 1273 CD2 TYR A 82 45.052 23.916 6.065 1.00 56.76 C ATOM 1274 CE1 TYR A 82 46.067 24.873 3.667 1.00 56.76 C ATOM 1275 CE2 TYR A 82 45.186 25.292 5.857 1.00 56.76 C ATOM 1276 CZ TYR A 82 45.693 25.760 4.655 1.00 56.76 C ATOM 1277 OH TYR A 82 45.807 27.110 4.431 1.00 56.76 O ATOM 1278 HA TYR A 82 46.699 20.860 6.696 1.00 0.00 H ATOM 1279 HB3 TYR A 82 44.505 21.371 6.088 1.00 0.00 H ATOM 1280 HB2 TYR A 82 44.819 21.097 4.358 1.00 0.00 H ATOM 1281 HD2 TYR A 82 44.655 23.553 7.013 1.00 0.00 H ATOM 1282 HE2 TYR A 82 44.893 25.994 6.637 1.00 0.00 H ATOM 1283 HE1 TYR A 82 46.468 25.242 2.723 1.00 0.00 H ATOM 1284 HD1 TYR A 82 46.227 22.804 3.098 1.00 0.00 H ATOM 1285 HH TYR A 82 46.185 27.263 3.529 1.00 0.00 H ATOM 1286 H TYR A 82 47.545 21.178 3.803 1.00 0.00 H ATOM 1287 N GLY A 83 47.269 18.423 5.614 1.00101.92 N ATOM 1288 CA GLY A 83 47.172 17.003 5.333 1.00101.92 C ATOM 1289 C GLY A 83 46.009 16.278 5.978 1.00101.92 C ATOM 1290 O GLY A 83 45.201 15.643 5.288 1.00 95.73 O ATOM 1291 HA3 GLY A 83 48.092 16.531 5.677 1.00 0.00 H ATOM 1292 HA2 GLY A 83 47.084 16.881 4.253 1.00 0.00 H ATOM 1293 H GLY A 83 48.133 18.803 6.050 1.00 0.00 H ATOM 1294 N ALA A 84 45.919 16.392 7.298 1.00100.30 N ATOM 1295 CA ALA A 84 44.882 15.726 8.074 1.00100.30 C ATOM 1296 C ALA A 84 43.422 16.085 7.765 1.00100.30 C ATOM 1297 O ALA A 84 42.625 15.211 7.418 1.00 58.92 O ATOM 1298 CB ALA A 84 45.164 15.904 9.563 1.00 58.92 C ATOM 1299 HA ALA A 84 44.952 14.684 7.762 1.00 0.00 H ATOM 1300 HB1 ALA A 84 46.134 15.467 9.803 1.00 0.00 H ATOM 1301 HB2 ALA A 84 45.173 16.967 9.805 1.00 0.00 H ATOM 1302 HB3 ALA A 84 44.386 15.405 10.141 1.00 0.00 H ATOM 1303 H ALA A 84 46.617 16.980 7.797 1.00 0.00 H ATOM 1304 N THR A 85 43.073 17.364 7.850 1.00 88.71 N ATOM 1305 CA THR A 85 41.687 17.771 7.635 1.00 88.71 C ATOM 1306 C THR A 85 41.421 18.645 6.423 1.00 88.71 C ATOM 1307 O THR A 85 40.285 18.726 5.953 1.00 84.33 O ATOM 1308 CB THR A 85 41.164 18.533 8.864 1.00 84.33 C ATOM 1309 OG1 THR A 85 41.638 17.893 10.055 1.00 84.33 O ATOM 1310 CG2 THR A 85 39.642 18.553 8.874 1.00 84.33 C ATOM 1311 HA THR A 85 41.171 16.827 7.459 1.00 0.00 H ATOM 1312 HB THR A 85 41.528 19.560 8.821 1.00 0.00 H ATOM 1313 HG1 THR A 85 41.302 18.382 10.847 1.00 0.00 H ATOM 1314 HG23 THR A 85 39.280 19.040 7.968 1.00 0.00 H ATOM 1315 HG21 THR A 85 39.267 17.530 8.913 1.00 0.00 H ATOM 1316 HG22 THR A 85 39.293 19.103 9.748 1.00 0.00 H ATOM 1317 H THR A 85 43.793 18.081 8.071 1.00 0.00 H ATOM 1318 N GLY A 86 42.456 19.295 5.910 1.00 67.67 N ATOM 1319 CA GLY A 86 42.254 20.181 4.785 1.00 67.67 C ATOM 1320 C GLY A 86 41.663 21.449 5.369 1.00 67.67 C ATOM 1321 O GLY A 86 42.064 21.882 6.450 1.00 54.03 O ATOM 1322 HA3 GLY A 86 41.566 19.735 4.067 1.00 0.00 H ATOM 1323 HA2 GLY A 86 43.203 20.394 4.292 1.00 0.00 H ATOM 1324 H GLY A 86 43.406 19.169 6.313 1.00 0.00 H ATOM 1325 N HIS A 87 40.706 22.043 4.674 1.00 41.68 N ATOM 1326 CA HIS A 87 40.066 23.253 5.160 1.00 41.68 C ATOM 1327 C HIS A 87 38.646 23.280 4.631 1.00 41.68 C ATOM 1328 O HIS A 87 38.419 23.434 3.429 1.00 54.99 O ATOM 1329 CB HIS A 87 40.826 24.496 4.706 1.00 54.99 C ATOM 1330 CG HIS A 87 40.491 25.728 5.488 1.00 54.99 C ATOM 1331 ND1 HIS A 87 41.379 26.315 6.364 1.00 54.99 N ATOM 1332 CD2 HIS A 87 39.368 26.486 5.526 1.00 54.99 C ATOM 1333 CE1 HIS A 87 40.820 27.380 6.907 1.00 54.99 C ATOM 1334 NE2 HIS A 87 39.601 27.507 6.417 1.00 54.99 N ATOM 1335 HA HIS A 87 40.064 23.254 6.250 1.00 0.00 H ATOM 1336 HB2 HIS A 87 41.894 24.303 4.809 1.00 0.00 H ATOM 1337 HB3 HIS A 87 40.591 24.679 3.658 1.00 0.00 H ATOM 1338 HD2 HIS A 87 38.453 26.318 4.958 1.00 0.00 H ATOM 1339 HE1 HIS A 87 41.286 28.042 7.636 1.00 0.00 H ATOM 1340 H HIS A 87 40.407 21.637 3.765 1.00 0.00 H ATOM 1341 N PRO A 88 37.670 23.158 5.539 1.00 79.72 N ATOM 1342 CA PRO A 88 36.227 23.147 5.299 1.00 79.72 C ATOM 1343 C PRO A 88 35.737 24.082 4.204 1.00 79.72 C ATOM 1344 O PRO A 88 35.962 25.294 4.252 1.00 48.63 O ATOM 1345 CB PRO A 88 35.664 23.532 6.662 1.00 48.63 C ATOM 1346 CG PRO A 88 36.590 22.811 7.582 1.00 48.63 C ATOM 1347 CD PRO A 88 37.948 23.141 6.988 1.00 48.63 C ATOM 1348 HA PRO A 88 35.900 22.177 4.924 1.00 0.00 H ATOM 1349 HD3 PRO A 88 38.303 24.112 7.332 1.00 0.00 H ATOM 1350 HD2 PRO A 88 38.684 22.377 7.239 1.00 0.00 H ATOM 1351 HG3 PRO A 88 36.403 21.737 7.571 1.00 0.00 H ATOM 1352 HG2 PRO A 88 36.503 23.183 8.603 1.00 0.00 H ATOM 1353 HB2 PRO A 88 35.705 24.610 6.820 1.00 0.00 H ATOM 1354 HB3 PRO A 88 34.637 23.187 6.780 1.00 0.00 H ATOM 1355 N GLY A 89 35.103 23.488 3.197 1.00 68.44 N ATOM 1356 CA GLY A 89 34.559 24.256 2.096 1.00 68.44 C ATOM 1357 C GLY A 89 35.520 24.644 0.993 1.00 68.44 C ATOM 1358 O GLY A 89 35.095 24.812 -0.153 1.00 48.35 O ATOM 1359 HA3 GLY A 89 34.142 25.175 2.509 1.00 0.00 H ATOM 1360 HA2 GLY A 89 33.760 23.667 1.646 1.00 0.00 H ATOM 1361 H GLY A 89 34.996 22.454 3.200 1.00 0.00 H ATOM 1362 N ILE A 90 36.800 24.807 1.316 1.00 47.80 N ATOM 1363 CA ILE A 90 37.773 25.197 0.303 1.00 47.80 C ATOM 1364 C ILE A 90 38.741 24.085 -0.073 1.00 47.80 C ATOM 1365 O ILE A 90 38.821 23.699 -1.240 1.00 66.91 O ATOM 1366 CB ILE A 90 38.561 26.453 0.720 1.00 66.91 C ATOM 1367 CG1 ILE A 90 37.589 27.539 1.185 1.00 66.91 C ATOM 1368 CG2 ILE A 90 39.360 26.986 -0.463 1.00 66.91 C ATOM 1369 CD1 ILE A 90 38.248 28.821 1.602 1.00 66.91 C ATOM 1370 HA ILE A 90 37.180 25.423 -0.584 1.00 0.00 H ATOM 1371 HB ILE A 90 39.240 26.187 1.530 1.00 0.00 H ATOM 1372 HG12 ILE A 90 36.904 27.758 0.366 1.00 0.00 H ATOM 1373 HG13 ILE A 90 37.026 27.152 2.034 1.00 0.00 H ATOM 1374 HD11 ILE A 90 38.928 28.625 2.431 1.00 0.00 H ATOM 1375 HD12 ILE A 90 38.807 29.231 0.761 1.00 0.00 H ATOM 1376 HD13 ILE A 90 37.486 29.534 1.916 1.00 0.00 H ATOM 1377 HG21 ILE A 90 40.058 26.221 -0.802 1.00 0.00 H ATOM 1378 HG22 ILE A 90 38.678 27.243 -1.274 1.00 0.00 H ATOM 1379 HG23 ILE A 90 39.913 27.874 -0.156 1.00 0.00 H ATOM 1380 H ILE A 90 37.109 24.655 2.298 1.00 0.00 H ATOM 1381 N ILE A 91 39.466 23.558 0.906 1.00 35.38 N ATOM 1382 CA ILE A 91 40.428 22.507 0.612 1.00 35.38 C ATOM 1383 C ILE A 91 40.034 21.146 1.176 1.00 35.38 C ATOM 1384 O ILE A 91 39.613 21.039 2.331 1.00 55.07 O ATOM 1385 CB ILE A 91 41.866 22.882 1.100 1.00 55.07 C ATOM 1386 CG1 ILE A 91 42.396 24.100 0.344 1.00 55.07 C ATOM 1387 CG2 ILE A 91 42.832 21.736 0.870 1.00 55.07 C ATOM 1388 CD1 ILE A 91 42.034 25.403 0.975 1.00 55.07 C ATOM 1389 HA ILE A 91 40.428 22.421 -0.475 1.00 0.00 H ATOM 1390 HB ILE A 91 41.794 23.103 2.165 1.00 0.00 H ATOM 1391 HG12 ILE A 91 43.483 24.030 0.297 1.00 0.00 H ATOM 1392 HG13 ILE A 91 41.988 24.082 -0.667 1.00 0.00 H ATOM 1393 HD11 ILE A 91 40.949 25.495 1.019 1.00 0.00 H ATOM 1394 HD12 ILE A 91 42.444 25.443 1.984 1.00 0.00 H ATOM 1395 HD13 ILE A 91 42.445 26.219 0.381 1.00 0.00 H ATOM 1396 HG21 ILE A 91 42.492 20.859 1.421 1.00 0.00 H ATOM 1397 HG22 ILE A 91 42.872 21.504 -0.194 1.00 0.00 H ATOM 1398 HG23 ILE A 91 43.824 22.023 1.218 1.00 0.00 H ATOM 1399 H ILE A 91 39.346 23.896 1.882 1.00 0.00 H ATOM 1400 N PRO A 92 40.067 20.104 0.326 1.00 36.33 N ATOM 1401 CA PRO A 92 39.731 18.733 0.721 1.00 36.33 C ATOM 1402 C PRO A 92 40.926 18.113 1.457 1.00 36.33 C ATOM 1403 O PRO A 92 42.040 18.635 1.389 1.00 88.07 O ATOM 1404 CB PRO A 92 39.483 18.048 -0.623 1.00 88.07 C ATOM 1405 CG PRO A 92 40.407 18.780 -1.550 1.00 88.07 C ATOM 1406 CD PRO A 92 40.194 20.210 -1.139 1.00 88.07 C ATOM 1407 HA PRO A 92 38.879 18.649 1.395 1.00 0.00 H ATOM 1408 HD3 PRO A 92 41.045 20.831 -1.417 1.00 0.00 H ATOM 1409 HD2 PRO A 92 39.287 20.618 -1.585 1.00 0.00 H ATOM 1410 HG3 PRO A 92 40.130 18.622 -2.592 1.00 0.00 H ATOM 1411 HG2 PRO A 92 41.443 18.475 -1.400 1.00 0.00 H ATOM 1412 HB2 PRO A 92 39.734 16.988 -0.575 1.00 0.00 H ATOM 1413 HB3 PRO A 92 38.445 18.161 -0.935 1.00 0.00 H ATOM 1414 N PRO A 93 40.707 17.020 2.205 1.00 56.94 N ATOM 1415 CA PRO A 93 41.816 16.386 2.930 1.00 56.94 C ATOM 1416 C PRO A 93 42.811 15.694 1.990 1.00 56.94 C ATOM 1417 O PRO A 93 42.434 15.251 0.901 1.00 62.90 O ATOM 1418 CB PRO A 93 41.101 15.366 3.823 1.00 62.90 C ATOM 1419 CG PRO A 93 39.737 15.968 4.016 1.00 62.90 C ATOM 1420 CD PRO A 93 39.418 16.444 2.625 1.00 62.90 C ATOM 1421 HA PRO A 93 42.419 17.107 3.482 1.00 0.00 H ATOM 1422 HD3 PRO A 93 39.123 15.617 1.979 1.00 0.00 H ATOM 1423 HD2 PRO A 93 38.630 17.197 2.633 1.00 0.00 H ATOM 1424 HG3 PRO A 93 39.764 16.796 4.724 1.00 0.00 H ATOM 1425 HG2 PRO A 93 39.018 15.223 4.357 1.00 0.00 H ATOM 1426 HB2 PRO A 93 41.033 14.396 3.331 1.00 0.00 H ATOM 1427 HB3 PRO A 93 41.616 15.253 4.777 1.00 0.00 H ATOM 1428 N HIS A 94 44.071 15.603 2.421 1.00 71.02 N ATOM 1429 CA HIS A 94 45.149 14.955 1.657 1.00 71.02 C ATOM 1430 C HIS A 94 45.536 15.643 0.347 1.00 71.02 C ATOM 1431 O HIS A 94 46.296 15.079 -0.447 1.00112.77 O ATOM 1432 CB HIS A 94 44.795 13.501 1.319 1.00112.77 C ATOM 1433 CG HIS A 94 44.326 12.695 2.486 1.00112.77 C ATOM 1434 ND1 HIS A 94 44.887 12.794 3.742 1.00112.77 N ATOM 1435 CD2 HIS A 94 43.348 11.762 2.583 1.00112.77 C ATOM 1436 CE1 HIS A 94 44.278 11.957 4.560 1.00112.77 C ATOM 1437 NE2 HIS A 94 43.340 11.319 3.883 1.00112.77 N ATOM 1438 HA HIS A 94 46.005 15.024 2.329 1.00 0.00 H ATOM 1439 HB2 HIS A 94 44.005 13.507 0.569 1.00 0.00 H ATOM 1440 HB3 HIS A 94 45.682 13.020 0.906 1.00 0.00 H ATOM 1441 HD2 HIS A 94 42.691 11.426 1.780 1.00 0.00 H ATOM 1442 HE1 HIS A 94 44.510 11.816 5.616 1.00 0.00 H ATOM 1443 H HIS A 94 44.304 16.013 3.348 1.00 0.00 H ATOM 1444 N ALA A 95 45.034 16.850 0.118 1.00 77.71 N ATOM 1445 CA ALA A 95 45.329 17.557 -1.121 1.00 77.71 C ATOM 1446 C ALA A 95 46.673 18.263 -1.131 1.00 77.71 C ATOM 1447 O ALA A 95 47.095 18.853 -0.130 1.00 54.75 O ATOM 1448 CB ALA A 95 44.219 18.541 -1.442 1.00 54.75 C ATOM 1449 HA ALA A 95 45.388 16.790 -1.893 1.00 0.00 H ATOM 1450 HB1 ALA A 95 43.278 18.002 -1.554 1.00 0.00 H ATOM 1451 HB2 ALA A 95 44.130 19.264 -0.631 1.00 0.00 H ATOM 1452 HB3 ALA A 95 44.454 19.061 -2.370 1.00 0.00 H ATOM 1453 H ALA A 95 44.423 17.296 0.831 1.00 0.00 H ATOM 1454 N THR A 96 47.355 18.159 -2.265 1.00 44.63 N ATOM 1455 CA THR A 96 48.642 18.802 -2.460 1.00 44.63 C ATOM 1456 C THR A 96 48.313 20.167 -3.067 1.00 44.63 C ATOM 1457 O THR A 96 47.416 20.271 -3.915 1.00 47.07 O ATOM 1458 CB THR A 96 49.519 17.986 -3.427 1.00 47.07 C ATOM 1459 OG1 THR A 96 49.450 16.596 -3.077 1.00 47.07 O ATOM 1460 CG2 THR A 96 50.958 18.437 -3.344 1.00 47.07 C ATOM 1461 HA THR A 96 49.199 18.886 -1.527 1.00 0.00 H ATOM 1462 HB THR A 96 49.152 18.139 -4.442 1.00 0.00 H ATOM 1463 HG1 THR A 96 50.014 16.072 -3.699 1.00 0.00 H ATOM 1464 HG23 THR A 96 51.022 19.493 -3.608 1.00 0.00 H ATOM 1465 HG21 THR A 96 51.325 18.292 -2.328 1.00 0.00 H ATOM 1466 HG22 THR A 96 51.562 17.850 -4.036 1.00 0.00 H ATOM 1467 H THR A 96 46.953 17.597 -3.042 1.00 0.00 H ATOM 1468 N LEU A 97 49.050 21.197 -2.655 1.00 34.06 N ATOM 1469 CA LEU A 97 48.808 22.563 -3.121 1.00 34.06 C ATOM 1470 C LEU A 97 49.946 23.205 -3.912 1.00 34.06 C ATOM 1471 O LEU A 97 51.129 22.988 -3.625 1.00 36.63 O ATOM 1472 CB LEU A 97 48.476 23.449 -1.921 1.00 36.63 C ATOM 1473 CG LEU A 97 47.437 22.874 -0.956 1.00 36.63 C ATOM 1474 CD1 LEU A 97 47.337 23.719 0.287 1.00 36.63 C ATOM 1475 CD2 LEU A 97 46.098 22.779 -1.641 1.00 36.63 C ATOM 1476 HA LEU A 97 47.978 22.483 -3.823 1.00 0.00 H ATOM 1477 HB2 LEU A 97 49.396 23.621 -1.363 1.00 0.00 H ATOM 1478 HB3 LEU A 97 48.098 24.400 -2.297 1.00 0.00 H ATOM 1479 HG LEU A 97 47.753 21.874 -0.658 1.00 0.00 H ATOM 1480 HD21 LEU A 97 45.783 23.773 -1.959 1.00 0.00 H ATOM 1481 HD22 LEU A 97 46.182 22.127 -2.511 1.00 0.00 H ATOM 1482 HD23 LEU A 97 45.365 22.369 -0.947 1.00 0.00 H ATOM 1483 HD11 LEU A 97 48.306 23.744 0.786 1.00 0.00 H ATOM 1484 HD12 LEU A 97 47.041 24.732 0.013 1.00 0.00 H ATOM 1485 HD13 LEU A 97 46.592 23.290 0.957 1.00 0.00 H ATOM 1486 H LEU A 97 49.822 21.025 -1.980 1.00 0.00 H ATOM 1487 N VAL A 98 49.574 24.024 -4.890 1.00 46.53 N ATOM 1488 CA VAL A 98 50.539 24.727 -5.723 1.00 46.53 C ATOM 1489 C VAL A 98 50.308 26.227 -5.521 1.00 46.53 C ATOM 1490 O VAL A 98 49.213 26.731 -5.782 1.00 68.51 O ATOM 1491 CB VAL A 98 50.364 24.368 -7.220 1.00 68.51 C ATOM 1492 CG1 VAL A 98 51.464 25.002 -8.049 1.00 68.51 C ATOM 1493 CG2 VAL A 98 50.385 22.867 -7.404 1.00 68.51 C ATOM 1494 HA VAL A 98 51.550 24.438 -5.437 1.00 0.00 H ATOM 1495 HB VAL A 98 49.402 24.755 -7.556 1.00 0.00 H ATOM 1496 HG11 VAL A 98 51.423 26.085 -7.937 1.00 0.00 H ATOM 1497 HG12 VAL A 98 52.432 24.636 -7.707 1.00 0.00 H ATOM 1498 HG13 VAL A 98 51.325 24.739 -9.098 1.00 0.00 H ATOM 1499 HG21 VAL A 98 51.338 22.472 -7.051 1.00 0.00 H ATOM 1500 HG22 VAL A 98 49.571 22.421 -6.832 1.00 0.00 H ATOM 1501 HG23 VAL A 98 50.261 22.630 -8.461 1.00 0.00 H ATOM 1502 H VAL A 98 48.559 24.168 -5.066 1.00 0.00 H ATOM 1503 N PHE A 99 51.321 26.923 -5.010 1.00 34.58 N ATOM 1504 CA PHE A 99 51.224 28.358 -4.766 1.00 34.58 C ATOM 1505 C PHE A 99 52.156 29.184 -5.644 1.00 34.58 C ATOM 1506 O PHE A 99 53.352 28.907 -5.725 1.00 35.31 O ATOM 1507 CB PHE A 99 51.522 28.677 -3.298 1.00 35.31 C ATOM 1508 CG PHE A 99 50.362 28.454 -2.377 1.00 35.31 C ATOM 1509 CD1 PHE A 99 49.308 29.359 -2.338 1.00 35.31 C ATOM 1510 CD2 PHE A 99 50.332 27.352 -1.530 1.00 35.31 C ATOM 1511 CE1 PHE A 99 48.240 29.170 -1.465 1.00 35.31 C ATOM 1512 CE2 PHE A 99 49.269 27.156 -0.655 1.00 35.31 C ATOM 1513 CZ PHE A 99 48.223 28.065 -0.622 1.00 35.31 C ATOM 1514 HA PHE A 99 50.200 28.632 -5.018 1.00 0.00 H ATOM 1515 HB2 PHE A 99 52.347 28.044 -2.970 1.00 0.00 H ATOM 1516 HB3 PHE A 99 51.819 29.723 -3.228 1.00 0.00 H ATOM 1517 HD2 PHE A 99 51.151 26.633 -1.552 1.00 0.00 H ATOM 1518 HE2 PHE A 99 49.258 26.288 0.004 1.00 0.00 H ATOM 1519 HZ PHE A 99 47.389 27.914 0.063 1.00 0.00 H ATOM 1520 HE1 PHE A 99 47.419 29.887 -1.443 1.00 0.00 H ATOM 1521 HD1 PHE A 99 49.318 30.226 -2.998 1.00 0.00 H ATOM 1522 H PHE A 99 52.207 26.430 -4.778 1.00 0.00 H ATOM 1523 N ASP A 100 51.593 30.180 -6.317 1.00 29.64 N ATOM 1524 CA ASP A 100 52.366 31.074 -7.166 1.00 29.64 C ATOM 1525 C ASP A 100 52.633 32.272 -6.271 1.00 29.64 C ATOM 1526 O ASP A 100 51.813 33.183 -6.189 1.00 54.57 O ATOM 1527 CB ASP A 100 51.546 31.498 -8.385 1.00 54.57 C ATOM 1528 CG ASP A 100 52.321 32.393 -9.336 1.00 54.57 C ATOM 1529 OD1 ASP A 100 52.748 33.494 -8.923 1.00 54.57 O ATOM 1530 OD2 ASP A 100 52.488 31.997 -10.506 1.00 54.57 O ATOM 1531 HA ASP A 100 53.276 30.613 -7.549 1.00 0.00 H ATOM 1532 HB2 ASP A 100 51.236 30.603 -8.924 1.00 0.00 H ATOM 1533 HB3 ASP A 100 50.664 32.037 -8.041 1.00 0.00 H ATOM 1534 H ASP A 100 50.567 30.326 -6.235 1.00 0.00 H ATOM 1535 N VAL A 101 53.770 32.264 -5.592 1.00 22.57 N ATOM 1536 CA VAL A 101 54.097 33.346 -4.682 1.00 22.57 C ATOM 1537 C VAL A 101 55.241 34.249 -5.145 1.00 22.57 C ATOM 1538 O VAL A 101 56.271 33.773 -5.619 1.00 33.16 O ATOM 1539 CB VAL A 101 54.366 32.784 -3.260 1.00 33.16 C ATOM 1540 CG1 VAL A 101 55.465 31.760 -3.298 1.00 33.16 C ATOM 1541 CG2 VAL A 101 54.710 33.896 -2.290 1.00 33.16 C ATOM 1542 HA VAL A 101 53.222 33.996 -4.664 1.00 0.00 H ATOM 1543 HB VAL A 101 53.453 32.302 -2.910 1.00 0.00 H ATOM 1544 HG11 VAL A 101 55.173 30.940 -3.954 1.00 0.00 H ATOM 1545 HG12 VAL A 101 56.377 32.222 -3.675 1.00 0.00 H ATOM 1546 HG13 VAL A 101 55.639 31.378 -2.292 1.00 0.00 H ATOM 1547 HG21 VAL A 101 55.604 34.414 -2.636 1.00 0.00 H ATOM 1548 HG22 VAL A 101 53.879 34.599 -2.236 1.00 0.00 H ATOM 1549 HG23 VAL A 101 54.893 33.472 -1.303 1.00 0.00 H ATOM 1550 H VAL A 101 54.436 31.474 -5.712 1.00 0.00 H ATOM 1551 N GLU A 102 55.025 35.558 -5.041 1.00 29.95 N ATOM 1552 CA GLU A 102 56.027 36.547 -5.417 1.00 29.95 C ATOM 1553 C GLU A 102 56.445 37.325 -4.176 1.00 29.95 C ATOM 1554 O GLU A 102 55.612 37.965 -3.526 1.00 38.96 O ATOM 1555 CB GLU A 102 55.481 37.514 -6.476 1.00 38.96 C ATOM 1556 CG GLU A 102 56.518 38.535 -6.968 1.00 38.96 C ATOM 1557 CD GLU A 102 56.022 39.463 -8.082 1.00 38.96 C ATOM 1558 OE1 GLU A 102 54.946 39.219 -8.675 1.00 38.96 O ATOM 1559 OE2 GLU A 102 56.738 40.445 -8.370 1.00 38.96 O ATOM 1560 HA GLU A 102 56.886 36.030 -5.845 1.00 0.00 H ATOM 1561 HB2 GLU A 102 55.138 36.931 -7.331 1.00 0.00 H ATOM 1562 HB3 GLU A 102 54.639 38.057 -6.046 1.00 0.00 H ATOM 1563 HG2 GLU A 102 56.817 39.151 -6.120 1.00 0.00 H ATOM 1564 HG3 GLU A 102 57.384 37.988 -7.341 1.00 0.00 H ATOM 1565 H GLU A 102 54.108 35.887 -4.678 1.00 0.00 H ATOM 1566 N LEU A 103 57.726 37.237 -3.827 1.00 30.42 N ATOM 1567 CA LEU A 103 58.257 37.942 -2.667 1.00 30.42 C ATOM 1568 C LEU A 103 58.462 39.397 -3.080 1.00 30.42 C ATOM 1569 O LEU A 103 59.484 39.746 -3.668 1.00 37.17 O ATOM 1570 CB LEU A 103 59.591 37.323 -2.235 1.00 37.17 C ATOM 1571 CG LEU A 103 60.109 37.565 -0.816 1.00 37.17 C ATOM 1572 CD1 LEU A 103 60.133 39.040 -0.482 1.00 37.17 C ATOM 1573 CD2 LEU A 103 59.234 36.834 0.168 1.00 37.17 C ATOM 1574 HA LEU A 103 57.569 37.871 -1.824 1.00 0.00 H ATOM 1575 HB2 LEU A 103 59.495 36.244 -2.358 1.00 0.00 H ATOM 1576 HB3 LEU A 103 60.352 37.699 -2.919 1.00 0.00 H ATOM 1577 HG LEU A 103 61.131 37.190 -0.756 1.00 0.00 H ATOM 1578 HD21 LEU A 103 58.211 37.202 0.086 1.00 0.00 H ATOM 1579 HD22 LEU A 103 59.256 35.766 -0.051 1.00 0.00 H ATOM 1580 HD23 LEU A 103 59.603 37.007 1.179 1.00 0.00 H ATOM 1581 HD11 LEU A 103 60.786 39.559 -1.183 1.00 0.00 H ATOM 1582 HD12 LEU A 103 59.124 39.445 -0.556 1.00 0.00 H ATOM 1583 HD13 LEU A 103 60.506 39.175 0.533 1.00 0.00 H ATOM 1584 H LEU A 103 58.366 36.649 -4.398 1.00 0.00 H ATOM 1585 N LEU A 104 57.487 40.241 -2.775 1.00 41.61 N ATOM 1586 CA LEU A 104 57.583 41.643 -3.137 1.00 41.61 C ATOM 1587 C LEU A 104 58.671 42.399 -2.384 1.00 41.61 C ATOM 1588 O LEU A 104 59.578 42.960 -3.004 1.00 57.99 O ATOM 1589 CB LEU A 104 56.229 42.315 -2.978 1.00 57.99 C ATOM 1590 CG LEU A 104 55.217 41.710 -3.948 1.00 57.99 C ATOM 1591 CD1 LEU A 104 53.864 42.339 -3.742 1.00 57.99 C ATOM 1592 CD2 LEU A 104 55.694 41.914 -5.380 1.00 57.99 C ATOM 1593 HA LEU A 104 57.883 41.677 -4.184 1.00 0.00 H ATOM 1594 HB2 LEU A 104 55.876 42.175 -1.956 1.00 0.00 H ATOM 1595 HB3 LEU A 104 56.330 43.381 -3.183 1.00 0.00 H ATOM 1596 HG LEU A 104 55.129 40.640 -3.758 1.00 0.00 H ATOM 1597 HD21 LEU A 104 55.794 42.981 -5.580 1.00 0.00 H ATOM 1598 HD22 LEU A 104 56.660 41.426 -5.513 1.00 0.00 H ATOM 1599 HD23 LEU A 104 54.969 41.481 -6.068 1.00 0.00 H ATOM 1600 HD11 LEU A 104 53.533 42.159 -2.719 1.00 0.00 H ATOM 1601 HD12 LEU A 104 53.933 43.412 -3.919 1.00 0.00 H ATOM 1602 HD13 LEU A 104 53.151 41.900 -4.439 1.00 0.00 H ATOM 1603 H LEU A 104 56.645 39.895 -2.272 1.00 0.00 H ATOM 1604 N LYS A 105 58.598 42.404 -1.056 1.00 19.79 N ATOM 1605 CA LYS A 105 59.596 43.101 -0.252 1.00 19.79 C ATOM 1606 C LYS A 105 59.567 42.680 1.207 1.00 19.79 C ATOM 1607 O LYS A 105 58.782 41.814 1.597 1.00 68.41 O ATOM 1608 CB LYS A 105 59.436 44.624 -0.360 1.00 68.41 C ATOM 1609 CG LYS A 105 58.293 45.226 0.454 1.00 68.41 C ATOM 1610 CD LYS A 105 58.438 46.743 0.519 1.00 68.41 C ATOM 1611 CE LYS A 105 57.437 47.369 1.479 1.00 68.41 C ATOM 1612 NZ LYS A 105 57.621 48.849 1.608 1.00 68.41 N ATOM 1613 HA LYS A 105 60.566 42.816 -0.659 1.00 0.00 H ATOM 1614 HB2 LYS A 105 60.366 45.084 -0.025 1.00 0.00 H ATOM 1615 HB3 LYS A 105 59.268 44.870 -1.408 1.00 0.00 H ATOM 1616 HG2 LYS A 105 57.343 44.974 -0.017 1.00 0.00 H ATOM 1617 HG3 LYS A 105 58.316 44.818 1.464 1.00 0.00 H ATOM 1618 HD2 LYS A 105 59.447 46.987 0.853 1.00 0.00 H ATOM 1619 HD3 LYS A 105 58.277 47.156 -0.477 1.00 0.00 H ATOM 1620 HE2 LYS A 105 57.561 46.913 2.461 1.00 0.00 H ATOM 1621 HE3 LYS A 105 56.429 47.172 1.113 1.00 0.00 H ATOM 1622 HZ1 LYS A 105 58.577 49.048 1.964 1.00 0.00 H ATOM 1623 HZ2 LYS A 105 57.497 49.295 0.677 1.00 0.00 H ATOM 1624 HZ3 LYS A 105 56.916 49.228 2.272 1.00 0.00 H ATOM 1625 H LYS A 105 57.818 41.904 -0.584 1.00 0.00 H ATOM 1626 N LEU A 106 60.431 43.297 2.005 1.00 35.98 N ATOM 1627 CA LEU A 106 60.525 42.990 3.422 1.00 35.98 C ATOM 1628 C LEU A 106 60.243 44.204 4.294 1.00 35.98 C ATOM 1629 O LEU A 106 60.375 45.355 3.852 1.00 66.86 O ATOM 1630 CB LEU A 106 61.906 42.420 3.760 1.00 66.86 C ATOM 1631 CG LEU A 106 62.234 41.042 3.183 1.00 66.86 C ATOM 1632 CD1 LEU A 106 63.645 40.644 3.564 1.00 66.86 C ATOM 1633 CD2 LEU A 106 61.243 40.019 3.699 1.00 66.86 C ATOM 1634 HA LEU A 106 59.761 42.242 3.635 1.00 0.00 H ATOM 1635 HB2 LEU A 106 62.654 43.121 3.390 1.00 0.00 H ATOM 1636 HB3 LEU A 106 61.980 42.351 4.845 1.00 0.00 H ATOM 1637 HG LEU A 106 62.164 41.084 2.096 1.00 0.00 H ATOM 1638 HD21 LEU A 106 61.299 39.977 4.787 1.00 0.00 H ATOM 1639 HD22 LEU A 106 60.236 40.306 3.397 1.00 0.00 H ATOM 1640 HD23 LEU A 106 61.483 39.040 3.284 1.00 0.00 H ATOM 1641 HD11 LEU A 106 64.348 41.377 3.167 1.00 0.00 H ATOM 1642 HD12 LEU A 106 63.730 40.609 4.650 1.00 0.00 H ATOM 1643 HD13 LEU A 106 63.869 39.661 3.148 1.00 0.00 H ATOM 1644 H LEU A 106 61.059 44.022 1.603 1.00 0.00 H ATOM 1645 N GLU A 107 59.825 43.922 5.523 1.00 51.95 N ATOM 1646 CA GLU A 107 59.504 44.922 6.532 1.00 51.95 C ATOM 1647 C GLU A 107 59.804 44.273 7.888 1.00 51.95 C ATOM 1648 O GLU A 107 59.157 44.644 8.891 1.00 96.97 O ATOM 1649 CB GLU A 107 58.022 45.315 6.467 1.00 96.97 C ATOM 1650 CG GLU A 107 57.647 46.274 5.347 1.00 96.97 C ATOM 1651 CD GLU A 107 56.187 46.705 5.408 1.00 96.97 C ATOM 1652 OE1 GLU A 107 55.678 46.958 6.522 1.00 96.97 O ATOM 1653 OE2 GLU A 107 55.545 46.797 4.341 1.00 96.97 O ATOM 1654 HA GLU A 107 60.088 45.829 6.373 1.00 0.00 H ATOM 1655 OXT GLU A 107 60.663 43.367 7.927 1.00 96.97 O ATOM 1656 HB2 GLU A 107 57.438 44.404 6.339 1.00 0.00 H ATOM 1657 HB3 GLU A 107 57.757 45.785 7.414 1.00 0.00 H ATOM 1658 HG2 GLU A 107 58.276 47.161 5.421 1.00 0.00 H ATOM 1659 HG3 GLU A 107 57.826 45.782 4.391 1.00 0.00 H ATOM 1660 H GLU A 107 59.720 42.920 5.782 1.00 0.00 H TER 1661 GLU A 107 ATOM 1662 N GLY C 201 16.653 29.066 5.274 1.00111.82 N ATOM 1663 CA GLY C 201 17.051 30.469 4.991 1.00111.82 C ATOM 1664 C GLY C 201 18.431 30.470 4.374 1.00111.82 C ATOM 1665 O GLY C 201 18.892 29.428 3.907 1.00 52.96 O ATOM 1666 HA3 GLY C 201 17.064 31.041 5.919 1.00 0.00 H ATOM 1667 HA2 GLY C 201 16.340 30.919 4.299 1.00 0.00 H ATOM 1668 HN3 GLY C 201 17.335 28.640 5.934 1.00 0.00 H ATOM 1669 HN2 GLY C 201 16.643 28.524 4.386 1.00 0.00 H ATOM 1670 HN1 GLY C 201 15.704 29.055 5.699 1.00 0.00 H ATOM 1671 N VAL C 202 19.074 31.631 4.329 1.00 67.21 N ATOM 1672 CA VAL C 202 20.419 31.716 3.780 1.00 67.21 C ATOM 1673 C VAL C 202 21.420 31.863 4.931 1.00 67.21 C ATOM 1674 O VAL C 202 21.326 32.788 5.746 1.00 42.52 O ATOM 1675 CB VAL C 202 20.555 32.865 2.733 1.00 42.52 C ATOM 1676 CG1 VAL C 202 20.296 34.224 3.363 1.00 42.52 C ATOM 1677 CG2 VAL C 202 21.929 32.824 2.074 1.00 42.52 C ATOM 1678 HA VAL C 202 20.637 30.797 3.237 1.00 0.00 H ATOM 1679 HB VAL C 202 19.797 32.711 1.965 1.00 0.00 H ATOM 1680 HG11 VAL C 202 19.286 34.247 3.773 1.00 0.00 H ATOM 1681 HG12 VAL C 202 21.017 34.396 4.162 1.00 0.00 H ATOM 1682 HG13 VAL C 202 20.399 35.000 2.605 1.00 0.00 H ATOM 1683 HG21 VAL C 202 22.700 32.944 2.836 1.00 0.00 H ATOM 1684 HG22 VAL C 202 22.060 31.866 1.570 1.00 0.00 H ATOM 1685 HG23 VAL C 202 22.006 33.632 1.347 1.00 0.00 H ATOM 1686 H VAL C 202 18.611 32.489 4.690 1.00 0.00 H ATOM 1687 N GLN C 203 22.321 30.890 5.026 1.00 29.70 N ATOM 1688 CA GLN C 203 23.345 30.850 6.066 1.00 29.70 C ATOM 1689 C GLN C 203 24.598 31.590 5.628 1.00 29.70 C ATOM 1690 O GLN C 203 24.967 31.550 4.455 1.00 92.56 O ATOM 1691 CB GLN C 203 23.716 29.398 6.370 1.00 92.56 C ATOM 1692 CG GLN C 203 23.983 29.120 7.827 1.00 92.56 C ATOM 1693 CD GLN C 203 22.729 29.260 8.654 1.00 92.56 C ATOM 1694 OE1 GLN C 203 22.338 30.365 9.023 1.00 92.56 O ATOM 1695 NE2 GLN C 203 22.073 28.141 8.927 1.00 92.56 N ATOM 1696 HA GLN C 203 22.939 31.333 6.955 1.00 0.00 H ATOM 1697 HB2 GLN C 203 22.894 28.760 6.045 1.00 0.00 H ATOM 1698 HB3 GLN C 203 24.614 29.149 5.804 1.00 0.00 H ATOM 1699 HG2 GLN C 203 24.364 28.104 7.930 1.00 0.00 H ATOM 1700 HG3 GLN C 203 24.729 29.826 8.192 1.00 0.00 H ATOM 1701 HE22 GLN C 203 22.442 27.227 8.594 1.00 0.00 H ATOM 1702 HE21 GLN C 203 21.189 28.177 9.474 1.00 0.00 H ATOM 1703 H GLN C 203 22.295 30.121 4.326 1.00 0.00 H ATOM 1704 N VAL C 204 25.267 32.233 6.578 1.00 29.15 N ATOM 1705 CA VAL C 204 26.488 32.973 6.289 1.00 29.15 C ATOM 1706 C VAL C 204 27.558 32.648 7.330 1.00 29.15 C ATOM 1707 O VAL C 204 27.525 33.172 8.445 1.00 47.41 O ATOM 1708 CB VAL C 204 26.240 34.508 6.293 1.00 47.41 C ATOM 1709 CG1 VAL C 204 27.459 35.248 5.762 1.00 47.41 C ATOM 1710 CG2 VAL C 204 25.011 34.857 5.472 1.00 47.41 C ATOM 1711 HA VAL C 204 26.823 32.673 5.296 1.00 0.00 H ATOM 1712 HB VAL C 204 26.065 34.821 7.322 1.00 0.00 H ATOM 1713 HG11 VAL C 204 28.320 35.027 6.393 1.00 0.00 H ATOM 1714 HG12 VAL C 204 27.662 34.925 4.741 1.00 0.00 H ATOM 1715 HG13 VAL C 204 27.265 36.320 5.773 1.00 0.00 H ATOM 1716 HG21 VAL C 204 25.157 34.526 4.444 1.00 0.00 H ATOM 1717 HG22 VAL C 204 24.139 34.358 5.895 1.00 0.00 H ATOM 1718 HG23 VAL C 204 24.858 35.936 5.490 1.00 0.00 H ATOM 1719 H VAL C 204 24.910 32.208 7.554 1.00 0.00 H ATOM 1720 N GLU C 205 28.468 31.738 6.996 1.00 58.08 N ATOM 1721 CA GLU C 205 29.555 31.376 7.906 1.00 58.08 C ATOM 1722 C GLU C 205 30.801 32.083 7.392 1.00 58.08 C ATOM 1723 O GLU C 205 31.371 31.684 6.379 1.00 73.05 O ATOM 1724 CB GLU C 205 29.776 29.861 7.913 1.00 73.05 C ATOM 1725 CG GLU C 205 28.636 29.064 8.520 1.00 73.05 C ATOM 1726 CD GLU C 205 28.844 27.567 8.404 1.00 73.05 C ATOM 1727 OE1 GLU C 205 29.980 27.096 8.642 1.00 73.05 O ATOM 1728 OE2 GLU C 205 27.868 26.858 8.070 1.00 73.05 O ATOM 1729 HA GLU C 205 29.320 31.673 8.928 1.00 0.00 H ATOM 1730 HB2 GLU C 205 29.912 29.531 6.883 1.00 0.00 H ATOM 1731 HB3 GLU C 205 30.681 29.651 8.483 1.00 0.00 H ATOM 1732 HG2 GLU C 205 28.551 29.324 9.575 1.00 0.00 H ATOM 1733 HG3 GLU C 205 27.712 29.329 8.006 1.00 0.00 H ATOM 1734 H GLU C 205 28.406 31.273 6.068 1.00 0.00 H ATOM 1735 N THR C 206 31.184 33.172 8.046 1.00 51.29 N ATOM 1736 CA THR C 206 32.356 33.931 7.619 1.00 51.29 C ATOM 1737 C THR C 206 33.642 33.149 7.865 1.00 51.29 C ATOM 1738 O THR C 206 33.770 32.467 8.880 1.00 58.55 O ATOM 1739 CB THR C 206 32.426 35.318 8.329 1.00 58.55 C ATOM 1740 OG1 THR C 206 33.601 36.029 7.912 1.00 58.55 O ATOM 1741 CG2 THR C 206 32.428 35.159 9.844 1.00 58.55 C ATOM 1742 HA THR C 206 32.255 34.100 6.547 1.00 0.00 H ATOM 1743 HB THR C 206 31.541 35.887 8.045 1.00 0.00 H ATOM 1744 HG1 THR C 206 33.634 36.907 8.369 1.00 0.00 H ATOM 1745 HG23 THR C 206 31.533 34.618 10.153 1.00 0.00 H ATOM 1746 HG21 THR C 206 33.314 34.601 10.148 1.00 0.00 H ATOM 1747 HG22 THR C 206 32.438 36.144 10.311 1.00 0.00 H ATOM 1748 H THR C 206 30.642 33.490 8.875 1.00 0.00 H ATOM 1749 N ILE C 207 34.568 33.213 6.912 1.00 58.21 N ATOM 1750 CA ILE C 207 35.848 32.522 7.040 1.00 58.21 C ATOM 1751 C ILE C 207 37.008 33.490 6.875 1.00 58.21 C ATOM 1752 O ILE C 207 38.083 33.277 7.429 1.00 73.03 O ATOM 1753 CB ILE C 207 35.992 31.355 6.037 1.00 73.03 C ATOM 1754 CG1 ILE C 207 35.508 31.774 4.651 1.00 73.03 C ATOM 1755 CG2 ILE C 207 35.249 30.121 6.551 1.00 73.03 C ATOM 1756 CD1 ILE C 207 35.499 30.647 3.661 1.00 73.03 C ATOM 1757 HA ILE C 207 35.872 32.100 8.045 1.00 0.00 H ATOM 1758 HB ILE C 207 37.046 31.093 5.946 1.00 0.00 H ATOM 1759 HG12 ILE C 207 34.494 32.164 4.741 1.00 0.00 H ATOM 1760 HG13 ILE C 207 36.166 32.559 4.277 1.00 0.00 H ATOM 1761 HD11 ILE C 207 36.509 30.253 3.552 1.00 0.00 H ATOM 1762 HD12 ILE C 207 34.836 29.858 4.017 1.00 0.00 H ATOM 1763 HD13 ILE C 207 35.145 31.014 2.698 1.00 0.00 H ATOM 1764 HG21 ILE C 207 35.668 29.820 7.511 1.00 0.00 H ATOM 1765 HG22 ILE C 207 34.192 30.359 6.672 1.00 0.00 H ATOM 1766 HG23 ILE C 207 35.359 29.307 5.834 1.00 0.00 H ATOM 1767 H ILE C 207 34.375 33.769 6.054 1.00 0.00 H ATOM 1768 N SER C 208 36.777 34.551 6.110 1.00 29.79 N ATOM 1769 CA SER C 208 37.772 35.589 5.877 1.00 29.79 C ATOM 1770 C SER C 208 37.058 36.921 6.091 1.00 29.79 C ATOM 1771 O SER C 208 35.925 37.110 5.638 1.00 85.20 O ATOM 1772 CB SER C 208 38.329 35.496 4.461 1.00 85.20 C ATOM 1773 OG SER C 208 38.978 34.253 4.266 1.00 85.20 O ATOM 1774 HA SER C 208 38.619 35.482 6.555 1.00 0.00 H ATOM 1775 HB2 SER C 208 39.044 36.303 4.302 1.00 0.00 H ATOM 1776 HB3 SER C 208 37.511 35.591 3.746 1.00 0.00 H ATOM 1777 HG SER C 208 39.333 34.209 3.343 1.00 0.00 H ATOM 1778 H SER C 208 35.845 34.645 5.658 1.00 0.00 H ATOM 1779 N PRO C 209 37.694 37.846 6.823 1.00 46.94 N ATOM 1780 CA PRO C 209 37.153 39.169 7.135 1.00 46.94 C ATOM 1781 C PRO C 209 37.244 40.222 6.043 1.00 46.94 C ATOM 1782 O PRO C 209 38.180 40.235 5.243 1.00 90.24 O ATOM 1783 CB PRO C 209 37.985 39.580 8.341 1.00 90.24 C ATOM 1784 CG PRO C 209 39.331 39.039 7.981 1.00 90.24 C ATOM 1785 CD PRO C 209 39.000 37.651 7.481 1.00 90.24 C ATOM 1786 HA PRO C 209 36.076 39.104 7.289 1.00 0.00 H ATOM 1787 HD3 PRO C 209 39.749 37.299 6.772 1.00 0.00 H ATOM 1788 HD2 PRO C 209 38.923 36.944 8.307 1.00 0.00 H ATOM 1789 HG3 PRO C 209 39.986 38.999 8.851 1.00 0.00 H ATOM 1790 HG2 PRO C 209 39.801 39.638 7.201 1.00 0.00 H ATOM 1791 HB2 PRO C 209 38.010 40.664 8.456 1.00 0.00 H ATOM 1792 HB3 PRO C 209 37.607 39.127 9.258 1.00 0.00 H ATOM 1793 N GLY C 210 36.241 41.091 6.020 1.00 26.15 N ATOM 1794 CA GLY C 210 36.203 42.188 5.075 1.00 26.15 C ATOM 1795 C GLY C 210 36.440 43.411 5.930 1.00 26.15 C ATOM 1796 O GLY C 210 37.102 43.299 6.962 1.00 75.18 O ATOM 1797 HA3 GLY C 210 35.233 42.242 4.581 1.00 0.00 H ATOM 1798 HA2 GLY C 210 36.986 42.081 4.324 1.00 0.00 H ATOM 1799 H GLY C 210 35.461 40.981 6.699 1.00 0.00 H ATOM 1800 N ASP C 211 35.903 44.566 5.549 1.00 26.69 N ATOM 1801 CA ASP C 211 36.093 45.757 6.372 1.00 26.69 C ATOM 1802 C ASP C 211 35.085 45.859 7.524 1.00 26.69 C ATOM 1803 O ASP C 211 35.269 46.642 8.460 1.00 46.79 O ATOM 1804 CB ASP C 211 36.160 47.047 5.528 1.00 46.79 C ATOM 1805 CG ASP C 211 34.824 47.457 4.913 1.00 46.79 C ATOM 1806 OD1 ASP C 211 33.809 46.742 5.053 1.00 46.79 O ATOM 1807 OD2 ASP C 211 34.806 48.531 4.275 1.00 46.79 O ATOM 1808 HA ASP C 211 37.069 45.643 6.844 1.00 0.00 H ATOM 1809 HB2 ASP C 211 36.506 47.858 6.168 1.00 0.00 H ATOM 1810 HB3 ASP C 211 36.876 46.892 4.721 1.00 0.00 H ATOM 1811 H ASP C 211 35.351 44.621 4.670 1.00 0.00 H ATOM 1812 N GLY C 212 34.036 45.043 7.462 1.00 56.09 N ATOM 1813 CA GLY C 212 33.023 45.043 8.505 1.00 56.09 C ATOM 1814 C GLY C 212 32.198 46.312 8.634 1.00 56.09 C ATOM 1815 O GLY C 212 31.501 46.496 9.630 1.00 52.46 O ATOM 1816 HA3 GLY C 212 33.525 44.873 9.458 1.00 0.00 H ATOM 1817 HA2 GLY C 212 32.338 44.219 8.305 1.00 0.00 H ATOM 1818 H GLY C 212 33.939 44.395 6.655 1.00 0.00 H ATOM 1819 N ARG C 213 32.276 47.187 7.637 1.00 47.97 N ATOM 1820 CA ARG C 213 31.522 48.435 7.660 1.00 47.97 C ATOM 1821 C ARG C 213 30.763 48.630 6.357 1.00 47.97 C ATOM 1822 O ARG C 213 29.550 48.834 6.355 1.00103.23 O ATOM 1823 CB ARG C 213 32.451 49.636 7.842 1.00103.23 C ATOM 1824 CG ARG C 213 33.454 49.539 8.973 1.00103.23 C ATOM 1825 CD ARG C 213 34.219 50.850 9.108 1.00103.23 C ATOM 1826 NE ARG C 213 34.667 51.369 7.811 1.00103.23 N ATOM 1827 CZ ARG C 213 35.788 51.002 7.194 1.00103.23 C ATOM 1828 NH1 ARG C 213 36.601 50.108 7.748 1.00103.23 N ATOM 1829 NH2 ARG C 213 36.086 51.514 6.009 1.00103.23 N ATOM 1830 HA ARG C 213 30.827 48.371 8.497 1.00 0.00 H ATOM 1831 HB2 ARG C 213 33.007 49.770 6.914 1.00 0.00 H ATOM 1832 HB3 ARG C 213 31.830 50.513 8.022 1.00 0.00 H ATOM 1833 HG2 ARG C 213 32.928 49.330 9.905 1.00 0.00 H ATOM 1834 HG3 ARG C 213 34.156 48.731 8.765 1.00 0.00 H ATOM 1835 HD2 ARG C 213 35.092 50.684 9.740 1.00 0.00 H ATOM 1836 HD3 ARG C 213 33.569 51.589 9.576 1.00 0.00 H ATOM 1837 HE ARG C 213 34.065 52.074 7.340 1.00 0.00 H ATOM 1838 HH12 ARG C 213 37.475 49.827 7.259 1.00 0.00 H ATOM 1839 HH11 ARG C 213 36.363 49.690 8.670 1.00 0.00 H ATOM 1840 HH22 ARG C 213 36.961 51.229 5.525 1.00 0.00 H ATOM 1841 HH21 ARG C 213 35.445 52.201 5.563 1.00 0.00 H ATOM 1842 H ARG C 213 32.888 46.977 6.823 1.00 0.00 H ATOM 1843 N THR C 214 31.493 48.596 5.250 1.00 37.50 N ATOM 1844 CA THR C 214 30.894 48.797 3.942 1.00 37.50 C ATOM 1845 C THR C 214 30.117 47.601 3.408 1.00 37.50 C ATOM 1846 O THR C 214 30.704 46.646 2.896 1.00 39.41 O ATOM 1847 CB THR C 214 31.952 49.219 2.916 1.00 39.41 C ATOM 1848 OG1 THR C 214 32.741 50.290 3.456 1.00 39.41 O ATOM 1849 CG2 THR C 214 31.287 49.692 1.637 1.00 39.41 C ATOM 1850 HA THR C 214 30.166 49.594 4.089 1.00 0.00 H ATOM 1851 HB THR C 214 32.587 48.361 2.694 1.00 0.00 H ATOM 1852 HG1 THR C 214 33.188 49.984 4.285 1.00 0.00 H ATOM 1853 HG23 THR C 214 30.686 48.883 1.221 1.00 0.00 H ATOM 1854 HG21 THR C 214 30.647 50.547 1.856 1.00 0.00 H ATOM 1855 HG22 THR C 214 32.052 49.985 0.918 1.00 0.00 H ATOM 1856 H THR C 214 32.516 48.422 5.320 1.00 0.00 H ATOM 1857 N PHE C 215 28.798 47.639 3.581 1.00 35.18 N ATOM 1858 CA PHE C 215 27.914 46.584 3.090 1.00 35.18 C ATOM 1859 C PHE C 215 27.283 47.162 1.832 1.00 35.18 C ATOM 1860 O PHE C 215 26.919 48.339 1.809 1.00 68.39 O ATOM 1861 CB PHE C 215 26.819 46.269 4.111 1.00 68.39 C ATOM 1862 CG PHE C 215 27.341 45.892 5.467 1.00 68.39 C ATOM 1863 CD1 PHE C 215 27.754 44.593 5.731 1.00 68.39 C ATOM 1864 CD2 PHE C 215 27.410 46.834 6.485 1.00 68.39 C ATOM 1865 CE1 PHE C 215 28.230 44.237 6.995 1.00 68.39 C ATOM 1866 CE2 PHE C 215 27.884 46.488 7.752 1.00 68.39 C ATOM 1867 CZ PHE C 215 28.294 45.187 8.005 1.00 68.39 C ATOM 1868 HA PHE C 215 28.458 45.657 2.907 1.00 0.00 H ATOM 1869 HB2 PHE C 215 26.187 47.150 4.219 1.00 0.00 H ATOM 1870 HB3 PHE C 215 26.223 45.440 3.730 1.00 0.00 H ATOM 1871 HD2 PHE C 215 27.090 47.858 6.292 1.00 0.00 H ATOM 1872 HE2 PHE C 215 27.932 47.239 8.541 1.00 0.00 H ATOM 1873 HZ PHE C 215 28.665 44.912 8.992 1.00 0.00 H ATOM 1874 HE1 PHE C 215 28.551 43.213 7.188 1.00 0.00 H ATOM 1875 HD1 PHE C 215 27.706 43.842 4.942 1.00 0.00 H ATOM 1876 H PHE C 215 28.381 48.449 4.084 1.00 0.00 H ATOM 1877 N PRO C 216 27.150 46.351 0.770 1.00 59.31 N ATOM 1878 CA PRO C 216 26.558 46.822 -0.487 1.00 59.31 C ATOM 1879 C PRO C 216 25.183 47.471 -0.329 1.00 59.31 C ATOM 1880 O PRO C 216 24.245 46.857 0.191 1.00 39.86 O ATOM 1881 CB PRO C 216 26.512 45.550 -1.343 1.00 39.86 C ATOM 1882 CG PRO C 216 26.438 44.444 -0.329 1.00 39.86 C ATOM 1883 CD PRO C 216 27.430 44.906 0.703 1.00 39.86 C ATOM 1884 HA PRO C 216 27.142 47.627 -0.933 1.00 0.00 H ATOM 1885 HD3 PRO C 216 27.256 44.423 1.665 1.00 0.00 H ATOM 1886 HD2 PRO C 216 28.454 44.715 0.382 1.00 0.00 H ATOM 1887 HG3 PRO C 216 26.732 43.488 -0.762 1.00 0.00 H ATOM 1888 HG2 PRO C 216 25.437 44.358 0.093 1.00 0.00 H ATOM 1889 HB2 PRO C 216 25.633 45.546 -1.988 1.00 0.00 H ATOM 1890 HB3 PRO C 216 27.410 45.459 -1.954 1.00 0.00 H ATOM 1891 N LYS C 217 25.084 48.727 -0.759 1.00 86.79 N ATOM 1892 CA LYS C 217 23.829 49.468 -0.677 1.00 86.79 C ATOM 1893 C LYS C 217 22.986 49.039 -1.874 1.00 86.79 C ATOM 1894 O LYS C 217 23.522 48.746 -2.947 1.00117.68 O ATOM 1895 CB LYS C 217 24.064 50.987 -0.746 1.00117.68 C ATOM 1896 CG LYS C 217 25.408 51.499 -0.213 1.00117.68 C ATOM 1897 CD LYS C 217 25.653 51.162 1.257 1.00117.68 C ATOM 1898 CE LYS C 217 26.977 51.754 1.760 1.00117.68 C ATOM 1899 NZ LYS C 217 28.162 51.359 0.937 1.00117.68 N ATOM 1900 HA LYS C 217 23.336 49.255 0.272 1.00 0.00 H ATOM 1901 HB2 LYS C 217 23.987 51.287 -1.791 1.00 0.00 H ATOM 1902 HB3 LYS C 217 23.274 51.471 -0.171 1.00 0.00 H ATOM 1903 HG2 LYS C 217 26.206 51.053 -0.806 1.00 0.00 H ATOM 1904 HG3 LYS C 217 25.434 52.583 -0.327 1.00 0.00 H ATOM 1905 HD2 LYS C 217 24.835 51.566 1.854 1.00 0.00 H ATOM 1906 HD3 LYS C 217 25.684 50.078 1.371 1.00 0.00 H ATOM 1907 HE2 LYS C 217 27.139 51.415 2.783 1.00 0.00 H ATOM 1908 HE3 LYS C 217 26.895 52.841 1.747 1.00 0.00 H ATOM 1909 HZ1 LYS C 217 28.261 50.324 0.948 1.00 0.00 H ATOM 1910 HZ2 LYS C 217 28.027 51.685 -0.041 1.00 0.00 H ATOM 1911 HZ3 LYS C 217 29.019 51.794 1.334 1.00 0.00 H ATOM 1912 H LYS C 217 25.922 49.192 -1.163 1.00 0.00 H ATOM 1913 N ARG C 218 21.672 48.996 -1.687 1.00 80.63 N ATOM 1914 CA ARG C 218 20.744 48.604 -2.746 1.00 80.63 C ATOM 1915 C ARG C 218 20.932 49.456 -4.003 1.00 80.63 C ATOM 1916 O ARG C 218 20.582 50.637 -4.015 1.00200.12 O ATOM 1917 CB ARG C 218 19.304 48.750 -2.244 1.00200.12 C ATOM 1918 CG ARG C 218 18.236 48.504 -3.297 1.00200.12 C ATOM 1919 CD ARG C 218 16.895 49.064 -2.842 1.00200.12 C ATOM 1920 NE ARG C 218 15.841 48.855 -3.835 1.00200.12 N ATOM 1921 CZ ARG C 218 14.555 49.139 -3.638 1.00200.12 C ATOM 1922 NH1 ARG C 218 14.154 49.651 -2.481 1.00200.12 N ATOM 1923 NH2 ARG C 218 13.666 48.891 -4.592 1.00200.12 N ATOM 1924 HA ARG C 218 20.950 47.566 -3.006 1.00 0.00 H ATOM 1925 HB2 ARG C 218 19.153 48.037 -1.434 1.00 0.00 H ATOM 1926 HB3 ARG C 218 19.178 49.763 -1.863 1.00 0.00 H ATOM 1927 HG2 ARG C 218 18.531 48.990 -4.227 1.00 0.00 H ATOM 1928 HG3 ARG C 218 18.138 47.431 -3.465 1.00 0.00 H ATOM 1929 HD2 ARG C 218 17.003 50.134 -2.665 1.00 0.00 H ATOM 1930 HD3 ARG C 218 16.606 48.571 -1.914 1.00 0.00 H ATOM 1931 HE ARG C 218 16.114 48.458 -4.757 1.00 0.00 H ATOM 1932 HH12 ARG C 218 13.149 49.872 -2.330 1.00 0.00 H ATOM 1933 HH11 ARG C 218 14.845 49.832 -1.725 1.00 0.00 H ATOM 1934 HH22 ARG C 218 12.662 49.113 -4.437 1.00 0.00 H ATOM 1935 HH21 ARG C 218 13.974 48.475 -5.494 1.00 0.00 H ATOM 1936 H ARG C 218 21.290 49.250 -0.754 1.00 0.00 H ATOM 1937 N GLY C 219 21.501 48.859 -5.045 1.00 95.74 N ATOM 1938 CA GLY C 219 21.717 49.585 -6.286 1.00 95.74 C ATOM 1939 C GLY C 219 23.157 49.586 -6.767 1.00 95.74 C ATOM 1940 O GLY C 219 23.464 50.133 -7.832 1.00 51.84 O ATOM 1941 HA3 GLY C 219 21.406 50.619 -6.135 1.00 0.00 H ATOM 1942 HA2 GLY C 219 21.099 49.130 -7.060 1.00 0.00 H ATOM 1943 H GLY C 219 21.794 47.864 -4.972 1.00 0.00 H ATOM 1944 N GLN C 220 24.046 49.007 -5.964 1.00 71.45 N ATOM 1945 CA GLN C 220 25.461 48.923 -6.307 1.00 71.45 C ATOM 1946 C GLN C 220 25.805 47.661 -7.094 1.00 71.45 C ATOM 1947 O GLN C 220 25.067 46.669 -7.064 1.00 61.35 O ATOM 1948 CB GLN C 220 26.323 48.964 -5.046 1.00 61.35 C ATOM 1949 CG GLN C 220 26.601 50.346 -4.500 1.00 61.35 C ATOM 1950 CD GLN C 220 27.628 50.318 -3.390 1.00 61.35 C ATOM 1951 OE1 GLN C 220 27.398 49.724 -2.338 1.00 61.35 O ATOM 1952 NE2 GLN C 220 28.778 50.936 -3.628 1.00 61.35 N ATOM 1953 HA GLN C 220 25.671 49.785 -6.940 1.00 0.00 H ATOM 1954 HB2 GLN C 220 25.814 48.391 -4.271 1.00 0.00 H ATOM 1955 HB3 GLN C 220 27.279 48.493 -5.275 1.00 0.00 H ATOM 1956 HG2 GLN C 220 26.972 50.976 -5.308 1.00 0.00 H ATOM 1957 HG3 GLN C 220 25.673 50.765 -4.111 1.00 0.00 H ATOM 1958 HE22 GLN C 220 28.928 51.426 -4.533 1.00 0.00 H ATOM 1959 HE21 GLN C 220 29.530 50.931 -2.909 1.00 0.00 H ATOM 1960 H GLN C 220 23.721 48.601 -5.063 1.00 0.00 H ATOM 1961 N THR C 221 26.947 47.699 -7.770 1.00 54.63 N ATOM 1962 CA THR C 221 27.422 46.573 -8.559 1.00 54.63 C ATOM 1963 C THR C 221 28.402 45.782 -7.696 1.00 54.63 C ATOM 1964 O THR C 221 29.313 46.358 -7.096 1.00 56.05 O ATOM 1965 CB THR C 221 28.154 47.060 -9.820 1.00 56.05 C ATOM 1966 OG1 THR C 221 27.487 48.215 -10.347 1.00 56.05 O ATOM 1967 CG2 THR C 221 28.166 45.971 -10.875 1.00 56.05 C ATOM 1968 HA THR C 221 26.575 45.960 -8.867 1.00 0.00 H ATOM 1969 HB THR C 221 29.180 47.312 -9.553 1.00 0.00 H ATOM 1970 HG1 THR C 221 27.488 48.934 -9.667 1.00 0.00 H ATOM 1971 HG23 THR C 221 28.672 45.090 -10.480 1.00 0.00 H ATOM 1972 HG21 THR C 221 27.141 45.714 -11.142 1.00 0.00 H ATOM 1973 HG22 THR C 221 28.694 46.329 -11.759 1.00 0.00 H ATOM 1974 H THR C 221 27.522 48.565 -7.734 1.00 0.00 H ATOM 1975 N CYS C 222 28.198 44.474 -7.605 1.00 47.80 N ATOM 1976 CA CYS C 222 29.083 43.635 -6.814 1.00 47.80 C ATOM 1977 C CYS C 222 29.980 42.795 -7.703 1.00 47.80 C ATOM 1978 O CYS C 222 29.513 42.177 -8.660 1.00 48.36 O ATOM 1979 CB CYS C 222 28.272 42.725 -5.902 1.00 48.36 C ATOM 1980 SG CYS C 222 27.239 43.622 -4.757 1.00 48.36 S ATOM 1981 HA CYS C 222 29.710 44.290 -6.209 1.00 0.00 H ATOM 1982 HB2 CYS C 222 28.961 42.101 -5.333 1.00 0.00 H ATOM 1983 HB3 CYS C 222 27.636 42.091 -6.520 1.00 0.00 H ATOM 1984 HG CYS C 222 26.541 42.727 -3.971 1.00 0.00 H ATOM 1985 H CYS C 222 27.395 44.044 -8.106 1.00 0.00 H ATOM 1986 N VAL C 223 31.275 42.820 -7.415 1.00 27.29 N ATOM 1987 CA VAL C 223 32.243 42.037 -8.169 1.00 27.29 C ATOM 1988 C VAL C 223 32.675 40.927 -7.219 1.00 27.29 C ATOM 1989 O VAL C 223 33.405 41.174 -6.253 1.00 27.64 O ATOM 1990 CB VAL C 223 33.475 42.874 -8.568 1.00 27.64 C ATOM 1991 CG1 VAL C 223 34.281 42.139 -9.621 1.00 27.64 C ATOM 1992 CG2 VAL C 223 33.052 44.245 -9.076 1.00 27.64 C ATOM 1993 HA VAL C 223 31.805 41.667 -9.096 1.00 0.00 H ATOM 1994 HB VAL C 223 34.100 43.019 -7.687 1.00 0.00 H ATOM 1995 HG11 VAL C 223 34.612 41.181 -9.220 1.00 0.00 H ATOM 1996 HG12 VAL C 223 33.660 41.971 -10.501 1.00 0.00 H ATOM 1997 HG13 VAL C 223 35.149 42.738 -9.896 1.00 0.00 H ATOM 1998 HG21 VAL C 223 32.409 44.125 -9.948 1.00 0.00 H ATOM 1999 HG22 VAL C 223 32.508 44.770 -8.291 1.00 0.00 H ATOM 2000 HG23 VAL C 223 33.937 44.818 -9.352 1.00 0.00 H ATOM 2001 H VAL C 223 31.607 43.415 -6.629 1.00 0.00 H ATOM 2002 N VAL C 224 32.202 39.711 -7.473 1.00 13.95 N ATOM 2003 CA VAL C 224 32.522 38.585 -6.611 1.00 13.95 C ATOM 2004 C VAL C 224 33.200 37.436 -7.325 1.00 13.95 C ATOM 2005 O VAL C 224 33.184 37.342 -8.553 1.00 15.94 O ATOM 2006 CB VAL C 224 31.256 38.016 -5.945 1.00 15.94 C ATOM 2007 CG1 VAL C 224 30.571 39.067 -5.109 1.00 15.94 C ATOM 2008 CG2 VAL C 224 30.313 37.486 -6.996 1.00 15.94 C ATOM 2009 HA VAL C 224 33.213 38.997 -5.876 1.00 0.00 H ATOM 2010 HB VAL C 224 31.550 37.198 -5.288 1.00 0.00 H ATOM 2011 HG11 VAL C 224 31.253 39.412 -4.331 1.00 0.00 H ATOM 2012 HG12 VAL C 224 30.287 39.906 -5.744 1.00 0.00 H ATOM 2013 HG13 VAL C 224 29.680 38.640 -4.649 1.00 0.00 H ATOM 2014 HG21 VAL C 224 30.031 38.295 -7.670 1.00 0.00 H ATOM 2015 HG22 VAL C 224 30.808 36.696 -7.561 1.00 0.00 H ATOM 2016 HG23 VAL C 224 29.421 37.086 -6.514 1.00 0.00 H ATOM 2017 H VAL C 224 31.593 39.563 -8.303 1.00 0.00 H ATOM 2018 N HIS C 225 33.816 36.572 -6.532 1.00 31.95 N ATOM 2019 CA HIS C 225 34.479 35.371 -7.018 1.00 31.95 C ATOM 2020 C HIS C 225 33.804 34.307 -6.176 1.00 31.95 C ATOM 2021 O HIS C 225 33.752 34.430 -4.953 1.00 47.11 O ATOM 2022 CB HIS C 225 35.977 35.410 -6.708 1.00 47.11 C ATOM 2023 CG HIS C 225 36.852 35.505 -7.920 1.00 47.11 C ATOM 2024 ND1 HIS C 225 36.350 35.632 -9.198 1.00 47.11 N ATOM 2025 CD2 HIS C 225 38.199 35.494 -8.047 1.00 47.11 C ATOM 2026 CE1 HIS C 225 37.350 35.699 -10.060 1.00 47.11 C ATOM 2027 NE2 HIS C 225 38.483 35.617 -9.387 1.00 47.11 N ATOM 2028 HA HIS C 225 34.402 35.224 -8.095 1.00 0.00 H ATOM 2029 HB2 HIS C 225 36.173 36.276 -6.076 1.00 0.00 H ATOM 2030 HB3 HIS C 225 36.238 34.500 -6.168 1.00 0.00 H ATOM 2031 HD2 HIS C 225 38.924 35.404 -7.238 1.00 0.00 H ATOM 2032 HE1 HIS C 225 37.255 35.804 -11.141 1.00 0.00 H ATOM 2033 H HIS C 225 33.826 36.762 -5.509 1.00 0.00 H ATOM 2034 N TYR C 226 33.245 33.293 -6.816 1.00 24.36 N ATOM 2035 CA TYR C 226 32.554 32.253 -6.074 1.00 24.36 C ATOM 2036 C TYR C 226 32.850 30.858 -6.572 1.00 24.36 C ATOM 2037 O TYR C 226 33.436 30.668 -7.637 1.00 36.27 O ATOM 2038 CB TYR C 226 31.049 32.476 -6.156 1.00 36.27 C ATOM 2039 CG TYR C 226 30.487 32.248 -7.542 1.00 36.27 C ATOM 2040 CD1 TYR C 226 30.141 30.968 -7.975 1.00 36.27 C ATOM 2041 CD2 TYR C 226 30.317 33.309 -8.427 1.00 36.27 C ATOM 2042 CE1 TYR C 226 29.646 30.752 -9.252 1.00 36.27 C ATOM 2043 CE2 TYR C 226 29.818 33.103 -9.713 1.00 36.27 C ATOM 2044 CZ TYR C 226 29.485 31.825 -10.118 1.00 36.27 C ATOM 2045 OH TYR C 226 28.999 31.632 -11.390 1.00 36.27 O ATOM 2046 HA TYR C 226 32.916 32.323 -5.048 1.00 0.00 H ATOM 2047 HB3 TYR C 226 30.834 33.503 -5.859 1.00 0.00 H ATOM 2048 HB2 TYR C 226 30.559 31.789 -5.466 1.00 0.00 H ATOM 2049 HD2 TYR C 226 30.578 34.318 -8.109 1.00 0.00 H ATOM 2050 HE2 TYR C 226 29.692 33.945 -10.394 1.00 0.00 H ATOM 2051 HE1 TYR C 226 29.384 29.744 -9.575 1.00 0.00 H ATOM 2052 HD1 TYR C 226 30.262 30.123 -7.298 1.00 0.00 H ATOM 2053 HH TYR C 226 28.809 30.670 -11.527 1.00 0.00 H ATOM 2054 H TYR C 226 33.300 33.240 -7.853 1.00 0.00 H ATOM 2055 N THR C 227 32.386 29.889 -5.802 1.00 14.93 N ATOM 2056 CA THR C 227 32.517 28.487 -6.137 1.00 14.93 C ATOM 2057 C THR C 227 31.271 27.867 -5.552 1.00 14.93 C ATOM 2058 O THR C 227 31.067 27.902 -4.339 1.00 34.00 O ATOM 2059 CB THR C 227 33.764 27.847 -5.511 1.00 34.00 C ATOM 2060 OG1 THR C 227 34.941 28.421 -6.091 1.00 34.00 O ATOM 2061 CG2 THR C 227 33.777 26.359 -5.773 1.00 34.00 C ATOM 2062 HA THR C 227 32.625 28.339 -7.212 1.00 0.00 H ATOM 2063 HB THR C 227 33.744 28.029 -4.436 1.00 0.00 H ATOM 2064 HG1 THR C 227 34.941 28.256 -7.067 1.00 0.00 H ATOM 2065 HG23 THR C 227 32.886 25.907 -5.337 1.00 0.00 H ATOM 2066 HG21 THR C 227 33.787 26.181 -6.848 1.00 0.00 H ATOM 2067 HG22 THR C 227 34.667 25.920 -5.322 1.00 0.00 H ATOM 2068 H THR C 227 31.905 30.145 -4.916 1.00 0.00 H ATOM 2069 N GLY C 228 30.373 27.443 -6.428 1.00 37.58 N ATOM 2070 CA GLY C 228 29.144 26.826 -5.978 1.00 37.58 C ATOM 2071 C GLY C 228 29.309 25.321 -5.939 1.00 37.58 C ATOM 2072 O GLY C 228 29.847 24.723 -6.876 1.00 90.00 O ATOM 2073 HA3 GLY C 228 28.337 27.084 -6.664 1.00 0.00 H ATOM 2074 HA2 GLY C 228 28.901 27.190 -4.980 1.00 0.00 H ATOM 2075 H GLY C 228 30.552 27.554 -7.446 1.00 0.00 H ATOM 2076 N MET C 229 28.846 24.702 -4.860 1.00 41.69 N ATOM 2077 CA MET C 229 28.941 23.258 -4.712 1.00 41.69 C ATOM 2078 C MET C 229 27.669 22.693 -4.105 1.00 41.69 C ATOM 2079 O MET C 229 26.914 23.414 -3.450 1.00 53.67 O ATOM 2080 CB MET C 229 30.170 22.879 -3.880 1.00 53.67 C ATOM 2081 CG MET C 229 30.353 23.670 -2.605 1.00 53.67 C ATOM 2082 SD MET C 229 31.997 23.424 -1.907 1.00 53.67 S ATOM 2083 CE MET C 229 32.848 24.852 -2.528 1.00 53.67 C ATOM 2084 HA MET C 229 29.060 22.819 -5.702 1.00 0.00 H ATOM 2085 HB2 MET C 229 30.086 21.825 -3.614 1.00 0.00 H ATOM 2086 HB3 MET C 229 31.055 23.027 -4.499 1.00 0.00 H ATOM 2087 HG2 MET C 229 29.607 23.349 -1.878 1.00 0.00 H ATOM 2088 HG3 MET C 229 30.214 24.729 -2.822 1.00 0.00 H ATOM 2089 HE1 MET C 229 32.832 24.838 -3.618 1.00 0.00 H ATOM 2090 HE2 MET C 229 32.353 25.754 -2.168 1.00 0.00 H ATOM 2091 HE3 MET C 229 33.880 24.839 -2.179 1.00 0.00 H ATOM 2092 H MET C 229 28.405 25.262 -4.103 1.00 0.00 H ATOM 2093 N LEU C 230 27.379 21.436 -4.428 1.00 72.59 N ATOM 2094 CA LEU C 230 26.196 20.757 -3.908 1.00 72.59 C ATOM 2095 C LEU C 230 26.424 20.430 -2.435 1.00 72.59 C ATOM 2096 O LEU C 230 27.562 20.483 -1.956 1.00 58.82 O ATOM 2097 CB LEU C 230 25.926 19.468 -4.689 1.00 58.82 C ATOM 2098 CG LEU C 230 25.677 19.606 -6.192 1.00 58.82 C ATOM 2099 CD1 LEU C 230 25.499 18.233 -6.825 1.00 58.82 C ATOM 2100 CD2 LEU C 230 24.452 20.470 -6.434 1.00 58.82 C ATOM 2101 HA LEU C 230 25.330 21.410 -4.017 1.00 0.00 H ATOM 2102 HB2 LEU C 230 26.790 18.816 -4.557 1.00 0.00 H ATOM 2103 HB3 LEU C 230 25.046 18.996 -4.252 1.00 0.00 H ATOM 2104 HG LEU C 230 26.540 20.086 -6.654 1.00 0.00 H ATOM 2105 HD21 LEU C 230 23.584 20.007 -5.966 1.00 0.00 H ATOM 2106 HD22 LEU C 230 24.615 21.458 -6.003 1.00 0.00 H ATOM 2107 HD23 LEU C 230 24.281 20.564 -7.506 1.00 0.00 H ATOM 2108 HD11 LEU C 230 26.400 17.641 -6.665 1.00 0.00 H ATOM 2109 HD12 LEU C 230 24.647 17.731 -6.367 1.00 0.00 H ATOM 2110 HD13 LEU C 230 25.323 18.348 -7.895 1.00 0.00 H ATOM 2111 H LEU C 230 28.014 20.921 -5.071 1.00 0.00 H ATOM 2112 N GLU C 231 25.355 20.053 -1.736 1.00 72.27 N ATOM 2113 CA GLU C 231 25.430 19.723 -0.310 1.00 72.27 C ATOM 2114 C GLU C 231 26.541 18.716 0.012 1.00 72.27 C ATOM 2115 O GLU C 231 27.138 18.770 1.089 1.00115.54 O ATOM 2116 CB GLU C 231 24.068 19.226 0.198 1.00115.54 C ATOM 2117 CG GLU C 231 23.929 19.198 1.726 1.00115.54 C ATOM 2118 CD GLU C 231 22.493 19.020 2.204 1.00115.54 C ATOM 2119 OE1 GLU C 231 21.612 18.664 1.388 1.00115.54 O ATOM 2120 OE2 GLU C 231 22.242 19.243 3.409 1.00115.54 O ATOM 2121 HA GLU C 231 25.690 20.642 0.216 1.00 0.00 H ATOM 2122 HB2 GLU C 231 23.295 19.882 -0.202 1.00 0.00 H ATOM 2123 HB3 GLU C 231 23.913 18.214 -0.177 1.00 0.00 H ATOM 2124 HG2 GLU C 231 24.526 18.372 2.112 1.00 0.00 H ATOM 2125 HG3 GLU C 231 24.311 20.138 2.125 1.00 0.00 H ATOM 2126 H GLU C 231 24.436 19.991 -2.218 1.00 0.00 H ATOM 2127 N ASP C 232 26.831 17.815 -0.925 1.00 62.62 N ATOM 2128 CA ASP C 232 27.890 16.825 -0.730 1.00 62.62 C ATOM 2129 C ASP C 232 29.250 17.277 -1.277 1.00 62.62 C ATOM 2130 O ASP C 232 30.052 16.457 -1.724 1.00137.24 O ATOM 2131 CB ASP C 232 27.487 15.447 -1.290 1.00137.24 C ATOM 2132 CG ASP C 232 26.664 15.531 -2.569 1.00137.24 C ATOM 2133 OD1 ASP C 232 27.011 16.318 -3.474 1.00137.24 O ATOM 2134 OD2 ASP C 232 25.663 14.789 -2.670 1.00137.24 O ATOM 2135 HA ASP C 232 28.015 16.727 0.348 1.00 0.00 H ATOM 2136 HB2 ASP C 232 28.394 14.880 -1.499 1.00 0.00 H ATOM 2137 HB3 ASP C 232 26.900 14.925 -0.535 1.00 0.00 H ATOM 2138 H ASP C 232 26.293 17.815 -1.815 1.00 0.00 H ATOM 2139 N GLY C 233 29.479 18.592 -1.265 1.00 67.41 N ATOM 2140 CA GLY C 233 30.738 19.170 -1.720 1.00 67.41 C ATOM 2141 C GLY C 233 31.104 19.135 -3.196 1.00 67.41 C ATOM 2142 O GLY C 233 32.230 19.485 -3.554 1.00 86.82 O ATOM 2143 HA3 GLY C 233 31.534 18.650 -1.186 1.00 0.00 H ATOM 2144 HA2 GLY C 233 30.728 20.219 -1.423 1.00 0.00 H ATOM 2145 H GLY C 233 28.732 19.227 -0.918 1.00 0.00 H ATOM 2146 N LYS C 234 30.173 18.740 -4.057 1.00 58.53 N ATOM 2147 CA LYS C 234 30.439 18.669 -5.495 1.00 58.53 C ATOM 2148 C LYS C 234 30.502 20.055 -6.134 1.00 58.53 C ATOM 2149 O LYS C 234 29.484 20.744 -6.238 1.00148.16 O ATOM 2150 CB LYS C 234 29.368 17.833 -6.209 1.00148.16 C ATOM 2151 CG LYS C 234 29.372 16.338 -5.892 1.00148.16 C ATOM 2152 CD LYS C 234 28.154 15.658 -6.526 1.00148.16 C ATOM 2153 CE LYS C 234 27.993 14.199 -6.098 1.00148.16 C ATOM 2154 NZ LYS C 234 28.978 13.274 -6.728 1.00148.16 N ATOM 2155 HA LYS C 234 31.412 18.192 -5.610 1.00 0.00 H ATOM 2156 HB2 LYS C 234 28.392 18.232 -5.932 1.00 0.00 H ATOM 2157 HB3 LYS C 234 29.514 17.948 -7.283 1.00 0.00 H ATOM 2158 HG2 LYS C 234 30.282 15.888 -6.288 1.00 0.00 H ATOM 2159 HG3 LYS C 234 29.340 16.199 -4.811 1.00 0.00 H ATOM 2160 HD2 LYS C 234 27.259 16.207 -6.234 1.00 0.00 H ATOM 2161 HD3 LYS C 234 28.262 15.692 -7.610 1.00 0.00 H ATOM 2162 HE2 LYS C 234 26.990 13.870 -6.369 1.00 0.00 H ATOM 2163 HE3 LYS C 234 28.112 14.143 -5.016 1.00 0.00 H ATOM 2164 HZ1 LYS C 234 28.870 13.306 -7.762 1.00 0.00 H ATOM 2165 HZ2 LYS C 234 29.942 13.567 -6.469 1.00 0.00 H ATOM 2166 HZ3 LYS C 234 28.807 12.305 -6.391 1.00 0.00 H ATOM 2167 H LYS C 234 29.232 18.475 -3.701 1.00 0.00 H ATOM 2168 N LYS C 235 31.697 20.454 -6.565 1.00 46.09 N ATOM 2169 CA LYS C 235 31.892 21.750 -7.213 1.00 46.09 C ATOM 2170 C LYS C 235 31.219 21.691 -8.578 1.00 46.09 C ATOM 2171 O LYS C 235 31.679 20.976 -9.470 1.00 88.43 O ATOM 2172 CB LYS C 235 33.386 22.048 -7.401 1.00 88.43 C ATOM 2173 CG LYS C 235 34.214 22.062 -6.124 1.00 88.43 C ATOM 2174 CD LYS C 235 35.690 22.310 -6.426 1.00 88.43 C ATOM 2175 CE LYS C 235 36.547 22.256 -5.166 1.00 88.43 C ATOM 2176 NZ LYS C 235 36.480 20.928 -4.488 1.00 88.43 N ATOM 2177 HA LYS C 235 31.463 22.537 -6.593 1.00 0.00 H ATOM 2178 HB2 LYS C 235 33.800 21.287 -8.063 1.00 0.00 H ATOM 2179 HB3 LYS C 235 33.477 23.027 -7.872 1.00 0.00 H ATOM 2180 HG2 LYS C 235 33.847 22.853 -5.470 1.00 0.00 H ATOM 2181 HG3 LYS C 235 34.110 21.100 -5.622 1.00 0.00 H ATOM 2182 HD2 LYS C 235 36.040 21.548 -7.123 1.00 0.00 H ATOM 2183 HD3 LYS C 235 35.796 23.294 -6.882 1.00 0.00 H ATOM 2184 HE2 LYS C 235 36.199 23.021 -4.472 1.00 0.00 H ATOM 2185 HE3 LYS C 235 37.583 22.458 -5.438 1.00 0.00 H ATOM 2186 HZ1 LYS C 235 35.496 20.728 -4.217 1.00 0.00 H ATOM 2187 HZ2 LYS C 235 36.818 20.190 -5.139 1.00 0.00 H ATOM 2188 HZ3 LYS C 235 37.079 20.943 -3.638 1.00 0.00 H ATOM 2189 H LYS C 235 32.516 19.825 -6.437 1.00 0.00 H ATOM 2190 N PHE C 236 30.110 22.404 -8.728 1.00 56.61 N ATOM 2191 CA PHE C 236 29.405 22.410 -9.999 1.00 56.61 C ATOM 2192 C PHE C 236 29.750 23.605 -10.886 1.00 56.61 C ATOM 2193 O PHE C 236 29.531 23.565 -12.097 1.00 37.94 O ATOM 2194 CB PHE C 236 27.889 22.312 -9.784 1.00 37.94 C ATOM 2195 CG PHE C 236 27.319 23.389 -8.915 1.00 37.94 C ATOM 2196 CD1 PHE C 236 27.042 24.644 -9.431 1.00 37.94 C ATOM 2197 CD2 PHE C 236 27.007 23.131 -7.590 1.00 37.94 C ATOM 2198 CE1 PHE C 236 26.463 25.623 -8.639 1.00 37.94 C ATOM 2199 CE2 PHE C 236 26.425 24.107 -6.791 1.00 37.94 C ATOM 2200 CZ PHE C 236 26.154 25.353 -7.316 1.00 37.94 C ATOM 2201 HA PHE C 236 29.748 21.526 -10.536 1.00 0.00 H ATOM 2202 HB2 PHE C 236 27.402 22.365 -10.758 1.00 0.00 H ATOM 2203 HB3 PHE C 236 27.671 21.349 -9.322 1.00 0.00 H ATOM 2204 HD2 PHE C 236 27.221 22.149 -7.169 1.00 0.00 H ATOM 2205 HE2 PHE C 236 26.183 23.888 -5.751 1.00 0.00 H ATOM 2206 HZ PHE C 236 25.698 26.122 -6.692 1.00 0.00 H ATOM 2207 HE1 PHE C 236 26.251 26.607 -9.058 1.00 0.00 H ATOM 2208 HD1 PHE C 236 27.282 24.864 -10.471 1.00 0.00 H ATOM 2209 H PHE C 236 29.743 22.962 -7.931 1.00 0.00 H ATOM 2210 N ASP C 237 30.326 24.648 -10.297 1.00 38.83 N ATOM 2211 CA ASP C 237 30.677 25.849 -11.050 1.00 38.83 C ATOM 2212 C ASP C 237 31.639 26.704 -10.241 1.00 38.83 C ATOM 2213 O ASP C 237 31.613 26.672 -9.010 1.00 55.01 O ATOM 2214 CB ASP C 237 29.409 26.651 -11.356 1.00 55.01 C ATOM 2215 CG ASP C 237 29.664 27.823 -12.277 1.00 55.01 C ATOM 2216 OD1 ASP C 237 29.802 27.609 -13.497 1.00 55.01 O ATOM 2217 OD2 ASP C 237 29.719 28.961 -11.785 1.00 55.01 O ATOM 2218 HA ASP C 237 31.157 25.558 -11.984 1.00 0.00 H ATOM 2219 HB2 ASP C 237 28.683 25.989 -11.828 1.00 0.00 H ATOM 2220 HB3 ASP C 237 29.000 27.027 -10.418 1.00 0.00 H ATOM 2221 H ASP C 237 30.531 24.608 -9.278 1.00 0.00 H ATOM 2222 N SER C 238 32.487 27.467 -10.926 1.00 33.59 N ATOM 2223 CA SER C 238 33.448 28.332 -10.242 1.00 33.59 C ATOM 2224 C SER C 238 33.984 29.432 -11.152 1.00 33.59 C ATOM 2225 O SER C 238 34.540 29.152 -12.216 1.00 46.56 O ATOM 2226 CB SER C 238 34.606 27.513 -9.663 1.00 46.56 C ATOM 2227 OG SER C 238 35.485 28.349 -8.937 1.00 46.56 O ATOM 2228 HA SER C 238 32.912 28.814 -9.425 1.00 0.00 H ATOM 2229 HB2 SER C 238 35.153 27.037 -10.477 1.00 0.00 H ATOM 2230 HB3 SER C 238 34.207 26.747 -8.998 1.00 0.00 H ATOM 2231 HG SER C 238 34.991 28.780 -8.195 1.00 0.00 H ATOM 2232 H SER C 238 32.466 27.448 -11.966 1.00 0.00 H ATOM 2233 N SER C 239 33.810 30.681 -10.728 1.00 30.74 N ATOM 2234 CA SER C 239 34.276 31.829 -11.501 1.00 30.74 C ATOM 2235 C SER C 239 35.795 31.919 -11.466 1.00 30.74 C ATOM 2236 O SER C 239 36.416 32.500 -12.359 1.00 32.01 O ATOM 2237 CB SER C 239 33.666 33.129 -10.966 1.00 32.01 C ATOM 2238 OG SER C 239 33.925 33.293 -9.581 1.00 32.01 O ATOM 2239 HA SER C 239 33.954 31.690 -12.533 1.00 0.00 H ATOM 2240 HB2 SER C 239 32.588 33.106 -11.125 1.00 0.00 H ATOM 2241 HB3 SER C 239 34.094 33.971 -11.509 1.00 0.00 H ATOM 2242 HG SER C 239 33.534 32.533 -9.081 1.00 0.00 H ATOM 2243 H SER C 239 33.329 30.844 -9.821 1.00 0.00 H ATOM 2244 N ARG C 240 36.393 31.316 -10.444 1.00 55.00 N ATOM 2245 CA ARG C 240 37.842 31.335 -10.288 1.00 55.00 C ATOM 2246 C ARG C 240 38.567 30.568 -11.389 1.00 55.00 C ATOM 2247 O ARG C 240 39.750 30.798 -11.640 1.00 53.87 O ATOM 2248 CB ARG C 240 38.242 30.800 -8.911 1.00 53.87 C ATOM 2249 CG ARG C 240 37.841 31.715 -7.776 1.00 53.87 C ATOM 2250 CD ARG C 240 38.331 31.215 -6.443 1.00 53.87 C ATOM 2251 NE ARG C 240 37.822 32.050 -5.363 1.00 53.87 N ATOM 2252 CZ ARG C 240 38.388 33.180 -4.952 1.00 53.87 C ATOM 2253 NH1 ARG C 240 39.497 33.633 -5.523 1.00 53.87 N ATOM 2254 NH2 ARG C 240 37.833 33.867 -3.966 1.00 53.87 N ATOM 2255 HA ARG C 240 38.152 32.377 -10.373 1.00 0.00 H ATOM 2256 HB2 ARG C 240 37.762 29.833 -8.762 1.00 0.00 H ATOM 2257 HB3 ARG C 240 39.325 30.674 -8.889 1.00 0.00 H ATOM 2258 HG2 ARG C 240 38.262 32.704 -7.957 1.00 0.00 H ATOM 2259 HG3 ARG C 240 36.754 31.784 -7.747 1.00 0.00 H ATOM 2260 HD2 ARG C 240 39.421 31.237 -6.430 1.00 0.00 H ATOM 2261 HD3 ARG C 240 37.988 30.191 -6.296 1.00 0.00 H ATOM 2262 HE ARG C 240 36.955 31.740 -4.880 1.00 0.00 H ATOM 2263 HH12 ARG C 240 39.929 34.519 -5.191 1.00 0.00 H ATOM 2264 HH11 ARG C 240 39.935 33.102 -6.303 1.00 0.00 H ATOM 2265 HH22 ARG C 240 38.270 34.752 -3.639 1.00 0.00 H ATOM 2266 HH21 ARG C 240 36.960 33.522 -3.519 1.00 0.00 H ATOM 2267 H ARG C 240 35.813 30.819 -9.738 1.00 0.00 H ATOM 2268 N ASP C 241 37.852 29.666 -12.055 1.00 71.42 N ATOM 2269 CA ASP C 241 38.441 28.885 -13.134 1.00 71.42 C ATOM 2270 C ASP C 241 38.475 29.721 -14.410 1.00 71.42 C ATOM 2271 O ASP C 241 39.470 29.729 -15.138 1.00 92.53 O ATOM 2272 CB ASP C 241 37.644 27.595 -13.366 1.00 92.53 C ATOM 2273 CG ASP C 241 37.734 26.624 -12.198 1.00 92.53 C ATOM 2274 OD1 ASP C 241 38.760 26.642 -11.478 1.00 92.53 O ATOM 2275 OD2 ASP C 241 36.779 25.834 -12.009 1.00 92.53 O ATOM 2276 HA ASP C 241 39.459 28.611 -12.856 1.00 0.00 H ATOM 2277 HB2 ASP C 241 36.597 27.856 -13.522 1.00 0.00 H ATOM 2278 HB3 ASP C 241 38.031 27.103 -14.258 1.00 0.00 H ATOM 2279 H ASP C 241 36.855 29.516 -11.801 1.00 0.00 H ATOM 2280 N ARG C 242 37.393 30.456 -14.650 1.00 46.43 N ATOM 2281 CA ARG C 242 37.276 31.301 -15.832 1.00 46.43 C ATOM 2282 C ARG C 242 38.163 32.545 -15.751 1.00 46.43 C ATOM 2283 O ARG C 242 38.312 33.269 -16.739 1.00 68.63 O ATOM 2284 CB ARG C 242 35.812 31.710 -16.051 1.00 68.63 C ATOM 2285 CG ARG C 242 34.864 30.546 -16.344 1.00 68.63 C ATOM 2286 CD ARG C 242 33.469 31.034 -16.725 1.00 68.63 C ATOM 2287 NE ARG C 242 32.777 31.685 -15.613 1.00 68.63 N ATOM 2288 CZ ARG C 242 32.073 31.037 -14.688 1.00 68.63 C ATOM 2289 NH1 ARG C 242 31.965 29.713 -14.733 1.00 68.63 N ATOM 2290 NH2 ARG C 242 31.475 31.710 -13.713 1.00 68.63 N ATOM 2291 HA ARG C 242 37.622 30.712 -16.682 1.00 0.00 H ATOM 2292 HB2 ARG C 242 35.462 32.216 -15.152 1.00 0.00 H ATOM 2293 HB3 ARG C 242 35.774 32.401 -16.893 1.00 0.00 H ATOM 2294 HG2 ARG C 242 35.270 29.959 -17.168 1.00 0.00 H ATOM 2295 HG3 ARG C 242 34.789 29.920 -15.455 1.00 0.00 H ATOM 2296 HD2 ARG C 242 32.877 30.179 -17.052 1.00 0.00 H ATOM 2297 HD3 ARG C 242 33.560 31.746 -17.545 1.00 0.00 H ATOM 2298 HE ARG C 242 32.839 32.721 -15.541 1.00 0.00 H ATOM 2299 HH12 ARG C 242 31.414 29.211 -14.008 1.00 0.00 H ATOM 2300 HH11 ARG C 242 32.432 29.179 -15.493 1.00 0.00 H ATOM 2301 HH22 ARG C 242 30.925 31.201 -12.991 1.00 0.00 H ATOM 2302 HH21 ARG C 242 31.556 32.746 -13.671 1.00 0.00 H ATOM 2303 H ARG C 242 36.605 30.427 -13.972 1.00 0.00 H ATOM 2304 N ASN C 243 38.737 32.788 -14.572 1.00 85.72 N ATOM 2305 CA ASN C 243 39.611 33.939 -14.322 1.00 85.72 C ATOM 2306 C ASN C 243 38.880 35.268 -14.517 1.00 85.72 C ATOM 2307 O ASN C 243 39.508 36.326 -14.643 1.00 82.02 O ATOM 2308 CB ASN C 243 40.873 33.884 -15.200 1.00 82.02 C ATOM 2309 CG ASN C 243 41.845 32.795 -14.766 1.00 82.02 C ATOM 2310 OD1 ASN C 243 42.469 32.890 -13.705 1.00 82.02 O ATOM 2311 ND2 ASN C 243 41.987 31.762 -15.588 1.00 82.02 N ATOM 2312 HA ASN C 243 39.916 33.881 -13.277 1.00 0.00 H ATOM 2313 HB2 ASN C 243 40.573 33.693 -16.230 1.00 0.00 H ATOM 2314 HB3 ASN C 243 41.380 34.847 -15.143 1.00 0.00 H ATOM 2315 HD22 ASN C 243 41.441 31.722 -16.472 1.00 0.00 H ATOM 2316 HD21 ASN C 243 42.644 30.993 -15.348 1.00 0.00 H ATOM 2317 H ASN C 243 38.556 32.127 -13.790 1.00 0.00 H ATOM 2318 N LYS C 244 37.549 35.203 -14.483 1.00 55.10 N ATOM 2319 CA LYS C 244 36.691 36.376 -14.660 1.00 55.10 C ATOM 2320 C LYS C 244 35.650 36.430 -13.539 1.00 55.10 C ATOM 2321 O LYS C 244 34.851 35.506 -13.376 1.00105.74 O ATOM 2322 CB LYS C 244 35.977 36.307 -16.019 1.00105.74 C ATOM 2323 CG LYS C 244 35.293 37.603 -16.454 1.00105.74 C ATOM 2324 CD LYS C 244 34.400 37.419 -17.688 1.00105.74 C ATOM 2325 CE LYS C 244 35.128 36.742 -18.848 1.00105.74 C ATOM 2326 NZ LYS C 244 34.705 37.267 -20.183 1.00105.74 N ATOM 2327 HA LYS C 244 37.309 37.273 -14.626 1.00 0.00 H ATOM 2328 HB2 LYS C 244 36.715 36.043 -16.776 1.00 0.00 H ATOM 2329 HB3 LYS C 244 35.219 35.526 -15.964 1.00 0.00 H ATOM 2330 HG2 LYS C 244 34.679 37.966 -15.630 1.00 0.00 H ATOM 2331 HG3 LYS C 244 36.061 38.341 -16.686 1.00 0.00 H ATOM 2332 HD2 LYS C 244 33.542 36.807 -17.410 1.00 0.00 H ATOM 2333 HD3 LYS C 244 34.054 38.399 -18.017 1.00 0.00 H ATOM 2334 HE2 LYS C 244 34.921 35.672 -18.813 1.00 0.00 H ATOM 2335 HE3 LYS C 244 36.199 36.908 -18.732 1.00 0.00 H ATOM 2336 HZ1 LYS C 244 33.685 37.107 -20.310 1.00 0.00 H ATOM 2337 HZ2 LYS C 244 34.906 38.286 -20.233 1.00 0.00 H ATOM 2338 HZ3 LYS C 244 35.231 36.772 -20.931 1.00 0.00 H ATOM 2339 H LYS C 244 37.100 34.278 -14.324 1.00 0.00 H ATOM 2340 N PRO C 245 35.704 37.468 -12.695 1.00 32.63 N ATOM 2341 CA PRO C 245 34.731 37.574 -11.609 1.00 32.63 C ATOM 2342 C PRO C 245 33.319 37.861 -12.125 1.00 32.63 C ATOM 2343 O PRO C 245 33.137 38.380 -13.228 1.00 57.52 O ATOM 2344 CB PRO C 245 35.289 38.723 -10.769 1.00 57.52 C ATOM 2345 CG PRO C 245 36.006 39.560 -11.765 1.00 57.52 C ATOM 2346 CD PRO C 245 36.719 38.529 -12.590 1.00 57.52 C ATOM 2347 HA PRO C 245 34.616 36.650 -11.043 1.00 0.00 H ATOM 2348 HD3 PRO C 245 36.986 38.921 -13.571 1.00 0.00 H ATOM 2349 HD2 PRO C 245 37.617 38.170 -12.087 1.00 0.00 H ATOM 2350 HG3 PRO C 245 36.711 40.235 -11.280 1.00 0.00 H ATOM 2351 HG2 PRO C 245 35.309 40.139 -12.371 1.00 0.00 H ATOM 2352 HB2 PRO C 245 34.485 39.285 -10.293 1.00 0.00 H ATOM 2353 HB3 PRO C 245 35.973 38.352 -10.006 1.00 0.00 H ATOM 2354 N PHE C 246 32.328 37.513 -11.315 1.00 37.90 N ATOM 2355 CA PHE C 246 30.929 37.712 -11.660 1.00 37.90 C ATOM 2356 C PHE C 246 30.473 39.082 -11.180 1.00 37.90 C ATOM 2357 O PHE C 246 30.619 39.412 -10.004 1.00 43.88 O ATOM 2358 CB PHE C 246 30.095 36.611 -10.998 1.00 43.88 C ATOM 2359 CG PHE C 246 28.609 36.786 -11.144 1.00 43.88 C ATOM 2360 CD1 PHE C 246 28.045 37.109 -12.368 1.00 43.88 C ATOM 2361 CD2 PHE C 246 27.770 36.603 -10.052 1.00 43.88 C ATOM 2362 CE1 PHE C 246 26.667 37.245 -12.502 1.00 43.88 C ATOM 2363 CE2 PHE C 246 26.393 36.737 -10.179 1.00 43.88 C ATOM 2364 CZ PHE C 246 25.842 37.057 -11.406 1.00 43.88 C ATOM 2365 HA PHE C 246 30.800 37.663 -12.741 1.00 0.00 H ATOM 2366 HB2 PHE C 246 30.372 35.657 -11.446 1.00 0.00 H ATOM 2367 HB3 PHE C 246 30.334 36.594 -9.935 1.00 0.00 H ATOM 2368 HD2 PHE C 246 28.198 36.351 -9.082 1.00 0.00 H ATOM 2369 HE2 PHE C 246 25.748 36.590 -9.313 1.00 0.00 H ATOM 2370 HZ PHE C 246 24.762 37.161 -11.510 1.00 0.00 H ATOM 2371 HE1 PHE C 246 26.236 37.500 -13.470 1.00 0.00 H ATOM 2372 HD1 PHE C 246 28.688 37.258 -13.235 1.00 0.00 H ATOM 2373 H PHE C 246 32.560 37.081 -10.398 1.00 0.00 H ATOM 2374 N LYS C 247 29.960 39.890 -12.098 1.00 43.04 N ATOM 2375 CA LYS C 247 29.474 41.219 -11.748 1.00 43.04 C ATOM 2376 C LYS C 247 27.952 41.261 -11.820 1.00 43.04 C ATOM 2377 O LYS C 247 27.371 41.162 -12.903 1.00 72.74 O ATOM 2378 CB LYS C 247 30.072 42.291 -12.674 1.00 72.74 C ATOM 2379 CG LYS C 247 31.544 42.604 -12.426 1.00 72.74 C ATOM 2380 CD LYS C 247 32.000 43.864 -13.166 1.00 72.74 C ATOM 2381 CE LYS C 247 33.460 44.203 -12.845 1.00 72.74 C ATOM 2382 NZ LYS C 247 33.924 45.497 -13.438 1.00 72.74 N ATOM 2383 HA LYS C 247 29.791 41.434 -10.727 1.00 0.00 H ATOM 2384 HB2 LYS C 247 29.967 41.947 -13.703 1.00 0.00 H ATOM 2385 HB3 LYS C 247 29.503 43.211 -12.540 1.00 0.00 H ATOM 2386 HG2 LYS C 247 31.697 42.750 -11.357 1.00 0.00 H ATOM 2387 HG3 LYS C 247 32.145 41.760 -12.766 1.00 0.00 H ATOM 2388 HD2 LYS C 247 31.901 43.701 -14.239 1.00 0.00 H ATOM 2389 HD3 LYS C 247 31.367 44.700 -12.867 1.00 0.00 H ATOM 2390 HE2 LYS C 247 34.092 43.402 -13.230 1.00 0.00 H ATOM 2391 HE3 LYS C 247 33.569 44.262 -11.762 1.00 0.00 H ATOM 2392 HZ1 LYS C 247 33.837 45.453 -14.473 1.00 0.00 H ATOM 2393 HZ2 LYS C 247 33.338 46.274 -13.072 1.00 0.00 H ATOM 2394 HZ3 LYS C 247 34.918 45.659 -13.179 1.00 0.00 H ATOM 2395 H LYS C 247 29.903 39.570 -13.086 1.00 0.00 H ATOM 2396 N PHE C 248 27.304 41.369 -10.665 1.00 50.38 N ATOM 2397 CA PHE C 248 25.849 41.443 -10.626 1.00 50.38 C ATOM 2398 C PHE C 248 25.418 42.662 -9.817 1.00 50.38 C ATOM 2399 O PHE C 248 26.085 43.041 -8.853 1.00 38.96 O ATOM 2400 CB PHE C 248 25.246 40.174 -10.018 1.00 38.96 C ATOM 2401 CG PHE C 248 25.352 40.101 -8.523 1.00 38.96 C ATOM 2402 CD1 PHE C 248 26.500 39.609 -7.917 1.00 38.96 C ATOM 2403 CD2 PHE C 248 24.296 40.518 -7.719 1.00 38.96 C ATOM 2404 CE1 PHE C 248 26.598 39.533 -6.533 1.00 38.96 C ATOM 2405 CE2 PHE C 248 24.382 40.447 -6.339 1.00 38.96 C ATOM 2406 CZ PHE C 248 25.537 39.954 -5.743 1.00 38.96 C ATOM 2407 HA PHE C 248 25.484 41.534 -11.649 1.00 0.00 H ATOM 2408 HB2 PHE C 248 24.191 40.132 -10.289 1.00 0.00 H ATOM 2409 HB3 PHE C 248 25.763 39.312 -10.441 1.00 0.00 H ATOM 2410 HD2 PHE C 248 23.389 40.906 -8.182 1.00 0.00 H ATOM 2411 HE2 PHE C 248 23.546 40.777 -5.722 1.00 0.00 H ATOM 2412 HZ PHE C 248 25.609 39.898 -4.657 1.00 0.00 H ATOM 2413 HE1 PHE C 248 27.505 39.144 -6.069 1.00 0.00 H ATOM 2414 HD1 PHE C 248 27.335 39.278 -8.535 1.00 0.00 H ATOM 2415 H PHE C 248 27.843 41.401 -9.776 1.00 0.00 H ATOM 2416 N MET C 249 24.317 43.286 -10.225 1.00 51.58 N ATOM 2417 CA MET C 249 23.789 44.452 -9.529 1.00 51.58 C ATOM 2418 C MET C 249 22.816 43.950 -8.470 1.00 51.58 C ATOM 2419 O MET C 249 22.049 43.017 -8.712 1.00100.58 O ATOM 2420 CB MET C 249 23.086 45.381 -10.517 1.00100.58 C ATOM 2421 CG MET C 249 22.624 46.690 -9.918 1.00100.58 C ATOM 2422 SD MET C 249 22.376 47.930 -11.200 1.00100.58 S ATOM 2423 CE MET C 249 20.655 47.677 -11.593 1.00100.58 C ATOM 2424 HA MET C 249 24.592 45.021 -9.061 1.00 0.00 H ATOM 2425 HB2 MET C 249 23.778 45.602 -11.330 1.00 0.00 H ATOM 2426 HB3 MET C 249 22.215 44.861 -10.915 1.00 0.00 H ATOM 2427 HG2 MET C 249 23.377 47.047 -9.216 1.00 0.00 H ATOM 2428 HG3 MET C 249 21.684 46.529 -9.390 1.00 0.00 H ATOM 2429 HE1 MET C 249 20.510 46.655 -11.943 1.00 0.00 H ATOM 2430 HE2 MET C 249 20.051 47.846 -10.701 1.00 0.00 H ATOM 2431 HE3 MET C 249 20.356 48.376 -12.374 1.00 0.00 H ATOM 2432 H MET C 249 23.818 42.931 -11.066 1.00 0.00 H ATOM 2433 N LEU C 250 22.863 44.560 -7.294 1.00 79.56 N ATOM 2434 CA LEU C 250 22.007 44.162 -6.182 1.00 79.56 C ATOM 2435 C LEU C 250 20.603 44.765 -6.268 1.00 79.56 C ATOM 2436 O LEU C 250 20.455 45.972 -6.473 1.00 81.74 O ATOM 2437 CB LEU C 250 22.664 44.574 -4.862 1.00 81.74 C ATOM 2438 CG LEU C 250 21.991 44.131 -3.563 1.00 81.74 C ATOM 2439 CD1 LEU C 250 22.071 42.614 -3.431 1.00 81.74 C ATOM 2440 CD2 LEU C 250 22.671 44.812 -2.385 1.00 81.74 C ATOM 2441 HA LEU C 250 21.893 43.079 -6.233 1.00 0.00 H ATOM 2442 HB2 LEU C 250 23.675 44.166 -4.860 1.00 0.00 H ATOM 2443 HB3 LEU C 250 22.713 45.663 -4.849 1.00 0.00 H ATOM 2444 HG LEU C 250 20.940 44.419 -3.576 1.00 0.00 H ATOM 2445 HD21 LEU C 250 23.724 44.533 -2.364 1.00 0.00 H ATOM 2446 HD22 LEU C 250 22.583 45.893 -2.492 1.00 0.00 H ATOM 2447 HD23 LEU C 250 22.192 44.497 -1.458 1.00 0.00 H ATOM 2448 HD11 LEU C 250 21.564 42.150 -4.277 1.00 0.00 H ATOM 2449 HD12 LEU C 250 23.117 42.306 -3.419 1.00 0.00 H ATOM 2450 HD13 LEU C 250 21.589 42.305 -2.503 1.00 0.00 H ATOM 2451 H LEU C 250 23.530 45.346 -7.160 1.00 0.00 H ATOM 2452 N GLY C 251 19.580 43.927 -6.113 1.00 66.16 N ATOM 2453 CA GLY C 251 18.209 44.413 -6.163 1.00 66.16 C ATOM 2454 C GLY C 251 17.380 43.870 -7.313 1.00 66.16 C ATOM 2455 O GLY C 251 16.265 43.375 -7.110 1.00106.71 O ATOM 2456 HA3 GLY C 251 18.237 45.499 -6.249 1.00 0.00 H ATOM 2457 HA2 GLY C 251 17.717 44.136 -5.230 1.00 0.00 H ATOM 2458 H GLY C 251 19.762 42.915 -5.955 1.00 0.00 H ATOM 2459 N LYS C 252 17.919 43.969 -8.526 1.00 54.90 N ATOM 2460 CA LYS C 252 17.230 43.494 -9.723 1.00 54.90 C ATOM 2461 C LYS C 252 17.346 41.979 -9.882 1.00 54.90 C ATOM 2462 O LYS C 252 18.280 41.364 -9.370 1.00136.16 O ATOM 2463 CB LYS C 252 17.780 44.207 -10.962 1.00136.16 C ATOM 2464 CG LYS C 252 17.813 45.724 -10.814 1.00136.16 C ATOM 2465 CD LYS C 252 16.482 46.258 -10.281 1.00136.16 C ATOM 2466 CE LYS C 252 16.606 47.693 -9.779 1.00136.16 C ATOM 2467 NZ LYS C 252 15.334 48.196 -9.175 1.00136.16 N ATOM 2468 HA LYS C 252 16.171 43.729 -9.614 1.00 0.00 H ATOM 2469 HB2 LYS C 252 18.795 43.854 -11.144 1.00 0.00 H ATOM 2470 HB3 LYS C 252 17.151 43.955 -11.816 1.00 0.00 H ATOM 2471 HG2 LYS C 252 18.609 45.996 -10.121 1.00 0.00 H ATOM 2472 HG3 LYS C 252 18.012 46.172 -11.788 1.00 0.00 H ATOM 2473 HD2 LYS C 252 15.743 46.227 -11.082 1.00 0.00 H ATOM 2474 HD3 LYS C 252 16.151 45.624 -9.459 1.00 0.00 H ATOM 2475 HE2 LYS C 252 16.874 48.336 -10.617 1.00 0.00 H ATOM 2476 HE3 LYS C 252 17.392 47.734 -9.025 1.00 0.00 H ATOM 2477 HZ1 LYS C 252 14.578 48.168 -9.889 1.00 0.00 H ATOM 2478 HZ2 LYS C 252 15.073 47.594 -8.368 1.00 0.00 H ATOM 2479 HZ3 LYS C 252 15.469 49.174 -8.849 1.00 0.00 H ATOM 2480 H LYS C 252 18.861 44.398 -8.625 1.00 0.00 H ATOM 2481 N GLN C 253 16.370 41.385 -10.563 1.00 95.53 N ATOM 2482 CA GLN C 253 16.343 39.944 -10.800 1.00 95.53 C ATOM 2483 C GLN C 253 17.610 39.459 -11.508 1.00 95.53 C ATOM 2484 O GLN C 253 17.628 39.301 -12.729 1.00190.04 O ATOM 2485 CB GLN C 253 15.105 39.558 -11.626 1.00190.04 C ATOM 2486 CG GLN C 253 14.941 40.335 -12.941 1.00190.04 C ATOM 2487 CD GLN C 253 14.544 39.450 -14.119 1.00190.04 C ATOM 2488 OE1 GLN C 253 13.578 38.689 -14.045 1.00190.04 O ATOM 2489 NE2 GLN C 253 15.289 39.553 -15.216 1.00190.04 N ATOM 2490 HA GLN C 253 16.295 39.457 -9.826 1.00 0.00 H ATOM 2491 HB2 GLN C 253 15.174 38.497 -11.865 1.00 0.00 H ATOM 2492 HB3 GLN C 253 14.220 39.735 -11.015 1.00 0.00 H ATOM 2493 HG2 GLN C 253 14.170 41.093 -12.802 1.00 0.00 H ATOM 2494 HG3 GLN C 253 15.888 40.821 -13.177 1.00 0.00 H ATOM 2495 HE22 GLN C 253 16.096 40.208 -15.237 1.00 0.00 H ATOM 2496 HE21 GLN C 253 15.064 38.978 -16.053 1.00 0.00 H ATOM 2497 H GLN C 253 15.597 41.969 -10.941 1.00 0.00 H ATOM 2498 N GLU C 254 18.678 39.256 -10.746 1.00 80.45 N ATOM 2499 CA GLU C 254 19.933 38.784 -11.322 1.00 80.45 C ATOM 2500 C GLU C 254 20.470 37.571 -10.586 1.00 80.45 C ATOM 2501 O GLU C 254 21.076 36.688 -11.189 1.00 72.00 O ATOM 2502 CB GLU C 254 20.990 39.895 -11.336 1.00 72.00 C ATOM 2503 CG GLU C 254 20.881 40.855 -12.512 1.00 72.00 C ATOM 2504 CD GLU C 254 22.074 41.785 -12.623 1.00 72.00 C ATOM 2505 OE1 GLU C 254 23.188 41.306 -12.945 1.00 72.00 O ATOM 2506 OE2 GLU C 254 21.892 42.999 -12.395 1.00 72.00 O ATOM 2507 HA GLU C 254 19.717 38.491 -12.349 1.00 0.00 H ATOM 2508 HB2 GLU C 254 20.891 40.471 -10.416 1.00 0.00 H ATOM 2509 HB3 GLU C 254 21.975 39.428 -11.367 1.00 0.00 H ATOM 2510 HG2 GLU C 254 20.805 40.274 -13.431 1.00 0.00 H ATOM 2511 HG3 GLU C 254 19.980 41.456 -12.389 1.00 0.00 H ATOM 2512 H GLU C 254 18.619 39.436 -9.723 1.00 0.00 H ATOM 2513 N VAL C 255 20.242 37.530 -9.281 1.00 43.81 N ATOM 2514 CA VAL C 255 20.721 36.419 -8.477 1.00 43.81 C ATOM 2515 C VAL C 255 19.595 35.725 -7.729 1.00 43.81 C ATOM 2516 O VAL C 255 18.550 36.327 -7.452 1.00 64.95 O ATOM 2517 CB VAL C 255 21.793 36.878 -7.453 1.00 64.95 C ATOM 2518 CG1 VAL C 255 23.082 37.231 -8.164 1.00 64.95 C ATOM 2519 CG2 VAL C 255 21.298 38.068 -6.653 1.00 64.95 C ATOM 2520 HA VAL C 255 21.166 35.712 -9.178 1.00 0.00 H ATOM 2521 HB VAL C 255 21.982 36.054 -6.765 1.00 0.00 H ATOM 2522 HG11 VAL C 255 23.452 36.356 -8.699 1.00 0.00 H ATOM 2523 HG12 VAL C 255 22.896 38.039 -8.871 1.00 0.00 H ATOM 2524 HG13 VAL C 255 23.823 37.551 -7.432 1.00 0.00 H ATOM 2525 HG21 VAL C 255 21.081 38.894 -7.330 1.00 0.00 H ATOM 2526 HG22 VAL C 255 20.392 37.790 -6.114 1.00 0.00 H ATOM 2527 HG23 VAL C 255 22.067 38.371 -5.942 1.00 0.00 H ATOM 2528 H VAL C 255 19.714 38.302 -8.827 1.00 0.00 H ATOM 2529 N ILE C 256 19.791 34.439 -7.461 1.00 44.91 N ATOM 2530 CA ILE C 256 18.822 33.651 -6.709 1.00 44.91 C ATOM 2531 C ILE C 256 18.670 34.309 -5.332 1.00 44.91 C ATOM 2532 O ILE C 256 19.647 34.829 -4.784 1.00 54.46 O ATOM 2533 CB ILE C 256 19.305 32.192 -6.537 1.00 54.46 C ATOM 2534 CG1 ILE C 256 20.724 32.162 -5.959 1.00 54.46 C ATOM 2535 CG2 ILE C 256 19.255 31.468 -7.871 1.00 54.46 C ATOM 2536 CD1 ILE C 256 21.312 30.771 -5.790 1.00 54.46 C ATOM 2537 HA ILE C 256 17.872 33.623 -7.243 1.00 0.00 H ATOM 2538 HB ILE C 256 18.642 31.682 -5.838 1.00 0.00 H ATOM 2539 HG12 ILE C 256 21.375 32.727 -6.626 1.00 0.00 H ATOM 2540 HG13 ILE C 256 20.703 32.643 -4.981 1.00 0.00 H ATOM 2541 HD11 ILE C 256 20.683 30.192 -5.114 1.00 0.00 H ATOM 2542 HD12 ILE C 256 21.356 30.276 -6.760 1.00 0.00 H ATOM 2543 HD13 ILE C 256 22.317 30.851 -5.375 1.00 0.00 H ATOM 2544 HG21 ILE C 256 18.231 31.466 -8.244 1.00 0.00 H ATOM 2545 HG22 ILE C 256 19.901 31.979 -8.585 1.00 0.00 H ATOM 2546 HG23 ILE C 256 19.597 30.442 -7.739 1.00 0.00 H ATOM 2547 H ILE C 256 20.662 33.980 -7.798 1.00 0.00 H ATOM 2548 N ARG C 257 17.460 34.289 -4.778 1.00 54.87 N ATOM 2549 CA ARG C 257 17.180 34.896 -3.471 1.00 54.87 C ATOM 2550 C ARG C 257 18.297 34.754 -2.441 1.00 54.87 C ATOM 2551 O ARG C 257 18.655 35.724 -1.768 1.00117.90 O ATOM 2552 CB ARG C 257 15.870 34.351 -2.896 1.00117.90 C ATOM 2553 CG ARG C 257 14.628 35.000 -3.480 1.00117.90 C ATOM 2554 CD ARG C 257 14.457 36.443 -2.993 1.00117.90 C ATOM 2555 NE ARG C 257 13.960 36.518 -1.617 1.00117.90 N ATOM 2556 CZ ARG C 257 13.997 37.611 -0.857 1.00117.90 C ATOM 2557 NH1 ARG C 257 14.515 38.742 -1.328 1.00117.90 N ATOM 2558 NH2 ARG C 257 13.508 37.576 0.376 1.00117.90 N ATOM 2559 HA ARG C 257 17.097 35.965 -3.670 1.00 0.00 H ATOM 2560 HB2 ARG C 257 15.825 33.281 -3.096 1.00 0.00 H ATOM 2561 HB3 ARG C 257 15.871 34.518 -1.819 1.00 0.00 H ATOM 2562 HG2 ARG C 257 14.708 35.001 -4.567 1.00 0.00 H ATOM 2563 HG3 ARG C 257 13.754 34.421 -3.182 1.00 0.00 H ATOM 2564 HD2 ARG C 257 13.750 36.951 -3.648 1.00 0.00 H ATOM 2565 HD3 ARG C 257 15.423 36.946 -3.044 1.00 0.00 H ATOM 2566 HE ARG C 257 13.549 35.656 -1.204 1.00 0.00 H ATOM 2567 HH12 ARG C 257 14.540 39.592 -0.729 1.00 0.00 H ATOM 2568 HH11 ARG C 257 14.895 38.777 -2.296 1.00 0.00 H ATOM 2569 HH22 ARG C 257 13.536 38.429 0.971 1.00 0.00 H ATOM 2570 HH21 ARG C 257 13.097 36.696 0.747 1.00 0.00 H ATOM 2571 H ARG C 257 16.683 33.826 -5.291 1.00 0.00 H ATOM 2572 N GLY C 258 18.855 33.552 -2.339 1.00 77.75 N ATOM 2573 CA GLY C 258 19.932 33.307 -1.395 1.00 77.75 C ATOM 2574 C GLY C 258 21.059 34.317 -1.517 1.00 77.75 C ATOM 2575 O GLY C 258 21.518 34.874 -0.520 1.00 60.86 O ATOM 2576 HA3 GLY C 258 20.335 32.311 -1.576 1.00 0.00 H ATOM 2577 HA2 GLY C 258 19.528 33.356 -0.384 1.00 0.00 H ATOM 2578 H GLY C 258 18.516 32.776 -2.943 1.00 0.00 H ATOM 2579 N TRP C 259 21.490 34.565 -2.748 1.00 56.48 N ATOM 2580 CA TRP C 259 22.552 35.523 -3.008 1.00 56.48 C ATOM 2581 C TRP C 259 22.139 36.945 -2.645 1.00 56.48 C ATOM 2582 O TRP C 259 22.946 37.706 -2.112 1.00 28.20 O ATOM 2583 CB TRP C 259 22.992 35.449 -4.471 1.00 28.20 C ATOM 2584 CG TRP C 259 24.010 34.382 -4.710 1.00 28.20 C ATOM 2585 CD1 TRP C 259 23.910 33.058 -4.379 1.00 28.20 C ATOM 2586 CD2 TRP C 259 25.316 34.558 -5.263 1.00 28.20 C ATOM 2587 NE1 TRP C 259 25.075 32.405 -4.685 1.00 28.20 N ATOM 2588 CE2 TRP C 259 25.959 33.302 -5.227 1.00 28.20 C ATOM 2589 CE3 TRP C 259 26.012 35.660 -5.783 1.00 28.20 C ATOM 2590 CZ2 TRP C 259 27.263 33.116 -5.688 1.00 28.20 C ATOM 2591 CZ3 TRP C 259 27.308 35.473 -6.241 1.00 28.20 C ATOM 2592 CH2 TRP C 259 27.920 34.210 -6.189 1.00 28.20 C ATOM 2593 HA TRP C 259 23.395 35.257 -2.371 1.00 0.00 H ATOM 2594 HB2 TRP C 259 22.118 35.243 -5.089 1.00 0.00 H ATOM 2595 HB3 TRP C 259 23.419 36.410 -4.757 1.00 0.00 H ATOM 2596 HE1 TRP C 259 25.259 31.393 -4.531 1.00 0.00 H ATOM 2597 HD1 TRP C 259 23.031 32.590 -3.936 1.00 0.00 H ATOM 2598 HZ2 TRP C 259 27.741 32.137 -5.651 1.00 0.00 H ATOM 2599 HH2 TRP C 259 28.940 34.097 -6.555 1.00 0.00 H ATOM 2600 HZ3 TRP C 259 27.860 36.320 -6.648 1.00 0.00 H ATOM 2601 HE3 TRP C 259 25.544 36.643 -5.826 1.00 0.00 H ATOM 2602 H TRP C 259 21.056 34.061 -3.547 1.00 0.00 H ATOM 2603 N GLU C 260 20.883 37.293 -2.917 1.00 47.04 N ATOM 2604 CA GLU C 260 20.376 38.626 -2.600 1.00 47.04 C ATOM 2605 C GLU C 260 20.537 38.898 -1.103 1.00 47.04 C ATOM 2606 O GLU C 260 21.178 39.871 -0.710 1.00 66.16 O ATOM 2607 CB GLU C 260 18.898 38.770 -3.003 1.00 66.16 C ATOM 2608 CG GLU C 260 18.626 39.003 -4.500 1.00 66.16 C ATOM 2609 CD GLU C 260 18.766 40.464 -4.939 1.00 66.16 C ATOM 2610 OE1 GLU C 260 18.493 41.377 -4.131 1.00 66.16 O ATOM 2611 OE2 GLU C 260 19.132 40.701 -6.110 1.00 66.16 O ATOM 2612 HA GLU C 260 20.954 39.355 -3.168 1.00 0.00 H ATOM 2613 HB2 GLU C 260 18.381 37.857 -2.708 1.00 0.00 H ATOM 2614 HB3 GLU C 260 18.483 39.615 -2.453 1.00 0.00 H ATOM 2615 HG2 GLU C 260 19.332 38.403 -5.074 1.00 0.00 H ATOM 2616 HG3 GLU C 260 17.610 38.675 -4.719 1.00 0.00 H ATOM 2617 H GLU C 260 20.249 36.601 -3.365 1.00 0.00 H ATOM 2618 N GLU C 261 19.998 38.009 -0.273 1.00 42.59 N ATOM 2619 CA GLU C 261 20.079 38.163 1.179 1.00 42.59 C ATOM 2620 C GLU C 261 21.488 37.956 1.730 1.00 42.59 C ATOM 2621 O GLU C 261 21.956 38.721 2.576 1.00 93.77 O ATOM 2622 CB GLU C 261 19.117 37.194 1.881 1.00 93.77 C ATOM 2623 CG GLU C 261 17.638 37.580 1.820 1.00 93.77 C ATOM 2624 CD GLU C 261 16.743 36.645 2.637 1.00 93.77 C ATOM 2625 OE1 GLU C 261 17.128 36.266 3.766 1.00 93.77 O ATOM 2626 OE2 GLU C 261 15.643 36.296 2.154 1.00 93.77 O ATOM 2627 HA GLU C 261 19.794 39.195 1.386 1.00 0.00 H ATOM 2628 HB2 GLU C 261 19.229 36.214 1.417 1.00 0.00 H ATOM 2629 HB3 GLU C 261 19.406 37.133 2.930 1.00 0.00 H ATOM 2630 HG2 GLU C 261 17.527 38.593 2.206 1.00 0.00 H ATOM 2631 HG3 GLU C 261 17.314 37.551 0.780 1.00 0.00 H ATOM 2632 H GLU C 261 19.506 37.182 -0.667 1.00 0.00 H ATOM 2633 N GLY C 262 22.148 36.906 1.254 1.00 42.19 N ATOM 2634 CA GLY C 262 23.488 36.579 1.707 1.00 42.19 C ATOM 2635 C GLY C 262 24.523 37.666 1.529 1.00 42.19 C ATOM 2636 O GLY C 262 25.034 38.197 2.508 1.00 33.05 O ATOM 2637 HA3 GLY C 262 23.824 35.702 1.154 1.00 0.00 H ATOM 2638 HA2 GLY C 262 23.434 36.338 2.769 1.00 0.00 H ATOM 2639 H GLY C 262 21.693 36.303 0.539 1.00 0.00 H ATOM 2640 N VAL C 263 24.814 38.026 0.285 1.00 37.22 N ATOM 2641 CA VAL C 263 25.816 39.051 0.009 1.00 37.22 C ATOM 2642 C VAL C 263 25.517 40.382 0.686 1.00 37.22 C ATOM 2643 O VAL C 263 26.431 41.058 1.131 1.00 28.32 O ATOM 2644 CB VAL C 263 26.017 39.257 -1.511 1.00 28.32 C ATOM 2645 CG1 VAL C 263 27.065 40.327 -1.773 1.00 28.32 C ATOM 2646 CG2 VAL C 263 26.465 37.961 -2.148 1.00 28.32 C ATOM 2647 HA VAL C 263 26.744 38.675 0.439 1.00 0.00 H ATOM 2648 HB VAL C 263 25.068 39.575 -1.942 1.00 0.00 H ATOM 2649 HG11 VAL C 263 26.741 41.268 -1.329 1.00 0.00 H ATOM 2650 HG12 VAL C 263 28.013 40.022 -1.329 1.00 0.00 H ATOM 2651 HG13 VAL C 263 27.190 40.455 -2.848 1.00 0.00 H ATOM 2652 HG21 VAL C 263 27.406 37.643 -1.699 1.00 0.00 H ATOM 2653 HG22 VAL C 263 25.706 37.196 -1.984 1.00 0.00 H ATOM 2654 HG23 VAL C 263 26.605 38.113 -3.218 1.00 0.00 H ATOM 2655 H VAL C 263 24.319 37.569 -0.508 1.00 0.00 H ATOM 2656 N ALA C 264 24.243 40.723 0.823 1.00 25.54 N ATOM 2657 CA ALA C 264 23.850 41.982 1.455 1.00 25.54 C ATOM 2658 C ALA C 264 24.340 42.116 2.896 1.00 25.54 C ATOM 2659 O ALA C 264 24.402 43.223 3.438 1.00 88.09 O ATOM 2660 CB ALA C 264 22.341 42.138 1.407 1.00 88.09 C ATOM 2661 HA ALA C 264 24.331 42.778 0.886 1.00 0.00 H ATOM 2662 HB1 ALA C 264 22.010 42.139 0.368 1.00 0.00 H ATOM 2663 HB2 ALA C 264 21.874 41.308 1.938 1.00 0.00 H ATOM 2664 HB3 ALA C 264 22.059 43.079 1.880 1.00 0.00 H ATOM 2665 H ALA C 264 23.505 40.079 0.472 1.00 0.00 H ATOM 2666 N GLN C 265 24.639 40.980 3.524 1.00 39.15 N ATOM 2667 CA GLN C 265 25.118 40.950 4.904 1.00 39.15 C ATOM 2668 C GLN C 265 26.639 40.942 4.951 1.00 39.15 C ATOM 2669 O GLN C 265 27.235 40.985 6.027 1.00 73.43 O ATOM 2670 CB GLN C 265 24.599 39.705 5.623 1.00 73.43 C ATOM 2671 CG GLN C 265 23.090 39.634 5.771 1.00 73.43 C ATOM 2672 CD GLN C 265 22.623 38.289 6.310 1.00 73.43 C ATOM 2673 OE1 GLN C 265 22.937 37.908 7.443 1.00 73.43 O ATOM 2674 NE2 GLN C 265 21.870 37.561 5.494 1.00 73.43 N ATOM 2675 HA GLN C 265 24.746 41.846 5.401 1.00 0.00 H ATOM 2676 HB2 GLN C 265 24.926 38.829 5.063 1.00 0.00 H ATOM 2677 HB3 GLN C 265 25.039 39.682 6.620 1.00 0.00 H ATOM 2678 HG2 GLN C 265 22.768 40.417 6.457 1.00 0.00 H ATOM 2679 HG3 GLN C 265 22.634 39.798 4.795 1.00 0.00 H ATOM 2680 HE22 GLN C 265 21.630 37.921 4.548 1.00 0.00 H ATOM 2681 HE21 GLN C 265 21.520 36.631 5.801 1.00 0.00 H ATOM 2682 H GLN C 265 24.527 40.081 3.013 1.00 0.00 H ATOM 2683 N MET C 266 27.257 40.834 3.783 1.00 38.89 N ATOM 2684 CA MET C 266 28.704 40.809 3.679 1.00 38.89 C ATOM 2685 C MET C 266 29.292 42.204 3.547 1.00 38.89 C ATOM 2686 O MET C 266 28.639 43.128 3.062 1.00 50.21 O ATOM 2687 CB MET C 266 29.142 39.969 2.476 1.00 50.21 C ATOM 2688 CG MET C 266 29.084 38.473 2.690 1.00 50.21 C ATOM 2689 SD MET C 266 29.847 37.573 1.325 1.00 50.21 S ATOM 2690 CE MET C 266 28.529 36.435 0.923 1.00 50.21 C ATOM 2691 HA MET C 266 29.077 40.364 4.601 1.00 0.00 H ATOM 2692 HB2 MET C 266 28.494 40.217 1.635 1.00 0.00 H ATOM 2693 HB3 MET C 266 30.170 40.237 2.232 1.00 0.00 H ATOM 2694 HG2 MET C 266 28.041 38.168 2.775 1.00 0.00 H ATOM 2695 HG3 MET C 266 29.609 38.227 3.613 1.00 0.00 H ATOM 2696 HE1 MET C 266 28.308 35.816 1.792 1.00 0.00 H ATOM 2697 HE2 MET C 266 27.639 36.997 0.640 1.00 0.00 H ATOM 2698 HE3 MET C 266 28.839 35.800 0.093 1.00 0.00 H ATOM 2699 H MET C 266 26.688 40.765 2.915 1.00 0.00 H ATOM 2700 N SER C 267 30.540 42.346 3.973 1.00 30.02 N ATOM 2701 CA SER C 267 31.232 43.618 3.891 1.00 30.02 C ATOM 2702 C SER C 267 32.359 43.454 2.883 1.00 30.02 C ATOM 2703 O SER C 267 32.882 42.352 2.718 1.00 37.45 O ATOM 2704 CB SER C 267 31.768 44.006 5.264 1.00 37.45 C ATOM 2705 OG SER C 267 32.310 42.885 5.939 1.00 37.45 O ATOM 2706 HA SER C 267 30.561 44.414 3.570 1.00 0.00 H ATOM 2707 HB2 SER C 267 30.954 44.420 5.859 1.00 0.00 H ATOM 2708 HB3 SER C 267 32.547 44.759 5.142 1.00 0.00 H ATOM 2709 HG SER C 267 31.605 42.200 6.057 1.00 0.00 H ATOM 2710 H SER C 267 31.035 41.525 4.376 1.00 0.00 H ATOM 2711 N VAL C 268 32.741 44.541 2.218 1.00 20.63 N ATOM 2712 CA VAL C 268 33.798 44.492 1.201 1.00 20.63 C ATOM 2713 C VAL C 268 35.076 43.807 1.682 1.00 20.63 C ATOM 2714 O VAL C 268 35.618 44.166 2.725 1.00 24.36 O ATOM 2715 CB VAL C 268 34.169 45.893 0.683 1.00 24.36 C ATOM 2716 CG1 VAL C 268 34.917 45.784 -0.628 1.00 24.36 C ATOM 2717 CG2 VAL C 268 32.937 46.729 0.495 1.00 24.36 C ATOM 2718 HA VAL C 268 33.369 43.897 0.395 1.00 0.00 H ATOM 2719 HB VAL C 268 34.810 46.373 1.422 1.00 0.00 H ATOM 2720 HG11 VAL C 268 35.828 45.205 -0.478 1.00 0.00 H ATOM 2721 HG12 VAL C 268 34.286 45.286 -1.364 1.00 0.00 H ATOM 2722 HG13 VAL C 268 35.173 46.782 -0.983 1.00 0.00 H ATOM 2723 HG21 VAL C 268 32.279 46.247 -0.228 1.00 0.00 H ATOM 2724 HG22 VAL C 268 32.419 46.830 1.449 1.00 0.00 H ATOM 2725 HG23 VAL C 268 33.221 47.715 0.128 1.00 0.00 H ATOM 2726 H VAL C 268 32.278 45.449 2.424 1.00 0.00 H ATOM 2727 N GLY C 269 35.528 42.807 0.925 1.00 25.77 N ATOM 2728 CA GLY C 269 36.741 42.076 1.255 1.00 25.77 C ATOM 2729 C GLY C 269 36.497 40.767 1.977 1.00 25.77 C ATOM 2730 O GLY C 269 37.409 39.952 2.135 1.00 35.01 O ATOM 2731 HA3 GLY C 269 37.360 42.708 1.892 1.00 0.00 H ATOM 2732 HA2 GLY C 269 37.275 41.862 0.329 1.00 0.00 H ATOM 2733 H GLY C 269 34.996 42.541 0.072 1.00 0.00 H ATOM 2734 N GLN C 270 35.250 40.564 2.391 1.00 25.90 N ATOM 2735 CA GLN C 270 34.847 39.375 3.125 1.00 25.90 C ATOM 2736 C GLN C 270 34.610 38.171 2.227 1.00 25.90 C ATOM 2737 O GLN C 270 34.249 38.311 1.057 1.00 44.63 O ATOM 2738 CB GLN C 270 33.587 39.682 3.948 1.00 44.63 C ATOM 2739 CG GLN C 270 33.088 38.554 4.848 1.00 44.63 C ATOM 2740 CD GLN C 270 31.911 38.969 5.719 1.00 44.63 C ATOM 2741 OE1 GLN C 270 31.454 40.116 5.674 1.00 44.63 O ATOM 2742 NE2 GLN C 270 31.422 38.039 6.525 1.00 44.63 N ATOM 2743 HA GLN C 270 35.672 39.109 3.785 1.00 0.00 H ATOM 2744 HB2 GLN C 270 33.802 40.544 4.580 1.00 0.00 H ATOM 2745 HB3 GLN C 270 32.786 39.934 3.252 1.00 0.00 H ATOM 2746 HG2 GLN C 270 32.779 37.718 4.220 1.00 0.00 H ATOM 2747 HG3 GLN C 270 33.906 38.237 5.495 1.00 0.00 H ATOM 2748 HE22 GLN C 270 31.837 37.085 6.531 1.00 0.00 H ATOM 2749 HE21 GLN C 270 30.623 38.262 7.152 1.00 0.00 H ATOM 2750 H GLN C 270 34.532 41.286 2.181 1.00 0.00 H ATOM 2751 N ARG C 271 34.846 36.991 2.787 1.00 30.29 N ATOM 2752 CA ARG C 271 34.642 35.735 2.086 1.00 30.29 C ATOM 2753 C ARG C 271 33.869 34.839 3.040 1.00 30.29 C ATOM 2754 O ARG C 271 34.272 34.659 4.196 1.00 42.70 O ATOM 2755 CB ARG C 271 35.975 35.089 1.723 1.00 42.70 C ATOM 2756 CG ARG C 271 35.814 33.867 0.852 1.00 42.70 C ATOM 2757 CD ARG C 271 37.144 33.274 0.447 1.00 42.70 C ATOM 2758 NE ARG C 271 36.980 32.394 -0.704 1.00 42.70 N ATOM 2759 CZ ARG C 271 37.959 31.689 -1.253 1.00 42.70 C ATOM 2760 NH1 ARG C 271 39.184 31.756 -0.758 1.00 42.70 N ATOM 2761 NH2 ARG C 271 37.714 30.921 -2.304 1.00 42.70 N ATOM 2762 HA ARG C 271 34.101 35.894 1.153 1.00 0.00 H ATOM 2763 HB2 ARG C 271 36.583 35.820 1.190 1.00 0.00 H ATOM 2764 HB3 ARG C 271 36.483 34.797 2.642 1.00 0.00 H ATOM 2765 HG2 ARG C 271 35.248 33.116 1.402 1.00 0.00 H ATOM 2766 HG3 ARG C 271 35.266 34.147 -0.048 1.00 0.00 H ATOM 2767 HD2 ARG C 271 37.551 32.703 1.281 1.00 0.00 H ATOM 2768 HD3 ARG C 271 37.832 34.079 0.189 1.00 0.00 H ATOM 2769 HE ARG C 271 36.031 32.314 -1.122 1.00 0.00 H ATOM 2770 HH12 ARG C 271 39.951 31.202 -1.190 1.00 0.00 H ATOM 2771 HH11 ARG C 271 39.380 32.363 0.064 1.00 0.00 H ATOM 2772 HH22 ARG C 271 38.482 30.368 -2.734 1.00 0.00 H ATOM 2773 HH21 ARG C 271 36.753 30.871 -2.699 1.00 0.00 H ATOM 2774 H ARG C 271 35.191 36.964 3.768 1.00 0.00 H ATOM 2775 N ALA C 272 32.760 34.283 2.568 1.00 30.48 N ATOM 2776 CA ALA C 272 31.938 33.443 3.425 1.00 30.48 C ATOM 2777 C ALA C 272 31.348 32.240 2.735 1.00 30.48 C ATOM 2778 O ALA C 272 31.295 32.170 1.506 1.00 43.00 O ATOM 2779 CB ALA C 272 30.828 34.271 4.059 1.00 43.00 C ATOM 2780 HA ALA C 272 32.610 33.052 4.189 1.00 0.00 H ATOM 2781 HB1 ALA C 272 31.268 35.070 4.656 1.00 0.00 H ATOM 2782 HB2 ALA C 272 30.205 34.702 3.275 1.00 0.00 H ATOM 2783 HB3 ALA C 272 30.219 33.632 4.698 1.00 0.00 H ATOM 2784 H ALA C 272 32.478 34.449 1.581 1.00 0.00 H ATOM 2785 N LYS C 273 30.879 31.312 3.557 1.00 41.99 N ATOM 2786 CA LYS C 273 30.276 30.083 3.090 1.00 41.99 C ATOM 2787 C LYS C 273 28.768 30.223 3.196 1.00 41.99 C ATOM 2788 O LYS C 273 28.199 30.082 4.282 1.00 73.68 O ATOM 2789 CB LYS C 273 30.754 28.924 3.957 1.00 73.68 C ATOM 2790 CG LYS C 273 30.932 27.627 3.210 1.00 73.68 C ATOM 2791 CD LYS C 273 31.499 26.564 4.130 1.00 73.68 C ATOM 2792 CE LYS C 273 30.477 26.095 5.155 1.00 73.68 C ATOM 2793 NZ LYS C 273 29.357 25.352 4.503 1.00 73.68 N ATOM 2794 HA LYS C 273 30.559 29.888 2.056 1.00 0.00 H ATOM 2795 HB2 LYS C 273 31.712 29.199 4.398 1.00 0.00 H ATOM 2796 HB3 LYS C 273 30.023 28.765 4.749 1.00 0.00 H ATOM 2797 HG2 LYS C 273 29.966 27.295 2.829 1.00 0.00 H ATOM 2798 HG3 LYS C 273 31.616 27.783 2.376 1.00 0.00 H ATOM 2799 HD2 LYS C 273 31.814 25.710 3.530 1.00 0.00 H ATOM 2800 HD3 LYS C 273 32.361 26.975 4.655 1.00 0.00 H ATOM 2801 HE2 LYS C 273 30.072 26.963 5.676 1.00 0.00 H ATOM 2802 HE3 LYS C 273 30.969 25.438 5.873 1.00 0.00 H ATOM 2803 HZ1 LYS C 273 28.880 25.975 3.820 1.00 0.00 H ATOM 2804 HZ2 LYS C 273 29.736 24.520 4.008 1.00 0.00 H ATOM 2805 HZ3 LYS C 273 28.677 25.046 5.228 1.00 0.00 H ATOM 2806 H LYS C 273 30.948 31.475 4.582 1.00 0.00 H ATOM 2807 N LEU C 274 28.140 30.593 2.083 1.00 43.38 N ATOM 2808 CA LEU C 274 26.693 30.748 2.024 1.00 43.38 C ATOM 2809 C LEU C 274 26.040 29.400 1.801 1.00 43.38 C ATOM 2810 O LEU C 274 26.260 28.754 0.773 1.00 28.74 O ATOM 2811 CB LEU C 274 26.283 31.678 0.884 1.00 28.74 C ATOM 2812 CG LEU C 274 26.532 33.168 1.040 1.00 28.74 C ATOM 2813 CD1 LEU C 274 26.102 33.888 -0.217 1.00 28.74 C ATOM 2814 CD2 LEU C 274 25.750 33.680 2.219 1.00 28.74 C ATOM 2815 HA LEU C 274 26.367 31.178 2.971 1.00 0.00 H ATOM 2816 HB2 LEU C 274 26.821 31.353 -0.006 1.00 0.00 H ATOM 2817 HB3 LEU C 274 25.212 31.545 0.729 1.00 0.00 H ATOM 2818 HG LEU C 274 27.594 33.348 1.206 1.00 0.00 H ATOM 2819 HD21 LEU C 274 24.687 33.502 2.054 1.00 0.00 H ATOM 2820 HD22 LEU C 274 26.071 33.159 3.121 1.00 0.00 H ATOM 2821 HD23 LEU C 274 25.927 34.749 2.334 1.00 0.00 H ATOM 2822 HD11 LEU C 274 26.675 33.511 -1.064 1.00 0.00 H ATOM 2823 HD12 LEU C 274 25.040 33.714 -0.389 1.00 0.00 H ATOM 2824 HD13 LEU C 274 26.282 34.957 -0.102 1.00 0.00 H ATOM 2825 H LEU C 274 28.701 30.778 1.227 1.00 0.00 H ATOM 2826 N THR C 275 25.267 28.953 2.778 1.00 52.25 N ATOM 2827 CA THR C 275 24.566 27.690 2.644 1.00 52.25 C ATOM 2828 C THR C 275 23.107 28.078 2.410 1.00 52.25 C ATOM 2829 O THR C 275 22.409 28.522 3.327 1.00 53.15 O ATOM 2830 CB THR C 275 24.720 26.808 3.896 1.00 53.15 C ATOM 2831 OG1 THR C 275 26.107 26.703 4.251 1.00 53.15 O ATOM 2832 CG2 THR C 275 24.179 25.419 3.615 1.00 53.15 C ATOM 2833 HA THR C 275 24.969 27.091 1.827 1.00 0.00 H ATOM 2834 HB THR C 275 24.164 27.262 4.716 1.00 0.00 H ATOM 2835 HG1 THR C 275 26.198 26.135 5.056 1.00 0.00 H ATOM 2836 HG23 THR C 275 23.125 25.489 3.344 1.00 0.00 H ATOM 2837 HG21 THR C 275 24.738 24.972 2.793 1.00 0.00 H ATOM 2838 HG22 THR C 275 24.286 24.801 4.507 1.00 0.00 H ATOM 2839 H THR C 275 25.161 29.512 3.649 1.00 0.00 H ATOM 2840 N ILE C 276 22.686 27.984 1.154 1.00 50.00 N ATOM 2841 CA ILE C 276 21.341 28.355 0.739 1.00 50.00 C ATOM 2842 C ILE C 276 20.367 27.179 0.686 1.00 50.00 C ATOM 2843 O ILE C 276 20.578 26.206 -0.050 1.00 46.70 O ATOM 2844 CB ILE C 276 21.390 29.076 -0.631 1.00 46.70 C ATOM 2845 CG1 ILE C 276 22.293 30.312 -0.526 1.00 46.70 C ATOM 2846 CG2 ILE C 276 19.995 29.468 -1.082 1.00 46.70 C ATOM 2847 CD1 ILE C 276 22.599 30.988 -1.844 1.00 46.70 C ATOM 2848 HA ILE C 276 20.957 29.030 1.504 1.00 0.00 H ATOM 2849 HB ILE C 276 21.802 28.396 -1.376 1.00 0.00 H ATOM 2850 HG12 ILE C 276 21.801 31.038 0.121 1.00 0.00 H ATOM 2851 HG13 ILE C 276 23.237 30.005 -0.075 1.00 0.00 H ATOM 2852 HD11 ILE C 276 23.106 30.283 -2.503 1.00 0.00 H ATOM 2853 HD12 ILE C 276 21.669 31.316 -2.307 1.00 0.00 H ATOM 2854 HD13 ILE C 276 23.243 31.850 -1.668 1.00 0.00 H ATOM 2855 HG21 ILE C 276 19.380 28.573 -1.176 1.00 0.00 H ATOM 2856 HG22 ILE C 276 19.552 30.139 -0.346 1.00 0.00 H ATOM 2857 HG23 ILE C 276 20.055 29.973 -2.046 1.00 0.00 H ATOM 2858 H ILE C 276 23.347 27.629 0.434 1.00 0.00 H ATOM 2859 N SER C 277 19.316 27.266 1.500 1.00 89.97 N ATOM 2860 CA SER C 277 18.286 26.235 1.559 1.00 89.97 C ATOM 2861 C SER C 277 17.536 26.175 0.225 1.00 89.97 C ATOM 2862 O SER C 277 17.329 27.207 -0.420 1.00 72.62 O ATOM 2863 CB SER C 277 17.326 26.502 2.731 1.00 72.62 C ATOM 2864 OG SER C 277 16.926 27.867 2.809 1.00 72.62 O ATOM 2865 HA SER C 277 18.755 25.266 1.731 1.00 0.00 H ATOM 2866 HB2 SER C 277 17.825 26.230 3.661 1.00 0.00 H ATOM 2867 HB3 SER C 277 16.437 25.884 2.603 1.00 0.00 H ATOM 2868 HG SER C 277 17.726 28.437 2.933 1.00 0.00 H ATOM 2869 H SER C 277 19.227 28.099 2.116 1.00 0.00 H ATOM 2870 N PRO C 278 17.067 24.974 -0.168 1.00 60.91 N ATOM 2871 CA PRO C 278 16.335 24.729 -1.417 1.00 60.91 C ATOM 2872 C PRO C 278 15.330 25.794 -1.828 1.00 60.91 C ATOM 2873 O PRO C 278 15.310 26.212 -2.985 1.00 80.56 O ATOM 2874 CB PRO C 278 15.650 23.395 -1.148 1.00 80.56 C ATOM 2875 CG PRO C 278 16.666 22.677 -0.339 1.00 80.56 C ATOM 2876 CD PRO C 278 17.106 23.745 0.649 1.00 80.56 C ATOM 2877 HA PRO C 278 17.020 24.739 -2.265 1.00 0.00 H ATOM 2878 HD3 PRO C 278 16.417 23.810 1.491 1.00 0.00 H ATOM 2879 HD2 PRO C 278 18.113 23.549 1.018 1.00 0.00 H ATOM 2880 HG3 PRO C 278 17.499 22.343 -0.957 1.00 0.00 H ATOM 2881 HG2 PRO C 278 16.229 21.820 0.174 1.00 0.00 H ATOM 2882 HB2 PRO C 278 14.724 23.532 -0.589 1.00 0.00 H ATOM 2883 HB3 PRO C 278 15.438 22.865 -2.077 1.00 0.00 H ATOM 2884 N ASP C 279 14.516 26.251 -0.884 1.00 43.68 N ATOM 2885 CA ASP C 279 13.503 27.262 -1.183 1.00 43.68 C ATOM 2886 C ASP C 279 14.056 28.630 -1.584 1.00 43.68 C ATOM 2887 O ASP C 279 13.344 29.434 -2.187 1.00 71.60 O ATOM 2888 CB ASP C 279 12.494 27.392 -0.020 1.00 71.60 C ATOM 2889 CG ASP C 279 13.093 28.010 1.241 1.00 71.60 C ATOM 2890 OD1 ASP C 279 14.134 27.527 1.735 1.00 71.60 O ATOM 2891 OD2 ASP C 279 12.485 28.966 1.763 1.00 71.60 O ATOM 2892 HA ASP C 279 12.990 26.895 -2.072 1.00 0.00 H ATOM 2893 HB2 ASP C 279 11.665 28.018 -0.351 1.00 0.00 H ATOM 2894 HB3 ASP C 279 12.121 26.398 0.226 1.00 0.00 H ATOM 2895 H ASP C 279 14.600 25.883 0.085 1.00 0.00 H ATOM 2896 N TYR C 280 15.322 28.883 -1.255 1.00 73.46 N ATOM 2897 CA TYR C 280 15.967 30.155 -1.576 1.00 73.46 C ATOM 2898 C TYR C 280 16.854 30.106 -2.820 1.00 73.46 C ATOM 2899 O TYR C 280 17.481 31.105 -3.191 1.00 91.33 O ATOM 2900 CB TYR C 280 16.768 30.673 -0.376 1.00 91.33 C ATOM 2901 CG TYR C 280 15.933 31.415 0.649 1.00 91.33 C ATOM 2902 CD1 TYR C 280 15.441 32.695 0.381 1.00 91.33 C ATOM 2903 CD2 TYR C 280 15.622 30.838 1.879 1.00 91.33 C ATOM 2904 CE1 TYR C 280 14.661 33.381 1.312 1.00 91.33 C ATOM 2905 CE2 TYR C 280 14.841 31.516 2.817 1.00 91.33 C ATOM 2906 CZ TYR C 280 14.365 32.786 2.527 1.00 91.33 C ATOM 2907 OH TYR C 280 13.600 33.453 3.456 1.00 91.33 O ATOM 2908 HA TYR C 280 15.157 30.846 -1.807 1.00 0.00 H ATOM 2909 HB3 TYR C 280 17.539 31.349 -0.745 1.00 0.00 H ATOM 2910 HB2 TYR C 280 17.238 29.821 0.116 1.00 0.00 H ATOM 2911 HD2 TYR C 280 15.995 29.841 2.113 1.00 0.00 H ATOM 2912 HE2 TYR C 280 14.606 31.049 3.774 1.00 0.00 H ATOM 2913 HE1 TYR C 280 14.287 34.379 1.085 1.00 0.00 H ATOM 2914 HD1 TYR C 280 15.671 33.167 -0.574 1.00 0.00 H ATOM 2915 HH TYR C 280 13.343 34.339 3.096 1.00 0.00 H ATOM 2916 H TYR C 280 15.868 28.153 -0.754 1.00 0.00 H ATOM 2917 N ALA C 281 16.915 28.941 -3.452 1.00 41.14 N ATOM 2918 CA ALA C 281 17.710 28.767 -4.657 1.00 41.14 C ATOM 2919 C ALA C 281 16.782 28.466 -5.824 1.00 41.14 C ATOM 2920 O ALA C 281 16.202 29.372 -6.422 1.00 40.42 O ATOM 2921 CB ALA C 281 18.712 27.633 -4.463 1.00 40.42 C ATOM 2922 HA ALA C 281 18.266 29.681 -4.867 1.00 0.00 H ATOM 2923 HB1 ALA C 281 19.372 27.872 -3.629 1.00 0.00 H ATOM 2924 HB2 ALA C 281 18.176 26.708 -4.250 1.00 0.00 H ATOM 2925 HB3 ALA C 281 19.302 27.512 -5.372 1.00 0.00 H ATOM 2926 H ALA C 281 16.381 28.132 -3.076 1.00 0.00 H ATOM 2927 N TYR C 282 16.640 27.183 -6.127 1.00 67.95 N ATOM 2928 CA TYR C 282 15.784 26.718 -7.202 1.00 67.95 C ATOM 2929 C TYR C 282 14.836 25.751 -6.509 1.00 67.95 C ATOM 2930 O TYR C 282 13.643 26.022 -6.384 1.00 63.49 O ATOM 2931 CB TYR C 282 16.619 25.993 -8.255 1.00 63.49 C ATOM 2932 CG TYR C 282 17.791 26.803 -8.757 1.00 63.49 C ATOM 2933 CD1 TYR C 282 17.632 27.737 -9.779 1.00 63.49 C ATOM 2934 CD2 TYR C 282 19.062 26.637 -8.212 1.00 63.49 C ATOM 2935 CE1 TYR C 282 18.715 28.489 -10.247 1.00 63.49 C ATOM 2936 CE2 TYR C 282 20.151 27.381 -8.672 1.00 63.49 C ATOM 2937 CZ TYR C 282 19.972 28.305 -9.690 1.00 63.49 C ATOM 2938 OH TYR C 282 21.049 29.024 -10.160 1.00 63.49 O ATOM 2939 HA TYR C 282 15.261 27.523 -7.718 1.00 0.00 H ATOM 2940 HB3 TYR C 282 15.976 25.755 -9.102 1.00 0.00 H ATOM 2941 HB2 TYR C 282 16.999 25.069 -7.818 1.00 0.00 H ATOM 2942 HD2 TYR C 282 19.210 25.913 -7.411 1.00 0.00 H ATOM 2943 HE2 TYR C 282 21.138 27.236 -8.232 1.00 0.00 H ATOM 2944 HE1 TYR C 282 18.572 29.216 -11.046 1.00 0.00 H ATOM 2945 HD1 TYR C 282 16.647 27.884 -10.221 1.00 0.00 H ATOM 2946 HH TYR C 282 20.749 29.634 -10.880 1.00 0.00 H ATOM 2947 H TYR C 282 17.165 26.479 -5.570 1.00 0.00 H ATOM 2948 N GLY C 283 15.393 24.644 -6.022 1.00114.38 N ATOM 2949 CA GLY C 283 14.615 23.654 -5.297 1.00114.38 C ATOM 2950 C GLY C 283 13.429 23.032 -6.003 1.00114.38 C ATOM 2951 O GLY C 283 13.450 21.833 -6.298 1.00 51.87 O ATOM 2952 HA3 GLY C 283 14.240 24.133 -4.393 1.00 0.00 H ATOM 2953 HA2 GLY C 283 15.292 22.845 -5.024 1.00 0.00 H ATOM 2954 H GLY C 283 16.411 24.484 -6.164 1.00 0.00 H ATOM 2955 N ALA C 284 12.372 23.816 -6.196 1.00156.12 N ATOM 2956 CA ALA C 284 11.161 23.347 -6.862 1.00156.12 C ATOM 2957 C ALA C 284 11.494 22.764 -8.240 1.00156.12 C ATOM 2958 O ALA C 284 11.673 21.544 -8.392 1.00 37.31 O ATOM 2959 CB ALA C 284 10.144 24.500 -6.990 1.00 37.31 C ATOM 2960 HA ALA C 284 10.716 22.556 -6.258 1.00 0.00 H ATOM 2961 HB1 ALA C 284 9.887 24.868 -5.997 1.00 0.00 H ATOM 2962 HB2 ALA C 284 10.584 25.308 -7.575 1.00 0.00 H ATOM 2963 HB3 ALA C 284 9.245 24.137 -7.489 1.00 0.00 H ATOM 2964 H ALA C 284 12.410 24.799 -5.860 1.00 0.00 H ATOM 2965 N THR C 285 11.646 23.650 -9.219 1.00 63.73 N ATOM 2966 CA THR C 285 11.949 23.257 -10.586 1.00 63.73 C ATOM 2967 C THR C 285 13.378 22.744 -10.768 1.00 63.73 C ATOM 2968 O THR C 285 13.684 22.050 -11.744 1.00106.11 O ATOM 2969 CB THR C 285 11.682 24.438 -11.551 1.00106.11 C ATOM 2970 OG1 THR C 285 12.392 25.602 -11.102 1.00106.11 O ATOM 2971 CG2 THR C 285 10.191 24.762 -11.588 1.00106.11 C ATOM 2972 HA THR C 285 11.287 22.424 -10.822 1.00 0.00 H ATOM 2973 HB THR C 285 12.021 24.153 -12.547 1.00 0.00 H ATOM 2974 HG1 THR C 285 12.084 25.845 -10.193 1.00 0.00 H ATOM 2975 HG23 THR C 285 9.638 23.886 -11.928 1.00 0.00 H ATOM 2976 HG21 THR C 285 9.856 25.040 -10.589 1.00 0.00 H ATOM 2977 HG22 THR C 285 10.018 25.591 -12.274 1.00 0.00 H ATOM 2978 H THR C 285 11.545 24.661 -8.999 1.00 0.00 H ATOM 2979 N GLY C 286 14.237 23.050 -9.801 1.00 94.73 N ATOM 2980 CA GLY C 286 15.628 22.641 -9.885 1.00 94.73 C ATOM 2981 C GLY C 286 16.274 23.483 -10.967 1.00 94.73 C ATOM 2982 O GLY C 286 15.958 24.668 -11.111 1.00110.85 O ATOM 2983 HA3 GLY C 286 15.693 21.584 -10.144 1.00 0.00 H ATOM 2984 HA2 GLY C 286 16.127 22.811 -8.931 1.00 0.00 H ATOM 2985 H GLY C 286 13.909 23.589 -8.974 1.00 0.00 H ATOM 2986 N HIS C 287 17.185 22.892 -11.723 1.00 46.99 N ATOM 2987 CA HIS C 287 17.835 23.611 -12.807 1.00 46.99 C ATOM 2988 C HIS C 287 18.456 22.632 -13.781 1.00 46.99 C ATOM 2989 O HIS C 287 19.507 22.042 -13.499 1.00 76.41 O ATOM 2990 CB HIS C 287 18.895 24.572 -12.287 1.00 76.41 C ATOM 2991 CG HIS C 287 19.535 25.390 -13.365 1.00 76.41 C ATOM 2992 ND1 HIS C 287 18.961 26.544 -13.857 1.00 76.41 N ATOM 2993 CD2 HIS C 287 20.683 25.215 -14.060 1.00 76.41 C ATOM 2994 CE1 HIS C 287 19.732 27.045 -14.809 1.00 76.41 C ATOM 2995 NE2 HIS C 287 20.782 26.255 -14.950 1.00 76.41 N ATOM 2996 HA HIS C 287 17.074 24.199 -13.319 1.00 0.00 H ATOM 2997 HB2 HIS C 287 18.428 25.248 -11.571 1.00 0.00 H ATOM 2998 HB3 HIS C 287 19.671 23.993 -11.785 1.00 0.00 H ATOM 2999 HD2 HIS C 287 21.396 24.400 -13.936 1.00 0.00 H ATOM 3000 HE1 HIS C 287 19.535 27.953 -15.379 1.00 0.00 H ATOM 3001 H HIS C 287 17.439 21.900 -11.540 1.00 0.00 H ATOM 3002 N PRO C 288 17.841 22.495 -14.971 1.00 21.89 N ATOM 3003 CA PRO C 288 18.261 21.605 -16.051 1.00 21.89 C ATOM 3004 C PRO C 288 19.764 21.565 -16.225 1.00 21.89 C ATOM 3005 O PRO C 288 20.381 22.588 -16.529 1.00 89.56 O ATOM 3006 CB PRO C 288 17.578 22.216 -17.267 1.00 89.56 C ATOM 3007 CG PRO C 288 16.293 22.677 -16.701 1.00 89.56 C ATOM 3008 CD PRO C 288 16.714 23.340 -15.409 1.00 89.56 C ATOM 3009 HA PRO C 288 17.990 20.566 -15.867 1.00 0.00 H ATOM 3010 HD3 PRO C 288 17.034 24.368 -15.579 1.00 0.00 H ATOM 3011 HD2 PRO C 288 15.905 23.329 -14.678 1.00 0.00 H ATOM 3012 HG3 PRO C 288 15.623 21.838 -16.512 1.00 0.00 H ATOM 3013 HG2 PRO C 288 15.803 23.388 -17.366 1.00 0.00 H ATOM 3014 HB2 PRO C 288 18.155 23.049 -17.669 1.00 0.00 H ATOM 3015 HB3 PRO C 288 17.422 21.473 -18.049 1.00 0.00 H ATOM 3016 N GLY C 289 20.360 20.408 -15.952 1.00 38.76 N ATOM 3017 CA GLY C 289 21.793 20.267 -16.128 1.00 38.76 C ATOM 3018 C GLY C 289 22.606 19.812 -14.936 1.00 38.76 C ATOM 3019 O GLY C 289 22.946 18.633 -14.829 1.00104.62 O ATOM 3020 HA3 GLY C 289 22.181 21.238 -16.435 1.00 0.00 H ATOM 3021 HA2 GLY C 289 21.954 19.544 -16.927 1.00 0.00 H ATOM 3022 H GLY C 289 19.797 19.602 -15.611 1.00 0.00 H ATOM 3023 N ILE C 290 22.917 20.745 -14.039 1.00 63.19 N ATOM 3024 CA ILE C 290 23.733 20.448 -12.864 1.00 63.19 C ATOM 3025 C ILE C 290 23.051 20.652 -11.524 1.00 63.19 C ATOM 3026 O ILE C 290 23.616 20.313 -10.483 1.00119.52 O ATOM 3027 CB ILE C 290 25.033 21.275 -12.862 1.00119.52 C ATOM 3028 CG1 ILE C 290 24.796 22.633 -13.532 1.00119.52 C ATOM 3029 CG2 ILE C 290 26.158 20.488 -13.515 1.00119.52 C ATOM 3030 CD1 ILE C 290 26.046 23.481 -13.686 1.00119.52 C ATOM 3031 HA ILE C 290 23.933 19.381 -12.962 1.00 0.00 H ATOM 3032 HB ILE C 290 25.339 21.474 -11.835 1.00 0.00 H ATOM 3033 HG12 ILE C 290 24.379 22.457 -14.523 1.00 0.00 H ATOM 3034 HG13 ILE C 290 24.077 23.190 -12.931 1.00 0.00 H ATOM 3035 HD11 ILE C 290 26.472 23.680 -12.703 1.00 0.00 H ATOM 3036 HD12 ILE C 290 26.773 22.946 -14.297 1.00 0.00 H ATOM 3037 HD13 ILE C 290 25.787 24.423 -14.169 1.00 0.00 H ATOM 3038 HG21 ILE C 290 26.322 19.564 -12.961 1.00 0.00 H ATOM 3039 HG22 ILE C 290 25.886 20.253 -14.544 1.00 0.00 H ATOM 3040 HG23 ILE C 290 27.070 21.085 -13.506 1.00 0.00 H ATOM 3041 H ILE C 290 22.569 21.715 -14.179 1.00 0.00 H ATOM 3042 N ILE C 291 21.841 21.198 -11.537 1.00 85.57 N ATOM 3043 CA ILE C 291 21.135 21.432 -10.285 1.00 85.57 C ATOM 3044 C ILE C 291 19.875 20.575 -10.139 1.00 85.57 C ATOM 3045 O ILE C 291 18.817 20.907 -10.689 1.00 79.78 O ATOM 3046 CB ILE C 291 20.791 22.937 -10.108 1.00 79.78 C ATOM 3047 CG1 ILE C 291 22.063 23.793 -10.176 1.00 79.78 C ATOM 3048 CG2 ILE C 291 20.054 23.166 -8.786 1.00 79.78 C ATOM 3049 CD1 ILE C 291 23.082 23.501 -9.091 1.00 79.78 C ATOM 3050 HA ILE C 291 21.818 21.129 -9.491 1.00 0.00 H ATOM 3051 HB ILE C 291 20.134 23.239 -10.923 1.00 0.00 H ATOM 3052 HG12 ILE C 291 22.537 23.621 -11.142 1.00 0.00 H ATOM 3053 HG13 ILE C 291 21.772 24.841 -10.096 1.00 0.00 H ATOM 3054 HD11 ILE C 291 22.632 23.680 -8.114 1.00 0.00 H ATOM 3055 HD12 ILE C 291 23.398 22.460 -9.161 1.00 0.00 H ATOM 3056 HD13 ILE C 291 23.946 24.153 -9.220 1.00 0.00 H ATOM 3057 HG21 ILE C 291 19.130 22.588 -8.782 1.00 0.00 H ATOM 3058 HG22 ILE C 291 20.687 22.847 -7.958 1.00 0.00 H ATOM 3059 HG23 ILE C 291 19.822 24.226 -8.680 1.00 0.00 H ATOM 3060 H ILE C 291 21.397 21.459 -12.441 1.00 0.00 H ATOM 3061 N PRO C 292 19.991 19.425 -9.446 1.00 93.73 N ATOM 3062 CA PRO C 292 18.856 18.523 -9.229 1.00 93.73 C ATOM 3063 C PRO C 292 17.855 19.162 -8.261 1.00 93.73 C ATOM 3064 O PRO C 292 18.209 20.066 -7.499 1.00 63.22 O ATOM 3065 CB PRO C 292 19.521 17.277 -8.638 1.00 63.22 C ATOM 3066 CG PRO C 292 20.695 17.829 -7.914 1.00 63.22 C ATOM 3067 CD PRO C 292 21.230 18.842 -8.900 1.00 63.22 C ATOM 3068 HA PRO C 292 18.282 18.297 -10.128 1.00 0.00 H ATOM 3069 HD3 PRO C 292 21.837 19.598 -8.401 1.00 0.00 H ATOM 3070 HD2 PRO C 292 21.819 18.362 -9.681 1.00 0.00 H ATOM 3071 HG3 PRO C 292 21.432 17.053 -7.705 1.00 0.00 H ATOM 3072 HG2 PRO C 292 20.396 18.305 -6.980 1.00 0.00 H ATOM 3073 HB2 PRO C 292 18.847 16.761 -7.954 1.00 0.00 H ATOM 3074 HB3 PRO C 292 19.834 16.590 -9.425 1.00 0.00 H ATOM 3075 N PRO C 293 16.585 18.722 -8.304 1.00 65.53 N ATOM 3076 CA PRO C 293 15.528 19.255 -7.438 1.00 65.53 C ATOM 3077 C PRO C 293 15.808 19.174 -5.942 1.00 65.53 C ATOM 3078 O PRO C 293 16.433 18.226 -5.459 1.00 85.60 O ATOM 3079 CB PRO C 293 14.318 18.404 -7.819 1.00 85.60 C ATOM 3080 CG PRO C 293 14.573 18.101 -9.254 1.00 85.60 C ATOM 3081 CD PRO C 293 16.033 17.729 -9.240 1.00 85.60 C ATOM 3082 HA PRO C 293 15.404 20.327 -7.594 1.00 0.00 H ATOM 3083 HD3 PRO C 293 16.181 16.713 -8.875 1.00 0.00 H ATOM 3084 HD2 PRO C 293 16.478 17.826 -10.230 1.00 0.00 H ATOM 3085 HG3 PRO C 293 14.392 18.974 -9.882 1.00 0.00 H ATOM 3086 HG2 PRO C 293 13.956 17.272 -9.600 1.00 0.00 H ATOM 3087 HB2 PRO C 293 14.276 17.491 -7.225 1.00 0.00 H ATOM 3088 HB3 PRO C 293 13.389 18.961 -7.693 1.00 0.00 H ATOM 3089 N HIS C 294 15.313 20.182 -5.225 1.00 93.66 N ATOM 3090 CA HIS C 294 15.452 20.305 -3.775 1.00 93.66 C ATOM 3091 C HIS C 294 16.888 20.154 -3.299 1.00 93.66 C ATOM 3092 O HIS C 294 17.170 19.493 -2.296 1.00100.30 O ATOM 3093 CB HIS C 294 14.533 19.312 -3.064 1.00100.30 C ATOM 3094 CG HIS C 294 13.086 19.500 -3.390 1.00100.30 C ATOM 3095 ND1 HIS C 294 12.304 20.460 -2.785 1.00100.30 N ATOM 3096 CD2 HIS C 294 12.286 18.878 -4.293 1.00100.30 C ATOM 3097 CE1 HIS C 294 11.087 20.423 -3.299 1.00100.30 C ATOM 3098 NE2 HIS C 294 11.052 19.472 -4.216 1.00100.30 N ATOM 3099 HA HIS C 294 15.150 21.319 -3.515 1.00 0.00 H ATOM 3100 HB2 HIS C 294 14.824 18.303 -3.355 1.00 0.00 H ATOM 3101 HB3 HIS C 294 14.663 19.430 -1.988 1.00 0.00 H ATOM 3102 HD2 HIS C 294 12.571 18.060 -4.955 1.00 0.00 H ATOM 3103 HE1 HIS C 294 10.254 21.067 -3.015 1.00 0.00 H ATOM 3104 H HIS C 294 14.794 20.929 -5.729 1.00 0.00 H ATOM 3105 N ALA C 295 17.789 20.808 -4.018 1.00105.74 N ATOM 3106 CA ALA C 295 19.200 20.760 -3.703 1.00105.74 C ATOM 3107 C ALA C 295 19.575 21.944 -2.825 1.00105.74 C ATOM 3108 O ALA C 295 19.092 23.063 -3.044 1.00 41.16 O ATOM 3109 CB ALA C 295 20.011 20.784 -4.993 1.00 41.16 C ATOM 3110 HA ALA C 295 19.419 19.840 -3.161 1.00 0.00 H ATOM 3111 HB1 ALA C 295 19.745 19.921 -5.604 1.00 0.00 H ATOM 3112 HB2 ALA C 295 19.792 21.700 -5.541 1.00 0.00 H ATOM 3113 HB3 ALA C 295 21.074 20.748 -4.753 1.00 0.00 H ATOM 3114 H ALA C 295 17.472 21.372 -4.832 1.00 0.00 H ATOM 3115 N THR C 296 20.380 21.676 -1.799 1.00 57.40 N ATOM 3116 CA THR C 296 20.857 22.720 -0.899 1.00 57.40 C ATOM 3117 C THR C 296 22.211 23.128 -1.482 1.00 57.40 C ATOM 3118 O THR C 296 23.067 22.271 -1.744 1.00 88.48 O ATOM 3119 CB THR C 296 21.030 22.198 0.546 1.00 88.48 C ATOM 3120 OG1 THR C 296 19.888 21.407 0.912 1.00 88.48 O ATOM 3121 CG2 THR C 296 21.154 23.366 1.524 1.00 88.48 C ATOM 3122 HA THR C 296 20.152 23.548 -0.832 1.00 0.00 H ATOM 3123 HB THR C 296 21.936 21.593 0.590 1.00 0.00 H ATOM 3124 HG1 THR C 296 20.001 21.074 1.837 1.00 0.00 H ATOM 3125 HG23 THR C 296 22.018 23.973 1.255 1.00 0.00 H ATOM 3126 HG21 THR C 296 20.251 23.975 1.477 1.00 0.00 H ATOM 3127 HG22 THR C 296 21.280 22.980 2.535 1.00 0.00 H ATOM 3128 H THR C 296 20.678 20.693 -1.634 1.00 0.00 H ATOM 3129 N LEU C 297 22.387 24.426 -1.708 1.00 46.00 N ATOM 3130 CA LEU C 297 23.608 24.946 -2.314 1.00 46.00 C ATOM 3131 C LEU C 297 24.564 25.629 -1.352 1.00 46.00 C ATOM 3132 O LEU C 297 24.145 26.344 -0.445 1.00 42.96 O ATOM 3133 CB LEU C 297 23.242 25.930 -3.428 1.00 42.96 C ATOM 3134 CG LEU C 297 22.331 25.408 -4.544 1.00 42.96 C ATOM 3135 CD1 LEU C 297 21.978 26.537 -5.482 1.00 42.96 C ATOM 3136 CD2 LEU C 297 23.002 24.270 -5.298 1.00 42.96 C ATOM 3137 HA LEU C 297 24.138 24.073 -2.695 1.00 0.00 H ATOM 3138 HB2 LEU C 297 22.741 26.780 -2.965 1.00 0.00 H ATOM 3139 HB3 LEU C 297 24.171 26.264 -3.890 1.00 0.00 H ATOM 3140 HG LEU C 297 21.415 25.019 -4.100 1.00 0.00 H ATOM 3141 HD21 LEU C 297 23.932 24.627 -5.740 1.00 0.00 H ATOM 3142 HD22 LEU C 297 23.216 23.455 -4.607 1.00 0.00 H ATOM 3143 HD23 LEU C 297 22.337 23.915 -6.085 1.00 0.00 H ATOM 3144 HD11 LEU C 297 21.460 27.320 -4.928 1.00 0.00 H ATOM 3145 HD12 LEU C 297 22.890 26.943 -5.919 1.00 0.00 H ATOM 3146 HD13 LEU C 297 21.330 26.161 -6.274 1.00 0.00 H ATOM 3147 H LEU C 297 21.632 25.091 -1.445 1.00 0.00 H ATOM 3148 N VAL C 298 25.854 25.394 -1.552 1.00 37.66 N ATOM 3149 CA VAL C 298 26.882 26.014 -0.728 1.00 37.66 C ATOM 3150 C VAL C 298 27.704 26.888 -1.662 1.00 37.66 C ATOM 3151 O VAL C 298 28.128 26.437 -2.724 1.00 51.74 O ATOM 3152 CB VAL C 298 27.796 24.974 -0.073 1.00 51.74 C ATOM 3153 CG1 VAL C 298 28.798 25.655 0.832 1.00 51.74 C ATOM 3154 CG2 VAL C 298 26.978 24.005 0.720 1.00 51.74 C ATOM 3155 HA VAL C 298 26.419 26.582 0.079 1.00 0.00 H ATOM 3156 HB VAL C 298 28.333 24.437 -0.855 1.00 0.00 H ATOM 3157 HG11 VAL C 298 29.405 26.345 0.246 1.00 0.00 H ATOM 3158 HG12 VAL C 298 28.268 26.205 1.610 1.00 0.00 H ATOM 3159 HG13 VAL C 298 29.441 24.904 1.291 1.00 0.00 H ATOM 3160 HG21 VAL C 298 26.431 24.542 1.495 1.00 0.00 H ATOM 3161 HG22 VAL C 298 26.273 23.500 0.059 1.00 0.00 H ATOM 3162 HG23 VAL C 298 27.636 23.269 1.182 1.00 0.00 H ATOM 3163 H VAL C 298 26.139 24.750 -2.317 1.00 0.00 H ATOM 3164 N PHE C 299 27.914 28.139 -1.276 1.00 26.59 N ATOM 3165 CA PHE C 299 28.667 29.053 -2.103 1.00 26.59 C ATOM 3166 C PHE C 299 29.811 29.687 -1.349 1.00 26.59 C ATOM 3167 O PHE C 299 29.625 30.242 -0.265 1.00 44.87 O ATOM 3168 CB PHE C 299 27.762 30.156 -2.619 1.00 44.87 C ATOM 3169 CG PHE C 299 26.846 29.722 -3.705 1.00 44.87 C ATOM 3170 CD1 PHE C 299 27.310 29.612 -5.005 1.00 44.87 C ATOM 3171 CD2 PHE C 299 25.513 29.454 -3.440 1.00 44.87 C ATOM 3172 CE1 PHE C 299 26.461 29.243 -6.028 1.00 44.87 C ATOM 3173 CE2 PHE C 299 24.655 29.083 -4.460 1.00 44.87 C ATOM 3174 CZ PHE C 299 25.130 28.978 -5.757 1.00 44.87 C ATOM 3175 HA PHE C 299 29.074 28.472 -2.930 1.00 0.00 H ATOM 3176 HB2 PHE C 299 27.160 30.524 -1.788 1.00 0.00 H ATOM 3177 HB3 PHE C 299 28.387 30.964 -2.999 1.00 0.00 H ATOM 3178 HD2 PHE C 299 25.137 29.536 -2.420 1.00 0.00 H ATOM 3179 HE2 PHE C 299 23.607 28.874 -4.243 1.00 0.00 H ATOM 3180 HZ PHE C 299 24.456 28.687 -6.563 1.00 0.00 H ATOM 3181 HE1 PHE C 299 26.838 29.160 -7.047 1.00 0.00 H ATOM 3182 HD1 PHE C 299 28.358 29.819 -5.223 1.00 0.00 H ATOM 3183 H PHE C 299 27.532 28.466 -0.366 1.00 0.00 H ATOM 3184 N ASP C 300 31.002 29.577 -1.918 1.00 22.01 N ATOM 3185 CA ASP C 300 32.189 30.168 -1.335 1.00 22.01 C ATOM 3186 C ASP C 300 32.300 31.491 -2.080 1.00 22.01 C ATOM 3187 O ASP C 300 32.795 31.542 -3.205 1.00 34.75 O ATOM 3188 CB ASP C 300 33.383 29.261 -1.615 1.00 34.75 C ATOM 3189 CG ASP C 300 34.696 29.888 -1.243 1.00 34.75 C ATOM 3190 OD1 ASP C 300 34.711 30.983 -0.656 1.00 34.75 O ATOM 3191 OD2 ASP C 300 35.731 29.265 -1.550 1.00 34.75 O ATOM 3192 HA ASP C 300 32.153 30.302 -0.254 1.00 0.00 H ATOM 3193 HB2 ASP C 300 33.263 28.341 -1.043 1.00 0.00 H ATOM 3194 HB3 ASP C 300 33.399 29.026 -2.679 1.00 0.00 H ATOM 3195 H ASP C 300 31.088 29.050 -2.811 1.00 0.00 H ATOM 3196 N VAL C 301 31.789 32.549 -1.470 1.00 16.35 N ATOM 3197 CA VAL C 301 31.800 33.856 -2.109 1.00 16.35 C ATOM 3198 C VAL C 301 32.798 34.819 -1.493 1.00 16.35 C ATOM 3199 O VAL C 301 32.844 34.968 -0.269 1.00 25.06 O ATOM 3200 CB VAL C 301 30.402 34.515 -2.041 1.00 25.06 C ATOM 3201 CG1 VAL C 301 30.382 35.812 -2.826 1.00 25.06 C ATOM 3202 CG2 VAL C 301 29.337 33.560 -2.548 1.00 25.06 C ATOM 3203 HA VAL C 301 32.094 33.668 -3.141 1.00 0.00 H ATOM 3204 HB VAL C 301 30.182 34.747 -0.999 1.00 0.00 H ATOM 3205 HG11 VAL C 301 31.117 36.500 -2.408 1.00 0.00 H ATOM 3206 HG12 VAL C 301 30.626 35.608 -3.869 1.00 0.00 H ATOM 3207 HG13 VAL C 301 29.389 36.257 -2.764 1.00 0.00 H ATOM 3208 HG21 VAL C 301 29.553 33.293 -3.583 1.00 0.00 H ATOM 3209 HG22 VAL C 301 29.335 32.660 -1.932 1.00 0.00 H ATOM 3210 HG23 VAL C 301 28.361 34.043 -2.492 1.00 0.00 H ATOM 3211 H VAL C 301 31.374 32.445 -0.522 1.00 0.00 H ATOM 3212 N GLU C 302 33.598 35.458 -2.346 1.00 15.92 N ATOM 3213 CA GLU C 302 34.568 36.459 -1.913 1.00 15.92 C ATOM 3214 C GLU C 302 34.164 37.776 -2.574 1.00 15.92 C ATOM 3215 O GLU C 302 34.253 37.908 -3.797 1.00 42.36 O ATOM 3216 CB GLU C 302 36.003 36.084 -2.324 1.00 42.36 C ATOM 3217 CG GLU C 302 37.027 37.185 -2.010 1.00 42.36 C ATOM 3218 CD GLU C 302 38.479 36.738 -2.095 1.00 42.36 C ATOM 3219 OE1 GLU C 302 38.953 36.403 -3.197 1.00 42.36 O ATOM 3220 OE2 GLU C 302 39.168 36.752 -1.054 1.00 42.36 O ATOM 3221 HA GLU C 302 34.564 36.533 -0.826 1.00 0.00 H ATOM 3222 HB2 GLU C 302 36.292 35.179 -1.790 1.00 0.00 H ATOM 3223 HB3 GLU C 302 36.018 35.892 -3.397 1.00 0.00 H ATOM 3224 HG2 GLU C 302 36.879 38.000 -2.718 1.00 0.00 H ATOM 3225 HG3 GLU C 302 36.840 37.546 -0.999 1.00 0.00 H ATOM 3226 H GLU C 302 33.528 35.235 -3.359 1.00 0.00 H ATOM 3227 N LEU C 303 33.656 38.717 -1.779 1.00 27.53 N ATOM 3228 CA LEU C 303 33.245 40.014 -2.302 1.00 27.53 C ATOM 3229 C LEU C 303 34.489 40.829 -2.576 1.00 27.53 C ATOM 3230 O LEU C 303 35.109 41.359 -1.652 1.00 26.16 O ATOM 3231 CB LEU C 303 32.346 40.750 -1.307 1.00 26.16 C ATOM 3232 CG LEU C 303 31.899 42.167 -1.697 1.00 26.16 C ATOM 3233 CD1 LEU C 303 31.278 42.186 -3.079 1.00 26.16 C ATOM 3234 CD2 LEU C 303 30.921 42.693 -0.671 1.00 26.16 C ATOM 3235 HA LEU C 303 32.673 39.870 -3.219 1.00 0.00 H ATOM 3236 HB2 LEU C 303 31.449 40.148 -1.165 1.00 0.00 H ATOM 3237 HB3 LEU C 303 32.887 40.822 -0.364 1.00 0.00 H ATOM 3238 HG LEU C 303 32.778 42.812 -1.720 1.00 0.00 H ATOM 3239 HD21 LEU C 303 30.051 42.037 -0.630 1.00 0.00 H ATOM 3240 HD22 LEU C 303 31.402 42.721 0.307 1.00 0.00 H ATOM 3241 HD23 LEU C 303 30.607 43.698 -0.952 1.00 0.00 H ATOM 3242 HD11 LEU C 303 32.009 41.838 -3.809 1.00 0.00 H ATOM 3243 HD12 LEU C 303 30.408 41.530 -3.094 1.00 0.00 H ATOM 3244 HD13 LEU C 303 30.972 43.203 -3.325 1.00 0.00 H ATOM 3245 H LEU C 303 33.550 38.522 -0.763 1.00 0.00 H ATOM 3246 N LEU C 304 34.840 40.931 -3.851 1.00 25.34 N ATOM 3247 CA LEU C 304 36.029 41.653 -4.260 1.00 25.34 C ATOM 3248 C LEU C 304 35.903 43.156 -4.139 1.00 25.34 C ATOM 3249 O LEU C 304 36.701 43.780 -3.447 1.00 37.66 O ATOM 3250 CB LEU C 304 36.411 41.258 -5.678 1.00 37.66 C ATOM 3251 CG LEU C 304 36.646 39.757 -5.784 1.00 37.66 C ATOM 3252 CD1 LEU C 304 36.889 39.367 -7.226 1.00 37.66 C ATOM 3253 CD2 LEU C 304 37.810 39.357 -4.895 1.00 37.66 C ATOM 3254 HA LEU C 304 36.821 41.367 -3.568 1.00 0.00 H ATOM 3255 HB2 LEU C 304 35.606 41.541 -6.356 1.00 0.00 H ATOM 3256 HB3 LEU C 304 37.324 41.782 -5.960 1.00 0.00 H ATOM 3257 HG LEU C 304 35.759 39.224 -5.442 1.00 0.00 H ATOM 3258 HD21 LEU C 304 38.708 39.887 -5.213 1.00 0.00 H ATOM 3259 HD22 LEU C 304 37.581 39.615 -3.861 1.00 0.00 H ATOM 3260 HD23 LEU C 304 37.974 38.282 -4.975 1.00 0.00 H ATOM 3261 HD11 LEU C 304 36.019 39.636 -7.825 1.00 0.00 H ATOM 3262 HD12 LEU C 304 37.767 39.894 -7.601 1.00 0.00 H ATOM 3263 HD13 LEU C 304 37.055 38.292 -7.287 1.00 0.00 H ATOM 3264 H LEU C 304 34.246 40.481 -4.577 1.00 0.00 H ATOM 3265 N LYS C 305 34.921 43.741 -4.819 1.00 28.63 N ATOM 3266 CA LYS C 305 34.732 45.182 -4.747 1.00 28.63 C ATOM 3267 C LYS C 305 33.303 45.602 -5.044 1.00 28.63 C ATOM 3268 O LYS C 305 32.494 44.805 -5.523 1.00 48.51 O ATOM 3269 CB LYS C 305 35.714 45.920 -5.678 1.00 48.51 C ATOM 3270 CG LYS C 305 35.413 45.829 -7.168 1.00 48.51 C ATOM 3271 CD LYS C 305 36.291 46.776 -7.995 1.00 48.51 C ATOM 3272 CE LYS C 305 37.675 46.192 -8.262 1.00 48.51 C ATOM 3273 NZ LYS C 305 38.579 47.137 -8.992 1.00 48.51 N ATOM 3274 HA LYS C 305 34.943 45.467 -3.716 1.00 0.00 H ATOM 3275 HB2 LYS C 305 35.710 46.974 -5.400 1.00 0.00 H ATOM 3276 HB3 LYS C 305 36.708 45.505 -5.512 1.00 0.00 H ATOM 3277 HG2 LYS C 305 35.590 44.806 -7.500 1.00 0.00 H ATOM 3278 HG3 LYS C 305 34.367 46.087 -7.332 1.00 0.00 H ATOM 3279 HD2 LYS C 305 35.800 46.967 -8.949 1.00 0.00 H ATOM 3280 HD3 LYS C 305 36.404 47.714 -7.452 1.00 0.00 H ATOM 3281 HE2 LYS C 305 37.561 45.288 -8.860 1.00 0.00 H ATOM 3282 HE3 LYS C 305 38.135 45.939 -7.307 1.00 0.00 H ATOM 3283 HZ1 LYS C 305 38.156 47.380 -9.910 1.00 0.00 H ATOM 3284 HZ2 LYS C 305 38.704 48.001 -8.427 1.00 0.00 H ATOM 3285 HZ3 LYS C 305 39.503 46.684 -9.144 1.00 0.00 H ATOM 3286 H LYS C 305 34.284 43.165 -5.406 1.00 0.00 H ATOM 3287 N LEU C 306 32.998 46.852 -4.706 1.00 46.29 N ATOM 3288 CA LEU C 306 31.683 47.445 -4.927 1.00 46.29 C ATOM 3289 C LEU C 306 31.907 48.685 -5.764 1.00 46.29 C ATOM 3290 O LEU C 306 32.744 49.520 -5.425 1.00 49.34 O ATOM 3291 CB LEU C 306 31.028 47.846 -3.605 1.00 49.34 C ATOM 3292 CG LEU C 306 30.716 46.713 -2.630 1.00 49.34 C ATOM 3293 CD1 LEU C 306 30.045 47.269 -1.402 1.00 49.34 C ATOM 3294 CD2 LEU C 306 29.821 45.686 -3.300 1.00 49.34 C ATOM 3295 HA LEU C 306 31.025 46.728 -5.418 1.00 0.00 H ATOM 3296 HB2 LEU C 306 31.698 48.543 -3.101 1.00 0.00 H ATOM 3297 HB3 LEU C 306 30.090 48.350 -3.839 1.00 0.00 H ATOM 3298 HG LEU C 306 31.646 46.227 -2.334 1.00 0.00 H ATOM 3299 HD21 LEU C 306 28.890 46.163 -3.608 1.00 0.00 H ATOM 3300 HD22 LEU C 306 30.329 45.279 -4.174 1.00 0.00 H ATOM 3301 HD23 LEU C 306 29.604 44.882 -2.597 1.00 0.00 H ATOM 3302 HD11 LEU C 306 30.708 47.988 -0.921 1.00 0.00 H ATOM 3303 HD12 LEU C 306 29.118 47.765 -1.689 1.00 0.00 H ATOM 3304 HD13 LEU C 306 29.825 46.456 -0.710 1.00 0.00 H ATOM 3305 H LEU C 306 33.734 47.437 -4.261 1.00 0.00 H ATOM 3306 N GLU C 307 31.191 48.788 -6.873 1.00 74.72 N ATOM 3307 CA GLU C 307 31.326 49.937 -7.751 1.00 74.72 C ATOM 3308 C GLU C 307 30.048 50.777 -7.693 1.00 74.72 C ATOM 3309 O GLU C 307 30.110 51.881 -7.099 1.00 80.95 O ATOM 3310 CB GLU C 307 31.660 49.474 -9.181 1.00 80.95 C ATOM 3311 CG GLU C 307 32.961 48.647 -9.255 1.00 80.95 C ATOM 3312 CD GLU C 307 33.352 48.206 -10.665 1.00 80.95 C ATOM 3313 OE1 GLU C 307 32.491 47.675 -11.399 1.00 80.95 O ATOM 3314 OE2 GLU C 307 34.540 48.376 -11.028 1.00 80.95 O ATOM 3315 HA GLU C 307 32.151 50.567 -7.419 1.00 0.00 H ATOM 3316 OXT GLU C 307 28.988 50.300 -8.166 1.00 80.95 O ATOM 3317 HB2 GLU C 307 30.837 48.862 -9.550 1.00 0.00 H ATOM 3318 HB3 GLU C 307 31.770 50.354 -9.815 1.00 0.00 H ATOM 3319 HG2 GLU C 307 33.772 49.251 -8.850 1.00 0.00 H ATOM 3320 HG3 GLU C 307 32.833 47.755 -8.642 1.00 0.00 H ATOM 3321 H GLU C 307 30.520 48.033 -7.120 1.00 0.00 H TER 3322 GLU C 307 HETATM 3323 O HOH 1 54.962 32.538 10.412 1.00 47.43 O HETATM 3324 O HOH 2 47.412 39.516 7.971 1.00 57.73 O HETATM 3325 O HOH 3 47.954 44.982 -6.109 1.00 56.07 O HETATM 3326 O HOH 4 48.981 13.508 -4.501 1.00 63.85 O HETATM 3327 O HOH 5 50.094 32.895 14.799 1.00 72.79 O HETATM 3328 O HOH 6 67.044 32.634 -5.434 1.00 33.32 O HETATM 3329 O HOH 7 66.868 29.837 3.933 1.00 77.68 O HETATM 3330 O HOH 8 40.406 38.840 -12.993 1.00 73.24 O HETATM 3331 O HOH 9 15.025 40.798 -6.505 1.00 67.78 O HETATM 3332 O HOH 10 12.316 27.311 -8.384 1.00 77.92 O HETATM 3333 O HOH 11 16.236 26.866 -13.485 1.00 54.38 O HETATM 3334 O HOH 12 18.608 18.896 -13.599 1.00 83.14 O HETATM 3335 O HOH 13 42.618 34.248 -10.903 1.00 80.91 O HETATM 3336 O HOH 14 20.616 57.430 -3.678 1.00 57.62 O HETATM 3337 C1 UNN A 15 47.928 29.999 5.207 1.00 0.26 C HETATM 3338 C2 UNN A 15 48.060 29.779 3.707 1.00 0.15 C HETATM 3339 C3 UNN A 15 49.358 30.402 3.200 1.00 -0.01 C HETATM 3340 C4 UNN A 15 49.366 31.922 3.241 1.00 -0.05 C HETATM 3341 C5 UNN A 15 48.201 32.478 2.449 1.00 -0.03 C HETATM 3342 C6 UNN A 15 46.900 31.896 2.959 1.00 0.04 C HETATM 3343 N7 UNN A 15 47.005 30.431 2.958 1.00 -0.24 N HETATM 3344 C8 UNN A 15 46.247 29.684 2.190 1.00 0.28 C HETATM 3345 C9 UNN A 15 45.317 30.264 1.372 1.00 0.29 C HETATM 3346 C10 UNN A 15 43.907 30.605 1.781 1.00 0.25 C HETATM 3347 C11 UNN A 15 43.435 29.544 2.786 1.00 0.02 C HETATM 3348 C12 UNN A 15 42.214 30.074 3.527 1.00 -0.02 C HETATM 3349 C13 UNN A 15 42.408 31.497 4.032 1.00 0.09 C HETATM 3350 C14 UNN A 15 42.810 32.397 2.858 1.00 0.11 C HETATM 3351 C15 UNN A 15 43.027 33.884 3.102 1.00 0.09 C HETATM 3352 C16 UNN A 15 43.992 34.105 4.271 1.00 -0.02 C HETATM 3353 C17 UNN A 15 44.306 35.557 4.645 1.00 -0.01 C HETATM 3354 C18 UNN A 15 43.121 36.305 5.275 1.00 0.08 C HETATM 3355 C19 UNN A 15 43.073 35.987 6.757 1.00 -0.05 C HETATM 3356 C20 UNN A 15 42.475 34.870 7.175 1.00 -0.09 C HETATM 3357 C21 UNN A 15 42.445 34.399 8.589 1.00 0.04 C HETATM 3358 C22 UNN A 15 43.203 33.088 8.768 1.00 0.11 C HETATM 3359 C23 UNN A 15 44.643 33.216 9.257 1.00 0.05 C HETATM 3360 C24 UNN A 15 45.524 32.033 8.844 1.00 0.08 C HETATM 3361 C25 UNN A 15 45.736 32.001 7.324 1.00 0.02 C HETATM 3362 C26 UNN A 15 46.502 30.702 7.050 1.00 0.12 C HETATM 3363 C27 UNN A 15 45.654 29.520 7.416 1.00 -0.05 C HETATM 3364 C28 UNN A 15 46.092 28.708 8.381 1.00 -0.10 C HETATM 3365 C29 UNN A 15 45.366 27.535 8.979 1.00 -0.03 C HETATM 3366 C30 UNN A 15 46.332 26.381 9.253 1.00 -0.02 C HETATM 3367 C31 UNN A 15 45.726 25.185 9.996 1.00 0.09 C HETATM 3368 C32 UNN A 15 45.120 25.655 11.321 1.00 0.10 C HETATM 3369 C33 UNN A 15 44.114 26.774 11.069 1.00 -0.02 C HETATM 3370 C34 UNN A 15 44.717 27.940 10.305 1.00 -0.04 C HETATM 3371 H35 UNN A 15 43.919 28.667 10.094 1.00 0.03 H HETATM 3372 H36 UNN A 15 45.484 28.411 10.938 1.00 0.03 H HETATM 3373 H33 UNN A 15 43.745 27.141 12.038 1.00 0.03 H HETATM 3374 H34 UNN A 15 43.274 26.368 10.487 1.00 0.03 H HETATM 3375 O12 UNN A 15 44.494 24.530 11.959 1.00 -0.32 O HETATM 3376 C58 UNN A 15 44.826 24.402 13.284 1.00 0.07 C HETATM 3377 C59 UNN A 15 46.174 24.374 13.654 1.00 -0.05 C HETATM 3378 C62 UNN A 15 46.529 24.496 14.970 1.00 -0.05 C HETATM 3379 C63 UNN A 15 45.508 24.646 15.925 1.00 0.06 C HETATM 3380 C61 UNN A 15 44.145 24.671 15.604 1.00 -0.04 C HETATM 3381 C60 UNN A 15 43.815 24.539 14.241 1.00 -0.05 C HETATM 3382 H67 UNN A 15 42.776 24.544 13.933 1.00 0.04 H HETATM 3383 C64 UNN A 15 43.338 24.857 16.712 1.00 -0.07 C HETATM 3384 C66 UNN A 15 44.006 24.996 17.921 1.00 0.02 C HETATM 3385 N65 UNN A 15 45.566 24.857 17.402 1.00 -0.27 N HETATM 3386 C67 UNN A 15 46.761 25.032 18.272 1.00 0.04 C HETATM 3387 H71 UNN A 15 47.673 24.886 17.675 1.00 0.06 H HETATM 3388 H72 UNN A 15 46.733 24.293 19.086 1.00 0.06 H HETATM 3389 H73 UNN A 15 46.760 26.047 18.697 1.00 0.06 H HETATM 3390 H70 UNN A 15 43.613 25.152 18.924 1.00 0.09 H HETATM 3391 H69 UNN A 15 42.252 24.892 16.641 1.00 0.03 H HETATM 3392 H68 UNN A 15 47.571 24.477 15.269 1.00 0.05 H HETATM 3393 H66 UNN A 15 46.940 24.255 12.896 1.00 0.05 H HETATM 3394 H32 UNN A 15 45.920 26.038 11.971 1.00 0.07 H HETATM 3395 O11 UNN A 15 46.703 24.245 10.390 1.00 -0.38 O HETATM 3396 C45 UNN A 15 47.378 23.592 9.314 1.00 0.04 C HETATM 3397 H63 UNN A 15 48.115 22.883 9.720 1.00 0.05 H HETATM 3398 H64 UNN A 15 47.893 24.342 8.695 1.00 0.05 H HETATM 3399 H65 UNN A 15 46.646 23.048 8.698 1.00 0.05 H HETATM 3400 H31 UNN A 15 44.966 24.708 9.360 1.00 0.06 H HETATM 3401 H29 UNN A 15 47.165 26.770 9.857 1.00 0.03 H HETATM 3402 H30 UNN A 15 46.716 26.022 8.287 1.00 0.03 H HETATM 3403 H28 UNN A 15 44.588 27.200 8.277 1.00 0.04 H HETATM 3404 H27 UNN A 15 47.084 28.918 8.779 1.00 0.02 H HETATM 3405 C42 UNN A 15 44.381 29.306 6.626 1.00 -0.04 C HETATM 3406 H54 UNN A 15 43.864 28.410 7.000 1.00 0.04 H HETATM 3407 H55 UNN A 15 44.628 29.170 5.563 1.00 0.04 H HETATM 3408 H56 UNN A 15 43.726 30.182 6.742 1.00 0.04 H HETATM 3409 O1 UNN A 15 46.784 30.577 5.670 1.00 -0.26 O HETATM 3410 H26 UNN A 15 47.436 30.697 7.631 1.00 0.08 H HETATM 3411 C41 UNN A 15 46.560 33.195 6.879 1.00 -0.06 C HETATM 3412 H51 UNN A 15 46.002 34.121 7.080 1.00 0.02 H HETATM 3413 H52 UNN A 15 46.766 33.117 5.801 1.00 0.02 H HETATM 3414 H53 UNN A 15 47.510 33.212 7.433 1.00 0.02 H HETATM 3415 H25 UNN A 15 44.770 32.001 6.798 1.00 0.04 H HETATM 3416 O10 UNN A 15 46.779 32.212 9.511 1.00 -0.39 O HETATM 3417 H75 UNN A 15 46.637 32.230 10.450 1.00 0.21 H HETATM 3418 H24 UNN A 15 45.057 31.090 9.163 1.00 0.06 H HETATM 3419 H22 UNN A 15 44.636 33.281 10.355 1.00 0.05 H HETATM 3420 H23 UNN A 15 45.075 34.137 8.838 1.00 0.05 H HETATM 3421 O9 UNN A 15 42.661 31.996 8.573 1.00 -0.39 O HETATM 3422 C38 UNN A 15 40.991 34.242 9.020 1.00 -0.03 C HETATM 3423 C39 UNN A 15 40.820 33.909 10.477 1.00 -0.06 C HETATM 3424 H48 UNN A 15 39.749 33.813 10.708 1.00 0.02 H HETATM 3425 H49 UNN A 15 41.257 34.711 11.090 1.00 0.02 H HETATM 3426 H50 UNN A 15 41.330 32.960 10.698 1.00 0.02 H HETATM 3427 H46 UNN A 15 40.538 33.435 8.425 1.00 0.03 H HETATM 3428 H47 UNN A 15 40.465 35.187 8.817 1.00 0.03 H HETATM 3429 H21 UNN A 15 42.923 35.161 9.222 1.00 0.06 H HETATM 3430 H20 UNN A 15 41.972 34.257 6.428 1.00 0.03 H HETATM 3431 C37 UNN A 15 43.702 36.940 7.755 1.00 -0.04 C HETATM 3432 H43 UNN A 15 43.569 36.545 8.773 1.00 0.04 H HETATM 3433 H44 UNN A 15 43.218 37.925 7.678 1.00 0.04 H HETATM 3434 H45 UNN A 15 44.776 37.042 7.538 1.00 0.04 H HETATM 3435 O13 UNN A 15 43.207 37.710 5.087 1.00 -0.38 O HETATM 3436 H76 UNN A 15 43.237 37.903 4.157 1.00 0.21 H HETATM 3437 H19 UNN A 15 42.193 35.950 4.802 1.00 0.07 H HETATM 3438 C36 UNN A 15 44.816 36.282 3.405 1.00 -0.06 C HETATM 3439 H40 UNN A 15 45.662 35.725 2.977 1.00 0.02 H HETATM 3440 H41 UNN A 15 45.146 37.294 3.682 1.00 0.02 H HETATM 3441 H42 UNN A 15 44.008 36.350 2.662 1.00 0.02 H HETATM 3442 H18 UNN A 15 45.114 35.542 5.391 1.00 0.03 H HETATM 3443 H16 UNN A 15 44.943 33.615 4.014 1.00 0.03 H HETATM 3444 H17 UNN A 15 43.557 33.620 5.157 1.00 0.03 H HETATM 3445 O8 UNN A 15 41.736 34.406 3.325 1.00 -0.38 O HETATM 3446 C44 UNN A 15 41.199 34.791 2.064 1.00 0.04 C HETATM 3447 H60 UNN A 15 40.189 35.203 2.206 1.00 0.05 H HETATM 3448 H61 UNN A 15 41.147 33.913 1.404 1.00 0.05 H HETATM 3449 H62 UNN A 15 41.846 35.555 1.608 1.00 0.05 H HETATM 3450 H15 UNN A 15 43.460 34.353 2.206 1.00 0.06 H HETATM 3451 O5 UNN A 15 43.996 31.904 2.298 1.00 -0.34 O HETATM 3452 H14 UNN A 15 42.004 32.313 2.114 1.00 0.06 H HETATM 3453 O7 UNN A 15 41.177 31.915 4.585 1.00 -0.38 O HETATM 3454 C43 UNN A 15 40.970 31.414 5.898 1.00 0.04 C HETATM 3455 H57 UNN A 15 40.001 31.769 6.277 1.00 0.05 H HETATM 3456 H58 UNN A 15 41.775 31.770 6.558 1.00 0.05 H HETATM 3457 H59 UNN A 15 40.974 30.314 5.876 1.00 0.05 H HETATM 3458 H13 UNN A 15 43.193 31.524 4.802 1.00 0.06 H HETATM 3459 H11 UNN A 15 42.012 29.419 4.388 1.00 0.03 H HETATM 3460 H12 UNN A 15 41.352 30.057 2.844 1.00 0.03 H HETATM 3461 C35 UNN A 15 43.058 28.283 2.044 1.00 -0.06 C HETATM 3462 H37 UNN A 15 43.937 27.897 1.507 1.00 0.02 H HETATM 3463 H38 UNN A 15 42.258 28.507 1.323 1.00 0.02 H HETATM 3464 H39 UNN A 15 42.705 27.527 2.761 1.00 0.02 H HETATM 3465 H10 UNN A 15 44.240 29.326 3.503 1.00 0.03 H HETATM 3466 O6 UNN A 15 43.076 30.643 0.644 1.00 -0.36 O HETATM 3467 H74 UNN A 15 43.453 31.228 -0.003 1.00 0.21 H HETATM 3468 O4 UNN A 15 45.650 30.568 0.224 1.00 -0.29 O HETATM 3469 O3 UNN A 15 46.308 28.452 2.156 1.00 -0.36 O HETATM 3470 H8 UNN A 15 46.073 32.208 2.304 1.00 0.05 H HETATM 3471 H9 UNN A 15 46.711 32.252 3.982 1.00 0.05 H HETATM 3472 H6 UNN A 15 48.325 32.217 1.388 1.00 0.03 H HETATM 3473 H7 UNN A 15 48.177 33.572 2.557 1.00 0.03 H HETATM 3474 H4 UNN A 15 50.307 32.291 2.808 1.00 0.03 H HETATM 3475 H5 UNN A 15 49.286 32.257 4.286 1.00 0.03 H HETATM 3476 H2 UNN A 15 49.513 30.082 2.159 1.00 0.03 H HETATM 3477 H3 UNN A 15 50.186 30.034 3.824 1.00 0.03 H HETATM 3478 H1 UNN A 15 48.050 28.698 3.503 1.00 0.08 H HETATM 3479 O2 UNN A 15 48.847 29.681 5.965 1.00 -0.37 O CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1662 1663 1668 1669 1670 CONECT 1668 1662 CONECT 1669 1662 CONECT 1670 1662 CONECT 3337 3338 3409 3479 CONECT 3338 3337 3339 3343 3478 CONECT 3339 3338 3340 3476 3477 CONECT 3340 3339 3341 3474 3475 CONECT 3341 3340 3342 3472 3473 CONECT 3342 3341 3343 3470 3471 CONECT 3343 3338 3342 3344 CONECT 3344 3343 3345 3469 CONECT 3345 3344 3346 3468 CONECT 3346 3345 3347 3451 3466 CONECT 3347 3346 3348 3461 3465 CONECT 3348 3347 3349 3459 3460 CONECT 3349 3348 3350 3453 3458 CONECT 3350 3349 3351 3451 3452 CONECT 3351 3350 3352 3445 3450 CONECT 3352 3351 3353 3443 3444 CONECT 3353 3352 3354 3438 3442 CONECT 3354 3353 3355 3435 3437 CONECT 3355 3354 3356 3431 CONECT 3356 3355 3357 3430 CONECT 3357 3356 3358 3422 3429 CONECT 3358 3357 3359 3421 CONECT 3359 3358 3360 3419 3420 CONECT 3360 3359 3361 3416 3418 CONECT 3361 3360 3362 3411 3415 CONECT 3362 3361 3363 3409 3410 CONECT 3363 3362 3364 3405 CONECT 3364 3363 3365 3404 CONECT 3365 3364 3366 3370 3403 CONECT 3366 3365 3367 3401 3402 CONECT 3367 3366 3368 3395 3400 CONECT 3368 3367 3369 3375 3394 CONECT 3369 3368 3370 3373 3374 CONECT 3370 3365 3369 3371 3372 CONECT 3371 3370 CONECT 3372 3370 CONECT 3373 3369 CONECT 3374 3369 CONECT 3375 3368 3376 CONECT 3376 3375 3377 3381 CONECT 3377 3376 3378 3393 CONECT 3378 3377 3379 3392 CONECT 3379 3378 3380 3385 CONECT 3380 3379 3381 3383 CONECT 3381 3376 3380 3382 CONECT 3382 3381 CONECT 3383 3380 3384 3391 CONECT 3384 3383 3385 3390 CONECT 3385 3379 3384 3386 CONECT 3386 3385 3387 3388 3389 CONECT 3387 3386 CONECT 3388 3386 CONECT 3389 3386 CONECT 3390 3384 CONECT 3391 3383 CONECT 3392 3378 CONECT 3393 3377 CONECT 3394 3368 CONECT 3395 3367 3396 CONECT 3396 3395 3397 3398 3399 CONECT 3397 3396 CONECT 3398 3396 CONECT 3399 3396 CONECT 3400 3367 CONECT 3401 3366 CONECT 3402 3366 CONECT 3403 3365 CONECT 3404 3364 CONECT 3405 3363 3406 3407 3408 CONECT 3406 3405 CONECT 3407 3405 CONECT 3408 3405 CONECT 3409 3337 3362 CONECT 3410 3362 CONECT 3411 3361 3412 3413 3414 CONECT 3412 3411 CONECT 3413 3411 CONECT 3414 3411 CONECT 3415 3361 CONECT 3416 3360 3417 CONECT 3417 3416 CONECT 3418 3360 CONECT 3419 3359 CONECT 3420 3359 CONECT 3421 3358 CONECT 3422 3357 3423 3427 3428 CONECT 3423 3422 3424 3425 3426 CONECT 3424 3423 CONECT 3425 3423 CONECT 3426 3423 CONECT 3427 3422 CONECT 3428 3422 CONECT 3429 3357 CONECT 3430 3356 CONECT 3431 3355 3432 3433 3434 CONECT 3432 3431 CONECT 3433 3431 CONECT 3434 3431 CONECT 3435 3354 3436 CONECT 3436 3435 CONECT 3437 3354 CONECT 3438 3353 3439 3440 3441 CONECT 3439 3438 CONECT 3440 3438 CONECT 3441 3438 CONECT 3442 3353 CONECT 3443 3352 CONECT 3444 3352 CONECT 3445 3351 3446 CONECT 3446 3445 3447 3448 3449 CONECT 3447 3446 CONECT 3448 3446 CONECT 3449 3446 CONECT 3450 3351 CONECT 3451 3346 3350 CONECT 3452 3350 CONECT 3453 3349 3454 CONECT 3454 3453 3455 3456 3457 CONECT 3455 3454 CONECT 3456 3454 CONECT 3457 3454 CONECT 3458 3349 CONECT 3459 3348 CONECT 3460 3348 CONECT 3461 3347 3462 3463 3464 CONECT 3462 3461 CONECT 3463 3461 CONECT 3464 3461 CONECT 3465 3347 CONECT 3466 3346 3467 CONECT 3467 3466 CONECT 3468 3345 CONECT 3469 3344 CONECT 3470 3342 CONECT 3471 3342 CONECT 3472 3341 CONECT 3473 3341 CONECT 3474 3340 CONECT 3475 3340 CONECT 3476 3339 CONECT 3477 3339 CONECT 3478 3338 CONECT 3479 3337 MASTER 0 0 0 0 0 0 0 0 3477 2 151 18 END
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Related entries of code: 1qpl
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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1d7j
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PDBbind
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RCSB PDB
PDBbind
107aa, >1FKB_1|Chain... at 100%
1fkf
RCSB PDB
PDBbind
107aa, >1FKF_1|Chain... at 100%
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RCSB PDB
PDBbind
107aa, >1FKG_1|Chain... at 100%
1fkh
RCSB PDB
PDBbind
107aa, >1FKH_1|Chain... at 100%
1fki
RCSB PDB
PDBbind
107aa, >1FKI_1|Chains... at 100%
1j4r
RCSB PDB
PDBbind
107aa, >1J4R_1|Chains... at 100%
1qpf
RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1qpl
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
fk506 binding protein (fkbp)
Ligand Name
587
EC.Number
E.C.5.2.1.8
Resolution
2.9(Å)
Affinity (Kd/Ki/IC50)
IC50=3.1nM
Release Year
1999
Protein/NA Sequence
Check fasta file
Primary Reference
J.Med.Chem. v42 pp. 2798-804, 1999
Ligand Properties
Formula
C
5
2
H
7
6
N
2
O
1
3
Molecular Weight
937.165
Exact Mass
936.535
No. of atoms
143
No. of bonds
148
Polar Surface Area
192.52
LOGP Value
5.78 (
Computed with XLOGP3
)
5.96 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
CO[C@@H]1C[C@@H](CC[C@H]1Oc1ccc2c(c1)ccn2C)/C=C(\[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@H]([C@H](C[C@H]([C@@H](/C(=C/[C@H](C(=O)C[C@@H]([C@H]1C)O)CC)/C)O)C)OC)[C@H](C[C@H]2C)OC)/C
InChI String
InChI=1S/C52H76N2O13/c1-11-35-23-29(2)46(57)30(3)24-44(63-9)48-45(64-10)25-32(5)52(61,67-48)49(58)50(59)54-20-13-12-14-39(54)51(60)66-47(33(6)40(55)28-41(35)56)31(4)22-34-15-18-42(43(26-34)62-8)65-37-16-17-38-36(27-37)19-21-53(38)7/h16-17,19,21-23,27,30,32-35,39-40,42-48,55,57,61H,11-15,18,20,24-26,28H2,1-10H3/b29-23+,31-22+/t30-,32-,33-,34+,35-,39+,40+,42-,43-,44+,45+,46-,47-,48-,52-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62942
Entrez Gene ID
NCBI Entrez Gene ID:
2280
ASD
Information of known allosteric effects of PDB entries
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