Browse entries in the PDBbind-CN Database
HEADER 1A7X_COMPLEX COMPND 1A7X_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 B 107 GLY VAL GLN VAL GLU THR ILE SER PRO GLY ASP GLY ARG SEQRES 2 B 107 THR PHE PRO LYS ARG GLY GLN THR CYS VAL VAL HIS TYR SEQRES 3 B 107 THR GLY MET LEU GLU ASP GLY LYS LYS PHE ASP SER SER SEQRES 4 B 107 ARG ASP ARG ASN LYS PRO PHE LYS PHE MET LEU GLY LYS SEQRES 5 B 107 GLN GLU VAL ILE ARG GLY TRP GLU GLU GLY VAL ALA GLN SEQRES 6 B 107 MET SER VAL GLY GLN ARG ALA LYS LEU THR ILE SER PRO SEQRES 7 B 107 ASP TYR ALA TYR GLY ALA THR GLY HIS PRO GLY ILE ILE SEQRES 8 B 107 PRO PRO HIS ALA THR LEU VAL PHE ASP VAL GLU LEU LEU SEQRES 9 B 107 LYS LEU GLU HET FKA A 392 143 ATOM 1 N GLY A 1 -6.380 5.910 15.876 1.00 7.50 N ATOM 2 CA GLY A 1 -5.849 4.600 16.128 1.00 7.29 C ATOM 3 C GLY A 1 -4.844 4.383 15.031 1.00 9.41 C ATOM 4 O GLY A 1 -4.202 5.354 14.605 1.00 11.91 O ATOM 5 HA3 GLY A 1 -6.638 3.849 16.082 1.00 0.00 H ATOM 6 HA2 GLY A 1 -5.368 4.561 17.105 1.00 0.00 H ATOM 7 HN3 GLY A 1 -6.823 5.928 14.935 1.00 0.00 H ATOM 8 HN2 GLY A 1 -5.610 6.608 15.912 1.00 0.00 H ATOM 9 HN1 GLY A 1 -7.091 6.140 16.599 1.00 0.00 H ATOM 10 N VAL A 2 -4.718 3.158 14.560 1.00 10.33 N ATOM 11 CA VAL A 2 -3.770 2.735 13.540 1.00 11.92 C ATOM 12 C VAL A 2 -4.641 1.938 12.582 1.00 14.49 C ATOM 13 O VAL A 2 -5.421 1.094 13.048 1.00 14.16 O ATOM 14 CB VAL A 2 -2.688 1.763 14.082 1.00 12.14 C ATOM 15 CG1 VAL A 2 -1.719 1.313 12.963 1.00 9.95 C ATOM 16 CG2 VAL A 2 -1.936 2.443 15.147 1.00 18.09 C ATOM 17 HA VAL A 2 -3.244 3.593 13.121 1.00 0.00 H ATOM 18 HB VAL A 2 -3.180 0.872 14.471 1.00 0.00 H ATOM 19 HG11 VAL A 2 -2.281 0.803 12.181 1.00 0.00 H ATOM 20 HG12 VAL A 2 -1.220 2.186 12.543 1.00 0.00 H ATOM 21 HG13 VAL A 2 -0.975 0.633 13.380 1.00 0.00 H ATOM 22 HG21 VAL A 2 -1.462 3.337 14.742 1.00 0.00 H ATOM 23 HG22 VAL A 2 -2.618 2.724 15.949 1.00 0.00 H ATOM 24 HG23 VAL A 2 -1.172 1.770 15.537 1.00 0.00 H ATOM 25 H VAL A 2 -5.351 2.431 14.951 1.00 0.00 H ATOM 26 N GLN A 3 -4.526 2.176 11.275 1.00 12.17 N ATOM 27 CA GLN A 3 -5.240 1.433 10.267 1.00 10.22 C ATOM 28 C GLN A 3 -4.144 0.608 9.600 1.00 10.30 C ATOM 29 O GLN A 3 -3.111 1.172 9.247 1.00 9.89 O ATOM 30 CB GLN A 3 -5.861 2.466 9.339 1.00 16.55 C ATOM 31 CG GLN A 3 -6.617 2.057 8.109 1.00 27.45 C ATOM 32 CD GLN A 3 -7.865 1.230 8.363 1.00 39.37 C ATOM 33 OE1 GLN A 3 -8.480 0.788 7.400 1.00 48.12 O ATOM 34 NE2 GLN A 3 -8.362 0.920 9.562 1.00 45.54 N ATOM 35 HA GLN A 3 -6.042 0.782 10.614 1.00 0.00 H ATOM 36 HB2 GLN A 3 -6.553 3.050 9.946 1.00 0.00 H ATOM 37 HB3 GLN A 3 -5.046 3.107 9.001 1.00 0.00 H ATOM 38 HG2 GLN A 3 -6.914 2.962 7.579 1.00 0.00 H ATOM 39 HG3 GLN A 3 -5.947 1.472 7.480 1.00 0.00 H ATOM 40 HE22 GLN A 3 -7.891 1.261 10.424 1.00 0.00 H ATOM 41 HE21 GLN A 3 -9.220 0.337 9.634 1.00 0.00 H ATOM 42 H GLN A 3 -3.888 2.937 10.967 1.00 0.00 H ATOM 43 N VAL A 4 -4.291 -0.702 9.442 1.00 9.53 N ATOM 44 CA VAL A 4 -3.311 -1.575 8.808 1.00 10.84 C ATOM 45 C VAL A 4 -3.915 -2.050 7.482 1.00 12.78 C ATOM 46 O VAL A 4 -4.940 -2.738 7.483 1.00 13.06 O ATOM 47 CB VAL A 4 -3.005 -2.800 9.718 1.00 9.31 C ATOM 48 CG1 VAL A 4 -1.921 -3.672 9.131 1.00 11.60 C ATOM 49 CG2 VAL A 4 -2.422 -2.332 11.047 1.00 11.75 C ATOM 50 HA VAL A 4 -2.376 -1.040 8.642 1.00 0.00 H ATOM 51 HB VAL A 4 -3.947 -3.338 9.824 1.00 0.00 H ATOM 52 HG11 VAL A 4 -2.240 -4.039 8.155 1.00 0.00 H ATOM 53 HG12 VAL A 4 -1.007 -3.088 9.020 1.00 0.00 H ATOM 54 HG13 VAL A 4 -1.736 -4.516 9.795 1.00 0.00 H ATOM 55 HG21 VAL A 4 -1.499 -1.782 10.864 1.00 0.00 H ATOM 56 HG22 VAL A 4 -3.140 -1.683 11.549 1.00 0.00 H ATOM 57 HG23 VAL A 4 -2.212 -3.198 11.675 1.00 0.00 H ATOM 58 H VAL A 4 -5.167 -1.136 9.796 1.00 0.00 H ATOM 59 N GLU A 5 -3.367 -1.724 6.316 1.00 12.01 N ATOM 60 CA GLU A 5 -3.892 -2.173 5.037 1.00 14.48 C ATOM 61 C GLU A 5 -2.815 -3.030 4.365 1.00 13.65 C ATOM 62 O GLU A 5 -1.690 -2.563 4.163 1.00 15.41 O ATOM 63 CB GLU A 5 -4.227 -0.948 4.187 1.00 16.90 C ATOM 64 CG GLU A 5 -5.304 -0.034 4.788 1.00 25.94 C ATOM 65 CD GLU A 5 -5.638 1.192 3.938 1.00 35.29 C ATOM 66 OE1 GLU A 5 -6.060 1.036 2.787 1.00 45.16 O ATOM 67 OE2 GLU A 5 -5.492 2.313 4.422 1.00 38.50 O ATOM 68 HA GLU A 5 -4.799 -2.764 5.161 1.00 0.00 H ATOM 69 HB2 GLU A 5 -3.316 -0.363 4.058 1.00 0.00 H ATOM 70 HB3 GLU A 5 -4.577 -1.293 3.214 1.00 0.00 H ATOM 71 HG2 GLU A 5 -6.215 -0.619 4.916 1.00 0.00 H ATOM 72 HG3 GLU A 5 -4.955 0.311 5.761 1.00 0.00 H ATOM 73 H GLU A 5 -2.522 -1.118 6.319 1.00 0.00 H ATOM 74 N THR A 6 -3.057 -4.290 4.038 1.00 11.57 N ATOM 75 CA THR A 6 -2.067 -5.166 3.422 1.00 13.06 C ATOM 76 C THR A 6 -1.631 -4.761 2.014 1.00 15.61 C ATOM 77 O THR A 6 -2.475 -4.515 1.144 1.00 16.62 O ATOM 78 CB THR A 6 -2.636 -6.628 3.393 1.00 14.84 C ATOM 79 OG1 THR A 6 -2.878 -6.996 4.742 1.00 11.38 O ATOM 80 CG2 THR A 6 -1.700 -7.655 2.797 1.00 11.83 C ATOM 81 HA THR A 6 -1.170 -5.088 4.036 1.00 0.00 H ATOM 82 HB THR A 6 -3.525 -6.621 2.763 1.00 0.00 H ATOM 83 HG1 THR A 6 -3.240 -7.917 4.772 1.00 0.00 H ATOM 84 HG23 THR A 6 -1.495 -7.398 1.758 1.00 0.00 H ATOM 85 HG21 THR A 6 -0.767 -7.665 3.361 1.00 0.00 H ATOM 86 HG22 THR A 6 -2.165 -8.640 2.844 1.00 0.00 H ATOM 87 H THR A 6 -4.003 -4.676 4.231 1.00 0.00 H ATOM 88 N ILE A 7 -0.313 -4.681 1.802 1.00 14.38 N ATOM 89 CA ILE A 7 0.259 -4.503 0.476 1.00 14.53 C ATOM 90 C ILE A 7 0.549 -5.921 0.018 1.00 13.40 C ATOM 91 O ILE A 7 0.161 -6.286 -1.084 1.00 17.87 O ATOM 92 CB ILE A 7 1.546 -3.619 0.556 1.00 12.94 C ATOM 93 CG1 ILE A 7 1.133 -2.173 0.913 1.00 12.12 C ATOM 94 CG2 ILE A 7 2.296 -3.578 -0.766 1.00 15.72 C ATOM 95 CD1 ILE A 7 2.292 -1.274 1.394 1.00 10.06 C ATOM 96 HA ILE A 7 -0.398 -3.984 -0.222 1.00 0.00 H ATOM 97 HB ILE A 7 2.200 -4.054 1.312 1.00 0.00 H ATOM 98 HG12 ILE A 7 0.693 -1.716 0.027 1.00 0.00 H ATOM 99 HG13 ILE A 7 0.386 -2.218 1.705 1.00 0.00 H ATOM 100 HD11 ILE A 7 2.738 -1.706 2.290 1.00 0.00 H ATOM 101 HD12 ILE A 7 3.045 -1.204 0.609 1.00 0.00 H ATOM 102 HD13 ILE A 7 1.908 -0.279 1.621 1.00 0.00 H ATOM 103 HG21 ILE A 7 2.595 -4.589 -1.044 1.00 0.00 H ATOM 104 HG22 ILE A 7 1.647 -3.164 -1.538 1.00 0.00 H ATOM 105 HG23 ILE A 7 3.182 -2.952 -0.660 1.00 0.00 H ATOM 106 H ILE A 7 0.329 -4.749 2.618 1.00 0.00 H ATOM 107 N SER A 8 1.201 -6.774 0.785 1.00 12.09 N ATOM 108 CA SER A 8 1.411 -8.156 0.409 1.00 14.28 C ATOM 109 C SER A 8 1.382 -8.971 1.694 1.00 13.97 C ATOM 110 O SER A 8 1.800 -8.530 2.771 1.00 13.78 O ATOM 111 CB SER A 8 2.758 -8.324 -0.286 1.00 14.82 C ATOM 112 OG SER A 8 3.685 -7.532 0.440 1.00 31.52 O ATOM 113 HA SER A 8 0.640 -8.487 -0.286 1.00 0.00 H ATOM 114 HB2 SER A 8 2.695 -7.980 -1.318 1.00 0.00 H ATOM 115 HB3 SER A 8 3.063 -9.370 -0.271 1.00 0.00 H ATOM 116 HG SER A 8 3.727 -7.850 1.377 1.00 0.00 H ATOM 117 H SER A 8 1.579 -6.441 1.695 1.00 0.00 H ATOM 118 N PRO A 9 0.793 -10.146 1.658 1.00 15.48 N ATOM 119 CA PRO A 9 0.573 -10.914 2.864 1.00 15.83 C ATOM 120 C PRO A 9 1.805 -11.545 3.472 1.00 17.10 C ATOM 121 O PRO A 9 2.818 -11.812 2.809 1.00 15.36 O ATOM 122 CB PRO A 9 -0.472 -11.902 2.439 1.00 15.36 C ATOM 123 CG PRO A 9 -0.204 -12.109 0.954 1.00 20.30 C ATOM 124 CD PRO A 9 0.197 -10.739 0.463 1.00 14.26 C ATOM 125 HA PRO A 9 0.259 -10.281 3.694 1.00 0.00 H ATOM 126 HD3 PRO A 9 0.921 -10.806 -0.349 1.00 0.00 H ATOM 127 HD2 PRO A 9 -0.670 -10.169 0.129 1.00 0.00 H ATOM 128 HG3 PRO A 9 -1.101 -12.457 0.443 1.00 0.00 H ATOM 129 HG2 PRO A 9 0.602 -12.827 0.801 1.00 0.00 H ATOM 130 HB2 PRO A 9 -0.365 -12.839 2.986 1.00 0.00 H ATOM 131 HB3 PRO A 9 -1.473 -11.501 2.600 1.00 0.00 H ATOM 132 N GLY A 10 1.689 -11.714 4.793 1.00 18.90 N ATOM 133 CA GLY A 10 2.668 -12.467 5.553 1.00 19.25 C ATOM 134 C GLY A 10 2.236 -13.918 5.624 1.00 18.07 C ATOM 135 O GLY A 10 1.389 -14.353 4.847 1.00 18.10 O ATOM 136 HA3 GLY A 10 2.740 -12.058 6.561 1.00 0.00 H ATOM 137 HA2 GLY A 10 3.640 -12.399 5.064 1.00 0.00 H ATOM 138 H GLY A 10 0.876 -11.295 5.288 1.00 0.00 H ATOM 139 N ASP A 11 2.741 -14.703 6.563 1.00 15.63 N ATOM 140 CA ASP A 11 2.322 -16.090 6.647 1.00 13.76 C ATOM 141 C ASP A 11 0.966 -16.277 7.297 1.00 12.80 C ATOM 142 O ASP A 11 0.485 -17.391 7.393 1.00 15.85 O ATOM 143 CB ASP A 11 3.385 -16.889 7.396 1.00 13.73 C ATOM 144 CG ASP A 11 3.588 -16.650 8.877 1.00 16.46 C ATOM 145 OD1 ASP A 11 2.936 -15.808 9.485 1.00 17.80 O ATOM 146 OD2 ASP A 11 4.425 -17.338 9.431 1.00 14.81 O ATOM 147 HA ASP A 11 2.215 -16.456 5.626 1.00 0.00 H ATOM 148 HB2 ASP A 11 3.134 -17.943 7.276 1.00 0.00 H ATOM 149 HB3 ASP A 11 4.338 -16.686 6.908 1.00 0.00 H ATOM 150 H ASP A 11 3.436 -14.327 7.239 1.00 0.00 H ATOM 151 N GLY A 12 0.337 -15.260 7.853 1.00 14.04 N ATOM 152 CA GLY A 12 -0.983 -15.404 8.455 1.00 17.00 C ATOM 153 C GLY A 12 -0.988 -16.096 9.815 1.00 20.37 C ATOM 154 O GLY A 12 -2.061 -16.397 10.346 1.00 21.76 O ATOM 155 HA3 GLY A 12 -1.606 -15.985 7.775 1.00 0.00 H ATOM 156 HA2 GLY A 12 -1.412 -14.409 8.578 1.00 0.00 H ATOM 157 H GLY A 12 0.796 -14.327 7.862 1.00 0.00 H ATOM 158 N ARG A 13 0.154 -16.423 10.438 1.00 19.25 N ATOM 159 CA ARG A 13 0.118 -17.039 11.742 1.00 20.48 C ATOM 160 C ARG A 13 1.183 -16.681 12.735 1.00 17.81 C ATOM 161 O ARG A 13 0.951 -16.870 13.940 1.00 19.89 O ATOM 162 CB ARG A 13 0.082 -18.549 11.589 1.00 25.68 C ATOM 163 CG ARG A 13 0.969 -19.205 10.598 1.00 29.46 C ATOM 164 CD ARG A 13 0.108 -20.365 10.181 1.00 36.43 C ATOM 165 NE ARG A 13 0.888 -21.212 9.308 1.00 48.27 N ATOM 166 CZ ARG A 13 0.653 -22.519 9.205 1.00 53.14 C ATOM 167 NH1 ARG A 13 -0.339 -23.125 9.879 1.00 55.23 N ATOM 168 NH2 ARG A 13 1.436 -23.221 8.390 1.00 55.41 N ATOM 169 HA ARG A 13 -0.789 -16.620 12.178 1.00 0.00 H ATOM 170 HB2 ARG A 13 0.327 -18.972 12.563 1.00 0.00 H ATOM 171 HB3 ARG A 13 -0.941 -18.817 11.325 1.00 0.00 H ATOM 172 HG2 ARG A 13 1.191 -18.546 9.758 1.00 0.00 H ATOM 173 HG3 ARG A 13 1.902 -19.539 11.052 1.00 0.00 H ATOM 174 HD2 ARG A 13 -0.773 -20.001 9.652 1.00 0.00 H ATOM 175 HD3 ARG A 13 -0.205 -20.928 11.060 1.00 0.00 H ATOM 176 HE ARG A 13 1.654 -20.790 8.745 1.00 0.00 H ATOM 177 HH12 ARG A 13 -0.491 -24.148 9.772 1.00 0.00 H ATOM 178 HH11 ARG A 13 -0.955 -22.571 10.508 1.00 0.00 H ATOM 179 HH22 ARG A 13 1.287 -24.244 8.280 1.00 0.00 H ATOM 180 HH21 ARG A 13 2.197 -22.746 7.863 1.00 0.00 H ATOM 181 H ARG A 13 1.068 -16.232 9.980 1.00 0.00 H ATOM 182 N THR A 14 2.320 -16.162 12.297 1.00 16.36 N ATOM 183 CA THR A 14 3.318 -15.689 13.236 1.00 14.27 C ATOM 184 C THR A 14 3.186 -14.182 13.480 1.00 14.16 C ATOM 185 O THR A 14 3.697 -13.373 12.694 1.00 12.25 O ATOM 186 CB THR A 14 4.704 -16.076 12.678 1.00 12.02 C ATOM 187 OG1 THR A 14 4.589 -17.348 12.040 1.00 11.52 O ATOM 188 CG2 THR A 14 5.735 -16.133 13.788 1.00 12.38 C ATOM 189 HA THR A 14 3.176 -16.155 14.211 1.00 0.00 H ATOM 190 HB THR A 14 5.035 -15.325 11.961 1.00 0.00 H ATOM 191 HG1 THR A 14 3.930 -17.288 11.304 1.00 0.00 H ATOM 192 HG23 THR A 14 5.810 -15.155 14.263 1.00 0.00 H ATOM 193 HG21 THR A 14 5.431 -16.875 14.526 1.00 0.00 H ATOM 194 HG22 THR A 14 6.703 -16.410 13.369 1.00 0.00 H ATOM 195 H THR A 14 2.498 -16.093 11.275 1.00 0.00 H ATOM 196 N PHE A 15 2.487 -13.822 14.562 1.00 13.24 N ATOM 197 CA PHE A 15 2.245 -12.437 14.967 1.00 12.61 C ATOM 198 C PHE A 15 3.171 -12.051 16.114 1.00 14.57 C ATOM 199 O PHE A 15 3.479 -12.932 16.926 1.00 14.60 O ATOM 200 CB PHE A 15 0.812 -12.266 15.424 1.00 12.10 C ATOM 201 CG PHE A 15 -0.137 -12.439 14.258 1.00 15.53 C ATOM 202 CD1 PHE A 15 -0.577 -13.711 13.886 1.00 18.07 C ATOM 203 CD2 PHE A 15 -0.541 -11.324 13.539 1.00 16.06 C ATOM 204 CE1 PHE A 15 -1.421 -13.870 12.787 1.00 16.82 C ATOM 205 CE2 PHE A 15 -1.384 -11.487 12.441 1.00 14.16 C ATOM 206 CZ PHE A 15 -1.823 -12.754 12.062 1.00 19.06 C ATOM 207 HA PHE A 15 2.437 -11.795 14.107 1.00 0.00 H ATOM 208 HB2 PHE A 15 0.586 -13.012 16.185 1.00 0.00 H ATOM 209 HB3 PHE A 15 0.686 -11.269 15.846 1.00 0.00 H ATOM 210 HD2 PHE A 15 -0.202 -10.330 13.830 1.00 0.00 H ATOM 211 HE2 PHE A 15 -1.703 -10.614 11.872 1.00 0.00 H ATOM 212 HZ PHE A 15 -2.480 -12.870 11.200 1.00 0.00 H ATOM 213 HE1 PHE A 15 -1.763 -14.864 12.498 1.00 0.00 H ATOM 214 HD1 PHE A 15 -0.259 -14.583 14.457 1.00 0.00 H ATOM 215 H PHE A 15 2.089 -14.577 15.155 1.00 0.00 H ATOM 216 N PRO A 16 3.664 -10.815 16.218 1.00 12.30 N ATOM 217 CA PRO A 16 4.538 -10.364 17.284 1.00 15.04 C ATOM 218 C PRO A 16 3.874 -10.482 18.669 1.00 17.13 C ATOM 219 O PRO A 16 2.689 -10.208 18.847 1.00 15.22 O ATOM 220 CB PRO A 16 4.872 -8.935 16.921 1.00 13.34 C ATOM 221 CG PRO A 16 4.606 -8.860 15.449 1.00 13.39 C ATOM 222 CD PRO A 16 3.384 -9.726 15.297 1.00 13.47 C ATOM 223 HA PRO A 16 5.434 -10.979 17.368 1.00 0.00 H ATOM 224 HD3 PRO A 16 2.480 -9.188 15.583 1.00 0.00 H ATOM 225 HD2 PRO A 16 3.281 -10.089 14.274 1.00 0.00 H ATOM 226 HG3 PRO A 16 5.444 -9.256 14.876 1.00 0.00 H ATOM 227 HG2 PRO A 16 4.405 -7.835 15.136 1.00 0.00 H ATOM 228 HB2 PRO A 16 4.235 -8.238 17.466 1.00 0.00 H ATOM 229 HB3 PRO A 16 5.917 -8.715 17.137 1.00 0.00 H ATOM 230 N LYS A 17 4.634 -10.897 19.666 1.00 18.73 N ATOM 231 CA LYS A 17 4.182 -10.991 21.033 1.00 21.79 C ATOM 232 C LYS A 17 5.056 -10.084 21.900 1.00 20.78 C ATOM 233 O LYS A 17 6.202 -9.760 21.558 1.00 16.17 O ATOM 234 CB LYS A 17 4.313 -12.421 21.531 1.00 27.06 C ATOM 235 CG LYS A 17 3.081 -13.297 21.445 1.00 35.33 C ATOM 236 CD LYS A 17 2.665 -13.584 20.022 1.00 45.14 C ATOM 237 CE LYS A 17 1.161 -13.845 19.973 1.00 50.69 C ATOM 238 NZ LYS A 17 0.673 -13.769 18.603 1.00 54.42 N ATOM 239 HA LYS A 17 3.137 -10.687 21.090 1.00 0.00 H ATOM 240 HB2 LYS A 17 5.099 -12.901 20.948 1.00 0.00 H ATOM 241 HB3 LYS A 17 4.613 -12.378 22.578 1.00 0.00 H ATOM 242 HG2 LYS A 17 3.290 -14.243 21.944 1.00 0.00 H ATOM 243 HG3 LYS A 17 2.259 -12.793 21.954 1.00 0.00 H ATOM 244 HD2 LYS A 17 2.906 -12.727 19.393 1.00 0.00 H ATOM 245 HD3 LYS A 17 3.198 -14.462 19.657 1.00 0.00 H ATOM 246 HE2 LYS A 17 0.647 -13.098 20.579 1.00 0.00 H ATOM 247 HE3 LYS A 17 0.956 -14.838 20.372 1.00 0.00 H ATOM 248 HZ1 LYS A 17 0.864 -12.821 18.220 1.00 0.00 H ATOM 249 HZ2 LYS A 17 1.159 -14.483 18.023 1.00 0.00 H ATOM 250 HZ3 LYS A 17 -0.351 -13.949 18.591 1.00 0.00 H ATOM 251 H LYS A 17 5.614 -11.172 19.454 1.00 0.00 H ATOM 252 N ARG A 18 4.522 -9.684 23.068 1.00 21.76 N ATOM 253 CA ARG A 18 5.268 -8.867 24.021 1.00 20.26 C ATOM 254 C ARG A 18 6.523 -9.598 24.415 1.00 17.49 C ATOM 255 O ARG A 18 6.542 -10.810 24.629 1.00 17.29 O ATOM 256 CB ARG A 18 4.507 -8.587 25.309 1.00 25.93 C ATOM 257 CG ARG A 18 3.410 -7.519 25.222 1.00 34.38 C ATOM 258 CD ARG A 18 2.734 -7.298 26.599 1.00 39.51 C ATOM 259 NE ARG A 18 3.672 -6.929 27.663 1.00 38.79 N ATOM 260 CZ ARG A 18 3.887 -5.651 28.015 1.00 39.93 C ATOM 261 NH1 ARG A 18 3.263 -4.615 27.424 1.00 38.16 N ATOM 262 NH2 ARG A 18 4.796 -5.410 28.963 1.00 39.48 N ATOM 263 HA ARG A 18 5.463 -7.919 23.520 1.00 0.00 H ATOM 264 HB2 ARG A 18 4.041 -9.518 25.631 1.00 0.00 H ATOM 265 HB3 ARG A 18 5.228 -8.264 26.060 1.00 0.00 H ATOM 266 HG2 ARG A 18 3.852 -6.581 24.888 1.00 0.00 H ATOM 267 HG3 ARG A 18 2.656 -7.840 24.503 1.00 0.00 H ATOM 268 HD2 ARG A 18 2.231 -8.221 26.888 1.00 0.00 H ATOM 269 HD3 ARG A 18 1.998 -6.501 26.497 1.00 0.00 H ATOM 270 HE ARG A 18 4.188 -7.682 28.162 1.00 0.00 H ATOM 271 HH12 ARG A 18 3.464 -3.642 27.733 1.00 0.00 H ATOM 272 HH11 ARG A 18 2.580 -4.787 26.659 1.00 0.00 H ATOM 273 HH22 ARG A 18 4.989 -4.433 29.262 1.00 0.00 H ATOM 274 HH21 ARG A 18 5.311 -6.200 29.403 1.00 0.00 H ATOM 275 H ARG A 18 3.548 -9.965 23.299 1.00 0.00 H ATOM 276 N GLY A 19 7.588 -8.828 24.385 1.00 14.87 N ATOM 277 CA GLY A 19 8.896 -9.309 24.728 1.00 15.22 C ATOM 278 C GLY A 19 9.654 -9.768 23.504 1.00 16.86 C ATOM 279 O GLY A 19 10.824 -10.075 23.652 1.00 20.08 O ATOM 280 HA3 GLY A 19 8.796 -10.147 25.418 1.00 0.00 H ATOM 281 HA2 GLY A 19 9.454 -8.507 25.211 1.00 0.00 H ATOM 282 H GLY A 19 7.479 -7.833 24.102 1.00 0.00 H ATOM 283 N GLN A 20 9.073 -9.832 22.300 1.00 19.68 N ATOM 284 CA GLN A 20 9.819 -10.185 21.100 1.00 18.43 C ATOM 285 C GLN A 20 10.299 -8.914 20.421 1.00 17.11 C ATOM 286 O GLN A 20 9.714 -7.844 20.620 1.00 15.90 O ATOM 287 CB GLN A 20 8.938 -10.959 20.140 1.00 18.70 C ATOM 288 CG GLN A 20 8.415 -12.223 20.774 1.00 22.77 C ATOM 289 CD GLN A 20 7.540 -13.050 19.861 1.00 27.31 C ATOM 290 OE1 GLN A 20 6.856 -12.529 18.988 1.00 30.03 O ATOM 291 NE2 GLN A 20 7.472 -14.355 20.020 1.00 32.08 N ATOM 292 HA GLN A 20 10.669 -10.807 21.381 1.00 0.00 H ATOM 293 HB2 GLN A 20 8.095 -10.333 19.848 1.00 0.00 H ATOM 294 HB3 GLN A 20 9.519 -11.219 19.255 1.00 0.00 H ATOM 295 HG2 GLN A 20 9.266 -12.832 21.078 1.00 0.00 H ATOM 296 HG3 GLN A 20 7.832 -11.950 21.654 1.00 0.00 H ATOM 297 HE22 GLN A 20 8.043 -14.820 20.754 1.00 0.00 H ATOM 298 HE21 GLN A 20 6.847 -14.921 19.411 1.00 0.00 H ATOM 299 H GLN A 20 8.057 -9.623 22.219 1.00 0.00 H ATOM 300 N THR A 21 11.392 -9.007 19.669 1.00 18.31 N ATOM 301 CA THR A 21 11.962 -7.938 18.859 1.00 16.16 C ATOM 302 C THR A 21 11.458 -8.066 17.432 1.00 14.86 C ATOM 303 O THR A 21 11.654 -9.105 16.795 1.00 13.06 O ATOM 304 CB THR A 21 13.489 -8.054 18.879 1.00 15.69 C ATOM 305 OG1 THR A 21 13.882 -7.838 20.233 1.00 18.56 O ATOM 306 CG2 THR A 21 14.185 -7.075 17.949 1.00 12.37 C ATOM 307 HA THR A 21 11.665 -6.969 19.261 1.00 0.00 H ATOM 308 HB THR A 21 13.786 -9.037 18.514 1.00 0.00 H ATOM 309 HG1 THR A 21 13.463 -8.524 20.810 1.00 0.00 H ATOM 310 HG23 THR A 21 13.867 -7.262 16.923 1.00 0.00 H ATOM 311 HG21 THR A 21 13.921 -6.056 18.233 1.00 0.00 H ATOM 312 HG22 THR A 21 15.264 -7.207 18.026 1.00 0.00 H ATOM 313 H THR A 21 11.883 -9.924 19.658 1.00 0.00 H ATOM 314 N CYS A 22 10.828 -7.020 16.928 1.00 14.45 N ATOM 315 CA CYS A 22 10.360 -6.961 15.545 1.00 10.56 C ATOM 316 C CYS A 22 11.480 -6.344 14.751 1.00 12.74 C ATOM 317 O CYS A 22 12.072 -5.348 15.169 1.00 12.94 O ATOM 318 CB CYS A 22 9.140 -6.081 15.427 1.00 12.78 C ATOM 319 SG CYS A 22 7.783 -6.680 16.465 1.00 21.23 S ATOM 320 HA CYS A 22 10.093 -7.956 15.189 1.00 0.00 H ATOM 321 HB2 CYS A 22 8.812 -6.068 14.388 1.00 0.00 H ATOM 322 HB3 CYS A 22 9.402 -5.069 15.736 1.00 0.00 H ATOM 323 HG CYS A 22 6.694 -5.845 16.323 1.00 0.00 H ATOM 324 H CYS A 22 10.657 -6.200 17.544 1.00 0.00 H ATOM 325 N VAL A 23 11.825 -6.946 13.626 1.00 14.51 N ATOM 326 CA VAL A 23 12.836 -6.417 12.733 1.00 11.60 C ATOM 327 C VAL A 23 12.067 -5.995 11.477 1.00 14.01 C ATOM 328 O VAL A 23 11.416 -6.854 10.843 1.00 8.81 O ATOM 329 CB VAL A 23 13.855 -7.539 12.454 1.00 13.75 C ATOM 330 CG1 VAL A 23 14.879 -6.984 11.501 1.00 12.40 C ATOM 331 CG2 VAL A 23 14.490 -8.065 13.749 1.00 11.70 C ATOM 332 HA VAL A 23 13.394 -5.570 13.132 1.00 0.00 H ATOM 333 HB VAL A 23 13.360 -8.401 12.007 1.00 0.00 H ATOM 334 HG11 VAL A 23 14.386 -6.675 10.579 1.00 0.00 H ATOM 335 HG12 VAL A 23 15.370 -6.124 11.957 1.00 0.00 H ATOM 336 HG13 VAL A 23 15.620 -7.752 11.279 1.00 0.00 H ATOM 337 HG21 VAL A 23 15.007 -7.250 14.256 1.00 0.00 H ATOM 338 HG22 VAL A 23 13.711 -8.463 14.399 1.00 0.00 H ATOM 339 HG23 VAL A 23 15.202 -8.854 13.508 1.00 0.00 H ATOM 340 H VAL A 23 11.351 -7.836 13.371 1.00 0.00 H ATOM 341 N VAL A 24 12.071 -4.705 11.108 1.00 11.21 N ATOM 342 CA VAL A 24 11.296 -4.202 9.981 1.00 11.75 C ATOM 343 C VAL A 24 12.086 -3.318 9.018 1.00 11.24 C ATOM 344 O VAL A 24 13.129 -2.747 9.367 1.00 11.45 O ATOM 345 CB VAL A 24 10.029 -3.338 10.424 1.00 8.56 C ATOM 346 CG1 VAL A 24 9.189 -4.085 11.429 1.00 10.48 C ATOM 347 CG2 VAL A 24 10.438 -2.046 11.113 1.00 9.54 C ATOM 348 HA VAL A 24 10.993 -5.122 9.482 1.00 0.00 H ATOM 349 HB VAL A 24 9.478 -3.134 9.506 1.00 0.00 H ATOM 350 HG11 VAL A 24 8.839 -5.018 10.986 1.00 0.00 H ATOM 351 HG12 VAL A 24 9.790 -4.303 12.312 1.00 0.00 H ATOM 352 HG13 VAL A 24 8.333 -3.472 11.712 1.00 0.00 H ATOM 353 HG21 VAL A 24 11.021 -2.280 12.004 1.00 0.00 H ATOM 354 HG22 VAL A 24 11.040 -1.446 10.430 1.00 0.00 H ATOM 355 HG23 VAL A 24 9.545 -1.489 11.398 1.00 0.00 H ATOM 356 H VAL A 24 12.653 -4.035 11.650 1.00 0.00 H ATOM 357 N HIS A 25 11.648 -3.186 7.767 1.00 11.61 N ATOM 358 CA HIS A 25 12.163 -2.137 6.918 1.00 10.61 C ATOM 359 C HIS A 25 10.975 -1.225 6.720 1.00 8.44 C ATOM 360 O HIS A 25 9.856 -1.726 6.630 1.00 8.74 O ATOM 361 CB HIS A 25 12.651 -2.688 5.596 1.00 14.00 C ATOM 362 CG HIS A 25 14.185 -2.688 5.584 1.00 18.87 C ATOM 363 ND1 HIS A 25 14.855 -3.798 5.332 1.00 21.15 N ATOM 364 CD2 HIS A 25 15.023 -1.639 5.894 1.00 16.77 C ATOM 365 CE1 HIS A 25 16.130 -3.442 5.493 1.00 22.63 C ATOM 366 NE2 HIS A 25 16.223 -2.160 5.830 1.00 20.02 N ATOM 367 HA HIS A 25 13.022 -1.627 7.355 1.00 0.00 H ATOM 368 HB2 HIS A 25 12.285 -3.707 5.468 1.00 0.00 H ATOM 369 HB3 HIS A 25 12.280 -2.065 4.782 1.00 0.00 H ATOM 370 HD2 HIS A 25 14.750 -0.612 6.137 1.00 0.00 H ATOM 371 HE1 HIS A 25 16.980 -4.112 5.365 1.00 0.00 H ATOM 372 H HIS A 25 10.930 -3.843 7.399 1.00 0.00 H ATOM 373 N TYR A 26 11.106 0.091 6.722 1.00 6.45 N ATOM 374 CA TYR A 26 9.952 0.958 6.546 1.00 5.88 C ATOM 375 C TYR A 26 10.412 2.241 5.889 1.00 9.12 C ATOM 376 O TYR A 26 11.608 2.584 5.899 1.00 10.92 O ATOM 377 CB TYR A 26 9.259 1.375 7.895 1.00 9.18 C ATOM 378 CG TYR A 26 10.102 2.287 8.786 1.00 7.05 C ATOM 379 CD1 TYR A 26 11.035 1.712 9.654 1.00 10.14 C ATOM 380 CD2 TYR A 26 10.026 3.683 8.705 1.00 11.13 C ATOM 381 CE1 TYR A 26 11.890 2.508 10.413 1.00 10.27 C ATOM 382 CE2 TYR A 26 10.891 4.486 9.462 1.00 14.32 C ATOM 383 CZ TYR A 26 11.818 3.890 10.307 1.00 14.25 C ATOM 384 OH TYR A 26 12.690 4.649 11.058 1.00 17.87 O ATOM 385 HA TYR A 26 9.234 0.393 5.951 1.00 0.00 H ATOM 386 HB3 TYR A 26 9.030 0.468 8.455 1.00 0.00 H ATOM 387 HB2 TYR A 26 8.332 1.896 7.655 1.00 0.00 H ATOM 388 HD2 TYR A 26 9.290 4.148 8.049 1.00 0.00 H ATOM 389 HE2 TYR A 26 10.836 5.572 9.388 1.00 0.00 H ATOM 390 HE1 TYR A 26 12.612 2.048 11.087 1.00 0.00 H ATOM 391 HD1 TYR A 26 11.094 0.627 9.738 1.00 0.00 H ATOM 392 HH TYR A 26 13.250 5.200 10.455 1.00 0.00 H ATOM 393 H TYR A 26 12.048 0.512 6.851 1.00 0.00 H ATOM 394 N THR A 27 9.433 2.976 5.406 1.00 10.19 N ATOM 395 CA THR A 27 9.642 4.341 4.983 1.00 12.16 C ATOM 396 C THR A 27 8.529 5.084 5.719 1.00 12.54 C ATOM 397 O THR A 27 7.416 4.552 5.758 1.00 12.00 O ATOM 398 CB THR A 27 9.476 4.428 3.459 1.00 14.57 C ATOM 399 OG1 THR A 27 10.453 3.552 2.903 1.00 17.20 O ATOM 400 CG2 THR A 27 9.564 5.854 2.939 1.00 13.34 C ATOM 401 HA THR A 27 10.630 4.746 5.202 1.00 0.00 H ATOM 402 HB THR A 27 8.477 4.115 3.154 1.00 0.00 H ATOM 403 HG1 THR A 27 11.356 3.848 3.181 1.00 0.00 H ATOM 404 HG23 THR A 27 8.788 6.459 3.409 1.00 0.00 H ATOM 405 HG21 THR A 27 10.544 6.267 3.179 1.00 0.00 H ATOM 406 HG22 THR A 27 9.423 5.855 1.858 1.00 0.00 H ATOM 407 H THR A 27 8.482 2.562 5.327 1.00 0.00 H ATOM 408 N GLY A 28 8.750 6.259 6.306 1.00 12.12 N ATOM 409 CA GLY A 28 7.712 7.000 6.987 1.00 11.91 C ATOM 410 C GLY A 28 7.377 8.248 6.204 1.00 9.91 C ATOM 411 O GLY A 28 8.299 8.922 5.780 1.00 12.16 O ATOM 412 HA3 GLY A 28 8.059 7.279 7.982 1.00 0.00 H ATOM 413 HA2 GLY A 28 6.821 6.378 7.075 1.00 0.00 H ATOM 414 H GLY A 28 9.709 6.660 6.273 1.00 0.00 H ATOM 415 N MET A 29 6.126 8.591 5.991 1.00 11.09 N ATOM 416 CA MET A 29 5.708 9.776 5.259 1.00 15.26 C ATOM 417 C MET A 29 4.709 10.556 6.109 1.00 17.17 C ATOM 418 O MET A 29 3.948 9.983 6.901 1.00 18.32 O ATOM 419 CB MET A 29 4.938 9.499 3.975 1.00 13.05 C ATOM 420 CG MET A 29 5.657 9.029 2.733 1.00 17.50 C ATOM 421 SD MET A 29 6.339 7.358 2.722 1.00 24.52 S ATOM 422 CE MET A 29 4.974 6.293 3.008 1.00 12.55 C ATOM 423 HA MET A 29 6.639 10.294 5.028 1.00 0.00 H ATOM 424 HB2 MET A 29 4.197 8.736 4.214 1.00 0.00 H ATOM 425 HB3 MET A 29 4.430 10.426 3.709 1.00 0.00 H ATOM 426 HG2 MET A 29 6.484 9.717 2.558 1.00 0.00 H ATOM 427 HG3 MET A 29 4.950 9.095 1.906 1.00 0.00 H ATOM 428 HE1 MET A 29 4.523 6.533 3.971 1.00 0.00 H ATOM 429 HE2 MET A 29 4.237 6.428 2.216 1.00 0.00 H ATOM 430 HE3 MET A 29 5.317 5.258 3.014 1.00 0.00 H ATOM 431 H MET A 29 5.383 7.971 6.373 1.00 0.00 H ATOM 432 N LEU A 30 4.685 11.878 5.990 1.00 16.45 N ATOM 433 CA LEU A 30 3.619 12.667 6.561 1.00 17.79 C ATOM 434 C LEU A 30 2.494 12.452 5.575 1.00 20.25 C ATOM 435 O LEU A 30 2.692 12.119 4.408 1.00 18.07 O ATOM 436 CB LEU A 30 3.982 14.112 6.595 1.00 15.33 C ATOM 437 CG LEU A 30 5.124 14.424 7.519 1.00 16.92 C ATOM 438 CD1 LEU A 30 5.434 15.891 7.401 1.00 23.63 C ATOM 439 CD2 LEU A 30 4.759 14.106 8.940 1.00 18.51 C ATOM 440 HA LEU A 30 3.381 12.386 7.587 1.00 0.00 H ATOM 441 HB2 LEU A 30 4.259 14.422 5.587 1.00 0.00 H ATOM 442 HB3 LEU A 30 3.110 14.679 6.921 1.00 0.00 H ATOM 443 HG LEU A 30 5.989 13.821 7.245 1.00 0.00 H ATOM 444 HD21 LEU A 30 3.895 14.702 9.234 1.00 0.00 H ATOM 445 HD22 LEU A 30 4.517 13.046 9.023 1.00 0.00 H ATOM 446 HD23 LEU A 30 5.601 14.340 9.591 1.00 0.00 H ATOM 447 HD11 LEU A 30 5.709 16.121 6.372 1.00 0.00 H ATOM 448 HD12 LEU A 30 4.554 16.471 7.681 1.00 0.00 H ATOM 449 HD13 LEU A 30 6.262 16.141 8.065 1.00 0.00 H ATOM 450 H LEU A 30 5.451 12.356 5.474 1.00 0.00 H ATOM 451 N GLU A 31 1.261 12.632 5.969 1.00 25.81 N ATOM 452 CA GLU A 31 0.153 12.353 5.071 1.00 30.89 C ATOM 453 C GLU A 31 0.115 13.217 3.792 1.00 30.25 C ATOM 454 O GLU A 31 -0.713 12.981 2.921 1.00 32.09 O ATOM 455 CB GLU A 31 -1.079 12.526 5.931 1.00 35.18 C ATOM 456 CG GLU A 31 -1.093 14.052 6.211 1.00 42.68 C ATOM 457 CD GLU A 31 -0.678 14.638 7.571 1.00 47.03 C ATOM 458 OE1 GLU A 31 -1.545 14.768 8.435 1.00 43.56 O ATOM 459 OE2 GLU A 31 0.459 15.002 7.717 1.00 48.16 O ATOM 460 HA GLU A 31 0.242 11.349 4.656 1.00 0.00 H ATOM 461 HB2 GLU A 31 -1.977 12.216 5.397 1.00 0.00 H ATOM 462 HB3 GLU A 31 -0.994 11.958 6.857 1.00 0.00 H ATOM 463 HG2 GLU A 31 -0.433 14.504 5.470 1.00 0.00 H ATOM 464 HG3 GLU A 31 -2.116 14.385 6.035 1.00 0.00 H ATOM 465 H GLU A 31 1.071 12.977 6.932 1.00 0.00 H ATOM 466 N ASP A 32 0.894 14.305 3.660 1.00 31.95 N ATOM 467 CA ASP A 32 0.969 15.045 2.399 1.00 30.76 C ATOM 468 C ASP A 32 1.991 14.384 1.440 1.00 29.76 C ATOM 469 O ASP A 32 2.368 14.965 0.422 1.00 30.42 O ATOM 470 CB ASP A 32 1.374 16.497 2.694 1.00 33.79 C ATOM 471 CG ASP A 32 2.872 16.754 2.833 1.00 38.17 C ATOM 472 OD1 ASP A 32 3.520 16.144 3.684 1.00 43.43 O ATOM 473 OD2 ASP A 32 3.391 17.556 2.060 1.00 42.49 O ATOM 474 HA ASP A 32 -0.007 15.030 1.913 1.00 0.00 H ATOM 475 HB2 ASP A 32 1.002 17.120 1.881 1.00 0.00 H ATOM 476 HB3 ASP A 32 0.895 16.795 3.627 1.00 0.00 H ATOM 477 H ASP A 32 1.456 14.628 4.473 1.00 0.00 H ATOM 478 N GLY A 33 2.552 13.217 1.799 1.00 25.42 N ATOM 479 CA GLY A 33 3.499 12.515 0.971 1.00 19.75 C ATOM 480 C GLY A 33 4.927 12.838 1.359 1.00 22.48 C ATOM 481 O GLY A 33 5.823 12.085 0.984 1.00 23.19 O ATOM 482 HA3 GLY A 33 3.341 12.802 -0.069 1.00 0.00 H ATOM 483 HA2 GLY A 33 3.337 11.443 1.079 1.00 0.00 H ATOM 484 H GLY A 33 2.291 12.802 2.716 1.00 0.00 H ATOM 485 N LYS A 34 5.248 13.882 2.129 1.00 21.57 N ATOM 486 CA LYS A 34 6.641 14.184 2.450 1.00 23.28 C ATOM 487 C LYS A 34 7.287 13.069 3.267 1.00 22.44 C ATOM 488 O LYS A 34 6.794 12.705 4.334 1.00 24.08 O ATOM 489 CB LYS A 34 6.668 15.539 3.188 1.00 25.82 C ATOM 490 CG LYS A 34 8.011 16.183 3.572 1.00 36.08 C ATOM 491 CD LYS A 34 8.417 15.775 4.999 1.00 47.82 C ATOM 492 CE LYS A 34 9.807 16.216 5.465 1.00 53.71 C ATOM 493 NZ LYS A 34 10.210 15.402 6.607 1.00 55.13 N ATOM 494 HA LYS A 34 7.231 14.252 1.536 1.00 0.00 H ATOM 495 HB2 LYS A 34 6.147 16.254 2.551 1.00 0.00 H ATOM 496 HB3 LYS A 34 6.108 15.404 4.114 1.00 0.00 H ATOM 497 HG2 LYS A 34 8.780 15.854 2.872 1.00 0.00 H ATOM 498 HG3 LYS A 34 7.916 17.268 3.522 1.00 0.00 H ATOM 499 HD2 LYS A 34 7.686 16.201 5.686 1.00 0.00 H ATOM 500 HD3 LYS A 34 8.377 14.687 5.057 1.00 0.00 H ATOM 501 HE2 LYS A 34 9.778 17.266 5.757 1.00 0.00 H ATOM 502 HE3 LYS A 34 10.523 16.086 4.653 1.00 0.00 H ATOM 503 HZ1 LYS A 34 9.526 15.528 7.380 1.00 0.00 H ATOM 504 HZ2 LYS A 34 10.237 14.401 6.326 1.00 0.00 H ATOM 505 HZ3 LYS A 34 11.154 15.699 6.927 1.00 0.00 H ATOM 506 H LYS A 34 4.493 14.490 2.506 1.00 0.00 H ATOM 507 N LYS A 35 8.381 12.497 2.781 1.00 21.72 N ATOM 508 CA LYS A 35 9.095 11.457 3.486 1.00 22.20 C ATOM 509 C LYS A 35 9.893 12.026 4.651 1.00 24.24 C ATOM 510 O LYS A 35 10.636 12.996 4.469 1.00 26.11 O ATOM 511 CB LYS A 35 10.006 10.812 2.517 1.00 25.86 C ATOM 512 CG LYS A 35 10.122 9.356 2.814 1.00 35.05 C ATOM 513 CD LYS A 35 11.410 8.831 2.252 1.00 38.99 C ATOM 514 CE LYS A 35 12.540 9.198 3.200 1.00 43.82 C ATOM 515 NZ LYS A 35 13.794 8.823 2.588 1.00 44.58 N ATOM 516 HA LYS A 35 8.388 10.738 3.900 1.00 0.00 H ATOM 517 HB2 LYS A 35 9.613 10.944 1.509 1.00 0.00 H ATOM 518 HB3 LYS A 35 10.991 11.274 2.585 1.00 0.00 H ATOM 519 HG2 LYS A 35 10.107 9.203 3.893 1.00 0.00 H ATOM 520 HG3 LYS A 35 9.285 8.825 2.361 1.00 0.00 H ATOM 521 HD2 LYS A 35 11.352 7.747 2.152 1.00 0.00 H ATOM 522 HD3 LYS A 35 11.592 9.276 1.274 1.00 0.00 H ATOM 523 HE2 LYS A 35 12.417 8.665 4.143 1.00 0.00 H ATOM 524 HE3 LYS A 35 12.529 10.272 3.387 1.00 0.00 H ATOM 525 HZ1 LYS A 35 13.799 7.798 2.410 1.00 0.00 H ATOM 526 HZ2 LYS A 35 13.906 9.333 1.688 1.00 0.00 H ATOM 527 HZ3 LYS A 35 14.577 9.069 3.227 1.00 0.00 H ATOM 528 H LYS A 35 8.739 12.809 1.856 1.00 0.00 H ATOM 529 N PHE A 36 9.819 11.499 5.868 1.00 20.07 N ATOM 530 CA PHE A 36 10.615 12.066 6.920 1.00 17.17 C ATOM 531 C PHE A 36 11.649 11.091 7.416 1.00 16.55 C ATOM 532 O PHE A 36 12.541 11.487 8.162 1.00 17.45 O ATOM 533 CB PHE A 36 9.685 12.522 8.058 1.00 18.22 C ATOM 534 CG PHE A 36 8.922 11.448 8.821 1.00 14.64 C ATOM 535 CD1 PHE A 36 9.538 10.757 9.866 1.00 17.16 C ATOM 536 CD2 PHE A 36 7.625 11.141 8.452 1.00 13.89 C ATOM 537 CE1 PHE A 36 8.862 9.736 10.534 1.00 19.59 C ATOM 538 CE2 PHE A 36 6.947 10.123 9.127 1.00 15.84 C ATOM 539 CZ PHE A 36 7.564 9.422 10.159 1.00 17.97 C ATOM 540 HA PHE A 36 11.159 12.927 6.532 1.00 0.00 H ATOM 541 HB2 PHE A 36 10.295 13.064 8.781 1.00 0.00 H ATOM 542 HB3 PHE A 36 8.949 13.200 7.626 1.00 0.00 H ATOM 543 HD2 PHE A 36 7.138 11.687 7.644 1.00 0.00 H ATOM 544 HE2 PHE A 36 5.924 9.875 8.843 1.00 0.00 H ATOM 545 HZ PHE A 36 7.027 8.625 10.673 1.00 0.00 H ATOM 546 HE1 PHE A 36 9.349 9.190 11.342 1.00 0.00 H ATOM 547 HD1 PHE A 36 10.554 11.017 10.162 1.00 0.00 H ATOM 548 H PHE A 36 9.195 10.689 6.056 1.00 0.00 H ATOM 549 N ASP A 37 11.595 9.812 7.050 1.00 17.26 N ATOM 550 CA ASP A 37 12.546 8.846 7.565 1.00 16.20 C ATOM 551 C ASP A 37 12.425 7.541 6.834 1.00 14.13 C ATOM 552 O ASP A 37 11.343 7.256 6.327 1.00 11.27 O ATOM 553 CB ASP A 37 12.265 8.607 9.025 1.00 21.59 C ATOM 554 CG ASP A 37 13.235 7.730 9.780 1.00 21.87 C ATOM 555 OD1 ASP A 37 14.387 7.596 9.393 1.00 21.08 O ATOM 556 OD2 ASP A 37 12.808 7.205 10.796 1.00 29.35 O ATOM 557 HA ASP A 37 13.552 9.241 7.426 1.00 0.00 H ATOM 558 HB2 ASP A 37 12.248 9.578 9.519 1.00 0.00 H ATOM 559 HB3 ASP A 37 11.280 8.146 9.098 1.00 0.00 H ATOM 560 H ASP A 37 10.859 9.501 6.384 1.00 0.00 H ATOM 561 N SER A 38 13.479 6.739 6.794 1.00 14.19 N ATOM 562 CA SER A 38 13.441 5.433 6.175 1.00 14.11 C ATOM 563 C SER A 38 14.594 4.568 6.654 1.00 12.39 C ATOM 564 O SER A 38 15.738 5.024 6.649 1.00 14.25 O ATOM 565 CB SER A 38 13.498 5.653 4.675 1.00 16.67 C ATOM 566 OG SER A 38 13.890 4.467 4.027 1.00 16.54 O ATOM 567 HA SER A 38 12.529 4.902 6.447 1.00 0.00 H ATOM 568 HB2 SER A 38 14.218 6.441 4.453 1.00 0.00 H ATOM 569 HB3 SER A 38 12.513 5.952 4.316 1.00 0.00 H ATOM 570 HG SER A 38 13.924 4.622 3.050 1.00 0.00 H ATOM 571 H SER A 38 14.369 7.062 7.225 1.00 0.00 H ATOM 572 N SER A 39 14.375 3.317 7.049 1.00 12.82 N ATOM 573 CA SER A 39 15.470 2.446 7.442 1.00 13.81 C ATOM 574 C SER A 39 16.309 2.012 6.235 1.00 19.33 C ATOM 575 O SER A 39 17.502 1.694 6.323 1.00 18.45 O ATOM 576 CB SER A 39 14.901 1.232 8.119 1.00 10.44 C ATOM 577 OG SER A 39 13.947 0.565 7.294 1.00 11.71 O ATOM 578 HA SER A 39 16.123 2.995 8.120 1.00 0.00 H ATOM 579 HB2 SER A 39 14.414 1.539 9.045 1.00 0.00 H ATOM 580 HB3 SER A 39 15.713 0.542 8.349 1.00 0.00 H ATOM 581 HG SER A 39 13.203 1.184 7.086 1.00 0.00 H ATOM 582 H SER A 39 13.401 2.955 7.077 1.00 0.00 H ATOM 583 N ARG A 40 15.686 2.008 5.053 1.00 22.85 N ATOM 584 CA ARG A 40 16.328 1.628 3.806 1.00 28.87 C ATOM 585 C ARG A 40 17.469 2.588 3.495 1.00 32.07 C ATOM 586 O ARG A 40 18.532 2.175 3.038 1.00 35.64 O ATOM 587 CB ARG A 40 15.271 1.625 2.693 1.00 29.08 C ATOM 588 CG ARG A 40 14.387 0.370 2.711 1.00 33.21 C ATOM 589 CD ARG A 40 13.318 0.316 1.639 1.00 39.69 C ATOM 590 NE ARG A 40 12.445 -0.841 1.846 1.00 42.31 N ATOM 591 CZ ARG A 40 11.154 -0.705 2.139 1.00 47.04 C ATOM 592 NH1 ARG A 40 10.574 0.522 2.261 1.00 45.05 N ATOM 593 NH2 ARG A 40 10.453 -1.840 2.367 1.00 47.64 N ATOM 594 HA ARG A 40 16.756 0.629 3.886 1.00 0.00 H ATOM 595 HB2 ARG A 40 14.634 2.501 2.816 1.00 0.00 H ATOM 596 HB3 ARG A 40 15.779 1.679 1.730 1.00 0.00 H ATOM 597 HG2 ARG A 40 15.033 -0.499 2.587 1.00 0.00 H ATOM 598 HG3 ARG A 40 13.894 0.319 3.682 1.00 0.00 H ATOM 599 HD2 ARG A 40 13.793 0.237 0.661 1.00 0.00 H ATOM 600 HD3 ARG A 40 12.722 1.228 1.680 1.00 0.00 H ATOM 601 HE ARG A 40 12.845 -1.797 1.762 1.00 0.00 H ATOM 602 HH12 ARG A 40 9.563 0.599 2.491 1.00 0.00 H ATOM 603 HH11 ARG A 40 11.143 1.382 2.124 1.00 0.00 H ATOM 604 HH22 ARG A 40 9.441 -1.788 2.600 1.00 0.00 H ATOM 605 HH21 ARG A 40 10.927 -2.764 2.309 1.00 0.00 H ATOM 606 H ARG A 40 14.686 2.293 5.024 1.00 0.00 H ATOM 607 N ASP A 41 17.307 3.861 3.842 1.00 34.74 N ATOM 608 CA ASP A 41 18.342 4.846 3.623 1.00 35.82 C ATOM 609 C ASP A 41 19.481 4.680 4.594 1.00 35.25 C ATOM 610 O ASP A 41 20.522 5.270 4.373 1.00 37.94 O ATOM 611 CB ASP A 41 17.828 6.256 3.797 1.00 43.61 C ATOM 612 CG ASP A 41 16.729 6.738 2.853 1.00 50.91 C ATOM 613 OD1 ASP A 41 16.282 6.022 1.947 1.00 55.40 O ATOM 614 OD2 ASP A 41 16.317 7.877 3.059 1.00 54.69 O ATOM 615 HA ASP A 41 18.679 4.687 2.599 1.00 0.00 H ATOM 616 HB2 ASP A 41 17.442 6.338 4.813 1.00 0.00 H ATOM 617 HB3 ASP A 41 18.677 6.928 3.677 1.00 0.00 H ATOM 618 H ASP A 41 16.412 4.156 4.283 1.00 0.00 H ATOM 619 N ARG A 42 19.301 4.002 5.720 1.00 32.53 N ATOM 620 CA ARG A 42 20.384 3.732 6.655 1.00 28.75 C ATOM 621 C ARG A 42 20.952 2.357 6.399 1.00 28.75 C ATOM 622 O ARG A 42 21.867 1.908 7.090 1.00 29.09 O ATOM 623 CB ARG A 42 19.925 3.715 8.072 1.00 25.86 C ATOM 624 CG ARG A 42 19.447 5.065 8.505 1.00 28.19 C ATOM 625 CD ARG A 42 19.167 4.996 9.987 1.00 22.63 C ATOM 626 NE ARG A 42 17.992 4.206 10.278 1.00 20.97 N ATOM 627 CZ ARG A 42 16.787 4.766 10.322 1.00 18.54 C ATOM 628 NH1 ARG A 42 16.617 6.060 10.089 1.00 17.58 N ATOM 629 NH2 ARG A 42 15.735 4.017 10.606 1.00 16.00 N ATOM 630 HA ARG A 42 21.114 4.528 6.504 1.00 0.00 H ATOM 631 HB2 ARG A 42 19.109 3.000 8.172 1.00 0.00 H ATOM 632 HB3 ARG A 42 20.754 3.410 8.710 1.00 0.00 H ATOM 633 HG2 ARG A 42 20.214 5.813 8.306 1.00 0.00 H ATOM 634 HG3 ARG A 42 18.537 5.328 7.966 1.00 0.00 H ATOM 635 HD2 ARG A 42 19.014 6.007 10.364 1.00 0.00 H ATOM 636 HD3 ARG A 42 20.026 4.548 10.488 1.00 0.00 H ATOM 637 HE ARG A 42 18.091 3.186 10.455 1.00 0.00 H ATOM 638 HH12 ARG A 42 15.664 6.475 10.129 1.00 0.00 H ATOM 639 HH11 ARG A 42 17.436 6.660 9.866 1.00 0.00 H ATOM 640 HH22 ARG A 42 14.787 4.444 10.643 1.00 0.00 H ATOM 641 HH21 ARG A 42 15.855 3.001 10.792 1.00 0.00 H ATOM 642 H ARG A 42 18.349 3.649 5.944 1.00 0.00 H ATOM 643 N ASN A 43 20.302 1.644 5.481 1.00 29.32 N ATOM 644 CA ASN A 43 20.642 0.300 5.096 1.00 30.24 C ATOM 645 C ASN A 43 20.723 -0.671 6.260 1.00 26.99 C ATOM 646 O ASN A 43 21.398 -1.689 6.173 1.00 25.45 O ATOM 647 CB ASN A 43 21.968 0.327 4.315 1.00 40.78 C ATOM 648 CG ASN A 43 21.881 1.102 2.999 1.00 46.30 C ATOM 649 OD1 ASN A 43 22.489 2.159 2.828 1.00 50.62 O ATOM 650 ND2 ASN A 43 21.194 0.616 1.973 1.00 49.52 N ATOM 651 HA ASN A 43 19.833 -0.072 4.468 1.00 0.00 H ATOM 652 HB2 ASN A 43 22.729 0.793 4.941 1.00 0.00 H ATOM 653 HB3 ASN A 43 22.260 -0.700 4.093 1.00 0.00 H ATOM 654 HD22 ASN A 43 20.666 -0.274 2.075 1.00 0.00 H ATOM 655 HD21 ASN A 43 21.183 1.126 1.066 1.00 0.00 H ATOM 656 H ASN A 43 19.490 2.091 5.008 1.00 0.00 H ATOM 657 N LYS A 44 20.006 -0.431 7.356 1.00 23.50 N ATOM 658 CA LYS A 44 19.970 -1.341 8.500 1.00 22.77 C ATOM 659 C LYS A 44 18.495 -1.473 8.808 1.00 19.70 C ATOM 660 O LYS A 44 17.804 -0.464 8.708 1.00 20.69 O ATOM 661 CB LYS A 44 20.620 -0.783 9.746 1.00 23.25 C ATOM 662 CG LYS A 44 22.115 -0.915 9.811 1.00 33.09 C ATOM 663 CD LYS A 44 22.545 -0.256 11.110 1.00 43.37 C ATOM 664 CE LYS A 44 24.030 -0.491 11.424 1.00 52.55 C ATOM 665 NZ LYS A 44 24.239 -0.871 12.823 1.00 57.57 N ATOM 666 HA LYS A 44 20.500 -2.260 8.251 1.00 0.00 H ATOM 667 HB2 LYS A 44 20.373 0.277 9.808 1.00 0.00 H ATOM 668 HB3 LYS A 44 20.199 -1.303 10.606 1.00 0.00 H ATOM 669 HG2 LYS A 44 22.402 -1.967 9.808 1.00 0.00 H ATOM 670 HG3 LYS A 44 22.576 -0.411 8.961 1.00 0.00 H ATOM 671 HD2 LYS A 44 22.369 0.817 11.033 1.00 0.00 H ATOM 672 HD3 LYS A 44 21.946 -0.664 11.924 1.00 0.00 H ATOM 673 HE2 LYS A 44 24.583 0.426 11.221 1.00 0.00 H ATOM 674 HE3 LYS A 44 24.404 -1.289 10.782 1.00 0.00 H ATOM 675 HZ1 LYS A 44 23.891 -0.112 13.443 1.00 0.00 H ATOM 676 HZ2 LYS A 44 23.720 -1.750 13.024 1.00 0.00 H ATOM 677 HZ3 LYS A 44 25.254 -1.020 12.993 1.00 0.00 H ATOM 678 H LYS A 44 19.446 0.444 7.400 1.00 0.00 H ATOM 679 N PRO A 45 17.923 -2.627 9.130 1.00 15.27 N ATOM 680 CA PRO A 45 16.555 -2.750 9.599 1.00 13.07 C ATOM 681 C PRO A 45 16.391 -2.025 10.929 1.00 14.43 C ATOM 682 O PRO A 45 17.310 -1.961 11.751 1.00 15.20 O ATOM 683 CB PRO A 45 16.326 -4.222 9.737 1.00 12.76 C ATOM 684 CG PRO A 45 17.456 -4.868 8.991 1.00 17.35 C ATOM 685 CD PRO A 45 18.607 -3.907 9.200 1.00 16.34 C ATOM 686 HA PRO A 45 15.832 -2.301 8.918 1.00 0.00 H ATOM 687 HD3 PRO A 45 19.080 -4.055 10.171 1.00 0.00 H ATOM 688 HD2 PRO A 45 19.356 -4.003 8.414 1.00 0.00 H ATOM 689 HG3 PRO A 45 17.218 -4.968 7.932 1.00 0.00 H ATOM 690 HG2 PRO A 45 17.687 -5.850 9.405 1.00 0.00 H ATOM 691 HB2 PRO A 45 16.344 -4.515 10.787 1.00 0.00 H ATOM 692 HB3 PRO A 45 15.368 -4.503 9.299 1.00 0.00 H ATOM 693 N PHE A 46 15.178 -1.543 11.159 1.00 13.40 N ATOM 694 CA PHE A 46 14.809 -0.907 12.402 1.00 11.92 C ATOM 695 C PHE A 46 14.395 -2.059 13.312 1.00 14.12 C ATOM 696 O PHE A 46 13.730 -2.995 12.846 1.00 14.87 O ATOM 697 CB PHE A 46 13.663 0.022 12.119 1.00 8.66 C ATOM 698 CG PHE A 46 13.115 0.715 13.344 1.00 10.89 C ATOM 699 CD1 PHE A 46 13.956 1.439 14.177 1.00 12.35 C ATOM 700 CD2 PHE A 46 11.747 0.640 13.620 1.00 12.78 C ATOM 701 CE1 PHE A 46 13.429 2.087 15.291 1.00 14.37 C ATOM 702 CE2 PHE A 46 11.231 1.297 14.730 1.00 11.72 C ATOM 703 CZ PHE A 46 12.072 2.016 15.566 1.00 13.97 C ATOM 704 HA PHE A 46 15.603 -0.319 12.863 1.00 0.00 H ATOM 705 HB2 PHE A 46 14.004 0.784 11.418 1.00 0.00 H ATOM 706 HB3 PHE A 46 12.859 -0.555 11.663 1.00 0.00 H ATOM 707 HD2 PHE A 46 11.088 0.068 12.967 1.00 0.00 H ATOM 708 HE2 PHE A 46 10.163 1.247 14.944 1.00 0.00 H ATOM 709 HZ PHE A 46 11.666 2.526 16.440 1.00 0.00 H ATOM 710 HE1 PHE A 46 14.087 2.653 15.950 1.00 0.00 H ATOM 711 HD1 PHE A 46 15.023 1.500 13.961 1.00 0.00 H ATOM 712 H PHE A 46 14.460 -1.626 10.411 1.00 0.00 H ATOM 713 N LYS A 47 14.755 -2.049 14.589 1.00 14.39 N ATOM 714 CA LYS A 47 14.388 -3.123 15.490 1.00 13.90 C ATOM 715 C LYS A 47 13.771 -2.514 16.712 1.00 12.34 C ATOM 716 O LYS A 47 14.232 -1.471 17.162 1.00 15.33 O ATOM 717 CB LYS A 47 15.579 -3.931 15.972 1.00 13.22 C ATOM 718 CG LYS A 47 16.270 -4.714 14.876 1.00 21.54 C ATOM 719 CD LYS A 47 17.398 -5.539 15.441 1.00 24.44 C ATOM 720 CE LYS A 47 18.014 -6.244 14.254 1.00 31.95 C ATOM 721 NZ LYS A 47 18.932 -7.286 14.688 1.00 37.32 N ATOM 722 HA LYS A 47 13.716 -3.783 14.941 1.00 0.00 H ATOM 723 HB2 LYS A 47 16.303 -3.246 16.414 1.00 0.00 H ATOM 724 HB3 LYS A 47 15.234 -4.633 16.731 1.00 0.00 H ATOM 725 HG2 LYS A 47 15.547 -5.375 14.398 1.00 0.00 H ATOM 726 HG3 LYS A 47 16.669 -4.019 14.137 1.00 0.00 H ATOM 727 HD2 LYS A 47 18.133 -4.898 15.928 1.00 0.00 H ATOM 728 HD3 LYS A 47 17.017 -6.264 16.160 1.00 0.00 H ATOM 729 HE2 LYS A 47 18.558 -5.518 13.650 1.00 0.00 H ATOM 730 HE3 LYS A 47 17.222 -6.693 13.655 1.00 0.00 H ATOM 731 HZ1 LYS A 47 19.692 -6.862 15.257 1.00 0.00 H ATOM 732 HZ2 LYS A 47 18.416 -7.984 15.261 1.00 0.00 H ATOM 733 HZ3 LYS A 47 19.341 -7.755 13.855 1.00 0.00 H ATOM 734 H LYS A 47 15.314 -1.251 14.952 1.00 0.00 H ATOM 735 N PHE A 48 12.740 -3.104 17.299 1.00 14.55 N ATOM 736 CA PHE A 48 12.213 -2.605 18.569 1.00 12.14 C ATOM 737 C PHE A 48 11.554 -3.778 19.249 1.00 11.95 C ATOM 738 O PHE A 48 11.117 -4.709 18.572 1.00 8.93 O ATOM 739 CB PHE A 48 11.166 -1.472 18.392 1.00 12.33 C ATOM 740 CG PHE A 48 9.877 -1.777 17.635 1.00 10.69 C ATOM 741 CD1 PHE A 48 9.849 -1.637 16.236 1.00 11.52 C ATOM 742 CD2 PHE A 48 8.726 -2.179 18.329 1.00 9.86 C ATOM 743 CE1 PHE A 48 8.664 -1.893 15.538 1.00 10.68 C ATOM 744 CE2 PHE A 48 7.551 -2.429 17.615 1.00 13.67 C ATOM 745 CZ PHE A 48 7.519 -2.286 16.221 1.00 9.02 C ATOM 746 HA PHE A 48 13.033 -2.180 19.149 1.00 0.00 H ATOM 747 HB2 PHE A 48 10.881 -1.139 19.390 1.00 0.00 H ATOM 748 HB3 PHE A 48 11.662 -0.656 17.866 1.00 0.00 H ATOM 749 HD2 PHE A 48 8.748 -2.295 19.413 1.00 0.00 H ATOM 750 HE2 PHE A 48 6.651 -2.738 18.147 1.00 0.00 H ATOM 751 HZ PHE A 48 6.597 -2.483 15.673 1.00 0.00 H ATOM 752 HE1 PHE A 48 8.638 -1.784 14.454 1.00 0.00 H ATOM 753 HD1 PHE A 48 10.746 -1.331 15.698 1.00 0.00 H ATOM 754 H PHE A 48 12.300 -3.933 16.851 1.00 0.00 H ATOM 755 N MET A 49 11.456 -3.741 20.573 1.00 10.97 N ATOM 756 CA MET A 49 10.882 -4.826 21.314 1.00 12.19 C ATOM 757 C MET A 49 9.508 -4.416 21.766 1.00 12.20 C ATOM 758 O MET A 49 9.305 -3.305 22.307 1.00 11.53 O ATOM 759 CB MET A 49 11.746 -5.129 22.510 1.00 15.68 C ATOM 760 CG MET A 49 11.251 -6.338 23.295 1.00 22.27 C ATOM 761 SD MET A 49 12.276 -6.669 24.743 1.00 31.08 S ATOM 762 CE MET A 49 13.871 -6.822 23.982 1.00 21.16 C ATOM 763 HA MET A 49 10.817 -5.718 20.691 1.00 0.00 H ATOM 764 HB2 MET A 49 12.762 -5.326 22.167 1.00 0.00 H ATOM 765 HB3 MET A 49 11.748 -4.261 23.169 1.00 0.00 H ATOM 766 HG2 MET A 49 11.268 -7.212 22.644 1.00 0.00 H ATOM 767 HG3 MET A 49 10.228 -6.151 23.623 1.00 0.00 H ATOM 768 HE1 MET A 49 13.851 -7.640 23.261 1.00 0.00 H ATOM 769 HE2 MET A 49 14.119 -5.892 23.471 1.00 0.00 H ATOM 770 HE3 MET A 49 14.619 -7.029 24.747 1.00 0.00 H ATOM 771 H MET A 49 11.804 -2.905 21.085 1.00 0.00 H ATOM 772 N LEU A 50 8.576 -5.333 21.561 1.00 10.91 N ATOM 773 CA LEU A 50 7.214 -5.114 22.024 1.00 12.78 C ATOM 774 C LEU A 50 7.174 -5.177 23.548 1.00 10.85 C ATOM 775 O LEU A 50 7.649 -6.121 24.173 1.00 11.45 O ATOM 776 CB LEU A 50 6.285 -6.182 21.447 1.00 14.85 C ATOM 777 CG LEU A 50 5.137 -5.723 20.569 1.00 18.80 C ATOM 778 CD1 LEU A 50 5.548 -4.730 19.505 1.00 17.51 C ATOM 779 CD2 LEU A 50 4.623 -6.957 19.887 1.00 22.26 C ATOM 780 HA LEU A 50 6.881 -4.132 21.690 1.00 0.00 H ATOM 781 HB2 LEU A 50 6.898 -6.860 20.853 1.00 0.00 H ATOM 782 HB3 LEU A 50 5.854 -6.726 22.287 1.00 0.00 H ATOM 783 HG LEU A 50 4.398 -5.219 21.192 1.00 0.00 H ATOM 784 HD21 LEU A 50 5.422 -7.402 19.293 1.00 0.00 H ATOM 785 HD22 LEU A 50 4.285 -7.672 20.638 1.00 0.00 H ATOM 786 HD23 LEU A 50 3.790 -6.691 19.236 1.00 0.00 H ATOM 787 HD11 LEU A 50 5.970 -3.844 19.980 1.00 0.00 H ATOM 788 HD12 LEU A 50 6.295 -5.185 18.854 1.00 0.00 H ATOM 789 HD13 LEU A 50 4.675 -4.448 18.917 1.00 0.00 H ATOM 790 H LEU A 50 8.818 -6.215 21.066 1.00 0.00 H ATOM 791 N GLY A 51 6.597 -4.171 24.174 1.00 11.35 N ATOM 792 CA GLY A 51 6.482 -4.116 25.602 1.00 13.23 C ATOM 793 C GLY A 51 7.617 -3.306 26.184 1.00 15.97 C ATOM 794 O GLY A 51 7.541 -2.961 27.358 1.00 15.21 O ATOM 795 HA3 GLY A 51 6.517 -5.128 26.006 1.00 0.00 H ATOM 796 HA2 GLY A 51 5.533 -3.652 25.870 1.00 0.00 H ATOM 797 H GLY A 51 6.210 -3.387 23.611 1.00 0.00 H ATOM 798 N LYS A 52 8.641 -2.891 25.448 1.00 13.94 N ATOM 799 CA LYS A 52 9.752 -2.191 26.064 1.00 15.18 C ATOM 800 C LYS A 52 9.502 -0.687 26.159 1.00 14.43 C ATOM 801 O LYS A 52 10.396 0.042 26.566 1.00 17.00 O ATOM 802 CB LYS A 52 11.048 -2.451 25.273 1.00 17.38 C ATOM 803 CG LYS A 52 12.243 -2.162 26.182 1.00 24.06 C ATOM 804 CD LYS A 52 13.640 -2.281 25.620 1.00 29.26 C ATOM 805 CE LYS A 52 14.539 -1.700 26.718 1.00 34.26 C ATOM 806 NZ LYS A 52 15.936 -2.009 26.490 1.00 41.82 N ATOM 807 HA LYS A 52 9.854 -2.577 27.078 1.00 0.00 H ATOM 808 HB2 LYS A 52 11.077 -3.491 24.948 1.00 0.00 H ATOM 809 HB3 LYS A 52 11.083 -1.798 24.401 1.00 0.00 H ATOM 810 HG2 LYS A 52 12.130 -1.139 26.542 1.00 0.00 H ATOM 811 HG3 LYS A 52 12.178 -2.852 27.024 1.00 0.00 H ATOM 812 HD2 LYS A 52 13.891 -3.324 25.426 1.00 0.00 H ATOM 813 HD3 LYS A 52 13.736 -1.708 24.698 1.00 0.00 H ATOM 814 HE2 LYS A 52 14.237 -2.117 27.679 1.00 0.00 H ATOM 815 HE3 LYS A 52 14.416 -0.617 26.739 1.00 0.00 H ATOM 816 HZ1 LYS A 52 16.064 -3.041 26.475 1.00 0.00 H ATOM 817 HZ2 LYS A 52 16.234 -1.608 25.578 1.00 0.00 H ATOM 818 HZ3 LYS A 52 16.510 -1.599 27.254 1.00 0.00 H ATOM 819 H LYS A 52 8.647 -3.069 24.423 1.00 0.00 H ATOM 820 N GLN A 53 8.339 -0.113 25.814 1.00 15.34 N ATOM 821 CA GLN A 53 8.057 1.327 25.924 1.00 14.26 C ATOM 822 C GLN A 53 9.089 2.197 25.206 1.00 14.57 C ATOM 823 O GLN A 53 9.566 3.223 25.686 1.00 16.39 O ATOM 824 CB GLN A 53 7.983 1.722 27.410 1.00 12.06 C ATOM 825 CG GLN A 53 7.064 0.798 28.232 1.00 20.12 C ATOM 826 CD GLN A 53 6.955 1.165 29.708 1.00 22.47 C ATOM 827 OE1 GLN A 53 5.876 1.487 30.152 1.00 27.89 O ATOM 828 NE2 GLN A 53 7.911 1.237 30.604 1.00 28.12 N ATOM 829 HA GLN A 53 7.101 1.506 25.432 1.00 0.00 H ATOM 830 HB2 GLN A 53 8.987 1.679 27.832 1.00 0.00 H ATOM 831 HB3 GLN A 53 7.604 2.742 27.481 1.00 0.00 H ATOM 832 HG2 GLN A 53 6.065 0.836 27.797 1.00 0.00 H ATOM 833 HG3 GLN A 53 7.451 -0.218 28.161 1.00 0.00 H ATOM 834 HE22 GLN A 53 8.886 0.985 30.345 1.00 0.00 H ATOM 835 HE21 GLN A 53 7.693 1.546 31.573 1.00 0.00 H ATOM 836 H GLN A 53 7.586 -0.728 25.444 1.00 0.00 H ATOM 837 N GLU A 54 9.486 1.761 24.018 1.00 14.24 N ATOM 838 CA GLU A 54 10.485 2.486 23.277 1.00 12.41 C ATOM 839 C GLU A 54 10.066 2.946 21.885 1.00 11.40 C ATOM 840 O GLU A 54 10.932 3.373 21.133 1.00 13.04 O ATOM 841 CB GLU A 54 11.737 1.622 23.188 1.00 12.42 C ATOM 842 CG GLU A 54 11.648 0.378 22.294 1.00 11.53 C ATOM 843 CD GLU A 54 12.972 -0.388 22.150 1.00 17.62 C ATOM 844 OE1 GLU A 54 14.047 0.188 22.273 1.00 15.41 O ATOM 845 OE2 GLU A 54 12.944 -1.583 21.917 1.00 14.52 O ATOM 846 HA GLU A 54 10.662 3.411 23.826 1.00 0.00 H ATOM 847 HB2 GLU A 54 12.545 2.247 22.807 1.00 0.00 H ATOM 848 HB3 GLU A 54 11.982 1.289 24.196 1.00 0.00 H ATOM 849 HG2 GLU A 54 10.906 -0.297 22.720 1.00 0.00 H ATOM 850 HG3 GLU A 54 11.324 0.692 21.302 1.00 0.00 H ATOM 851 H GLU A 54 9.074 0.893 23.620 1.00 0.00 H ATOM 852 N VAL A 55 8.801 2.864 21.471 1.00 10.51 N ATOM 853 CA VAL A 55 8.333 3.359 20.177 1.00 10.30 C ATOM 854 C VAL A 55 6.943 3.967 20.410 1.00 9.76 C ATOM 855 O VAL A 55 6.302 3.722 21.446 1.00 10.74 O ATOM 856 CB VAL A 55 8.160 2.258 19.027 1.00 9.27 C ATOM 857 CG1 VAL A 55 9.545 1.839 18.527 1.00 4.81 C ATOM 858 CG2 VAL A 55 7.265 1.101 19.508 1.00 7.83 C ATOM 859 HA VAL A 55 9.097 4.053 19.826 1.00 0.00 H ATOM 860 HB VAL A 55 7.633 2.671 18.167 1.00 0.00 H ATOM 861 HG11 VAL A 55 10.065 2.710 18.128 1.00 0.00 H ATOM 862 HG12 VAL A 55 10.117 1.420 19.355 1.00 0.00 H ATOM 863 HG13 VAL A 55 9.436 1.089 17.743 1.00 0.00 H ATOM 864 HG21 VAL A 55 7.719 0.631 20.380 1.00 0.00 H ATOM 865 HG22 VAL A 55 6.282 1.490 19.774 1.00 0.00 H ATOM 866 HG23 VAL A 55 7.163 0.366 18.709 1.00 0.00 H ATOM 867 H VAL A 55 8.106 2.422 22.106 1.00 0.00 H ATOM 868 N ILE A 56 6.478 4.764 19.454 1.00 6.80 N ATOM 869 CA ILE A 56 5.172 5.365 19.552 1.00 7.80 C ATOM 870 C ILE A 56 4.120 4.282 19.522 1.00 8.43 C ATOM 871 O ILE A 56 4.359 3.186 19.018 1.00 11.37 O ATOM 872 CB ILE A 56 4.917 6.373 18.395 1.00 10.02 C ATOM 873 CG1 ILE A 56 5.224 5.814 17.015 1.00 8.23 C ATOM 874 CG2 ILE A 56 5.701 7.608 18.773 1.00 7.84 C ATOM 875 CD1 ILE A 56 4.543 6.602 15.892 1.00 7.91 C ATOM 876 HA ILE A 56 5.120 5.915 20.492 1.00 0.00 H ATOM 877 HB ILE A 56 3.858 6.610 18.292 1.00 0.00 H ATOM 878 HG12 ILE A 56 6.302 5.844 16.858 1.00 0.00 H ATOM 879 HG13 ILE A 56 4.881 4.780 16.973 1.00 0.00 H ATOM 880 HD11 ILE A 56 3.462 6.571 16.032 1.00 0.00 H ATOM 881 HD12 ILE A 56 4.885 7.637 15.917 1.00 0.00 H ATOM 882 HD13 ILE A 56 4.799 6.157 14.931 1.00 0.00 H ATOM 883 HG21 ILE A 56 5.338 7.990 19.727 1.00 0.00 H ATOM 884 HG22 ILE A 56 6.757 7.354 18.860 1.00 0.00 H ATOM 885 HG23 ILE A 56 5.572 8.369 18.003 1.00 0.00 H ATOM 886 H ILE A 56 7.068 4.958 18.619 1.00 0.00 H ATOM 887 N ARG A 57 2.932 4.570 20.021 1.00 7.66 N ATOM 888 CA ARG A 57 1.867 3.588 20.143 1.00 6.06 C ATOM 889 C ARG A 57 1.466 2.956 18.821 1.00 9.37 C ATOM 890 O ARG A 57 1.195 1.748 18.786 1.00 6.84 O ATOM 891 CB ARG A 57 0.652 4.258 20.799 1.00 5.60 C ATOM 892 CG ARG A 57 -0.403 3.248 21.262 1.00 3.29 C ATOM 893 CD ARG A 57 -1.540 3.963 21.979 1.00 4.67 C ATOM 894 NE ARG A 57 -2.449 2.990 22.557 1.00 6.88 N ATOM 895 CZ ARG A 57 -3.542 3.330 23.260 1.00 8.47 C ATOM 896 NH1 ARG A 57 -3.904 4.605 23.487 1.00 8.22 N ATOM 897 NH2 ARG A 57 -4.265 2.344 23.795 1.00 6.43 N ATOM 898 HA ARG A 57 2.245 2.773 20.760 1.00 0.00 H ATOM 899 HB2 ARG A 57 0.992 4.828 21.664 1.00 0.00 H ATOM 900 HB3 ARG A 57 0.194 4.934 20.077 1.00 0.00 H ATOM 901 HG2 ARG A 57 -0.800 2.719 20.395 1.00 0.00 H ATOM 902 HG3 ARG A 57 0.058 2.532 21.943 1.00 0.00 H ATOM 903 HD2 ARG A 57 -2.082 4.586 21.267 1.00 0.00 H ATOM 904 HD3 ARG A 57 -1.131 4.590 22.771 1.00 0.00 H ATOM 905 HE ARG A 57 -2.244 1.980 22.420 1.00 0.00 H ATOM 906 HH12 ARG A 57 -4.761 4.812 24.039 1.00 0.00 H ATOM 907 HH11 ARG A 57 -3.327 5.384 23.111 1.00 0.00 H ATOM 908 HH22 ARG A 57 -5.119 2.565 24.347 1.00 0.00 H ATOM 909 HH21 ARG A 57 -3.975 1.354 23.660 1.00 0.00 H ATOM 910 H ARG A 57 2.750 5.543 20.341 1.00 0.00 H ATOM 911 N GLY A 58 1.416 3.760 17.747 1.00 9.99 N ATOM 912 CA GLY A 58 1.072 3.314 16.403 1.00 9.30 C ATOM 913 C GLY A 58 1.991 2.205 15.885 1.00 10.14 C ATOM 914 O GLY A 58 1.535 1.311 15.178 1.00 8.59 O ATOM 915 HA3 GLY A 58 1.140 4.166 15.726 1.00 0.00 H ATOM 916 HA2 GLY A 58 0.048 2.940 16.413 1.00 0.00 H ATOM 917 H GLY A 58 1.637 4.767 17.883 1.00 0.00 H ATOM 918 N TRP A 59 3.280 2.203 16.213 1.00 9.07 N ATOM 919 CA TRP A 59 4.177 1.120 15.828 1.00 10.46 C ATOM 920 C TRP A 59 3.798 -0.186 16.528 1.00 9.31 C ATOM 921 O TRP A 59 3.639 -1.231 15.903 1.00 9.48 O ATOM 922 CB TRP A 59 5.613 1.430 16.213 1.00 10.92 C ATOM 923 CG TRP A 59 6.485 2.063 15.129 1.00 16.97 C ATOM 924 CD1 TRP A 59 7.010 3.316 15.310 1.00 17.96 C ATOM 925 CD2 TRP A 59 6.841 1.504 13.929 1.00 15.62 C ATOM 926 NE1 TRP A 59 7.698 3.568 14.239 1.00 19.36 N ATOM 927 CE2 TRP A 59 7.619 2.525 13.387 1.00 18.52 C ATOM 928 CE3 TRP A 59 6.636 0.323 13.223 1.00 18.90 C ATOM 929 CZ2 TRP A 59 8.209 2.388 12.131 1.00 18.23 C ATOM 930 CZ3 TRP A 59 7.220 0.187 11.954 1.00 20.85 C ATOM 931 CH2 TRP A 59 8.004 1.211 11.425 1.00 15.75 C ATOM 932 HA TRP A 59 4.086 1.017 14.747 1.00 0.00 H ATOM 933 HB2 TRP A 59 5.589 2.114 17.061 1.00 0.00 H ATOM 934 HB3 TRP A 59 6.085 0.495 16.515 1.00 0.00 H ATOM 935 HE1 TRP A 59 8.231 4.444 14.064 1.00 0.00 H ATOM 936 HD1 TRP A 59 6.877 3.966 16.175 1.00 0.00 H ATOM 937 HZ2 TRP A 59 8.819 3.189 11.712 1.00 0.00 H ATOM 938 HH2 TRP A 59 8.462 1.086 10.444 1.00 0.00 H ATOM 939 HZ3 TRP A 59 7.060 -0.725 11.379 1.00 0.00 H ATOM 940 HE3 TRP A 59 6.034 -0.481 13.647 1.00 0.00 H ATOM 941 H TRP A 59 3.661 3.000 16.762 1.00 0.00 H ATOM 942 N GLU A 60 3.583 -0.134 17.849 1.00 9.33 N ATOM 943 CA GLU A 60 3.309 -1.337 18.618 1.00 13.07 C ATOM 944 C GLU A 60 1.995 -1.944 18.255 1.00 14.12 C ATOM 945 O GLU A 60 1.908 -3.163 18.063 1.00 17.25 O ATOM 946 CB GLU A 60 3.311 -1.060 20.119 1.00 15.84 C ATOM 947 CG GLU A 60 4.760 -1.063 20.493 1.00 25.54 C ATOM 948 CD GLU A 60 5.068 -1.288 21.958 1.00 26.08 C ATOM 949 OE1 GLU A 60 4.846 -2.378 22.459 1.00 27.65 O ATOM 950 OE2 GLU A 60 5.567 -0.369 22.587 1.00 33.73 O ATOM 951 HA GLU A 60 4.110 -2.035 18.373 1.00 0.00 H ATOM 952 HB2 GLU A 60 2.858 -0.092 20.334 1.00 0.00 H ATOM 953 HB3 GLU A 60 2.771 -1.840 20.657 1.00 0.00 H ATOM 954 HG2 GLU A 60 5.250 -1.853 19.924 1.00 0.00 H ATOM 955 HG3 GLU A 60 5.180 -0.098 20.208 1.00 0.00 H ATOM 956 H GLU A 60 3.613 0.785 18.334 1.00 0.00 H ATOM 957 N GLU A 61 0.973 -1.100 18.128 1.00 13.61 N ATOM 958 CA GLU A 61 -0.326 -1.638 17.786 1.00 16.15 C ATOM 959 C GLU A 61 -0.469 -1.978 16.328 1.00 12.97 C ATOM 960 O GLU A 61 -1.182 -2.919 15.992 1.00 13.20 O ATOM 961 CB GLU A 61 -1.382 -0.662 18.239 1.00 20.88 C ATOM 962 CG GLU A 61 -1.594 -1.207 19.675 1.00 34.62 C ATOM 963 CD GLU A 61 -2.591 -0.427 20.527 1.00 39.22 C ATOM 964 OE1 GLU A 61 -3.664 -0.123 20.017 1.00 44.56 O ATOM 965 OE2 GLU A 61 -2.290 -0.107 21.684 1.00 43.31 O ATOM 966 HA GLU A 61 -0.449 -2.589 18.305 1.00 0.00 H ATOM 967 HB2 GLU A 61 -1.020 0.366 18.238 1.00 0.00 H ATOM 968 HB3 GLU A 61 -2.288 -0.727 17.636 1.00 0.00 H ATOM 969 HG2 GLU A 61 -1.949 -2.235 19.597 1.00 0.00 H ATOM 970 HG3 GLU A 61 -0.631 -1.194 20.186 1.00 0.00 H ATOM 971 H GLU A 61 1.105 -0.078 18.271 1.00 0.00 H ATOM 972 N GLY A 62 0.261 -1.280 15.468 1.00 10.73 N ATOM 973 CA GLY A 62 0.246 -1.606 14.065 1.00 11.79 C ATOM 974 C GLY A 62 0.957 -2.918 13.791 1.00 10.94 C ATOM 975 O GLY A 62 0.384 -3.809 13.172 1.00 11.10 O ATOM 976 HA3 GLY A 62 0.744 -0.810 13.511 1.00 0.00 H ATOM 977 HA2 GLY A 62 -0.788 -1.687 13.731 1.00 0.00 H ATOM 978 H GLY A 62 0.848 -0.492 15.809 1.00 0.00 H ATOM 979 N VAL A 63 2.206 -3.085 14.210 1.00 12.24 N ATOM 980 CA VAL A 63 2.974 -4.306 13.980 1.00 12.93 C ATOM 981 C VAL A 63 2.383 -5.523 14.686 1.00 11.31 C ATOM 982 O VAL A 63 2.483 -6.648 14.200 1.00 10.56 O ATOM 983 CB VAL A 63 4.435 -4.044 14.423 1.00 14.54 C ATOM 984 CG1 VAL A 63 5.317 -5.277 14.472 1.00 18.48 C ATOM 985 CG2 VAL A 63 5.051 -3.201 13.325 1.00 18.71 C ATOM 986 HA VAL A 63 2.939 -4.549 12.918 1.00 0.00 H ATOM 987 HB VAL A 63 4.389 -3.610 15.422 1.00 0.00 H ATOM 988 HG11 VAL A 63 4.898 -5.994 15.178 1.00 0.00 H ATOM 989 HG12 VAL A 63 5.365 -5.727 13.481 1.00 0.00 H ATOM 990 HG13 VAL A 63 6.319 -4.993 14.792 1.00 0.00 H ATOM 991 HG21 VAL A 63 5.014 -3.749 12.384 1.00 0.00 H ATOM 992 HG22 VAL A 63 4.493 -2.270 13.227 1.00 0.00 H ATOM 993 HG23 VAL A 63 6.088 -2.980 13.577 1.00 0.00 H ATOM 994 H VAL A 63 2.661 -2.307 14.728 1.00 0.00 H ATOM 995 N ALA A 64 1.726 -5.346 15.831 1.00 9.60 N ATOM 996 CA ALA A 64 1.094 -6.451 16.505 1.00 9.23 C ATOM 997 C ALA A 64 0.050 -7.105 15.628 1.00 10.00 C ATOM 998 O ALA A 64 -0.282 -8.259 15.828 1.00 12.96 O ATOM 999 CB ALA A 64 0.411 -5.987 17.774 1.00 11.47 C ATOM 1000 HA ALA A 64 1.880 -7.168 16.740 1.00 0.00 H ATOM 1001 HB1 ALA A 64 1.150 -5.544 18.441 1.00 0.00 H ATOM 1002 HB2 ALA A 64 -0.348 -5.245 17.526 1.00 0.00 H ATOM 1003 HB3 ALA A 64 -0.059 -6.839 18.265 1.00 0.00 H ATOM 1004 H ALA A 64 1.668 -4.394 16.245 1.00 0.00 H ATOM 1005 N GLN A 65 -0.481 -6.401 14.648 1.00 9.83 N ATOM 1006 CA GLN A 65 -1.474 -6.952 13.763 1.00 12.59 C ATOM 1007 C GLN A 65 -0.926 -7.558 12.471 1.00 12.09 C ATOM 1008 O GLN A 65 -1.687 -8.007 11.613 1.00 13.76 O ATOM 1009 CB GLN A 65 -2.436 -5.874 13.396 1.00 13.55 C ATOM 1010 CG GLN A 65 -3.181 -5.416 14.609 1.00 18.76 C ATOM 1011 CD GLN A 65 -4.097 -4.302 14.181 1.00 25.75 C ATOM 1012 OE1 GLN A 65 -4.994 -4.501 13.355 1.00 28.17 O ATOM 1013 NE2 GLN A 65 -3.859 -3.106 14.684 1.00 24.13 N ATOM 1014 HA GLN A 65 -1.939 -7.770 14.313 1.00 0.00 H ATOM 1015 HB2 GLN A 65 -1.890 -5.033 12.969 1.00 0.00 H ATOM 1016 HB3 GLN A 65 -3.144 -6.257 12.661 1.00 0.00 H ATOM 1017 HG2 GLN A 65 -3.763 -6.240 15.022 1.00 0.00 H ATOM 1018 HG3 GLN A 65 -2.481 -5.054 15.362 1.00 0.00 H ATOM 1019 HE22 GLN A 65 -3.095 -2.976 15.378 1.00 0.00 H ATOM 1020 HE21 GLN A 65 -4.435 -2.293 14.387 1.00 0.00 H ATOM 1021 H GLN A 65 -0.173 -5.417 14.510 1.00 0.00 H ATOM 1022 N MET A 66 0.375 -7.582 12.297 1.00 9.86 N ATOM 1023 CA MET A 66 0.998 -8.048 11.088 1.00 11.80 C ATOM 1024 C MET A 66 1.601 -9.424 11.300 1.00 10.62 C ATOM 1025 O MET A 66 1.986 -9.713 12.429 1.00 10.42 O ATOM 1026 CB MET A 66 2.093 -7.060 10.701 1.00 12.16 C ATOM 1027 CG MET A 66 1.563 -5.719 10.213 1.00 10.49 C ATOM 1028 SD MET A 66 2.888 -4.540 9.879 1.00 12.55 S ATOM 1029 CE MET A 66 3.664 -5.219 8.442 1.00 12.19 C ATOM 1030 HA MET A 66 0.254 -8.119 10.295 1.00 0.00 H ATOM 1031 HB2 MET A 66 2.723 -6.885 11.573 1.00 0.00 H ATOM 1032 HB3 MET A 66 2.692 -7.504 9.906 1.00 0.00 H ATOM 1033 HG2 MET A 66 0.907 -5.302 10.977 1.00 0.00 H ATOM 1034 HG3 MET A 66 0.996 -5.879 9.296 1.00 0.00 H ATOM 1035 HE1 MET A 66 4.037 -6.218 8.670 1.00 0.00 H ATOM 1036 HE2 MET A 66 2.938 -5.277 7.631 1.00 0.00 H ATOM 1037 HE3 MET A 66 4.494 -4.580 8.143 1.00 0.00 H ATOM 1038 H MET A 66 0.984 -7.248 13.071 1.00 0.00 H ATOM 1039 N SER A 67 1.709 -10.285 10.287 1.00 9.72 N ATOM 1040 CA SER A 67 2.376 -11.560 10.467 1.00 8.45 C ATOM 1041 C SER A 67 3.726 -11.469 9.791 1.00 9.03 C ATOM 1042 O SER A 67 3.949 -10.548 8.977 1.00 9.10 O ATOM 1043 CB SER A 67 1.513 -12.697 9.880 1.00 8.03 C ATOM 1044 OG SER A 67 1.124 -12.580 8.502 1.00 10.59 O ATOM 1045 HA SER A 67 2.517 -11.785 11.524 1.00 0.00 H ATOM 1046 HB2 SER A 67 0.601 -12.758 10.475 1.00 0.00 H ATOM 1047 HB3 SER A 67 2.076 -13.624 9.985 1.00 0.00 H ATOM 1048 HG SER A 67 0.593 -11.753 8.379 1.00 0.00 H ATOM 1049 H SER A 67 1.311 -10.039 9.358 1.00 0.00 H ATOM 1050 N VAL A 68 4.686 -12.354 10.102 1.00 6.82 N ATOM 1051 CA VAL A 68 6.008 -12.275 9.503 1.00 7.58 C ATOM 1052 C VAL A 68 5.908 -12.405 7.989 1.00 7.32 C ATOM 1053 O VAL A 68 5.118 -13.228 7.497 1.00 9.71 O ATOM 1054 CB VAL A 68 6.922 -13.384 10.098 1.00 9.29 C ATOM 1055 CG1 VAL A 68 8.284 -13.388 9.441 1.00 6.15 C ATOM 1056 CG2 VAL A 68 7.258 -13.048 11.547 1.00 12.86 C ATOM 1057 HA VAL A 68 6.449 -11.304 9.730 1.00 0.00 H ATOM 1058 HB VAL A 68 6.384 -14.322 9.964 1.00 0.00 H ATOM 1059 HG11 VAL A 68 8.170 -13.569 8.372 1.00 0.00 H ATOM 1060 HG12 VAL A 68 8.764 -12.422 9.598 1.00 0.00 H ATOM 1061 HG13 VAL A 68 8.896 -14.175 9.881 1.00 0.00 H ATOM 1062 HG21 VAL A 68 7.778 -12.091 11.586 1.00 0.00 H ATOM 1063 HG22 VAL A 68 6.337 -12.987 12.127 1.00 0.00 H ATOM 1064 HG23 VAL A 68 7.898 -13.827 11.960 1.00 0.00 H ATOM 1065 H VAL A 68 4.480 -13.111 10.785 1.00 0.00 H ATOM 1066 N GLY A 69 6.668 -11.561 7.280 1.00 6.03 N ATOM 1067 CA GLY A 69 6.654 -11.518 5.817 1.00 10.53 C ATOM 1068 C GLY A 69 5.660 -10.504 5.225 1.00 11.35 C ATOM 1069 O GLY A 69 5.691 -10.199 4.017 1.00 12.90 O ATOM 1070 HA3 GLY A 69 6.392 -12.510 5.448 1.00 0.00 H ATOM 1071 HA2 GLY A 69 7.655 -11.257 5.473 1.00 0.00 H ATOM 1072 H GLY A 69 7.295 -10.908 7.791 1.00 0.00 H ATOM 1073 N GLN A 70 4.771 -9.957 6.054 1.00 8.04 N ATOM 1074 CA GLN A 70 3.770 -9.037 5.585 1.00 11.07 C ATOM 1075 C GLN A 70 4.327 -7.646 5.301 1.00 12.50 C ATOM 1076 O GLN A 70 5.222 -7.172 6.006 1.00 11.50 O ATOM 1077 CB GLN A 70 2.650 -8.962 6.623 1.00 6.20 C ATOM 1078 CG GLN A 70 1.364 -8.337 6.096 1.00 9.45 C ATOM 1079 CD GLN A 70 0.273 -8.278 7.149 1.00 14.17 C ATOM 1080 OE1 GLN A 70 0.366 -8.948 8.187 1.00 11.23 O ATOM 1081 NE2 GLN A 70 -0.789 -7.501 6.934 1.00 11.21 N ATOM 1082 HA GLN A 70 3.388 -9.410 4.635 1.00 0.00 H ATOM 1083 HB2 GLN A 70 2.427 -9.974 6.962 1.00 0.00 H ATOM 1084 HB3 GLN A 70 3.001 -8.367 7.466 1.00 0.00 H ATOM 1085 HG2 GLN A 70 1.580 -7.323 5.759 1.00 0.00 H ATOM 1086 HG3 GLN A 70 1.006 -8.930 5.254 1.00 0.00 H ATOM 1087 HE22 GLN A 70 -0.856 -6.943 6.059 1.00 0.00 H ATOM 1088 HE21 GLN A 70 -1.550 -7.453 7.641 1.00 0.00 H ATOM 1089 H GLN A 70 4.802 -10.201 7.064 1.00 0.00 H ATOM 1090 N ARG A 71 3.809 -7.020 4.246 1.00 10.21 N ATOM 1091 CA ARG A 71 4.110 -5.632 3.958 1.00 11.69 C ATOM 1092 C ARG A 71 2.790 -4.905 4.051 1.00 8.73 C ATOM 1093 O ARG A 71 1.786 -5.348 3.490 1.00 10.28 O ATOM 1094 CB ARG A 71 4.683 -5.481 2.565 1.00 13.14 C ATOM 1095 CG ARG A 71 5.102 -4.065 2.264 1.00 18.02 C ATOM 1096 CD ARG A 71 6.222 -4.249 1.279 1.00 22.79 C ATOM 1097 NE ARG A 71 6.795 -2.980 0.917 1.00 28.13 N ATOM 1098 CZ ARG A 71 7.981 -2.889 0.325 1.00 30.74 C ATOM 1099 NH1 ARG A 71 8.709 -3.971 0.045 1.00 31.61 N ATOM 1100 NH2 ARG A 71 8.411 -1.677 -0.029 1.00 33.04 N ATOM 1101 HA ARG A 71 4.851 -5.236 4.653 1.00 0.00 H ATOM 1102 HB2 ARG A 71 5.553 -6.131 2.472 1.00 0.00 H ATOM 1103 HB3 ARG A 71 3.927 -5.784 1.841 1.00 0.00 H ATOM 1104 HG2 ARG A 71 4.282 -3.498 1.824 1.00 0.00 H ATOM 1105 HG3 ARG A 71 5.450 -3.559 3.164 1.00 0.00 H ATOM 1106 HD2 ARG A 71 5.835 -4.736 0.384 1.00 0.00 H ATOM 1107 HD3 ARG A 71 6.993 -4.875 1.727 1.00 0.00 H ATOM 1108 HE ARG A 71 6.266 -2.109 1.125 1.00 0.00 H ATOM 1109 HH12 ARG A 71 9.634 -3.869 -0.419 1.00 0.00 H ATOM 1110 HH11 ARG A 71 8.351 -4.916 0.291 1.00 0.00 H ATOM 1111 HH22 ARG A 71 9.335 -1.568 -0.495 1.00 0.00 H ATOM 1112 HH21 ARG A 71 7.823 -0.841 0.160 1.00 0.00 H ATOM 1113 H ARG A 71 3.171 -7.541 3.611 1.00 0.00 H ATOM 1114 N ALA A 72 2.730 -3.769 4.725 1.00 7.29 N ATOM 1115 CA ALA A 72 1.484 -3.115 4.999 1.00 5.08 C ATOM 1116 C ALA A 72 1.682 -1.620 5.062 1.00 7.20 C ATOM 1117 O ALA A 72 2.791 -1.146 5.312 1.00 7.05 O ATOM 1118 CB ALA A 72 0.938 -3.605 6.340 1.00 3.04 C ATOM 1119 HA ALA A 72 0.779 -3.349 4.201 1.00 0.00 H ATOM 1120 HB1 ALA A 72 0.782 -4.683 6.295 1.00 0.00 H ATOM 1121 HB2 ALA A 72 1.653 -3.372 7.129 1.00 0.00 H ATOM 1122 HB3 ALA A 72 -0.009 -3.108 6.549 1.00 0.00 H ATOM 1123 H ALA A 72 3.612 -3.337 5.066 1.00 0.00 H ATOM 1124 N LYS A 73 0.600 -0.900 4.815 1.00 7.28 N ATOM 1125 CA LYS A 73 0.548 0.529 4.922 1.00 8.78 C ATOM 1126 C LYS A 73 -0.115 0.738 6.277 1.00 10.05 C ATOM 1127 O LYS A 73 -1.171 0.135 6.515 1.00 10.22 O ATOM 1128 CB LYS A 73 -0.308 1.076 3.792 1.00 7.68 C ATOM 1129 CG LYS A 73 -0.510 2.563 3.864 1.00 11.89 C ATOM 1130 CD LYS A 73 -1.559 2.985 2.849 1.00 13.71 C ATOM 1131 CE LYS A 73 -1.853 4.479 3.021 1.00 14.17 C ATOM 1132 NZ LYS A 73 -2.828 4.919 2.029 1.00 16.54 N ATOM 1133 HA LYS A 73 1.513 1.030 4.850 1.00 0.00 H ATOM 1134 HB2 LYS A 73 0.176 0.838 2.845 1.00 0.00 H ATOM 1135 HB3 LYS A 73 -1.284 0.592 3.832 1.00 0.00 H ATOM 1136 HG2 LYS A 73 -0.843 2.836 4.865 1.00 0.00 H ATOM 1137 HG3 LYS A 73 0.431 3.068 3.645 1.00 0.00 H ATOM 1138 HD2 LYS A 73 -1.187 2.800 1.841 1.00 0.00 H ATOM 1139 HD3 LYS A 73 -2.473 2.412 3.009 1.00 0.00 H ATOM 1140 HE2 LYS A 73 -0.930 5.045 2.894 1.00 0.00 H ATOM 1141 HE3 LYS A 73 -2.251 4.655 4.020 1.00 0.00 H ATOM 1142 HZ1 LYS A 73 -2.449 4.754 1.075 1.00 0.00 H ATOM 1143 HZ2 LYS A 73 -3.710 4.382 2.150 1.00 0.00 H ATOM 1144 HZ3 LYS A 73 -3.018 5.933 2.157 1.00 0.00 H ATOM 1145 H LYS A 73 -0.265 -1.400 4.526 1.00 0.00 H ATOM 1146 N LEU A 74 0.497 1.525 7.176 1.00 12.03 N ATOM 1147 CA LEU A 74 -0.077 1.830 8.483 1.00 12.42 C ATOM 1148 C LEU A 74 -0.381 3.319 8.437 1.00 11.49 C ATOM 1149 O LEU A 74 0.491 4.110 8.057 1.00 12.32 O ATOM 1150 CB LEU A 74 0.897 1.635 9.671 1.00 12.19 C ATOM 1151 CG LEU A 74 1.664 0.338 9.879 1.00 15.40 C ATOM 1152 CD1 LEU A 74 2.399 0.433 11.190 1.00 11.59 C ATOM 1153 CD2 LEU A 74 0.752 -0.861 9.936 1.00 14.22 C ATOM 1154 HA LEU A 74 -0.925 1.165 8.646 1.00 0.00 H ATOM 1155 HB2 LEU A 74 1.646 2.422 9.585 1.00 0.00 H ATOM 1156 HB3 LEU A 74 0.310 1.791 10.576 1.00 0.00 H ATOM 1157 HG LEU A 74 2.343 0.206 9.036 1.00 0.00 H ATOM 1158 HD21 LEU A 74 0.052 -0.745 10.764 1.00 0.00 H ATOM 1159 HD22 LEU A 74 0.199 -0.940 9.000 1.00 0.00 H ATOM 1160 HD23 LEU A 74 1.347 -1.762 10.086 1.00 0.00 H ATOM 1161 HD11 LEU A 74 3.089 1.276 11.158 1.00 0.00 H ATOM 1162 HD12 LEU A 74 1.682 0.579 11.998 1.00 0.00 H ATOM 1163 HD13 LEU A 74 2.957 -0.488 11.360 1.00 0.00 H ATOM 1164 H LEU A 74 1.421 1.935 6.931 1.00 0.00 H ATOM 1165 N THR A 75 -1.595 3.726 8.748 1.00 9.11 N ATOM 1166 CA THR A 75 -1.947 5.128 8.910 1.00 8.77 C ATOM 1167 C THR A 75 -2.186 5.342 10.408 1.00 11.08 C ATOM 1168 O THR A 75 -3.040 4.660 10.987 1.00 9.25 O ATOM 1169 CB THR A 75 -3.211 5.418 8.119 1.00 10.55 C ATOM 1170 OG1 THR A 75 -2.916 5.011 6.788 1.00 10.18 O ATOM 1171 CG2 THR A 75 -3.610 6.898 8.168 1.00 10.37 C ATOM 1172 HA THR A 75 -1.163 5.793 8.547 1.00 0.00 H ATOM 1173 HB THR A 75 -4.064 4.884 8.538 1.00 0.00 H ATOM 1174 HG1 THR A 75 -2.694 4.046 6.781 1.00 0.00 H ATOM 1175 HG23 THR A 75 -3.829 7.180 9.198 1.00 0.00 H ATOM 1176 HG21 THR A 75 -2.789 7.507 7.790 1.00 0.00 H ATOM 1177 HG22 THR A 75 -4.494 7.055 7.551 1.00 0.00 H ATOM 1178 H THR A 75 -2.337 3.010 8.884 1.00 0.00 H ATOM 1179 N ILE A 76 -1.462 6.270 11.025 1.00 9.07 N ATOM 1180 CA ILE A 76 -1.452 6.477 12.468 1.00 6.89 C ATOM 1181 C ILE A 76 -1.949 7.891 12.803 1.00 10.01 C ATOM 1182 O ILE A 76 -1.327 8.870 12.371 1.00 9.41 O ATOM 1183 CB ILE A 76 -0.010 6.279 12.942 1.00 5.03 C ATOM 1184 CG1 ILE A 76 0.436 4.894 12.530 1.00 5.58 C ATOM 1185 CG2 ILE A 76 0.095 6.482 14.444 1.00 6.51 C ATOM 1186 CD1 ILE A 76 1.906 4.584 12.848 1.00 6.23 C ATOM 1187 HA ILE A 76 -2.116 5.772 12.969 1.00 0.00 H ATOM 1188 HB ILE A 76 0.645 7.019 12.481 1.00 0.00 H ATOM 1189 HG12 ILE A 76 -0.187 4.166 13.049 1.00 0.00 H ATOM 1190 HG13 ILE A 76 0.290 4.794 11.454 1.00 0.00 H ATOM 1191 HD11 ILE A 76 2.547 5.295 12.327 1.00 0.00 H ATOM 1192 HD12 ILE A 76 2.069 4.666 13.923 1.00 0.00 H ATOM 1193 HD13 ILE A 76 2.142 3.572 12.520 1.00 0.00 H ATOM 1194 HG21 ILE A 76 -0.223 7.494 14.696 1.00 0.00 H ATOM 1195 HG22 ILE A 76 -0.545 5.761 14.952 1.00 0.00 H ATOM 1196 HG23 ILE A 76 1.129 6.336 14.758 1.00 0.00 H ATOM 1197 H ILE A 76 -0.864 6.888 10.441 1.00 0.00 H ATOM 1198 N SER A 77 -3.059 8.027 13.541 1.00 8.22 N ATOM 1199 CA SER A 77 -3.577 9.336 13.904 1.00 10.85 C ATOM 1200 C SER A 77 -2.614 9.993 14.904 1.00 11.17 C ATOM 1201 O SER A 77 -1.860 9.259 15.567 1.00 6.96 O ATOM 1202 CB SER A 77 -5.003 9.152 14.504 1.00 9.27 C ATOM 1203 OG SER A 77 -5.077 8.251 15.619 1.00 8.11 O ATOM 1204 HA SER A 77 -3.652 9.989 13.035 1.00 0.00 H ATOM 1205 HB2 SER A 77 -5.655 8.773 13.718 1.00 0.00 H ATOM 1206 HB3 SER A 77 -5.361 10.128 14.832 1.00 0.00 H ATOM 1207 HG SER A 77 -4.500 8.586 16.351 1.00 0.00 H ATOM 1208 H SER A 77 -3.562 7.175 13.862 1.00 0.00 H ATOM 1209 N PRO A 78 -2.619 11.321 15.138 1.00 12.65 N ATOM 1210 CA PRO A 78 -1.651 12.013 15.993 1.00 12.00 C ATOM 1211 C PRO A 78 -1.704 11.467 17.416 1.00 12.41 C ATOM 1212 O PRO A 78 -0.671 11.332 18.077 1.00 12.28 O ATOM 1213 CB PRO A 78 -2.022 13.478 15.940 1.00 11.68 C ATOM 1214 CG PRO A 78 -2.798 13.609 14.670 1.00 12.13 C ATOM 1215 CD PRO A 78 -3.521 12.285 14.524 1.00 12.12 C ATOM 1216 HA PRO A 78 -0.627 11.862 15.651 1.00 0.00 H ATOM 1217 HD3 PRO A 78 -4.478 12.307 15.045 1.00 0.00 H ATOM 1218 HD2 PRO A 78 -3.686 12.047 13.473 1.00 0.00 H ATOM 1219 HG3 PRO A 78 -2.129 13.778 13.826 1.00 0.00 H ATOM 1220 HG2 PRO A 78 -3.510 14.431 14.737 1.00 0.00 H ATOM 1221 HB2 PRO A 78 -2.634 13.754 16.799 1.00 0.00 H ATOM 1222 HB3 PRO A 78 -1.130 14.103 15.915 1.00 0.00 H ATOM 1223 N ASP A 79 -2.877 11.099 17.929 1.00 10.35 N ATOM 1224 CA ASP A 79 -2.939 10.587 19.291 1.00 11.65 C ATOM 1225 C ASP A 79 -2.270 9.232 19.477 1.00 13.73 C ATOM 1226 O ASP A 79 -2.145 8.798 20.625 1.00 13.93 O ATOM 1227 CB ASP A 79 -4.404 10.531 19.725 1.00 12.70 C ATOM 1228 CG ASP A 79 -5.298 9.664 18.863 1.00 16.30 C ATOM 1229 OD1 ASP A 79 -5.343 9.878 17.655 1.00 11.92 O ATOM 1230 OD2 ASP A 79 -5.954 8.773 19.400 1.00 12.91 O ATOM 1231 HA ASP A 79 -2.372 11.272 19.921 1.00 0.00 H ATOM 1232 HB2 ASP A 79 -4.440 10.145 20.744 1.00 0.00 H ATOM 1233 HB3 ASP A 79 -4.800 11.546 19.708 1.00 0.00 H ATOM 1234 H ASP A 79 -3.744 11.177 17.360 1.00 0.00 H ATOM 1235 N TYR A 80 -1.864 8.538 18.389 1.00 10.06 N ATOM 1236 CA TYR A 80 -1.151 7.273 18.478 1.00 7.86 C ATOM 1237 C TYR A 80 0.286 7.503 18.012 1.00 9.39 C ATOM 1238 O TYR A 80 1.012 6.536 17.754 1.00 10.46 O ATOM 1239 CB TYR A 80 -1.778 6.210 17.579 1.00 7.23 C ATOM 1240 CG TYR A 80 -2.774 5.321 18.278 1.00 9.22 C ATOM 1241 CD1 TYR A 80 -3.810 5.893 19.028 1.00 10.41 C ATOM 1242 CD2 TYR A 80 -2.618 3.941 18.226 1.00 8.28 C ATOM 1243 CE1 TYR A 80 -4.687 5.085 19.745 1.00 11.22 C ATOM 1244 CE2 TYR A 80 -3.495 3.125 18.946 1.00 10.95 C ATOM 1245 CZ TYR A 80 -4.508 3.705 19.711 1.00 11.07 C ATOM 1246 OH TYR A 80 -5.302 2.918 20.513 1.00 13.92 O ATOM 1247 HA TYR A 80 -1.194 6.923 19.509 1.00 0.00 H ATOM 1248 HB3 TYR A 80 -0.980 5.583 17.182 1.00 0.00 H ATOM 1249 HB2 TYR A 80 -2.286 6.713 16.757 1.00 0.00 H ATOM 1250 HD2 TYR A 80 -1.820 3.499 17.630 1.00 0.00 H ATOM 1251 HE2 TYR A 80 -3.388 2.041 18.910 1.00 0.00 H ATOM 1252 HE1 TYR A 80 -5.500 5.525 20.323 1.00 0.00 H ATOM 1253 HD1 TYR A 80 -3.930 6.976 19.050 1.00 0.00 H ATOM 1254 HH TYR A 80 -5.963 3.487 20.981 1.00 0.00 H ATOM 1255 H TYR A 80 -2.071 8.926 17.447 1.00 0.00 H ATOM 1256 N ALA A 81 0.718 8.765 17.859 1.00 9.08 N ATOM 1257 CA ALA A 81 2.050 9.085 17.351 1.00 8.74 C ATOM 1258 C ALA A 81 2.646 10.189 18.220 1.00 8.12 C ATOM 1259 O ALA A 81 2.879 9.925 19.401 1.00 10.54 O ATOM 1260 CB ALA A 81 1.937 9.530 15.873 1.00 6.85 C ATOM 1261 HA ALA A 81 2.704 8.214 17.393 1.00 0.00 H ATOM 1262 HB1 ALA A 81 1.504 8.722 15.284 1.00 0.00 H ATOM 1263 HB2 ALA A 81 1.298 10.411 15.808 1.00 0.00 H ATOM 1264 HB3 ALA A 81 2.929 9.770 15.490 1.00 0.00 H ATOM 1265 H ALA A 81 0.079 9.546 18.112 1.00 0.00 H ATOM 1266 N TYR A 82 2.873 11.414 17.753 1.00 9.85 N ATOM 1267 CA TYR A 82 3.551 12.436 18.526 1.00 7.93 C ATOM 1268 C TYR A 82 2.604 13.508 19.016 1.00 10.70 C ATOM 1269 O TYR A 82 2.989 14.507 19.652 1.00 13.24 O ATOM 1270 CB TYR A 82 4.676 13.047 17.671 1.00 7.40 C ATOM 1271 CG TYR A 82 5.771 12.036 17.407 1.00 8.16 C ATOM 1272 CD1 TYR A 82 6.776 11.817 18.356 1.00 9.98 C ATOM 1273 CD2 TYR A 82 5.749 11.308 16.223 1.00 10.68 C ATOM 1274 CE1 TYR A 82 7.753 10.840 18.131 1.00 10.25 C ATOM 1275 CE2 TYR A 82 6.716 10.326 15.990 1.00 11.69 C ATOM 1276 CZ TYR A 82 7.709 10.111 16.944 1.00 14.74 C ATOM 1277 OH TYR A 82 8.603 9.099 16.702 1.00 19.60 O ATOM 1278 HA TYR A 82 3.974 11.969 19.416 1.00 0.00 H ATOM 1279 HB3 TYR A 82 5.100 13.902 18.198 1.00 0.00 H ATOM 1280 HB2 TYR A 82 4.260 13.378 16.719 1.00 0.00 H ATOM 1281 HD2 TYR A 82 4.978 11.503 15.477 1.00 0.00 H ATOM 1282 HE2 TYR A 82 6.694 9.736 15.074 1.00 0.00 H ATOM 1283 HE1 TYR A 82 8.533 10.653 18.869 1.00 0.00 H ATOM 1284 HD1 TYR A 82 6.798 12.408 19.272 1.00 0.00 H ATOM 1285 HH TYR A 82 9.252 9.049 17.447 1.00 0.00 H ATOM 1286 H TYR A 82 2.550 11.648 16.793 1.00 0.00 H ATOM 1287 N GLY A 83 1.321 13.289 18.775 1.00 13.39 N ATOM 1288 CA GLY A 83 0.271 14.136 19.287 1.00 15.36 C ATOM 1289 C GLY A 83 0.389 15.612 18.951 1.00 19.32 C ATOM 1290 O GLY A 83 0.827 16.076 17.879 1.00 16.33 O ATOM 1291 HA3 GLY A 83 0.263 14.040 20.373 1.00 0.00 H ATOM 1292 HA2 GLY A 83 -0.676 13.776 18.884 1.00 0.00 H ATOM 1293 H GLY A 83 1.058 12.470 18.191 1.00 0.00 H ATOM 1294 N ALA A 84 -0.042 16.372 19.948 1.00 19.86 N ATOM 1295 CA ALA A 84 -0.010 17.795 19.786 1.00 23.30 C ATOM 1296 C ALA A 84 1.416 18.346 19.772 1.00 24.18 C ATOM 1297 O ALA A 84 1.591 19.399 19.185 1.00 27.12 O ATOM 1298 CB ALA A 84 -0.830 18.402 20.904 1.00 23.02 C ATOM 1299 HA ALA A 84 -0.434 18.061 18.818 1.00 0.00 H ATOM 1300 HB1 ALA A 84 -1.855 18.035 20.842 1.00 0.00 H ATOM 1301 HB2 ALA A 84 -0.399 18.119 21.864 1.00 0.00 H ATOM 1302 HB3 ALA A 84 -0.825 19.488 20.808 1.00 0.00 H ATOM 1303 H ALA A 84 -0.395 15.945 20.828 1.00 0.00 H ATOM 1304 N THR A 85 2.481 17.690 20.251 1.00 27.44 N ATOM 1305 CA THR A 85 3.816 18.310 20.302 1.00 26.75 C ATOM 1306 C THR A 85 4.587 18.139 19.017 1.00 24.36 C ATOM 1307 O THR A 85 5.385 18.990 18.622 1.00 25.12 O ATOM 1308 CB THR A 85 4.704 17.725 21.434 1.00 31.10 C ATOM 1309 OG1 THR A 85 4.002 17.993 22.648 1.00 35.15 O ATOM 1310 CG2 THR A 85 6.079 18.367 21.589 1.00 33.97 C ATOM 1311 HA THR A 85 3.612 19.365 20.485 1.00 0.00 H ATOM 1312 HB THR A 85 4.877 16.675 21.196 1.00 0.00 H ATOM 1313 HG1 THR A 85 3.116 17.553 22.619 1.00 0.00 H ATOM 1314 HG23 THR A 85 6.664 18.193 20.686 1.00 0.00 H ATOM 1315 HG21 THR A 85 5.962 19.439 21.747 1.00 0.00 H ATOM 1316 HG22 THR A 85 6.590 17.926 22.445 1.00 0.00 H ATOM 1317 H THR A 85 2.362 16.716 20.596 1.00 0.00 H ATOM 1318 N GLY A 86 4.366 16.984 18.401 1.00 22.23 N ATOM 1319 CA GLY A 86 5.116 16.620 17.218 1.00 15.32 C ATOM 1320 C GLY A 86 6.479 16.245 17.741 1.00 16.73 C ATOM 1321 O GLY A 86 6.702 15.953 18.942 1.00 17.78 O ATOM 1322 HA3 GLY A 86 5.185 17.462 16.530 1.00 0.00 H ATOM 1323 HA2 GLY A 86 4.651 15.775 16.711 1.00 0.00 H ATOM 1324 H GLY A 86 3.645 16.333 18.773 1.00 0.00 H ATOM 1325 N HIS A 87 7.417 16.236 16.828 1.00 18.64 N ATOM 1326 CA HIS A 87 8.788 15.988 17.208 1.00 22.36 C ATOM 1327 C HIS A 87 9.425 17.166 16.508 1.00 21.06 C ATOM 1328 O HIS A 87 9.649 17.081 15.298 1.00 22.83 O ATOM 1329 CB HIS A 87 9.313 14.646 16.651 1.00 22.22 C ATOM 1330 CG HIS A 87 10.796 14.359 16.891 1.00 27.11 C ATOM 1331 ND1 HIS A 87 11.545 13.510 16.189 1.00 31.95 N ATOM 1332 CD2 HIS A 87 11.631 14.973 17.792 1.00 28.58 C ATOM 1333 CE1 HIS A 87 12.781 13.602 16.620 1.00 26.51 C ATOM 1334 NE2 HIS A 87 12.823 14.484 17.573 1.00 30.45 N ATOM 1335 HA HIS A 87 8.973 15.907 18.279 1.00 0.00 H ATOM 1336 HB2 HIS A 87 8.738 13.844 17.114 1.00 0.00 H ATOM 1337 HB3 HIS A 87 9.141 14.640 15.575 1.00 0.00 H ATOM 1338 HD2 HIS A 87 11.355 15.718 18.539 1.00 0.00 H ATOM 1339 HE1 HIS A 87 13.631 13.033 16.242 1.00 0.00 H ATOM 1340 H HIS A 87 7.175 16.407 15.831 1.00 0.00 H ATOM 1341 N PRO A 88 9.724 18.241 17.240 1.00 20.74 N ATOM 1342 CA PRO A 88 10.127 19.520 16.719 1.00 20.98 C ATOM 1343 C PRO A 88 11.190 19.435 15.659 1.00 23.03 C ATOM 1344 O PRO A 88 12.267 18.846 15.814 1.00 20.02 O ATOM 1345 CB PRO A 88 10.560 20.286 17.945 1.00 25.23 C ATOM 1346 CG PRO A 88 9.587 19.791 18.986 1.00 20.16 C ATOM 1347 CD PRO A 88 9.628 18.312 18.703 1.00 18.52 C ATOM 1348 HA PRO A 88 9.317 20.017 16.186 1.00 0.00 H ATOM 1349 HD3 PRO A 88 10.496 17.850 19.173 1.00 0.00 H ATOM 1350 HD2 PRO A 88 8.721 17.823 19.058 1.00 0.00 H ATOM 1351 HG3 PRO A 88 8.589 20.204 18.836 1.00 0.00 H ATOM 1352 HG2 PRO A 88 9.925 20.019 19.997 1.00 0.00 H ATOM 1353 HB2 PRO A 88 11.588 20.048 18.218 1.00 0.00 H ATOM 1354 HB3 PRO A 88 10.466 21.361 17.794 1.00 0.00 H ATOM 1355 N GLY A 89 10.741 19.990 14.543 1.00 24.66 N ATOM 1356 CA GLY A 89 11.561 20.040 13.346 1.00 26.48 C ATOM 1357 C GLY A 89 11.523 18.794 12.471 1.00 28.12 C ATOM 1358 O GLY A 89 12.027 18.865 11.350 1.00 31.75 O ATOM 1359 HA3 GLY A 89 12.594 20.203 13.653 1.00 0.00 H ATOM 1360 HA2 GLY A 89 11.225 20.884 12.744 1.00 0.00 H ATOM 1361 H GLY A 89 9.784 20.397 14.524 1.00 0.00 H ATOM 1362 N ILE A 90 10.962 17.661 12.913 1.00 25.39 N ATOM 1363 CA ILE A 90 10.870 16.449 12.105 1.00 22.49 C ATOM 1364 C ILE A 90 9.386 16.206 11.790 1.00 23.18 C ATOM 1365 O ILE A 90 8.946 16.125 10.641 1.00 23.47 O ATOM 1366 CB ILE A 90 11.451 15.251 12.897 1.00 24.33 C ATOM 1367 CG1 ILE A 90 12.812 15.541 13.551 1.00 30.18 C ATOM 1368 CG2 ILE A 90 11.525 14.105 11.927 1.00 24.49 C ATOM 1369 CD1 ILE A 90 14.005 15.851 12.637 1.00 32.22 C ATOM 1370 HA ILE A 90 11.437 16.558 11.181 1.00 0.00 H ATOM 1371 HB ILE A 90 10.804 15.020 13.743 1.00 0.00 H ATOM 1372 HG12 ILE A 90 12.678 16.399 14.210 1.00 0.00 H ATOM 1373 HG13 ILE A 90 13.078 14.667 14.145 1.00 0.00 H ATOM 1374 HD11 ILE A 90 14.185 15.003 11.976 1.00 0.00 H ATOM 1375 HD12 ILE A 90 13.784 16.737 12.041 1.00 0.00 H ATOM 1376 HD13 ILE A 90 14.890 16.033 13.246 1.00 0.00 H ATOM 1377 HG21 ILE A 90 10.526 13.882 11.553 1.00 0.00 H ATOM 1378 HG22 ILE A 90 12.173 14.377 11.094 1.00 0.00 H ATOM 1379 HG23 ILE A 90 11.930 13.228 12.433 1.00 0.00 H ATOM 1380 H ILE A 90 10.574 17.644 13.878 1.00 0.00 H ATOM 1381 N ILE A 91 8.563 16.102 12.843 1.00 22.19 N ATOM 1382 CA ILE A 91 7.139 15.766 12.718 1.00 18.91 C ATOM 1383 C ILE A 91 6.414 17.022 13.178 1.00 18.70 C ATOM 1384 O ILE A 91 6.684 17.455 14.297 1.00 17.68 O ATOM 1385 CB ILE A 91 6.755 14.581 13.652 1.00 18.16 C ATOM 1386 CG1 ILE A 91 7.690 13.381 13.472 1.00 19.82 C ATOM 1387 CG2 ILE A 91 5.310 14.225 13.387 1.00 16.03 C ATOM 1388 CD1 ILE A 91 7.739 12.770 12.063 1.00 20.14 C ATOM 1389 HA ILE A 91 6.885 15.464 11.702 1.00 0.00 H ATOM 1390 HB ILE A 91 6.870 14.882 14.693 1.00 0.00 H ATOM 1391 HG12 ILE A 91 8.699 13.702 13.732 1.00 0.00 H ATOM 1392 HG13 ILE A 91 7.369 12.601 14.163 1.00 0.00 H ATOM 1393 HD11 ILE A 91 6.744 12.424 11.784 1.00 0.00 H ATOM 1394 HD12 ILE A 91 8.075 13.525 11.352 1.00 0.00 H ATOM 1395 HD13 ILE A 91 8.433 11.929 12.057 1.00 0.00 H ATOM 1396 HG21 ILE A 91 4.680 15.089 13.597 1.00 0.00 H ATOM 1397 HG22 ILE A 91 5.194 13.934 12.343 1.00 0.00 H ATOM 1398 HG23 ILE A 91 5.017 13.396 14.031 1.00 0.00 H ATOM 1399 H ILE A 91 8.951 16.267 13.794 1.00 0.00 H ATOM 1400 N PRO A 92 5.541 17.674 12.417 1.00 18.04 N ATOM 1401 CA PRO A 92 4.729 18.787 12.887 1.00 16.74 C ATOM 1402 C PRO A 92 3.691 18.403 13.950 1.00 14.24 C ATOM 1403 O PRO A 92 3.373 17.210 14.110 1.00 11.83 O ATOM 1404 CB PRO A 92 4.149 19.341 11.585 1.00 18.88 C ATOM 1405 CG PRO A 92 4.086 18.144 10.680 1.00 20.56 C ATOM 1406 CD PRO A 92 5.401 17.474 10.985 1.00 19.26 C ATOM 1407 HA PRO A 92 5.299 19.534 13.439 1.00 0.00 H ATOM 1408 HD3 PRO A 92 5.368 16.413 10.738 1.00 0.00 H ATOM 1409 HD2 PRO A 92 6.218 17.947 10.441 1.00 0.00 H ATOM 1410 HG3 PRO A 92 4.021 18.438 9.632 1.00 0.00 H ATOM 1411 HG2 PRO A 92 3.242 17.500 10.928 1.00 0.00 H ATOM 1412 HB2 PRO A 92 3.155 19.757 11.749 1.00 0.00 H ATOM 1413 HB3 PRO A 92 4.799 20.110 11.167 1.00 0.00 H ATOM 1414 N PRO A 93 3.156 19.358 14.718 1.00 12.87 N ATOM 1415 CA PRO A 93 2.015 19.172 15.607 1.00 10.34 C ATOM 1416 C PRO A 93 0.845 18.528 14.890 1.00 13.03 C ATOM 1417 O PRO A 93 0.562 18.879 13.742 1.00 11.22 O ATOM 1418 CB PRO A 93 1.673 20.563 16.082 1.00 12.90 C ATOM 1419 CG PRO A 93 2.989 21.298 16.044 1.00 12.79 C ATOM 1420 CD PRO A 93 3.623 20.747 14.770 1.00 12.06 C ATOM 1421 HA PRO A 93 2.248 18.500 16.433 1.00 0.00 H ATOM 1422 HD3 PRO A 93 3.285 21.303 13.896 1.00 0.00 H ATOM 1423 HD2 PRO A 93 4.711 20.789 14.828 1.00 0.00 H ATOM 1424 HG3 PRO A 93 3.596 21.069 16.920 1.00 0.00 H ATOM 1425 HG2 PRO A 93 2.839 22.376 15.978 1.00 0.00 H ATOM 1426 HB2 PRO A 93 0.948 21.032 15.417 1.00 0.00 H ATOM 1427 HB3 PRO A 93 1.272 20.539 17.095 1.00 0.00 H ATOM 1428 N HIS A 94 0.146 17.614 15.562 1.00 12.85 N ATOM 1429 CA HIS A 94 -1.071 17.010 15.053 1.00 13.38 C ATOM 1430 C HIS A 94 -0.931 16.318 13.698 1.00 12.83 C ATOM 1431 O HIS A 94 -1.867 16.302 12.884 1.00 13.62 O ATOM 1432 CB HIS A 94 -2.194 18.085 14.976 1.00 18.12 C ATOM 1433 CG HIS A 94 -2.401 18.891 16.264 1.00 23.58 C ATOM 1434 ND1 HIS A 94 -2.947 18.545 17.434 1.00 24.20 N ATOM 1435 CD2 HIS A 94 -2.011 20.209 16.391 1.00 23.08 C ATOM 1436 CE1 HIS A 94 -2.901 19.582 18.236 1.00 22.37 C ATOM 1437 NE2 HIS A 94 -2.333 20.582 17.600 1.00 22.31 N ATOM 1438 HA HIS A 94 -1.323 16.220 15.760 1.00 0.00 H ATOM 1439 HB2 HIS A 94 -1.943 18.782 14.176 1.00 0.00 H ATOM 1440 HB3 HIS A 94 -3.130 17.581 14.737 1.00 0.00 H ATOM 1441 HD2 HIS A 94 -1.528 20.820 15.629 1.00 0.00 H ATOM 1442 HE1 HIS A 94 -3.272 19.610 19.260 1.00 0.00 H ATOM 1443 H HIS A 94 0.490 17.319 16.498 1.00 0.00 H ATOM 1444 N ALA A 95 0.182 15.616 13.492 1.00 11.03 N ATOM 1445 CA ALA A 95 0.424 14.958 12.216 1.00 9.56 C ATOM 1446 C ALA A 95 -0.061 13.516 12.159 1.00 11.78 C ATOM 1447 O ALA A 95 0.198 12.756 13.097 1.00 11.25 O ATOM 1448 CB ALA A 95 1.916 14.932 11.902 1.00 11.57 C ATOM 1449 HA ALA A 95 -0.141 15.544 11.491 1.00 0.00 H ATOM 1450 HB1 ALA A 95 2.293 15.953 11.851 1.00 0.00 H ATOM 1451 HB2 ALA A 95 2.442 14.388 12.687 1.00 0.00 H ATOM 1452 HB3 ALA A 95 2.076 14.436 10.945 1.00 0.00 H ATOM 1453 H ALA A 95 0.887 15.537 14.252 1.00 0.00 H ATOM 1454 N THR A 96 -0.815 13.161 11.119 1.00 10.68 N ATOM 1455 CA THR A 96 -1.152 11.778 10.819 1.00 10.89 C ATOM 1456 C THR A 96 0.045 11.238 10.055 1.00 10.74 C ATOM 1457 O THR A 96 0.585 11.909 9.165 1.00 13.60 O ATOM 1458 CB THR A 96 -2.384 11.716 9.950 1.00 7.75 C ATOM 1459 OG1 THR A 96 -3.428 12.214 10.774 1.00 9.87 O ATOM 1460 CG2 THR A 96 -2.727 10.327 9.461 1.00 8.29 C ATOM 1461 HA THR A 96 -1.362 11.205 11.722 1.00 0.00 H ATOM 1462 HB THR A 96 -2.225 12.293 9.039 1.00 0.00 H ATOM 1463 HG1 THR A 96 -3.216 13.141 11.049 1.00 0.00 H ATOM 1464 HG23 THR A 96 -1.919 9.955 8.830 1.00 0.00 H ATOM 1465 HG21 THR A 96 -2.856 9.664 10.316 1.00 0.00 H ATOM 1466 HG22 THR A 96 -3.652 10.364 8.885 1.00 0.00 H ATOM 1467 H THR A 96 -1.179 13.907 10.493 1.00 0.00 H ATOM 1468 N LEU A 97 0.532 10.067 10.418 1.00 8.84 N ATOM 1469 CA LEU A 97 1.695 9.512 9.759 1.00 7.57 C ATOM 1470 C LEU A 97 1.327 8.323 8.915 1.00 8.47 C ATOM 1471 O LEU A 97 0.369 7.602 9.229 1.00 9.01 O ATOM 1472 CB LEU A 97 2.740 9.048 10.752 1.00 8.11 C ATOM 1473 CG LEU A 97 3.146 10.031 11.853 1.00 10.17 C ATOM 1474 CD1 LEU A 97 4.124 9.331 12.795 1.00 10.74 C ATOM 1475 CD2 LEU A 97 3.747 11.287 11.230 1.00 9.23 C ATOM 1476 HA LEU A 97 2.098 10.314 9.141 1.00 0.00 H ATOM 1477 HB2 LEU A 97 2.355 8.152 11.238 1.00 0.00 H ATOM 1478 HB3 LEU A 97 3.639 8.797 10.189 1.00 0.00 H ATOM 1479 HG LEU A 97 2.276 10.344 12.431 1.00 0.00 H ATOM 1480 HD21 LEU A 97 4.627 11.016 10.646 1.00 0.00 H ATOM 1481 HD22 LEU A 97 3.009 11.758 10.581 1.00 0.00 H ATOM 1482 HD23 LEU A 97 4.033 11.981 12.020 1.00 0.00 H ATOM 1483 HD11 LEU A 97 3.641 8.459 13.235 1.00 0.00 H ATOM 1484 HD12 LEU A 97 5.004 9.016 12.234 1.00 0.00 H ATOM 1485 HD13 LEU A 97 4.422 10.020 13.585 1.00 0.00 H ATOM 1486 H LEU A 97 0.075 9.536 11.187 1.00 0.00 H ATOM 1487 N VAL A 98 2.056 8.108 7.827 1.00 7.20 N ATOM 1488 CA VAL A 98 1.812 6.956 6.970 1.00 11.33 C ATOM 1489 C VAL A 98 3.092 6.174 6.881 1.00 9.00 C ATOM 1490 O VAL A 98 4.106 6.787 6.563 1.00 12.16 O ATOM 1491 CB VAL A 98 1.381 7.408 5.580 1.00 11.44 C ATOM 1492 CG1 VAL A 98 1.272 6.230 4.627 1.00 9.75 C ATOM 1493 CG2 VAL A 98 0.003 8.048 5.713 1.00 11.95 C ATOM 1494 HA VAL A 98 1.013 6.341 7.385 1.00 0.00 H ATOM 1495 HB VAL A 98 2.120 8.104 5.183 1.00 0.00 H ATOM 1496 HG11 VAL A 98 2.241 5.738 4.548 1.00 0.00 H ATOM 1497 HG12 VAL A 98 0.534 5.524 5.007 1.00 0.00 H ATOM 1498 HG13 VAL A 98 0.963 6.587 3.644 1.00 0.00 H ATOM 1499 HG21 VAL A 98 -0.699 7.316 6.111 1.00 0.00 H ATOM 1500 HG22 VAL A 98 0.063 8.900 6.390 1.00 0.00 H ATOM 1501 HG23 VAL A 98 -0.336 8.384 4.733 1.00 0.00 H ATOM 1502 H VAL A 98 2.816 8.775 7.582 1.00 0.00 H ATOM 1503 N PHE A 99 3.115 4.874 7.184 1.00 8.80 N ATOM 1504 CA PHE A 99 4.319 4.078 7.075 1.00 8.17 C ATOM 1505 C PHE A 99 4.086 2.963 6.078 1.00 8.42 C ATOM 1506 O PHE A 99 2.979 2.424 5.985 1.00 12.05 O ATOM 1507 CB PHE A 99 4.712 3.430 8.388 1.00 7.68 C ATOM 1508 CG PHE A 99 5.315 4.409 9.383 1.00 15.31 C ATOM 1509 CD1 PHE A 99 6.696 4.680 9.375 1.00 22.27 C ATOM 1510 CD2 PHE A 99 4.502 5.039 10.320 1.00 19.10 C ATOM 1511 CE1 PHE A 99 7.243 5.581 10.309 1.00 23.53 C ATOM 1512 CE2 PHE A 99 5.055 5.933 11.246 1.00 17.68 C ATOM 1513 CZ PHE A 99 6.413 6.201 11.247 1.00 19.57 C ATOM 1514 HA PHE A 99 5.117 4.752 6.764 1.00 0.00 H ATOM 1515 HB2 PHE A 99 3.823 2.985 8.835 1.00 0.00 H ATOM 1516 HB3 PHE A 99 5.444 2.649 8.184 1.00 0.00 H ATOM 1517 HD2 PHE A 99 3.431 4.836 10.334 1.00 0.00 H ATOM 1518 HE2 PHE A 99 4.409 6.423 11.974 1.00 0.00 H ATOM 1519 HZ PHE A 99 6.833 6.893 11.977 1.00 0.00 H ATOM 1520 HE1 PHE A 99 8.312 5.794 10.300 1.00 0.00 H ATOM 1521 HD1 PHE A 99 7.343 4.192 8.646 1.00 0.00 H ATOM 1522 H PHE A 99 2.239 4.418 7.509 1.00 0.00 H ATOM 1523 N ASP A 100 5.091 2.652 5.268 1.00 7.60 N ATOM 1524 CA ASP A 100 5.054 1.484 4.412 1.00 9.59 C ATOM 1525 C ASP A 100 5.999 0.562 5.168 1.00 9.14 C ATOM 1526 O ASP A 100 7.189 0.887 5.186 1.00 9.29 O ATOM 1527 CB ASP A 100 5.622 1.818 3.066 1.00 11.12 C ATOM 1528 CG ASP A 100 5.622 0.714 2.015 1.00 14.05 C ATOM 1529 OD1 ASP A 100 5.869 -0.458 2.288 1.00 14.43 O ATOM 1530 OD2 ASP A 100 5.382 1.066 0.877 1.00 16.55 O ATOM 1531 HA ASP A 100 4.061 1.074 4.228 1.00 0.00 H ATOM 1532 HB2 ASP A 100 5.047 2.652 2.665 1.00 0.00 H ATOM 1533 HB3 ASP A 100 6.656 2.129 3.214 1.00 0.00 H ATOM 1534 H ASP A 100 5.930 3.266 5.247 1.00 0.00 H ATOM 1535 N VAL A 101 5.541 -0.551 5.757 1.00 8.45 N ATOM 1536 CA VAL A 101 6.342 -1.388 6.649 1.00 9.84 C ATOM 1537 C VAL A 101 6.399 -2.822 6.138 1.00 9.88 C ATOM 1538 O VAL A 101 5.385 -3.357 5.676 1.00 10.19 O ATOM 1539 CB VAL A 101 5.702 -1.391 8.077 1.00 11.60 C ATOM 1540 CG1 VAL A 101 6.653 -2.052 9.051 1.00 12.05 C ATOM 1541 CG2 VAL A 101 5.422 -0.001 8.557 1.00 7.58 C ATOM 1542 HA VAL A 101 7.352 -0.981 6.685 1.00 0.00 H ATOM 1543 HB VAL A 101 4.761 -1.937 8.020 1.00 0.00 H ATOM 1544 HG11 VAL A 101 6.842 -3.077 8.733 1.00 0.00 H ATOM 1545 HG12 VAL A 101 7.592 -1.498 9.073 1.00 0.00 H ATOM 1546 HG13 VAL A 101 6.208 -2.055 10.046 1.00 0.00 H ATOM 1547 HG21 VAL A 101 6.354 0.563 8.598 1.00 0.00 H ATOM 1548 HG22 VAL A 101 4.731 0.487 7.870 1.00 0.00 H ATOM 1549 HG23 VAL A 101 4.978 -0.044 9.552 1.00 0.00 H ATOM 1550 H VAL A 101 4.559 -0.836 5.569 1.00 0.00 H ATOM 1551 N GLU A 102 7.532 -3.483 6.294 1.00 10.14 N ATOM 1552 CA GLU A 102 7.668 -4.884 6.003 1.00 8.49 C ATOM 1553 C GLU A 102 8.187 -5.578 7.253 1.00 6.13 C ATOM 1554 O GLU A 102 9.263 -5.252 7.742 1.00 5.08 O ATOM 1555 CB GLU A 102 8.651 -5.059 4.885 1.00 12.49 C ATOM 1556 CG GLU A 102 8.688 -6.474 4.348 1.00 19.95 C ATOM 1557 CD GLU A 102 9.750 -6.712 3.279 1.00 25.54 C ATOM 1558 OE1 GLU A 102 10.346 -5.756 2.764 1.00 29.46 O ATOM 1559 OE2 GLU A 102 9.980 -7.876 2.964 1.00 28.51 O ATOM 1560 HA GLU A 102 6.710 -5.311 5.707 1.00 0.00 H ATOM 1561 HB2 GLU A 102 8.378 -4.386 4.073 1.00 0.00 H ATOM 1562 HB3 GLU A 102 9.644 -4.800 5.251 1.00 0.00 H ATOM 1563 HG2 GLU A 102 8.883 -7.150 5.180 1.00 0.00 H ATOM 1564 HG3 GLU A 102 7.713 -6.702 3.918 1.00 0.00 H ATOM 1565 H GLU A 102 8.364 -2.966 6.643 1.00 0.00 H ATOM 1566 N LEU A 103 7.479 -6.549 7.806 1.00 6.32 N ATOM 1567 CA LEU A 103 7.960 -7.241 8.980 1.00 7.73 C ATOM 1568 C LEU A 103 8.806 -8.379 8.463 1.00 10.23 C ATOM 1569 O LEU A 103 8.303 -9.319 7.833 1.00 12.24 O ATOM 1570 CB LEU A 103 6.773 -7.740 9.805 1.00 7.44 C ATOM 1571 CG LEU A 103 7.117 -8.514 11.098 1.00 12.45 C ATOM 1572 CD1 LEU A 103 8.072 -7.745 12.011 1.00 11.80 C ATOM 1573 CD2 LEU A 103 5.810 -8.785 11.815 1.00 8.90 C ATOM 1574 HA LEU A 103 8.546 -6.599 9.637 1.00 0.00 H ATOM 1575 HB2 LEU A 103 6.175 -6.873 10.085 1.00 0.00 H ATOM 1576 HB3 LEU A 103 6.180 -8.399 9.170 1.00 0.00 H ATOM 1577 HG LEU A 103 7.633 -9.438 10.836 1.00 0.00 H ATOM 1578 HD21 LEU A 103 5.323 -7.839 12.051 1.00 0.00 H ATOM 1579 HD22 LEU A 103 5.161 -9.379 11.172 1.00 0.00 H ATOM 1580 HD23 LEU A 103 6.009 -9.332 12.737 1.00 0.00 H ATOM 1581 HD11 LEU A 103 9.004 -7.552 11.480 1.00 0.00 H ATOM 1582 HD12 LEU A 103 7.614 -6.799 12.300 1.00 0.00 H ATOM 1583 HD13 LEU A 103 8.277 -8.338 12.902 1.00 0.00 H ATOM 1584 H LEU A 103 6.564 -6.818 7.390 1.00 0.00 H ATOM 1585 N LEU A 104 10.107 -8.225 8.681 1.00 10.40 N ATOM 1586 CA LEU A 104 11.100 -9.153 8.184 1.00 13.52 C ATOM 1587 C LEU A 104 11.241 -10.362 9.073 1.00 15.66 C ATOM 1588 O LEU A 104 11.269 -11.476 8.544 1.00 17.69 O ATOM 1589 CB LEU A 104 12.471 -8.481 8.058 1.00 11.78 C ATOM 1590 CG LEU A 104 12.595 -7.275 7.134 1.00 10.58 C ATOM 1591 CD1 LEU A 104 13.921 -6.590 7.287 1.00 11.80 C ATOM 1592 CD2 LEU A 104 12.438 -7.750 5.719 1.00 16.60 C ATOM 1593 HA LEU A 104 10.751 -9.473 7.202 1.00 0.00 H ATOM 1594 HB2 LEU A 104 12.766 -8.157 9.056 1.00 0.00 H ATOM 1595 HB3 LEU A 104 13.171 -9.236 7.701 1.00 0.00 H ATOM 1596 HG LEU A 104 11.821 -6.553 7.394 1.00 0.00 H ATOM 1597 HD21 LEU A 104 13.217 -8.478 5.493 1.00 0.00 H ATOM 1598 HD22 LEU A 104 11.459 -8.215 5.600 1.00 0.00 H ATOM 1599 HD23 LEU A 104 12.524 -6.901 5.041 1.00 0.00 H ATOM 1600 HD11 LEU A 104 14.035 -6.247 8.315 1.00 0.00 H ATOM 1601 HD12 LEU A 104 14.720 -7.291 7.046 1.00 0.00 H ATOM 1602 HD13 LEU A 104 13.968 -5.736 6.611 1.00 0.00 H ATOM 1603 H LEU A 104 10.426 -7.403 9.232 1.00 0.00 H ATOM 1604 N LYS A 105 11.299 -10.219 10.391 1.00 13.31 N ATOM 1605 CA LYS A 105 11.488 -11.350 11.272 1.00 18.32 C ATOM 1606 C LYS A 105 11.303 -10.918 12.698 1.00 15.05 C ATOM 1607 O LYS A 105 11.249 -9.719 12.973 1.00 16.50 O ATOM 1608 CB LYS A 105 12.900 -11.955 11.097 1.00 24.76 C ATOM 1609 CG LYS A 105 14.104 -11.454 11.846 1.00 34.80 C ATOM 1610 CD LYS A 105 15.287 -12.007 11.069 1.00 44.42 C ATOM 1611 CE LYS A 105 16.477 -12.373 11.961 1.00 53.98 C ATOM 1612 NZ LYS A 105 16.279 -13.619 12.695 1.00 56.92 N ATOM 1613 HA LYS A 105 10.749 -12.110 11.017 1.00 0.00 H ATOM 1614 HB2 LYS A 105 12.808 -13.012 11.349 1.00 0.00 H ATOM 1615 HB3 LYS A 105 13.141 -11.855 10.039 1.00 0.00 H ATOM 1616 HG2 LYS A 105 14.125 -10.364 11.859 1.00 0.00 H ATOM 1617 HG3 LYS A 105 14.105 -11.828 12.870 1.00 0.00 H ATOM 1618 HD2 LYS A 105 14.964 -12.902 10.537 1.00 0.00 H ATOM 1619 HD3 LYS A 105 15.611 -11.255 10.350 1.00 0.00 H ATOM 1620 HE2 LYS A 105 16.634 -11.568 12.679 1.00 0.00 H ATOM 1621 HE3 LYS A 105 17.363 -12.476 11.334 1.00 0.00 H ATOM 1622 HZ1 LYS A 105 15.442 -13.531 13.305 1.00 0.00 H ATOM 1623 HZ2 LYS A 105 16.138 -14.398 12.021 1.00 0.00 H ATOM 1624 HZ3 LYS A 105 17.117 -13.812 13.280 1.00 0.00 H ATOM 1625 H LYS A 105 11.206 -9.268 10.801 1.00 0.00 H ATOM 1626 N LEU A 106 11.129 -11.893 13.579 1.00 15.58 N ATOM 1627 CA LEU A 106 10.952 -11.651 14.994 1.00 17.96 C ATOM 1628 C LEU A 106 12.155 -12.284 15.671 1.00 23.09 C ATOM 1629 O LEU A 106 12.661 -13.287 15.161 1.00 28.95 O ATOM 1630 CB LEU A 106 9.678 -12.309 15.494 1.00 11.30 C ATOM 1631 CG LEU A 106 8.368 -11.772 14.991 1.00 10.77 C ATOM 1632 CD1 LEU A 106 7.244 -12.612 15.543 1.00 13.26 C ATOM 1633 CD2 LEU A 106 8.178 -10.357 15.446 1.00 11.87 C ATOM 1634 HA LEU A 106 10.873 -10.585 15.207 1.00 0.00 H ATOM 1635 HB2 LEU A 106 9.726 -13.362 15.217 1.00 0.00 H ATOM 1636 HB3 LEU A 106 9.671 -12.220 16.580 1.00 0.00 H ATOM 1637 HG LEU A 106 8.368 -11.804 13.901 1.00 0.00 H ATOM 1638 HD21 LEU A 106 8.183 -10.323 16.535 1.00 0.00 H ATOM 1639 HD22 LEU A 106 8.989 -9.740 15.059 1.00 0.00 H ATOM 1640 HD23 LEU A 106 7.225 -9.982 15.074 1.00 0.00 H ATOM 1641 HD11 LEU A 106 7.368 -13.644 15.214 1.00 0.00 H ATOM 1642 HD12 LEU A 106 7.263 -12.572 16.632 1.00 0.00 H ATOM 1643 HD13 LEU A 106 6.291 -12.226 15.180 1.00 0.00 H ATOM 1644 H LEU A 106 11.119 -12.875 13.238 1.00 0.00 H ATOM 1645 N GLU A 107 12.727 -11.751 16.745 1.00 25.35 N ATOM 1646 CA GLU A 107 13.787 -12.461 17.455 1.00 27.22 C ATOM 1647 C GLU A 107 13.747 -12.193 18.970 1.00 26.77 C ATOM 1648 O GLU A 107 14.620 -12.622 19.712 1.00 28.55 O ATOM 1649 CB GLU A 107 15.126 -12.080 16.795 1.00 26.21 C ATOM 1650 CG GLU A 107 15.430 -10.626 16.592 1.00 28.90 C ATOM 1651 CD GLU A 107 16.751 -10.366 15.890 1.00 31.12 C ATOM 1652 OE1 GLU A 107 17.020 -10.990 14.868 1.00 32.57 O ATOM 1653 OE2 GLU A 107 17.513 -9.522 16.358 1.00 34.40 O ATOM 1654 HA GLU A 107 13.648 -13.539 17.372 1.00 0.00 H ATOM 1655 OXT GLU A 107 12.740 -11.657 19.438 1.00 24.60 O ATOM 1656 HB2 GLU A 107 15.921 -12.493 17.416 1.00 0.00 H ATOM 1657 HB3 GLU A 107 15.149 -12.555 15.814 1.00 0.00 H ATOM 1658 HG2 GLU A 107 14.631 -10.188 15.994 1.00 0.00 H ATOM 1659 HG3 GLU A 107 15.458 -10.141 17.568 1.00 0.00 H ATOM 1660 H GLU A 107 12.416 -10.818 17.084 1.00 0.00 H TER 1661 GLU A 107 ATOM 1662 N GLY B 1 25.255 18.162 38.378 1.00 21.86 N ATOM 1663 CA GLY B 1 25.376 18.809 37.089 1.00 25.61 C ATOM 1664 C GLY B 1 25.616 17.675 36.118 1.00 25.92 C ATOM 1665 O GLY B 1 25.125 16.569 36.384 1.00 27.93 O ATOM 1666 HA3 GLY B 1 26.215 19.505 37.084 1.00 0.00 H ATOM 1667 HA2 GLY B 1 24.460 19.344 36.838 1.00 0.00 H ATOM 1668 HN3 GLY B 1 26.134 17.648 38.590 1.00 0.00 H ATOM 1669 HN2 GLY B 1 24.458 17.494 38.356 1.00 0.00 H ATOM 1670 HN1 GLY B 1 25.086 18.881 39.111 1.00 0.00 H ATOM 1671 N VAL B 2 26.322 17.897 35.025 1.00 25.58 N ATOM 1672 CA VAL B 2 26.646 16.814 34.114 1.00 23.95 C ATOM 1673 C VAL B 2 28.164 16.748 34.055 1.00 24.01 C ATOM 1674 O VAL B 2 28.825 17.785 34.048 1.00 26.02 O ATOM 1675 CB VAL B 2 26.008 17.090 32.698 1.00 22.04 C ATOM 1676 CG1 VAL B 2 26.318 18.472 32.157 1.00 22.37 C ATOM 1677 CG2 VAL B 2 26.587 16.107 31.697 1.00 20.80 C ATOM 1678 HA VAL B 2 26.243 15.859 34.450 1.00 0.00 H ATOM 1679 HB VAL B 2 24.930 16.993 32.827 1.00 0.00 H ATOM 1680 HG11 VAL B 2 25.931 19.225 32.844 1.00 0.00 H ATOM 1681 HG12 VAL B 2 27.397 18.589 32.059 1.00 0.00 H ATOM 1682 HG13 VAL B 2 25.848 18.593 31.181 1.00 0.00 H ATOM 1683 HG21 VAL B 2 27.668 16.237 31.646 1.00 0.00 H ATOM 1684 HG22 VAL B 2 26.356 15.090 32.014 1.00 0.00 H ATOM 1685 HG23 VAL B 2 26.151 16.291 30.715 1.00 0.00 H ATOM 1686 H VAL B 2 26.651 18.861 34.814 1.00 0.00 H ATOM 1687 N GLN B 3 28.774 15.573 34.048 1.00 25.32 N ATOM 1688 CA GLN B 3 30.209 15.433 33.823 1.00 27.93 C ATOM 1689 C GLN B 3 30.378 14.873 32.406 1.00 27.90 C ATOM 1690 O GLN B 3 29.701 13.896 32.052 1.00 28.20 O ATOM 1691 CB GLN B 3 30.863 14.425 34.744 1.00 35.84 C ATOM 1692 CG GLN B 3 30.683 14.545 36.238 1.00 49.10 C ATOM 1693 CD GLN B 3 31.525 15.593 36.964 1.00 60.13 C ATOM 1694 OE1 GLN B 3 31.230 15.847 38.130 1.00 68.17 O ATOM 1695 NE2 GLN B 3 32.584 16.220 36.442 1.00 64.01 N ATOM 1696 HA GLN B 3 30.668 16.407 33.992 1.00 0.00 H ATOM 1697 HB2 GLN B 3 30.484 13.444 34.458 1.00 0.00 H ATOM 1698 HB3 GLN B 3 31.935 14.470 34.551 1.00 0.00 H ATOM 1699 HG2 GLN B 3 29.635 14.781 36.424 1.00 0.00 H ATOM 1700 HG3 GLN B 3 30.919 13.575 36.675 1.00 0.00 H ATOM 1701 HE22 GLN B 3 32.867 16.033 35.459 1.00 0.00 H ATOM 1702 HE21 GLN B 3 33.125 16.895 37.019 1.00 0.00 H ATOM 1703 H GLN B 3 28.208 14.716 34.209 1.00 0.00 H ATOM 1704 N VAL B 4 31.277 15.388 31.574 1.00 23.33 N ATOM 1705 CA VAL B 4 31.484 14.895 30.226 1.00 22.69 C ATOM 1706 C VAL B 4 32.872 14.261 30.234 1.00 23.89 C ATOM 1707 O VAL B 4 33.812 14.948 30.632 1.00 26.42 O ATOM 1708 CB VAL B 4 31.454 16.061 29.202 1.00 19.34 C ATOM 1709 CG1 VAL B 4 31.556 15.484 27.792 1.00 19.69 C ATOM 1710 CG2 VAL B 4 30.198 16.900 29.373 1.00 19.70 C ATOM 1711 HA VAL B 4 30.704 14.190 29.939 1.00 0.00 H ATOM 1712 HB VAL B 4 32.303 16.723 29.375 1.00 0.00 H ATOM 1713 HG11 VAL B 4 32.490 14.931 27.694 1.00 0.00 H ATOM 1714 HG12 VAL B 4 30.715 14.814 27.613 1.00 0.00 H ATOM 1715 HG13 VAL B 4 31.536 16.297 27.066 1.00 0.00 H ATOM 1716 HG21 VAL B 4 29.320 16.273 29.217 1.00 0.00 H ATOM 1717 HG22 VAL B 4 30.175 17.316 30.380 1.00 0.00 H ATOM 1718 HG23 VAL B 4 30.202 17.710 28.644 1.00 0.00 H ATOM 1719 H VAL B 4 31.860 16.183 31.905 1.00 0.00 H ATOM 1720 N GLU B 5 33.063 13.000 29.851 1.00 23.54 N ATOM 1721 CA GLU B 5 34.387 12.409 29.758 1.00 24.67 C ATOM 1722 C GLU B 5 34.517 11.886 28.331 1.00 23.19 C ATOM 1723 O GLU B 5 33.688 11.092 27.882 1.00 23.01 O ATOM 1724 CB GLU B 5 34.472 11.305 30.768 1.00 29.97 C ATOM 1725 CG GLU B 5 35.818 10.611 30.850 1.00 45.04 C ATOM 1726 CD GLU B 5 35.887 9.569 31.961 1.00 54.04 C ATOM 1727 OE1 GLU B 5 35.193 8.551 31.866 1.00 57.43 O ATOM 1728 OE2 GLU B 5 36.641 9.784 32.916 1.00 59.29 O ATOM 1729 HA GLU B 5 35.193 13.113 29.965 1.00 0.00 H ATOM 1730 HB2 GLU B 5 34.248 11.726 31.748 1.00 0.00 H ATOM 1731 HB3 GLU B 5 33.721 10.557 30.515 1.00 0.00 H ATOM 1732 HG2 GLU B 5 36.012 10.117 29.898 1.00 0.00 H ATOM 1733 HG3 GLU B 5 36.586 11.363 31.031 1.00 0.00 H ATOM 1734 H GLU B 5 32.236 12.418 29.610 1.00 0.00 H ATOM 1735 N THR B 6 35.482 12.302 27.532 1.00 19.30 N ATOM 1736 CA THR B 6 35.563 11.859 26.163 1.00 20.70 C ATOM 1737 C THR B 6 36.012 10.408 26.029 1.00 22.71 C ATOM 1738 O THR B 6 36.922 9.954 26.716 1.00 24.45 O ATOM 1739 CB THR B 6 36.511 12.832 25.457 1.00 18.19 C ATOM 1740 OG1 THR B 6 35.937 14.116 25.631 1.00 21.77 O ATOM 1741 CG2 THR B 6 36.647 12.597 23.982 1.00 18.16 C ATOM 1742 HA THR B 6 34.576 11.869 25.701 1.00 0.00 H ATOM 1743 HB THR B 6 37.507 12.711 25.883 1.00 0.00 H ATOM 1744 HG1 THR B 6 36.509 14.794 25.192 1.00 0.00 H ATOM 1745 HG23 THR B 6 37.087 11.615 23.811 1.00 0.00 H ATOM 1746 HG21 THR B 6 35.663 12.642 23.516 1.00 0.00 H ATOM 1747 HG22 THR B 6 37.290 13.364 23.551 1.00 0.00 H ATOM 1748 H THR B 6 36.198 12.962 27.898 1.00 0.00 H ATOM 1749 N ILE B 7 35.306 9.631 25.218 1.00 24.04 N ATOM 1750 CA ILE B 7 35.732 8.284 24.873 1.00 21.38 C ATOM 1751 C ILE B 7 36.509 8.455 23.559 1.00 23.09 C ATOM 1752 O ILE B 7 37.611 7.947 23.423 1.00 25.32 O ATOM 1753 CB ILE B 7 34.486 7.379 24.702 1.00 18.70 C ATOM 1754 CG1 ILE B 7 33.734 7.315 26.037 1.00 17.82 C ATOM 1755 CG2 ILE B 7 34.910 5.985 24.215 1.00 20.30 C ATOM 1756 CD1 ILE B 7 32.353 6.606 25.961 1.00 20.22 C ATOM 1757 HA ILE B 7 36.350 7.810 25.635 1.00 0.00 H ATOM 1758 HB ILE B 7 33.816 7.793 23.948 1.00 0.00 H ATOM 1759 HG12 ILE B 7 34.355 6.777 26.753 1.00 0.00 H ATOM 1760 HG13 ILE B 7 33.576 8.334 26.389 1.00 0.00 H ATOM 1761 HD11 ILE B 7 31.711 7.138 25.258 1.00 0.00 H ATOM 1762 HD12 ILE B 7 32.491 5.579 25.623 1.00 0.00 H ATOM 1763 HD13 ILE B 7 31.891 6.606 26.948 1.00 0.00 H ATOM 1764 HG21 ILE B 7 35.421 6.076 23.257 1.00 0.00 H ATOM 1765 HG22 ILE B 7 35.582 5.535 24.946 1.00 0.00 H ATOM 1766 HG23 ILE B 7 34.026 5.358 24.098 1.00 0.00 H ATOM 1767 H ILE B 7 34.419 9.997 24.816 1.00 0.00 H ATOM 1768 N SER B 8 36.013 9.176 22.561 1.00 23.90 N ATOM 1769 CA SER B 8 36.709 9.421 21.319 1.00 26.08 C ATOM 1770 C SER B 8 36.543 10.893 21.006 1.00 25.47 C ATOM 1771 O SER B 8 35.441 11.418 21.188 1.00 25.10 O ATOM 1772 CB SER B 8 36.119 8.648 20.179 1.00 25.50 C ATOM 1773 OG SER B 8 37.039 7.671 19.747 1.00 40.16 O ATOM 1774 HA SER B 8 37.750 9.118 21.433 1.00 0.00 H ATOM 1775 HB2 SER B 8 35.896 9.327 19.356 1.00 0.00 H ATOM 1776 HB3 SER B 8 35.200 8.162 20.506 1.00 0.00 H ATOM 1777 HG SER B 8 37.240 7.055 20.495 1.00 0.00 H ATOM 1778 H SER B 8 35.066 9.589 22.680 1.00 0.00 H ATOM 1779 N PRO B 9 37.579 11.624 20.592 1.00 24.53 N ATOM 1780 CA PRO B 9 37.470 13.020 20.233 1.00 20.09 C ATOM 1781 C PRO B 9 36.800 13.252 18.899 1.00 19.49 C ATOM 1782 O PRO B 9 36.784 12.402 17.997 1.00 19.92 O ATOM 1783 CB PRO B 9 38.894 13.518 20.293 1.00 20.05 C ATOM 1784 CG PRO B 9 39.645 12.300 19.852 1.00 23.09 C ATOM 1785 CD PRO B 9 38.972 11.203 20.639 1.00 23.50 C ATOM 1786 HA PRO B 9 36.815 13.569 20.910 1.00 0.00 H ATOM 1787 HD3 PRO B 9 39.111 10.231 20.166 1.00 0.00 H ATOM 1788 HD2 PRO B 9 39.342 11.163 21.664 1.00 0.00 H ATOM 1789 HG3 PRO B 9 40.703 12.375 20.105 1.00 0.00 H ATOM 1790 HG2 PRO B 9 39.540 12.138 18.779 1.00 0.00 H ATOM 1791 HB2 PRO B 9 39.054 14.355 19.613 1.00 0.00 H ATOM 1792 HB3 PRO B 9 39.172 13.815 21.304 1.00 0.00 H ATOM 1793 N GLY B 10 36.134 14.394 18.855 1.00 19.49 N ATOM 1794 CA GLY B 10 35.542 14.841 17.622 1.00 21.33 C ATOM 1795 C GLY B 10 36.492 15.779 16.923 1.00 22.17 C ATOM 1796 O GLY B 10 37.703 15.826 17.190 1.00 23.11 O ATOM 1797 HA3 GLY B 10 34.607 15.360 17.834 1.00 0.00 H ATOM 1798 HA2 GLY B 10 35.342 13.982 16.982 1.00 0.00 H ATOM 1799 H GLY B 10 36.038 14.971 19.715 1.00 0.00 H ATOM 1800 N ASP B 11 35.934 16.632 16.081 1.00 21.50 N ATOM 1801 CA ASP B 11 36.781 17.537 15.344 1.00 20.48 C ATOM 1802 C ASP B 11 37.245 18.765 16.115 1.00 18.57 C ATOM 1803 O ASP B 11 38.056 19.526 15.627 1.00 18.09 O ATOM 1804 CB ASP B 11 36.031 17.926 14.065 1.00 20.28 C ATOM 1805 CG ASP B 11 34.852 18.856 14.161 1.00 19.08 C ATOM 1806 OD1 ASP B 11 34.496 19.351 15.228 1.00 21.07 O ATOM 1807 OD2 ASP B 11 34.286 19.102 13.108 1.00 23.52 O ATOM 1808 HA ASP B 11 37.712 17.015 15.123 1.00 0.00 H ATOM 1809 HB2 ASP B 11 36.756 18.397 13.401 1.00 0.00 H ATOM 1810 HB3 ASP B 11 35.672 17.002 13.612 1.00 0.00 H ATOM 1811 H ASP B 11 34.902 16.650 15.952 1.00 0.00 H ATOM 1812 N GLY B 12 36.689 19.088 17.267 1.00 20.08 N ATOM 1813 CA GLY B 12 37.114 20.248 18.049 1.00 20.49 C ATOM 1814 C GLY B 12 36.779 21.632 17.495 1.00 24.27 C ATOM 1815 O GLY B 12 37.136 22.636 18.117 1.00 23.38 O ATOM 1816 HA3 GLY B 12 38.197 20.192 18.155 1.00 0.00 H ATOM 1817 HA2 GLY B 12 36.649 20.168 19.032 1.00 0.00 H ATOM 1818 H GLY B 12 35.918 18.494 17.633 1.00 0.00 H ATOM 1819 N ARG B 13 36.116 21.737 16.339 1.00 27.89 N ATOM 1820 CA ARG B 13 35.788 23.024 15.718 1.00 29.14 C ATOM 1821 C ARG B 13 34.275 23.247 15.580 1.00 27.43 C ATOM 1822 O ARG B 13 33.775 24.372 15.678 1.00 26.40 O ATOM 1823 CB ARG B 13 36.391 23.112 14.313 1.00 32.96 C ATOM 1824 CG ARG B 13 37.737 22.429 14.058 1.00 45.15 C ATOM 1825 CD ARG B 13 38.107 22.347 12.572 1.00 56.03 C ATOM 1826 NE ARG B 13 37.095 21.637 11.797 1.00 69.20 N ATOM 1827 CZ ARG B 13 37.167 21.475 10.464 1.00 75.24 C ATOM 1828 NH1 ARG B 13 38.182 21.967 9.744 1.00 77.31 N ATOM 1829 NH2 ARG B 13 36.194 20.814 9.817 1.00 79.59 N ATOM 1830 HA ARG B 13 36.203 23.786 16.377 1.00 0.00 H ATOM 1831 HB2 ARG B 13 35.670 22.673 13.624 1.00 0.00 H ATOM 1832 HB3 ARG B 13 36.516 24.170 14.081 1.00 0.00 H ATOM 1833 HG2 ARG B 13 38.514 22.991 14.577 1.00 0.00 H ATOM 1834 HG3 ARG B 13 37.693 21.417 14.460 1.00 0.00 H ATOM 1835 HD2 ARG B 13 39.058 21.823 12.474 1.00 0.00 H ATOM 1836 HD3 ARG B 13 38.208 23.358 12.178 1.00 0.00 H ATOM 1837 HE ARG B 13 36.278 21.236 12.300 1.00 0.00 H ATOM 1838 HH12 ARG B 13 38.207 21.823 8.714 1.00 0.00 H ATOM 1839 HH11 ARG B 13 38.946 22.493 10.214 1.00 0.00 H ATOM 1840 HH22 ARG B 13 36.248 20.688 8.786 1.00 0.00 H ATOM 1841 HH21 ARG B 13 35.386 20.428 10.347 1.00 0.00 H ATOM 1842 H ARG B 13 35.819 20.864 15.857 1.00 0.00 H ATOM 1843 N THR B 14 33.515 22.183 15.300 1.00 26.13 N ATOM 1844 CA THR B 14 32.082 22.296 15.040 1.00 22.66 C ATOM 1845 C THR B 14 31.244 21.885 16.252 1.00 22.41 C ATOM 1846 O THR B 14 31.109 20.686 16.548 1.00 22.45 O ATOM 1847 CB THR B 14 31.773 21.413 13.810 1.00 22.39 C ATOM 1848 OG1 THR B 14 32.828 21.591 12.859 1.00 22.78 O ATOM 1849 CG2 THR B 14 30.438 21.760 13.192 1.00 20.74 C ATOM 1850 HA THR B 14 31.818 23.335 14.843 1.00 0.00 H ATOM 1851 HB THR B 14 31.712 20.370 14.122 1.00 0.00 H ATOM 1852 HG1 THR B 14 33.688 21.319 13.267 1.00 0.00 H ATOM 1853 HG23 THR B 14 29.649 21.618 13.931 1.00 0.00 H ATOM 1854 HG21 THR B 14 30.449 22.800 12.866 1.00 0.00 H ATOM 1855 HG22 THR B 14 30.256 21.111 12.335 1.00 0.00 H ATOM 1856 H THR B 14 33.959 21.243 15.266 1.00 0.00 H ATOM 1857 N PHE B 15 30.722 22.862 16.986 1.00 23.00 N ATOM 1858 CA PHE B 15 29.921 22.634 18.171 1.00 23.61 C ATOM 1859 C PHE B 15 28.446 22.952 17.882 1.00 25.06 C ATOM 1860 O PHE B 15 28.178 23.830 17.047 1.00 26.06 O ATOM 1861 CB PHE B 15 30.426 23.519 19.298 1.00 23.08 C ATOM 1862 CG PHE B 15 31.813 23.118 19.743 1.00 21.73 C ATOM 1863 CD1 PHE B 15 32.914 23.602 19.047 1.00 21.02 C ATOM 1864 CD2 PHE B 15 31.972 22.258 20.823 1.00 15.81 C ATOM 1865 CE1 PHE B 15 34.192 23.214 19.422 1.00 18.72 C ATOM 1866 CE2 PHE B 15 33.261 21.882 21.186 1.00 17.75 C ATOM 1867 CZ PHE B 15 34.370 22.355 20.494 1.00 17.57 C ATOM 1868 HA PHE B 15 30.004 21.587 18.463 1.00 0.00 H ATOM 1869 HB2 PHE B 15 30.450 24.553 18.952 1.00 0.00 H ATOM 1870 HB3 PHE B 15 29.745 23.436 20.145 1.00 0.00 H ATOM 1871 HD2 PHE B 15 31.107 21.887 21.373 1.00 0.00 H ATOM 1872 HE2 PHE B 15 33.404 21.205 22.028 1.00 0.00 H ATOM 1873 HZ PHE B 15 35.373 22.052 20.793 1.00 0.00 H ATOM 1874 HE1 PHE B 15 35.057 23.585 18.873 1.00 0.00 H ATOM 1875 HD1 PHE B 15 32.774 24.285 18.209 1.00 0.00 H ATOM 1876 H PHE B 15 30.898 23.844 16.694 1.00 0.00 H ATOM 1877 N PRO B 16 27.467 22.239 18.462 1.00 23.57 N ATOM 1878 CA PRO B 16 26.047 22.480 18.254 1.00 25.70 C ATOM 1879 C PRO B 16 25.622 23.903 18.587 1.00 28.77 C ATOM 1880 O PRO B 16 25.960 24.419 19.653 1.00 31.60 O ATOM 1881 CB PRO B 16 25.339 21.480 19.135 1.00 23.39 C ATOM 1882 CG PRO B 16 26.350 20.396 19.368 1.00 23.89 C ATOM 1883 CD PRO B 16 27.666 21.139 19.399 1.00 22.37 C ATOM 1884 HA PRO B 16 25.794 22.361 17.201 1.00 0.00 H ATOM 1885 HD3 PRO B 16 27.877 21.515 20.400 1.00 0.00 H ATOM 1886 HD2 PRO B 16 28.483 20.495 19.074 1.00 0.00 H ATOM 1887 HG3 PRO B 16 26.333 19.667 18.558 1.00 0.00 H ATOM 1888 HG2 PRO B 16 26.166 19.889 20.315 1.00 0.00 H ATOM 1889 HB2 PRO B 16 25.043 21.940 20.078 1.00 0.00 H ATOM 1890 HB3 PRO B 16 24.457 21.082 18.634 1.00 0.00 H ATOM 1891 N LYS B 17 24.864 24.524 17.694 1.00 29.25 N ATOM 1892 CA LYS B 17 24.263 25.832 17.910 1.00 34.45 C ATOM 1893 C LYS B 17 22.754 25.634 18.145 1.00 33.67 C ATOM 1894 O LYS B 17 22.194 24.607 17.753 1.00 31.62 O ATOM 1895 CB LYS B 17 24.492 26.712 16.672 1.00 39.91 C ATOM 1896 CG LYS B 17 25.923 27.132 16.301 1.00 46.77 C ATOM 1897 CD LYS B 17 26.300 28.229 17.286 1.00 56.06 C ATOM 1898 CE LYS B 17 27.647 28.896 17.060 1.00 61.74 C ATOM 1899 NZ LYS B 17 27.667 30.140 17.824 1.00 65.28 N ATOM 1900 HA LYS B 17 24.713 26.321 18.774 1.00 0.00 H ATOM 1901 HB2 LYS B 17 24.088 26.170 15.817 1.00 0.00 H ATOM 1902 HB3 LYS B 17 23.921 27.628 16.823 1.00 0.00 H ATOM 1903 HG2 LYS B 17 26.604 26.286 16.395 1.00 0.00 H ATOM 1904 HG3 LYS B 17 25.955 27.511 15.279 1.00 0.00 H ATOM 1905 HD2 LYS B 17 25.533 29.001 17.235 1.00 0.00 H ATOM 1906 HD3 LYS B 17 26.308 27.792 18.285 1.00 0.00 H ATOM 1907 HE2 LYS B 17 27.781 29.110 16.000 1.00 0.00 H ATOM 1908 HE3 LYS B 17 28.447 28.239 17.401 1.00 0.00 H ATOM 1909 HZ1 LYS B 17 26.899 30.759 17.496 1.00 0.00 H ATOM 1910 HZ2 LYS B 17 27.535 29.928 18.834 1.00 0.00 H ATOM 1911 HZ3 LYS B 17 28.581 30.616 17.685 1.00 0.00 H ATOM 1912 H LYS B 17 24.688 24.049 16.786 1.00 0.00 H ATOM 1913 N ARG B 18 22.025 26.552 18.787 1.00 34.75 N ATOM 1914 CA ARG B 18 20.577 26.457 18.959 1.00 35.62 C ATOM 1915 C ARG B 18 19.904 26.512 17.590 1.00 33.61 C ATOM 1916 O ARG B 18 20.407 27.213 16.700 1.00 33.94 O ATOM 1917 CB ARG B 18 20.110 27.616 19.844 1.00 42.95 C ATOM 1918 CG ARG B 18 18.639 28.042 19.699 1.00 53.31 C ATOM 1919 CD ARG B 18 17.692 27.598 20.794 1.00 63.61 C ATOM 1920 NE ARG B 18 17.905 28.396 21.986 1.00 74.49 N ATOM 1921 CZ ARG B 18 17.121 28.336 23.072 1.00 81.12 C ATOM 1922 NH1 ARG B 18 16.036 27.553 23.170 1.00 84.14 N ATOM 1923 NH2 ARG B 18 17.441 29.126 24.096 1.00 84.28 N ATOM 1924 HA ARG B 18 20.308 25.516 19.438 1.00 0.00 H ATOM 1925 HB2 ARG B 18 20.270 27.325 20.882 1.00 0.00 H ATOM 1926 HB3 ARG B 18 20.730 28.482 19.611 1.00 0.00 H ATOM 1927 HG2 ARG B 18 18.612 29.131 19.660 1.00 0.00 H ATOM 1928 HG3 ARG B 18 18.269 27.637 18.757 1.00 0.00 H ATOM 1929 HD2 ARG B 18 17.873 26.548 21.025 1.00 0.00 H ATOM 1930 HD3 ARG B 18 16.664 27.722 20.455 1.00 0.00 H ATOM 1931 HE ARG B 18 18.712 29.052 21.999 1.00 0.00 H ATOM 1932 HH12 ARG B 18 15.471 27.555 24.043 1.00 0.00 H ATOM 1933 HH11 ARG B 18 15.760 26.944 22.373 1.00 0.00 H ATOM 1934 HH22 ARG B 18 16.864 29.116 24.961 1.00 0.00 H ATOM 1935 HH21 ARG B 18 18.268 29.753 24.030 1.00 0.00 H ATOM 1936 H ARG B 18 22.515 27.378 19.186 1.00 0.00 H ATOM 1937 N GLY B 19 18.804 25.779 17.386 1.00 30.33 N ATOM 1938 CA GLY B 19 18.175 25.752 16.082 1.00 27.08 C ATOM 1939 C GLY B 19 18.799 24.706 15.172 1.00 27.61 C ATOM 1940 O GLY B 19 18.208 24.376 14.143 1.00 31.60 O ATOM 1941 HA3 GLY B 19 18.283 26.732 15.618 1.00 0.00 H ATOM 1942 HA2 GLY B 19 17.116 25.525 16.206 1.00 0.00 H ATOM 1943 H GLY B 19 18.398 25.226 18.168 1.00 0.00 H ATOM 1944 N GLN B 20 19.956 24.116 15.469 1.00 24.87 N ATOM 1945 CA GLN B 20 20.510 23.045 14.658 1.00 22.83 C ATOM 1946 C GLN B 20 19.974 21.677 15.069 1.00 21.20 C ATOM 1947 O GLN B 20 19.646 21.461 16.240 1.00 21.89 O ATOM 1948 CB GLN B 20 22.002 22.949 14.789 1.00 21.72 C ATOM 1949 CG GLN B 20 22.734 24.104 14.163 1.00 27.63 C ATOM 1950 CD GLN B 20 24.205 23.761 13.974 1.00 29.12 C ATOM 1951 OE1 GLN B 20 24.963 23.755 14.937 1.00 28.39 O ATOM 1952 NE2 GLN B 20 24.693 23.383 12.798 1.00 32.38 N ATOM 1953 HA GLN B 20 20.218 23.294 13.638 1.00 0.00 H ATOM 1954 HB2 GLN B 20 22.254 22.914 15.849 1.00 0.00 H ATOM 1955 HB3 GLN B 20 22.333 22.029 14.307 1.00 0.00 H ATOM 1956 HG2 GLN B 20 22.290 24.328 13.193 1.00 0.00 H ATOM 1957 HG3 GLN B 20 22.649 24.977 14.810 1.00 0.00 H ATOM 1958 HE22 GLN B 20 24.079 23.375 11.958 1.00 0.00 H ATOM 1959 HE21 GLN B 20 25.689 23.095 12.717 1.00 0.00 H ATOM 1960 H GLN B 20 20.480 24.433 16.310 1.00 0.00 H ATOM 1961 N THR B 21 19.864 20.734 14.142 1.00 22.25 N ATOM 1962 CA THR B 21 19.448 19.375 14.426 1.00 23.35 C ATOM 1963 C THR B 21 20.657 18.503 14.739 1.00 22.41 C ATOM 1964 O THR B 21 21.534 18.283 13.907 1.00 23.90 O ATOM 1965 CB THR B 21 18.678 18.833 13.210 1.00 25.76 C ATOM 1966 OG1 THR B 21 17.531 19.669 13.052 1.00 26.63 O ATOM 1967 CG2 THR B 21 18.233 17.392 13.377 1.00 24.83 C ATOM 1968 HA THR B 21 18.798 19.361 15.301 1.00 0.00 H ATOM 1969 HB THR B 21 19.334 18.846 12.340 1.00 0.00 H ATOM 1970 HG1 THR B 21 17.823 20.603 12.899 1.00 0.00 H ATOM 1971 HG23 THR B 21 19.109 16.754 13.498 1.00 0.00 H ATOM 1972 HG21 THR B 21 17.597 17.309 14.259 1.00 0.00 H ATOM 1973 HG22 THR B 21 17.674 17.081 12.494 1.00 0.00 H ATOM 1974 H THR B 21 20.089 20.984 13.158 1.00 0.00 H ATOM 1975 N CYS B 22 20.742 18.011 15.952 1.00 18.98 N ATOM 1976 CA CYS B 22 21.800 17.113 16.335 1.00 18.91 C ATOM 1977 C CYS B 22 21.338 15.690 16.063 1.00 17.20 C ATOM 1978 O CYS B 22 20.201 15.335 16.393 1.00 18.08 O ATOM 1979 CB CYS B 22 22.099 17.295 17.814 1.00 17.60 C ATOM 1980 SG CYS B 22 22.685 18.944 18.292 1.00 26.02 S ATOM 1981 HA CYS B 22 22.707 17.320 15.766 1.00 0.00 H ATOM 1982 HB2 CYS B 22 22.865 16.571 18.094 1.00 0.00 H ATOM 1983 HB3 CYS B 22 21.185 17.088 18.370 1.00 0.00 H ATOM 1984 HG CYS B 22 22.917 18.972 19.652 1.00 0.00 H ATOM 1985 H CYS B 22 20.025 18.277 16.657 1.00 0.00 H ATOM 1986 N VAL B 23 22.181 14.864 15.459 1.00 13.01 N ATOM 1987 CA VAL B 23 21.858 13.469 15.202 1.00 12.33 C ATOM 1988 C VAL B 23 22.868 12.710 16.057 1.00 12.30 C ATOM 1989 O VAL B 23 24.083 12.848 15.851 1.00 11.78 O ATOM 1990 CB VAL B 23 22.053 13.120 13.719 1.00 12.94 C ATOM 1991 CG1 VAL B 23 21.664 11.655 13.522 1.00 13.59 C ATOM 1992 CG2 VAL B 23 21.242 14.059 12.817 1.00 10.27 C ATOM 1993 HA VAL B 23 20.821 13.229 15.436 1.00 0.00 H ATOM 1994 HB VAL B 23 23.096 13.256 13.434 1.00 0.00 H ATOM 1995 HG11 VAL B 23 22.300 11.025 14.144 1.00 0.00 H ATOM 1996 HG12 VAL B 23 20.621 11.516 13.808 1.00 0.00 H ATOM 1997 HG13 VAL B 23 21.794 11.383 12.474 1.00 0.00 H ATOM 1998 HG21 VAL B 23 20.183 13.969 13.060 1.00 0.00 H ATOM 1999 HG22 VAL B 23 21.567 15.087 12.979 1.00 0.00 H ATOM 2000 HG23 VAL B 23 21.401 13.786 11.774 1.00 0.00 H ATOM 2001 H VAL B 23 23.108 15.227 15.158 1.00 0.00 H ATOM 2002 N VAL B 24 22.404 11.942 17.040 1.00 10.47 N ATOM 2003 CA VAL B 24 23.268 11.228 17.968 1.00 12.69 C ATOM 2004 C VAL B 24 22.907 9.747 18.026 1.00 15.05 C ATOM 2005 O VAL B 24 21.786 9.359 17.649 1.00 14.21 O ATOM 2006 CB VAL B 24 23.152 11.802 19.421 1.00 10.03 C ATOM 2007 CG1 VAL B 24 23.337 13.323 19.400 1.00 13.42 C ATOM 2008 CG2 VAL B 24 21.790 11.486 20.041 1.00 9.80 C ATOM 2009 HA VAL B 24 24.286 11.356 17.599 1.00 0.00 H ATOM 2010 HB VAL B 24 23.931 11.332 20.021 1.00 0.00 H ATOM 2011 HG11 VAL B 24 24.321 13.563 18.997 1.00 0.00 H ATOM 2012 HG12 VAL B 24 22.567 13.773 18.774 1.00 0.00 H ATOM 2013 HG13 VAL B 24 23.255 13.712 20.415 1.00 0.00 H ATOM 2014 HG21 VAL B 24 21.003 11.929 19.431 1.00 0.00 H ATOM 2015 HG22 VAL B 24 21.654 10.405 20.084 1.00 0.00 H ATOM 2016 HG23 VAL B 24 21.746 11.900 21.049 1.00 0.00 H ATOM 2017 H VAL B 24 21.374 11.848 17.150 1.00 0.00 H ATOM 2018 N HIS B 25 23.814 8.901 18.510 1.00 13.16 N ATOM 2019 CA HIS B 25 23.461 7.538 18.890 1.00 11.53 C ATOM 2020 C HIS B 25 23.736 7.551 20.391 1.00 13.14 C ATOM 2021 O HIS B 25 24.720 8.160 20.832 1.00 16.01 O ATOM 2022 CB HIS B 25 24.351 6.480 18.207 1.00 11.76 C ATOM 2023 CG HIS B 25 23.623 5.670 17.116 1.00 13.70 C ATOM 2024 ND1 HIS B 25 22.388 5.210 17.294 1.00 14.47 N ATOM 2025 CD2 HIS B 25 24.124 5.283 15.898 1.00 15.46 C ATOM 2026 CE1 HIS B 25 22.104 4.534 16.191 1.00 12.90 C ATOM 2027 NE2 HIS B 25 23.135 4.580 15.380 1.00 15.01 N ATOM 2028 HA HIS B 25 22.442 7.276 18.604 1.00 0.00 H ATOM 2029 HB2 HIS B 25 25.201 6.987 17.750 1.00 0.00 H ATOM 2030 HB3 HIS B 25 24.710 5.788 18.969 1.00 0.00 H ATOM 2031 HD2 HIS B 25 25.100 5.503 15.465 1.00 0.00 H ATOM 2032 HE1 HIS B 25 21.164 4.021 15.989 1.00 0.00 H ATOM 2033 H HIS B 25 24.798 9.220 18.620 1.00 0.00 H ATOM 2034 N TYR B 26 22.928 6.965 21.260 1.00 12.29 N ATOM 2035 CA TYR B 26 23.173 7.008 22.697 1.00 11.75 C ATOM 2036 C TYR B 26 22.885 5.644 23.308 1.00 11.99 C ATOM 2037 O TYR B 26 22.093 4.863 22.749 1.00 15.06 O ATOM 2038 CB TYR B 26 22.260 8.079 23.376 1.00 8.19 C ATOM 2039 CG TYR B 26 20.747 7.768 23.399 1.00 12.29 C ATOM 2040 CD1 TYR B 26 20.164 7.020 24.437 1.00 12.61 C ATOM 2041 CD2 TYR B 26 19.927 8.219 22.369 1.00 9.50 C ATOM 2042 CE1 TYR B 26 18.809 6.700 24.430 1.00 9.27 C ATOM 2043 CE2 TYR B 26 18.573 7.906 22.352 1.00 7.80 C ATOM 2044 CZ TYR B 26 18.034 7.139 23.369 1.00 8.93 C ATOM 2045 OH TYR B 26 16.700 6.809 23.311 1.00 12.18 O ATOM 2046 HA TYR B 26 24.217 7.274 22.863 1.00 0.00 H ATOM 2047 HB3 TYR B 26 22.399 9.020 22.844 1.00 0.00 H ATOM 2048 HB2 TYR B 26 22.592 8.194 24.408 1.00 0.00 H ATOM 2049 HD2 TYR B 26 20.351 8.824 21.567 1.00 0.00 H ATOM 2050 HE2 TYR B 26 17.939 8.263 21.541 1.00 0.00 H ATOM 2051 HE1 TYR B 26 18.369 6.118 25.240 1.00 0.00 H ATOM 2052 HD1 TYR B 26 20.787 6.683 25.266 1.00 0.00 H ATOM 2053 HH TYR B 26 16.462 6.262 24.101 1.00 0.00 H ATOM 2054 H TYR B 26 22.092 6.458 20.907 1.00 0.00 H ATOM 2055 N THR B 27 23.501 5.351 24.445 1.00 9.15 N ATOM 2056 CA THR B 27 23.118 4.219 25.255 1.00 10.21 C ATOM 2057 C THR B 27 22.961 4.819 26.656 1.00 12.83 C ATOM 2058 O THR B 27 23.827 5.577 27.098 1.00 15.51 O ATOM 2059 CB THR B 27 24.197 3.141 25.245 1.00 7.99 C ATOM 2060 OG1 THR B 27 24.263 2.654 23.921 1.00 12.08 O ATOM 2061 CG2 THR B 27 23.892 1.996 26.192 1.00 14.81 C ATOM 2062 HA THR B 27 22.213 3.731 24.894 1.00 0.00 H ATOM 2063 HB THR B 27 25.141 3.571 25.581 1.00 0.00 H ATOM 2064 HG1 THR B 27 23.384 2.278 23.665 1.00 0.00 H ATOM 2065 HG23 THR B 27 23.842 2.374 27.213 1.00 0.00 H ATOM 2066 HG21 THR B 27 22.936 1.547 25.922 1.00 0.00 H ATOM 2067 HG22 THR B 27 24.680 1.246 26.119 1.00 0.00 H ATOM 2068 H THR B 27 24.285 5.956 24.763 1.00 0.00 H ATOM 2069 N GLY B 28 21.861 4.564 27.359 1.00 12.47 N ATOM 2070 CA GLY B 28 21.609 5.112 28.661 1.00 10.87 C ATOM 2071 C GLY B 28 21.727 3.982 29.660 1.00 13.61 C ATOM 2072 O GLY B 28 21.223 2.866 29.448 1.00 11.69 O ATOM 2073 HA3 GLY B 28 20.607 5.539 28.698 1.00 0.00 H ATOM 2074 HA2 GLY B 28 22.341 5.887 28.887 1.00 0.00 H ATOM 2075 H GLY B 28 21.146 3.934 26.943 1.00 0.00 H ATOM 2076 N MET B 29 22.382 4.280 30.776 1.00 12.00 N ATOM 2077 CA MET B 29 22.611 3.332 31.832 1.00 15.21 C ATOM 2078 C MET B 29 22.320 4.017 33.140 1.00 16.29 C ATOM 2079 O MET B 29 22.433 5.232 33.288 1.00 18.16 O ATOM 2080 CB MET B 29 24.054 2.874 31.884 1.00 17.04 C ATOM 2081 CG MET B 29 24.392 1.926 30.766 1.00 21.70 C ATOM 2082 SD MET B 29 26.147 1.964 30.328 1.00 24.48 S ATOM 2083 CE MET B 29 26.146 3.356 29.240 1.00 17.13 C ATOM 2084 HA MET B 29 21.972 2.467 31.652 1.00 0.00 H ATOM 2085 HB2 MET B 29 24.702 3.747 31.812 1.00 0.00 H ATOM 2086 HB3 MET B 29 24.229 2.371 32.835 1.00 0.00 H ATOM 2087 HG2 MET B 29 23.807 2.199 29.888 1.00 0.00 H ATOM 2088 HG3 MET B 29 24.131 0.914 31.075 1.00 0.00 H ATOM 2089 HE1 MET B 29 25.480 3.159 28.400 1.00 0.00 H ATOM 2090 HE2 MET B 29 25.801 4.238 29.780 1.00 0.00 H ATOM 2091 HE3 MET B 29 27.157 3.528 28.871 1.00 0.00 H ATOM 2092 H MET B 29 22.747 5.247 30.892 1.00 0.00 H ATOM 2093 N LEU B 30 21.852 3.271 34.108 1.00 17.21 N ATOM 2094 CA LEU B 30 21.702 3.808 35.434 1.00 20.96 C ATOM 2095 C LEU B 30 23.100 3.752 36.060 1.00 25.74 C ATOM 2096 O LEU B 30 23.915 2.927 35.639 1.00 20.85 O ATOM 2097 CB LEU B 30 20.703 2.922 36.150 1.00 21.09 C ATOM 2098 CG LEU B 30 19.200 3.188 36.304 1.00 23.00 C ATOM 2099 CD1 LEU B 30 18.732 4.367 35.503 1.00 22.13 C ATOM 2100 CD2 LEU B 30 18.480 1.915 35.917 1.00 21.75 C ATOM 2101 HA LEU B 30 21.334 4.833 35.476 1.00 0.00 H ATOM 2102 HB2 LEU B 30 20.771 1.955 35.651 1.00 0.00 H ATOM 2103 HB3 LEU B 30 21.082 2.831 37.168 1.00 0.00 H ATOM 2104 HG LEU B 30 18.977 3.454 37.337 1.00 0.00 H ATOM 2105 HD21 LEU B 30 18.722 1.662 34.885 1.00 0.00 H ATOM 2106 HD22 LEU B 30 18.797 1.106 36.575 1.00 0.00 H ATOM 2107 HD23 LEU B 30 17.405 2.064 36.013 1.00 0.00 H ATOM 2108 HD11 LEU B 30 19.264 5.261 35.830 1.00 0.00 H ATOM 2109 HD12 LEU B 30 18.932 4.189 34.446 1.00 0.00 H ATOM 2110 HD13 LEU B 30 17.661 4.505 35.653 1.00 0.00 H ATOM 2111 H LEU B 30 21.587 2.284 33.917 1.00 0.00 H ATOM 2112 N GLU B 31 23.440 4.602 37.042 1.00 35.04 N ATOM 2113 CA GLU B 31 24.727 4.573 37.766 1.00 42.34 C ATOM 2114 C GLU B 31 25.155 3.173 38.174 1.00 44.30 C ATOM 2115 O GLU B 31 26.330 2.858 38.114 1.00 45.75 O ATOM 2116 CB GLU B 31 24.657 5.412 39.035 1.00 47.67 C ATOM 2117 CG GLU B 31 25.948 5.649 39.835 1.00 58.91 C ATOM 2118 CD GLU B 31 26.780 6.879 39.461 1.00 64.79 C ATOM 2119 OE1 GLU B 31 27.167 7.029 38.293 1.00 66.17 O ATOM 2120 OE2 GLU B 31 27.045 7.691 40.359 1.00 70.58 O ATOM 2121 HA GLU B 31 25.457 4.976 37.064 1.00 0.00 H ATOM 2122 HB2 GLU B 31 24.270 6.391 38.752 1.00 0.00 H ATOM 2123 HB3 GLU B 31 23.949 4.923 39.705 1.00 0.00 H ATOM 2124 HG2 GLU B 31 25.672 5.745 40.885 1.00 0.00 H ATOM 2125 HG3 GLU B 31 26.581 4.771 39.706 1.00 0.00 H ATOM 2126 H GLU B 31 22.749 5.331 37.312 1.00 0.00 H ATOM 2127 N ASP B 32 24.235 2.308 38.587 1.00 49.92 N ATOM 2128 CA ASP B 32 24.560 0.911 38.883 1.00 57.03 C ATOM 2129 C ASP B 32 25.038 0.079 37.673 1.00 59.25 C ATOM 2130 O ASP B 32 25.603 -1.004 37.858 1.00 63.58 O ATOM 2131 CB ASP B 32 23.333 0.187 39.516 1.00 61.83 C ATOM 2132 CG ASP B 32 22.118 -0.153 38.635 1.00 68.00 C ATOM 2133 OD1 ASP B 32 21.981 0.375 37.531 1.00 71.42 O ATOM 2134 OD2 ASP B 32 21.285 -0.959 39.059 1.00 70.91 O ATOM 2135 HA ASP B 32 25.398 0.970 39.577 1.00 0.00 H ATOM 2136 HB2 ASP B 32 23.698 -0.753 39.930 1.00 0.00 H ATOM 2137 HB3 ASP B 32 22.971 0.823 40.324 1.00 0.00 H ATOM 2138 H ASP B 32 23.254 2.633 38.704 1.00 0.00 H ATOM 2139 N GLY B 33 24.743 0.488 36.429 1.00 56.78 N ATOM 2140 CA GLY B 33 25.217 -0.198 35.240 1.00 51.30 C ATOM 2141 C GLY B 33 24.096 -0.871 34.465 1.00 48.43 C ATOM 2142 O GLY B 33 24.374 -1.431 33.401 1.00 52.60 O ATOM 2143 HA3 GLY B 33 25.939 -0.958 35.540 1.00 0.00 H ATOM 2144 HA2 GLY B 33 25.704 0.528 34.589 1.00 0.00 H ATOM 2145 H GLY B 33 24.149 1.333 36.311 1.00 0.00 H ATOM 2146 N LYS B 34 22.831 -0.879 34.925 1.00 41.64 N ATOM 2147 CA LYS B 34 21.720 -1.467 34.174 1.00 35.76 C ATOM 2148 C LYS B 34 21.393 -0.534 33.014 1.00 28.12 C ATOM 2149 O LYS B 34 21.116 0.649 33.225 1.00 23.61 O ATOM 2150 CB LYS B 34 20.490 -1.624 35.078 1.00 42.20 C ATOM 2151 CG LYS B 34 19.220 -2.218 34.422 1.00 52.02 C ATOM 2152 CD LYS B 34 18.035 -1.218 34.346 1.00 58.31 C ATOM 2153 CE LYS B 34 16.829 -1.686 33.502 1.00 60.86 C ATOM 2154 NZ LYS B 34 15.825 -0.636 33.332 1.00 64.99 N ATOM 2155 HA LYS B 34 21.999 -2.454 33.805 1.00 0.00 H ATOM 2156 HB2 LYS B 34 20.769 -2.274 35.907 1.00 0.00 H ATOM 2157 HB3 LYS B 34 20.233 -0.637 35.462 1.00 0.00 H ATOM 2158 HG2 LYS B 34 19.470 -2.534 33.409 1.00 0.00 H ATOM 2159 HG3 LYS B 34 18.904 -3.084 35.004 1.00 0.00 H ATOM 2160 HD2 LYS B 34 17.684 -1.033 35.361 1.00 0.00 H ATOM 2161 HD3 LYS B 34 18.406 -0.288 33.916 1.00 0.00 H ATOM 2162 HE2 LYS B 34 16.364 -2.538 33.998 1.00 0.00 H ATOM 2163 HE3 LYS B 34 17.187 -1.991 32.519 1.00 0.00 H ATOM 2164 HZ1 LYS B 34 15.470 -0.343 34.265 1.00 0.00 H ATOM 2165 HZ2 LYS B 34 16.256 0.180 32.852 1.00 0.00 H ATOM 2166 HZ3 LYS B 34 15.037 -1.001 32.759 1.00 0.00 H ATOM 2167 H LYS B 34 22.635 -0.450 35.852 1.00 0.00 H ATOM 2168 N LYS B 35 21.491 -1.034 31.789 1.00 23.90 N ATOM 2169 CA LYS B 35 21.171 -0.279 30.594 1.00 22.20 C ATOM 2170 C LYS B 35 19.687 -0.206 30.516 1.00 20.19 C ATOM 2171 O LYS B 35 19.047 -1.244 30.649 1.00 23.69 O ATOM 2172 CB LYS B 35 21.689 -0.985 29.379 1.00 24.10 C ATOM 2173 CG LYS B 35 21.220 -0.566 27.998 1.00 25.26 C ATOM 2174 CD LYS B 35 22.134 -1.414 27.145 1.00 28.92 C ATOM 2175 CE LYS B 35 21.454 -1.886 25.907 1.00 31.06 C ATOM 2176 NZ LYS B 35 22.321 -2.796 25.179 1.00 37.65 N ATOM 2177 HA LYS B 35 21.623 0.712 30.635 1.00 0.00 H ATOM 2178 HB2 LYS B 35 22.773 -0.875 29.390 1.00 0.00 H ATOM 2179 HB3 LYS B 35 21.431 -2.038 29.493 1.00 0.00 H ATOM 2180 HG2 LYS B 35 20.170 -0.811 27.835 1.00 0.00 H ATOM 2181 HG3 LYS B 35 21.375 0.499 27.823 1.00 0.00 H ATOM 2182 HD2 LYS B 35 23.006 -0.822 26.866 1.00 0.00 H ATOM 2183 HD3 LYS B 35 22.455 -2.280 27.724 1.00 0.00 H ATOM 2184 HE2 LYS B 35 21.218 -1.029 25.276 1.00 0.00 H ATOM 2185 HE3 LYS B 35 20.533 -2.403 26.176 1.00 0.00 H ATOM 2186 HZ1 LYS B 35 23.200 -2.303 24.920 1.00 0.00 H ATOM 2187 HZ2 LYS B 35 22.545 -3.615 25.780 1.00 0.00 H ATOM 2188 HZ3 LYS B 35 21.837 -3.119 24.317 1.00 0.00 H ATOM 2189 H LYS B 35 21.814 -2.017 31.681 1.00 0.00 H ATOM 2190 N PHE B 36 19.153 0.987 30.346 1.00 17.36 N ATOM 2191 CA PHE B 36 17.718 1.078 30.244 1.00 17.11 C ATOM 2192 C PHE B 36 17.265 1.442 28.824 1.00 14.49 C ATOM 2193 O PHE B 36 16.078 1.325 28.530 1.00 16.90 O ATOM 2194 CB PHE B 36 17.194 2.118 31.265 1.00 12.96 C ATOM 2195 CG PHE B 36 17.774 3.513 31.121 1.00 11.19 C ATOM 2196 CD1 PHE B 36 17.240 4.412 30.192 1.00 10.80 C ATOM 2197 CD2 PHE B 36 18.843 3.886 31.925 1.00 9.65 C ATOM 2198 CE1 PHE B 36 17.792 5.681 30.060 1.00 7.74 C ATOM 2199 CE2 PHE B 36 19.379 5.165 31.783 1.00 12.90 C ATOM 2200 CZ PHE B 36 18.861 6.064 30.860 1.00 10.08 C ATOM 2201 HA PHE B 36 17.299 0.098 30.471 1.00 0.00 H ATOM 2202 HB2 PHE B 36 16.112 2.189 31.150 1.00 0.00 H ATOM 2203 HB3 PHE B 36 17.429 1.756 32.266 1.00 0.00 H ATOM 2204 HD2 PHE B 36 19.256 3.190 32.655 1.00 0.00 H ATOM 2205 HE2 PHE B 36 20.220 5.465 32.408 1.00 0.00 H ATOM 2206 HZ PHE B 36 19.290 7.062 30.764 1.00 0.00 H ATOM 2207 HE1 PHE B 36 17.385 6.377 29.327 1.00 0.00 H ATOM 2208 HD1 PHE B 36 16.393 4.118 29.573 1.00 0.00 H ATOM 2209 H PHE B 36 19.749 1.837 30.287 1.00 0.00 H ATOM 2210 N ASP B 37 18.141 1.913 27.936 1.00 13.61 N ATOM 2211 CA ASP B 37 17.723 2.343 26.604 1.00 13.42 C ATOM 2212 C ASP B 37 18.923 2.488 25.695 1.00 12.71 C ATOM 2213 O ASP B 37 20.020 2.828 26.158 1.00 12.77 O ATOM 2214 CB ASP B 37 17.036 3.723 26.629 1.00 15.32 C ATOM 2215 CG ASP B 37 16.217 4.130 25.408 1.00 12.96 C ATOM 2216 OD1 ASP B 37 16.012 3.306 24.527 1.00 14.91 O ATOM 2217 OD2 ASP B 37 15.758 5.265 25.352 1.00 14.66 O ATOM 2218 HA ASP B 37 17.030 1.581 26.246 1.00 0.00 H ATOM 2219 HB2 ASP B 37 16.367 3.738 27.490 1.00 0.00 H ATOM 2220 HB3 ASP B 37 17.816 4.473 26.763 1.00 0.00 H ATOM 2221 H ASP B 37 19.146 1.976 28.198 1.00 0.00 H ATOM 2222 N SER B 38 18.723 2.283 24.407 1.00 10.93 N ATOM 2223 CA SER B 38 19.790 2.524 23.468 1.00 11.67 C ATOM 2224 C SER B 38 19.225 2.733 22.084 1.00 10.48 C ATOM 2225 O SER B 38 18.419 1.902 21.638 1.00 11.71 O ATOM 2226 CB SER B 38 20.730 1.348 23.428 1.00 13.05 C ATOM 2227 OG SER B 38 21.731 1.544 22.448 1.00 16.84 O ATOM 2228 HA SER B 38 20.330 3.415 23.789 1.00 0.00 H ATOM 2229 HB2 SER B 38 20.166 0.446 23.189 1.00 0.00 H ATOM 2230 HB3 SER B 38 21.201 1.232 24.404 1.00 0.00 H ATOM 2231 HG SER B 38 22.338 0.762 22.437 1.00 0.00 H ATOM 2232 H SER B 38 17.798 1.948 24.070 1.00 0.00 H ATOM 2233 N SER B 39 19.627 3.800 21.387 1.00 8.64 N ATOM 2234 CA SER B 39 19.205 4.009 20.015 1.00 6.84 C ATOM 2235 C SER B 39 20.005 3.093 19.105 1.00 10.03 C ATOM 2236 O SER B 39 19.574 2.728 18.005 1.00 9.73 O ATOM 2237 CB SER B 39 19.441 5.448 19.606 1.00 7.44 C ATOM 2238 OG SER B 39 20.834 5.742 19.632 1.00 7.10 O ATOM 2239 HA SER B 39 18.141 3.787 19.931 1.00 0.00 H ATOM 2240 HB2 SER B 39 18.920 6.110 20.298 1.00 0.00 H ATOM 2241 HB3 SER B 39 19.058 5.604 18.597 1.00 0.00 H ATOM 2242 HG SER B 39 21.308 5.143 19.003 1.00 0.00 H ATOM 2243 H SER B 39 20.256 4.495 21.838 1.00 0.00 H ATOM 2244 N ARG B 40 21.185 2.676 19.575 1.00 10.94 N ATOM 2245 CA ARG B 40 22.065 1.806 18.826 1.00 12.57 C ATOM 2246 C ARG B 40 21.338 0.464 18.703 1.00 15.40 C ATOM 2247 O ARG B 40 21.290 -0.110 17.607 1.00 15.14 O ATOM 2248 CB ARG B 40 23.399 1.647 19.553 1.00 13.38 C ATOM 2249 CG ARG B 40 24.198 2.934 19.646 1.00 14.44 C ATOM 2250 CD ARG B 40 25.663 2.749 20.035 1.00 17.18 C ATOM 2251 NE ARG B 40 26.408 3.998 20.157 1.00 17.57 N ATOM 2252 CZ ARG B 40 26.685 4.562 21.336 1.00 16.01 C ATOM 2253 NH1 ARG B 40 26.371 3.976 22.482 1.00 15.41 N ATOM 2254 NH2 ARG B 40 27.306 5.736 21.363 1.00 10.20 N ATOM 2255 HA ARG B 40 22.291 2.215 17.841 1.00 0.00 H ATOM 2256 HB2 ARG B 40 23.200 1.291 20.564 1.00 0.00 H ATOM 2257 HB3 ARG B 40 23.997 0.908 19.019 1.00 0.00 H ATOM 2258 HG2 ARG B 40 24.164 3.426 18.674 1.00 0.00 H ATOM 2259 HG3 ARG B 40 23.726 3.574 20.392 1.00 0.00 H ATOM 2260 HD2 ARG B 40 26.145 2.135 19.274 1.00 0.00 H ATOM 2261 HD3 ARG B 40 25.700 2.232 20.994 1.00 0.00 H ATOM 2262 HE ARG B 40 26.737 4.469 19.290 1.00 0.00 H ATOM 2263 HH12 ARG B 40 26.600 4.441 23.384 1.00 0.00 H ATOM 2264 HH11 ARG B 40 25.895 3.051 22.480 1.00 0.00 H ATOM 2265 HH22 ARG B 40 27.528 6.186 22.274 1.00 0.00 H ATOM 2266 HH21 ARG B 40 27.571 6.205 20.473 1.00 0.00 H ATOM 2267 H ARG B 40 21.483 2.991 20.520 1.00 0.00 H ATOM 2268 N ASP B 41 20.647 -0.019 19.741 1.00 15.75 N ATOM 2269 CA ASP B 41 19.858 -1.231 19.637 1.00 14.48 C ATOM 2270 C ASP B 41 18.695 -1.189 18.650 1.00 16.39 C ATOM 2271 O ASP B 41 18.254 -2.235 18.176 1.00 16.10 O ATOM 2272 CB ASP B 41 19.291 -1.585 20.974 1.00 14.69 C ATOM 2273 CG ASP B 41 20.319 -2.092 21.975 1.00 19.65 C ATOM 2274 OD1 ASP B 41 21.472 -2.388 21.639 1.00 21.90 O ATOM 2275 OD2 ASP B 41 19.941 -2.199 23.125 1.00 24.66 O ATOM 2276 HA ASP B 41 20.564 -1.971 19.260 1.00 0.00 H ATOM 2277 HB2 ASP B 41 18.818 -0.696 21.391 1.00 0.00 H ATOM 2278 HB3 ASP B 41 18.540 -2.362 20.832 1.00 0.00 H ATOM 2279 H ASP B 41 20.676 0.489 20.648 1.00 0.00 H ATOM 2280 N ARG B 42 18.151 -0.013 18.338 1.00 12.87 N ATOM 2281 CA ARG B 42 17.049 0.070 17.401 1.00 11.62 C ATOM 2282 C ARG B 42 17.541 0.295 15.982 1.00 12.30 C ATOM 2283 O ARG B 42 16.748 0.279 15.050 1.00 13.15 O ATOM 2284 CB ARG B 42 16.102 1.210 17.808 1.00 7.26 C ATOM 2285 CG ARG B 42 15.350 0.867 19.091 1.00 8.76 C ATOM 2286 CD ARG B 42 14.283 1.914 19.332 1.00 11.63 C ATOM 2287 NE ARG B 42 14.899 3.215 19.590 1.00 14.40 N ATOM 2288 CZ ARG B 42 15.271 3.604 20.825 1.00 14.59 C ATOM 2289 NH1 ARG B 42 15.097 2.807 21.865 1.00 6.87 N ATOM 2290 NH2 ARG B 42 15.834 4.802 21.027 1.00 11.65 N ATOM 2291 HA ARG B 42 16.515 -0.880 17.427 1.00 0.00 H ATOM 2292 HB2 ARG B 42 16.685 2.117 17.968 1.00 0.00 H ATOM 2293 HB3 ARG B 42 15.382 1.378 17.007 1.00 0.00 H ATOM 2294 HG2 ARG B 42 14.884 -0.113 18.991 1.00 0.00 H ATOM 2295 HG3 ARG B 42 16.045 0.854 19.930 1.00 0.00 H ATOM 2296 HD2 ARG B 42 13.681 1.623 20.193 1.00 0.00 H ATOM 2297 HD3 ARG B 42 13.644 1.986 18.452 1.00 0.00 H ATOM 2298 HE ARG B 42 15.055 3.863 18.792 1.00 0.00 H ATOM 2299 HH12 ARG B 42 15.388 3.119 22.813 1.00 0.00 H ATOM 2300 HH11 ARG B 42 14.669 1.868 21.735 1.00 0.00 H ATOM 2301 HH22 ARG B 42 16.116 5.089 21.986 1.00 0.00 H ATOM 2302 HH21 ARG B 42 15.989 5.446 20.225 1.00 0.00 H ATOM 2303 H ARG B 42 18.522 0.856 18.773 1.00 0.00 H ATOM 2304 N ASN B 43 18.854 0.487 15.816 1.00 12.35 N ATOM 2305 CA ASN B 43 19.486 0.845 14.569 1.00 12.48 C ATOM 2306 C ASN B 43 18.938 2.162 14.071 1.00 14.25 C ATOM 2307 O ASN B 43 18.754 2.347 12.868 1.00 18.47 O ATOM 2308 CB ASN B 43 19.273 -0.205 13.484 1.00 12.00 C ATOM 2309 CG ASN B 43 19.945 -1.530 13.760 1.00 14.24 C ATOM 2310 OD1 ASN B 43 19.642 -2.584 13.191 1.00 18.60 O ATOM 2311 ND2 ASN B 43 20.928 -1.581 14.628 1.00 13.86 N ATOM 2312 HA ASN B 43 20.555 0.919 14.770 1.00 0.00 H ATOM 2313 HB2 ASN B 43 18.202 -0.380 13.383 1.00 0.00 H ATOM 2314 HB3 ASN B 43 19.665 0.188 12.546 1.00 0.00 H ATOM 2315 HD22 ASN B 43 21.221 -0.720 15.133 1.00 0.00 H ATOM 2316 HD21 ASN B 43 21.414 -2.482 14.811 1.00 0.00 H ATOM 2317 H ASN B 43 19.466 0.369 16.649 1.00 0.00 H ATOM 2318 N LYS B 44 18.701 3.136 14.948 1.00 13.01 N ATOM 2319 CA LYS B 44 18.166 4.412 14.502 1.00 13.60 C ATOM 2320 C LYS B 44 18.654 5.543 15.386 1.00 14.82 C ATOM 2321 O LYS B 44 18.316 5.575 16.566 1.00 15.84 O ATOM 2322 CB LYS B 44 16.639 4.405 14.525 1.00 10.96 C ATOM 2323 CG LYS B 44 16.065 5.685 13.963 1.00 12.28 C ATOM 2324 CD LYS B 44 14.594 5.653 14.240 1.00 19.70 C ATOM 2325 CE LYS B 44 13.981 7.008 13.946 1.00 27.26 C ATOM 2326 NZ LYS B 44 12.559 6.773 13.752 1.00 37.85 N ATOM 2327 HA LYS B 44 18.516 4.566 13.481 1.00 0.00 H ATOM 2328 HB2 LYS B 44 16.280 3.565 13.929 1.00 0.00 H ATOM 2329 HB3 LYS B 44 16.302 4.289 15.555 1.00 0.00 H ATOM 2330 HG2 LYS B 44 16.521 6.547 14.450 1.00 0.00 H ATOM 2331 HG3 LYS B 44 16.245 5.738 12.889 1.00 0.00 H ATOM 2332 HD2 LYS B 44 14.124 4.899 13.608 1.00 0.00 H ATOM 2333 HD3 LYS B 44 14.429 5.402 15.288 1.00 0.00 H ATOM 2334 HE2 LYS B 44 14.421 7.435 13.045 1.00 0.00 H ATOM 2335 HE3 LYS B 44 14.142 7.686 14.784 1.00 0.00 H ATOM 2336 HZ1 LYS B 44 12.423 6.118 12.956 1.00 0.00 H ATOM 2337 HZ2 LYS B 44 12.156 6.358 14.616 1.00 0.00 H ATOM 2338 HZ3 LYS B 44 12.085 7.675 13.546 1.00 0.00 H ATOM 2339 H LYS B 44 18.900 2.983 15.957 1.00 0.00 H ATOM 2340 N PRO B 45 19.442 6.486 14.876 1.00 17.40 N ATOM 2341 CA PRO B 45 19.875 7.706 15.570 1.00 15.95 C ATOM 2342 C PRO B 45 18.738 8.561 16.067 1.00 16.61 C ATOM 2343 O PRO B 45 17.685 8.678 15.431 1.00 15.55 O ATOM 2344 CB PRO B 45 20.701 8.466 14.577 1.00 14.20 C ATOM 2345 CG PRO B 45 21.168 7.384 13.636 1.00 16.92 C ATOM 2346 CD PRO B 45 19.954 6.484 13.506 1.00 16.20 C ATOM 2347 HA PRO B 45 20.430 7.434 16.468 1.00 0.00 H ATOM 2348 HD3 PRO B 45 19.225 6.896 12.808 1.00 0.00 H ATOM 2349 HD2 PRO B 45 20.234 5.480 13.187 1.00 0.00 H ATOM 2350 HG3 PRO B 45 22.014 6.840 14.056 1.00 0.00 H ATOM 2351 HG2 PRO B 45 21.450 7.802 12.669 1.00 0.00 H ATOM 2352 HB2 PRO B 45 20.101 9.210 14.054 1.00 0.00 H ATOM 2353 HB3 PRO B 45 21.545 8.957 15.061 1.00 0.00 H ATOM 2354 N PHE B 46 18.965 9.220 17.192 1.00 15.90 N ATOM 2355 CA PHE B 46 18.002 10.129 17.752 1.00 15.13 C ATOM 2356 C PHE B 46 18.360 11.496 17.165 1.00 15.02 C ATOM 2357 O PHE B 46 19.507 11.921 17.199 1.00 14.69 O ATOM 2358 CB PHE B 46 18.111 10.095 19.290 1.00 13.37 C ATOM 2359 CG PHE B 46 17.268 11.145 20.010 1.00 16.30 C ATOM 2360 CD1 PHE B 46 15.908 11.313 19.723 1.00 18.12 C ATOM 2361 CD2 PHE B 46 17.891 11.999 20.937 1.00 18.44 C ATOM 2362 CE1 PHE B 46 15.182 12.328 20.349 1.00 15.80 C ATOM 2363 CE2 PHE B 46 17.156 13.008 21.557 1.00 17.32 C ATOM 2364 CZ PHE B 46 15.809 13.173 21.261 1.00 16.24 C ATOM 2365 HA PHE B 46 16.969 9.875 17.514 1.00 0.00 H ATOM 2366 HB2 PHE B 46 17.793 9.110 19.632 1.00 0.00 H ATOM 2367 HB3 PHE B 46 19.155 10.253 19.561 1.00 0.00 H ATOM 2368 HD2 PHE B 46 18.948 11.872 21.171 1.00 0.00 H ATOM 2369 HE2 PHE B 46 17.640 13.669 22.276 1.00 0.00 H ATOM 2370 HZ PHE B 46 15.240 13.967 21.745 1.00 0.00 H ATOM 2371 HE1 PHE B 46 14.124 12.459 20.124 1.00 0.00 H ATOM 2372 HD1 PHE B 46 15.416 10.651 19.011 1.00 0.00 H ATOM 2373 H PHE B 46 19.868 9.076 17.687 1.00 0.00 H ATOM 2374 N LYS B 47 17.401 12.192 16.558 1.00 14.35 N ATOM 2375 CA LYS B 47 17.612 13.513 15.984 1.00 14.75 C ATOM 2376 C LYS B 47 16.816 14.507 16.799 1.00 14.09 C ATOM 2377 O LYS B 47 15.622 14.265 17.034 1.00 18.96 O ATOM 2378 CB LYS B 47 17.095 13.647 14.568 1.00 14.63 C ATOM 2379 CG LYS B 47 17.634 12.660 13.596 1.00 16.84 C ATOM 2380 CD LYS B 47 17.196 13.214 12.248 1.00 25.31 C ATOM 2381 CE LYS B 47 17.810 12.456 11.082 1.00 28.48 C ATOM 2382 NZ LYS B 47 17.603 13.197 9.844 1.00 35.26 N ATOM 2383 HA LYS B 47 18.688 13.685 15.986 1.00 0.00 H ATOM 2384 HB2 LYS B 47 16.011 13.536 14.594 1.00 0.00 H ATOM 2385 HB3 LYS B 47 17.349 14.645 14.210 1.00 0.00 H ATOM 2386 HG2 LYS B 47 18.721 12.603 13.660 1.00 0.00 H ATOM 2387 HG3 LYS B 47 17.209 11.671 13.768 1.00 0.00 H ATOM 2388 HD2 LYS B 47 16.110 13.146 12.177 1.00 0.00 H ATOM 2389 HD3 LYS B 47 17.498 14.259 12.184 1.00 0.00 H ATOM 2390 HE2 LYS B 47 17.340 11.476 11.000 1.00 0.00 H ATOM 2391 HE3 LYS B 47 18.879 12.331 11.254 1.00 0.00 H ATOM 2392 HZ1 LYS B 47 16.583 13.315 9.678 1.00 0.00 H ATOM 2393 HZ2 LYS B 47 18.053 14.131 9.921 1.00 0.00 H ATOM 2394 HZ3 LYS B 47 18.026 12.672 9.052 1.00 0.00 H ATOM 2395 H LYS B 47 16.453 11.770 16.490 1.00 0.00 H ATOM 2396 N PHE B 48 17.359 15.619 17.241 1.00 14.18 N ATOM 2397 CA PHE B 48 16.564 16.579 17.971 1.00 16.56 C ATOM 2398 C PHE B 48 17.125 17.940 17.647 1.00 18.45 C ATOM 2399 O PHE B 48 18.290 18.065 17.258 1.00 18.24 O ATOM 2400 CB PHE B 48 16.626 16.336 19.490 1.00 16.50 C ATOM 2401 CG PHE B 48 17.997 16.526 20.119 1.00 18.00 C ATOM 2402 CD1 PHE B 48 18.982 15.538 19.948 1.00 20.38 C ATOM 2403 CD2 PHE B 48 18.262 17.682 20.863 1.00 16.48 C ATOM 2404 CE1 PHE B 48 20.233 15.714 20.519 1.00 17.17 C ATOM 2405 CE2 PHE B 48 19.513 17.852 21.436 1.00 17.04 C ATOM 2406 CZ PHE B 48 20.496 16.872 21.263 1.00 20.07 C ATOM 2407 HA PHE B 48 15.517 16.491 17.681 1.00 0.00 H ATOM 2408 HB2 PHE B 48 15.935 17.028 19.971 1.00 0.00 H ATOM 2409 HB3 PHE B 48 16.305 15.312 19.682 1.00 0.00 H ATOM 2410 HD2 PHE B 48 17.491 18.442 20.991 1.00 0.00 H ATOM 2411 HE2 PHE B 48 19.730 18.747 22.020 1.00 0.00 H ATOM 2412 HZ PHE B 48 21.479 17.011 21.713 1.00 0.00 H ATOM 2413 HE1 PHE B 48 21.007 14.957 20.390 1.00 0.00 H ATOM 2414 HD1 PHE B 48 18.764 14.640 19.370 1.00 0.00 H ATOM 2415 H PHE B 48 18.366 15.809 17.064 1.00 0.00 H ATOM 2416 N MET B 49 16.324 18.969 17.826 1.00 19.27 N ATOM 2417 CA MET B 49 16.716 20.338 17.572 1.00 22.95 C ATOM 2418 C MET B 49 17.159 20.894 18.913 1.00 22.76 C ATOM 2419 O MET B 49 16.373 20.912 19.879 1.00 21.81 O ATOM 2420 CB MET B 49 15.514 21.085 17.039 1.00 26.09 C ATOM 2421 CG MET B 49 15.826 22.399 16.361 1.00 34.52 C ATOM 2422 SD MET B 49 14.586 22.731 15.079 1.00 41.30 S ATOM 2423 CE MET B 49 14.877 21.306 14.070 1.00 28.55 C ATOM 2424 HA MET B 49 17.518 20.427 16.840 1.00 0.00 H ATOM 2425 HB2 MET B 49 15.010 20.443 16.317 1.00 0.00 H ATOM 2426 HB3 MET B 49 14.843 21.286 17.874 1.00 0.00 H ATOM 2427 HG2 MET B 49 16.815 22.347 15.905 1.00 0.00 H ATOM 2428 HG3 MET B 49 15.809 23.201 17.099 1.00 0.00 H ATOM 2429 HE1 MET B 49 15.909 21.315 13.720 1.00 0.00 H ATOM 2430 HE2 MET B 49 14.698 20.405 14.656 1.00 0.00 H ATOM 2431 HE3 MET B 49 14.202 21.324 13.214 1.00 0.00 H ATOM 2432 H MET B 49 15.359 18.788 18.168 1.00 0.00 H ATOM 2433 N LEU B 50 18.399 21.364 18.980 1.00 23.25 N ATOM 2434 CA LEU B 50 18.939 21.844 20.231 1.00 22.70 C ATOM 2435 C LEU B 50 18.238 23.140 20.581 1.00 23.38 C ATOM 2436 O LEU B 50 18.188 24.052 19.760 1.00 27.53 O ATOM 2437 CB LEU B 50 20.428 22.070 20.076 1.00 22.73 C ATOM 2438 CG LEU B 50 21.151 22.428 21.376 1.00 22.26 C ATOM 2439 CD1 LEU B 50 21.007 21.260 22.367 1.00 23.58 C ATOM 2440 CD2 LEU B 50 22.612 22.747 21.085 1.00 18.68 C ATOM 2441 HA LEU B 50 18.780 21.117 21.028 1.00 0.00 H ATOM 2442 HB2 LEU B 50 20.872 21.157 19.679 1.00 0.00 H ATOM 2443 HB3 LEU B 50 20.578 22.884 19.367 1.00 0.00 H ATOM 2444 HG LEU B 50 20.706 23.316 21.825 1.00 0.00 H ATOM 2445 HD21 LEU B 50 23.090 21.877 20.635 1.00 0.00 H ATOM 2446 HD22 LEU B 50 22.668 23.591 20.397 1.00 0.00 H ATOM 2447 HD23 LEU B 50 23.119 23.001 22.016 1.00 0.00 H ATOM 2448 HD11 LEU B 50 19.950 21.085 22.569 1.00 0.00 H ATOM 2449 HD12 LEU B 50 21.449 20.362 21.935 1.00 0.00 H ATOM 2450 HD13 LEU B 50 21.520 21.508 23.296 1.00 0.00 H ATOM 2451 H LEU B 50 18.988 21.387 18.123 1.00 0.00 H ATOM 2452 N GLY B 51 17.645 23.247 21.754 1.00 23.43 N ATOM 2453 CA GLY B 51 16.949 24.443 22.169 1.00 24.62 C ATOM 2454 C GLY B 51 15.445 24.295 22.027 1.00 26.91 C ATOM 2455 O GLY B 51 14.661 24.711 22.890 1.00 31.05 O ATOM 2456 HA3 GLY B 51 17.282 25.278 21.552 1.00 0.00 H ATOM 2457 HA2 GLY B 51 17.187 24.646 23.213 1.00 0.00 H ATOM 2458 H GLY B 51 17.680 22.438 22.407 1.00 0.00 H ATOM 2459 N LYS B 52 15.003 23.695 20.935 1.00 28.78 N ATOM 2460 CA LYS B 52 13.597 23.419 20.764 1.00 27.46 C ATOM 2461 C LYS B 52 13.101 22.152 21.435 1.00 26.27 C ATOM 2462 O LYS B 52 11.990 22.144 21.961 1.00 24.34 O ATOM 2463 CB LYS B 52 13.265 23.327 19.294 1.00 29.48 C ATOM 2464 CG LYS B 52 11.867 23.827 19.058 1.00 36.97 C ATOM 2465 CD LYS B 52 12.009 24.636 17.813 1.00 43.32 C ATOM 2466 CE LYS B 52 11.811 23.788 16.594 1.00 48.28 C ATOM 2467 NZ LYS B 52 12.222 24.575 15.460 1.00 50.46 N ATOM 2468 HA LYS B 52 13.092 24.252 21.252 1.00 0.00 H ATOM 2469 HB2 LYS B 52 13.968 23.935 18.725 1.00 0.00 H ATOM 2470 HB3 LYS B 52 13.338 22.289 18.970 1.00 0.00 H ATOM 2471 HG2 LYS B 52 11.173 22.999 18.911 1.00 0.00 H ATOM 2472 HG3 LYS B 52 11.525 24.443 19.890 1.00 0.00 H ATOM 2473 HD2 LYS B 52 11.264 25.432 17.818 1.00 0.00 H ATOM 2474 HD3 LYS B 52 13.007 25.074 17.784 1.00 0.00 H ATOM 2475 HE2 LYS B 52 10.761 23.511 16.497 1.00 0.00 H ATOM 2476 HE3 LYS B 52 12.418 22.886 16.663 1.00 0.00 H ATOM 2477 HZ1 LYS B 52 11.640 25.435 15.407 1.00 0.00 H ATOM 2478 HZ2 LYS B 52 13.223 24.838 15.566 1.00 0.00 H ATOM 2479 HZ3 LYS B 52 12.099 24.018 14.590 1.00 0.00 H ATOM 2480 H LYS B 52 15.676 23.419 20.191 1.00 0.00 H ATOM 2481 N GLN B 53 13.851 21.055 21.390 1.00 24.40 N ATOM 2482 CA GLN B 53 13.382 19.810 21.959 1.00 22.14 C ATOM 2483 C GLN B 53 13.493 19.850 23.482 1.00 24.44 C ATOM 2484 O GLN B 53 14.519 20.274 24.024 1.00 26.41 O ATOM 2485 CB GLN B 53 14.214 18.691 21.382 1.00 20.10 C ATOM 2486 CG GLN B 53 13.796 17.290 21.780 1.00 17.98 C ATOM 2487 CD GLN B 53 12.601 16.757 21.019 1.00 22.20 C ATOM 2488 OE1 GLN B 53 12.443 17.026 19.833 1.00 23.55 O ATOM 2489 NE2 GLN B 53 11.714 15.971 21.607 1.00 21.72 N ATOM 2490 HA GLN B 53 12.332 19.649 21.714 1.00 0.00 H ATOM 2491 HB2 GLN B 53 14.162 18.760 20.295 1.00 0.00 H ATOM 2492 HB3 GLN B 53 15.244 18.838 21.705 1.00 0.00 H ATOM 2493 HG2 GLN B 53 14.638 16.620 21.607 1.00 0.00 H ATOM 2494 HG3 GLN B 53 13.550 17.295 22.842 1.00 0.00 H ATOM 2495 HE22 GLN B 53 11.822 15.726 22.612 1.00 0.00 H ATOM 2496 HE21 GLN B 53 10.909 15.599 21.064 1.00 0.00 H ATOM 2497 H GLN B 53 14.788 21.092 20.940 1.00 0.00 H ATOM 2498 N GLU B 54 12.455 19.402 24.185 1.00 24.59 N ATOM 2499 CA GLU B 54 12.485 19.359 25.628 1.00 26.85 C ATOM 2500 C GLU B 54 13.287 18.182 26.123 1.00 23.67 C ATOM 2501 O GLU B 54 12.858 17.038 25.986 1.00 18.31 O ATOM 2502 CB GLU B 54 11.099 19.246 26.165 1.00 37.15 C ATOM 2503 CG GLU B 54 10.757 20.588 26.772 1.00 55.67 C ATOM 2504 CD GLU B 54 9.984 20.419 28.067 1.00 66.00 C ATOM 2505 OE1 GLU B 54 10.543 19.860 29.021 1.00 72.24 O ATOM 2506 OE2 GLU B 54 8.822 20.841 28.107 1.00 72.06 O ATOM 2507 HA GLU B 54 12.952 20.281 25.975 1.00 0.00 H ATOM 2508 HB2 GLU B 54 10.402 19.009 25.361 1.00 0.00 H ATOM 2509 HB3 GLU B 54 11.053 18.467 26.926 1.00 0.00 H ATOM 2510 HG2 GLU B 54 11.679 21.133 26.976 1.00 0.00 H ATOM 2511 HG3 GLU B 54 10.150 21.155 26.066 1.00 0.00 H ATOM 2512 H GLU B 54 11.604 19.076 23.684 1.00 0.00 H ATOM 2513 N VAL B 55 14.480 18.389 26.640 1.00 21.93 N ATOM 2514 CA VAL B 55 15.285 17.273 27.103 1.00 20.66 C ATOM 2515 C VAL B 55 15.713 17.580 28.527 1.00 21.48 C ATOM 2516 O VAL B 55 15.587 18.711 29.015 1.00 24.63 O ATOM 2517 CB VAL B 55 16.565 17.020 26.207 1.00 21.72 C ATOM 2518 CG1 VAL B 55 16.125 16.605 24.812 1.00 16.12 C ATOM 2519 CG2 VAL B 55 17.459 18.258 26.127 1.00 19.35 C ATOM 2520 HA VAL B 55 14.685 16.365 27.044 1.00 0.00 H ATOM 2521 HB VAL B 55 17.151 16.225 26.668 1.00 0.00 H ATOM 2522 HG11 VAL B 55 15.536 15.690 24.875 1.00 0.00 H ATOM 2523 HG12 VAL B 55 15.521 17.398 24.372 1.00 0.00 H ATOM 2524 HG13 VAL B 55 17.004 16.430 24.192 1.00 0.00 H ATOM 2525 HG21 VAL B 55 16.896 19.084 25.693 1.00 0.00 H ATOM 2526 HG22 VAL B 55 17.791 18.530 27.129 1.00 0.00 H ATOM 2527 HG23 VAL B 55 18.325 18.039 25.502 1.00 0.00 H ATOM 2528 H VAL B 55 14.848 19.359 26.717 1.00 0.00 H ATOM 2529 N ILE B 56 16.143 16.564 29.257 1.00 18.20 N ATOM 2530 CA ILE B 56 16.680 16.790 30.581 1.00 16.60 C ATOM 2531 C ILE B 56 17.897 17.738 30.461 1.00 17.23 C ATOM 2532 O ILE B 56 18.679 17.721 29.496 1.00 11.27 O ATOM 2533 CB ILE B 56 17.052 15.425 31.203 1.00 12.45 C ATOM 2534 CG1 ILE B 56 18.006 14.617 30.355 1.00 10.91 C ATOM 2535 CG2 ILE B 56 15.754 14.687 31.408 1.00 11.59 C ATOM 2536 CD1 ILE B 56 18.529 13.329 30.974 1.00 10.48 C ATOM 2537 HA ILE B 56 15.951 17.265 31.237 1.00 0.00 H ATOM 2538 HB ILE B 56 17.585 15.585 32.140 1.00 0.00 H ATOM 2539 HG12 ILE B 56 17.491 14.357 29.430 1.00 0.00 H ATOM 2540 HG13 ILE B 56 18.864 15.249 30.126 1.00 0.00 H ATOM 2541 HD11 ILE B 56 19.066 13.561 31.894 1.00 0.00 H ATOM 2542 HD12 ILE B 56 17.691 12.669 31.198 1.00 0.00 H ATOM 2543 HD13 ILE B 56 19.203 12.838 30.272 1.00 0.00 H ATOM 2544 HG21 ILE B 56 15.113 15.261 32.077 1.00 0.00 H ATOM 2545 HG22 ILE B 56 15.256 14.557 30.447 1.00 0.00 H ATOM 2546 HG23 ILE B 56 15.958 13.711 31.847 1.00 0.00 H ATOM 2547 H ILE B 56 16.095 15.597 28.877 1.00 0.00 H ATOM 2548 N ARG B 57 18.054 18.585 31.470 1.00 21.18 N ATOM 2549 CA ARG B 57 19.069 19.624 31.532 1.00 22.68 C ATOM 2550 C ARG B 57 20.470 19.126 31.283 1.00 20.78 C ATOM 2551 O ARG B 57 21.203 19.757 30.517 1.00 22.52 O ATOM 2552 CB ARG B 57 19.041 20.279 32.886 1.00 29.06 C ATOM 2553 CG ARG B 57 19.844 21.550 32.904 1.00 38.26 C ATOM 2554 CD ARG B 57 19.779 22.173 34.290 1.00 44.76 C ATOM 2555 NE ARG B 57 20.584 23.378 34.263 1.00 50.09 N ATOM 2556 CZ ARG B 57 20.970 24.021 35.362 1.00 54.18 C ATOM 2557 NH1 ARG B 57 20.639 23.611 36.590 1.00 55.35 N ATOM 2558 NH2 ARG B 57 21.784 25.065 35.216 1.00 58.78 N ATOM 2559 HA ARG B 57 18.824 20.326 30.735 1.00 0.00 H ATOM 2560 HB2 ARG B 57 18.008 20.509 33.146 1.00 0.00 H ATOM 2561 HB3 ARG B 57 19.454 19.589 33.622 1.00 0.00 H ATOM 2562 HG2 ARG B 57 20.881 21.328 32.654 1.00 0.00 H ATOM 2563 HG3 ARG B 57 19.436 22.248 32.172 1.00 0.00 H ATOM 2564 HD2 ARG B 57 20.174 21.477 35.030 1.00 0.00 H ATOM 2565 HD3 ARG B 57 18.747 22.420 34.540 1.00 0.00 H ATOM 2566 HE ARG B 57 20.874 23.759 33.340 1.00 0.00 H ATOM 2567 HH12 ARG B 57 20.963 24.145 37.422 1.00 0.00 H ATOM 2568 HH11 ARG B 57 20.057 22.758 36.714 1.00 0.00 H ATOM 2569 HH22 ARG B 57 22.107 25.593 36.052 1.00 0.00 H ATOM 2570 HH21 ARG B 57 22.096 25.352 34.266 1.00 0.00 H ATOM 2571 H ARG B 57 17.403 18.499 32.276 1.00 0.00 H ATOM 2572 N GLY B 58 20.836 17.985 31.880 1.00 18.62 N ATOM 2573 CA GLY B 58 22.152 17.417 31.687 1.00 16.22 C ATOM 2574 C GLY B 58 22.454 17.093 30.232 1.00 16.86 C ATOM 2575 O GLY B 58 23.589 17.216 29.754 1.00 17.62 O ATOM 2576 HA3 GLY B 58 22.223 16.498 32.269 1.00 0.00 H ATOM 2577 HA2 GLY B 58 22.894 18.130 32.045 1.00 0.00 H ATOM 2578 H GLY B 58 20.158 17.495 32.498 1.00 0.00 H ATOM 2579 N TRP B 59 21.442 16.711 29.463 1.00 18.68 N ATOM 2580 CA TRP B 59 21.668 16.317 28.080 1.00 17.14 C ATOM 2581 C TRP B 59 21.916 17.542 27.243 1.00 16.94 C ATOM 2582 O TRP B 59 22.834 17.569 26.426 1.00 17.16 O ATOM 2583 CB TRP B 59 20.448 15.555 27.571 1.00 16.20 C ATOM 2584 CG TRP B 59 20.535 15.063 26.147 1.00 13.55 C ATOM 2585 CD1 TRP B 59 20.122 15.846 25.096 1.00 15.63 C ATOM 2586 CD2 TRP B 59 21.010 13.849 25.757 1.00 12.92 C ATOM 2587 NE1 TRP B 59 20.310 15.107 24.039 1.00 15.92 N ATOM 2588 CE2 TRP B 59 20.841 13.923 24.366 1.00 13.37 C ATOM 2589 CE3 TRP B 59 21.509 12.705 26.361 1.00 12.41 C ATOM 2590 CZ2 TRP B 59 21.163 12.859 23.532 1.00 14.19 C ATOM 2591 CZ3 TRP B 59 21.862 11.645 25.524 1.00 15.33 C ATOM 2592 CH2 TRP B 59 21.688 11.715 24.132 1.00 15.09 C ATOM 2593 HA TRP B 59 22.542 15.669 28.014 1.00 0.00 H ATOM 2594 HB2 TRP B 59 20.299 14.690 28.217 1.00 0.00 H ATOM 2595 HB3 TRP B 59 19.584 16.216 27.646 1.00 0.00 H ATOM 2596 HE1 TRP B 59 20.078 15.399 23.068 1.00 0.00 H ATOM 2597 HD1 TRP B 59 19.725 16.860 25.137 1.00 0.00 H ATOM 2598 HZ2 TRP B 59 21.012 12.916 22.454 1.00 0.00 H ATOM 2599 HH2 TRP B 59 21.967 10.863 23.512 1.00 0.00 H ATOM 2600 HZ3 TRP B 59 22.283 10.740 25.962 1.00 0.00 H ATOM 2601 HE3 TRP B 59 21.621 12.636 27.443 1.00 0.00 H ATOM 2602 H TRP B 59 20.478 16.693 29.852 1.00 0.00 H ATOM 2603 N GLU B 60 21.116 18.566 27.486 1.00 17.39 N ATOM 2604 CA GLU B 60 21.255 19.811 26.776 1.00 20.93 C ATOM 2605 C GLU B 60 22.640 20.413 27.051 1.00 20.93 C ATOM 2606 O GLU B 60 23.392 20.712 26.122 1.00 20.91 O ATOM 2607 CB GLU B 60 20.153 20.708 27.238 1.00 24.52 C ATOM 2608 CG GLU B 60 19.758 21.553 26.053 1.00 38.34 C ATOM 2609 CD GLU B 60 18.459 22.295 26.274 1.00 43.95 C ATOM 2610 OE1 GLU B 60 18.513 23.407 26.786 1.00 51.88 O ATOM 2611 OE2 GLU B 60 17.398 21.763 25.952 1.00 51.91 O ATOM 2612 HA GLU B 60 21.180 19.670 25.698 1.00 0.00 H ATOM 2613 HB2 GLU B 60 19.303 20.116 27.578 1.00 0.00 H ATOM 2614 HB3 GLU B 60 20.501 21.342 28.053 1.00 0.00 H ATOM 2615 HG2 GLU B 60 20.548 22.280 25.864 1.00 0.00 H ATOM 2616 HG3 GLU B 60 19.647 20.905 25.184 1.00 0.00 H ATOM 2617 H GLU B 60 20.371 18.470 28.205 1.00 0.00 H ATOM 2618 N GLU B 61 23.056 20.515 28.307 1.00 19.62 N ATOM 2619 CA GLU B 61 24.365 21.043 28.622 1.00 23.00 C ATOM 2620 C GLU B 61 25.526 20.199 28.155 1.00 23.05 C ATOM 2621 O GLU B 61 26.564 20.729 27.728 1.00 26.26 O ATOM 2622 CB GLU B 61 24.493 21.234 30.109 1.00 29.40 C ATOM 2623 CG GLU B 61 23.694 22.492 30.467 1.00 39.58 C ATOM 2624 CD GLU B 61 23.898 23.096 31.851 1.00 44.45 C ATOM 2625 OE1 GLU B 61 24.952 22.882 32.476 1.00 48.03 O ATOM 2626 OE2 GLU B 61 22.976 23.802 32.279 1.00 44.23 O ATOM 2627 HA GLU B 61 24.425 21.985 28.077 1.00 0.00 H ATOM 2628 HB2 GLU B 61 24.087 20.370 30.635 1.00 0.00 H ATOM 2629 HB3 GLU B 61 25.540 21.365 30.382 1.00 0.00 H ATOM 2630 HG2 GLU B 61 23.951 23.259 29.737 1.00 0.00 H ATOM 2631 HG3 GLU B 61 22.637 22.243 30.374 1.00 0.00 H ATOM 2632 H GLU B 61 22.429 20.210 29.079 1.00 0.00 H ATOM 2633 N GLY B 62 25.381 18.884 28.253 1.00 22.29 N ATOM 2634 CA GLY B 62 26.431 17.959 27.865 1.00 17.27 C ATOM 2635 C GLY B 62 26.643 17.958 26.367 1.00 17.80 C ATOM 2636 O GLY B 62 27.761 18.196 25.946 1.00 16.03 O ATOM 2637 HA3 GLY B 62 26.154 16.954 28.185 1.00 0.00 H ATOM 2638 HA2 GLY B 62 27.360 18.252 28.354 1.00 0.00 H ATOM 2639 H GLY B 62 24.486 18.503 28.620 1.00 0.00 H ATOM 2640 N VAL B 63 25.619 17.791 25.525 1.00 18.41 N ATOM 2641 CA VAL B 63 25.763 17.737 24.066 1.00 17.43 C ATOM 2642 C VAL B 63 26.252 19.049 23.478 1.00 16.20 C ATOM 2643 O VAL B 63 26.982 19.082 22.486 1.00 15.13 O ATOM 2644 CB VAL B 63 24.393 17.308 23.470 1.00 17.69 C ATOM 2645 CG1 VAL B 63 24.381 17.270 21.947 1.00 14.51 C ATOM 2646 CG2 VAL B 63 24.121 15.884 23.936 1.00 15.84 C ATOM 2647 HA VAL B 63 26.530 17.008 23.805 1.00 0.00 H ATOM 2648 HB VAL B 63 23.653 18.037 23.800 1.00 0.00 H ATOM 2649 HG11 VAL B 63 24.612 18.262 21.558 1.00 0.00 H ATOM 2650 HG12 VAL B 63 25.128 16.558 21.597 1.00 0.00 H ATOM 2651 HG13 VAL B 63 23.394 16.963 21.600 1.00 0.00 H ATOM 2652 HG21 VAL B 63 24.916 15.228 23.580 1.00 0.00 H ATOM 2653 HG22 VAL B 63 24.089 15.859 25.025 1.00 0.00 H ATOM 2654 HG23 VAL B 63 23.164 15.548 23.536 1.00 0.00 H ATOM 2655 H VAL B 63 24.665 17.694 25.927 1.00 0.00 H ATOM 2656 N ALA B 64 25.890 20.151 24.130 1.00 19.70 N ATOM 2657 CA ALA B 64 26.347 21.472 23.742 1.00 21.52 C ATOM 2658 C ALA B 64 27.858 21.661 23.748 1.00 24.41 C ATOM 2659 O ALA B 64 28.392 22.479 23.000 1.00 27.39 O ATOM 2660 CB ALA B 64 25.801 22.515 24.661 1.00 21.02 C ATOM 2661 HA ALA B 64 25.987 21.574 22.718 1.00 0.00 H ATOM 2662 HB1 ALA B 64 24.712 22.495 24.625 1.00 0.00 H ATOM 2663 HB2 ALA B 64 26.136 22.312 25.678 1.00 0.00 H ATOM 2664 HB3 ALA B 64 26.159 23.496 24.348 1.00 0.00 H ATOM 2665 H ALA B 64 25.255 20.062 24.949 1.00 0.00 H ATOM 2666 N GLN B 65 28.556 20.910 24.591 1.00 23.27 N ATOM 2667 CA GLN B 65 30.012 20.952 24.683 1.00 25.03 C ATOM 2668 C GLN B 65 30.683 19.905 23.796 1.00 24.77 C ATOM 2669 O GLN B 65 31.900 19.696 23.889 1.00 26.58 O ATOM 2670 CB GLN B 65 30.484 20.658 26.088 1.00 26.43 C ATOM 2671 CG GLN B 65 30.032 21.560 27.203 1.00 30.91 C ATOM 2672 CD GLN B 65 30.314 20.871 28.520 1.00 32.87 C ATOM 2673 OE1 GLN B 65 31.448 20.489 28.815 1.00 38.65 O ATOM 2674 NE2 GLN B 65 29.329 20.650 29.372 1.00 29.97 N ATOM 2675 HA GLN B 65 30.284 21.959 24.366 1.00 0.00 H ATOM 2676 HB2 GLN B 65 30.151 19.650 26.335 1.00 0.00 H ATOM 2677 HB3 GLN B 65 31.574 20.686 26.074 1.00 0.00 H ATOM 2678 HG2 GLN B 65 30.576 22.503 27.157 1.00 0.00 H ATOM 2679 HG3 GLN B 65 28.963 21.753 27.110 1.00 0.00 H ATOM 2680 HE22 GLN B 65 28.364 20.964 29.144 1.00 0.00 H ATOM 2681 HE21 GLN B 65 29.519 20.162 30.271 1.00 0.00 H ATOM 2682 H GLN B 65 28.040 20.259 25.217 1.00 0.00 H ATOM 2683 N MET B 66 29.968 19.154 22.970 1.00 20.85 N ATOM 2684 CA MET B 66 30.600 18.109 22.204 1.00 17.44 C ATOM 2685 C MET B 66 30.854 18.613 20.811 1.00 15.19 C ATOM 2686 O MET B 66 30.101 19.460 20.353 1.00 18.85 O ATOM 2687 CB MET B 66 29.688 16.896 22.197 1.00 16.07 C ATOM 2688 CG MET B 66 29.711 16.061 23.485 1.00 14.80 C ATOM 2689 SD MET B 66 28.447 14.760 23.502 1.00 20.29 S ATOM 2690 CE MET B 66 29.201 13.633 22.372 1.00 12.48 C ATOM 2691 HA MET B 66 31.556 17.823 22.643 1.00 0.00 H ATOM 2692 HB2 MET B 66 28.667 17.241 22.035 1.00 0.00 H ATOM 2693 HB3 MET B 66 29.988 16.252 21.370 1.00 0.00 H ATOM 2694 HG2 MET B 66 29.540 16.724 24.333 1.00 0.00 H ATOM 2695 HG3 MET B 66 30.692 15.595 23.581 1.00 0.00 H ATOM 2696 HE1 MET B 66 29.333 14.122 21.407 1.00 0.00 H ATOM 2697 HE2 MET B 66 30.172 13.325 22.761 1.00 0.00 H ATOM 2698 HE3 MET B 66 28.562 12.758 22.253 1.00 0.00 H ATOM 2699 H MET B 66 28.946 19.320 22.874 1.00 0.00 H ATOM 2700 N SER B 67 31.908 18.209 20.120 1.00 12.30 N ATOM 2701 CA SER B 67 32.027 18.628 18.750 1.00 14.93 C ATOM 2702 C SER B 67 31.651 17.440 17.881 1.00 17.34 C ATOM 2703 O SER B 67 31.588 16.298 18.368 1.00 18.31 O ATOM 2704 CB SER B 67 33.445 19.084 18.462 1.00 16.08 C ATOM 2705 OG SER B 67 34.465 18.178 18.869 1.00 17.12 O ATOM 2706 HA SER B 67 31.368 19.471 18.542 1.00 0.00 H ATOM 2707 HB2 SER B 67 33.607 20.030 18.979 1.00 0.00 H ATOM 2708 HB3 SER B 67 33.539 19.238 17.387 1.00 0.00 H ATOM 2709 HG SER B 67 34.407 18.035 19.847 1.00 0.00 H ATOM 2710 H SER B 67 32.632 17.604 20.557 1.00 0.00 H ATOM 2711 N VAL B 68 31.376 17.670 16.597 1.00 15.77 N ATOM 2712 CA VAL B 68 30.991 16.595 15.700 1.00 18.51 C ATOM 2713 C VAL B 68 32.016 15.468 15.625 1.00 19.61 C ATOM 2714 O VAL B 68 33.224 15.711 15.502 1.00 22.06 O ATOM 2715 CB VAL B 68 30.722 17.219 14.308 1.00 21.60 C ATOM 2716 CG1 VAL B 68 30.302 16.164 13.291 1.00 19.92 C ATOM 2717 CG2 VAL B 68 29.558 18.187 14.431 1.00 20.25 C ATOM 2718 HA VAL B 68 30.091 16.119 16.089 1.00 0.00 H ATOM 2719 HB VAL B 68 31.641 17.703 13.977 1.00 0.00 H ATOM 2720 HG11 VAL B 68 31.095 15.423 13.189 1.00 0.00 H ATOM 2721 HG12 VAL B 68 29.389 15.676 13.632 1.00 0.00 H ATOM 2722 HG13 VAL B 68 30.122 16.641 12.328 1.00 0.00 H ATOM 2723 HG21 VAL B 68 28.675 17.649 14.775 1.00 0.00 H ATOM 2724 HG22 VAL B 68 29.811 18.969 15.147 1.00 0.00 H ATOM 2725 HG23 VAL B 68 29.356 18.635 13.458 1.00 0.00 H ATOM 2726 H VAL B 68 31.439 18.641 16.230 1.00 0.00 H ATOM 2727 N GLY B 69 31.521 14.240 15.769 1.00 16.47 N ATOM 2728 CA GLY B 69 32.311 13.032 15.715 1.00 15.13 C ATOM 2729 C GLY B 69 32.703 12.555 17.102 1.00 14.31 C ATOM 2730 O GLY B 69 33.227 11.448 17.264 1.00 17.23 O ATOM 2731 HA3 GLY B 69 33.216 13.227 15.139 1.00 0.00 H ATOM 2732 HA2 GLY B 69 31.730 12.251 15.224 1.00 0.00 H ATOM 2733 H GLY B 69 30.498 14.145 15.931 1.00 0.00 H ATOM 2734 N GLN B 70 32.489 13.349 18.137 1.00 15.67 N ATOM 2735 CA GLN B 70 32.931 12.983 19.465 1.00 14.54 C ATOM 2736 C GLN B 70 32.018 11.953 20.071 1.00 15.84 C ATOM 2737 O GLN B 70 30.806 11.993 19.862 1.00 16.59 O ATOM 2738 CB GLN B 70 32.951 14.221 20.332 1.00 15.99 C ATOM 2739 CG GLN B 70 33.439 14.023 21.753 1.00 16.67 C ATOM 2740 CD GLN B 70 33.625 15.336 22.467 1.00 19.36 C ATOM 2741 OE1 GLN B 70 33.449 16.420 21.902 1.00 26.73 O ATOM 2742 NE2 GLN B 70 34.005 15.312 23.732 1.00 17.99 N ATOM 2743 HA GLN B 70 33.930 12.553 19.400 1.00 0.00 H ATOM 2744 HB2 GLN B 70 33.601 14.954 19.854 1.00 0.00 H ATOM 2745 HB3 GLN B 70 31.935 14.614 20.379 1.00 0.00 H ATOM 2746 HG2 GLN B 70 32.708 13.425 22.298 1.00 0.00 H ATOM 2747 HG3 GLN B 70 34.393 13.496 21.729 1.00 0.00 H ATOM 2748 HE22 GLN B 70 34.155 14.402 24.213 1.00 0.00 H ATOM 2749 HE21 GLN B 70 34.154 16.203 24.247 1.00 0.00 H ATOM 2750 H GLN B 70 31.994 14.253 17.994 1.00 0.00 H ATOM 2751 N ARG B 71 32.595 11.044 20.828 1.00 14.57 N ATOM 2752 CA ARG B 71 31.818 10.084 21.584 1.00 15.69 C ATOM 2753 C ARG B 71 32.230 10.394 23.008 1.00 13.81 C ATOM 2754 O ARG B 71 33.434 10.503 23.305 1.00 16.45 O ATOM 2755 CB ARG B 71 32.203 8.676 21.188 1.00 15.37 C ATOM 2756 CG ARG B 71 31.362 7.687 21.941 1.00 14.57 C ATOM 2757 CD ARG B 71 31.787 6.371 21.387 1.00 22.30 C ATOM 2758 NE ARG B 71 31.216 5.331 22.207 1.00 20.61 N ATOM 2759 CZ ARG B 71 31.654 4.079 22.174 1.00 22.53 C ATOM 2760 NH1 ARG B 71 32.643 3.665 21.378 1.00 26.53 N ATOM 2761 NH2 ARG B 71 31.097 3.214 23.000 1.00 25.76 N ATOM 2762 HA ARG B 71 30.741 10.148 21.426 1.00 0.00 H ATOM 2763 HB2 ARG B 71 32.045 8.545 20.118 1.00 0.00 H ATOM 2764 HB3 ARG B 71 33.254 8.509 21.422 1.00 0.00 H ATOM 2765 HG2 ARG B 71 31.561 7.742 23.011 1.00 0.00 H ATOM 2766 HG3 ARG B 71 30.301 7.861 21.761 1.00 0.00 H ATOM 2767 HD2 ARG B 71 32.874 6.298 21.402 1.00 0.00 H ATOM 2768 HD3 ARG B 71 31.431 6.270 20.362 1.00 0.00 H ATOM 2769 HE ARG B 71 30.433 5.571 22.847 1.00 0.00 H ATOM 2770 HH12 ARG B 71 32.943 2.669 21.396 1.00 0.00 H ATOM 2771 HH11 ARG B 71 33.113 4.338 20.740 1.00 0.00 H ATOM 2772 HH22 ARG B 71 31.412 2.223 23.005 1.00 0.00 H ATOM 2773 HH21 ARG B 71 30.343 3.523 23.646 1.00 0.00 H ATOM 2774 H ARG B 71 33.633 11.015 20.885 1.00 0.00 H ATOM 2775 N ALA B 72 31.291 10.561 23.919 1.00 12.89 N ATOM 2776 CA ALA B 72 31.605 10.987 25.282 1.00 14.51 C ATOM 2777 C ALA B 72 30.670 10.307 26.238 1.00 14.59 C ATOM 2778 O ALA B 72 29.628 9.796 25.851 1.00 16.52 O ATOM 2779 CB ALA B 72 31.406 12.482 25.507 1.00 11.24 C ATOM 2780 HA ALA B 72 32.653 10.732 25.441 1.00 0.00 H ATOM 2781 HB1 ALA B 72 32.054 13.039 24.830 1.00 0.00 H ATOM 2782 HB2 ALA B 72 30.366 12.742 25.312 1.00 0.00 H ATOM 2783 HB3 ALA B 72 31.657 12.729 26.538 1.00 0.00 H ATOM 2784 H ALA B 72 30.299 10.385 23.661 1.00 0.00 H ATOM 2785 N LYS B 73 31.016 10.318 27.506 1.00 18.84 N ATOM 2786 CA LYS B 73 30.200 9.720 28.534 1.00 18.34 C ATOM 2787 C LYS B 73 29.723 10.871 29.379 1.00 17.96 C ATOM 2788 O LYS B 73 30.556 11.595 29.928 1.00 19.80 O ATOM 2789 CB LYS B 73 31.078 8.752 29.293 1.00 19.99 C ATOM 2790 CG LYS B 73 30.477 8.010 30.451 1.00 26.28 C ATOM 2791 CD LYS B 73 31.664 7.265 31.034 1.00 31.71 C ATOM 2792 CE LYS B 73 31.335 6.888 32.454 1.00 37.12 C ATOM 2793 NZ LYS B 73 32.516 6.456 33.172 1.00 37.12 N ATOM 2794 HA LYS B 73 29.338 9.161 28.170 1.00 0.00 H ATOM 2795 HB2 LYS B 73 31.431 8.007 28.580 1.00 0.00 H ATOM 2796 HB3 LYS B 73 31.927 9.317 29.676 1.00 0.00 H ATOM 2797 HG2 LYS B 73 30.051 8.700 31.180 1.00 0.00 H ATOM 2798 HG3 LYS B 73 29.706 7.317 30.115 1.00 0.00 H ATOM 2799 HD2 LYS B 73 31.858 6.366 30.449 1.00 0.00 H ATOM 2800 HD3 LYS B 73 32.546 7.905 31.017 1.00 0.00 H ATOM 2801 HE2 LYS B 73 30.607 6.077 32.447 1.00 0.00 H ATOM 2802 HE3 LYS B 73 30.908 7.753 32.961 1.00 0.00 H ATOM 2803 HZ1 LYS B 73 32.926 5.627 32.696 1.00 0.00 H ATOM 2804 HZ2 LYS B 73 33.213 7.228 33.187 1.00 0.00 H ATOM 2805 HZ3 LYS B 73 32.255 6.204 34.147 1.00 0.00 H ATOM 2806 H LYS B 73 31.910 10.774 27.778 1.00 0.00 H ATOM 2807 N LEU B 74 28.414 11.076 29.497 1.00 19.40 N ATOM 2808 CA LEU B 74 27.823 12.135 30.309 1.00 19.33 C ATOM 2809 C LEU B 74 27.319 11.483 31.583 1.00 17.71 C ATOM 2810 O LEU B 74 26.536 10.534 31.522 1.00 19.40 O ATOM 2811 CB LEU B 74 26.641 12.787 29.578 1.00 22.26 C ATOM 2812 CG LEU B 74 26.744 13.241 28.103 1.00 22.64 C ATOM 2813 CD1 LEU B 74 25.480 13.997 27.720 1.00 20.26 C ATOM 2814 CD2 LEU B 74 27.896 14.180 27.899 1.00 23.30 C ATOM 2815 HA LEU B 74 28.562 12.910 30.514 1.00 0.00 H ATOM 2816 HB2 LEU B 74 25.821 12.070 29.621 1.00 0.00 H ATOM 2817 HB3 LEU B 74 26.377 13.674 30.154 1.00 0.00 H ATOM 2818 HG LEU B 74 26.883 12.348 27.494 1.00 0.00 H ATOM 2819 HD21 LEU B 74 27.759 15.062 28.525 1.00 0.00 H ATOM 2820 HD22 LEU B 74 28.824 13.679 28.173 1.00 0.00 H ATOM 2821 HD23 LEU B 74 27.938 14.479 26.852 1.00 0.00 H ATOM 2822 HD11 LEU B 74 24.616 13.343 27.842 1.00 0.00 H ATOM 2823 HD12 LEU B 74 25.371 14.869 28.364 1.00 0.00 H ATOM 2824 HD13 LEU B 74 25.551 14.318 26.681 1.00 0.00 H ATOM 2825 H LEU B 74 27.772 10.443 28.979 1.00 0.00 H ATOM 2826 N THR B 75 27.775 11.875 32.757 1.00 17.23 N ATOM 2827 CA THR B 75 27.239 11.328 34.003 1.00 17.80 C ATOM 2828 C THR B 75 26.438 12.482 34.553 1.00 15.74 C ATOM 2829 O THR B 75 27.002 13.562 34.765 1.00 13.20 O ATOM 2830 CB THR B 75 28.377 10.919 34.945 1.00 18.55 C ATOM 2831 OG1 THR B 75 29.104 9.938 34.221 1.00 20.93 O ATOM 2832 CG2 THR B 75 27.920 10.319 36.268 1.00 16.64 C ATOM 2833 HA THR B 75 26.641 10.426 33.871 1.00 0.00 H ATOM 2834 HB THR B 75 28.950 11.804 35.222 1.00 0.00 H ATOM 2835 HG1 THR B 75 29.445 10.335 33.381 1.00 0.00 H ATOM 2836 HG23 THR B 75 27.361 11.066 36.830 1.00 0.00 H ATOM 2837 HG21 THR B 75 27.282 9.457 36.073 1.00 0.00 H ATOM 2838 HG22 THR B 75 28.791 10.006 36.844 1.00 0.00 H ATOM 2839 H THR B 75 28.531 12.588 32.797 1.00 0.00 H ATOM 2840 N ILE B 76 25.137 12.254 34.715 1.00 15.22 N ATOM 2841 CA ILE B 76 24.167 13.280 35.031 1.00 17.69 C ATOM 2842 C ILE B 76 23.545 13.033 36.392 1.00 21.74 C ATOM 2843 O ILE B 76 22.958 11.969 36.640 1.00 22.31 O ATOM 2844 CB ILE B 76 23.070 13.283 33.911 1.00 17.49 C ATOM 2845 CG1 ILE B 76 23.714 13.508 32.518 1.00 12.16 C ATOM 2846 CG2 ILE B 76 22.013 14.361 34.241 1.00 12.97 C ATOM 2847 CD1 ILE B 76 22.736 13.333 31.343 1.00 9.45 C ATOM 2848 HA ILE B 76 24.658 14.252 35.071 1.00 0.00 H ATOM 2849 HB ILE B 76 22.573 12.314 33.877 1.00 0.00 H ATOM 2850 HG12 ILE B 76 24.114 14.521 32.484 1.00 0.00 H ATOM 2851 HG13 ILE B 76 24.528 12.793 32.397 1.00 0.00 H ATOM 2852 HD11 ILE B 76 22.335 12.320 31.354 1.00 0.00 H ATOM 2853 HD12 ILE B 76 21.920 14.049 31.441 1.00 0.00 H ATOM 2854 HD13 ILE B 76 23.263 13.507 30.405 1.00 0.00 H ATOM 2855 HG21 ILE B 76 21.554 14.136 35.204 1.00 0.00 H ATOM 2856 HG22 ILE B 76 22.494 15.338 34.286 1.00 0.00 H ATOM 2857 HG23 ILE B 76 21.248 14.367 33.465 1.00 0.00 H ATOM 2858 H ILE B 76 24.796 11.277 34.608 1.00 0.00 H ATOM 2859 N SER B 77 23.655 14.027 37.275 1.00 24.12 N ATOM 2860 CA SER B 77 23.056 13.948 38.603 1.00 26.21 C ATOM 2861 C SER B 77 21.519 13.999 38.502 1.00 25.27 C ATOM 2862 O SER B 77 21.018 14.725 37.637 1.00 23.87 O ATOM 2863 CB SER B 77 23.595 15.126 39.453 1.00 25.47 C ATOM 2864 OG SER B 77 23.323 16.459 38.972 1.00 26.04 O ATOM 2865 HA SER B 77 23.322 13.004 39.079 1.00 0.00 H ATOM 2866 HB2 SER B 77 24.677 15.015 39.521 1.00 0.00 H ATOM 2867 HB3 SER B 77 23.159 15.040 40.448 1.00 0.00 H ATOM 2868 HG SER B 77 23.724 16.573 38.074 1.00 0.00 H ATOM 2869 H SER B 77 24.183 14.883 37.009 1.00 0.00 H ATOM 2870 N PRO B 78 20.706 13.376 39.359 1.00 24.62 N ATOM 2871 CA PRO B 78 19.251 13.338 39.242 1.00 24.51 C ATOM 2872 C PRO B 78 18.581 14.691 39.130 1.00 23.22 C ATOM 2873 O PRO B 78 17.604 14.820 38.401 1.00 24.84 O ATOM 2874 CB PRO B 78 18.802 12.570 40.439 1.00 25.00 C ATOM 2875 CG PRO B 78 19.953 12.702 41.412 1.00 28.48 C ATOM 2876 CD PRO B 78 21.162 12.613 40.508 1.00 25.74 C ATOM 2877 HA PRO B 78 18.958 12.868 38.303 1.00 0.00 H ATOM 2878 HD3 PRO B 78 22.040 13.067 40.967 1.00 0.00 H ATOM 2879 HD2 PRO B 78 21.387 11.581 40.240 1.00 0.00 H ATOM 2880 HG3 PRO B 78 19.947 11.892 42.142 1.00 0.00 H ATOM 2881 HG2 PRO B 78 19.920 13.659 41.933 1.00 0.00 H ATOM 2882 HB2 PRO B 78 17.891 12.999 40.856 1.00 0.00 H ATOM 2883 HB3 PRO B 78 18.627 11.525 40.185 1.00 0.00 H ATOM 2884 N ASP B 79 19.083 15.754 39.763 1.00 24.53 N ATOM 2885 CA ASP B 79 18.528 17.107 39.599 1.00 23.03 C ATOM 2886 C ASP B 79 18.762 17.673 38.211 1.00 21.36 C ATOM 2887 O ASP B 79 18.156 18.673 37.841 1.00 23.06 O ATOM 2888 CB ASP B 79 19.129 18.071 40.613 1.00 25.42 C ATOM 2889 CG ASP B 79 20.652 18.130 40.620 1.00 30.06 C ATOM 2890 OD1 ASP B 79 21.297 17.139 40.982 1.00 30.58 O ATOM 2891 OD2 ASP B 79 21.188 19.182 40.271 1.00 33.74 O ATOM 2892 HA ASP B 79 17.454 17.006 39.758 1.00 0.00 H ATOM 2893 HB2 ASP B 79 18.752 19.070 40.395 1.00 0.00 H ATOM 2894 HB3 ASP B 79 18.797 17.768 41.606 1.00 0.00 H ATOM 2895 H ASP B 79 19.897 15.621 40.396 1.00 0.00 H ATOM 2896 N TYR B 80 19.668 17.088 37.429 1.00 19.41 N ATOM 2897 CA TYR B 80 19.829 17.509 36.054 1.00 19.68 C ATOM 2898 C TYR B 80 19.162 16.519 35.117 1.00 18.77 C ATOM 2899 O TYR B 80 19.357 16.597 33.901 1.00 18.82 O ATOM 2900 CB TYR B 80 21.282 17.599 35.705 1.00 18.06 C ATOM 2901 CG TYR B 80 21.852 18.978 35.895 1.00 23.36 C ATOM 2902 CD1 TYR B 80 21.786 19.625 37.133 1.00 26.09 C ATOM 2903 CD2 TYR B 80 22.496 19.573 34.818 1.00 24.83 C ATOM 2904 CE1 TYR B 80 22.383 20.872 37.298 1.00 26.95 C ATOM 2905 CE2 TYR B 80 23.097 20.814 34.974 1.00 29.87 C ATOM 2906 CZ TYR B 80 23.045 21.448 36.215 1.00 31.36 C ATOM 2907 OH TYR B 80 23.654 22.675 36.368 1.00 34.64 O ATOM 2908 HA TYR B 80 19.363 18.488 35.943 1.00 0.00 H ATOM 2909 HB3 TYR B 80 21.406 17.313 34.660 1.00 0.00 H ATOM 2910 HB2 TYR B 80 21.834 16.905 36.338 1.00 0.00 H ATOM 2911 HD2 TYR B 80 22.529 19.067 33.853 1.00 0.00 H ATOM 2912 HE2 TYR B 80 23.605 21.289 34.135 1.00 0.00 H ATOM 2913 HE1 TYR B 80 22.334 21.388 38.257 1.00 0.00 H ATOM 2914 HD1 TYR B 80 21.268 19.154 37.968 1.00 0.00 H ATOM 2915 HH TYR B 80 23.529 22.990 37.298 1.00 0.00 H ATOM 2916 H TYR B 80 20.263 16.324 37.809 1.00 0.00 H ATOM 2917 N ALA B 81 18.376 15.602 35.672 1.00 20.20 N ATOM 2918 CA ALA B 81 17.779 14.543 34.900 1.00 18.79 C ATOM 2919 C ALA B 81 16.329 14.405 35.357 1.00 19.00 C ATOM 2920 O ALA B 81 15.617 15.403 35.210 1.00 19.05 O ATOM 2921 CB ALA B 81 18.579 13.274 35.145 1.00 16.87 C ATOM 2922 HA ALA B 81 17.789 14.747 33.829 1.00 0.00 H ATOM 2923 HB1 ALA B 81 19.612 13.431 34.834 1.00 0.00 H ATOM 2924 HB2 ALA B 81 18.552 13.028 36.207 1.00 0.00 H ATOM 2925 HB3 ALA B 81 18.145 12.456 34.570 1.00 0.00 H ATOM 2926 H ALA B 81 18.187 15.651 36.693 1.00 0.00 H ATOM 2927 N TYR B 82 15.821 13.289 35.905 1.00 18.55 N ATOM 2928 CA TYR B 82 14.395 13.161 36.202 1.00 19.41 C ATOM 2929 C TYR B 82 14.052 13.374 37.669 1.00 24.69 C ATOM 2930 O TYR B 82 12.948 13.091 38.152 1.00 27.35 O ATOM 2931 CB TYR B 82 13.928 11.783 35.751 1.00 14.74 C ATOM 2932 CG TYR B 82 13.983 11.621 34.237 1.00 18.45 C ATOM 2933 CD1 TYR B 82 12.947 12.133 33.442 1.00 16.65 C ATOM 2934 CD2 TYR B 82 15.110 11.055 33.636 1.00 15.82 C ATOM 2935 CE1 TYR B 82 13.034 12.064 32.056 1.00 14.11 C ATOM 2936 CE2 TYR B 82 15.203 10.990 32.250 1.00 13.60 C ATOM 2937 CZ TYR B 82 14.159 11.494 31.482 1.00 12.23 C ATOM 2938 OH TYR B 82 14.263 11.436 30.114 1.00 16.95 O ATOM 2939 HA TYR B 82 13.877 13.952 35.659 1.00 0.00 H ATOM 2940 HB3 TYR B 82 12.900 11.635 36.083 1.00 0.00 H ATOM 2941 HB2 TYR B 82 14.568 11.029 36.208 1.00 0.00 H ATOM 2942 HD2 TYR B 82 15.918 10.664 34.254 1.00 0.00 H ATOM 2943 HE2 TYR B 82 16.080 10.551 31.774 1.00 0.00 H ATOM 2944 HE1 TYR B 82 12.230 12.452 31.431 1.00 0.00 H ATOM 2945 HD1 TYR B 82 12.073 12.585 33.911 1.00 0.00 H ATOM 2946 HH TYR B 82 14.352 10.492 29.831 1.00 0.00 H ATOM 2947 H TYR B 82 16.458 12.496 36.124 1.00 0.00 H ATOM 2948 N GLY B 83 15.049 13.833 38.413 1.00 28.81 N ATOM 2949 CA GLY B 83 14.927 14.213 39.802 1.00 28.77 C ATOM 2950 C GLY B 83 14.354 13.137 40.694 1.00 30.80 C ATOM 2951 O GLY B 83 14.644 11.944 40.628 1.00 27.53 O ATOM 2952 HA3 GLY B 83 14.278 15.087 39.861 1.00 0.00 H ATOM 2953 HA2 GLY B 83 15.918 14.472 40.173 1.00 0.00 H ATOM 2954 H GLY B 83 15.983 13.926 37.966 1.00 0.00 H ATOM 2955 N ALA B 84 13.469 13.654 41.522 1.00 31.56 N ATOM 2956 CA ALA B 84 12.798 12.900 42.548 1.00 31.44 C ATOM 2957 C ALA B 84 11.739 11.928 42.065 1.00 29.67 C ATOM 2958 O ALA B 84 11.540 10.925 42.729 1.00 26.26 O ATOM 2959 CB ALA B 84 12.163 13.879 43.505 1.00 35.58 C ATOM 2960 HA ALA B 84 13.562 12.278 43.013 1.00 0.00 H ATOM 2961 HB1 ALA B 84 12.936 14.509 43.944 1.00 0.00 H ATOM 2962 HB2 ALA B 84 11.449 14.501 42.966 1.00 0.00 H ATOM 2963 HB3 ALA B 84 11.647 13.331 44.294 1.00 0.00 H ATOM 2964 H ALA B 84 13.242 14.665 41.429 1.00 0.00 H ATOM 2965 N THR B 85 11.068 12.207 40.953 1.00 29.55 N ATOM 2966 CA THR B 85 10.038 11.312 40.448 1.00 31.96 C ATOM 2967 C THR B 85 10.532 10.188 39.529 1.00 31.92 C ATOM 2968 O THR B 85 10.046 9.049 39.564 1.00 33.65 O ATOM 2969 CB THR B 85 8.970 12.175 39.740 1.00 33.48 C ATOM 2970 OG1 THR B 85 9.576 13.059 38.799 1.00 36.86 O ATOM 2971 CG2 THR B 85 8.228 13.018 40.762 1.00 38.72 C ATOM 2972 HA THR B 85 9.629 10.779 41.306 1.00 0.00 H ATOM 2973 HB THR B 85 8.285 11.502 39.225 1.00 0.00 H ATOM 2974 HG1 THR B 85 8.875 13.601 38.358 1.00 0.00 H ATOM 2975 HG23 THR B 85 7.754 12.365 41.495 1.00 0.00 H ATOM 2976 HG21 THR B 85 8.933 13.680 41.265 1.00 0.00 H ATOM 2977 HG22 THR B 85 7.466 13.612 40.257 1.00 0.00 H ATOM 2978 H THR B 85 11.283 13.082 40.433 1.00 0.00 H ATOM 2979 N GLY B 86 11.536 10.470 38.701 1.00 27.05 N ATOM 2980 CA GLY B 86 11.987 9.443 37.790 1.00 22.68 C ATOM 2981 C GLY B 86 11.080 9.555 36.576 1.00 20.94 C ATOM 2982 O GLY B 86 10.446 10.591 36.323 1.00 19.48 O ATOM 2983 HA3 GLY B 86 11.893 8.458 38.248 1.00 0.00 H ATOM 2984 HA2 GLY B 86 13.026 9.613 37.507 1.00 0.00 H ATOM 2985 H GLY B 86 11.985 11.408 38.710 1.00 0.00 H ATOM 2986 N HIS B 87 11.016 8.515 35.764 1.00 18.66 N ATOM 2987 CA HIS B 87 10.179 8.554 34.584 1.00 16.23 C ATOM 2988 C HIS B 87 9.515 7.200 34.641 1.00 15.13 C ATOM 2989 O HIS B 87 10.187 6.212 34.336 1.00 13.42 O ATOM 2990 CB HIS B 87 11.033 8.710 33.303 1.00 13.38 C ATOM 2991 CG HIS B 87 10.187 8.905 32.049 1.00 15.12 C ATOM 2992 ND1 HIS B 87 9.574 10.010 31.635 1.00 19.58 N ATOM 2993 CD2 HIS B 87 9.891 7.921 31.125 1.00 17.14 C ATOM 2994 CE1 HIS B 87 8.930 9.740 30.517 1.00 16.02 C ATOM 2995 NE2 HIS B 87 9.121 8.473 30.222 1.00 13.70 N ATOM 2996 HA HIS B 87 9.479 9.389 34.558 1.00 0.00 H ATOM 2997 HB2 HIS B 87 11.685 9.576 33.422 1.00 0.00 H ATOM 2998 HB3 HIS B 87 11.641 7.814 33.178 1.00 0.00 H ATOM 2999 HD2 HIS B 87 10.232 6.886 31.144 1.00 0.00 H ATOM 3000 HE1 HIS B 87 8.339 10.447 29.935 1.00 0.00 H ATOM 3001 H HIS B 87 11.572 7.661 35.974 1.00 0.00 H ATOM 3002 N PRO B 88 8.233 7.079 34.992 1.00 15.81 N ATOM 3003 CA PRO B 88 7.533 5.821 35.224 1.00 14.47 C ATOM 3004 C PRO B 88 7.816 4.773 34.188 1.00 12.72 C ATOM 3005 O PRO B 88 7.747 4.991 32.967 1.00 13.02 O ATOM 3006 CB PRO B 88 6.054 6.153 35.265 1.00 13.65 C ATOM 3007 CG PRO B 88 6.068 7.568 35.766 1.00 16.83 C ATOM 3008 CD PRO B 88 7.294 8.184 35.099 1.00 18.34 C ATOM 3009 HA PRO B 88 7.882 5.385 36.160 1.00 0.00 H ATOM 3010 HD3 PRO B 88 7.043 8.575 34.113 1.00 0.00 H ATOM 3011 HD2 PRO B 88 7.707 8.985 35.712 1.00 0.00 H ATOM 3012 HG3 PRO B 88 6.163 7.594 36.852 1.00 0.00 H ATOM 3013 HG2 PRO B 88 5.160 8.093 35.469 1.00 0.00 H ATOM 3014 HB2 PRO B 88 5.605 6.087 34.274 1.00 0.00 H ATOM 3015 HB3 PRO B 88 5.518 5.495 35.949 1.00 0.00 H ATOM 3016 N GLY B 89 8.262 3.678 34.765 1.00 14.51 N ATOM 3017 CA GLY B 89 8.479 2.488 33.995 1.00 15.74 C ATOM 3018 C GLY B 89 9.870 2.414 33.406 1.00 20.31 C ATOM 3019 O GLY B 89 10.182 1.372 32.832 1.00 21.49 O ATOM 3020 HA3 GLY B 89 7.754 2.463 33.181 1.00 0.00 H ATOM 3021 HA2 GLY B 89 8.328 1.623 34.641 1.00 0.00 H ATOM 3022 H GLY B 89 8.458 3.675 35.786 1.00 0.00 H ATOM 3023 N ILE B 90 10.714 3.460 33.479 1.00 20.07 N ATOM 3024 CA ILE B 90 12.040 3.432 32.882 1.00 17.23 C ATOM 3025 C ILE B 90 13.070 3.970 33.878 1.00 19.74 C ATOM 3026 O ILE B 90 14.078 3.309 34.113 1.00 22.70 O ATOM 3027 CB ILE B 90 12.070 4.286 31.592 1.00 15.86 C ATOM 3028 CG1 ILE B 90 11.007 3.820 30.592 1.00 16.91 C ATOM 3029 CG2 ILE B 90 13.468 4.161 30.971 1.00 16.45 C ATOM 3030 CD1 ILE B 90 10.826 4.742 29.379 1.00 21.82 C ATOM 3031 HA ILE B 90 12.285 2.401 32.628 1.00 0.00 H ATOM 3032 HB ILE B 90 11.851 5.325 31.840 1.00 0.00 H ATOM 3033 HG12 ILE B 90 11.290 2.832 30.229 1.00 0.00 H ATOM 3034 HG13 ILE B 90 10.053 3.754 31.115 1.00 0.00 H ATOM 3035 HD11 ILE B 90 10.528 5.734 29.719 1.00 0.00 H ATOM 3036 HD12 ILE B 90 11.767 4.811 28.833 1.00 0.00 H ATOM 3037 HD13 ILE B 90 10.055 4.334 28.726 1.00 0.00 H ATOM 3038 HG21 ILE B 90 14.213 4.523 31.680 1.00 0.00 H ATOM 3039 HG22 ILE B 90 13.667 3.116 30.735 1.00 0.00 H ATOM 3040 HG23 ILE B 90 13.513 4.756 30.059 1.00 0.00 H ATOM 3041 H ILE B 90 10.407 4.318 33.980 1.00 0.00 H ATOM 3042 N ILE B 91 12.923 5.143 34.495 1.00 18.88 N ATOM 3043 CA ILE B 91 13.954 5.680 35.375 1.00 16.51 C ATOM 3044 C ILE B 91 13.349 5.714 36.772 1.00 18.25 C ATOM 3045 O ILE B 91 12.274 6.290 36.963 1.00 17.62 O ATOM 3046 CB ILE B 91 14.358 7.123 34.948 1.00 18.28 C ATOM 3047 CG1 ILE B 91 14.841 7.160 33.505 1.00 12.75 C ATOM 3048 CG2 ILE B 91 15.406 7.644 35.929 1.00 13.82 C ATOM 3049 CD1 ILE B 91 16.090 6.334 33.230 1.00 12.58 C ATOM 3050 HA ILE B 91 14.852 5.064 35.333 1.00 0.00 H ATOM 3051 HB ILE B 91 13.488 7.778 34.985 1.00 0.00 H ATOM 3052 HG12 ILE B 91 14.039 6.785 32.869 1.00 0.00 H ATOM 3053 HG13 ILE B 91 15.055 8.197 33.245 1.00 0.00 H ATOM 3054 HD11 ILE B 91 16.910 6.702 33.847 1.00 0.00 H ATOM 3055 HD12 ILE B 91 15.893 5.289 33.470 1.00 0.00 H ATOM 3056 HD13 ILE B 91 16.358 6.422 32.177 1.00 0.00 H ATOM 3057 HG21 ILE B 91 14.986 7.657 36.935 1.00 0.00 H ATOM 3058 HG22 ILE B 91 16.279 6.991 35.907 1.00 0.00 H ATOM 3059 HG23 ILE B 91 15.699 8.654 35.643 1.00 0.00 H ATOM 3060 H ILE B 91 12.051 5.689 34.345 1.00 0.00 H ATOM 3061 N PRO B 92 13.985 5.137 37.778 1.00 19.16 N ATOM 3062 CA PRO B 92 13.651 5.311 39.182 1.00 20.40 C ATOM 3063 C PRO B 92 13.827 6.727 39.752 1.00 23.32 C ATOM 3064 O PRO B 92 14.595 7.543 39.227 1.00 23.88 O ATOM 3065 CB PRO B 92 14.520 4.291 39.831 1.00 20.36 C ATOM 3066 CG PRO B 92 15.743 4.210 38.973 1.00 20.10 C ATOM 3067 CD PRO B 92 15.097 4.207 37.606 1.00 20.70 C ATOM 3068 HA PRO B 92 12.585 5.177 39.365 1.00 0.00 H ATOM 3069 HD3 PRO B 92 15.790 4.559 36.842 1.00 0.00 H ATOM 3070 HD2 PRO B 92 14.741 3.212 37.341 1.00 0.00 H ATOM 3071 HG3 PRO B 92 16.308 3.296 39.157 1.00 0.00 H ATOM 3072 HG2 PRO B 92 16.394 5.073 39.112 1.00 0.00 H ATOM 3073 HB2 PRO B 92 14.783 4.601 40.842 1.00 0.00 H ATOM 3074 HB3 PRO B 92 14.014 3.326 39.868 1.00 0.00 H ATOM 3075 N PRO B 93 13.130 7.112 40.819 1.00 25.36 N ATOM 3076 CA PRO B 93 13.395 8.300 41.618 1.00 24.78 C ATOM 3077 C PRO B 93 14.834 8.455 42.025 1.00 22.81 C ATOM 3078 O PRO B 93 15.492 7.490 42.408 1.00 20.70 O ATOM 3079 CB PRO B 93 12.488 8.162 42.813 1.00 25.88 C ATOM 3080 CG PRO B 93 12.143 6.696 42.819 1.00 29.53 C ATOM 3081 CD PRO B 93 11.953 6.444 41.340 1.00 28.90 C ATOM 3082 HA PRO B 93 13.201 9.203 41.040 1.00 0.00 H ATOM 3083 HD3 PRO B 93 11.955 5.379 41.107 1.00 0.00 H ATOM 3084 HD2 PRO B 93 11.033 6.895 40.967 1.00 0.00 H ATOM 3085 HG3 PRO B 93 11.229 6.501 43.380 1.00 0.00 H ATOM 3086 HG2 PRO B 93 12.955 6.094 43.228 1.00 0.00 H ATOM 3087 HB2 PRO B 93 13.004 8.446 43.730 1.00 0.00 H ATOM 3088 HB3 PRO B 93 11.593 8.774 42.697 1.00 0.00 H ATOM 3089 N HIS B 94 15.299 9.695 41.972 1.00 22.21 N ATOM 3090 CA HIS B 94 16.645 10.061 42.376 1.00 23.88 C ATOM 3091 C HIS B 94 17.804 9.385 41.642 1.00 24.38 C ATOM 3092 O HIS B 94 18.894 9.242 42.211 1.00 23.79 O ATOM 3093 CB HIS B 94 16.830 9.798 43.864 1.00 29.34 C ATOM 3094 CG HIS B 94 15.782 10.476 44.703 1.00 33.35 C ATOM 3095 ND1 HIS B 94 15.531 11.773 44.780 1.00 32.78 N ATOM 3096 CD2 HIS B 94 14.892 9.799 45.496 1.00 35.58 C ATOM 3097 CE1 HIS B 94 14.512 11.922 45.580 1.00 37.07 C ATOM 3098 NE2 HIS B 94 14.141 10.737 46.009 1.00 39.00 N ATOM 3099 HA HIS B 94 16.703 11.116 42.109 1.00 0.00 H ATOM 3100 HB2 HIS B 94 16.777 8.723 44.039 1.00 0.00 H ATOM 3101 HB3 HIS B 94 17.811 10.166 44.165 1.00 0.00 H ATOM 3102 HD2 HIS B 94 14.826 8.724 45.661 1.00 0.00 H ATOM 3103 HE1 HIS B 94 14.046 12.870 45.848 1.00 0.00 H ATOM 3104 H HIS B 94 14.668 10.444 41.623 1.00 0.00 H ATOM 3105 N ALA B 95 17.667 9.030 40.369 1.00 20.96 N ATOM 3106 CA ALA B 95 18.721 8.305 39.701 1.00 20.36 C ATOM 3107 C ALA B 95 19.780 9.152 39.015 1.00 20.06 C ATOM 3108 O ALA B 95 19.485 10.198 38.428 1.00 21.25 O ATOM 3109 CB ALA B 95 18.103 7.391 38.676 1.00 20.14 C ATOM 3110 HA ALA B 95 19.246 7.770 40.492 1.00 0.00 H ATOM 3111 HB1 ALA B 95 17.429 6.693 39.173 1.00 0.00 H ATOM 3112 HB2 ALA B 95 17.544 7.984 37.952 1.00 0.00 H ATOM 3113 HB3 ALA B 95 18.890 6.837 38.164 1.00 0.00 H ATOM 3114 H ALA B 95 16.798 9.275 39.853 1.00 0.00 H ATOM 3115 N THR B 96 21.035 8.721 39.148 1.00 19.06 N ATOM 3116 CA THR B 96 22.139 9.316 38.398 1.00 19.92 C ATOM 3117 C THR B 96 22.186 8.505 37.097 1.00 17.58 C ATOM 3118 O THR B 96 22.109 7.265 37.131 1.00 16.38 O ATOM 3119 CB THR B 96 23.500 9.178 39.143 1.00 17.58 C ATOM 3120 OG1 THR B 96 23.424 9.927 40.350 1.00 19.44 O ATOM 3121 CG2 THR B 96 24.657 9.715 38.316 1.00 17.85 C ATOM 3122 HA THR B 96 21.984 10.384 38.249 1.00 0.00 H ATOM 3123 HB THR B 96 23.681 8.120 39.333 1.00 0.00 H ATOM 3124 HG1 THR B 96 24.282 9.851 40.839 1.00 0.00 H ATOM 3125 HG23 THR B 96 24.730 9.151 37.386 1.00 0.00 H ATOM 3126 HG21 THR B 96 24.484 10.768 38.092 1.00 0.00 H ATOM 3127 HG22 THR B 96 25.584 9.610 38.879 1.00 0.00 H ATOM 3128 H THR B 96 21.234 7.939 39.804 1.00 0.00 H ATOM 3129 N LEU B 97 22.278 9.182 35.966 1.00 16.61 N ATOM 3130 CA LEU B 97 22.271 8.529 34.667 1.00 16.83 C ATOM 3131 C LEU B 97 23.648 8.649 34.031 1.00 16.28 C ATOM 3132 O LEU B 97 24.387 9.608 34.270 1.00 16.46 O ATOM 3133 CB LEU B 97 21.224 9.179 33.765 1.00 12.29 C ATOM 3134 CG LEU B 97 19.790 9.304 34.290 1.00 13.48 C ATOM 3135 CD1 LEU B 97 18.907 9.946 33.240 1.00 12.16 C ATOM 3136 CD2 LEU B 97 19.256 7.950 34.615 1.00 7.40 C ATOM 3137 HA LEU B 97 22.023 7.475 34.794 1.00 0.00 H ATOM 3138 HB2 LEU B 97 21.574 10.186 33.538 1.00 0.00 H ATOM 3139 HB3 LEU B 97 21.182 8.594 32.846 1.00 0.00 H ATOM 3140 HG LEU B 97 19.796 9.924 35.186 1.00 0.00 H ATOM 3141 HD21 LEU B 97 19.261 7.334 33.716 1.00 0.00 H ATOM 3142 HD22 LEU B 97 19.882 7.487 35.378 1.00 0.00 H ATOM 3143 HD23 LEU B 97 18.236 8.043 34.988 1.00 0.00 H ATOM 3144 HD11 LEU B 97 19.290 10.938 33.002 1.00 0.00 H ATOM 3145 HD12 LEU B 97 18.908 9.330 32.341 1.00 0.00 H ATOM 3146 HD13 LEU B 97 17.890 10.030 33.624 1.00 0.00 H ATOM 3147 H LEU B 97 22.358 10.218 36.006 1.00 0.00 H ATOM 3148 N VAL B 98 24.033 7.644 33.267 1.00 17.70 N ATOM 3149 CA VAL B 98 25.289 7.650 32.541 1.00 16.77 C ATOM 3150 C VAL B 98 24.865 7.477 31.084 1.00 18.42 C ATOM 3151 O VAL B 98 24.198 6.484 30.748 1.00 16.84 O ATOM 3152 CB VAL B 98 26.172 6.460 32.996 1.00 16.66 C ATOM 3153 CG1 VAL B 98 27.435 6.405 32.156 1.00 16.11 C ATOM 3154 CG2 VAL B 98 26.540 6.612 34.459 1.00 15.17 C ATOM 3155 HA VAL B 98 25.875 8.554 32.704 1.00 0.00 H ATOM 3156 HB VAL B 98 25.610 5.535 32.865 1.00 0.00 H ATOM 3157 HG11 VAL B 98 27.167 6.275 31.107 1.00 0.00 H ATOM 3158 HG12 VAL B 98 27.992 7.334 32.278 1.00 0.00 H ATOM 3159 HG13 VAL B 98 28.050 5.566 32.482 1.00 0.00 H ATOM 3160 HG21 VAL B 98 27.092 7.541 34.599 1.00 0.00 H ATOM 3161 HG22 VAL B 98 25.631 6.634 35.061 1.00 0.00 H ATOM 3162 HG23 VAL B 98 27.160 5.770 34.766 1.00 0.00 H ATOM 3163 H VAL B 98 23.411 6.815 33.182 1.00 0.00 H ATOM 3164 N PHE B 99 25.190 8.413 30.206 1.00 17.21 N ATOM 3165 CA PHE B 99 24.879 8.261 28.797 1.00 16.90 C ATOM 3166 C PHE B 99 26.153 8.132 27.977 1.00 16.36 C ATOM 3167 O PHE B 99 27.058 8.959 28.118 1.00 15.33 O ATOM 3168 CB PHE B 99 24.092 9.474 28.240 1.00 18.86 C ATOM 3169 CG PHE B 99 22.602 9.459 28.544 1.00 18.50 C ATOM 3170 CD1 PHE B 99 21.725 8.786 27.691 1.00 18.96 C ATOM 3171 CD2 PHE B 99 22.107 10.107 29.668 1.00 19.52 C ATOM 3172 CE1 PHE B 99 20.361 8.775 27.976 1.00 19.33 C ATOM 3173 CE2 PHE B 99 20.739 10.091 29.944 1.00 17.51 C ATOM 3174 CZ PHE B 99 19.863 9.426 29.100 1.00 15.87 C ATOM 3175 HA PHE B 99 24.269 7.361 28.716 1.00 0.00 H ATOM 3176 HB2 PHE B 99 24.517 10.381 28.669 1.00 0.00 H ATOM 3177 HB3 PHE B 99 24.218 9.492 27.157 1.00 0.00 H ATOM 3178 HD2 PHE B 99 22.790 10.630 30.337 1.00 0.00 H ATOM 3179 HE2 PHE B 99 20.358 10.604 30.827 1.00 0.00 H ATOM 3180 HZ PHE B 99 18.794 9.413 29.315 1.00 0.00 H ATOM 3181 HE1 PHE B 99 19.676 8.250 27.310 1.00 0.00 H ATOM 3182 HD1 PHE B 99 22.105 8.272 26.808 1.00 0.00 H ATOM 3183 H PHE B 99 25.677 9.272 30.532 1.00 0.00 H ATOM 3184 N ASP B 100 26.259 7.132 27.120 1.00 12.69 N ATOM 3185 CA ASP B 100 27.346 7.029 26.174 1.00 13.37 C ATOM 3186 C ASP B 100 26.755 7.641 24.892 1.00 13.71 C ATOM 3187 O ASP B 100 25.909 7.017 24.244 1.00 12.98 O ATOM 3188 CB ASP B 100 27.677 5.562 26.032 1.00 8.27 C ATOM 3189 CG ASP B 100 28.580 5.203 24.857 1.00 22.35 C ATOM 3190 OD1 ASP B 100 29.152 6.073 24.181 1.00 21.08 O ATOM 3191 OD2 ASP B 100 28.716 4.006 24.615 1.00 21.86 O ATOM 3192 HA ASP B 100 28.271 7.535 26.449 1.00 0.00 H ATOM 3193 HB2 ASP B 100 28.173 5.239 26.948 1.00 0.00 H ATOM 3194 HB3 ASP B 100 26.741 5.016 25.915 1.00 0.00 H ATOM 3195 H ASP B 100 25.531 6.389 27.127 1.00 0.00 H ATOM 3196 N VAL B 101 27.204 8.829 24.499 1.00 14.54 N ATOM 3197 CA VAL B 101 26.632 9.622 23.414 1.00 14.07 C ATOM 3198 C VAL B 101 27.618 9.792 22.283 1.00 12.70 C ATOM 3199 O VAL B 101 28.781 10.113 22.545 1.00 11.85 O ATOM 3200 CB VAL B 101 26.251 11.050 23.916 1.00 16.97 C ATOM 3201 CG1 VAL B 101 25.553 11.848 22.817 1.00 15.75 C ATOM 3202 CG2 VAL B 101 25.331 10.939 25.096 1.00 17.67 C ATOM 3203 HA VAL B 101 25.748 9.087 23.066 1.00 0.00 H ATOM 3204 HB VAL B 101 27.168 11.567 24.199 1.00 0.00 H ATOM 3205 HG11 VAL B 101 26.220 11.944 21.960 1.00 0.00 H ATOM 3206 HG12 VAL B 101 24.644 11.329 22.515 1.00 0.00 H ATOM 3207 HG13 VAL B 101 25.299 12.839 23.194 1.00 0.00 H ATOM 3208 HG21 VAL B 101 24.428 10.405 24.802 1.00 0.00 H ATOM 3209 HG22 VAL B 101 25.833 10.395 25.896 1.00 0.00 H ATOM 3210 HG23 VAL B 101 25.067 11.937 25.444 1.00 0.00 H ATOM 3211 H VAL B 101 28.024 9.223 25.002 1.00 0.00 H ATOM 3212 N GLU B 102 27.221 9.620 21.032 1.00 14.63 N ATOM 3213 CA GLU B 102 28.088 9.947 19.928 1.00 12.69 C ATOM 3214 C GLU B 102 27.391 10.992 19.091 1.00 12.67 C ATOM 3215 O GLU B 102 26.274 10.760 18.637 1.00 13.29 O ATOM 3216 CB GLU B 102 28.360 8.748 19.072 1.00 16.80 C ATOM 3217 CG GLU B 102 29.318 9.212 17.964 1.00 22.61 C ATOM 3218 CD GLU B 102 29.958 8.129 17.115 1.00 29.72 C ATOM 3219 OE1 GLU B 102 29.767 6.949 17.420 1.00 31.77 O ATOM 3220 OE2 GLU B 102 30.666 8.479 16.160 1.00 31.25 O ATOM 3221 HA GLU B 102 29.040 10.309 20.317 1.00 0.00 H ATOM 3222 HB2 GLU B 102 28.823 7.959 19.665 1.00 0.00 H ATOM 3223 HB3 GLU B 102 27.432 8.377 18.637 1.00 0.00 H ATOM 3224 HG2 GLU B 102 28.758 9.867 17.296 1.00 0.00 H ATOM 3225 HG3 GLU B 102 30.121 9.778 18.437 1.00 0.00 H ATOM 3226 H GLU B 102 26.270 9.244 20.843 1.00 0.00 H ATOM 3227 N LEU B 103 28.009 12.142 18.859 1.00 13.36 N ATOM 3228 CA LEU B 103 27.400 13.201 18.099 1.00 14.42 C ATOM 3229 C LEU B 103 27.796 12.943 16.670 1.00 17.49 C ATOM 3230 O LEU B 103 28.906 13.248 16.269 1.00 18.50 O ATOM 3231 CB LEU B 103 27.900 14.566 18.580 1.00 15.07 C ATOM 3232 CG LEU B 103 27.409 15.845 17.873 1.00 18.42 C ATOM 3233 CD1 LEU B 103 25.892 15.842 17.731 1.00 19.11 C ATOM 3234 CD2 LEU B 103 27.816 17.062 18.694 1.00 21.26 C ATOM 3235 HA LEU B 103 26.316 13.218 18.214 1.00 0.00 H ATOM 3236 HB2 LEU B 103 27.619 14.655 19.629 1.00 0.00 H ATOM 3237 HB3 LEU B 103 28.987 14.554 18.496 1.00 0.00 H ATOM 3238 HG LEU B 103 27.859 15.881 16.881 1.00 0.00 H ATOM 3239 HD21 LEU B 103 27.367 16.997 19.685 1.00 0.00 H ATOM 3240 HD22 LEU B 103 28.902 17.090 18.787 1.00 0.00 H ATOM 3241 HD23 LEU B 103 27.470 17.967 18.196 1.00 0.00 H ATOM 3242 HD11 LEU B 103 25.585 14.977 17.143 1.00 0.00 H ATOM 3243 HD12 LEU B 103 25.436 15.791 18.720 1.00 0.00 H ATOM 3244 HD13 LEU B 103 25.574 16.756 17.229 1.00 0.00 H ATOM 3245 H LEU B 103 28.967 12.283 19.239 1.00 0.00 H ATOM 3246 N LEU B 104 26.881 12.381 15.895 1.00 19.64 N ATOM 3247 CA LEU B 104 27.151 11.936 14.547 1.00 21.24 C ATOM 3248 C LEU B 104 27.164 13.014 13.484 1.00 23.12 C ATOM 3249 O LEU B 104 27.945 12.910 12.535 1.00 23.97 O ATOM 3250 CB LEU B 104 26.118 10.886 14.153 1.00 19.41 C ATOM 3251 CG LEU B 104 26.052 9.631 14.991 1.00 19.41 C ATOM 3252 CD1 LEU B 104 24.782 8.856 14.708 1.00 20.29 C ATOM 3253 CD2 LEU B 104 27.240 8.780 14.652 1.00 22.12 C ATOM 3254 HA LEU B 104 28.167 11.543 14.580 1.00 0.00 H ATOM 3255 HB2 LEU B 104 25.137 11.360 14.194 1.00 0.00 H ATOM 3256 HB3 LEU B 104 26.332 10.585 13.128 1.00 0.00 H ATOM 3257 HG LEU B 104 26.055 9.902 16.047 1.00 0.00 H ATOM 3258 HD21 LEU B 104 27.213 8.526 13.592 1.00 0.00 H ATOM 3259 HD22 LEU B 104 28.155 9.331 14.872 1.00 0.00 H ATOM 3260 HD23 LEU B 104 27.213 7.867 15.247 1.00 0.00 H ATOM 3261 HD11 LEU B 104 23.918 9.479 14.941 1.00 0.00 H ATOM 3262 HD12 LEU B 104 24.756 8.576 13.655 1.00 0.00 H ATOM 3263 HD13 LEU B 104 24.761 7.958 15.325 1.00 0.00 H ATOM 3264 H LEU B 104 25.921 12.254 16.275 1.00 0.00 H ATOM 3265 N LYS B 105 26.340 14.056 13.579 1.00 22.13 N ATOM 3266 CA LYS B 105 26.172 14.968 12.464 1.00 23.40 C ATOM 3267 C LYS B 105 25.363 16.144 12.947 1.00 23.10 C ATOM 3268 O LYS B 105 24.576 15.972 13.873 1.00 21.90 O ATOM 3269 CB LYS B 105 25.423 14.213 11.376 1.00 28.80 C ATOM 3270 CG LYS B 105 25.204 14.862 10.041 1.00 40.77 C ATOM 3271 CD LYS B 105 24.529 13.817 9.147 1.00 49.79 C ATOM 3272 CE LYS B 105 24.321 14.375 7.735 1.00 56.22 C ATOM 3273 NZ LYS B 105 23.578 13.438 6.906 1.00 60.16 N ATOM 3274 HA LYS B 105 27.124 15.327 12.074 1.00 0.00 H ATOM 3275 HB2 LYS B 105 25.974 13.291 11.193 1.00 0.00 H ATOM 3276 HB3 LYS B 105 24.438 13.973 11.777 1.00 0.00 H ATOM 3277 HG2 LYS B 105 24.561 15.736 10.149 1.00 0.00 H ATOM 3278 HG3 LYS B 105 26.158 15.165 9.610 1.00 0.00 H ATOM 3279 HD2 LYS B 105 25.159 12.929 9.093 1.00 0.00 H ATOM 3280 HD3 LYS B 105 23.562 13.550 9.574 1.00 0.00 H ATOM 3281 HE2 LYS B 105 25.293 14.561 7.279 1.00 0.00 H ATOM 3282 HE3 LYS B 105 23.766 15.311 7.800 1.00 0.00 H ATOM 3283 HZ1 LYS B 105 24.105 12.544 6.837 1.00 0.00 H ATOM 3284 HZ2 LYS B 105 22.647 13.260 7.335 1.00 0.00 H ATOM 3285 HZ3 LYS B 105 23.452 13.842 5.956 1.00 0.00 H ATOM 3286 H LYS B 105 25.812 14.217 14.461 1.00 0.00 H ATOM 3287 N LEU B 106 25.560 17.339 12.423 1.00 24.94 N ATOM 3288 CA LEU B 106 24.678 18.463 12.693 1.00 26.68 C ATOM 3289 C LEU B 106 24.106 18.833 11.336 1.00 32.87 C ATOM 3290 O LEU B 106 24.834 18.862 10.333 1.00 34.63 O ATOM 3291 CB LEU B 106 25.387 19.688 13.210 1.00 23.52 C ATOM 3292 CG LEU B 106 26.016 19.612 14.560 1.00 23.08 C ATOM 3293 CD1 LEU B 106 26.899 20.837 14.725 1.00 23.19 C ATOM 3294 CD2 LEU B 106 24.937 19.474 15.631 1.00 21.16 C ATOM 3295 HA LEU B 106 23.954 18.170 13.454 1.00 0.00 H ATOM 3296 HB2 LEU B 106 26.175 19.932 12.498 1.00 0.00 H ATOM 3297 HB3 LEU B 106 24.658 20.498 13.236 1.00 0.00 H ATOM 3298 HG LEU B 106 26.646 18.729 14.669 1.00 0.00 H ATOM 3299 HD21 LEU B 106 24.275 20.339 15.591 1.00 0.00 H ATOM 3300 HD22 LEU B 106 24.362 18.566 15.451 1.00 0.00 H ATOM 3301 HD23 LEU B 106 25.407 19.419 16.613 1.00 0.00 H ATOM 3302 HD11 LEU B 106 27.664 20.839 13.948 1.00 0.00 H ATOM 3303 HD12 LEU B 106 26.290 21.737 14.639 1.00 0.00 H ATOM 3304 HD13 LEU B 106 27.375 20.811 15.705 1.00 0.00 H ATOM 3305 H LEU B 106 26.376 17.482 11.794 1.00 0.00 H ATOM 3306 N GLU B 107 22.795 19.006 11.306 1.00 37.77 N ATOM 3307 CA GLU B 107 22.058 19.404 10.123 1.00 41.30 C ATOM 3308 C GLU B 107 21.538 20.779 10.540 1.00 45.01 C ATOM 3309 O GLU B 107 20.613 20.884 11.342 1.00 46.36 O ATOM 3310 CB GLU B 107 20.908 18.411 9.849 1.00 39.63 C ATOM 3311 CG GLU B 107 21.378 16.995 9.502 1.00 37.87 C ATOM 3312 CD GLU B 107 20.329 15.880 9.480 1.00 41.81 C ATOM 3313 OE1 GLU B 107 19.187 16.106 9.881 1.00 44.44 O ATOM 3314 OE2 GLU B 107 20.654 14.758 9.075 1.00 41.63 O ATOM 3315 HA GLU B 107 22.641 19.422 9.202 1.00 0.00 H ATOM 3316 OXT GLU B 107 22.156 21.767 10.153 1.00 53.99 O ATOM 3317 HB2 GLU B 107 20.282 18.356 10.740 1.00 0.00 H ATOM 3318 HB3 GLU B 107 20.318 18.791 9.015 1.00 0.00 H ATOM 3319 HG2 GLU B 107 21.830 17.036 8.511 1.00 0.00 H ATOM 3320 HG3 GLU B 107 22.135 16.715 10.234 1.00 0.00 H ATOM 3321 H GLU B 107 22.261 18.847 12.184 1.00 0.00 H TER 3322 GLU B 107 HETATM 3323 O HOH 1 18.038 -1.286 25.057 1.00 30.04 O HETATM 3324 O HOH 2 -7.640 6.958 18.135 1.00 12.91 O HETATM 3325 O HOH 3 -9.202 5.715 19.794 1.00 35.85 O HETATM 3326 O HOH 4 -5.978 7.734 21.709 1.00 14.65 O HETATM 3327 O HOH 5 -3.205 7.401 22.893 1.00 17.95 O HETATM 3328 O HOH 6 -2.727 7.395 25.680 1.00 11.99 O HETATM 3329 O HOH 7 0.132 7.405 24.634 1.00 18.83 O HETATM 3330 O HOH 8 -3.354 2.434 6.404 1.00 14.18 O HETATM 3331 O HOH 9 4.825 -10.158 1.320 1.00 27.57 O HETATM 3332 O HOH 10 5.379 -12.940 2.551 1.00 39.00 O HETATM 3333 O HOH 11 -1.014 -11.388 5.813 1.00 17.70 O HETATM 3334 O HOH 12 -0.166 -9.860 18.388 1.00 33.13 O HETATM 3335 O HOH 13 13.832 -10.099 22.021 1.00 37.49 O HETATM 3336 O HOH 14 1.431 9.936 3.052 1.00 36.89 O HETATM 3337 O HOH 15 15.685 8.948 6.001 1.00 36.67 O HETATM 3338 O HOH 16 17.176 1.394 10.552 1.00 15.82 O HETATM 3339 O HOH 17 8.395 -0.705 22.676 1.00 13.10 O HETATM 3340 O HOH 18 5.800 -0.859 25.301 1.00 13.27 O HETATM 3341 O HOH 19 4.333 -1.934 28.269 1.00 26.86 O HETATM 3342 O HOH 20 2.103 12.606 15.138 1.00 9.38 O HETATM 3343 O HOH 21 2.422 15.313 15.888 1.00 12.17 O HETATM 3344 O HOH 22 8.039 21.178 14.739 1.00 43.06 O HETATM 3345 O HOH 23 8.746 15.101 20.754 1.00 30.54 O HETATM 3346 O HOH 24 -3.266 15.958 17.981 1.00 34.49 O HETATM 3347 O HOH 25 -4.242 12.348 6.434 1.00 33.54 O HETATM 3348 O HOH 26 10.708 -14.997 12.427 1.00 22.00 O HETATM 3349 O HOH 27 12.746 2.347 26.666 1.00 49.25 O HETATM 3350 O HOH 28 -6.739 -1.670 10.609 1.00 36.08 O HETATM 3351 O HOH 29 -7.987 -2.312 7.289 1.00 54.95 O HETATM 3352 O HOH 30 -4.817 -5.818 7.713 1.00 45.78 O HETATM 3353 O HOH 31 -5.818 -5.163 4.237 1.00 36.81 O HETATM 3354 O HOH 32 -3.109 -10.045 4.838 1.00 45.41 O HETATM 3355 O HOH 33 -2.486 -13.621 5.068 1.00 49.18 O HETATM 3356 O HOH 34 -3.914 -17.634 12.281 1.00 76.09 O HETATM 3357 O HOH 35 1.861 -15.920 16.583 1.00 29.88 O HETATM 3358 O HOH 36 1.344 -11.110 23.930 1.00 45.65 O HETATM 3359 O HOH 37 1.191 -6.412 22.041 1.00 58.89 O HETATM 3360 O HOH 38 0.383 -3.840 21.172 1.00 53.29 O HETATM 3361 O HOH 39 2.924 -4.011 23.546 1.00 45.96 O HETATM 3362 O HOH 40 11.305 -11.789 26.000 1.00 75.26 O HETATM 3363 O HOH 41 12.734 4.528 1.574 1.00 38.47 O HETATM 3364 O HOH 42 7.186 4.922 24.297 1.00 31.93 O HETATM 3365 O HOH 43 -4.468 -9.044 12.127 1.00 70.83 O HETATM 3366 O HOH 44 -2.881 -7.723 9.041 1.00 31.33 O HETATM 3367 O HOH 45 8.664 -10.399 3.135 1.00 51.57 O HETATM 3368 O HOH 46 -3.000 14.447 20.318 1.00 39.33 O HETATM 3369 O HOH 47 -5.577 16.315 15.837 1.00 36.77 O HETATM 3370 O HOH 48 -6.793 12.041 16.709 1.00 35.65 O HETATM 3371 O HOH 49 -6.755 13.336 14.341 1.00 33.95 O HETATM 3372 O HOH 50 -3.823 14.887 11.459 1.00 34.19 O HETATM 3373 O HOH 51 -7.267 12.704 19.753 1.00 40.68 O HETATM 3374 O HOH 52 2.730 15.675 22.843 1.00 42.18 O HETATM 3375 O HOH 53 23.445 0.727 15.361 1.00 45.90 O HETATM 3376 O HOH 54 -6.307 11.543 11.923 1.00 56.52 O HETATM 3377 O HOH 55 -7.029 14.911 22.472 1.00 55.90 O HETATM 3378 O HOH 56 -9.422 4.329 8.927 1.00 39.72 O HETATM 3379 O HOH 57 7.628 -7.194 0.607 1.00 43.79 O HETATM 3380 O HOH 58 3.632 -20.941 7.302 1.00 41.23 O HETATM 3381 O HOH 59 -1.867 -17.409 15.022 1.00 52.85 O HETATM 3382 O HOH 60 -0.512 -17.304 19.363 1.00 51.46 O HETATM 3383 O HOH 61 4.700 -16.126 17.531 1.00 49.71 O HETATM 3384 O HOH 62 6.399 -18.340 18.436 1.00 46.04 O HETATM 3385 O HOH 63 -3.477 -10.342 15.818 1.00 52.62 O HETATM 3386 O HOH 64 11.489 -14.090 21.501 1.00 55.38 O HETATM 3387 O HOH 65 9.829 -15.427 22.275 1.00 58.66 O HETATM 3388 O HOH 66 6.545 -21.217 16.095 1.00 41.74 O HETATM 3389 O HOH 67 7.831 -18.059 21.066 1.00 41.52 O HETATM 3390 O HOH 68 13.444 -5.783 2.452 1.00 58.79 O HETATM 3391 O HOH 69 0.862 15.579 -2.052 1.00 56.60 O HETATM 3392 O HOH 70 9.711 13.583 0.008 1.00 58.82 O HETATM 3393 O HOH 71 18.522 -3.868 26.933 1.00 51.27 O HETATM 3394 O HOH 72 6.216 -1.137 31.879 1.00 49.05 O HETATM 3395 O HOH 73 8.678 5.419 17.438 1.00 24.96 O HETATM 3396 O HOH 74 6.879 21.558 12.308 1.00 38.81 O HETATM 3397 O HOH 75 11.494 -14.587 8.900 1.00 49.20 O HETATM 3398 O HOH 76 -4.069 -13.102 7.398 1.00 55.97 O HETATM 3399 O HOH 77 -4.273 -14.746 9.451 1.00 56.54 O HETATM 3400 O HOH 78 6.000 -19.232 8.337 1.00 55.71 O HETATM 3401 O HOH 79 6.585 -15.382 5.481 1.00 50.27 O HETATM 3402 O HOH 80 8.066 -21.635 8.202 1.00 45.72 O HETATM 3403 O HOH 81 -3.990 -20.177 12.881 1.00 52.86 O HETATM 3404 O HOH 82 4.849 -15.093 26.194 1.00 57.46 O HETATM 3405 O HOH 83 7.813 -8.700 28.584 1.00 56.20 O HETATM 3406 O HOH 84 8.780 -16.247 17.432 1.00 45.42 O HETATM 3407 O HOH 85 17.723 -8.980 19.396 1.00 57.01 O HETATM 3408 O HOH 86 15.020 -2.603 1.230 1.00 44.01 O HETATM 3409 O HOH 87 14.705 11.222 4.534 1.00 58.63 O HETATM 3410 O HOH 88 18.473 -1.789 2.498 1.00 57.02 O HETATM 3411 O HOH 89 -5.625 14.463 17.895 1.00 53.68 O HETATM 3412 O HOH 90 -6.219 19.371 17.740 1.00 58.77 O HETATM 3413 O HOH 91 12.071 -8.049 0.778 1.00 51.37 O HETATM 3414 O HOH 92 9.514 7.270 19.591 1.00 26.07 O HETATM 3415 O HOH 93 12.026 5.125 18.898 1.00 35.66 O HETATM 3416 O HOH 94 15.292 -2.539 21.161 1.00 24.01 O HETATM 3417 O HOH 95 -1.302 -11.132 8.580 1.00 26.69 O HETATM 3418 O HOH 96 -3.811 1.352 -0.283 1.00 49.73 O HETATM 3419 O HOH 97 -11.729 2.138 8.850 1.00 44.63 O HETATM 3420 O HOH 98 -3.920 9.540 5.325 1.00 51.67 O HETATM 3421 O HOH 99 9.756 7.077 12.000 1.00 60.99 O HETATM 3422 O HOH 100 10.716 10.224 14.005 1.00 38.60 O HETATM 3423 O HOH 101 8.752 6.992 14.320 1.00 31.33 O HETATM 3424 O HOH 102 11.097 8.914 17.386 1.00 58.82 O HETATM 3425 O HOH 103 8.862 -1.820 4.313 1.00 50.08 O HETATM 3426 O HOH 104 11.248 5.700 0.020 1.00 51.41 O HETATM 3427 O HOH 105 1.039 15.237 24.004 1.00 38.70 O HETATM 3428 O HOH 106 -0.002 -0.678 23.270 1.00 47.30 O HETATM 3429 O HOH 107 -3.428 14.792 6.783 1.00 43.58 O HETATM 3430 O HOH 108 27.338 14.608 37.645 1.00 25.00 O HETATM 3431 O HOH 109 35.755 9.972 17.087 1.00 47.69 O HETATM 3432 O HOH 110 36.662 16.167 20.942 1.00 20.53 O HETATM 3433 O HOH 111 31.344 25.709 16.473 1.00 45.36 O HETATM 3434 O HOH 112 15.936 25.558 18.499 1.00 37.51 O HETATM 3435 O HOH 113 14.722 1.021 24.946 1.00 24.60 O HETATM 3436 O HOH 114 13.731 18.222 17.936 1.00 16.85 O HETATM 3437 O HOH 115 17.143 20.926 23.333 1.00 29.94 O HETATM 3438 O HOH 116 9.796 18.298 23.066 1.00 20.74 O HETATM 3439 O HOH 117 16.072 17.948 33.747 1.00 30.03 O HETATM 3440 O HOH 118 26.775 23.551 28.171 1.00 47.48 O HETATM 3441 O HOH 119 31.095 11.372 32.686 1.00 21.59 O HETATM 3442 O HOH 120 33.303 11.277 34.511 1.00 46.37 O HETATM 3443 O HOH 121 17.140 10.899 36.806 1.00 10.83 O HETATM 3444 O HOH 122 15.423 10.088 38.865 1.00 18.06 O HETATM 3445 O HOH 123 31.067 18.881 37.209 1.00 53.58 O HETATM 3446 O HOH 124 27.810 20.975 34.898 1.00 57.04 O HETATM 3447 O HOH 125 34.020 19.565 27.858 1.00 51.56 O HETATM 3448 O HOH 126 35.746 16.797 28.620 1.00 52.52 O HETATM 3449 O HOH 127 38.043 13.263 28.914 1.00 44.27 O HETATM 3450 O HOH 128 38.094 15.912 23.886 1.00 53.60 O HETATM 3451 O HOH 129 38.255 6.345 27.358 1.00 42.45 O HETATM 3452 O HOH 130 39.273 5.686 24.587 1.00 58.51 O HETATM 3453 O HOH 131 37.626 4.848 21.535 1.00 48.96 O HETATM 3454 O HOH 132 35.018 4.738 19.964 1.00 46.54 O HETATM 3455 O HOH 133 39.334 17.288 19.314 1.00 41.42 O HETATM 3456 O HOH 134 38.958 22.076 20.276 1.00 31.15 O HETATM 3457 O HOH 135 27.865 22.368 10.589 1.00 56.73 O HETATM 3458 O HOH 136 17.041 -0.277 22.754 1.00 30.07 O HETATM 3459 O HOH 137 16.230 5.978 18.391 1.00 23.29 O HETATM 3460 O HOH 138 17.321 8.634 12.729 1.00 54.11 O HETATM 3461 O HOH 139 16.272 16.028 9.831 1.00 49.26 O HETATM 3462 O HOH 140 9.668 25.223 26.469 1.00 55.03 O HETATM 3463 O HOH 141 14.648 21.368 27.197 1.00 35.89 O HETATM 3464 O HOH 142 35.391 18.466 21.464 1.00 18.19 O HETATM 3465 O HOH 143 13.637 17.364 37.310 1.00 47.99 O HETATM 3466 O HOH 144 16.714 2.325 42.537 1.00 55.43 O HETATM 3467 O HOH 145 16.661 13.876 43.455 1.00 48.29 O HETATM 3468 O HOH 146 27.786 17.884 10.501 1.00 43.66 O HETATM 3469 O HOH 147 9.238 6.661 22.639 1.00 34.69 O HETATM 3470 O HOH 148 40.040 19.960 21.278 1.00 56.22 O HETATM 3471 O HOH 149 17.643 22.558 11.295 1.00 50.08 O HETATM 3472 O HOH 150 23.909 -0.545 23.471 1.00 51.56 O HETATM 3473 O HOH 151 22.467 3.552 12.500 1.00 30.38 O HETATM 3474 O HOH 152 9.480 22.495 29.778 1.00 53.83 O HETATM 3475 O HOH 153 18.162 22.105 37.798 1.00 52.87 O HETATM 3476 O HOH 154 6.479 9.214 38.797 1.00 45.00 O HETATM 3477 O HOH 155 7.545 5.424 39.469 1.00 55.64 O HETATM 3478 O HOH 156 21.390 5.109 40.011 1.00 58.49 O HETATM 3479 O HOH 157 16.013 10.536 8.434 1.00 58.99 O HETATM 3480 O HOH 158 21.068 -5.065 13.292 1.00 43.83 O HETATM 3481 O HOH 159 27.907 16.833 38.874 1.00 52.78 O HETATM 3482 O HOH 160 28.654 9.390 40.214 1.00 54.80 O HETATM 3483 O HOH 161 29.508 20.488 32.560 1.00 53.14 O HETATM 3484 O HOH 162 30.540 3.119 17.965 1.00 51.99 O HETATM 3485 O HOH 163 40.484 14.792 16.708 1.00 58.93 O HETATM 3486 O HOH 164 38.630 14.471 13.000 1.00 58.44 O HETATM 3487 O HOH 165 14.001 7.983 17.376 1.00 26.21 O HETATM 3488 O HOH 166 14.600 10.680 16.333 1.00 32.57 O HETATM 3489 O HOH 167 6.215 6.978 22.243 1.00 52.75 O HETATM 3490 O HOH 168 22.989 -1.408 16.200 1.00 51.84 O HETATM 3491 O HOH 169 21.203 -3.662 16.709 1.00 54.16 O HETATM 3492 O HOH 170 16.675 -4.398 19.788 1.00 52.22 O HETATM 3493 O HOH 171 27.863 5.469 15.724 1.00 41.89 O HETATM 3494 O HOH 172 25.591 1.287 16.240 1.00 58.16 O HETATM 3495 O HOH 173 17.123 21.778 29.132 1.00 53.55 O HETATM 3496 O HOH 174 13.191 10.700 13.066 1.00 39.66 O HETATM 3497 O HOH 175 17.606 5.490 42.380 1.00 51.91 O HETATM 3498 O HOH 176 10.382 5.012 13.383 1.00 42.31 O HETATM 3499 O HOH 177 11.194 5.540 16.024 1.00 55.61 O HETATM 3500 O1 FKA A 178 14.479 12.414 26.578 1.00 -0.26 O HETATM 3501 C1 FKA A 178 15.550 12.969 27.131 1.00 0.26 C HETATM 3502 O2 FKA A 178 15.566 14.161 27.468 1.00 -0.37 O HETATM 3503 C2 FKA A 178 16.763 12.080 27.320 1.00 0.15 C HETATM 3504 C3 FKA A 178 17.895 12.564 26.452 1.00 -0.01 C HETATM 3505 C4 FKA A 178 17.793 12.159 24.986 1.00 -0.05 C HETATM 3506 C5 FKA A 178 17.554 10.681 24.857 1.00 -0.03 C HETATM 3507 C6 FKA A 178 16.245 10.450 25.541 1.00 0.04 C HETATM 3508 N1 FKA A 178 16.503 10.688 26.949 1.00 -0.24 N HETATM 3509 C7 FKA A 178 16.340 9.736 27.856 1.00 0.28 C HETATM 3510 O3 FKA A 178 16.397 10.078 29.041 1.00 -0.36 O HETATM 3511 C8 FKA A 178 16.118 8.389 27.484 1.00 0.29 C HETATM 3512 O4 FKA A 178 17.058 7.635 27.219 1.00 -0.29 O HETATM 3513 C9 FKA A 178 14.721 7.802 27.373 1.00 0.25 C HETATM 3514 C10 FKA A 178 13.692 8.483 28.290 1.00 0.02 C HETATM 3515 C11 FKA A 178 12.308 8.188 27.750 1.00 -0.02 C HETATM 3516 C12 FKA A 178 12.119 8.372 26.248 1.00 0.09 C HETATM 3517 C13 FKA A 178 13.190 7.541 25.502 1.00 0.11 C HETATM 3518 O5 FKA A 178 14.453 8.018 25.985 1.00 -0.34 O HETATM 3519 C14 FKA A 178 13.249 7.712 23.968 1.00 0.09 C HETATM 3520 O8 FKA A 178 12.228 6.950 23.315 1.00 -0.38 O HETATM 3521 C43 FKA A 178 12.605 5.571 23.152 1.00 0.04 C HETATM 3522 H23 FKA A 178 11.793 5.026 22.648 1.00 0.05 H HETATM 3523 H24 FKA A 178 12.790 5.122 24.139 1.00 0.05 H HETATM 3524 H25 FKA A 178 13.520 5.510 22.544 1.00 0.05 H HETATM 3525 C15 FKA A 178 13.163 9.195 23.575 1.00 -0.02 C HETATM 3526 C16 FKA A 178 13.344 9.553 22.085 1.00 -0.03 C HETATM 3527 C35 FKA A 178 14.533 8.794 21.508 1.00 -0.06 C HETATM 3528 H29 FKA A 178 14.654 9.055 20.446 1.00 0.02 H HETATM 3529 H30 FKA A 178 14.358 7.712 21.602 1.00 0.02 H HETATM 3530 H31 FKA A 178 15.445 9.067 22.059 1.00 0.02 H HETATM 3531 C17 FKA A 178 12.030 9.244 21.317 1.00 -0.03 C HETATM 3532 C18 FKA A 178 10.973 10.346 21.499 1.00 -0.08 C HETATM 3533 C36 FKA A 178 11.071 11.475 20.469 1.00 -0.04 C HETATM 3534 H34 FKA A 178 10.286 12.220 20.665 1.00 0.04 H HETATM 3535 H35 FKA A 178 10.940 11.062 19.458 1.00 0.04 H HETATM 3536 H36 FKA A 178 12.058 11.955 20.544 1.00 0.04 H HETATM 3537 C19 FKA A 178 10.081 10.301 22.478 1.00 -0.09 C HETATM 3538 C20 FKA A 178 9.121 11.418 22.788 1.00 0.04 C HETATM 3539 C37 FKA A 178 7.764 10.888 23.169 1.00 -0.00 C HETATM 3540 C51 FKA A 178 6.904 10.509 21.949 1.00 0.08 C HETATM 3541 O17 FKA A 178 5.696 10.180 22.399 1.00 -0.26 O HETATM 3542 C50 FKA A 178 4.788 11.061 22.065 1.00 0.32 C HETATM 3543 O23 FKA A 178 5.066 12.142 21.547 1.00 -0.38 O HETATM 3544 N2 FKA A 178 3.552 10.661 22.375 1.00 -0.25 N HETATM 3545 C49 FKA A 178 2.460 11.481 21.903 1.00 0.07 C HETATM 3546 C47 FKA A 178 1.166 11.497 22.559 1.00 -0.02 C HETATM 3547 C46 FKA A 178 1.205 11.491 23.943 1.00 -0.06 C HETATM 3548 C45 FKA A 178 0.035 11.492 24.671 1.00 -0.07 C HETATM 3549 C39 FKA A 178 -1.181 11.490 24.027 1.00 -0.07 C HETATM 3550 C38 FKA A 178 -1.218 11.498 22.648 1.00 -0.07 C HETATM 3551 C48 FKA A 178 -0.050 11.496 21.906 1.00 -0.06 C HETATM 3552 H76 FKA A 178 -0.090 11.494 20.823 1.00 0.06 H HETATM 3553 H75 FKA A 178 -2.175 11.506 22.139 1.00 0.06 H HETATM 3554 H74 FKA A 178 -2.102 11.482 24.598 1.00 0.06 H HETATM 3555 H73 FKA A 178 0.073 11.494 25.754 1.00 0.06 H HETATM 3556 H72 FKA A 178 2.160 11.486 24.456 1.00 0.06 H HETATM 3557 H70 FKA A 178 2.273 11.175 20.863 1.00 0.07 H HETATM 3558 H71 FKA A 178 2.825 12.518 21.920 1.00 0.07 H HETATM 3559 H69 FKA A 178 3.390 9.832 22.910 1.00 0.19 H HETATM 3560 H67 FKA A 178 7.354 9.655 21.423 1.00 0.06 H HETATM 3561 H68 FKA A 178 6.829 11.365 21.262 1.00 0.06 H HETATM 3562 H39 FKA A 178 7.234 11.661 23.745 1.00 0.03 H HETATM 3563 H40 FKA A 178 7.900 9.993 23.794 1.00 0.03 H HETATM 3564 C21 FKA A 178 9.680 12.169 23.972 1.00 0.11 C HETATM 3565 O9 FKA A 178 9.427 11.856 25.139 1.00 -0.39 O HETATM 3566 C22 FKA A 178 10.591 13.321 23.616 1.00 0.05 C HETATM 3567 C23 FKA A 178 11.472 13.778 24.754 1.00 0.08 C HETATM 3568 O10 FKA A 178 11.973 15.022 24.298 1.00 -0.39 O HETATM 3569 H44 FKA A 178 12.547 15.392 24.958 1.00 0.21 H HETATM 3570 C24 FKA A 178 12.706 12.854 25.037 1.00 0.02 C HETATM 3571 C40 FKA A 178 13.763 12.882 23.936 1.00 -0.06 C HETATM 3572 H46 FKA A 178 14.592 12.212 24.207 1.00 0.02 H HETATM 3573 H47 FKA A 178 14.143 13.907 23.819 1.00 0.02 H HETATM 3574 H48 FKA A 178 13.315 12.547 22.989 1.00 0.02 H HETATM 3575 C25 FKA A 178 13.431 13.346 26.287 1.00 0.12 C HETATM 3576 C26 FKA A 178 12.529 13.386 27.494 1.00 -0.05 C HETATM 3577 C41 FKA A 178 11.939 12.077 28.018 1.00 -0.04 C HETATM 3578 H50 FKA A 178 11.309 12.284 28.896 1.00 0.04 H HETATM 3579 H51 FKA A 178 12.754 11.396 28.304 1.00 0.04 H HETATM 3580 H52 FKA A 178 11.329 11.609 27.232 1.00 0.04 H HETATM 3581 C27 FKA A 178 12.301 14.550 28.033 1.00 -0.10 C HETATM 3582 C28 FKA A 178 11.406 14.692 29.233 1.00 -0.03 C HETATM 3583 C29 FKA A 178 12.113 15.514 30.294 1.00 -0.02 C HETATM 3584 C30 FKA A 178 11.243 15.818 31.474 1.00 0.09 C HETATM 3585 C31 FKA A 178 10.016 16.573 30.986 1.00 0.08 C HETATM 3586 C32 FKA A 178 9.271 15.779 29.939 1.00 -0.02 C HETATM 3587 C33 FKA A 178 10.150 15.404 28.772 1.00 -0.04 C HETATM 3588 H61 FKA A 178 9.588 14.739 28.100 1.00 0.03 H HETATM 3589 H62 FKA A 178 10.435 16.318 28.230 1.00 0.03 H HETATM 3590 H59 FKA A 178 8.430 16.384 29.569 1.00 0.03 H HETATM 3591 H60 FKA A 178 8.885 14.858 30.401 1.00 0.03 H HETATM 3592 O12 FKA A 178 9.151 16.789 32.097 1.00 -0.39 O HETATM 3593 H66 FKA A 178 9.610 17.288 32.762 1.00 0.21 H HETATM 3594 H58 FKA A 178 10.326 17.538 30.559 1.00 0.06 H HETATM 3595 O11 FKA A 178 11.858 16.551 32.535 1.00 -0.38 O HETATM 3596 C44 FKA A 178 12.649 15.747 33.430 1.00 0.04 C HETATM 3597 H63 FKA A 178 13.083 16.388 34.212 1.00 0.05 H HETATM 3598 H64 FKA A 178 13.457 15.258 32.866 1.00 0.05 H HETATM 3599 H65 FKA A 178 12.011 14.981 33.896 1.00 0.05 H HETATM 3600 H57 FKA A 178 10.917 14.855 31.894 1.00 0.06 H HETATM 3601 H55 FKA A 178 12.437 16.464 29.843 1.00 0.03 H HETATM 3602 H56 FKA A 178 12.993 14.954 30.642 1.00 0.03 H HETATM 3603 H54 FKA A 178 11.152 13.702 29.639 1.00 0.04 H HETATM 3604 H53 FKA A 178 12.767 15.437 27.606 1.00 0.02 H HETATM 3605 H49 FKA A 178 13.845 14.348 26.101 1.00 0.08 H HETATM 3606 H45 FKA A 178 12.349 11.823 25.179 1.00 0.04 H HETATM 3607 H43 FKA A 178 10.879 13.889 25.674 1.00 0.06 H HETATM 3608 H41 FKA A 178 9.968 14.170 23.298 1.00 0.05 H HETATM 3609 H42 FKA A 178 11.237 13.007 22.782 1.00 0.05 H HETATM 3610 H38 FKA A 178 9.028 12.084 21.917 1.00 0.06 H HETATM 3611 H37 FKA A 178 10.040 9.404 23.094 1.00 0.03 H HETATM 3612 H32 FKA A 178 11.618 8.294 21.689 1.00 0.04 H HETATM 3613 H33 FKA A 178 12.261 9.149 20.246 1.00 0.04 H HETATM 3614 H28 FKA A 178 13.549 10.630 22.002 1.00 0.03 H HETATM 3615 H26 FKA A 178 13.942 9.730 24.139 1.00 0.03 H HETATM 3616 H27 FKA A 178 12.172 9.560 23.883 1.00 0.03 H HETATM 3617 H22 FKA A 178 14.222 7.330 23.626 1.00 0.06 H HETATM 3618 H14 FKA A 178 13.047 6.476 25.740 1.00 0.06 H HETATM 3619 O7 FKA A 178 10.767 8.036 25.881 1.00 -0.38 O HETATM 3620 C42 FKA A 178 9.834 9.072 26.279 1.00 0.04 C HETATM 3621 H19 FKA A 178 8.815 8.781 25.983 1.00 0.05 H HETATM 3622 H20 FKA A 178 10.103 10.017 25.785 1.00 0.05 H HETATM 3623 H21 FKA A 178 9.876 9.203 27.370 1.00 0.05 H HETATM 3624 H13 FKA A 178 12.280 9.431 26.000 1.00 0.06 H HETATM 3625 H11 FKA A 178 11.599 8.855 28.262 1.00 0.03 H HETATM 3626 H12 FKA A 178 12.069 7.142 27.993 1.00 0.03 H HETATM 3627 C34 FKA A 178 13.800 8.004 29.730 1.00 -0.06 C HETATM 3628 H16 FKA A 178 14.807 8.222 30.114 1.00 0.02 H HETATM 3629 H17 FKA A 178 13.619 6.920 29.770 1.00 0.02 H HETATM 3630 H18 FKA A 178 13.052 8.524 30.346 1.00 0.02 H HETATM 3631 H10 FKA A 178 13.865 9.569 28.271 1.00 0.03 H HETATM 3632 O6 FKA A 178 14.706 6.419 27.680 1.00 -0.36 O HETATM 3633 H15 FKA A 178 15.371 5.975 27.167 1.00 0.21 H HETATM 3634 H8 FKA A 178 15.903 9.417 25.381 1.00 0.05 H HETATM 3635 H9 FKA A 178 15.485 11.150 25.165 1.00 0.05 H HETATM 3636 H6 FKA A 178 18.356 10.113 25.351 1.00 0.03 H HETATM 3637 H7 FKA A 178 17.496 10.388 23.798 1.00 0.03 H HETATM 3638 H4 FKA A 178 18.731 12.419 24.474 1.00 0.03 H HETATM 3639 H5 FKA A 178 16.958 12.702 24.519 1.00 0.03 H HETATM 3640 H2 FKA A 178 18.834 12.157 26.855 1.00 0.03 H HETATM 3641 H3 FKA A 178 17.920 13.662 26.503 1.00 0.03 H HETATM 3642 H1 FKA A 178 17.065 12.120 28.377 1.00 0.08 H 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 3500 3501 3575 CONECT 3501 3500 3502 3503 CONECT 3502 3501 CONECT 3503 3501 3504 3508 3642 CONECT 3504 3503 3505 3640 3641 CONECT 3505 3504 3506 3638 3639 CONECT 3506 3505 3507 3636 3637 CONECT 3507 3506 3508 3634 3635 CONECT 3508 3503 3507 3509 CONECT 3509 3508 3510 3511 CONECT 3510 3509 CONECT 3511 3509 3512 3513 CONECT 3512 3511 CONECT 3513 3511 3514 3518 3632 CONECT 3514 3513 3515 3627 3631 CONECT 3515 3514 3516 3625 3626 CONECT 3516 3515 3517 3619 3624 CONECT 3517 3516 3518 3519 3618 CONECT 3518 3513 3517 CONECT 3519 3517 3520 3525 3617 CONECT 3520 3519 3521 CONECT 3521 3520 3522 3523 3524 CONECT 3522 3521 CONECT 3523 3521 CONECT 3524 3521 CONECT 3525 3519 3526 3615 3616 CONECT 3526 3525 3527 3531 3614 CONECT 3527 3526 3528 3529 3530 CONECT 3528 3527 CONECT 3529 3527 CONECT 3530 3527 CONECT 3531 3526 3532 3612 3613 CONECT 3532 3531 3533 3537 CONECT 3533 3532 3534 3535 3536 CONECT 3534 3533 CONECT 3535 3533 CONECT 3536 3533 CONECT 3537 3532 3538 3611 CONECT 3538 3537 3539 3564 3610 CONECT 3539 3538 3540 3562 3563 CONECT 3540 3539 3541 3560 3561 CONECT 3541 3540 3542 CONECT 3542 3541 3543 3544 CONECT 3543 3542 CONECT 3544 3542 3545 3559 CONECT 3545 3544 3546 3557 3558 CONECT 3546 3545 3547 3551 CONECT 3547 3546 3548 3556 CONECT 3548 3547 3549 3555 CONECT 3549 3548 3550 3554 CONECT 3550 3549 3551 3553 CONECT 3551 3546 3550 3552 CONECT 3552 3551 CONECT 3553 3550 CONECT 3554 3549 CONECT 3555 3548 CONECT 3556 3547 CONECT 3557 3545 CONECT 3558 3545 CONECT 3559 3544 CONECT 3560 3540 CONECT 3561 3540 CONECT 3562 3539 CONECT 3563 3539 CONECT 3564 3538 3565 3566 CONECT 3565 3564 CONECT 3566 3564 3567 3608 3609 CONECT 3567 3566 3568 3570 3607 CONECT 3568 3567 3569 CONECT 3569 3568 CONECT 3570 3567 3571 3575 3606 CONECT 3571 3570 3572 3573 3574 CONECT 3572 3571 CONECT 3573 3571 CONECT 3574 3571 CONECT 3575 3500 3570 3576 3605 CONECT 3576 3575 3577 3581 CONECT 3577 3576 3578 3579 3580 CONECT 3578 3577 CONECT 3579 3577 CONECT 3580 3577 CONECT 3581 3576 3582 3604 CONECT 3582 3581 3583 3587 3603 CONECT 3583 3582 3584 3601 3602 CONECT 3584 3583 3585 3595 3600 CONECT 3585 3584 3586 3592 3594 CONECT 3586 3585 3587 3590 3591 CONECT 3587 3582 3586 3588 3589 CONECT 3588 3587 CONECT 3589 3587 CONECT 3590 3586 CONECT 3591 3586 CONECT 3592 3585 3593 CONECT 3593 3592 CONECT 3594 3585 CONECT 3595 3584 3596 CONECT 3596 3595 3597 3598 3599 CONECT 3597 3596 CONECT 3598 3596 CONECT 3599 3596 CONECT 3600 3584 CONECT 3601 3583 CONECT 3602 3583 CONECT 3603 3582 CONECT 3604 3581 CONECT 3605 3575 CONECT 3606 3570 CONECT 3607 3567 CONECT 3608 3566 CONECT 3609 3566 CONECT 3610 3538 CONECT 3611 3537 CONECT 3612 3531 CONECT 3613 3531 CONECT 3614 3526 CONECT 3615 3525 CONECT 3616 3525 CONECT 3617 3519 CONECT 3618 3517 CONECT 3619 3516 3620 CONECT 3620 3619 3621 3622 3623 CONECT 3621 3620 CONECT 3622 3620 CONECT 3623 3620 CONECT 3624 3516 CONECT 3625 3515 CONECT 3626 3515 CONECT 3627 3514 3628 3629 3630 CONECT 3628 3627 CONECT 3629 3627 CONECT 3630 3627 CONECT 3631 3514 CONECT 3632 3513 3633 CONECT 3633 3632 CONECT 3634 3507 CONECT 3635 3507 CONECT 3636 3506 CONECT 3637 3506 CONECT 3638 3505 CONECT 3639 3505 CONECT 3640 3504 CONECT 3641 3504 CONECT 3642 3503 MASTER 0 0 0 0 0 0 0 0 3640 2 151 18 END
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Related entries of code: 1a7x
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1b6c
RCSB PDB
PDBbind
107aa, >1B6C_1|Chains... at 100%
1bl4
RCSB PDB
PDBbind
107aa, >1BL4_1|Chains... at 99%
1d7i
RCSB PDB
PDBbind
107aa, >1D7I_1|Chains... at 100%
1d7j
RCSB PDB
PDBbind
107aa, >1D7J_1|Chains... at 100%
1f40
RCSB PDB
PDBbind
107aa, >1F40_1|Chain... at 100%
1fkb
RCSB PDB
PDBbind
107aa, >1FKB_1|Chain... at 100%
1fkf
RCSB PDB
PDBbind
107aa, >1FKF_1|Chain... at 100%
1fkg
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
107aa, >1QPF_1|Chains... at 100%
1qpl
RCSB PDB
PDBbind
107aa, >1QPL_1|Chains... at 100%
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
1a7x
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
FK506 binding protein
Ligand Name
FKA
EC.Number
E.C.5.2.1.8
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=0.2nM
Release Year
1998
Protein/NA Sequence
Check fasta file
Primary Reference
Bioorg.Med.Chem.Lett. v8 pp. 1-6, 1998
Ligand Properties
Formula
C
5
1
H
7
6
N
2
O
1
4
Molecular Weight
941.154
Exact Mass
940.530
No. of atoms
143
No. of bonds
147
Polar Surface Area
216.69
LOGP Value
5.99 (
Computed with XLOGP3
)
5.78 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 5
Canonical SMILES
CO[C@H]1C[C@@H](C)C/C(=C/[C@@H](CCOC(=O)NCc2ccccc2)C(=O)C[C@H](O)[C@H]([C@H](OC(=O)[C@H]2N(/[C](=[C](\O)/[C@@]3(O[C@H]1[C@@H](OC)C[C@H]3C)O)/O)CCCC2)/C(=C/[C@@H]1CC[C@H]([C@@H](C1)OC)O)/C)C)/C
InChI String
InChI=1S/C51H76N2O14/c1-30-22-31(2)24-43(63-7)46-44(64-8)26-33(4)51(61,67-46)47(57)48(58)53-20-13-12-16-38(53)49(59)66-45(32(3)25-36-17-18-39(54)42(27-36)62-6)34(5)40(55)28-41(56)37(23-30)19-21-65-50(60)52-29-35-14-10-9-11-15-35/h9-11,14-15,23,25,31,33-34,36-40,42-46,54-55,61H,12-13,16-22,24,26-29H2,1-8H3,(H,52,60)/b30-23+,32-25+/t31-,33+,34+,36-,37+,38-,39+,40-,42+,43-,44-,45+,46+,51+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62942
Entrez Gene ID
NCBI Entrez Gene ID:
2280
ASD
Information of known allosteric effects of PDB entries
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