Browse entries in the PDBbind-CN Database
HEADER 4KTC_COMPLEX COMPND 4KTC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 175 ALA PRO ILE THR ALA TYR SER GLN GLN THR ARG GLY LEU SEQRES 2 A 175 LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG ASP LYS SEQRES 3 A 175 ASN GLN VAL ASP GLY GLU VAL GLN VAL LEU SER THR ALA SEQRES 4 A 175 THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY VAL CYS SEQRES 5 A 175 TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR LEU ALA SEQRES 6 A 175 GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR ASN VAL SEQRES 7 A 175 ASP GLN ASP LEU VAL GLY TRP PRO ALA PRO PRO GLY ALA SEQRES 8 A 175 ARG SER MET THR PRO CYS THR CYS GLY SER SER ASP LEU SEQRES 9 A 175 TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO VAL ARG SEQRES 10 A 175 ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER PRO ARG SEQRES 11 A 175 PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY PRO LEU SEQRES 12 A 175 LEU CYS PRO SER GLY HIS VAL VAL GLY ILE PHE ARG ALA SEQRES 13 A 175 ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL ASP PHE SEQRES 14 A 175 ILE PRO VAL GLU SER MET HET ZN A 1 1 HET UNN A 193 103 ATOM 1 N ALA A 1 26.572 31.874 93.749 1.00 89.61 N ATOM 2 CA ALA A 1 27.244 32.894 92.887 1.00 90.73 C ATOM 3 C ALA A 1 28.197 32.244 91.872 1.00 89.90 C ATOM 4 O ALA A 1 29.295 31.812 92.250 1.00 91.09 O ATOM 5 CB ALA A 1 27.991 33.899 93.750 1.00 88.16 C ATOM 6 HA ALA A 1 26.470 33.414 92.322 1.00 0.00 H ATOM 7 HB1 ALA A 1 27.287 34.400 94.414 1.00 0.00 H ATOM 8 HB2 ALA A 1 28.744 33.379 94.342 1.00 0.00 H ATOM 9 HB3 ALA A 1 28.476 34.636 93.110 1.00 0.00 H ATOM 10 HN3 ALA A 1 27.292 31.337 94.273 1.00 0.00 H ATOM 11 HN2 ALA A 1 26.021 31.226 93.151 1.00 0.00 H ATOM 12 HN1 ALA A 1 25.938 32.353 94.420 1.00 0.00 H ATOM 13 N PRO A 2 27.789 32.176 90.580 1.00 82.90 N ATOM 14 CA PRO A 2 28.651 31.539 89.583 1.00 76.35 C ATOM 15 C PRO A 2 29.788 32.473 89.144 1.00 70.04 C ATOM 16 O PRO A 2 29.874 32.846 87.970 1.00 72.86 O ATOM 17 CB PRO A 2 27.687 31.229 88.430 1.00 75.81 C ATOM 18 CG PRO A 2 26.614 32.262 88.540 1.00 78.21 C ATOM 19 CD PRO A 2 26.570 32.749 89.968 1.00 82.74 C ATOM 20 HA PRO A 2 29.155 30.649 89.960 1.00 0.00 H ATOM 21 HD3 PRO A 2 26.592 33.838 90.007 1.00 0.00 H ATOM 22 HD2 PRO A 2 25.675 32.386 90.474 1.00 0.00 H ATOM 23 HG3 PRO A 2 25.653 31.826 88.269 1.00 0.00 H ATOM 24 HG2 PRO A 2 26.834 33.095 87.873 1.00 0.00 H ATOM 25 HB2 PRO A 2 28.198 31.307 87.470 1.00 0.00 H ATOM 26 HB3 PRO A 2 27.269 30.228 88.537 1.00 0.00 H ATOM 27 N ILE A 3 30.636 32.849 90.102 1.00 60.01 N ATOM 28 CA ILE A 3 31.808 33.678 89.846 1.00 49.71 C ATOM 29 C ILE A 3 33.003 32.781 89.549 1.00 46.06 C ATOM 30 O ILE A 3 33.349 31.914 90.350 1.00 43.56 O ATOM 31 CB ILE A 3 32.133 34.628 91.020 1.00 49.97 C ATOM 32 CG1 ILE A 3 30.918 35.512 91.348 1.00 51.11 C ATOM 33 CG2 ILE A 3 33.342 35.501 90.684 1.00 48.22 C ATOM 34 CD1 ILE A 3 31.082 36.396 92.571 1.00 51.74 C ATOM 35 HA ILE A 3 31.586 34.309 88.985 1.00 0.00 H ATOM 36 HB ILE A 3 32.372 34.022 91.894 1.00 0.00 H ATOM 37 HG12 ILE A 3 30.725 36.154 90.489 1.00 0.00 H ATOM 38 HG13 ILE A 3 30.060 34.861 91.513 1.00 0.00 H ATOM 39 HD11 ILE A 3 31.262 35.773 93.447 1.00 0.00 H ATOM 40 HD12 ILE A 3 31.927 37.068 92.422 1.00 0.00 H ATOM 41 HD13 ILE A 3 30.174 36.980 92.720 1.00 0.00 H ATOM 42 HG21 ILE A 3 34.206 34.865 90.493 1.00 0.00 H ATOM 43 HG22 ILE A 3 33.124 36.096 89.797 1.00 0.00 H ATOM 44 HG23 ILE A 3 33.555 36.163 91.523 1.00 0.00 H ATOM 45 H ILE A 3 30.453 32.537 91.077 1.00 0.00 H ATOM 46 N THR A 4 33.602 32.994 88.378 1.00 41.97 N ATOM 47 CA THR A 4 34.812 32.306 87.948 1.00 41.68 C ATOM 48 C THR A 4 35.890 33.333 87.554 1.00 41.44 C ATOM 49 O THR A 4 35.609 34.522 87.374 1.00 40.23 O ATOM 50 CB THR A 4 34.535 31.383 86.737 1.00 42.84 C ATOM 51 OG1 THR A 4 33.864 32.135 85.717 1.00 41.76 O ATOM 52 CG2 THR A 4 33.685 30.165 87.136 1.00 39.85 C ATOM 53 HA THR A 4 35.160 31.697 88.782 1.00 0.00 H ATOM 54 HB THR A 4 35.488 31.010 86.362 1.00 0.00 H ATOM 55 HG1 THR A 4 33.685 31.548 84.940 1.00 0.00 H ATOM 56 HG23 THR A 4 34.203 29.600 87.911 1.00 0.00 H ATOM 57 HG21 THR A 4 32.721 30.505 87.515 1.00 0.00 H ATOM 58 HG22 THR A 4 33.531 29.530 86.264 1.00 0.00 H ATOM 59 H THR A 4 33.181 33.693 87.733 1.00 0.00 H ATOM 60 N ALA A 5 37.124 32.865 87.415 1.00 41.44 N ATOM 61 CA ALA A 5 38.239 33.746 87.098 1.00 41.76 C ATOM 62 C ALA A 5 39.178 33.067 86.113 1.00 42.07 C ATOM 63 O ALA A 5 39.244 31.841 86.049 1.00 42.77 O ATOM 64 CB ALA A 5 38.981 34.136 88.370 1.00 41.67 C ATOM 65 HA ALA A 5 37.852 34.654 86.636 1.00 0.00 H ATOM 66 HB1 ALA A 5 38.298 34.653 89.044 1.00 0.00 H ATOM 67 HB2 ALA A 5 39.363 33.238 88.856 1.00 0.00 H ATOM 68 HB3 ALA A 5 39.812 34.795 88.117 1.00 0.00 H ATOM 69 H ALA A 5 37.298 31.847 87.535 1.00 0.00 H ATOM 70 N TYR A 6 39.908 33.860 85.344 1.00 43.46 N ATOM 71 CA TYR A 6 40.867 33.305 84.403 1.00 44.34 C ATOM 72 C TYR A 6 42.082 34.208 84.367 1.00 45.10 C ATOM 73 O TYR A 6 41.947 35.412 84.150 1.00 43.50 O ATOM 74 CB TYR A 6 40.231 33.160 83.013 1.00 45.83 C ATOM 75 CG TYR A 6 41.190 32.744 81.919 1.00 51.02 C ATOM 76 CD1 TYR A 6 42.015 33.685 81.291 1.00 53.55 C ATOM 77 CD2 TYR A 6 41.276 31.413 81.510 1.00 54.68 C ATOM 78 CE1 TYR A 6 42.902 33.311 80.296 1.00 57.52 C ATOM 79 CE2 TYR A 6 42.162 31.027 80.511 1.00 58.53 C ATOM 80 CZ TYR A 6 42.970 31.982 79.908 1.00 59.83 C ATOM 81 OH TYR A 6 43.849 31.614 78.917 1.00 62.88 O ATOM 82 HA TYR A 6 41.173 32.308 84.721 1.00 0.00 H ATOM 83 HB3 TYR A 6 39.796 34.120 82.736 1.00 0.00 H ATOM 84 HB2 TYR A 6 39.442 32.410 83.077 1.00 0.00 H ATOM 85 HD2 TYR A 6 40.639 30.664 81.981 1.00 0.00 H ATOM 86 HE2 TYR A 6 42.222 29.983 80.203 1.00 0.00 H ATOM 87 HE1 TYR A 6 43.542 34.055 79.822 1.00 0.00 H ATOM 88 HD1 TYR A 6 41.958 34.731 81.591 1.00 0.00 H ATOM 89 HH TYR A 6 44.341 32.413 78.601 1.00 0.00 H ATOM 90 H TYR A 6 39.794 34.891 85.414 1.00 0.00 H ATOM 91 N SER A 7 43.266 33.632 84.579 1.00 47.19 N ATOM 92 CA SER A 7 44.500 34.422 84.620 1.00 46.89 C ATOM 93 C SER A 7 45.182 34.489 83.265 1.00 46.96 C ATOM 94 O SER A 7 45.329 33.478 82.575 1.00 47.18 O ATOM 95 CB SER A 7 45.473 33.866 85.660 1.00 49.42 C ATOM 96 OG SER A 7 45.932 32.583 85.291 1.00 52.08 O ATOM 97 HA SER A 7 44.213 35.435 84.903 1.00 0.00 H ATOM 98 HB2 SER A 7 44.966 33.800 86.623 1.00 0.00 H ATOM 99 HB3 SER A 7 46.326 34.539 85.745 1.00 0.00 H ATOM 100 HG SER A 7 46.397 32.638 84.419 1.00 0.00 H ATOM 101 H SER A 7 43.315 32.602 84.718 1.00 0.00 H ATOM 102 N GLN A 8 45.587 35.691 82.881 1.00 45.53 N ATOM 103 CA GLN A 8 46.332 35.863 81.649 1.00 47.86 C ATOM 104 C GLN A 8 47.615 36.632 81.902 1.00 45.33 C ATOM 105 O GLN A 8 47.591 37.790 82.316 1.00 46.38 O ATOM 106 CB GLN A 8 45.496 36.552 80.564 1.00 48.94 C ATOM 107 CG GLN A 8 46.097 36.401 79.170 1.00 50.39 C ATOM 108 CD GLN A 8 45.834 37.601 78.275 1.00 54.66 C ATOM 109 OE1 GLN A 8 45.298 38.627 78.712 1.00 54.13 O ATOM 110 NE2 GLN A 8 46.213 37.477 77.010 1.00 54.61 N ATOM 111 HA GLN A 8 46.585 34.868 81.282 1.00 0.00 H ATOM 112 HB2 GLN A 8 44.498 36.114 80.563 1.00 0.00 H ATOM 113 HB3 GLN A 8 45.425 37.614 80.800 1.00 0.00 H ATOM 114 HG2 GLN A 8 47.175 36.271 79.269 1.00 0.00 H ATOM 115 HG3 GLN A 8 45.667 35.516 78.700 1.00 0.00 H ATOM 116 HE22 GLN A 8 46.660 36.596 76.685 1.00 0.00 H ATOM 117 HE21 GLN A 8 46.063 38.261 76.343 1.00 0.00 H ATOM 118 H GLN A 8 45.368 36.520 83.470 1.00 0.00 H ATOM 119 N GLN A 9 48.728 35.959 81.653 1.00 44.99 N ATOM 120 CA GLN A 9 50.046 36.553 81.756 1.00 45.17 C ATOM 121 C GLN A 9 50.242 37.480 80.561 1.00 43.59 C ATOM 122 O GLN A 9 50.009 37.084 79.422 1.00 44.12 O ATOM 123 CB GLN A 9 51.097 35.434 81.768 1.00 46.05 C ATOM 124 CG GLN A 9 52.544 35.890 81.722 1.00 49.28 C ATOM 125 CD GLN A 9 53.527 34.805 82.154 1.00 54.32 C ATOM 126 OE1 GLN A 9 54.701 34.832 81.771 1.00 55.71 O ATOM 127 NE2 GLN A 9 53.059 33.852 82.956 1.00 53.31 N ATOM 128 HA GLN A 9 50.151 37.129 82.675 1.00 0.00 H ATOM 129 HB2 GLN A 9 50.957 34.853 82.679 1.00 0.00 H ATOM 130 HB3 GLN A 9 50.919 34.797 80.902 1.00 0.00 H ATOM 131 HG2 GLN A 9 52.782 36.188 80.701 1.00 0.00 H ATOM 132 HG3 GLN A 9 52.659 36.747 82.385 1.00 0.00 H ATOM 133 HE22 GLN A 9 52.063 33.867 83.255 1.00 0.00 H ATOM 134 HE21 GLN A 9 53.689 33.092 83.284 1.00 0.00 H ATOM 135 H GLN A 9 48.653 34.961 81.371 1.00 0.00 H ATOM 136 N THR A 10 50.660 38.712 80.826 1.00 43.93 N ATOM 137 CA THR A 10 50.964 39.677 79.762 1.00 44.38 C ATOM 138 C THR A 10 52.464 39.982 79.630 1.00 45.52 C ATOM 139 O THR A 10 52.876 40.766 78.772 1.00 46.02 O ATOM 140 CB THR A 10 50.241 41.016 79.991 1.00 44.02 C ATOM 141 OG1 THR A 10 50.572 41.515 81.294 1.00 42.47 O ATOM 142 CG2 THR A 10 48.725 40.856 79.861 1.00 43.44 C ATOM 143 HA THR A 10 50.616 39.199 78.846 1.00 0.00 H ATOM 144 HB THR A 10 50.569 41.723 79.229 1.00 0.00 H ATOM 145 HG1 THR A 10 50.108 42.377 81.444 1.00 0.00 H ATOM 146 HG23 THR A 10 48.485 40.477 78.868 1.00 0.00 H ATOM 147 HG21 THR A 10 48.369 40.154 80.615 1.00 0.00 H ATOM 148 HG22 THR A 10 48.245 41.824 80.008 1.00 0.00 H ATOM 149 H THR A 10 50.776 39.002 81.818 1.00 0.00 H ATOM 150 N ARG A 11 53.287 39.374 80.475 1.00 47.95 N ATOM 151 CA ARG A 11 54.712 39.664 80.433 1.00 49.66 C ATOM 152 C ARG A 11 55.564 38.525 80.963 1.00 51.43 C ATOM 153 O ARG A 11 55.155 37.826 81.890 1.00 50.51 O ATOM 154 CB ARG A 11 54.995 40.914 81.246 1.00 50.18 C ATOM 155 CG ARG A 11 55.998 41.817 80.584 1.00 51.21 C ATOM 156 CD ARG A 11 56.219 43.059 81.415 1.00 52.59 C ATOM 157 NE ARG A 11 56.285 44.223 80.543 1.00 52.91 N ATOM 158 CZ ARG A 11 55.360 45.172 80.491 1.00 51.17 C ATOM 159 NH1 ARG A 11 54.299 45.124 81.290 1.00 48.73 N ATOM 160 NH2 ARG A 11 55.514 46.180 79.647 1.00 50.44 N ATOM 161 HA ARG A 11 54.978 39.809 79.386 1.00 0.00 H ATOM 162 HB2 ARG A 11 54.063 41.464 81.378 1.00 0.00 H ATOM 163 HB3 ARG A 11 55.382 40.617 82.221 1.00 0.00 H ATOM 164 HG2 ARG A 11 56.943 41.285 80.475 1.00 0.00 H ATOM 165 HG3 ARG A 11 55.628 42.104 79.600 1.00 0.00 H ATOM 166 HD2 ARG A 11 57.154 42.965 81.967 1.00 0.00 H ATOM 167 HD3 ARG A 11 55.394 43.178 82.118 1.00 0.00 H ATOM 168 HE ARG A 11 57.112 44.316 79.920 1.00 0.00 H ATOM 169 HH12 ARG A 11 53.578 45.872 81.243 1.00 0.00 H ATOM 170 HH11 ARG A 11 54.190 44.338 81.962 1.00 0.00 H ATOM 171 HH22 ARG A 11 54.796 46.930 79.597 1.00 0.00 H ATOM 172 HH21 ARG A 11 56.353 46.222 79.034 1.00 0.00 H ATOM 173 H ARG A 11 52.914 38.692 81.166 1.00 0.00 H ATOM 174 N GLY A 12 56.748 38.351 80.371 1.00 50.66 N ATOM 175 CA GLY A 12 57.759 37.435 80.895 1.00 49.47 C ATOM 176 C GLY A 12 58.615 38.130 81.940 1.00 51.44 C ATOM 177 O GLY A 12 58.331 39.272 82.319 1.00 53.77 O ATOM 178 HA3 GLY A 12 58.395 37.096 80.077 1.00 0.00 H ATOM 179 HA2 GLY A 12 57.265 36.576 81.349 1.00 0.00 H ATOM 180 H GLY A 12 56.959 38.887 79.505 1.00 0.00 H ATOM 181 N LEU A 13 59.668 37.454 82.398 1.00 53.14 N ATOM 182 CA LEU A 13 60.556 38.003 83.432 1.00 55.59 C ATOM 183 C LEU A 13 61.539 39.045 82.882 1.00 56.13 C ATOM 184 O LEU A 13 61.777 40.075 83.519 1.00 57.89 O ATOM 185 CB LEU A 13 61.317 36.888 84.162 1.00 55.26 C ATOM 186 CG LEU A 13 61.425 36.993 85.695 1.00 58.32 C ATOM 187 CD1 LEU A 13 62.009 35.705 86.267 1.00 60.69 C ATOM 188 CD2 LEU A 13 62.217 38.194 86.188 1.00 53.72 C ATOM 189 HA LEU A 13 59.909 38.515 84.145 1.00 0.00 H ATOM 190 HB2 LEU A 13 60.818 35.946 83.932 1.00 0.00 H ATOM 191 HB3 LEU A 13 62.331 36.868 83.763 1.00 0.00 H ATOM 192 HG LEU A 13 60.408 37.143 86.056 1.00 0.00 H ATOM 193 HD21 LEU A 13 63.234 38.141 85.800 1.00 0.00 H ATOM 194 HD22 LEU A 13 61.741 39.110 85.839 1.00 0.00 H ATOM 195 HD23 LEU A 13 62.242 38.189 87.278 1.00 0.00 H ATOM 196 HD11 LEU A 13 61.360 34.868 86.009 1.00 0.00 H ATOM 197 HD12 LEU A 13 63.001 35.540 85.848 1.00 0.00 H ATOM 198 HD13 LEU A 13 62.081 35.790 87.351 1.00 0.00 H ATOM 199 H LEU A 13 59.867 36.509 82.012 1.00 0.00 H ATOM 200 N LEU A 14 62.103 38.779 81.707 1.00 53.66 N ATOM 201 CA LEU A 14 63.019 39.724 81.069 1.00 54.59 C ATOM 202 C LEU A 14 62.312 41.052 80.827 1.00 54.85 C ATOM 203 O LEU A 14 62.845 42.117 81.145 1.00 55.65 O ATOM 204 CB LEU A 14 63.562 39.151 79.754 1.00 53.04 C ATOM 205 CG LEU A 14 64.633 39.925 78.968 1.00 55.53 C ATOM 206 CD1 LEU A 14 65.752 40.468 79.859 1.00 54.31 C ATOM 207 CD2 LEU A 14 65.207 39.036 77.873 1.00 53.77 C ATOM 208 HA LEU A 14 63.865 39.894 81.735 1.00 0.00 H ATOM 209 HB2 LEU A 14 63.985 38.174 79.986 1.00 0.00 H ATOM 210 HB3 LEU A 14 62.709 39.027 79.087 1.00 0.00 H ATOM 211 HG LEU A 14 64.145 40.793 78.524 1.00 0.00 H ATOM 212 HD21 LEU A 14 65.657 38.151 78.324 1.00 0.00 H ATOM 213 HD22 LEU A 14 64.408 38.734 77.196 1.00 0.00 H ATOM 214 HD23 LEU A 14 65.966 39.589 77.319 1.00 0.00 H ATOM 215 HD11 LEU A 14 65.328 41.147 80.599 1.00 0.00 H ATOM 216 HD12 LEU A 14 66.246 39.639 80.365 1.00 0.00 H ATOM 217 HD13 LEU A 14 66.476 41.004 79.245 1.00 0.00 H ATOM 218 H LEU A 14 61.888 37.879 81.232 1.00 0.00 H ATOM 219 N GLY A 15 61.100 40.969 80.280 1.00 54.64 N ATOM 220 CA GLY A 15 60.252 42.134 80.069 1.00 52.89 C ATOM 221 C GLY A 15 59.848 42.776 81.380 1.00 52.19 C ATOM 222 O GLY A 15 59.581 43.973 81.433 1.00 51.58 O ATOM 223 HA3 GLY A 15 59.354 41.825 79.534 1.00 0.00 H ATOM 224 HA2 GLY A 15 60.797 42.864 79.470 1.00 0.00 H ATOM 225 H GLY A 15 60.745 40.035 79.992 1.00 0.00 H ATOM 226 N CYS A 16 59.814 41.987 82.450 1.00 50.53 N ATOM 227 CA CYS A 16 59.514 42.548 83.765 1.00 50.83 C ATOM 228 C CYS A 16 60.713 43.277 84.376 1.00 48.61 C ATOM 229 O CYS A 16 60.556 44.381 84.904 1.00 46.61 O ATOM 230 CB CYS A 16 58.961 41.482 84.715 1.00 50.13 C ATOM 231 SG CYS A 16 58.655 42.073 86.392 1.00 48.40 S ATOM 232 HA CYS A 16 58.736 43.297 83.617 1.00 0.00 H ATOM 233 HB2 CYS A 16 59.679 40.664 84.766 1.00 0.00 H ATOM 234 HB3 CYS A 16 58.021 41.113 84.305 1.00 0.00 H ATOM 235 HG CYS A 16 58.161 41.038 87.160 1.00 0.00 H ATOM 236 H CYS A 16 60.001 40.969 82.350 1.00 0.00 H ATOM 237 N ILE A 17 61.899 42.675 84.309 1.00 50.27 N ATOM 238 CA ILE A 17 63.113 43.358 84.787 1.00 51.12 C ATOM 239 C ILE A 17 63.301 44.684 84.040 1.00 53.92 C ATOM 240 O ILE A 17 63.621 45.708 84.653 1.00 52.18 O ATOM 241 CB ILE A 17 64.384 42.497 84.653 1.00 51.83 C ATOM 242 CG1 ILE A 17 64.197 41.124 85.310 1.00 51.84 C ATOM 243 CG2 ILE A 17 65.582 43.214 85.270 1.00 52.44 C ATOM 244 CD1 ILE A 17 65.357 40.170 85.087 1.00 49.30 C ATOM 245 HA ILE A 17 62.967 43.545 85.851 1.00 0.00 H ATOM 246 HB ILE A 17 64.571 42.343 83.590 1.00 0.00 H ATOM 247 HG12 ILE A 17 64.075 41.271 86.383 1.00 0.00 H ATOM 248 HG13 ILE A 17 63.295 40.668 84.902 1.00 0.00 H ATOM 249 HD11 ILE A 17 65.486 40.001 84.018 1.00 0.00 H ATOM 250 HD12 ILE A 17 66.267 40.604 85.500 1.00 0.00 H ATOM 251 HD13 ILE A 17 65.147 39.222 85.583 1.00 0.00 H ATOM 252 HG21 ILE A 17 65.740 44.162 84.757 1.00 0.00 H ATOM 253 HG22 ILE A 17 65.388 43.399 86.327 1.00 0.00 H ATOM 254 HG23 ILE A 17 66.470 42.591 85.166 1.00 0.00 H ATOM 255 H ILE A 17 61.968 41.715 83.916 1.00 0.00 H ATOM 256 N ILE A 18 63.065 44.665 82.726 1.00 55.86 N ATOM 257 CA ILE A 18 63.255 45.855 81.887 1.00 57.12 C ATOM 258 C ILE A 18 62.243 46.965 82.200 1.00 56.50 C ATOM 259 O ILE A 18 62.628 48.127 82.360 1.00 59.39 O ATOM 260 CB ILE A 18 63.289 45.508 80.376 1.00 57.06 C ATOM 261 CG1 ILE A 18 64.486 44.590 80.075 1.00 57.76 C ATOM 262 CG2 ILE A 18 63.372 46.779 79.535 1.00 57.55 C ATOM 263 CD1 ILE A 18 64.425 43.882 78.738 1.00 57.81 C ATOM 264 HA ILE A 18 64.237 46.253 82.142 1.00 0.00 H ATOM 265 HB ILE A 18 62.368 44.986 80.117 1.00 0.00 H ATOM 266 HG12 ILE A 18 65.392 45.196 80.097 1.00 0.00 H ATOM 267 HG13 ILE A 18 64.538 43.833 80.857 1.00 0.00 H ATOM 268 HD11 ILE A 18 63.533 43.257 78.699 1.00 0.00 H ATOM 269 HD12 ILE A 18 64.387 44.621 77.938 1.00 0.00 H ATOM 270 HD13 ILE A 18 65.311 43.259 78.617 1.00 0.00 H ATOM 271 HG21 ILE A 18 62.501 47.403 79.735 1.00 0.00 H ATOM 272 HG22 ILE A 18 64.279 47.325 79.793 1.00 0.00 H ATOM 273 HG23 ILE A 18 63.395 46.513 78.478 1.00 0.00 H ATOM 274 H ILE A 18 62.737 43.782 82.284 1.00 0.00 H ATOM 275 N THR A 19 60.966 46.599 82.315 1.00 54.69 N ATOM 276 CA THR A 19 59.898 47.554 82.626 1.00 51.79 C ATOM 277 C THR A 19 60.030 48.066 84.057 1.00 53.34 C ATOM 278 O THR A 19 59.600 49.177 84.365 1.00 54.27 O ATOM 279 CB THR A 19 58.496 46.933 82.407 1.00 53.88 C ATOM 280 OG1 THR A 19 58.410 46.372 81.090 1.00 52.26 O ATOM 281 CG2 THR A 19 57.376 47.969 82.584 1.00 53.09 C ATOM 282 HA THR A 19 60.004 48.395 81.940 1.00 0.00 H ATOM 283 HB THR A 19 58.364 46.155 83.159 1.00 0.00 H ATOM 284 HG1 THR A 19 59.099 45.668 80.987 1.00 0.00 H ATOM 285 HG23 THR A 19 57.436 48.400 83.584 1.00 0.00 H ATOM 286 HG21 THR A 19 57.491 48.757 81.840 1.00 0.00 H ATOM 287 HG22 THR A 19 56.409 47.483 82.454 1.00 0.00 H ATOM 288 H THR A 19 60.718 45.598 82.179 1.00 0.00 H ATOM 289 N SER A 20 60.623 47.254 84.929 1.00 54.78 N ATOM 290 CA SER A 20 60.861 47.654 86.313 1.00 55.88 C ATOM 291 C SER A 20 61.946 48.724 86.421 1.00 57.58 C ATOM 292 O SER A 20 61.761 49.730 87.111 1.00 58.43 O ATOM 293 CB SER A 20 61.230 46.449 87.177 1.00 55.87 C ATOM 294 OG SER A 20 61.358 46.840 88.532 1.00 58.84 O ATOM 295 HA SER A 20 59.929 48.082 86.681 1.00 0.00 H ATOM 296 HB2 SER A 20 62.176 46.034 86.831 1.00 0.00 H ATOM 297 HB3 SER A 20 60.450 45.692 87.092 1.00 0.00 H ATOM 298 HG SER A 20 61.597 46.051 89.081 1.00 0.00 H ATOM 299 H SER A 20 60.925 46.309 84.616 1.00 0.00 H ATOM 300 N LEU A 21 63.071 48.493 85.746 1.00 56.03 N ATOM 301 CA LEU A 21 64.179 49.449 85.719 1.00 58.54 C ATOM 302 C LEU A 21 63.785 50.803 85.111 1.00 59.62 C ATOM 303 O LEU A 21 64.193 51.850 85.608 1.00 61.51 O ATOM 304 CB LEU A 21 65.381 48.866 84.961 1.00 57.72 C ATOM 305 CG LEU A 21 66.088 47.625 85.521 1.00 57.69 C ATOM 306 CD1 LEU A 21 67.167 47.135 84.564 1.00 56.87 C ATOM 307 CD2 LEU A 21 66.682 47.900 86.896 1.00 60.62 C ATOM 308 HA LEU A 21 64.455 49.629 86.758 1.00 0.00 H ATOM 309 HB2 LEU A 21 65.033 48.610 83.960 1.00 0.00 H ATOM 310 HB3 LEU A 21 66.129 49.656 84.894 1.00 0.00 H ATOM 311 HG LEU A 21 65.339 46.840 85.627 1.00 0.00 H ATOM 312 HD21 LEU A 21 67.408 48.709 86.821 1.00 0.00 H ATOM 313 HD22 LEU A 21 65.886 48.186 87.584 1.00 0.00 H ATOM 314 HD23 LEU A 21 67.175 47.000 87.264 1.00 0.00 H ATOM 315 HD11 LEU A 21 66.713 46.878 83.607 1.00 0.00 H ATOM 316 HD12 LEU A 21 67.906 47.923 84.417 1.00 0.00 H ATOM 317 HD13 LEU A 21 67.652 46.255 84.985 1.00 0.00 H ATOM 318 H LEU A 21 63.165 47.601 85.219 1.00 0.00 H ATOM 319 N THR A 22 62.990 50.779 84.047 1.00 60.25 N ATOM 320 CA THR A 22 62.633 51.998 83.332 1.00 63.14 C ATOM 321 C THR A 22 61.514 52.771 84.029 1.00 66.08 C ATOM 322 O THR A 22 61.595 53.992 84.175 1.00 69.62 O ATOM 323 CB THR A 22 62.198 51.706 81.879 1.00 63.00 C ATOM 324 OG1 THR A 22 61.083 50.805 81.889 1.00 65.91 O ATOM 325 CG2 THR A 22 63.337 51.094 81.079 1.00 60.52 C ATOM 326 HA THR A 22 63.536 52.608 83.325 1.00 0.00 H ATOM 327 HB THR A 22 61.915 52.647 81.408 1.00 0.00 H ATOM 328 HG1 THR A 22 61.347 49.960 82.332 1.00 0.00 H ATOM 329 HG23 THR A 22 64.184 51.780 81.072 1.00 0.00 H ATOM 330 HG21 THR A 22 63.635 50.151 81.537 1.00 0.00 H ATOM 331 HG22 THR A 22 63.005 50.914 80.056 1.00 0.00 H ATOM 332 H THR A 22 62.613 49.868 83.716 1.00 0.00 H ATOM 333 N GLY A 23 60.476 52.055 84.455 1.00 62.52 N ATOM 334 CA GLY A 23 59.271 52.680 84.990 1.00 59.29 C ATOM 335 C GLY A 23 58.247 52.970 83.905 1.00 57.27 C ATOM 336 O GLY A 23 57.221 53.607 84.154 1.00 51.58 O ATOM 337 HA3 GLY A 23 59.546 53.617 85.474 1.00 0.00 H ATOM 338 HA2 GLY A 23 58.824 52.011 85.725 1.00 0.00 H ATOM 339 H GLY A 23 60.525 51.017 84.405 1.00 0.00 H ATOM 340 N ARG A 24 58.522 52.494 82.694 1.00 57.95 N ATOM 341 CA ARG A 24 57.670 52.801 81.554 1.00 58.30 C ATOM 342 C ARG A 24 57.053 51.535 80.986 1.00 56.81 C ATOM 343 O ARG A 24 57.760 50.632 80.526 1.00 57.30 O ATOM 344 CB ARG A 24 58.461 53.562 80.489 1.00 61.07 C ATOM 345 CG ARG A 24 57.595 54.323 79.504 1.00 66.21 C ATOM 346 CD ARG A 24 58.432 55.078 78.482 1.00 67.80 C ATOM 347 NE ARG A 24 57.751 55.143 77.190 1.00 71.16 N ATOM 348 CZ ARG A 24 56.879 56.084 76.836 1.00 74.13 C ATOM 349 NH1 ARG A 24 56.567 57.067 77.673 1.00 75.13 N ATOM 350 NH2 ARG A 24 56.316 56.040 75.635 1.00 77.20 N ATOM 351 HA ARG A 24 56.855 53.442 81.891 1.00 0.00 H ATOM 352 HB2 ARG A 24 59.116 54.274 80.991 1.00 0.00 H ATOM 353 HB3 ARG A 24 59.065 52.845 79.932 1.00 0.00 H ATOM 354 HG2 ARG A 24 56.951 53.616 78.980 1.00 0.00 H ATOM 355 HG3 ARG A 24 56.979 55.036 80.052 1.00 0.00 H ATOM 356 HD2 ARG A 24 59.387 54.568 78.356 1.00 0.00 H ATOM 357 HD3 ARG A 24 58.608 56.091 78.844 1.00 0.00 H ATOM 358 HE ARG A 24 57.964 54.398 76.496 1.00 0.00 H ATOM 359 HH12 ARG A 24 55.884 57.797 77.386 1.00 0.00 H ATOM 360 HH11 ARG A 24 57.005 57.106 78.615 1.00 0.00 H ATOM 361 HH22 ARG A 24 55.634 56.773 75.353 1.00 0.00 H ATOM 362 HH21 ARG A 24 56.557 55.273 74.976 1.00 0.00 H ATOM 363 H ARG A 24 59.360 51.892 82.559 1.00 0.00 H ATOM 364 N ASP A 25 55.728 51.471 81.034 1.00 56.42 N ATOM 365 CA ASP A 25 55.005 50.287 80.590 1.00 58.19 C ATOM 366 C ASP A 25 54.403 50.549 79.217 1.00 59.41 C ATOM 367 O ASP A 25 53.588 51.456 79.042 1.00 61.47 O ATOM 368 CB ASP A 25 53.928 49.889 81.618 1.00 59.83 C ATOM 369 CG ASP A 25 53.270 48.535 81.310 1.00 61.49 C ATOM 370 OD1 ASP A 25 53.737 47.795 80.421 1.00 54.76 O ATOM 371 OD2 ASP A 25 52.264 48.207 81.971 1.00 66.90 O ATOM 372 HA ASP A 25 55.696 49.448 80.510 1.00 0.00 H ATOM 373 HB2 ASP A 25 54.392 49.833 82.603 1.00 0.00 H ATOM 374 HB3 ASP A 25 53.155 50.657 81.625 1.00 0.00 H ATOM 375 H ASP A 25 55.193 52.286 81.397 1.00 0.00 H ATOM 376 N LYS A 26 54.832 49.752 78.244 1.00 61.25 N ATOM 377 CA LYS A 26 54.356 49.869 76.873 1.00 65.13 C ATOM 378 C LYS A 26 52.970 49.249 76.707 1.00 67.78 C ATOM 379 O LYS A 26 52.175 49.715 75.891 1.00 73.83 O ATOM 380 CB LYS A 26 55.358 49.218 75.907 1.00 65.58 C ATOM 381 CG LYS A 26 55.641 47.741 76.158 1.00 60.30 C ATOM 382 CD LYS A 26 56.994 47.352 75.597 1.00 59.15 C ATOM 383 CE LYS A 26 57.281 45.871 75.762 1.00 59.64 C ATOM 384 NZ LYS A 26 56.527 45.029 74.789 1.00 61.92 N ATOM 385 HA LYS A 26 54.273 50.929 76.635 1.00 0.00 H ATOM 386 HB2 LYS A 26 54.965 49.318 74.895 1.00 0.00 H ATOM 387 HB3 LYS A 26 56.301 49.759 75.984 1.00 0.00 H ATOM 388 HG2 LYS A 26 55.631 47.552 77.231 1.00 0.00 H ATOM 389 HG3 LYS A 26 54.868 47.141 75.677 1.00 0.00 H ATOM 390 HD2 LYS A 26 57.018 47.598 74.535 1.00 0.00 H ATOM 391 HD3 LYS A 26 57.766 47.919 76.117 1.00 0.00 H ATOM 392 HE2 LYS A 26 57.003 45.572 76.772 1.00 0.00 H ATOM 393 HE3 LYS A 26 58.348 45.703 75.616 1.00 0.00 H ATOM 394 HZ1 LYS A 26 55.506 45.174 74.925 1.00 0.00 H ATOM 395 HZ2 LYS A 26 56.791 45.300 73.820 1.00 0.00 H ATOM 396 HZ3 LYS A 26 56.760 44.028 74.946 1.00 0.00 H ATOM 397 H LYS A 26 55.533 49.018 78.470 1.00 0.00 H ATOM 398 N ASN A 27 52.694 48.210 77.498 1.00 64.03 N ATOM 399 CA ASN A 27 51.482 47.403 77.368 1.00 61.84 C ATOM 400 C ASN A 27 50.179 48.148 77.623 1.00 61.21 C ATOM 401 O ASN A 27 50.157 49.172 78.303 1.00 57.90 O ATOM 402 CB ASN A 27 51.558 46.173 78.280 1.00 60.82 C ATOM 403 CG ASN A 27 52.492 45.100 77.746 1.00 61.83 C ATOM 404 OD1 ASN A 27 52.622 44.032 78.345 1.00 61.65 O ATOM 405 ND2 ASN A 27 53.148 45.374 76.618 1.00 61.97 N ATOM 406 HA ASN A 27 51.454 47.108 76.319 1.00 0.00 H ATOM 407 HB2 ASN A 27 51.914 46.488 79.261 1.00 0.00 H ATOM 408 HB3 ASN A 27 50.559 45.749 78.377 1.00 0.00 H ATOM 409 HD22 ASN A 27 53.008 46.289 76.144 1.00 0.00 H ATOM 410 HD21 ASN A 27 53.799 44.672 76.212 1.00 0.00 H ATOM 411 H ASN A 27 53.375 47.962 78.244 1.00 0.00 H ATOM 412 N GLN A 28 49.102 47.616 77.051 1.00 61.78 N ATOM 413 CA GLN A 28 47.759 48.128 77.261 1.00 64.06 C ATOM 414 C GLN A 28 47.156 47.387 78.442 1.00 65.39 C ATOM 415 O GLN A 28 47.042 46.161 78.420 1.00 69.57 O ATOM 416 CB GLN A 28 46.911 47.920 75.996 1.00 66.47 C ATOM 417 CG GLN A 28 45.418 48.190 76.150 1.00 66.45 C ATOM 418 CD GLN A 28 45.100 49.637 76.477 1.00 69.84 C ATOM 419 OE1 GLN A 28 44.559 49.936 77.544 1.00 72.53 O ATOM 420 NE2 GLN A 28 45.431 50.544 75.560 1.00 70.50 N ATOM 421 HA GLN A 28 47.785 49.198 77.469 1.00 0.00 H ATOM 422 HB2 GLN A 28 47.294 48.585 75.222 1.00 0.00 H ATOM 423 HB3 GLN A 28 47.033 46.885 75.677 1.00 0.00 H ATOM 424 HG2 GLN A 28 44.921 47.929 75.216 1.00 0.00 H ATOM 425 HG3 GLN A 28 45.033 47.561 76.953 1.00 0.00 H ATOM 426 HE22 GLN A 28 45.886 50.245 74.674 1.00 0.00 H ATOM 427 HE21 GLN A 28 45.234 51.551 75.730 1.00 0.00 H ATOM 428 H GLN A 28 49.228 46.795 76.424 1.00 0.00 H ATOM 429 N VAL A 29 46.777 48.134 79.471 1.00 62.73 N ATOM 430 CA VAL A 29 46.194 47.547 80.669 1.00 63.25 C ATOM 431 C VAL A 29 44.706 47.271 80.469 1.00 65.36 C ATOM 432 O VAL A 29 43.960 48.137 80.012 1.00 62.80 O ATOM 433 CB VAL A 29 46.400 48.452 81.905 1.00 61.92 C ATOM 434 CG1 VAL A 29 45.705 47.866 83.127 1.00 61.32 C ATOM 435 CG2 VAL A 29 47.883 48.658 82.179 1.00 58.59 C ATOM 436 HA VAL A 29 46.709 46.603 80.849 1.00 0.00 H ATOM 437 HB VAL A 29 45.953 49.423 81.693 1.00 0.00 H ATOM 438 HG11 VAL A 29 44.637 47.779 82.929 1.00 0.00 H ATOM 439 HG12 VAL A 29 46.118 46.880 83.340 1.00 0.00 H ATOM 440 HG13 VAL A 29 45.865 48.521 83.983 1.00 0.00 H ATOM 441 HG21 VAL A 29 48.354 47.693 82.365 1.00 0.00 H ATOM 442 HG22 VAL A 29 48.349 49.130 81.314 1.00 0.00 H ATOM 443 HG23 VAL A 29 48.004 49.298 83.053 1.00 0.00 H ATOM 444 H VAL A 29 46.900 49.166 79.420 1.00 0.00 H ATOM 445 N ASP A 30 44.295 46.051 80.809 1.00 69.59 N ATOM 446 CA ASP A 30 42.882 45.664 80.842 1.00 71.42 C ATOM 447 C ASP A 30 42.547 44.959 82.156 1.00 68.96 C ATOM 448 O ASP A 30 43.443 44.555 82.900 1.00 73.45 O ATOM 449 CB ASP A 30 42.536 44.761 79.651 1.00 73.49 C ATOM 450 CG ASP A 30 42.035 45.542 78.444 1.00 77.54 C ATOM 451 OD1 ASP A 30 42.795 46.377 77.901 1.00 79.63 O ATOM 452 OD2 ASP A 30 40.877 45.309 78.033 1.00 74.96 O ATOM 453 HA ASP A 30 42.282 46.571 80.772 1.00 0.00 H ATOM 454 HB2 ASP A 30 43.430 44.208 79.362 1.00 0.00 H ATOM 455 HB3 ASP A 30 41.760 44.060 79.959 1.00 0.00 H ATOM 456 H ASP A 30 45.010 45.340 81.063 1.00 0.00 H ATOM 457 N GLY A 31 41.257 44.828 82.444 1.00 64.73 N ATOM 458 CA GLY A 31 40.805 44.082 83.610 1.00 59.43 C ATOM 459 C GLY A 31 40.742 44.870 84.908 1.00 56.82 C ATOM 460 O GLY A 31 41.173 46.030 84.987 1.00 54.51 O ATOM 461 HA3 GLY A 31 41.487 43.245 83.758 1.00 0.00 H ATOM 462 HA2 GLY A 31 39.805 43.702 83.399 1.00 0.00 H ATOM 463 H GLY A 31 40.551 45.270 81.821 1.00 0.00 H ATOM 464 N GLU A 32 40.215 44.210 85.935 1.00 53.14 N ATOM 465 CA GLU A 32 39.966 44.828 87.230 1.00 52.61 C ATOM 466 C GLU A 32 40.976 44.352 88.270 1.00 51.25 C ATOM 467 O GLU A 32 41.352 45.117 89.158 1.00 52.82 O ATOM 468 CB GLU A 32 38.558 44.493 87.700 1.00 53.05 C ATOM 469 CG GLU A 32 37.476 44.754 86.669 1.00 56.45 C ATOM 470 CD GLU A 32 36.328 43.781 86.795 1.00 56.76 C ATOM 471 OE1 GLU A 32 36.518 42.576 86.512 1.00 62.40 O ATOM 472 OE2 GLU A 32 35.234 44.224 87.178 1.00 58.02 O ATOM 473 HA GLU A 32 40.070 45.907 87.116 1.00 0.00 H ATOM 474 HB2 GLU A 32 38.529 43.436 87.965 1.00 0.00 H ATOM 475 HB3 GLU A 32 38.341 45.094 88.583 1.00 0.00 H ATOM 476 HG2 GLU A 32 37.096 45.767 86.806 1.00 0.00 H ATOM 477 HG3 GLU A 32 37.909 44.661 85.673 1.00 0.00 H ATOM 478 H GLU A 32 39.970 43.207 85.808 1.00 0.00 H ATOM 479 N VAL A 33 41.393 43.088 88.160 1.00 47.76 N ATOM 480 CA VAL A 33 42.479 42.538 88.977 1.00 46.13 C ATOM 481 C VAL A 33 43.763 42.503 88.157 1.00 44.72 C ATOM 482 O VAL A 33 43.791 41.930 87.068 1.00 49.10 O ATOM 483 CB VAL A 33 42.183 41.108 89.483 1.00 44.69 C ATOM 484 CG1 VAL A 33 43.258 40.659 90.464 1.00 44.71 C ATOM 485 CG2 VAL A 33 40.815 41.028 90.144 1.00 44.31 C ATOM 486 HA VAL A 33 42.581 43.187 89.847 1.00 0.00 H ATOM 487 HB VAL A 33 42.185 40.443 88.619 1.00 0.00 H ATOM 488 HG11 VAL A 33 44.228 40.667 89.967 1.00 0.00 H ATOM 489 HG12 VAL A 33 43.279 41.340 91.315 1.00 0.00 H ATOM 490 HG13 VAL A 33 43.034 39.650 90.810 1.00 0.00 H ATOM 491 HG21 VAL A 33 40.783 41.711 90.993 1.00 0.00 H ATOM 492 HG22 VAL A 33 40.047 41.307 89.422 1.00 0.00 H ATOM 493 HG23 VAL A 33 40.638 40.009 90.488 1.00 0.00 H ATOM 494 H VAL A 33 40.928 42.468 87.466 1.00 0.00 H ATOM 495 N GLN A 34 44.818 43.114 88.680 1.00 42.56 N ATOM 496 CA GLN A 34 46.132 43.069 88.045 1.00 42.32 C ATOM 497 C GLN A 34 47.068 42.124 88.791 1.00 41.76 C ATOM 498 O GLN A 34 47.049 42.073 90.024 1.00 41.58 O ATOM 499 CB GLN A 34 46.756 44.467 87.998 1.00 44.35 C ATOM 500 CG GLN A 34 45.824 45.573 87.517 1.00 50.37 C ATOM 501 CD GLN A 34 45.179 45.277 86.172 1.00 54.80 C ATOM 502 OE1 GLN A 34 43.970 45.443 86.006 1.00 59.91 O ATOM 503 NE2 GLN A 34 45.978 44.831 85.207 1.00 55.91 N ATOM 504 HA GLN A 34 45.994 42.700 87.028 1.00 0.00 H ATOM 505 HB2 GLN A 34 47.092 44.721 89.003 1.00 0.00 H ATOM 506 HB3 GLN A 34 47.614 44.432 87.327 1.00 0.00 H ATOM 507 HG2 GLN A 34 45.035 45.706 88.257 1.00 0.00 H ATOM 508 HG3 GLN A 34 46.398 46.495 87.430 1.00 0.00 H ATOM 509 HE22 GLN A 34 46.994 44.705 85.390 1.00 0.00 H ATOM 510 HE21 GLN A 34 45.587 44.608 84.269 1.00 0.00 H ATOM 511 H GLN A 34 44.706 43.641 89.569 1.00 0.00 H ATOM 512 N VAL A 35 47.879 41.381 88.039 1.00 40.61 N ATOM 513 CA VAL A 35 48.936 40.552 88.610 1.00 38.11 C ATOM 514 C VAL A 35 50.179 41.439 88.629 1.00 39.68 C ATOM 515 O VAL A 35 50.640 41.892 87.581 1.00 39.73 O ATOM 516 CB VAL A 35 49.206 39.277 87.765 1.00 39.69 C ATOM 517 CG1 VAL A 35 50.292 38.395 88.398 1.00 36.82 C ATOM 518 CG2 VAL A 35 47.925 38.479 87.549 1.00 36.31 C ATOM 519 HA VAL A 35 48.653 40.200 89.602 1.00 0.00 H ATOM 520 HB VAL A 35 49.572 39.607 86.793 1.00 0.00 H ATOM 521 HG11 VAL A 35 51.221 38.961 88.472 1.00 0.00 H ATOM 522 HG12 VAL A 35 49.973 38.086 89.393 1.00 0.00 H ATOM 523 HG13 VAL A 35 50.451 37.514 87.776 1.00 0.00 H ATOM 524 HG21 VAL A 35 47.519 38.178 88.515 1.00 0.00 H ATOM 525 HG22 VAL A 35 47.197 39.098 87.024 1.00 0.00 H ATOM 526 HG23 VAL A 35 48.146 37.593 86.954 1.00 0.00 H ATOM 527 H VAL A 35 47.754 41.392 87.007 1.00 0.00 H ATOM 528 N LEU A 36 50.700 41.707 89.823 1.00 40.93 N ATOM 529 CA LEU A 36 51.850 42.600 89.980 1.00 41.06 C ATOM 530 C LEU A 36 53.133 41.844 90.241 1.00 42.38 C ATOM 531 O LEU A 36 53.127 40.683 90.665 1.00 42.80 O ATOM 532 CB LEU A 36 51.616 43.606 91.115 1.00 38.61 C ATOM 533 CG LEU A 36 50.480 44.610 90.917 1.00 38.08 C ATOM 534 CD1 LEU A 36 50.530 45.633 92.028 1.00 36.69 C ATOM 535 CD2 LEU A 36 50.575 45.291 89.558 1.00 37.22 C ATOM 536 HA LEU A 36 51.955 43.133 89.035 1.00 0.00 H ATOM 537 HB2 LEU A 36 51.402 43.039 92.021 1.00 0.00 H ATOM 538 HB3 LEU A 36 52.538 44.172 91.251 1.00 0.00 H ATOM 539 HG LEU A 36 49.528 44.079 90.948 1.00 0.00 H ATOM 540 HD21 LEU A 36 51.524 45.821 89.484 1.00 0.00 H ATOM 541 HD22 LEU A 36 50.515 44.539 88.771 1.00 0.00 H ATOM 542 HD23 LEU A 36 49.753 45.998 89.449 1.00 0.00 H ATOM 543 HD11 LEU A 36 50.415 45.130 92.988 1.00 0.00 H ATOM 544 HD12 LEU A 36 51.489 46.151 92.000 1.00 0.00 H ATOM 545 HD13 LEU A 36 49.723 46.353 91.894 1.00 0.00 H ATOM 546 H LEU A 36 50.279 41.271 90.668 1.00 0.00 H ATOM 547 N SER A 37 54.237 42.522 89.983 1.00 43.53 N ATOM 548 CA SER A 37 55.536 41.987 90.297 1.00 46.65 C ATOM 549 C SER A 37 56.577 43.090 90.401 1.00 49.82 C ATOM 550 O SER A 37 56.627 43.995 89.569 1.00 47.59 O ATOM 551 CB SER A 37 55.954 40.976 89.231 1.00 47.23 C ATOM 552 OG SER A 37 57.219 40.432 89.533 1.00 47.22 O ATOM 553 HA SER A 37 55.472 41.490 91.265 1.00 0.00 H ATOM 554 HB2 SER A 37 56.000 41.474 88.263 1.00 0.00 H ATOM 555 HB3 SER A 37 55.218 40.173 89.191 1.00 0.00 H ATOM 556 HG SER A 37 57.890 41.159 89.567 1.00 0.00 H ATOM 557 H SER A 37 54.166 43.462 89.544 1.00 0.00 H ATOM 558 N THR A 38 57.368 43.020 91.467 1.00 53.99 N ATOM 559 CA THR A 38 58.715 43.572 91.493 1.00 56.27 C ATOM 560 C THR A 38 59.520 42.438 90.876 1.00 62.01 C ATOM 561 O THR A 38 58.994 41.336 90.737 1.00 69.14 O ATOM 562 CB THR A 38 59.177 43.828 92.940 1.00 55.89 C ATOM 563 OG1 THR A 38 59.265 42.584 93.645 1.00 50.92 O ATOM 564 CG2 THR A 38 58.189 44.751 93.675 1.00 53.63 C ATOM 565 HA THR A 38 58.811 44.528 90.978 1.00 0.00 H ATOM 566 HB THR A 38 60.154 44.310 92.906 1.00 0.00 H ATOM 567 HG1 THR A 38 59.562 42.753 94.574 1.00 0.00 H ATOM 568 HG23 THR A 38 58.117 45.700 93.144 1.00 0.00 H ATOM 569 HG21 THR A 38 57.208 44.277 93.710 1.00 0.00 H ATOM 570 HG22 THR A 38 58.545 44.927 94.690 1.00 0.00 H ATOM 571 H THR A 38 57.008 42.549 92.322 1.00 0.00 H ATOM 572 N ALA A 39 60.773 42.655 90.499 1.00 64.98 N ATOM 573 CA ALA A 39 61.514 41.556 89.856 1.00 69.75 C ATOM 574 C ALA A 39 61.591 40.292 90.738 1.00 68.17 C ATOM 575 O ALA A 39 61.794 39.182 90.233 1.00 67.40 O ATOM 576 CB ALA A 39 62.906 42.009 89.428 1.00 73.23 C ATOM 577 HA ALA A 39 60.951 41.281 88.964 1.00 0.00 H ATOM 578 HB1 ALA A 39 62.817 42.832 88.719 1.00 0.00 H ATOM 579 HB2 ALA A 39 63.464 42.341 90.304 1.00 0.00 H ATOM 580 HB3 ALA A 39 63.429 41.177 88.957 1.00 0.00 H ATOM 581 H ALA A 39 61.222 43.580 90.654 1.00 0.00 H ATOM 582 N THR A 40 61.374 40.466 92.042 1.00 65.19 N ATOM 583 CA THR A 40 61.716 39.445 93.035 1.00 62.54 C ATOM 584 C THR A 40 60.533 38.813 93.800 1.00 59.19 C ATOM 585 O THR A 40 60.696 37.802 94.479 1.00 57.83 O ATOM 586 CB THR A 40 62.720 40.021 94.042 1.00 61.18 C ATOM 587 OG1 THR A 40 62.064 41.017 94.835 1.00 62.13 O ATOM 588 CG2 THR A 40 63.900 40.661 93.307 1.00 59.87 C ATOM 589 HA THR A 40 62.141 38.628 92.451 1.00 0.00 H ATOM 590 HB THR A 40 63.092 39.217 94.677 1.00 0.00 H ATOM 591 HG1 THR A 40 62.706 41.393 95.488 1.00 0.00 H ATOM 592 HG23 THR A 40 64.402 39.906 92.702 1.00 0.00 H ATOM 593 HG21 THR A 40 63.535 41.461 92.663 1.00 0.00 H ATOM 594 HG22 THR A 40 64.601 41.071 94.035 1.00 0.00 H ATOM 595 H THR A 40 60.947 41.358 92.365 1.00 0.00 H ATOM 596 N GLN A 41 59.355 39.421 93.713 1.00 57.05 N ATOM 597 CA GLN A 41 58.152 38.848 94.318 1.00 52.13 C ATOM 598 C GLN A 41 56.907 39.256 93.529 1.00 49.29 C ATOM 599 O GLN A 41 56.915 40.256 92.810 1.00 45.87 O ATOM 600 CB GLN A 41 58.032 39.226 95.802 1.00 53.48 C ATOM 601 CG GLN A 41 57.883 40.713 96.082 1.00 55.26 C ATOM 602 CD GLN A 41 57.865 41.056 97.571 1.00 57.46 C ATOM 603 OE1 GLN A 41 57.950 40.181 98.441 1.00 57.54 O ATOM 604 NE2 GLN A 41 57.746 42.345 97.869 1.00 54.65 N ATOM 605 HA GLN A 41 58.236 37.762 94.274 1.00 0.00 H ATOM 606 HB2 GLN A 41 57.159 38.717 96.210 1.00 0.00 H ATOM 607 HB3 GLN A 41 58.928 38.875 96.313 1.00 0.00 H ATOM 608 HG2 GLN A 41 58.718 41.237 95.617 1.00 0.00 H ATOM 609 HG3 GLN A 41 56.949 41.056 95.638 1.00 0.00 H ATOM 610 HE22 GLN A 41 57.677 43.050 97.108 1.00 0.00 H ATOM 611 HE21 GLN A 41 57.722 42.649 98.863 1.00 0.00 H ATOM 612 H GLN A 41 59.286 40.325 93.203 1.00 0.00 H ATOM 613 N SER A 42 55.845 38.472 93.661 1.00 43.41 N ATOM 614 CA SER A 42 54.652 38.671 92.853 1.00 41.41 C ATOM 615 C SER A 42 53.395 38.582 93.712 1.00 39.03 C ATOM 616 O SER A 42 53.317 37.767 94.610 1.00 36.00 O ATOM 617 CB SER A 42 54.616 37.660 91.704 1.00 40.43 C ATOM 618 OG SER A 42 53.496 37.888 90.862 1.00 43.03 O ATOM 619 HA SER A 42 54.684 39.672 92.422 1.00 0.00 H ATOM 620 HB2 SER A 42 54.553 36.653 92.116 1.00 0.00 H ATOM 621 HB3 SER A 42 55.529 37.755 91.117 1.00 0.00 H ATOM 622 HG SER A 42 53.551 38.800 90.482 1.00 0.00 H ATOM 623 H SER A 42 55.866 37.699 94.357 1.00 0.00 H ATOM 624 N PHE A 43 52.425 39.444 93.429 1.00 40.57 N ATOM 625 CA PHE A 43 51.205 39.584 94.238 1.00 38.36 C ATOM 626 C PHE A 43 50.104 40.191 93.376 1.00 36.92 C ATOM 627 O PHE A 43 50.273 40.305 92.168 1.00 36.22 O ATOM 628 CB PHE A 43 51.455 40.417 95.510 1.00 39.43 C ATOM 629 CG PHE A 43 52.259 41.667 95.282 1.00 40.74 C ATOM 630 CD1 PHE A 43 53.654 41.618 95.210 1.00 40.40 C ATOM 631 CD2 PHE A 43 51.627 42.906 95.163 1.00 41.49 C ATOM 632 CE1 PHE A 43 54.398 42.777 95.005 1.00 40.69 C ATOM 633 CE2 PHE A 43 52.365 44.066 94.962 1.00 40.23 C ATOM 634 CZ PHE A 43 53.752 44.001 94.877 1.00 40.41 C ATOM 635 HA PHE A 43 50.890 38.597 94.577 1.00 0.00 H ATOM 636 HB2 PHE A 43 50.489 40.703 95.927 1.00 0.00 H ATOM 637 HB3 PHE A 43 51.988 39.794 96.228 1.00 0.00 H ATOM 638 HD2 PHE A 43 50.541 42.964 95.229 1.00 0.00 H ATOM 639 HE2 PHE A 43 51.857 45.026 94.871 1.00 0.00 H ATOM 640 HZ PHE A 43 54.332 44.909 94.710 1.00 0.00 H ATOM 641 HE1 PHE A 43 55.485 42.724 94.945 1.00 0.00 H ATOM 642 HD1 PHE A 43 54.165 40.661 95.316 1.00 0.00 H ATOM 643 H PHE A 43 52.534 40.051 92.592 1.00 0.00 H ATOM 644 N LEU A 44 48.970 40.550 93.972 1.00 35.60 N ATOM 645 CA LEU A 44 47.847 41.036 93.173 1.00 36.46 C ATOM 646 C LEU A 44 47.519 42.479 93.506 1.00 38.26 C ATOM 647 O LEU A 44 47.981 43.001 94.526 1.00 40.25 O ATOM 648 CB LEU A 44 46.603 40.153 93.347 1.00 33.17 C ATOM 649 CG LEU A 44 46.704 38.671 92.965 1.00 32.81 C ATOM 650 CD1 LEU A 44 45.447 37.928 93.416 1.00 29.90 C ATOM 651 CD2 LEU A 44 46.957 38.462 91.477 1.00 30.09 C ATOM 652 HA LEU A 44 48.153 40.984 92.128 1.00 0.00 H ATOM 653 HB2 LEU A 44 46.320 40.197 94.399 1.00 0.00 H ATOM 654 HB3 LEU A 44 45.810 40.590 92.740 1.00 0.00 H ATOM 655 HG LEU A 44 47.570 38.260 93.483 1.00 0.00 H ATOM 656 HD21 LEU A 44 46.138 38.899 90.906 1.00 0.00 H ATOM 657 HD22 LEU A 44 47.894 38.944 91.198 1.00 0.00 H ATOM 658 HD23 LEU A 44 47.019 37.394 91.267 1.00 0.00 H ATOM 659 HD11 LEU A 44 45.344 38.014 94.498 1.00 0.00 H ATOM 660 HD12 LEU A 44 44.574 38.365 92.931 1.00 0.00 H ATOM 661 HD13 LEU A 44 45.529 36.877 93.140 1.00 0.00 H ATOM 662 H LEU A 44 48.883 40.485 95.006 1.00 0.00 H ATOM 663 N ALA A 45 46.745 43.113 92.622 1.00 37.68 N ATOM 664 CA ALA A 45 46.167 44.441 92.854 1.00 39.70 C ATOM 665 C ALA A 45 44.714 44.433 92.420 1.00 41.35 C ATOM 666 O ALA A 45 44.345 43.682 91.514 1.00 44.87 O ATOM 667 CB ALA A 45 46.922 45.502 92.070 1.00 39.04 C ATOM 668 HA ALA A 45 46.242 44.676 93.916 1.00 0.00 H ATOM 669 HB1 ALA A 45 47.965 45.512 92.386 1.00 0.00 H ATOM 670 HB2 ALA A 45 46.866 45.274 91.006 1.00 0.00 H ATOM 671 HB3 ALA A 45 46.475 46.478 92.258 1.00 0.00 H ATOM 672 H ALA A 45 46.541 42.639 91.719 1.00 0.00 H ATOM 673 N THR A 46 43.901 45.277 93.048 1.00 42.41 N ATOM 674 CA THR A 46 42.506 45.460 92.640 1.00 45.02 C ATOM 675 C THR A 46 42.190 46.939 92.438 1.00 46.51 C ATOM 676 O THR A 46 42.389 47.751 93.342 1.00 46.47 O ATOM 677 CB THR A 46 41.522 44.872 93.666 1.00 43.14 C ATOM 678 OG1 THR A 46 41.803 43.483 93.854 1.00 45.01 O ATOM 679 CG2 THR A 46 40.086 45.027 93.187 1.00 42.56 C ATOM 680 HA THR A 46 42.384 44.925 91.698 1.00 0.00 H ATOM 681 HB THR A 46 41.641 45.411 94.606 1.00 0.00 H ATOM 682 HG1 THR A 46 42.730 43.377 94.186 1.00 0.00 H ATOM 683 HG23 THR A 46 39.865 46.084 93.042 1.00 0.00 H ATOM 684 HG21 THR A 46 39.959 44.495 92.244 1.00 0.00 H ATOM 685 HG22 THR A 46 39.409 44.612 93.933 1.00 0.00 H ATOM 686 H THR A 46 44.267 45.824 93.853 1.00 0.00 H ATOM 687 N CYS A 47 41.699 47.279 91.249 1.00 50.80 N ATOM 688 CA CYS A 47 41.304 48.656 90.944 1.00 53.52 C ATOM 689 C CYS A 47 39.890 48.919 91.455 1.00 51.96 C ATOM 690 O CYS A 47 38.942 48.244 91.052 1.00 51.54 O ATOM 691 CB CYS A 47 41.406 48.948 89.438 1.00 53.05 C ATOM 692 SG CYS A 47 43.097 48.969 88.799 1.00 54.48 S ATOM 693 HA CYS A 47 41.993 49.330 91.453 1.00 0.00 H ATOM 694 HB2 CYS A 47 40.956 49.922 89.247 1.00 0.00 H ATOM 695 HB3 CYS A 47 40.847 48.180 88.902 1.00 0.00 H ATOM 696 HG CYS A 47 43.072 49.239 87.446 1.00 0.00 H ATOM 697 H CYS A 47 41.593 46.548 90.517 1.00 0.00 H ATOM 698 N VAL A 48 39.764 49.875 92.367 1.00 48.97 N ATOM 699 CA VAL A 48 38.459 50.286 92.866 1.00 53.85 C ATOM 700 C VAL A 48 38.404 51.800 92.901 1.00 55.56 C ATOM 701 O VAL A 48 39.257 52.444 93.512 1.00 56.41 O ATOM 702 CB VAL A 48 38.160 49.747 94.278 1.00 54.32 C ATOM 703 CG1 VAL A 48 36.715 50.045 94.659 1.00 57.31 C ATOM 704 CG2 VAL A 48 38.419 48.249 94.358 1.00 56.07 C ATOM 705 HA VAL A 48 37.708 49.872 92.193 1.00 0.00 H ATOM 706 HB VAL A 48 38.827 50.248 94.979 1.00 0.00 H ATOM 707 HG11 VAL A 48 36.552 51.123 94.646 1.00 0.00 H ATOM 708 HG12 VAL A 48 36.046 49.566 93.944 1.00 0.00 H ATOM 709 HG13 VAL A 48 36.517 49.659 95.659 1.00 0.00 H ATOM 710 HG21 VAL A 48 37.778 47.732 93.644 1.00 0.00 H ATOM 711 HG22 VAL A 48 39.464 48.049 94.122 1.00 0.00 H ATOM 712 HG23 VAL A 48 38.199 47.897 95.366 1.00 0.00 H ATOM 713 H VAL A 48 40.618 50.342 92.734 1.00 0.00 H ATOM 714 N ASN A 49 37.402 52.350 92.219 1.00 60.30 N ATOM 715 CA ASN A 49 37.146 53.794 92.164 1.00 60.30 C ATOM 716 C ASN A 49 38.380 54.656 91.857 1.00 55.99 C ATOM 717 O ASN A 49 38.744 55.546 92.621 1.00 54.86 O ATOM 718 CB ASN A 49 36.406 54.260 93.434 1.00 63.82 C ATOM 719 CG ASN A 49 35.054 53.573 93.614 1.00 67.80 C ATOM 720 OD1 ASN A 49 34.301 53.905 94.528 1.00 70.92 O ATOM 721 ND2 ASN A 49 34.744 52.606 92.743 1.00 71.57 N ATOM 722 HA ASN A 49 36.497 53.951 91.302 1.00 0.00 H ATOM 723 HB2 ASN A 49 37.028 54.039 94.301 1.00 0.00 H ATOM 724 HB3 ASN A 49 36.245 55.336 93.369 1.00 0.00 H ATOM 725 HD22 ASN A 49 35.410 52.356 91.984 1.00 0.00 H ATOM 726 HD21 ASN A 49 33.837 52.104 92.825 1.00 0.00 H ATOM 727 H ASN A 49 36.763 51.719 91.694 1.00 0.00 H ATOM 728 N GLY A 50 39.027 54.355 90.735 1.00 56.76 N ATOM 729 CA GLY A 50 40.108 55.187 90.202 1.00 53.78 C ATOM 730 C GLY A 50 41.506 54.785 90.621 1.00 53.03 C ATOM 731 O GLY A 50 42.488 55.212 90.025 1.00 52.97 O ATOM 732 HA3 GLY A 50 39.939 56.211 90.534 1.00 0.00 H ATOM 733 HA2 GLY A 50 40.058 55.146 89.114 1.00 0.00 H ATOM 734 H GLY A 50 38.755 53.496 90.216 1.00 0.00 H ATOM 735 N VAL A 51 41.604 53.958 91.651 1.00 52.88 N ATOM 736 CA VAL A 51 42.904 53.625 92.209 1.00 50.59 C ATOM 737 C VAL A 51 43.212 52.121 92.092 1.00 49.65 C ATOM 738 O VAL A 51 42.341 51.271 92.284 1.00 44.48 O ATOM 739 CB VAL A 51 43.027 54.156 93.656 1.00 50.80 C ATOM 740 CG1 VAL A 51 44.365 53.810 94.286 1.00 50.42 C ATOM 741 CG2 VAL A 51 42.829 55.668 93.677 1.00 53.87 C ATOM 742 HA VAL A 51 43.669 54.128 91.617 1.00 0.00 H ATOM 743 HB VAL A 51 42.249 53.669 94.244 1.00 0.00 H ATOM 744 HG11 VAL A 51 44.483 52.727 94.312 1.00 0.00 H ATOM 745 HG12 VAL A 51 45.168 54.250 93.695 1.00 0.00 H ATOM 746 HG13 VAL A 51 44.400 54.205 95.301 1.00 0.00 H ATOM 747 HG21 VAL A 51 43.589 56.141 93.055 1.00 0.00 H ATOM 748 HG22 VAL A 51 41.839 55.909 93.289 1.00 0.00 H ATOM 749 HG23 VAL A 51 42.918 56.031 94.701 1.00 0.00 H ATOM 750 H VAL A 51 40.744 53.544 92.064 1.00 0.00 H ATOM 751 N CYS A 52 44.458 51.832 91.732 1.00 46.81 N ATOM 752 CA CYS A 52 45.008 50.493 91.745 1.00 47.97 C ATOM 753 C CYS A 52 45.553 50.157 93.149 1.00 45.79 C ATOM 754 O CYS A 52 46.633 50.609 93.523 1.00 47.35 O ATOM 755 CB CYS A 52 46.121 50.413 90.701 1.00 47.69 C ATOM 756 SG CYS A 52 46.862 48.778 90.531 1.00 52.42 S ATOM 757 HA CYS A 52 44.231 49.768 91.504 1.00 0.00 H ATOM 758 HB2 CYS A 52 46.905 51.116 90.983 1.00 0.00 H ATOM 759 HB3 CYS A 52 45.705 50.702 89.736 1.00 0.00 H ATOM 760 HG CYS A 52 47.849 48.820 89.568 1.00 0.00 H ATOM 761 H CYS A 52 45.073 52.612 91.423 1.00 0.00 H ATOM 762 N TRP A 53 44.803 49.367 93.915 1.00 43.10 N ATOM 763 CA TRP A 53 45.134 49.081 95.325 1.00 43.06 C ATOM 764 C TRP A 53 45.847 47.746 95.534 1.00 43.72 C ATOM 765 O TRP A 53 45.453 46.733 94.959 1.00 45.32 O ATOM 766 CB TRP A 53 43.867 49.038 96.169 1.00 43.58 C ATOM 767 CG TRP A 53 42.966 50.247 96.075 1.00 47.20 C ATOM 768 CD1 TRP A 53 41.872 50.398 95.264 1.00 45.95 C ATOM 769 CD2 TRP A 53 43.063 51.447 96.846 1.00 46.96 C ATOM 770 NE1 TRP A 53 41.286 51.619 95.483 1.00 46.84 N ATOM 771 CE2 TRP A 53 41.993 52.283 96.452 1.00 48.19 C ATOM 772 CE3 TRP A 53 43.947 51.896 97.837 1.00 47.37 C ATOM 773 CZ2 TRP A 53 41.790 53.552 97.003 1.00 46.94 C ATOM 774 CZ3 TRP A 53 43.737 53.152 98.391 1.00 49.95 C ATOM 775 CH2 TRP A 53 42.666 53.966 97.967 1.00 49.00 C ATOM 776 HA TRP A 53 45.804 49.886 95.625 1.00 0.00 H ATOM 777 HB2 TRP A 53 43.290 48.167 95.860 1.00 0.00 H ATOM 778 HB3 TRP A 53 44.164 48.924 97.211 1.00 0.00 H ATOM 779 HE1 TRP A 53 40.443 51.982 94.994 1.00 0.00 H ATOM 780 HD1 TRP A 53 41.518 49.656 94.548 1.00 0.00 H ATOM 781 HZ2 TRP A 53 40.966 54.186 96.677 1.00 0.00 H ATOM 782 HH2 TRP A 53 42.534 54.949 98.419 1.00 0.00 H ATOM 783 HZ3 TRP A 53 44.411 53.515 99.167 1.00 0.00 H ATOM 784 HE3 TRP A 53 44.780 51.274 98.165 1.00 0.00 H ATOM 785 H TRP A 53 43.951 48.935 93.504 1.00 0.00 H ATOM 786 N THR A 54 46.861 47.746 96.396 1.00 43.78 N ATOM 787 CA THR A 54 47.597 46.530 96.756 1.00 44.08 C ATOM 788 C THR A 54 48.205 46.615 98.186 1.00 44.03 C ATOM 789 O THR A 54 48.017 47.606 98.890 1.00 44.65 O ATOM 790 CB THR A 54 48.653 46.189 95.680 1.00 43.25 C ATOM 791 OG1 THR A 54 49.165 44.875 95.904 1.00 45.80 O ATOM 792 CG2 THR A 54 49.790 47.163 95.704 1.00 43.11 C ATOM 793 HA THR A 54 46.885 45.705 96.784 1.00 0.00 H ATOM 794 HB THR A 54 48.166 46.244 94.706 1.00 0.00 H ATOM 795 HG1 THR A 54 48.424 44.221 95.855 1.00 0.00 H ATOM 796 HG23 THR A 54 49.408 48.170 95.534 1.00 0.00 H ATOM 797 HG21 THR A 54 50.283 47.120 96.675 1.00 0.00 H ATOM 798 HG22 THR A 54 50.503 46.906 94.921 1.00 0.00 H ATOM 799 H THR A 54 47.143 48.647 96.833 1.00 0.00 H ATOM 800 N VAL A 55 48.916 45.577 98.612 1.00 43.11 N ATOM 801 CA VAL A 55 49.518 45.552 99.949 1.00 43.90 C ATOM 802 C VAL A 55 50.879 46.240 100.037 1.00 43.87 C ATOM 803 O VAL A 55 51.715 46.122 99.133 1.00 45.06 O ATOM 804 CB VAL A 55 49.652 44.116 100.509 1.00 41.26 C ATOM 805 CG1 VAL A 55 48.296 43.587 100.941 1.00 40.37 C ATOM 806 CG2 VAL A 55 50.304 43.198 99.485 1.00 41.08 C ATOM 807 HA VAL A 55 48.816 46.122 100.558 1.00 0.00 H ATOM 808 HB VAL A 55 50.297 44.143 101.387 1.00 0.00 H ATOM 809 HG11 VAL A 55 47.885 44.234 101.716 1.00 0.00 H ATOM 810 HG12 VAL A 55 47.623 43.573 100.084 1.00 0.00 H ATOM 811 HG13 VAL A 55 48.410 42.576 101.332 1.00 0.00 H ATOM 812 HG21 VAL A 55 49.693 43.169 98.583 1.00 0.00 H ATOM 813 HG22 VAL A 55 51.297 43.576 99.241 1.00 0.00 H ATOM 814 HG23 VAL A 55 50.388 42.194 99.901 1.00 0.00 H ATOM 815 H VAL A 55 49.049 44.761 97.981 1.00 0.00 H ATOM 816 N TYR A 56 51.092 46.948 101.145 1.00 45.22 N ATOM 817 CA TYR A 56 52.388 47.551 101.434 1.00 47.83 C ATOM 818 C TYR A 56 53.520 46.512 101.533 1.00 46.28 C ATOM 819 O TYR A 56 54.585 46.716 100.958 1.00 44.10 O ATOM 820 CB TYR A 56 52.336 48.402 102.706 1.00 47.65 C ATOM 821 CG TYR A 56 53.614 49.165 102.942 1.00 49.59 C ATOM 822 CD1 TYR A 56 53.868 50.357 102.259 1.00 51.41 C ATOM 823 CD2 TYR A 56 54.573 48.700 103.832 1.00 50.16 C ATOM 824 CE1 TYR A 56 55.039 51.065 102.463 1.00 51.87 C ATOM 825 CE2 TYR A 56 55.750 49.404 104.047 1.00 51.72 C ATOM 826 CZ TYR A 56 55.975 50.585 103.357 1.00 51.95 C ATOM 827 OH TYR A 56 57.141 51.285 103.547 1.00 53.75 O ATOM 828 HA TYR A 56 52.616 48.198 100.587 1.00 0.00 H ATOM 829 HB3 TYR A 56 52.157 47.747 103.558 1.00 0.00 H ATOM 830 HB2 TYR A 56 51.515 49.113 102.618 1.00 0.00 H ATOM 831 HD2 TYR A 56 54.399 47.768 104.370 1.00 0.00 H ATOM 832 HE2 TYR A 56 56.492 49.031 104.753 1.00 0.00 H ATOM 833 HE1 TYR A 56 55.221 51.994 101.922 1.00 0.00 H ATOM 834 HD1 TYR A 56 53.130 50.736 101.552 1.00 0.00 H ATOM 835 HH TYR A 56 57.134 52.096 102.979 1.00 0.00 H ATOM 836 H TYR A 56 50.313 47.074 101.822 1.00 0.00 H ATOM 837 N HIS A 57 53.290 45.408 102.249 1.00 44.62 N ATOM 838 CA HIS A 57 54.317 44.364 102.389 1.00 42.44 C ATOM 839 C HIS A 57 54.739 43.778 101.030 1.00 42.83 C ATOM 840 O HIS A 57 55.784 43.116 100.914 1.00 43.84 O ATOM 841 CB HIS A 57 53.889 43.270 103.384 1.00 40.07 C ATOM 842 CG HIS A 57 52.893 42.285 102.839 1.00 39.92 C ATOM 843 ND1 HIS A 57 51.536 42.388 103.069 1.00 38.07 N ATOM 844 CD2 HIS A 57 53.062 41.164 102.100 1.00 39.30 C ATOM 845 CE1 HIS A 57 50.914 41.378 102.490 1.00 37.35 C ATOM 846 NE2 HIS A 57 51.817 40.621 101.895 1.00 38.72 N ATOM 847 HA HIS A 57 55.201 44.845 102.807 1.00 0.00 H ATOM 848 HB2 HIS A 57 54.779 42.720 103.689 1.00 0.00 H ATOM 849 HB3 HIS A 57 53.447 43.755 104.254 1.00 0.00 H ATOM 850 HD2 HIS A 57 54.009 40.766 101.736 1.00 0.00 H ATOM 851 HE1 HIS A 57 49.839 41.200 102.501 1.00 0.00 H ATOM 852 H HIS A 57 52.369 45.284 102.716 1.00 0.00 H ATOM 853 N GLY A 58 53.928 44.043 100.008 1.00 40.94 N ATOM 854 CA GLY A 58 54.284 43.718 98.631 1.00 40.91 C ATOM 855 C GLY A 58 54.925 44.873 97.871 1.00 42.81 C ATOM 856 O GLY A 58 56.059 44.764 97.413 1.00 39.61 O ATOM 857 HA3 GLY A 58 53.378 43.420 98.103 1.00 0.00 H ATOM 858 HA2 GLY A 58 54.986 42.884 98.645 1.00 0.00 H ATOM 859 H GLY A 58 53.011 44.496 100.197 1.00 0.00 H ATOM 860 N ALA A 59 54.196 45.981 97.739 1.00 45.35 N ATOM 861 CA ALA A 59 54.644 47.117 96.924 1.00 48.52 C ATOM 862 C ALA A 59 55.696 48.023 97.572 1.00 51.05 C ATOM 863 O ALA A 59 56.427 48.736 96.871 1.00 51.98 O ATOM 864 CB ALA A 59 53.449 47.941 96.478 1.00 48.70 C ATOM 865 HA ALA A 59 55.150 46.667 96.070 1.00 0.00 H ATOM 866 HB1 ALA A 59 52.779 47.317 95.886 1.00 0.00 H ATOM 867 HB2 ALA A 59 52.920 48.315 97.354 1.00 0.00 H ATOM 868 HB3 ALA A 59 53.793 48.781 95.874 1.00 0.00 H ATOM 869 H ALA A 59 53.281 46.043 98.229 1.00 0.00 H ATOM 870 N GLY A 60 55.781 47.995 98.900 1.00 50.22 N ATOM 871 CA GLY A 60 56.537 49.006 99.633 1.00 50.25 C ATOM 872 C GLY A 60 56.013 50.388 99.281 1.00 51.66 C ATOM 873 O GLY A 60 54.801 50.606 99.228 1.00 52.69 O ATOM 874 HA3 GLY A 60 57.591 48.938 99.364 1.00 0.00 H ATOM 875 HA2 GLY A 60 56.425 48.837 100.704 1.00 0.00 H ATOM 876 H GLY A 60 55.299 47.238 99.426 1.00 0.00 H ATOM 877 N SER A 61 56.930 51.318 99.026 1.00 53.21 N ATOM 878 CA SER A 61 56.578 52.660 98.567 1.00 54.39 C ATOM 879 C SER A 61 56.952 52.839 97.099 1.00 56.39 C ATOM 880 O SER A 61 56.986 53.964 96.591 1.00 58.29 O ATOM 881 CB SER A 61 57.305 53.711 99.406 1.00 55.52 C ATOM 882 OG SER A 61 58.708 53.545 99.288 1.00 58.62 O ATOM 883 HA SER A 61 55.501 52.787 98.678 1.00 0.00 H ATOM 884 HB2 SER A 61 57.016 53.601 100.451 1.00 0.00 H ATOM 885 HB3 SER A 61 57.029 54.706 99.056 1.00 0.00 H ATOM 886 HG SER A 61 58.960 52.643 99.607 1.00 0.00 H ATOM 887 H SER A 61 57.934 51.081 99.158 1.00 0.00 H ATOM 888 N LYS A 62 57.247 51.723 96.433 1.00 56.80 N ATOM 889 CA LYS A 62 57.668 51.725 95.039 1.00 53.19 C ATOM 890 C LYS A 62 56.625 52.347 94.133 1.00 50.96 C ATOM 891 O LYS A 62 55.413 52.273 94.394 1.00 49.58 O ATOM 892 CB LYS A 62 57.990 50.310 94.544 1.00 51.60 C ATOM 893 CG LYS A 62 59.250 49.718 95.138 1.00 52.51 C ATOM 894 CD LYS A 62 59.597 48.401 94.473 1.00 51.40 C ATOM 895 CE LYS A 62 60.795 47.770 95.150 1.00 53.08 C ATOM 896 NZ LYS A 62 61.598 46.970 94.185 1.00 58.56 N ATOM 897 HA LYS A 62 58.573 52.331 94.996 1.00 0.00 H ATOM 898 HB2 LYS A 62 57.153 49.660 94.798 1.00 0.00 H ATOM 899 HB3 LYS A 62 58.106 50.344 93.461 1.00 0.00 H ATOM 900 HG2 LYS A 62 60.074 50.417 94.996 1.00 0.00 H ATOM 901 HG3 LYS A 62 59.097 49.550 96.204 1.00 0.00 H ATOM 902 HD2 LYS A 62 58.745 47.725 94.546 1.00 0.00 H ATOM 903 HD3 LYS A 62 59.829 48.578 93.423 1.00 0.00 H ATOM 904 HE2 LYS A 62 60.448 47.118 95.952 1.00 0.00 H ATOM 905 HE3 LYS A 62 61.422 48.557 95.569 1.00 0.00 H ATOM 906 HZ1 LYS A 62 61.005 46.214 93.785 1.00 0.00 H ATOM 907 HZ2 LYS A 62 61.936 47.589 93.420 1.00 0.00 H ATOM 908 HZ3 LYS A 62 62.412 46.550 94.678 1.00 0.00 H ATOM 909 H LYS A 62 57.173 50.812 96.930 1.00 0.00 H ATOM 910 N THR A 63 57.133 52.972 93.077 1.00 47.15 N ATOM 911 CA THR A 63 56.337 53.469 91.967 1.00 48.90 C ATOM 912 C THR A 63 55.827 52.313 91.099 1.00 45.49 C ATOM 913 O THR A 63 56.434 51.244 91.065 1.00 48.23 O ATOM 914 CB THR A 63 57.176 54.436 91.103 1.00 51.79 C ATOM 915 OG1 THR A 63 56.514 54.657 89.853 1.00 59.47 O ATOM 916 CG2 THR A 63 58.585 53.874 90.851 1.00 48.47 C ATOM 917 HA THR A 63 55.479 54.001 92.377 1.00 0.00 H ATOM 918 HB THR A 63 57.277 55.379 91.641 1.00 0.00 H ATOM 919 HG1 THR A 63 55.621 55.052 90.019 1.00 0.00 H ATOM 920 HG23 THR A 63 59.084 53.708 91.805 1.00 0.00 H ATOM 921 HG21 THR A 63 58.507 52.930 90.311 1.00 0.00 H ATOM 922 HG22 THR A 63 59.159 54.587 90.259 1.00 0.00 H ATOM 923 H THR A 63 58.163 53.114 93.042 1.00 0.00 H ATOM 924 N LEU A 64 54.711 52.529 90.412 1.00 43.65 N ATOM 925 CA LEU A 64 54.188 51.564 89.452 1.00 45.66 C ATOM 926 C LEU A 64 54.470 52.016 88.013 1.00 48.08 C ATOM 927 O LEU A 64 54.213 53.169 87.655 1.00 49.48 O ATOM 928 CB LEU A 64 52.685 51.372 89.662 1.00 42.89 C ATOM 929 CG LEU A 64 51.844 50.593 88.647 1.00 40.92 C ATOM 930 CD1 LEU A 64 51.878 49.092 88.915 1.00 39.27 C ATOM 931 CD2 LEU A 64 50.413 51.110 88.698 1.00 41.71 C ATOM 932 HA LEU A 64 54.692 50.612 89.615 1.00 0.00 H ATOM 933 HB2 LEU A 64 52.567 50.864 90.619 1.00 0.00 H ATOM 934 HB3 LEU A 64 52.250 52.369 89.726 1.00 0.00 H ATOM 935 HG LEU A 64 52.264 50.748 87.653 1.00 0.00 H ATOM 936 HD21 LEU A 64 50.011 50.965 89.701 1.00 0.00 H ATOM 937 HD22 LEU A 64 50.403 52.172 88.451 1.00 0.00 H ATOM 938 HD23 LEU A 64 49.804 50.562 87.979 1.00 0.00 H ATOM 939 HD11 LEU A 64 52.906 48.736 88.853 1.00 0.00 H ATOM 940 HD12 LEU A 64 51.483 48.893 89.911 1.00 0.00 H ATOM 941 HD13 LEU A 64 51.269 48.578 88.172 1.00 0.00 H ATOM 942 H LEU A 64 54.192 53.417 90.564 1.00 0.00 H ATOM 943 N ALA A 65 54.993 51.104 87.198 1.00 47.79 N ATOM 944 CA ALA A 65 55.316 51.407 85.806 1.00 50.29 C ATOM 945 C ALA A 65 54.056 51.763 85.030 1.00 52.32 C ATOM 946 O ALA A 65 53.097 50.996 85.026 1.00 53.76 O ATOM 947 CB ALA A 65 56.039 50.240 85.150 1.00 47.86 C ATOM 948 HA ALA A 65 55.984 52.269 85.792 1.00 0.00 H ATOM 949 HB1 ALA A 65 56.965 50.038 85.689 1.00 0.00 H ATOM 950 HB2 ALA A 65 55.401 49.357 85.178 1.00 0.00 H ATOM 951 HB3 ALA A 65 56.268 50.492 84.114 1.00 0.00 H ATOM 952 H ALA A 65 55.177 50.148 87.562 1.00 0.00 H ATOM 953 N GLY A 66 54.065 52.934 84.390 1.00 56.29 N ATOM 954 CA GLY A 66 52.897 53.449 83.662 1.00 57.61 C ATOM 955 C GLY A 66 53.182 53.816 82.210 1.00 59.86 C ATOM 956 O GLY A 66 54.342 53.802 81.781 1.00 57.08 O ATOM 957 HA3 GLY A 66 52.538 54.340 84.177 1.00 0.00 H ATOM 958 HA2 GLY A 66 52.120 52.685 83.676 1.00 0.00 H ATOM 959 H GLY A 66 54.934 53.505 84.407 1.00 0.00 H ATOM 960 N PRO A 67 52.123 54.149 81.443 1.00 62.05 N ATOM 961 CA PRO A 67 52.253 54.444 80.009 1.00 65.43 C ATOM 962 C PRO A 67 53.249 55.572 79.732 1.00 67.87 C ATOM 963 O PRO A 67 54.146 55.410 78.903 1.00 68.55 O ATOM 964 CB PRO A 67 50.826 54.852 79.589 1.00 63.01 C ATOM 965 CG PRO A 67 50.117 55.183 80.856 1.00 65.28 C ATOM 966 CD PRO A 67 50.734 54.311 81.913 1.00 64.43 C ATOM 967 HA PRO A 67 52.639 53.590 79.452 1.00 0.00 H ATOM 968 HD3 PRO A 67 50.705 54.797 82.888 1.00 0.00 H ATOM 969 HD2 PRO A 67 50.226 53.349 81.973 1.00 0.00 H ATOM 970 HG3 PRO A 67 49.052 54.970 80.762 1.00 0.00 H ATOM 971 HG2 PRO A 67 50.255 56.235 81.104 1.00 0.00 H ATOM 972 HB2 PRO A 67 50.856 55.720 78.931 1.00 0.00 H ATOM 973 HB3 PRO A 67 50.329 54.028 79.078 1.00 0.00 H ATOM 974 N LYS A 68 53.100 56.693 80.436 1.00 69.95 N ATOM 975 CA LYS A 68 54.018 57.812 80.297 1.00 70.36 C ATOM 976 C LYS A 68 54.896 57.967 81.534 1.00 67.91 C ATOM 977 O LYS A 68 54.917 59.027 82.161 1.00 73.47 O ATOM 978 CB LYS A 68 53.260 59.117 79.994 1.00 74.11 C ATOM 979 CG LYS A 68 52.684 59.248 78.580 1.00 75.17 C ATOM 980 CD LYS A 68 53.706 59.082 77.447 1.00 76.94 C ATOM 981 CE LYS A 68 54.941 59.970 77.571 1.00 75.48 C ATOM 982 NZ LYS A 68 54.618 61.414 77.698 1.00 77.03 N ATOM 983 HA LYS A 68 54.671 57.598 79.451 1.00 0.00 H ATOM 984 HB2 LYS A 68 52.433 59.194 80.700 1.00 0.00 H ATOM 985 HB3 LYS A 68 53.949 59.947 80.152 1.00 0.00 H ATOM 986 HG2 LYS A 68 51.914 58.486 78.456 1.00 0.00 H ATOM 987 HG3 LYS A 68 52.234 60.236 78.488 1.00 0.00 H ATOM 988 HD2 LYS A 68 54.034 58.043 77.434 1.00 0.00 H ATOM 989 HD3 LYS A 68 53.211 59.317 76.505 1.00 0.00 H ATOM 990 HE2 LYS A 68 55.558 59.830 76.683 1.00 0.00 H ATOM 991 HE3 LYS A 68 55.501 59.662 78.454 1.00 0.00 H ATOM 992 HZ1 LYS A 68 54.091 61.725 76.857 1.00 0.00 H ATOM 993 HZ2 LYS A 68 54.037 61.565 78.548 1.00 0.00 H ATOM 994 HZ3 LYS A 68 55.500 61.959 77.778 1.00 0.00 H ATOM 995 H LYS A 68 52.306 56.770 81.103 1.00 0.00 H ATOM 996 N GLY A 69 55.616 56.901 81.879 1.00 65.57 N ATOM 997 CA GLY A 69 56.578 56.930 82.984 1.00 60.55 C ATOM 998 C GLY A 69 56.094 56.312 84.291 1.00 57.17 C ATOM 999 O GLY A 69 54.971 55.818 84.371 1.00 59.13 O ATOM 1000 HA3 GLY A 69 56.835 57.971 83.179 1.00 0.00 H ATOM 1001 HA2 GLY A 69 57.470 56.390 82.667 1.00 0.00 H ATOM 1002 H GLY A 69 55.491 56.017 81.345 1.00 0.00 H ATOM 1003 N PRO A 70 56.953 56.320 85.322 1.00 53.64 N ATOM 1004 CA PRO A 70 56.608 55.839 86.660 1.00 54.02 C ATOM 1005 C PRO A 70 55.434 56.588 87.299 1.00 53.42 C ATOM 1006 O PRO A 70 55.414 57.815 87.295 1.00 50.01 O ATOM 1007 CB PRO A 70 57.893 56.081 87.465 1.00 54.33 C ATOM 1008 CG PRO A 70 58.769 56.943 86.610 1.00 55.20 C ATOM 1009 CD PRO A 70 58.390 56.613 85.203 1.00 54.30 C ATOM 1010 HA PRO A 70 56.281 54.799 86.631 1.00 0.00 H ATOM 1011 HD3 PRO A 70 58.566 57.459 84.538 1.00 0.00 H ATOM 1012 HD2 PRO A 70 58.941 55.745 84.839 1.00 0.00 H ATOM 1013 HG3 PRO A 70 59.820 56.715 86.787 1.00 0.00 H ATOM 1014 HG2 PRO A 70 58.588 57.998 86.818 1.00 0.00 H ATOM 1015 HB2 PRO A 70 57.662 56.589 88.401 1.00 0.00 H ATOM 1016 HB3 PRO A 70 58.388 55.134 87.679 1.00 0.00 H ATOM 1017 N ILE A 71 54.461 55.848 87.827 1.00 53.40 N ATOM 1018 CA ILE A 71 53.356 56.449 88.579 1.00 55.34 C ATOM 1019 C ILE A 71 53.689 56.439 90.066 1.00 59.79 C ATOM 1020 O ILE A 71 53.952 55.380 90.651 1.00 60.86 O ATOM 1021 CB ILE A 71 52.012 55.729 88.349 1.00 54.51 C ATOM 1022 CG1 ILE A 71 51.726 55.579 86.851 1.00 53.67 C ATOM 1023 CG2 ILE A 71 50.884 56.480 89.050 1.00 54.97 C ATOM 1024 CD1 ILE A 71 50.480 54.778 86.525 1.00 53.77 C ATOM 1025 HA ILE A 71 53.239 57.470 88.217 1.00 0.00 H ATOM 1026 HB ILE A 71 52.075 54.729 88.777 1.00 0.00 H ATOM 1027 HG12 ILE A 71 51.612 56.576 86.425 1.00 0.00 H ATOM 1028 HG13 ILE A 71 52.580 55.084 86.389 1.00 0.00 H ATOM 1029 HD11 ILE A 71 50.580 53.772 86.931 1.00 0.00 H ATOM 1030 HD12 ILE A 71 49.611 55.265 86.967 1.00 0.00 H ATOM 1031 HD13 ILE A 71 50.357 54.724 85.443 1.00 0.00 H ATOM 1032 HG21 ILE A 71 51.088 56.523 90.120 1.00 0.00 H ATOM 1033 HG22 ILE A 71 50.820 57.492 88.650 1.00 0.00 H ATOM 1034 HG23 ILE A 71 49.942 55.960 88.879 1.00 0.00 H ATOM 1035 H ILE A 71 54.486 54.816 87.702 1.00 0.00 H ATOM 1036 N THR A 72 53.684 57.627 90.666 1.00 60.26 N ATOM 1037 CA THR A 72 53.972 57.785 92.086 1.00 57.61 C ATOM 1038 C THR A 72 52.769 57.281 92.902 1.00 59.40 C ATOM 1039 O THR A 72 51.616 57.425 92.476 1.00 57.11 O ATOM 1040 CB THR A 72 54.335 59.259 92.425 1.00 57.52 C ATOM 1041 OG1 THR A 72 55.444 59.303 93.332 1.00 57.91 O ATOM 1042 CG2 THR A 72 53.149 60.023 93.024 1.00 59.07 C ATOM 1043 HA THR A 72 54.844 57.187 92.350 1.00 0.00 H ATOM 1044 HB THR A 72 54.606 59.746 91.488 1.00 0.00 H ATOM 1045 HG1 THR A 72 55.663 60.246 93.538 1.00 0.00 H ATOM 1046 HG23 THR A 72 52.308 59.987 92.331 1.00 0.00 H ATOM 1047 HG21 THR A 72 52.862 59.563 93.970 1.00 0.00 H ATOM 1048 HG22 THR A 72 53.436 61.060 93.196 1.00 0.00 H ATOM 1049 H THR A 72 53.467 58.473 90.101 1.00 0.00 H ATOM 1050 N GLN A 73 53.048 56.670 94.053 1.00 59.18 N ATOM 1051 CA GLN A 73 52.003 56.265 94.988 1.00 62.25 C ATOM 1052 C GLN A 73 51.263 57.488 95.523 1.00 65.40 C ATOM 1053 O GLN A 73 51.846 58.292 96.251 1.00 70.70 O ATOM 1054 CB GLN A 73 52.608 55.478 96.155 1.00 59.86 C ATOM 1055 CG GLN A 73 52.746 53.986 95.899 1.00 57.49 C ATOM 1056 CD GLN A 73 53.142 53.195 97.135 1.00 55.98 C ATOM 1057 OE1 GLN A 73 53.014 53.666 98.268 1.00 55.19 O ATOM 1058 NE2 GLN A 73 53.623 51.977 96.919 1.00 54.25 N ATOM 1059 HA GLN A 73 51.297 55.628 94.456 1.00 0.00 H ATOM 1060 HB2 GLN A 73 53.599 55.882 96.362 1.00 0.00 H ATOM 1061 HB3 GLN A 73 51.970 55.617 97.028 1.00 0.00 H ATOM 1062 HG2 GLN A 73 51.790 53.607 95.538 1.00 0.00 H ATOM 1063 HG3 GLN A 73 53.507 53.836 95.134 1.00 0.00 H ATOM 1064 HE22 GLN A 73 53.714 51.619 95.947 1.00 0.00 H ATOM 1065 HE21 GLN A 73 53.909 51.381 97.722 1.00 0.00 H ATOM 1066 H GLN A 73 54.041 56.476 94.292 1.00 0.00 H ATOM 1067 N MET A 74 49.994 57.641 95.153 1.00 67.95 N ATOM 1068 CA MET A 74 49.179 58.736 95.680 1.00 73.06 C ATOM 1069 C MET A 74 48.754 58.433 97.117 1.00 76.19 C ATOM 1070 O MET A 74 48.585 59.343 97.932 1.00 76.37 O ATOM 1071 CB MET A 74 47.946 59.000 94.804 1.00 77.79 C ATOM 1072 CG MET A 74 46.781 58.045 95.042 1.00 85.66 C ATOM 1073 SD MET A 74 45.156 58.776 94.757 1.00 94.92 S ATOM 1074 CE MET A 74 44.218 58.040 96.098 1.00 89.88 C ATOM 1075 HA MET A 74 49.790 59.639 95.669 1.00 0.00 H ATOM 1076 HB2 MET A 74 47.600 60.015 95.001 1.00 0.00 H ATOM 1077 HB3 MET A 74 48.247 58.916 93.760 1.00 0.00 H ATOM 1078 HG2 MET A 74 46.825 57.702 96.076 1.00 0.00 H ATOM 1079 HG3 MET A 74 46.895 57.193 94.372 1.00 0.00 H ATOM 1080 HE1 MET A 74 44.233 56.955 95.997 1.00 0.00 H ATOM 1081 HE2 MET A 74 44.665 58.324 97.051 1.00 0.00 H ATOM 1082 HE3 MET A 74 43.188 58.396 96.057 1.00 0.00 H ATOM 1083 H MET A 74 49.574 56.971 94.478 1.00 0.00 H ATOM 1084 N TYR A 75 48.604 57.144 97.415 1.00 77.56 N ATOM 1085 CA TYR A 75 48.098 56.681 98.697 1.00 76.77 C ATOM 1086 C TYR A 75 49.064 55.665 99.308 1.00 70.51 C ATOM 1087 O TYR A 75 49.518 54.733 98.643 1.00 65.30 O ATOM 1088 CB TYR A 75 46.716 56.051 98.500 1.00 84.45 C ATOM 1089 CG TYR A 75 45.731 56.238 99.642 1.00 95.52 C ATOM 1090 CD1 TYR A 75 45.986 55.714 100.919 1.00 96.91 C ATOM 1091 CD2 TYR A 75 44.522 56.908 99.436 1.00 99.14 C ATOM 1092 CE1 TYR A 75 45.073 55.872 101.956 1.00 99.70 C ATOM 1093 CE2 TYR A 75 43.603 57.071 100.466 1.00104.49 C ATOM 1094 CZ TYR A 75 43.880 56.552 101.723 1.00105.09 C ATOM 1095 OH TYR A 75 42.964 56.714 102.742 1.00102.10 O ATOM 1096 HA TYR A 75 48.012 57.527 99.379 1.00 0.00 H ATOM 1097 HB3 TYR A 75 46.855 54.980 98.351 1.00 0.00 H ATOM 1098 HB2 TYR A 75 46.275 56.487 97.604 1.00 0.00 H ATOM 1099 HD2 TYR A 75 44.295 57.310 98.449 1.00 0.00 H ATOM 1100 HE2 TYR A 75 42.669 57.604 100.287 1.00 0.00 H ATOM 1101 HE1 TYR A 75 45.290 55.466 102.944 1.00 0.00 H ATOM 1102 HD1 TYR A 75 46.915 55.174 101.101 1.00 0.00 H ATOM 1103 HH TYR A 75 43.311 56.289 103.566 1.00 0.00 H ATOM 1104 H TYR A 75 48.861 56.436 96.698 1.00 0.00 H ATOM 1105 N THR A 76 49.404 55.879 100.572 1.00 66.25 N ATOM 1106 CA THR A 76 50.181 54.916 101.344 1.00 62.03 C ATOM 1107 C THR A 76 49.663 54.970 102.770 1.00 62.49 C ATOM 1108 O THR A 76 49.682 56.025 103.417 1.00 65.77 O ATOM 1109 CB THR A 76 51.700 55.203 101.319 1.00 59.57 C ATOM 1110 OG1 THR A 76 52.144 55.355 99.968 1.00 61.29 O ATOM 1111 CG2 THR A 76 52.482 54.069 101.966 1.00 54.96 C ATOM 1112 HA THR A 76 50.059 53.927 100.902 1.00 0.00 H ATOM 1113 HB THR A 76 51.876 56.121 101.879 1.00 0.00 H ATOM 1114 HG1 THR A 76 51.960 54.522 99.466 1.00 0.00 H ATOM 1115 HG23 THR A 76 52.152 53.944 102.997 1.00 0.00 H ATOM 1116 HG21 THR A 76 52.307 53.146 101.412 1.00 0.00 H ATOM 1117 HG22 THR A 76 53.545 54.307 101.950 1.00 0.00 H ATOM 1118 H THR A 76 49.106 56.765 101.029 1.00 0.00 H ATOM 1119 N ASN A 77 49.175 53.830 103.238 1.00 57.81 N ATOM 1120 CA ASN A 77 48.726 53.679 104.608 1.00 55.57 C ATOM 1121 C ASN A 77 49.406 52.448 105.202 1.00 54.62 C ATOM 1122 O ASN A 77 48.881 51.336 105.127 1.00 53.14 O ATOM 1123 CB ASN A 77 47.198 53.568 104.642 1.00 55.44 C ATOM 1124 CG ASN A 77 46.632 53.556 106.050 1.00 55.52 C ATOM 1125 OD1 ASN A 77 45.427 53.412 106.227 1.00 55.60 O ATOM 1126 ND2 ASN A 77 47.492 53.704 107.054 1.00 54.78 N ATOM 1127 HA ASN A 77 48.998 54.548 105.207 1.00 0.00 H ATOM 1128 HB2 ASN A 77 46.776 54.418 104.106 1.00 0.00 H ATOM 1129 HB3 ASN A 77 46.906 52.644 104.143 1.00 0.00 H ATOM 1130 HD22 ASN A 77 48.506 53.823 106.857 1.00 0.00 H ATOM 1131 HD21 ASN A 77 47.150 53.700 108.036 1.00 0.00 H ATOM 1132 H ASN A 77 49.112 53.013 102.598 1.00 0.00 H ATOM 1133 N VAL A 78 50.591 52.660 105.771 1.00 54.62 N ATOM 1134 CA VAL A 78 51.392 51.579 106.348 1.00 54.47 C ATOM 1135 C VAL A 78 50.693 50.914 107.541 1.00 54.78 C ATOM 1136 O VAL A 78 50.850 49.710 107.751 1.00 52.35 O ATOM 1137 CB VAL A 78 52.808 52.059 106.738 1.00 58.25 C ATOM 1138 CG1 VAL A 78 53.737 50.871 106.950 1.00 57.29 C ATOM 1139 CG2 VAL A 78 53.380 52.977 105.662 1.00 57.74 C ATOM 1140 HA VAL A 78 51.498 50.824 105.569 1.00 0.00 H ATOM 1141 HB VAL A 78 52.730 52.617 107.671 1.00 0.00 H ATOM 1142 HG11 VAL A 78 53.344 50.242 107.749 1.00 0.00 H ATOM 1143 HG12 VAL A 78 53.801 50.292 106.028 1.00 0.00 H ATOM 1144 HG13 VAL A 78 54.729 51.231 107.224 1.00 0.00 H ATOM 1145 HG21 VAL A 78 53.438 52.436 104.718 1.00 0.00 H ATOM 1146 HG22 VAL A 78 52.732 53.846 105.545 1.00 0.00 H ATOM 1147 HG23 VAL A 78 54.377 53.303 105.957 1.00 0.00 H ATOM 1148 H VAL A 78 50.962 53.631 105.807 1.00 0.00 H ATOM 1149 N ASP A 79 49.920 51.704 108.295 1.00 55.40 N ATOM 1150 CA ASP A 79 49.081 51.219 109.403 1.00 54.97 C ATOM 1151 C ASP A 79 48.122 50.111 108.950 1.00 52.82 C ATOM 1152 O ASP A 79 47.776 49.218 109.721 1.00 50.95 O ATOM 1153 CB ASP A 79 48.224 52.360 109.995 1.00 59.44 C ATOM 1154 CG ASP A 79 49.048 53.489 110.644 1.00 63.03 C ATOM 1155 OD1 ASP A 79 50.295 53.504 110.543 1.00 62.88 O ATOM 1156 OD2 ASP A 79 48.419 54.381 111.266 1.00 62.65 O ATOM 1157 HA ASP A 79 49.769 50.829 110.153 1.00 0.00 H ATOM 1158 HB2 ASP A 79 47.624 52.790 109.193 1.00 0.00 H ATOM 1159 HB3 ASP A 79 47.565 51.937 110.753 1.00 0.00 H ATOM 1160 H ASP A 79 49.911 52.723 108.086 1.00 0.00 H ATOM 1161 N GLN A 80 47.673 50.205 107.703 1.00 49.44 N ATOM 1162 CA GLN A 80 46.679 49.296 107.159 1.00 50.59 C ATOM 1163 C GLN A 80 47.292 48.299 106.167 1.00 47.55 C ATOM 1164 O GLN A 80 46.594 47.417 105.651 1.00 48.72 O ATOM 1165 CB GLN A 80 45.559 50.111 106.502 1.00 55.78 C ATOM 1166 CG GLN A 80 44.231 49.387 106.319 1.00 62.51 C ATOM 1167 CD GLN A 80 43.465 49.160 107.614 1.00 67.40 C ATOM 1168 OE1 GLN A 80 42.642 48.238 107.710 1.00 67.34 O ATOM 1169 NE2 GLN A 80 43.721 50.000 108.614 1.00 66.68 N ATOM 1170 HA GLN A 80 46.267 48.704 107.976 1.00 0.00 H ATOM 1171 HB2 GLN A 80 45.378 50.990 107.120 1.00 0.00 H ATOM 1172 HB3 GLN A 80 45.907 50.425 105.518 1.00 0.00 H ATOM 1173 HG2 GLN A 80 43.607 49.980 105.651 1.00 0.00 H ATOM 1174 HG3 GLN A 80 44.429 48.417 105.863 1.00 0.00 H ATOM 1175 HE22 GLN A 80 44.420 50.760 108.489 1.00 0.00 H ATOM 1176 HE21 GLN A 80 43.222 49.897 109.521 1.00 0.00 H ATOM 1177 H GLN A 80 48.048 50.959 107.092 1.00 0.00 H ATOM 1178 N ASP A 81 48.598 48.431 105.917 1.00 45.76 N ATOM 1179 CA ASP A 81 49.305 47.608 104.920 1.00 44.42 C ATOM 1180 C ASP A 81 48.730 47.815 103.502 1.00 43.82 C ATOM 1181 O ASP A 81 48.703 46.899 102.682 1.00 44.02 O ATOM 1182 CB ASP A 81 49.265 46.132 105.345 1.00 43.55 C ATOM 1183 CG ASP A 81 50.151 45.242 104.502 1.00 43.90 C ATOM 1184 OD1 ASP A 81 51.135 45.747 103.897 1.00 40.55 O ATOM 1185 OD2 ASP A 81 49.845 44.023 104.448 1.00 41.69 O ATOM 1186 HA ASP A 81 50.347 47.926 104.879 1.00 0.00 H ATOM 1187 HB2 ASP A 81 49.591 46.062 106.383 1.00 0.00 H ATOM 1188 HB3 ASP A 81 48.238 45.776 105.263 1.00 0.00 H ATOM 1189 H ASP A 81 49.138 49.144 106.448 1.00 0.00 H ATOM 1190 N LEU A 82 48.281 49.035 103.224 1.00 42.44 N ATOM 1191 CA LEU A 82 47.638 49.362 101.951 1.00 46.56 C ATOM 1192 C LEU A 82 48.410 50.442 101.192 1.00 49.87 C ATOM 1193 O LEU A 82 48.866 51.417 101.782 1.00 51.95 O ATOM 1194 CB LEU A 82 46.205 49.840 102.205 1.00 44.53 C ATOM 1195 CG LEU A 82 45.301 50.300 101.056 1.00 46.27 C ATOM 1196 CD1 LEU A 82 44.788 49.126 100.226 1.00 44.50 C ATOM 1197 CD2 LEU A 82 44.135 51.096 101.623 1.00 43.22 C ATOM 1198 HA LEU A 82 47.628 48.460 101.339 1.00 0.00 H ATOM 1199 HB2 LEU A 82 45.687 49.015 102.693 1.00 0.00 H ATOM 1200 HB3 LEU A 82 46.278 50.681 102.895 1.00 0.00 H ATOM 1201 HG LEU A 82 45.891 50.929 100.390 1.00 0.00 H ATOM 1202 HD21 LEU A 82 43.566 50.467 102.307 1.00 0.00 H ATOM 1203 HD22 LEU A 82 44.517 51.965 102.159 1.00 0.00 H ATOM 1204 HD23 LEU A 82 43.490 51.424 100.808 1.00 0.00 H ATOM 1205 HD11 LEU A 82 45.634 48.587 99.799 1.00 0.00 H ATOM 1206 HD12 LEU A 82 44.213 48.455 100.864 1.00 0.00 H ATOM 1207 HD13 LEU A 82 44.152 49.500 99.424 1.00 0.00 H ATOM 1208 H LEU A 82 48.391 49.784 103.937 1.00 0.00 H ATOM 1209 N VAL A 83 48.570 50.255 99.886 1.00 52.18 N ATOM 1210 CA VAL A 83 49.030 51.330 99.006 1.00 51.35 C ATOM 1211 C VAL A 83 48.097 51.408 97.807 1.00 50.59 C ATOM 1212 O VAL A 83 47.397 50.441 97.493 1.00 48.99 O ATOM 1213 CB VAL A 83 50.501 51.166 98.532 1.00 50.54 C ATOM 1214 CG1 VAL A 83 51.462 51.112 99.713 1.00 52.04 C ATOM 1215 CG2 VAL A 83 50.670 49.936 97.654 1.00 50.42 C ATOM 1216 HA VAL A 83 49.008 52.255 99.583 1.00 0.00 H ATOM 1217 HB VAL A 83 50.744 52.044 97.934 1.00 0.00 H ATOM 1218 HG11 VAL A 83 51.383 52.036 100.286 1.00 0.00 H ATOM 1219 HG12 VAL A 83 51.206 50.265 100.349 1.00 0.00 H ATOM 1220 HG13 VAL A 83 52.482 50.997 99.345 1.00 0.00 H ATOM 1221 HG21 VAL A 83 50.388 49.047 98.218 1.00 0.00 H ATOM 1222 HG22 VAL A 83 50.032 50.028 96.775 1.00 0.00 H ATOM 1223 HG23 VAL A 83 51.711 49.854 97.342 1.00 0.00 H ATOM 1224 H VAL A 83 48.363 49.321 99.479 1.00 0.00 H ATOM 1225 N GLY A 84 48.081 52.568 97.158 1.00 49.40 N ATOM 1226 CA GLY A 84 47.343 52.759 95.923 1.00 52.04 C ATOM 1227 C GLY A 84 48.073 53.674 94.953 1.00 54.76 C ATOM 1228 O GLY A 84 48.832 54.563 95.368 1.00 53.53 O ATOM 1229 HA3 GLY A 84 46.373 53.198 96.158 1.00 0.00 H ATOM 1230 HA2 GLY A 84 47.196 51.789 95.448 1.00 0.00 H ATOM 1231 H GLY A 84 48.617 53.368 97.550 1.00 0.00 H ATOM 1232 N TRP A 85 47.858 53.431 93.660 1.00 52.38 N ATOM 1233 CA TRP A 85 48.293 54.332 92.598 1.00 50.64 C ATOM 1234 C TRP A 85 47.052 54.723 91.815 1.00 51.92 C ATOM 1235 O TRP A 85 46.130 53.915 91.691 1.00 50.87 O ATOM 1236 CB TRP A 85 49.254 53.631 91.635 1.00 51.97 C ATOM 1237 CG TRP A 85 50.473 52.977 92.239 1.00 50.36 C ATOM 1238 CD1 TRP A 85 51.648 53.582 92.566 1.00 50.03 C ATOM 1239 CD2 TRP A 85 50.646 51.585 92.531 1.00 50.94 C ATOM 1240 NE1 TRP A 85 52.541 52.661 93.064 1.00 49.29 N ATOM 1241 CE2 TRP A 85 51.950 51.426 93.060 1.00 49.32 C ATOM 1242 CE3 TRP A 85 49.823 50.456 92.408 1.00 51.98 C ATOM 1243 CZ2 TRP A 85 52.455 50.183 93.457 1.00 48.76 C ATOM 1244 CZ3 TRP A 85 50.325 49.216 92.813 1.00 49.75 C ATOM 1245 CH2 TRP A 85 51.628 49.094 93.330 1.00 50.18 C ATOM 1246 HA TRP A 85 48.804 55.190 93.035 1.00 0.00 H ATOM 1247 HB2 TRP A 85 48.691 52.858 91.112 1.00 0.00 H ATOM 1248 HB3 TRP A 85 49.601 54.374 90.917 1.00 0.00 H ATOM 1249 HE1 TRP A 85 53.506 52.869 93.390 1.00 0.00 H ATOM 1250 HD1 TRP A 85 51.853 54.646 92.450 1.00 0.00 H ATOM 1251 HZ2 TRP A 85 53.466 50.083 93.852 1.00 0.00 H ATOM 1252 HH2 TRP A 85 51.989 48.112 93.637 1.00 0.00 H ATOM 1253 HZ3 TRP A 85 49.697 48.329 92.727 1.00 0.00 H ATOM 1254 HE3 TRP A 85 48.814 50.544 92.005 1.00 0.00 H ATOM 1255 H TRP A 85 47.357 52.559 93.396 1.00 0.00 H ATOM 1256 N PRO A 86 47.012 55.960 91.274 1.00 53.79 N ATOM 1257 CA PRO A 86 45.937 56.245 90.324 1.00 53.13 C ATOM 1258 C PRO A 86 46.003 55.222 89.192 1.00 53.13 C ATOM 1259 O PRO A 86 47.078 55.001 88.632 1.00 51.34 O ATOM 1260 CB PRO A 86 46.269 57.656 89.810 1.00 51.61 C ATOM 1261 CG PRO A 86 47.669 57.931 90.244 1.00 53.51 C ATOM 1262 CD PRO A 86 47.874 57.134 91.497 1.00 54.69 C ATOM 1263 HA PRO A 86 44.936 56.192 90.753 1.00 0.00 H ATOM 1264 HD3 PRO A 86 48.918 56.841 91.611 1.00 0.00 H ATOM 1265 HD2 PRO A 86 47.557 57.694 92.377 1.00 0.00 H ATOM 1266 HG3 PRO A 86 47.802 58.994 90.444 1.00 0.00 H ATOM 1267 HG2 PRO A 86 48.374 57.616 89.474 1.00 0.00 H ATOM 1268 HB2 PRO A 86 46.195 57.691 88.723 1.00 0.00 H ATOM 1269 HB3 PRO A 86 45.587 58.388 90.243 1.00 0.00 H ATOM 1270 N ALA A 87 44.876 54.572 88.903 1.00 54.55 N ATOM 1271 CA ALA A 87 44.817 53.514 87.889 1.00 57.22 C ATOM 1272 C ALA A 87 45.241 54.021 86.506 1.00 62.56 C ATOM 1273 O ALA A 87 44.812 55.101 86.085 1.00 64.37 O ATOM 1274 CB ALA A 87 43.418 52.920 87.831 1.00 55.88 C ATOM 1275 HA ALA A 87 45.524 52.738 88.181 1.00 0.00 H ATOM 1276 HB1 ALA A 87 43.163 52.498 88.803 1.00 0.00 H ATOM 1277 HB2 ALA A 87 42.703 53.702 87.574 1.00 0.00 H ATOM 1278 HB3 ALA A 87 43.389 52.136 87.074 1.00 0.00 H ATOM 1279 H ALA A 87 44.007 54.824 89.415 1.00 0.00 H ATOM 1280 N PRO A 88 46.098 53.257 85.799 1.00 65.65 N ATOM 1281 CA PRO A 88 46.459 53.651 84.435 1.00 65.65 C ATOM 1282 C PRO A 88 45.257 53.456 83.508 1.00 65.66 C ATOM 1283 O PRO A 88 44.456 52.548 83.747 1.00 66.36 O ATOM 1284 CB PRO A 88 47.588 52.674 84.068 1.00 66.25 C ATOM 1285 CG PRO A 88 48.025 52.061 85.359 1.00 64.09 C ATOM 1286 CD PRO A 88 46.791 52.025 86.207 1.00 63.61 C ATOM 1287 HA PRO A 88 46.760 54.695 84.347 1.00 0.00 H ATOM 1288 HD3 PRO A 88 46.189 51.142 85.992 1.00 0.00 H ATOM 1289 HD2 PRO A 88 47.039 52.044 87.268 1.00 0.00 H ATOM 1290 HG3 PRO A 88 48.797 52.669 85.831 1.00 0.00 H ATOM 1291 HG2 PRO A 88 48.407 51.054 85.195 1.00 0.00 H ATOM 1292 HB2 PRO A 88 47.221 51.906 83.387 1.00 0.00 H ATOM 1293 HB3 PRO A 88 48.416 53.207 83.600 1.00 0.00 H ATOM 1294 N PRO A 89 45.112 54.311 82.468 1.00 67.07 N ATOM 1295 CA PRO A 89 43.949 54.177 81.575 1.00 61.58 C ATOM 1296 C PRO A 89 43.855 52.773 80.961 1.00 56.73 C ATOM 1297 O PRO A 89 44.868 52.199 80.540 1.00 52.29 O ATOM 1298 CB PRO A 89 44.196 55.250 80.503 1.00 61.32 C ATOM 1299 CG PRO A 89 45.103 56.243 81.159 1.00 63.77 C ATOM 1300 CD PRO A 89 45.992 55.424 82.054 1.00 67.04 C ATOM 1301 HA PRO A 89 43.002 54.310 82.098 1.00 0.00 H ATOM 1302 HD3 PRO A 89 46.862 55.055 81.511 1.00 0.00 H ATOM 1303 HD2 PRO A 89 46.322 56.004 82.916 1.00 0.00 H ATOM 1304 HG3 PRO A 89 44.527 56.961 81.743 1.00 0.00 H ATOM 1305 HG2 PRO A 89 45.694 56.774 80.413 1.00 0.00 H ATOM 1306 HB2 PRO A 89 44.674 54.814 79.626 1.00 0.00 H ATOM 1307 HB3 PRO A 89 43.259 55.722 80.208 1.00 0.00 H ATOM 1308 N GLY A 90 42.643 52.230 80.942 1.00 54.00 N ATOM 1309 CA GLY A 90 42.411 50.854 80.530 1.00 52.30 C ATOM 1310 C GLY A 90 42.015 49.984 81.707 1.00 56.32 C ATOM 1311 O GLY A 90 41.251 49.030 81.549 1.00 59.08 O ATOM 1312 HA3 GLY A 90 43.324 50.457 80.087 1.00 0.00 H ATOM 1313 HA2 GLY A 90 41.611 50.835 79.790 1.00 0.00 H ATOM 1314 H GLY A 90 41.830 52.810 81.232 1.00 0.00 H ATOM 1315 N ALA A 91 42.532 50.306 82.892 1.00 57.74 N ATOM 1316 CA ALA A 91 42.203 49.551 84.103 1.00 63.39 C ATOM 1317 C ALA A 91 40.812 49.909 84.633 1.00 66.46 C ATOM 1318 O ALA A 91 40.617 50.981 85.211 1.00 68.86 O ATOM 1319 CB ALA A 91 43.258 49.783 85.175 1.00 61.97 C ATOM 1320 HA ALA A 91 42.192 48.493 83.841 1.00 0.00 H ATOM 1321 HB1 ALA A 91 44.229 49.455 84.804 1.00 0.00 H ATOM 1322 HB2 ALA A 91 43.300 50.845 85.418 1.00 0.00 H ATOM 1323 HB3 ALA A 91 42.998 49.215 86.068 1.00 0.00 H ATOM 1324 H ALA A 91 43.185 51.113 82.959 1.00 0.00 H ATOM 1325 N ARG A 92 39.842 49.023 84.428 1.00 67.61 N ATOM 1326 CA ARG A 92 38.491 49.277 84.932 1.00 69.61 C ATOM 1327 C ARG A 92 38.382 49.040 86.442 1.00 67.57 C ATOM 1328 O ARG A 92 38.968 48.101 86.993 1.00 67.97 O ATOM 1329 CB ARG A 92 37.406 48.517 84.143 1.00 73.79 C ATOM 1330 CG ARG A 92 37.727 47.075 83.772 1.00 81.16 C ATOM 1331 CD ARG A 92 36.475 46.321 83.335 1.00 81.54 C ATOM 1332 NE ARG A 92 36.781 44.954 82.912 1.00 85.75 N ATOM 1333 CZ ARG A 92 35.892 43.964 82.824 1.00 88.45 C ATOM 1334 NH1 ARG A 92 34.616 44.169 83.136 1.00 90.10 N ATOM 1335 NH2 ARG A 92 36.280 42.756 82.426 1.00 82.71 N ATOM 1336 HA ARG A 92 38.300 50.337 84.765 1.00 0.00 H ATOM 1337 HB2 ARG A 92 36.499 48.511 84.747 1.00 0.00 H ATOM 1338 HB3 ARG A 92 37.222 49.065 83.219 1.00 0.00 H ATOM 1339 HG2 ARG A 92 38.447 47.071 82.954 1.00 0.00 H ATOM 1340 HG3 ARG A 92 38.159 46.574 84.638 1.00 0.00 H ATOM 1341 HD2 ARG A 92 36.015 46.853 82.502 1.00 0.00 H ATOM 1342 HD3 ARG A 92 35.776 46.284 84.171 1.00 0.00 H ATOM 1343 HE ARG A 92 37.767 44.738 82.661 1.00 0.00 H ATOM 1344 HH12 ARG A 92 33.931 43.390 83.064 1.00 0.00 H ATOM 1345 HH11 ARG A 92 34.303 45.109 83.452 1.00 0.00 H ATOM 1346 HH22 ARG A 92 35.587 41.984 82.357 1.00 0.00 H ATOM 1347 HH21 ARG A 92 37.277 42.584 82.183 1.00 0.00 H ATOM 1348 H ARG A 92 40.044 48.146 83.907 1.00 0.00 H ATOM 1349 N SER A 93 37.651 49.930 87.102 1.00 63.25 N ATOM 1350 CA SER A 93 37.432 49.848 88.539 1.00 61.32 C ATOM 1351 C SER A 93 36.236 48.967 88.857 1.00 60.54 C ATOM 1352 O SER A 93 35.246 48.953 88.123 1.00 59.02 O ATOM 1353 CB SER A 93 37.235 51.243 89.142 1.00 55.55 C ATOM 1354 OG SER A 93 38.482 51.852 89.432 1.00 51.72 O ATOM 1355 HA SER A 93 38.320 49.399 88.985 1.00 0.00 H ATOM 1356 HB2 SER A 93 36.658 51.155 90.063 1.00 0.00 H ATOM 1357 HB3 SER A 93 36.691 51.865 88.431 1.00 0.00 H ATOM 1358 HG SER A 93 38.327 52.750 89.820 1.00 0.00 H ATOM 1359 H SER A 93 37.219 50.714 86.573 1.00 0.00 H ATOM 1360 N MET A 94 36.341 48.224 89.951 1.00 60.71 N ATOM 1361 CA MET A 94 35.248 47.378 90.393 1.00 59.99 C ATOM 1362 C MET A 94 34.259 48.216 91.178 1.00 59.83 C ATOM 1363 O MET A 94 34.623 49.229 91.780 1.00 58.85 O ATOM 1364 CB MET A 94 35.751 46.254 91.286 1.00 60.67 C ATOM 1365 CG MET A 94 36.786 45.342 90.665 1.00 60.86 C ATOM 1366 SD MET A 94 36.560 43.682 91.326 1.00 59.36 S ATOM 1367 CE MET A 94 38.170 42.994 90.998 1.00 65.47 C ATOM 1368 HA MET A 94 34.774 46.942 89.514 1.00 0.00 H ATOM 1369 HB2 MET A 94 36.190 46.703 92.177 1.00 0.00 H ATOM 1370 HB3 MET A 94 34.895 45.644 91.573 1.00 0.00 H ATOM 1371 HG2 MET A 94 37.786 45.701 90.908 1.00 0.00 H ATOM 1372 HG3 MET A 94 36.660 45.327 89.582 1.00 0.00 H ATOM 1373 HE1 MET A 94 38.364 43.021 89.926 1.00 0.00 H ATOM 1374 HE2 MET A 94 38.927 43.579 91.520 1.00 0.00 H ATOM 1375 HE3 MET A 94 38.201 41.962 91.348 1.00 0.00 H ATOM 1376 H MET A 94 37.223 48.248 90.502 1.00 0.00 H ATOM 1377 N THR A 95 33.008 47.780 91.168 1.00 61.43 N ATOM 1378 CA THR A 95 31.971 48.434 91.946 1.00 67.26 C ATOM 1379 C THR A 95 31.965 47.883 93.386 1.00 64.58 C ATOM 1380 O THR A 95 31.820 46.677 93.581 1.00 63.02 O ATOM 1381 CB THR A 95 30.583 48.335 91.250 1.00 69.39 C ATOM 1382 OG1 THR A 95 29.542 48.639 92.184 1.00 75.58 O ATOM 1383 CG2 THR A 95 30.340 46.942 90.650 1.00 69.45 C ATOM 1384 HA THR A 95 32.193 49.499 92.006 1.00 0.00 H ATOM 1385 HB THR A 95 30.575 49.059 90.436 1.00 0.00 H ATOM 1386 HG1 THR A 95 29.576 47.995 92.935 1.00 0.00 H ATOM 1387 HG23 THR A 95 31.133 46.711 89.939 1.00 0.00 H ATOM 1388 HG21 THR A 95 30.338 46.199 91.448 1.00 0.00 H ATOM 1389 HG22 THR A 95 29.377 46.931 90.139 1.00 0.00 H ATOM 1390 H THR A 95 32.763 46.951 90.590 1.00 0.00 H ATOM 1391 N PRO A 96 32.170 48.764 94.390 1.00 63.23 N ATOM 1392 CA PRO A 96 32.069 48.418 95.823 1.00 60.56 C ATOM 1393 C PRO A 96 30.738 47.773 96.223 1.00 61.47 C ATOM 1394 O PRO A 96 29.690 48.084 95.643 1.00 61.86 O ATOM 1395 CB PRO A 96 32.245 49.766 96.540 1.00 59.43 C ATOM 1396 CG PRO A 96 32.306 50.813 95.472 1.00 62.41 C ATOM 1397 CD PRO A 96 32.706 50.124 94.202 1.00 62.65 C ATOM 1398 HA PRO A 96 32.815 47.668 96.086 1.00 0.00 H ATOM 1399 HD3 PRO A 96 32.258 50.607 93.334 1.00 0.00 H ATOM 1400 HD2 PRO A 96 33.790 50.108 94.088 1.00 0.00 H ATOM 1401 HG3 PRO A 96 33.043 51.572 95.734 1.00 0.00 H ATOM 1402 HG2 PRO A 96 31.330 51.282 95.352 1.00 0.00 H ATOM 1403 HB2 PRO A 96 31.400 49.953 97.203 1.00 0.00 H ATOM 1404 HB3 PRO A 96 33.168 49.766 97.120 1.00 0.00 H ATOM 1405 N CYS A 97 30.791 46.883 97.213 1.00 58.44 N ATOM 1406 CA CYS A 97 29.646 46.041 97.560 1.00 57.50 C ATOM 1407 C CYS A 97 28.482 46.769 98.242 1.00 59.14 C ATOM 1408 O CYS A 97 28.698 47.723 98.993 1.00 58.53 O ATOM 1409 CB CYS A 97 30.090 44.863 98.412 1.00 53.47 C ATOM 1410 SG CYS A 97 28.686 43.928 99.039 1.00 50.91 S ATOM 1411 HA CYS A 97 29.253 45.698 96.603 1.00 0.00 H ATOM 1412 HB2 CYS A 97 30.671 45.236 99.255 1.00 0.00 H ATOM 1413 HB3 CYS A 97 30.712 44.204 97.807 1.00 0.00 H ATOM 1414 HG CYS A 97 29.142 42.873 99.803 1.00 0.00 H ATOM 1415 H CYS A 97 31.673 46.784 97.755 1.00 0.00 H ATOM 1416 N THR A 98 27.263 46.281 97.981 1.00 57.47 N ATOM 1417 CA THR A 98 26.014 46.886 98.471 1.00 58.71 C ATOM 1418 C THR A 98 25.175 45.949 99.346 1.00 58.47 C ATOM 1419 O THR A 98 24.680 46.349 100.403 1.00 62.58 O ATOM 1420 CB THR A 98 25.164 47.446 97.289 1.00 57.87 C ATOM 1421 OG1 THR A 98 25.502 48.823 97.082 1.00 55.44 O ATOM 1422 CG2 THR A 98 23.646 47.333 97.540 1.00 53.79 C ATOM 1423 HA THR A 98 26.317 47.710 99.116 1.00 0.00 H ATOM 1424 HB THR A 98 25.394 46.846 96.409 1.00 0.00 H ATOM 1425 HG1 THR A 98 24.965 49.184 96.333 1.00 0.00 H ATOM 1426 HG23 THR A 98 23.382 46.287 97.698 1.00 0.00 H ATOM 1427 HG21 THR A 98 23.381 47.914 98.423 1.00 0.00 H ATOM 1428 HG22 THR A 98 23.106 47.718 96.675 1.00 0.00 H ATOM 1429 H THR A 98 27.195 45.423 97.397 1.00 0.00 H ATOM 1430 N CYS A 99 25.021 44.704 98.908 1.00 58.09 N ATOM 1431 CA CYS A 99 24.127 43.761 99.572 1.00 61.20 C ATOM 1432 C CYS A 99 24.471 43.493 101.045 1.00 60.52 C ATOM 1433 O CYS A 99 23.680 42.874 101.763 1.00 60.83 O ATOM 1434 CB CYS A 99 24.060 42.449 98.785 1.00 61.49 C ATOM 1435 SG CYS A 99 25.660 41.649 98.539 1.00 62.44 S ATOM 1436 HA CYS A 99 23.147 44.237 99.584 1.00 0.00 H ATOM 1437 HB2 CYS A 99 23.629 42.659 97.806 1.00 0.00 H ATOM 1438 HB3 CYS A 99 23.412 41.759 99.325 1.00 0.00 H ATOM 1439 HG CYS A 99 25.484 40.483 97.823 1.00 0.00 H ATOM 1440 H CYS A 99 25.552 44.393 98.069 1.00 0.00 H ATOM 1441 N GLY A 100 25.643 43.963 101.483 1.00 60.19 N ATOM 1442 CA GLY A 100 26.164 43.680 102.826 1.00 53.30 C ATOM 1443 C GLY A 100 26.152 42.200 103.171 1.00 51.64 C ATOM 1444 O GLY A 100 25.948 41.831 104.322 1.00 52.13 O ATOM 1445 HA3 GLY A 100 25.552 44.211 103.555 1.00 0.00 H ATOM 1446 HA2 GLY A 100 27.191 44.041 102.883 1.00 0.00 H ATOM 1447 H GLY A 100 26.211 44.555 100.844 1.00 0.00 H ATOM 1448 N SER A 101 26.347 41.350 102.163 1.00 52.26 N ATOM 1449 CA SER A 101 26.328 39.896 102.344 1.00 48.88 C ATOM 1450 C SER A 101 27.569 39.433 103.089 1.00 47.12 C ATOM 1451 O SER A 101 28.646 40.025 102.957 1.00 43.37 O ATOM 1452 CB SER A 101 26.252 39.183 100.989 1.00 50.62 C ATOM 1453 OG SER A 101 26.310 37.768 101.132 1.00 48.98 O ATOM 1454 HA SER A 101 25.444 39.644 102.930 1.00 0.00 H ATOM 1455 HB2 SER A 101 27.088 39.510 100.371 1.00 0.00 H ATOM 1456 HB3 SER A 101 25.315 39.450 100.501 1.00 0.00 H ATOM 1457 HG SER A 101 26.258 37.345 100.239 1.00 0.00 H ATOM 1458 H SER A 101 26.519 41.733 101.212 1.00 0.00 H ATOM 1459 N SER A 102 27.409 38.365 103.863 1.00 46.06 N ATOM 1460 CA SER A 102 28.520 37.784 104.600 1.00 45.70 C ATOM 1461 C SER A 102 29.118 36.561 103.895 1.00 44.17 C ATOM 1462 O SER A 102 30.120 36.007 104.355 1.00 44.91 O ATOM 1463 CB SER A 102 28.102 37.466 106.038 1.00 43.28 C ATOM 1464 OG SER A 102 28.303 38.598 106.876 1.00 46.09 O ATOM 1465 HA SER A 102 29.315 38.529 104.634 1.00 0.00 H ATOM 1466 HB2 SER A 102 28.699 36.633 106.410 1.00 0.00 H ATOM 1467 HB3 SER A 102 27.047 37.191 106.053 1.00 0.00 H ATOM 1468 HG SER A 102 28.028 38.376 107.801 1.00 0.00 H ATOM 1469 H SER A 102 26.466 37.934 103.944 1.00 0.00 H ATOM 1470 N ASP A 103 28.506 36.149 102.784 1.00 44.23 N ATOM 1471 CA ASP A 103 29.042 35.062 101.951 1.00 42.98 C ATOM 1472 C ASP A 103 29.996 35.652 100.915 1.00 40.92 C ATOM 1473 O ASP A 103 29.559 36.236 99.924 1.00 40.07 O ATOM 1474 CB ASP A 103 27.906 34.276 101.264 1.00 42.77 C ATOM 1475 CG ASP A 103 27.231 33.268 102.191 1.00 46.15 C ATOM 1476 OD1 ASP A 103 27.789 32.942 103.259 1.00 47.08 O ATOM 1477 OD2 ASP A 103 26.125 32.784 101.853 1.00 50.85 O ATOM 1478 HA ASP A 103 29.584 34.361 102.585 1.00 0.00 H ATOM 1479 HB2 ASP A 103 27.155 34.985 100.915 1.00 0.00 H ATOM 1480 HB3 ASP A 103 28.321 33.740 100.411 1.00 0.00 H ATOM 1481 H ASP A 103 27.620 36.612 102.497 1.00 0.00 H ATOM 1482 N LEU A 104 31.297 35.509 101.147 1.00 40.28 N ATOM 1483 CA LEU A 104 32.306 36.114 100.261 1.00 39.89 C ATOM 1484 C LEU A 104 33.050 35.125 99.380 1.00 39.68 C ATOM 1485 O LEU A 104 33.026 33.912 99.606 1.00 39.14 O ATOM 1486 CB LEU A 104 33.323 36.936 101.059 1.00 39.58 C ATOM 1487 CG LEU A 104 32.784 37.965 102.053 1.00 38.77 C ATOM 1488 CD1 LEU A 104 33.967 38.731 102.624 1.00 37.09 C ATOM 1489 CD2 LEU A 104 31.754 38.899 101.417 1.00 39.43 C ATOM 1490 HA LEU A 104 31.731 36.758 99.596 1.00 0.00 H ATOM 1491 HB2 LEU A 104 33.941 36.234 101.620 1.00 0.00 H ATOM 1492 HB3 LEU A 104 33.944 37.471 100.341 1.00 0.00 H ATOM 1493 HG LEU A 104 32.253 37.452 102.855 1.00 0.00 H ATOM 1494 HD21 LEU A 104 32.216 39.437 100.589 1.00 0.00 H ATOM 1495 HD22 LEU A 104 30.913 38.312 101.047 1.00 0.00 H ATOM 1496 HD23 LEU A 104 31.402 39.611 102.163 1.00 0.00 H ATOM 1497 HD11 LEU A 104 34.639 38.036 103.128 1.00 0.00 H ATOM 1498 HD12 LEU A 104 34.499 39.231 101.815 1.00 0.00 H ATOM 1499 HD13 LEU A 104 33.608 39.473 103.337 1.00 0.00 H ATOM 1500 H LEU A 104 31.609 34.958 101.972 1.00 0.00 H ATOM 1501 N TYR A 105 33.719 35.666 98.370 1.00 41.42 N ATOM 1502 CA TYR A 105 34.464 34.858 97.415 1.00 42.17 C ATOM 1503 C TYR A 105 35.798 35.505 97.146 1.00 40.64 C ATOM 1504 O TYR A 105 35.865 36.596 96.574 1.00 43.49 O ATOM 1505 CB TYR A 105 33.657 34.647 96.126 1.00 42.45 C ATOM 1506 CG TYR A 105 32.343 33.959 96.414 1.00 48.08 C ATOM 1507 CD1 TYR A 105 32.261 32.564 96.486 1.00 47.31 C ATOM 1508 CD2 TYR A 105 31.193 34.702 96.671 1.00 45.53 C ATOM 1509 CE1 TYR A 105 31.057 31.939 96.782 1.00 51.28 C ATOM 1510 CE2 TYR A 105 29.994 34.086 96.970 1.00 50.24 C ATOM 1511 CZ TYR A 105 29.925 32.712 97.024 1.00 51.58 C ATOM 1512 OH TYR A 105 28.717 32.121 97.323 1.00 54.87 O ATOM 1513 HA TYR A 105 34.641 33.869 97.838 1.00 0.00 H ATOM 1514 HB3 TYR A 105 34.238 34.032 95.438 1.00 0.00 H ATOM 1515 HB2 TYR A 105 33.459 35.616 95.667 1.00 0.00 H ATOM 1516 HD2 TYR A 105 31.241 35.790 96.635 1.00 0.00 H ATOM 1517 HE2 TYR A 105 29.105 34.686 97.163 1.00 0.00 H ATOM 1518 HE1 TYR A 105 30.999 30.851 96.825 1.00 0.00 H ATOM 1519 HD1 TYR A 105 33.152 31.962 96.308 1.00 0.00 H ATOM 1520 HH TYR A 105 28.824 31.137 97.325 1.00 0.00 H ATOM 1521 H TYR A 105 33.711 36.700 98.257 1.00 0.00 H ATOM 1522 N LEU A 106 36.855 34.833 97.593 1.00 38.63 N ATOM 1523 CA LEU A 106 38.223 35.306 97.412 1.00 35.60 C ATOM 1524 C LEU A 106 38.766 34.842 96.068 1.00 34.65 C ATOM 1525 O LEU A 106 38.697 33.655 95.741 1.00 34.54 O ATOM 1526 CB LEU A 106 39.113 34.795 98.553 1.00 34.05 C ATOM 1527 CG LEU A 106 40.636 34.858 98.385 1.00 32.36 C ATOM 1528 CD1 LEU A 106 41.161 36.284 98.454 1.00 32.49 C ATOM 1529 CD2 LEU A 106 41.301 33.998 99.440 1.00 32.38 C ATOM 1530 HA LEU A 106 38.224 36.396 97.430 1.00 0.00 H ATOM 1531 HB2 LEU A 106 38.864 35.377 99.440 1.00 0.00 H ATOM 1532 HB3 LEU A 106 38.852 33.750 98.721 1.00 0.00 H ATOM 1533 HG LEU A 106 40.879 34.475 97.394 1.00 0.00 H ATOM 1534 HD21 LEU A 106 41.030 34.365 100.430 1.00 0.00 H ATOM 1535 HD22 LEU A 106 40.967 32.966 99.330 1.00 0.00 H ATOM 1536 HD23 LEU A 106 42.383 34.046 99.317 1.00 0.00 H ATOM 1537 HD11 LEU A 106 40.707 36.876 97.660 1.00 0.00 H ATOM 1538 HD12 LEU A 106 40.907 36.717 99.422 1.00 0.00 H ATOM 1539 HD13 LEU A 106 42.244 36.278 98.330 1.00 0.00 H ATOM 1540 H LEU A 106 36.700 33.934 98.092 1.00 0.00 H ATOM 1541 N VAL A 107 39.314 35.783 95.306 1.00 35.36 N ATOM 1542 CA VAL A 107 39.950 35.486 94.029 1.00 36.30 C ATOM 1543 C VAL A 107 41.467 35.407 94.204 1.00 37.38 C ATOM 1544 O VAL A 107 42.096 36.361 94.656 1.00 37.16 O ATOM 1545 CB VAL A 107 39.580 36.538 92.956 1.00 37.10 C ATOM 1546 CG1 VAL A 107 40.269 36.233 91.629 1.00 37.73 C ATOM 1547 CG2 VAL A 107 38.068 36.594 92.763 1.00 35.14 C ATOM 1548 HA VAL A 107 39.582 34.520 93.684 1.00 0.00 H ATOM 1549 HB VAL A 107 39.927 37.510 93.305 1.00 0.00 H ATOM 1550 HG11 VAL A 107 41.350 36.244 91.771 1.00 0.00 H ATOM 1551 HG12 VAL A 107 39.957 35.250 91.277 1.00 0.00 H ATOM 1552 HG13 VAL A 107 39.990 36.989 90.894 1.00 0.00 H ATOM 1553 HG21 VAL A 107 37.708 35.617 92.441 1.00 0.00 H ATOM 1554 HG22 VAL A 107 37.593 36.866 93.705 1.00 0.00 H ATOM 1555 HG23 VAL A 107 37.827 37.339 92.005 1.00 0.00 H ATOM 1556 H VAL A 107 39.288 36.770 95.634 1.00 0.00 H ATOM 1557 N THR A 108 42.046 34.263 93.841 1.00 37.47 N ATOM 1558 CA THR A 108 43.485 34.044 93.995 1.00 36.40 C ATOM 1559 C THR A 108 44.215 34.251 92.665 1.00 37.87 C ATOM 1560 O THR A 108 43.578 34.395 91.614 1.00 39.27 O ATOM 1561 CB THR A 108 43.796 32.640 94.553 1.00 32.33 C ATOM 1562 OG1 THR A 108 43.398 31.653 93.610 1.00 33.85 O ATOM 1563 CG2 THR A 108 43.063 32.376 95.850 1.00 32.49 C ATOM 1564 HA THR A 108 43.844 34.780 94.715 1.00 0.00 H ATOM 1565 HB THR A 108 44.869 32.594 94.739 1.00 0.00 H ATOM 1566 HG1 THR A 108 43.599 30.753 93.971 1.00 0.00 H ATOM 1567 HG23 THR A 108 43.354 33.123 96.589 1.00 0.00 H ATOM 1568 HG21 THR A 108 41.988 32.434 95.677 1.00 0.00 H ATOM 1569 HG22 THR A 108 43.320 31.382 96.216 1.00 0.00 H ATOM 1570 H THR A 108 41.459 33.505 93.437 1.00 0.00 H ATOM 1571 N ARG A 109 45.547 34.252 92.716 1.00 37.63 N ATOM 1572 CA ARG A 109 46.377 34.455 91.525 1.00 37.07 C ATOM 1573 C ARG A 109 46.275 33.279 90.551 1.00 37.20 C ATOM 1574 O ARG A 109 46.556 33.426 89.362 1.00 38.81 O ATOM 1575 CB ARG A 109 47.839 34.733 91.913 1.00 35.34 C ATOM 1576 CG ARG A 109 48.650 33.491 92.273 1.00 35.90 C ATOM 1577 CD ARG A 109 50.064 33.812 92.754 1.00 32.75 C ATOM 1578 NE ARG A 109 50.920 34.223 91.652 1.00 33.38 N ATOM 1579 CZ ARG A 109 51.359 35.463 91.459 1.00 34.57 C ATOM 1580 NH1 ARG A 109 51.038 36.440 92.299 1.00 33.05 N ATOM 1581 NH2 ARG A 109 52.125 35.726 90.413 1.00 35.23 N ATOM 1582 HA ARG A 109 45.993 35.334 91.007 1.00 0.00 H ATOM 1583 HB2 ARG A 109 48.326 35.225 91.071 1.00 0.00 H ATOM 1584 HB3 ARG A 109 47.841 35.402 92.774 1.00 0.00 H ATOM 1585 HG2 ARG A 109 48.128 32.954 93.065 1.00 0.00 H ATOM 1586 HG3 ARG A 109 48.720 32.855 91.390 1.00 0.00 H ATOM 1587 HD2 ARG A 109 50.490 32.924 93.222 1.00 0.00 H ATOM 1588 HD3 ARG A 109 50.015 34.619 93.485 1.00 0.00 H ATOM 1589 HE ARG A 109 51.209 33.496 90.967 1.00 0.00 H ATOM 1590 HH12 ARG A 109 51.390 37.405 92.134 1.00 0.00 H ATOM 1591 HH11 ARG A 109 50.435 36.241 93.122 1.00 0.00 H ATOM 1592 HH22 ARG A 109 52.473 36.693 90.254 1.00 0.00 H ATOM 1593 HH21 ARG A 109 52.379 34.966 89.750 1.00 0.00 H ATOM 1594 H ARG A 109 46.014 34.103 93.633 1.00 0.00 H ATOM 1595 N HIS A 110 45.864 32.118 91.061 1.00 36.77 N ATOM 1596 CA HIS A 110 45.674 30.932 90.236 1.00 36.52 C ATOM 1597 C HIS A 110 44.260 30.844 89.660 1.00 37.26 C ATOM 1598 O HIS A 110 43.805 29.764 89.285 1.00 37.48 O ATOM 1599 CB HIS A 110 45.975 29.670 91.049 1.00 39.81 C ATOM 1600 CG HIS A 110 47.284 29.717 91.765 1.00 39.40 C ATOM 1601 ND1 HIS A 110 47.375 29.770 93.140 1.00 41.04 N ATOM 1602 CD2 HIS A 110 48.555 29.733 91.298 1.00 39.53 C ATOM 1603 CE1 HIS A 110 48.649 29.814 93.488 1.00 41.06 C ATOM 1604 NE2 HIS A 110 49.385 29.795 92.390 1.00 39.12 N ATOM 1605 HA HIS A 110 46.368 31.011 89.399 1.00 0.00 H ATOM 1606 HB2 HIS A 110 45.183 29.538 91.786 1.00 0.00 H ATOM 1607 HB3 HIS A 110 45.984 28.817 90.371 1.00 0.00 H ATOM 1608 HD2 HIS A 110 48.861 29.702 90.252 1.00 0.00 H ATOM 1609 HE1 HIS A 110 49.029 29.858 94.509 1.00 0.00 H ATOM 1610 H HIS A 110 45.673 32.057 92.081 1.00 0.00 H ATOM 1611 N ALA A 111 43.570 31.981 89.604 1.00 39.15 N ATOM 1612 CA ALA A 111 42.257 32.093 88.981 1.00 40.76 C ATOM 1613 C ALA A 111 41.165 31.296 89.694 1.00 43.58 C ATOM 1614 O ALA A 111 40.083 31.128 89.144 1.00 46.92 O ATOM 1615 CB ALA A 111 42.320 31.707 87.508 1.00 37.65 C ATOM 1616 HA ALA A 111 41.976 33.142 89.070 1.00 0.00 H ATOM 1617 HB1 ALA A 111 43.013 32.370 86.989 1.00 0.00 H ATOM 1618 HB2 ALA A 111 42.665 30.677 87.418 1.00 0.00 H ATOM 1619 HB3 ALA A 111 41.328 31.799 87.067 1.00 0.00 H ATOM 1620 H ALA A 111 43.990 32.834 90.027 1.00 0.00 H ATOM 1621 N ASP A 112 41.441 30.797 90.896 1.00 42.32 N ATOM 1622 CA ASP A 112 40.390 30.156 91.695 1.00 43.75 C ATOM 1623 C ASP A 112 39.590 31.190 92.482 1.00 42.71 C ATOM 1624 O ASP A 112 40.105 32.255 92.818 1.00 41.45 O ATOM 1625 CB ASP A 112 40.966 29.120 92.658 1.00 43.97 C ATOM 1626 CG ASP A 112 41.717 28.016 91.950 1.00 43.78 C ATOM 1627 OD1 ASP A 112 41.105 27.322 91.110 1.00 48.56 O ATOM 1628 OD2 ASP A 112 42.916 27.836 92.243 1.00 41.21 O ATOM 1629 HA ASP A 112 39.727 29.648 90.994 1.00 0.00 H ATOM 1630 HB2 ASP A 112 41.649 29.623 93.343 1.00 0.00 H ATOM 1631 HB3 ASP A 112 40.147 28.677 93.224 1.00 0.00 H ATOM 1632 H ASP A 112 42.408 30.862 91.272 1.00 0.00 H ATOM 1633 N VAL A 113 38.333 30.855 92.766 1.00 40.78 N ATOM 1634 CA VAL A 113 37.440 31.695 93.552 1.00 42.67 C ATOM 1635 C VAL A 113 36.990 30.882 94.769 1.00 43.97 C ATOM 1636 O VAL A 113 36.244 29.918 94.631 1.00 47.07 O ATOM 1637 CB VAL A 113 36.223 32.167 92.716 1.00 44.06 C ATOM 1638 CG1 VAL A 113 35.273 33.003 93.563 1.00 41.08 C ATOM 1639 CG2 VAL A 113 36.682 32.948 91.484 1.00 40.77 C ATOM 1640 HA VAL A 113 37.963 32.597 93.871 1.00 0.00 H ATOM 1641 HB VAL A 113 35.683 31.283 92.377 1.00 0.00 H ATOM 1642 HG11 VAL A 113 34.913 32.405 94.400 1.00 0.00 H ATOM 1643 HG12 VAL A 113 35.800 33.879 93.941 1.00 0.00 H ATOM 1644 HG13 VAL A 113 34.428 33.321 92.952 1.00 0.00 H ATOM 1645 HG21 VAL A 113 37.252 33.821 91.801 1.00 0.00 H ATOM 1646 HG22 VAL A 113 37.309 32.309 90.863 1.00 0.00 H ATOM 1647 HG23 VAL A 113 35.811 33.269 90.913 1.00 0.00 H ATOM 1648 H VAL A 113 37.971 29.948 92.409 1.00 0.00 H ATOM 1649 N ILE A 114 37.467 31.274 95.951 1.00 43.63 N ATOM 1650 CA ILE A 114 37.328 30.491 97.189 1.00 40.76 C ATOM 1651 C ILE A 114 36.194 31.041 98.072 1.00 39.42 C ATOM 1652 O ILE A 114 36.203 32.230 98.420 1.00 38.36 O ATOM 1653 CB ILE A 114 38.633 30.558 98.030 1.00 41.93 C ATOM 1654 CG1 ILE A 114 39.896 30.470 97.156 1.00 45.31 C ATOM 1655 CG2 ILE A 114 38.613 29.559 99.182 1.00 43.66 C ATOM 1656 CD1 ILE A 114 40.255 29.089 96.659 1.00 45.84 C ATOM 1657 HA ILE A 114 37.111 29.466 96.888 1.00 0.00 H ATOM 1658 HB ILE A 114 38.675 31.544 98.492 1.00 0.00 H ATOM 1659 HG12 ILE A 114 39.747 31.111 96.287 1.00 0.00 H ATOM 1660 HG13 ILE A 114 40.736 30.844 97.742 1.00 0.00 H ATOM 1661 HD11 ILE A 114 40.426 28.431 97.511 1.00 0.00 H ATOM 1662 HD12 ILE A 114 39.437 28.698 96.054 1.00 0.00 H ATOM 1663 HD13 ILE A 114 41.160 29.146 96.055 1.00 0.00 H ATOM 1664 HG21 ILE A 114 37.770 29.779 99.837 1.00 0.00 H ATOM 1665 HG22 ILE A 114 38.512 28.549 98.784 1.00 0.00 H ATOM 1666 HG23 ILE A 114 39.543 29.637 99.745 1.00 0.00 H ATOM 1667 H ILE A 114 37.966 32.185 96.001 1.00 0.00 H ATOM 1668 N PRO A 115 35.236 30.177 98.478 1.00 39.38 N ATOM 1669 CA PRO A 115 34.178 30.644 99.386 1.00 37.80 C ATOM 1670 C PRO A 115 34.736 31.037 100.765 1.00 38.36 C ATOM 1671 O PRO A 115 35.540 30.300 101.363 1.00 36.16 O ATOM 1672 CB PRO A 115 33.238 29.431 99.483 1.00 39.76 C ATOM 1673 CG PRO A 115 33.571 28.592 98.287 1.00 38.74 C ATOM 1674 CD PRO A 115 35.049 28.761 98.124 1.00 37.46 C ATOM 1675 HA PRO A 115 33.680 31.544 99.025 1.00 0.00 H ATOM 1676 HD3 PRO A 115 35.600 28.107 98.800 1.00 0.00 H ATOM 1677 HD2 PRO A 115 35.360 28.565 97.098 1.00 0.00 H ATOM 1678 HG3 PRO A 115 33.041 28.948 97.404 1.00 0.00 H ATOM 1679 HG2 PRO A 115 33.318 27.547 98.464 1.00 0.00 H ATOM 1680 HB2 PRO A 115 33.420 28.877 100.404 1.00 0.00 H ATOM 1681 HB3 PRO A 115 32.196 29.749 99.451 1.00 0.00 H ATOM 1682 N VAL A 116 34.330 32.213 101.237 1.00 37.21 N ATOM 1683 CA VAL A 116 34.803 32.756 102.511 1.00 37.85 C ATOM 1684 C VAL A 116 33.613 33.305 103.302 1.00 36.08 C ATOM 1685 O VAL A 116 32.821 34.069 102.765 1.00 36.97 O ATOM 1686 CB VAL A 116 35.850 33.882 102.309 1.00 35.67 C ATOM 1687 CG1 VAL A 116 36.166 34.567 103.634 1.00 36.86 C ATOM 1688 CG2 VAL A 116 37.126 33.346 101.682 1.00 35.17 C ATOM 1689 HA VAL A 116 35.285 31.947 103.060 1.00 0.00 H ATOM 1690 HB VAL A 116 35.418 34.614 101.627 1.00 0.00 H ATOM 1691 HG11 VAL A 116 35.254 35.002 104.043 1.00 0.00 H ATOM 1692 HG12 VAL A 116 36.566 33.834 104.334 1.00 0.00 H ATOM 1693 HG13 VAL A 116 36.903 35.353 103.468 1.00 0.00 H ATOM 1694 HG21 VAL A 116 37.557 32.585 102.332 1.00 0.00 H ATOM 1695 HG22 VAL A 116 36.896 32.908 100.711 1.00 0.00 H ATOM 1696 HG23 VAL A 116 37.837 34.162 101.555 1.00 0.00 H ATOM 1697 H VAL A 116 33.650 32.768 100.679 1.00 0.00 H ATOM 1698 N ARG A 117 33.508 32.931 104.574 1.00 35.33 N ATOM 1699 CA ARG A 117 32.442 33.441 105.441 1.00 38.47 C ATOM 1700 C ARG A 117 32.914 34.576 106.352 1.00 39.61 C ATOM 1701 O ARG A 117 33.715 34.354 107.265 1.00 39.53 O ATOM 1702 CB ARG A 117 31.822 32.312 106.269 1.00 35.47 C ATOM 1703 CG ARG A 117 30.666 32.758 107.134 1.00 38.49 C ATOM 1704 CD ARG A 117 29.538 33.352 106.301 1.00 41.73 C ATOM 1705 NE ARG A 117 28.492 33.895 107.159 1.00 44.27 N ATOM 1706 CZ ARG A 117 27.278 34.253 106.746 1.00 48.20 C ATOM 1707 NH1 ARG A 117 26.926 34.137 105.473 1.00 47.63 N ATOM 1708 NH2 ARG A 117 26.408 34.743 107.617 1.00 50.20 N ATOM 1709 HA ARG A 117 31.679 33.856 104.782 1.00 0.00 H ATOM 1710 HB2 ARG A 117 31.464 31.541 105.587 1.00 0.00 H ATOM 1711 HB3 ARG A 117 32.594 31.894 106.915 1.00 0.00 H ATOM 1712 HG2 ARG A 117 30.284 31.899 107.685 1.00 0.00 H ATOM 1713 HG3 ARG A 117 31.021 33.511 107.838 1.00 0.00 H ATOM 1714 HD2 ARG A 117 29.113 32.573 105.668 1.00 0.00 H ATOM 1715 HD3 ARG A 117 29.937 34.150 105.675 1.00 0.00 H ATOM 1716 HE ARG A 117 28.710 34.011 108.169 1.00 0.00 H ATOM 1717 HH12 ARG A 117 25.973 34.422 105.169 1.00 0.00 H ATOM 1718 HH11 ARG A 117 27.603 33.761 104.779 1.00 0.00 H ATOM 1719 HH22 ARG A 117 25.458 35.025 107.301 1.00 0.00 H ATOM 1720 HH21 ARG A 117 26.675 34.846 108.617 1.00 0.00 H ATOM 1721 H ARG A 117 34.200 32.259 104.963 1.00 0.00 H ATOM 1722 N ARG A 118 32.392 35.776 106.091 1.00 41.84 N ATOM 1723 CA ARG A 118 32.741 37.006 106.812 1.00 46.11 C ATOM 1724 C ARG A 118 32.465 36.885 108.329 1.00 47.54 C ATOM 1725 O ARG A 118 31.375 36.481 108.734 1.00 46.90 O ATOM 1726 CB ARG A 118 32.006 38.195 106.156 1.00 47.03 C ATOM 1727 CG ARG A 118 31.787 39.424 107.022 1.00 48.82 C ATOM 1728 CD ARG A 118 32.719 40.567 106.668 1.00 48.15 C ATOM 1729 NE ARG A 118 32.085 41.509 105.762 1.00 48.06 N ATOM 1730 CZ ARG A 118 32.505 42.749 105.518 1.00 48.74 C ATOM 1731 NH1 ARG A 118 33.580 43.249 106.116 1.00 46.07 N ATOM 1732 NH2 ARG A 118 31.830 43.500 104.659 1.00 47.22 N ATOM 1733 HA ARG A 118 33.814 37.182 106.734 1.00 0.00 H ATOM 1734 HB2 ARG A 118 32.586 38.503 105.286 1.00 0.00 H ATOM 1735 HB3 ARG A 118 31.028 37.841 105.832 1.00 0.00 H ATOM 1736 HG2 ARG A 118 30.758 39.761 106.895 1.00 0.00 H ATOM 1737 HG3 ARG A 118 31.952 39.150 108.064 1.00 0.00 H ATOM 1738 HD2 ARG A 118 33.612 40.162 106.191 1.00 0.00 H ATOM 1739 HD3 ARG A 118 33.002 41.090 107.582 1.00 0.00 H ATOM 1740 HE ARG A 118 31.231 41.188 105.262 1.00 0.00 H ATOM 1741 HH12 ARG A 118 33.886 44.221 105.907 1.00 0.00 H ATOM 1742 HH11 ARG A 118 34.116 42.669 106.793 1.00 0.00 H ATOM 1743 HH22 ARG A 118 32.145 44.470 104.457 1.00 0.00 H ATOM 1744 HH21 ARG A 118 30.986 43.119 104.187 1.00 0.00 H ATOM 1745 H ARG A 118 31.691 35.844 105.326 1.00 0.00 H ATOM 1746 N ARG A 119 33.473 37.200 109.149 1.00 48.49 N ATOM 1747 CA ARG A 119 33.373 37.074 110.619 1.00 47.80 C ATOM 1748 C ARG A 119 33.484 38.404 111.351 1.00 46.71 C ATOM 1749 O ARG A 119 33.198 38.492 112.546 1.00 50.07 O ATOM 1750 CB ARG A 119 34.455 36.144 111.164 1.00 47.66 C ATOM 1751 CG ARG A 119 34.389 34.733 110.644 1.00 48.35 C ATOM 1752 CD ARG A 119 33.088 34.043 111.022 1.00 48.50 C ATOM 1753 NE ARG A 119 33.133 32.669 110.546 1.00 50.52 N ATOM 1754 CZ ARG A 119 32.129 31.804 110.582 1.00 50.78 C ATOM 1755 NH1 ARG A 119 30.947 32.153 111.075 1.00 52.51 N ATOM 1756 NH2 ARG A 119 32.321 30.578 110.114 1.00 48.27 N ATOM 1757 HA ARG A 119 32.380 36.664 110.802 1.00 0.00 H ATOM 1758 HB2 ARG A 119 35.427 36.560 110.898 1.00 0.00 H ATOM 1759 HB3 ARG A 119 34.360 36.111 112.249 1.00 0.00 H ATOM 1760 HG2 ARG A 119 34.473 34.755 109.557 1.00 0.00 H ATOM 1761 HG3 ARG A 119 35.222 34.166 111.060 1.00 0.00 H ATOM 1762 HD2 ARG A 119 32.249 34.564 110.561 1.00 0.00 H ATOM 1763 HD3 ARG A 119 32.969 34.052 112.105 1.00 0.00 H ATOM 1764 HE ARG A 119 34.032 32.336 110.142 1.00 0.00 H ATOM 1765 HH12 ARG A 119 30.169 31.464 111.097 1.00 0.00 H ATOM 1766 HH11 ARG A 119 30.799 33.116 111.439 1.00 0.00 H ATOM 1767 HH22 ARG A 119 31.545 29.886 110.134 1.00 0.00 H ATOM 1768 HH21 ARG A 119 33.248 30.308 109.727 1.00 0.00 H ATOM 1769 H ARG A 119 34.362 37.547 108.737 1.00 0.00 H ATOM 1770 N GLY A 120 33.921 39.428 110.636 1.00 44.99 N ATOM 1771 CA GLY A 120 34.065 40.757 111.199 1.00 43.21 C ATOM 1772 C GLY A 120 34.450 41.705 110.085 1.00 45.13 C ATOM 1773 O GLY A 120 34.501 41.314 108.916 1.00 46.15 O ATOM 1774 HA3 GLY A 120 34.842 40.752 111.964 1.00 0.00 H ATOM 1775 HA2 GLY A 120 33.121 41.074 111.643 1.00 0.00 H ATOM 1776 H GLY A 120 34.169 39.275 109.638 1.00 0.00 H ATOM 1777 N ASP A 121 34.742 42.948 110.446 1.00 43.94 N ATOM 1778 CA ASP A 121 35.123 43.965 109.475 1.00 46.36 C ATOM 1779 C ASP A 121 36.234 43.511 108.530 1.00 44.34 C ATOM 1780 O ASP A 121 36.166 43.791 107.332 1.00 42.51 O ATOM 1781 CB ASP A 121 35.507 45.273 110.181 1.00 47.01 C ATOM 1782 CG ASP A 121 34.349 45.872 110.987 1.00 50.60 C ATOM 1783 OD1 ASP A 121 33.174 45.454 110.814 1.00 50.03 O ATOM 1784 OD2 ASP A 121 34.622 46.765 111.815 1.00 54.84 O ATOM 1785 HA ASP A 121 34.246 44.141 108.853 1.00 0.00 H ATOM 1786 HB2 ASP A 121 36.337 45.073 110.858 1.00 0.00 H ATOM 1787 HB3 ASP A 121 35.820 45.997 109.429 1.00 0.00 H ATOM 1788 H ASP A 121 34.698 43.204 111.453 1.00 0.00 H ATOM 1789 N SER A 122 37.225 42.800 109.073 1.00 43.02 N ATOM 1790 CA SER A 122 38.425 42.393 108.335 1.00 42.18 C ATOM 1791 C SER A 122 38.661 40.884 108.256 1.00 41.23 C ATOM 1792 O SER A 122 39.694 40.445 107.749 1.00 42.01 O ATOM 1793 CB SER A 122 39.660 43.020 108.976 1.00 42.52 C ATOM 1794 OG SER A 122 39.864 44.312 108.468 1.00 50.26 O ATOM 1795 HA SER A 122 38.255 42.742 107.316 1.00 0.00 H ATOM 1796 HB2 SER A 122 40.532 42.404 108.757 1.00 0.00 H ATOM 1797 HB3 SER A 122 39.518 43.075 110.055 1.00 0.00 H ATOM 1798 HG SER A 122 39.995 44.263 107.488 1.00 0.00 H ATOM 1799 H SER A 122 37.142 42.520 110.071 1.00 0.00 H ATOM 1800 N ARG A 123 37.726 40.092 108.761 1.00 39.88 N ATOM 1801 CA ARG A 123 37.971 38.660 108.909 1.00 40.08 C ATOM 1802 C ARG A 123 36.916 37.832 108.212 1.00 39.38 C ATOM 1803 O ARG A 123 35.735 38.149 108.278 1.00 40.78 O ATOM 1804 CB ARG A 123 38.028 38.277 110.395 1.00 37.22 C ATOM 1805 CG ARG A 123 38.320 36.798 110.671 1.00 36.95 C ATOM 1806 CD ARG A 123 39.785 36.404 110.451 1.00 34.67 C ATOM 1807 NE ARG A 123 40.700 37.251 111.211 1.00 36.41 N ATOM 1808 CZ ARG A 123 41.061 37.034 112.481 1.00 40.89 C ATOM 1809 NH1 ARG A 123 40.602 35.968 113.150 1.00 34.79 N ATOM 1810 NH2 ARG A 123 41.904 37.883 113.084 1.00 38.83 N ATOM 1811 HA ARG A 123 38.931 38.447 108.439 1.00 0.00 H ATOM 1812 HB2 ARG A 123 38.810 38.871 110.868 1.00 0.00 H ATOM 1813 HB3 ARG A 123 37.066 38.522 110.845 1.00 0.00 H ATOM 1814 HG2 ARG A 123 38.058 36.583 111.707 1.00 0.00 H ATOM 1815 HG3 ARG A 123 37.699 36.195 110.008 1.00 0.00 H ATOM 1816 HD2 ARG A 123 40.019 36.496 109.390 1.00 0.00 H ATOM 1817 HD3 ARG A 123 39.922 35.369 110.763 1.00 0.00 H ATOM 1818 HE ARG A 123 41.100 38.082 110.731 1.00 0.00 H ATOM 1819 HH12 ARG A 123 40.890 35.810 114.137 1.00 0.00 H ATOM 1820 HH11 ARG A 123 39.958 35.298 112.683 1.00 0.00 H ATOM 1821 HH22 ARG A 123 42.189 37.720 114.071 1.00 0.00 H ATOM 1822 HH21 ARG A 123 42.274 38.705 112.565 1.00 0.00 H ATOM 1823 H ARG A 123 36.812 40.493 109.054 1.00 0.00 H ATOM 1824 N GLY A 124 37.354 36.769 107.544 1.00 40.26 N ATOM 1825 CA GLY A 124 36.448 35.744 107.030 1.00 40.57 C ATOM 1826 C GLY A 124 37.086 34.368 107.158 1.00 41.51 C ATOM 1827 O GLY A 124 38.307 34.249 107.134 1.00 40.07 O ATOM 1828 HA3 GLY A 124 36.234 35.946 105.981 1.00 0.00 H ATOM 1829 HA2 GLY A 124 35.519 35.765 107.600 1.00 0.00 H ATOM 1830 H GLY A 124 38.376 36.663 107.382 1.00 0.00 H ATOM 1831 N SER A 125 36.272 33.324 107.297 1.00 40.22 N ATOM 1832 CA SER A 125 36.812 31.971 107.355 1.00 39.09 C ATOM 1833 C SER A 125 36.678 31.255 106.043 1.00 39.11 C ATOM 1834 O SER A 125 35.662 31.370 105.352 1.00 40.23 O ATOM 1835 CB SER A 125 36.181 31.127 108.466 1.00 38.49 C ATOM 1836 OG SER A 125 35.220 31.855 109.188 1.00 38.59 O ATOM 1837 HA SER A 125 37.871 32.093 107.584 1.00 0.00 H ATOM 1838 HB2 SER A 125 36.964 30.800 109.150 1.00 0.00 H ATOM 1839 HB3 SER A 125 35.703 30.255 108.020 1.00 0.00 H ATOM 1840 HG SER A 125 34.835 31.280 109.895 1.00 0.00 H ATOM 1841 H SER A 125 35.245 33.474 107.365 1.00 0.00 H ATOM 1842 N LEU A 126 37.730 30.520 105.713 1.00 41.01 N ATOM 1843 CA LEU A 126 37.741 29.600 104.582 1.00 42.49 C ATOM 1844 C LEU A 126 36.828 28.431 104.931 1.00 41.89 C ATOM 1845 O LEU A 126 37.007 27.787 105.968 1.00 43.90 O ATOM 1846 CB LEU A 126 39.173 29.097 104.347 1.00 42.76 C ATOM 1847 CG LEU A 126 40.128 29.681 103.282 1.00 44.37 C ATOM 1848 CD1 LEU A 126 39.633 30.942 102.600 1.00 41.26 C ATOM 1849 CD2 LEU A 126 41.538 29.860 103.851 1.00 41.88 C ATOM 1850 HA LEU A 126 37.394 30.094 103.674 1.00 0.00 H ATOM 1851 HB2 LEU A 126 39.688 29.212 105.301 1.00 0.00 H ATOM 1852 HB3 LEU A 126 39.080 28.037 104.111 1.00 0.00 H ATOM 1853 HG LEU A 126 40.159 28.938 102.485 1.00 0.00 H ATOM 1854 HD21 LEU A 126 41.502 30.541 104.701 1.00 0.00 H ATOM 1855 HD22 LEU A 126 41.923 28.893 104.175 1.00 0.00 H ATOM 1856 HD23 LEU A 126 42.190 30.272 103.081 1.00 0.00 H ATOM 1857 HD11 LEU A 126 38.690 30.734 102.094 1.00 0.00 H ATOM 1858 HD12 LEU A 126 39.482 31.722 103.346 1.00 0.00 H ATOM 1859 HD13 LEU A 126 40.372 31.273 101.871 1.00 0.00 H ATOM 1860 H LEU A 126 38.591 30.604 106.290 1.00 0.00 H ATOM 1861 N LEU A 127 35.833 28.177 104.085 1.00 42.61 N ATOM 1862 CA LEU A 127 34.926 27.053 104.295 1.00 41.43 C ATOM 1863 C LEU A 127 35.685 25.745 104.169 1.00 41.90 C ATOM 1864 O LEU A 127 35.423 24.793 104.906 1.00 42.96 O ATOM 1865 CB LEU A 127 33.753 27.115 103.317 1.00 43.82 C ATOM 1866 CG LEU A 127 32.569 27.960 103.805 1.00 43.38 C ATOM 1867 CD1 LEU A 127 32.783 29.456 103.642 1.00 42.99 C ATOM 1868 CD2 LEU A 127 31.322 27.545 103.062 1.00 42.66 C ATOM 1869 HA LEU A 127 34.514 27.113 105.302 1.00 0.00 H ATOM 1870 HB2 LEU A 127 34.112 27.539 102.379 1.00 0.00 H ATOM 1871 HB3 LEU A 127 33.399 26.099 103.143 1.00 0.00 H ATOM 1872 HG LEU A 127 32.468 27.775 104.874 1.00 0.00 H ATOM 1873 HD21 LEU A 127 31.468 27.702 101.993 1.00 0.00 H ATOM 1874 HD22 LEU A 127 31.122 26.490 103.251 1.00 0.00 H ATOM 1875 HD23 LEU A 127 30.479 28.144 103.407 1.00 0.00 H ATOM 1876 HD11 LEU A 127 33.660 29.761 104.214 1.00 0.00 H ATOM 1877 HD12 LEU A 127 32.937 29.687 102.588 1.00 0.00 H ATOM 1878 HD13 LEU A 127 31.906 29.989 104.008 1.00 0.00 H ATOM 1879 H LEU A 127 35.699 28.792 103.257 1.00 0.00 H ATOM 1880 N SER A 128 36.635 25.719 103.240 1.00 40.19 N ATOM 1881 CA SER A 128 37.619 24.646 103.145 1.00 42.04 C ATOM 1882 C SER A 128 39.018 25.217 103.405 1.00 38.49 C ATOM 1883 O SER A 128 39.415 26.178 102.741 1.00 38.21 O ATOM 1884 CB SER A 128 37.582 24.005 101.751 1.00 39.22 C ATOM 1885 OG SER A 128 36.531 23.067 101.674 1.00 45.99 O ATOM 1886 HA SER A 128 37.383 23.884 103.888 1.00 0.00 H ATOM 1887 HB2 SER A 128 38.530 23.501 101.561 1.00 0.00 H ATOM 1888 HB3 SER A 128 37.428 24.781 101.001 1.00 0.00 H ATOM 1889 HG SER A 128 36.518 22.661 100.771 1.00 0.00 H ATOM 1890 H SER A 128 36.679 26.497 102.551 1.00 0.00 H ATOM 1891 N PRO A 129 39.757 24.638 104.372 1.00 37.11 N ATOM 1892 CA PRO A 129 41.139 25.050 104.611 1.00 37.14 C ATOM 1893 C PRO A 129 41.987 24.920 103.352 1.00 37.92 C ATOM 1894 O PRO A 129 41.701 24.097 102.490 1.00 39.65 O ATOM 1895 CB PRO A 129 41.639 24.075 105.679 1.00 36.47 C ATOM 1896 CG PRO A 129 40.499 23.177 106.013 1.00 36.64 C ATOM 1897 CD PRO A 129 39.255 23.742 105.426 1.00 36.94 C ATOM 1898 HA PRO A 129 41.204 26.095 104.915 1.00 0.00 H ATOM 1899 HD3 PRO A 129 38.629 22.955 105.005 1.00 0.00 H ATOM 1900 HD2 PRO A 129 38.687 24.296 106.173 1.00 0.00 H ATOM 1901 HG3 PRO A 129 40.394 23.105 107.096 1.00 0.00 H ATOM 1902 HG2 PRO A 129 40.681 22.185 105.600 1.00 0.00 H ATOM 1903 HB2 PRO A 129 42.475 23.492 105.293 1.00 0.00 H ATOM 1904 HB3 PRO A 129 41.958 24.622 106.566 1.00 0.00 H ATOM 1905 N ARG A 130 43.016 25.746 103.245 1.00 39.46 N ATOM 1906 CA ARG A 130 43.898 25.742 102.090 1.00 38.08 C ATOM 1907 C ARG A 130 45.357 25.673 102.525 1.00 37.76 C ATOM 1908 O ARG A 130 45.711 26.211 103.585 1.00 38.31 O ATOM 1909 CB ARG A 130 43.656 26.984 101.246 1.00 40.34 C ATOM 1910 CG ARG A 130 43.093 26.677 99.868 1.00 48.92 C ATOM 1911 CD ARG A 130 41.597 26.438 99.856 1.00 52.58 C ATOM 1912 NE ARG A 130 41.157 26.175 98.491 1.00 58.90 N ATOM 1913 CZ ARG A 130 39.908 25.894 98.130 1.00 61.51 C ATOM 1914 NH1 ARG A 130 38.934 25.833 99.032 1.00 61.56 N ATOM 1915 NH2 ARG A 130 39.638 25.677 96.849 1.00 63.18 N ATOM 1916 HA ARG A 130 43.680 24.858 101.490 1.00 0.00 H ATOM 1917 HB2 ARG A 130 42.951 27.628 101.772 1.00 0.00 H ATOM 1918 HB3 ARG A 130 44.603 27.509 101.123 1.00 0.00 H ATOM 1919 HG2 ARG A 130 43.312 27.520 99.212 1.00 0.00 H ATOM 1920 HG3 ARG A 130 43.587 25.783 99.486 1.00 0.00 H ATOM 1921 HD2 ARG A 130 41.085 27.320 100.239 1.00 0.00 H ATOM 1922 HD3 ARG A 130 41.361 25.580 100.486 1.00 0.00 H ATOM 1923 HE ARG A 130 41.876 26.210 97.741 1.00 0.00 H ATOM 1924 HH12 ARG A 130 37.962 25.612 98.734 1.00 0.00 H ATOM 1925 HH11 ARG A 130 39.143 26.006 100.036 1.00 0.00 H ATOM 1926 HH22 ARG A 130 38.666 25.456 96.553 1.00 0.00 H ATOM 1927 HH21 ARG A 130 40.399 25.728 96.141 1.00 0.00 H ATOM 1928 H ARG A 130 43.200 26.421 104.014 1.00 0.00 H ATOM 1929 N PRO A 131 46.214 25.007 101.719 1.00 34.25 N ATOM 1930 CA PRO A 131 47.634 25.038 102.070 1.00 33.05 C ATOM 1931 C PRO A 131 48.204 26.465 101.959 1.00 34.19 C ATOM 1932 O PRO A 131 47.809 27.216 101.060 1.00 32.13 O ATOM 1933 CB PRO A 131 48.289 24.098 101.032 1.00 32.16 C ATOM 1934 CG PRO A 131 47.156 23.396 100.340 1.00 31.98 C ATOM 1935 CD PRO A 131 45.971 24.303 100.445 1.00 31.30 C ATOM 1936 HA PRO A 131 47.819 24.727 103.098 1.00 0.00 H ATOM 1937 HD3 PRO A 131 45.935 25.002 99.610 1.00 0.00 H ATOM 1938 HD2 PRO A 131 45.042 23.734 100.481 1.00 0.00 H ATOM 1939 HG3 PRO A 131 46.947 22.444 100.828 1.00 0.00 H ATOM 1940 HG2 PRO A 131 47.404 23.219 99.294 1.00 0.00 H ATOM 1941 HB2 PRO A 131 48.874 24.674 100.314 1.00 0.00 H ATOM 1942 HB3 PRO A 131 48.936 23.375 101.529 1.00 0.00 H ATOM 1943 N VAL A 132 49.097 26.828 102.883 1.00 33.22 N ATOM 1944 CA VAL A 132 49.765 28.139 102.885 1.00 36.07 C ATOM 1945 C VAL A 132 50.426 28.458 101.533 1.00 36.20 C ATOM 1946 O VAL A 132 50.215 29.527 100.971 1.00 35.77 O ATOM 1947 CB VAL A 132 50.783 28.266 104.067 1.00 40.49 C ATOM 1948 CG1 VAL A 132 51.695 27.039 104.169 1.00 40.23 C ATOM 1949 CG2 VAL A 132 51.620 29.529 103.944 1.00 38.83 C ATOM 1950 HA VAL A 132 48.988 28.887 103.040 1.00 0.00 H ATOM 1951 HB VAL A 132 50.194 28.327 104.982 1.00 0.00 H ATOM 1952 HG11 VAL A 132 51.088 26.149 104.335 1.00 0.00 H ATOM 1953 HG12 VAL A 132 52.258 26.929 103.242 1.00 0.00 H ATOM 1954 HG13 VAL A 132 52.385 27.169 105.002 1.00 0.00 H ATOM 1955 HG21 VAL A 132 52.177 29.504 103.008 1.00 0.00 H ATOM 1956 HG22 VAL A 132 50.965 30.400 103.956 1.00 0.00 H ATOM 1957 HG23 VAL A 132 52.316 29.585 104.781 1.00 0.00 H ATOM 1958 H VAL A 132 49.332 26.152 103.637 1.00 0.00 H ATOM 1959 N SER A 133 51.199 27.513 101.004 1.00 37.81 N ATOM 1960 CA SER A 133 51.847 27.658 99.695 1.00 37.51 C ATOM 1961 C SER A 133 50.857 27.991 98.568 1.00 37.74 C ATOM 1962 O SER A 133 51.202 28.661 97.590 1.00 36.65 O ATOM 1963 CB SER A 133 52.638 26.394 99.351 1.00 37.00 C ATOM 1964 OG SER A 133 51.782 25.262 99.267 1.00 40.86 O ATOM 1965 HA SER A 133 52.528 28.505 99.774 1.00 0.00 H ATOM 1966 HB2 SER A 133 53.385 26.219 100.125 1.00 0.00 H ATOM 1967 HB3 SER A 133 53.137 26.536 98.392 1.00 0.00 H ATOM 1968 HG SER A 133 52.318 24.460 99.044 1.00 0.00 H ATOM 1969 H SER A 133 51.350 26.635 101.540 1.00 0.00 H ATOM 1970 N TYR A 134 49.619 27.540 98.720 1.00 37.34 N ATOM 1971 CA TYR A 134 48.609 27.798 97.718 1.00 37.08 C ATOM 1972 C TYR A 134 48.150 29.280 97.685 1.00 36.66 C ATOM 1973 O TYR A 134 47.809 29.802 96.623 1.00 35.25 O ATOM 1974 CB TYR A 134 47.414 26.840 97.875 1.00 37.42 C ATOM 1975 CG TYR A 134 46.269 27.269 97.010 1.00 38.67 C ATOM 1976 CD1 TYR A 134 46.227 26.931 95.653 1.00 39.34 C ATOM 1977 CD2 TYR A 134 45.259 28.080 97.528 1.00 39.90 C ATOM 1978 CE1 TYR A 134 45.179 27.359 94.841 1.00 42.11 C ATOM 1979 CE2 TYR A 134 44.213 28.514 96.733 1.00 40.76 C ATOM 1980 CZ TYR A 134 44.177 28.155 95.396 1.00 42.65 C ATOM 1981 OH TYR A 134 43.136 28.608 94.625 1.00 47.13 O ATOM 1982 HA TYR A 134 49.075 27.605 96.752 1.00 0.00 H ATOM 1983 HB3 TYR A 134 47.093 26.837 98.917 1.00 0.00 H ATOM 1984 HB2 TYR A 134 47.722 25.835 97.588 1.00 0.00 H ATOM 1985 HD2 TYR A 134 45.294 28.377 98.576 1.00 0.00 H ATOM 1986 HE2 TYR A 134 43.423 29.134 97.156 1.00 0.00 H ATOM 1987 HE1 TYR A 134 45.143 27.076 93.789 1.00 0.00 H ATOM 1988 HD1 TYR A 134 47.025 26.324 95.225 1.00 0.00 H ATOM 1989 HH TYR A 134 43.243 28.274 93.699 1.00 0.00 H ATOM 1990 H TYR A 134 49.372 26.994 99.570 1.00 0.00 H ATOM 1991 N LEU A 135 48.152 29.945 98.841 1.00 35.60 N ATOM 1992 CA LEU A 135 47.671 31.321 98.928 1.00 33.65 C ATOM 1993 C LEU A 135 48.759 32.365 98.755 1.00 34.16 C ATOM 1994 O LEU A 135 48.450 33.523 98.524 1.00 33.09 O ATOM 1995 CB LEU A 135 46.939 31.570 100.246 1.00 33.92 C ATOM 1996 CG LEU A 135 45.611 30.855 100.490 1.00 32.91 C ATOM 1997 CD1 LEU A 135 45.216 31.082 101.946 1.00 32.95 C ATOM 1998 CD2 LEU A 135 44.527 31.358 99.542 1.00 32.64 C ATOM 1999 HA LEU A 135 46.982 31.432 98.091 1.00 0.00 H ATOM 2000 HB2 LEU A 135 47.615 31.277 101.050 1.00 0.00 H ATOM 2001 HB3 LEU A 135 46.744 32.641 100.309 1.00 0.00 H ATOM 2002 HG LEU A 135 45.724 29.789 100.295 1.00 0.00 H ATOM 2003 HD21 LEU A 135 44.379 32.427 99.696 1.00 0.00 H ATOM 2004 HD22 LEU A 135 44.834 31.177 98.512 1.00 0.00 H ATOM 2005 HD23 LEU A 135 43.596 30.828 99.743 1.00 0.00 H ATOM 2006 HD11 LEU A 135 45.989 30.676 102.598 1.00 0.00 H ATOM 2007 HD12 LEU A 135 45.109 32.151 102.130 1.00 0.00 H ATOM 2008 HD13 LEU A 135 44.269 30.581 102.147 1.00 0.00 H ATOM 2009 H LEU A 135 48.504 29.474 99.699 1.00 0.00 H ATOM 2010 N LYS A 136 50.025 31.964 98.875 1.00 35.40 N ATOM 2011 CA LYS A 136 51.128 32.906 98.732 1.00 38.45 C ATOM 2012 C LYS A 136 51.100 33.579 97.369 1.00 36.57 C ATOM 2013 O LYS A 136 50.989 32.909 96.347 1.00 38.83 O ATOM 2014 CB LYS A 136 52.483 32.227 98.992 1.00 40.26 C ATOM 2015 CG LYS A 136 53.096 32.565 100.347 1.00 45.79 C ATOM 2016 CD LYS A 136 54.034 33.767 100.240 1.00 52.66 C ATOM 2017 CE LYS A 136 54.009 34.663 101.477 1.00 55.47 C ATOM 2018 NZ LYS A 136 55.042 34.292 102.488 1.00 63.03 N ATOM 2019 HA LYS A 136 51.001 33.681 99.488 1.00 0.00 H ATOM 2020 HB2 LYS A 136 52.342 31.148 98.939 1.00 0.00 H ATOM 2021 HB3 LYS A 136 53.179 32.540 98.213 1.00 0.00 H ATOM 2022 HG2 LYS A 136 52.298 32.797 101.052 1.00 0.00 H ATOM 2023 HG3 LYS A 136 53.659 31.704 100.708 1.00 0.00 H ATOM 2024 HD2 LYS A 136 55.051 33.401 100.097 1.00 0.00 H ATOM 2025 HD3 LYS A 136 53.738 34.361 99.375 1.00 0.00 H ATOM 2026 HE2 LYS A 136 53.026 34.587 101.941 1.00 0.00 H ATOM 2027 HE3 LYS A 136 54.183 35.692 101.164 1.00 0.00 H ATOM 2028 HZ1 LYS A 136 54.882 33.314 102.803 1.00 0.00 H ATOM 2029 HZ2 LYS A 136 55.987 34.369 102.061 1.00 0.00 H ATOM 2030 HZ3 LYS A 136 54.975 34.935 103.303 1.00 0.00 H ATOM 2031 H LYS A 136 50.229 30.964 99.074 1.00 0.00 H ATOM 2032 N GLY A 137 51.180 34.907 97.365 1.00 37.25 N ATOM 2033 CA GLY A 137 51.195 35.679 96.123 1.00 33.92 C ATOM 2034 C GLY A 137 49.822 36.180 95.736 1.00 33.72 C ATOM 2035 O GLY A 137 49.645 36.757 94.660 1.00 34.76 O ATOM 2036 HA3 GLY A 137 51.575 35.045 95.322 1.00 0.00 H ATOM 2037 HA2 GLY A 137 51.857 36.536 96.252 1.00 0.00 H ATOM 2038 H GLY A 137 51.234 35.412 98.273 1.00 0.00 H ATOM 2039 N SER A 138 48.841 35.970 96.605 1.00 31.57 N ATOM 2040 CA SER A 138 47.485 36.400 96.291 1.00 32.34 C ATOM 2041 C SER A 138 47.044 37.622 97.086 1.00 31.16 C ATOM 2042 O SER A 138 45.900 38.042 96.963 1.00 33.76 O ATOM 2043 CB SER A 138 46.476 35.248 96.452 1.00 33.71 C ATOM 2044 OG SER A 138 46.577 34.306 95.395 1.00 33.75 O ATOM 2045 HA SER A 138 47.502 36.700 95.243 1.00 0.00 H ATOM 2046 HB2 SER A 138 45.467 35.661 96.462 1.00 0.00 H ATOM 2047 HB3 SER A 138 46.668 34.740 97.397 1.00 0.00 H ATOM 2048 HG SER A 138 47.489 33.921 95.383 1.00 0.00 H ATOM 2049 H SER A 138 49.040 35.498 97.510 1.00 0.00 H ATOM 2050 N SER A 139 47.935 38.196 97.896 1.00 31.28 N ATOM 2051 CA SER A 139 47.598 39.435 98.611 1.00 32.57 C ATOM 2052 C SER A 139 47.297 40.530 97.586 1.00 32.59 C ATOM 2053 O SER A 139 47.937 40.595 96.540 1.00 33.41 O ATOM 2054 CB SER A 139 48.713 39.872 99.568 1.00 31.78 C ATOM 2055 OG SER A 139 49.924 40.100 98.857 1.00 33.61 O ATOM 2056 HA SER A 139 46.718 39.252 99.227 1.00 0.00 H ATOM 2057 HB2 SER A 139 48.875 39.090 100.310 1.00 0.00 H ATOM 2058 HB3 SER A 139 48.414 40.792 100.070 1.00 0.00 H ATOM 2059 HG SER A 139 50.200 39.265 98.402 1.00 0.00 H ATOM 2060 H SER A 139 48.873 37.765 98.022 1.00 0.00 H ATOM 2061 N GLY A 140 46.311 41.366 97.883 1.00 33.82 N ATOM 2062 CA GLY A 140 45.831 42.361 96.927 1.00 35.82 C ATOM 2063 C GLY A 140 44.617 41.895 96.129 1.00 37.30 C ATOM 2064 O GLY A 140 43.922 42.714 95.529 1.00 37.88 O ATOM 2065 HA3 GLY A 140 46.637 42.588 96.230 1.00 0.00 H ATOM 2066 HA2 GLY A 140 45.560 43.264 97.474 1.00 0.00 H ATOM 2067 H GLY A 140 45.867 41.312 98.822 1.00 0.00 H ATOM 2068 N GLY A 141 44.379 40.581 96.101 1.00 36.10 N ATOM 2069 CA GLY A 141 43.257 40.008 95.372 1.00 33.63 C ATOM 2070 C GLY A 141 41.960 40.304 96.090 1.00 34.95 C ATOM 2071 O GLY A 141 41.941 40.393 97.318 1.00 36.07 O ATOM 2072 HA3 GLY A 141 43.389 38.929 95.298 1.00 0.00 H ATOM 2073 HA2 GLY A 141 43.221 40.438 94.371 1.00 0.00 H ATOM 2074 H GLY A 141 45.018 39.945 96.619 1.00 0.00 H ATOM 2075 N PRO A 142 40.863 40.462 95.334 1.00 34.70 N ATOM 2076 CA PRO A 142 39.607 40.904 95.926 1.00 35.08 C ATOM 2077 C PRO A 142 38.831 39.815 96.649 1.00 36.23 C ATOM 2078 O PRO A 142 38.970 38.618 96.336 1.00 34.41 O ATOM 2079 CB PRO A 142 38.806 41.379 94.711 1.00 35.30 C ATOM 2080 CG PRO A 142 39.285 40.506 93.611 1.00 34.87 C ATOM 2081 CD PRO A 142 40.767 40.364 93.867 1.00 35.14 C ATOM 2082 HA PRO A 142 39.789 41.656 96.694 1.00 0.00 H ATOM 2083 HD3 PRO A 142 41.135 39.401 93.514 1.00 0.00 H ATOM 2084 HD2 PRO A 142 41.327 41.165 93.383 1.00 0.00 H ATOM 2085 HG3 PRO A 142 39.103 40.970 92.642 1.00 0.00 H ATOM 2086 HG2 PRO A 142 38.792 39.535 93.646 1.00 0.00 H ATOM 2087 HB2 PRO A 142 37.736 41.247 94.874 1.00 0.00 H ATOM 2088 HB3 PRO A 142 39.013 42.427 94.494 1.00 0.00 H ATOM 2089 N LEU A 143 38.035 40.241 97.626 1.00 36.76 N ATOM 2090 CA LEU A 143 36.950 39.407 98.143 1.00 39.62 C ATOM 2091 C LEU A 143 35.668 40.001 97.593 1.00 40.78 C ATOM 2092 O LEU A 143 35.419 41.196 97.736 1.00 40.22 O ATOM 2093 CB LEU A 143 36.925 39.360 99.678 1.00 36.40 C ATOM 2094 CG LEU A 143 38.085 38.598 100.329 1.00 37.23 C ATOM 2095 CD1 LEU A 143 39.319 39.489 100.407 1.00 37.87 C ATOM 2096 CD2 LEU A 143 37.696 38.079 101.703 1.00 34.87 C ATOM 2097 HA LEU A 143 37.084 38.372 97.828 1.00 0.00 H ATOM 2098 HB2 LEU A 143 36.946 40.385 100.047 1.00 0.00 H ATOM 2099 HB3 LEU A 143 35.994 38.884 99.986 1.00 0.00 H ATOM 2100 HG LEU A 143 38.322 37.733 99.709 1.00 0.00 H ATOM 2101 HD21 LEU A 143 37.426 38.918 102.344 1.00 0.00 H ATOM 2102 HD22 LEU A 143 36.845 37.405 101.608 1.00 0.00 H ATOM 2103 HD23 LEU A 143 38.539 37.543 102.140 1.00 0.00 H ATOM 2104 HD11 LEU A 143 39.610 39.794 99.402 1.00 0.00 H ATOM 2105 HD12 LEU A 143 39.091 40.372 101.004 1.00 0.00 H ATOM 2106 HD13 LEU A 143 40.136 38.936 100.871 1.00 0.00 H ATOM 2107 H LEU A 143 38.187 41.187 98.031 1.00 0.00 H ATOM 2108 N LEU A 144 34.885 39.169 96.923 1.00 43.72 N ATOM 2109 CA LEU A 144 33.662 39.627 96.310 1.00 45.51 C ATOM 2110 C LEU A 144 32.472 39.025 97.017 1.00 46.35 C ATOM 2111 O LEU A 144 32.533 37.895 97.508 1.00 43.15 O ATOM 2112 CB LEU A 144 33.598 39.249 94.826 1.00 46.00 C ATOM 2113 CG LEU A 144 34.602 39.724 93.773 1.00 47.14 C ATOM 2114 CD1 LEU A 144 35.194 41.105 94.039 1.00 44.77 C ATOM 2115 CD2 LEU A 144 35.693 38.684 93.644 1.00 47.03 C ATOM 2116 HA LEU A 144 33.642 40.714 96.395 1.00 0.00 H ATOM 2117 HB2 LEU A 144 33.634 38.160 94.797 1.00 0.00 H ATOM 2118 HB3 LEU A 144 32.623 39.588 94.477 1.00 0.00 H ATOM 2119 HG LEU A 144 34.056 39.836 92.836 1.00 0.00 H ATOM 2120 HD21 LEU A 144 36.192 38.562 94.605 1.00 0.00 H ATOM 2121 HD22 LEU A 144 35.254 37.735 93.338 1.00 0.00 H ATOM 2122 HD23 LEU A 144 36.417 39.009 92.896 1.00 0.00 H ATOM 2123 HD11 LEU A 144 34.392 41.843 94.069 1.00 0.00 H ATOM 2124 HD12 LEU A 144 35.717 41.097 94.995 1.00 0.00 H ATOM 2125 HD13 LEU A 144 35.894 41.358 93.243 1.00 0.00 H ATOM 2126 H LEU A 144 35.156 38.169 96.837 1.00 0.00 H ATOM 2127 N CYS A 145 31.391 39.798 97.051 1.00 48.09 N ATOM 2128 CA CYS A 145 30.097 39.314 97.510 1.00 52.03 C ATOM 2129 C CYS A 145 29.496 38.439 96.404 1.00 52.36 C ATOM 2130 O CYS A 145 30.079 38.339 95.320 1.00 49.67 O ATOM 2131 CB CYS A 145 29.181 40.492 97.836 1.00 53.11 C ATOM 2132 SG CYS A 145 28.756 41.521 96.412 1.00 57.19 S ATOM 2133 HA CYS A 145 30.211 38.725 98.420 1.00 0.00 H ATOM 2134 HB2 CYS A 145 29.681 41.120 98.574 1.00 0.00 H ATOM 2135 HB3 CYS A 145 28.257 40.099 98.261 1.00 0.00 H ATOM 2136 HG CYS A 145 28.105 40.752 95.469 1.00 0.00 H ATOM 2137 H CYS A 145 31.473 40.786 96.738 1.00 0.00 H ATOM 2138 N PRO A 146 28.339 37.796 96.673 1.00 55.03 N ATOM 2139 CA PRO A 146 27.717 36.926 95.668 1.00 56.52 C ATOM 2140 C PRO A 146 27.328 37.639 94.367 1.00 57.14 C ATOM 2141 O PRO A 146 27.361 37.020 93.301 1.00 57.19 O ATOM 2142 CB PRO A 146 26.470 36.387 96.384 1.00 55.10 C ATOM 2143 CG PRO A 146 26.236 37.331 97.515 1.00 56.62 C ATOM 2144 CD PRO A 146 27.593 37.773 97.943 1.00 52.45 C ATOM 2145 HA PRO A 146 28.416 36.157 95.338 1.00 0.00 H ATOM 2146 HD3 PRO A 146 27.559 38.763 98.398 1.00 0.00 H ATOM 2147 HD2 PRO A 146 28.034 37.066 98.646 1.00 0.00 H ATOM 2148 HG3 PRO A 146 25.722 36.827 98.334 1.00 0.00 H ATOM 2149 HG2 PRO A 146 25.642 38.184 97.185 1.00 0.00 H ATOM 2150 HB2 PRO A 146 25.614 36.378 95.709 1.00 0.00 H ATOM 2151 HB3 PRO A 146 26.648 35.378 96.757 1.00 0.00 H ATOM 2152 N SER A 147 26.970 38.919 94.447 1.00 57.31 N ATOM 2153 CA SER A 147 26.624 39.666 93.242 1.00 63.16 C ATOM 2154 C SER A 147 27.879 40.002 92.428 1.00 64.51 C ATOM 2155 O SER A 147 27.802 40.181 91.216 1.00 68.11 O ATOM 2156 CB SER A 147 25.779 40.908 93.559 1.00 63.79 C ATOM 2157 OG SER A 147 26.531 41.908 94.219 1.00 70.11 O ATOM 2158 HA SER A 147 25.998 39.026 92.621 1.00 0.00 H ATOM 2159 HB2 SER A 147 24.947 40.614 94.199 1.00 0.00 H ATOM 2160 HB3 SER A 147 25.391 41.317 92.626 1.00 0.00 H ATOM 2161 HG SER A 147 26.882 41.547 95.071 1.00 0.00 H ATOM 2162 H SER A 147 26.937 39.389 95.374 1.00 0.00 H ATOM 2163 N GLY A 148 29.028 40.075 93.100 1.00 65.39 N ATOM 2164 CA GLY A 148 30.323 40.215 92.428 1.00 58.79 C ATOM 2165 C GLY A 148 31.035 41.534 92.646 1.00 56.41 C ATOM 2166 O GLY A 148 31.903 41.898 91.859 1.00 55.10 O ATOM 2167 HA3 GLY A 148 30.160 40.095 91.357 1.00 0.00 H ATOM 2168 HA2 GLY A 148 30.975 39.419 92.787 1.00 0.00 H ATOM 2169 H GLY A 148 29.005 40.031 94.139 1.00 0.00 H ATOM 2170 N HIS A 149 30.675 42.244 93.716 1.00 57.59 N ATOM 2171 CA HIS A 149 31.251 43.557 94.039 1.00 58.27 C ATOM 2172 C HIS A 149 32.358 43.424 95.092 1.00 55.17 C ATOM 2173 O HIS A 149 32.345 42.474 95.869 1.00 52.35 O ATOM 2174 CB HIS A 149 30.153 44.479 94.569 1.00 66.72 C ATOM 2175 CG HIS A 149 29.057 44.761 93.585 1.00 75.64 C ATOM 2176 ND1 HIS A 149 28.465 46.001 93.471 1.00 79.51 N ATOM 2177 CD2 HIS A 149 28.443 43.967 92.675 1.00 76.28 C ATOM 2178 CE1 HIS A 149 27.534 45.958 92.536 1.00 79.90 C ATOM 2179 NE2 HIS A 149 27.502 44.736 92.035 1.00 77.84 N ATOM 2180 HA HIS A 149 31.684 43.977 93.131 1.00 0.00 H ATOM 2181 HB2 HIS A 149 29.710 44.013 95.449 1.00 0.00 H ATOM 2182 HB3 HIS A 149 30.610 45.427 94.853 1.00 0.00 H ATOM 2183 HD2 HIS A 149 28.656 42.915 92.486 1.00 0.00 H ATOM 2184 HE1 HIS A 149 26.899 46.790 92.229 1.00 0.00 H ATOM 2185 H HIS A 149 29.953 41.850 94.352 1.00 0.00 H ATOM 2186 N VAL A 150 33.301 44.370 95.124 1.00 55.00 N ATOM 2187 CA VAL A 150 34.429 44.312 96.075 1.00 56.44 C ATOM 2188 C VAL A 150 34.058 44.703 97.499 1.00 55.95 C ATOM 2189 O VAL A 150 33.469 45.766 97.730 1.00 55.60 O ATOM 2190 CB VAL A 150 35.639 45.196 95.679 1.00 58.64 C ATOM 2191 CG1 VAL A 150 36.643 44.413 94.857 1.00 61.21 C ATOM 2192 CG2 VAL A 150 35.201 46.474 94.975 1.00 60.62 C ATOM 2193 HA VAL A 150 34.705 43.258 96.032 1.00 0.00 H ATOM 2194 HB VAL A 150 36.137 45.501 96.599 1.00 0.00 H ATOM 2195 HG11 VAL A 150 37.006 43.566 95.439 1.00 0.00 H ATOM 2196 HG12 VAL A 150 36.163 44.051 93.948 1.00 0.00 H ATOM 2197 HG13 VAL A 150 37.480 45.060 94.595 1.00 0.00 H ATOM 2198 HG21 VAL A 150 34.653 46.218 94.068 1.00 0.00 H ATOM 2199 HG22 VAL A 150 34.558 47.051 95.639 1.00 0.00 H ATOM 2200 HG23 VAL A 150 36.080 47.064 94.715 1.00 0.00 H ATOM 2201 H VAL A 150 33.239 45.169 94.461 1.00 0.00 H ATOM 2202 N VAL A 151 34.431 43.852 98.451 1.00 50.14 N ATOM 2203 CA VAL A 151 34.246 44.182 99.850 1.00 47.70 C ATOM 2204 C VAL A 151 35.597 44.466 100.503 1.00 46.61 C ATOM 2205 O VAL A 151 35.670 45.151 101.530 1.00 46.63 O ATOM 2206 CB VAL A 151 33.376 43.149 100.615 1.00 48.45 C ATOM 2207 CG1 VAL A 151 32.624 42.245 99.647 1.00 45.10 C ATOM 2208 CG2 VAL A 151 34.192 42.341 101.608 1.00 50.20 C ATOM 2209 HA VAL A 151 33.660 45.099 99.908 1.00 0.00 H ATOM 2210 HB VAL A 151 32.641 43.709 101.192 1.00 0.00 H ATOM 2211 HG11 VAL A 151 31.974 42.851 99.016 1.00 0.00 H ATOM 2212 HG12 VAL A 151 33.339 41.708 99.024 1.00 0.00 H ATOM 2213 HG13 VAL A 151 32.023 41.532 100.211 1.00 0.00 H ATOM 2214 HG21 VAL A 151 34.976 41.800 101.077 1.00 0.00 H ATOM 2215 HG22 VAL A 151 34.643 43.013 102.338 1.00 0.00 H ATOM 2216 HG23 VAL A 151 33.541 41.632 102.119 1.00 0.00 H ATOM 2217 H VAL A 151 34.859 42.941 98.189 1.00 0.00 H ATOM 2218 N GLY A 152 36.664 43.976 99.875 1.00 43.04 N ATOM 2219 CA GLY A 152 38.022 44.283 100.309 1.00 38.87 C ATOM 2220 C GLY A 152 39.063 43.534 99.501 1.00 38.32 C ATOM 2221 O GLY A 152 38.732 42.868 98.515 1.00 41.04 O ATOM 2222 HA3 GLY A 152 38.126 44.008 101.358 1.00 0.00 H ATOM 2223 HA2 GLY A 152 38.193 45.354 100.197 1.00 0.00 H ATOM 2224 H GLY A 152 36.525 43.357 99.051 1.00 0.00 H ATOM 2225 N ILE A 153 40.319 43.643 99.924 1.00 35.48 N ATOM 2226 CA ILE A 153 41.428 42.929 99.292 1.00 36.21 C ATOM 2227 C ILE A 153 42.217 42.088 100.309 1.00 36.06 C ATOM 2228 O ILE A 153 42.407 42.492 101.458 1.00 37.50 O ATOM 2229 CB ILE A 153 42.384 43.880 98.517 1.00 36.36 C ATOM 2230 CG1 ILE A 153 42.935 44.982 99.421 1.00 35.86 C ATOM 2231 CG2 ILE A 153 41.686 44.496 97.312 1.00 37.09 C ATOM 2232 CD1 ILE A 153 44.295 45.491 98.983 1.00 37.63 C ATOM 2233 HA ILE A 153 40.977 42.254 98.565 1.00 0.00 H ATOM 2234 HB ILE A 153 43.221 43.276 98.166 1.00 0.00 H ATOM 2235 HG12 ILE A 153 42.234 45.817 99.416 1.00 0.00 H ATOM 2236 HG13 ILE A 153 43.022 44.588 100.434 1.00 0.00 H ATOM 2237 HD11 ILE A 153 45.010 44.668 98.993 1.00 0.00 H ATOM 2238 HD12 ILE A 153 44.222 45.898 97.974 1.00 0.00 H ATOM 2239 HD13 ILE A 153 44.627 46.271 99.668 1.00 0.00 H ATOM 2240 HG21 ILE A 153 41.360 43.704 96.638 1.00 0.00 H ATOM 2241 HG22 ILE A 153 40.821 45.068 97.648 1.00 0.00 H ATOM 2242 HG23 ILE A 153 42.379 45.156 96.790 1.00 0.00 H ATOM 2243 H ILE A 153 40.521 44.260 100.736 1.00 0.00 H ATOM 2244 N PHE A 154 42.669 40.919 99.868 1.00 35.61 N ATOM 2245 CA PHE A 154 43.354 39.939 100.713 1.00 32.47 C ATOM 2246 C PHE A 154 44.658 40.524 101.244 1.00 31.32 C ATOM 2247 O PHE A 154 45.476 41.039 100.469 1.00 31.37 O ATOM 2248 CB PHE A 154 43.611 38.677 99.876 1.00 31.95 C ATOM 2249 CG PHE A 154 44.212 37.511 100.637 1.00 32.60 C ATOM 2250 CD1 PHE A 154 44.029 37.355 102.010 1.00 32.04 C ATOM 2251 CD2 PHE A 154 44.914 36.524 99.944 1.00 33.42 C ATOM 2252 CE1 PHE A 154 44.565 36.274 102.683 1.00 33.47 C ATOM 2253 CE2 PHE A 154 45.440 35.427 100.611 1.00 34.45 C ATOM 2254 CZ PHE A 154 45.273 35.306 101.990 1.00 33.43 C ATOM 2255 HA PHE A 154 42.737 39.682 101.574 1.00 0.00 H ATOM 2256 HB2 PHE A 154 42.660 38.351 99.455 1.00 0.00 H ATOM 2257 HB3 PHE A 154 44.293 38.941 99.068 1.00 0.00 H ATOM 2258 HD2 PHE A 154 45.051 36.616 98.867 1.00 0.00 H ATOM 2259 HE2 PHE A 154 45.983 34.661 100.058 1.00 0.00 H ATOM 2260 HZ PHE A 154 45.698 34.454 102.520 1.00 0.00 H ATOM 2261 HE1 PHE A 154 44.431 36.183 103.761 1.00 0.00 H ATOM 2262 HD1 PHE A 154 43.453 38.098 102.562 1.00 0.00 H ATOM 2263 H PHE A 154 42.528 40.687 98.864 1.00 0.00 H ATOM 2264 N ARG A 155 44.835 40.454 102.564 1.00 29.79 N ATOM 2265 CA ARG A 155 46.025 40.996 103.234 1.00 29.27 C ATOM 2266 C ARG A 155 46.919 39.912 103.867 1.00 29.60 C ATOM 2267 O ARG A 155 48.138 39.870 103.613 1.00 30.79 O ATOM 2268 CB ARG A 155 45.621 42.039 104.287 1.00 28.27 C ATOM 2269 CG ARG A 155 46.768 42.530 105.161 1.00 28.85 C ATOM 2270 CD ARG A 155 46.385 43.745 105.997 1.00 27.67 C ATOM 2271 NE ARG A 155 45.230 43.513 106.870 1.00 28.11 N ATOM 2272 CZ ARG A 155 44.483 44.485 107.406 1.00 27.85 C ATOM 2273 NH1 ARG A 155 44.763 45.762 107.168 1.00 26.30 N ATOM 2274 NH2 ARG A 155 43.448 44.184 108.173 1.00 26.61 N ATOM 2275 HA ARG A 155 46.623 41.473 102.457 1.00 0.00 H ATOM 2276 HB2 ARG A 155 45.195 42.898 103.770 1.00 0.00 H ATOM 2277 HB3 ARG A 155 44.865 41.595 104.934 1.00 0.00 H ATOM 2278 HG2 ARG A 155 47.067 41.724 105.831 1.00 0.00 H ATOM 2279 HG3 ARG A 155 47.607 42.797 104.519 1.00 0.00 H ATOM 2280 HD2 ARG A 155 46.148 44.568 105.322 1.00 0.00 H ATOM 2281 HD3 ARG A 155 47.238 44.020 106.618 1.00 0.00 H ATOM 2282 HE ARG A 155 44.975 42.528 107.087 1.00 0.00 H ATOM 2283 HH12 ARG A 155 44.176 46.510 107.589 1.00 0.00 H ATOM 2284 HH11 ARG A 155 45.569 46.013 106.560 1.00 0.00 H ATOM 2285 HH22 ARG A 155 42.870 44.943 108.588 1.00 0.00 H ATOM 2286 HH21 ARG A 155 43.212 43.189 108.361 1.00 0.00 H ATOM 2287 H ARG A 155 44.101 39.997 103.142 1.00 0.00 H ATOM 2288 N ALA A 156 46.313 39.051 104.685 1.00 26.77 N ATOM 2289 CA ALA A 156 47.057 38.044 105.444 1.00 28.67 C ATOM 2290 C ALA A 156 46.270 36.756 105.664 1.00 29.70 C ATOM 2291 O ALA A 156 45.047 36.796 105.845 1.00 32.60 O ATOM 2292 CB ALA A 156 47.512 38.611 106.782 1.00 25.95 C ATOM 2293 HA ALA A 156 47.926 37.785 104.839 1.00 0.00 H ATOM 2294 HB1 ALA A 156 48.157 39.473 106.610 1.00 0.00 H ATOM 2295 HB2 ALA A 156 46.641 38.918 107.360 1.00 0.00 H ATOM 2296 HB3 ALA A 156 48.063 37.847 107.330 1.00 0.00 H ATOM 2297 H ALA A 156 45.279 39.096 104.787 1.00 0.00 H ATOM 2298 N ALA A 157 46.980 35.627 105.664 1.00 30.48 N ATOM 2299 CA ALA A 157 46.387 34.306 105.953 1.00 33.05 C ATOM 2300 C ALA A 157 46.424 33.960 107.448 1.00 35.86 C ATOM 2301 O ALA A 157 47.497 33.919 108.070 1.00 36.84 O ATOM 2302 CB ALA A 157 47.085 33.211 105.149 1.00 29.74 C ATOM 2303 HA ALA A 157 45.340 34.363 105.654 1.00 0.00 H ATOM 2304 HB1 ALA A 157 46.978 33.420 104.084 1.00 0.00 H ATOM 2305 HB2 ALA A 157 48.143 33.187 105.412 1.00 0.00 H ATOM 2306 HB3 ALA A 157 46.630 32.247 105.379 1.00 0.00 H ATOM 2307 H ALA A 157 47.997 35.679 105.451 1.00 0.00 H ATOM 2308 N VAL A 158 45.246 33.703 108.008 1.00 36.99 N ATOM 2309 CA VAL A 158 45.118 33.233 109.388 1.00 38.15 C ATOM 2310 C VAL A 158 45.285 31.718 109.414 1.00 39.67 C ATOM 2311 O VAL A 158 44.464 30.980 108.845 1.00 39.02 O ATOM 2312 CB VAL A 158 43.737 33.594 109.983 1.00 36.75 C ATOM 2313 CG1 VAL A 158 43.621 33.102 111.424 1.00 35.88 C ATOM 2314 CG2 VAL A 158 43.472 35.085 109.880 1.00 34.19 C ATOM 2315 HA VAL A 158 45.888 33.719 109.987 1.00 0.00 H ATOM 2316 HB VAL A 158 42.971 33.085 109.398 1.00 0.00 H ATOM 2317 HG11 VAL A 158 43.742 32.019 111.448 1.00 0.00 H ATOM 2318 HG12 VAL A 158 44.398 33.569 112.030 1.00 0.00 H ATOM 2319 HG13 VAL A 158 42.641 33.368 111.820 1.00 0.00 H ATOM 2320 HG21 VAL A 158 44.242 35.628 110.428 1.00 0.00 H ATOM 2321 HG22 VAL A 158 43.490 35.384 108.832 1.00 0.00 H ATOM 2322 HG23 VAL A 158 42.494 35.309 110.306 1.00 0.00 H ATOM 2323 H VAL A 158 44.383 33.841 107.444 1.00 0.00 H ATOM 2324 N CYS A 159 46.329 31.257 110.095 1.00 40.99 N ATOM 2325 CA CYS A 159 46.699 29.843 110.063 1.00 44.92 C ATOM 2326 C CYS A 159 46.421 29.072 111.363 1.00 48.40 C ATOM 2327 O CYS A 159 46.470 29.631 112.465 1.00 46.42 O ATOM 2328 CB CYS A 159 48.168 29.701 109.653 1.00 44.89 C ATOM 2329 SG CYS A 159 48.556 30.468 108.058 1.00 43.82 S ATOM 2330 HA CYS A 159 46.049 29.381 109.320 1.00 0.00 H ATOM 2331 HB2 CYS A 159 48.408 28.639 109.592 1.00 0.00 H ATOM 2332 HB3 CYS A 159 48.786 30.168 110.419 1.00 0.00 H ATOM 2333 HG CYS A 159 48.274 31.817 108.118 1.00 0.00 H ATOM 2334 H CYS A 159 46.896 31.918 110.664 1.00 0.00 H ATOM 2335 N THR A 160 46.105 27.786 111.221 1.00 51.74 N ATOM 2336 CA THR A 160 46.002 26.879 112.369 1.00 52.10 C ATOM 2337 C THR A 160 46.925 25.721 112.073 1.00 53.57 C ATOM 2338 O THR A 160 46.625 24.893 111.215 1.00 51.60 O ATOM 2339 CB THR A 160 44.582 26.310 112.570 1.00 53.02 C ATOM 2340 OG1 THR A 160 43.605 27.316 112.314 1.00 55.39 O ATOM 2341 CG2 THR A 160 44.399 25.760 113.988 1.00 49.97 C ATOM 2342 HA THR A 160 46.257 27.431 113.274 1.00 0.00 H ATOM 2343 HB THR A 160 44.450 25.490 111.864 1.00 0.00 H ATOM 2344 HG1 THR A 160 42.700 26.937 112.447 1.00 0.00 H ATOM 2345 HG23 THR A 160 45.148 24.992 114.178 1.00 0.00 H ATOM 2346 HG21 THR A 160 44.516 26.570 114.708 1.00 0.00 H ATOM 2347 HG22 THR A 160 43.402 25.329 114.083 1.00 0.00 H ATOM 2348 H THR A 160 45.926 27.413 110.267 1.00 0.00 H ATOM 2349 N ARG A 161 48.057 25.688 112.766 1.00 57.86 N ATOM 2350 CA ARG A 161 49.073 24.651 112.569 1.00 58.10 C ATOM 2351 C ARG A 161 49.425 24.393 111.086 1.00 55.11 C ATOM 2352 O ARG A 161 49.135 23.315 110.555 1.00 51.69 O ATOM 2353 CB ARG A 161 48.647 23.348 113.261 1.00 61.12 C ATOM 2354 CG ARG A 161 48.194 23.508 114.702 1.00 61.89 C ATOM 2355 CD ARG A 161 47.612 22.206 115.214 1.00 63.85 C ATOM 2356 NE ARG A 161 47.207 22.289 116.615 1.00 64.29 N ATOM 2357 CZ ARG A 161 45.944 22.314 117.042 1.00 64.68 C ATOM 2358 NH1 ARG A 161 44.932 22.268 116.173 1.00 60.08 N ATOM 2359 NH2 ARG A 161 45.694 22.387 118.348 1.00 61.90 N ATOM 2360 HA ARG A 161 49.986 25.029 113.029 1.00 0.00 H ATOM 2361 HB2 ARG A 161 47.823 22.916 112.693 1.00 0.00 H ATOM 2362 HB3 ARG A 161 49.495 22.663 113.246 1.00 0.00 H ATOM 2363 HG2 ARG A 161 49.047 23.789 115.319 1.00 0.00 H ATOM 2364 HG3 ARG A 161 47.435 24.288 114.757 1.00 0.00 H ATOM 2365 HD2 ARG A 161 48.363 21.423 115.112 1.00 0.00 H ATOM 2366 HD3 ARG A 161 46.740 21.952 114.612 1.00 0.00 H ATOM 2367 HE ARG A 161 47.959 22.332 117.332 1.00 0.00 H ATOM 2368 HH12 ARG A 161 43.950 22.288 116.516 1.00 0.00 H ATOM 2369 HH11 ARG A 161 45.125 22.212 115.153 1.00 0.00 H ATOM 2370 HH22 ARG A 161 44.712 22.407 118.689 1.00 0.00 H ATOM 2371 HH21 ARG A 161 46.481 22.424 119.027 1.00 0.00 H ATOM 2372 H ARG A 161 48.229 26.427 113.477 1.00 0.00 H ATOM 2373 N GLY A 162 50.029 25.394 110.431 1.00 51.88 N ATOM 2374 CA GLY A 162 50.601 25.242 109.077 1.00 48.40 C ATOM 2375 C GLY A 162 49.651 25.328 107.888 1.00 44.87 C ATOM 2376 O GLY A 162 50.080 25.288 106.737 1.00 49.65 O ATOM 2377 HA3 GLY A 162 51.085 24.266 109.036 1.00 0.00 H ATOM 2378 HA2 GLY A 162 51.351 26.023 108.951 1.00 0.00 H ATOM 2379 H GLY A 162 50.098 26.321 110.897 1.00 0.00 H ATOM 2380 N VAL A 163 48.359 25.462 108.173 1.00 44.37 N ATOM 2381 CA VAL A 163 47.295 25.431 107.168 1.00 39.62 C ATOM 2382 C VAL A 163 46.459 26.697 107.328 1.00 36.91 C ATOM 2383 O VAL A 163 46.134 27.081 108.450 1.00 36.67 O ATOM 2384 CB VAL A 163 46.422 24.161 107.377 1.00 41.98 C ATOM 2385 CG1 VAL A 163 45.139 24.201 106.566 1.00 40.25 C ATOM 2386 CG2 VAL A 163 47.223 22.907 107.035 1.00 40.16 C ATOM 2387 HA VAL A 163 47.711 25.394 106.161 1.00 0.00 H ATOM 2388 HB VAL A 163 46.138 24.136 108.429 1.00 0.00 H ATOM 2389 HG11 VAL A 163 44.550 25.068 106.863 1.00 0.00 H ATOM 2390 HG12 VAL A 163 45.383 24.272 105.506 1.00 0.00 H ATOM 2391 HG13 VAL A 163 44.567 23.291 106.748 1.00 0.00 H ATOM 2392 HG21 VAL A 163 47.542 22.954 105.994 1.00 0.00 H ATOM 2393 HG22 VAL A 163 48.098 22.849 107.682 1.00 0.00 H ATOM 2394 HG23 VAL A 163 46.599 22.026 107.186 1.00 0.00 H ATOM 2395 H VAL A 163 48.089 25.597 109.168 1.00 0.00 H ATOM 2396 N ALA A 164 46.118 27.356 106.223 1.00 34.56 N ATOM 2397 CA ALA A 164 45.281 28.561 106.294 1.00 33.91 C ATOM 2398 C ALA A 164 43.829 28.187 106.517 1.00 34.81 C ATOM 2399 O ALA A 164 43.261 27.400 105.745 1.00 32.98 O ATOM 2400 CB ALA A 164 45.422 29.409 105.035 1.00 33.38 C ATOM 2401 HA ALA A 164 45.625 29.156 107.140 1.00 0.00 H ATOM 2402 HB1 ALA A 164 46.462 29.715 104.919 1.00 0.00 H ATOM 2403 HB2 ALA A 164 45.115 28.824 104.168 1.00 0.00 H ATOM 2404 HB3 ALA A 164 44.789 30.293 105.121 1.00 0.00 H ATOM 2405 H ALA A 164 46.448 27.014 105.298 1.00 0.00 H ATOM 2406 N LYS A 165 43.233 28.743 107.573 1.00 34.52 N ATOM 2407 CA LYS A 165 41.831 28.478 107.882 1.00 35.88 C ATOM 2408 C LYS A 165 40.936 29.706 107.768 1.00 35.67 C ATOM 2409 O LYS A 165 39.706 29.588 107.791 1.00 35.33 O ATOM 2410 CB LYS A 165 41.680 27.835 109.268 1.00 39.63 C ATOM 2411 CG LYS A 165 41.791 26.317 109.228 1.00 45.40 C ATOM 2412 CD LYS A 165 40.743 25.624 110.095 1.00 46.80 C ATOM 2413 CE LYS A 165 40.715 24.115 109.847 1.00 47.97 C ATOM 2414 NZ LYS A 165 42.010 23.429 110.125 1.00 47.04 N ATOM 2415 HA LYS A 165 41.492 27.776 107.121 1.00 0.00 H ATOM 2416 HB2 LYS A 165 42.461 28.225 109.920 1.00 0.00 H ATOM 2417 HB3 LYS A 165 40.704 28.103 109.672 1.00 0.00 H ATOM 2418 HG2 LYS A 165 41.665 25.985 108.197 1.00 0.00 H ATOM 2419 HG3 LYS A 165 42.781 26.030 109.582 1.00 0.00 H ATOM 2420 HD2 LYS A 165 40.975 25.806 111.144 1.00 0.00 H ATOM 2421 HD3 LYS A 165 39.762 26.039 109.864 1.00 0.00 H ATOM 2422 HE2 LYS A 165 40.454 23.944 108.803 1.00 0.00 H ATOM 2423 HE3 LYS A 165 39.950 23.676 110.488 1.00 0.00 H ATOM 2424 HZ1 LYS A 165 42.750 23.827 109.513 1.00 0.00 H ATOM 2425 HZ2 LYS A 165 42.269 23.572 111.122 1.00 0.00 H ATOM 2426 HZ3 LYS A 165 41.910 22.412 109.934 1.00 0.00 H ATOM 2427 H LYS A 165 43.779 29.379 108.189 1.00 0.00 H ATOM 2428 N ALA A 166 41.550 30.881 107.642 1.00 34.27 N ATOM 2429 CA ALA A 166 40.807 32.134 107.589 1.00 34.11 C ATOM 2430 C ALA A 166 41.632 33.161 106.864 1.00 36.10 C ATOM 2431 O ALA A 166 42.851 32.997 106.718 1.00 37.79 O ATOM 2432 CB ALA A 166 40.459 32.622 108.996 1.00 34.59 C ATOM 2433 HA ALA A 166 39.871 31.973 107.055 1.00 0.00 H ATOM 2434 HB1 ALA A 166 39.848 31.872 109.498 1.00 0.00 H ATOM 2435 HB2 ALA A 166 41.377 32.782 109.561 1.00 0.00 H ATOM 2436 HB3 ALA A 166 39.905 33.558 108.928 1.00 0.00 H ATOM 2437 H ALA A 166 42.588 30.905 107.580 1.00 0.00 H ATOM 2438 N VAL A 167 40.969 34.209 106.388 1.00 37.00 N ATOM 2439 CA VAL A 167 41.658 35.311 105.731 1.00 38.82 C ATOM 2440 C VAL A 167 41.387 36.637 106.421 1.00 40.53 C ATOM 2441 O VAL A 167 40.276 36.898 106.907 1.00 41.30 O ATOM 2442 CB VAL A 167 41.371 35.406 104.209 1.00 39.50 C ATOM 2443 CG1 VAL A 167 41.857 34.147 103.494 1.00 38.35 C ATOM 2444 CG2 VAL A 167 39.899 35.686 103.918 1.00 37.09 C ATOM 2445 HA VAL A 167 42.720 35.086 105.827 1.00 0.00 H ATOM 2446 HB VAL A 167 41.930 36.257 103.819 1.00 0.00 H ATOM 2447 HG11 VAL A 167 42.931 34.036 103.646 1.00 0.00 H ATOM 2448 HG12 VAL A 167 41.339 33.278 103.899 1.00 0.00 H ATOM 2449 HG13 VAL A 167 41.647 34.232 102.428 1.00 0.00 H ATOM 2450 HG21 VAL A 167 39.289 34.882 104.329 1.00 0.00 H ATOM 2451 HG22 VAL A 167 39.613 36.632 104.378 1.00 0.00 H ATOM 2452 HG23 VAL A 167 39.748 35.744 102.840 1.00 0.00 H ATOM 2453 H VAL A 167 39.934 34.243 106.487 1.00 0.00 H ATOM 2454 N ASP A 168 42.439 37.447 106.473 1.00 39.03 N ATOM 2455 CA ASP A 168 42.380 38.794 106.985 1.00 36.67 C ATOM 2456 C ASP A 168 42.485 39.696 105.769 1.00 36.81 C ATOM 2457 O ASP A 168 43.328 39.477 104.884 1.00 35.38 O ATOM 2458 CB ASP A 168 43.525 39.035 107.977 1.00 36.22 C ATOM 2459 CG ASP A 168 43.862 40.507 108.157 1.00 36.60 C ATOM 2460 OD1 ASP A 168 43.175 41.208 108.928 1.00 36.53 O ATOM 2461 OD2 ASP A 168 44.847 40.960 107.545 1.00 37.45 O ATOM 2462 HA ASP A 168 41.459 38.990 107.533 1.00 0.00 H ATOM 2463 HB2 ASP A 168 43.237 38.624 108.945 1.00 0.00 H ATOM 2464 HB3 ASP A 168 44.413 38.518 107.614 1.00 0.00 H ATOM 2465 H ASP A 168 43.353 37.091 106.126 1.00 0.00 H ATOM 2466 N PHE A 169 41.622 40.704 105.719 1.00 35.77 N ATOM 2467 CA PHE A 169 41.546 41.564 104.545 1.00 37.08 C ATOM 2468 C PHE A 169 41.294 43.036 104.888 1.00 37.81 C ATOM 2469 O PHE A 169 40.783 43.354 105.962 1.00 38.22 O ATOM 2470 CB PHE A 169 40.477 41.037 103.581 1.00 35.66 C ATOM 2471 CG PHE A 169 39.079 41.068 104.134 1.00 37.30 C ATOM 2472 CD1 PHE A 169 38.274 42.196 103.969 1.00 38.41 C ATOM 2473 CD2 PHE A 169 38.547 39.958 104.794 1.00 38.34 C ATOM 2474 CE1 PHE A 169 36.975 42.227 104.475 1.00 37.68 C ATOM 2475 CE2 PHE A 169 37.249 39.979 105.287 1.00 38.59 C ATOM 2476 CZ PHE A 169 36.465 41.120 105.134 1.00 38.36 C ATOM 2477 HA PHE A 169 42.523 41.532 104.062 1.00 0.00 H ATOM 2478 HB2 PHE A 169 40.501 41.646 102.677 1.00 0.00 H ATOM 2479 HB3 PHE A 169 40.722 40.005 103.329 1.00 0.00 H ATOM 2480 HD2 PHE A 169 39.158 39.065 104.924 1.00 0.00 H ATOM 2481 HE2 PHE A 169 36.844 39.103 105.793 1.00 0.00 H ATOM 2482 HZ PHE A 169 35.451 41.142 105.533 1.00 0.00 H ATOM 2483 HE1 PHE A 169 36.362 43.120 104.352 1.00 0.00 H ATOM 2484 HD1 PHE A 169 38.666 43.064 103.438 1.00 0.00 H ATOM 2485 H PHE A 169 40.993 40.882 106.528 1.00 0.00 H ATOM 2486 N ILE A 170 41.669 43.915 103.962 1.00 40.00 N ATOM 2487 CA ILE A 170 41.422 45.349 104.065 1.00 40.78 C ATOM 2488 C ILE A 170 40.038 45.658 103.493 1.00 42.88 C ATOM 2489 O ILE A 170 39.798 45.424 102.307 1.00 44.54 O ATOM 2490 CB ILE A 170 42.491 46.148 103.303 1.00 40.40 C ATOM 2491 CG1 ILE A 170 43.889 45.789 103.830 1.00 39.09 C ATOM 2492 CG2 ILE A 170 42.207 47.646 103.422 1.00 42.14 C ATOM 2493 CD1 ILE A 170 45.024 45.968 102.839 1.00 39.74 C ATOM 2494 HA ILE A 170 41.467 45.640 105.114 1.00 0.00 H ATOM 2495 HB ILE A 170 42.458 45.887 102.245 1.00 0.00 H ATOM 2496 HG12 ILE A 170 44.095 46.420 104.695 1.00 0.00 H ATOM 2497 HG13 ILE A 170 43.874 44.744 104.139 1.00 0.00 H ATOM 2498 HD11 ILE A 170 44.849 45.334 101.970 1.00 0.00 H ATOM 2499 HD12 ILE A 170 45.070 47.011 102.526 1.00 0.00 H ATOM 2500 HD13 ILE A 170 45.965 45.687 103.312 1.00 0.00 H ATOM 2501 HG21 ILE A 170 41.226 47.863 102.999 1.00 0.00 H ATOM 2502 HG22 ILE A 170 42.223 47.935 104.473 1.00 0.00 H ATOM 2503 HG23 ILE A 170 42.970 48.203 102.879 1.00 0.00 H ATOM 2504 H ILE A 170 42.165 43.561 103.119 1.00 0.00 H ATOM 2505 N PRO A 171 39.115 46.173 104.334 1.00 43.17 N ATOM 2506 CA PRO A 171 37.760 46.445 103.854 1.00 42.86 C ATOM 2507 C PRO A 171 37.750 47.554 102.808 1.00 44.78 C ATOM 2508 O PRO A 171 38.682 48.371 102.768 1.00 45.27 O ATOM 2509 CB PRO A 171 36.998 46.878 105.125 1.00 43.31 C ATOM 2510 CG PRO A 171 37.880 46.564 106.279 1.00 42.33 C ATOM 2511 CD PRO A 171 39.292 46.566 105.747 1.00 43.85 C ATOM 2512 HA PRO A 171 37.312 45.580 103.365 1.00 0.00 H ATOM 2513 HD3 PRO A 171 39.739 47.557 105.825 1.00 0.00 H ATOM 2514 HD2 PRO A 171 39.913 45.846 106.280 1.00 0.00 H ATOM 2515 HG3 PRO A 171 37.632 45.585 106.688 1.00 0.00 H ATOM 2516 HG2 PRO A 171 37.768 47.320 107.056 1.00 0.00 H ATOM 2517 HB2 PRO A 171 36.788 47.947 105.092 1.00 0.00 H ATOM 2518 HB3 PRO A 171 36.061 46.328 105.207 1.00 0.00 H ATOM 2519 N VAL A 172 36.722 47.568 101.960 1.00 47.39 N ATOM 2520 CA VAL A 172 36.593 48.582 100.905 1.00 55.60 C ATOM 2521 C VAL A 172 36.478 50.004 101.492 1.00 58.61 C ATOM 2522 O VAL A 172 37.047 50.957 100.949 1.00 60.28 O ATOM 2523 CB VAL A 172 35.438 48.245 99.922 1.00 58.79 C ATOM 2524 CG1 VAL A 172 34.073 48.329 100.603 1.00 61.66 C ATOM 2525 CG2 VAL A 172 35.484 49.129 98.686 1.00 60.18 C ATOM 2526 HA VAL A 172 37.512 48.564 100.319 1.00 0.00 H ATOM 2527 HB VAL A 172 35.583 47.213 99.601 1.00 0.00 H ATOM 2528 HG11 VAL A 172 34.037 47.621 101.431 1.00 0.00 H ATOM 2529 HG12 VAL A 172 33.919 49.340 100.981 1.00 0.00 H ATOM 2530 HG13 VAL A 172 33.293 48.086 99.881 1.00 0.00 H ATOM 2531 HG21 VAL A 172 35.391 50.173 98.984 1.00 0.00 H ATOM 2532 HG22 VAL A 172 36.432 48.980 98.170 1.00 0.00 H ATOM 2533 HG23 VAL A 172 34.662 48.865 98.021 1.00 0.00 H ATOM 2534 H VAL A 172 35.987 46.837 102.048 1.00 0.00 H ATOM 2535 N GLU A 173 35.785 50.117 102.624 1.00 61.65 N ATOM 2536 CA GLU A 173 35.599 51.387 103.337 1.00 67.23 C ATOM 2537 C GLU A 173 36.918 52.018 103.776 1.00 69.26 C ATOM 2538 O GLU A 173 37.012 53.239 103.876 1.00 73.32 O ATOM 2539 CB GLU A 173 34.689 51.200 104.563 1.00 70.69 C ATOM 2540 CG GLU A 173 33.268 50.735 104.258 1.00 70.76 C ATOM 2541 CD GLU A 173 33.132 49.221 104.116 1.00 74.86 C ATOM 2542 OE1 GLU A 173 34.156 48.494 104.164 1.00 70.42 O ATOM 2543 OE2 GLU A 173 31.982 48.753 103.951 1.00 74.51 O ATOM 2544 HA GLU A 173 35.126 52.066 102.627 1.00 0.00 H ATOM 2545 HB2 GLU A 173 35.152 50.461 105.216 1.00 0.00 H ATOM 2546 HB3 GLU A 173 34.626 52.155 105.084 1.00 0.00 H ATOM 2547 HG2 GLU A 173 32.617 51.064 105.068 1.00 0.00 H ATOM 2548 HG3 GLU A 173 32.947 51.198 103.325 1.00 0.00 H ATOM 2549 H GLU A 173 35.353 49.260 103.024 1.00 0.00 H ATOM 2550 N SER A 174 37.923 51.179 104.039 1.00 70.69 N ATOM 2551 CA SER A 174 39.264 51.637 104.418 1.00 68.85 C ATOM 2552 C SER A 174 39.977 52.334 103.267 1.00 70.67 C ATOM 2553 O SER A 174 40.855 53.172 103.490 1.00 73.73 O ATOM 2554 CB SER A 174 40.132 50.468 104.892 1.00 67.17 C ATOM 2555 OG SER A 174 39.609 49.871 106.062 1.00 71.07 O ATOM 2556 HA SER A 174 39.125 52.350 105.231 1.00 0.00 H ATOM 2557 HB2 SER A 174 41.137 50.835 105.101 1.00 0.00 H ATOM 2558 HB3 SER A 174 40.178 49.718 104.102 1.00 0.00 H ATOM 2559 HG SER A 174 40.194 49.122 106.338 1.00 0.00 H ATOM 2560 H SER A 174 37.747 50.156 103.972 1.00 0.00 H ATOM 2561 N MET A 175 39.613 51.973 102.040 1.00 70.41 N ATOM 2562 CA MET A 175 40.242 52.554 100.856 1.00 69.86 C ATOM 2563 C MET A 175 39.562 53.877 100.481 1.00 71.19 C ATOM 2564 O MET A 175 40.192 54.774 99.921 1.00 70.71 O ATOM 2565 CB MET A 175 40.223 51.560 99.686 1.00 64.70 C ATOM 2566 CG MET A 175 40.517 50.117 100.087 1.00 65.31 C ATOM 2567 SD MET A 175 40.312 48.862 98.798 1.00 63.82 S ATOM 2568 CE MET A 175 38.809 49.407 97.999 1.00 60.67 C ATOM 2569 HA MET A 175 41.285 52.769 101.087 1.00 0.00 H ATOM 2570 HB2 MET A 175 39.236 51.593 99.225 1.00 0.00 H ATOM 2571 HB3 MET A 175 40.973 51.873 98.959 1.00 0.00 H ATOM 2572 HG2 MET A 175 39.850 49.859 100.910 1.00 0.00 H ATOM 2573 HG3 MET A 175 41.550 50.073 100.431 1.00 0.00 H ATOM 2574 HE1 MET A 175 37.996 49.415 98.725 1.00 0.00 H ATOM 2575 HE2 MET A 175 38.954 50.412 97.602 1.00 0.00 H ATOM 2576 HE3 MET A 175 38.564 48.725 97.185 1.00 0.00 H ATOM 2577 H MET A 175 38.864 51.261 101.920 1.00 0.00 H TER 2578 MET A 175 HETATM 2579 ZN ZN A 1 27.199 42.875 97.588 1.00 66.41 ZN HETATM 2580 O HOH 2 50.076 28.097 112.229 1.00 31.80 O HETATM 2581 O HOH 3 48.372 32.296 95.377 1.00 30.44 O HETATM 2582 O HOH 4 41.385 39.962 110.538 1.00 36.31 O HETATM 2583 O HOH 5 43.231 40.107 112.940 1.00 28.76 O HETATM 2584 O HOH 6 49.410 45.837 74.961 1.00 47.53 O HETATM 2585 O HOH 7 57.530 43.772 78.265 1.00 45.28 O HETATM 2586 O HOH 8 48.479 33.487 80.063 1.00 40.38 O HETATM 2587 O HOH 9 41.481 35.201 115.711 1.00 31.44 O HETATM 2588 O HOH 10 48.393 27.996 114.439 1.00 44.08 O HETATM 2589 O HOH 11 26.533 44.481 96.020 1.00 34.98 O HETATM 2590 O HOH 12 59.694 50.350 98.723 1.00 49.43 O HETATM 2591 O HOH 13 36.481 27.676 100.978 1.00 43.74 O HETATM 2592 O HOH 14 60.312 43.228 96.007 1.00 49.92 O HETATM 2593 O HOH 15 43.757 42.421 111.338 1.00 44.44 O HETATM 2594 O HOH 16 51.049 30.160 95.445 1.00 44.33 O HETATM 2595 O HOH 17 30.922 40.865 109.602 1.00 49.06 O HETATM 2596 C21 UNN A 18 49.608 36.815 109.581 1.00 0.32 C HETATM 2597 O22 UNN A 18 50.515 37.595 109.887 1.00 -0.38 O HETATM 2598 O23 UNN A 18 48.416 36.815 110.135 1.00 -0.26 O HETATM 2599 C42 UNN A 18 48.140 37.714 111.203 1.00 0.09 C HETATM 2600 C46 UNN A 18 46.927 37.231 112.002 1.00 -0.02 C HETATM 2601 C45 UNN A 18 45.735 37.792 111.216 1.00 -0.05 C HETATM 2602 C44 UNN A 18 46.243 38.981 110.387 1.00 -0.05 C HETATM 2603 C43 UNN A 18 47.754 39.089 110.646 1.00 -0.02 C HETATM 2604 H8 UNN A 18 48.296 39.297 109.712 1.00 0.03 H HETATM 2605 H9 UNN A 18 47.968 39.881 111.379 1.00 0.03 H HETATM 2606 H6 UNN A 18 45.738 39.906 110.702 1.00 0.03 H HETATM 2607 H7 UNN A 18 46.054 38.806 109.318 1.00 0.03 H HETATM 2608 H4 UNN A 18 44.952 38.127 111.912 1.00 0.03 H HETATM 2609 H5 UNN A 18 45.327 37.017 110.550 1.00 0.03 H HETATM 2610 H2 UNN A 18 46.946 37.631 113.026 1.00 0.03 H HETATM 2611 H3 UNN A 18 46.892 36.132 112.038 1.00 0.03 H HETATM 2612 H1 UNN A 18 49.022 37.796 111.855 1.00 0.06 H HETATM 2613 N20 UNN A 18 49.766 35.772 108.699 1.00 -0.24 N HETATM 2614 C18 UNN A 18 50.896 35.697 107.767 1.00 0.13 C HETATM 2615 C17 UNN A 18 50.635 36.639 106.579 1.00 0.21 C HETATM 2616 O19 UNN A 18 49.609 36.442 105.927 1.00 -0.39 O HETATM 2617 N10 UNN A 18 51.553 37.595 106.226 1.00 -0.25 N HETATM 2618 C11 UNN A 18 51.384 38.490 105.067 1.00 0.14 C HETATM 2619 C14 UNN A 18 51.314 37.711 103.746 1.00 0.20 C HETATM 2620 N4 UNN A 18 50.223 37.824 102.908 1.00 -0.27 N HETATM 2621 C2 UNN A 18 49.771 36.870 101.933 1.00 0.14 C HETATM 2622 C1 UNN A 18 48.277 36.665 101.757 1.00 -0.02 C HETATM 2623 C3 UNN A 18 49.104 35.637 102.511 1.00 -0.01 C HETATM 2624 C8 UNN A 18 49.345 34.240 102.007 1.00 -0.05 C HETATM 2625 C29 UNN A 18 50.209 33.305 102.459 1.00 -0.05 C HETATM 2626 C28 UNN A 18 50.645 33.012 103.909 1.00 -0.05 C HETATM 2627 C27 UNN A 18 52.168 33.036 104.146 1.00 -0.05 C HETATM 2628 C26 UNN A 18 52.436 32.835 105.656 1.00 -0.05 C HETATM 2629 C25 UNN A 18 52.369 34.191 106.400 1.00 -0.05 C HETATM 2630 C24 UNN A 18 51.118 34.237 107.312 1.00 -0.01 C HETATM 2631 H12 UNN A 18 50.238 33.885 106.753 1.00 0.03 H HETATM 2632 H13 UNN A 18 51.276 33.594 108.191 1.00 0.03 H HETATM 2633 H14 UNN A 18 53.273 34.313 107.015 1.00 0.03 H HETATM 2634 H15 UNN A 18 52.313 35.007 105.665 1.00 0.03 H HETATM 2635 H16 UNN A 18 51.677 32.155 106.072 1.00 0.03 H HETATM 2636 H17 UNN A 18 53.435 32.396 105.792 1.00 0.03 H HETATM 2637 H18 UNN A 18 52.645 32.226 103.574 1.00 0.03 H HETATM 2638 H19 UNN A 18 52.578 34.004 103.823 1.00 0.03 H HETATM 2639 H20 UNN A 18 50.185 33.767 104.563 1.00 0.03 H HETATM 2640 H21 UNN A 18 50.272 32.014 104.183 1.00 0.03 H HETATM 2641 H28 UNN A 18 49.794 32.352 102.099 1.00 0.03 H HETATM 2642 H29 UNN A 18 51.148 33.520 101.928 1.00 0.03 H HETATM 2643 H26 UNN A 18 49.619 34.376 100.950 1.00 0.03 H HETATM 2644 H27 UNN A 18 48.360 33.754 102.071 1.00 0.03 H HETATM 2645 H24 UNN A 18 48.988 35.574 103.603 1.00 0.03 H HETATM 2646 H22 UNN A 18 47.868 36.422 100.765 1.00 0.03 H HETATM 2647 H23 UNN A 18 47.566 37.305 102.300 1.00 0.03 H HETATM 2648 C6 UNN A 18 50.688 36.809 100.730 1.00 0.24 C HETATM 2649 O5 UNN A 18 50.420 35.962 99.755 1.00 -0.34 O HETATM 2650 N7 UNN A 18 51.637 37.734 100.625 1.00 -0.16 N HETATM 2651 S47 UNN A 18 52.547 37.805 99.204 1.00 0.06 S HETATM 2652 O49 UNN A 18 53.185 36.505 98.970 1.00 -0.15 O HETATM 2653 O50 UNN A 18 51.679 38.353 98.144 1.00 -0.15 O HETATM 2654 C48 UNN A 18 53.842 39.073 99.567 1.00 0.10 C HETATM 2655 C52 UNN A 18 54.622 39.472 98.332 1.00 -0.03 C HETATM 2656 C51 UNN A 18 53.558 40.396 98.882 1.00 -0.03 C HETATM 2657 H34 UNN A 18 53.847 41.340 99.368 1.00 0.03 H HETATM 2658 H35 UNN A 18 52.616 40.540 98.332 1.00 0.03 H HETATM 2659 H32 UNN A 18 54.454 38.944 97.382 1.00 0.03 H HETATM 2660 H33 UNN A 18 55.684 39.745 98.417 1.00 0.03 H HETATM 2661 H31 UNN A 18 54.287 38.986 100.569 1.00 0.06 H HETATM 2662 H30 UNN A 18 51.809 38.375 101.373 1.00 0.21 H HETATM 2663 H25 UNN A 18 49.687 38.664 102.988 1.00 0.18 H HETATM 2664 O15 UNN A 18 52.224 36.909 103.549 1.00 -0.39 O HETATM 2665 C12 UNN A 18 52.568 39.474 105.118 1.00 0.02 C HETATM 2666 C13 UNN A 18 52.912 39.503 106.612 1.00 0.11 C HETATM 2667 C9 UNN A 18 52.637 38.071 107.095 1.00 0.07 C HETATM 2668 H40 UNN A 18 53.532 37.443 106.980 1.00 0.06 H HETATM 2669 H41 UNN A 18 52.321 38.069 108.148 1.00 0.06 H HETATM 2670 O16 UNN A 18 52.053 40.406 107.311 1.00 -0.26 O HETATM 2671 C30 UNN A 18 52.052 41.702 107.081 1.00 0.32 C HETATM 2672 N31 UNN A 18 51.020 42.312 107.758 1.00 -0.24 N HETATM 2673 C33 UNN A 18 50.942 43.775 107.954 1.00 0.07 C HETATM 2674 C34 UNN A 18 49.674 44.262 108.665 1.00 -0.02 C HETATM 2675 C35 UNN A 18 48.610 43.372 108.937 1.00 -0.04 C HETATM 2676 C36 UNN A 18 48.770 41.934 108.520 1.00 -0.00 C HETATM 2677 C37 UNN A 18 50.231 41.569 108.745 1.00 0.05 C HETATM 2678 H46 UNN A 18 50.538 41.852 109.763 1.00 0.05 H HETATM 2679 H47 UNN A 18 50.375 40.487 108.606 1.00 0.05 H HETATM 2680 H44 UNN A 18 48.510 41.817 107.458 1.00 0.04 H HETATM 2681 H45 UNN A 18 48.121 41.289 109.130 1.00 0.04 H HETATM 2682 C41 UNN A 18 47.432 43.784 109.598 1.00 -0.07 C HETATM 2683 C40 UNN A 18 47.320 45.133 109.978 1.00 -0.08 C HETATM 2684 C39 UNN A 18 48.371 46.035 109.699 1.00 -0.08 C HETATM 2685 C38 UNN A 18 49.549 45.612 109.044 1.00 -0.06 C HETATM 2686 H48 UNN A 18 50.346 46.317 108.836 1.00 0.05 H HETATM 2687 H49 UNN A 18 48.271 47.073 109.994 1.00 0.05 H HETATM 2688 H50 UNN A 18 46.427 45.481 110.485 1.00 0.05 H HETATM 2689 H51 UNN A 18 46.636 43.079 109.807 1.00 0.05 H HETATM 2690 H42 UNN A 18 50.986 44.255 106.966 1.00 0.07 H HETATM 2691 H43 UNN A 18 51.811 44.087 108.552 1.00 0.07 H HETATM 2692 O32 UNN A 18 53.034 42.322 106.671 1.00 -0.38 O HETATM 2693 H39 UNN A 18 53.964 39.784 106.769 1.00 0.07 H HETATM 2694 H37 UNN A 18 52.272 40.471 104.759 1.00 0.03 H HETATM 2695 H38 UNN A 18 53.416 39.106 104.522 1.00 0.03 H HETATM 2696 H36 UNN A 18 50.445 39.052 105.177 1.00 0.08 H HETATM 2697 H10 UNN A 18 51.805 36.036 108.285 1.00 0.08 H HETATM 2698 H11 UNN A 18 49.086 35.038 108.693 1.00 0.19 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 1410 1409 1414 2579 CONECT 1435 1434 1439 2579 CONECT 2132 2131 2136 2579 CONECT 2579 1410 1435 2132 CONECT 2596 2597 2598 2613 CONECT 2597 2596 CONECT 2598 2596 2599 CONECT 2599 2598 2600 2603 2612 CONECT 2600 2599 2601 2610 2611 CONECT 2601 2600 2602 2608 2609 CONECT 2602 2601 2603 2606 2607 CONECT 2603 2599 2602 2604 2605 CONECT 2604 2603 CONECT 2605 2603 CONECT 2606 2602 CONECT 2607 2602 CONECT 2608 2601 CONECT 2609 2601 CONECT 2610 2600 CONECT 2611 2600 CONECT 2612 2599 CONECT 2613 2596 2614 2698 CONECT 2614 2613 2615 2630 2697 CONECT 2615 2614 2616 2617 CONECT 2616 2615 CONECT 2617 2615 2618 2667 CONECT 2618 2617 2619 2665 2696 CONECT 2619 2618 2620 2664 CONECT 2620 2619 2621 2663 CONECT 2621 2620 2622 2623 2648 CONECT 2622 2621 2623 2646 2647 CONECT 2623 2621 2622 2624 2645 CONECT 2624 2623 2625 2643 2644 CONECT 2625 2624 2626 2641 2642 CONECT 2626 2625 2627 2639 2640 CONECT 2627 2626 2628 2637 2638 CONECT 2628 2627 2629 2635 2636 CONECT 2629 2628 2630 2633 2634 CONECT 2630 2614 2629 2631 2632 CONECT 2631 2630 CONECT 2632 2630 CONECT 2633 2629 CONECT 2634 2629 CONECT 2635 2628 CONECT 2636 2628 CONECT 2637 2627 CONECT 2638 2627 CONECT 2639 2626 CONECT 2640 2626 CONECT 2641 2625 CONECT 2642 2625 CONECT 2643 2624 CONECT 2644 2624 CONECT 2645 2623 CONECT 2646 2622 CONECT 2647 2622 CONECT 2648 2621 2649 2650 CONECT 2649 2648 CONECT 2650 2648 2651 2662 CONECT 2651 2650 2652 2653 2654 CONECT 2652 2651 CONECT 2653 2651 CONECT 2654 2651 2655 2656 2661 CONECT 2655 2654 2656 2659 2660 CONECT 2656 2654 2655 2657 2658 CONECT 2657 2656 CONECT 2658 2656 CONECT 2659 2655 CONECT 2660 2655 CONECT 2661 2654 CONECT 2662 2650 CONECT 2663 2620 CONECT 2664 2619 CONECT 2665 2618 2666 2694 2695 CONECT 2666 2665 2667 2670 2693 CONECT 2667 2617 2666 2668 2669 CONECT 2668 2667 CONECT 2669 2667 CONECT 2670 2666 2671 CONECT 2671 2670 2672 2692 CONECT 2672 2671 2673 2677 CONECT 2673 2672 2674 2690 2691 CONECT 2674 2673 2675 2685 CONECT 2675 2674 2676 2682 CONECT 2676 2675 2677 2680 2681 CONECT 2677 2672 2676 2678 2679 CONECT 2678 2677 CONECT 2679 2677 CONECT 2680 2676 CONECT 2681 2676 CONECT 2682 2675 2683 2689 CONECT 2683 2682 2684 2688 CONECT 2684 2683 2685 2687 CONECT 2685 2674 2684 2686 CONECT 2686 2685 CONECT 2687 2684 CONECT 2688 2683 CONECT 2689 2682 CONECT 2690 2673 CONECT 2691 2673 CONECT 2692 2671 CONECT 2693 2666 CONECT 2694 2665 CONECT 2695 2665 CONECT 2696 2618 CONECT 2697 2614 CONECT 2698 2613 MASTER 0 0 0 0 0 0 0 0 2697 1 111 14 END
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Related entries of code: 4ktc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1dxp
RCSB PDB
PDBbind
16aa, >1DXP_2|Chains... at 100%
3oyp
RCSB PDB
PDBbind
16aa, >3OYP_2|Chains... at 100%
3p8n
RCSB PDB
PDBbind
17aa, >3P8N_2|Chains... at 100%
3p8o
RCSB PDB
PDBbind
17aa, >3P8O_2|Chains... at 100%
4i31
RCSB PDB
PDBbind
17aa, >4I31_2|Chains... at 100%
4i32
RCSB PDB
PDBbind
17aa, >4I32_2|Chains... at 100%
4i33
RCSB PDB
PDBbind
17aa, >4I33_2|Chains... at 100%
4u01
RCSB PDB
PDBbind
16aa, >4U01_2|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
4ktc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Serine protease NS3
Ligand Name
1X3
EC.Number
E.C.3.4.21.98 3.6.1.15 3.6.4.13
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
IC50=1nM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Med.Chem. Vol. 57: pp. 1753-1769
Ligand Properties
Formula
C
3
7
H
5
1
N
5
O
9
S
Molecular Weight
741.894
Exact Mass
741.341
No. of atoms
103
No. of bonds
109
Polar Surface Area
188.9
LOGP Value
4.51 (
Computed with XLOGP3
)
5.48 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 14
No. of Rings: 7
Canonical SMILES
O=C(N[C@H]1CCCCCCC[C@H]2[C@](NC(=O)[C@H]3N(C1=O)C[C@@H](C3)OC(=O)N1CCc3c(C1)cccc3)(C2)C(=O)NS(=O)(=O)C1CC1)OC1CCCC1
InChI String
InChI=1S/C37H51N5O9S/c43-32-31-20-28(51-36(47)41-19-18-24-10-6-7-11-25(24)22-41)23-42(31)33(44)30(38-35(46)50-27-13-8-9-14-27)15-5-3-1-2-4-12-26-21-37(26,39-32)34(45)40-52(48,49)29-16-17-29/h6-7,10-11,26-31H,1-5,8-9,12-23H2,(H,38,46)(H,39,43)(H,40,45)/t26-,28-,30+,31+,37-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P26662
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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