Browse entries in the PDBbind-CN Database
HEADER 5AIP_COMPLEX COMPND 5AIP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 141 MSE PRO THR GLN SER LYS HIS ALA SER ILE ASN ILE GLY SEQRES 2 A 141 LEU ILE GLN ALA ARG GLU ALA LEU MSE THR GLN PHE ARG SEQRES 3 A 141 PRO ILE LEU ASN GLN ALA ASN ILE THR ASP GLN GLN TRP SEQRES 4 A 141 ARG ILE ILE ARG LEU LEU ALA GLU ASN GLY THR LEU ASP SEQRES 5 A 141 PHE GLN ASP LEU ALA ASN GLN ALA CYS ILE LEU ARG PRO SEQRES 6 A 141 SER LEU THR GLY ILE LEU THR ARG LEU GLU LYS ALA GLY SEQRES 7 A 141 LEU VAL VAL ARG LEU LYS PRO SER ASN ASP GLN ARG ARG SEQRES 8 A 141 VAL PHE LEU LYS LEU THR ALA GLU GLY GLU LYS LEU TYR SEQRES 9 A 141 GLU GLU ILE GLY GLU GLU VAL ASP GLU ARG TYR ASP ALA SEQRES 10 A 141 ILE GLU GLU VAL LEU GLY ARG GLU LYS MSE LEU LEU LEU SEQRES 11 A 141 LYS ASP LEU LEU ALA GLU LEU ALA LYS ILE GLU SEQRES 1 B 77 SER ILE ASN ILE GLY LEU ILE GLN ALA ARG GLU ALA LEU SEQRES 2 B 77 MSE THR GLN PHE ARG PRO ILE LEU ASN GLN ALA ASN ILE SEQRES 3 B 77 THR ASP GLN GLN TRP ARG ILE ILE ARG LEU LEU ALA GLU SEQRES 4 B 77 ASN GLY THR LEU ASP PHE GLN ASP LEU ALA ASN GLN ALA SEQRES 5 B 77 CYS ILE LEU ARG PRO SER LEU THR GLY ILE LEU THR ARG SEQRES 6 B 77 LEU GLU LYS ALA GLY LEU VAL VAL ARG LEU LYS PRO SEQRES 1 B 55 ARG VAL PHE LEU LYS LEU THR ALA GLU GLY GLU LYS LEU SEQRES 2 B 55 TYR GLU GLU ILE GLY GLU GLU VAL ASP GLU ARG TYR ASP SEQRES 3 B 55 ALA ILE GLU GLU VAL LEU GLY ARG GLU LYS MSE LEU LEU SEQRES 4 B 55 LEU LYS ASP LEU LEU ALA GLU LEU ALA LYS ILE GLU ASP SEQRES 5 B 55 ALA LEU ASN HET MSE A 1 11 HET MSE A 22 9 HET MSE A 127 9 HET MSE B 22 9 HET MSE B 127 9 HET UNN A 319 18 HETATM 1 N MSE A 1 48.247 22.202 2.820 1.00 54.12 N HETATM 2 CA MSE A 1 47.276 22.584 3.845 1.00 51.38 C HETATM 3 C MSE A 1 46.124 23.394 3.284 1.00 47.05 C HETATM 4 O MSE A 1 46.336 24.334 2.514 1.00 49.74 O HETATM 5 CB MSE A 1 47.940 23.397 4.954 1.00 52.90 C HETATM 6 CG MSE A 1 48.929 22.633 5.801 1.00 56.52 C HETATM 7 SE MSE A 1 49.287 23.626 7.430 1.00 92.64 S HETATM 8 CE MSE A 1 47.471 23.693 8.160 1.00 56.04 C HETATM 9 HN3 MSE A 1 48.642 23.059 2.382 1.00 0.00 H HETATM 10 HN2 MSE A 1 47.775 21.626 2.094 1.00 0.00 H HETATM 11 HN1 MSE A 1 49.013 21.651 3.258 1.00 0.00 H ATOM 12 N PRO A 2 44.898 23.042 3.687 1.00 39.54 N ATOM 13 CA PRO A 2 43.700 23.790 3.309 1.00 38.03 C ATOM 14 C PRO A 2 43.541 25.039 4.176 1.00 42.83 C ATOM 15 O PRO A 2 44.197 25.172 5.213 1.00 39.38 O ATOM 16 CB PRO A 2 42.574 22.790 3.567 1.00 36.92 C ATOM 17 CG PRO A 2 43.076 21.963 4.720 1.00 33.26 C ATOM 18 CD PRO A 2 44.588 21.914 4.587 1.00 39.46 C ATOM 19 N THR A 3 42.678 25.952 3.751 1.00 45.73 N ATOM 20 CA THR A 3 42.363 27.113 4.565 1.00 41.49 C ATOM 21 C THR A 3 41.649 26.659 5.832 1.00 34.75 C ATOM 22 O THR A 3 40.661 25.927 5.762 1.00 42.11 O ATOM 23 CB THR A 3 41.493 28.112 3.794 1.00 39.45 C ATOM 24 OG1 THR A 3 42.182 28.516 2.606 1.00 41.75 O ATOM 25 CG2 THR A 3 41.200 29.331 4.642 1.00 39.14 C ATOM 26 HG1 THR A 3 41.623 29.162 2.105 1.00 0.00 H ATOM 27 H THR A 3 42.221 25.835 2.824 1.00 0.00 H ATOM 28 N GLN A 4 42.167 27.070 6.988 1.00 37.76 N ATOM 29 CA GLN A 4 41.544 26.751 8.269 1.00 33.59 C ATOM 30 C GLN A 4 40.141 27.319 8.307 1.00 35.47 C ATOM 31 O GLN A 4 39.870 28.378 7.736 1.00 32.12 O ATOM 32 CB GLN A 4 42.348 27.313 9.451 1.00 43.09 C ATOM 33 CG GLN A 4 43.858 27.101 9.375 1.00 54.59 C ATOM 34 CD GLN A 4 44.283 25.651 9.571 1.00 58.87 C ATOM 35 OE1 GLN A 4 44.699 25.258 10.665 1.00 63.01 O ATOM 36 NE2 GLN A 4 44.200 24.853 8.504 1.00 57.13 N ATOM 37 HE22 GLN A 4 43.843 25.227 7.601 1.00 0.00 H ATOM 38 HE21 GLN A 4 44.492 23.857 8.575 1.00 0.00 H ATOM 39 H GLN A 4 43.040 27.634 6.978 1.00 0.00 H ATOM 40 N SER A 5 39.250 26.605 8.979 1.00 33.59 N ATOM 41 CA SER A 5 37.916 27.104 9.233 1.00 28.03 C ATOM 42 C SER A 5 38.022 28.423 9.973 1.00 34.09 C ATOM 43 O SER A 5 39.030 28.691 10.626 1.00 30.81 O ATOM 44 CB SER A 5 37.121 26.101 10.049 1.00 29.83 C ATOM 45 OG SER A 5 37.062 24.850 9.385 1.00 42.79 O ATOM 46 HG SER A 5 37.980 24.503 9.256 1.00 0.00 H ATOM 47 H SER A 5 39.516 25.664 9.332 1.00 0.00 H ATOM 48 N LYS A 6 36.985 29.245 9.857 1.00 35.21 N ATOM 49 CA LYS A 6 36.938 30.524 10.541 1.00 28.81 C ATOM 50 C LYS A 6 36.994 30.301 12.051 1.00 28.87 C ATOM 51 O LYS A 6 37.786 30.914 12.745 1.00 35.06 O ATOM 52 CB LYS A 6 35.667 31.284 10.142 1.00 31.31 C ATOM 53 CG LYS A 6 35.442 32.595 10.870 1.00 37.58 C ATOM 54 CD LYS A 6 34.178 33.279 10.366 1.00 39.77 C ATOM 55 CE LYS A 6 33.796 34.469 11.237 1.00 43.50 C ATOM 56 NZ LYS A 6 32.480 35.046 10.843 1.00 43.29 N ATOM 57 HZ1 LYS A 6 32.525 35.366 9.855 1.00 0.00 H ATOM 58 HZ2 LYS A 6 31.742 34.320 10.940 1.00 0.00 H ATOM 59 HZ3 LYS A 6 32.258 35.853 11.460 1.00 0.00 H ATOM 60 H LYS A 6 36.183 28.964 9.258 1.00 0.00 H ATOM 61 N HIS A 7 36.159 29.405 12.556 1.00 23.69 N ATOM 62 CA HIS A 7 36.119 29.164 13.988 1.00 23.93 C ATOM 63 C HIS A 7 36.932 27.956 14.378 1.00 29.00 C ATOM 64 O HIS A 7 36.827 26.897 13.763 1.00 26.71 O ATOM 65 CB HIS A 7 34.686 28.979 14.466 1.00 29.19 C ATOM 66 CG HIS A 7 33.833 30.187 14.266 1.00 30.82 C ATOM 67 ND1 HIS A 7 33.682 31.156 15.229 1.00 33.41 N ATOM 68 CD2 HIS A 7 33.100 30.592 13.201 1.00 38.50 C ATOM 69 CE1 HIS A 7 32.879 32.103 14.775 1.00 33.84 C ATOM 70 NE2 HIS A 7 32.512 31.784 13.549 1.00 41.58 N ATOM 71 H HIS A 7 35.529 28.871 11.924 1.00 0.00 H ATOM 72 N ALA A 8 37.772 28.137 15.390 1.00 28.51 N ATOM 73 CA ALA A 8 38.452 27.022 16.011 1.00 30.17 C ATOM 74 C ALA A 8 37.394 26.090 16.617 1.00 22.89 C ATOM 75 O ALA A 8 36.309 26.536 16.974 1.00 19.32 O ATOM 76 CB ALA A 8 39.422 27.517 17.067 1.00 26.94 C ATOM 77 H ALA A 8 37.944 29.100 15.743 1.00 0.00 H ATOM 78 N SER A 9 37.705 24.806 16.731 1.00 23.65 N ATOM 79 CA SER A 9 36.750 23.863 17.301 1.00 18.96 C ATOM 80 C SER A 9 36.676 23.969 18.825 1.00 18.29 C ATOM 81 O SER A 9 37.583 23.545 19.536 1.00 18.26 O ATOM 82 CB SER A 9 37.119 22.436 16.911 1.00 25.04 C ATOM 83 OG SER A 9 36.261 21.519 17.573 1.00 37.69 O ATOM 84 HG SER A 9 35.323 21.698 17.311 1.00 0.00 H ATOM 85 H SER A 9 38.636 24.469 16.412 1.00 0.00 H ATOM 86 N ILE A 10 35.606 24.569 19.324 1.00 26.04 N ATOM 87 CA ILE A 10 35.379 24.641 20.764 1.00 22.73 C ATOM 88 C ILE A 10 35.155 23.217 21.273 1.00 18.50 C ATOM 89 O ILE A 10 35.487 22.876 22.404 1.00 19.36 O ATOM 90 CB ILE A 10 34.196 25.555 21.097 1.00 20.20 C ATOM 91 CG1 ILE A 10 34.496 26.975 20.621 1.00 25.53 C ATOM 92 CG2 ILE A 10 33.898 25.573 22.581 1.00 20.92 C ATOM 93 CD1 ILE A 10 33.233 27.824 20.435 1.00 22.60 C ATOM 94 H ILE A 10 34.914 24.997 18.677 1.00 0.00 H ATOM 95 N ASN A 11 34.561 22.396 20.420 1.00 18.38 N ATOM 96 CA ASN A 11 34.302 21.001 20.730 1.00 18.34 C ATOM 97 C ASN A 11 35.589 20.275 21.166 1.00 25.25 C ATOM 98 O ASN A 11 35.644 19.682 22.245 1.00 17.90 O ATOM 99 CB ASN A 11 33.699 20.295 19.531 1.00 18.87 C ATOM 100 CG ASN A 11 33.312 18.871 19.844 1.00 29.82 C ATOM 101 OD1 ASN A 11 32.743 18.603 20.897 1.00 27.90 O ATOM 102 ND2 ASN A 11 33.649 17.949 18.955 1.00 20.05 N ATOM 103 HD22 ASN A 11 34.131 18.226 18.076 1.00 0.00 H ATOM 104 HD21 ASN A 11 33.432 16.948 19.136 1.00 0.00 H ATOM 105 H ASN A 11 34.269 22.765 19.492 1.00 0.00 H ATOM 106 N ILE A 12 36.615 20.328 20.316 1.00 17.91 N ATOM 107 CA ILE A 12 37.881 19.689 20.619 1.00 18.14 C ATOM 108 C ILE A 12 38.486 20.309 21.902 1.00 24.34 C ATOM 109 O ILE A 12 39.063 19.604 22.724 1.00 18.37 O ATOM 110 CB ILE A 12 38.881 19.796 19.431 1.00 23.09 C ATOM 111 CG1 ILE A 12 38.419 18.956 18.232 1.00 19.23 C ATOM 112 CG2 ILE A 12 40.281 19.365 19.863 1.00 19.50 C ATOM 113 CD1 ILE A 12 39.203 19.231 16.952 1.00 19.92 C ATOM 114 H ILE A 12 36.505 20.838 19.417 1.00 0.00 H ATOM 115 N GLY A 13 38.339 21.620 22.076 1.00 18.17 N ATOM 116 CA GLY A 13 38.827 22.270 23.273 1.00 21.40 C ATOM 117 C GLY A 13 38.168 21.738 24.536 1.00 25.74 C ATOM 118 O GLY A 13 38.841 21.512 25.553 1.00 19.02 O ATOM 119 H GLY A 13 37.867 22.185 21.342 1.00 0.00 H ATOM 120 N LEU A 14 36.855 21.540 24.466 1.00 18.27 N ATOM 121 CA LEU A 14 36.066 20.988 25.567 1.00 24.83 C ATOM 122 C LEU A 14 36.469 19.538 25.861 1.00 18.03 C ATOM 123 O LEU A 14 36.534 19.105 27.020 1.00 18.18 O ATOM 124 CB LEU A 14 34.565 21.058 25.245 1.00 18.68 C ATOM 125 CG LEU A 14 33.885 22.429 25.239 1.00 19.64 C ATOM 126 CD1 LEU A 14 32.441 22.291 24.752 1.00 20.35 C ATOM 127 CD2 LEU A 14 33.930 23.075 26.601 1.00 20.65 C ATOM 128 H LEU A 14 36.364 21.790 23.584 1.00 0.00 H ATOM 129 N ILE A 15 36.727 18.788 24.795 1.00 19.65 N ATOM 130 CA ILE A 15 37.084 17.378 24.932 1.00 21.19 C ATOM 131 C ILE A 15 38.472 17.179 25.536 1.00 18.47 C ATOM 132 O ILE A 15 38.678 16.317 26.394 1.00 18.78 O ATOM 133 CB ILE A 15 37.049 16.670 23.567 1.00 18.55 C ATOM 134 CG1 ILE A 15 35.616 16.633 23.049 1.00 18.73 C ATOM 135 CG2 ILE A 15 37.628 15.244 23.681 1.00 19.47 C ATOM 136 CD1 ILE A 15 35.478 16.250 21.603 1.00 19.44 C ATOM 137 H ILE A 15 36.674 19.212 23.847 1.00 0.00 H ATOM 138 N GLN A 16 39.410 18.015 25.127 1.00 18.73 N ATOM 139 CA GLN A 16 40.765 17.919 25.643 1.00 19.67 C ATOM 140 C GLN A 16 40.818 18.378 27.103 1.00 23.54 C ATOM 141 O GLN A 16 41.544 17.809 27.919 1.00 20.63 O ATOM 142 CB GLN A 16 41.719 18.723 24.771 1.00 20.39 C ATOM 143 CG GLN A 16 41.830 18.155 23.377 1.00 22.99 C ATOM 144 CD GLN A 16 42.760 18.940 22.500 1.00 25.10 C ATOM 145 OE1 GLN A 16 43.110 20.074 22.821 1.00 30.03 O ATOM 146 NE2 GLN A 16 43.178 18.340 21.385 1.00 22.38 N ATOM 147 HE22 GLN A 16 42.852 17.379 21.158 1.00 0.00 H ATOM 148 HE21 GLN A 16 43.830 18.833 20.742 1.00 0.00 H ATOM 149 H GLN A 16 39.176 18.749 24.429 1.00 0.00 H ATOM 150 N ALA A 17 40.029 19.394 27.427 1.00 19.50 N ATOM 151 CA ALA A 17 39.991 19.909 28.788 1.00 21.15 C ATOM 152 C ALA A 17 39.427 18.878 29.771 1.00 19.77 C ATOM 153 O ALA A 17 39.978 18.670 30.837 1.00 20.48 O ATOM 154 CB ALA A 17 39.177 21.196 28.842 1.00 20.37 C ATOM 155 H ALA A 17 39.429 19.829 26.698 1.00 0.00 H ATOM 156 N ARG A 18 38.363 18.193 29.387 1.00 18.96 N ATOM 157 CA ARG A 18 37.766 17.238 30.302 1.00 21.46 C ATOM 158 C ARG A 18 38.678 16.022 30.410 1.00 19.19 C ATOM 159 O ARG A 18 38.829 15.461 31.481 1.00 19.54 O ATOM 160 CB ARG A 18 36.338 16.865 29.872 1.00 18.59 C ATOM 161 CG ARG A 18 35.562 16.135 30.972 1.00 29.53 C ATOM 162 CD ARG A 18 34.157 15.697 30.545 1.00 32.63 C ATOM 163 NE ARG A 18 34.120 14.358 29.975 1.00 31.72 N ATOM 164 CZ ARG A 18 34.097 13.247 30.702 1.00 32.35 C ATOM 165 NH1 ARG A 18 34.120 13.319 32.030 1.00 21.51 N ATOM 166 NH2 ARG A 18 34.055 12.065 30.100 1.00 32.50 N ATOM 167 HE ARG A 18 34.111 14.266 28.939 1.00 0.00 H ATOM 168 HH12 ARG A 18 34.102 12.448 32.598 1.00 0.00 H ATOM 169 HH11 ARG A 18 34.156 14.246 32.500 1.00 0.00 H ATOM 170 HH22 ARG A 18 34.037 11.193 30.667 1.00 0.00 H ATOM 171 HH21 ARG A 18 34.040 12.011 29.062 1.00 0.00 H ATOM 172 H ARG A 18 37.959 18.337 28.440 1.00 0.00 H ATOM 173 N GLU A 19 39.294 15.628 29.304 1.00 19.37 N ATOM 174 CA GLU A 19 40.218 14.492 29.321 1.00 21.41 C ATOM 175 C GLU A 19 41.454 14.767 30.197 1.00 21.91 C ATOM 176 O GLU A 19 41.985 13.858 30.819 1.00 29.13 O ATOM 177 CB GLU A 19 40.648 14.113 27.897 1.00 25.58 C ATOM 178 CG GLU A 19 41.633 12.956 27.840 1.00 38.57 C ATOM 179 CD GLU A 19 41.077 11.686 28.478 1.00 51.23 C ATOM 180 OE1 GLU A 19 39.870 11.414 28.301 1.00 53.11 O ATOM 181 OE2 GLU A 19 41.844 10.963 29.158 1.00 58.30 O ATOM 182 H GLU A 19 39.119 16.133 28.412 1.00 0.00 H ATOM 183 N ALA A 20 41.919 16.012 30.239 1.00 21.53 N ATOM 184 CA ALA A 20 43.013 16.363 31.148 1.00 28.25 C ATOM 185 C ALA A 20 42.550 16.262 32.619 1.00 33.83 C ATOM 186 O ALA A 20 43.340 15.928 33.500 1.00 32.18 O ATOM 187 CB ALA A 20 43.546 17.755 30.845 1.00 23.76 C ATOM 188 H ALA A 20 41.504 16.740 29.623 1.00 0.00 H ATOM 189 N LEU A 21 41.286 16.584 32.897 1.00 21.79 N ATOM 190 CA LEU A 21 40.778 16.400 34.252 1.00 21.93 C ATOM 191 C LEU A 21 40.671 14.889 34.583 1.00 21.72 C ATOM 192 O LEU A 21 40.994 14.445 35.698 1.00 22.44 O ATOM 193 CB LEU A 21 39.415 17.104 34.442 1.00 23.76 C ATOM 194 CG LEU A 21 39.386 18.632 34.638 1.00 23.27 C ATOM 195 CD1 LEU A 21 37.981 19.137 34.932 1.00 22.29 C ATOM 196 CD2 LEU A 21 40.324 19.067 35.759 1.00 24.08 C ATOM 197 H LEU A 21 40.667 16.964 32.153 1.00 0.00 H HETATM 198 N MSE A 22 40.223 14.104 33.609 1.00 21.89 N HETATM 199 CA MSE A 22 40.022 12.682 33.854 1.00 25.26 C HETATM 200 C MSE A 22 41.324 11.934 34.141 1.00 23.55 C HETATM 201 O MSE A 22 41.312 11.026 34.958 1.00 25.48 O HETATM 202 CB MSE A 22 39.285 12.020 32.685 1.00 21.81 C HETATM 203 CG MSE A 22 37.804 12.363 32.634 1.00 29.40 C HETATM 204 SE MSE A 22 36.865 12.094 34.348 1.00 33.90 S HETATM 205 CE MSE A 22 37.176 10.161 34.515 1.00 52.69 C HETATM 206 H MSE A 22 40.016 14.505 32.672 1.00 0.00 H ATOM 207 N THR A 23 42.439 12.302 33.511 1.00 23.65 N ATOM 208 CA THR A 23 43.679 11.584 33.819 1.00 27.45 C ATOM 209 C THR A 23 44.087 11.864 35.264 1.00 26.32 C ATOM 210 O THR A 23 44.633 10.992 35.909 1.00 27.66 O ATOM 211 CB THR A 23 44.852 11.930 32.862 1.00 28.80 C ATOM 212 OG1 THR A 23 45.432 13.190 33.220 1.00 37.89 O ATOM 213 CG2 THR A 23 44.381 11.960 31.418 1.00 26.33 C ATOM 214 HG1 THR A 23 44.744 13.899 33.157 1.00 0.00 H ATOM 215 H THR A 23 42.430 13.078 32.819 1.00 0.00 H ATOM 216 N GLN A 24 43.779 13.056 35.780 1.00 25.71 N ATOM 217 CA GLN A 24 43.994 13.353 37.199 1.00 26.58 C ATOM 218 C GLN A 24 42.991 12.616 38.083 1.00 25.63 C ATOM 219 O GLN A 24 43.308 12.265 39.211 1.00 26.61 O ATOM 220 CB GLN A 24 43.874 14.852 37.507 1.00 26.79 C ATOM 221 CG GLN A 24 44.747 15.749 36.693 1.00 28.82 C ATOM 222 CD GLN A 24 46.188 15.294 36.685 1.00 41.46 C ATOM 223 OE1 GLN A 24 46.718 14.832 37.697 1.00 47.85 O ATOM 224 NE2 GLN A 24 46.828 15.406 35.530 1.00 44.21 N ATOM 225 HE22 GLN A 24 46.340 15.802 34.701 1.00 0.00 H ATOM 226 HE21 GLN A 24 47.818 15.098 35.452 1.00 0.00 H ATOM 227 H GLN A 24 43.378 13.790 35.162 1.00 0.00 H ATOM 228 N PHE A 25 41.790 12.354 37.568 1.00 24.03 N ATOM 229 CA PHE A 25 40.731 11.798 38.405 1.00 23.44 C ATOM 230 C PHE A 25 40.598 10.282 38.255 1.00 25.25 C ATOM 231 O PHE A 25 40.038 9.610 39.114 1.00 23.75 O ATOM 232 CB PHE A 25 39.392 12.440 38.056 1.00 22.27 C ATOM 233 CG PHE A 25 39.315 13.918 38.358 1.00 22.55 C ATOM 234 CD1 PHE A 25 40.222 14.524 39.221 1.00 23.84 C ATOM 235 CD2 PHE A 25 38.323 14.702 37.786 1.00 21.90 C ATOM 236 CE1 PHE A 25 40.140 15.877 39.501 1.00 24.66 C ATOM 237 CE2 PHE A 25 38.236 16.067 38.072 1.00 23.99 C ATOM 238 CZ PHE A 25 39.148 16.652 38.922 1.00 24.08 C ATOM 239 H PHE A 25 41.606 12.547 36.563 1.00 0.00 H ATOM 240 N ARG A 26 41.165 9.745 37.185 1.00 24.16 N ATOM 241 CA ARG A 26 41.072 8.320 36.907 1.00 27.48 C ATOM 242 C ARG A 26 41.601 7.419 38.040 1.00 26.35 C ATOM 243 O ARG A 26 40.937 6.449 38.406 1.00 26.62 O ATOM 244 CB ARG A 26 41.774 8.035 35.589 1.00 35.34 C ATOM 245 CG ARG A 26 41.609 6.650 35.039 1.00 48.25 C ATOM 246 CD ARG A 26 41.948 6.776 33.584 1.00 49.84 C ATOM 247 NE ARG A 26 40.869 7.504 32.925 1.00 43.83 N ATOM 248 CZ ARG A 26 41.019 8.199 31.809 1.00 37.29 C ATOM 249 NH1 ARG A 26 42.214 8.304 31.243 1.00 51.30 N ATOM 250 NH2 ARG A 26 39.986 8.817 31.283 1.00 24.32 N ATOM 251 HE ARG A 26 39.924 7.475 33.359 1.00 0.00 H ATOM 252 HH12 ARG A 26 42.328 8.851 30.366 1.00 0.00 H ATOM 253 HH11 ARG A 26 43.037 7.839 31.676 1.00 0.00 H ATOM 254 HH22 ARG A 26 40.099 9.364 30.406 1.00 0.00 H ATOM 255 HH21 ARG A 26 39.055 8.759 31.744 1.00 0.00 H ATOM 256 H ARG A 26 41.689 10.357 36.528 1.00 0.00 H ATOM 257 N PRO A 27 42.783 7.731 38.608 1.00 27.50 N ATOM 258 CA PRO A 27 43.234 6.827 39.667 1.00 28.95 C ATOM 259 C PRO A 27 42.353 6.897 40.922 1.00 27.99 C ATOM 260 O PRO A 27 42.162 5.875 41.584 1.00 28.70 O ATOM 261 CB PRO A 27 44.660 7.313 39.955 1.00 30.72 C ATOM 262 CG PRO A 27 44.667 8.722 39.534 1.00 29.72 C ATOM 263 CD PRO A 27 43.772 8.795 38.346 1.00 28.04 C ATOM 264 N ILE A 28 41.829 8.082 41.225 1.00 26.74 N ATOM 265 CA ILE A 28 40.924 8.283 42.356 1.00 26.17 C ATOM 266 C ILE A 28 39.649 7.458 42.198 1.00 25.47 C ATOM 267 O ILE A 28 39.214 6.773 43.126 1.00 25.88 O ATOM 268 CB ILE A 28 40.547 9.763 42.499 1.00 25.52 C ATOM 269 CG1 ILE A 28 41.791 10.604 42.793 1.00 26.83 C ATOM 270 CG2 ILE A 28 39.515 9.946 43.595 1.00 25.39 C ATOM 271 CD1 ILE A 28 41.552 12.073 42.663 1.00 26.69 C ATOM 272 H ILE A 28 42.074 8.901 40.632 1.00 0.00 H ATOM 273 N LEU A 29 39.076 7.514 40.999 1.00 24.73 N ATOM 274 CA LEU A 29 37.851 6.800 40.681 1.00 26.34 C ATOM 275 C LEU A 29 38.083 5.293 40.652 1.00 29.77 C ATOM 276 O LEU A 29 37.228 4.514 41.076 1.00 26.54 O ATOM 277 CB LEU A 29 37.309 7.272 39.342 1.00 23.88 C ATOM 278 CG LEU A 29 36.801 8.717 39.311 1.00 25.75 C ATOM 279 CD1 LEU A 29 36.171 9.014 37.960 1.00 22.37 C ATOM 280 CD2 LEU A 29 35.807 8.957 40.439 1.00 23.02 C ATOM 281 H LEU A 29 39.523 8.092 40.259 1.00 0.00 H ATOM 282 N ASN A 30 39.254 4.890 40.172 1.00 26.97 N ATOM 283 CA ASN A 30 39.555 3.474 40.058 1.00 31.03 C ATOM 284 C ASN A 30 39.658 2.829 41.417 1.00 29.69 C ATOM 285 O ASN A 30 39.117 1.741 41.645 1.00 32.32 O ATOM 286 CB ASN A 30 40.862 3.260 39.292 1.00 30.34 C ATOM 287 CG ASN A 30 40.720 3.552 37.817 1.00 38.80 C ATOM 288 OD1 ASN A 30 39.622 3.479 37.259 1.00 37.05 O ATOM 289 ND2 ASN A 30 41.829 3.899 37.173 1.00 40.87 N ATOM 290 HD22 ASN A 30 42.734 3.948 37.684 1.00 0.00 H ATOM 291 HD21 ASN A 30 41.793 4.122 36.158 1.00 0.00 H ATOM 292 H ASN A 30 39.960 5.594 39.876 1.00 0.00 H ATOM 293 N GLN A 31 40.326 3.527 42.326 1.00 29.30 N ATOM 294 CA GLN A 31 40.530 3.048 43.686 1.00 30.11 C ATOM 295 C GLN A 31 39.226 2.961 44.475 1.00 29.33 C ATOM 296 O GLN A 31 39.034 2.070 45.285 1.00 30.31 O ATOM 297 CB GLN A 31 41.551 3.947 44.390 1.00 34.94 C ATOM 298 CG GLN A 31 41.914 3.510 45.796 1.00 40.40 C ATOM 299 CD GLN A 31 43.290 4.003 46.215 1.00 49.18 C ATOM 300 OE1 GLN A 31 44.204 4.106 45.391 1.00 60.41 O ATOM 301 NE2 GLN A 31 43.441 4.323 47.492 1.00 40.78 N ATOM 302 HE22 GLN A 31 42.644 4.220 48.152 1.00 0.00 H ATOM 303 HE21 GLN A 31 44.357 4.677 47.835 1.00 0.00 H ATOM 304 H GLN A 31 40.719 4.452 42.057 1.00 0.00 H ATOM 305 N ALA A 32 38.295 3.852 44.195 1.00 37.96 N ATOM 306 CA ALA A 32 37.023 3.783 44.886 1.00 37.81 C ATOM 307 C ALA A 32 36.049 2.831 44.179 1.00 35.12 C ATOM 308 O ALA A 32 34.900 2.681 44.600 1.00 34.02 O ATOM 309 CB ALA A 32 36.440 5.162 45.017 1.00 33.23 C ATOM 310 H ALA A 32 38.471 4.594 43.488 1.00 0.00 H ATOM 311 N ASN A 33 36.541 2.178 43.127 1.00 35.93 N ATOM 312 CA ASN A 33 35.763 1.286 42.269 1.00 35.40 C ATOM 313 C ASN A 33 34.586 1.984 41.573 1.00 31.93 C ATOM 314 O ASN A 33 33.526 1.400 41.438 1.00 31.39 O ATOM 315 CB ASN A 33 35.222 0.088 43.066 1.00 43.31 C ATOM 316 CG ASN A 33 36.292 -0.614 43.893 1.00 52.49 C ATOM 317 OD1 ASN A 33 37.054 -1.437 43.383 1.00 52.31 O ATOM 318 ND2 ASN A 33 36.335 -0.306 45.187 1.00 60.73 N ATOM 319 HD22 ASN A 33 35.673 0.395 45.577 1.00 0.00 H ATOM 320 HD21 ASN A 33 37.031 -0.766 45.808 1.00 0.00 H ATOM 321 H ASN A 33 37.547 2.312 42.901 1.00 0.00 H ATOM 322 N ILE A 34 34.804 3.208 41.091 1.00 31.89 N ATOM 323 CA ILE A 34 33.763 4.014 40.440 1.00 27.13 C ATOM 324 C ILE A 34 34.160 4.390 39.011 1.00 26.46 C ATOM 325 O ILE A 34 35.255 4.854 38.801 1.00 31.15 O ATOM 326 CB ILE A 34 33.511 5.318 41.256 1.00 25.63 C ATOM 327 CG1 ILE A 34 33.147 4.986 42.704 1.00 35.37 C ATOM 328 CG2 ILE A 34 32.452 6.189 40.633 1.00 23.14 C ATOM 329 CD1 ILE A 34 31.868 4.200 42.851 1.00 31.73 C ATOM 330 H ILE A 34 35.758 3.612 41.180 1.00 0.00 H ATOM 331 N THR A 35 33.260 4.249 38.039 1.00 25.31 N ATOM 332 CA THR A 35 33.574 4.679 36.674 1.00 24.91 C ATOM 333 C THR A 35 33.302 6.164 36.467 1.00 23.92 C ATOM 334 O THR A 35 32.651 6.833 37.299 1.00 29.72 O ATOM 335 CB THR A 35 32.762 3.925 35.586 1.00 24.99 C ATOM 336 OG1 THR A 35 31.380 4.256 35.716 1.00 25.04 O ATOM 337 CG2 THR A 35 32.942 2.410 35.665 1.00 27.18 C ATOM 338 HG1 THR A 35 31.061 3.988 36.614 1.00 0.00 H ATOM 339 H THR A 35 32.331 3.832 38.250 1.00 0.00 H ATOM 340 N ASP A 36 33.772 6.664 35.330 1.00 26.73 N ATOM 341 CA ASP A 36 33.575 8.055 34.946 1.00 21.81 C ATOM 342 C ASP A 36 32.091 8.421 34.884 1.00 20.13 C ATOM 343 O ASP A 36 31.681 9.436 35.465 1.00 19.03 O ATOM 344 CB ASP A 36 34.253 8.316 33.594 1.00 27.06 C ATOM 345 CG ASP A 36 33.894 9.672 32.994 1.00 31.22 C ATOM 346 OD1 ASP A 36 33.594 10.626 33.734 1.00 37.17 O ATOM 347 OD2 ASP A 36 33.934 9.789 31.757 1.00 32.95 O ATOM 348 H ASP A 36 34.301 6.038 34.689 1.00 0.00 H ATOM 349 N GLN A 37 31.304 7.592 34.198 1.00 20.38 N ATOM 350 CA GLN A 37 29.870 7.804 34.101 1.00 19.46 C ATOM 351 C GLN A 37 29.218 7.731 35.475 1.00 18.80 C ATOM 352 O GLN A 37 28.354 8.518 35.777 1.00 17.87 O ATOM 353 CB GLN A 37 29.196 6.792 33.159 1.00 23.30 C ATOM 354 CG GLN A 37 29.478 7.003 31.674 1.00 21.16 C ATOM 355 CD GLN A 37 28.806 5.955 30.802 1.00 31.05 C ATOM 356 OE1 GLN A 37 28.041 6.284 29.888 1.00 28.92 O ATOM 357 NE2 GLN A 37 29.076 4.684 31.088 1.00 26.65 N ATOM 358 HE22 GLN A 37 29.726 4.453 31.866 1.00 0.00 H ATOM 359 HE21 GLN A 37 28.637 3.922 30.533 1.00 0.00 H ATOM 360 H GLN A 37 31.728 6.772 33.720 1.00 0.00 H ATOM 361 N GLN A 38 29.646 6.780 36.303 1.00 20.74 N ATOM 362 CA GLN A 38 29.043 6.614 37.619 1.00 21.82 C ATOM 363 C GLN A 38 29.238 7.846 38.495 1.00 18.53 C ATOM 364 O GLN A 38 28.328 8.246 39.208 1.00 23.70 O ATOM 365 CB GLN A 38 29.602 5.368 38.313 1.00 23.87 C ATOM 366 CG GLN A 38 28.897 4.086 37.909 1.00 31.17 C ATOM 367 CD GLN A 38 29.653 2.829 38.296 1.00 24.12 C ATOM 368 OE1 GLN A 38 30.824 2.880 38.659 1.00 35.10 O ATOM 369 NE2 GLN A 38 28.978 1.694 38.223 1.00 37.03 N ATOM 370 HE22 GLN A 38 27.986 1.698 37.910 1.00 0.00 H ATOM 371 HE21 GLN A 38 29.439 0.797 38.479 1.00 0.00 H ATOM 372 H GLN A 38 30.418 6.149 36.007 1.00 0.00 H ATOM 373 N TRP A 39 30.421 8.437 38.424 1.00 18.74 N ATOM 374 CA TRP A 39 30.759 9.600 39.218 1.00 18.30 C ATOM 375 C TRP A 39 29.985 10.843 38.749 1.00 20.12 C ATOM 376 O TRP A 39 29.594 11.677 39.570 1.00 16.62 O ATOM 377 CB TRP A 39 32.276 9.845 39.181 1.00 19.31 C ATOM 378 CG TRP A 39 32.684 11.092 39.889 1.00 19.14 C ATOM 379 CD1 TRP A 39 33.263 12.199 39.335 1.00 22.45 C ATOM 380 CD2 TRP A 39 32.533 11.375 41.275 1.00 19.39 C ATOM 381 NE1 TRP A 39 33.482 13.149 40.294 1.00 19.18 N ATOM 382 CE2 TRP A 39 33.039 12.669 41.499 1.00 19.40 C ATOM 383 CE3 TRP A 39 32.018 10.659 42.359 1.00 25.62 C ATOM 384 CZ2 TRP A 39 33.066 13.255 42.758 1.00 19.90 C ATOM 385 CZ3 TRP A 39 32.019 11.257 43.608 1.00 25.70 C ATOM 386 CH2 TRP A 39 32.541 12.538 43.793 1.00 20.35 C ATOM 387 HE1 TRP A 39 33.914 14.082 40.135 1.00 0.00 H ATOM 388 H TRP A 39 31.135 8.051 37.773 1.00 0.00 H ATOM 389 N ARG A 40 29.766 10.972 37.440 1.00 18.95 N ATOM 390 CA ARG A 40 28.966 12.089 36.936 1.00 16.20 C ATOM 391 C ARG A 40 27.613 12.037 37.611 1.00 15.77 C ATOM 392 O ARG A 40 27.148 13.040 38.153 1.00 15.54 O ATOM 393 CB ARG A 40 28.813 12.045 35.410 1.00 16.54 C ATOM 394 CG ARG A 40 30.134 12.207 34.702 1.00 23.18 C ATOM 395 CD ARG A 40 30.032 12.964 33.410 1.00 22.59 C ATOM 396 NE ARG A 40 29.367 12.198 32.358 1.00 25.10 N ATOM 397 CZ ARG A 40 29.903 11.175 31.709 1.00 25.74 C ATOM 398 NH1 ARG A 40 31.123 10.745 32.000 1.00 38.23 N ATOM 399 NH2 ARG A 40 29.209 10.578 30.755 1.00 35.13 N ATOM 400 HE ARG A 40 28.399 12.477 32.099 1.00 0.00 H ATOM 401 HH12 ARG A 40 31.528 9.940 31.480 1.00 0.00 H ATOM 402 HH11 ARG A 40 31.674 11.212 32.748 1.00 0.00 H ATOM 403 HH22 ARG A 40 29.620 9.774 30.239 1.00 0.00 H ATOM 404 HH21 ARG A 40 28.253 10.912 30.521 1.00 0.00 H ATOM 405 H ARG A 40 30.164 10.278 36.776 1.00 0.00 H ATOM 406 N ILE A 41 27.042 10.838 37.666 1.00 20.49 N ATOM 407 CA ILE A 41 25.748 10.635 38.304 1.00 18.21 C ATOM 408 C ILE A 41 25.797 10.908 39.804 1.00 15.96 C ATOM 409 O ILE A 41 24.979 11.641 40.335 1.00 18.87 O ATOM 410 CB ILE A 41 25.268 9.193 38.066 1.00 22.08 C ATOM 411 CG1 ILE A 41 24.841 9.021 36.609 1.00 17.10 C ATOM 412 CG2 ILE A 41 24.139 8.823 39.018 1.00 17.05 C ATOM 413 CD1 ILE A 41 24.812 7.570 36.178 1.00 20.24 C ATOM 414 H ILE A 41 27.531 10.024 37.243 1.00 0.00 H ATOM 415 N ILE A 42 26.791 10.337 40.470 1.00 19.83 N ATOM 416 CA ILE A 42 26.936 10.483 41.905 1.00 22.21 C ATOM 417 C ILE A 42 27.091 11.954 42.312 1.00 16.42 C ATOM 418 O ILE A 42 26.429 12.429 43.247 1.00 21.98 O ATOM 419 CB ILE A 42 28.136 9.645 42.397 1.00 20.79 C ATOM 420 CG1 ILE A 42 27.803 8.152 42.270 1.00 18.83 C ATOM 421 CG2 ILE A 42 28.494 10.002 43.826 1.00 18.74 C ATOM 422 CD1 ILE A 42 28.943 7.229 42.548 1.00 20.35 C ATOM 423 H ILE A 42 27.487 9.768 39.948 1.00 0.00 H ATOM 424 N ARG A 43 27.933 12.673 41.593 1.00 16.14 N ATOM 425 CA ARG A 43 28.147 14.071 41.908 1.00 16.04 C ATOM 426 C ARG A 43 26.854 14.854 41.699 1.00 20.53 C ATOM 427 O ARG A 43 26.440 15.619 42.569 1.00 15.87 O ATOM 428 CB ARG A 43 29.276 14.650 41.064 1.00 16.13 C ATOM 429 CG ARG A 43 29.503 16.120 41.313 1.00 16.73 C ATOM 430 CD ARG A 43 30.947 16.502 41.123 1.00 19.94 C ATOM 431 NE ARG A 43 31.273 17.637 41.963 1.00 17.72 N ATOM 432 CZ ARG A 43 32.468 17.873 42.485 1.00 18.88 C ATOM 433 NH1 ARG A 43 33.478 17.060 42.244 1.00 19.55 N ATOM 434 NH2 ARG A 43 32.643 18.936 43.248 1.00 21.16 N ATOM 435 HE ARG A 43 30.513 18.316 42.171 1.00 0.00 H ATOM 436 HH12 ARG A 43 34.412 17.254 42.658 1.00 0.00 H ATOM 437 HH11 ARG A 43 33.341 16.225 41.640 1.00 0.00 H ATOM 438 HH22 ARG A 43 33.577 19.130 43.663 1.00 0.00 H ATOM 439 HH21 ARG A 43 31.847 19.579 43.434 1.00 0.00 H ATOM 440 H ARG A 43 28.443 12.235 40.799 1.00 0.00 H ATOM 441 N LEU A 44 26.204 14.629 40.561 1.00 15.31 N ATOM 442 CA LEU A 44 24.984 15.359 40.232 1.00 20.46 C ATOM 443 C LEU A 44 23.851 15.094 41.221 1.00 19.05 C ATOM 444 O LEU A 44 23.143 16.025 41.588 1.00 22.57 O ATOM 445 CB LEU A 44 24.512 15.019 38.815 1.00 16.39 C ATOM 446 CG LEU A 44 25.271 15.704 37.684 1.00 21.41 C ATOM 447 CD1 LEU A 44 24.912 15.054 36.388 1.00 16.00 C ATOM 448 CD2 LEU A 44 24.935 17.221 37.655 1.00 16.13 C ATOM 449 H LEU A 44 26.571 13.921 39.894 1.00 0.00 H ATOM 450 N LEU A 45 23.691 13.842 41.658 1.00 15.82 N ATOM 451 CA LEU A 45 22.662 13.535 42.639 1.00 16.42 C ATOM 452 C LEU A 45 23.016 14.199 43.970 1.00 16.78 C ATOM 453 O LEU A 45 22.143 14.746 44.642 1.00 17.39 O ATOM 454 CB LEU A 45 22.471 12.020 42.817 1.00 16.83 C ATOM 455 CG LEU A 45 21.926 11.239 41.598 1.00 20.31 C ATOM 456 CD1 LEU A 45 21.591 9.799 41.941 1.00 17.72 C ATOM 457 CD2 LEU A 45 20.729 11.934 40.967 1.00 17.25 C ATOM 458 H LEU A 45 24.304 13.084 41.296 1.00 0.00 H ATOM 459 N ALA A 46 24.299 14.180 44.331 1.00 16.71 N ATOM 460 CA ALA A 46 24.723 14.798 45.576 1.00 17.40 C ATOM 461 C ALA A 46 24.470 16.308 45.548 1.00 17.45 C ATOM 462 O ALA A 46 23.914 16.855 46.480 1.00 18.25 O ATOM 463 CB ALA A 46 26.196 14.522 45.841 1.00 17.72 C ATOM 464 H ALA A 46 25.001 13.720 43.717 1.00 0.00 H ATOM 465 N GLU A 47 24.809 16.949 44.435 1.00 16.87 N ATOM 466 CA GLU A 47 24.786 18.398 44.381 1.00 17.27 C ATOM 467 C GLU A 47 23.405 18.982 44.095 1.00 22.80 C ATOM 468 O GLU A 47 23.118 20.090 44.523 1.00 27.77 O ATOM 469 CB GLU A 47 25.788 18.895 43.332 1.00 16.94 C ATOM 470 CG GLU A 47 27.237 18.800 43.812 1.00 26.48 C ATOM 471 CD GLU A 47 28.256 19.019 42.719 1.00 38.37 C ATOM 472 OE1 GLU A 47 27.874 19.328 41.568 1.00 45.47 O ATOM 473 OE2 GLU A 47 29.459 18.899 43.023 1.00 53.88 O ATOM 474 H GLU A 47 25.094 16.407 43.594 1.00 0.00 H ATOM 475 N ASN A 48 22.526 18.203 43.475 1.00 17.48 N ATOM 476 CA ASN A 48 21.159 18.643 43.196 1.00 18.33 C ATOM 477 C ASN A 48 20.179 18.071 44.206 1.00 20.52 C ATOM 478 O ASN A 48 19.018 18.437 44.206 1.00 24.56 O ATOM 479 CB ASN A 48 20.706 18.229 41.790 1.00 23.24 C ATOM 480 CG ASN A 48 21.376 19.018 40.694 1.00 23.30 C ATOM 481 OD1 ASN A 48 20.943 20.129 40.364 1.00 19.53 O ATOM 482 ND2 ASN A 48 22.416 18.444 40.097 1.00 17.25 N ATOM 483 HD22 ASN A 48 22.744 17.508 40.410 1.00 0.00 H ATOM 484 HD21 ASN A 48 22.902 18.931 39.317 1.00 0.00 H ATOM 485 H ASN A 48 22.819 17.250 43.178 1.00 0.00 H ATOM 486 N GLY A 49 20.643 17.170 45.064 1.00 18.73 N ATOM 487 CA GLY A 49 19.744 16.558 46.021 1.00 19.67 C ATOM 488 C GLY A 49 19.017 15.367 45.406 1.00 19.66 C ATOM 489 O GLY A 49 19.048 14.255 45.946 1.00 19.87 O ATOM 490 H GLY A 49 21.648 16.905 45.049 1.00 0.00 H ATOM 491 N THR A 50 18.330 15.628 44.295 1.00 19.80 N ATOM 492 CA THR A 50 17.640 14.596 43.527 1.00 20.07 C ATOM 493 C THR A 50 17.458 15.047 42.061 1.00 20.07 C ATOM 494 O THR A 50 17.416 16.244 41.780 1.00 20.41 O ATOM 495 CB THR A 50 16.246 14.251 44.143 1.00 21.72 C ATOM 496 OG1 THR A 50 15.677 13.121 43.476 1.00 31.73 O ATOM 497 CG2 THR A 50 15.298 15.442 44.052 1.00 23.04 C ATOM 498 HG1 THR A 50 16.279 12.342 43.578 1.00 0.00 H ATOM 499 H THR A 50 18.283 16.611 43.960 1.00 0.00 H ATOM 500 N LEU A 51 17.439 14.095 41.134 1.00 19.93 N ATOM 501 CA LEU A 51 17.083 14.377 39.737 1.00 20.51 C ATOM 502 C LEU A 51 16.123 13.313 39.210 1.00 23.24 C ATOM 503 O LEU A 51 16.267 12.116 39.525 1.00 21.42 O ATOM 504 CB LEU A 51 18.323 14.449 38.845 1.00 19.36 C ATOM 505 CG LEU A 51 19.151 15.735 38.983 1.00 18.80 C ATOM 506 CD1 LEU A 51 20.399 15.716 38.113 1.00 17.94 C ATOM 507 CD2 LEU A 51 18.271 16.955 38.668 1.00 20.24 C ATOM 508 H LEU A 51 17.683 13.121 41.406 1.00 0.00 H ATOM 509 N ASP A 52 15.168 13.714 38.374 1.00 23.29 N ATOM 510 CA ASP A 52 14.326 12.694 37.766 1.00 25.01 C ATOM 511 C ASP A 52 15.141 12.027 36.662 1.00 24.01 C ATOM 512 O ASP A 52 16.136 12.586 36.222 1.00 22.89 O ATOM 513 CB ASP A 52 12.972 13.246 37.266 1.00 27.67 C ATOM 514 CG ASP A 52 13.095 14.254 36.137 1.00 40.82 C ATOM 515 OD1 ASP A 52 13.823 14.003 35.160 1.00 37.48 O ATOM 516 OD2 ASP A 52 12.393 15.287 36.200 1.00 52.25 O ATOM 517 H ASP A 52 15.028 14.723 38.162 1.00 0.00 H ATOM 518 N PHE A 53 14.745 10.810 36.285 1.00 24.89 N ATOM 519 CA PHE A 53 15.480 9.992 35.319 1.00 26.13 C ATOM 520 C PHE A 53 15.843 10.749 34.059 1.00 24.87 C ATOM 521 O PHE A 53 16.977 10.686 33.602 1.00 23.74 O ATOM 522 CB PHE A 53 14.682 8.745 34.938 1.00 26.32 C ATOM 523 CG PHE A 53 15.350 7.904 33.872 1.00 26.47 C ATOM 524 CD1 PHE A 53 16.365 7.020 34.198 1.00 29.67 C ATOM 525 CD2 PHE A 53 14.929 7.974 32.549 1.00 31.28 C ATOM 526 CE1 PHE A 53 16.967 6.235 33.222 1.00 31.85 C ATOM 527 CE2 PHE A 53 15.525 7.187 31.565 1.00 33.25 C ATOM 528 CZ PHE A 53 16.546 6.316 31.905 1.00 32.14 C ATOM 529 H PHE A 53 13.872 10.424 36.697 1.00 0.00 H ATOM 530 N GLN A 54 14.866 11.454 33.504 1.00 26.77 N ATOM 531 CA GLN A 54 15.114 12.232 32.300 1.00 30.84 C ATOM 532 C GLN A 54 16.128 13.359 32.509 1.00 26.05 C ATOM 533 O GLN A 54 17.039 13.496 31.696 1.00 25.67 O ATOM 534 CB GLN A 54 13.819 12.810 31.737 1.00 30.53 C ATOM 535 CG GLN A 54 14.038 13.502 30.385 1.00 49.86 C ATOM 536 CD GLN A 54 14.707 12.591 29.340 1.00 56.29 C ATOM 537 OE1 GLN A 54 14.167 11.535 28.993 1.00 60.10 O ATOM 538 NE2 GLN A 54 15.889 13.000 28.842 1.00 52.01 N ATOM 539 HE22 GLN A 54 16.306 13.897 29.163 1.00 0.00 H ATOM 540 HE21 GLN A 54 16.385 12.419 28.136 1.00 0.00 H ATOM 541 H GLN A 54 13.918 11.451 33.932 1.00 0.00 H ATOM 542 N ASP A 55 15.954 14.176 33.554 1.00 25.46 N ATOM 543 CA ASP A 55 16.933 15.240 33.836 1.00 29.63 C ATOM 544 C ASP A 55 18.333 14.680 34.120 1.00 21.97 C ATOM 545 O ASP A 55 19.325 15.282 33.715 1.00 21.40 O ATOM 546 CB ASP A 55 16.499 16.133 35.000 1.00 24.16 C ATOM 547 CG ASP A 55 15.334 17.055 34.637 1.00 26.69 C ATOM 548 OD1 ASP A 55 15.171 17.411 33.456 1.00 31.86 O ATOM 549 OD2 ASP A 55 14.571 17.417 35.539 1.00 37.89 O ATOM 550 H ASP A 55 15.124 14.059 34.170 1.00 0.00 H ATOM 551 N LEU A 56 18.402 13.541 34.816 1.00 21.12 N ATOM 552 CA LEU A 56 19.685 12.903 35.105 1.00 19.56 C ATOM 553 C LEU A 56 20.415 12.520 33.816 1.00 19.80 C ATOM 554 O LEU A 56 21.619 12.693 33.726 1.00 18.93 O ATOM 555 CB LEU A 56 19.505 11.671 35.998 1.00 19.26 C ATOM 556 CG LEU A 56 20.778 10.932 36.425 1.00 18.16 C ATOM 557 CD1 LEU A 56 21.843 11.901 36.995 1.00 20.53 C ATOM 558 CD2 LEU A 56 20.487 9.834 37.437 1.00 18.34 C ATOM 559 H LEU A 56 17.525 13.100 35.159 1.00 0.00 H ATOM 560 N ALA A 57 19.694 11.993 32.832 1.00 21.27 N ATOM 561 CA ALA A 57 20.309 11.619 31.558 1.00 24.41 C ATOM 562 C ALA A 57 20.859 12.842 30.825 1.00 22.22 C ATOM 563 O ALA A 57 21.951 12.784 30.269 1.00 21.95 O ATOM 564 CB ALA A 57 19.326 10.882 30.669 1.00 23.89 C ATOM 565 H ALA A 57 18.674 11.844 32.970 1.00 0.00 H ATOM 566 N ASN A 58 20.091 13.928 30.797 1.00 23.16 N ATOM 567 CA ASN A 58 20.535 15.131 30.111 1.00 28.92 C ATOM 568 C ASN A 58 21.759 15.757 30.764 1.00 27.27 C ATOM 569 O ASN A 58 22.717 16.097 30.072 1.00 22.45 O ATOM 570 CB ASN A 58 19.406 16.161 30.041 1.00 25.65 C ATOM 571 CG ASN A 58 18.357 15.787 29.027 1.00 34.88 C ATOM 572 OD1 ASN A 58 18.677 15.202 27.991 1.00 32.55 O ATOM 573 ND2 ASN A 58 17.097 16.119 29.310 1.00 36.92 N ATOM 574 HD22 ASN A 58 16.876 16.613 30.198 1.00 0.00 H ATOM 575 HD21 ASN A 58 16.335 15.884 28.642 1.00 0.00 H ATOM 576 H ASN A 58 19.165 13.917 31.270 1.00 0.00 H ATOM 577 N GLN A 59 21.734 15.876 32.087 1.00 20.89 N ATOM 578 CA GLN A 59 22.802 16.545 32.819 1.00 19.69 C ATOM 579 C GLN A 59 24.064 15.707 32.979 1.00 20.39 C ATOM 580 O GLN A 59 25.171 16.242 32.933 1.00 18.29 O ATOM 581 CB GLN A 59 22.271 17.000 34.177 1.00 22.21 C ATOM 582 CG GLN A 59 21.481 18.309 34.056 1.00 20.55 C ATOM 583 CD GLN A 59 20.778 18.703 35.325 1.00 25.57 C ATOM 584 OE1 GLN A 59 21.405 18.950 36.344 1.00 32.29 O ATOM 585 NE2 GLN A 59 19.458 18.764 35.266 1.00 28.80 N ATOM 586 HE22 GLN A 59 18.967 18.545 34.376 1.00 0.00 H ATOM 587 HE21 GLN A 59 18.912 19.031 36.110 1.00 0.00 H ATOM 588 H GLN A 59 20.930 15.481 32.615 1.00 0.00 H ATOM 589 N ALA A 60 23.909 14.395 33.112 1.00 18.19 N ATOM 590 CA ALA A 60 25.067 13.513 33.195 1.00 18.23 C ATOM 591 C ALA A 60 25.570 13.148 31.805 1.00 22.92 C ATOM 592 O ALA A 60 26.655 12.576 31.672 1.00 27.61 O ATOM 593 CB ALA A 60 24.736 12.252 33.980 1.00 17.22 C ATOM 594 H ALA A 60 22.951 13.992 33.157 1.00 0.00 H ATOM 595 N CYS A 61 24.778 13.484 30.786 1.00 19.81 N ATOM 596 CA CYS A 61 25.084 13.171 29.389 1.00 21.20 C ATOM 597 C CYS A 61 25.309 11.677 29.166 1.00 21.39 C ATOM 598 O CYS A 61 26.338 11.265 28.646 1.00 21.78 O ATOM 599 CB CYS A 61 26.299 13.972 28.903 1.00 21.47 C ATOM 600 SG CYS A 61 26.009 15.788 28.859 1.00 27.73 S ATOM 601 H CYS A 61 23.897 13.995 30.995 1.00 0.00 H ATOM 602 N ILE A 62 24.325 10.881 29.565 1.00 21.42 N ATOM 603 CA ILE A 62 24.360 9.438 29.384 1.00 27.84 C ATOM 604 C ILE A 62 23.129 8.969 28.601 1.00 23.66 C ATOM 605 O ILE A 62 22.006 9.378 28.913 1.00 23.88 O ATOM 606 CB ILE A 62 24.439 8.719 30.751 1.00 28.19 C ATOM 607 CG1 ILE A 62 25.741 9.104 31.466 1.00 20.17 C ATOM 608 CG2 ILE A 62 24.359 7.212 30.588 1.00 24.31 C ATOM 609 CD1 ILE A 62 25.860 8.539 32.869 1.00 18.91 C ATOM 610 H ILE A 62 23.495 11.306 30.026 1.00 0.00 H ATOM 611 N LEU A 63 23.338 8.134 27.580 1.00 25.18 N ATOM 612 CA LEU A 63 22.218 7.591 26.799 1.00 27.21 C ATOM 613 C LEU A 63 21.258 6.841 27.720 1.00 27.02 C ATOM 614 O LEU A 63 21.682 6.143 28.637 1.00 29.38 O ATOM 615 CB LEU A 63 22.725 6.675 25.704 1.00 28.95 C ATOM 616 CG LEU A 63 23.558 7.334 24.612 1.00 36.58 C ATOM 617 CD1 LEU A 63 24.268 6.261 23.843 1.00 31.55 C ATOM 618 CD2 LEU A 63 22.640 8.115 23.682 1.00 31.76 C ATOM 619 H LEU A 63 24.311 7.863 27.333 1.00 0.00 H ATOM 620 N ARG A 64 19.963 6.993 27.478 1.00 35.06 N ATOM 621 CA ARG A 64 18.953 6.569 28.451 1.00 32.60 C ATOM 622 C ARG A 64 18.949 5.083 28.839 1.00 30.79 C ATOM 623 O ARG A 64 18.910 4.771 30.035 1.00 27.65 O ATOM 624 CB ARG A 64 17.570 7.003 27.954 1.00 33.41 C ATOM 625 CG ARG A 64 17.326 8.488 28.247 1.00 36.00 C ATOM 626 CD ARG A 64 15.957 8.951 27.801 1.00 37.30 C ATOM 627 NE ARG A 64 16.002 9.585 26.486 1.00 44.18 N ATOM 628 CZ ARG A 64 15.105 10.470 26.054 1.00 58.74 C ATOM 629 NH1 ARG A 64 14.087 10.824 26.833 1.00 62.15 N ATOM 630 NH2 ARG A 64 15.221 11.001 24.840 1.00 60.28 N ATOM 631 HE ARG A 64 16.782 9.330 25.848 1.00 0.00 H ATOM 632 HH12 ARG A 64 13.388 11.515 26.493 1.00 0.00 H ATOM 633 HH11 ARG A 64 13.990 10.410 27.782 1.00 0.00 H ATOM 634 HH22 ARG A 64 14.519 11.692 24.505 1.00 0.00 H ATOM 635 HH21 ARG A 64 16.013 10.725 24.225 1.00 0.00 H ATOM 636 H ARG A 64 19.659 7.421 26.581 1.00 0.00 H ATOM 637 N PRO A 65 18.996 4.166 27.853 1.00 30.68 N ATOM 638 CA PRO A 65 19.027 2.760 28.268 1.00 31.34 C ATOM 639 C PRO A 65 20.293 2.413 29.058 1.00 31.07 C ATOM 640 O PRO A 65 20.248 1.586 29.959 1.00 34.78 O ATOM 641 CB PRO A 65 18.980 1.998 26.930 1.00 36.75 C ATOM 642 CG PRO A 65 18.364 2.960 25.967 1.00 35.10 C ATOM 643 CD PRO A 65 18.920 4.293 26.388 1.00 32.76 C ATOM 644 N SER A 66 21.408 3.043 28.717 1.00 28.54 N ATOM 645 CA SER A 66 22.649 2.811 29.424 1.00 27.28 C ATOM 646 C SER A 66 22.592 3.317 30.882 1.00 34.28 C ATOM 647 O SER A 66 23.188 2.720 31.786 1.00 25.07 O ATOM 648 CB SER A 66 23.795 3.463 28.646 1.00 26.95 C ATOM 649 OG SER A 66 24.980 3.451 29.409 1.00 43.15 O ATOM 650 HG SER A 66 24.835 3.953 30.250 1.00 0.00 H ATOM 651 H SER A 66 21.391 3.717 27.926 1.00 0.00 H ATOM 652 N LEU A 67 21.870 4.420 31.093 1.00 24.55 N ATOM 653 CA LEU A 67 21.675 5.020 32.412 1.00 23.07 C ATOM 654 C LEU A 67 20.872 4.108 33.337 1.00 23.73 C ATOM 655 O LEU A 67 21.150 3.992 34.526 1.00 23.00 O ATOM 656 CB LEU A 67 20.961 6.367 32.272 1.00 22.96 C ATOM 657 CG LEU A 67 20.589 7.049 33.577 1.00 21.49 C ATOM 658 CD1 LEU A 67 21.859 7.295 34.349 1.00 20.67 C ATOM 659 CD2 LEU A 67 19.809 8.372 33.356 1.00 22.42 C ATOM 660 H LEU A 67 21.421 4.878 30.274 1.00 0.00 H ATOM 661 N THR A 68 19.866 3.471 32.766 1.00 25.45 N ATOM 662 CA THR A 68 19.040 2.526 33.498 1.00 31.40 C ATOM 663 C THR A 68 19.884 1.386 34.048 1.00 31.81 C ATOM 664 O THR A 68 19.785 1.036 35.230 1.00 26.92 O ATOM 665 CB THR A 68 17.940 1.952 32.596 1.00 28.88 C ATOM 666 OG1 THR A 68 17.102 3.022 32.149 1.00 29.03 O ATOM 667 CG2 THR A 68 17.102 0.941 33.350 1.00 38.12 C ATOM 668 HG1 THR A 68 17.645 3.675 31.641 1.00 0.00 H ATOM 669 H THR A 68 19.659 3.651 31.763 1.00 0.00 H ATOM 670 N GLY A 69 20.754 0.859 33.192 1.00 27.54 N ATOM 671 CA GLY A 69 21.626 -0.231 33.567 1.00 28.38 C ATOM 672 C GLY A 69 22.568 0.209 34.659 1.00 26.90 C ATOM 673 O GLY A 69 22.769 -0.519 35.625 1.00 27.64 O ATOM 674 H GLY A 69 20.809 1.241 32.226 1.00 0.00 H ATOM 675 N ILE A 70 23.136 1.411 34.505 1.00 25.14 N ATOM 676 CA ILE A 70 24.021 1.962 35.514 1.00 23.92 C ATOM 677 C ILE A 70 23.276 2.168 36.834 1.00 23.52 C ATOM 678 O ILE A 70 23.772 1.775 37.887 1.00 23.91 O ATOM 679 CB ILE A 70 24.636 3.280 35.037 1.00 25.72 C ATOM 680 CG1 ILE A 70 25.577 2.995 33.862 1.00 23.11 C ATOM 681 CG2 ILE A 70 25.424 3.922 36.142 1.00 25.54 C ATOM 682 CD1 ILE A 70 26.036 4.203 33.150 1.00 22.68 C ATOM 683 H ILE A 70 22.939 1.961 33.645 1.00 0.00 H ATOM 684 N LEU A 71 22.071 2.733 36.760 1.00 23.18 N ATOM 685 CA LEU A 71 21.259 2.980 37.947 1.00 24.65 C ATOM 686 C LEU A 71 20.910 1.685 38.671 1.00 29.43 C ATOM 687 O LEU A 71 21.104 1.577 39.875 1.00 25.03 O ATOM 688 CB LEU A 71 19.980 3.721 37.578 1.00 22.99 C ATOM 689 CG LEU A 71 20.204 5.198 37.264 1.00 25.15 C ATOM 690 CD1 LEU A 71 18.880 5.847 36.896 1.00 22.03 C ATOM 691 CD2 LEU A 71 20.854 5.880 38.443 1.00 20.33 C ATOM 692 H LEU A 71 21.698 3.006 35.828 1.00 0.00 H ATOM 693 N THR A 72 20.443 0.695 37.916 1.00 28.14 N ATOM 694 CA THR A 72 20.148 -0.617 38.464 1.00 28.86 C ATOM 695 C THR A 72 21.311 -1.141 39.293 1.00 30.93 C ATOM 696 O THR A 72 21.123 -1.600 40.420 1.00 32.10 O ATOM 697 CB THR A 72 19.834 -1.633 37.349 1.00 30.33 C ATOM 698 OG1 THR A 72 18.619 -1.248 36.696 1.00 42.15 O ATOM 699 CG2 THR A 72 19.620 -2.996 37.944 1.00 40.68 C ATOM 700 HG1 THR A 72 18.728 -0.345 36.305 1.00 0.00 H ATOM 701 H THR A 72 20.284 0.866 36.902 1.00 0.00 H ATOM 702 N ARG A 73 22.517 -1.004 38.759 1.00 28.33 N ATOM 703 CA ARG A 73 23.696 -1.513 39.436 1.00 30.64 C ATOM 704 C ARG A 73 24.029 -0.696 40.683 1.00 29.44 C ATOM 705 O ARG A 73 24.390 -1.276 41.714 1.00 31.83 O ATOM 706 CB ARG A 73 24.887 -1.548 38.467 1.00 32.41 C ATOM 707 CG ARG A 73 24.812 -2.737 37.489 1.00 44.03 C ATOM 708 CD ARG A 73 26.013 -2.835 36.554 1.00 44.91 C ATOM 709 NE ARG A 73 26.005 -1.764 35.565 1.00 45.90 N ATOM 710 CZ ARG A 73 25.312 -1.812 34.432 1.00 46.85 C ATOM 711 NH1 ARG A 73 24.580 -2.879 34.160 1.00 42.99 N ATOM 712 NH2 ARG A 73 25.338 -0.794 33.577 1.00 48.91 N ATOM 713 HE ARG A 73 26.574 -0.915 35.757 1.00 0.00 H ATOM 714 HH12 ARG A 73 24.035 -2.924 33.275 1.00 0.00 H ATOM 715 HH11 ARG A 73 24.549 -3.673 34.831 1.00 0.00 H ATOM 716 HH22 ARG A 73 24.792 -0.843 32.693 1.00 0.00 H ATOM 717 HH21 ARG A 73 25.905 0.051 33.792 1.00 0.00 H ATOM 718 H ARG A 73 22.620 -0.525 37.842 1.00 0.00 H ATOM 719 N LEU A 74 23.864 0.626 40.606 1.00 26.07 N ATOM 720 CA LEU A 74 24.114 1.506 41.747 1.00 25.24 C ATOM 721 C LEU A 74 23.092 1.289 42.873 1.00 26.17 C ATOM 722 O LEU A 74 23.417 1.459 44.050 1.00 26.69 O ATOM 723 CB LEU A 74 24.120 2.982 41.305 1.00 23.01 C ATOM 724 CG LEU A 74 25.337 3.501 40.522 1.00 23.97 C ATOM 725 CD1 LEU A 74 25.135 4.941 40.058 1.00 20.34 C ATOM 726 CD2 LEU A 74 26.637 3.374 41.336 1.00 22.95 C ATOM 727 H LEU A 74 23.548 1.043 39.707 1.00 0.00 H ATOM 728 N GLU A 75 21.863 0.918 42.519 1.00 26.68 N ATOM 729 CA GLU A 75 20.857 0.576 43.526 1.00 30.11 C ATOM 730 C GLU A 75 21.193 -0.740 44.217 1.00 30.55 C ATOM 731 O GLU A 75 21.130 -0.840 45.444 1.00 31.74 O ATOM 732 CB GLU A 75 19.457 0.480 42.912 1.00 35.98 C ATOM 733 CG GLU A 75 19.018 1.757 42.217 1.00 41.83 C ATOM 734 CD GLU A 75 17.594 1.710 41.694 1.00 45.75 C ATOM 735 OE1 GLU A 75 16.799 0.847 42.148 1.00 42.40 O ATOM 736 OE2 GLU A 75 17.277 2.549 40.824 1.00 47.25 O ATOM 737 H GLU A 75 21.614 0.870 41.510 1.00 0.00 H ATOM 738 N LYS A 76 21.550 -1.751 43.430 1.00 31.71 N ATOM 739 CA LYS A 76 21.886 -3.053 44.005 1.00 34.55 C ATOM 740 C LYS A 76 23.074 -2.906 44.953 1.00 37.19 C ATOM 741 O LYS A 76 23.176 -3.610 45.955 1.00 37.51 O ATOM 742 CB LYS A 76 22.215 -4.073 42.912 1.00 35.79 C ATOM 743 CG LYS A 76 21.024 -4.567 42.114 1.00 43.35 C ATOM 744 CD LYS A 76 21.451 -5.611 41.072 1.00 49.55 C ATOM 745 CE LYS A 76 22.429 -5.003 40.052 1.00 47.25 C ATOM 746 NZ LYS A 76 23.002 -6.002 39.086 1.00 48.22 N ATOM 747 HZ1 LYS A 76 23.521 -6.733 39.613 1.00 0.00 H ATOM 748 HZ2 LYS A 76 22.230 -6.444 38.547 1.00 0.00 H ATOM 749 HZ3 LYS A 76 23.650 -5.518 38.432 1.00 0.00 H ATOM 750 H LYS A 76 21.590 -1.615 42.400 1.00 0.00 H ATOM 751 N ALA A 77 23.951 -1.960 44.634 1.00 31.42 N ATOM 752 CA ALA A 77 25.115 -1.667 45.456 1.00 29.99 C ATOM 753 C ALA A 77 24.750 -0.820 46.677 1.00 27.47 C ATOM 754 O ALA A 77 25.590 -0.551 47.525 1.00 26.25 O ATOM 755 CB ALA A 77 26.193 -0.968 44.617 1.00 29.94 C ATOM 756 H ALA A 77 23.800 -1.409 43.765 1.00 0.00 H ATOM 757 N GLY A 78 23.502 -0.371 46.742 1.00 26.87 N ATOM 758 CA GLY A 78 23.011 0.389 47.869 1.00 24.87 C ATOM 759 C GLY A 78 23.419 1.852 47.843 1.00 23.01 C ATOM 760 O GLY A 78 23.341 2.534 48.851 1.00 21.65 O ATOM 761 H GLY A 78 22.855 -0.574 45.954 1.00 0.00 H ATOM 762 N LEU A 79 23.813 2.355 46.684 1.00 23.42 N ATOM 763 CA LEU A 79 24.313 3.721 46.600 1.00 23.29 C ATOM 764 C LEU A 79 23.219 4.671 46.143 1.00 23.30 C ATOM 765 O LEU A 79 23.252 5.859 46.457 1.00 20.22 O ATOM 766 CB LEU A 79 25.513 3.804 45.645 1.00 22.85 C ATOM 767 CG LEU A 79 26.686 2.868 45.961 1.00 28.07 C ATOM 768 CD1 LEU A 79 27.700 2.878 44.849 1.00 24.93 C ATOM 769 CD2 LEU A 79 27.352 3.271 47.266 1.00 21.96 C ATOM 770 H LEU A 79 23.765 1.770 45.825 1.00 0.00 H ATOM 771 N VAL A 80 22.254 4.148 45.395 1.00 22.83 N ATOM 772 CA VAL A 80 21.192 4.979 44.841 1.00 22.67 C ATOM 773 C VAL A 80 19.811 4.404 45.155 1.00 23.99 C ATOM 774 O VAL A 80 19.572 3.212 45.023 1.00 24.68 O ATOM 775 CB VAL A 80 21.349 5.145 43.307 1.00 24.13 C ATOM 776 CG1 VAL A 80 20.104 5.792 42.679 1.00 24.37 C ATOM 777 CG2 VAL A 80 22.589 5.953 42.986 1.00 23.64 C ATOM 778 H VAL A 80 22.256 3.126 45.201 1.00 0.00 H ATOM 779 N VAL A 81 18.894 5.287 45.515 1.00 22.18 N ATOM 780 CA VAL A 81 17.517 4.928 45.798 1.00 23.70 C ATOM 781 C VAL A 81 16.575 5.663 44.847 1.00 23.15 C ATOM 782 O VAL A 81 16.867 6.791 44.431 1.00 22.40 O ATOM 783 CB VAL A 81 17.173 5.233 47.267 1.00 22.70 C ATOM 784 CG1 VAL A 81 15.735 5.665 47.432 1.00 26.81 C ATOM 785 CG2 VAL A 81 17.429 3.995 48.090 1.00 37.40 C ATOM 786 H VAL A 81 19.173 6.285 45.599 1.00 0.00 H ATOM 787 N ARG A 82 15.498 4.994 44.440 1.00 24.63 N ATOM 788 CA ARG A 82 14.415 5.648 43.690 1.00 31.99 C ATOM 789 C ARG A 82 13.373 6.365 44.556 1.00 24.14 C ATOM 790 O ARG A 82 12.942 5.858 45.580 1.00 23.99 O ATOM 791 CB ARG A 82 13.672 4.614 42.840 1.00 27.47 C ATOM 792 CG ARG A 82 14.378 4.207 41.589 1.00 32.31 C ATOM 793 CD ARG A 82 13.689 3.021 40.945 1.00 34.76 C ATOM 794 NE ARG A 82 13.810 1.804 41.748 1.00 36.24 N ATOM 795 CZ ARG A 82 12.841 1.270 42.489 1.00 43.07 C ATOM 796 NH1 ARG A 82 11.632 1.830 42.535 1.00 43.47 N ATOM 797 NH2 ARG A 82 13.078 0.152 43.171 1.00 40.59 N ATOM 798 HE ARG A 82 14.728 1.316 41.739 1.00 0.00 H ATOM 799 HH12 ARG A 82 10.883 1.404 43.117 1.00 0.00 H ATOM 800 HH11 ARG A 82 11.438 2.693 41.988 1.00 0.00 H ATOM 801 HH22 ARG A 82 12.327 -0.272 43.752 1.00 0.00 H ATOM 802 HH21 ARG A 82 14.014 -0.298 43.123 1.00 0.00 H ATOM 803 H ARG A 82 15.420 3.980 44.659 1.00 0.00 H ATOM 804 N LEU A 83 12.980 7.555 44.118 1.00 35.12 N ATOM 805 CA LEU A 83 11.909 8.346 44.735 1.00 29.93 C ATOM 806 C LEU A 83 10.699 8.488 43.814 1.00 25.73 C ATOM 807 O LEU A 83 10.839 8.902 42.660 1.00 28.85 O ATOM 808 CB LEU A 83 12.409 9.729 45.165 1.00 24.26 C ATOM 809 CG LEU A 83 12.917 9.926 46.607 1.00 22.70 C ATOM 810 CD1 LEU A 83 14.008 8.949 47.003 1.00 19.80 C ATOM 811 CD2 LEU A 83 13.423 11.347 46.789 1.00 32.52 C ATOM 812 H LEU A 83 13.461 7.951 43.286 1.00 0.00 H ATOM 813 N LYS A 84 9.513 8.137 44.292 1.00 29.70 N ATOM 814 CA LYS A 84 8.337 8.283 43.433 1.00 34.75 C ATOM 815 C LYS A 84 7.517 9.492 43.859 1.00 25.82 C ATOM 816 O LYS A 84 7.225 9.665 45.035 1.00 25.02 O ATOM 817 CB LYS A 84 7.459 7.016 43.481 1.00 32.13 C ATOM 818 CG LYS A 84 8.044 5.800 42.804 1.00 37.17 C ATOM 819 CD LYS A 84 8.193 6.055 41.310 1.00 45.03 C ATOM 820 CE LYS A 84 6.828 6.381 40.681 1.00 50.73 C ATOM 821 NZ LYS A 84 6.908 6.663 39.219 1.00 53.62 N ATOM 822 HZ1 LYS A 84 7.532 7.479 39.058 1.00 0.00 H ATOM 823 HZ2 LYS A 84 7.291 5.830 38.727 1.00 0.00 H ATOM 824 HZ3 LYS A 84 5.957 6.875 38.856 1.00 0.00 H ATOM 825 H LYS A 84 9.420 7.765 45.259 1.00 0.00 H ATOM 826 N PRO A 85 7.100 10.313 42.886 1.00 30.37 N ATOM 827 CA PRO A 85 6.321 11.512 43.233 1.00 32.98 C ATOM 828 C PRO A 85 4.840 11.224 43.214 1.00 27.33 C ATOM 829 O PRO A 85 4.401 10.443 42.393 1.00 28.96 O ATOM 830 CB PRO A 85 6.689 12.499 42.125 1.00 26.03 C ATOM 831 CG PRO A 85 6.946 11.635 40.944 1.00 27.45 C ATOM 832 CD PRO A 85 7.564 10.347 41.487 1.00 27.61 C ATOM 833 N SER A 86 4.078 11.863 44.088 1.00 27.05 N ATOM 834 CA SER A 86 2.667 11.548 44.227 1.00 28.39 C ATOM 835 C SER A 86 1.834 12.205 43.135 1.00 33.05 C ATOM 836 O SER A 86 0.638 11.950 43.029 1.00 40.24 O ATOM 837 CB SER A 86 2.164 11.982 45.601 1.00 32.88 C ATOM 838 OG SER A 86 2.381 13.374 45.806 1.00 39.24 O ATOM 839 HG SER A 86 2.047 13.630 46.702 1.00 0.00 H ATOM 840 H SER A 86 4.497 12.604 44.686 1.00 0.00 H ATOM 841 N ASN A 87 2.469 12.982 42.263 1.00 32.22 N ATOM 842 CA ASN A 87 1.702 13.700 41.246 1.00 39.61 C ATOM 843 C ASN A 87 2.068 13.317 39.822 1.00 40.85 C ATOM 844 O ASN A 87 1.601 13.939 38.869 1.00 35.87 O ATOM 845 CB ASN A 87 1.894 15.206 41.420 1.00 41.04 C ATOM 846 CG ASN A 87 3.324 15.645 41.136 1.00 42.01 C ATOM 847 OD1 ASN A 87 4.278 14.886 41.357 1.00 38.04 O ATOM 848 ND2 ASN A 87 3.485 16.886 40.673 1.00 33.72 N ATOM 849 HD22 ASN A 87 2.655 17.489 40.502 1.00 0.00 H ATOM 850 HD21 ASN A 87 4.440 17.250 40.483 1.00 0.00 H ATOM 851 H ASN A 87 3.504 13.078 42.304 1.00 0.00 H ATOM 852 N ASP A 88 2.886 12.276 39.686 1.00 42.33 N ATOM 853 CA ASP A 88 3.244 11.753 38.376 1.00 48.28 C ATOM 854 C ASP A 88 3.547 10.256 38.423 1.00 46.67 C ATOM 855 O ASP A 88 4.523 9.817 39.042 1.00 45.03 O ATOM 856 CB ASP A 88 4.445 12.503 37.800 1.00 47.28 C ATOM 857 CG ASP A 88 4.533 12.370 36.292 1.00 48.94 C ATOM 858 OD1 ASP A 88 4.791 11.244 35.804 1.00 49.16 O ATOM 859 OD2 ASP A 88 4.306 13.384 35.597 1.00 47.46 O ATOM 860 H ASP A 88 3.279 11.825 40.537 1.00 0.00 H ATOM 861 N GLN A 89 2.725 9.492 37.718 1.00 48.40 N ATOM 862 CA GLN A 89 2.735 8.038 37.801 1.00 50.03 C ATOM 863 C GLN A 89 3.915 7.356 37.119 1.00 50.33 C ATOM 864 O GLN A 89 4.249 6.230 37.469 1.00 61.71 O ATOM 865 CB GLN A 89 1.431 7.492 37.213 1.00 51.16 C ATOM 866 CG GLN A 89 0.199 7.972 37.961 1.00 58.73 C ATOM 867 CD GLN A 89 -1.100 7.625 37.255 1.00 68.61 C ATOM 868 OE1 GLN A 89 -1.112 6.919 36.242 1.00 72.78 O ATOM 869 NE2 GLN A 89 -2.206 8.125 37.791 1.00 70.11 N ATOM 870 HE22 GLN A 89 -2.149 8.715 38.645 1.00 0.00 H ATOM 871 HE21 GLN A 89 -3.130 7.927 37.357 1.00 0.00 H ATOM 872 H GLN A 89 2.044 9.950 37.079 1.00 0.00 H ATOM 873 N ARG A 90 4.539 8.015 36.151 1.00 37.96 N ATOM 874 CA ARG A 90 5.594 7.371 35.368 1.00 39.66 C ATOM 875 C ARG A 90 6.985 7.890 35.736 1.00 39.79 C ATOM 876 O ARG A 90 7.995 7.180 35.628 1.00 44.72 O ATOM 877 CB ARG A 90 5.354 7.580 33.868 1.00 41.21 C ATOM 878 CG ARG A 90 3.940 7.281 33.418 1.00 47.78 C ATOM 879 CD ARG A 90 3.848 7.091 31.910 1.00 46.35 C ATOM 880 NE ARG A 90 2.555 6.525 31.530 1.00 48.53 N ATOM 881 CZ ARG A 90 2.322 5.224 31.382 1.00 56.47 C ATOM 882 NH1 ARG A 90 3.298 4.348 31.573 1.00 55.85 N ATOM 883 NH2 ARG A 90 1.116 4.797 31.040 1.00 52.92 N ATOM 884 HE ARG A 90 1.766 7.182 31.365 1.00 0.00 H ATOM 885 HH12 ARG A 90 3.114 3.331 31.457 1.00 0.00 H ATOM 886 HH11 ARG A 90 4.248 4.678 31.839 1.00 0.00 H ATOM 887 HH22 ARG A 90 0.938 3.779 30.925 1.00 0.00 H ATOM 888 HH21 ARG A 90 0.347 5.480 30.886 1.00 0.00 H ATOM 889 H ARG A 90 4.275 9.000 35.947 1.00 0.00 H ATOM 890 N ARG A 91 7.012 9.138 36.177 1.00 35.04 N ATOM 891 CA ARG A 91 8.229 9.866 36.471 1.00 33.24 C ATOM 892 C ARG A 91 8.955 9.318 37.704 1.00 31.56 C ATOM 893 O ARG A 91 8.343 9.029 38.734 1.00 30.86 O ATOM 894 CB ARG A 91 7.874 11.333 36.637 1.00 32.24 C ATOM 895 CG ARG A 91 9.002 12.273 36.912 1.00 37.23 C ATOM 896 CD ARG A 91 8.418 13.662 36.962 1.00 45.71 C ATOM 897 NE ARG A 91 9.412 14.695 37.214 1.00 52.67 N ATOM 898 CZ ARG A 91 9.123 15.992 37.261 1.00 55.18 C ATOM 899 NH1 ARG A 91 7.867 16.395 37.075 1.00 51.88 N ATOM 900 NH2 ARG A 91 10.082 16.883 37.496 1.00 56.73 N ATOM 901 HE ARG A 91 10.399 14.404 37.365 1.00 0.00 H ATOM 902 HH12 ARG A 91 7.635 17.408 37.111 1.00 0.00 H ATOM 903 HH11 ARG A 91 7.118 15.696 36.894 1.00 0.00 H ATOM 904 HH22 ARG A 91 9.852 17.897 37.532 1.00 0.00 H ATOM 905 HH21 ARG A 91 11.061 16.566 37.644 1.00 0.00 H ATOM 906 H ARG A 91 6.104 9.625 36.321 1.00 0.00 H ATOM 907 N VAL A 92 10.256 9.106 37.556 1.00 24.22 N ATOM 908 CA VAL A 92 11.088 8.521 38.608 1.00 23.87 C ATOM 909 C VAL A 92 12.195 9.483 39.024 1.00 25.27 C ATOM 910 O VAL A 92 12.955 9.948 38.176 1.00 29.45 O ATOM 911 CB VAL A 92 11.735 7.176 38.126 1.00 27.04 C ATOM 912 CG1 VAL A 92 12.513 6.495 39.233 1.00 24.49 C ATOM 913 CG2 VAL A 92 10.671 6.233 37.571 1.00 35.32 C ATOM 914 H VAL A 92 10.704 9.367 36.654 1.00 0.00 H ATOM 915 N PHE A 93 12.326 9.742 40.322 1.00 28.73 N ATOM 916 CA PHE A 93 13.422 10.574 40.836 1.00 20.35 C ATOM 917 C PHE A 93 14.524 9.664 41.413 1.00 20.22 C ATOM 918 O PHE A 93 14.264 8.532 41.799 1.00 21.44 O ATOM 919 CB PHE A 93 12.926 11.566 41.891 1.00 20.34 C ATOM 920 CG PHE A 93 12.292 12.805 41.310 1.00 20.08 C ATOM 921 CD1 PHE A 93 10.929 12.840 41.021 1.00 21.30 C ATOM 922 CD2 PHE A 93 13.064 13.927 41.045 1.00 18.81 C ATOM 923 CE1 PHE A 93 10.345 13.974 40.482 1.00 26.91 C ATOM 924 CE2 PHE A 93 12.498 15.066 40.511 1.00 20.05 C ATOM 925 CZ PHE A 93 11.131 15.094 40.220 1.00 27.22 C ATOM 926 H PHE A 93 11.635 9.345 40.990 1.00 0.00 H ATOM 927 N LEU A 94 15.762 10.155 41.397 1.00 18.88 N ATOM 928 CA LEU A 94 16.911 9.401 41.902 1.00 21.31 C ATOM 929 C LEU A 94 17.644 10.225 42.953 1.00 17.88 C ATOM 930 O LEU A 94 17.738 11.431 42.837 1.00 16.94 O ATOM 931 CB LEU A 94 17.885 9.024 40.788 1.00 18.19 C ATOM 932 CG LEU A 94 17.514 8.088 39.634 1.00 19.13 C ATOM 933 CD1 LEU A 94 16.936 6.777 40.146 1.00 20.83 C ATOM 934 CD2 LEU A 94 16.597 8.782 38.636 1.00 19.11 C ATOM 935 H LEU A 94 15.918 11.108 41.012 1.00 0.00 H ATOM 936 N LYS A 95 18.158 9.556 43.973 1.00 18.40 N ATOM 937 CA LYS A 95 18.836 10.216 45.073 1.00 17.91 C ATOM 938 C LYS A 95 19.895 9.265 45.646 1.00 21.99 C ATOM 939 O LYS A 95 19.808 8.049 45.480 1.00 23.77 O ATOM 940 CB LYS A 95 17.828 10.659 46.148 1.00 18.77 C ATOM 941 CG LYS A 95 18.448 11.484 47.265 1.00 26.24 C ATOM 942 CD LYS A 95 17.423 12.040 48.239 1.00 25.53 C ATOM 943 CE LYS A 95 18.118 12.735 49.413 1.00 29.62 C ATOM 944 NZ LYS A 95 19.011 13.873 49.016 1.00 27.03 N ATOM 945 HZ1 LYS A 95 19.758 13.521 48.384 1.00 0.00 H ATOM 946 HZ2 LYS A 95 18.450 14.596 48.522 1.00 0.00 H ATOM 947 HZ3 LYS A 95 19.441 14.288 49.867 1.00 0.00 H ATOM 948 H LYS A 95 18.073 8.520 43.986 1.00 0.00 H ATOM 949 N LEU A 96 20.929 9.821 46.259 1.00 18.77 N ATOM 950 CA LEU A 96 21.918 8.997 46.942 1.00 18.95 C ATOM 951 C LEU A 96 21.341 8.497 48.269 1.00 19.73 C ATOM 952 O LEU A 96 20.522 9.155 48.909 1.00 20.04 O ATOM 953 CB LEU A 96 23.201 9.794 47.177 1.00 17.06 C ATOM 954 CG LEU A 96 23.909 10.260 45.897 1.00 15.71 C ATOM 955 CD1 LEU A 96 25.105 11.126 46.240 1.00 14.81 C ATOM 956 CD2 LEU A 96 24.339 9.082 45.027 1.00 16.10 C ATOM 957 H LEU A 96 21.036 10.855 46.253 1.00 0.00 H ATOM 958 N THR A 97 21.782 7.306 48.654 1.00 20.91 N ATOM 959 CA THR A 97 21.491 6.733 49.951 1.00 22.63 C ATOM 960 C THR A 97 22.492 7.285 50.948 1.00 23.07 C ATOM 961 O THR A 97 23.330 8.112 50.592 1.00 20.93 O ATOM 962 CB THR A 97 21.593 5.211 49.918 1.00 24.24 C ATOM 963 OG1 THR A 97 22.941 4.841 49.609 1.00 23.81 O ATOM 964 CG2 THR A 97 20.677 4.647 48.862 1.00 25.60 C ATOM 965 HG1 THR A 97 23.014 3.854 49.586 1.00 0.00 H ATOM 966 H THR A 97 22.366 6.757 47.991 1.00 0.00 H ATOM 967 N ALA A 98 22.448 6.784 52.178 1.00 24.07 N ATOM 968 CA ALA A 98 23.445 7.145 53.167 1.00 24.24 C ATOM 969 C ALA A 98 24.822 6.710 52.683 1.00 25.80 C ATOM 970 O ALA A 98 25.785 7.481 52.741 1.00 25.58 O ATOM 971 CB ALA A 98 23.126 6.501 54.488 1.00 31.85 C ATOM 972 H ALA A 98 21.687 6.123 52.435 1.00 0.00 H ATOM 973 N GLU A 99 24.891 5.494 52.150 1.00 25.25 N ATOM 974 CA GLU A 99 26.146 4.952 51.644 1.00 31.81 C ATOM 975 C GLU A 99 26.638 5.775 50.464 1.00 29.52 C ATOM 976 O GLU A 99 27.833 6.041 50.348 1.00 25.46 O ATOM 977 CB GLU A 99 25.985 3.489 51.205 1.00 29.42 C ATOM 978 CG GLU A 99 25.741 2.493 52.310 1.00 49.07 C ATOM 979 CD GLU A 99 24.711 1.440 51.915 1.00 64.12 C ATOM 980 OE1 GLU A 99 23.590 1.830 51.497 1.00 60.75 O ATOM 981 OE2 GLU A 99 25.023 0.231 52.022 1.00 66.52 O ATOM 982 H GLU A 99 24.029 4.915 52.093 1.00 0.00 H ATOM 983 N GLY A 100 25.708 6.202 49.610 1.00 28.69 N ATOM 984 CA GLY A 100 26.058 6.998 48.448 1.00 26.38 C ATOM 985 C GLY A 100 26.613 8.365 48.798 1.00 24.76 C ATOM 986 O GLY A 100 27.569 8.829 48.182 1.00 30.78 O ATOM 987 H GLY A 100 24.711 5.960 49.780 1.00 0.00 H ATOM 988 N GLU A 101 26.012 9.003 49.795 1.00 19.89 N ATOM 989 CA GLU A 101 26.452 10.309 50.260 1.00 17.65 C ATOM 990 C GLU A 101 27.875 10.250 50.834 1.00 21.11 C ATOM 991 O GLU A 101 28.719 11.066 50.482 1.00 19.95 O ATOM 992 CB GLU A 101 25.466 10.844 51.303 1.00 18.43 C ATOM 993 CG GLU A 101 24.182 11.379 50.699 1.00 26.28 C ATOM 994 CD GLU A 101 23.219 11.963 51.734 1.00 35.35 C ATOM 995 OE1 GLU A 101 23.655 12.246 52.869 1.00 44.27 O ATOM 996 OE2 GLU A 101 22.038 12.211 51.385 1.00 41.23 O ATOM 997 H GLU A 101 25.198 8.553 50.260 1.00 0.00 H ATOM 998 N LYS A 102 28.133 9.268 51.696 1.00 19.32 N ATOM 999 CA LYS A 102 29.461 9.040 52.262 1.00 24.48 C ATOM 1000 C LYS A 102 30.513 8.805 51.177 1.00 28.82 C ATOM 1001 O LYS A 102 31.603 9.368 51.231 1.00 31.96 O ATOM 1002 CB LYS A 102 29.425 7.847 53.225 1.00 29.07 C ATOM 1003 CG LYS A 102 30.749 7.558 53.938 1.00 43.77 C ATOM 1004 CD LYS A 102 30.613 6.354 54.875 1.00 57.67 C ATOM 1005 CE LYS A 102 31.951 5.945 55.495 1.00 63.18 C ATOM 1006 NZ LYS A 102 32.536 7.029 56.340 1.00 67.76 N ATOM 1007 HZ1 LYS A 102 32.695 7.875 55.756 1.00 0.00 H ATOM 1008 HZ2 LYS A 102 31.878 7.258 57.112 1.00 0.00 H ATOM 1009 HZ3 LYS A 102 33.441 6.706 56.738 1.00 0.00 H ATOM 1010 H LYS A 102 27.356 8.637 51.978 1.00 0.00 H ATOM 1011 N LEU A 103 30.179 7.984 50.184 1.00 27.95 N ATOM 1012 CA LEU A 103 31.091 7.723 49.069 1.00 28.94 C ATOM 1013 C LEU A 103 31.380 9.004 48.290 1.00 24.80 C ATOM 1014 O LEU A 103 32.508 9.261 47.891 1.00 30.11 O ATOM 1015 CB LEU A 103 30.494 6.671 48.135 1.00 36.53 C ATOM 1016 CG LEU A 103 31.360 6.215 46.959 1.00 42.51 C ATOM 1017 CD1 LEU A 103 32.625 5.521 47.456 1.00 36.09 C ATOM 1018 CD2 LEU A 103 30.566 5.309 46.011 1.00 44.35 C ATOM 1019 H LEU A 103 29.250 7.518 50.201 1.00 0.00 H ATOM 1020 N TYR A 104 30.355 9.820 48.100 1.00 23.21 N ATOM 1021 CA TYR A 104 30.505 11.093 47.421 1.00 21.75 C ATOM 1022 C TYR A 104 31.473 12.018 48.116 1.00 23.99 C ATOM 1023 O TYR A 104 32.261 12.703 47.464 1.00 21.40 O ATOM 1024 CB TYR A 104 29.157 11.814 47.316 1.00 21.75 C ATOM 1025 CG TYR A 104 29.275 13.292 46.940 1.00 25.24 C ATOM 1026 CD1 TYR A 104 29.624 13.681 45.648 1.00 26.35 C ATOM 1027 CD2 TYR A 104 28.990 14.293 47.867 1.00 27.10 C ATOM 1028 CE1 TYR A 104 29.714 15.024 45.298 1.00 21.34 C ATOM 1029 CE2 TYR A 104 29.080 15.635 47.528 1.00 27.23 C ATOM 1030 CZ TYR A 104 29.448 15.993 46.242 1.00 32.26 C ATOM 1031 OH TYR A 104 29.529 17.324 45.889 1.00 43.55 O ATOM 1032 HH TYR A 104 29.804 17.397 44.941 1.00 0.00 H ATOM 1033 H TYR A 104 29.415 9.540 48.447 1.00 0.00 H ATOM 1034 N GLU A 105 31.390 12.047 49.441 1.00 24.54 N ATOM 1035 CA GLU A 105 32.205 12.951 50.231 1.00 29.41 C ATOM 1036 C GLU A 105 33.668 12.555 50.177 1.00 25.68 C ATOM 1037 O GLU A 105 34.546 13.409 50.030 1.00 25.63 O ATOM 1038 CB GLU A 105 31.737 12.968 51.685 1.00 32.00 C ATOM 1039 CG GLU A 105 30.331 13.494 51.884 1.00 47.10 C ATOM 1040 CD GLU A 105 29.911 13.516 53.351 1.00 61.68 C ATOM 1041 OE1 GLU A 105 30.605 12.891 54.192 1.00 64.86 O ATOM 1042 OE2 GLU A 105 28.870 14.143 53.658 1.00 64.68 O ATOM 1043 H GLU A 105 30.726 11.408 49.923 1.00 0.00 H ATOM 1044 N GLU A 106 33.930 11.260 50.281 1.00 18.07 N ATOM 1045 CA GLU A 106 35.304 10.778 50.391 1.00 30.24 C ATOM 1046 C GLU A 106 36.022 10.845 49.044 1.00 30.22 C ATOM 1047 O GLU A 106 37.240 11.006 48.989 1.00 40.28 O ATOM 1048 CB GLU A 106 35.345 9.347 50.929 1.00 35.06 C ATOM 1049 CG GLU A 106 34.962 8.273 49.917 1.00 50.75 C ATOM 1050 CD GLU A 106 35.278 6.863 50.402 1.00 67.01 C ATOM 1051 OE1 GLU A 106 34.689 6.434 51.421 1.00 72.78 O ATOM 1052 OE2 GLU A 106 36.141 6.201 49.779 1.00 72.07 O ATOM 1053 H GLU A 106 33.146 10.577 50.284 1.00 0.00 H ATOM 1054 N ILE A 107 35.264 10.676 47.967 1.00 21.70 N ATOM 1055 CA ILE A 107 35.779 10.825 46.616 1.00 18.82 C ATOM 1056 C ILE A 107 35.768 12.287 46.243 1.00 20.70 C ATOM 1057 O ILE A 107 36.705 12.785 45.630 1.00 24.12 O ATOM 1058 CB ILE A 107 34.947 10.034 45.598 1.00 18.85 C ATOM 1059 CG1 ILE A 107 35.099 8.537 45.830 1.00 24.45 C ATOM 1060 CG2 ILE A 107 35.374 10.342 44.182 1.00 15.11 C ATOM 1061 CD1 ILE A 107 34.294 7.761 44.816 1.00 39.13 C ATOM 1062 H ILE A 107 34.262 10.427 48.095 1.00 0.00 H ATOM 1063 N GLY A 108 34.689 12.970 46.617 1.00 18.01 N ATOM 1064 CA GLY A 108 34.542 14.379 46.307 1.00 15.91 C ATOM 1065 C GLY A 108 35.686 15.218 46.836 1.00 20.54 C ATOM 1066 O GLY A 108 36.137 16.145 46.172 1.00 25.53 O ATOM 1067 H GLY A 108 33.935 12.483 47.143 1.00 0.00 H ATOM 1068 N GLU A 109 36.163 14.889 48.028 1.00 20.00 N ATOM 1069 CA GLU A 109 37.250 15.643 48.637 1.00 27.59 C ATOM 1070 C GLU A 109 38.560 15.434 47.899 1.00 30.67 C ATOM 1071 O GLU A 109 39.388 16.335 47.808 1.00 34.30 O ATOM 1072 CB GLU A 109 37.412 15.269 50.102 1.00 20.11 C ATOM 1073 CG GLU A 109 36.314 15.833 50.979 1.00 22.33 C ATOM 1074 CD GLU A 109 36.224 15.082 52.302 1.00 24.86 C ATOM 1075 OE1 GLU A 109 36.887 14.027 52.427 1.00 31.51 O ATOM 1076 OE2 GLU A 109 35.506 15.535 53.212 1.00 26.87 O ATOM 1077 H GLU A 109 35.754 14.079 48.537 1.00 0.00 H ATOM 1078 N GLU A 110 38.769 14.216 47.416 1.00 35.90 N ATOM 1079 CA GLU A 110 39.984 13.900 46.685 1.00 20.95 C ATOM 1080 C GLU A 110 40.017 14.600 45.339 1.00 16.74 C ATOM 1081 O GLU A 110 41.031 15.179 44.954 1.00 18.79 O ATOM 1082 CB GLU A 110 40.081 12.385 46.522 1.00 14.08 C ATOM 1083 CG GLU A 110 40.383 11.721 47.851 1.00 25.85 C ATOM 1084 CD GLU A 110 40.358 10.220 47.789 1.00 39.36 C ATOM 1085 OE1 GLU A 110 40.532 9.662 46.686 1.00 52.01 O ATOM 1086 OE2 GLU A 110 40.240 9.598 48.862 1.00 36.31 O ATOM 1087 H GLU A 110 38.052 13.477 47.563 1.00 0.00 H ATOM 1088 N VAL A 111 38.880 14.567 44.656 1.00 18.99 N ATOM 1089 CA VAL A 111 38.696 15.203 43.362 1.00 22.68 C ATOM 1090 C VAL A 111 38.802 16.720 43.447 1.00 24.46 C ATOM 1091 O VAL A 111 39.405 17.361 42.582 1.00 19.07 O ATOM 1092 CB VAL A 111 37.316 14.797 42.760 1.00 31.99 C ATOM 1093 CG1 VAL A 111 36.731 15.865 41.826 1.00 18.75 C ATOM 1094 CG2 VAL A 111 37.377 13.399 42.128 1.00 32.95 C ATOM 1095 H VAL A 111 38.074 14.057 45.070 1.00 0.00 H ATOM 1096 N ASP A 112 38.200 17.285 44.486 1.00 24.93 N ATOM 1097 CA ASP A 112 38.147 18.731 44.654 1.00 39.62 C ATOM 1098 C ASP A 112 39.529 19.327 44.858 1.00 34.70 C ATOM 1099 O ASP A 112 39.689 20.528 44.752 1.00 33.58 O ATOM 1100 CB ASP A 112 37.224 19.121 45.811 1.00 45.08 C ATOM 1101 CG ASP A 112 35.742 18.986 45.449 1.00 51.23 C ATOM 1102 OD1 ASP A 112 35.423 18.839 44.244 1.00 37.78 O ATOM 1103 OD2 ASP A 112 34.894 19.044 46.370 1.00 59.25 O ATOM 1104 H ASP A 112 37.753 16.677 45.202 1.00 0.00 H ATOM 1105 N GLU A 113 40.510 18.498 45.202 1.00 33.87 N ATOM 1106 CA GLU A 113 41.864 18.991 45.462 1.00 32.96 C ATOM 1107 C GLU A 113 42.485 19.598 44.192 1.00 28.13 C ATOM 1108 O GLU A 113 43.097 20.669 44.232 1.00 37.91 O ATOM 1109 CB GLU A 113 42.737 17.856 46.005 1.00 31.06 C ATOM 1110 CG GLU A 113 44.152 18.272 46.445 1.00 38.19 C ATOM 1111 CD GLU A 113 45.146 18.306 45.310 1.00 44.81 C ATOM 1112 OE1 GLU A 113 44.819 17.784 44.223 1.00 45.92 O ATOM 1113 OE2 GLU A 113 46.254 18.857 45.508 1.00 51.32 O ATOM 1114 H GLU A 113 40.312 17.481 45.288 1.00 0.00 H ATOM 1115 N ARG A 114 42.328 18.910 43.067 1.00 18.57 N ATOM 1116 CA ARG A 114 42.786 19.436 41.794 1.00 27.45 C ATOM 1117 C ARG A 114 41.992 20.683 41.381 1.00 30.12 C ATOM 1118 O ARG A 114 42.561 21.618 40.813 1.00 32.60 O ATOM 1119 CB ARG A 114 42.691 18.358 40.698 1.00 34.68 C ATOM 1120 CG ARG A 114 42.969 18.874 39.276 1.00 40.34 C ATOM 1121 CD ARG A 114 44.290 19.651 39.144 1.00 43.77 C ATOM 1122 NE ARG A 114 45.444 18.936 39.674 1.00 51.19 N ATOM 1123 CZ ARG A 114 46.363 18.351 38.913 1.00 49.67 C ATOM 1124 NH1 ARG A 114 46.284 18.446 37.591 1.00 41.08 N ATOM 1125 NH2 ARG A 114 47.386 17.716 39.477 1.00 56.31 N ATOM 1126 HE ARG A 114 45.555 18.880 40.707 1.00 0.00 H ATOM 1127 HH12 ARG A 114 47.002 17.989 36.993 1.00 0.00 H ATOM 1128 HH11 ARG A 114 45.504 18.977 37.153 1.00 0.00 H ATOM 1129 HH22 ARG A 114 48.106 17.258 38.882 1.00 0.00 H ATOM 1130 HH21 ARG A 114 47.467 17.677 40.513 1.00 0.00 H ATOM 1131 H ARG A 114 41.869 17.978 43.099 1.00 0.00 H ATOM 1132 N TYR A 115 40.697 20.719 41.693 1.00 22.53 N ATOM 1133 CA TYR A 115 39.901 21.909 41.404 1.00 27.05 C ATOM 1134 C TYR A 115 40.436 23.070 42.233 1.00 32.09 C ATOM 1135 O TYR A 115 40.555 24.190 41.745 1.00 34.17 O ATOM 1136 CB TYR A 115 38.428 21.686 41.731 1.00 24.81 C ATOM 1137 CG TYR A 115 37.696 20.838 40.714 1.00 25.72 C ATOM 1138 CD1 TYR A 115 37.945 20.962 39.355 1.00 22.92 C ATOM 1139 CD2 TYR A 115 36.786 19.871 41.130 1.00 26.57 C ATOM 1140 CE1 TYR A 115 37.276 20.158 38.424 1.00 26.76 C ATOM 1141 CE2 TYR A 115 36.117 19.058 40.216 1.00 29.17 C ATOM 1142 CZ TYR A 115 36.367 19.208 38.869 1.00 29.15 C ATOM 1143 OH TYR A 115 35.698 18.409 37.977 1.00 27.61 O ATOM 1144 HH TYR A 115 34.724 18.559 38.068 1.00 0.00 H ATOM 1145 H TYR A 115 40.251 19.895 42.145 1.00 0.00 H ATOM 1146 N ASP A 116 40.768 22.796 43.493 1.00 29.03 N ATOM 1147 CA ASP A 116 41.337 23.823 44.364 1.00 31.64 C ATOM 1148 C ASP A 116 42.705 24.298 43.884 1.00 33.33 C ATOM 1149 O ASP A 116 43.013 25.485 43.955 1.00 40.09 O ATOM 1150 CB ASP A 116 41.461 23.314 45.797 1.00 36.06 C ATOM 1151 CG ASP A 116 40.117 23.178 46.480 1.00 46.79 C ATOM 1152 OD1 ASP A 116 39.120 23.746 45.971 1.00 43.65 O ATOM 1153 OD2 ASP A 116 40.067 22.522 47.545 1.00 51.82 O ATOM 1154 H ASP A 116 40.620 21.836 43.864 1.00 0.00 H ATOM 1155 N ALA A 117 43.525 23.368 43.400 1.00 30.22 N ATOM 1156 CA ALA A 117 44.862 23.711 42.934 1.00 31.61 C ATOM 1157 C ALA A 117 44.767 24.626 41.721 1.00 37.10 C ATOM 1158 O ALA A 117 45.462 25.629 41.645 1.00 38.89 O ATOM 1159 CB ALA A 117 45.662 22.447 42.605 1.00 30.59 C ATOM 1160 H ALA A 117 43.206 22.379 43.354 1.00 0.00 H ATOM 1161 N ILE A 118 43.884 24.286 40.788 1.00 34.66 N ATOM 1162 CA ILE A 118 43.651 25.120 39.610 1.00 35.59 C ATOM 1163 C ILE A 118 43.111 26.493 40.014 1.00 38.58 C ATOM 1164 O ILE A 118 43.491 27.519 39.443 1.00 35.68 O ATOM 1165 CB ILE A 118 42.651 24.459 38.635 1.00 30.52 C ATOM 1166 CG1 ILE A 118 43.150 23.087 38.198 1.00 27.85 C ATOM 1167 CG2 ILE A 118 42.405 25.349 37.423 1.00 29.48 C ATOM 1168 CD1 ILE A 118 42.129 22.303 37.391 1.00 26.04 C ATOM 1169 H ILE A 118 43.345 23.404 40.899 1.00 0.00 H ATOM 1170 N GLU A 119 42.216 26.502 40.999 1.00 41.90 N ATOM 1171 CA GLU A 119 41.585 27.738 41.453 1.00 40.01 C ATOM 1172 C GLU A 119 42.547 28.668 42.166 1.00 44.93 C ATOM 1173 O GLU A 119 42.410 29.883 42.080 1.00 45.48 O ATOM 1174 CB GLU A 119 40.396 27.430 42.363 1.00 37.13 C ATOM 1175 CG GLU A 119 39.643 28.665 42.810 1.00 46.40 C ATOM 1176 CD GLU A 119 38.375 28.337 43.574 1.00 56.08 C ATOM 1177 OE1 GLU A 119 38.036 27.135 43.689 1.00 61.14 O ATOM 1178 OE2 GLU A 119 37.722 29.286 44.067 1.00 57.54 O ATOM 1179 H GLU A 119 41.959 25.605 41.458 1.00 0.00 H ATOM 1180 N GLU A 120 43.532 28.106 42.857 1.00 55.27 N ATOM 1181 CA GLU A 120 44.534 28.932 43.515 1.00 56.13 C ATOM 1182 C GLU A 120 45.485 29.536 42.495 1.00 52.88 C ATOM 1183 O GLU A 120 46.091 30.579 42.736 1.00 59.53 O ATOM 1184 CB GLU A 120 45.323 28.109 44.536 1.00 63.12 C ATOM 1185 CG GLU A 120 44.520 27.716 45.762 1.00 75.27 C ATOM 1186 CD GLU A 120 45.260 26.748 46.669 1.00 80.19 C ATOM 1187 OE1 GLU A 120 46.372 26.313 46.296 1.00 82.37 O ATOM 1188 OE2 GLU A 120 44.722 26.414 47.748 1.00 80.88 O ATOM 1189 H GLU A 120 43.588 27.070 42.928 1.00 0.00 H ATOM 1190 N VAL A 121 45.584 28.885 41.343 1.00 39.73 N ATOM 1191 CA VAL A 121 46.468 29.331 40.273 1.00 41.96 C ATOM 1192 C VAL A 121 45.761 30.251 39.265 1.00 43.38 C ATOM 1193 O VAL A 121 46.261 31.328 38.931 1.00 38.01 O ATOM 1194 CB VAL A 121 47.083 28.120 39.553 1.00 38.81 C ATOM 1195 CG1 VAL A 121 47.938 28.563 38.405 1.00 35.34 C ATOM 1196 CG2 VAL A 121 47.913 27.311 40.532 1.00 41.64 C ATOM 1197 H VAL A 121 45.012 28.028 41.199 1.00 0.00 H ATOM 1198 N LEU A 122 44.595 29.822 38.793 1.00 44.76 N ATOM 1199 CA LEU A 122 43.824 30.581 37.811 1.00 37.20 C ATOM 1200 C LEU A 122 43.139 31.781 38.460 1.00 30.11 C ATOM 1201 O LEU A 122 42.930 32.803 37.810 1.00 36.54 O ATOM 1202 CB LEU A 122 42.791 29.674 37.135 1.00 36.61 C ATOM 1203 CG LEU A 122 42.027 30.179 35.909 1.00 44.80 C ATOM 1204 CD1 LEU A 122 42.964 30.461 34.751 1.00 46.75 C ATOM 1205 CD2 LEU A 122 40.955 29.165 35.490 1.00 45.02 C ATOM 1206 H LEU A 122 44.218 28.915 39.134 1.00 0.00 H ATOM 1207 N GLY A 123 42.768 31.661 39.730 1.00 45.14 N ATOM 1208 CA GLY A 123 42.053 32.741 40.391 1.00 44.68 C ATOM 1209 C GLY A 123 40.578 32.395 40.478 1.00 38.58 C ATOM 1210 O GLY A 123 40.045 31.799 39.544 1.00 33.22 O ATOM 1211 H GLY A 123 42.990 30.790 40.254 1.00 0.00 H ATOM 1212 N ARG A 124 39.925 32.758 41.582 1.00 42.39 N ATOM 1213 CA ARG A 124 38.512 32.422 41.801 1.00 47.68 C ATOM 1214 C ARG A 124 37.586 33.068 40.770 1.00 43.12 C ATOM 1215 O ARG A 124 36.629 32.447 40.307 1.00 44.20 O ATOM 1216 CB ARG A 124 38.079 32.815 43.219 1.00 55.58 C ATOM 1217 CG ARG A 124 36.573 32.715 43.469 1.00 59.81 C ATOM 1218 CD ARG A 124 36.250 32.847 44.948 1.00 70.01 C ATOM 1219 NE ARG A 124 36.589 31.630 45.690 1.00 76.15 N ATOM 1220 CZ ARG A 124 36.308 31.428 46.977 1.00 80.45 C ATOM 1221 NH1 ARG A 124 35.693 32.369 47.681 1.00 85.32 N ATOM 1222 NH2 ARG A 124 36.654 30.291 47.566 1.00 79.77 N ATOM 1223 HE ARG A 124 37.083 30.872 45.177 1.00 0.00 H ATOM 1224 HH12 ARG A 124 35.475 32.208 48.685 1.00 0.00 H ATOM 1225 HH11 ARG A 124 35.429 33.267 47.229 1.00 0.00 H ATOM 1226 HH22 ARG A 124 36.433 30.137 48.571 1.00 0.00 H ATOM 1227 HH21 ARG A 124 37.146 29.553 47.023 1.00 0.00 H ATOM 1228 H ARG A 124 40.433 33.297 42.312 1.00 0.00 H ATOM 1229 N GLU A 125 37.890 34.314 40.415 1.00 42.42 N ATOM 1230 CA GLU A 125 37.112 35.088 39.454 1.00 41.24 C ATOM 1231 C GLU A 125 37.049 34.408 38.096 1.00 37.83 C ATOM 1232 O GLU A 125 35.970 34.241 37.521 1.00 37.89 O ATOM 1233 CB GLU A 125 37.719 36.496 39.307 1.00 45.85 C ATOM 1234 CG GLU A 125 37.061 37.392 38.246 1.00 52.32 C ATOM 1235 CD GLU A 125 37.497 38.865 38.337 1.00 64.61 C ATOM 1236 OE1 GLU A 125 38.077 39.259 39.372 1.00 74.17 O ATOM 1237 OE2 GLU A 125 37.248 39.635 37.378 1.00 63.72 O ATOM 1238 H GLU A 125 38.726 34.759 40.845 1.00 0.00 H ATOM 1239 N LYS A 126 38.207 33.990 37.594 1.00 34.64 N ATOM 1240 CA LYS A 126 38.273 33.322 36.298 1.00 39.83 C ATOM 1241 C LYS A 126 37.572 31.975 36.340 1.00 39.78 C ATOM 1242 O LYS A 126 36.859 31.601 35.406 1.00 40.13 O ATOM 1243 CB LYS A 126 39.726 33.140 35.866 1.00 42.18 C ATOM 1244 CG LYS A 126 40.357 34.402 35.308 1.00 44.54 C ATOM 1245 CD LYS A 126 41.759 34.115 34.792 1.00 45.26 C ATOM 1246 CE LYS A 126 42.412 35.381 34.298 1.00 42.25 C ATOM 1247 NZ LYS A 126 43.849 35.163 33.974 1.00 47.38 N ATOM 1248 HZ1 LYS A 126 44.351 34.844 34.827 1.00 0.00 H ATOM 1249 HZ2 LYS A 126 43.930 34.439 33.232 1.00 0.00 H ATOM 1250 HZ3 LYS A 126 44.266 36.054 33.637 1.00 0.00 H ATOM 1251 H LYS A 126 39.082 34.142 38.135 1.00 0.00 H HETATM 1252 N MSE A 127 37.794 31.256 37.434 1.00 41.39 N HETATM 1253 CA MSE A 127 37.176 29.957 37.678 1.00 37.26 C HETATM 1254 C MSE A 127 35.658 30.048 37.596 1.00 35.01 C HETATM 1255 O MSE A 127 35.015 29.227 36.929 1.00 32.28 O HETATM 1256 CB MSE A 127 37.597 29.441 39.053 1.00 40.14 C HETATM 1257 CG MSE A 127 37.175 28.029 39.360 1.00 48.87 C HETATM 1258 SE MSE A 127 38.153 26.796 38.234 1.00 85.57 S HETATM 1259 CE MSE A 127 39.915 27.558 38.437 1.00 66.16 C HETATM 1260 H MSE A 127 38.441 31.638 38.153 1.00 0.00 H ATOM 1261 N LEU A 128 35.095 31.050 38.281 1.00 29.41 N ATOM 1262 CA LEU A 128 33.657 31.299 38.223 1.00 29.94 C ATOM 1263 C LEU A 128 33.210 31.604 36.815 1.00 23.50 C ATOM 1264 O LEU A 128 32.227 31.043 36.345 1.00 22.55 O ATOM 1265 CB LEU A 128 33.254 32.465 39.134 1.00 29.66 C ATOM 1266 CG LEU A 128 32.944 32.117 40.580 1.00 45.33 C ATOM 1267 CD1 LEU A 128 32.871 33.367 41.461 1.00 37.72 C ATOM 1268 CD2 LEU A 128 31.630 31.349 40.592 1.00 49.94 C ATOM 1269 H LEU A 128 35.694 31.665 38.868 1.00 0.00 H ATOM 1270 N LEU A 129 33.963 32.462 36.137 1.00 22.87 N ATOM 1271 CA LEU A 129 33.664 32.825 34.756 1.00 21.08 C ATOM 1272 C LEU A 129 33.622 31.619 33.837 1.00 18.64 C ATOM 1273 O LEU A 129 32.722 31.507 33.008 1.00 23.21 O ATOM 1274 CB LEU A 129 34.689 33.816 34.233 1.00 21.60 C ATOM 1275 CG LEU A 129 34.313 34.551 32.949 1.00 32.78 C ATOM 1276 CD1 LEU A 129 32.946 35.190 33.072 1.00 33.53 C ATOM 1277 CD2 LEU A 129 35.351 35.603 32.638 1.00 30.70 C ATOM 1278 H LEU A 129 34.789 32.887 36.604 1.00 0.00 H ATOM 1279 N LEU A 130 34.578 30.708 34.000 1.00 18.22 N ATOM 1280 CA LEU A 130 34.635 29.537 33.147 1.00 26.45 C ATOM 1281 C LEU A 130 33.407 28.664 33.399 1.00 23.99 C ATOM 1282 O LEU A 130 32.753 28.230 32.453 1.00 17.35 O ATOM 1283 CB LEU A 130 35.930 28.740 33.373 1.00 17.43 C ATOM 1284 CG LEU A 130 36.003 27.463 32.539 1.00 16.87 C ATOM 1285 CD1 LEU A 130 35.872 27.833 31.087 1.00 25.72 C ATOM 1286 CD2 LEU A 130 37.306 26.712 32.754 1.00 26.92 C ATOM 1287 H LEU A 130 35.291 30.837 34.746 1.00 0.00 H ATOM 1288 N LYS A 131 33.088 28.433 34.672 1.00 18.34 N ATOM 1289 CA LYS A 131 31.900 27.672 35.040 1.00 19.28 C ATOM 1290 C LYS A 131 30.609 28.294 34.525 1.00 27.60 C ATOM 1291 O LYS A 131 29.675 27.580 34.159 1.00 26.21 O ATOM 1292 CB LYS A 131 31.789 27.516 36.559 1.00 23.50 C ATOM 1293 CG LYS A 131 32.707 26.494 37.190 1.00 23.82 C ATOM 1294 CD LYS A 131 32.652 26.576 38.702 1.00 26.78 C ATOM 1295 CE LYS A 131 33.697 25.672 39.349 1.00 32.22 C ATOM 1296 NZ LYS A 131 33.701 25.792 40.838 1.00 38.84 N ATOM 1297 HZ1 LYS A 131 33.913 26.775 41.105 1.00 0.00 H ATOM 1298 HZ2 LYS A 131 32.767 25.524 41.209 1.00 0.00 H ATOM 1299 HZ3 LYS A 131 34.426 25.160 41.234 1.00 0.00 H ATOM 1300 H LYS A 131 33.703 28.806 35.423 1.00 0.00 H ATOM 1301 N ASP A 132 30.539 29.619 34.527 1.00 19.74 N ATOM 1302 CA ASP A 132 29.327 30.281 34.091 1.00 20.70 C ATOM 1303 C ASP A 132 29.204 30.213 32.575 1.00 21.82 C ATOM 1304 O ASP A 132 28.104 30.048 32.065 1.00 24.80 O ATOM 1305 CB ASP A 132 29.264 31.725 34.597 1.00 25.29 C ATOM 1306 CG ASP A 132 29.011 31.799 36.092 1.00 43.28 C ATOM 1307 OD1 ASP A 132 28.344 30.889 36.644 1.00 45.75 O ATOM 1308 OD2 ASP A 132 29.491 32.761 36.725 1.00 52.13 O ATOM 1309 H ASP A 132 31.355 30.182 34.842 1.00 0.00 H ATOM 1310 N LEU A 133 30.318 30.337 31.857 1.00 18.39 N ATOM 1311 CA LEU A 133 30.277 30.289 30.403 1.00 16.18 C ATOM 1312 C LEU A 133 29.924 28.893 29.895 1.00 25.16 C ATOM 1313 O LEU A 133 29.118 28.759 28.970 1.00 16.03 O ATOM 1314 CB LEU A 133 31.613 30.727 29.811 1.00 20.23 C ATOM 1315 CG LEU A 133 31.958 32.213 30.001 1.00 24.13 C ATOM 1316 CD1 LEU A 133 33.307 32.571 29.383 1.00 16.71 C ATOM 1317 CD2 LEU A 133 30.825 33.140 29.528 1.00 27.46 C ATOM 1318 H LEU A 133 31.229 30.470 32.341 1.00 0.00 H ATOM 1319 N LEU A 134 30.501 27.862 30.520 1.00 15.28 N ATOM 1320 CA LEU A 134 30.159 26.483 30.196 1.00 15.56 C ATOM 1321 C LEU A 134 28.673 26.234 30.381 1.00 20.38 C ATOM 1322 O LEU A 134 28.044 25.645 29.515 1.00 17.58 O ATOM 1323 CB LEU A 134 30.938 25.503 31.073 1.00 16.03 C ATOM 1324 CG LEU A 134 32.431 25.491 30.798 1.00 20.54 C ATOM 1325 CD1 LEU A 134 33.144 24.615 31.821 1.00 22.30 C ATOM 1326 CD2 LEU A 134 32.644 25.012 29.370 1.00 15.37 C ATOM 1327 H LEU A 134 31.212 28.049 31.256 1.00 0.00 H ATOM 1328 N ALA A 135 28.118 26.736 31.486 1.00 18.33 N ATOM 1329 CA ALA A 135 26.699 26.599 31.778 1.00 20.71 C ATOM 1330 C ALA A 135 25.835 27.366 30.771 1.00 24.23 C ATOM 1331 O ALA A 135 24.738 26.924 30.439 1.00 28.05 O ATOM 1332 CB ALA A 135 26.401 27.063 33.179 1.00 22.82 C ATOM 1333 H ALA A 135 28.722 27.244 32.163 1.00 0.00 H ATOM 1334 N GLU A 136 26.309 28.522 30.312 1.00 20.34 N ATOM 1335 CA GLU A 136 25.560 29.298 29.319 1.00 25.51 C ATOM 1336 C GLU A 136 25.589 28.619 27.953 1.00 25.99 C ATOM 1337 O GLU A 136 24.613 28.659 27.209 1.00 33.51 O ATOM 1338 CB GLU A 136 26.089 30.733 29.211 1.00 23.86 C ATOM 1339 CG GLU A 136 25.727 31.593 30.426 1.00 37.78 C ATOM 1340 CD GLU A 136 26.060 33.064 30.258 1.00 48.66 C ATOM 1341 OE1 GLU A 136 26.198 33.522 29.102 1.00 54.03 O ATOM 1342 OE2 GLU A 136 26.185 33.763 31.289 1.00 54.36 O ATOM 1343 H GLU A 136 27.221 28.879 30.662 1.00 0.00 H ATOM 1344 N LEU A 137 26.707 28.003 27.616 1.00 18.82 N ATOM 1345 CA LEU A 137 26.792 27.254 26.375 1.00 27.29 C ATOM 1346 C LEU A 137 25.951 25.979 26.459 1.00 31.88 C ATOM 1347 O LEU A 137 25.286 25.570 25.498 1.00 35.38 O ATOM 1348 CB LEU A 137 28.246 26.947 26.058 1.00 27.83 C ATOM 1349 CG LEU A 137 28.513 26.181 24.786 1.00 26.10 C ATOM 1350 CD1 LEU A 137 27.737 26.876 23.684 1.00 39.04 C ATOM 1351 CD2 LEU A 137 29.981 26.330 24.519 1.00 18.02 C ATOM 1352 H LEU A 137 27.534 28.055 28.245 1.00 0.00 H ATOM 1353 N ALA A 138 25.964 25.367 27.633 1.00 31.47 N ATOM 1354 CA ALA A 138 25.252 24.132 27.848 1.00 37.80 C ATOM 1355 C ALA A 138 23.738 24.339 27.864 1.00 40.95 C ATOM 1356 O ALA A 138 22.981 23.446 27.472 1.00 34.34 O ATOM 1357 CB ALA A 138 25.712 23.495 29.141 1.00 40.17 C ATOM 1358 H ALA A 138 26.501 25.787 28.419 1.00 0.00 H ATOM 1359 N LYS A 139 23.294 25.513 28.305 1.00 47.09 N ATOM 1360 CA LYS A 139 21.857 25.759 28.455 1.00 47.61 C ATOM 1361 C LYS A 139 21.264 26.307 27.176 1.00 47.06 C ATOM 1362 O LYS A 139 20.074 26.602 27.122 1.00 53.92 O ATOM 1363 CB LYS A 139 21.537 26.671 29.651 1.00 55.61 C ATOM 1364 CG LYS A 139 22.008 28.108 29.588 1.00 59.53 C ATOM 1365 CD LYS A 139 21.596 28.827 30.878 1.00 60.66 C ATOM 1366 CE LYS A 139 22.382 30.107 31.096 1.00 63.95 C ATOM 1367 NZ LYS A 139 22.036 30.755 32.393 1.00 71.14 N ATOM 1368 HZ1 LYS A 139 21.022 30.988 32.403 1.00 0.00 H ATOM 1369 HZ2 LYS A 139 22.251 30.102 33.174 1.00 0.00 H ATOM 1370 HZ3 LYS A 139 22.594 31.626 32.504 1.00 0.00 H ATOM 1371 H LYS A 139 23.973 26.263 28.546 1.00 0.00 H ATOM 1372 N ILE A 140 22.100 26.475 26.158 1.00 46.00 N ATOM 1373 CA ILE A 140 21.594 26.824 24.838 1.00 53.57 C ATOM 1374 C ILE A 140 20.658 25.729 24.364 1.00 69.92 C ATOM 1375 O ILE A 140 21.028 24.552 24.316 1.00 68.15 O ATOM 1376 CB ILE A 140 22.718 26.997 23.810 1.00 51.39 C ATOM 1377 CG1 ILE A 140 23.579 28.194 24.185 1.00 57.48 C ATOM 1378 CG2 ILE A 140 22.141 27.237 22.438 1.00 55.30 C ATOM 1379 CD1 ILE A 140 22.773 29.449 24.451 1.00 64.81 C ATOM 1380 H ILE A 140 23.123 26.357 26.304 1.00 0.00 H ATOM 1381 N GLU A 141 19.435 26.144 24.042 1.00 49.59 N ATOM 1382 CA GLU A 141 18.343 25.255 23.650 1.00 57.78 C ATOM 1383 C GLU A 141 17.960 24.347 24.814 1.00 61.45 C ATOM 1384 O GLU A 141 17.254 24.774 25.731 1.00 64.38 O ATOM 1385 CB GLU A 141 18.716 24.429 22.412 1.00 63.38 C ATOM 1386 CG GLU A 141 18.985 25.290 21.186 1.00 71.55 C ATOM 1387 CD GLU A 141 17.768 26.090 20.742 1.00 79.26 C ATOM 1388 OE1 GLU A 141 16.624 25.660 21.020 1.00 79.37 O ATOM 1389 OE2 GLU A 141 17.962 27.173 20.144 1.00 83.30 O ATOM 1390 H GLU A 141 19.244 27.166 24.071 1.00 0.00 H TER 1391 GLU A 141 ATOM 1392 N SER B 9 31.422 21.887 39.260 1.00 43.82 N ATOM 1393 CA SER B 9 32.200 20.821 38.652 1.00 28.39 C ATOM 1394 C SER B 9 32.539 21.164 37.206 1.00 27.98 C ATOM 1395 O SER B 9 31.691 21.083 36.317 1.00 29.21 O ATOM 1396 CB SER B 9 31.447 19.504 38.730 1.00 30.62 C ATOM 1397 OG SER B 9 32.134 18.501 38.014 1.00 28.81 O ATOM 1398 HG SER B 9 32.215 18.771 37.065 1.00 0.00 H ATOM 1399 HN3 SER B 9 30.538 22.017 38.727 1.00 0.00 H ATOM 1400 HN2 SER B 9 31.972 22.770 39.242 1.00 0.00 H ATOM 1401 HN1 SER B 9 31.201 21.635 40.244 1.00 0.00 H ATOM 1402 N ILE B 10 33.801 21.518 36.981 1.00 25.50 N ATOM 1403 CA ILE B 10 34.275 21.861 35.657 1.00 29.76 C ATOM 1404 C ILE B 10 34.104 20.662 34.739 1.00 26.20 C ATOM 1405 O ILE B 10 33.686 20.812 33.592 1.00 31.54 O ATOM 1406 CB ILE B 10 35.761 22.290 35.696 1.00 29.37 C ATOM 1407 CG1 ILE B 10 35.926 23.544 36.553 1.00 36.10 C ATOM 1408 CG2 ILE B 10 36.294 22.553 34.302 1.00 25.64 C ATOM 1409 CD1 ILE B 10 35.358 24.774 35.909 1.00 36.54 C ATOM 1410 H ILE B 10 34.467 21.549 37.779 1.00 0.00 H ATOM 1411 N ASN B 11 34.357 19.472 35.281 1.00 27.88 N ATOM 1412 CA ASN B 11 34.196 18.212 34.548 1.00 20.88 C ATOM 1413 C ASN B 11 32.822 18.051 33.936 1.00 23.42 C ATOM 1414 O ASN B 11 32.688 17.957 32.715 1.00 32.52 O ATOM 1415 CB ASN B 11 34.501 17.048 35.492 1.00 19.45 C ATOM 1416 CG ASN B 11 34.126 15.678 34.924 1.00 27.26 C ATOM 1417 OD1 ASN B 11 34.301 15.397 33.736 1.00 34.00 O ATOM 1418 ND2 ASN B 11 33.629 14.802 35.804 1.00 26.68 N ATOM 1419 HD22 ASN B 11 33.497 15.081 36.797 1.00 0.00 H ATOM 1420 HD21 ASN B 11 33.374 13.842 35.495 1.00 0.00 H ATOM 1421 H ASN B 11 34.683 19.435 36.268 1.00 0.00 H ATOM 1422 N ILE B 12 31.806 18.062 34.793 1.00 25.59 N ATOM 1423 CA ILE B 12 30.423 17.966 34.368 1.00 24.70 C ATOM 1424 C ILE B 12 30.023 19.131 33.451 1.00 29.04 C ATOM 1425 O ILE B 12 29.359 18.934 32.437 1.00 30.89 O ATOM 1426 CB ILE B 12 29.506 17.907 35.603 1.00 28.13 C ATOM 1427 CG1 ILE B 12 29.584 16.498 36.210 1.00 26.28 C ATOM 1428 CG2 ILE B 12 28.056 18.214 35.236 1.00 23.95 C ATOM 1429 CD1 ILE B 12 28.975 16.387 37.570 1.00 25.93 C ATOM 1430 H ILE B 12 32.011 18.143 35.809 1.00 0.00 H ATOM 1431 N GLY B 13 30.473 20.333 33.783 1.00 25.73 N ATOM 1432 CA GLY B 13 30.199 21.498 32.962 1.00 23.50 C ATOM 1433 C GLY B 13 30.776 21.350 31.569 1.00 27.12 C ATOM 1434 O GLY B 13 30.140 21.747 30.595 1.00 29.32 O ATOM 1435 H GLY B 13 31.035 20.444 34.651 1.00 0.00 H ATOM 1436 N LEU B 14 31.980 20.784 31.476 1.00 21.14 N ATOM 1437 CA LEU B 14 32.630 20.585 30.192 1.00 22.15 C ATOM 1438 C LEU B 14 31.866 19.627 29.289 1.00 23.44 C ATOM 1439 O LEU B 14 31.683 19.903 28.099 1.00 27.15 O ATOM 1440 CB LEU B 14 34.074 20.072 30.387 1.00 17.27 C ATOM 1441 CG LEU B 14 35.115 21.069 30.885 1.00 17.46 C ATOM 1442 CD1 LEU B 14 36.417 20.381 31.195 1.00 24.46 C ATOM 1443 CD2 LEU B 14 35.355 22.181 29.843 1.00 20.83 C ATOM 1444 H LEU B 14 32.465 20.478 32.343 1.00 0.00 H ATOM 1445 N ILE B 15 31.390 18.520 29.849 1.00 25.61 N ATOM 1446 CA ILE B 15 30.668 17.532 29.052 1.00 26.29 C ATOM 1447 C ILE B 15 29.276 18.040 28.637 1.00 25.97 C ATOM 1448 O ILE B 15 28.791 17.704 27.558 1.00 30.59 O ATOM 1449 CB ILE B 15 30.546 16.175 29.779 1.00 30.42 C ATOM 1450 CG1 ILE B 15 30.292 15.063 28.760 1.00 28.60 C ATOM 1451 CG2 ILE B 15 29.446 16.187 30.813 1.00 31.29 C ATOM 1452 CD1 ILE B 15 30.093 13.715 29.406 1.00 32.76 C ATOM 1453 H ILE B 15 31.533 18.355 30.866 1.00 0.00 H ATOM 1454 N GLN B 16 28.639 18.838 29.491 1.00 31.33 N ATOM 1455 CA GLN B 16 27.326 19.417 29.183 1.00 31.20 C ATOM 1456 C GLN B 16 27.415 20.458 28.071 1.00 25.50 C ATOM 1457 O GLN B 16 26.555 20.526 27.190 1.00 23.72 O ATOM 1458 CB GLN B 16 26.713 20.055 30.440 1.00 24.78 C ATOM 1459 CG GLN B 16 26.351 19.052 31.512 1.00 24.14 C ATOM 1460 CD GLN B 16 25.756 19.708 32.734 1.00 24.28 C ATOM 1461 OE1 GLN B 16 25.871 20.922 32.909 1.00 30.99 O ATOM 1462 NE2 GLN B 16 25.114 18.911 33.593 1.00 23.66 N ATOM 1463 HE22 GLN B 16 25.043 17.891 33.402 1.00 0.00 H ATOM 1464 HE21 GLN B 16 24.686 19.311 34.452 1.00 0.00 H ATOM 1465 H GLN B 16 29.085 19.058 30.404 1.00 0.00 H ATOM 1466 N ALA B 17 28.475 21.254 28.102 1.00 23.62 N ATOM 1467 CA ALA B 17 28.704 22.255 27.065 1.00 21.83 C ATOM 1468 C ALA B 17 28.950 21.536 25.739 1.00 25.12 C ATOM 1469 O ALA B 17 28.511 21.986 24.676 1.00 38.99 O ATOM 1470 CB ALA B 17 29.868 23.161 27.432 1.00 17.61 C ATOM 1471 H ALA B 17 29.157 21.163 28.882 1.00 0.00 H ATOM 1472 N ARG B 18 29.644 20.405 25.807 1.00 25.04 N ATOM 1473 CA ARG B 18 29.945 19.627 24.610 1.00 26.49 C ATOM 1474 C ARG B 18 28.709 18.965 24.023 1.00 27.31 C ATOM 1475 O ARG B 18 28.516 18.959 22.812 1.00 35.69 O ATOM 1476 CB ARG B 18 30.974 18.542 24.923 1.00 21.48 C ATOM 1477 CG ARG B 18 31.420 17.804 23.689 1.00 32.04 C ATOM 1478 CD ARG B 18 32.259 16.591 24.030 1.00 41.69 C ATOM 1479 NE ARG B 18 32.280 15.639 22.918 1.00 42.21 N ATOM 1480 CZ ARG B 18 32.509 14.337 23.050 1.00 42.60 C ATOM 1481 NH1 ARG B 18 32.743 13.810 24.250 1.00 42.79 N ATOM 1482 NH2 ARG B 18 32.503 13.561 21.980 1.00 44.30 N ATOM 1483 HE ARG B 18 32.104 16.006 21.961 1.00 0.00 H ATOM 1484 HH12 ARG B 18 32.921 12.790 24.344 1.00 0.00 H ATOM 1485 HH11 ARG B 18 32.747 14.419 25.093 1.00 0.00 H ATOM 1486 HH22 ARG B 18 32.682 12.541 22.076 1.00 0.00 H ATOM 1487 HH21 ARG B 18 32.320 13.970 21.042 1.00 0.00 H ATOM 1488 H ARG B 18 29.979 20.068 26.732 1.00 0.00 H ATOM 1489 N GLU B 19 27.859 18.427 24.885 1.00 24.60 N ATOM 1490 CA GLU B 19 26.637 17.783 24.420 1.00 21.65 C ATOM 1491 C GLU B 19 25.733 18.815 23.741 1.00 25.06 C ATOM 1492 O GLU B 19 25.070 18.514 22.751 1.00 31.16 O ATOM 1493 CB GLU B 19 25.913 17.109 25.593 1.00 23.37 C ATOM 1494 CG GLU B 19 24.578 16.455 25.263 1.00 31.88 C ATOM 1495 CD GLU B 19 23.633 16.460 26.466 1.00 47.66 C ATOM 1496 OE1 GLU B 19 23.678 17.438 27.247 1.00 57.26 O ATOM 1497 OE2 GLU B 19 22.849 15.499 26.640 1.00 50.32 O ATOM 1498 H GLU B 19 28.066 18.465 25.904 1.00 0.00 H ATOM 1499 N ALA B 20 25.741 20.041 24.258 1.00 29.40 N ATOM 1500 CA ALA B 20 24.957 21.117 23.658 1.00 32.06 C ATOM 1501 C ALA B 20 25.485 21.513 22.265 1.00 28.21 C ATOM 1502 O ALA B 20 24.705 21.806 21.361 1.00 31.54 O ATOM 1503 CB ALA B 20 24.924 22.321 24.591 1.00 27.31 C ATOM 1504 H ALA B 20 26.315 20.236 25.103 1.00 0.00 H ATOM 1505 N LEU B 21 26.802 21.484 22.079 1.00 28.12 N ATOM 1506 CA LEU B 21 27.383 21.773 20.766 1.00 27.50 C ATOM 1507 C LEU B 21 27.037 20.710 19.751 1.00 34.63 C ATOM 1508 O LEU B 21 26.714 20.999 18.596 1.00 41.24 O ATOM 1509 CB LEU B 21 28.894 21.879 20.850 1.00 25.27 C ATOM 1510 CG LEU B 21 29.482 23.157 21.407 1.00 26.94 C ATOM 1511 CD1 LEU B 21 30.991 23.066 21.225 1.00 29.88 C ATOM 1512 CD2 LEU B 21 28.890 24.348 20.679 1.00 17.91 C ATOM 1513 H LEU B 21 27.428 21.253 22.877 1.00 0.00 H HETATM 1514 N MSE B 22 27.139 19.472 20.206 1.00 32.01 N HETATM 1515 CA MSE B 22 26.802 18.301 19.425 1.00 28.70 C HETATM 1516 C MSE B 22 25.424 18.400 18.775 1.00 32.04 C HETATM 1517 O MSE B 22 25.262 18.074 17.598 1.00 38.05 O HETATM 1518 CB MSE B 22 26.868 17.079 20.332 1.00 36.41 C HETATM 1519 CG MSE B 22 26.939 15.749 19.629 1.00 46.88 C HETATM 1520 SE MSE B 22 26.949 14.348 20.975 1.00131.00 S HETATM 1521 CE MSE B 22 27.776 12.925 19.921 1.00 34.28 C HETATM 1522 H MSE B 22 27.480 19.332 21.178 1.00 0.00 H ATOM 1523 N THR B 23 24.433 18.845 19.542 1.00 33.13 N ATOM 1524 CA THR B 23 23.068 18.955 19.034 1.00 29.27 C ATOM 1525 C THR B 23 22.965 20.022 17.955 1.00 30.57 C ATOM 1526 O THR B 23 22.166 19.908 17.034 1.00 32.90 O ATOM 1527 CB THR B 23 22.071 19.302 20.147 1.00 29.54 C ATOM 1528 OG1 THR B 23 22.197 20.688 20.483 1.00 40.75 O ATOM 1529 CG2 THR B 23 22.342 18.472 21.378 1.00 28.89 C ATOM 1530 HG1 THR B 23 23.119 20.868 20.796 1.00 0.00 H ATOM 1531 H THR B 23 24.634 19.121 20.524 1.00 0.00 H ATOM 1532 N GLN B 24 23.791 21.057 18.072 1.00 29.41 N ATOM 1533 CA GLN B 24 23.828 22.114 17.071 1.00 27.97 C ATOM 1534 C GLN B 24 24.490 21.659 15.789 1.00 26.44 C ATOM 1535 O GLN B 24 24.143 22.131 14.715 1.00 33.01 O ATOM 1536 CB GLN B 24 24.567 23.353 17.609 1.00 24.86 C ATOM 1537 CG GLN B 24 24.002 23.910 18.908 1.00 32.30 C ATOM 1538 CD GLN B 24 22.502 24.136 18.838 1.00 42.65 C ATOM 1539 OE1 GLN B 24 21.762 23.724 19.736 1.00 53.50 O ATOM 1540 NE2 GLN B 24 22.044 24.784 17.769 1.00 35.97 N ATOM 1541 HE22 GLN B 24 22.706 25.113 17.037 1.00 0.00 H ATOM 1542 HE21 GLN B 24 21.024 24.961 17.666 1.00 0.00 H ATOM 1543 H GLN B 24 24.424 21.113 18.895 1.00 0.00 H ATOM 1544 N PHE B 25 25.464 20.761 15.897 1.00 29.40 N ATOM 1545 CA PHE B 25 26.241 20.363 14.724 1.00 25.94 C ATOM 1546 C PHE B 25 25.866 19.011 14.160 1.00 30.88 C ATOM 1547 O PHE B 25 26.227 18.696 13.028 1.00 29.37 O ATOM 1548 CB PHE B 25 27.735 20.421 15.032 1.00 22.50 C ATOM 1549 CG PHE B 25 28.236 21.818 15.213 1.00 29.05 C ATOM 1550 CD1 PHE B 25 28.619 22.566 14.115 1.00 22.92 C ATOM 1551 CD2 PHE B 25 28.291 22.396 16.466 1.00 26.13 C ATOM 1552 CE1 PHE B 25 29.073 23.849 14.270 1.00 24.83 C ATOM 1553 CE2 PHE B 25 28.744 23.683 16.626 1.00 26.30 C ATOM 1554 CZ PHE B 25 29.126 24.418 15.529 1.00 22.80 C ATOM 1555 H PHE B 25 25.675 20.338 16.823 1.00 0.00 H ATOM 1556 N ARG B 26 25.108 18.236 14.930 1.00 36.28 N ATOM 1557 CA ARG B 26 24.664 16.912 14.493 1.00 41.35 C ATOM 1558 C ARG B 26 24.011 16.910 13.123 1.00 40.64 C ATOM 1559 O ARG B 26 24.349 16.066 12.298 1.00 43.79 O ATOM 1560 CB ARG B 26 23.665 16.317 15.492 1.00 49.68 C ATOM 1561 CG ARG B 26 23.189 14.920 15.111 1.00 59.53 C ATOM 1562 CD ARG B 26 22.495 14.202 16.251 1.00 67.81 C ATOM 1563 NE ARG B 26 23.440 13.767 17.271 1.00 77.58 N ATOM 1564 CZ ARG B 26 23.110 13.492 18.528 1.00 83.78 C ATOM 1565 NH1 ARG B 26 21.848 13.598 18.928 1.00 82.53 N ATOM 1566 NH2 ARG B 26 24.045 13.104 19.385 1.00 88.90 N ATOM 1567 HE ARG B 26 24.438 13.665 16.997 1.00 0.00 H ATOM 1568 HH12 ARG B 26 21.595 13.382 19.913 1.00 0.00 H ATOM 1569 HH11 ARG B 26 21.113 13.897 18.256 1.00 0.00 H ATOM 1570 HH22 ARG B 26 23.790 12.888 20.370 1.00 0.00 H ATOM 1571 HH21 ARG B 26 25.033 13.016 19.072 1.00 0.00 H ATOM 1572 H ARG B 26 24.823 18.580 15.869 1.00 0.00 H ATOM 1573 N PRO B 27 23.084 17.854 12.857 1.00 39.82 N ATOM 1574 CA PRO B 27 22.459 17.753 11.535 1.00 37.67 C ATOM 1575 C PRO B 27 23.436 17.998 10.396 1.00 39.67 C ATOM 1576 O PRO B 27 23.305 17.369 9.350 1.00 46.84 O ATOM 1577 CB PRO B 27 21.370 18.836 11.578 1.00 37.43 C ATOM 1578 CG PRO B 27 21.813 19.791 12.600 1.00 35.87 C ATOM 1579 CD PRO B 27 22.501 18.958 13.647 1.00 36.65 C ATOM 1580 N ILE B 28 24.407 18.882 10.602 1.00 37.36 N ATOM 1581 CA ILE B 28 25.424 19.133 9.591 1.00 32.73 C ATOM 1582 C ILE B 28 26.273 17.893 9.337 1.00 35.36 C ATOM 1583 O ILE B 28 26.491 17.526 8.190 1.00 40.77 O ATOM 1584 CB ILE B 28 26.336 20.311 9.985 1.00 28.65 C ATOM 1585 CG1 ILE B 28 25.503 21.594 10.067 1.00 32.51 C ATOM 1586 CG2 ILE B 28 27.447 20.476 8.970 1.00 27.63 C ATOM 1587 CD1 ILE B 28 26.207 22.767 10.676 1.00 23.56 C ATOM 1588 H ILE B 28 24.441 19.403 11.501 1.00 0.00 H ATOM 1589 N LEU B 29 26.742 17.235 10.397 1.00 33.04 N ATOM 1590 CA LEU B 29 27.586 16.056 10.204 1.00 36.21 C ATOM 1591 C LEU B 29 26.804 14.868 9.628 1.00 34.12 C ATOM 1592 O LEU B 29 27.328 14.133 8.802 1.00 39.65 O ATOM 1593 CB LEU B 29 28.268 15.640 11.510 1.00 35.71 C ATOM 1594 CG LEU B 29 29.317 16.588 12.089 1.00 33.13 C ATOM 1595 CD1 LEU B 29 30.050 15.907 13.238 1.00 30.42 C ATOM 1596 CD2 LEU B 29 30.295 17.073 11.034 1.00 37.46 C ATOM 1597 H LEU B 29 26.509 17.559 11.357 1.00 0.00 H ATOM 1598 N ASN B 30 25.557 14.682 10.052 1.00 33.76 N ATOM 1599 CA ASN B 30 24.742 13.578 9.525 1.00 41.57 C ATOM 1600 C ASN B 30 24.373 13.758 8.065 1.00 43.95 C ATOM 1601 O ASN B 30 24.335 12.790 7.311 1.00 50.86 O ATOM 1602 CB ASN B 30 23.482 13.367 10.367 1.00 46.22 C ATOM 1603 CG ASN B 30 23.783 12.651 11.671 1.00 54.68 C ATOM 1604 OD1 ASN B 30 24.772 11.918 11.775 1.00 54.72 O ATOM 1605 ND2 ASN B 30 22.942 12.855 12.666 1.00 56.84 N ATOM 1606 HD22 ASN B 30 22.122 13.481 12.534 1.00 0.00 H ATOM 1607 HD21 ASN B 30 23.099 12.390 13.583 1.00 0.00 H ATOM 1608 H ASN B 30 25.154 15.324 10.764 1.00 0.00 H ATOM 1609 N GLN B 31 24.098 14.993 7.667 1.00 44.24 N ATOM 1610 CA GLN B 31 23.771 15.271 6.280 1.00 41.09 C ATOM 1611 C GLN B 31 24.977 14.909 5.426 1.00 46.70 C ATOM 1612 O GLN B 31 24.830 14.506 4.270 1.00 50.96 O ATOM 1613 CB GLN B 31 23.392 16.739 6.084 1.00 45.68 C ATOM 1614 CG GLN B 31 22.945 17.070 4.666 1.00 55.43 C ATOM 1615 CD GLN B 31 22.099 18.330 4.592 1.00 61.23 C ATOM 1616 OE1 GLN B 31 21.363 18.656 5.526 1.00 65.76 O ATOM 1617 NE2 GLN B 31 22.188 19.037 3.470 1.00 59.21 N ATOM 1618 HE22 GLN B 31 22.822 18.725 2.707 1.00 0.00 H ATOM 1619 HE21 GLN B 31 21.623 19.903 3.355 1.00 0.00 H ATOM 1620 H GLN B 31 24.117 15.771 8.357 1.00 0.00 H ATOM 1621 N ALA B 32 26.171 15.059 5.998 1.00 43.19 N ATOM 1622 CA ALA B 32 27.401 14.675 5.308 1.00 38.50 C ATOM 1623 C ALA B 32 27.749 13.212 5.547 1.00 44.06 C ATOM 1624 O ALA B 32 28.764 12.723 5.051 1.00 47.71 O ATOM 1625 CB ALA B 32 28.546 15.552 5.749 1.00 35.66 C ATOM 1626 H ALA B 32 26.229 15.458 6.957 1.00 0.00 H ATOM 1627 N ASN B 33 26.908 12.524 6.314 1.00 45.70 N ATOM 1628 CA ASN B 33 27.137 11.123 6.660 1.00 49.83 C ATOM 1629 C ASN B 33 28.491 10.910 7.352 1.00 45.59 C ATOM 1630 O ASN B 33 29.220 9.973 7.042 1.00 47.22 O ATOM 1631 CB ASN B 33 27.029 10.242 5.416 1.00 53.10 C ATOM 1632 CG ASN B 33 26.557 8.848 5.739 1.00 59.99 C ATOM 1633 OD1 ASN B 33 25.357 8.592 5.806 1.00 63.76 O ATOM 1634 ND2 ASN B 33 27.497 7.934 5.949 1.00 62.82 N ATOM 1635 HD22 ASN B 33 28.501 8.196 5.882 1.00 0.00 H ATOM 1636 HD21 ASN B 33 27.229 6.956 6.181 1.00 0.00 H ATOM 1637 H ASN B 33 26.058 12.999 6.680 1.00 0.00 H ATOM 1638 N ILE B 34 28.829 11.811 8.270 1.00 41.31 N ATOM 1639 CA ILE B 34 30.085 11.753 9.003 1.00 36.31 C ATOM 1640 C ILE B 34 29.796 11.721 10.496 1.00 37.32 C ATOM 1641 O ILE B 34 28.861 12.370 10.960 1.00 37.89 O ATOM 1642 CB ILE B 34 30.994 12.953 8.688 1.00 43.43 C ATOM 1643 CG1 ILE B 34 31.265 13.044 7.189 1.00 48.28 C ATOM 1644 CG2 ILE B 34 32.306 12.835 9.437 1.00 42.99 C ATOM 1645 CD1 ILE B 34 32.000 11.849 6.641 1.00 53.32 C ATOM 1646 H ILE B 34 28.169 12.589 8.472 1.00 0.00 H ATOM 1647 N THR B 35 30.559 10.934 11.246 1.00 30.81 N ATOM 1648 CA THR B 35 30.401 10.918 12.696 1.00 33.00 C ATOM 1649 C THR B 35 31.234 12.016 13.390 1.00 30.57 C ATOM 1650 O THR B 35 32.123 12.615 12.776 1.00 37.40 O ATOM 1651 CB THR B 35 30.776 9.529 13.253 1.00 30.25 C ATOM 1652 OG1 THR B 35 32.165 9.260 13.009 1.00 34.12 O ATOM 1653 CG2 THR B 35 29.932 8.452 12.561 1.00 29.63 C ATOM 1654 HG1 THR B 35 32.395 8.367 13.370 1.00 0.00 H ATOM 1655 H THR B 35 31.273 10.326 10.797 1.00 0.00 H ATOM 1656 N ASP B 36 30.959 12.265 14.670 1.00 32.19 N ATOM 1657 CA ASP B 36 31.700 13.272 15.445 1.00 34.34 C ATOM 1658 C ASP B 36 33.201 12.943 15.485 1.00 32.25 C ATOM 1659 O ASP B 36 34.046 13.827 15.333 1.00 37.17 O ATOM 1660 CB ASP B 36 31.144 13.397 16.878 1.00 37.80 C ATOM 1661 CG ASP B 36 32.005 14.317 17.782 1.00 56.57 C ATOM 1662 OD1 ASP B 36 32.645 15.272 17.280 1.00 54.43 O ATOM 1663 OD2 ASP B 36 32.043 14.080 19.007 1.00 56.38 O ATOM 1664 H ASP B 36 30.197 11.731 15.135 1.00 0.00 H ATOM 1665 N GLN B 37 33.512 11.675 15.732 1.00 31.26 N ATOM 1666 CA GLN B 37 34.881 11.178 15.785 1.00 31.04 C ATOM 1667 C GLN B 37 35.611 11.354 14.463 1.00 27.31 C ATOM 1668 O GLN B 37 36.775 11.740 14.442 1.00 31.05 O ATOM 1669 CB GLN B 37 34.876 9.692 16.151 1.00 32.30 C ATOM 1670 CG GLN B 37 34.464 9.386 17.565 1.00 37.61 C ATOM 1671 CD GLN B 37 34.336 7.898 17.786 1.00 47.43 C ATOM 1672 OE1 GLN B 37 33.693 7.203 16.997 1.00 45.56 O ATOM 1673 NE2 GLN B 37 34.954 7.393 18.847 1.00 58.78 N ATOM 1674 HE22 GLN B 37 35.485 8.018 19.486 1.00 0.00 H ATOM 1675 HE21 GLN B 37 34.907 6.372 19.039 1.00 0.00 H ATOM 1676 H GLN B 37 32.737 11.001 15.896 1.00 0.00 H ATOM 1677 N GLN B 38 34.926 11.029 13.366 1.00 28.93 N ATOM 1678 CA GLN B 38 35.503 11.128 12.027 1.00 28.29 C ATOM 1679 C GLN B 38 35.794 12.579 11.697 1.00 32.83 C ATOM 1680 O GLN B 38 36.833 12.907 11.126 1.00 31.56 O ATOM 1681 CB GLN B 38 34.556 10.533 10.974 1.00 17.30 C ATOM 1682 CG GLN B 38 34.590 9.018 10.913 1.00 18.92 C ATOM 1683 CD GLN B 38 33.453 8.441 10.104 1.00 23.63 C ATOM 1684 OE1 GLN B 38 32.514 9.146 9.734 1.00 31.73 O ATOM 1685 NE2 GLN B 38 33.518 7.143 9.846 1.00 32.37 N ATOM 1686 HE22 GLN B 38 34.331 6.587 10.179 1.00 0.00 H ATOM 1687 HE21 GLN B 38 32.756 6.680 9.311 1.00 0.00 H ATOM 1688 H GLN B 38 33.947 10.693 13.467 1.00 0.00 H ATOM 1689 N TRP B 39 34.859 13.449 12.068 1.00 36.17 N ATOM 1690 CA TRP B 39 35.012 14.873 11.820 1.00 31.94 C ATOM 1691 C TRP B 39 36.127 15.449 12.679 1.00 28.37 C ATOM 1692 O TRP B 39 36.896 16.309 12.235 1.00 31.16 O ATOM 1693 CB TRP B 39 33.699 15.608 12.090 1.00 25.49 C ATOM 1694 CG TRP B 39 33.829 17.104 12.016 1.00 20.90 C ATOM 1695 CD1 TRP B 39 33.593 17.996 13.019 1.00 19.73 C ATOM 1696 CD2 TRP B 39 34.288 17.871 10.894 1.00 24.97 C ATOM 1697 NE1 TRP B 39 33.833 19.278 12.577 1.00 25.40 N ATOM 1698 CE2 TRP B 39 34.264 19.227 11.276 1.00 29.72 C ATOM 1699 CE3 TRP B 39 34.686 17.542 9.589 1.00 20.40 C ATOM 1700 CZ2 TRP B 39 34.635 20.260 10.407 1.00 23.32 C ATOM 1701 CZ3 TRP B 39 35.062 18.563 8.731 1.00 22.40 C ATOM 1702 CH2 TRP B 39 35.032 19.907 9.144 1.00 20.23 C ATOM 1703 HE1 TRP B 39 33.708 20.144 13.139 1.00 0.00 H ATOM 1704 H TRP B 39 34.002 13.104 12.545 1.00 0.00 H ATOM 1705 N ARG B 40 36.217 14.957 13.907 1.00 30.18 N ATOM 1706 CA ARG B 40 37.270 15.371 14.829 1.00 33.23 C ATOM 1707 C ARG B 40 38.652 15.089 14.232 1.00 31.01 C ATOM 1708 O ARG B 40 39.557 15.918 14.286 1.00 31.27 O ATOM 1709 CB ARG B 40 37.103 14.637 16.160 1.00 35.00 C ATOM 1710 CG ARG B 40 37.495 15.438 17.373 1.00 32.31 C ATOM 1711 CD ARG B 40 36.626 15.043 18.553 1.00 32.34 C ATOM 1712 NE ARG B 40 37.081 13.830 19.234 1.00 31.91 N ATOM 1713 CZ ARG B 40 36.275 12.846 19.623 1.00 28.16 C ATOM 1714 NH1 ARG B 40 34.979 12.922 19.383 1.00 24.86 N ATOM 1715 NH2 ARG B 40 36.763 11.781 20.248 1.00 33.07 N ATOM 1716 HE ARG B 40 38.098 13.731 19.426 1.00 0.00 H ATOM 1717 HH12 ARG B 40 34.348 12.153 19.687 1.00 0.00 H ATOM 1718 HH11 ARG B 40 34.589 13.751 18.890 1.00 0.00 H ATOM 1719 HH22 ARG B 40 36.125 11.017 20.548 1.00 0.00 H ATOM 1720 HH21 ARG B 40 37.783 11.711 20.437 1.00 0.00 H ATOM 1721 H ARG B 40 35.517 14.256 14.222 1.00 0.00 H ATOM 1722 N ILE B 41 38.798 13.899 13.664 1.00 30.23 N ATOM 1723 CA ILE B 41 40.040 13.482 13.032 1.00 26.99 C ATOM 1724 C ILE B 41 40.342 14.285 11.766 1.00 33.01 C ATOM 1725 O ILE B 41 41.478 14.711 11.543 1.00 32.53 O ATOM 1726 CB ILE B 41 39.995 11.991 12.729 1.00 30.26 C ATOM 1727 CG1 ILE B 41 40.131 11.229 14.045 1.00 26.71 C ATOM 1728 CG2 ILE B 41 41.112 11.599 11.777 1.00 33.32 C ATOM 1729 CD1 ILE B 41 39.649 9.832 13.953 1.00 33.23 C ATOM 1730 H ILE B 41 37.994 13.239 13.671 1.00 0.00 H ATOM 1731 N ILE B 42 39.334 14.478 10.926 1.00 31.60 N ATOM 1732 CA ILE B 42 39.522 15.261 9.715 1.00 29.12 C ATOM 1733 C ILE B 42 40.000 16.681 10.061 1.00 30.49 C ATOM 1734 O ILE B 42 40.906 17.215 9.419 1.00 36.57 O ATOM 1735 CB ILE B 42 38.234 15.305 8.888 1.00 27.98 C ATOM 1736 CG1 ILE B 42 37.974 13.916 8.296 1.00 31.50 C ATOM 1737 CG2 ILE B 42 38.322 16.363 7.788 1.00 21.71 C ATOM 1738 CD1 ILE B 42 36.665 13.787 7.582 1.00 34.01 C ATOM 1739 H ILE B 42 38.402 14.066 11.135 1.00 0.00 H ATOM 1740 N ARG B 43 39.409 17.289 11.083 1.00 27.94 N ATOM 1741 CA ARG B 43 39.824 18.640 11.469 1.00 28.67 C ATOM 1742 C ARG B 43 41.260 18.684 11.971 1.00 30.92 C ATOM 1743 O ARG B 43 42.010 19.600 11.628 1.00 34.62 O ATOM 1744 CB ARG B 43 38.922 19.220 12.551 1.00 20.40 C ATOM 1745 CG ARG B 43 37.529 19.487 12.127 1.00 31.05 C ATOM 1746 CD ARG B 43 36.904 20.457 13.100 1.00 31.31 C ATOM 1747 NE ARG B 43 37.624 21.717 13.078 1.00 35.31 N ATOM 1748 CZ ARG B 43 37.075 22.889 13.360 1.00 32.68 C ATOM 1749 NH1 ARG B 43 35.793 22.955 13.703 1.00 34.62 N ATOM 1750 NH2 ARG B 43 37.814 23.986 13.305 1.00 26.56 N ATOM 1751 HE ARG B 43 38.633 21.699 12.825 1.00 0.00 H ATOM 1752 HH12 ARG B 43 35.361 23.875 13.925 1.00 0.00 H ATOM 1753 HH11 ARG B 43 35.222 22.087 13.750 1.00 0.00 H ATOM 1754 HH22 ARG B 43 37.390 24.910 13.525 1.00 0.00 H ATOM 1755 HH21 ARG B 43 38.818 23.924 13.042 1.00 0.00 H ATOM 1756 H ARG B 43 38.652 16.807 11.609 1.00 0.00 H ATOM 1757 N LEU B 44 41.626 17.717 12.809 1.00 27.63 N ATOM 1758 CA LEU B 44 42.964 17.697 13.399 1.00 27.21 C ATOM 1759 C LEU B 44 44.038 17.533 12.321 1.00 27.26 C ATOM 1760 O LEU B 44 45.104 18.156 12.384 1.00 28.42 O ATOM 1761 CB LEU B 44 43.067 16.581 14.440 1.00 23.55 C ATOM 1762 CG LEU B 44 42.330 16.941 15.734 1.00 25.53 C ATOM 1763 CD1 LEU B 44 42.152 15.748 16.636 1.00 21.87 C ATOM 1764 CD2 LEU B 44 43.041 18.076 16.481 1.00 32.83 C ATOM 1765 H LEU B 44 40.950 16.964 13.048 1.00 0.00 H ATOM 1766 N LEU B 45 43.752 16.692 11.335 1.00 22.62 N ATOM 1767 CA LEU B 45 44.679 16.469 10.219 1.00 25.57 C ATOM 1768 C LEU B 45 44.775 17.703 9.335 1.00 29.25 C ATOM 1769 O LEU B 45 45.857 18.105 8.917 1.00 33.80 O ATOM 1770 CB LEU B 45 44.230 15.267 9.389 1.00 19.89 C ATOM 1771 CG LEU B 45 44.288 13.933 10.128 1.00 23.81 C ATOM 1772 CD1 LEU B 45 43.944 12.779 9.203 1.00 24.01 C ATOM 1773 CD2 LEU B 45 45.672 13.752 10.724 1.00 28.66 C ATOM 1774 H LEU B 45 42.848 16.178 11.354 1.00 0.00 H ATOM 1775 N ALA B 46 43.629 18.324 9.089 1.00 30.46 N ATOM 1776 CA ALA B 46 43.573 19.500 8.251 1.00 27.76 C ATOM 1777 C ALA B 46 44.374 20.638 8.867 1.00 29.26 C ATOM 1778 O ALA B 46 45.047 21.391 8.171 1.00 35.56 O ATOM 1779 CB ALA B 46 42.131 19.928 8.043 1.00 21.69 C ATOM 1780 H ALA B 46 42.751 17.956 9.509 1.00 0.00 H ATOM 1781 N GLU B 47 44.251 20.773 10.179 1.00 29.35 N ATOM 1782 CA GLU B 47 44.763 21.926 10.884 1.00 28.24 C ATOM 1783 C GLU B 47 46.212 21.759 11.336 1.00 34.79 C ATOM 1784 O GLU B 47 46.869 22.737 11.673 1.00 42.25 O ATOM 1785 CB GLU B 47 43.833 22.235 12.054 1.00 26.51 C ATOM 1786 CG GLU B 47 42.494 22.787 11.551 1.00 32.06 C ATOM 1787 CD GLU B 47 41.412 22.831 12.614 1.00 34.34 C ATOM 1788 OE1 GLU B 47 41.730 22.552 13.788 1.00 41.39 O ATOM 1789 OE2 GLU B 47 40.238 23.101 12.260 1.00 30.35 O ATOM 1790 H GLU B 47 43.771 20.025 10.719 1.00 0.00 H ATOM 1791 N ASN B 48 46.687 20.518 11.388 1.00 42.00 N ATOM 1792 CA ASN B 48 48.080 20.247 11.740 1.00 41.59 C ATOM 1793 C ASN B 48 48.923 19.854 10.533 1.00 46.58 C ATOM 1794 O ASN B 48 50.145 19.773 10.628 1.00 56.89 O ATOM 1795 CB ASN B 48 48.162 19.138 12.783 1.00 42.73 C ATOM 1796 CG ASN B 48 47.604 19.559 14.112 1.00 48.74 C ATOM 1797 OD1 ASN B 48 48.280 20.208 14.913 1.00 54.18 O ATOM 1798 ND2 ASN B 48 46.357 19.185 14.365 1.00 50.22 N ATOM 1799 HD22 ASN B 48 45.825 18.638 13.659 1.00 0.00 H ATOM 1800 HD21 ASN B 48 45.911 19.439 15.270 1.00 0.00 H ATOM 1801 H ASN B 48 46.053 19.722 11.173 1.00 0.00 H ATOM 1802 N GLY B 49 48.263 19.591 9.408 1.00 55.12 N ATOM 1803 CA GLY B 49 48.938 19.198 8.182 1.00 52.67 C ATOM 1804 C GLY B 49 49.281 17.721 8.089 1.00 52.90 C ATOM 1805 O GLY B 49 48.821 17.022 7.189 1.00 52.45 O ATOM 1806 H GLY B 49 47.226 19.669 9.406 1.00 0.00 H ATOM 1807 N THR B 50 50.087 17.247 9.031 1.00 51.70 N ATOM 1808 CA THR B 50 50.443 15.837 9.116 1.00 47.72 C ATOM 1809 C THR B 50 50.759 15.509 10.579 1.00 48.18 C ATOM 1810 O THR B 50 51.444 16.271 11.268 1.00 53.31 O ATOM 1811 CB THR B 50 51.633 15.507 8.174 1.00 53.21 C ATOM 1812 OG1 THR B 50 51.950 14.115 8.262 1.00 54.48 O ATOM 1813 CG2 THR B 50 52.871 16.315 8.540 1.00 60.11 C ATOM 1814 HG1 THR B 50 51.161 13.580 7.993 1.00 0.00 H ATOM 1815 H THR B 50 50.479 17.906 9.734 1.00 0.00 H ATOM 1816 N LEU B 51 50.273 14.358 11.038 1.00 40.48 N ATOM 1817 CA LEU B 51 50.458 13.933 12.422 1.00 35.18 C ATOM 1818 C LEU B 51 50.815 12.468 12.548 1.00 41.18 C ATOM 1819 O LEU B 51 50.368 11.652 11.738 1.00 43.39 O ATOM 1820 CB LEU B 51 49.178 14.183 13.228 1.00 33.78 C ATOM 1821 CG LEU B 51 48.805 15.618 13.581 1.00 36.97 C ATOM 1822 CD1 LEU B 51 47.491 15.635 14.357 1.00 29.97 C ATOM 1823 CD2 LEU B 51 49.932 16.312 14.359 1.00 37.87 C ATOM 1824 H LEU B 51 49.744 13.741 10.389 1.00 0.00 H ATOM 1825 N ASP B 52 51.622 12.110 13.545 1.00 43.08 N ATOM 1826 CA ASP B 52 51.803 10.682 13.781 1.00 44.77 C ATOM 1827 C ASP B 52 50.606 10.139 14.564 1.00 43.55 C ATOM 1828 O ASP B 52 49.881 10.884 15.222 1.00 43.46 O ATOM 1829 CB ASP B 52 53.135 10.355 14.474 1.00 47.82 C ATOM 1830 CG ASP B 52 53.238 10.895 15.876 1.00 52.37 C ATOM 1831 OD1 ASP B 52 52.308 10.704 16.683 1.00 55.75 O ATOM 1832 OD2 ASP B 52 54.294 11.482 16.187 1.00 60.37 O ATOM 1833 H ASP B 52 52.104 12.820 14.132 1.00 0.00 H ATOM 1834 N PHE B 53 50.416 8.830 14.461 1.00 41.87 N ATOM 1835 CA PHE B 53 49.271 8.130 15.015 1.00 37.08 C ATOM 1836 C PHE B 53 49.039 8.476 16.479 1.00 42.55 C ATOM 1837 O PHE B 53 47.908 8.751 16.902 1.00 36.42 O ATOM 1838 CB PHE B 53 49.464 6.618 14.852 1.00 33.68 C ATOM 1839 CG PHE B 53 48.306 5.798 15.342 1.00 32.72 C ATOM 1840 CD1 PHE B 53 47.207 5.581 14.526 1.00 30.64 C ATOM 1841 CD2 PHE B 53 48.315 5.237 16.604 1.00 33.07 C ATOM 1842 CE1 PHE B 53 46.139 4.824 14.960 1.00 32.28 C ATOM 1843 CE2 PHE B 53 47.244 4.479 17.047 1.00 34.48 C ATOM 1844 CZ PHE B 53 46.158 4.271 16.226 1.00 29.90 C ATOM 1845 H PHE B 53 51.131 8.271 13.952 1.00 0.00 H ATOM 1846 N GLN B 54 50.121 8.457 17.247 1.00 43.77 N ATOM 1847 CA GLN B 54 50.046 8.721 18.680 1.00 42.22 C ATOM 1848 C GLN B 54 49.559 10.135 19.004 1.00 39.39 C ATOM 1849 O GLN B 54 48.739 10.318 19.906 1.00 41.85 O ATOM 1850 CB GLN B 54 51.401 8.475 19.344 1.00 52.39 C ATOM 1851 CG GLN B 54 51.283 8.494 20.856 1.00 62.61 C ATOM 1852 CD GLN B 54 50.234 7.496 21.335 1.00 63.34 C ATOM 1853 OE1 GLN B 54 50.356 6.298 21.087 1.00 71.40 O ATOM 1854 NE2 GLN B 54 49.179 7.992 21.981 1.00 56.57 N ATOM 1855 HE22 GLN B 54 49.117 9.013 22.169 1.00 0.00 H ATOM 1856 HE21 GLN B 54 48.417 7.358 22.297 1.00 0.00 H ATOM 1857 H GLN B 54 51.045 8.249 16.817 1.00 0.00 H ATOM 1858 N ASP B 55 50.119 11.138 18.327 1.00 38.55 N ATOM 1859 CA ASP B 55 49.705 12.528 18.529 1.00 34.02 C ATOM 1860 C ASP B 55 48.246 12.745 18.161 1.00 34.19 C ATOM 1861 O ASP B 55 47.526 13.490 18.830 1.00 38.52 O ATOM 1862 CB ASP B 55 50.569 13.463 17.708 1.00 34.08 C ATOM 1863 CG ASP B 55 51.983 13.486 18.186 1.00 55.23 C ATOM 1864 OD1 ASP B 55 52.211 13.199 19.383 1.00 62.04 O ATOM 1865 OD2 ASP B 55 52.870 13.781 17.360 1.00 66.42 O ATOM 1866 H ASP B 55 50.869 10.928 17.638 1.00 0.00 H ATOM 1867 N LEU B 56 47.827 12.106 17.075 1.00 30.63 N ATOM 1868 CA LEU B 56 46.447 12.165 16.636 1.00 26.01 C ATOM 1869 C LEU B 56 45.549 11.587 17.705 1.00 34.14 C ATOM 1870 O LEU B 56 44.528 12.175 18.051 1.00 36.26 O ATOM 1871 CB LEU B 56 46.261 11.407 15.322 1.00 30.86 C ATOM 1872 CG LEU B 56 44.843 11.409 14.737 1.00 27.02 C ATOM 1873 CD1 LEU B 56 44.228 12.818 14.666 1.00 24.09 C ATOM 1874 CD2 LEU B 56 44.857 10.779 13.371 1.00 22.45 C ATOM 1875 H LEU B 56 48.509 11.547 16.523 1.00 0.00 H ATOM 1876 N ALA B 57 45.984 10.466 18.276 1.00 40.47 N ATOM 1877 CA ALA B 57 45.228 9.765 19.305 1.00 30.15 C ATOM 1878 C ALA B 57 44.999 10.654 20.499 1.00 29.17 C ATOM 1879 O ALA B 57 43.886 10.770 21.001 1.00 31.13 O ATOM 1880 CB ALA B 57 45.985 8.504 19.745 1.00 28.77 C ATOM 1881 H ALA B 57 46.900 10.075 17.976 1.00 0.00 H ATOM 1882 N ASN B 58 46.067 11.317 20.922 1.00 35.47 N ATOM 1883 CA ASN B 58 46.029 12.175 22.092 1.00 33.34 C ATOM 1884 C ASN B 58 45.169 13.415 21.893 1.00 36.01 C ATOM 1885 O ASN B 58 44.399 13.782 22.775 1.00 44.75 O ATOM 1886 CB ASN B 58 47.454 12.571 22.486 1.00 34.78 C ATOM 1887 CG ASN B 58 48.221 11.411 23.095 1.00 50.87 C ATOM 1888 OD1 ASN B 58 47.643 10.557 23.778 1.00 54.86 O ATOM 1889 ND2 ASN B 58 49.530 11.369 22.847 1.00 53.77 N ATOM 1890 HD22 ASN B 58 49.973 12.110 22.267 1.00 0.00 H ATOM 1891 HD21 ASN B 58 50.108 10.596 23.234 1.00 0.00 H ATOM 1892 H ASN B 58 46.960 11.219 20.399 1.00 0.00 H ATOM 1893 N GLN B 59 45.303 14.059 20.742 1.00 31.55 N ATOM 1894 CA GLN B 59 44.589 15.302 20.498 1.00 27.12 C ATOM 1895 C GLN B 59 43.112 15.027 20.228 1.00 23.17 C ATOM 1896 O GLN B 59 42.254 15.836 20.555 1.00 30.38 O ATOM 1897 CB GLN B 59 45.203 16.071 19.328 1.00 28.92 C ATOM 1898 CG GLN B 59 46.458 16.864 19.682 1.00 33.08 C ATOM 1899 CD GLN B 59 47.084 17.510 18.462 1.00 37.48 C ATOM 1900 OE1 GLN B 59 48.208 17.191 18.079 1.00 37.22 O ATOM 1901 NE2 GLN B 59 46.348 18.428 17.840 1.00 41.06 N ATOM 1902 HE22 GLN B 59 45.402 18.667 18.199 1.00 0.00 H ATOM 1903 HE21 GLN B 59 46.719 18.907 16.995 1.00 0.00 H ATOM 1904 H GLN B 59 45.926 13.671 20.005 1.00 0.00 H ATOM 1905 N ALA B 60 42.809 13.881 19.636 1.00 27.12 N ATOM 1906 CA ALA B 60 41.419 13.548 19.381 1.00 21.86 C ATOM 1907 C ALA B 60 40.752 12.937 20.606 1.00 25.67 C ATOM 1908 O ALA B 60 39.536 12.816 20.649 1.00 26.32 O ATOM 1909 CB ALA B 60 41.317 12.608 18.208 1.00 25.00 C ATOM 1910 H ALA B 60 43.564 13.223 19.355 1.00 0.00 H ATOM 1911 N CYS B 61 41.567 12.590 21.601 1.00 33.21 N ATOM 1912 CA CYS B 61 41.120 11.895 22.804 1.00 31.50 C ATOM 1913 C CYS B 61 40.402 10.602 22.425 1.00 33.97 C ATOM 1914 O CYS B 61 39.279 10.355 22.847 1.00 33.52 O ATOM 1915 CB CYS B 61 40.225 12.798 23.675 1.00 25.45 C ATOM 1916 SG CYS B 61 41.122 14.245 24.430 1.00 27.31 S ATOM 1917 H CYS B 61 42.576 12.827 21.516 1.00 0.00 H ATOM 1918 N ILE B 62 41.074 9.786 21.617 1.00 37.68 N ATOM 1919 CA ILE B 62 40.547 8.493 21.197 1.00 37.06 C ATOM 1920 C ILE B 62 41.572 7.386 21.465 1.00 36.19 C ATOM 1921 O ILE B 62 42.720 7.509 21.059 1.00 38.72 O ATOM 1922 CB ILE B 62 40.205 8.500 19.696 1.00 31.94 C ATOM 1923 CG1 ILE B 62 39.226 9.618 19.352 1.00 32.97 C ATOM 1924 CG2 ILE B 62 39.641 7.178 19.280 1.00 22.02 C ATOM 1925 CD1 ILE B 62 38.959 9.705 17.868 1.00 25.23 C ATOM 1926 H ILE B 62 42.010 10.081 21.272 1.00 0.00 H ATOM 1927 N LEU B 63 41.168 6.302 22.124 1.00 34.54 N ATOM 1928 CA LEU B 63 42.085 5.186 22.367 1.00 35.63 C ATOM 1929 C LEU B 63 42.589 4.576 21.052 1.00 38.05 C ATOM 1930 O LEU B 63 41.870 4.546 20.047 1.00 42.90 O ATOM 1931 CB LEU B 63 41.432 4.124 23.251 1.00 29.24 C ATOM 1932 CG LEU B 63 41.096 4.672 24.645 1.00 24.03 C ATOM 1933 CD1 LEU B 63 40.188 3.734 25.428 1.00 24.90 C ATOM 1934 CD2 LEU B 63 42.345 4.998 25.442 1.00 29.85 C ATOM 1935 H LEU B 63 40.189 6.247 22.471 1.00 0.00 H ATOM 1936 N ARG B 64 43.841 4.124 21.062 1.00 37.29 N ATOM 1937 CA ARG B 64 44.542 3.732 19.836 1.00 43.52 C ATOM 1938 C ARG B 64 43.839 2.659 18.999 1.00 40.30 C ATOM 1939 O ARG B 64 43.715 2.825 17.783 1.00 40.84 O ATOM 1940 CB ARG B 64 45.963 3.257 20.167 1.00 56.18 C ATOM 1941 CG ARG B 64 46.965 4.384 20.403 1.00 62.74 C ATOM 1942 CD ARG B 64 48.357 3.821 20.666 1.00 68.18 C ATOM 1943 NE ARG B 64 48.656 3.734 22.093 1.00 73.51 N ATOM 1944 CZ ARG B 64 49.886 3.712 22.599 1.00 78.77 C ATOM 1945 NH1 ARG B 64 50.939 3.742 21.793 1.00 79.59 N ATOM 1946 NH2 ARG B 64 50.066 3.644 23.912 1.00 82.50 N ATOM 1947 HE ARG B 64 47.856 3.686 22.756 1.00 0.00 H ATOM 1948 HH12 ARG B 64 51.899 3.725 22.191 1.00 0.00 H ATOM 1949 HH11 ARG B 64 50.804 3.783 20.763 1.00 0.00 H ATOM 1950 HH22 ARG B 64 51.029 3.627 24.305 1.00 0.00 H ATOM 1951 HH21 ARG B 64 49.244 3.608 24.548 1.00 0.00 H ATOM 1952 H ARG B 64 44.339 4.046 21.972 1.00 0.00 H ATOM 1953 N PRO B 65 43.370 1.560 19.622 1.00 32.37 N ATOM 1954 CA PRO B 65 42.674 0.592 18.766 1.00 34.31 C ATOM 1955 C PRO B 65 41.395 1.144 18.135 1.00 41.09 C ATOM 1956 O PRO B 65 41.116 0.866 16.962 1.00 35.26 O ATOM 1957 CB PRO B 65 42.347 -0.549 19.730 1.00 32.32 C ATOM 1958 CG PRO B 65 43.340 -0.422 20.803 1.00 25.78 C ATOM 1959 CD PRO B 65 43.513 1.048 20.991 1.00 29.30 C ATOM 1960 N SER B 66 40.653 1.958 18.876 1.00 34.79 N ATOM 1961 CA SER B 66 39.454 2.548 18.319 1.00 26.99 C ATOM 1962 C SER B 66 39.816 3.513 17.188 1.00 32.18 C ATOM 1963 O SER B 66 39.096 3.611 16.199 1.00 36.03 O ATOM 1964 CB SER B 66 38.657 3.279 19.399 1.00 35.10 C ATOM 1965 OG SER B 66 37.614 4.050 18.809 1.00 36.92 O ATOM 1966 HG SER B 66 38.007 4.716 18.191 1.00 0.00 H ATOM 1967 H SER B 66 40.932 2.171 19.855 1.00 0.00 H ATOM 1968 N LEU B 67 40.936 4.219 17.338 1.00 35.40 N ATOM 1969 CA LEU B 67 41.408 5.144 16.305 1.00 28.31 C ATOM 1970 C LEU B 67 41.788 4.404 15.028 1.00 34.98 C ATOM 1971 O LEU B 67 41.520 4.871 13.920 1.00 39.74 O ATOM 1972 CB LEU B 67 42.599 5.957 16.813 1.00 22.58 C ATOM 1973 CG LEU B 67 43.267 6.903 15.809 1.00 24.52 C ATOM 1974 CD1 LEU B 67 42.277 7.938 15.285 1.00 22.53 C ATOM 1975 CD2 LEU B 67 44.458 7.599 16.469 1.00 20.91 C ATOM 1976 H LEU B 67 41.490 4.110 18.212 1.00 0.00 H ATOM 1977 N THR B 68 42.405 3.240 15.194 1.00 35.55 N ATOM 1978 CA THR B 68 42.791 2.396 14.069 1.00 33.92 C ATOM 1979 C THR B 68 41.575 2.046 13.223 1.00 38.41 C ATOM 1980 O THR B 68 41.640 2.047 11.991 1.00 40.39 O ATOM 1981 CB THR B 68 43.475 1.103 14.545 1.00 26.77 C ATOM 1982 OG1 THR B 68 44.666 1.440 15.257 1.00 29.48 O ATOM 1983 CG2 THR B 68 43.841 0.214 13.359 1.00 28.74 C ATOM 1984 HG1 THR B 68 44.434 2.002 16.038 1.00 0.00 H ATOM 1985 H THR B 68 42.620 2.919 16.160 1.00 0.00 H ATOM 1986 N GLY B 69 40.468 1.734 13.889 1.00 38.09 N ATOM 1987 CA GLY B 69 39.240 1.405 13.192 1.00 32.29 C ATOM 1988 C GLY B 69 38.659 2.575 12.416 1.00 33.57 C ATOM 1989 O GLY B 69 38.199 2.426 11.281 1.00 38.00 O ATOM 1990 H GLY B 69 40.483 1.726 14.929 1.00 0.00 H ATOM 1991 N ILE B 70 38.646 3.741 13.053 1.00 29.80 N ATOM 1992 CA ILE B 70 38.142 4.949 12.415 1.00 31.54 C ATOM 1993 C ILE B 70 39.044 5.314 11.229 1.00 33.62 C ATOM 1994 O ILE B 70 38.566 5.707 10.165 1.00 40.22 O ATOM 1995 CB ILE B 70 38.071 6.125 13.407 1.00 32.75 C ATOM 1996 CG1 ILE B 70 37.207 5.776 14.614 1.00 30.36 C ATOM 1997 CG2 ILE B 70 37.553 7.363 12.724 1.00 29.85 C ATOM 1998 CD1 ILE B 70 37.309 6.796 15.724 1.00 22.95 C ATOM 1999 H ILE B 70 39.004 3.792 14.028 1.00 0.00 H ATOM 2000 N LEU B 71 40.355 5.207 11.431 1.00 33.17 N ATOM 2001 CA LEU B 71 41.311 5.519 10.375 1.00 27.87 C ATOM 2002 C LEU B 71 41.127 4.574 9.202 1.00 32.65 C ATOM 2003 O LEU B 71 41.131 5.003 8.049 1.00 37.38 O ATOM 2004 CB LEU B 71 42.747 5.468 10.897 1.00 30.27 C ATOM 2005 CG LEU B 71 43.138 6.656 11.793 1.00 27.47 C ATOM 2006 CD1 LEU B 71 44.587 6.565 12.256 1.00 26.40 C ATOM 2007 CD2 LEU B 71 42.855 8.013 11.141 1.00 25.11 C ATOM 2008 H LEU B 71 40.704 4.895 12.360 1.00 0.00 H ATOM 2009 N THR B 72 40.978 3.285 9.495 1.00 36.03 N ATOM 2010 CA THR B 72 40.727 2.290 8.458 1.00 32.08 C ATOM 2011 C THR B 72 39.554 2.697 7.565 1.00 35.00 C ATOM 2012 O THR B 72 39.632 2.603 6.340 1.00 41.53 O ATOM 2013 CB THR B 72 40.437 0.898 9.062 1.00 36.47 C ATOM 2014 OG1 THR B 72 41.570 0.454 9.813 1.00 45.70 O ATOM 2015 CG2 THR B 72 40.160 -0.111 7.961 1.00 26.49 C ATOM 2016 HG1 THR B 72 41.754 1.098 10.543 1.00 0.00 H ATOM 2017 H THR B 72 41.042 2.979 10.487 1.00 0.00 H ATOM 2018 N ARG B 73 38.466 3.158 8.168 1.00 32.46 N ATOM 2019 CA ARG B 73 37.316 3.547 7.361 1.00 31.11 C ATOM 2020 C ARG B 73 37.551 4.861 6.607 1.00 32.37 C ATOM 2021 O ARG B 73 37.108 5.008 5.467 1.00 32.52 O ATOM 2022 CB ARG B 73 36.053 3.656 8.206 1.00 29.83 C ATOM 2023 CG ARG B 73 34.836 3.939 7.346 1.00 37.05 C ATOM 2024 CD ARG B 73 33.533 3.778 8.082 1.00 41.66 C ATOM 2025 NE ARG B 73 32.424 4.225 7.247 1.00 43.02 N ATOM 2026 CZ ARG B 73 31.781 3.458 6.372 1.00 39.45 C ATOM 2027 NH1 ARG B 73 32.130 2.187 6.205 1.00 37.96 N ATOM 2028 NH2 ARG B 73 30.782 3.971 5.665 1.00 36.75 N ATOM 2029 HE ARG B 73 32.114 5.213 7.343 1.00 0.00 H ATOM 2030 HH12 ARG B 73 31.622 1.594 5.518 1.00 0.00 H ATOM 2031 HH11 ARG B 73 32.912 1.785 6.761 1.00 0.00 H ATOM 2032 HH22 ARG B 73 30.273 3.379 4.978 1.00 0.00 H ATOM 2033 HH21 ARG B 73 30.508 4.965 5.798 1.00 0.00 H ATOM 2034 H ARG B 73 38.434 3.241 9.204 1.00 0.00 H ATOM 2035 N LEU B 74 38.249 5.811 7.225 1.00 32.60 N ATOM 2036 CA LEU B 74 38.529 7.083 6.548 1.00 25.84 C ATOM 2037 C LEU B 74 39.454 6.871 5.354 1.00 31.50 C ATOM 2038 O LEU B 74 39.322 7.565 4.343 1.00 36.37 O ATOM 2039 CB LEU B 74 39.137 8.110 7.518 1.00 20.75 C ATOM 2040 CG LEU B 74 38.149 8.735 8.513 1.00 23.29 C ATOM 2041 CD1 LEU B 74 38.846 9.654 9.521 1.00 17.33 C ATOM 2042 CD2 LEU B 74 37.043 9.498 7.785 1.00 20.45 C ATOM 2043 H LEU B 74 38.598 5.651 8.192 1.00 0.00 H ATOM 2044 N GLU B 75 40.357 5.894 5.452 1.00 33.96 N ATOM 2045 CA GLU B 75 41.229 5.541 4.328 1.00 36.39 C ATOM 2046 C GLU B 75 40.427 4.894 3.215 1.00 34.06 C ATOM 2047 O GLU B 75 40.578 5.256 2.048 1.00 37.16 O ATOM 2048 CB GLU B 75 42.337 4.579 4.755 1.00 43.58 C ATOM 2049 CG GLU B 75 43.223 5.104 5.862 1.00 56.52 C ATOM 2050 CD GLU B 75 44.345 4.148 6.216 1.00 61.70 C ATOM 2051 OE1 GLU B 75 44.670 3.260 5.392 1.00 65.72 O ATOM 2052 OE2 GLU B 75 44.865 4.260 7.344 1.00 56.51 O ATOM 2053 H GLU B 75 40.444 5.371 6.347 1.00 0.00 H ATOM 2054 N LYS B 76 39.573 3.936 3.574 1.00 31.03 N ATOM 2055 CA LYS B 76 38.747 3.262 2.572 1.00 30.74 C ATOM 2056 C LYS B 76 37.848 4.245 1.858 1.00 30.09 C ATOM 2057 O LYS B 76 37.516 4.048 0.686 1.00 40.07 O ATOM 2058 CB LYS B 76 37.884 2.164 3.187 1.00 32.32 C ATOM 2059 CG LYS B 76 38.627 0.896 3.558 1.00 34.89 C ATOM 2060 CD LYS B 76 37.656 -0.146 4.099 1.00 36.36 C ATOM 2061 CE LYS B 76 36.650 -0.590 3.024 1.00 38.29 C ATOM 2062 NZ LYS B 76 37.188 -1.715 2.185 1.00 37.29 N ATOM 2063 HZ1 LYS B 76 38.059 -1.405 1.709 1.00 0.00 H ATOM 2064 HZ2 LYS B 76 37.396 -2.531 2.795 1.00 0.00 H ATOM 2065 HZ3 LYS B 76 36.479 -1.984 1.473 1.00 0.00 H ATOM 2066 H LYS B 76 39.493 3.665 4.575 1.00 0.00 H ATOM 2067 N ALA B 77 37.449 5.295 2.567 1.00 25.14 N ATOM 2068 CA ALA B 77 36.617 6.333 1.975 1.00 25.88 C ATOM 2069 C ALA B 77 37.443 7.298 1.128 1.00 29.07 C ATOM 2070 O ALA B 77 36.881 8.134 0.429 1.00 36.84 O ATOM 2071 CB ALA B 77 35.865 7.084 3.050 1.00 26.51 C ATOM 2072 H ALA B 77 37.736 5.377 3.563 1.00 0.00 H ATOM 2073 N GLY B 78 38.770 7.172 1.186 1.00 31.09 N ATOM 2074 CA GLY B 78 39.666 7.989 0.380 1.00 26.29 C ATOM 2075 C GLY B 78 39.931 9.379 0.927 1.00 31.32 C ATOM 2076 O GLY B 78 40.320 10.284 0.187 1.00 33.16 O ATOM 2077 H GLY B 78 39.179 6.465 1.830 1.00 0.00 H ATOM 2078 N LEU B 79 39.715 9.554 2.230 1.00 33.05 N ATOM 2079 CA LEU B 79 39.837 10.863 2.867 1.00 31.15 C ATOM 2080 C LEU B 79 41.161 11.022 3.599 1.00 35.67 C ATOM 2081 O LEU B 79 41.667 12.141 3.766 1.00 35.93 O ATOM 2082 CB LEU B 79 38.676 11.076 3.844 1.00 26.27 C ATOM 2083 CG LEU B 79 37.285 10.875 3.230 1.00 18.34 C ATOM 2084 CD1 LEU B 79 36.207 10.899 4.294 1.00 20.86 C ATOM 2085 CD2 LEU B 79 37.021 11.923 2.177 1.00 22.94 C ATOM 2086 H LEU B 79 39.451 8.733 2.812 1.00 0.00 H ATOM 2087 N VAL B 80 41.711 9.894 4.042 1.00 36.98 N ATOM 2088 CA VAL B 80 42.933 9.887 4.844 1.00 36.51 C ATOM 2089 C VAL B 80 43.933 8.909 4.277 1.00 35.60 C ATOM 2090 O VAL B 80 43.558 7.828 3.839 1.00 36.59 O ATOM 2091 CB VAL B 80 42.645 9.519 6.324 1.00 25.96 C ATOM 2092 CG1 VAL B 80 43.937 9.270 7.089 1.00 28.01 C ATOM 2093 CG2 VAL B 80 41.816 10.613 7.000 1.00 24.18 C ATOM 2094 H VAL B 80 41.256 8.988 3.810 1.00 0.00 H ATOM 2095 N VAL B 81 45.203 9.302 4.260 1.00 39.25 N ATOM 2096 CA VAL B 81 46.271 8.405 3.841 1.00 43.48 C ATOM 2097 C VAL B 81 47.329 8.202 4.930 1.00 41.80 C ATOM 2098 O VAL B 81 47.714 9.141 5.615 1.00 42.46 O ATOM 2099 CB VAL B 81 46.941 8.927 2.544 1.00 43.17 C ATOM 2100 CG1 VAL B 81 48.442 8.761 2.579 1.00 47.55 C ATOM 2101 CG2 VAL B 81 46.327 8.252 1.319 1.00 43.48 C ATOM 2102 H VAL B 81 45.439 10.272 4.552 1.00 0.00 H ATOM 2103 N ARG B 82 47.792 6.973 5.062 1.00 45.19 N ATOM 2104 CA ARG B 82 48.845 6.588 5.974 1.00 44.17 C ATOM 2105 C ARG B 82 50.080 6.785 5.126 1.00 53.33 C ATOM 2106 O ARG B 82 50.035 6.595 3.933 1.00 53.32 O ATOM 2107 CB ARG B 82 48.741 5.123 6.304 1.00 44.17 C ATOM 2108 CG ARG B 82 47.979 4.805 7.558 1.00 54.33 C ATOM 2109 CD ARG B 82 47.643 3.332 7.736 1.00 59.92 C ATOM 2110 NE ARG B 82 47.378 2.692 6.462 1.00 61.74 N ATOM 2111 CZ ARG B 82 48.218 1.885 5.842 1.00 64.75 C ATOM 2112 NH1 ARG B 82 49.378 1.576 6.400 1.00 66.38 N ATOM 2113 NH2 ARG B 82 47.891 1.392 4.669 1.00 65.64 N ATOM 2114 HE ARG B 82 46.463 2.882 6.006 1.00 0.00 H ATOM 2115 HH12 ARG B 82 50.038 0.940 5.909 1.00 0.00 H ATOM 2116 HH11 ARG B 82 49.629 1.970 7.329 1.00 0.00 H ATOM 2117 HH22 ARG B 82 48.546 0.755 4.172 1.00 0.00 H ATOM 2118 HH21 ARG B 82 46.977 1.639 4.238 1.00 0.00 H ATOM 2119 H ARG B 82 47.370 6.230 4.469 1.00 0.00 H ATOM 2120 N LEU B 83 51.182 7.173 5.722 1.00 57.11 N ATOM 2121 CA LEU B 83 52.396 7.381 4.968 1.00 62.59 C ATOM 2122 C LEU B 83 53.316 6.125 5.094 1.00 65.52 C ATOM 2123 O LEU B 83 53.891 5.870 6.139 1.00 66.90 O ATOM 2124 CB LEU B 83 53.032 8.712 5.371 1.00 64.62 C ATOM 2125 CG LEU B 83 52.833 9.888 4.414 1.00 58.12 C ATOM 2126 CD1 LEU B 83 51.408 10.194 4.092 1.00 53.59 C ATOM 2127 CD2 LEU B 83 53.491 11.145 4.897 1.00 61.54 C ATOM 2128 H LEU B 83 51.182 7.333 6.750 1.00 0.00 H ATOM 2129 N LYS B 84 53.377 5.360 3.992 1.00 59.91 N ATOM 2130 CA LYS B 84 54.088 4.088 3.868 1.00 57.34 C ATOM 2131 C LYS B 84 55.035 4.011 2.634 1.00 57.37 C ATOM 2132 O LYS B 84 54.901 4.785 1.719 1.00 50.26 O ATOM 2133 CB LYS B 84 53.056 2.949 3.723 1.00 53.93 C ATOM 2134 CG LYS B 84 52.097 2.656 4.870 1.00 48.84 C ATOM 2135 CD LYS B 84 52.798 2.301 6.157 1.00 51.26 C ATOM 2136 CE LYS B 84 53.235 0.845 6.265 1.00 56.66 C ATOM 2137 NZ LYS B 84 53.432 0.512 7.701 1.00 55.65 N ATOM 2138 HZ1 LYS B 84 54.164 1.132 8.102 1.00 0.00 H ATOM 2139 HZ2 LYS B 84 52.538 0.652 8.214 1.00 0.00 H ATOM 2140 HZ3 LYS B 84 53.731 -0.480 7.788 1.00 0.00 H ATOM 2141 H LYS B 84 52.873 5.703 3.150 1.00 0.00 H ATOM 2142 N PRO B 85 56.015 3.016 2.569 1.00 59.24 N ATOM 2143 CA PRO B 85 56.115 2.107 3.725 1.00 62.78 C ATOM 2144 C PRO B 85 56.805 2.629 4.960 1.00 74.84 C ATOM 2145 O PRO B 85 57.120 1.773 5.774 1.00 72.04 O ATOM 2146 CB PRO B 85 56.939 0.964 3.200 1.00 61.90 C ATOM 2147 CG PRO B 85 57.855 1.590 2.271 1.00 66.13 C ATOM 2148 CD PRO B 85 56.981 2.494 1.504 1.00 56.50 C TER 2149 PRO B 85 ATOM 2150 N ARG B 91 56.624 3.884 13.891 1.00 67.33 N ATOM 2151 CA ARG B 91 55.952 5.179 13.902 1.00 65.37 C ATOM 2152 C ARG B 91 55.173 5.384 12.606 1.00 62.82 C ATOM 2153 O ARG B 91 55.711 5.227 11.515 1.00 62.28 O ATOM 2154 CB ARG B 91 56.971 6.302 14.111 1.00 72.65 C ATOM 2155 CG ARG B 91 56.393 7.712 14.145 1.00 72.13 C ATOM 2156 CD ARG B 91 57.499 8.746 14.431 1.00 79.32 C ATOM 2157 NE ARG B 91 56.991 10.117 14.478 1.00 80.12 N ATOM 2158 CZ ARG B 91 57.730 11.191 14.754 1.00 82.28 C ATOM 2159 NH1 ARG B 91 59.028 11.070 15.012 1.00 82.91 N ATOM 2160 NH2 ARG B 91 57.166 12.394 14.769 1.00 82.96 N ATOM 2161 HE ARG B 91 55.980 10.264 14.282 1.00 0.00 H ATOM 2162 HH12 ARG B 91 59.596 11.914 15.226 1.00 0.00 H ATOM 2163 HH11 ARG B 91 59.475 10.131 15.000 1.00 0.00 H ATOM 2164 HH22 ARG B 91 57.739 13.235 14.984 1.00 0.00 H ATOM 2165 HH21 ARG B 91 56.151 12.495 14.566 1.00 0.00 H ATOM 2166 HN3 ARG B 91 57.284 3.844 13.088 1.00 0.00 H ATOM 2167 HN2 ARG B 91 55.916 3.128 13.797 1.00 0.00 H ATOM 2168 HN1 ARG B 91 57.150 3.760 14.780 1.00 0.00 H ATOM 2169 N VAL B 92 53.900 5.735 12.730 1.00 61.30 N ATOM 2170 CA VAL B 92 53.030 5.860 11.568 1.00 59.86 C ATOM 2171 C VAL B 92 52.526 7.283 11.400 1.00 60.03 C ATOM 2172 O VAL B 92 52.041 7.883 12.355 1.00 63.31 O ATOM 2173 CB VAL B 92 51.829 4.915 11.671 1.00 56.11 C ATOM 2174 CG1 VAL B 92 50.996 4.976 10.401 1.00 50.45 C ATOM 2175 CG2 VAL B 92 52.306 3.501 11.944 1.00 59.51 C ATOM 2176 H VAL B 92 53.515 5.925 13.677 1.00 0.00 H ATOM 2177 N PHE B 93 52.645 7.823 10.190 1.00 49.85 N ATOM 2178 CA PHE B 93 52.159 9.171 9.924 1.00 41.23 C ATOM 2179 C PHE B 93 50.854 9.187 9.147 1.00 42.53 C ATOM 2180 O PHE B 93 50.622 8.342 8.280 1.00 40.70 O ATOM 2181 CB PHE B 93 53.216 9.969 9.166 1.00 43.42 C ATOM 2182 CG PHE B 93 54.324 10.477 10.040 1.00 44.31 C ATOM 2183 CD1 PHE B 93 54.171 11.644 10.769 1.00 42.20 C ATOM 2184 CD2 PHE B 93 55.510 9.775 10.143 1.00 46.27 C ATOM 2185 CE1 PHE B 93 55.189 12.111 11.575 1.00 50.06 C ATOM 2186 CE2 PHE B 93 56.534 10.234 10.944 1.00 54.14 C ATOM 2187 CZ PHE B 93 56.373 11.404 11.663 1.00 57.72 C ATOM 2188 H PHE B 93 53.090 7.277 9.425 1.00 0.00 H ATOM 2189 N LEU B 94 50.039 10.200 9.434 1.00 41.63 N ATOM 2190 CA LEU B 94 48.724 10.355 8.825 1.00 41.67 C ATOM 2191 C LEU B 94 48.553 11.719 8.175 1.00 41.91 C ATOM 2192 O LEU B 94 49.047 12.730 8.670 1.00 43.45 O ATOM 2193 CB LEU B 94 47.634 10.142 9.872 1.00 38.21 C ATOM 2194 CG LEU B 94 47.714 8.718 10.400 1.00 39.15 C ATOM 2195 CD1 LEU B 94 47.524 8.704 11.900 1.00 41.65 C ATOM 2196 CD2 LEU B 94 46.710 7.842 9.680 1.00 40.18 C ATOM 2197 H LEU B 94 50.355 10.912 10.123 1.00 0.00 H ATOM 2198 N LYS B 95 47.838 11.730 7.059 1.00 42.48 N ATOM 2199 CA LYS B 95 47.622 12.945 6.305 1.00 47.57 C ATOM 2200 C LYS B 95 46.289 12.837 5.572 1.00 41.83 C ATOM 2201 O LYS B 95 45.851 11.739 5.243 1.00 44.53 O ATOM 2202 CB LYS B 95 48.788 13.142 5.334 1.00 57.10 C ATOM 2203 CG LYS B 95 48.820 14.446 4.589 1.00 60.22 C ATOM 2204 CD LYS B 95 50.096 14.548 3.778 1.00 59.47 C ATOM 2205 CE LYS B 95 50.102 15.807 2.941 1.00 63.22 C ATOM 2206 NZ LYS B 95 49.965 17.014 3.805 1.00 64.38 N ATOM 2207 HZ1 LYS B 95 49.069 16.963 4.330 1.00 0.00 H ATOM 2208 HZ2 LYS B 95 50.759 17.051 4.475 1.00 0.00 H ATOM 2209 HZ3 LYS B 95 49.971 17.867 3.210 1.00 0.00 H ATOM 2210 H LYS B 95 47.421 10.841 6.716 1.00 0.00 H ATOM 2211 N LEU B 96 45.637 13.966 5.326 1.00 37.33 N ATOM 2212 CA LEU B 96 44.432 13.967 4.502 1.00 30.34 C ATOM 2213 C LEU B 96 44.759 13.823 3.024 1.00 34.16 C ATOM 2214 O LEU B 96 45.800 14.287 2.571 1.00 36.91 O ATOM 2215 CB LEU B 96 43.623 15.247 4.699 1.00 30.34 C ATOM 2216 CG LEU B 96 42.982 15.493 6.056 1.00 24.85 C ATOM 2217 CD1 LEU B 96 42.266 16.801 5.984 1.00 22.55 C ATOM 2218 CD2 LEU B 96 42.019 14.379 6.375 1.00 31.53 C ATOM 2219 H LEU B 96 45.988 14.860 5.725 1.00 0.00 H ATOM 2220 N THR B 97 43.852 13.212 2.268 1.00 37.26 N ATOM 2221 CA THR B 97 43.995 13.184 0.823 1.00 34.40 C ATOM 2222 C THR B 97 43.520 14.524 0.263 1.00 35.78 C ATOM 2223 O THR B 97 43.175 15.431 1.027 1.00 38.68 O ATOM 2224 CB THR B 97 43.192 12.032 0.193 1.00 36.55 C ATOM 2225 OG1 THR B 97 41.805 12.199 0.515 1.00 36.94 O ATOM 2226 CG2 THR B 97 43.659 10.682 0.734 1.00 34.62 C ATOM 2227 HG1 THR B 97 41.283 11.461 0.112 1.00 0.00 H ATOM 2228 H THR B 97 43.034 12.751 2.715 1.00 0.00 H ATOM 2229 N ALA B 98 43.515 14.665 -1.058 1.00 38.57 N ATOM 2230 CA ALA B 98 42.979 15.875 -1.676 1.00 37.41 C ATOM 2231 C ALA B 98 41.491 15.985 -1.365 1.00 39.51 C ATOM 2232 O ALA B 98 40.989 17.053 -1.005 1.00 40.73 O ATOM 2233 CB ALA B 98 43.219 15.867 -3.190 1.00 33.94 C ATOM 2234 H ALA B 98 43.897 13.906 -1.658 1.00 0.00 H ATOM 2235 N GLU B 99 40.807 14.850 -1.482 1.00 38.65 N ATOM 2236 CA GLU B 99 39.372 14.744 -1.233 1.00 35.32 C ATOM 2237 C GLU B 99 39.039 15.005 0.231 1.00 36.14 C ATOM 2238 O GLU B 99 38.012 15.607 0.544 1.00 41.44 O ATOM 2239 CB GLU B 99 38.851 13.359 -1.664 1.00 30.48 C ATOM 2240 CG GLU B 99 38.862 13.124 -3.183 1.00 38.73 C ATOM 2241 CD GLU B 99 40.264 12.917 -3.758 1.00 50.96 C ATOM 2242 OE1 GLU B 99 41.225 12.777 -2.971 1.00 51.57 O ATOM 2243 OE2 GLU B 99 40.405 12.892 -5.004 1.00 59.99 O ATOM 2244 H GLU B 99 41.322 13.992 -1.766 1.00 0.00 H ATOM 2245 N GLY B 100 39.906 14.549 1.127 1.00 31.99 N ATOM 2246 CA GLY B 100 39.708 14.773 2.545 1.00 33.39 C ATOM 2247 C GLY B 100 39.794 16.257 2.850 1.00 36.47 C ATOM 2248 O GLY B 100 39.068 16.784 3.696 1.00 39.96 O ATOM 2249 H GLY B 100 40.743 14.021 0.805 1.00 0.00 H ATOM 2250 N GLU B 101 40.718 16.931 2.176 1.00 36.65 N ATOM 2251 CA GLU B 101 40.873 18.363 2.343 1.00 32.97 C ATOM 2252 C GLU B 101 39.624 19.082 1.845 1.00 37.70 C ATOM 2253 O GLU B 101 39.110 19.984 2.500 1.00 46.16 O ATOM 2254 CB GLU B 101 42.114 18.858 1.608 1.00 31.70 C ATOM 2255 CG GLU B 101 43.397 18.463 2.312 1.00 40.98 C ATOM 2256 CD GLU B 101 44.636 19.059 1.664 1.00 53.10 C ATOM 2257 OE1 GLU B 101 44.503 20.083 0.959 1.00 55.65 O ATOM 2258 OE2 GLU B 101 45.738 18.498 1.858 1.00 56.14 O ATOM 2259 H GLU B 101 41.342 16.423 1.517 1.00 0.00 H ATOM 2260 N LYS B 102 39.148 18.664 0.678 1.00 36.46 N ATOM 2261 CA LYS B 102 37.933 19.194 0.074 1.00 30.80 C ATOM 2262 C LYS B 102 36.741 19.045 1.017 1.00 37.09 C ATOM 2263 O LYS B 102 35.960 19.980 1.209 1.00 45.04 O ATOM 2264 CB LYS B 102 37.675 18.480 -1.259 1.00 29.32 C ATOM 2265 CG LYS B 102 36.486 18.982 -2.065 1.00 38.38 C ATOM 2266 CD LYS B 102 36.365 18.209 -3.372 1.00 44.58 C ATOM 2267 CE LYS B 102 35.099 18.590 -4.143 1.00 50.70 C ATOM 2268 NZ LYS B 102 35.063 20.028 -4.548 1.00 51.51 N ATOM 2269 HZ1 LYS B 102 35.105 20.627 -3.699 1.00 0.00 H ATOM 2270 HZ2 LYS B 102 35.877 20.235 -5.161 1.00 0.00 H ATOM 2271 HZ3 LYS B 102 34.181 20.219 -5.065 1.00 0.00 H ATOM 2272 H LYS B 102 39.669 17.921 0.170 1.00 0.00 H ATOM 2273 N LEU B 103 36.616 17.873 1.625 1.00 30.65 N ATOM 2274 CA LEU B 103 35.539 17.628 2.561 1.00 29.69 C ATOM 2275 C LEU B 103 35.679 18.546 3.779 1.00 33.44 C ATOM 2276 O LEU B 103 34.683 19.029 4.310 1.00 35.69 O ATOM 2277 CB LEU B 103 35.524 16.155 2.977 1.00 30.82 C ATOM 2278 CG LEU B 103 34.388 15.677 3.876 1.00 33.14 C ATOM 2279 CD1 LEU B 103 33.074 15.856 3.153 1.00 40.54 C ATOM 2280 CD2 LEU B 103 34.595 14.218 4.220 1.00 33.29 C ATOM 2281 H LEU B 103 37.303 17.118 1.426 1.00 0.00 H ATOM 2282 N TYR B 104 36.911 18.780 4.225 1.00 29.08 N ATOM 2283 CA TYR B 104 37.137 19.673 5.361 1.00 24.93 C ATOM 2284 C TYR B 104 36.613 21.083 5.047 1.00 24.99 C ATOM 2285 O TYR B 104 36.011 21.732 5.901 1.00 24.35 O ATOM 2286 CB TYR B 104 38.628 19.738 5.734 1.00 23.65 C ATOM 2287 CG TYR B 104 38.966 20.827 6.743 1.00 16.28 C ATOM 2288 CD1 TYR B 104 38.629 20.685 8.083 1.00 22.61 C ATOM 2289 CD2 TYR B 104 39.599 22.003 6.350 1.00 24.94 C ATOM 2290 CE1 TYR B 104 38.932 21.679 9.016 1.00 24.29 C ATOM 2291 CE2 TYR B 104 39.914 22.997 7.273 1.00 27.71 C ATOM 2292 CZ TYR B 104 39.572 22.827 8.604 1.00 34.06 C ATOM 2293 OH TYR B 104 39.875 23.798 9.532 1.00 46.12 O ATOM 2294 HH TYR B 104 39.559 23.510 10.425 1.00 0.00 H ATOM 2295 H TYR B 104 37.722 18.323 3.761 1.00 0.00 H ATOM 2296 N GLU B 105 36.847 21.543 3.823 1.00 25.26 N ATOM 2297 CA GLU B 105 36.422 22.872 3.388 1.00 27.58 C ATOM 2298 C GLU B 105 34.902 23.000 3.234 1.00 36.45 C ATOM 2299 O GLU B 105 34.317 24.018 3.620 1.00 39.13 O ATOM 2300 CB GLU B 105 37.114 23.240 2.065 1.00 29.58 C ATOM 2301 CG GLU B 105 38.635 23.389 2.183 1.00 39.51 C ATOM 2302 CD GLU B 105 39.307 23.796 0.876 1.00 55.33 C ATOM 2303 OE1 GLU B 105 38.669 23.690 -0.198 1.00 58.83 O ATOM 2304 OE2 GLU B 105 40.476 24.243 0.927 1.00 61.88 O ATOM 2305 H GLU B 105 37.352 20.934 3.148 1.00 0.00 H ATOM 2306 N GLU B 106 34.257 22.000 2.642 1.00 38.20 N ATOM 2307 CA GLU B 106 32.820 22.121 2.412 1.00 40.47 C ATOM 2308 C GLU B 106 32.004 21.871 3.685 1.00 37.23 C ATOM 2309 O GLU B 106 31.002 22.536 3.905 1.00 40.22 O ATOM 2310 CB GLU B 106 32.370 21.185 1.291 1.00 47.79 C ATOM 2311 CG GLU B 106 32.385 19.707 1.637 1.00 55.71 C ATOM 2312 CD GLU B 106 31.658 18.866 0.596 1.00 57.86 C ATOM 2313 OE1 GLU B 106 32.069 18.885 -0.585 1.00 58.15 O ATOM 2314 OE2 GLU B 106 30.681 18.180 0.971 1.00 55.16 O ATOM 2315 H GLU B 106 34.768 21.144 2.347 1.00 0.00 H ATOM 2316 N ILE B 107 32.461 20.976 4.555 1.00 28.77 N ATOM 2317 CA ILE B 107 31.775 20.763 5.820 1.00 24.96 C ATOM 2318 C ILE B 107 32.157 21.878 6.763 1.00 28.78 C ATOM 2319 O ILE B 107 31.322 22.408 7.494 1.00 34.29 O ATOM 2320 CB ILE B 107 32.130 19.417 6.499 1.00 25.05 C ATOM 2321 CG1 ILE B 107 31.633 18.229 5.690 1.00 29.23 C ATOM 2322 CG2 ILE B 107 31.526 19.348 7.893 1.00 20.31 C ATOM 2323 CD1 ILE B 107 31.913 16.910 6.386 1.00 32.38 C ATOM 2324 H ILE B 107 33.314 20.425 4.330 1.00 0.00 H ATOM 2325 N GLY B 108 33.435 22.237 6.722 1.00 25.45 N ATOM 2326 CA GLY B 108 33.964 23.285 7.565 1.00 21.29 C ATOM 2327 C GLY B 108 33.211 24.592 7.416 1.00 28.42 C ATOM 2328 O GLY B 108 33.063 25.345 8.379 1.00 36.78 O ATOM 2329 H GLY B 108 34.075 21.749 6.063 1.00 0.00 H ATOM 2330 N GLU B 109 32.756 24.873 6.200 1.00 29.35 N ATOM 2331 CA GLU B 109 32.037 26.111 5.920 1.00 31.06 C ATOM 2332 C GLU B 109 30.673 26.139 6.609 1.00 36.50 C ATOM 2333 O GLU B 109 30.263 27.158 7.162 1.00 45.69 O ATOM 2334 CB GLU B 109 31.872 26.279 4.409 1.00 34.52 C ATOM 2335 CG GLU B 109 31.155 27.540 3.987 1.00 42.68 C ATOM 2336 CD GLU B 109 31.177 27.735 2.485 1.00 49.44 C ATOM 2337 OE1 GLU B 109 32.116 27.223 1.840 1.00 47.02 O ATOM 2338 OE2 GLU B 109 30.257 28.393 1.952 1.00 56.31 O ATOM 2339 H GLU B 109 32.916 24.194 5.429 1.00 0.00 H ATOM 2340 N GLU B 110 29.980 25.011 6.590 1.00 32.17 N ATOM 2341 CA GLU B 110 28.692 24.910 7.252 1.00 27.32 C ATOM 2342 C GLU B 110 28.888 24.956 8.760 1.00 28.34 C ATOM 2343 O GLU B 110 28.069 25.521 9.489 1.00 30.01 O ATOM 2344 CB GLU B 110 27.951 23.633 6.831 1.00 30.32 C ATOM 2345 CG GLU B 110 27.458 23.656 5.390 1.00 38.45 C ATOM 2346 CD GLU B 110 26.746 22.372 5.007 1.00 57.09 C ATOM 2347 OE1 GLU B 110 26.187 21.714 5.913 1.00 63.80 O ATOM 2348 OE2 GLU B 110 26.730 22.022 3.806 1.00 65.99 O ATOM 2349 H GLU B 110 30.365 24.183 6.092 1.00 0.00 H ATOM 2350 N VAL B 111 29.971 24.334 9.220 1.00 28.04 N ATOM 2351 CA VAL B 111 30.311 24.320 10.636 1.00 18.04 C ATOM 2352 C VAL B 111 30.595 25.753 11.113 1.00 24.49 C ATOM 2353 O VAL B 111 30.163 26.133 12.205 1.00 33.41 O ATOM 2354 CB VAL B 111 31.541 23.395 10.926 1.00 24.41 C ATOM 2355 CG1 VAL B 111 32.065 23.614 12.347 1.00 24.40 C ATOM 2356 CG2 VAL B 111 31.150 21.939 10.775 1.00 25.86 C ATOM 2357 H VAL B 111 30.594 23.843 8.547 1.00 0.00 H ATOM 2358 N ASP B 112 31.317 26.543 10.309 1.00 30.07 N ATOM 2359 CA ASP B 112 31.629 27.932 10.682 1.00 19.89 C ATOM 2360 C ASP B 112 30.361 28.766 10.739 1.00 24.97 C ATOM 2361 O ASP B 112 30.257 29.715 11.507 1.00 36.02 O ATOM 2362 CB ASP B 112 32.591 28.590 9.679 1.00 25.30 C ATOM 2363 CG ASP B 112 34.042 28.224 9.905 1.00 28.04 C ATOM 2364 OD1 ASP B 112 34.374 27.728 10.995 1.00 35.88 O ATOM 2365 OD2 ASP B 112 34.862 28.461 8.990 1.00 33.71 O ATOM 2366 H ASP B 112 31.664 26.168 9.403 1.00 0.00 H ATOM 2367 N GLU B 113 29.396 28.385 9.915 1.00 32.14 N ATOM 2368 CA GLU B 113 28.124 29.082 9.832 1.00 35.94 C ATOM 2369 C GLU B 113 27.319 28.886 11.103 1.00 36.44 C ATOM 2370 O GLU B 113 26.759 29.841 11.644 1.00 43.26 O ATOM 2371 CB GLU B 113 27.337 28.608 8.613 1.00 35.70 C ATOM 2372 CG GLU B 113 25.986 29.290 8.436 1.00 47.94 C ATOM 2373 CD GLU B 113 26.085 30.768 8.117 1.00 58.43 C ATOM 2374 OE1 GLU B 113 27.130 31.203 7.577 1.00 64.95 O ATOM 2375 OE2 GLU B 113 25.105 31.494 8.405 1.00 60.51 O ATOM 2376 H GLU B 113 29.555 27.557 9.306 1.00 0.00 H ATOM 2377 N ARG B 114 27.287 27.645 11.579 1.00 31.75 N ATOM 2378 CA ARG B 114 26.572 27.290 12.807 1.00 30.99 C ATOM 2379 C ARG B 114 27.236 27.914 14.035 1.00 23.70 C ATOM 2380 O ARG B 114 26.556 28.271 14.996 1.00 30.51 O ATOM 2381 CB ARG B 114 26.491 25.769 12.948 1.00 28.32 C ATOM 2382 CG ARG B 114 25.735 25.257 14.166 1.00 29.25 C ATOM 2383 CD ARG B 114 24.325 25.853 14.234 1.00 28.01 C ATOM 2384 NE ARG B 114 23.682 25.827 12.925 1.00 31.89 N ATOM 2385 CZ ARG B 114 22.804 24.916 12.521 1.00 28.70 C ATOM 2386 NH1 ARG B 114 22.474 23.911 13.310 1.00 28.88 N ATOM 2387 NH2 ARG B 114 22.293 24.991 11.300 1.00 31.50 N ATOM 2388 HE ARG B 114 23.931 26.582 12.255 1.00 0.00 H ATOM 2389 HH12 ARG B 114 21.786 23.201 12.988 1.00 0.00 H ATOM 2390 HH11 ARG B 114 22.902 23.829 14.254 1.00 0.00 H ATOM 2391 HH22 ARG B 114 21.605 24.280 10.980 1.00 0.00 H ATOM 2392 HH21 ARG B 114 22.580 25.761 10.663 1.00 0.00 H ATOM 2393 H ARG B 114 27.789 26.897 11.059 1.00 0.00 H ATOM 2394 N TYR B 115 28.567 28.019 14.004 1.00 26.11 N ATOM 2395 CA TYR B 115 29.313 28.747 15.034 1.00 19.03 C ATOM 2396 C TYR B 115 28.988 30.244 15.049 1.00 19.07 C ATOM 2397 O TYR B 115 28.937 30.846 16.116 1.00 29.27 O ATOM 2398 CB TYR B 115 30.826 28.564 14.873 1.00 25.52 C ATOM 2399 CG TYR B 115 31.397 27.376 15.603 1.00 22.37 C ATOM 2400 CD1 TYR B 115 31.278 27.283 16.983 1.00 21.92 C ATOM 2401 CD2 TYR B 115 32.090 26.373 14.933 1.00 21.26 C ATOM 2402 CE1 TYR B 115 31.808 26.205 17.682 1.00 27.15 C ATOM 2403 CE2 TYR B 115 32.628 25.291 15.623 1.00 21.57 C ATOM 2404 CZ TYR B 115 32.484 25.210 17.001 1.00 29.44 C ATOM 2405 OH TYR B 115 33.009 24.137 17.705 1.00 32.26 O ATOM 2406 HH TYR B 115 32.600 23.297 17.377 1.00 0.00 H ATOM 2407 H TYR B 115 29.090 27.570 13.225 1.00 0.00 H ATOM 2408 N ASP B 116 28.808 30.845 13.874 1.00 21.36 N ATOM 2409 CA ASP B 116 28.385 32.244 13.796 1.00 30.98 C ATOM 2410 C ASP B 116 27.014 32.435 14.432 1.00 29.81 C ATOM 2411 O ASP B 116 26.774 33.435 15.099 1.00 38.15 O ATOM 2412 CB ASP B 116 28.345 32.732 12.347 1.00 32.42 C ATOM 2413 CG ASP B 116 29.722 33.016 11.787 1.00 37.28 C ATOM 2414 OD1 ASP B 116 30.662 33.180 12.592 1.00 35.77 O ATOM 2415 OD2 ASP B 116 29.858 33.095 10.545 1.00 42.33 O ATOM 2416 H ASP B 116 28.971 30.311 12.997 1.00 0.00 H ATOM 2417 N ALA B 117 26.119 31.478 14.217 1.00 26.63 N ATOM 2418 CA ALA B 117 24.783 31.542 14.802 1.00 30.74 C ATOM 2419 C ALA B 117 24.852 31.428 16.331 1.00 34.99 C ATOM 2420 O ALA B 117 24.216 32.207 17.045 1.00 37.98 O ATOM 2421 CB ALA B 117 23.899 30.454 14.225 1.00 26.55 C ATOM 2422 H ALA B 117 26.375 30.666 13.620 1.00 0.00 H ATOM 2423 N ILE B 118 25.646 30.473 16.824 1.00 26.29 N ATOM 2424 CA ILE B 118 25.848 30.292 18.260 1.00 23.33 C ATOM 2425 C ILE B 118 26.474 31.516 18.903 1.00 31.72 C ATOM 2426 O ILE B 118 26.090 31.933 19.996 1.00 36.27 O ATOM 2427 CB ILE B 118 26.741 29.070 18.548 1.00 22.06 C ATOM 2428 CG1 ILE B 118 26.011 27.795 18.131 1.00 25.89 C ATOM 2429 CG2 ILE B 118 27.075 28.971 20.041 1.00 23.28 C ATOM 2430 CD1 ILE B 118 26.852 26.546 18.250 1.00 27.79 C ATOM 2431 H ILE B 118 26.137 29.837 16.163 1.00 0.00 H ATOM 2432 N GLU B 119 27.428 32.107 18.199 1.00 32.29 N ATOM 2433 CA GLU B 119 28.154 33.255 18.704 1.00 31.70 C ATOM 2434 C GLU B 119 27.227 34.467 18.827 1.00 33.26 C ATOM 2435 O GLU B 119 27.438 35.351 19.655 1.00 34.33 O ATOM 2436 CB GLU B 119 29.341 33.543 17.790 1.00 40.52 C ATOM 2437 CG GLU B 119 30.240 34.672 18.246 1.00 49.45 C ATOM 2438 CD GLU B 119 31.481 34.793 17.388 1.00 53.56 C ATOM 2439 OE1 GLU B 119 31.666 33.941 16.505 1.00 54.61 O ATOM 2440 OE2 GLU B 119 32.264 35.741 17.584 1.00 57.42 O ATOM 2441 H GLU B 119 27.663 31.736 17.256 1.00 0.00 H ATOM 2442 N GLU B 120 26.215 34.504 17.968 1.00 30.25 N ATOM 2443 CA GLU B 120 25.187 35.523 18.005 1.00 34.46 C ATOM 2444 C GLU B 120 24.223 35.300 19.173 1.00 32.85 C ATOM 2445 O GLU B 120 23.474 36.199 19.544 1.00 33.69 O ATOM 2446 CB GLU B 120 24.429 35.564 16.671 1.00 35.96 C ATOM 2447 CG GLU B 120 25.282 36.106 15.530 1.00 43.36 C ATOM 2448 CD GLU B 120 24.604 36.020 14.176 1.00 49.17 C ATOM 2449 OE1 GLU B 120 23.486 35.463 14.087 1.00 52.71 O ATOM 2450 OE2 GLU B 120 25.201 36.511 13.195 1.00 52.51 O ATOM 2451 H GLU B 120 26.158 33.768 17.236 1.00 0.00 H ATOM 2452 N VAL B 121 24.214 34.101 19.741 1.00 32.24 N ATOM 2453 CA VAL B 121 23.322 33.851 20.866 1.00 30.93 C ATOM 2454 C VAL B 121 24.012 34.223 22.163 1.00 37.91 C ATOM 2455 O VAL B 121 23.471 34.986 22.955 1.00 42.97 O ATOM 2456 CB VAL B 121 22.885 32.385 20.947 1.00 31.40 C ATOM 2457 CG1 VAL B 121 22.039 32.157 22.197 1.00 36.03 C ATOM 2458 CG2 VAL B 121 22.127 31.995 19.708 1.00 24.88 C ATOM 2459 H VAL B 121 24.837 33.347 19.387 1.00 0.00 H ATOM 2460 N LEU B 122 25.214 33.698 22.370 1.00 39.43 N ATOM 2461 CA LEU B 122 25.981 34.006 23.575 1.00 40.14 C ATOM 2462 C LEU B 122 26.657 35.373 23.515 1.00 39.38 C ATOM 2463 O LEU B 122 26.761 36.073 24.524 1.00 39.41 O ATOM 2464 CB LEU B 122 27.039 32.930 23.815 1.00 42.71 C ATOM 2465 CG LEU B 122 26.474 31.558 24.179 1.00 48.51 C ATOM 2466 CD1 LEU B 122 27.593 30.615 24.567 1.00 50.54 C ATOM 2467 CD2 LEU B 122 25.466 31.693 25.313 1.00 48.52 C ATOM 2468 H LEU B 122 25.618 33.054 21.660 1.00 0.00 H ATOM 2469 N GLY B 123 27.070 35.775 22.318 1.00 38.63 N ATOM 2470 CA GLY B 123 27.846 36.994 22.144 1.00 32.84 C ATOM 2471 C GLY B 123 29.289 36.638 21.840 1.00 38.19 C ATOM 2472 O GLY B 123 29.833 35.675 22.395 1.00 42.36 O ATOM 2473 H GLY B 123 26.832 35.203 21.483 1.00 0.00 H ATOM 2474 N ARG B 124 29.907 37.410 20.951 1.00 37.94 N ATOM 2475 CA ARG B 124 31.276 37.155 20.529 1.00 40.30 C ATOM 2476 C ARG B 124 32.261 37.235 21.680 1.00 41.59 C ATOM 2477 O ARG B 124 33.162 36.402 21.792 1.00 50.76 O ATOM 2478 CB ARG B 124 31.703 38.152 19.440 1.00 47.55 C ATOM 2479 CG ARG B 124 33.222 38.148 19.175 1.00 49.82 C ATOM 2480 CD ARG B 124 33.609 38.936 17.936 1.00 52.56 C ATOM 2481 NE ARG B 124 33.297 38.233 16.697 1.00 58.55 N ATOM 2482 CZ ARG B 124 33.652 38.662 15.491 1.00 59.93 C ATOM 2483 NH1 ARG B 124 34.325 39.800 15.365 1.00 59.06 N ATOM 2484 NH2 ARG B 124 33.331 37.956 14.412 1.00 61.78 N ATOM 2485 HE ARG B 124 32.764 37.342 16.762 1.00 0.00 H ATOM 2486 HH12 ARG B 124 34.604 40.138 14.422 1.00 0.00 H ATOM 2487 HH11 ARG B 124 34.573 40.354 16.210 1.00 0.00 H ATOM 2488 HH22 ARG B 124 33.609 38.293 13.468 1.00 0.00 H ATOM 2489 HH21 ARG B 124 32.801 37.067 14.511 1.00 0.00 H ATOM 2490 H ARG B 124 29.397 38.220 20.545 1.00 0.00 H ATOM 2491 N GLU B 125 32.082 38.232 22.538 1.00 36.74 N ATOM 2492 CA GLU B 125 32.983 38.431 23.663 1.00 34.09 C ATOM 2493 C GLU B 125 32.979 37.217 24.587 1.00 31.24 C ATOM 2494 O GLU B 125 34.042 36.744 24.993 1.00 35.75 O ATOM 2495 CB GLU B 125 32.634 39.721 24.400 1.00 38.17 C ATOM 2496 CG GLU B 125 33.430 39.987 25.669 1.00 43.69 C ATOM 2497 CD GLU B 125 33.304 41.433 26.122 1.00 52.19 C ATOM 2498 OE1 GLU B 125 32.921 42.286 25.289 1.00 54.82 O ATOM 2499 OE2 GLU B 125 33.529 41.715 27.316 1.00 58.58 O ATOM 2500 H GLU B 125 31.282 38.883 22.403 1.00 0.00 H ATOM 2501 N LYS B 126 31.795 36.695 24.899 1.00 25.69 N ATOM 2502 CA LYS B 126 31.700 35.519 25.761 1.00 25.83 C ATOM 2503 C LYS B 126 32.323 34.293 25.108 1.00 32.38 C ATOM 2504 O LYS B 126 32.937 33.465 25.779 1.00 29.64 O ATOM 2505 CB LYS B 126 30.245 35.218 26.126 1.00 22.83 C ATOM 2506 CG LYS B 126 29.705 36.103 27.232 1.00 30.63 C ATOM 2507 CD LYS B 126 28.327 35.642 27.657 1.00 33.47 C ATOM 2508 CE LYS B 126 27.753 36.548 28.723 1.00 36.91 C ATOM 2509 NZ LYS B 126 26.337 36.155 28.986 1.00 43.28 N ATOM 2510 HZ1 LYS B 126 25.784 36.249 28.110 1.00 0.00 H ATOM 2511 HZ2 LYS B 126 26.307 35.168 29.311 1.00 0.00 H ATOM 2512 HZ3 LYS B 126 25.937 36.775 29.719 1.00 0.00 H ATOM 2513 H LYS B 126 30.927 37.129 24.525 1.00 0.00 H HETATM 2514 N MSE B 127 32.165 34.175 23.796 1.00 36.72 N HETATM 2515 CA MSE B 127 32.734 33.044 23.083 1.00 30.78 C HETATM 2516 C MSE B 127 34.257 33.108 23.111 1.00 31.34 C HETATM 2517 O MSE B 127 34.936 32.082 23.216 1.00 32.85 O HETATM 2518 CB MSE B 127 32.246 33.009 21.640 1.00 30.12 C HETATM 2519 CG MSE B 127 32.440 31.646 20.996 1.00 38.41 C HETATM 2520 SE MSE B 127 31.328 30.326 21.910 1.00 99.61 S HETATM 2521 CE MSE B 127 29.604 31.099 21.472 1.00 68.13 C HETATM 2522 H MSE B 127 31.630 34.898 23.274 1.00 0.00 H ATOM 2523 N LEU B 128 34.783 34.326 23.008 1.00 28.84 N ATOM 2524 CA LEU B 128 36.224 34.552 23.017 1.00 24.01 C ATOM 2525 C LEU B 128 36.748 34.328 24.429 1.00 20.97 C ATOM 2526 O LEU B 128 37.805 33.731 24.614 1.00 32.03 O ATOM 2527 CB LEU B 128 36.555 35.953 22.515 1.00 23.68 C ATOM 2528 CG LEU B 128 36.619 36.101 20.986 1.00 28.69 C ATOM 2529 CD1 LEU B 128 36.619 37.571 20.583 1.00 29.47 C ATOM 2530 CD2 LEU B 128 37.833 35.390 20.407 1.00 28.11 C ATOM 2531 H LEU B 128 34.146 35.143 22.918 1.00 0.00 H ATOM 2532 N LEU B 129 36.003 34.808 25.420 1.00 22.41 N ATOM 2533 CA LEU B 129 36.343 34.583 26.824 1.00 20.59 C ATOM 2534 C LEU B 129 36.449 33.106 27.156 1.00 27.69 C ATOM 2535 O LEU B 129 37.365 32.700 27.870 1.00 36.77 O ATOM 2536 CB LEU B 129 35.305 35.220 27.746 1.00 22.29 C ATOM 2537 CG LEU B 129 35.409 36.739 27.838 1.00 25.94 C ATOM 2538 CD1 LEU B 129 34.207 37.330 28.564 1.00 23.66 C ATOM 2539 CD2 LEU B 129 36.714 37.109 28.529 1.00 29.97 C ATOM 2540 H LEU B 129 35.152 35.360 25.189 1.00 0.00 H ATOM 2541 N LEU B 130 35.508 32.312 26.646 1.00 26.09 N ATOM 2542 CA LEU B 130 35.474 30.876 26.914 1.00 31.16 C ATOM 2543 C LEU B 130 36.684 30.194 26.295 1.00 33.69 C ATOM 2544 O LEU B 130 37.334 29.357 26.936 1.00 31.21 O ATOM 2545 CB LEU B 130 34.170 30.244 26.391 1.00 25.25 C ATOM 2546 CG LEU B 130 34.054 28.718 26.504 1.00 31.00 C ATOM 2547 CD1 LEU B 130 34.195 28.246 27.948 1.00 32.45 C ATOM 2548 CD2 LEU B 130 32.750 28.206 25.897 1.00 31.34 C ATOM 2549 H LEU B 130 34.774 32.728 26.038 1.00 0.00 H ATOM 2550 N LYS B 131 36.969 30.553 25.048 1.00 27.88 N ATOM 2551 CA LYS B 131 38.141 30.061 24.322 1.00 28.53 C ATOM 2552 C LYS B 131 39.441 30.436 25.026 1.00 28.98 C ATOM 2553 O LYS B 131 40.407 29.681 25.030 1.00 34.03 O ATOM 2554 CB LYS B 131 38.143 30.623 22.896 1.00 31.88 C ATOM 2555 CG LYS B 131 37.081 29.995 22.000 1.00 37.84 C ATOM 2556 CD LYS B 131 36.907 30.731 20.675 1.00 38.75 C ATOM 2557 CE LYS B 131 38.209 30.863 19.908 1.00 36.01 C ATOM 2558 NZ LYS B 131 37.927 31.275 18.507 1.00 38.99 N ATOM 2559 HZ1 LYS B 131 37.328 30.558 18.050 1.00 0.00 H ATOM 2560 HZ2 LYS B 131 37.433 32.190 18.509 1.00 0.00 H ATOM 2561 HZ3 LYS B 131 38.823 31.364 17.986 1.00 0.00 H ATOM 2562 H LYS B 131 36.329 31.215 24.565 1.00 0.00 H ATOM 2563 N ASP B 132 39.466 31.623 25.610 1.00 29.89 N ATOM 2564 CA ASP B 132 40.664 32.102 26.273 1.00 35.44 C ATOM 2565 C ASP B 132 40.855 31.356 27.584 1.00 38.39 C ATOM 2566 O ASP B 132 41.968 30.950 27.922 1.00 44.51 O ATOM 2567 CB ASP B 132 40.572 33.609 26.507 1.00 39.91 C ATOM 2568 CG ASP B 132 41.795 34.169 27.185 1.00 43.40 C ATOM 2569 OD1 ASP B 132 42.736 34.557 26.471 1.00 43.35 O ATOM 2570 OD2 ASP B 132 41.814 34.227 28.435 1.00 53.83 O ATOM 2571 H ASP B 132 38.615 32.221 25.593 1.00 0.00 H ATOM 2572 N LEU B 133 39.758 31.142 28.304 1.00 33.73 N ATOM 2573 CA LEU B 133 39.815 30.435 29.578 1.00 30.67 C ATOM 2574 C LEU B 133 40.164 28.951 29.409 1.00 32.73 C ATOM 2575 O LEU B 133 40.902 28.400 30.226 1.00 33.57 O ATOM 2576 CB LEU B 133 38.494 30.592 30.335 1.00 32.38 C ATOM 2577 CG LEU B 133 38.240 31.984 30.918 1.00 31.66 C ATOM 2578 CD1 LEU B 133 36.898 32.039 31.629 1.00 27.77 C ATOM 2579 CD2 LEU B 133 39.366 32.344 31.894 1.00 32.21 C ATOM 2580 H LEU B 133 38.842 31.485 27.952 1.00 0.00 H ATOM 2581 N LEU B 134 39.621 28.304 28.377 1.00 27.15 N ATOM 2582 CA LEU B 134 39.985 26.920 28.068 1.00 23.30 C ATOM 2583 C LEU B 134 41.478 26.812 27.784 1.00 27.98 C ATOM 2584 O LEU B 134 42.138 25.860 28.197 1.00 31.97 O ATOM 2585 CB LEU B 134 39.202 26.386 26.867 1.00 21.98 C ATOM 2586 CG LEU B 134 37.689 26.203 27.064 1.00 26.16 C ATOM 2587 CD1 LEU B 134 37.001 25.775 25.770 1.00 20.03 C ATOM 2588 CD2 LEU B 134 37.391 25.227 28.198 1.00 26.54 C ATOM 2589 H LEU B 134 38.924 28.793 27.779 1.00 0.00 H ATOM 2590 N ALA B 135 41.994 27.786 27.047 1.00 29.95 N ATOM 2591 CA ALA B 135 43.408 27.824 26.712 1.00 35.48 C ATOM 2592 C ALA B 135 44.259 28.051 27.959 1.00 39.84 C ATOM 2593 O ALA B 135 45.337 27.475 28.102 1.00 43.56 O ATOM 2594 CB ALA B 135 43.667 28.898 25.684 1.00 33.75 C ATOM 2595 H ALA B 135 41.371 28.543 26.700 1.00 0.00 H ATOM 2596 N GLU B 136 43.764 28.886 28.867 1.00 31.96 N ATOM 2597 CA GLU B 136 44.450 29.124 30.126 1.00 26.49 C ATOM 2598 C GLU B 136 44.352 27.885 31.014 1.00 32.71 C ATOM 2599 O GLU B 136 45.306 27.537 31.710 1.00 34.50 O ATOM 2600 CB GLU B 136 43.877 30.355 30.835 1.00 31.01 C ATOM 2601 CG GLU B 136 44.275 31.665 30.186 1.00 39.09 C ATOM 2602 CD GLU B 136 43.843 32.869 30.985 1.00 48.37 C ATOM 2603 OE1 GLU B 136 43.545 32.716 32.187 1.00 51.29 O ATOM 2604 OE2 GLU B 136 43.842 33.981 30.422 1.00 57.01 O ATOM 2605 H GLU B 136 42.869 29.378 28.673 1.00 0.00 H ATOM 2606 N LEU B 137 43.221 27.188 30.940 1.00 27.07 N ATOM 2607 CA LEU B 137 43.022 25.967 31.721 1.00 28.60 C ATOM 2608 C LEU B 137 44.001 24.889 31.296 1.00 35.84 C ATOM 2609 O LEU B 137 44.556 24.178 32.136 1.00 38.58 O ATOM 2610 CB LEU B 137 41.594 25.441 31.560 1.00 23.66 C ATOM 2611 CG LEU B 137 41.227 24.101 32.216 1.00 21.59 C ATOM 2612 CD1 LEU B 137 41.554 24.050 33.702 1.00 28.02 C ATOM 2613 CD2 LEU B 137 39.769 23.757 31.969 1.00 21.92 C ATOM 2614 H LEU B 137 42.461 27.519 30.312 1.00 0.00 H ATOM 2615 N ALA B 138 44.250 24.801 29.995 1.00 36.14 N ATOM 2616 CA ALA B 138 45.133 23.769 29.474 1.00 28.40 C ATOM 2617 C ALA B 138 46.573 24.049 29.886 1.00 30.11 C ATOM 2618 O ALA B 138 47.356 23.124 30.079 1.00 36.05 O ATOM 2619 CB ALA B 138 45.010 23.668 27.955 1.00 26.32 C ATOM 2620 H ALA B 138 43.809 25.478 29.340 1.00 0.00 H ATOM 2621 N LYS B 139 46.914 25.321 30.059 1.00 34.12 N ATOM 2622 CA LYS B 139 48.294 25.671 30.366 1.00 33.26 C ATOM 2623 C LYS B 139 48.528 25.587 31.868 1.00 32.29 C ATOM 2624 O LYS B 139 49.642 25.350 32.307 1.00 34.92 O ATOM 2625 CB LYS B 139 48.608 27.082 29.855 1.00 35.21 C ATOM 2626 CG LYS B 139 50.045 27.548 30.056 1.00 46.40 C ATOM 2627 CD LYS B 139 50.226 29.009 29.624 1.00 49.25 C ATOM 2628 CE LYS B 139 50.349 29.942 30.831 1.00 52.00 C ATOM 2629 NZ LYS B 139 49.225 29.769 31.808 1.00 57.84 N ATOM 2630 HZ1 LYS B 139 48.322 29.974 31.335 1.00 0.00 H ATOM 2631 HZ2 LYS B 139 49.220 28.790 32.159 1.00 0.00 H ATOM 2632 HZ3 LYS B 139 49.357 30.424 32.605 1.00 0.00 H ATOM 2633 H LYS B 139 46.195 26.068 29.975 1.00 0.00 H ATOM 2634 N ILE B 140 47.463 25.707 32.654 1.00 34.64 N ATOM 2635 CA ILE B 140 47.556 25.452 34.087 1.00 37.30 C ATOM 2636 C ILE B 140 47.771 23.954 34.325 1.00 38.19 C ATOM 2637 O ILE B 140 48.603 23.566 35.146 1.00 45.77 O ATOM 2638 CB ILE B 140 46.305 25.943 34.860 1.00 39.57 C ATOM 2639 CG1 ILE B 140 46.112 27.441 34.663 1.00 39.74 C ATOM 2640 CG2 ILE B 140 46.422 25.617 36.342 1.00 41.62 C ATOM 2641 CD1 ILE B 140 47.341 28.237 34.925 1.00 40.71 C ATOM 2642 H ILE B 140 46.550 25.987 32.241 1.00 0.00 H ATOM 2643 N GLU B 141 47.016 23.119 33.611 1.00 31.58 N ATOM 2644 CA GLU B 141 47.109 21.663 33.777 1.00 31.23 C ATOM 2645 C GLU B 141 48.537 21.131 33.607 1.00 34.93 C ATOM 2646 O GLU B 141 48.986 20.288 34.380 1.00 39.11 O ATOM 2647 CB GLU B 141 46.190 20.941 32.793 1.00 35.29 C ATOM 2648 CG GLU B 141 44.686 21.131 32.992 1.00 34.18 C ATOM 2649 CD GLU B 141 44.164 20.563 34.310 1.00 44.58 C ATOM 2650 OE1 GLU B 141 44.811 19.671 34.901 1.00 53.72 O ATOM 2651 OE2 GLU B 141 43.057 20.959 34.722 1.00 54.79 O ATOM 2652 H GLU B 141 46.344 23.509 32.919 1.00 0.00 H ATOM 2653 N ASP B 142 49.243 21.627 32.597 1.00 40.84 N ATOM 2654 CA ASP B 142 50.630 21.238 32.389 1.00 44.04 C ATOM 2655 C ASP B 142 51.511 21.730 33.520 1.00 41.86 C ATOM 2656 O ASP B 142 52.322 20.972 34.056 1.00 38.74 O ATOM 2657 CB ASP B 142 51.151 21.777 31.062 1.00 47.98 C ATOM 2658 CG ASP B 142 50.594 21.031 29.880 1.00 50.31 C ATOM 2659 OD1 ASP B 142 50.248 19.839 30.041 1.00 53.12 O ATOM 2660 OD2 ASP B 142 50.507 21.636 28.792 1.00 48.52 O ATOM 2661 H ASP B 142 48.798 22.304 31.945 1.00 0.00 H ATOM 2662 N ALA B 143 51.342 23.001 33.882 1.00 37.83 N ATOM 2663 CA ALA B 143 52.152 23.608 34.935 1.00 36.32 C ATOM 2664 C ALA B 143 52.037 22.853 36.266 1.00 38.64 C ATOM 2665 O ALA B 143 53.046 22.635 36.949 1.00 40.95 O ATOM 2666 CB ALA B 143 51.772 25.080 35.116 1.00 34.53 C ATOM 2667 H ALA B 143 50.617 23.574 33.404 1.00 0.00 H ATOM 2668 N LEU B 144 50.818 22.441 36.622 1.00 36.91 N ATOM 2669 CA LEU B 144 50.593 21.720 37.875 1.00 43.77 C ATOM 2670 C LEU B 144 51.305 20.365 37.877 1.00 52.15 C ATOM 2671 O LEU B 144 51.719 19.870 38.927 1.00 57.40 O ATOM 2672 CB LEU B 144 49.092 21.528 38.128 1.00 39.72 C ATOM 2673 CG LEU B 144 48.321 22.815 38.422 1.00 33.41 C ATOM 2674 CD1 LEU B 144 46.833 22.548 38.413 1.00 30.41 C ATOM 2675 CD2 LEU B 144 48.750 23.397 39.760 1.00 33.55 C ATOM 2676 H LEU B 144 50.011 22.637 35.995 1.00 0.00 H ATOM 2677 N ASN B 145 51.453 19.784 36.692 1.00 51.26 N ATOM 2678 CA ASN B 145 52.060 18.467 36.538 1.00 49.04 C ATOM 2679 C ASN B 145 53.567 18.508 36.257 1.00 53.01 C ATOM 2680 O ASN B 145 54.168 19.584 36.132 1.00 47.04 O ATOM 2681 CB ASN B 145 51.345 17.717 35.420 1.00 47.56 C ATOM 2682 CG ASN B 145 49.857 17.551 35.691 1.00 50.22 C ATOM 2683 OD1 ASN B 145 49.443 17.350 36.834 1.00 55.69 O ATOM 2684 ND2 ASN B 145 49.048 17.623 34.637 1.00 45.68 N ATOM 2685 HD22 ASN B 145 49.442 17.794 33.690 1.00 0.00 H ATOM 2686 HD21 ASN B 145 48.022 17.508 34.760 1.00 0.00 H ATOM 2687 H ASN B 145 51.124 20.287 35.843 1.00 0.00 H TER 2688 ASN B 145 HETATM 2689 O HOH 1 34.608 24.626 10.766 1.00 40.10 O HETATM 2690 O HOH 2 40.003 23.919 15.461 1.00 44.57 O HETATM 2691 O HOH 3 34.776 18.663 16.016 1.00 28.49 O HETATM 2692 O HOH 4 41.189 22.765 26.081 1.00 28.75 O HETATM 2693 O HOH 5 33.650 14.764 26.836 1.00 24.86 O HETATM 2694 O HOH 6 10.686 13.200 32.744 1.00 27.94 O HETATM 2695 O HOH 7 39.597 3.566 33.916 1.00 36.97 O HETATM 2696 O HOH 8 42.451 3.230 34.535 1.00 25.94 O HETATM 2697 O HOH 9 32.182 5.363 32.625 1.00 28.91 O HETATM 2698 O HOH 10 33.689 11.750 35.867 1.00 26.53 O HETATM 2699 O HOH 11 28.362 8.850 28.425 1.00 42.44 O HETATM 2700 O HOH 12 26.274 6.728 27.146 1.00 28.33 O HETATM 2701 O HOH 13 27.945 0.372 35.684 1.00 35.70 O HETATM 2702 O HOH 14 29.503 -0.748 41.010 1.00 51.42 O HETATM 2703 O HOH 15 21.431 12.551 46.173 1.00 25.19 O HETATM 2704 O HOH 16 26.412 20.129 39.597 1.00 44.60 O HETATM 2705 O HOH 17 11.688 10.860 34.786 1.00 27.10 O HETATM 2706 O HOH 18 23.888 20.150 36.355 1.00 39.29 O HETATM 2707 O HOH 19 23.358 -3.044 32.169 1.00 36.10 O HETATM 2708 O HOH 20 15.317 2.188 38.371 1.00 48.98 O HETATM 2709 O HOH 21 22.454 -5.519 36.474 1.00 46.63 O HETATM 2710 O HOH 22 3.397 7.542 41.887 1.00 35.41 O HETATM 2711 O HOH 23 6.119 18.346 40.029 1.00 35.54 O HETATM 2712 O HOH 24 5.330 15.757 36.720 1.00 53.20 O HETATM 2713 O HOH 25 18.515 16.181 49.981 1.00 36.65 O HETATM 2714 O HOH 26 19.954 5.746 53.462 1.00 33.36 O HETATM 2715 O HOH 27 43.215 15.762 42.810 1.00 35.37 O HETATM 2716 O HOH 28 42.148 10.599 50.768 1.00 27.73 O HETATM 2717 O HOH 29 40.388 36.173 41.189 1.00 36.97 O HETATM 2718 O HOH 30 29.068 24.903 34.394 1.00 33.40 O HETATM 2719 O HOH 31 34.347 22.587 39.886 1.00 36.56 O HETATM 2720 O HOH 32 31.115 23.934 35.707 1.00 33.69 O HETATM 2721 O HOH 33 32.520 8.493 5.603 1.00 38.77 O HETATM 2722 O HOH 34 33.119 7.153 14.464 1.00 37.95 O HETATM 2723 O HOH 35 28.767 10.741 15.866 1.00 36.99 O HETATM 2724 O HOH 36 50.761 16.480 17.529 1.00 69.82 O HETATM 2725 O HOH 37 38.225 5.830 22.373 1.00 31.54 O HETATM 2726 O HOH 38 45.564 3.885 23.311 1.00 44.11 O HETATM 2727 O HOH 39 45.126 2.386 9.473 1.00 41.58 O HETATM 2728 O HOH 40 47.090 16.416 2.554 1.00 51.24 O HETATM 2729 O HOH 41 30.667 29.799 6.684 1.00 37.48 O HETATM 2730 O HOH 42 27.023 37.805 13.294 1.00 47.27 O HETATM 2731 O HOH 43 32.432 42.878 22.952 1.00 34.24 O HETATM 2732 O HOH 44 41.510 23.511 28.295 1.00 34.85 O HETATM 2733 O HOH 45 56.470 19.616 37.162 1.00 37.45 O HETATM 2734 C8 UNN A 46 33.216 21.481 15.643 1.00 0.04 C HETATM 2735 O1 UNN A 46 34.007 21.119 14.725 1.00 -0.57 O HETATM 2736 O2 UNN A 46 33.670 21.933 16.737 1.00 -0.57 O HETATM 2737 C7 UNN A 46 31.739 21.376 15.426 1.00 0.03 C HETATM 2738 C1 UNN A 46 31.197 20.215 16.196 1.00 -0.04 C HETATM 2739 C2 UNN A 46 31.057 18.884 15.536 1.00 -0.07 C HETATM 2740 C3 UNN A 46 30.561 17.822 16.230 1.00 -0.04 C HETATM 2741 C4 UNN A 46 30.167 17.981 17.657 1.00 0.08 C HETATM 2742 C5 UNN A 46 30.299 19.196 18.270 1.00 -0.04 C HETATM 2743 C6 UNN A 46 30.832 20.364 17.504 1.00 -0.07 C HETATM 2744 H6 UNN A 46 30.929 21.330 17.987 1.00 0.05 H HETATM 2745 H5 UNN A 46 30.017 19.312 19.310 1.00 0.05 H HETATM 2746 O4 UNN A 46 29.674 16.902 18.351 1.00 -0.34 O HETATM 2747 H7 UNN A 46 29.649 16.144 17.779 1.00 0.25 H HETATM 2748 H4 UNN A 46 30.453 16.860 15.743 1.00 0.05 H HETATM 2749 H3 UNN A 46 31.351 18.762 14.500 1.00 0.05 H HETATM 2750 H1 UNN A 46 31.536 21.231 14.355 1.00 0.06 H HETATM 2751 H2 UNN A 46 31.253 22.301 15.769 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 2 1 3 5 CONECT 3 2 4 12 CONECT 4 3 CONECT 5 2 6 CONECT 6 5 7 CONECT 7 6 8 CONECT 8 7 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 198 191 199 206 CONECT 199 198 200 202 CONECT 200 199 201 207 CONECT 201 200 CONECT 202 199 203 CONECT 203 202 204 CONECT 204 203 205 CONECT 205 204 CONECT 206 198 CONECT 1252 1241 1253 1260 CONECT 1253 1252 1254 1256 CONECT 1254 1253 1255 1261 CONECT 1255 1254 CONECT 1256 1253 1257 CONECT 1257 1256 1258 CONECT 1258 1257 1259 CONECT 1259 1258 CONECT 1260 1252 CONECT 1392 1393 1399 1400 1401 CONECT 1399 1392 CONECT 1400 1392 CONECT 1401 1392 CONECT 1514 1507 1515 1522 CONECT 1515 1514 1516 1518 CONECT 1516 1515 1517 1523 CONECT 1517 1516 CONECT 1518 1515 1519 CONECT 1519 1518 1520 CONECT 1520 1519 1521 CONECT 1521 1520 CONECT 1522 1514 CONECT 2150 2151 2166 2167 2168 CONECT 2166 2150 CONECT 2167 2150 CONECT 2168 2150 CONECT 2514 2503 2515 2522 CONECT 2515 2514 2516 2518 CONECT 2516 2515 2517 2523 CONECT 2517 2516 CONECT 2518 2515 2519 CONECT 2519 2518 2520 CONECT 2520 2519 2521 CONECT 2521 2520 CONECT 2522 2514 CONECT 2734 2735 2736 2737 CONECT 2735 2734 CONECT 2736 2734 CONECT 2737 2734 2738 2750 2751 CONECT 2738 2737 2739 2743 CONECT 2739 2738 2740 2749 CONECT 2740 2739 2741 2748 CONECT 2741 2740 2742 2746 CONECT 2742 2741 2743 2745 CONECT 2743 2738 2742 2744 CONECT 2744 2743 CONECT 2745 2742 CONECT 2746 2741 2747 CONECT 2747 2746 CONECT 2748 2740 CONECT 2749 2739 CONECT 2750 2737 CONECT 2751 2737 MASTER 0 0 0 0 0 0 0 0 2748 3 73 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5aip
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
1ai6
RCSB PDB
PDBbind
4HP
3pcg
RCSB PDB
PDBbind
4HP
Entry Information
PDB ID
5aip
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Neisseria adhesin A
Ligand Name
4HP
EC.Number
E.C.-.-.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=1.5mM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Plos Pathog. Vol. 12: pp. 5557-5581
Ligand Properties
Formula
C
8
H
8
O
3
Molecular Weight
152.147
Exact Mass
152.047
No. of atoms
19
No. of bonds
19
Polar Surface Area
57.53
LOGP Value
2.47 (
Computed with XLOGP3
)
1.02 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
Canonical SMILES
OC(=O)Cc1ccc(cc1)O
InChI String
InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
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):
Q7DD70
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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