Browse entries in the PDBbind-CN Database
HEADER 1VYF_COMPLEX COMPND 1VYF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 135 GLY SER MET SER SER PHE LEU GLY LYS TRP LYS LEU SER SEQRES 2 A 135 GLU SER HIS ASN PHE ASP ALA VAL MET SER LYS LEU GLY SEQRES 3 A 135 VAL SER TRP ALA THR ARG GLN ILE GLY ASN THR VAL THR SEQRES 4 A 135 PRO THR VAL THR PHE THR MET ASP GLY ASP LYS MET THR SEQRES 5 A 135 MET LEU THR GLU SER THR PHE LYS ASN LEU SER CYS THR SEQRES 6 A 135 PHE LYS PHE GLY GLU GLU PHE ASP GLU LYS THR SER ASP SEQRES 7 A 135 GLY ARG ASN VAL LYS SER VAL VAL GLU LYS ASN SER GLU SEQRES 8 A 135 SER LYS LEU THR GLN THR GLN VAL ASP PRO LYS ASN THR SEQRES 9 A 135 THR VAL ILE VAL ARG GLU VAL ASP GLY ASP THR MET LYS SEQRES 10 A 135 THR THR VAL THR VAL GLY ASP VAL THR ALA ILE ARG ASN SEQRES 11 A 135 TYR LYS ARG LEU SER HET OLA A 309 53 ATOM 1 N GLY A -1 39.713 39.849 10.922 1.00 55.55 N ATOM 2 CA GLY A -1 38.621 40.028 11.928 1.00 55.62 C ATOM 3 C GLY A -1 37.780 38.777 12.063 1.00 55.43 C ATOM 4 O GLY A -1 37.937 37.829 11.287 1.00 56.13 O ATOM 5 HA3 GLY A -1 37.981 40.853 11.614 1.00 0.00 H ATOM 6 HA2 GLY A -1 39.065 40.262 12.895 1.00 0.00 H ATOM 7 HN3 GLY A -1 39.296 39.631 9.995 1.00 0.00 H ATOM 8 HN2 GLY A -1 40.331 39.067 11.218 1.00 0.00 H ATOM 9 HN1 GLY A -1 40.269 40.726 10.856 1.00 0.00 H ATOM 10 N SER A 0 36.884 38.757 13.044 1.00 54.77 N ATOM 11 CA SER A 0 36.110 37.553 13.288 1.00 54.17 C ATOM 12 C SER A 0 34.911 37.441 12.338 1.00 52.85 C ATOM 13 O SER A 0 34.373 38.452 11.854 1.00 52.92 O ATOM 14 CB SER A 0 35.707 37.422 14.757 1.00 54.37 C ATOM 15 OG SER A 0 34.668 38.309 15.125 1.00 55.56 O ATOM 16 HA SER A 0 36.758 36.705 13.069 1.00 0.00 H ATOM 17 HB2 SER A 0 36.579 37.631 15.377 1.00 0.00 H ATOM 18 HB3 SER A 0 35.372 36.400 14.936 1.00 0.00 H ATOM 19 HG SER A 0 34.449 38.181 16.082 1.00 0.00 H ATOM 20 H SER A 0 36.738 39.600 13.635 1.00 0.00 H ATOM 21 N MET A 1 34.548 36.197 12.035 1.00 51.30 N ATOM 22 CA MET A 1 33.465 35.891 11.092 1.00 49.83 C ATOM 23 C MET A 1 33.655 36.525 9.716 1.00 47.77 C ATOM 24 O MET A 1 32.690 36.704 8.982 1.00 47.38 O ATOM 25 CB MET A 1 32.110 36.312 11.693 1.00 49.59 C ATOM 26 CG MET A 1 31.921 35.852 13.142 1.00 50.71 C ATOM 27 SD MET A 1 30.891 34.378 13.231 1.00 50.44 S ATOM 28 CE MET A 1 31.430 33.512 14.692 1.00 51.41 C ATOM 29 HA MET A 1 33.486 34.813 10.934 1.00 0.00 H ATOM 30 HB2 MET A 1 32.041 37.399 11.663 1.00 0.00 H ATOM 31 HB3 MET A 1 31.313 35.882 11.086 1.00 0.00 H ATOM 32 HG2 MET A 1 31.446 36.652 13.710 1.00 0.00 H ATOM 33 HG3 MET A 1 32.897 35.631 13.575 1.00 0.00 H ATOM 34 HE1 MET A 1 32.485 33.257 14.593 1.00 0.00 H ATOM 35 HE2 MET A 1 31.290 34.151 15.564 1.00 0.00 H ATOM 36 HE3 MET A 1 30.844 32.601 14.810 1.00 0.00 H ATOM 37 H MET A 1 35.053 35.408 12.486 1.00 0.00 H ATOM 38 N SER A 2 34.896 36.837 9.353 1.00 45.51 N ATOM 39 CA SER A 2 35.171 37.576 8.127 1.00 43.71 C ATOM 40 C SER A 2 34.615 36.926 6.847 1.00 41.65 C ATOM 41 O SER A 2 34.320 37.624 5.868 1.00 40.58 O ATOM 42 CB SER A 2 36.692 37.808 7.981 1.00 44.57 C ATOM 43 OG SER A 2 37.403 36.594 7.803 1.00 44.42 O ATOM 44 HA SER A 2 34.643 38.524 8.230 1.00 0.00 H ATOM 45 HB2 SER A 2 37.060 38.303 8.880 1.00 0.00 H ATOM 46 HB3 SER A 2 36.869 38.449 7.117 1.00 0.00 H ATOM 47 HG SER A 2 37.080 36.141 6.984 1.00 0.00 H ATOM 48 H SER A 2 35.690 36.547 9.959 1.00 0.00 H ATOM 49 N SER A 3 34.482 35.598 6.834 1.00 39.38 N ATOM 50 CA SER A 3 33.969 34.917 5.639 1.00 37.59 C ATOM 51 C SER A 3 32.466 35.158 5.433 1.00 35.58 C ATOM 52 O SER A 3 31.967 34.986 4.321 1.00 35.93 O ATOM 53 CB SER A 3 34.293 33.410 5.649 1.00 37.20 C ATOM 54 OG SER A 3 33.703 32.750 6.755 1.00 38.14 O ATOM 55 HA SER A 3 34.488 35.359 4.789 1.00 0.00 H ATOM 56 HB2 SER A 3 35.374 33.282 5.698 1.00 0.00 H ATOM 57 HB3 SER A 3 33.917 32.962 4.729 1.00 0.00 H ATOM 58 HG SER A 3 34.045 33.147 7.595 1.00 0.00 H ATOM 59 H SER A 3 34.743 35.043 7.674 1.00 0.00 H ATOM 60 N PHE A 4 31.758 35.547 6.488 1.00 33.19 N ATOM 61 CA PHE A 4 30.320 35.888 6.391 1.00 32.94 C ATOM 62 C PHE A 4 30.020 37.250 5.810 1.00 32.37 C ATOM 63 O PHE A 4 28.906 37.506 5.377 1.00 31.76 O ATOM 64 CB PHE A 4 29.683 35.882 7.781 1.00 32.18 C ATOM 65 CG PHE A 4 29.273 34.522 8.252 1.00 32.94 C ATOM 66 CD1 PHE A 4 30.185 33.693 8.870 1.00 35.83 C ATOM 67 CD2 PHE A 4 27.950 34.096 8.140 1.00 32.50 C ATOM 68 CE1 PHE A 4 29.799 32.452 9.306 1.00 34.74 C ATOM 69 CE2 PHE A 4 27.577 32.861 8.571 1.00 31.36 C ATOM 70 CZ PHE A 4 28.505 32.035 9.142 1.00 32.55 C ATOM 71 HA PHE A 4 29.916 35.130 5.721 1.00 0.00 H ATOM 72 HB2 PHE A 4 30.403 36.289 8.491 1.00 0.00 H ATOM 73 HB3 PHE A 4 28.799 36.519 7.757 1.00 0.00 H ATOM 74 HD2 PHE A 4 27.206 34.761 7.702 1.00 0.00 H ATOM 75 HE2 PHE A 4 26.544 32.532 8.462 1.00 0.00 H ATOM 76 HZ PHE A 4 28.213 31.037 9.469 1.00 0.00 H ATOM 77 HE1 PHE A 4 30.525 31.795 9.785 1.00 0.00 H ATOM 78 HD1 PHE A 4 31.214 34.025 9.012 1.00 0.00 H ATOM 79 H PHE A 4 32.229 35.614 7.413 1.00 0.00 H ATOM 80 N LEU A 5 30.997 38.161 5.872 1.00 33.24 N ATOM 81 CA LEU A 5 30.763 39.573 5.584 1.00 33.19 C ATOM 82 C LEU A 5 30.443 39.822 4.143 1.00 33.15 C ATOM 83 O LEU A 5 31.103 39.322 3.264 1.00 32.89 O ATOM 84 CB LEU A 5 31.983 40.406 5.980 1.00 33.87 C ATOM 85 CG LEU A 5 32.445 40.256 7.425 1.00 34.84 C ATOM 86 CD1 LEU A 5 33.646 41.179 7.644 1.00 37.31 C ATOM 87 CD2 LEU A 5 31.355 40.586 8.376 1.00 37.55 C ATOM 88 HA LEU A 5 29.896 39.871 6.174 1.00 0.00 H ATOM 89 HB2 LEU A 5 32.811 40.118 5.332 1.00 0.00 H ATOM 90 HB3 LEU A 5 31.741 41.456 5.813 1.00 0.00 H ATOM 91 HG LEU A 5 32.729 39.220 7.609 1.00 0.00 H ATOM 92 HD21 LEU A 5 31.036 41.616 8.218 1.00 0.00 H ATOM 93 HD22 LEU A 5 30.513 39.914 8.209 1.00 0.00 H ATOM 94 HD23 LEU A 5 31.718 40.469 9.397 1.00 0.00 H ATOM 95 HD11 LEU A 5 34.449 40.896 6.963 1.00 0.00 H ATOM 96 HD12 LEU A 5 33.350 42.210 7.451 1.00 0.00 H ATOM 97 HD13 LEU A 5 33.991 41.086 8.674 1.00 0.00 H ATOM 98 H LEU A 5 31.955 37.853 6.134 1.00 0.00 H ATOM 99 N GLY A 6 29.421 40.634 3.910 1.00 33.27 N ATOM 100 CA GLY A 6 28.957 40.927 2.576 1.00 32.42 C ATOM 101 C GLY A 6 27.507 40.489 2.382 1.00 32.09 C ATOM 102 O GLY A 6 26.748 40.344 3.347 1.00 32.35 O ATOM 103 HA3 GLY A 6 29.586 40.401 1.858 1.00 0.00 H ATOM 104 HA2 GLY A 6 29.030 42.001 2.403 1.00 0.00 H ATOM 105 H GLY A 6 28.937 41.075 4.718 1.00 0.00 H ATOM 106 N LYS A 7 27.136 40.258 1.136 1.00 31.95 N ATOM 107 CA LYS A 7 25.759 39.958 0.779 1.00 33.22 C ATOM 108 C LYS A 7 25.618 38.588 0.156 1.00 32.74 C ATOM 109 O LYS A 7 26.523 38.116 -0.553 1.00 33.09 O ATOM 110 CB LYS A 7 25.249 40.967 -0.242 1.00 34.20 C ATOM 111 CG LYS A 7 25.102 42.357 0.260 1.00 37.49 C ATOM 112 CD LYS A 7 24.132 43.145 -0.680 1.00 41.99 C ATOM 113 CE LYS A 7 23.814 44.490 -0.107 1.00 43.15 C ATOM 114 NZ LYS A 7 24.397 45.494 -1.013 1.00 46.75 N ATOM 115 HA LYS A 7 25.185 40.000 1.705 1.00 0.00 H ATOM 116 HB2 LYS A 7 25.947 40.983 -1.079 1.00 0.00 H ATOM 117 HB3 LYS A 7 24.273 40.630 -0.591 1.00 0.00 H ATOM 118 HG2 LYS A 7 24.695 42.338 1.271 1.00 0.00 H ATOM 119 HG3 LYS A 7 26.076 42.846 0.271 1.00 0.00 H ATOM 120 HD2 LYS A 7 24.604 43.274 -1.654 1.00 0.00 H ATOM 121 HD3 LYS A 7 23.208 42.578 -0.797 1.00 0.00 H ATOM 122 HE2 LYS A 7 24.249 44.586 0.888 1.00 0.00 H ATOM 123 HE3 LYS A 7 22.734 44.624 -0.044 1.00 0.00 H ATOM 124 HZ1 LYS A 7 25.426 45.352 -1.070 1.00 0.00 H ATOM 125 HZ2 LYS A 7 23.979 45.389 -1.959 1.00 0.00 H ATOM 126 HZ3 LYS A 7 24.197 46.447 -0.648 1.00 0.00 H ATOM 127 H LYS A 7 27.854 40.292 0.384 1.00 0.00 H ATOM 128 N TRP A 8 24.436 37.998 0.349 1.00 30.81 N ATOM 129 CA TRP A 8 24.157 36.609 -0.020 1.00 30.05 C ATOM 130 C TRP A 8 22.741 36.544 -0.569 1.00 29.49 C ATOM 131 O TRP A 8 21.893 37.236 -0.064 1.00 29.47 O ATOM 132 CB TRP A 8 24.260 35.692 1.226 1.00 28.66 C ATOM 133 CG TRP A 8 25.608 35.691 1.851 1.00 28.98 C ATOM 134 CD1 TRP A 8 26.073 36.557 2.815 1.00 28.32 C ATOM 135 CD2 TRP A 8 26.680 34.785 1.585 1.00 29.26 C ATOM 136 NE1 TRP A 8 27.368 36.245 3.136 1.00 30.74 N ATOM 137 CE2 TRP A 8 27.771 35.174 2.385 1.00 29.56 C ATOM 138 CE3 TRP A 8 26.831 33.674 0.745 1.00 26.76 C ATOM 139 CZ2 TRP A 8 28.993 34.485 2.377 1.00 28.64 C ATOM 140 CZ3 TRP A 8 28.025 32.991 0.752 1.00 26.34 C ATOM 141 CH2 TRP A 8 29.095 33.404 1.555 1.00 27.39 C ATOM 142 HA TRP A 8 24.879 36.272 -0.764 1.00 0.00 H ATOM 143 HB2 TRP A 8 23.536 36.033 1.966 1.00 0.00 H ATOM 144 HB3 TRP A 8 24.018 34.673 0.926 1.00 0.00 H ATOM 145 HE1 TRP A 8 27.952 36.743 3.838 1.00 0.00 H ATOM 146 HD1 TRP A 8 25.497 37.370 3.257 1.00 0.00 H ATOM 147 HZ2 TRP A 8 29.827 34.802 3.003 1.00 0.00 H ATOM 148 HH2 TRP A 8 30.032 32.847 1.521 1.00 0.00 H ATOM 149 HZ3 TRP A 8 28.140 32.111 0.120 1.00 0.00 H ATOM 150 HE3 TRP A 8 26.015 33.356 0.096 1.00 0.00 H ATOM 151 H TRP A 8 23.673 38.555 0.785 1.00 0.00 H ATOM 152 N LYS A 9 22.498 35.766 -1.623 1.00 29.64 N ATOM 153 CA LYS A 9 21.153 35.624 -2.152 1.00 29.24 C ATOM 154 C LYS A 9 20.788 34.141 -2.180 1.00 27.73 C ATOM 155 O LYS A 9 21.580 33.290 -2.590 1.00 26.57 O ATOM 156 CB LYS A 9 21.012 36.282 -3.538 1.00 29.75 C ATOM 157 CG LYS A 9 19.579 36.250 -4.106 1.00 33.43 C ATOM 158 CD LYS A 9 19.499 36.890 -5.506 1.00 38.60 C ATOM 159 CE LYS A 9 18.074 37.250 -5.886 1.00 42.35 C ATOM 160 NZ LYS A 9 18.052 38.433 -6.806 1.00 43.60 N ATOM 161 HA LYS A 9 20.453 36.148 -1.501 1.00 0.00 H ATOM 162 HB2 LYS A 9 21.325 37.323 -3.457 1.00 0.00 H ATOM 163 HB3 LYS A 9 21.668 35.759 -4.234 1.00 0.00 H ATOM 164 HG2 LYS A 9 19.250 35.213 -4.173 1.00 0.00 H ATOM 165 HG3 LYS A 9 18.920 36.796 -3.431 1.00 0.00 H ATOM 166 HD2 LYS A 9 20.105 37.796 -5.514 1.00 0.00 H ATOM 167 HD3 LYS A 9 19.891 36.185 -6.239 1.00 0.00 H ATOM 168 HE2 LYS A 9 17.512 37.489 -4.983 1.00 0.00 H ATOM 169 HE3 LYS A 9 17.611 36.399 -6.386 1.00 0.00 H ATOM 170 HZ1 LYS A 9 18.489 39.248 -6.331 1.00 0.00 H ATOM 171 HZ2 LYS A 9 18.584 38.208 -7.671 1.00 0.00 H ATOM 172 HZ3 LYS A 9 17.068 38.661 -7.052 1.00 0.00 H ATOM 173 H LYS A 9 23.283 35.253 -2.073 1.00 0.00 H ATOM 174 N LEU A 10 19.587 33.840 -1.703 1.00 26.46 N ATOM 175 CA LEU A 10 19.058 32.479 -1.720 1.00 26.21 C ATOM 176 C LEU A 10 19.060 31.934 -3.124 1.00 27.70 C ATOM 177 O LEU A 10 18.470 32.578 -3.997 1.00 26.59 O ATOM 178 CB LEU A 10 17.603 32.422 -1.229 1.00 26.25 C ATOM 179 CG LEU A 10 17.042 30.989 -1.122 1.00 25.92 C ATOM 180 CD1 LEU A 10 17.640 30.262 0.086 1.00 25.84 C ATOM 181 CD2 LEU A 10 15.555 31.069 -0.998 1.00 28.64 C ATOM 182 HA LEU A 10 19.698 31.894 -1.060 1.00 0.00 H ATOM 183 HB2 LEU A 10 17.553 32.886 -0.244 1.00 0.00 H ATOM 184 HB3 LEU A 10 16.982 32.984 -1.926 1.00 0.00 H ATOM 185 HG LEU A 10 17.310 30.424 -2.015 1.00 0.00 H ATOM 186 HD21 LEU A 10 15.296 31.638 -0.105 1.00 0.00 H ATOM 187 HD22 LEU A 10 15.144 31.565 -1.878 1.00 0.00 H ATOM 188 HD23 LEU A 10 15.143 30.063 -0.921 1.00 0.00 H ATOM 189 HD11 LEU A 10 18.723 30.210 -0.023 1.00 0.00 H ATOM 190 HD12 LEU A 10 17.391 30.807 0.996 1.00 0.00 H ATOM 191 HD13 LEU A 10 17.230 29.254 0.141 1.00 0.00 H ATOM 192 H LEU A 10 19.001 34.601 -1.303 1.00 0.00 H ATOM 193 N SER A 11 19.693 30.770 -3.296 1.00 28.19 N ATOM 194 CA SER A 11 19.760 30.029 -4.585 1.00 29.86 C ATOM 195 C SER A 11 18.943 28.769 -4.647 1.00 30.09 C ATOM 196 O SER A 11 18.378 28.456 -5.712 1.00 28.91 O ATOM 197 CB SER A 11 21.214 29.720 -4.983 1.00 30.45 C ATOM 198 OG SER A 11 21.914 28.912 -4.045 1.00 36.28 O ATOM 199 HA SER A 11 19.309 30.715 -5.302 1.00 0.00 H ATOM 200 HB2 SER A 11 21.748 30.664 -5.088 1.00 0.00 H ATOM 201 HB3 SER A 11 21.204 29.201 -5.942 1.00 0.00 H ATOM 202 HG SER A 11 22.837 28.757 -4.368 1.00 0.00 H ATOM 203 H SER A 11 20.172 30.353 -2.472 1.00 0.00 H ATOM 204 N GLU A 12 18.859 28.036 -3.529 1.00 28.52 N ATOM 205 CA GLU A 12 18.093 26.796 -3.462 1.00 28.81 C ATOM 206 C GLU A 12 17.529 26.528 -2.083 1.00 28.22 C ATOM 207 O GLU A 12 18.188 26.809 -1.068 1.00 26.95 O ATOM 208 CB GLU A 12 18.936 25.567 -3.771 1.00 29.11 C ATOM 209 CG GLU A 12 19.956 25.666 -4.858 1.00 32.24 C ATOM 210 CD GLU A 12 20.848 24.456 -4.792 1.00 36.03 C ATOM 211 OE1 GLU A 12 21.846 24.469 -4.032 1.00 36.63 O ATOM 212 OE2 GLU A 12 20.472 23.458 -5.434 1.00 38.39 O ATOM 213 HA GLU A 12 17.305 26.946 -4.200 1.00 0.00 H ATOM 214 HB2 GLU A 12 19.464 25.298 -2.856 1.00 0.00 H ATOM 215 HB3 GLU A 12 18.250 24.764 -4.043 1.00 0.00 H ATOM 216 HG2 GLU A 12 19.458 25.703 -5.827 1.00 0.00 H ATOM 217 HG3 GLU A 12 20.551 26.569 -4.722 1.00 0.00 H ATOM 218 H GLU A 12 19.358 28.363 -2.677 1.00 0.00 H ATOM 219 N SER A 13 16.368 25.887 -2.064 1.00 26.91 N ATOM 220 CA SER A 13 15.702 25.534 -0.832 1.00 27.22 C ATOM 221 C SER A 13 15.193 24.086 -0.919 1.00 27.08 C ATOM 222 O SER A 13 14.534 23.723 -1.889 1.00 27.64 O ATOM 223 CB SER A 13 14.538 26.473 -0.616 1.00 27.40 C ATOM 224 OG SER A 13 14.008 26.284 0.660 1.00 27.38 O ATOM 225 HA SER A 13 16.399 25.617 0.002 1.00 0.00 H ATOM 226 HB2 SER A 13 13.768 26.273 -1.361 1.00 0.00 H ATOM 227 HB3 SER A 13 14.880 27.503 -0.717 1.00 0.00 H ATOM 228 HG SER A 13 13.246 26.902 0.795 1.00 0.00 H ATOM 229 H SER A 13 15.922 25.630 -2.967 1.00 0.00 H ATOM 230 N HIS A 14 15.471 23.290 0.093 1.00 25.90 N ATOM 231 CA HIS A 14 15.061 21.889 0.168 1.00 26.50 C ATOM 232 C HIS A 14 14.317 21.580 1.456 1.00 26.76 C ATOM 233 O HIS A 14 14.818 21.808 2.558 1.00 26.07 O ATOM 234 CB HIS A 14 16.319 20.990 0.093 1.00 26.48 C ATOM 235 CG HIS A 14 16.053 19.525 0.312 1.00 27.33 C ATOM 236 ND1 HIS A 14 15.720 18.664 -0.715 1.00 28.81 N ATOM 237 CD2 HIS A 14 16.090 18.768 1.435 1.00 28.23 C ATOM 238 CE1 HIS A 14 15.565 17.444 -0.233 1.00 28.18 C ATOM 239 NE2 HIS A 14 15.760 17.483 1.072 1.00 26.74 N ATOM 240 HA HIS A 14 14.388 21.694 -0.667 1.00 0.00 H ATOM 241 HB2 HIS A 14 16.766 21.111 -0.894 1.00 0.00 H ATOM 242 HB3 HIS A 14 17.024 21.326 0.854 1.00 0.00 H ATOM 243 HD2 HIS A 14 16.336 19.113 2.439 1.00 0.00 H ATOM 244 HE1 HIS A 14 15.318 16.556 -0.814 1.00 0.00 H ATOM 245 H HIS A 14 16.016 23.682 0.887 1.00 0.00 H ATOM 246 N ASN A 15 13.101 21.073 1.313 1.00 26.71 N ATOM 247 CA ASN A 15 12.270 20.667 2.460 1.00 26.49 C ATOM 248 C ASN A 15 11.779 21.777 3.403 1.00 26.26 C ATOM 249 O ASN A 15 11.451 21.494 4.561 1.00 26.34 O ATOM 250 CB ASN A 15 12.943 19.535 3.262 1.00 27.34 C ATOM 251 CG ASN A 15 11.925 18.623 3.972 1.00 28.36 C ATOM 252 OD1 ASN A 15 10.880 18.326 3.410 1.00 30.01 O ATOM 253 ND2 ASN A 15 12.225 18.203 5.194 1.00 27.18 N ATOM 254 HA ASN A 15 11.356 20.313 1.983 1.00 0.00 H ATOM 255 HB2 ASN A 15 13.537 18.929 2.578 1.00 0.00 H ATOM 256 HB3 ASN A 15 13.596 19.980 4.013 1.00 0.00 H ATOM 257 HD22 ASN A 15 13.126 18.481 5.633 1.00 0.00 H ATOM 258 HD21 ASN A 15 11.559 17.596 5.713 1.00 0.00 H ATOM 259 H ASN A 15 12.718 20.957 0.353 1.00 0.00 H ATOM 260 N PHE A 16 11.712 23.006 2.913 1.00 25.93 N ATOM 261 CA PHE A 16 11.374 24.144 3.770 1.00 27.45 C ATOM 262 C PHE A 16 9.895 24.171 4.161 1.00 28.85 C ATOM 263 O PHE A 16 9.575 24.588 5.277 1.00 28.14 O ATOM 264 CB PHE A 16 11.774 25.455 3.093 1.00 27.22 C ATOM 265 CG PHE A 16 11.772 26.689 4.006 1.00 27.51 C ATOM 266 CD1 PHE A 16 12.385 26.684 5.253 1.00 31.38 C ATOM 267 CD2 PHE A 16 11.173 27.845 3.587 1.00 30.00 C ATOM 268 CE1 PHE A 16 12.392 27.832 6.064 1.00 29.53 C ATOM 269 CE2 PHE A 16 11.176 28.996 4.396 1.00 32.32 C ATOM 270 CZ PHE A 16 11.805 28.966 5.641 1.00 31.07 C ATOM 271 HA PHE A 16 11.941 24.027 4.694 1.00 0.00 H ATOM 272 HB2 PHE A 16 12.780 25.334 2.691 1.00 0.00 H ATOM 273 HB3 PHE A 16 11.077 25.639 2.275 1.00 0.00 H ATOM 274 HD2 PHE A 16 10.686 27.875 2.612 1.00 0.00 H ATOM 275 HE2 PHE A 16 10.689 29.908 4.051 1.00 0.00 H ATOM 276 HZ PHE A 16 11.821 29.857 6.268 1.00 0.00 H ATOM 277 HE1 PHE A 16 12.875 27.803 7.040 1.00 0.00 H ATOM 278 HD1 PHE A 16 12.869 25.774 5.608 1.00 0.00 H ATOM 279 H PHE A 16 11.903 23.165 1.903 1.00 0.00 H ATOM 280 N ASP A 17 8.998 23.715 3.291 1.00 28.92 N ATOM 281 CA ASP A 17 7.591 23.692 3.687 1.00 31.34 C ATOM 282 C ASP A 17 7.317 22.793 4.895 1.00 31.50 C ATOM 283 O ASP A 17 6.467 23.118 5.726 1.00 31.83 O ATOM 284 CB ASP A 17 6.667 23.343 2.544 1.00 31.33 C ATOM 285 CG ASP A 17 5.209 23.644 2.883 1.00 34.73 C ATOM 286 OD1 ASP A 17 4.866 24.842 2.922 1.00 34.09 O ATOM 287 OD2 ASP A 17 4.357 22.745 3.146 1.00 37.05 O ATOM 288 HA ASP A 17 7.372 24.716 3.991 1.00 0.00 H ATOM 289 HB2 ASP A 17 6.953 23.925 1.668 1.00 0.00 H ATOM 290 HB3 ASP A 17 6.766 22.281 2.321 1.00 0.00 H ATOM 291 H ASP A 17 9.291 23.382 2.350 1.00 0.00 H ATOM 292 N ALA A 18 8.031 21.680 5.008 1.00 31.40 N ATOM 293 CA ALA A 18 7.899 20.799 6.174 1.00 31.43 C ATOM 294 C ALA A 18 8.218 21.551 7.482 1.00 32.63 C ATOM 295 O ALA A 18 7.633 21.257 8.544 1.00 33.20 O ATOM 296 CB ALA A 18 8.819 19.599 6.034 1.00 31.63 C ATOM 297 HA ALA A 18 6.865 20.458 6.218 1.00 0.00 H ATOM 298 HB1 ALA A 18 8.554 19.043 5.135 1.00 0.00 H ATOM 299 HB2 ALA A 18 9.851 19.941 5.960 1.00 0.00 H ATOM 300 HB3 ALA A 18 8.710 18.955 6.907 1.00 0.00 H ATOM 301 H ALA A 18 8.699 21.426 4.253 1.00 0.00 H ATOM 302 N VAL A 19 9.138 22.507 7.437 1.00 32.52 N ATOM 303 CA VAL A 19 9.502 23.180 8.695 1.00 32.95 C ATOM 304 C VAL A 19 8.558 24.298 9.017 1.00 32.51 C ATOM 305 O VAL A 19 8.209 24.470 10.179 1.00 33.48 O ATOM 306 CB VAL A 19 10.993 23.655 8.880 1.00 33.49 C ATOM 307 CG1 VAL A 19 12.005 22.826 8.149 1.00 33.35 C ATOM 308 CG2 VAL A 19 11.165 25.171 8.715 1.00 34.77 C ATOM 309 HA VAL A 19 9.407 22.366 9.414 1.00 0.00 H ATOM 310 HB VAL A 19 11.226 23.459 9.927 1.00 0.00 H ATOM 311 HG11 VAL A 19 11.954 21.796 8.503 1.00 0.00 H ATOM 312 HG12 VAL A 19 11.793 22.855 7.080 1.00 0.00 H ATOM 313 HG13 VAL A 19 13.002 23.226 8.334 1.00 0.00 H ATOM 314 HG21 VAL A 19 10.845 25.465 7.715 1.00 0.00 H ATOM 315 HG22 VAL A 19 10.558 25.687 9.459 1.00 0.00 H ATOM 316 HG23 VAL A 19 12.214 25.434 8.854 1.00 0.00 H ATOM 317 H VAL A 19 9.589 22.773 6.538 1.00 0.00 H ATOM 318 N MET A 20 8.079 25.043 8.038 1.00 32.86 N ATOM 319 CA MET A 20 7.135 26.090 8.446 1.00 33.57 C ATOM 320 C MET A 20 5.783 25.566 8.783 1.00 33.93 C ATOM 321 O MET A 20 5.064 26.215 9.489 1.00 33.39 O ATOM 322 CB MET A 20 7.081 27.334 7.580 1.00 33.33 C ATOM 323 CG MET A 20 7.675 27.223 6.331 1.00 31.35 C ATOM 324 SD MET A 20 6.436 26.549 5.420 1.00 29.45 S ATOM 325 CE MET A 20 6.885 27.623 3.824 1.00 26.09 C ATOM 326 HA MET A 20 7.582 26.454 9.371 1.00 0.00 H ATOM 327 HB2 MET A 20 6.033 27.594 7.431 1.00 0.00 H ATOM 328 HB3 MET A 20 7.580 28.139 8.118 1.00 0.00 H ATOM 329 HG2 MET A 20 8.546 26.569 6.362 1.00 0.00 H ATOM 330 HG3 MET A 20 7.968 28.198 5.943 1.00 0.00 H ATOM 331 HE1 MET A 20 6.801 28.683 4.065 1.00 0.00 H ATOM 332 HE2 MET A 20 7.905 27.400 3.513 1.00 0.00 H ATOM 333 HE3 MET A 20 6.195 27.377 3.016 1.00 0.00 H ATOM 334 H MET A 20 8.352 24.898 7.045 1.00 0.00 H ATOM 335 N SER A 21 5.425 24.459 8.147 1.00 35.48 N ATOM 336 CA SER A 21 4.182 23.781 8.421 1.00 36.53 C ATOM 337 C SER A 21 4.195 23.357 9.884 1.00 36.72 C ATOM 338 O SER A 21 3.223 23.587 10.628 1.00 37.40 O ATOM 339 CB SER A 21 4.039 22.569 7.494 1.00 35.70 C ATOM 340 OG SER A 21 2.723 22.057 7.596 1.00 40.39 O ATOM 341 HA SER A 21 3.331 24.437 8.240 1.00 0.00 H ATOM 342 HB2 SER A 21 4.753 21.800 7.787 1.00 0.00 H ATOM 343 HB3 SER A 21 4.234 22.872 6.465 1.00 0.00 H ATOM 344 HG SER A 21 2.628 21.274 6.998 1.00 0.00 H ATOM 345 H SER A 21 6.063 24.066 7.426 1.00 0.00 H ATOM 346 N LYS A 22 5.306 22.753 10.291 1.00 36.40 N ATOM 347 CA LYS A 22 5.521 22.331 11.673 1.00 36.54 C ATOM 348 C LYS A 22 5.498 23.491 12.678 1.00 35.87 C ATOM 349 O LYS A 22 4.970 23.348 13.779 1.00 36.31 O ATOM 350 CB LYS A 22 6.834 21.545 11.776 1.00 36.53 C ATOM 351 CG LYS A 22 7.149 21.026 13.176 1.00 37.94 C ATOM 352 CD LYS A 22 8.199 19.933 13.140 1.00 39.09 C ATOM 353 CE LYS A 22 8.422 19.327 14.525 1.00 39.77 C ATOM 354 NZ LYS A 22 7.403 18.287 14.824 1.00 40.69 N ATOM 355 HA LYS A 22 4.683 21.688 11.944 1.00 0.00 H ATOM 356 HB2 LYS A 22 6.775 20.691 11.101 1.00 0.00 H ATOM 357 HB3 LYS A 22 7.648 22.198 11.463 1.00 0.00 H ATOM 358 HG2 LYS A 22 7.517 21.851 13.786 1.00 0.00 H ATOM 359 HG3 LYS A 22 6.237 20.627 13.620 1.00 0.00 H ATOM 360 HD2 LYS A 22 7.871 19.148 12.458 1.00 0.00 H ATOM 361 HD3 LYS A 22 9.138 20.355 12.782 1.00 0.00 H ATOM 362 HE2 LYS A 22 8.356 20.116 15.274 1.00 0.00 H ATOM 363 HE3 LYS A 22 9.413 18.875 14.561 1.00 0.00 H ATOM 364 HZ1 LYS A 22 6.455 18.714 14.796 1.00 0.00 H ATOM 365 HZ2 LYS A 22 7.465 17.529 14.115 1.00 0.00 H ATOM 366 HZ3 LYS A 22 7.579 17.893 15.770 1.00 0.00 H ATOM 367 H LYS A 22 6.057 22.572 9.594 1.00 0.00 H ATOM 368 N LEU A 23 6.047 24.639 12.285 1.00 34.98 N ATOM 369 CA LEU A 23 6.068 25.852 13.104 1.00 35.36 C ATOM 370 C LEU A 23 4.719 26.539 13.266 1.00 36.11 C ATOM 371 O LEU A 23 4.604 27.512 14.039 1.00 36.83 O ATOM 372 CB LEU A 23 7.065 26.870 12.519 1.00 34.75 C ATOM 373 CG LEU A 23 8.530 26.471 12.633 1.00 33.51 C ATOM 374 CD1 LEU A 23 9.427 27.446 11.848 1.00 31.65 C ATOM 375 CD2 LEU A 23 8.963 26.365 14.083 1.00 32.62 C ATOM 376 HA LEU A 23 6.369 25.515 14.096 1.00 0.00 H ATOM 377 HB2 LEU A 23 6.832 27.004 11.463 1.00 0.00 H ATOM 378 HB3 LEU A 23 6.930 27.816 13.043 1.00 0.00 H ATOM 379 HG LEU A 23 8.643 25.482 12.188 1.00 0.00 H ATOM 380 HD21 LEU A 23 8.827 27.329 14.573 1.00 0.00 H ATOM 381 HD22 LEU A 23 8.358 25.611 14.587 1.00 0.00 H ATOM 382 HD23 LEU A 23 10.014 26.079 14.127 1.00 0.00 H ATOM 383 HD11 LEU A 23 9.141 27.435 10.796 1.00 0.00 H ATOM 384 HD12 LEU A 23 9.305 28.452 12.248 1.00 0.00 H ATOM 385 HD13 LEU A 23 10.468 27.139 11.946 1.00 0.00 H ATOM 386 H LEU A 23 6.486 24.676 11.343 1.00 0.00 H ATOM 387 N GLY A 24 3.739 26.091 12.490 1.00 36.03 N ATOM 388 CA GLY A 24 2.387 26.606 12.538 1.00 36.22 C ATOM 389 C GLY A 24 2.177 27.852 11.696 1.00 36.26 C ATOM 390 O GLY A 24 1.188 28.575 11.925 1.00 36.21 O ATOM 391 HA3 GLY A 24 2.147 26.846 13.574 1.00 0.00 H ATOM 392 HA2 GLY A 24 1.710 25.830 12.180 1.00 0.00 H ATOM 393 H GLY A 24 3.954 25.331 11.813 1.00 0.00 H ATOM 394 N VAL A 25 3.098 28.138 10.764 1.00 35.04 N ATOM 395 CA VAL A 25 3.014 29.320 9.930 1.00 35.07 C ATOM 396 C VAL A 25 1.783 29.268 9.046 1.00 35.03 C ATOM 397 O VAL A 25 1.443 28.222 8.495 1.00 35.54 O ATOM 398 CB VAL A 25 4.288 29.513 9.042 1.00 35.13 C ATOM 399 CG1 VAL A 25 4.174 30.758 8.169 1.00 33.76 C ATOM 400 CG2 VAL A 25 5.524 29.617 9.917 1.00 36.54 C ATOM 401 HA VAL A 25 2.943 30.173 10.605 1.00 0.00 H ATOM 402 HB VAL A 25 4.373 28.644 8.390 1.00 0.00 H ATOM 403 HG11 VAL A 25 3.307 30.664 7.515 1.00 0.00 H ATOM 404 HG12 VAL A 25 4.058 31.636 8.804 1.00 0.00 H ATOM 405 HG13 VAL A 25 5.076 30.861 7.566 1.00 0.00 H ATOM 406 HG21 VAL A 25 5.422 30.470 10.587 1.00 0.00 H ATOM 407 HG22 VAL A 25 5.631 28.704 10.503 1.00 0.00 H ATOM 408 HG23 VAL A 25 6.403 29.751 9.287 1.00 0.00 H ATOM 409 H VAL A 25 3.900 27.489 10.635 1.00 0.00 H ATOM 410 N SER A 26 1.123 30.407 8.877 1.00 34.81 N ATOM 411 CA SER A 26 -0.121 30.446 8.160 1.00 34.88 C ATOM 412 C SER A 26 0.101 29.971 6.728 1.00 35.45 C ATOM 413 O SER A 26 1.209 30.083 6.181 1.00 33.80 O ATOM 414 CB SER A 26 -0.703 31.858 8.156 1.00 35.23 C ATOM 415 OG SER A 26 -0.035 32.678 7.218 1.00 33.06 O ATOM 416 HA SER A 26 -0.831 29.786 8.658 1.00 0.00 H ATOM 417 HB2 SER A 26 -0.594 32.292 9.150 1.00 0.00 H ATOM 418 HB3 SER A 26 -1.760 31.807 7.897 1.00 0.00 H ATOM 419 HG SER A 26 -0.430 33.586 7.235 1.00 0.00 H ATOM 420 H SER A 26 1.513 31.287 9.271 1.00 0.00 H ATOM 421 N TRP A 27 -0.954 29.432 6.139 1.00 35.38 N ATOM 422 CA TRP A 27 -0.938 29.037 4.745 1.00 36.14 C ATOM 423 C TRP A 27 -0.390 30.127 3.837 1.00 36.07 C ATOM 424 O TRP A 27 0.489 29.851 3.018 1.00 35.26 O ATOM 425 CB TRP A 27 -2.348 28.641 4.263 1.00 37.13 C ATOM 426 CG TRP A 27 -2.356 28.291 2.822 1.00 38.11 C ATOM 427 CD1 TRP A 27 -2.824 29.043 1.798 1.00 39.79 C ATOM 428 CD2 TRP A 27 -1.838 27.099 2.242 1.00 39.63 C ATOM 429 NE1 TRP A 27 -2.655 28.381 0.602 1.00 41.31 N ATOM 430 CE2 TRP A 27 -2.041 27.187 0.847 1.00 41.09 C ATOM 431 CE3 TRP A 27 -1.220 25.957 2.759 1.00 43.00 C ATOM 432 CZ2 TRP A 27 -1.648 26.189 -0.032 1.00 42.73 C ATOM 433 CZ3 TRP A 27 -0.838 24.952 1.884 1.00 45.11 C ATOM 434 CH2 TRP A 27 -1.050 25.079 0.504 1.00 45.11 C ATOM 435 HA TRP A 27 -0.273 28.175 4.683 1.00 0.00 H ATOM 436 HB2 TRP A 27 -2.690 27.780 4.838 1.00 0.00 H ATOM 437 HB3 TRP A 27 -3.026 29.478 4.427 1.00 0.00 H ATOM 438 HE1 TRP A 27 -2.947 28.733 -0.332 1.00 0.00 H ATOM 439 HD1 TRP A 27 -3.271 30.031 1.905 1.00 0.00 H ATOM 440 HZ2 TRP A 27 -1.808 26.284 -1.106 1.00 0.00 H ATOM 441 HH2 TRP A 27 -0.731 24.275 -0.159 1.00 0.00 H ATOM 442 HZ3 TRP A 27 -0.366 24.050 2.274 1.00 0.00 H ATOM 443 HE3 TRP A 27 -1.042 25.858 3.830 1.00 0.00 H ATOM 444 H TRP A 27 -1.822 29.287 6.694 1.00 0.00 H ATOM 445 N ALA A 28 -0.921 31.353 3.952 1.00 36.00 N ATOM 446 CA ALA A 28 -0.545 32.432 3.038 1.00 35.65 C ATOM 447 C ALA A 28 0.914 32.871 3.214 1.00 35.01 C ATOM 448 O ALA A 28 1.595 33.156 2.237 1.00 35.56 O ATOM 449 CB ALA A 28 -1.497 33.647 3.178 1.00 36.50 C ATOM 450 HA ALA A 28 -0.642 32.028 2.030 1.00 0.00 H ATOM 451 HB1 ALA A 28 -2.516 33.337 2.948 1.00 0.00 H ATOM 452 HB2 ALA A 28 -1.453 34.026 4.199 1.00 0.00 H ATOM 453 HB3 ALA A 28 -1.189 34.430 2.485 1.00 0.00 H ATOM 454 H ALA A 28 -1.613 31.540 4.705 1.00 0.00 H ATOM 455 N THR A 29 1.398 32.942 4.454 1.00 33.72 N ATOM 456 CA THR A 29 2.799 33.272 4.691 1.00 33.25 C ATOM 457 C THR A 29 3.723 32.126 4.235 1.00 33.02 C ATOM 458 O THR A 29 4.852 32.375 3.783 1.00 32.76 O ATOM 459 CB THR A 29 3.067 33.610 6.162 1.00 33.55 C ATOM 460 OG1 THR A 29 2.312 34.773 6.521 1.00 35.45 O ATOM 461 CG2 THR A 29 4.528 34.034 6.339 1.00 33.09 C ATOM 462 HA THR A 29 3.019 34.159 4.097 1.00 0.00 H ATOM 463 HB THR A 29 2.813 32.735 6.760 1.00 0.00 H ATOM 464 HG1 THR A 29 2.482 34.995 7.471 1.00 0.00 H ATOM 465 HG23 THR A 29 5.181 33.199 6.084 1.00 0.00 H ATOM 466 HG21 THR A 29 4.742 34.878 5.683 1.00 0.00 H ATOM 467 HG22 THR A 29 4.697 34.326 7.375 1.00 0.00 H ATOM 468 H THR A 29 0.769 32.760 5.262 1.00 0.00 H ATOM 469 N ARG A 30 3.253 30.890 4.378 1.00 31.94 N ATOM 470 CA ARG A 30 3.994 29.719 3.906 1.00 33.35 C ATOM 471 C ARG A 30 4.211 29.822 2.400 1.00 34.01 C ATOM 472 O ARG A 30 5.336 29.594 1.908 1.00 33.93 O ATOM 473 CB ARG A 30 3.275 28.415 4.272 1.00 33.33 C ATOM 474 CG ARG A 30 3.650 27.905 5.621 1.00 33.96 C ATOM 475 CD ARG A 30 2.791 26.760 6.145 1.00 34.76 C ATOM 476 NE ARG A 30 2.904 25.586 5.283 1.00 34.52 N ATOM 477 CZ ARG A 30 1.903 24.758 5.019 1.00 37.99 C ATOM 478 NH1 ARG A 30 0.712 24.933 5.572 1.00 38.97 N ATOM 479 NH2 ARG A 30 2.097 23.725 4.209 1.00 38.84 N ATOM 480 HA ARG A 30 4.964 29.699 4.403 1.00 0.00 H ATOM 481 HB2 ARG A 30 2.200 28.593 4.254 1.00 0.00 H ATOM 482 HB3 ARG A 30 3.529 27.658 3.531 1.00 0.00 H ATOM 483 HG2 ARG A 30 4.683 27.559 5.576 1.00 0.00 H ATOM 484 HG3 ARG A 30 3.576 28.732 6.327 1.00 0.00 H ATOM 485 HD2 ARG A 30 1.750 27.081 6.177 1.00 0.00 H ATOM 486 HD3 ARG A 30 3.120 26.498 7.150 1.00 0.00 H ATOM 487 HE ARG A 30 3.828 25.387 4.849 1.00 0.00 H ATOM 488 HH12 ARG A 30 -0.064 24.275 5.355 1.00 0.00 H ATOM 489 HH11 ARG A 30 0.553 25.728 6.223 1.00 0.00 H ATOM 490 HH22 ARG A 30 1.314 23.074 4.000 1.00 0.00 H ATOM 491 HH21 ARG A 30 3.032 23.567 3.783 1.00 0.00 H ATOM 492 H ARG A 30 2.331 30.751 4.839 1.00 0.00 H ATOM 493 N GLN A 31 3.174 30.221 1.660 1.00 35.24 N ATOM 494 CA GLN A 31 3.306 30.303 0.204 1.00 35.81 C ATOM 495 C GLN A 31 4.340 31.356 -0.185 1.00 36.07 C ATOM 496 O GLN A 31 5.140 31.122 -1.104 1.00 35.70 O ATOM 497 CB GLN A 31 1.981 30.590 -0.516 1.00 36.27 C ATOM 498 CG GLN A 31 0.854 29.520 -0.350 1.00 39.34 C ATOM 499 CD GLN A 31 1.329 28.063 -0.251 1.00 42.93 C ATOM 500 OE1 GLN A 31 1.694 27.452 -1.254 1.00 45.99 O ATOM 501 NE2 GLN A 31 1.313 27.512 0.952 1.00 45.03 N ATOM 502 HA GLN A 31 3.637 29.317 -0.121 1.00 0.00 H ATOM 503 HB2 GLN A 31 1.597 31.538 -0.139 1.00 0.00 H ATOM 504 HB3 GLN A 31 2.195 30.684 -1.581 1.00 0.00 H ATOM 505 HG2 GLN A 31 0.300 29.755 0.559 1.00 0.00 H ATOM 506 HG3 GLN A 31 0.188 29.598 -1.210 1.00 0.00 H ATOM 507 HE22 GLN A 31 0.997 28.066 1.773 1.00 0.00 H ATOM 508 HE21 GLN A 31 1.617 26.525 1.076 1.00 0.00 H ATOM 509 H GLN A 31 2.274 30.473 2.117 1.00 0.00 H ATOM 510 N ILE A 32 4.300 32.517 0.477 1.00 35.29 N ATOM 511 CA ILE A 32 5.320 33.557 0.317 1.00 35.04 C ATOM 512 C ILE A 32 6.703 33.004 0.651 1.00 34.41 C ATOM 513 O ILE A 32 7.643 33.200 -0.121 1.00 35.14 O ATOM 514 CB ILE A 32 5.009 34.834 1.178 1.00 35.47 C ATOM 515 CG1 ILE A 32 3.741 35.533 0.673 1.00 36.57 C ATOM 516 CG2 ILE A 32 6.174 35.854 1.139 1.00 37.02 C ATOM 517 CD1 ILE A 32 3.065 36.395 1.749 1.00 36.87 C ATOM 518 HA ILE A 32 5.306 33.866 -0.728 1.00 0.00 H ATOM 519 HB ILE A 32 4.869 34.491 2.203 1.00 0.00 H ATOM 520 HG12 ILE A 32 4.008 36.172 -0.168 1.00 0.00 H ATOM 521 HG13 ILE A 32 3.034 34.773 0.340 1.00 0.00 H ATOM 522 HD11 ILE A 32 2.784 35.766 2.593 1.00 0.00 H ATOM 523 HD12 ILE A 32 3.759 37.166 2.084 1.00 0.00 H ATOM 524 HD13 ILE A 32 2.174 36.863 1.331 1.00 0.00 H ATOM 525 HG21 ILE A 32 7.077 35.387 1.533 1.00 0.00 H ATOM 526 HG22 ILE A 32 6.345 36.169 0.110 1.00 0.00 H ATOM 527 HG23 ILE A 32 5.917 36.721 1.747 1.00 0.00 H ATOM 528 H ILE A 32 3.512 32.689 1.133 1.00 0.00 H ATOM 529 N GLY A 33 6.822 32.291 1.762 1.00 33.57 N ATOM 530 CA GLY A 33 8.080 31.673 2.181 1.00 33.88 C ATOM 531 C GLY A 33 8.628 30.629 1.215 1.00 34.63 C ATOM 532 O GLY A 33 9.864 30.456 1.119 1.00 35.01 O ATOM 533 HA3 GLY A 33 7.918 31.192 3.146 1.00 0.00 H ATOM 534 HA2 GLY A 33 8.826 32.460 2.290 1.00 0.00 H ATOM 535 H GLY A 33 5.983 32.165 2.363 1.00 0.00 H ATOM 536 N ASN A 34 7.727 29.964 0.474 1.00 33.84 N ATOM 537 CA ASN A 34 8.134 28.987 -0.551 1.00 35.13 C ATOM 538 C ASN A 34 8.473 29.607 -1.927 1.00 35.84 C ATOM 539 O ASN A 34 8.899 28.884 -2.832 1.00 36.18 O ATOM 540 CB ASN A 34 7.073 27.874 -0.684 1.00 34.85 C ATOM 541 CG ASN A 34 6.964 27.005 0.583 1.00 34.11 C ATOM 542 OD1 ASN A 34 7.958 26.762 1.265 1.00 31.96 O ATOM 543 ND2 ASN A 34 5.757 26.533 0.890 1.00 35.49 N ATOM 544 HA ASN A 34 9.071 28.556 -0.199 1.00 0.00 H ATOM 545 HB2 ASN A 34 6.104 28.336 -0.875 1.00 0.00 H ATOM 546 HB3 ASN A 34 7.341 27.234 -1.525 1.00 0.00 H ATOM 547 HD22 ASN A 34 4.941 26.761 0.287 1.00 0.00 H ATOM 548 HD21 ASN A 34 5.631 25.936 1.732 1.00 0.00 H ATOM 549 H ASN A 34 6.714 30.143 0.628 1.00 0.00 H ATOM 550 N THR A 35 8.317 30.926 -2.061 1.00 36.37 N ATOM 551 CA THR A 35 8.523 31.625 -3.325 1.00 37.88 C ATOM 552 C THR A 35 9.631 32.695 -3.281 1.00 37.80 C ATOM 553 O THR A 35 10.458 32.751 -4.205 1.00 38.46 O ATOM 554 CB THR A 35 7.225 32.277 -3.853 1.00 38.57 C ATOM 555 OG1 THR A 35 6.885 33.414 -3.049 1.00 42.00 O ATOM 556 CG2 THR A 35 6.010 31.348 -3.764 1.00 38.74 C ATOM 557 HA THR A 35 8.846 30.839 -4.008 1.00 0.00 H ATOM 558 HB THR A 35 7.431 32.531 -4.893 1.00 0.00 H ATOM 559 HG1 THR A 35 6.747 33.125 -2.112 1.00 0.00 H ATOM 560 HG23 THR A 35 6.195 30.452 -4.356 1.00 0.00 H ATOM 561 HG21 THR A 35 5.843 31.069 -2.724 1.00 0.00 H ATOM 562 HG22 THR A 35 5.131 31.864 -4.149 1.00 0.00 H ATOM 563 H THR A 35 8.036 31.480 -1.227 1.00 0.00 H ATOM 564 N VAL A 36 9.653 33.551 -2.251 1.00 36.63 N ATOM 565 CA VAL A 36 10.598 34.676 -2.255 1.00 36.39 C ATOM 566 C VAL A 36 12.017 34.186 -2.076 1.00 35.13 C ATOM 567 O VAL A 36 12.274 33.179 -1.415 1.00 33.08 O ATOM 568 CB VAL A 36 10.336 35.767 -1.168 1.00 36.78 C ATOM 569 CG1 VAL A 36 9.037 36.479 -1.436 1.00 39.15 C ATOM 570 CG2 VAL A 36 10.404 35.186 0.252 1.00 37.65 C ATOM 571 HA VAL A 36 10.446 35.142 -3.228 1.00 0.00 H ATOM 572 HB VAL A 36 11.134 36.507 -1.230 1.00 0.00 H ATOM 573 HG11 VAL A 36 9.081 36.957 -2.414 1.00 0.00 H ATOM 574 HG12 VAL A 36 8.219 35.759 -1.419 1.00 0.00 H ATOM 575 HG13 VAL A 36 8.873 37.235 -0.668 1.00 0.00 H ATOM 576 HG21 VAL A 36 9.650 34.406 0.361 1.00 0.00 H ATOM 577 HG22 VAL A 36 11.394 34.763 0.423 1.00 0.00 H ATOM 578 HG23 VAL A 36 10.216 35.978 0.977 1.00 0.00 H ATOM 579 H VAL A 36 9.003 33.420 -1.450 1.00 0.00 H ATOM 580 N THR A 37 12.932 34.951 -2.658 1.00 35.24 N ATOM 581 CA THR A 37 14.354 34.658 -2.590 1.00 34.76 C ATOM 582 C THR A 37 15.025 35.877 -1.974 1.00 33.54 C ATOM 583 O THR A 37 15.298 36.881 -2.643 1.00 34.50 O ATOM 584 CB THR A 37 14.913 34.344 -3.978 1.00 35.81 C ATOM 585 OG1 THR A 37 14.510 35.361 -4.880 1.00 37.84 O ATOM 586 CG2 THR A 37 14.271 33.119 -4.537 1.00 36.93 C ATOM 587 HA THR A 37 14.544 33.774 -1.981 1.00 0.00 H ATOM 588 HB THR A 37 15.993 34.243 -3.875 1.00 0.00 H ATOM 589 HG1 THR A 37 14.859 36.234 -4.569 1.00 0.00 H ATOM 590 HG23 THR A 37 14.519 32.262 -3.911 1.00 0.00 H ATOM 591 HG21 THR A 37 13.190 33.254 -4.558 1.00 0.00 H ATOM 592 HG22 THR A 37 14.637 32.948 -5.550 1.00 0.00 H ATOM 593 H THR A 37 12.620 35.793 -3.183 1.00 0.00 H ATOM 594 N PRO A 38 15.239 35.829 -0.665 1.00 30.13 N ATOM 595 CA PRO A 38 15.810 36.968 0.027 1.00 28.86 C ATOM 596 C PRO A 38 17.279 37.170 -0.251 1.00 27.53 C ATOM 597 O PRO A 38 17.979 36.243 -0.617 1.00 25.91 O ATOM 598 CB PRO A 38 15.607 36.600 1.504 1.00 28.75 C ATOM 599 CG PRO A 38 14.627 35.564 1.476 1.00 30.34 C ATOM 600 CD PRO A 38 14.934 34.735 0.266 1.00 31.04 C ATOM 601 HA PRO A 38 15.342 37.901 -0.287 1.00 0.00 H ATOM 602 HD3 PRO A 38 15.788 34.077 0.423 1.00 0.00 H ATOM 603 HD2 PRO A 38 14.077 34.145 -0.058 1.00 0.00 H ATOM 604 HG3 PRO A 38 13.627 35.991 1.399 1.00 0.00 H ATOM 605 HG2 PRO A 38 14.693 34.956 2.378 1.00 0.00 H ATOM 606 HB2 PRO A 38 16.537 36.241 1.944 1.00 0.00 H ATOM 607 HB3 PRO A 38 15.246 37.459 2.070 1.00 0.00 H ATOM 608 N THR A 39 17.726 38.395 -0.036 1.00 28.37 N ATOM 609 CA THR A 39 19.123 38.748 0.080 1.00 29.06 C ATOM 610 C THR A 39 19.484 39.056 1.537 1.00 29.42 C ATOM 611 O THR A 39 18.766 39.747 2.227 1.00 30.68 O ATOM 612 CB THR A 39 19.382 39.941 -0.817 1.00 29.04 C ATOM 613 OG1 THR A 39 19.321 39.503 -2.174 1.00 32.80 O ATOM 614 CG2 THR A 39 20.819 40.483 -0.674 1.00 30.94 C ATOM 615 HA THR A 39 19.751 37.913 -0.232 1.00 0.00 H ATOM 616 HB THR A 39 18.649 40.700 -0.545 1.00 0.00 H ATOM 617 HG1 THR A 39 19.488 40.271 -2.775 1.00 0.00 H ATOM 618 HG23 THR A 39 20.969 40.847 0.342 1.00 0.00 H ATOM 619 HG21 THR A 39 21.530 39.684 -0.884 1.00 0.00 H ATOM 620 HG22 THR A 39 20.970 41.300 -1.380 1.00 0.00 H ATOM 621 H THR A 39 17.025 39.157 0.056 1.00 0.00 H ATOM 622 N VAL A 40 20.595 38.500 2.005 1.00 30.07 N ATOM 623 CA VAL A 40 21.029 38.609 3.398 1.00 30.18 C ATOM 624 C VAL A 40 22.415 39.291 3.427 1.00 29.92 C ATOM 625 O VAL A 40 23.315 38.941 2.696 1.00 29.28 O ATOM 626 CB VAL A 40 21.039 37.244 4.103 1.00 30.97 C ATOM 627 CG1 VAL A 40 21.517 37.353 5.537 1.00 30.74 C ATOM 628 CG2 VAL A 40 19.641 36.631 4.105 1.00 31.95 C ATOM 629 HA VAL A 40 20.318 39.220 3.954 1.00 0.00 H ATOM 630 HB VAL A 40 21.729 36.609 3.548 1.00 0.00 H ATOM 631 HG11 VAL A 40 22.531 37.753 5.551 1.00 0.00 H ATOM 632 HG12 VAL A 40 20.854 38.019 6.090 1.00 0.00 H ATOM 633 HG13 VAL A 40 21.508 36.365 5.998 1.00 0.00 H ATOM 634 HG21 VAL A 40 18.955 37.296 4.630 1.00 0.00 H ATOM 635 HG22 VAL A 40 19.303 36.496 3.077 1.00 0.00 H ATOM 636 HG23 VAL A 40 19.670 35.665 4.609 1.00 0.00 H ATOM 637 H VAL A 40 21.189 37.958 1.346 1.00 0.00 H ATOM 638 N THR A 41 22.543 40.312 4.250 1.00 29.90 N ATOM 639 CA THR A 41 23.781 41.062 4.386 1.00 29.26 C ATOM 640 C THR A 41 24.296 40.894 5.811 1.00 29.21 C ATOM 641 O THR A 41 23.567 41.109 6.764 1.00 29.95 O ATOM 642 CB THR A 41 23.534 42.555 4.079 1.00 29.05 C ATOM 643 OG1 THR A 41 23.011 42.720 2.751 1.00 28.25 O ATOM 644 CG2 THR A 41 24.833 43.373 4.082 1.00 28.87 C ATOM 645 HA THR A 41 24.522 40.687 3.680 1.00 0.00 H ATOM 646 HB THR A 41 22.847 42.897 4.853 1.00 0.00 H ATOM 647 HG1 THR A 41 22.154 42.230 2.672 1.00 0.00 H ATOM 648 HG23 THR A 41 25.302 43.303 5.063 1.00 0.00 H ATOM 649 HG21 THR A 41 25.511 42.979 3.325 1.00 0.00 H ATOM 650 HG22 THR A 41 24.605 44.416 3.860 1.00 0.00 H ATOM 651 H THR A 41 21.724 40.593 4.826 1.00 0.00 H ATOM 652 N PHE A 42 25.572 40.573 5.971 1.00 30.04 N ATOM 653 CA PHE A 42 26.192 40.525 7.304 1.00 30.41 C ATOM 654 C PHE A 42 27.236 41.643 7.424 1.00 31.45 C ATOM 655 O PHE A 42 28.031 41.842 6.524 1.00 30.44 O ATOM 656 CB PHE A 42 26.926 39.201 7.551 1.00 30.39 C ATOM 657 CG PHE A 42 26.011 38.002 7.678 1.00 31.23 C ATOM 658 CD1 PHE A 42 25.646 37.275 6.574 1.00 32.58 C ATOM 659 CD2 PHE A 42 25.534 37.605 8.918 1.00 30.18 C ATOM 660 CE1 PHE A 42 24.777 36.162 6.698 1.00 32.26 C ATOM 661 CE2 PHE A 42 24.662 36.493 9.044 1.00 31.34 C ATOM 662 CZ PHE A 42 24.306 35.778 7.934 1.00 32.97 C ATOM 663 HA PHE A 42 25.388 40.636 8.031 1.00 0.00 H ATOM 664 HB2 PHE A 42 27.607 39.026 6.718 1.00 0.00 H ATOM 665 HB3 PHE A 42 27.499 39.294 8.473 1.00 0.00 H ATOM 666 HD2 PHE A 42 25.834 38.156 9.810 1.00 0.00 H ATOM 667 HE2 PHE A 42 24.277 36.209 10.023 1.00 0.00 H ATOM 668 HZ PHE A 42 23.654 34.910 8.027 1.00 0.00 H ATOM 669 HE1 PHE A 42 24.479 35.606 5.809 1.00 0.00 H ATOM 670 HD1 PHE A 42 26.028 37.556 5.592 1.00 0.00 H ATOM 671 H PHE A 42 26.148 40.350 5.135 1.00 0.00 H ATOM 672 N THR A 43 27.224 42.345 8.543 1.00 33.33 N ATOM 673 CA THR A 43 28.342 43.231 8.917 1.00 36.26 C ATOM 674 C THR A 43 28.733 42.886 10.340 1.00 38.03 C ATOM 675 O THR A 43 27.936 42.345 11.102 1.00 38.59 O ATOM 676 CB THR A 43 27.959 44.723 8.797 1.00 35.72 C ATOM 677 OG1 THR A 43 26.971 45.060 9.775 1.00 37.50 O ATOM 678 CG2 THR A 43 27.268 44.995 7.517 1.00 37.39 C ATOM 679 HA THR A 43 29.180 43.077 8.237 1.00 0.00 H ATOM 680 HB THR A 43 28.889 45.281 8.903 1.00 0.00 H ATOM 681 HG1 THR A 43 27.333 44.890 10.681 1.00 0.00 H ATOM 682 HG23 THR A 43 27.939 44.769 6.688 1.00 0.00 H ATOM 683 HG21 THR A 43 26.378 44.370 7.446 1.00 0.00 H ATOM 684 HG22 THR A 43 26.980 46.046 7.477 1.00 0.00 H ATOM 685 H THR A 43 26.403 42.271 9.178 1.00 0.00 H ATOM 686 N MET A 44 29.986 43.156 10.691 1.00 41.03 N ATOM 687 CA MET A 44 30.500 42.879 12.034 1.00 43.08 C ATOM 688 C MET A 44 31.114 44.187 12.538 1.00 44.50 C ATOM 689 O MET A 44 32.071 44.694 11.943 1.00 43.94 O ATOM 690 CB MET A 44 31.537 41.738 12.003 1.00 44.06 C ATOM 691 CG MET A 44 32.073 41.315 13.373 1.00 46.76 C ATOM 692 SD MET A 44 30.933 40.380 14.408 1.00 51.80 S ATOM 693 CE MET A 44 31.767 38.855 14.589 1.00 53.25 C ATOM 694 HA MET A 44 29.706 42.545 12.702 1.00 0.00 H ATOM 695 HB2 MET A 44 31.071 40.869 11.539 1.00 0.00 H ATOM 696 HB3 MET A 44 32.381 42.064 11.395 1.00 0.00 H ATOM 697 HG2 MET A 44 32.354 42.218 13.916 1.00 0.00 H ATOM 698 HG3 MET A 44 32.958 40.700 13.211 1.00 0.00 H ATOM 699 HE1 MET A 44 31.918 38.406 13.607 1.00 0.00 H ATOM 700 HE2 MET A 44 32.733 39.025 15.064 1.00 0.00 H ATOM 701 HE3 MET A 44 31.169 38.186 15.208 1.00 0.00 H ATOM 702 H MET A 44 30.624 43.579 9.987 1.00 0.00 H ATOM 703 N ASP A 45 30.496 44.732 13.585 1.00 45.61 N ATOM 704 CA ASP A 45 30.821 46.038 14.141 1.00 46.97 C ATOM 705 C ASP A 45 31.025 45.902 15.657 1.00 47.11 C ATOM 706 O ASP A 45 30.087 46.094 16.442 1.00 48.32 O ATOM 707 CB ASP A 45 29.675 47.012 13.852 1.00 46.99 C ATOM 708 CG ASP A 45 29.262 47.012 12.381 1.00 48.10 C ATOM 709 OD1 ASP A 45 29.873 47.785 11.584 1.00 48.70 O ATOM 710 OD2 ASP A 45 28.341 46.264 11.950 1.00 46.28 O ATOM 711 HA ASP A 45 31.736 46.419 13.687 1.00 0.00 H ATOM 712 HB2 ASP A 45 28.814 46.728 14.457 1.00 0.00 H ATOM 713 HB3 ASP A 45 29.994 48.018 14.126 1.00 0.00 H ATOM 714 H ASP A 45 29.731 44.189 14.035 1.00 0.00 H ATOM 715 N GLY A 46 32.243 45.530 16.043 1.00 47.37 N ATOM 716 CA GLY A 46 32.635 45.451 17.437 1.00 47.41 C ATOM 717 C GLY A 46 32.404 44.066 17.991 1.00 46.82 C ATOM 718 O GLY A 46 32.799 43.073 17.372 1.00 47.50 O ATOM 719 HA3 GLY A 46 32.049 46.167 18.013 1.00 0.00 H ATOM 720 HA2 GLY A 46 33.693 45.697 17.524 1.00 0.00 H ATOM 721 H GLY A 46 32.943 45.286 15.314 1.00 0.00 H ATOM 722 N ASP A 47 31.762 44.012 19.153 1.00 46.07 N ATOM 723 CA ASP A 47 31.312 42.760 19.752 1.00 45.30 C ATOM 724 C ASP A 47 30.017 42.273 19.082 1.00 44.38 C ATOM 725 O ASP A 47 29.444 41.272 19.497 1.00 43.70 O ATOM 726 CB ASP A 47 31.029 42.959 21.249 1.00 45.36 C ATOM 727 CG ASP A 47 32.265 43.291 22.046 1.00 45.54 C ATOM 728 OD1 ASP A 47 32.942 44.290 21.716 1.00 45.72 O ATOM 729 OD2 ASP A 47 32.623 42.614 23.038 1.00 45.97 O ATOM 730 HA ASP A 47 32.102 42.022 19.611 1.00 0.00 H ATOM 731 HB2 ASP A 47 30.314 43.774 21.362 1.00 0.00 H ATOM 732 HB3 ASP A 47 30.597 42.040 21.646 1.00 0.00 H ATOM 733 H ASP A 47 31.572 44.901 19.658 1.00 0.00 H ATOM 734 N LYS A 48 29.552 42.991 18.063 1.00 44.20 N ATOM 735 CA LYS A 48 28.198 42.804 17.538 1.00 43.49 C ATOM 736 C LYS A 48 28.205 42.441 16.069 1.00 41.90 C ATOM 737 O LYS A 48 28.909 43.060 15.289 1.00 42.73 O ATOM 738 CB LYS A 48 27.391 44.098 17.708 1.00 44.44 C ATOM 739 CG LYS A 48 27.297 44.595 19.167 1.00 46.31 C ATOM 740 CD LYS A 48 25.861 44.944 19.577 1.00 49.14 C ATOM 741 CE LYS A 48 25.151 43.741 20.242 1.00 50.58 C ATOM 742 NZ LYS A 48 23.702 43.982 20.600 1.00 49.84 N ATOM 743 HA LYS A 48 27.747 41.986 18.099 1.00 0.00 H ATOM 744 HB2 LYS A 48 27.863 44.877 17.110 1.00 0.00 H ATOM 745 HB3 LYS A 48 26.380 43.922 17.340 1.00 0.00 H ATOM 746 HG2 LYS A 48 27.669 43.812 19.828 1.00 0.00 H ATOM 747 HG3 LYS A 48 27.918 45.485 19.274 1.00 0.00 H ATOM 748 HD2 LYS A 48 25.886 45.775 20.282 1.00 0.00 H ATOM 749 HD3 LYS A 48 25.301 45.239 18.690 1.00 0.00 H ATOM 750 HE2 LYS A 48 25.690 43.491 21.156 1.00 0.00 H ATOM 751 HE3 LYS A 48 25.195 42.897 19.553 1.00 0.00 H ATOM 752 HZ1 LYS A 48 23.639 44.776 21.268 1.00 0.00 H ATOM 753 HZ2 LYS A 48 23.166 44.209 19.738 1.00 0.00 H ATOM 754 HZ3 LYS A 48 23.308 43.126 21.039 1.00 0.00 H ATOM 755 H LYS A 48 30.168 43.706 17.627 1.00 0.00 H ATOM 756 N MET A 49 27.390 41.452 15.696 1.00 40.16 N ATOM 757 CA MET A 49 27.091 41.149 14.304 1.00 38.16 C ATOM 758 C MET A 49 25.673 41.601 13.981 1.00 36.55 C ATOM 759 O MET A 49 24.780 41.483 14.820 1.00 35.52 O ATOM 760 CB MET A 49 27.172 39.646 14.085 1.00 38.66 C ATOM 761 CG MET A 49 26.865 39.209 12.674 1.00 39.69 C ATOM 762 SD MET A 49 27.293 37.448 12.429 1.00 43.79 S ATOM 763 CE MET A 49 28.626 37.583 11.388 1.00 38.92 C ATOM 764 HA MET A 49 27.808 41.664 13.664 1.00 0.00 H ATOM 765 HB2 MET A 49 28.182 39.318 14.333 1.00 0.00 H ATOM 766 HB3 MET A 49 26.460 39.164 14.755 1.00 0.00 H ATOM 767 HG2 MET A 49 27.443 39.817 11.978 1.00 0.00 H ATOM 768 HG3 MET A 49 25.801 39.348 12.480 1.00 0.00 H ATOM 769 HE1 MET A 49 28.320 38.089 10.472 1.00 0.00 H ATOM 770 HE2 MET A 49 29.411 38.159 11.878 1.00 0.00 H ATOM 771 HE3 MET A 49 29.000 36.588 11.147 1.00 0.00 H ATOM 772 H MET A 49 26.947 40.870 16.435 1.00 0.00 H ATOM 773 N THR A 50 25.480 42.089 12.763 1.00 34.95 N ATOM 774 CA THR A 50 24.168 42.452 12.247 1.00 34.90 C ATOM 775 C THR A 50 23.847 41.702 10.959 1.00 33.53 C ATOM 776 O THR A 50 24.626 41.713 10.011 1.00 31.47 O ATOM 777 CB THR A 50 24.068 43.991 12.046 1.00 35.05 C ATOM 778 OG1 THR A 50 24.152 44.640 13.324 1.00 36.58 O ATOM 779 CG2 THR A 50 22.680 44.384 11.542 1.00 36.91 C ATOM 780 HA THR A 50 23.422 42.156 12.985 1.00 0.00 H ATOM 781 HB THR A 50 24.859 44.273 11.352 1.00 0.00 H ATOM 782 HG1 THR A 50 23.408 44.330 13.900 1.00 0.00 H ATOM 783 HG23 THR A 50 22.510 43.937 10.562 1.00 0.00 H ATOM 784 HG21 THR A 50 21.926 44.025 12.242 1.00 0.00 H ATOM 785 HG22 THR A 50 22.617 45.469 11.463 1.00 0.00 H ATOM 786 H THR A 50 26.307 42.219 12.146 1.00 0.00 H ATOM 787 N MET A 51 22.684 41.050 10.946 1.00 32.45 N ATOM 788 CA MET A 51 22.180 40.390 9.754 1.00 32.13 C ATOM 789 C MET A 51 20.946 41.119 9.215 1.00 30.58 C ATOM 790 O MET A 51 19.967 41.243 9.895 1.00 31.13 O ATOM 791 CB MET A 51 21.821 38.946 10.114 1.00 32.45 C ATOM 792 CG MET A 51 21.387 38.110 8.921 1.00 33.67 C ATOM 793 SD MET A 51 21.035 36.366 9.427 1.00 36.87 S ATOM 794 CE MET A 51 19.283 36.432 9.514 1.00 37.06 C ATOM 795 HA MET A 51 22.945 40.404 8.978 1.00 0.00 H ATOM 796 HB2 MET A 51 22.695 38.476 10.565 1.00 0.00 H ATOM 797 HB3 MET A 51 21.006 38.964 10.837 1.00 0.00 H ATOM 798 HG2 MET A 51 22.182 38.112 8.176 1.00 0.00 H ATOM 799 HG3 MET A 51 20.486 38.545 8.489 1.00 0.00 H ATOM 800 HE1 MET A 51 18.985 37.179 10.250 1.00 0.00 H ATOM 801 HE2 MET A 51 18.882 36.702 8.537 1.00 0.00 H ATOM 802 HE3 MET A 51 18.898 35.456 9.809 1.00 0.00 H ATOM 803 H MET A 51 22.119 41.013 11.818 1.00 0.00 H ATOM 804 N LEU A 52 20.999 41.618 7.992 1.00 31.15 N ATOM 805 CA LEU A 52 19.857 42.259 7.349 1.00 30.90 C ATOM 806 C LEU A 52 19.283 41.317 6.319 1.00 31.33 C ATOM 807 O LEU A 52 20.020 40.839 5.465 1.00 32.07 O ATOM 808 CB LEU A 52 20.311 43.537 6.635 1.00 31.41 C ATOM 809 CG LEU A 52 19.382 44.268 5.668 1.00 31.21 C ATOM 810 CD1 LEU A 52 18.184 44.861 6.409 1.00 34.10 C ATOM 811 CD2 LEU A 52 20.150 45.340 4.974 1.00 32.34 C ATOM 812 HA LEU A 52 19.111 42.504 8.105 1.00 0.00 H ATOM 813 HB2 LEU A 52 20.573 44.252 7.415 1.00 0.00 H ATOM 814 HB3 LEU A 52 21.205 43.276 6.069 1.00 0.00 H ATOM 815 HG LEU A 52 18.999 43.560 4.933 1.00 0.00 H ATOM 816 HD21 LEU A 52 20.540 46.042 5.712 1.00 0.00 H ATOM 817 HD22 LEU A 52 20.978 44.894 4.423 1.00 0.00 H ATOM 818 HD23 LEU A 52 19.493 45.866 4.282 1.00 0.00 H ATOM 819 HD11 LEU A 52 17.626 44.060 6.895 1.00 0.00 H ATOM 820 HD12 LEU A 52 18.537 45.568 7.160 1.00 0.00 H ATOM 821 HD13 LEU A 52 17.538 45.376 5.698 1.00 0.00 H ATOM 822 H LEU A 52 21.893 41.551 7.465 1.00 0.00 H ATOM 823 N THR A 53 17.980 41.065 6.385 1.00 31.26 N ATOM 824 CA THR A 53 17.259 40.280 5.376 1.00 30.86 C ATOM 825 C THR A 53 16.327 41.180 4.559 1.00 31.04 C ATOM 826 O THR A 53 15.516 41.899 5.120 1.00 32.43 O ATOM 827 CB THR A 53 16.473 39.179 6.107 1.00 31.35 C ATOM 828 OG1 THR A 53 17.387 38.357 6.864 1.00 31.20 O ATOM 829 CG2 THR A 53 15.838 38.184 5.128 1.00 32.75 C ATOM 830 HA THR A 53 17.959 39.827 4.674 1.00 0.00 H ATOM 831 HB THR A 53 15.725 39.693 6.711 1.00 0.00 H ATOM 832 HG1 THR A 53 17.863 38.918 7.526 1.00 0.00 H ATOM 833 HG23 THR A 53 15.119 38.706 4.497 1.00 0.00 H ATOM 834 HG21 THR A 53 16.616 37.742 4.506 1.00 0.00 H ATOM 835 HG22 THR A 53 15.329 37.400 5.688 1.00 0.00 H ATOM 836 H THR A 53 17.444 41.443 7.192 1.00 0.00 H ATOM 837 N GLU A 54 16.447 41.150 3.241 1.00 31.06 N ATOM 838 CA GLU A 54 15.634 41.966 2.366 1.00 32.45 C ATOM 839 C GLU A 54 14.880 41.066 1.395 1.00 32.41 C ATOM 840 O GLU A 54 15.434 40.129 0.832 1.00 32.87 O ATOM 841 CB GLU A 54 16.502 42.980 1.611 1.00 32.98 C ATOM 842 CG GLU A 54 17.202 43.965 2.537 1.00 33.77 C ATOM 843 CD GLU A 54 18.199 44.828 1.807 1.00 37.92 C ATOM 844 OE1 GLU A 54 19.141 44.299 1.159 1.00 38.08 O ATOM 845 OE2 GLU A 54 18.029 46.049 1.854 1.00 39.69 O ATOM 846 HA GLU A 54 14.914 42.527 2.962 1.00 0.00 H ATOM 847 HB2 GLU A 54 17.258 42.437 1.044 1.00 0.00 H ATOM 848 HB3 GLU A 54 15.867 43.539 0.924 1.00 0.00 H ATOM 849 HG2 GLU A 54 16.452 44.608 2.997 1.00 0.00 H ATOM 850 HG3 GLU A 54 17.724 43.406 3.313 1.00 0.00 H ATOM 851 H GLU A 54 17.154 40.515 2.818 1.00 0.00 H ATOM 852 N SER A 55 13.593 41.336 1.240 1.00 33.27 N ATOM 853 CA SER A 55 12.750 40.602 0.293 1.00 33.91 C ATOM 854 C SER A 55 11.548 41.463 -0.058 1.00 35.23 C ATOM 855 O SER A 55 11.311 42.492 0.559 1.00 34.63 O ATOM 856 CB SER A 55 12.287 39.275 0.872 1.00 33.98 C ATOM 857 OG SER A 55 11.297 39.425 1.875 1.00 33.78 O ATOM 858 HA SER A 55 13.334 40.384 -0.601 1.00 0.00 H ATOM 859 HB2 SER A 55 13.147 38.766 1.306 1.00 0.00 H ATOM 860 HB3 SER A 55 11.876 38.668 0.065 1.00 0.00 H ATOM 861 HG SER A 55 11.662 39.968 2.618 1.00 0.00 H ATOM 862 H SER A 55 13.166 42.094 1.810 1.00 0.00 H ATOM 863 N THR A 56 10.795 41.032 -1.053 1.00 37.32 N ATOM 864 CA THR A 56 9.523 41.690 -1.403 1.00 38.56 C ATOM 865 C THR A 56 8.514 41.608 -0.276 1.00 39.23 C ATOM 866 O THR A 56 7.601 42.414 -0.203 1.00 41.17 O ATOM 867 CB THR A 56 8.912 41.052 -2.662 1.00 38.76 C ATOM 868 OG1 THR A 56 8.782 39.629 -2.484 1.00 38.61 O ATOM 869 CG2 THR A 56 9.817 41.216 -3.843 1.00 37.93 C ATOM 870 HA THR A 56 9.753 42.739 -1.590 1.00 0.00 H ATOM 871 HB THR A 56 7.951 41.541 -2.824 1.00 0.00 H ATOM 872 HG1 THR A 56 8.193 39.447 -1.709 1.00 0.00 H ATOM 873 HG23 THR A 56 9.964 42.278 -4.042 1.00 0.00 H ATOM 874 HG21 THR A 56 10.778 40.748 -3.630 1.00 0.00 H ATOM 875 HG22 THR A 56 9.365 40.741 -4.714 1.00 0.00 H ATOM 876 H THR A 56 11.107 40.207 -1.604 1.00 0.00 H ATOM 877 N PHE A 57 8.663 40.622 0.594 1.00 40.16 N ATOM 878 CA PHE A 57 7.728 40.384 1.681 1.00 40.16 C ATOM 879 C PHE A 57 7.970 41.349 2.821 1.00 40.34 C ATOM 880 O PHE A 57 7.079 42.085 3.211 1.00 39.40 O ATOM 881 CB PHE A 57 7.865 38.950 2.191 1.00 40.38 C ATOM 882 CG PHE A 57 6.997 38.637 3.380 1.00 40.91 C ATOM 883 CD1 PHE A 57 7.543 38.086 4.522 1.00 40.87 C ATOM 884 CD2 PHE A 57 5.634 38.903 3.355 1.00 43.52 C ATOM 885 CE1 PHE A 57 6.757 37.793 5.629 1.00 41.55 C ATOM 886 CE2 PHE A 57 4.838 38.603 4.458 1.00 42.17 C ATOM 887 CZ PHE A 57 5.410 38.050 5.598 1.00 42.14 C ATOM 888 HA PHE A 57 6.719 40.539 1.298 1.00 0.00 H ATOM 889 HB2 PHE A 57 7.596 38.271 1.382 1.00 0.00 H ATOM 890 HB3 PHE A 57 8.905 38.784 2.472 1.00 0.00 H ATOM 891 HD2 PHE A 57 5.185 39.349 2.468 1.00 0.00 H ATOM 892 HE2 PHE A 57 3.767 38.802 4.427 1.00 0.00 H ATOM 893 HZ PHE A 57 4.790 37.821 6.465 1.00 0.00 H ATOM 894 HE1 PHE A 57 7.210 37.360 6.521 1.00 0.00 H ATOM 895 HD1 PHE A 57 8.612 37.877 4.556 1.00 0.00 H ATOM 896 H PHE A 57 9.484 39.991 0.496 1.00 0.00 H ATOM 897 N LYS A 58 9.199 41.345 3.327 1.00 40.43 N ATOM 898 CA LYS A 58 9.591 42.098 4.518 1.00 39.91 C ATOM 899 C LYS A 58 11.091 42.386 4.447 1.00 39.08 C ATOM 900 O LYS A 58 11.856 41.549 3.943 1.00 38.21 O ATOM 901 CB LYS A 58 9.316 41.231 5.733 1.00 40.55 C ATOM 902 CG LYS A 58 9.446 41.919 7.074 1.00 43.98 C ATOM 903 CD LYS A 58 8.669 41.114 8.133 1.00 47.50 C ATOM 904 CE LYS A 58 7.159 41.410 8.076 1.00 49.42 C ATOM 905 NZ LYS A 58 6.260 40.219 8.343 1.00 51.34 N ATOM 906 HA LYS A 58 9.036 43.034 4.581 1.00 0.00 H ATOM 907 HB2 LYS A 58 8.298 40.850 5.649 1.00 0.00 H ATOM 908 HB3 LYS A 58 10.017 40.397 5.715 1.00 0.00 H ATOM 909 HG2 LYS A 58 10.498 41.973 7.356 1.00 0.00 H ATOM 910 HG3 LYS A 58 9.036 42.927 7.008 1.00 0.00 H ATOM 911 HD2 LYS A 58 8.828 40.050 7.956 1.00 0.00 H ATOM 912 HD3 LYS A 58 9.044 41.376 9.122 1.00 0.00 H ATOM 913 HE2 LYS A 58 6.927 41.793 7.082 1.00 0.00 H ATOM 914 HE3 LYS A 58 6.936 42.175 8.820 1.00 0.00 H ATOM 915 HZ1 LYS A 58 6.446 39.480 7.635 1.00 0.00 H ATOM 916 HZ2 LYS A 58 6.455 39.846 9.294 1.00 0.00 H ATOM 917 HZ3 LYS A 58 5.265 40.517 8.283 1.00 0.00 H ATOM 918 H LYS A 58 9.924 40.773 2.848 1.00 0.00 H ATOM 919 N ASN A 59 11.501 43.549 4.953 1.00 37.35 N ATOM 920 CA ASN A 59 12.913 43.863 5.195 1.00 37.11 C ATOM 921 C ASN A 59 13.108 43.944 6.696 1.00 36.14 C ATOM 922 O ASN A 59 12.401 44.652 7.370 1.00 36.71 O ATOM 923 CB ASN A 59 13.356 45.169 4.533 1.00 36.17 C ATOM 924 CG ASN A 59 13.106 45.183 3.061 1.00 38.51 C ATOM 925 OD1 ASN A 59 13.510 44.263 2.341 1.00 33.45 O ATOM 926 ND2 ASN A 59 12.443 46.241 2.576 1.00 40.13 N ATOM 927 HA ASN A 59 13.528 43.080 4.752 1.00 0.00 H ATOM 928 HB2 ASN A 59 12.808 45.994 4.988 1.00 0.00 H ATOM 929 HB3 ASN A 59 14.424 45.304 4.707 1.00 0.00 H ATOM 930 HD22 ASN A 59 12.121 46.992 3.219 1.00 0.00 H ATOM 931 HD21 ASN A 59 12.250 46.311 1.556 1.00 0.00 H ATOM 932 H ASN A 59 10.786 44.267 5.187 1.00 0.00 H ATOM 933 N LEU A 60 14.088 43.211 7.197 1.00 35.77 N ATOM 934 CA LEU A 60 14.205 42.851 8.591 1.00 36.37 C ATOM 935 C LEU A 60 15.682 42.829 9.007 1.00 35.81 C ATOM 936 O LEU A 60 16.508 42.361 8.265 1.00 35.62 O ATOM 937 CB LEU A 60 13.641 41.446 8.730 1.00 37.98 C ATOM 938 CG LEU A 60 12.998 41.064 10.035 1.00 41.38 C ATOM 939 CD1 LEU A 60 11.729 41.885 10.218 1.00 45.81 C ATOM 940 CD2 LEU A 60 12.671 39.585 10.004 1.00 43.14 C ATOM 941 HA LEU A 60 13.674 43.568 9.218 1.00 0.00 H ATOM 942 HB2 LEU A 60 12.890 41.320 7.950 1.00 0.00 H ATOM 943 HB3 LEU A 60 14.462 40.750 8.558 1.00 0.00 H ATOM 944 HG LEU A 60 13.673 41.262 10.868 1.00 0.00 H ATOM 945 HD21 LEU A 60 11.986 39.383 9.181 1.00 0.00 H ATOM 946 HD22 LEU A 60 13.589 39.014 9.863 1.00 0.00 H ATOM 947 HD23 LEU A 60 12.204 39.298 10.946 1.00 0.00 H ATOM 948 HD11 LEU A 60 11.982 42.945 10.227 1.00 0.00 H ATOM 949 HD12 LEU A 60 11.044 41.681 9.395 1.00 0.00 H ATOM 950 HD13 LEU A 60 11.256 41.615 11.162 1.00 0.00 H ATOM 951 H LEU A 60 14.823 42.871 6.544 1.00 0.00 H ATOM 952 N SER A 61 16.008 43.318 10.192 1.00 35.15 N ATOM 953 CA SER A 61 17.382 43.328 10.685 1.00 34.91 C ATOM 954 C SER A 61 17.457 42.816 12.131 1.00 34.27 C ATOM 955 O SER A 61 16.548 43.063 12.910 1.00 33.18 O ATOM 956 CB SER A 61 17.913 44.767 10.637 1.00 35.23 C ATOM 957 OG SER A 61 19.128 44.836 11.326 1.00 37.82 O ATOM 958 HA SER A 61 17.983 42.671 10.056 1.00 0.00 H ATOM 959 HB2 SER A 61 17.191 45.437 11.104 1.00 0.00 H ATOM 960 HB3 SER A 61 18.065 45.065 9.600 1.00 0.00 H ATOM 961 HG SER A 61 18.988 44.566 12.268 1.00 0.00 H ATOM 962 H SER A 61 15.257 43.710 10.795 1.00 0.00 H ATOM 963 N CYS A 62 18.537 42.113 12.491 1.00 35.44 N ATOM 964 CA CYS A 62 18.822 41.779 13.898 1.00 36.74 C ATOM 965 C CYS A 62 20.300 42.025 14.208 1.00 36.15 C ATOM 966 O CYS A 62 21.155 41.880 13.347 1.00 34.78 O ATOM 967 CB CYS A 62 18.412 40.328 14.266 1.00 37.81 C ATOM 968 SG CYS A 62 19.447 39.106 13.456 1.00 45.91 S ATOM 969 HA CYS A 62 18.211 42.437 14.517 1.00 0.00 H ATOM 970 HB2 CYS A 62 17.377 40.168 13.964 1.00 0.00 H ATOM 971 HB3 CYS A 62 18.498 40.202 15.345 1.00 0.00 H ATOM 972 HG CYS A 62 19.034 37.841 13.822 1.00 0.00 H ATOM 973 H CYS A 62 19.197 41.792 11.754 1.00 0.00 H ATOM 974 N THR A 63 20.575 42.450 15.437 1.00 36.20 N ATOM 975 CA THR A 63 21.933 42.749 15.891 1.00 37.04 C ATOM 976 C THR A 63 22.131 41.974 17.197 1.00 37.22 C ATOM 977 O THR A 63 21.223 41.923 18.035 1.00 39.02 O ATOM 978 CB THR A 63 22.144 44.276 16.077 1.00 36.72 C ATOM 979 OG1 THR A 63 21.995 44.960 14.810 1.00 38.04 O ATOM 980 CG2 THR A 63 23.579 44.602 16.490 1.00 36.93 C ATOM 981 HA THR A 63 22.674 42.444 15.152 1.00 0.00 H ATOM 982 HB THR A 63 21.418 44.585 16.829 1.00 0.00 H ATOM 983 HG1 THR A 63 22.132 45.931 14.943 1.00 0.00 H ATOM 984 HG23 THR A 63 23.797 44.127 17.447 1.00 0.00 H ATOM 985 HG21 THR A 63 24.268 44.228 15.732 1.00 0.00 H ATOM 986 HG22 THR A 63 23.692 45.682 16.585 1.00 0.00 H ATOM 987 H THR A 63 19.789 42.576 16.106 1.00 0.00 H ATOM 988 N PHE A 64 23.290 41.333 17.357 1.00 37.10 N ATOM 989 CA PHE A 64 23.520 40.457 18.509 1.00 36.48 C ATOM 990 C PHE A 64 24.991 40.319 18.884 1.00 37.05 C ATOM 991 O PHE A 64 25.890 40.463 18.058 1.00 36.24 O ATOM 992 CB PHE A 64 22.936 39.058 18.246 1.00 36.62 C ATOM 993 CG PHE A 64 23.364 38.450 16.930 1.00 33.88 C ATOM 994 CD1 PHE A 64 22.618 38.664 15.782 1.00 36.49 C ATOM 995 CD2 PHE A 64 24.521 37.702 16.837 1.00 35.64 C ATOM 996 CE1 PHE A 64 23.015 38.131 14.565 1.00 33.20 C ATOM 997 CE2 PHE A 64 24.917 37.148 15.613 1.00 34.44 C ATOM 998 CZ PHE A 64 24.156 37.367 14.487 1.00 34.16 C ATOM 999 HA PHE A 64 23.014 40.932 19.349 1.00 0.00 H ATOM 1000 HB2 PHE A 64 23.257 38.396 19.050 1.00 0.00 H ATOM 1001 HB3 PHE A 64 21.849 39.134 18.251 1.00 0.00 H ATOM 1002 HD2 PHE A 64 25.132 37.541 17.725 1.00 0.00 H ATOM 1003 HE2 PHE A 64 25.824 36.546 15.552 1.00 0.00 H ATOM 1004 HZ PHE A 64 24.458 36.935 13.533 1.00 0.00 H ATOM 1005 HE1 PHE A 64 22.422 38.318 13.669 1.00 0.00 H ATOM 1006 HD1 PHE A 64 21.707 39.259 15.836 1.00 0.00 H ATOM 1007 H PHE A 64 24.044 41.457 16.651 1.00 0.00 H ATOM 1008 N LYS A 65 25.200 40.052 20.169 1.00 37.85 N ATOM 1009 CA LYS A 65 26.458 39.536 20.690 1.00 38.44 C ATOM 1010 C LYS A 65 26.345 38.019 20.775 1.00 37.84 C ATOM 1011 O LYS A 65 25.283 37.498 21.116 1.00 37.46 O ATOM 1012 CB LYS A 65 26.662 40.094 22.097 1.00 39.36 C ATOM 1013 CG LYS A 65 28.002 39.813 22.703 1.00 41.98 C ATOM 1014 CD LYS A 65 28.252 40.776 23.894 1.00 45.12 C ATOM 1015 CE LYS A 65 28.258 42.236 23.425 1.00 47.68 C ATOM 1016 NZ LYS A 65 26.917 42.895 23.543 1.00 49.27 N ATOM 1017 HA LYS A 65 27.292 39.822 20.048 1.00 0.00 H ATOM 1018 HB2 LYS A 65 26.530 41.175 22.054 1.00 0.00 H ATOM 1019 HB3 LYS A 65 25.900 39.662 22.746 1.00 0.00 H ATOM 1020 HG2 LYS A 65 28.030 38.783 23.058 1.00 0.00 H ATOM 1021 HG3 LYS A 65 28.777 39.958 21.951 1.00 0.00 H ATOM 1022 HD2 LYS A 65 27.463 40.642 24.634 1.00 0.00 H ATOM 1023 HD3 LYS A 65 29.216 40.542 24.346 1.00 0.00 H ATOM 1024 HE2 LYS A 65 28.568 42.264 22.381 1.00 0.00 H ATOM 1025 HE3 LYS A 65 28.973 42.793 24.031 1.00 0.00 H ATOM 1026 HZ1 LYS A 65 26.226 42.379 22.962 1.00 0.00 H ATOM 1027 HZ2 LYS A 65 26.613 42.883 24.537 1.00 0.00 H ATOM 1028 HZ3 LYS A 65 26.985 43.878 23.211 1.00 0.00 H ATOM 1029 H LYS A 65 24.423 40.221 20.839 1.00 0.00 H ATOM 1030 N PHE A 66 27.416 37.307 20.447 1.00 38.03 N ATOM 1031 CA PHE A 66 27.410 35.844 20.534 1.00 39.08 C ATOM 1032 C PHE A 66 27.237 35.388 21.995 1.00 40.24 C ATOM 1033 O PHE A 66 27.878 35.946 22.870 1.00 40.85 O ATOM 1034 CB PHE A 66 28.696 35.255 19.921 1.00 38.86 C ATOM 1035 CG PHE A 66 28.872 35.547 18.458 1.00 40.94 C ATOM 1036 CD1 PHE A 66 27.917 35.143 17.531 1.00 41.17 C ATOM 1037 CD2 PHE A 66 29.991 36.221 17.998 1.00 41.72 C ATOM 1038 CE1 PHE A 66 28.076 35.409 16.199 1.00 40.91 C ATOM 1039 CE2 PHE A 66 30.146 36.496 16.660 1.00 42.49 C ATOM 1040 CZ PHE A 66 29.182 36.089 15.756 1.00 41.22 C ATOM 1041 HA PHE A 66 26.562 35.470 19.960 1.00 0.00 H ATOM 1042 HB2 PHE A 66 29.550 35.668 20.457 1.00 0.00 H ATOM 1043 HB3 PHE A 66 28.674 34.173 20.053 1.00 0.00 H ATOM 1044 HD2 PHE A 66 30.758 36.537 18.705 1.00 0.00 H ATOM 1045 HE2 PHE A 66 31.028 37.034 16.312 1.00 0.00 H ATOM 1046 HZ PHE A 66 29.301 36.308 14.695 1.00 0.00 H ATOM 1047 HE1 PHE A 66 27.320 35.079 15.486 1.00 0.00 H ATOM 1048 HD1 PHE A 66 27.030 34.607 17.871 1.00 0.00 H ATOM 1049 H PHE A 66 28.275 37.796 20.123 1.00 0.00 H ATOM 1050 N GLY A 67 26.337 34.429 22.254 1.00 40.79 N ATOM 1051 CA GLY A 67 26.097 33.876 23.582 1.00 42.24 C ATOM 1052 C GLY A 67 25.086 34.645 24.411 1.00 43.10 C ATOM 1053 O GLY A 67 24.658 34.184 25.501 1.00 44.68 O ATOM 1054 HA3 GLY A 67 27.043 33.865 24.123 1.00 0.00 H ATOM 1055 HA2 GLY A 67 25.735 32.854 23.465 1.00 0.00 H ATOM 1056 H GLY A 67 25.777 34.057 21.461 1.00 0.00 H ATOM 1057 N GLU A 68 24.680 35.800 23.888 1.00 43.26 N ATOM 1058 CA GLU A 68 23.809 36.736 24.582 1.00 44.65 C ATOM 1059 C GLU A 68 22.363 36.640 24.094 1.00 44.17 C ATOM 1060 O GLU A 68 22.061 37.021 22.969 1.00 44.75 O ATOM 1061 CB GLU A 68 24.329 38.159 24.385 1.00 44.75 C ATOM 1062 CG GLU A 68 23.396 39.216 24.965 1.00 48.00 C ATOM 1063 CD GLU A 68 23.977 40.611 24.912 1.00 51.83 C ATOM 1064 OE1 GLU A 68 23.505 41.395 24.058 1.00 51.94 O ATOM 1065 OE2 GLU A 68 24.903 40.904 25.721 1.00 55.46 O ATOM 1066 HA GLU A 68 23.816 36.478 25.641 1.00 0.00 H ATOM 1067 HB2 GLU A 68 25.300 38.246 24.873 1.00 0.00 H ATOM 1068 HB3 GLU A 68 24.443 38.343 23.317 1.00 0.00 H ATOM 1069 HG2 GLU A 68 22.465 39.206 24.399 1.00 0.00 H ATOM 1070 HG3 GLU A 68 23.190 38.965 26.005 1.00 0.00 H ATOM 1071 H GLU A 68 25.003 36.047 22.931 1.00 0.00 H ATOM 1072 N GLU A 69 21.476 36.150 24.949 1.00 44.85 N ATOM 1073 CA GLU A 69 20.057 36.034 24.627 1.00 45.26 C ATOM 1074 C GLU A 69 19.498 37.388 24.266 1.00 44.79 C ATOM 1075 O GLU A 69 19.914 38.411 24.823 1.00 45.01 O ATOM 1076 CB GLU A 69 19.262 35.443 25.798 1.00 46.04 C ATOM 1077 CG GLU A 69 17.782 35.249 25.479 1.00 48.36 C ATOM 1078 CD GLU A 69 17.071 34.252 26.384 1.00 52.17 C ATOM 1079 OE1 GLU A 69 16.761 34.621 27.542 1.00 55.36 O ATOM 1080 OE2 GLU A 69 16.776 33.111 25.931 1.00 54.32 O ATOM 1081 HA GLU A 69 19.962 35.359 23.777 1.00 0.00 H ATOM 1082 HB2 GLU A 69 19.691 34.475 26.056 1.00 0.00 H ATOM 1083 HB3 GLU A 69 19.348 36.116 26.651 1.00 0.00 H ATOM 1084 HG2 GLU A 69 17.283 36.213 25.574 1.00 0.00 H ATOM 1085 HG3 GLU A 69 17.697 34.898 24.451 1.00 0.00 H ATOM 1086 H GLU A 69 21.804 35.836 25.885 1.00 0.00 H ATOM 1087 N PHE A 70 18.574 37.400 23.309 1.00 43.83 N ATOM 1088 CA PHE A 70 17.909 38.615 22.887 1.00 42.86 C ATOM 1089 C PHE A 70 16.506 38.333 22.360 1.00 42.65 C ATOM 1090 O PHE A 70 16.166 37.203 21.982 1.00 41.85 O ATOM 1091 CB PHE A 70 18.755 39.361 21.854 1.00 42.80 C ATOM 1092 CG PHE A 70 18.878 38.656 20.498 1.00 40.77 C ATOM 1093 CD1 PHE A 70 19.931 37.770 20.247 1.00 38.25 C ATOM 1094 CD2 PHE A 70 17.978 38.922 19.475 1.00 40.13 C ATOM 1095 CE1 PHE A 70 20.062 37.143 18.999 1.00 39.29 C ATOM 1096 CE2 PHE A 70 18.117 38.311 18.219 1.00 39.13 C ATOM 1097 CZ PHE A 70 19.159 37.416 17.995 1.00 37.21 C ATOM 1098 HA PHE A 70 17.798 39.257 23.761 1.00 0.00 H ATOM 1099 HB2 PHE A 70 18.305 40.340 21.689 1.00 0.00 H ATOM 1100 HB3 PHE A 70 19.757 39.488 22.263 1.00 0.00 H ATOM 1101 HD2 PHE A 70 17.154 39.614 19.649 1.00 0.00 H ATOM 1102 HE2 PHE A 70 17.410 38.537 17.421 1.00 0.00 H ATOM 1103 HZ PHE A 70 19.261 36.931 17.024 1.00 0.00 H ATOM 1104 HE1 PHE A 70 20.877 36.441 18.824 1.00 0.00 H ATOM 1105 HD1 PHE A 70 20.659 37.564 21.031 1.00 0.00 H ATOM 1106 H PHE A 70 18.320 36.504 22.847 1.00 0.00 H ATOM 1107 N ASP A 71 15.683 39.369 22.351 1.00 43.01 N ATOM 1108 CA ASP A 71 14.314 39.245 21.891 1.00 43.16 C ATOM 1109 C ASP A 71 14.254 39.561 20.399 1.00 42.71 C ATOM 1110 O ASP A 71 14.900 40.493 19.913 1.00 43.02 O ATOM 1111 CB ASP A 71 13.373 40.177 22.681 1.00 44.16 C ATOM 1112 CG ASP A 71 13.154 39.719 24.112 1.00 45.24 C ATOM 1113 OD1 ASP A 71 13.207 38.506 24.396 1.00 50.18 O ATOM 1114 OD2 ASP A 71 12.923 40.515 25.031 1.00 49.45 O ATOM 1115 HA ASP A 71 13.978 38.222 22.060 1.00 0.00 H ATOM 1116 HB2 ASP A 71 13.807 41.177 22.698 1.00 0.00 H ATOM 1117 HB3 ASP A 71 12.409 40.209 22.174 1.00 0.00 H ATOM 1118 H ASP A 71 16.026 40.293 22.682 1.00 0.00 H ATOM 1119 N GLU A 72 13.457 38.772 19.691 1.00 41.57 N ATOM 1120 CA GLU A 72 13.380 38.801 18.235 1.00 41.34 C ATOM 1121 C GLU A 72 11.929 38.587 17.845 1.00 40.46 C ATOM 1122 O GLU A 72 11.216 37.834 18.497 1.00 39.42 O ATOM 1123 CB GLU A 72 14.258 37.682 17.622 1.00 41.07 C ATOM 1124 CG GLU A 72 14.612 37.881 16.149 1.00 43.40 C ATOM 1125 CD GLU A 72 15.053 36.608 15.435 1.00 45.12 C ATOM 1126 OE1 GLU A 72 15.666 35.721 16.104 1.00 42.36 O ATOM 1127 OE2 GLU A 72 14.767 36.499 14.196 1.00 43.54 O ATOM 1128 HA GLU A 72 13.744 39.758 17.861 1.00 0.00 H ATOM 1129 HB2 GLU A 72 15.187 37.629 18.190 1.00 0.00 H ATOM 1130 HB3 GLU A 72 13.721 36.738 17.718 1.00 0.00 H ATOM 1131 HG2 GLU A 72 13.734 38.274 15.636 1.00 0.00 H ATOM 1132 HG3 GLU A 72 15.423 38.607 16.087 1.00 0.00 H ATOM 1133 H GLU A 72 12.854 38.096 20.202 1.00 0.00 H ATOM 1134 N LYS A 73 11.488 39.287 16.800 1.00 41.00 N ATOM 1135 CA LYS A 73 10.254 38.954 16.096 1.00 41.37 C ATOM 1136 C LYS A 73 10.654 38.402 14.714 1.00 40.08 C ATOM 1137 O LYS A 73 11.421 39.042 13.973 1.00 40.63 O ATOM 1138 CB LYS A 73 9.340 40.174 15.941 1.00 41.91 C ATOM 1139 CG LYS A 73 7.898 39.790 15.535 1.00 45.91 C ATOM 1140 CD LYS A 73 7.081 40.969 14.968 1.00 48.69 C ATOM 1141 CE LYS A 73 5.901 41.312 15.875 1.00 50.79 C ATOM 1142 NZ LYS A 73 4.930 42.225 15.192 1.00 53.36 N ATOM 1143 HA LYS A 73 9.691 38.216 16.667 1.00 0.00 H ATOM 1144 HB2 LYS A 73 9.305 40.707 16.891 1.00 0.00 H ATOM 1145 HB3 LYS A 73 9.756 40.827 15.174 1.00 0.00 H ATOM 1146 HG2 LYS A 73 7.950 39.010 14.776 1.00 0.00 H ATOM 1147 HG3 LYS A 73 7.383 39.405 16.415 1.00 0.00 H ATOM 1148 HD2 LYS A 73 7.729 41.842 14.882 1.00 0.00 H ATOM 1149 HD3 LYS A 73 6.704 40.699 13.981 1.00 0.00 H ATOM 1150 HE2 LYS A 73 6.276 41.802 16.774 1.00 0.00 H ATOM 1151 HE3 LYS A 73 5.387 40.391 16.152 1.00 0.00 H ATOM 1152 HZ1 LYS A 73 5.412 43.109 14.930 1.00 0.00 H ATOM 1153 HZ2 LYS A 73 4.564 41.762 14.336 1.00 0.00 H ATOM 1154 HZ3 LYS A 73 4.142 42.436 15.837 1.00 0.00 H ATOM 1155 H LYS A 73 12.045 40.102 16.474 1.00 0.00 H ATOM 1156 N THR A 74 10.159 37.207 14.399 1.00 38.16 N ATOM 1157 CA THR A 74 10.521 36.515 13.170 1.00 37.47 C ATOM 1158 C THR A 74 9.762 37.153 12.018 1.00 37.50 C ATOM 1159 O THR A 74 8.834 37.927 12.239 1.00 37.66 O ATOM 1160 CB THR A 74 10.166 34.992 13.240 1.00 37.01 C ATOM 1161 OG1 THR A 74 8.750 34.807 13.396 1.00 32.24 O ATOM 1162 CG2 THR A 74 10.784 34.332 14.453 1.00 36.06 C ATOM 1163 HA THR A 74 11.598 36.601 13.025 1.00 0.00 H ATOM 1164 HB THR A 74 10.541 34.556 12.314 1.00 0.00 H ATOM 1165 HG1 THR A 74 8.548 33.839 13.438 1.00 0.00 H ATOM 1166 HG23 THR A 74 11.868 34.432 14.406 1.00 0.00 H ATOM 1167 HG21 THR A 74 10.412 34.815 15.357 1.00 0.00 H ATOM 1168 HG22 THR A 74 10.515 33.276 14.467 1.00 0.00 H ATOM 1169 H THR A 74 9.491 36.752 15.053 1.00 0.00 H ATOM 1170 N SER A 75 10.142 36.809 10.792 1.00 39.00 N ATOM 1171 CA SER A 75 9.482 37.352 9.602 1.00 40.12 C ATOM 1172 C SER A 75 7.986 37.025 9.553 1.00 40.14 C ATOM 1173 O SER A 75 7.178 37.800 9.062 1.00 42.21 O ATOM 1174 CB SER A 75 10.189 36.902 8.305 1.00 39.84 C ATOM 1175 OG SER A 75 10.572 35.536 8.302 1.00 42.47 O ATOM 1176 HA SER A 75 9.566 38.436 9.676 1.00 0.00 H ATOM 1177 HB2 SER A 75 11.084 37.510 8.173 1.00 0.00 H ATOM 1178 HB3 SER A 75 9.511 37.070 7.468 1.00 0.00 H ATOM 1179 HG SER A 75 11.198 35.368 9.050 1.00 0.00 H ATOM 1180 H SER A 75 10.927 36.138 10.674 1.00 0.00 H ATOM 1181 N ASP A 76 7.611 35.879 10.089 1.00 40.13 N ATOM 1182 CA ASP A 76 6.224 35.462 10.065 1.00 39.25 C ATOM 1183 C ASP A 76 5.400 35.977 11.257 1.00 40.09 C ATOM 1184 O ASP A 76 4.197 35.735 11.324 1.00 39.57 O ATOM 1185 CB ASP A 76 6.137 33.940 9.971 1.00 39.17 C ATOM 1186 CG ASP A 76 6.775 33.246 11.129 1.00 37.24 C ATOM 1187 OD1 ASP A 76 8.007 33.351 11.309 1.00 36.54 O ATOM 1188 OD2 ASP A 76 6.112 32.559 11.930 1.00 36.22 O ATOM 1189 HA ASP A 76 5.781 35.916 9.178 1.00 0.00 H ATOM 1190 HB2 ASP A 76 5.086 33.654 9.930 1.00 0.00 H ATOM 1191 HB3 ASP A 76 6.635 33.619 9.056 1.00 0.00 H ATOM 1192 H ASP A 76 8.322 35.266 10.536 1.00 0.00 H ATOM 1193 N GLY A 77 6.059 36.662 12.188 1.00 40.77 N ATOM 1194 CA GLY A 77 5.393 37.357 13.280 1.00 41.61 C ATOM 1195 C GLY A 77 5.481 36.775 14.678 1.00 42.10 C ATOM 1196 O GLY A 77 4.837 37.296 15.590 1.00 42.49 O ATOM 1197 HA3 GLY A 77 4.335 37.417 13.024 1.00 0.00 H ATOM 1198 HA2 GLY A 77 5.813 38.362 13.324 1.00 0.00 H ATOM 1199 H GLY A 77 7.097 36.703 12.133 1.00 0.00 H ATOM 1200 N ARG A 78 6.269 35.720 14.878 1.00 41.68 N ATOM 1201 CA ARG A 78 6.373 35.091 16.181 1.00 41.15 C ATOM 1202 C ARG A 78 7.425 35.819 17.036 1.00 41.57 C ATOM 1203 O ARG A 78 8.528 36.112 16.562 1.00 40.74 O ATOM 1204 CB ARG A 78 6.753 33.619 16.037 1.00 41.29 C ATOM 1205 CG ARG A 78 5.695 32.733 15.381 1.00 41.20 C ATOM 1206 CD ARG A 78 6.286 31.760 14.337 1.00 42.58 C ATOM 1207 NE ARG A 78 7.395 31.123 14.964 1.00 40.75 N ATOM 1208 CZ ARG A 78 8.606 30.916 14.489 1.00 34.00 C ATOM 1209 NH1 ARG A 78 9.017 31.214 13.242 1.00 31.37 N ATOM 1210 NH2 ARG A 78 9.451 30.364 15.345 1.00 33.45 N ATOM 1211 HA ARG A 78 5.403 35.155 16.673 1.00 0.00 H ATOM 1212 HB2 ARG A 78 7.660 33.562 15.436 1.00 0.00 H ATOM 1213 HB3 ARG A 78 6.954 33.224 17.033 1.00 0.00 H ATOM 1214 HG2 ARG A 78 5.199 32.151 16.158 1.00 0.00 H ATOM 1215 HG3 ARG A 78 4.964 33.373 14.886 1.00 0.00 H ATOM 1216 HD2 ARG A 78 6.615 32.308 13.454 1.00 0.00 H ATOM 1217 HD3 ARG A 78 5.540 31.020 14.046 1.00 0.00 H ATOM 1218 HE ARG A 78 7.225 30.774 15.929 1.00 0.00 H ATOM 1219 HH12 ARG A 78 9.996 31.013 12.955 1.00 0.00 H ATOM 1220 HH11 ARG A 78 8.355 31.645 12.565 1.00 0.00 H ATOM 1221 HH22 ARG A 78 10.430 30.165 15.055 1.00 0.00 H ATOM 1222 HH21 ARG A 78 9.137 30.130 16.308 1.00 0.00 H ATOM 1223 H ARG A 78 6.821 35.339 14.083 1.00 0.00 H ATOM 1224 N ASN A 79 7.065 36.130 18.286 1.00 41.34 N ATOM 1225 CA ASN A 79 8.025 36.640 19.259 1.00 41.47 C ATOM 1226 C ASN A 79 8.774 35.472 19.886 1.00 40.74 C ATOM 1227 O ASN A 79 8.170 34.523 20.408 1.00 41.45 O ATOM 1228 CB ASN A 79 7.332 37.464 20.349 1.00 42.36 C ATOM 1229 CG ASN A 79 6.709 38.723 19.802 1.00 43.46 C ATOM 1230 OD1 ASN A 79 7.397 39.595 19.274 1.00 45.67 O ATOM 1231 ND2 ASN A 79 5.392 38.812 19.900 1.00 47.43 N ATOM 1232 HA ASN A 79 8.726 37.296 18.742 1.00 0.00 H ATOM 1233 HB2 ASN A 79 6.552 36.856 20.806 1.00 0.00 H ATOM 1234 HB3 ASN A 79 8.068 37.736 21.105 1.00 0.00 H ATOM 1235 HD22 ASN A 79 4.852 38.049 20.355 1.00 0.00 H ATOM 1236 HD21 ASN A 79 4.898 39.645 19.522 1.00 0.00 H ATOM 1237 H ASN A 79 6.073 36.005 18.572 1.00 0.00 H ATOM 1238 N VAL A 80 10.089 35.541 19.802 1.00 39.19 N ATOM 1239 CA VAL A 80 10.969 34.452 20.190 1.00 38.57 C ATOM 1240 C VAL A 80 12.155 35.003 20.988 1.00 38.80 C ATOM 1241 O VAL A 80 12.507 36.188 20.881 1.00 39.68 O ATOM 1242 CB VAL A 80 11.460 33.676 18.923 1.00 38.31 C ATOM 1243 CG1 VAL A 80 10.263 33.197 18.102 1.00 36.21 C ATOM 1244 CG2 VAL A 80 12.377 34.558 18.051 1.00 38.40 C ATOM 1245 HA VAL A 80 10.420 33.754 20.822 1.00 0.00 H ATOM 1246 HB VAL A 80 12.035 32.813 19.258 1.00 0.00 H ATOM 1247 HG11 VAL A 80 9.648 32.535 18.711 1.00 0.00 H ATOM 1248 HG12 VAL A 80 9.672 34.057 17.788 1.00 0.00 H ATOM 1249 HG13 VAL A 80 10.619 32.659 17.223 1.00 0.00 H ATOM 1250 HG21 VAL A 80 11.828 35.442 17.727 1.00 0.00 H ATOM 1251 HG22 VAL A 80 13.247 34.862 18.633 1.00 0.00 H ATOM 1252 HG23 VAL A 80 12.702 33.991 17.179 1.00 0.00 H ATOM 1253 H VAL A 80 10.516 36.418 19.440 1.00 0.00 H ATOM 1254 N LYS A 81 12.733 34.138 21.811 1.00 38.76 N ATOM 1255 CA LYS A 81 13.994 34.391 22.488 1.00 38.97 C ATOM 1256 C LYS A 81 15.060 33.673 21.696 1.00 37.36 C ATOM 1257 O LYS A 81 14.974 32.444 21.529 1.00 38.04 O ATOM 1258 CB LYS A 81 14.005 33.792 23.910 1.00 39.08 C ATOM 1259 CG LYS A 81 12.774 34.042 24.780 1.00 42.48 C ATOM 1260 CD LYS A 81 12.882 33.223 26.113 1.00 45.38 C ATOM 1261 CE LYS A 81 12.736 31.678 25.928 1.00 48.18 C ATOM 1262 NZ LYS A 81 14.058 30.902 25.964 1.00 49.41 N ATOM 1263 HA LYS A 81 14.154 35.467 22.559 1.00 0.00 H ATOM 1264 HB2 LYS A 81 14.124 32.713 23.811 1.00 0.00 H ATOM 1265 HB3 LYS A 81 14.867 34.205 24.434 1.00 0.00 H ATOM 1266 HG2 LYS A 81 12.707 35.105 25.014 1.00 0.00 H ATOM 1267 HG3 LYS A 81 11.880 33.733 24.238 1.00 0.00 H ATOM 1268 HD2 LYS A 81 13.856 33.424 26.560 1.00 0.00 H ATOM 1269 HD3 LYS A 81 12.097 33.563 26.788 1.00 0.00 H ATOM 1270 HE2 LYS A 81 12.260 31.494 24.965 1.00 0.00 H ATOM 1271 HE3 LYS A 81 12.097 31.299 26.726 1.00 0.00 H ATOM 1272 HZ1 LYS A 81 14.678 31.240 25.200 1.00 0.00 H ATOM 1273 HZ2 LYS A 81 14.523 31.053 26.882 1.00 0.00 H ATOM 1274 HZ3 LYS A 81 13.867 29.888 25.834 1.00 0.00 H ATOM 1275 H LYS A 81 12.258 33.229 21.981 1.00 0.00 H ATOM 1276 N SER A 82 16.049 34.421 21.219 1.00 36.09 N ATOM 1277 CA SER A 82 17.133 33.867 20.454 1.00 34.82 C ATOM 1278 C SER A 82 18.514 34.082 21.057 1.00 34.93 C ATOM 1279 O SER A 82 18.754 35.009 21.811 1.00 35.53 O ATOM 1280 CB SER A 82 17.102 34.455 19.028 1.00 35.06 C ATOM 1281 OG SER A 82 15.795 34.363 18.509 1.00 35.36 O ATOM 1282 HA SER A 82 16.975 32.789 20.449 1.00 0.00 H ATOM 1283 HB2 SER A 82 17.787 33.897 18.390 1.00 0.00 H ATOM 1284 HB3 SER A 82 17.408 35.501 19.059 1.00 0.00 H ATOM 1285 HG SER A 82 15.777 34.741 17.594 1.00 0.00 H ATOM 1286 H SER A 82 16.039 35.444 21.406 1.00 0.00 H ATOM 1287 N VAL A 83 19.425 33.185 20.731 1.00 34.20 N ATOM 1288 CA VAL A 83 20.838 33.399 20.956 1.00 34.34 C ATOM 1289 C VAL A 83 21.581 32.821 19.763 1.00 33.97 C ATOM 1290 O VAL A 83 21.162 31.812 19.215 1.00 33.55 O ATOM 1291 CB VAL A 83 21.322 32.718 22.257 1.00 34.57 C ATOM 1292 CG1 VAL A 83 21.120 31.222 22.200 1.00 36.99 C ATOM 1293 CG2 VAL A 83 22.770 33.044 22.489 1.00 37.15 C ATOM 1294 HA VAL A 83 21.031 34.466 21.065 1.00 0.00 H ATOM 1295 HB VAL A 83 20.729 33.100 23.088 1.00 0.00 H ATOM 1296 HG11 VAL A 83 20.060 31.005 22.067 1.00 0.00 H ATOM 1297 HG12 VAL A 83 21.684 30.812 21.362 1.00 0.00 H ATOM 1298 HG13 VAL A 83 21.470 30.774 23.130 1.00 0.00 H ATOM 1299 HG21 VAL A 83 23.362 32.682 21.648 1.00 0.00 H ATOM 1300 HG22 VAL A 83 22.888 34.124 22.580 1.00 0.00 H ATOM 1301 HG23 VAL A 83 23.107 32.562 23.407 1.00 0.00 H ATOM 1302 H VAL A 83 19.116 32.292 20.297 1.00 0.00 H ATOM 1303 N VAL A 84 22.646 33.480 19.367 1.00 34.03 N ATOM 1304 CA VAL A 84 23.490 33.032 18.271 1.00 34.39 C ATOM 1305 C VAL A 84 24.813 32.643 18.915 1.00 34.95 C ATOM 1306 O VAL A 84 25.361 33.410 19.707 1.00 35.12 O ATOM 1307 CB VAL A 84 23.707 34.131 17.214 1.00 33.63 C ATOM 1308 CG1 VAL A 84 24.619 33.630 16.104 1.00 34.48 C ATOM 1309 CG2 VAL A 84 22.379 34.610 16.626 1.00 32.95 C ATOM 1310 HA VAL A 84 23.024 32.202 17.739 1.00 0.00 H ATOM 1311 HB VAL A 84 24.182 34.977 17.710 1.00 0.00 H ATOM 1312 HG11 VAL A 84 25.584 33.349 16.527 1.00 0.00 H ATOM 1313 HG12 VAL A 84 24.164 32.763 15.626 1.00 0.00 H ATOM 1314 HG13 VAL A 84 24.760 34.421 15.367 1.00 0.00 H ATOM 1315 HG21 VAL A 84 21.869 33.771 16.153 1.00 0.00 H ATOM 1316 HG22 VAL A 84 21.755 35.014 17.423 1.00 0.00 H ATOM 1317 HG23 VAL A 84 22.570 35.385 15.884 1.00 0.00 H ATOM 1318 H VAL A 84 22.897 34.361 19.859 1.00 0.00 H ATOM 1319 N GLU A 85 25.296 31.437 18.623 1.00 35.47 N ATOM 1320 CA GLU A 85 26.576 30.980 19.145 1.00 37.09 C ATOM 1321 C GLU A 85 27.586 30.825 18.006 1.00 37.20 C ATOM 1322 O GLU A 85 27.233 30.376 16.910 1.00 36.48 O ATOM 1323 CB GLU A 85 26.409 29.660 19.908 1.00 37.54 C ATOM 1324 CG GLU A 85 25.533 29.739 21.158 1.00 41.30 C ATOM 1325 CD GLU A 85 26.292 30.136 22.431 1.00 46.25 C ATOM 1326 OE1 GLU A 85 25.862 29.701 23.529 1.00 52.68 O ATOM 1327 OE2 GLU A 85 27.301 30.880 22.355 1.00 48.84 O ATOM 1328 HA GLU A 85 26.954 31.727 19.843 1.00 0.00 H ATOM 1329 HB2 GLU A 85 25.965 28.932 19.230 1.00 0.00 H ATOM 1330 HB3 GLU A 85 27.399 29.317 20.210 1.00 0.00 H ATOM 1331 HG2 GLU A 85 24.750 30.477 20.982 1.00 0.00 H ATOM 1332 HG3 GLU A 85 25.079 28.761 21.321 1.00 0.00 H ATOM 1333 H GLU A 85 24.745 30.806 18.007 1.00 0.00 H ATOM 1334 N LYS A 86 28.821 31.225 18.268 1.00 37.29 N ATOM 1335 CA LYS A 86 29.933 31.045 17.336 1.00 38.75 C ATOM 1336 C LYS A 86 30.530 29.625 17.466 1.00 39.24 C ATOM 1337 O LYS A 86 31.133 29.267 18.488 1.00 39.08 O ATOM 1338 CB LYS A 86 31.021 32.093 17.561 1.00 39.71 C ATOM 1339 CG LYS A 86 32.137 32.014 16.505 1.00 41.49 C ATOM 1340 CD LYS A 86 33.024 33.275 16.435 1.00 46.39 C ATOM 1341 CE LYS A 86 33.921 33.329 17.642 1.00 50.14 C ATOM 1342 NZ LYS A 86 34.883 32.178 17.738 1.00 53.35 N ATOM 1343 HA LYS A 86 29.541 31.172 16.327 1.00 0.00 H ATOM 1344 HB2 LYS A 86 30.568 33.083 17.519 1.00 0.00 H ATOM 1345 HB3 LYS A 86 31.459 31.937 18.547 1.00 0.00 H ATOM 1346 HG2 LYS A 86 32.772 31.160 16.740 1.00 0.00 H ATOM 1347 HG3 LYS A 86 31.676 31.864 15.529 1.00 0.00 H ATOM 1348 HD2 LYS A 86 33.633 33.241 15.531 1.00 0.00 H ATOM 1349 HD3 LYS A 86 32.392 34.163 16.412 1.00 0.00 H ATOM 1350 HE2 LYS A 86 33.296 33.329 18.535 1.00 0.00 H ATOM 1351 HE3 LYS A 86 34.496 34.254 17.602 1.00 0.00 H ATOM 1352 HZ1 LYS A 86 34.351 31.286 17.789 1.00 0.00 H ATOM 1353 HZ2 LYS A 86 35.496 32.169 16.898 1.00 0.00 H ATOM 1354 HZ3 LYS A 86 35.465 32.285 18.593 1.00 0.00 H ATOM 1355 H LYS A 86 29.009 31.689 19.180 1.00 0.00 H ATOM 1356 N ASN A 87 30.335 28.814 16.430 1.00 37.93 N ATOM 1357 CA ASN A 87 30.921 27.472 16.379 1.00 38.52 C ATOM 1358 C ASN A 87 32.382 27.495 15.950 1.00 38.47 C ATOM 1359 O ASN A 87 33.180 26.652 16.383 1.00 39.53 O ATOM 1360 CB ASN A 87 30.105 26.546 15.457 1.00 37.98 C ATOM 1361 CG ASN A 87 28.656 26.466 15.856 1.00 38.13 C ATOM 1362 OD1 ASN A 87 27.823 27.157 15.303 1.00 33.55 O ATOM 1363 ND2 ASN A 87 28.355 25.648 16.846 1.00 40.99 N ATOM 1364 HA ASN A 87 30.885 27.076 17.394 1.00 0.00 H ATOM 1365 HB2 ASN A 87 30.167 26.925 14.437 1.00 0.00 H ATOM 1366 HB3 ASN A 87 30.535 25.545 15.497 1.00 0.00 H ATOM 1367 HD22 ASN A 87 29.100 25.074 17.291 1.00 0.00 H ATOM 1368 HD21 ASN A 87 27.373 25.577 17.181 1.00 0.00 H ATOM 1369 H ASN A 87 29.751 29.141 15.634 1.00 0.00 H ATOM 1370 N SER A 88 32.711 28.471 15.112 1.00 38.74 N ATOM 1371 CA SER A 88 33.990 28.596 14.424 1.00 39.00 C ATOM 1372 C SER A 88 33.979 29.927 13.680 1.00 38.76 C ATOM 1373 O SER A 88 32.976 30.600 13.682 1.00 38.61 O ATOM 1374 CB SER A 88 34.186 27.431 13.444 1.00 39.47 C ATOM 1375 OG SER A 88 33.786 27.784 12.128 1.00 38.99 O ATOM 1376 HA SER A 88 34.814 28.565 15.137 1.00 0.00 H ATOM 1377 HB2 SER A 88 33.591 26.582 13.779 1.00 0.00 H ATOM 1378 HB3 SER A 88 35.240 27.152 13.431 1.00 0.00 H ATOM 1379 HG SER A 88 33.925 27.012 11.524 1.00 0.00 H ATOM 1380 H SER A 88 31.998 29.206 14.932 1.00 0.00 H ATOM 1381 N GLU A 89 35.081 30.321 13.045 1.00 38.52 N ATOM 1382 CA GLU A 89 35.094 31.553 12.250 1.00 39.16 C ATOM 1383 C GLU A 89 34.206 31.487 10.974 1.00 37.83 C ATOM 1384 O GLU A 89 33.987 32.489 10.300 1.00 38.87 O ATOM 1385 CB GLU A 89 36.543 31.932 11.881 1.00 39.87 C ATOM 1386 CG GLU A 89 37.380 32.282 13.116 1.00 42.45 C ATOM 1387 CD GLU A 89 36.942 33.587 13.763 1.00 45.65 C ATOM 1388 OE1 GLU A 89 36.614 33.586 14.978 1.00 48.76 O ATOM 1389 OE2 GLU A 89 36.901 34.612 13.044 1.00 49.94 O ATOM 1390 HA GLU A 89 34.656 32.328 12.879 1.00 0.00 H ATOM 1391 HB2 GLU A 89 37.007 31.089 11.369 1.00 0.00 H ATOM 1392 HB3 GLU A 89 36.522 32.794 11.214 1.00 0.00 H ATOM 1393 HG2 GLU A 89 37.280 31.479 13.846 1.00 0.00 H ATOM 1394 HG3 GLU A 89 38.424 32.372 12.817 1.00 0.00 H ATOM 1395 H GLU A 89 35.945 29.747 13.114 1.00 0.00 H ATOM 1396 N SER A 90 33.688 30.311 10.682 1.00 36.36 N ATOM 1397 CA SER A 90 32.926 30.069 9.455 1.00 35.08 C ATOM 1398 C SER A 90 31.551 29.418 9.742 1.00 33.27 C ATOM 1399 O SER A 90 30.821 29.086 8.834 1.00 31.76 O ATOM 1400 CB SER A 90 33.770 29.203 8.520 1.00 34.46 C ATOM 1401 OG SER A 90 33.911 27.910 9.056 1.00 37.22 O ATOM 1402 HA SER A 90 32.712 31.025 8.976 1.00 0.00 H ATOM 1403 HB2 SER A 90 34.755 29.654 8.401 1.00 0.00 H ATOM 1404 HB3 SER A 90 33.281 29.139 7.548 1.00 0.00 H ATOM 1405 HG SER A 90 34.356 27.967 9.938 1.00 0.00 H ATOM 1406 H SER A 90 33.826 29.525 11.348 1.00 0.00 H ATOM 1407 N LYS A 91 31.180 29.268 11.007 1.00 31.51 N ATOM 1408 CA LYS A 91 29.917 28.638 11.351 1.00 30.95 C ATOM 1409 C LYS A 91 29.290 29.242 12.609 1.00 31.59 C ATOM 1410 O LYS A 91 29.959 29.374 13.635 1.00 31.07 O ATOM 1411 CB LYS A 91 30.144 27.152 11.545 1.00 30.72 C ATOM 1412 CG LYS A 91 28.920 26.314 11.725 1.00 31.73 C ATOM 1413 CD LYS A 91 29.365 24.846 11.733 1.00 34.33 C ATOM 1414 CE LYS A 91 28.298 23.908 12.107 1.00 37.16 C ATOM 1415 NZ LYS A 91 28.895 22.573 12.264 1.00 40.28 N ATOM 1416 HA LYS A 91 29.218 28.812 10.533 1.00 0.00 H ATOM 1417 HB2 LYS A 91 30.676 26.780 10.669 1.00 0.00 H ATOM 1418 HB3 LYS A 91 30.768 27.024 12.429 1.00 0.00 H ATOM 1419 HG2 LYS A 91 28.434 26.561 12.669 1.00 0.00 H ATOM 1420 HG3 LYS A 91 28.225 26.488 10.904 1.00 0.00 H ATOM 1421 HD2 LYS A 91 29.717 24.587 10.734 1.00 0.00 H ATOM 1422 HD3 LYS A 91 30.184 24.738 12.445 1.00 0.00 H ATOM 1423 HE2 LYS A 91 27.538 23.883 11.326 1.00 0.00 H ATOM 1424 HE3 LYS A 91 27.843 24.222 13.046 1.00 0.00 H ATOM 1425 HZ1 LYS A 91 29.330 22.281 11.365 1.00 0.00 H ATOM 1426 HZ2 LYS A 91 29.621 22.605 13.008 1.00 0.00 H ATOM 1427 HZ3 LYS A 91 28.155 21.893 12.529 1.00 0.00 H ATOM 1428 H LYS A 91 31.805 29.608 11.766 1.00 0.00 H ATOM 1429 N LEU A 92 28.003 29.583 12.537 1.00 31.01 N ATOM 1430 CA LEU A 92 27.256 30.005 13.727 1.00 31.85 C ATOM 1431 C LEU A 92 25.939 29.301 13.800 1.00 31.21 C ATOM 1432 O LEU A 92 25.378 28.873 12.768 1.00 29.94 O ATOM 1433 CB LEU A 92 27.074 31.518 13.780 1.00 33.00 C ATOM 1434 CG LEU A 92 26.615 32.231 12.551 1.00 34.09 C ATOM 1435 CD1 LEU A 92 25.127 32.056 12.414 1.00 36.64 C ATOM 1436 CD2 LEU A 92 27.020 33.737 12.549 1.00 35.33 C ATOM 1437 HA LEU A 92 27.845 29.725 14.600 1.00 0.00 H ATOM 1438 HB2 LEU A 92 26.344 31.726 14.563 1.00 0.00 H ATOM 1439 HB3 LEU A 92 28.036 31.947 14.059 1.00 0.00 H ATOM 1440 HG LEU A 92 27.114 31.791 11.687 1.00 0.00 H ATOM 1441 HD21 LEU A 92 26.575 34.233 13.412 1.00 0.00 H ATOM 1442 HD22 LEU A 92 28.106 33.820 12.601 1.00 0.00 H ATOM 1443 HD23 LEU A 92 26.662 34.207 11.633 1.00 0.00 H ATOM 1444 HD11 LEU A 92 24.893 30.994 12.334 1.00 0.00 H ATOM 1445 HD12 LEU A 92 24.631 32.474 13.290 1.00 0.00 H ATOM 1446 HD13 LEU A 92 24.782 32.574 11.519 1.00 0.00 H ATOM 1447 H LEU A 92 27.518 29.549 11.617 1.00 0.00 H ATOM 1448 N THR A 93 25.432 29.170 15.018 1.00 29.99 N ATOM 1449 CA THR A 93 24.186 28.476 15.255 1.00 29.60 C ATOM 1450 C THR A 93 23.195 29.382 16.022 1.00 30.38 C ATOM 1451 O THR A 93 23.523 29.870 17.101 1.00 30.25 O ATOM 1452 CB THR A 93 24.475 27.204 16.065 1.00 29.87 C ATOM 1453 OG1 THR A 93 25.395 26.341 15.371 1.00 30.65 O ATOM 1454 CG2 THR A 93 23.243 26.391 16.251 1.00 29.87 C ATOM 1455 HA THR A 93 23.731 28.212 14.300 1.00 0.00 H ATOM 1456 HB THR A 93 24.881 27.546 17.017 1.00 0.00 H ATOM 1457 HG1 THR A 93 26.248 26.821 15.222 1.00 0.00 H ATOM 1458 HG23 THR A 93 22.493 26.984 16.775 1.00 0.00 H ATOM 1459 HG21 THR A 93 22.856 26.092 15.277 1.00 0.00 H ATOM 1460 HG22 THR A 93 23.480 25.503 16.837 1.00 0.00 H ATOM 1461 H THR A 93 25.945 29.578 15.826 1.00 0.00 H ATOM 1462 N GLN A 94 22.006 29.605 15.462 1.00 29.16 N ATOM 1463 CA GLN A 94 20.974 30.430 16.059 1.00 30.07 C ATOM 1464 C GLN A 94 19.846 29.555 16.558 1.00 31.21 C ATOM 1465 O GLN A 94 19.290 28.731 15.822 1.00 30.33 O ATOM 1466 CB GLN A 94 20.429 31.438 15.046 1.00 29.55 C ATOM 1467 CG GLN A 94 19.315 32.324 15.576 1.00 30.58 C ATOM 1468 CD GLN A 94 18.852 33.334 14.608 1.00 32.67 C ATOM 1469 OE1 GLN A 94 19.196 33.272 13.431 1.00 32.71 O ATOM 1470 NE2 GLN A 94 18.084 34.315 15.097 1.00 31.49 N ATOM 1471 HA GLN A 94 21.412 30.978 16.893 1.00 0.00 H ATOM 1472 HB2 GLN A 94 21.251 32.079 14.727 1.00 0.00 H ATOM 1473 HB3 GLN A 94 20.046 30.886 14.188 1.00 0.00 H ATOM 1474 HG2 GLN A 94 18.469 31.691 15.845 1.00 0.00 H ATOM 1475 HG3 GLN A 94 19.678 32.840 16.465 1.00 0.00 H ATOM 1476 HE22 GLN A 94 17.823 34.318 16.104 1.00 0.00 H ATOM 1477 HE21 GLN A 94 17.749 35.074 14.470 1.00 0.00 H ATOM 1478 H GLN A 94 21.807 29.161 14.543 1.00 0.00 H ATOM 1479 N THR A 95 19.490 29.745 17.826 1.00 30.57 N ATOM 1480 CA THR A 95 18.399 29.025 18.421 1.00 31.42 C ATOM 1481 C THR A 95 17.281 30.037 18.664 1.00 31.67 C ATOM 1482 O THR A 95 17.522 31.098 19.230 1.00 32.69 O ATOM 1483 CB THR A 95 18.902 28.310 19.720 1.00 31.31 C ATOM 1484 OG1 THR A 95 19.906 27.336 19.368 1.00 34.06 O ATOM 1485 CG2 THR A 95 17.851 27.494 20.321 1.00 34.17 C ATOM 1486 HA THR A 95 18.009 28.235 17.779 1.00 0.00 H ATOM 1487 HB THR A 95 19.251 29.096 20.389 1.00 0.00 H ATOM 1488 HG1 THR A 95 20.665 27.791 18.924 1.00 0.00 H ATOM 1489 HG23 THR A 95 17.026 28.136 20.630 1.00 0.00 H ATOM 1490 HG21 THR A 95 17.494 26.768 19.590 1.00 0.00 H ATOM 1491 HG22 THR A 95 18.251 26.971 21.189 1.00 0.00 H ATOM 1492 H THR A 95 20.016 30.433 18.402 1.00 0.00 H ATOM 1493 N GLN A 96 16.088 29.737 18.186 1.00 31.69 N ATOM 1494 CA GLN A 96 14.917 30.584 18.356 1.00 33.42 C ATOM 1495 C GLN A 96 13.872 29.802 19.131 1.00 34.73 C ATOM 1496 O GLN A 96 13.384 28.782 18.670 1.00 35.06 O ATOM 1497 CB GLN A 96 14.329 30.996 17.007 1.00 33.32 C ATOM 1498 CG GLN A 96 15.240 31.880 16.204 1.00 33.32 C ATOM 1499 CD GLN A 96 14.612 32.370 14.881 1.00 32.49 C ATOM 1500 OE1 GLN A 96 13.994 31.606 14.164 1.00 35.30 O ATOM 1501 NE2 GLN A 96 14.795 33.648 14.576 1.00 31.25 N ATOM 1502 HA GLN A 96 15.210 31.488 18.890 1.00 0.00 H ATOM 1503 HB2 GLN A 96 14.124 30.095 16.429 1.00 0.00 H ATOM 1504 HB3 GLN A 96 13.396 31.531 17.185 1.00 0.00 H ATOM 1505 HG2 GLN A 96 15.497 32.750 16.808 1.00 0.00 H ATOM 1506 HG3 GLN A 96 16.146 31.321 15.970 1.00 0.00 H ATOM 1507 HE22 GLN A 96 15.331 34.265 15.220 1.00 0.00 H ATOM 1508 HE21 GLN A 96 14.403 34.033 13.693 1.00 0.00 H ATOM 1509 H GLN A 96 15.979 28.847 17.659 1.00 0.00 H ATOM 1510 N VAL A 97 13.509 30.290 20.306 1.00 36.77 N ATOM 1511 CA VAL A 97 12.556 29.583 21.154 1.00 37.66 C ATOM 1512 C VAL A 97 11.249 30.367 21.194 1.00 38.73 C ATOM 1513 O VAL A 97 11.202 31.456 21.767 1.00 37.93 O ATOM 1514 CB VAL A 97 13.124 29.352 22.579 1.00 37.56 C ATOM 1515 CG1 VAL A 97 12.123 28.588 23.447 1.00 38.86 C ATOM 1516 CG2 VAL A 97 14.432 28.594 22.523 1.00 37.61 C ATOM 1517 HA VAL A 97 12.368 28.596 20.732 1.00 0.00 H ATOM 1518 HB VAL A 97 13.303 30.330 23.025 1.00 0.00 H ATOM 1519 HG11 VAL A 97 11.200 29.162 23.525 1.00 0.00 H ATOM 1520 HG12 VAL A 97 11.913 27.620 22.991 1.00 0.00 H ATOM 1521 HG13 VAL A 97 12.545 28.439 24.441 1.00 0.00 H ATOM 1522 HG21 VAL A 97 14.270 27.626 22.049 1.00 0.00 H ATOM 1523 HG22 VAL A 97 15.157 29.166 21.945 1.00 0.00 H ATOM 1524 HG23 VAL A 97 14.808 28.446 23.535 1.00 0.00 H ATOM 1525 H VAL A 97 13.910 31.193 20.630 1.00 0.00 H ATOM 1526 N ASP A 98 10.226 29.836 20.511 1.00 40.43 N ATOM 1527 CA ASP A 98 8.829 30.208 20.752 1.00 42.00 C ATOM 1528 C ASP A 98 8.159 29.212 21.751 1.00 43.46 C ATOM 1529 O ASP A 98 8.772 28.221 22.161 1.00 43.53 O ATOM 1530 CB ASP A 98 8.055 30.454 19.418 1.00 41.62 C ATOM 1531 CG ASP A 98 7.588 29.182 18.701 1.00 42.99 C ATOM 1532 OD1 ASP A 98 8.046 28.907 17.540 1.00 37.53 O ATOM 1533 OD2 ASP A 98 6.680 28.456 19.152 1.00 42.13 O ATOM 1534 HA ASP A 98 8.791 31.176 21.252 1.00 0.00 H ATOM 1535 HB2 ASP A 98 7.177 31.059 19.642 1.00 0.00 H ATOM 1536 HB3 ASP A 98 8.710 31.003 18.742 1.00 0.00 H ATOM 1537 H ASP A 98 10.432 29.128 19.777 1.00 0.00 H ATOM 1538 N PRO A 99 6.954 29.518 22.229 1.00 44.99 N ATOM 1539 CA PRO A 99 6.308 28.672 23.252 1.00 44.84 C ATOM 1540 C PRO A 99 5.875 27.300 22.748 1.00 44.75 C ATOM 1541 O PRO A 99 5.795 26.359 23.550 1.00 46.16 O ATOM 1542 CB PRO A 99 5.084 29.500 23.657 1.00 45.06 C ATOM 1543 CG PRO A 99 5.409 30.871 23.247 1.00 45.48 C ATOM 1544 CD PRO A 99 6.137 30.708 21.926 1.00 44.99 C ATOM 1545 HA PRO A 99 6.998 28.444 24.064 1.00 0.00 H ATOM 1546 HD3 PRO A 99 5.446 30.526 21.103 1.00 0.00 H ATOM 1547 HD2 PRO A 99 6.755 31.575 21.695 1.00 0.00 H ATOM 1548 HG3 PRO A 99 6.051 31.352 23.985 1.00 0.00 H ATOM 1549 HG2 PRO A 99 4.501 31.460 23.117 1.00 0.00 H ATOM 1550 HB2 PRO A 99 4.192 29.145 23.141 1.00 0.00 H ATOM 1551 HB3 PRO A 99 4.924 29.448 24.734 1.00 0.00 H ATOM 1552 N LYS A 100 5.580 27.197 21.454 1.00 44.04 N ATOM 1553 CA LYS A 100 5.218 25.927 20.841 1.00 43.05 C ATOM 1554 C LYS A 100 6.454 25.106 20.401 1.00 42.09 C ATOM 1555 O LYS A 100 6.464 23.883 20.550 1.00 41.68 O ATOM 1556 CB LYS A 100 4.258 26.168 19.682 1.00 43.25 C ATOM 1557 CG LYS A 100 2.894 26.731 20.079 1.00 44.71 C ATOM 1558 CD LYS A 100 1.937 26.793 18.860 1.00 46.33 C ATOM 1559 CE LYS A 100 0.647 27.553 19.151 1.00 48.27 C ATOM 1560 NZ LYS A 100 -0.114 27.897 17.900 1.00 50.50 N ATOM 1561 HA LYS A 100 4.713 25.323 21.595 1.00 0.00 H ATOM 1562 HB2 LYS A 100 4.727 26.872 18.995 1.00 0.00 H ATOM 1563 HB3 LYS A 100 4.097 25.218 19.173 1.00 0.00 H ATOM 1564 HG2 LYS A 100 2.454 26.092 20.845 1.00 0.00 H ATOM 1565 HG3 LYS A 100 3.027 27.736 20.479 1.00 0.00 H ATOM 1566 HD2 LYS A 100 2.454 27.288 18.038 1.00 0.00 H ATOM 1567 HD3 LYS A 100 1.682 25.775 18.567 1.00 0.00 H ATOM 1568 HE2 LYS A 100 0.895 28.476 19.674 1.00 0.00 H ATOM 1569 HE3 LYS A 100 0.013 26.935 19.787 1.00 0.00 H ATOM 1570 HZ1 LYS A 100 0.479 28.494 17.288 1.00 0.00 H ATOM 1571 HZ2 LYS A 100 -0.364 27.022 17.396 1.00 0.00 H ATOM 1572 HZ3 LYS A 100 -0.981 28.412 18.154 1.00 0.00 H ATOM 1573 H LYS A 100 5.609 28.051 20.862 1.00 0.00 H ATOM 1574 N ASN A 101 7.509 25.776 19.923 1.00 40.29 N ATOM 1575 CA ASN A 101 8.639 25.096 19.277 1.00 39.40 C ATOM 1576 C ASN A 101 9.973 25.809 19.419 1.00 38.09 C ATOM 1577 O ASN A 101 10.044 26.978 19.768 1.00 38.10 O ATOM 1578 CB ASN A 101 8.392 24.958 17.789 1.00 39.41 C ATOM 1579 CG ASN A 101 7.457 23.818 17.440 1.00 39.71 C ATOM 1580 OD1 ASN A 101 7.743 22.660 17.729 1.00 44.09 O ATOM 1581 ND2 ASN A 101 6.358 24.137 16.796 1.00 36.25 N ATOM 1582 HA ASN A 101 8.701 24.136 19.789 1.00 0.00 H ATOM 1583 HB2 ASN A 101 7.956 25.888 17.423 1.00 0.00 H ATOM 1584 HB3 ASN A 101 9.348 24.786 17.294 1.00 0.00 H ATOM 1585 HD22 ASN A 101 6.157 25.133 16.572 1.00 0.00 H ATOM 1586 HD21 ASN A 101 5.689 23.394 16.510 1.00 0.00 H ATOM 1587 H ASN A 101 7.529 26.812 20.012 1.00 0.00 H ATOM 1588 N THR A 102 11.034 25.072 19.126 1.00 36.43 N ATOM 1589 CA THR A 102 12.376 25.603 19.077 1.00 35.40 C ATOM 1590 C THR A 102 12.939 25.345 17.684 1.00 33.52 C ATOM 1591 O THR A 102 12.816 24.235 17.179 1.00 32.54 O ATOM 1592 CB THR A 102 13.208 24.947 20.175 1.00 36.92 C ATOM 1593 OG1 THR A 102 12.808 25.520 21.443 1.00 38.87 O ATOM 1594 CG2 THR A 102 14.710 25.284 20.051 1.00 36.83 C ATOM 1595 HA THR A 102 12.392 26.678 19.255 1.00 0.00 H ATOM 1596 HB THR A 102 13.052 23.871 20.097 1.00 0.00 H ATOM 1597 HG1 THR A 102 13.337 25.108 22.172 1.00 0.00 H ATOM 1598 HG23 THR A 102 15.095 24.884 19.113 1.00 0.00 H ATOM 1599 HG21 THR A 102 14.841 26.366 20.067 1.00 0.00 H ATOM 1600 HG22 THR A 102 15.251 24.839 20.886 1.00 0.00 H ATOM 1601 H THR A 102 10.894 24.062 18.921 1.00 0.00 H ATOM 1602 N THR A 103 13.493 26.393 17.079 1.00 31.41 N ATOM 1603 CA THR A 103 14.138 26.335 15.747 1.00 29.84 C ATOM 1604 C THR A 103 15.635 26.529 15.906 1.00 28.77 C ATOM 1605 O THR A 103 16.069 27.481 16.533 1.00 28.74 O ATOM 1606 CB THR A 103 13.593 27.433 14.854 1.00 29.27 C ATOM 1607 OG1 THR A 103 12.166 27.369 14.816 1.00 28.76 O ATOM 1608 CG2 THR A 103 14.102 27.245 13.358 1.00 29.47 C ATOM 1609 HA THR A 103 13.930 25.365 15.295 1.00 0.00 H ATOM 1610 HB THR A 103 13.936 28.385 15.260 1.00 0.00 H ATOM 1611 HG1 THR A 103 11.807 27.485 15.731 1.00 0.00 H ATOM 1612 HG23 THR A 103 15.191 27.287 13.338 1.00 0.00 H ATOM 1613 HG21 THR A 103 13.767 26.279 12.980 1.00 0.00 H ATOM 1614 HG22 THR A 103 13.695 28.041 12.734 1.00 0.00 H ATOM 1615 H THR A 103 13.472 27.309 17.572 1.00 0.00 H ATOM 1616 N VAL A 104 16.422 25.612 15.352 1.00 27.27 N ATOM 1617 CA VAL A 104 17.859 25.727 15.352 1.00 26.88 C ATOM 1618 C VAL A 104 18.281 26.032 13.904 1.00 26.46 C ATOM 1619 O VAL A 104 17.888 25.311 12.966 1.00 27.31 O ATOM 1620 CB VAL A 104 18.540 24.502 15.858 1.00 26.81 C ATOM 1621 CG1 VAL A 104 20.020 24.700 15.871 1.00 28.12 C ATOM 1622 CG2 VAL A 104 18.030 24.155 17.271 1.00 29.06 C ATOM 1623 HA VAL A 104 18.160 26.523 16.033 1.00 0.00 H ATOM 1624 HB VAL A 104 18.309 23.671 15.191 1.00 0.00 H ATOM 1625 HG11 VAL A 104 20.366 24.908 14.859 1.00 0.00 H ATOM 1626 HG12 VAL A 104 20.267 25.540 16.521 1.00 0.00 H ATOM 1627 HG13 VAL A 104 20.503 23.796 16.243 1.00 0.00 H ATOM 1628 HG21 VAL A 104 18.240 24.985 17.946 1.00 0.00 H ATOM 1629 HG22 VAL A 104 16.955 23.977 17.234 1.00 0.00 H ATOM 1630 HG23 VAL A 104 18.536 23.258 17.628 1.00 0.00 H ATOM 1631 H VAL A 104 15.985 24.782 14.903 1.00 0.00 H ATOM 1632 N ILE A 105 18.995 27.136 13.730 1.00 26.13 N ATOM 1633 CA ILE A 105 19.469 27.559 12.387 1.00 26.01 C ATOM 1634 C ILE A 105 20.983 27.624 12.359 1.00 25.99 C ATOM 1635 O ILE A 105 21.616 28.485 12.981 1.00 26.42 O ATOM 1636 CB ILE A 105 18.863 28.923 11.991 1.00 25.89 C ATOM 1637 CG1 ILE A 105 17.354 28.926 12.194 1.00 27.41 C ATOM 1638 CG2 ILE A 105 19.224 29.243 10.516 1.00 26.76 C ATOM 1639 CD1 ILE A 105 16.772 30.289 12.415 1.00 31.69 C ATOM 1640 HA ILE A 105 19.137 26.818 11.660 1.00 0.00 H ATOM 1641 HB ILE A 105 19.283 29.697 12.634 1.00 0.00 H ATOM 1642 HG12 ILE A 105 16.888 28.493 11.309 1.00 0.00 H ATOM 1643 HG13 ILE A 105 17.123 28.309 13.063 1.00 0.00 H ATOM 1644 HD11 ILE A 105 17.218 30.733 13.305 1.00 0.00 H ATOM 1645 HD12 ILE A 105 16.982 30.917 11.549 1.00 0.00 H ATOM 1646 HD13 ILE A 105 15.694 30.205 12.551 1.00 0.00 H ATOM 1647 HG21 ILE A 105 20.308 29.282 10.409 1.00 0.00 H ATOM 1648 HG22 ILE A 105 18.821 28.465 9.868 1.00 0.00 H ATOM 1649 HG23 ILE A 105 18.795 30.206 10.239 1.00 0.00 H ATOM 1650 H ILE A 105 19.230 27.722 14.557 1.00 0.00 H ATOM 1651 N VAL A 106 21.598 26.696 11.652 1.00 25.89 N ATOM 1652 CA VAL A 106 23.032 26.657 11.511 1.00 26.27 C ATOM 1653 C VAL A 106 23.347 27.321 10.149 1.00 25.91 C ATOM 1654 O VAL A 106 22.670 27.065 9.162 1.00 26.68 O ATOM 1655 CB VAL A 106 23.559 25.187 11.599 1.00 26.41 C ATOM 1656 CG1 VAL A 106 25.041 25.120 11.492 1.00 28.86 C ATOM 1657 CG2 VAL A 106 23.074 24.501 12.869 1.00 29.21 C ATOM 1658 HA VAL A 106 23.536 27.193 12.315 1.00 0.00 H ATOM 1659 HB VAL A 106 23.147 24.650 10.745 1.00 0.00 H ATOM 1660 HG11 VAL A 106 25.354 25.538 10.535 1.00 0.00 H ATOM 1661 HG12 VAL A 106 25.489 25.692 12.304 1.00 0.00 H ATOM 1662 HG13 VAL A 106 25.362 24.080 11.558 1.00 0.00 H ATOM 1663 HG21 VAL A 106 23.434 25.052 13.738 1.00 0.00 H ATOM 1664 HG22 VAL A 106 21.984 24.481 12.876 1.00 0.00 H ATOM 1665 HG23 VAL A 106 23.458 23.481 12.899 1.00 0.00 H ATOM 1666 H VAL A 106 21.028 25.966 11.179 1.00 0.00 H ATOM 1667 N ARG A 107 24.318 28.225 10.144 1.00 25.42 N ATOM 1668 CA ARG A 107 24.808 28.900 8.954 1.00 24.85 C ATOM 1669 C ARG A 107 26.288 28.645 8.853 1.00 26.15 C ATOM 1670 O ARG A 107 27.059 28.947 9.781 1.00 27.41 O ATOM 1671 CB ARG A 107 24.559 30.389 9.042 1.00 24.82 C ATOM 1672 CG ARG A 107 23.085 30.758 9.192 1.00 22.42 C ATOM 1673 CD ARG A 107 22.805 32.215 9.096 1.00 23.80 C ATOM 1674 NE ARG A 107 21.400 32.506 8.902 1.00 24.29 N ATOM 1675 CZ ARG A 107 20.493 32.662 9.851 1.00 27.89 C ATOM 1676 NH1 ARG A 107 20.816 32.569 11.125 1.00 28.21 N ATOM 1677 NH2 ARG A 107 19.245 32.931 9.507 1.00 29.68 N ATOM 1678 HA ARG A 107 24.286 28.520 8.076 1.00 0.00 H ATOM 1679 HB2 ARG A 107 25.101 30.778 9.904 1.00 0.00 H ATOM 1680 HB3 ARG A 107 24.940 30.856 8.134 1.00 0.00 H ATOM 1681 HG2 ARG A 107 22.524 30.250 8.407 1.00 0.00 H ATOM 1682 HG3 ARG A 107 22.743 30.408 10.166 1.00 0.00 H ATOM 1683 HD2 ARG A 107 23.365 32.623 8.254 1.00 0.00 H ATOM 1684 HD3 ARG A 107 23.136 32.695 10.017 1.00 0.00 H ATOM 1685 HE ARG A 107 21.072 32.602 7.920 1.00 0.00 H ATOM 1686 HH12 ARG A 107 20.088 32.695 11.857 1.00 0.00 H ATOM 1687 HH11 ARG A 107 21.799 32.370 11.399 1.00 0.00 H ATOM 1688 HH22 ARG A 107 18.519 33.057 10.241 1.00 0.00 H ATOM 1689 HH21 ARG A 107 18.989 33.017 8.503 1.00 0.00 H ATOM 1690 H ARG A 107 24.759 28.467 11.054 1.00 0.00 H ATOM 1691 N GLU A 108 26.705 28.063 7.746 1.00 25.66 N ATOM 1692 CA GLU A 108 28.094 27.726 7.578 1.00 25.69 C ATOM 1693 C GLU A 108 28.554 28.214 6.220 1.00 25.54 C ATOM 1694 O GLU A 108 27.895 27.934 5.254 1.00 25.07 O ATOM 1695 CB GLU A 108 28.249 26.213 7.683 1.00 25.25 C ATOM 1696 CG GLU A 108 29.665 25.702 7.437 1.00 27.35 C ATOM 1697 CD GLU A 108 29.953 24.351 8.063 1.00 27.89 C ATOM 1698 OE1 GLU A 108 29.004 23.621 8.415 1.00 31.83 O ATOM 1699 OE2 GLU A 108 31.149 24.030 8.237 1.00 28.02 O ATOM 1700 HA GLU A 108 28.701 28.199 8.350 1.00 0.00 H ATOM 1701 HB2 GLU A 108 27.946 25.909 8.685 1.00 0.00 H ATOM 1702 HB3 GLU A 108 27.588 25.751 6.949 1.00 0.00 H ATOM 1703 HG2 GLU A 108 29.818 25.621 6.361 1.00 0.00 H ATOM 1704 HG3 GLU A 108 30.367 26.427 7.849 1.00 0.00 H ATOM 1705 H GLU A 108 26.026 27.846 6.989 1.00 0.00 H ATOM 1706 N VAL A 109 29.692 28.896 6.173 1.00 25.84 N ATOM 1707 CA VAL A 109 30.219 29.476 4.935 1.00 25.49 C ATOM 1708 C VAL A 109 31.322 28.594 4.433 1.00 26.71 C ATOM 1709 O VAL A 109 32.237 28.234 5.179 1.00 25.54 O ATOM 1710 CB VAL A 109 30.756 30.905 5.128 1.00 26.42 C ATOM 1711 CG1 VAL A 109 31.492 31.401 3.887 1.00 26.23 C ATOM 1712 CG2 VAL A 109 29.607 31.848 5.455 1.00 27.07 C ATOM 1713 HA VAL A 109 29.401 29.539 4.218 1.00 0.00 H ATOM 1714 HB VAL A 109 31.466 30.887 5.955 1.00 0.00 H ATOM 1715 HG11 VAL A 109 32.334 30.742 3.678 1.00 0.00 H ATOM 1716 HG12 VAL A 109 30.809 31.401 3.037 1.00 0.00 H ATOM 1717 HG13 VAL A 109 31.856 32.413 4.062 1.00 0.00 H ATOM 1718 HG21 VAL A 109 28.888 31.840 4.636 1.00 0.00 H ATOM 1719 HG22 VAL A 109 29.118 31.519 6.372 1.00 0.00 H ATOM 1720 HG23 VAL A 109 29.995 32.858 5.590 1.00 0.00 H ATOM 1721 H VAL A 109 30.232 29.024 7.052 1.00 0.00 H ATOM 1722 N ASP A 110 31.216 28.215 3.163 1.00 25.95 N ATOM 1723 CA ASP A 110 32.246 27.444 2.475 1.00 27.08 C ATOM 1724 C ASP A 110 32.465 28.045 1.116 1.00 27.48 C ATOM 1725 O ASP A 110 31.708 27.792 0.174 1.00 27.46 O ATOM 1726 CB ASP A 110 31.833 25.989 2.312 1.00 27.68 C ATOM 1727 CG ASP A 110 32.922 25.144 1.611 1.00 29.08 C ATOM 1728 OD1 ASP A 110 32.658 23.971 1.248 1.00 29.95 O ATOM 1729 OD2 ASP A 110 34.061 25.572 1.403 1.00 29.09 O ATOM 1730 HA ASP A 110 33.160 27.475 3.069 1.00 0.00 H ATOM 1731 HB2 ASP A 110 31.642 25.566 3.298 1.00 0.00 H ATOM 1732 HB3 ASP A 110 30.920 25.948 1.717 1.00 0.00 H ATOM 1733 H ASP A 110 30.360 28.480 2.636 1.00 0.00 H ATOM 1734 N GLY A 111 33.472 28.902 1.019 1.00 28.22 N ATOM 1735 CA GLY A 111 33.745 29.573 -0.240 1.00 28.28 C ATOM 1736 C GLY A 111 32.627 30.517 -0.631 1.00 29.25 C ATOM 1737 O GLY A 111 32.361 31.494 0.086 1.00 29.46 O ATOM 1738 HA3 GLY A 111 33.862 28.822 -1.022 1.00 0.00 H ATOM 1739 HA2 GLY A 111 34.670 30.142 -0.143 1.00 0.00 H ATOM 1740 H GLY A 111 34.069 29.095 1.848 1.00 0.00 H ATOM 1741 N ASP A 112 32.000 30.258 -1.774 1.00 29.54 N ATOM 1742 CA ASP A 112 30.901 31.086 -2.232 1.00 30.37 C ATOM 1743 C ASP A 112 29.518 30.588 -1.900 1.00 28.11 C ATOM 1744 O ASP A 112 28.561 31.150 -2.425 1.00 27.36 O ATOM 1745 CB ASP A 112 31.010 31.345 -3.728 1.00 31.22 C ATOM 1746 CG ASP A 112 32.208 32.208 -4.052 1.00 35.86 C ATOM 1747 OD1 ASP A 112 32.617 33.060 -3.200 1.00 39.31 O ATOM 1748 OD2 ASP A 112 32.805 32.073 -5.121 1.00 39.89 O ATOM 1749 HA ASP A 112 31.013 32.011 -1.667 1.00 0.00 H ATOM 1750 HB2 ASP A 112 31.108 30.392 -4.247 1.00 0.00 H ATOM 1751 HB3 ASP A 112 30.106 31.851 -4.068 1.00 0.00 H ATOM 1752 H ASP A 112 32.303 29.447 -2.350 1.00 0.00 H ATOM 1753 N THR A 113 29.429 29.584 -1.030 1.00 26.36 N ATOM 1754 CA THR A 113 28.157 29.096 -0.478 1.00 25.97 C ATOM 1755 C THR A 113 27.995 29.313 1.013 1.00 26.73 C ATOM 1756 O THR A 113 28.858 28.934 1.772 1.00 26.40 O ATOM 1757 CB THR A 113 28.032 27.569 -0.773 1.00 26.71 C ATOM 1758 OG1 THR A 113 28.138 27.344 -2.203 1.00 25.93 O ATOM 1759 CG2 THR A 113 26.654 27.016 -0.436 1.00 26.24 C ATOM 1760 HA THR A 113 27.373 29.678 -0.963 1.00 0.00 H ATOM 1761 HB THR A 113 28.811 27.092 -0.178 1.00 0.00 H ATOM 1762 HG1 THR A 113 29.015 27.672 -2.523 1.00 0.00 H ATOM 1763 HG23 THR A 113 26.467 27.136 0.631 1.00 0.00 H ATOM 1764 HG21 THR A 113 25.897 27.560 -1.002 1.00 0.00 H ATOM 1765 HG22 THR A 113 26.615 25.958 -0.697 1.00 0.00 H ATOM 1766 H THR A 113 30.308 29.119 -0.724 1.00 0.00 H ATOM 1767 N MET A 114 26.854 29.866 1.428 1.00 26.22 N ATOM 1768 CA MET A 114 26.443 29.791 2.803 1.00 26.92 C ATOM 1769 C MET A 114 25.289 28.815 2.848 1.00 27.15 C ATOM 1770 O MET A 114 24.271 29.016 2.168 1.00 25.69 O ATOM 1771 CB MET A 114 26.007 31.154 3.354 1.00 27.01 C ATOM 1772 CG MET A 114 25.463 31.042 4.793 1.00 28.21 C ATOM 1773 SD MET A 114 25.115 32.593 5.508 1.00 30.67 S ATOM 1774 CE MET A 114 23.481 32.831 4.895 1.00 33.89 C ATOM 1775 HA MET A 114 27.277 29.467 3.425 1.00 0.00 H ATOM 1776 HB2 MET A 114 26.865 31.827 3.352 1.00 0.00 H ATOM 1777 HB3 MET A 114 25.226 31.561 2.712 1.00 0.00 H ATOM 1778 HG2 MET A 114 26.206 30.534 5.408 1.00 0.00 H ATOM 1779 HG3 MET A 114 24.546 30.454 4.774 1.00 0.00 H ATOM 1780 HE1 MET A 114 23.500 32.834 3.805 1.00 0.00 H ATOM 1781 HE2 MET A 114 22.841 32.022 5.246 1.00 0.00 H ATOM 1782 HE3 MET A 114 23.094 33.784 5.255 1.00 0.00 H ATOM 1783 H MET A 114 26.249 30.362 0.742 1.00 0.00 H ATOM 1784 N LYS A 115 25.500 27.734 3.584 1.00 26.08 N ATOM 1785 CA LYS A 115 24.501 26.699 3.753 1.00 27.04 C ATOM 1786 C LYS A 115 23.784 26.996 5.032 1.00 27.30 C ATOM 1787 O LYS A 115 24.411 27.099 6.070 1.00 26.37 O ATOM 1788 CB LYS A 115 25.145 25.328 3.827 1.00 27.52 C ATOM 1789 CG LYS A 115 24.107 24.220 4.086 1.00 29.38 C ATOM 1790 CD LYS A 115 24.648 22.813 3.988 1.00 34.75 C ATOM 1791 CE LYS A 115 25.786 22.544 4.922 1.00 36.48 C ATOM 1792 NZ LYS A 115 26.342 21.182 4.688 1.00 41.05 N ATOM 1793 HA LYS A 115 23.816 26.689 2.905 1.00 0.00 H ATOM 1794 HB2 LYS A 115 25.651 25.124 2.883 1.00 0.00 H ATOM 1795 HB3 LYS A 115 25.875 25.324 4.637 1.00 0.00 H ATOM 1796 HG2 LYS A 115 23.704 24.360 5.089 1.00 0.00 H ATOM 1797 HG3 LYS A 115 23.306 24.328 3.355 1.00 0.00 H ATOM 1798 HD2 LYS A 115 23.842 22.116 4.217 1.00 0.00 H ATOM 1799 HD3 LYS A 115 24.992 22.646 2.967 1.00 0.00 H ATOM 1800 HE2 LYS A 115 25.431 22.615 5.950 1.00 0.00 H ATOM 1801 HE3 LYS A 115 26.569 23.285 4.757 1.00 0.00 H ATOM 1802 HZ1 LYS A 115 25.598 20.473 4.848 1.00 0.00 H ATOM 1803 HZ2 LYS A 115 26.684 21.112 3.708 1.00 0.00 H ATOM 1804 HZ3 LYS A 115 27.130 21.013 5.345 1.00 0.00 H ATOM 1805 H LYS A 115 26.419 27.624 4.059 1.00 0.00 H ATOM 1806 N THR A 116 22.473 27.090 4.974 1.00 27.37 N ATOM 1807 CA THR A 116 21.669 27.358 6.194 1.00 27.53 C ATOM 1808 C THR A 116 20.819 26.120 6.496 1.00 27.45 C ATOM 1809 O THR A 116 19.940 25.782 5.698 1.00 26.63 O ATOM 1810 CB THR A 116 20.789 28.582 5.936 1.00 27.12 C ATOM 1811 OG1 THR A 116 21.633 29.730 5.731 1.00 27.00 O ATOM 1812 CG2 THR A 116 19.898 28.946 7.137 1.00 28.65 C ATOM 1813 HA THR A 116 22.308 27.562 7.053 1.00 0.00 H ATOM 1814 HB THR A 116 20.168 28.333 5.076 1.00 0.00 H ATOM 1815 HG1 THR A 116 21.070 30.527 5.563 1.00 0.00 H ATOM 1816 HG23 THR A 116 19.225 28.116 7.353 1.00 0.00 H ATOM 1817 HG21 THR A 116 20.525 29.143 8.006 1.00 0.00 H ATOM 1818 HG22 THR A 116 19.315 29.835 6.899 1.00 0.00 H ATOM 1819 H THR A 116 21.992 26.975 4.059 1.00 0.00 H ATOM 1820 N THR A 117 21.089 25.421 7.605 1.00 27.58 N ATOM 1821 CA THR A 117 20.310 24.233 7.957 1.00 26.86 C ATOM 1822 C THR A 117 19.308 24.638 9.013 1.00 28.07 C ATOM 1823 O THR A 117 19.693 25.221 10.017 1.00 27.68 O ATOM 1824 CB THR A 117 21.239 23.131 8.425 1.00 27.87 C ATOM 1825 OG1 THR A 117 22.140 22.775 7.368 1.00 28.67 O ATOM 1826 CG2 THR A 117 20.497 21.856 8.718 1.00 28.20 C ATOM 1827 HA THR A 117 19.769 23.838 7.097 1.00 0.00 H ATOM 1828 HB THR A 117 21.738 23.516 9.314 1.00 0.00 H ATOM 1829 HG1 THR A 117 22.674 23.568 7.111 1.00 0.00 H ATOM 1830 HG23 THR A 117 19.779 22.031 9.520 1.00 0.00 H ATOM 1831 HG21 THR A 117 19.970 21.530 7.822 1.00 0.00 H ATOM 1832 HG22 THR A 117 21.206 21.087 9.024 1.00 0.00 H ATOM 1833 H THR A 117 21.865 25.727 8.227 1.00 0.00 H ATOM 1834 N VAL A 118 18.033 24.323 8.807 1.00 27.04 N ATOM 1835 CA VAL A 118 16.975 24.734 9.749 1.00 27.01 C ATOM 1836 C VAL A 118 16.307 23.482 10.301 1.00 26.83 C ATOM 1837 O VAL A 118 15.757 22.687 9.549 1.00 26.59 O ATOM 1838 CB VAL A 118 15.940 25.601 9.053 1.00 26.51 C ATOM 1839 CG1 VAL A 118 14.836 26.084 10.043 1.00 28.52 C ATOM 1840 CG2 VAL A 118 16.621 26.783 8.360 1.00 27.22 C ATOM 1841 HA VAL A 118 17.418 25.317 10.556 1.00 0.00 H ATOM 1842 HB VAL A 118 15.444 24.995 8.295 1.00 0.00 H ATOM 1843 HG11 VAL A 118 14.329 25.219 10.471 1.00 0.00 H ATOM 1844 HG12 VAL A 118 15.295 26.668 10.840 1.00 0.00 H ATOM 1845 HG13 VAL A 118 14.114 26.701 9.508 1.00 0.00 H ATOM 1846 HG21 VAL A 118 17.149 27.382 9.102 1.00 0.00 H ATOM 1847 HG22 VAL A 118 17.330 26.410 7.621 1.00 0.00 H ATOM 1848 HG23 VAL A 118 15.867 27.396 7.865 1.00 0.00 H ATOM 1849 H VAL A 118 17.776 23.774 7.962 1.00 0.00 H ATOM 1850 N THR A 119 16.318 23.303 11.623 1.00 27.40 N ATOM 1851 CA THR A 119 15.770 22.081 12.220 1.00 28.04 C ATOM 1852 C THR A 119 14.756 22.445 13.297 1.00 28.62 C ATOM 1853 O THR A 119 15.001 23.351 14.066 1.00 27.24 O ATOM 1854 CB THR A 119 16.897 21.208 12.832 1.00 29.47 C ATOM 1855 OG1 THR A 119 17.684 21.953 13.787 1.00 33.59 O ATOM 1856 CG2 THR A 119 17.896 20.902 11.827 1.00 26.31 C ATOM 1857 HA THR A 119 15.279 21.505 11.435 1.00 0.00 H ATOM 1858 HB THR A 119 16.390 20.342 13.258 1.00 0.00 H ATOM 1859 HG1 THR A 119 18.392 21.368 14.157 1.00 0.00 H ATOM 1860 HG23 THR A 119 17.436 20.328 11.023 1.00 0.00 H ATOM 1861 HG21 THR A 119 18.302 21.831 11.426 1.00 0.00 H ATOM 1862 HG22 THR A 119 18.698 20.319 12.279 1.00 0.00 H ATOM 1863 H THR A 119 16.720 24.039 12.238 1.00 0.00 H ATOM 1864 N VAL A 120 13.595 21.796 13.265 1.00 29.29 N ATOM 1865 CA VAL A 120 12.541 21.953 14.275 1.00 31.23 C ATOM 1866 C VAL A 120 12.172 20.504 14.660 1.00 32.06 C ATOM 1867 O VAL A 120 11.513 19.817 13.891 1.00 32.62 O ATOM 1868 CB VAL A 120 11.321 22.680 13.707 1.00 30.89 C ATOM 1869 CG1 VAL A 120 10.244 22.843 14.787 1.00 33.50 C ATOM 1870 CG2 VAL A 120 11.721 24.073 13.093 1.00 31.00 C ATOM 1871 HA VAL A 120 12.875 22.550 15.123 1.00 0.00 H ATOM 1872 HB VAL A 120 10.910 22.073 12.901 1.00 0.00 H ATOM 1873 HG11 VAL A 120 9.937 21.860 15.144 1.00 0.00 H ATOM 1874 HG12 VAL A 120 10.648 23.422 15.617 1.00 0.00 H ATOM 1875 HG13 VAL A 120 9.384 23.362 14.365 1.00 0.00 H ATOM 1876 HG21 VAL A 120 12.167 24.696 13.868 1.00 0.00 H ATOM 1877 HG22 VAL A 120 12.441 23.921 12.289 1.00 0.00 H ATOM 1878 HG23 VAL A 120 10.831 24.564 12.698 1.00 0.00 H ATOM 1879 H VAL A 120 13.424 21.138 12.478 1.00 0.00 H ATOM 1880 N GLY A 121 12.653 20.045 15.807 1.00 33.45 N ATOM 1881 CA GLY A 121 12.456 18.671 16.240 1.00 34.46 C ATOM 1882 C GLY A 121 13.169 17.713 15.309 1.00 35.44 C ATOM 1883 O GLY A 121 14.385 17.820 15.141 1.00 36.77 O ATOM 1884 HA3 GLY A 121 11.390 18.444 16.240 1.00 0.00 H ATOM 1885 HA2 GLY A 121 12.852 18.552 17.249 1.00 0.00 H ATOM 1886 H GLY A 121 13.191 20.691 16.419 1.00 0.00 H ATOM 1887 N ASP A 122 12.396 16.837 14.656 1.00 36.04 N ATOM 1888 CA ASP A 122 12.938 15.803 13.756 1.00 36.36 C ATOM 1889 C ASP A 122 12.893 16.237 12.278 1.00 35.33 C ATOM 1890 O ASP A 122 13.362 15.501 11.430 1.00 36.72 O ATOM 1891 CB ASP A 122 12.239 14.418 13.955 1.00 36.56 C ATOM 1892 CG ASP A 122 10.749 14.409 13.567 1.00 36.97 C ATOM 1893 OD1 ASP A 122 9.980 13.602 14.148 1.00 36.04 O ATOM 1894 OD2 ASP A 122 10.243 15.137 12.689 1.00 37.60 O ATOM 1895 HA ASP A 122 13.986 15.682 14.031 1.00 0.00 H ATOM 1896 HB2 ASP A 122 12.758 13.680 13.343 1.00 0.00 H ATOM 1897 HB3 ASP A 122 12.322 14.139 15.005 1.00 0.00 H ATOM 1898 H ASP A 122 11.366 16.888 14.790 1.00 0.00 H ATOM 1899 N VAL A 123 12.374 17.430 11.978 1.00 33.72 N ATOM 1900 CA VAL A 123 12.283 17.929 10.582 1.00 32.14 C ATOM 1901 C VAL A 123 13.466 18.880 10.261 1.00 31.40 C ATOM 1902 O VAL A 123 13.841 19.750 11.080 1.00 30.18 O ATOM 1903 CB VAL A 123 10.944 18.659 10.369 1.00 32.63 C ATOM 1904 CG1 VAL A 123 10.739 19.061 8.962 1.00 33.31 C ATOM 1905 CG2 VAL A 123 9.765 17.776 10.839 1.00 33.43 C ATOM 1906 HA VAL A 123 12.335 17.075 9.906 1.00 0.00 H ATOM 1907 HB VAL A 123 10.981 19.568 10.969 1.00 0.00 H ATOM 1908 HG11 VAL A 123 11.541 19.733 8.657 1.00 0.00 H ATOM 1909 HG12 VAL A 123 10.744 18.175 8.328 1.00 0.00 H ATOM 1910 HG13 VAL A 123 9.781 19.571 8.867 1.00 0.00 H ATOM 1911 HG21 VAL A 123 9.758 16.848 10.268 1.00 0.00 H ATOM 1912 HG22 VAL A 123 9.881 17.551 11.899 1.00 0.00 H ATOM 1913 HG23 VAL A 123 8.828 18.309 10.680 1.00 0.00 H ATOM 1914 H VAL A 123 12.021 18.031 12.749 1.00 0.00 H ATOM 1915 N THR A 124 14.059 18.715 9.075 1.00 29.83 N ATOM 1916 CA THR A 124 15.207 19.526 8.657 1.00 29.17 C ATOM 1917 C THR A 124 15.030 20.070 7.232 1.00 28.20 C ATOM 1918 O THR A 124 14.630 19.340 6.325 1.00 26.83 O ATOM 1919 CB THR A 124 16.548 18.733 8.779 1.00 30.06 C ATOM 1920 OG1 THR A 124 16.836 18.442 10.169 1.00 30.77 O ATOM 1921 CG2 THR A 124 17.706 19.610 8.400 1.00 30.65 C ATOM 1922 HA THR A 124 15.255 20.376 9.337 1.00 0.00 H ATOM 1923 HB THR A 124 16.437 17.847 8.154 1.00 0.00 H ATOM 1924 HG1 THR A 124 16.102 17.897 10.550 1.00 0.00 H ATOM 1925 HG23 THR A 124 17.609 19.906 7.355 1.00 0.00 H ATOM 1926 HG21 THR A 124 17.709 20.498 9.032 1.00 0.00 H ATOM 1927 HG22 THR A 124 18.637 19.060 8.539 1.00 0.00 H ATOM 1928 H THR A 124 13.694 17.988 8.427 1.00 0.00 H ATOM 1929 N ALA A 125 15.327 21.350 7.066 1.00 26.96 N ATOM 1930 CA ALA A 125 15.404 21.994 5.769 1.00 26.38 C ATOM 1931 C ALA A 125 16.813 22.511 5.520 1.00 26.79 C ATOM 1932 O ALA A 125 17.527 22.846 6.431 1.00 25.19 O ATOM 1933 CB ALA A 125 14.386 23.083 5.642 1.00 26.71 C ATOM 1934 HA ALA A 125 15.175 21.254 5.002 1.00 0.00 H ATOM 1935 HB1 ALA A 125 13.388 22.661 5.762 1.00 0.00 H ATOM 1936 HB2 ALA A 125 14.560 23.833 6.413 1.00 0.00 H ATOM 1937 HB3 ALA A 125 14.471 23.545 4.658 1.00 0.00 H ATOM 1938 H ALA A 125 15.515 21.925 7.912 1.00 0.00 H ATOM 1939 N ILE A 126 17.243 22.521 4.258 1.00 26.53 N ATOM 1940 CA ILE A 126 18.538 23.108 3.907 1.00 27.90 C ATOM 1941 C ILE A 126 18.324 24.173 2.835 1.00 27.17 C ATOM 1942 O ILE A 126 17.678 23.921 1.819 1.00 27.94 O ATOM 1943 CB ILE A 126 19.527 22.006 3.381 1.00 29.21 C ATOM 1944 CG1 ILE A 126 19.768 20.937 4.436 1.00 30.90 C ATOM 1945 CG2 ILE A 126 20.867 22.620 2.876 1.00 30.54 C ATOM 1946 CD1 ILE A 126 20.610 19.786 3.952 1.00 32.82 C ATOM 1947 HA ILE A 126 18.979 23.559 4.796 1.00 0.00 H ATOM 1948 HB ILE A 126 19.053 21.528 2.524 1.00 0.00 H ATOM 1949 HG12 ILE A 126 20.272 21.399 5.285 1.00 0.00 H ATOM 1950 HG13 ILE A 126 18.802 20.546 4.757 1.00 0.00 H ATOM 1951 HD11 ILE A 126 20.115 19.304 3.109 1.00 0.00 H ATOM 1952 HD12 ILE A 126 21.585 20.158 3.638 1.00 0.00 H ATOM 1953 HD13 ILE A 126 20.737 19.066 4.760 1.00 0.00 H ATOM 1954 HG21 ILE A 126 20.663 23.313 2.060 1.00 0.00 H ATOM 1955 HG22 ILE A 126 21.352 23.152 3.694 1.00 0.00 H ATOM 1956 HG23 ILE A 126 21.520 21.822 2.522 1.00 0.00 H ATOM 1957 H ILE A 126 16.650 22.106 3.512 1.00 0.00 H ATOM 1958 N ARG A 127 18.865 25.363 3.069 1.00 26.73 N ATOM 1959 CA ARG A 127 18.783 26.477 2.145 1.00 26.59 C ATOM 1960 C ARG A 127 20.169 27.014 1.834 1.00 26.88 C ATOM 1961 O ARG A 127 20.910 27.419 2.725 1.00 24.79 O ATOM 1962 CB ARG A 127 17.920 27.577 2.736 1.00 26.14 C ATOM 1963 CG ARG A 127 16.467 27.169 2.837 1.00 28.51 C ATOM 1964 CD ARG A 127 15.713 27.892 3.918 1.00 28.01 C ATOM 1965 NE ARG A 127 15.515 29.316 3.665 1.00 29.32 N ATOM 1966 CZ ARG A 127 14.683 29.810 2.756 1.00 29.54 C ATOM 1967 NH1 ARG A 127 14.559 31.111 2.651 1.00 30.79 N ATOM 1968 NH2 ARG A 127 13.938 29.013 1.980 1.00 29.00 N ATOM 1969 HA ARG A 127 18.331 26.127 1.217 1.00 0.00 H ATOM 1970 HB2 ARG A 127 18.289 27.815 3.734 1.00 0.00 H ATOM 1971 HB3 ARG A 127 17.994 28.461 2.102 1.00 0.00 H ATOM 1972 HG2 ARG A 127 15.984 27.375 1.882 1.00 0.00 H ATOM 1973 HG3 ARG A 127 16.422 26.099 3.042 1.00 0.00 H ATOM 1974 HD2 ARG A 127 16.267 27.785 4.851 1.00 0.00 H ATOM 1975 HD3 ARG A 127 14.734 27.424 4.022 1.00 0.00 H ATOM 1976 HE ARG A 127 16.064 29.990 4.236 1.00 0.00 H ATOM 1977 HH12 ARG A 127 13.912 31.516 1.945 1.00 0.00 H ATOM 1978 HH11 ARG A 127 15.108 31.738 3.274 1.00 0.00 H ATOM 1979 HH22 ARG A 127 13.294 29.427 1.276 1.00 0.00 H ATOM 1980 HH21 ARG A 127 14.003 27.980 2.081 1.00 0.00 H ATOM 1981 H ARG A 127 19.375 25.503 3.964 1.00 0.00 H ATOM 1982 N ASN A 128 20.520 26.980 0.553 1.00 25.11 N ATOM 1983 CA ASN A 128 21.829 27.427 0.079 1.00 26.34 C ATOM 1984 C ASN A 128 21.735 28.859 -0.438 1.00 26.46 C ATOM 1985 O ASN A 128 20.831 29.200 -1.203 1.00 27.83 O ATOM 1986 CB ASN A 128 22.333 26.516 -1.061 1.00 26.27 C ATOM 1987 CG ASN A 128 22.922 25.212 -0.553 1.00 30.00 C ATOM 1988 OD1 ASN A 128 23.400 25.114 0.598 1.00 28.36 O ATOM 1989 ND2 ASN A 128 22.814 24.175 -1.369 1.00 33.58 N ATOM 1990 HA ASN A 128 22.528 27.379 0.914 1.00 0.00 H ATOM 1991 HB2 ASN A 128 21.496 26.287 -1.721 1.00 0.00 H ATOM 1992 HB3 ASN A 128 23.100 27.050 -1.621 1.00 0.00 H ATOM 1993 HD22 ASN A 128 22.410 24.301 -2.319 1.00 0.00 H ATOM 1994 HD21 ASN A 128 23.133 23.235 -1.060 1.00 0.00 H ATOM 1995 H ASN A 128 19.835 26.620 -0.142 1.00 0.00 H ATOM 1996 N TYR A 129 22.684 29.687 -0.028 1.00 26.64 N ATOM 1997 CA TYR A 129 22.819 31.064 -0.487 1.00 25.37 C ATOM 1998 C TYR A 129 24.150 31.192 -1.226 1.00 26.86 C ATOM 1999 O TYR A 129 25.125 30.577 -0.840 1.00 25.19 O ATOM 2000 CB TYR A 129 22.862 32.024 0.713 1.00 25.73 C ATOM 2001 CG TYR A 129 21.568 32.177 1.456 1.00 23.20 C ATOM 2002 CD1 TYR A 129 21.085 31.138 2.284 1.00 24.97 C ATOM 2003 CD2 TYR A 129 20.798 33.349 1.334 1.00 24.66 C ATOM 2004 CE1 TYR A 129 19.904 31.288 3.010 1.00 26.92 C ATOM 2005 CE2 TYR A 129 19.583 33.494 2.039 1.00 23.80 C ATOM 2006 CZ TYR A 129 19.143 32.470 2.854 1.00 24.90 C ATOM 2007 OH TYR A 129 17.970 32.672 3.524 1.00 25.63 O ATOM 2008 HA TYR A 129 21.973 31.312 -1.128 1.00 0.00 H ATOM 2009 HB3 TYR A 129 23.160 33.007 0.348 1.00 0.00 H ATOM 2010 HB2 TYR A 129 23.612 31.655 1.413 1.00 0.00 H ATOM 2011 HD2 TYR A 129 21.144 34.155 0.687 1.00 0.00 H ATOM 2012 HE2 TYR A 129 18.997 34.408 1.940 1.00 0.00 H ATOM 2013 HE1 TYR A 129 19.571 30.504 3.690 1.00 0.00 H ATOM 2014 HD1 TYR A 129 21.644 30.205 2.356 1.00 0.00 H ATOM 2015 HH TYR A 129 17.762 31.873 4.071 1.00 0.00 H ATOM 2016 H TYR A 129 23.375 29.333 0.664 1.00 0.00 H ATOM 2017 N LYS A 130 24.160 31.964 -2.313 1.00 27.20 N ATOM 2018 CA LYS A 130 25.367 32.306 -3.052 1.00 27.37 C ATOM 2019 C LYS A 130 25.813 33.684 -2.664 1.00 27.59 C ATOM 2020 O LYS A 130 25.005 34.603 -2.471 1.00 27.63 O ATOM 2021 CB LYS A 130 25.128 32.253 -4.575 1.00 26.89 C ATOM 2022 CG LYS A 130 24.554 30.926 -5.035 1.00 28.09 C ATOM 2023 CD LYS A 130 24.714 30.682 -6.561 1.00 29.11 C ATOM 2024 CE LYS A 130 23.735 31.488 -7.388 1.00 30.54 C ATOM 2025 NZ LYS A 130 24.392 32.126 -8.594 1.00 32.38 N ATOM 2026 HA LYS A 130 26.138 31.576 -2.804 1.00 0.00 H ATOM 2027 HB2 LYS A 130 24.432 33.047 -4.846 1.00 0.00 H ATOM 2028 HB3 LYS A 130 26.079 32.416 -5.083 1.00 0.00 H ATOM 2029 HG2 LYS A 130 25.064 30.124 -4.501 1.00 0.00 H ATOM 2030 HG3 LYS A 130 23.492 30.905 -4.791 1.00 0.00 H ATOM 2031 HD2 LYS A 130 25.727 30.957 -6.854 1.00 0.00 H ATOM 2032 HD3 LYS A 130 24.553 29.623 -6.764 1.00 0.00 H ATOM 2033 HE2 LYS A 130 23.311 32.274 -6.763 1.00 0.00 H ATOM 2034 HE3 LYS A 130 22.938 30.828 -7.731 1.00 0.00 H ATOM 2035 HZ1 LYS A 130 25.150 32.764 -8.277 1.00 0.00 H ATOM 2036 HZ2 LYS A 130 24.794 31.384 -9.202 1.00 0.00 H ATOM 2037 HZ3 LYS A 130 23.682 32.667 -9.128 1.00 0.00 H ATOM 2038 H LYS A 130 23.253 32.344 -2.653 1.00 0.00 H ATOM 2039 N ARG A 131 27.119 33.852 -2.576 1.00 29.54 N ATOM 2040 CA ARG A 131 27.719 35.145 -2.236 1.00 30.93 C ATOM 2041 C ARG A 131 27.549 36.071 -3.457 1.00 33.01 C ATOM 2042 O ARG A 131 27.829 35.677 -4.575 1.00 34.16 O ATOM 2043 CB ARG A 131 29.208 34.934 -1.907 1.00 30.98 C ATOM 2044 CG ARG A 131 29.997 36.181 -1.613 1.00 32.69 C ATOM 2045 CD ARG A 131 31.503 35.925 -1.586 1.00 34.13 C ATOM 2046 NE ARG A 131 31.913 34.897 -0.634 1.00 33.64 N ATOM 2047 CZ ARG A 131 32.118 35.104 0.670 1.00 35.55 C ATOM 2048 NH1 ARG A 131 31.890 36.297 1.209 1.00 35.03 N ATOM 2049 NH2 ARG A 131 32.528 34.107 1.458 1.00 34.35 N ATOM 2050 HA ARG A 131 27.239 35.594 -1.367 1.00 0.00 H ATOM 2051 HB2 ARG A 131 29.269 34.286 -1.033 1.00 0.00 H ATOM 2052 HB3 ARG A 131 29.672 34.438 -2.759 1.00 0.00 H ATOM 2053 HG2 ARG A 131 29.781 36.922 -2.383 1.00 0.00 H ATOM 2054 HG3 ARG A 131 29.690 36.569 -0.642 1.00 0.00 H ATOM 2055 HD2 ARG A 131 32.005 36.856 -1.323 1.00 0.00 H ATOM 2056 HD3 ARG A 131 31.816 35.614 -2.583 1.00 0.00 H ATOM 2057 HE ARG A 131 32.056 33.933 -0.997 1.00 0.00 H ATOM 2058 HH12 ARG A 131 32.053 36.448 2.225 1.00 0.00 H ATOM 2059 HH11 ARG A 131 31.549 37.079 0.615 1.00 0.00 H ATOM 2060 HH22 ARG A 131 32.685 34.277 2.472 1.00 0.00 H ATOM 2061 HH21 ARG A 131 32.690 33.161 1.058 1.00 0.00 H ATOM 2062 H ARG A 131 27.743 33.040 -2.754 1.00 0.00 H ATOM 2063 N LEU A 132 27.094 37.286 -3.233 1.00 34.70 N ATOM 2064 CA LEU A 132 26.953 38.253 -4.301 1.00 37.42 C ATOM 2065 C LEU A 132 28.233 39.065 -4.567 1.00 39.82 C ATOM 2066 O LEU A 132 29.070 39.305 -3.681 1.00 39.84 O ATOM 2067 CB LEU A 132 25.792 39.208 -4.038 1.00 37.48 C ATOM 2068 CG LEU A 132 24.391 38.618 -4.114 1.00 36.99 C ATOM 2069 CD1 LEU A 132 23.396 39.645 -3.672 1.00 36.60 C ATOM 2070 CD2 LEU A 132 24.006 38.137 -5.515 1.00 38.80 C ATOM 2071 HA LEU A 132 26.749 37.664 -5.195 1.00 0.00 H ATOM 2072 HB2 LEU A 132 25.923 39.620 -3.038 1.00 0.00 H ATOM 2073 HB3 LEU A 132 25.852 40.012 -4.772 1.00 0.00 H ATOM 2074 HG LEU A 132 24.386 37.746 -3.460 1.00 0.00 H ATOM 2075 HD21 LEU A 132 24.045 38.976 -6.209 1.00 0.00 H ATOM 2076 HD22 LEU A 132 24.704 37.364 -5.837 1.00 0.00 H ATOM 2077 HD23 LEU A 132 22.995 37.729 -5.493 1.00 0.00 H ATOM 2078 HD11 LEU A 132 23.613 39.941 -2.645 1.00 0.00 H ATOM 2079 HD12 LEU A 132 23.461 40.516 -4.324 1.00 0.00 H ATOM 2080 HD13 LEU A 132 22.392 39.223 -3.726 1.00 0.00 H ATOM 2081 H LEU A 132 26.829 37.558 -2.265 1.00 0.00 H ATOM 2082 N SER A 133 28.322 39.471 -5.828 1.00 42.76 N ATOM 2083 CA SER A 133 29.410 40.243 -6.430 1.00 44.59 C ATOM 2084 C SER A 133 30.749 39.539 -6.457 1.00 45.81 C ATOM 2085 O SER A 133 31.101 38.983 -7.509 1.00 47.48 O ATOM 2086 CB SER A 133 29.482 41.643 -5.840 1.00 45.05 C ATOM 2087 OG SER A 133 28.422 42.383 -6.418 1.00 45.70 O ATOM 2088 HA SER A 133 29.155 40.341 -7.485 1.00 0.00 H ATOM 2089 HB2 SER A 133 30.439 42.105 -6.083 1.00 0.00 H ATOM 2090 HB3 SER A 133 29.365 41.601 -4.757 1.00 0.00 H ATOM 2091 HG SER A 133 27.560 41.950 -6.196 1.00 0.00 H ATOM 2092 H SER A 133 27.534 39.213 -6.455 1.00 0.00 H TER 2093 SER A 133 HETATM 2094 O HOH 1 37.696 35.183 10.401 1.00 54.45 O HETATM 2095 O HOH 2 34.500 36.232 16.825 1.00 59.41 O HETATM 2096 O HOH 3 33.539 37.906 3.308 1.00 39.93 O HETATM 2097 O HOH 4 37.253 35.565 5.239 1.00 54.69 O HETATM 2098 O HOH 5 34.699 30.154 5.698 1.00 57.68 O HETATM 2099 O HOH 6 31.208 39.014 0.354 1.00 49.03 O HETATM 2100 O HOH 7 4.519 18.983 6.542 1.00 50.12 O HETATM 2101 O HOH 8 22.374 45.110 -3.044 1.00 56.17 O HETATM 2102 O HOH 9 24.480 43.799 -3.985 1.00 66.89 O HETATM 2103 O HOH 10 25.047 48.330 -1.761 1.00 68.55 O HETATM 2104 O HOH 11 -4.516 31.713 2.835 1.00 58.82 O HETATM 2105 O HOH 12 19.626 28.060 -8.207 1.00 52.97 O HETATM 2106 O HOH 13 23.562 26.806 -4.822 1.00 37.19 O HETATM 2107 O HOH 14 18.027 22.622 -5.999 1.00 58.18 O HETATM 2108 O HOH 15 19.649 24.897 -8.156 1.00 63.65 O HETATM 2109 O HOH 16 12.426 24.411 -3.813 1.00 48.98 O HETATM 2110 O HOH 17 13.707 22.420 -4.379 1.00 54.44 O HETATM 2111 O HOH 18 15.430 25.365 -4.981 1.00 47.89 O HETATM 2112 O HOH 19 13.948 15.690 3.043 1.00 53.17 O HETATM 2113 O HOH 20 32.879 44.489 6.224 1.00 51.33 O HETATM 2114 O HOH 21 2.734 24.740 1.148 1.00 42.28 O HETATM 2115 O HOH 22 4.524 20.214 3.858 1.00 37.99 O HETATM 2116 O HOH 23 16.477 38.290 11.228 1.00 57.55 O HETATM 2117 O HOH 24 7.191 45.107 7.453 1.00 53.30 O HETATM 2118 O HOH 25 0.870 24.897 9.630 1.00 47.54 O HETATM 2119 O HOH 26 9.190 16.491 15.146 1.00 53.79 O HETATM 2120 O HOH 27 3.057 24.118 15.929 1.00 53.21 O HETATM 2121 O HOH 28 7.225 18.582 17.376 1.00 83.95 O HETATM 2122 O HOH 29 5.722 27.169 16.198 1.00 38.61 O HETATM 2123 O HOH 30 3.365 30.121 13.741 1.00 50.14 O HETATM 2124 O HOH 31 20.817 32.720 28.935 1.00 66.77 O HETATM 2125 O HOH 32 -0.154 26.299 7.895 1.00 45.25 O HETATM 2126 O HOH 33 11.045 43.268 17.947 1.00 58.50 O HETATM 2127 O HOH 34 -0.945 35.193 7.876 1.00 39.39 O HETATM 2128 O HOH 35 1.746 32.834 10.414 1.00 38.25 O HETATM 2129 O HOH 36 -3.714 29.336 7.232 1.00 55.43 O HETATM 2130 O HOH 37 0.600 34.182 0.250 1.00 44.27 O HETATM 2131 O HOH 38 -3.587 31.735 5.556 1.00 50.80 O HETATM 2132 O HOH 39 18.601 28.855 23.489 1.00 47.63 O HETATM 2133 O HOH 40 14.012 25.600 25.921 1.00 55.92 O HETATM 2134 O HOH 41 1.014 36.734 5.143 1.00 48.34 O HETATM 2135 O HOH 42 2.424 35.277 9.029 1.00 35.45 O HETATM 2136 O HOH 43 1.650 28.428 -3.251 1.00 50.99 O HETATM 2137 O HOH 44 22.956 22.570 15.833 1.00 44.17 O HETATM 2138 O HOH 45 21.962 22.908 18.595 1.00 48.50 O HETATM 2139 O HOH 46 18.378 23.427 21.218 1.00 52.93 O HETATM 2140 O HOH 47 11.820 28.867 -0.109 1.00 28.60 O HETATM 2141 O HOH 48 10.457 22.543 21.842 1.00 42.69 O HETATM 2142 O HOH 49 9.966 26.380 -2.658 1.00 55.58 O HETATM 2143 O HOH 50 10.296 26.199 -0.221 1.00 32.55 O HETATM 2144 O HOH 51 11.721 25.171 25.629 1.00 47.71 O HETATM 2145 O HOH 52 17.613 25.291 23.387 1.00 47.46 O HETATM 2146 O HOH 53 12.510 29.973 -5.011 1.00 67.64 O HETATM 2147 O HOH 54 11.587 34.247 -6.630 1.00 53.84 O HETATM 2148 O HOH 55 12.282 30.459 -2.387 1.00 39.64 O HETATM 2149 O HOH 56 12.139 31.997 1.002 1.00 28.51 O HETATM 2150 O HOH 57 12.094 37.479 -4.201 1.00 41.62 O HETATM 2151 O HOH 58 13.751 35.068 -7.798 1.00 80.77 O HETATM 2152 O HOH 59 16.466 39.288 -2.891 1.00 42.84 O HETATM 2153 O HOH 60 24.583 21.525 10.820 1.00 50.03 O HETATM 2154 O HOH 61 28.363 23.982 0.823 1.00 31.43 O HETATM 2155 O HOH 62 29.606 29.848 -7.793 1.00 36.53 O HETATM 2156 O HOH 63 20.047 40.773 -4.531 1.00 53.21 O HETATM 2157 O HOH 64 24.127 43.688 7.949 1.00 35.54 O HETATM 2158 O HOH 65 20.306 42.263 2.607 1.00 30.29 O HETATM 2159 O HOH 66 28.761 43.784 4.493 1.00 37.85 O HETATM 2160 O HOH 67 8.830 14.184 9.293 1.00 53.27 O HETATM 2161 O HOH 68 32.004 44.253 8.887 1.00 36.23 O HETATM 2162 O HOH 69 31.229 49.587 12.992 1.00 57.05 O HETATM 2163 O HOH 70 26.842 45.169 13.917 1.00 44.03 O HETATM 2164 O HOH 71 29.900 38.896 20.039 1.00 45.83 O HETATM 2165 O HOH 72 17.597 39.521 9.349 1.00 34.72 O HETATM 2166 O HOH 73 20.688 44.886 -0.795 1.00 59.91 O HETATM 2167 O HOH 74 10.133 44.924 0.952 1.00 57.46 O HETATM 2168 O HOH 75 6.419 38.917 -1.334 1.00 52.81 O HETATM 2169 O HOH 76 12.498 39.142 -2.566 1.00 37.81 O HETATM 2170 O HOH 77 9.307 38.044 -5.073 1.00 52.62 O HETATM 2171 O HOH 78 5.328 41.940 -3.678 1.00 61.86 O HETATM 2172 O HOH 79 7.574 45.395 2.904 1.00 54.87 O HETATM 2173 O HOH 80 14.485 47.771 0.395 1.00 57.90 O HETATM 2174 O HOH 81 9.342 45.576 5.460 1.00 39.14 O HETATM 2175 O HOH 82 11.735 45.545 9.707 1.00 47.84 O HETATM 2176 O HOH 83 13.653 44.687 -0.009 1.00 38.63 O HETATM 2177 O HOH 84 11.713 48.617 4.316 1.00 42.88 O HETATM 2178 O HOH 85 20.389 46.505 8.827 1.00 43.64 O HETATM 2179 O HOH 86 19.539 45.065 13.602 1.00 38.22 O HETATM 2180 O HOH 87 16.678 44.966 15.430 1.00 34.99 O HETATM 2181 O HOH 88 14.474 41.439 13.501 1.00 54.95 O HETATM 2182 O HOH 89 20.959 41.611 20.567 1.00 56.50 O HETATM 2183 O HOH 90 18.160 42.349 17.638 1.00 54.08 O HETATM 2184 O HOH 91 19.560 45.122 18.656 1.00 67.64 O HETATM 2185 O HOH 92 27.302 42.689 26.368 1.00 68.16 O HETATM 2186 O HOH 93 23.244 36.030 20.482 1.00 31.36 O HETATM 2187 O HOH 94 25.507 36.170 27.858 1.00 63.08 O HETATM 2188 O HOH 95 22.627 39.679 21.930 1.00 41.67 O HETATM 2189 O HOH 96 22.536 35.781 28.139 1.00 52.58 O HETATM 2190 O HOH 97 16.144 36.985 27.821 1.00 58.94 O HETATM 2191 O HOH 98 20.934 38.877 27.421 1.00 71.43 O HETATM 2192 O HOH 99 16.288 40.959 16.947 1.00 54.29 O HETATM 2193 O HOH 100 11.459 42.921 23.493 1.00 65.78 O HETATM 2194 O HOH 101 16.019 38.476 25.798 1.00 60.46 O HETATM 2195 O HOH 102 13.861 38.558 12.555 1.00 44.46 O HETATM 2196 O HOH 103 16.496 35.617 12.521 1.00 44.74 O HETATM 2197 O HOH 104 13.305 41.551 15.681 1.00 46.39 O HETATM 2198 O HOH 105 12.523 34.954 10.121 1.00 59.03 O HETATM 2199 O HOH 106 3.523 32.466 12.336 1.00 41.65 O HETATM 2200 O HOH 107 11.682 29.972 13.792 1.00 30.35 O HETATM 2201 O HOH 108 4.256 42.613 22.683 1.00 63.14 O HETATM 2202 O HOH 109 10.554 38.360 21.678 1.00 48.25 O HETATM 2203 O HOH 110 15.632 28.522 26.193 1.00 48.39 O HETATM 2204 O HOH 111 17.403 31.222 22.678 1.00 44.73 O HETATM 2205 O HOH 112 27.960 28.837 24.944 1.00 62.09 O HETATM 2206 O HOH 113 35.643 29.340 17.481 1.00 50.28 O HETATM 2207 O HOH 114 35.642 25.634 16.017 1.00 49.32 O HETATM 2208 O HOH 115 33.614 25.272 11.366 1.00 48.64 O HETATM 2209 O HOH 116 35.380 33.578 8.622 1.00 41.83 O HETATM 2210 O HOH 117 37.800 28.915 13.048 1.00 52.64 O HETATM 2211 O HOH 118 40.747 32.731 15.854 1.00 53.28 O HETATM 2212 O HOH 119 25.470 23.575 15.476 1.00 47.11 O HETATM 2213 O HOH 120 18.158 37.163 13.647 1.00 47.98 O HETATM 2214 O HOH 121 22.464 28.631 19.472 1.00 34.77 O HETATM 2215 O HOH 122 20.512 24.723 19.907 1.00 36.14 O HETATM 2216 O HOH 123 13.565 33.266 11.733 1.00 54.43 O HETATM 2217 O HOH 124 4.047 29.527 17.540 1.00 48.55 O HETATM 2218 O HOH 125 9.902 25.968 22.315 1.00 48.57 O HETATM 2219 O HOH 126 1.230 25.769 15.917 1.00 56.49 O HETATM 2220 O HOH 127 -2.506 27.617 16.637 1.00 56.40 O HETATM 2221 O HOH 128 -1.027 24.980 18.185 1.00 54.87 O HETATM 2222 O HOH 129 9.548 20.666 17.079 1.00 79.44 O HETATM 2223 O HOH 130 14.229 21.952 17.748 1.00 38.55 O HETATM 2224 O HOH 131 10.547 22.216 19.071 1.00 40.56 O HETATM 2225 O HOH 132 14.323 24.597 23.566 1.00 45.37 O HETATM 2226 O HOH 133 11.031 28.616 17.028 1.00 35.73 O HETATM 2227 O HOH 134 22.902 30.649 12.482 1.00 41.57 O HETATM 2228 O HOH 135 16.871 33.828 11.163 1.00 43.71 O HETATM 2229 O HOH 136 28.496 25.799 3.046 1.00 34.12 O HETATM 2230 O HOH 137 24.421 24.547 7.892 1.00 27.47 O HETATM 2231 O HOH 138 27.040 21.298 9.750 1.00 61.43 O HETATM 2232 O HOH 139 29.261 23.970 4.386 1.00 50.23 O HETATM 2233 O HOH 140 32.562 25.512 6.035 1.00 65.22 O HETATM 2234 O HOH 141 33.816 22.016 -0.044 1.00 25.54 O HETATM 2235 O HOH 142 35.802 26.754 2.623 1.00 54.19 O HETATM 2236 O HOH 143 31.581 22.662 3.226 1.00 56.19 O HETATM 2237 O HOH 144 30.720 23.980 -0.507 1.00 33.46 O HETATM 2238 O HOH 145 35.523 29.707 3.334 1.00 56.98 O HETATM 2239 O HOH 146 34.930 35.405 -3.631 1.00 61.33 O HETATM 2240 O HOH 147 32.249 30.237 -6.565 1.00 36.94 O HETATM 2241 O HOH 148 35.160 32.984 -1.560 1.00 64.85 O HETATM 2242 O HOH 149 26.511 29.158 -4.361 1.00 49.01 O HETATM 2243 O HOH 150 30.492 26.205 -2.538 1.00 29.90 O HETATM 2244 O HOH 151 28.712 21.627 2.397 1.00 39.73 O HETATM 2245 O HOH 152 24.398 19.869 4.665 1.00 60.74 O HETATM 2246 O HOH 153 21.177 21.613 14.186 1.00 39.50 O HETATM 2247 O HOH 154 19.829 23.087 12.200 1.00 27.39 O HETATM 2248 O HOH 155 16.731 20.927 16.847 1.00 54.33 O HETATM 2249 O HOH 156 19.264 20.656 15.848 1.00 42.59 O HETATM 2250 O HOH 157 15.956 18.657 16.957 1.00 45.67 O HETATM 2251 O HOH 158 7.808 14.314 15.128 1.00 41.62 O HETATM 2252 O HOH 159 12.256 14.313 8.653 1.00 57.96 O HETATM 2253 O HOH 160 15.731 15.852 9.950 1.00 59.22 O HETATM 2254 O HOH 161 13.432 16.251 7.756 1.00 32.83 O HETATM 2255 O HOH 162 16.694 18.458 4.572 1.00 45.25 O HETATM 2256 O HOH 163 20.808 18.430 10.224 1.00 47.71 O HETATM 2257 O HOH 164 25.591 23.464 0.576 1.00 29.37 O HETATM 2258 O HOH 165 28.007 30.067 -5.764 1.00 62.24 O HETATM 2259 O HOH 166 35.311 37.034 1.555 1.00 49.24 O HETATM 2260 O HOH 167 29.006 33.347 -6.111 1.00 50.40 O HETATM 2261 O HOH 168 29.206 40.048 -1.159 1.00 42.98 O HETATM 2262 O HOH 169 26.977 38.633 -8.370 1.00 58.08 O HETATM 2263 O HOH 170 32.680 37.031 -5.160 1.00 58.87 O HETATM 2264 O HOH 171 26.959 42.658 -3.936 1.00 58.79 O HETATM 2265 O HOH 172 20.444 32.402 6.157 1.00 34.35 O HETATM 2266 O HOH 173 17.403 35.181 6.756 1.00 51.70 O HETATM 2267 C1 OLA A 174 16.992 31.263 6.380 1.00 0.03 C HETATM 2268 O1 OLA A 174 17.785 32.115 6.750 1.00 -0.57 O HETATM 2269 O2 OLA A 174 17.037 30.966 5.090 1.00 -0.57 O HETATM 2270 C2 OLA A 174 16.023 30.477 7.264 1.00 0.00 C HETATM 2271 C3 OLA A 174 15.432 31.148 8.515 1.00 -0.04 C HETATM 2272 C4 OLA A 174 13.891 30.983 8.621 1.00 -0.05 C HETATM 2273 C5 OLA A 174 13.354 30.258 9.863 1.00 -0.05 C HETATM 2274 C6 OLA A 174 11.949 29.672 9.664 1.00 -0.05 C HETATM 2275 C7 OLA A 174 10.798 30.632 9.934 1.00 -0.05 C HETATM 2276 C8 OLA A 174 10.379 31.431 8.703 1.00 -0.04 C HETATM 2277 C9 OLA A 174 8.918 31.245 8.366 1.00 -0.10 C HETATM 2278 C10 OLA A 174 8.352 31.760 7.264 1.00 -0.10 C HETATM 2279 C11 OLA A 174 9.104 32.570 6.227 1.00 -0.04 C HETATM 2280 C12 OLA A 174 8.320 33.807 5.783 1.00 -0.05 C HETATM 2281 C13 OLA A 174 8.893 34.463 4.518 1.00 -0.05 C HETATM 2282 C14 OLA A 174 10.226 35.193 4.720 1.00 -0.05 C HETATM 2283 C15 OLA A 174 11.449 34.330 4.385 1.00 -0.05 C HETATM 2284 C16 OLA A 174 12.728 34.890 5.018 1.00 -0.05 C HETATM 2285 C17 OLA A 174 13.442 33.878 5.921 1.00 -0.06 C HETATM 2286 C18 OLA A 174 14.436 33.081 5.113 1.00 -0.07 C HETATM 2287 H31 OLA A 174 14.944 32.357 5.767 1.00 0.02 H HETATM 2288 H32 OLA A 174 15.179 33.761 4.672 1.00 0.02 H HETATM 2289 H33 OLA A 174 13.909 32.543 4.311 1.00 0.02 H HETATM 2290 H29 OLA A 174 12.700 33.196 6.362 1.00 0.03 H HETATM 2291 H30 OLA A 174 13.970 34.414 6.723 1.00 0.03 H HETATM 2292 H27 OLA A 174 12.464 35.772 5.620 1.00 0.03 H HETATM 2293 H28 OLA A 174 13.416 35.188 4.213 1.00 0.03 H HETATM 2294 H25 OLA A 174 11.576 34.300 3.293 1.00 0.03 H HETATM 2295 H26 OLA A 174 11.281 33.311 4.763 1.00 0.03 H HETATM 2296 H23 OLA A 174 10.297 35.505 5.772 1.00 0.03 H HETATM 2297 H24 OLA A 174 10.239 36.082 4.072 1.00 0.03 H HETATM 2298 H21 OLA A 174 8.157 35.191 4.147 1.00 0.03 H HETATM 2299 H22 OLA A 174 9.044 33.677 3.763 1.00 0.03 H HETATM 2300 H19 OLA A 174 8.339 34.545 6.599 1.00 0.03 H HETATM 2301 H20 OLA A 174 7.280 33.509 5.582 1.00 0.03 H HETATM 2302 H17 OLA A 174 9.292 31.935 5.349 1.00 0.04 H HETATM 2303 H18 OLA A 174 10.063 32.894 6.657 1.00 0.04 H HETATM 2304 H16 OLA A 174 7.289 31.586 7.105 1.00 0.04 H HETATM 2305 H15 OLA A 174 8.296 30.667 9.048 1.00 0.04 H HETATM 2306 H13 OLA A 174 10.984 31.102 7.845 1.00 0.04 H HETATM 2307 H14 OLA A 174 10.564 32.498 8.895 1.00 0.04 H HETATM 2308 H11 OLA A 174 11.108 31.337 10.719 1.00 0.03 H HETATM 2309 H12 OLA A 174 9.933 30.050 10.284 1.00 0.03 H HETATM 2310 H9 OLA A 174 11.840 28.812 10.342 1.00 0.03 H HETATM 2311 H10 OLA A 174 11.868 29.330 8.622 1.00 0.03 H HETATM 2312 H7 OLA A 174 13.319 30.974 10.697 1.00 0.03 H HETATM 2313 H8 OLA A 174 14.042 29.437 10.113 1.00 0.03 H HETATM 2314 H5 OLA A 174 13.555 30.421 7.737 1.00 0.03 H HETATM 2315 H6 OLA A 174 13.447 31.989 8.606 1.00 0.03 H HETATM 2316 H3 OLA A 174 15.668 32.222 8.482 1.00 0.03 H HETATM 2317 H4 OLA A 174 15.895 30.698 9.406 1.00 0.03 H HETATM 2318 H1 OLA A 174 16.557 29.578 7.604 1.00 0.04 H HETATM 2319 H2 OLA A 174 15.176 30.182 6.628 1.00 0.04 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 2267 2268 2269 2270 CONECT 2268 2267 CONECT 2269 2267 CONECT 2270 2267 2271 2318 2319 CONECT 2271 2270 2272 2316 2317 CONECT 2272 2271 2273 2314 2315 CONECT 2273 2272 2274 2312 2313 CONECT 2274 2273 2275 2310 2311 CONECT 2275 2274 2276 2308 2309 CONECT 2276 2275 2277 2306 2307 CONECT 2277 2276 2278 2305 CONECT 2278 2277 2279 2304 CONECT 2279 2278 2280 2302 2303 CONECT 2280 2279 2281 2300 2301 CONECT 2281 2280 2282 2298 2299 CONECT 2282 2281 2283 2296 2297 CONECT 2283 2282 2284 2294 2295 CONECT 2284 2283 2285 2292 2293 CONECT 2285 2284 2286 2290 2291 CONECT 2286 2285 2287 2288 2289 CONECT 2287 2286 CONECT 2288 2286 CONECT 2289 2286 CONECT 2290 2285 CONECT 2291 2285 CONECT 2292 2284 CONECT 2293 2284 CONECT 2294 2283 CONECT 2295 2283 CONECT 2296 2282 CONECT 2297 2282 CONECT 2298 2281 CONECT 2299 2281 CONECT 2300 2280 CONECT 2301 2280 CONECT 2302 2279 CONECT 2303 2279 CONECT 2304 2278 CONECT 2305 2277 CONECT 2306 2276 CONECT 2307 2276 CONECT 2308 2275 CONECT 2309 2275 CONECT 2310 2274 CONECT 2311 2274 CONECT 2312 2273 CONECT 2313 2273 CONECT 2314 2272 CONECT 2315 2272 CONECT 2316 2271 CONECT 2317 2271 CONECT 2318 2270 CONECT 2319 2270 MASTER 0 0 0 0 0 0 0 0 2318 1 57 11 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 1vyf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1vyg
RCSB PDB
PDBbind
135aa, >1VYG_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
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Ligand Name
1fe3
RCSB PDB
PDBbind
OLA
1g74
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PDBbind
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OLA
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PDBbind
OLA
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RCSB PDB
PDBbind
OLA
3pgu
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PDBbind
OLA
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RCSB PDB
PDBbind
OLA
Entry Information
PDB ID
1vyf
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
fatty acid binding protein
Ligand Name
OLA
EC.Number
E.C.-.-.-.-
Resolution
1.85(Å)
Affinity (Kd/Ki/IC50)
Kd=9nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistryv43;pp.13000
Ligand Properties
Formula
C
1
8
H
3
4
O
2
Molecular Weight
282.461
Exact Mass
282.256
No. of atoms
54
No. of bonds
53
Polar Surface Area
37.3
LOGP Value
8.71 (
Computed with XLOGP3
)
6.11 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 14
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 0
Canonical SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)O
InChI String
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-
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):
P29498
Entrez Gene ID
NCBI Entrez Gene ID:
8344852
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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