Browse entries in the PDBbind-CN Database
HEADER 3HYF_COMPLEX COMPND 3HYF_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 50 PRO VAL LYS ASN VAL ASP LEU VAL ASN GLN ILE ILE GLU SEQRES 2 A 50 GLN LEU ILE LYS LYS GLU LYS VAL TYR LEU ALA TRP VAL SEQRES 3 A 50 PRO ALA HIS LYS GLY ILE GLY GLY ASN GLU GLN VAL ASP SEQRES 4 A 50 LYS LEU VAL SER ALA GLY ILE ARG LYS VAL LEU SEQRES 1 A 93 MET TYR GLN LEU GLU LYS GLU PRO ILE VAL GLY ALA GLU SEQRES 2 A 93 THR PHE TYR VAL ASP GLY ALA ALA ASN ARG GLU THR LYS SEQRES 3 A 93 LEU GLY LYS ALA GLY TYR VAL THR ASN ARG GLY ARG GLN SEQRES 4 A 93 LYS VAL VAL THR LEU THR ASP THR THR ASN GLN LYS THR SEQRES 5 A 93 GLU LEU GLN ALA ILE TYR LEU ALA LEU GLN ASP SER GLY SEQRES 6 A 93 LEU GLU VAL ASN ILE VAL THR ASP SER GLN TYR ALA LEU SEQRES 7 A 93 GLY ILE ILE THR GLN TRP ILE HIS ASN TRP LYS LYS ARG SEQRES 8 A 93 GLY TRP HET MN A 1 1 HET MN A 2 1 HET ON A 1 27 ATOM 1 N PRO A 97 0.929 39.226 10.088 1.00 57.69 N ATOM 2 CA PRO A 97 0.082 39.594 11.228 1.00 61.14 C ATOM 3 C PRO A 97 -1.404 39.331 10.991 1.00 64.88 C ATOM 4 O PRO A 97 -1.880 39.376 9.857 1.00 62.84 O ATOM 5 CB PRO A 97 0.379 41.080 11.436 1.00 62.95 C ATOM 6 CG PRO A 97 0.870 41.559 10.112 1.00 64.83 C ATOM 7 CD PRO A 97 1.594 40.397 9.489 1.00 63.10 C ATOM 8 HA PRO A 97 0.304 38.989 12.107 1.00 0.00 H ATOM 9 HD3 PRO A 97 1.479 40.400 8.405 1.00 0.00 H ATOM 10 HD2 PRO A 97 2.654 40.416 9.741 1.00 0.00 H ATOM 11 HG3 PRO A 97 1.549 42.402 10.242 1.00 0.00 H ATOM 12 HG2 PRO A 97 0.032 41.863 9.485 1.00 0.00 H ATOM 13 HB2 PRO A 97 -0.525 41.615 11.727 1.00 0.00 H ATOM 14 HB3 PRO A 97 1.143 41.216 12.201 1.00 0.00 H ATOM 15 N VAL A 98 -2.128 39.053 12.071 1.00 50.34 N ATOM 16 CA VAL A 98 -3.564 38.808 11.992 1.00 40.70 C ATOM 17 C VAL A 98 -4.359 39.918 12.683 1.00 41.37 C ATOM 18 O VAL A 98 -5.376 40.378 12.161 1.00 57.61 O ATOM 19 CB VAL A 98 -3.934 37.454 12.636 1.00 47.22 C ATOM 20 CG1 VAL A 98 -5.451 37.262 12.611 1.00 44.00 C ATOM 21 CG2 VAL A 98 -3.239 36.315 11.894 1.00 47.66 C ATOM 22 HA VAL A 98 -3.822 38.789 10.933 1.00 0.00 H ATOM 23 HB VAL A 98 -3.599 37.448 13.673 1.00 0.00 H ATOM 24 HG11 VAL A 98 -5.927 38.068 13.169 1.00 0.00 H ATOM 25 HG12 VAL A 98 -5.801 37.277 11.579 1.00 0.00 H ATOM 26 HG13 VAL A 98 -5.702 36.305 13.067 1.00 0.00 H ATOM 27 HG21 VAL A 98 -3.556 36.315 10.851 1.00 0.00 H ATOM 28 HG22 VAL A 98 -2.159 36.454 11.946 1.00 0.00 H ATOM 29 HG23 VAL A 98 -3.507 35.365 12.356 1.00 0.00 H ATOM 30 H VAL A 98 -1.658 39.009 12.998 1.00 0.00 H ATOM 31 N LYS A 99 -3.899 40.344 13.856 1.00 42.04 N ATOM 32 CA LYS A 99 -4.513 41.474 14.548 1.00 38.98 C ATOM 33 C LYS A 99 -3.922 42.780 14.033 1.00 26.95 C ATOM 34 O LYS A 99 -2.723 42.863 13.778 1.00 38.67 O ATOM 35 CB LYS A 99 -4.270 41.389 16.058 1.00 37.74 C ATOM 36 CG LYS A 99 -4.954 40.231 16.758 1.00 83.06 C ATOM 37 CD LYS A 99 -5.441 40.648 18.143 1.00 79.07 C ATOM 38 CE LYS A 99 -4.410 41.500 18.876 1.00 74.81 C ATOM 39 NZ LYS A 99 -3.127 40.781 19.119 1.00 46.42 N ATOM 40 HA LYS A 99 -5.585 41.443 14.355 1.00 0.00 H ATOM 41 HB2 LYS A 99 -3.196 41.296 16.222 1.00 0.00 H ATOM 42 HB3 LYS A 99 -4.627 42.315 16.510 1.00 0.00 H ATOM 43 HG2 LYS A 99 -5.807 39.906 16.162 1.00 0.00 H ATOM 44 HG3 LYS A 99 -4.248 39.407 16.860 1.00 0.00 H ATOM 45 HD2 LYS A 99 -6.361 41.223 18.035 1.00 0.00 H ATOM 46 HD3 LYS A 99 -5.641 39.752 18.731 1.00 0.00 H ATOM 47 HE2 LYS A 99 -4.827 41.801 19.837 1.00 0.00 H ATOM 48 HE3 LYS A 99 -4.203 42.387 18.277 1.00 0.00 H ATOM 49 HZ1 LYS A 99 -3.309 39.936 19.698 1.00 0.00 H ATOM 50 HZ2 LYS A 99 -2.713 40.496 18.209 1.00 0.00 H ATOM 51 HZ3 LYS A 99 -2.468 41.411 19.620 1.00 0.00 H ATOM 52 H LYS A 99 -3.085 39.863 14.289 1.00 0.00 H ATOM 53 N ASN A 100 -4.767 43.795 13.879 1.00 22.19 N ATOM 54 CA ASN A 100 -4.292 45.134 13.541 1.00 36.71 C ATOM 55 C ASN A 100 -3.571 45.153 12.195 1.00 40.49 C ATOM 56 O ASN A 100 -2.600 45.894 12.009 1.00 32.01 O ATOM 57 CB ASN A 100 -3.345 45.640 14.634 1.00 29.79 C ATOM 58 CG ASN A 100 -3.990 45.639 16.003 1.00 29.75 C ATOM 59 OD1 ASN A 100 -5.143 46.038 16.152 1.00 29.11 O ATOM 60 ND2 ASN A 100 -3.251 45.186 17.011 1.00 22.84 N ATOM 61 HA ASN A 100 -5.162 45.787 13.469 1.00 0.00 H ATOM 62 HB2 ASN A 100 -2.466 44.997 14.661 1.00 0.00 H ATOM 63 HB3 ASN A 100 -3.042 46.658 14.391 1.00 0.00 H ATOM 64 HD22 ASN A 100 -2.279 44.858 16.837 1.00 0.00 H ATOM 65 HD21 ASN A 100 -3.645 45.159 17.973 1.00 0.00 H ATOM 66 H ASN A 100 -5.787 43.632 14.002 1.00 0.00 H ATOM 67 N VAL A 101 -4.050 44.337 11.262 1.00 33.17 N ATOM 68 CA VAL A 101 -3.386 44.174 9.975 1.00 41.91 C ATOM 69 C VAL A 101 -3.399 45.447 9.132 1.00 30.11 C ATOM 70 O VAL A 101 -2.375 45.825 8.563 1.00 46.44 O ATOM 71 CB VAL A 101 -4.023 43.023 9.157 1.00 53.90 C ATOM 72 CG1 VAL A 101 -3.870 41.714 9.905 1.00 54.85 C ATOM 73 CG2 VAL A 101 -5.491 43.309 8.898 1.00 58.24 C ATOM 74 HA VAL A 101 -2.349 43.934 10.208 1.00 0.00 H ATOM 75 HB VAL A 101 -3.510 42.947 8.198 1.00 0.00 H ATOM 76 HG11 VAL A 101 -2.811 41.505 10.057 1.00 0.00 H ATOM 77 HG12 VAL A 101 -4.369 41.789 10.871 1.00 0.00 H ATOM 78 HG13 VAL A 101 -4.320 40.910 9.323 1.00 0.00 H ATOM 79 HG21 VAL A 101 -6.015 43.402 9.849 1.00 0.00 H ATOM 80 HG22 VAL A 101 -5.585 44.239 8.337 1.00 0.00 H ATOM 81 HG23 VAL A 101 -5.923 42.491 8.322 1.00 0.00 H ATOM 82 H VAL A 101 -4.920 43.801 11.455 1.00 0.00 H ATOM 83 N ASP A 102 -4.546 46.111 9.046 1.00 41.67 N ATOM 84 CA ASP A 102 -4.633 47.329 8.248 1.00 45.15 C ATOM 85 C ASP A 102 -3.624 48.355 8.752 1.00 47.57 C ATOM 86 O ASP A 102 -2.981 49.049 7.964 1.00 45.22 O ATOM 87 CB ASP A 102 -6.044 47.925 8.315 1.00 46.56 C ATOM 88 CG ASP A 102 -7.065 47.097 7.556 1.00 47.14 C ATOM 89 OD1 ASP A 102 -6.647 46.231 6.757 1.00 54.80 O ATOM 90 OD2 ASP A 102 -8.282 47.316 7.761 1.00 59.96 O ATOM 91 HA ASP A 102 -4.409 47.074 7.212 1.00 0.00 H ATOM 92 HB2 ASP A 102 -6.349 47.984 9.360 1.00 0.00 H ATOM 93 HB3 ASP A 102 -6.020 48.928 7.888 1.00 0.00 H ATOM 94 H ASP A 102 -5.386 45.761 9.550 1.00 0.00 H ATOM 95 N LEU A 517 -3.483 48.435 10.071 1.00 36.96 N ATOM 96 CA LEU A 517 -2.668 49.475 10.686 1.00 32.84 C ATOM 97 C LEU A 517 -1.178 49.182 10.550 1.00 35.55 C ATOM 98 O LEU A 517 -0.382 50.087 10.285 1.00 26.74 O ATOM 99 CB LEU A 517 -3.022 49.616 12.163 1.00 33.27 C ATOM 100 CG LEU A 517 -3.108 51.036 12.721 1.00 51.15 C ATOM 101 CD1 LEU A 517 -2.843 50.990 14.215 1.00 36.13 C ATOM 102 CD2 LEU A 517 -2.102 51.945 12.023 1.00 35.56 C ATOM 103 HA LEU A 517 -2.881 50.407 10.162 1.00 0.00 H ATOM 104 HB2 LEU A 517 -3.992 49.142 12.316 1.00 0.00 H ATOM 105 HB3 LEU A 517 -2.264 49.082 12.736 1.00 0.00 H ATOM 106 HG LEU A 517 -4.103 51.442 12.541 1.00 0.00 H ATOM 107 HD21 LEU A 517 -1.095 51.561 12.184 1.00 0.00 H ATOM 108 HD22 LEU A 517 -2.317 51.970 10.955 1.00 0.00 H ATOM 109 HD23 LEU A 517 -2.178 52.952 12.434 1.00 0.00 H ATOM 110 HD11 LEU A 517 -3.589 50.357 14.696 1.00 0.00 H ATOM 111 HD12 LEU A 517 -1.848 50.581 14.394 1.00 0.00 H ATOM 112 HD13 LEU A 517 -2.902 51.998 14.624 1.00 0.00 H ATOM 113 H LEU A 517 -3.965 47.741 10.677 1.00 0.00 H ATOM 114 N VAL A 518 -0.794 47.924 10.737 1.00 25.99 N ATOM 115 CA VAL A 518 0.606 47.553 10.592 1.00 22.32 C ATOM 116 C VAL A 518 1.029 47.791 9.144 1.00 40.87 C ATOM 117 O VAL A 518 2.177 48.158 8.870 1.00 29.63 O ATOM 118 CB VAL A 518 0.844 46.078 10.977 1.00 28.23 C ATOM 119 CG1 VAL A 518 2.257 45.668 10.617 1.00 30.87 C ATOM 120 CG2 VAL A 518 0.630 45.898 12.491 1.00 20.53 C ATOM 121 HA VAL A 518 1.203 48.167 11.266 1.00 0.00 H ATOM 122 HB VAL A 518 0.139 45.452 10.430 1.00 0.00 H ATOM 123 HG11 VAL A 518 2.406 45.787 9.544 1.00 0.00 H ATOM 124 HG12 VAL A 518 2.965 46.298 11.156 1.00 0.00 H ATOM 125 HG13 VAL A 518 2.413 44.625 10.893 1.00 0.00 H ATOM 126 HG21 VAL A 518 1.331 46.532 13.034 1.00 0.00 H ATOM 127 HG22 VAL A 518 -0.391 46.180 12.748 1.00 0.00 H ATOM 128 HG23 VAL A 518 0.799 44.855 12.759 1.00 0.00 H ATOM 129 H VAL A 518 -1.497 47.200 10.988 1.00 0.00 H ATOM 130 N ASN A 519 0.087 47.603 8.222 1.00 37.13 N ATOM 131 CA ASN A 519 0.340 47.857 6.806 1.00 37.29 C ATOM 132 C ASN A 519 0.532 49.341 6.507 1.00 25.06 C ATOM 133 O ASN A 519 1.422 49.714 5.740 1.00 37.77 O ATOM 134 CB ASN A 519 -0.809 47.312 5.956 1.00 54.88 C ATOM 135 CG ASN A 519 -0.728 45.813 5.764 1.00 39.86 C ATOM 136 OD1 ASN A 519 0.333 45.211 5.930 1.00 42.16 O ATOM 137 ND2 ASN A 519 -1.852 45.200 5.408 1.00 62.53 N ATOM 138 HA ASN A 519 1.267 47.343 6.553 1.00 0.00 H ATOM 139 HB2 ASN A 519 -1.752 47.551 6.448 1.00 0.00 H ATOM 140 HB3 ASN A 519 -0.779 47.792 4.978 1.00 0.00 H ATOM 141 HD22 ASN A 519 -2.726 45.749 5.279 1.00 0.00 H ATOM 142 HD21 ASN A 519 -1.858 44.171 5.258 1.00 0.00 H ATOM 143 H ASN A 519 -0.852 47.267 8.517 1.00 0.00 H ATOM 144 N GLN A 520 -0.302 50.184 7.101 1.00 25.02 N ATOM 145 CA GLN A 520 -0.156 51.621 6.935 1.00 26.27 C ATOM 146 C GLN A 520 1.224 52.066 7.417 1.00 41.47 C ATOM 147 O GLN A 520 1.854 52.924 6.801 1.00 28.86 O ATOM 148 CB GLN A 520 -1.245 52.367 7.709 1.00 29.49 C ATOM 149 CG GLN A 520 -2.626 52.274 7.073 1.00 57.20 C ATOM 150 CD GLN A 520 -3.746 52.580 8.050 1.00 73.28 C ATOM 151 OE1 GLN A 520 -3.763 53.633 8.689 1.00 45.19 O ATOM 152 NE2 GLN A 520 -4.690 51.653 8.172 1.00 93.72 N ATOM 153 HA GLN A 520 -0.259 51.858 5.876 1.00 0.00 H ATOM 154 HB2 GLN A 520 -1.300 51.949 8.714 1.00 0.00 H ATOM 155 HB3 GLN A 520 -0.965 53.419 7.770 1.00 0.00 H ATOM 156 HG2 GLN A 520 -2.679 52.985 6.249 1.00 0.00 H ATOM 157 HG3 GLN A 520 -2.765 51.264 6.689 1.00 0.00 H ATOM 158 HE22 GLN A 520 -4.635 50.778 7.612 1.00 0.00 H ATOM 159 HE21 GLN A 520 -5.484 51.802 8.827 1.00 0.00 H ATOM 160 H GLN A 520 -1.071 49.812 7.694 1.00 0.00 H ATOM 161 N ILE A 521 1.695 51.471 8.510 1.00 32.47 N ATOM 162 CA ILE A 521 3.009 51.809 9.056 1.00 22.14 C ATOM 163 C ILE A 521 4.147 51.359 8.137 1.00 26.21 C ATOM 164 O ILE A 521 5.088 52.113 7.885 1.00 22.90 O ATOM 165 CB ILE A 521 3.197 51.180 10.462 1.00 17.64 C ATOM 166 CG1 ILE A 521 2.291 51.891 11.468 1.00 20.89 C ATOM 167 CG2 ILE A 521 4.648 51.242 10.873 1.00 16.15 C ATOM 168 CD1 ILE A 521 2.226 51.200 12.825 1.00 23.33 C ATOM 169 HA ILE A 521 3.048 52.895 9.135 1.00 0.00 H ATOM 170 HB ILE A 521 2.911 50.128 10.434 1.00 0.00 H ATOM 171 HG12 ILE A 521 2.666 52.904 11.614 1.00 0.00 H ATOM 172 HG13 ILE A 521 1.283 51.934 11.054 1.00 0.00 H ATOM 173 HD11 ILE A 521 1.841 50.188 12.698 1.00 0.00 H ATOM 174 HD12 ILE A 521 3.225 51.159 13.258 1.00 0.00 H ATOM 175 HD13 ILE A 521 1.565 51.761 13.486 1.00 0.00 H ATOM 176 HG21 ILE A 521 5.252 50.691 10.152 1.00 0.00 H ATOM 177 HG22 ILE A 521 4.972 52.282 10.901 1.00 0.00 H ATOM 178 HG23 ILE A 521 4.764 50.797 11.861 1.00 0.00 H ATOM 179 H ILE A 521 1.116 50.750 8.986 1.00 0.00 H ATOM 180 N ILE A 522 4.062 50.134 7.627 1.00 20.91 N ATOM 181 CA ILE A 522 5.103 49.617 6.757 1.00 19.42 C ATOM 182 C ILE A 522 5.188 50.453 5.479 1.00 21.61 C ATOM 183 O ILE A 522 6.280 50.754 4.994 1.00 24.27 O ATOM 184 CB ILE A 522 4.831 48.150 6.378 1.00 24.59 C ATOM 185 CG1 ILE A 522 4.814 47.290 7.641 1.00 32.75 C ATOM 186 CG2 ILE A 522 5.888 47.659 5.408 1.00 29.62 C ATOM 187 CD1 ILE A 522 6.099 47.345 8.426 1.00 31.76 C ATOM 188 HA ILE A 522 6.046 49.674 7.300 1.00 0.00 H ATOM 189 HB ILE A 522 3.859 48.075 5.890 1.00 0.00 H ATOM 190 HG12 ILE A 522 4.003 47.635 8.282 1.00 0.00 H ATOM 191 HG13 ILE A 522 4.631 46.255 7.351 1.00 0.00 H ATOM 192 HD11 ILE A 522 6.920 46.992 7.802 1.00 0.00 H ATOM 193 HD12 ILE A 522 6.291 48.373 8.734 1.00 0.00 H ATOM 194 HD13 ILE A 522 6.012 46.710 9.308 1.00 0.00 H ATOM 195 HG21 ILE A 522 5.866 48.272 4.507 1.00 0.00 H ATOM 196 HG22 ILE A 522 6.870 47.733 5.875 1.00 0.00 H ATOM 197 HG23 ILE A 522 5.685 46.620 5.147 1.00 0.00 H ATOM 198 H ILE A 522 3.240 49.539 7.854 1.00 0.00 H ATOM 199 N GLU A 523 4.032 50.833 4.948 1.00 25.31 N ATOM 200 CA GLU A 523 3.991 51.641 3.733 1.00 32.47 C ATOM 201 C GLU A 523 4.577 53.032 3.956 1.00 30.28 C ATOM 202 O GLU A 523 5.124 53.633 3.030 1.00 25.48 O ATOM 203 CB GLU A 523 2.555 51.748 3.222 1.00 31.14 C ATOM 204 CG GLU A 523 2.056 50.442 2.624 1.00 33.36 C ATOM 205 CD GLU A 523 0.548 50.360 2.542 1.00 34.92 C ATOM 206 OE1 GLU A 523 0.028 49.229 2.428 1.00 55.95 O ATOM 207 OE2 GLU A 523 -0.116 51.418 2.590 1.00 72.48 O ATOM 208 HA GLU A 523 4.605 51.143 2.983 1.00 0.00 H ATOM 209 HB2 GLU A 523 1.906 52.023 4.054 1.00 0.00 H ATOM 210 HB3 GLU A 523 2.512 52.523 2.457 1.00 0.00 H ATOM 211 HG2 GLU A 523 2.463 50.344 1.618 1.00 0.00 H ATOM 212 HG3 GLU A 523 2.415 49.619 3.242 1.00 0.00 H ATOM 213 H GLU A 523 3.142 50.550 5.405 1.00 0.00 H ATOM 214 N GLN A 524 4.469 53.533 5.184 1.00 21.56 N ATOM 215 CA GLN A 524 5.143 54.779 5.559 1.00 19.12 C ATOM 216 C GLN A 524 6.649 54.593 5.666 1.00 19.21 C ATOM 217 O GLN A 524 7.421 55.410 5.155 1.00 20.96 O ATOM 218 CB GLN A 524 4.641 55.285 6.908 1.00 28.60 C ATOM 219 CG GLN A 524 3.282 55.932 6.907 1.00 25.50 C ATOM 220 CD GLN A 524 2.855 56.281 8.315 1.00 33.44 C ATOM 221 OE1 GLN A 524 2.348 57.372 8.575 1.00 40.76 O ATOM 222 NE2 GLN A 524 3.068 55.348 9.241 1.00 35.68 N ATOM 223 HA GLN A 524 4.917 55.500 4.773 1.00 0.00 H ATOM 224 HB2 GLN A 524 4.606 54.436 7.591 1.00 0.00 H ATOM 225 HB3 GLN A 524 5.359 56.017 7.278 1.00 0.00 H ATOM 226 HG2 GLN A 524 3.319 56.842 6.308 1.00 0.00 H ATOM 227 HG3 GLN A 524 2.557 55.243 6.474 1.00 0.00 H ATOM 228 HE22 GLN A 524 3.500 54.440 8.975 1.00 0.00 H ATOM 229 HE21 GLN A 524 2.803 55.527 10.231 1.00 0.00 H ATOM 230 H GLN A 524 3.895 53.031 5.891 1.00 0.00 H ATOM 231 N LEU A 525 7.069 53.533 6.357 1.00 18.91 N ATOM 232 CA LEU A 525 8.486 53.280 6.580 1.00 19.05 C ATOM 233 C LEU A 525 9.283 53.274 5.290 1.00 22.94 C ATOM 234 O LEU A 525 10.340 53.889 5.211 1.00 20.64 O ATOM 235 CB LEU A 525 8.707 51.932 7.287 1.00 22.53 C ATOM 236 CG LEU A 525 8.526 51.831 8.803 1.00 25.05 C ATOM 237 CD1 LEU A 525 8.795 50.393 9.225 1.00 21.47 C ATOM 238 CD2 LEU A 525 9.472 52.774 9.531 1.00 15.19 C ATOM 239 HA LEU A 525 8.837 54.098 7.210 1.00 0.00 H ATOM 240 HB2 LEU A 525 8.013 51.222 6.838 1.00 0.00 H ATOM 241 HB3 LEU A 525 9.730 51.625 7.070 1.00 0.00 H ATOM 242 HG LEU A 525 7.507 52.118 9.064 1.00 0.00 H ATOM 243 HD21 LEU A 525 10.502 52.516 9.284 1.00 0.00 H ATOM 244 HD22 LEU A 525 9.269 53.800 9.222 1.00 0.00 H ATOM 245 HD23 LEU A 525 9.320 52.680 10.606 1.00 0.00 H ATOM 246 HD11 LEU A 525 8.092 49.730 8.720 1.00 0.00 H ATOM 247 HD12 LEU A 525 9.814 50.120 8.952 1.00 0.00 H ATOM 248 HD13 LEU A 525 8.670 50.303 10.304 1.00 0.00 H ATOM 249 H LEU A 525 6.368 52.871 6.746 1.00 0.00 H ATOM 250 N ILE A 526 8.791 52.564 4.278 1.00 21.54 N ATOM 251 CA ILE A 526 9.620 52.335 3.114 1.00 21.87 C ATOM 252 C ILE A 526 9.839 53.617 2.331 1.00 18.24 C ATOM 253 O ILE A 526 10.793 53.719 1.567 1.00 22.92 O ATOM 254 CB ILE A 526 9.023 51.257 2.189 1.00 22.65 C ATOM 255 CG1 ILE A 526 7.637 51.675 1.703 1.00 17.60 C ATOM 256 CG2 ILE A 526 8.956 49.932 2.939 1.00 25.02 C ATOM 257 CD1 ILE A 526 7.018 50.676 0.721 1.00 30.52 C ATOM 258 HA ILE A 526 10.582 51.978 3.482 1.00 0.00 H ATOM 259 HB ILE A 526 9.661 51.139 1.313 1.00 0.00 H ATOM 260 HG12 ILE A 526 6.979 51.766 2.567 1.00 0.00 H ATOM 261 HG13 ILE A 526 7.720 52.643 1.208 1.00 0.00 H ATOM 262 HD11 ILE A 526 7.661 50.583 -0.154 1.00 0.00 H ATOM 263 HD12 ILE A 526 6.919 49.705 1.206 1.00 0.00 H ATOM 264 HD13 ILE A 526 6.034 51.032 0.414 1.00 0.00 H ATOM 265 HG21 ILE A 526 9.960 49.637 3.244 1.00 0.00 H ATOM 266 HG22 ILE A 526 8.326 50.047 3.821 1.00 0.00 H ATOM 267 HG23 ILE A 526 8.534 49.168 2.287 1.00 0.00 H ATOM 268 H ILE A 526 7.826 52.180 4.323 1.00 0.00 H ATOM 269 N LYS A 527 8.974 54.608 2.528 1.00 19.01 N ATOM 270 CA LYS A 527 9.159 55.877 1.817 1.00 15.76 C ATOM 271 C LYS A 527 10.139 56.817 2.509 1.00 21.24 C ATOM 272 O LYS A 527 10.573 57.809 1.927 1.00 19.76 O ATOM 273 CB LYS A 527 7.815 56.580 1.611 1.00 19.12 C ATOM 274 CG LYS A 527 6.970 55.919 0.542 1.00 20.85 C ATOM 275 CD LYS A 527 5.669 56.658 0.315 1.00 22.51 C ATOM 276 CE LYS A 527 4.770 56.586 1.542 1.00 30.97 C ATOM 277 NZ LYS A 527 3.485 57.308 1.328 1.00 35.60 N ATOM 278 HA LYS A 527 9.593 55.624 0.850 1.00 0.00 H ATOM 279 HB2 LYS A 527 7.264 56.564 2.552 1.00 0.00 H ATOM 280 HB3 LYS A 527 8.002 57.613 1.319 1.00 0.00 H ATOM 281 HG2 LYS A 527 7.533 55.901 -0.391 1.00 0.00 H ATOM 282 HG3 LYS A 527 6.746 54.898 0.850 1.00 0.00 H ATOM 283 HD2 LYS A 527 5.888 57.703 0.096 1.00 0.00 H ATOM 284 HD3 LYS A 527 5.150 56.211 -0.533 1.00 0.00 H ATOM 285 HE2 LYS A 527 5.291 57.034 2.388 1.00 0.00 H ATOM 286 HE3 LYS A 527 4.555 55.540 1.762 1.00 0.00 H ATOM 287 HZ1 LYS A 527 3.681 58.309 1.124 1.00 0.00 H ATOM 288 HZ2 LYS A 527 2.979 56.882 0.526 1.00 0.00 H ATOM 289 HZ3 LYS A 527 2.901 57.236 2.186 1.00 0.00 H ATOM 290 H LYS A 527 8.174 54.484 3.180 1.00 0.00 H ATOM 291 N LYS A 528 10.498 56.507 3.751 1.00 16.95 N ATOM 292 CA LYS A 528 11.503 57.300 4.454 1.00 15.10 C ATOM 293 C LYS A 528 12.878 57.094 3.835 1.00 15.55 C ATOM 294 O LYS A 528 13.130 56.082 3.179 1.00 18.30 O ATOM 295 CB LYS A 528 11.549 56.911 5.941 1.00 13.34 C ATOM 296 CG LYS A 528 10.266 57.210 6.705 1.00 11.87 C ATOM 297 CD LYS A 528 10.061 58.717 6.819 1.00 13.15 C ATOM 298 CE LYS A 528 8.813 59.065 7.621 1.00 13.56 C ATOM 299 NZ LYS A 528 8.545 60.543 7.708 1.00 14.33 N ATOM 300 HA LYS A 528 11.226 58.351 4.365 1.00 0.00 H ATOM 301 HB2 LYS A 528 11.746 55.841 6.009 1.00 0.00 H ATOM 302 HB3 LYS A 528 12.364 57.460 6.413 1.00 0.00 H ATOM 303 HG2 LYS A 528 9.421 56.770 6.176 1.00 0.00 H ATOM 304 HG3 LYS A 528 10.332 56.779 7.704 1.00 0.00 H ATOM 305 HD2 LYS A 528 10.929 59.154 7.312 1.00 0.00 H ATOM 306 HD3 LYS A 528 9.964 59.136 5.817 1.00 0.00 H ATOM 307 HE2 LYS A 528 8.933 58.676 8.632 1.00 0.00 H ATOM 308 HE3 LYS A 528 7.955 58.586 7.149 1.00 0.00 H ATOM 309 HZ1 LYS A 528 9.351 61.014 8.167 1.00 0.00 H ATOM 310 HZ2 LYS A 528 8.417 60.928 6.750 1.00 0.00 H ATOM 311 HZ3 LYS A 528 7.683 60.705 8.267 1.00 0.00 H ATOM 312 H LYS A 528 10.059 55.693 4.226 1.00 0.00 H ATOM 313 N GLU A 529 13.772 58.058 4.041 1.00 15.25 N ATOM 314 CA GLU A 529 15.171 57.870 3.659 1.00 17.26 C ATOM 315 C GLU A 529 15.886 56.984 4.672 1.00 17.63 C ATOM 316 O GLU A 529 16.526 55.997 4.304 1.00 18.60 O ATOM 317 CB GLU A 529 15.881 59.225 3.560 1.00 21.21 C ATOM 318 CG GLU A 529 15.314 60.136 2.486 1.00 42.54 C ATOM 319 CD GLU A 529 15.697 59.694 1.085 1.00 91.66 C ATOM 320 OE1 GLU A 529 15.105 60.210 0.107 1.00 49.03 O ATOM 321 OE2 GLU A 529 16.593 58.830 0.966 1.00 29.54 O ATOM 322 HA GLU A 529 15.199 57.382 2.685 1.00 0.00 H ATOM 323 HB2 GLU A 529 15.793 59.731 4.522 1.00 0.00 H ATOM 324 HB3 GLU A 529 16.933 59.047 3.340 1.00 0.00 H ATOM 325 HG2 GLU A 529 14.227 60.138 2.567 1.00 0.00 H ATOM 326 HG3 GLU A 529 15.691 61.146 2.649 1.00 0.00 H ATOM 327 H GLU A 529 13.473 58.953 4.478 1.00 0.00 H ATOM 328 N LYS A 530 15.761 57.327 5.953 1.00 16.35 N ATOM 329 CA LYS A 530 16.351 56.533 7.023 1.00 16.07 C ATOM 330 C LYS A 530 15.437 56.509 8.247 1.00 19.33 C ATOM 331 O LYS A 530 14.889 57.536 8.624 1.00 16.56 O ATOM 332 CB LYS A 530 17.691 57.129 7.445 1.00 21.09 C ATOM 333 CG LYS A 530 18.739 57.208 6.354 1.00 17.93 C ATOM 334 CD LYS A 530 20.073 57.613 6.972 1.00 26.72 C ATOM 335 CE LYS A 530 21.187 57.665 5.940 1.00 33.15 C ATOM 336 NZ LYS A 530 22.428 58.238 6.540 1.00 36.96 N ATOM 337 HA LYS A 530 16.489 55.520 6.645 1.00 0.00 H ATOM 338 HB2 LYS A 530 17.510 58.139 7.811 1.00 0.00 H ATOM 339 HB3 LYS A 530 18.092 56.517 8.253 1.00 0.00 H ATOM 340 HG2 LYS A 530 18.840 56.235 5.873 1.00 0.00 H ATOM 341 HG3 LYS A 530 18.440 57.949 5.613 1.00 0.00 H ATOM 342 HD2 LYS A 530 19.966 58.599 7.425 1.00 0.00 H ATOM 343 HD3 LYS A 530 20.339 56.888 7.741 1.00 0.00 H ATOM 344 HE2 LYS A 530 20.872 58.288 5.103 1.00 0.00 H ATOM 345 HE3 LYS A 530 21.393 56.656 5.583 1.00 0.00 H ATOM 346 HZ1 LYS A 530 22.235 59.202 6.879 1.00 0.00 H ATOM 347 HZ2 LYS A 530 22.732 57.644 7.337 1.00 0.00 H ATOM 348 HZ3 LYS A 530 23.178 58.266 5.821 1.00 0.00 H ATOM 349 H LYS A 530 15.227 58.186 6.196 1.00 0.00 H ATOM 350 N VAL A 531 15.288 55.346 8.877 1.00 15.43 N ATOM 351 CA VAL A 531 14.559 55.275 10.140 1.00 18.15 C ATOM 352 C VAL A 531 15.309 54.442 11.155 1.00 14.55 C ATOM 353 O VAL A 531 15.727 53.321 10.861 1.00 16.38 O ATOM 354 CB VAL A 531 13.167 54.645 9.970 1.00 14.74 C ATOM 355 CG1 VAL A 531 12.478 54.534 11.333 1.00 17.02 C ATOM 356 CG2 VAL A 531 12.336 55.484 9.009 1.00 17.90 C ATOM 357 HA VAL A 531 14.458 56.304 10.484 1.00 0.00 H ATOM 358 HB VAL A 531 13.269 53.643 9.553 1.00 0.00 H ATOM 359 HG11 VAL A 531 13.079 53.908 11.993 1.00 0.00 H ATOM 360 HG12 VAL A 531 12.374 55.528 11.768 1.00 0.00 H ATOM 361 HG13 VAL A 531 11.492 54.087 11.205 1.00 0.00 H ATOM 362 HG21 VAL A 531 12.230 56.493 9.408 1.00 0.00 H ATOM 363 HG22 VAL A 531 12.835 55.526 8.041 1.00 0.00 H ATOM 364 HG23 VAL A 531 11.351 55.032 8.893 1.00 0.00 H ATOM 365 H VAL A 531 15.694 54.481 8.466 1.00 0.00 H ATOM 366 N TYR A 532 15.450 54.997 12.353 1.00 12.92 N ATOM 367 CA TYR A 532 15.942 54.268 13.509 1.00 15.37 C ATOM 368 C TYR A 532 14.771 54.064 14.462 1.00 14.73 C ATOM 369 O TYR A 532 14.136 55.030 14.880 1.00 16.16 O ATOM 370 CB TYR A 532 17.034 55.086 14.207 1.00 13.32 C ATOM 371 CG TYR A 532 17.478 54.501 15.532 1.00 15.37 C ATOM 372 CD1 TYR A 532 18.238 53.337 15.577 1.00 20.80 C ATOM 373 CD2 TYR A 532 17.158 55.121 16.733 1.00 18.55 C ATOM 374 CE1 TYR A 532 18.672 52.810 16.778 1.00 22.20 C ATOM 375 CE2 TYR A 532 17.591 54.598 17.946 1.00 19.38 C ATOM 376 CZ TYR A 532 18.350 53.442 17.955 1.00 23.81 C ATOM 377 OH TYR A 532 18.812 52.918 19.144 1.00 28.19 O ATOM 378 HA TYR A 532 16.362 53.309 13.206 1.00 0.00 H ATOM 379 HB3 TYR A 532 16.651 56.091 14.385 1.00 0.00 H ATOM 380 HB2 TYR A 532 17.900 55.140 13.547 1.00 0.00 H ATOM 381 HD2 TYR A 532 16.558 56.031 16.724 1.00 0.00 H ATOM 382 HE2 TYR A 532 17.335 55.095 18.882 1.00 0.00 H ATOM 383 HE1 TYR A 532 19.267 51.897 16.792 1.00 0.00 H ATOM 384 HD1 TYR A 532 18.496 52.831 14.647 1.00 0.00 H ATOM 385 HH TYR A 532 19.333 52.096 18.961 1.00 0.00 H ATOM 386 H TYR A 532 15.197 55.999 12.469 1.00 0.00 H ATOM 387 N LEU A 533 14.490 52.808 14.797 1.00 14.98 N ATOM 388 CA LEU A 533 13.376 52.478 15.681 1.00 17.84 C ATOM 389 C LEU A 533 13.916 51.681 16.862 1.00 21.28 C ATOM 390 O LEU A 533 14.479 50.602 16.684 1.00 28.36 O ATOM 391 CB LEU A 533 12.341 51.647 14.917 1.00 18.41 C ATOM 392 CG LEU A 533 11.129 51.142 15.704 1.00 25.65 C ATOM 393 CD1 LEU A 533 10.243 52.312 16.128 1.00 19.09 C ATOM 394 CD2 LEU A 533 10.349 50.172 14.820 1.00 27.14 C ATOM 395 HA LEU A 533 12.897 53.389 16.038 1.00 0.00 H ATOM 396 HB2 LEU A 533 11.967 52.261 14.098 1.00 0.00 H ATOM 397 HB3 LEU A 533 12.855 50.776 14.511 1.00 0.00 H ATOM 398 HG LEU A 533 11.461 50.632 16.608 1.00 0.00 H ATOM 399 HD21 LEU A 533 10.020 50.689 13.919 1.00 0.00 H ATOM 400 HD22 LEU A 533 10.991 49.335 14.546 1.00 0.00 H ATOM 401 HD23 LEU A 533 9.481 49.802 15.366 1.00 0.00 H ATOM 402 HD11 LEU A 533 10.817 52.992 16.758 1.00 0.00 H ATOM 403 HD12 LEU A 533 9.895 52.842 15.242 1.00 0.00 H ATOM 404 HD13 LEU A 533 9.387 51.934 16.686 1.00 0.00 H ATOM 405 H LEU A 533 15.080 52.040 14.419 1.00 0.00 H ATOM 406 N ALA A 534 13.756 52.216 18.066 1.00 17.98 N ATOM 407 CA ALA A 534 14.385 51.614 19.238 1.00 21.16 C ATOM 408 C ALA A 534 13.402 51.449 20.383 1.00 21.18 C ATOM 409 O ALA A 534 12.414 52.177 20.483 1.00 17.53 O ATOM 410 CB ALA A 534 15.557 52.458 19.688 1.00 26.04 C ATOM 411 HA ALA A 534 14.735 50.622 18.951 1.00 0.00 H ATOM 412 HB1 ALA A 534 16.288 52.522 18.882 1.00 0.00 H ATOM 413 HB2 ALA A 534 15.206 53.458 19.943 1.00 0.00 H ATOM 414 HB3 ALA A 534 16.019 52.000 20.563 1.00 0.00 H ATOM 415 H ALA A 534 13.177 53.073 18.176 1.00 0.00 H ATOM 416 N TRP A 535 13.689 50.487 21.251 1.00 17.80 N ATOM 417 CA TRP A 535 12.838 50.210 22.395 1.00 16.11 C ATOM 418 C TRP A 535 13.530 50.665 23.663 1.00 18.75 C ATOM 419 O TRP A 535 14.745 50.502 23.810 1.00 22.18 O ATOM 420 CB TRP A 535 12.556 48.711 22.486 1.00 17.21 C ATOM 421 CG TRP A 535 11.732 48.334 23.662 1.00 19.28 C ATOM 422 CD1 TRP A 535 10.367 48.358 23.750 1.00 23.55 C ATOM 423 CD2 TRP A 535 12.209 47.871 24.931 1.00 21.30 C ATOM 424 NE1 TRP A 535 9.968 47.942 24.996 1.00 22.37 N ATOM 425 CE2 TRP A 535 11.079 47.637 25.741 1.00 20.38 C ATOM 426 CE3 TRP A 535 13.481 47.632 25.461 1.00 26.48 C ATOM 427 CZ2 TRP A 535 11.182 47.172 27.052 1.00 23.84 C ATOM 428 CZ3 TRP A 535 13.581 47.171 26.765 1.00 27.42 C ATOM 429 CH2 TRP A 535 12.436 46.946 27.545 1.00 21.71 C ATOM 430 HA TRP A 535 11.897 50.747 22.275 1.00 0.00 H ATOM 431 HB2 TRP A 535 12.030 48.403 21.583 1.00 0.00 H ATOM 432 HB3 TRP A 535 13.508 48.184 22.548 1.00 0.00 H ATOM 433 HE1 TRP A 535 8.983 47.870 25.322 1.00 0.00 H ATOM 434 HD1 TRP A 535 9.695 48.663 22.948 1.00 0.00 H ATOM 435 HZ2 TRP A 535 10.295 46.995 27.661 1.00 0.00 H ATOM 436 HH2 TRP A 535 12.550 46.583 28.566 1.00 0.00 H ATOM 437 HZ3 TRP A 535 14.566 46.980 27.192 1.00 0.00 H ATOM 438 HE3 TRP A 535 14.375 47.804 24.862 1.00 0.00 H ATOM 439 H TRP A 535 14.546 49.916 21.108 1.00 0.00 H ATOM 440 N VAL A 536 12.755 51.244 24.570 1.00 15.80 N ATOM 441 CA VAL A 536 13.220 51.507 25.928 1.00 17.35 C ATOM 442 C VAL A 536 12.168 51.023 26.914 1.00 23.14 C ATOM 443 O VAL A 536 10.985 50.933 26.591 1.00 16.95 O ATOM 444 CB VAL A 536 13.472 53.011 26.181 1.00 16.43 C ATOM 445 CG1 VAL A 536 14.554 53.528 25.244 1.00 18.03 C ATOM 446 CG2 VAL A 536 12.175 53.801 26.014 1.00 18.80 C ATOM 447 HA VAL A 536 14.164 50.978 26.060 1.00 0.00 H ATOM 448 HB VAL A 536 13.819 53.145 27.206 1.00 0.00 H ATOM 449 HG11 VAL A 536 15.478 52.977 25.419 1.00 0.00 H ATOM 450 HG12 VAL A 536 14.236 53.388 24.211 1.00 0.00 H ATOM 451 HG13 VAL A 536 14.721 54.588 25.434 1.00 0.00 H ATOM 452 HG21 VAL A 536 11.798 53.668 25.000 1.00 0.00 H ATOM 453 HG22 VAL A 536 11.436 53.438 26.728 1.00 0.00 H ATOM 454 HG23 VAL A 536 12.369 54.858 26.195 1.00 0.00 H ATOM 455 H VAL A 536 11.787 51.519 24.306 1.00 0.00 H ATOM 456 N PRO A 537 12.587 50.691 28.135 1.00 19.00 N ATOM 457 CA PRO A 537 11.613 50.227 29.127 1.00 19.61 C ATOM 458 C PRO A 537 10.738 51.355 29.677 1.00 18.82 C ATOM 459 O PRO A 537 11.229 52.433 30.002 1.00 17.71 O ATOM 460 CB PRO A 537 12.482 49.587 30.207 1.00 19.12 C ATOM 461 CG PRO A 537 13.804 50.298 30.088 1.00 23.97 C ATOM 462 CD PRO A 537 13.975 50.588 28.619 1.00 19.59 C ATOM 463 HA PRO A 537 10.889 49.533 28.700 1.00 0.00 H ATOM 464 HD3 PRO A 537 14.514 51.523 28.464 1.00 0.00 H ATOM 465 HD2 PRO A 537 14.505 49.777 28.119 1.00 0.00 H ATOM 466 HG3 PRO A 537 14.613 49.662 30.448 1.00 0.00 H ATOM 467 HG2 PRO A 537 13.791 51.225 30.661 1.00 0.00 H ATOM 468 HB2 PRO A 537 12.047 49.741 31.195 1.00 0.00 H ATOM 469 HB3 PRO A 537 12.600 48.519 30.026 1.00 0.00 H ATOM 470 N ALA A 538 9.440 51.082 29.786 1.00 15.75 N ATOM 471 CA ALA A 538 8.477 52.045 30.312 1.00 17.18 C ATOM 472 C ALA A 538 8.722 52.341 31.793 1.00 16.99 C ATOM 473 O ALA A 538 9.118 51.451 32.551 1.00 19.48 O ATOM 474 CB ALA A 538 7.063 51.506 30.126 1.00 16.74 C ATOM 475 HA ALA A 538 8.599 52.977 29.760 1.00 0.00 H ATOM 476 HB1 ALA A 538 6.873 51.345 29.065 1.00 0.00 H ATOM 477 HB2 ALA A 538 6.962 50.562 30.661 1.00 0.00 H ATOM 478 HB3 ALA A 538 6.346 52.227 30.519 1.00 0.00 H ATOM 479 H ALA A 538 9.099 50.147 29.485 1.00 0.00 H ATOM 480 N HIS A 539 8.462 53.585 32.189 1.00 15.95 N ATOM 481 CA HIS A 539 8.501 53.999 33.587 1.00 21.25 C ATOM 482 C HIS A 539 9.855 53.758 34.238 1.00 24.32 C ATOM 483 O HIS A 539 9.945 53.302 35.382 1.00 23.77 O ATOM 484 CB HIS A 539 7.386 53.290 34.350 1.00 18.83 C ATOM 485 CG HIS A 539 6.025 53.622 33.826 1.00 24.24 C ATOM 486 ND1 HIS A 539 5.451 54.864 33.998 1.00 18.61 N ATOM 487 CD2 HIS A 539 5.166 52.914 33.053 1.00 19.97 C ATOM 488 CE1 HIS A 539 4.300 54.907 33.351 1.00 17.94 C ATOM 489 NE2 HIS A 539 4.103 53.738 32.768 1.00 19.76 N ATOM 490 HA HIS A 539 8.344 55.077 33.623 1.00 0.00 H ATOM 491 HB2 HIS A 539 7.538 52.214 34.269 1.00 0.00 H ATOM 492 HB3 HIS A 539 7.438 53.585 35.398 1.00 0.00 H ATOM 493 HD2 HIS A 539 5.294 51.884 32.720 1.00 0.00 H ATOM 494 HE1 HIS A 539 3.626 55.763 33.306 1.00 0.00 H ATOM 495 H HIS A 539 8.220 54.295 31.468 1.00 0.00 H ATOM 496 N LYS A 540 10.910 54.068 33.493 1.00 22.61 N ATOM 497 CA LYS A 540 12.267 53.936 34.001 1.00 27.69 C ATOM 498 C LYS A 540 13.001 55.264 33.904 1.00 31.60 C ATOM 499 O LYS A 540 14.227 55.300 33.865 1.00 36.73 O ATOM 500 CB LYS A 540 13.026 52.864 33.222 1.00 31.35 C ATOM 501 CG LYS A 540 12.606 51.436 33.550 1.00 38.56 C ATOM 502 CD LYS A 540 13.041 51.052 34.956 1.00 36.31 C ATOM 503 CE LYS A 540 11.851 50.702 35.836 1.00 74.48 C ATOM 504 NZ LYS A 540 11.160 49.472 35.372 1.00 41.69 N ATOM 505 HA LYS A 540 12.214 53.639 35.048 1.00 0.00 H ATOM 506 HB2 LYS A 540 12.861 53.033 32.158 1.00 0.00 H ATOM 507 HB3 LYS A 540 14.088 52.968 33.444 1.00 0.00 H ATOM 508 HG2 LYS A 540 11.521 51.357 33.478 1.00 0.00 H ATOM 509 HG3 LYS A 540 13.067 50.755 32.835 1.00 0.00 H ATOM 510 HD2 LYS A 540 13.704 50.189 34.898 1.00 0.00 H ATOM 511 HD3 LYS A 540 13.576 51.890 35.402 1.00 0.00 H ATOM 512 HE2 LYS A 540 11.144 51.531 35.819 1.00 0.00 H ATOM 513 HE3 LYS A 540 12.201 50.546 36.856 1.00 0.00 H ATOM 514 HZ1 LYS A 540 10.816 49.614 34.401 1.00 0.00 H ATOM 515 HZ2 LYS A 540 11.826 48.673 35.392 1.00 0.00 H ATOM 516 HZ3 LYS A 540 10.356 49.270 36.000 1.00 0.00 H ATOM 517 H LYS A 540 10.763 54.413 32.523 1.00 0.00 H ATOM 518 N GLY A 541 12.241 56.352 33.850 1.00 32.52 N ATOM 519 CA GLY A 541 12.831 57.669 34.011 1.00 34.57 C ATOM 520 C GLY A 541 13.432 58.280 32.759 1.00 36.42 C ATOM 521 O GLY A 541 13.997 59.370 32.820 1.00 35.27 O ATOM 522 HA3 GLY A 541 13.620 57.593 34.759 1.00 0.00 H ATOM 523 HA2 GLY A 541 12.054 58.342 34.372 1.00 0.00 H ATOM 524 H GLY A 541 11.217 56.260 33.691 1.00 0.00 H ATOM 525 N ILE A 542 13.320 57.589 31.628 1.00 27.21 N ATOM 526 CA ILE A 542 13.792 58.136 30.364 1.00 21.30 C ATOM 527 C ILE A 542 12.914 59.335 30.004 1.00 35.73 C ATOM 528 O ILE A 542 11.695 59.206 29.866 1.00 28.16 O ATOM 529 CB ILE A 542 13.724 57.073 29.251 1.00 24.31 C ATOM 530 CG1 ILE A 542 14.667 55.917 29.590 1.00 34.03 C ATOM 531 CG2 ILE A 542 14.078 57.696 27.905 1.00 31.81 C ATOM 532 CD1 ILE A 542 14.606 54.769 28.624 1.00 55.95 C ATOM 533 HA ILE A 542 14.832 58.447 30.463 1.00 0.00 H ATOM 534 HB ILE A 542 12.709 56.683 29.181 1.00 0.00 H ATOM 535 HG12 ILE A 542 15.687 56.300 29.602 1.00 0.00 H ATOM 536 HG13 ILE A 542 14.409 55.544 30.581 1.00 0.00 H ATOM 537 HD11 ILE A 542 13.595 54.363 28.607 1.00 0.00 H ATOM 538 HD12 ILE A 542 14.874 55.120 27.627 1.00 0.00 H ATOM 539 HD13 ILE A 542 15.305 53.994 28.938 1.00 0.00 H ATOM 540 HG21 ILE A 542 13.372 58.495 27.679 1.00 0.00 H ATOM 541 HG22 ILE A 542 15.088 58.103 27.949 1.00 0.00 H ATOM 542 HG23 ILE A 542 14.026 56.933 27.128 1.00 0.00 H ATOM 543 H ILE A 542 12.888 56.643 31.647 1.00 0.00 H ATOM 544 N GLY A 543 13.542 60.499 29.859 1.00 28.54 N ATOM 545 CA GLY A 543 12.811 61.754 29.903 1.00 28.91 C ATOM 546 C GLY A 543 11.706 61.907 28.876 1.00 31.73 C ATOM 547 O GLY A 543 10.567 62.236 29.226 1.00 22.14 O ATOM 548 HA3 GLY A 543 13.525 62.563 29.750 1.00 0.00 H ATOM 549 HA2 GLY A 543 12.364 61.847 30.893 1.00 0.00 H ATOM 550 H GLY A 543 14.571 60.511 29.712 1.00 0.00 H ATOM 551 N GLY A 544 12.034 61.670 27.610 1.00 26.28 N ATOM 552 CA GLY A 544 11.045 61.837 26.559 1.00 15.54 C ATOM 553 C GLY A 544 9.900 60.862 26.719 1.00 16.60 C ATOM 554 O GLY A 544 8.734 61.197 26.513 1.00 17.25 O ATOM 555 HA3 GLY A 544 11.522 61.669 25.593 1.00 0.00 H ATOM 556 HA2 GLY A 544 10.654 62.854 26.598 1.00 0.00 H ATOM 557 H GLY A 544 12.999 61.365 27.372 1.00 0.00 H ATOM 558 N ASN A 545 10.246 59.646 27.105 1.00 17.44 N ATOM 559 CA ASN A 545 9.268 58.585 27.298 1.00 17.71 C ATOM 560 C ASN A 545 8.312 58.899 28.449 1.00 18.28 C ATOM 561 O ASN A 545 7.101 58.692 28.342 1.00 16.07 O ATOM 562 CB ASN A 545 10.008 57.272 27.556 1.00 16.26 C ATOM 563 CG ASN A 545 9.081 56.154 27.967 1.00 18.94 C ATOM 564 OD1 ASN A 545 8.911 55.886 29.157 1.00 18.69 O ATOM 565 ND2 ASN A 545 8.466 55.501 26.986 1.00 16.60 N ATOM 566 HA ASN A 545 8.662 58.499 26.396 1.00 0.00 H ATOM 567 HB2 ASN A 545 10.527 56.978 26.643 1.00 0.00 H ATOM 568 HB3 ASN A 545 10.736 57.432 28.351 1.00 0.00 H ATOM 569 HD22 ASN A 545 8.642 55.764 25.995 1.00 0.00 H ATOM 570 HD21 ASN A 545 7.808 54.727 27.209 1.00 0.00 H ATOM 571 H ASN A 545 11.251 59.440 27.277 1.00 0.00 H ATOM 572 N GLU A 546 8.840 59.412 29.555 1.00 17.80 N ATOM 573 CA GLU A 546 7.973 59.750 30.676 1.00 22.38 C ATOM 574 C GLU A 546 7.008 60.857 30.272 1.00 20.59 C ATOM 575 O GLU A 546 5.842 60.836 30.650 1.00 18.75 O ATOM 576 CB GLU A 546 8.796 60.186 31.896 1.00 24.48 C ATOM 577 CG GLU A 546 9.703 59.089 32.468 1.00 39.31 C ATOM 578 CD GLU A 546 8.937 57.946 33.137 1.00 71.41 C ATOM 579 OE1 GLU A 546 7.715 57.815 32.908 1.00 46.93 O ATOM 580 OE2 GLU A 546 9.562 57.173 33.897 1.00 32.50 O ATOM 581 HA GLU A 546 7.405 58.861 30.950 1.00 0.00 H ATOM 582 HB2 GLU A 546 9.422 61.029 31.603 1.00 0.00 H ATOM 583 HB3 GLU A 546 8.106 60.502 32.679 1.00 0.00 H ATOM 584 HG2 GLU A 546 10.298 58.675 31.654 1.00 0.00 H ATOM 585 HG3 GLU A 546 10.365 59.540 33.208 1.00 0.00 H ATOM 586 H GLU A 546 9.866 59.571 29.620 1.00 0.00 H ATOM 587 N GLN A 547 7.492 61.815 29.488 1.00 18.31 N ATOM 588 CA GLN A 547 6.660 62.935 29.076 1.00 18.13 C ATOM 589 C GLN A 547 5.499 62.499 28.197 1.00 22.97 C ATOM 590 O GLN A 547 4.369 62.933 28.401 1.00 18.62 O ATOM 591 CB GLN A 547 7.499 63.973 28.339 1.00 20.19 C ATOM 592 CG GLN A 547 8.361 64.814 29.263 1.00 23.34 C ATOM 593 CD GLN A 547 9.457 65.543 28.518 1.00 62.73 C ATOM 594 OE1 GLN A 547 10.632 65.445 28.870 1.00 54.47 O ATOM 595 NE2 GLN A 547 9.078 66.279 27.477 1.00 42.73 N ATOM 596 HA GLN A 547 6.243 63.373 29.983 1.00 0.00 H ATOM 597 HB2 GLN A 547 8.150 63.455 27.634 1.00 0.00 H ATOM 598 HB3 GLN A 547 6.828 64.636 27.793 1.00 0.00 H ATOM 599 HG2 GLN A 547 7.728 65.548 29.762 1.00 0.00 H ATOM 600 HG3 GLN A 547 8.817 64.162 30.008 1.00 0.00 H ATOM 601 HE22 GLN A 547 8.073 66.332 27.216 1.00 0.00 H ATOM 602 HE21 GLN A 547 9.787 66.801 26.924 1.00 0.00 H ATOM 603 H GLN A 547 8.479 61.763 29.165 1.00 0.00 H ATOM 604 N VAL A 548 5.758 61.634 27.222 1.00 19.15 N ATOM 605 CA VAL A 548 4.666 61.238 26.352 1.00 13.41 C ATOM 606 C VAL A 548 3.714 60.296 27.086 1.00 14.92 C ATOM 607 O VAL A 548 2.510 60.337 26.870 1.00 13.02 O ATOM 608 CB VAL A 548 5.170 60.591 25.022 1.00 13.27 C ATOM 609 CG1 VAL A 548 5.938 59.289 25.277 1.00 15.97 C ATOM 610 CG2 VAL A 548 3.977 60.327 24.108 1.00 15.66 C ATOM 611 HA VAL A 548 4.126 62.144 26.078 1.00 0.00 H ATOM 612 HB VAL A 548 5.860 61.286 24.544 1.00 0.00 H ATOM 613 HG11 VAL A 548 6.803 59.496 25.907 1.00 0.00 H ATOM 614 HG12 VAL A 548 5.284 58.576 25.779 1.00 0.00 H ATOM 615 HG13 VAL A 548 6.270 58.873 24.326 1.00 0.00 H ATOM 616 HG21 VAL A 548 3.283 59.649 24.605 1.00 0.00 H ATOM 617 HG22 VAL A 548 3.473 61.268 23.889 1.00 0.00 H ATOM 618 HG23 VAL A 548 4.325 59.876 23.179 1.00 0.00 H ATOM 619 H VAL A 548 6.716 61.252 27.086 1.00 0.00 H ATOM 620 N ASP A 549 4.238 59.464 27.978 1.00 15.51 N ATOM 621 CA ASP A 549 3.351 58.618 28.766 1.00 16.71 C ATOM 622 C ASP A 549 2.373 59.449 29.597 1.00 17.25 C ATOM 623 O ASP A 549 1.194 59.106 29.699 1.00 18.33 O ATOM 624 CB ASP A 549 4.149 57.692 29.688 1.00 16.05 C ATOM 625 CG ASP A 549 3.263 56.968 30.686 1.00 18.77 C ATOM 626 OD1 ASP A 549 3.104 57.470 31.823 1.00 21.73 O ATOM 627 OD2 ASP A 549 2.718 55.901 30.339 1.00 16.47 O ATOM 628 HA ASP A 549 2.780 58.013 28.061 1.00 0.00 H ATOM 629 HB2 ASP A 549 4.668 56.952 29.078 1.00 0.00 H ATOM 630 HB3 ASP A 549 4.880 58.287 30.235 1.00 0.00 H ATOM 631 H ASP A 549 5.268 59.417 28.113 1.00 0.00 H ATOM 632 N LYS A 550 2.855 60.540 30.186 1.00 18.43 N ATOM 633 CA LYS A 550 1.978 61.412 30.966 1.00 19.07 C ATOM 634 C LYS A 550 0.876 62.000 30.078 1.00 22.07 C ATOM 635 O LYS A 550 -0.279 62.104 30.483 1.00 22.79 O ATOM 636 CB LYS A 550 2.793 62.538 31.615 1.00 21.60 C ATOM 637 CG LYS A 550 1.968 63.499 32.455 1.00 50.02 C ATOM 638 CD LYS A 550 2.860 64.484 33.200 1.00 60.92 C ATOM 639 CE LYS A 550 2.050 65.385 34.118 1.00 49.67 C ATOM 640 NZ LYS A 550 1.057 66.205 33.371 1.00 56.32 N ATOM 641 HA LYS A 550 1.509 60.819 31.751 1.00 0.00 H ATOM 642 HB2 LYS A 550 3.550 62.087 32.256 1.00 0.00 H ATOM 643 HB3 LYS A 550 3.281 63.107 30.824 1.00 0.00 H ATOM 644 HG2 LYS A 550 1.293 64.053 31.802 1.00 0.00 H ATOM 645 HG3 LYS A 550 1.385 62.929 33.179 1.00 0.00 H ATOM 646 HD2 LYS A 550 3.582 63.927 33.797 1.00 0.00 H ATOM 647 HD3 LYS A 550 3.390 65.101 32.474 1.00 0.00 H ATOM 648 HE2 LYS A 550 2.731 66.053 34.645 1.00 0.00 H ATOM 649 HE3 LYS A 550 1.520 64.764 34.841 1.00 0.00 H ATOM 650 HZ1 LYS A 550 1.553 66.807 32.683 1.00 0.00 H ATOM 651 HZ2 LYS A 550 0.397 65.577 32.870 1.00 0.00 H ATOM 652 HZ3 LYS A 550 0.530 66.802 34.039 1.00 0.00 H ATOM 653 H LYS A 550 3.864 60.775 30.091 1.00 0.00 H ATOM 654 N LEU A 551 1.237 62.370 28.857 1.00 22.82 N ATOM 655 CA LEU A 551 0.283 62.951 27.918 1.00 24.19 C ATOM 656 C LEU A 551 -0.837 61.981 27.520 1.00 24.14 C ATOM 657 O LEU A 551 -2.019 62.341 27.524 1.00 22.00 O ATOM 658 CB LEU A 551 1.039 63.423 26.673 1.00 26.80 C ATOM 659 CG LEU A 551 0.524 64.618 25.872 1.00 26.55 C ATOM 660 CD1 LEU A 551 0.193 65.795 26.787 1.00 20.66 C ATOM 661 CD2 LEU A 551 1.598 65.000 24.862 1.00 24.62 C ATOM 662 HA LEU A 551 -0.202 63.790 28.417 1.00 0.00 H ATOM 663 HB2 LEU A 551 2.050 63.672 26.995 1.00 0.00 H ATOM 664 HB3 LEU A 551 1.075 62.577 25.987 1.00 0.00 H ATOM 665 HG LEU A 551 -0.399 64.350 25.358 1.00 0.00 H ATOM 666 HD21 LEU A 551 2.514 65.265 25.390 1.00 0.00 H ATOM 667 HD22 LEU A 551 1.790 64.155 24.200 1.00 0.00 H ATOM 668 HD23 LEU A 551 1.256 65.852 24.275 1.00 0.00 H ATOM 669 HD11 LEU A 551 -0.576 65.495 27.499 1.00 0.00 H ATOM 670 HD12 LEU A 551 1.091 66.098 27.326 1.00 0.00 H ATOM 671 HD13 LEU A 551 -0.171 66.629 26.187 1.00 0.00 H ATOM 672 H LEU A 551 2.226 62.243 28.561 1.00 0.00 H ATOM 673 N VAL A 552 -0.486 60.748 27.165 1.00 17.01 N ATOM 674 CA VAL A 552 -1.517 59.846 26.665 1.00 15.35 C ATOM 675 C VAL A 552 -2.303 59.185 27.798 1.00 17.30 C ATOM 676 O VAL A 552 -3.393 58.674 27.582 1.00 19.53 O ATOM 677 CB VAL A 552 -0.928 58.750 25.728 1.00 20.84 C ATOM 678 CG1 VAL A 552 -0.196 59.415 24.561 1.00 18.07 C ATOM 679 CG2 VAL A 552 0.002 57.807 26.504 1.00 20.04 C ATOM 680 HA VAL A 552 -2.202 60.466 26.087 1.00 0.00 H ATOM 681 HB VAL A 552 -1.743 58.145 25.331 1.00 0.00 H ATOM 682 HG11 VAL A 552 -0.896 60.035 24.001 1.00 0.00 H ATOM 683 HG12 VAL A 552 0.612 60.036 24.947 1.00 0.00 H ATOM 684 HG13 VAL A 552 0.215 58.647 23.907 1.00 0.00 H ATOM 685 HG21 VAL A 552 0.824 58.381 26.933 1.00 0.00 H ATOM 686 HG22 VAL A 552 -0.559 57.321 27.302 1.00 0.00 H ATOM 687 HG23 VAL A 552 0.399 57.052 25.826 1.00 0.00 H ATOM 688 H VAL A 552 0.502 60.434 27.242 1.00 0.00 H ATOM 689 N SER A 553 -1.748 59.210 29.004 1.00 20.95 N ATOM 690 CA SER A 553 -2.397 58.535 30.120 1.00 22.76 C ATOM 691 C SER A 553 -3.382 59.461 30.820 1.00 25.74 C ATOM 692 O SER A 553 -4.294 58.997 31.505 1.00 27.63 O ATOM 693 CB SER A 553 -1.359 58.019 31.122 1.00 24.42 C ATOM 694 OG SER A 553 -0.653 59.083 31.725 1.00 16.31 O ATOM 695 HA SER A 553 -2.948 57.685 29.718 1.00 0.00 H ATOM 696 HB2 SER A 553 -0.652 57.374 30.600 1.00 0.00 H ATOM 697 HB3 SER A 553 -1.868 57.446 31.897 1.00 0.00 H ATOM 698 HG SER A 553 -0.184 59.604 31.026 1.00 0.00 H ATOM 699 H SER A 553 -0.849 59.712 29.152 1.00 0.00 H ATOM 700 N ALA A 554 -3.206 60.764 30.628 1.00 28.53 N ATOM 701 CA ALA A 554 -4.098 61.751 31.224 1.00 32.80 C ATOM 702 C ALA A 554 -5.539 61.492 30.806 1.00 33.91 C ATOM 703 O ALA A 554 -5.851 61.406 29.617 1.00 32.95 O ATOM 704 CB ALA A 554 -3.677 63.151 30.810 1.00 27.83 C ATOM 705 HA ALA A 554 -4.033 61.667 32.309 1.00 0.00 H ATOM 706 HB1 ALA A 554 -2.658 63.338 31.149 1.00 0.00 H ATOM 707 HB2 ALA A 554 -3.722 63.236 29.724 1.00 0.00 H ATOM 708 HB3 ALA A 554 -4.350 63.880 31.261 1.00 0.00 H ATOM 709 H ALA A 554 -2.413 61.087 30.038 1.00 0.00 H ATOM 710 N GLY A 555 -6.418 61.357 31.790 1.00 38.44 N ATOM 711 CA GLY A 555 -7.818 61.127 31.487 1.00 31.34 C ATOM 712 C GLY A 555 -8.095 59.732 30.963 1.00 34.62 C ATOM 713 O GLY A 555 -9.221 59.432 30.568 1.00 40.73 O ATOM 714 HA3 GLY A 555 -8.133 61.849 30.734 1.00 0.00 H ATOM 715 HA2 GLY A 555 -8.399 61.277 32.397 1.00 0.00 H ATOM 716 H GLY A 555 -6.103 61.416 32.780 1.00 0.00 H ATOM 717 N ILE A 556 -7.073 58.879 30.956 1.00 26.62 N ATOM 718 CA ILE A 556 -7.213 57.518 30.452 1.00 24.90 C ATOM 719 C ILE A 556 -6.832 56.492 31.516 1.00 26.89 C ATOM 720 O ILE A 556 -7.567 55.539 31.765 1.00 34.72 O ATOM 721 CB ILE A 556 -6.310 57.270 29.214 1.00 26.87 C ATOM 722 CG1 ILE A 556 -6.620 58.291 28.117 1.00 27.09 C ATOM 723 CG2 ILE A 556 -6.546 55.861 28.673 1.00 25.40 C ATOM 724 CD1 ILE A 556 -7.908 58.025 27.386 1.00 30.84 C ATOM 725 HA ILE A 556 -8.261 57.403 30.175 1.00 0.00 H ATOM 726 HB ILE A 556 -5.268 57.376 29.517 1.00 0.00 H ATOM 727 HG12 ILE A 556 -6.682 59.279 28.574 1.00 0.00 H ATOM 728 HG13 ILE A 556 -5.805 58.277 27.394 1.00 0.00 H ATOM 729 HD11 ILE A 556 -7.860 57.045 26.912 1.00 0.00 H ATOM 730 HD12 ILE A 556 -8.737 58.047 28.093 1.00 0.00 H ATOM 731 HD13 ILE A 556 -8.057 58.791 26.625 1.00 0.00 H ATOM 732 HG21 ILE A 556 -6.306 55.131 29.446 1.00 0.00 H ATOM 733 HG22 ILE A 556 -7.591 55.755 28.384 1.00 0.00 H ATOM 734 HG23 ILE A 556 -5.909 55.695 27.805 1.00 0.00 H ATOM 735 H ILE A 556 -6.150 59.192 31.320 1.00 0.00 H ATOM 736 N ARG A 557 -5.669 56.681 32.128 1.00 26.57 N ATOM 737 CA ARG A 557 -5.190 55.743 33.127 1.00 30.39 C ATOM 738 C ARG A 557 -5.324 56.358 34.505 1.00 37.13 C ATOM 739 O ARG A 557 -4.699 57.377 34.810 1.00 48.55 O ATOM 740 CB ARG A 557 -3.725 55.361 32.866 1.00 32.16 C ATOM 741 CG ARG A 557 -3.200 54.266 33.800 1.00 33.96 C ATOM 742 CD ARG A 557 -1.727 53.963 33.544 1.00 32.91 C ATOM 743 NE ARG A 557 -0.869 55.097 33.884 1.00 32.20 N ATOM 744 CZ ARG A 557 0.194 55.467 33.175 1.00 31.02 C ATOM 745 NH1 ARG A 557 0.536 54.792 32.087 1.00 21.94 N ATOM 746 NH2 ARG A 557 0.905 56.520 33.543 1.00 25.34 N ATOM 747 HA ARG A 557 -5.793 54.837 33.069 1.00 0.00 H ATOM 748 HB2 ARG A 557 -3.639 55.008 31.838 1.00 0.00 H ATOM 749 HB3 ARG A 557 -3.108 56.250 32.997 1.00 0.00 H ATOM 750 HG2 ARG A 557 -3.319 54.595 34.832 1.00 0.00 H ATOM 751 HG3 ARG A 557 -3.781 53.357 33.641 1.00 0.00 H ATOM 752 HD2 ARG A 557 -1.594 53.725 32.489 1.00 0.00 H ATOM 753 HD3 ARG A 557 -1.433 53.105 34.149 1.00 0.00 H ATOM 754 HE ARG A 557 -1.105 55.649 34.733 1.00 0.00 H ATOM 755 HH12 ARG A 557 1.367 55.083 31.534 1.00 0.00 H ATOM 756 HH11 ARG A 557 -0.027 53.971 31.786 1.00 0.00 H ATOM 757 HH22 ARG A 557 1.736 56.807 32.987 1.00 0.00 H ATOM 758 HH21 ARG A 557 0.633 57.061 34.389 1.00 0.00 H ATOM 759 H ARG A 557 -5.093 57.513 31.888 1.00 0.00 H ATOM 760 N LYS A 558 -6.155 55.729 35.326 1.00 57.62 N ATOM 761 CA LYS A 558 -6.373 56.153 36.700 1.00 69.26 C ATOM 762 C LYS A 558 -5.036 56.416 37.384 1.00 59.23 C ATOM 763 O LYS A 558 -4.605 57.561 37.522 1.00 51.87 O ATOM 764 CB LYS A 558 -7.130 55.062 37.463 1.00 59.77 C ATOM 765 CG LYS A 558 -7.749 53.977 36.578 1.00 54.42 C ATOM 766 CD LYS A 558 -6.693 53.075 35.940 1.00 56.80 C ATOM 767 CE LYS A 558 -5.681 52.581 36.959 1.00 62.51 C ATOM 768 NZ LYS A 558 -4.656 51.695 36.336 1.00 65.31 N ATOM 769 HA LYS A 558 -6.961 57.071 36.698 1.00 0.00 H ATOM 770 HB2 LYS A 558 -6.434 54.583 38.152 1.00 0.00 H ATOM 771 HB3 LYS A 558 -7.931 55.537 38.030 1.00 0.00 H ATOM 772 HG2 LYS A 558 -8.412 53.363 37.188 1.00 0.00 H ATOM 773 HG3 LYS A 558 -8.325 54.456 35.787 1.00 0.00 H ATOM 774 HD2 LYS A 558 -7.189 52.215 35.490 1.00 0.00 H ATOM 775 HD3 LYS A 558 -6.169 53.637 35.167 1.00 0.00 H ATOM 776 HE2 LYS A 558 -6.205 52.024 37.735 1.00 0.00 H ATOM 777 HE3 LYS A 558 -5.181 53.440 37.405 1.00 0.00 H ATOM 778 HZ1 LYS A 558 -5.125 50.869 35.913 1.00 0.00 H ATOM 779 HZ2 LYS A 558 -4.147 52.222 35.598 1.00 0.00 H ATOM 780 HZ3 LYS A 558 -3.984 51.379 37.064 1.00 0.00 H ATOM 781 H LYS A 558 -6.672 54.899 34.972 1.00 0.00 H ATOM 782 N VAL A 559 -4.387 55.338 37.806 1.00 57.68 N ATOM 783 CA VAL A 559 -3.099 55.425 38.479 1.00 60.33 C ATOM 784 C VAL A 559 -2.155 54.379 37.899 1.00 49.66 C ATOM 785 O VAL A 559 -2.596 53.403 37.290 1.00 48.72 O ATOM 786 CB VAL A 559 -3.246 55.184 40.000 1.00 57.80 C ATOM 787 CG1 VAL A 559 -4.166 56.237 40.604 1.00 56.58 C ATOM 788 CG2 VAL A 559 -3.792 53.786 40.257 1.00 50.28 C ATOM 789 HA VAL A 559 -2.699 56.427 38.323 1.00 0.00 H ATOM 790 HB VAL A 559 -2.267 55.264 40.472 1.00 0.00 H ATOM 791 HG11 VAL A 559 -3.743 57.227 40.435 1.00 0.00 H ATOM 792 HG12 VAL A 559 -5.147 56.174 40.133 1.00 0.00 H ATOM 793 HG13 VAL A 559 -4.264 56.060 41.675 1.00 0.00 H ATOM 794 HG21 VAL A 559 -4.768 53.685 39.782 1.00 0.00 H ATOM 795 HG22 VAL A 559 -3.106 53.047 39.841 1.00 0.00 H ATOM 796 HG23 VAL A 559 -3.891 53.628 41.331 1.00 0.00 H ATOM 797 H VAL A 559 -4.812 54.402 37.651 1.00 0.00 H ATOM 798 N LEU A 560 -0.857 54.586 38.088 1.00 41.59 N ATOM 799 CA LEU A 560 0.137 53.685 37.522 1.00 45.34 C ATOM 800 C LEU A 560 0.185 52.370 38.296 1.00 61.80 C ATOM 801 O LEU A 560 -0.275 52.356 39.459 1.00 68.03 O ATOM 802 CB LEU A 560 1.515 54.353 37.541 1.00 43.63 C ATOM 803 CG LEU A 560 2.645 53.577 36.862 1.00 42.72 C ATOM 804 CD1 LEU A 560 2.239 53.253 35.440 1.00 32.05 C ATOM 805 CD2 LEU A 560 3.924 54.393 36.886 1.00 47.22 C ATOM 806 HA LEU A 560 -0.145 53.465 36.492 1.00 0.00 H ATOM 807 HB2 LEU A 560 1.425 55.318 37.042 1.00 0.00 H ATOM 808 HB3 LEU A 560 1.796 54.509 38.583 1.00 0.00 H ATOM 809 HG LEU A 560 2.829 52.646 37.399 1.00 0.00 H ATOM 810 HD21 LEU A 560 3.764 55.332 36.356 1.00 0.00 H ATOM 811 HD22 LEU A 560 4.202 54.601 37.919 1.00 0.00 H ATOM 812 HD23 LEU A 560 4.721 53.831 36.400 1.00 0.00 H ATOM 813 HD11 LEU A 560 1.333 52.647 35.451 1.00 0.00 H ATOM 814 HD12 LEU A 560 2.052 54.179 34.897 1.00 0.00 H ATOM 815 HD13 LEU A 560 3.041 52.700 34.952 1.00 0.00 H ATOM 816 H LEU A 560 -0.546 55.404 38.649 1.00 0.00 H TER 817 LEU A 560 ATOM 818 N MET A 426 13.465 53.483 2.027 1.00 21.46 N ATOM 819 CA MET A 426 14.179 52.669 3.055 1.00 28.09 C ATOM 820 C MET A 426 13.760 51.208 2.907 1.00 23.36 C ATOM 821 O MET A 426 12.585 50.919 2.708 1.00 23.45 O ATOM 822 CB MET A 426 13.816 53.178 4.454 1.00 25.34 C ATOM 823 CG MET A 426 14.655 52.612 5.584 1.00 41.94 C ATOM 824 SD MET A 426 13.630 52.280 7.028 1.00 46.41 S ATOM 825 CE MET A 426 12.478 51.078 6.272 1.00 29.87 C ATOM 826 HA MET A 426 15.257 52.755 2.916 1.00 0.00 H ATOM 827 HB2 MET A 426 13.930 54.262 4.459 1.00 0.00 H ATOM 828 HB3 MET A 426 12.774 52.923 4.646 1.00 0.00 H ATOM 829 HG2 MET A 426 15.429 53.331 5.851 1.00 0.00 H ATOM 830 HG3 MET A 426 15.122 51.684 5.254 1.00 0.00 H ATOM 831 HE1 MET A 426 11.954 51.552 5.442 1.00 0.00 H ATOM 832 HE2 MET A 426 13.040 50.219 5.906 1.00 0.00 H ATOM 833 HE3 MET A 426 11.756 50.750 7.019 1.00 0.00 H ATOM 834 HN3 MET A 426 12.438 53.395 2.168 1.00 0.00 H ATOM 835 HN2 MET A 426 13.716 53.139 1.078 1.00 0.00 H ATOM 836 HN1 MET A 426 13.745 54.480 2.121 1.00 0.00 H ATOM 837 N TYR A 427 14.712 50.285 2.996 1.00 24.22 N ATOM 838 CA TYR A 427 14.355 48.869 3.029 1.00 24.45 C ATOM 839 C TYR A 427 14.898 48.167 4.269 1.00 23.82 C ATOM 840 O TYR A 427 14.547 47.023 4.540 1.00 30.35 O ATOM 841 CB TYR A 427 14.845 48.147 1.763 1.00 27.43 C ATOM 842 CG TYR A 427 16.341 48.179 1.562 1.00 31.11 C ATOM 843 CD1 TYR A 427 17.141 47.117 1.971 1.00 44.02 C ATOM 844 CD2 TYR A 427 16.956 49.269 0.964 1.00 22.95 C ATOM 845 CE1 TYR A 427 18.513 47.144 1.788 1.00 39.44 C ATOM 846 CE2 TYR A 427 18.326 49.305 0.777 1.00 32.17 C ATOM 847 CZ TYR A 427 19.099 48.241 1.190 1.00 41.68 C ATOM 848 OH TYR A 427 20.463 48.279 1.001 1.00 52.61 O ATOM 849 HA TYR A 427 13.267 48.822 3.068 1.00 0.00 H ATOM 850 HB3 TYR A 427 14.375 48.618 0.899 1.00 0.00 H ATOM 851 HB2 TYR A 427 14.532 47.105 1.823 1.00 0.00 H ATOM 852 HD2 TYR A 427 16.349 50.112 0.635 1.00 0.00 H ATOM 853 HE2 TYR A 427 18.792 50.170 0.305 1.00 0.00 H ATOM 854 HE1 TYR A 427 19.126 46.304 2.114 1.00 0.00 H ATOM 855 HD1 TYR A 427 16.680 46.249 2.443 1.00 0.00 H ATOM 856 HH TYR A 427 20.867 47.445 1.350 1.00 0.00 H ATOM 857 H TYR A 427 15.711 50.571 3.042 1.00 0.00 H ATOM 858 N GLN A 428 15.753 48.852 5.021 1.00 21.61 N ATOM 859 CA GLN A 428 16.168 48.339 6.319 1.00 21.03 C ATOM 860 C GLN A 428 16.299 49.447 7.351 1.00 20.67 C ATOM 861 O GLN A 428 16.626 50.588 7.018 1.00 24.44 O ATOM 862 CB GLN A 428 17.492 47.580 6.202 1.00 30.96 C ATOM 863 CG GLN A 428 18.658 48.404 5.719 1.00 29.93 C ATOM 864 CD GLN A 428 19.824 47.534 5.272 1.00 58.88 C ATOM 865 OE1 GLN A 428 20.692 47.972 4.517 1.00 39.15 O ATOM 866 NE2 GLN A 428 19.845 46.291 5.738 1.00 39.76 N ATOM 867 HA GLN A 428 15.389 47.655 6.657 1.00 0.00 H ATOM 868 HB2 GLN A 428 17.743 47.183 7.186 1.00 0.00 H ATOM 869 HB3 GLN A 428 17.349 46.755 5.504 1.00 0.00 H ATOM 870 HG2 GLN A 428 18.332 49.016 4.878 1.00 0.00 H ATOM 871 HG3 GLN A 428 18.992 49.051 6.530 1.00 0.00 H ATOM 872 HE22 GLN A 428 19.091 45.961 6.374 1.00 0.00 H ATOM 873 HE21 GLN A 428 20.615 45.647 5.467 1.00 0.00 H ATOM 874 H GLN A 428 16.128 49.760 4.680 1.00 0.00 H ATOM 875 N LEU A 429 16.034 49.101 8.604 1.00 21.20 N ATOM 876 CA LEU A 429 16.154 50.049 9.701 1.00 16.07 C ATOM 877 C LEU A 429 17.617 50.320 10.034 1.00 20.71 C ATOM 878 O LEU A 429 18.474 49.445 9.863 1.00 20.43 O ATOM 879 CB LEU A 429 15.452 49.494 10.942 1.00 18.53 C ATOM 880 CG LEU A 429 13.935 49.318 10.840 1.00 26.08 C ATOM 881 CD1 LEU A 429 13.423 48.511 12.025 1.00 23.62 C ATOM 882 CD2 LEU A 429 13.275 50.693 10.804 1.00 22.04 C ATOM 883 HA LEU A 429 15.686 50.984 9.393 1.00 0.00 H ATOM 884 HB2 LEU A 429 15.886 48.518 11.161 1.00 0.00 H ATOM 885 HB3 LEU A 429 15.653 50.174 11.770 1.00 0.00 H ATOM 886 HG LEU A 429 13.688 48.777 9.926 1.00 0.00 H ATOM 887 HD21 LEU A 429 13.521 51.237 11.716 1.00 0.00 H ATOM 888 HD22 LEU A 429 13.640 51.247 9.939 1.00 0.00 H ATOM 889 HD23 LEU A 429 12.194 50.574 10.731 1.00 0.00 H ATOM 890 HD11 LEU A 429 13.899 47.530 12.028 1.00 0.00 H ATOM 891 HD12 LEU A 429 13.662 49.035 12.950 1.00 0.00 H ATOM 892 HD13 LEU A 429 12.343 48.392 11.942 1.00 0.00 H ATOM 893 H LEU A 429 15.733 48.127 8.807 1.00 0.00 H ATOM 894 N GLU A 430 17.888 51.530 10.520 1.00 18.84 N ATOM 895 CA GLU A 430 19.215 51.910 10.999 1.00 20.72 C ATOM 896 C GLU A 430 19.595 51.101 12.233 1.00 21.66 C ATOM 897 O GLU A 430 18.746 50.796 13.072 1.00 25.42 O ATOM 898 CB GLU A 430 19.247 53.401 11.358 1.00 18.65 C ATOM 899 CG GLU A 430 18.990 54.334 10.193 1.00 22.48 C ATOM 900 CD GLU A 430 19.991 54.147 9.071 1.00 32.07 C ATOM 901 OE1 GLU A 430 19.563 53.827 7.943 1.00 38.30 O ATOM 902 OE2 GLU A 430 21.204 54.315 9.318 1.00 33.39 O ATOM 903 HA GLU A 430 19.928 51.708 10.199 1.00 0.00 H ATOM 904 HB2 GLU A 430 18.486 53.585 12.116 1.00 0.00 H ATOM 905 HB3 GLU A 430 20.230 53.631 11.768 1.00 0.00 H ATOM 906 HG2 GLU A 430 17.989 54.143 9.805 1.00 0.00 H ATOM 907 HG3 GLU A 430 19.050 55.363 10.548 1.00 0.00 H ATOM 908 H GLU A 430 17.123 52.234 10.560 1.00 0.00 H ATOM 909 N LYS A 431 20.880 50.772 12.346 1.00 24.01 N ATOM 910 CA LYS A 431 21.396 50.088 13.527 1.00 24.29 C ATOM 911 C LYS A 431 21.618 51.054 14.686 1.00 21.24 C ATOM 912 O LYS A 431 21.648 50.645 15.848 1.00 28.16 O ATOM 913 CB LYS A 431 22.722 49.391 13.200 1.00 35.62 C ATOM 914 CG LYS A 431 22.635 48.369 12.075 1.00 39.80 C ATOM 915 CD LYS A 431 21.763 47.185 12.459 1.00 57.63 C ATOM 916 CE LYS A 431 21.720 46.155 11.340 1.00 69.43 C ATOM 917 NZ LYS A 431 20.859 44.989 11.681 1.00 83.66 N ATOM 918 HA LYS A 431 20.650 49.352 13.826 1.00 0.00 H ATOM 919 HB2 LYS A 431 23.446 50.153 12.913 1.00 0.00 H ATOM 920 HB3 LYS A 431 23.070 48.881 14.098 1.00 0.00 H ATOM 921 HG2 LYS A 431 22.211 48.849 11.193 1.00 0.00 H ATOM 922 HG3 LYS A 431 23.638 48.010 11.845 1.00 0.00 H ATOM 923 HD2 LYS A 431 22.169 46.719 13.357 1.00 0.00 H ATOM 924 HD3 LYS A 431 20.751 47.537 12.659 1.00 0.00 H ATOM 925 HE2 LYS A 431 22.733 45.800 11.150 1.00 0.00 H ATOM 926 HE3 LYS A 431 21.328 46.630 10.440 1.00 0.00 H ATOM 927 HZ1 LYS A 431 21.229 44.524 12.535 1.00 0.00 H ATOM 928 HZ2 LYS A 431 19.888 45.316 11.857 1.00 0.00 H ATOM 929 HZ3 LYS A 431 20.861 44.315 10.889 1.00 0.00 H ATOM 930 H LYS A 431 21.533 51.009 11.572 1.00 0.00 H ATOM 931 N GLU A 432 21.782 52.333 14.364 1.00 22.25 N ATOM 932 CA GLU A 432 22.107 53.349 15.362 1.00 21.98 C ATOM 933 C GLU A 432 21.322 54.629 15.111 1.00 19.53 C ATOM 934 O GLU A 432 20.863 54.876 13.997 1.00 21.59 O ATOM 935 CB GLU A 432 23.604 53.663 15.320 1.00 32.99 C ATOM 936 CG GLU A 432 24.483 52.442 15.499 1.00 31.76 C ATOM 937 CD GLU A 432 24.223 51.731 16.812 1.00 40.00 C ATOM 938 OE1 GLU A 432 24.663 50.569 16.952 1.00 39.23 O ATOM 939 OE2 GLU A 432 23.581 52.330 17.706 1.00 34.91 O ATOM 940 HA GLU A 432 21.838 52.956 16.343 1.00 0.00 H ATOM 941 HB2 GLU A 432 23.835 54.116 14.356 1.00 0.00 H ATOM 942 HB3 GLU A 432 23.831 54.371 16.117 1.00 0.00 H ATOM 943 HG2 GLU A 432 24.290 51.748 14.681 1.00 0.00 H ATOM 944 HG3 GLU A 432 25.527 52.754 15.470 1.00 0.00 H ATOM 945 H GLU A 432 21.676 52.620 13.370 1.00 0.00 H ATOM 946 N PRO A 433 21.170 55.468 16.147 1.00 21.70 N ATOM 947 CA PRO A 433 20.447 56.734 15.992 1.00 17.80 C ATOM 948 C PRO A 433 21.009 57.573 14.861 1.00 28.85 C ATOM 949 O PRO A 433 22.218 57.590 14.626 1.00 21.73 O ATOM 950 CB PRO A 433 20.625 57.417 17.346 1.00 19.22 C ATOM 951 CG PRO A 433 20.834 56.294 18.296 1.00 23.91 C ATOM 952 CD PRO A 433 21.624 55.270 17.533 1.00 22.64 C ATOM 953 HA PRO A 433 19.400 56.587 15.729 1.00 0.00 H ATOM 954 HD3 PRO A 433 22.695 55.452 17.625 1.00 0.00 H ATOM 955 HD2 PRO A 433 21.397 54.262 17.880 1.00 0.00 H ATOM 956 HG3 PRO A 433 19.877 55.879 18.614 1.00 0.00 H ATOM 957 HG2 PRO A 433 21.390 56.632 19.170 1.00 0.00 H ATOM 958 HB2 PRO A 433 21.490 58.080 17.334 1.00 0.00 H ATOM 959 HB3 PRO A 433 19.735 57.988 17.611 1.00 0.00 H ATOM 960 N ILE A 434 20.117 58.268 14.167 1.00 17.26 N ATOM 961 CA ILE A 434 20.496 59.144 13.064 1.00 20.06 C ATOM 962 C ILE A 434 20.830 60.524 13.622 1.00 27.00 C ATOM 963 O ILE A 434 19.980 61.205 14.199 1.00 19.06 O ATOM 964 CB ILE A 434 19.342 59.278 12.048 1.00 17.12 C ATOM 965 CG1 ILE A 434 18.916 57.894 11.556 1.00 18.44 C ATOM 966 CG2 ILE A 434 19.769 60.159 10.878 1.00 14.99 C ATOM 967 CD1 ILE A 434 17.501 57.864 10.975 1.00 19.99 C ATOM 968 HA ILE A 434 21.360 58.716 12.556 1.00 0.00 H ATOM 969 HB ILE A 434 18.490 59.749 12.538 1.00 0.00 H ATOM 970 HG12 ILE A 434 19.614 57.572 10.783 1.00 0.00 H ATOM 971 HG13 ILE A 434 18.960 57.200 12.395 1.00 0.00 H ATOM 972 HD11 ILE A 434 16.789 58.173 11.740 1.00 0.00 H ATOM 973 HD12 ILE A 434 17.444 58.546 10.126 1.00 0.00 H ATOM 974 HD13 ILE A 434 17.266 56.852 10.646 1.00 0.00 H ATOM 975 HG21 ILE A 434 20.035 61.149 11.249 1.00 0.00 H ATOM 976 HG22 ILE A 434 20.631 59.711 10.383 1.00 0.00 H ATOM 977 HG23 ILE A 434 18.945 60.244 10.170 1.00 0.00 H ATOM 978 H ILE A 434 19.111 58.185 14.419 1.00 0.00 H ATOM 979 N VAL A 435 22.085 60.927 13.462 1.00 21.85 N ATOM 980 CA VAL A 435 22.534 62.204 13.987 1.00 26.30 C ATOM 981 C VAL A 435 21.892 63.349 13.211 1.00 18.98 C ATOM 982 O VAL A 435 21.877 63.349 11.981 1.00 27.86 O ATOM 983 CB VAL A 435 24.071 62.312 13.896 1.00 29.23 C ATOM 984 CG1 VAL A 435 24.518 63.715 14.257 1.00 29.48 C ATOM 985 CG2 VAL A 435 24.705 61.299 14.830 1.00 33.24 C ATOM 986 HA VAL A 435 22.235 62.270 15.033 1.00 0.00 H ATOM 987 HB VAL A 435 24.388 62.102 12.874 1.00 0.00 H ATOM 988 HG11 VAL A 435 24.068 64.428 13.566 1.00 0.00 H ATOM 989 HG12 VAL A 435 24.203 63.945 15.275 1.00 0.00 H ATOM 990 HG13 VAL A 435 25.604 63.778 14.189 1.00 0.00 H ATOM 991 HG21 VAL A 435 24.386 61.500 15.853 1.00 0.00 H ATOM 992 HG22 VAL A 435 24.393 60.295 14.541 1.00 0.00 H ATOM 993 HG23 VAL A 435 25.790 61.376 14.765 1.00 0.00 H ATOM 994 H VAL A 435 22.757 60.318 12.953 1.00 0.00 H ATOM 995 N GLY A 436 21.334 64.308 13.940 1.00 26.99 N ATOM 996 CA GLY A 436 20.709 65.446 13.291 1.00 27.40 C ATOM 997 C GLY A 436 19.265 65.219 12.860 1.00 33.26 C ATOM 998 O GLY A 436 18.654 66.097 12.252 1.00 33.85 O ATOM 999 HA3 GLY A 436 21.293 65.695 12.405 1.00 0.00 H ATOM 1000 HA2 GLY A 436 20.728 66.286 13.985 1.00 0.00 H ATOM 1001 H GLY A 436 21.345 64.244 14.978 1.00 0.00 H ATOM 1002 N ALA A 437 18.715 64.045 13.155 1.00 18.80 N ATOM 1003 CA ALA A 437 17.305 63.796 12.874 1.00 17.08 C ATOM 1004 C ALA A 437 16.459 63.951 14.132 1.00 19.04 C ATOM 1005 O ALA A 437 16.905 63.665 15.237 1.00 21.58 O ATOM 1006 CB ALA A 437 17.117 62.404 12.295 1.00 18.86 C ATOM 1007 HA ALA A 437 16.975 64.535 12.143 1.00 0.00 H ATOM 1008 HB1 ALA A 437 17.684 62.318 11.368 1.00 0.00 H ATOM 1009 HB2 ALA A 437 17.473 61.663 13.011 1.00 0.00 H ATOM 1010 HB3 ALA A 437 16.059 62.236 12.092 1.00 0.00 H ATOM 1011 H ALA A 437 19.294 63.298 13.589 1.00 0.00 H ATOM 1012 N GLU A 438 15.229 64.414 13.949 1.00 14.02 N ATOM 1013 CA GLU A 438 14.308 64.586 15.061 1.00 11.97 C ATOM 1014 C GLU A 438 14.061 63.228 15.720 1.00 12.30 C ATOM 1015 O GLU A 438 13.941 62.211 15.037 1.00 14.12 O ATOM 1016 CB GLU A 438 12.994 65.173 14.547 1.00 13.61 C ATOM 1017 CG GLU A 438 12.014 65.579 15.629 1.00 13.16 C ATOM 1018 CD GLU A 438 10.892 66.438 15.083 1.00 13.58 C ATOM 1019 OE1 GLU A 438 10.699 66.447 13.846 1.00 16.29 O ATOM 1020 OE2 GLU A 438 10.204 67.108 15.882 1.00 14.79 O ATOM 1021 HA GLU A 438 14.734 65.269 15.796 1.00 0.00 H ATOM 1022 HB2 GLU A 438 13.227 66.055 13.951 1.00 0.00 H ATOM 1023 HB3 GLU A 438 12.513 64.426 13.916 1.00 0.00 H ATOM 1024 HG2 GLU A 438 11.586 64.680 16.072 1.00 0.00 H ATOM 1025 HG3 GLU A 438 12.548 66.141 16.395 1.00 0.00 H ATOM 1026 H GLU A 438 14.916 64.660 12.988 1.00 0.00 H ATOM 1027 N THR A 439 13.988 63.215 17.045 1.00 12.64 N ATOM 1028 CA THR A 439 13.665 61.989 17.782 1.00 14.82 C ATOM 1029 C THR A 439 12.264 62.087 18.395 1.00 12.63 C ATOM 1030 O THR A 439 11.978 63.000 19.167 1.00 14.84 O ATOM 1031 CB THR A 439 14.706 61.722 18.901 1.00 17.31 C ATOM 1032 OG1 THR A 439 15.996 61.507 18.302 1.00 15.44 O ATOM 1033 CG2 THR A 439 14.326 60.491 19.725 1.00 16.91 C ATOM 1034 HA THR A 439 13.691 61.159 17.076 1.00 0.00 H ATOM 1035 HB THR A 439 14.731 62.587 19.563 1.00 0.00 H ATOM 1036 HG1 THR A 439 16.258 62.311 17.788 1.00 0.00 H ATOM 1037 HG23 THR A 439 13.349 60.648 20.181 1.00 0.00 H ATOM 1038 HG21 THR A 439 14.288 59.617 19.074 1.00 0.00 H ATOM 1039 HG22 THR A 439 15.071 60.333 20.504 1.00 0.00 H ATOM 1040 H THR A 439 14.164 64.094 17.572 1.00 0.00 H ATOM 1041 N PHE A 440 11.408 61.133 18.037 1.00 13.30 N ATOM 1042 CA PHE A 440 10.033 61.064 18.533 1.00 13.40 C ATOM 1043 C PHE A 440 9.922 60.010 19.626 1.00 13.91 C ATOM 1044 O PHE A 440 10.250 58.847 19.393 1.00 15.15 O ATOM 1045 CB PHE A 440 9.075 60.661 17.404 1.00 13.32 C ATOM 1046 CG PHE A 440 8.803 61.741 16.416 1.00 12.84 C ATOM 1047 CD1 PHE A 440 9.827 62.256 15.626 1.00 13.53 C ATOM 1048 CD2 PHE A 440 7.514 62.253 16.269 1.00 10.44 C ATOM 1049 CE1 PHE A 440 9.575 63.264 14.705 1.00 13.60 C ATOM 1050 CE2 PHE A 440 7.256 63.256 15.355 1.00 14.47 C ATOM 1051 CZ PHE A 440 8.284 63.765 14.568 1.00 13.58 C ATOM 1052 HA PHE A 440 9.770 62.049 18.920 1.00 0.00 H ATOM 1053 HB2 PHE A 440 9.510 59.814 16.873 1.00 0.00 H ATOM 1054 HB3 PHE A 440 8.127 60.360 17.851 1.00 0.00 H ATOM 1055 HD2 PHE A 440 6.703 61.858 16.881 1.00 0.00 H ATOM 1056 HE2 PHE A 440 6.245 63.649 15.250 1.00 0.00 H ATOM 1057 HZ PHE A 440 8.079 64.555 13.845 1.00 0.00 H ATOM 1058 HE1 PHE A 440 10.384 63.661 14.092 1.00 0.00 H ATOM 1059 HD1 PHE A 440 10.838 61.863 15.732 1.00 0.00 H ATOM 1060 H PHE A 440 11.732 60.401 17.373 1.00 0.00 H ATOM 1061 N TYR A 441 9.447 60.408 20.807 1.00 11.71 N ATOM 1062 CA TYR A 441 9.114 59.438 21.849 1.00 10.59 C ATOM 1063 C TYR A 441 7.617 59.185 21.782 1.00 8.19 C ATOM 1064 O TYR A 441 6.831 60.109 21.935 1.00 12.88 O ATOM 1065 CB TYR A 441 9.472 59.984 23.230 1.00 11.53 C ATOM 1066 CG TYR A 441 10.954 60.211 23.398 1.00 14.01 C ATOM 1067 CD1 TYR A 441 11.550 61.393 22.965 1.00 15.48 C ATOM 1068 CD2 TYR A 441 11.762 59.221 23.935 1.00 20.23 C ATOM 1069 CE1 TYR A 441 12.920 61.573 23.059 1.00 19.47 C ATOM 1070 CE2 TYR A 441 13.127 59.394 24.035 1.00 21.30 C ATOM 1071 CZ TYR A 441 13.701 60.568 23.595 1.00 28.67 C ATOM 1072 OH TYR A 441 15.069 60.729 23.693 1.00 23.52 O ATOM 1073 HA TYR A 441 9.677 58.518 21.690 1.00 0.00 H ATOM 1074 HB3 TYR A 441 9.140 59.271 23.984 1.00 0.00 H ATOM 1075 HB2 TYR A 441 8.955 60.932 23.376 1.00 0.00 H ATOM 1076 HD2 TYR A 441 11.312 58.291 24.284 1.00 0.00 H ATOM 1077 HE2 TYR A 441 13.749 58.606 24.460 1.00 0.00 H ATOM 1078 HE1 TYR A 441 13.378 62.500 22.713 1.00 0.00 H ATOM 1079 HD1 TYR A 441 10.930 62.186 22.547 1.00 0.00 H ATOM 1080 HH TYR A 441 15.322 61.618 23.338 1.00 0.00 H ATOM 1081 H TYR A 441 9.312 61.423 20.989 1.00 0.00 H ATOM 1082 N VAL A 442 7.237 57.940 21.516 1.00 10.77 N ATOM 1083 CA VAL A 442 5.836 57.641 21.285 1.00 10.18 C ATOM 1084 C VAL A 442 5.267 56.842 22.441 1.00 13.46 C ATOM 1085 O VAL A 442 5.999 56.168 23.163 1.00 13.22 O ATOM 1086 CB VAL A 442 5.636 56.858 19.965 1.00 7.47 C ATOM 1087 CG1 VAL A 442 6.017 57.753 18.789 1.00 10.21 C ATOM 1088 CG2 VAL A 442 6.447 55.565 19.963 1.00 10.63 C ATOM 1089 HA VAL A 442 5.307 58.591 21.206 1.00 0.00 H ATOM 1090 HB VAL A 442 4.587 56.576 19.872 1.00 0.00 H ATOM 1091 HG11 VAL A 442 5.383 58.640 18.789 1.00 0.00 H ATOM 1092 HG12 VAL A 442 7.061 58.051 18.884 1.00 0.00 H ATOM 1093 HG13 VAL A 442 5.878 57.205 17.857 1.00 0.00 H ATOM 1094 HG21 VAL A 442 7.506 55.801 20.071 1.00 0.00 H ATOM 1095 HG22 VAL A 442 6.127 54.936 20.794 1.00 0.00 H ATOM 1096 HG23 VAL A 442 6.285 55.038 19.023 1.00 0.00 H ATOM 1097 H VAL A 442 7.944 57.179 21.473 1.00 0.00 H ATOM 1098 N ASP A 443 3.954 56.915 22.615 1.00 9.91 N ATOM 1099 CA ASP A 443 3.305 56.010 23.560 1.00 12.76 C ATOM 1100 C ASP A 443 1.813 56.048 23.340 1.00 12.66 C ATOM 1101 O ASP A 443 1.303 56.928 22.648 1.00 12.98 O ATOM 1102 CB ASP A 443 3.617 56.416 25.002 1.00 12.17 C ATOM 1103 CG ASP A 443 3.393 55.270 25.993 1.00 12.47 C ATOM 1104 OD1 ASP A 443 3.365 54.102 25.564 1.00 15.17 O ATOM 1105 OD2 ASP A 443 3.235 55.552 27.193 1.00 13.69 O ATOM 1106 HA ASP A 443 3.683 55.001 23.394 1.00 0.00 H ATOM 1107 HB2 ASP A 443 4.659 56.730 25.060 1.00 0.00 H ATOM 1108 HB3 ASP A 443 2.971 57.250 25.279 1.00 0.00 H ATOM 1109 H ASP A 443 3.392 57.610 22.084 1.00 0.00 H ATOM 1110 N GLY A 444 1.125 55.074 23.918 1.00 12.84 N ATOM 1111 CA GLY A 444 -0.322 55.072 23.865 1.00 14.23 C ATOM 1112 C GLY A 444 -0.860 54.530 25.169 1.00 15.82 C ATOM 1113 O GLY A 444 -0.147 53.847 25.907 1.00 15.80 O ATOM 1114 HA3 GLY A 444 -0.657 54.442 23.041 1.00 0.00 H ATOM 1115 HA2 GLY A 444 -0.684 56.089 23.714 1.00 0.00 H ATOM 1116 H GLY A 444 1.626 54.308 24.412 1.00 0.00 H ATOM 1117 N ALA A 445 -2.116 54.848 25.453 1.00 16.27 N ATOM 1118 CA ALA A 445 -2.803 54.334 26.639 1.00 18.77 C ATOM 1119 C ALA A 445 -4.265 54.100 26.277 1.00 22.08 C ATOM 1120 O ALA A 445 -4.845 54.840 25.480 1.00 22.10 O ATOM 1121 CB ALA A 445 -2.701 55.336 27.781 1.00 16.96 C ATOM 1122 HA ALA A 445 -2.342 53.401 26.964 1.00 0.00 H ATOM 1123 HB1 ALA A 445 -1.651 55.506 28.021 1.00 0.00 H ATOM 1124 HB2 ALA A 445 -3.163 56.276 27.480 1.00 0.00 H ATOM 1125 HB3 ALA A 445 -3.216 54.941 28.657 1.00 0.00 H ATOM 1126 H ALA A 445 -2.630 55.484 24.811 1.00 0.00 H ATOM 1127 N ALA A 446 -4.867 53.066 26.851 1.00 20.58 N ATOM 1128 CA ALA A 446 -6.280 52.808 26.608 1.00 23.50 C ATOM 1129 C ALA A 446 -6.936 52.334 27.899 1.00 30.47 C ATOM 1130 O ALA A 446 -6.332 51.598 28.675 1.00 25.20 O ATOM 1131 CB ALA A 446 -6.449 51.762 25.518 1.00 26.02 C ATOM 1132 HA ALA A 446 -6.760 53.729 26.275 1.00 0.00 H ATOM 1133 HB1 ALA A 446 -5.990 52.121 24.597 1.00 0.00 H ATOM 1134 HB2 ALA A 446 -5.967 50.835 25.828 1.00 0.00 H ATOM 1135 HB3 ALA A 446 -7.511 51.582 25.350 1.00 0.00 H ATOM 1136 H ALA A 446 -4.327 52.436 27.478 1.00 0.00 H ATOM 1137 N ASN A 447 -8.170 52.769 28.125 1.00 26.80 N ATOM 1138 CA ASN A 447 -8.916 52.389 29.318 1.00 30.77 C ATOM 1139 C ASN A 447 -9.650 51.083 29.027 1.00 30.50 C ATOM 1140 O ASN A 447 -10.343 50.967 28.019 1.00 28.72 O ATOM 1141 CB ASN A 447 -9.911 53.499 29.670 1.00 51.37 C ATOM 1142 CG ASN A 447 -10.687 53.213 30.939 1.00 37.18 C ATOM 1143 OD1 ASN A 447 -11.584 52.373 30.952 1.00 42.57 O ATOM 1144 ND2 ASN A 447 -10.350 53.918 32.011 1.00 37.17 N ATOM 1145 HA ASN A 447 -8.244 52.248 30.165 1.00 0.00 H ATOM 1146 HB2 ASN A 447 -9.361 54.431 29.801 1.00 0.00 H ATOM 1147 HB3 ASN A 447 -10.617 53.608 28.847 1.00 0.00 H ATOM 1148 HD22 ASN A 447 -9.584 54.619 31.953 1.00 0.00 H ATOM 1149 HD21 ASN A 447 -10.852 53.770 32.910 1.00 0.00 H ATOM 1150 H ASN A 447 -8.618 53.400 27.430 1.00 0.00 H ATOM 1151 N ARG A 448 -9.484 50.091 29.899 1.00 33.61 N ATOM 1152 CA ARG A 448 -10.071 48.776 29.661 1.00 41.25 C ATOM 1153 C ARG A 448 -11.594 48.847 29.713 1.00 43.63 C ATOM 1154 O ARG A 448 -12.286 48.138 28.980 1.00 40.33 O ATOM 1155 CB ARG A 448 -9.568 47.778 30.703 1.00 46.13 C ATOM 1156 CG ARG A 448 -10.127 46.372 30.548 1.00 72.09 C ATOM 1157 CD ARG A 448 -9.732 45.501 31.730 1.00 65.74 C ATOM 1158 NE ARG A 448 -8.395 45.836 32.212 1.00 83.45 N ATOM 1159 CZ ARG A 448 -8.151 46.610 33.265 1.00 66.80 C ATOM 1160 NH1 ARG A 448 -9.157 47.130 33.957 1.00 80.10 N ATOM 1161 NH2 ARG A 448 -6.902 46.872 33.620 1.00 42.91 N ATOM 1162 HA ARG A 448 -9.769 48.443 28.668 1.00 0.00 H ATOM 1163 HB2 ARG A 448 -8.482 47.724 30.627 1.00 0.00 H ATOM 1164 HB3 ARG A 448 -9.844 48.148 31.691 1.00 0.00 H ATOM 1165 HG2 ARG A 448 -11.214 46.424 30.489 1.00 0.00 H ATOM 1166 HG3 ARG A 448 -9.736 45.930 29.632 1.00 0.00 H ATOM 1167 HD2 ARG A 448 -9.747 44.456 31.422 1.00 0.00 H ATOM 1168 HD3 ARG A 448 -10.449 45.651 32.537 1.00 0.00 H ATOM 1169 HE ARG A 448 -7.580 45.444 31.698 1.00 0.00 H ATOM 1170 HH12 ARG A 448 -8.964 47.735 34.780 1.00 0.00 H ATOM 1171 HH11 ARG A 448 -10.139 46.932 33.676 1.00 0.00 H ATOM 1172 HH22 ARG A 448 -6.712 47.478 34.444 1.00 0.00 H ATOM 1173 HH21 ARG A 448 -6.112 46.472 33.075 1.00 0.00 H ATOM 1174 H ARG A 448 -8.928 50.255 30.762 1.00 0.00 H ATOM 1175 N GLU A 449 -12.108 49.715 30.579 1.00 42.12 N ATOM 1176 CA GLU A 449 -13.549 49.859 30.762 1.00 55.01 C ATOM 1177 C GLU A 449 -14.172 50.619 29.597 1.00 54.45 C ATOM 1178 O GLU A 449 -14.956 50.063 28.829 1.00 60.25 O ATOM 1179 CB GLU A 449 -13.840 50.604 32.068 1.00 53.62 C ATOM 1180 CG GLU A 449 -13.166 50.000 33.287 1.00 68.14 C ATOM 1181 CD GLU A 449 -13.524 48.540 33.484 1.00 81.42 C ATOM 1182 OE1 GLU A 449 -12.612 47.740 33.782 1.00 90.94 O ATOM 1183 OE2 GLU A 449 -14.716 48.193 33.340 1.00 75.23 O ATOM 1184 HA GLU A 449 -13.986 48.861 30.804 1.00 0.00 H ATOM 1185 HB2 GLU A 449 -13.496 51.633 31.960 1.00 0.00 H ATOM 1186 HB3 GLU A 449 -14.917 50.598 32.234 1.00 0.00 H ATOM 1187 HG2 GLU A 449 -12.086 50.082 33.166 1.00 0.00 H ATOM 1188 HG3 GLU A 449 -13.475 50.558 34.171 1.00 0.00 H ATOM 1189 H GLU A 449 -11.465 50.308 31.142 1.00 0.00 H ATOM 1190 N THR A 450 -13.805 51.890 29.471 1.00 38.57 N ATOM 1191 CA THR A 450 -14.387 52.776 28.469 1.00 41.67 C ATOM 1192 C THR A 450 -13.879 52.469 27.060 1.00 43.49 C ATOM 1193 O THR A 450 -14.520 52.828 26.075 1.00 38.33 O ATOM 1194 CB THR A 450 -14.066 54.251 28.788 1.00 55.24 C ATOM 1195 OG1 THR A 450 -12.647 54.453 28.750 1.00 39.81 O ATOM 1196 CG2 THR A 450 -14.577 54.618 30.171 1.00 54.24 C ATOM 1197 HA THR A 450 -15.463 52.607 28.501 1.00 0.00 H ATOM 1198 HB THR A 450 -14.555 54.881 28.045 1.00 0.00 H ATOM 1199 HG1 THR A 450 -12.444 55.400 28.955 1.00 0.00 H ATOM 1200 HG23 THR A 450 -15.656 54.468 30.210 1.00 0.00 H ATOM 1201 HG21 THR A 450 -14.094 53.985 30.915 1.00 0.00 H ATOM 1202 HG22 THR A 450 -14.347 55.663 30.376 1.00 0.00 H ATOM 1203 H THR A 450 -13.076 52.267 30.110 1.00 0.00 H ATOM 1204 N LYS A 451 -12.726 51.809 26.975 1.00 28.21 N ATOM 1205 CA LYS A 451 -12.061 51.544 25.696 1.00 30.77 C ATOM 1206 C LYS A 451 -11.708 52.832 24.958 1.00 23.25 C ATOM 1207 O LYS A 451 -11.431 52.814 23.757 1.00 21.72 O ATOM 1208 CB LYS A 451 -12.932 50.673 24.793 1.00 26.38 C ATOM 1209 CG LYS A 451 -13.306 49.320 25.399 1.00 40.39 C ATOM 1210 CD LYS A 451 -14.054 48.458 24.398 1.00 61.18 C ATOM 1211 CE LYS A 451 -14.542 47.165 25.033 1.00 59.94 C ATOM 1212 NZ LYS A 451 -15.236 46.287 24.046 1.00 60.40 N ATOM 1213 HA LYS A 451 -11.138 51.014 25.932 1.00 0.00 H ATOM 1214 HB2 LYS A 451 -13.851 51.217 24.577 1.00 0.00 H ATOM 1215 HB3 LYS A 451 -12.390 50.494 23.864 1.00 0.00 H ATOM 1216 HG2 LYS A 451 -12.396 48.803 25.704 1.00 0.00 H ATOM 1217 HG3 LYS A 451 -13.939 49.483 26.271 1.00 0.00 H ATOM 1218 HD2 LYS A 451 -14.912 49.015 24.022 1.00 0.00 H ATOM 1219 HD3 LYS A 451 -13.388 48.217 23.570 1.00 0.00 H ATOM 1220 HE2 LYS A 451 -15.236 47.407 25.838 1.00 0.00 H ATOM 1221 HE3 LYS A 451 -13.686 46.628 25.442 1.00 0.00 H ATOM 1222 HZ1 LYS A 451 -16.059 46.789 23.655 1.00 0.00 H ATOM 1223 HZ2 LYS A 451 -14.579 46.045 23.277 1.00 0.00 H ATOM 1224 HZ3 LYS A 451 -15.552 45.417 24.520 1.00 0.00 H ATOM 1225 H LYS A 451 -12.280 51.468 27.850 1.00 0.00 H ATOM 1226 N LEU A 452 -11.735 53.942 25.680 1.00 27.65 N ATOM 1227 CA LEU A 452 -11.211 55.195 25.158 1.00 28.70 C ATOM 1228 C LEU A 452 -9.692 55.147 25.337 1.00 30.97 C ATOM 1229 O LEU A 452 -9.191 54.625 26.338 1.00 25.75 O ATOM 1230 CB LEU A 452 -11.794 56.371 25.941 1.00 35.04 C ATOM 1231 CG LEU A 452 -11.782 57.746 25.268 1.00 53.63 C ATOM 1232 CD1 LEU A 452 -10.366 58.282 25.205 1.00 60.66 C ATOM 1233 CD2 LEU A 452 -12.388 57.636 23.874 1.00 49.18 C ATOM 1234 HA LEU A 452 -11.477 55.326 24.109 1.00 0.00 H ATOM 1235 HB2 LEU A 452 -12.832 56.129 26.170 1.00 0.00 H ATOM 1236 HB3 LEU A 452 -11.229 56.457 26.869 1.00 0.00 H ATOM 1237 HG LEU A 452 -12.381 58.444 25.853 1.00 0.00 H ATOM 1238 HD21 LEU A 452 -11.803 56.935 23.279 1.00 0.00 H ATOM 1239 HD22 LEU A 452 -13.415 57.279 23.953 1.00 0.00 H ATOM 1240 HD23 LEU A 452 -12.378 58.616 23.397 1.00 0.00 H ATOM 1241 HD11 LEU A 452 -9.968 58.374 26.216 1.00 0.00 H ATOM 1242 HD12 LEU A 452 -9.744 57.596 24.630 1.00 0.00 H ATOM 1243 HD13 LEU A 452 -10.370 59.260 24.724 1.00 0.00 H ATOM 1244 H LEU A 452 -12.138 53.918 26.638 1.00 0.00 H ATOM 1245 N GLY A 453 -8.965 55.683 24.360 1.00 29.12 N ATOM 1246 CA GLY A 453 -7.520 55.718 24.462 1.00 17.00 C ATOM 1247 C GLY A 453 -6.915 56.953 23.834 1.00 20.61 C ATOM 1248 O GLY A 453 -7.622 57.772 23.239 1.00 20.28 O ATOM 1249 HA3 GLY A 453 -7.114 54.839 23.961 1.00 0.00 H ATOM 1250 HA2 GLY A 453 -7.245 55.693 25.516 1.00 0.00 H ATOM 1251 H GLY A 453 -9.435 56.078 23.521 1.00 0.00 H ATOM 1252 N LYS A 454 -5.601 57.093 23.975 1.00 17.17 N ATOM 1253 CA LYS A 454 -4.865 58.179 23.330 1.00 16.70 C ATOM 1254 C LYS A 454 -3.561 57.638 22.752 1.00 15.52 C ATOM 1255 O LYS A 454 -2.974 56.700 23.295 1.00 16.13 O ATOM 1256 CB LYS A 454 -4.563 59.295 24.338 1.00 16.33 C ATOM 1257 CG LYS A 454 -5.798 60.076 24.790 1.00 16.42 C ATOM 1258 CD LYS A 454 -5.448 61.095 25.853 1.00 19.05 C ATOM 1259 CE LYS A 454 -6.628 62.001 26.167 1.00 25.53 C ATOM 1260 NZ LYS A 454 -6.275 62.982 27.224 1.00 24.80 N ATOM 1261 HA LYS A 454 -5.476 58.592 22.528 1.00 0.00 H ATOM 1262 HB2 LYS A 454 -4.100 58.847 25.217 1.00 0.00 H ATOM 1263 HB3 LYS A 454 -3.865 59.994 23.877 1.00 0.00 H ATOM 1264 HG2 LYS A 454 -6.226 60.592 23.931 1.00 0.00 H ATOM 1265 HG3 LYS A 454 -6.531 59.378 25.195 1.00 0.00 H ATOM 1266 HD2 LYS A 454 -5.151 60.571 26.762 1.00 0.00 H ATOM 1267 HD3 LYS A 454 -4.617 61.705 25.499 1.00 0.00 H ATOM 1268 HE2 LYS A 454 -7.465 61.392 26.510 1.00 0.00 H ATOM 1269 HE3 LYS A 454 -6.917 62.538 25.263 1.00 0.00 H ATOM 1270 HZ1 LYS A 454 -6.003 62.474 28.090 1.00 0.00 H ATOM 1271 HZ2 LYS A 454 -5.479 63.568 26.900 1.00 0.00 H ATOM 1272 HZ3 LYS A 454 -7.097 63.589 27.420 1.00 0.00 H ATOM 1273 H LYS A 454 -5.081 56.410 24.562 1.00 0.00 H ATOM 1274 N ALA A 455 -3.129 58.227 21.639 1.00 14.10 N ATOM 1275 CA ALA A 455 -1.831 57.912 21.023 1.00 10.45 C ATOM 1276 C ALA A 455 -1.126 59.241 20.785 1.00 13.14 C ATOM 1277 O ALA A 455 -1.768 60.244 20.471 1.00 14.51 O ATOM 1278 CB ALA A 455 -2.043 57.209 19.707 1.00 14.38 C ATOM 1279 HA ALA A 455 -1.241 57.259 21.666 1.00 0.00 H ATOM 1280 HB1 ALA A 455 -2.595 56.284 19.875 1.00 0.00 H ATOM 1281 HB2 ALA A 455 -2.611 57.856 19.038 1.00 0.00 H ATOM 1282 HB3 ALA A 455 -1.076 56.980 19.259 1.00 0.00 H ATOM 1283 H ALA A 455 -3.735 58.940 21.186 1.00 0.00 H ATOM 1284 N GLY A 456 0.192 59.266 20.922 1.00 12.75 N ATOM 1285 CA GLY A 456 0.843 60.552 20.842 1.00 12.21 C ATOM 1286 C GLY A 456 2.348 60.460 20.802 1.00 12.12 C ATOM 1287 O GLY A 456 2.907 59.377 20.891 1.00 11.33 O ATOM 1288 HA3 GLY A 456 0.556 61.140 21.714 1.00 0.00 H ATOM 1289 HA2 GLY A 456 0.503 61.056 19.937 1.00 0.00 H ATOM 1290 H GLY A 456 0.736 58.394 21.081 1.00 0.00 H ATOM 1291 N TYR A 457 2.979 61.614 20.665 1.00 10.75 N ATOM 1292 CA TYR A 457 4.437 61.707 20.680 1.00 11.27 C ATOM 1293 C TYR A 457 4.878 63.022 21.305 1.00 14.08 C ATOM 1294 O TYR A 457 4.122 64.006 21.346 1.00 13.07 O ATOM 1295 CB TYR A 457 5.012 61.578 19.250 1.00 12.07 C ATOM 1296 CG TYR A 457 4.621 62.671 18.258 1.00 12.62 C ATOM 1297 CD1 TYR A 457 5.047 63.987 18.431 1.00 12.74 C ATOM 1298 CD2 TYR A 457 3.857 62.373 17.127 1.00 14.91 C ATOM 1299 CE1 TYR A 457 4.722 64.982 17.506 1.00 11.95 C ATOM 1300 CE2 TYR A 457 3.531 63.366 16.193 1.00 14.64 C ATOM 1301 CZ TYR A 457 3.964 64.663 16.394 1.00 14.28 C ATOM 1302 OH TYR A 457 3.623 65.656 15.494 1.00 16.10 O ATOM 1303 HA TYR A 457 4.823 60.884 21.281 1.00 0.00 H ATOM 1304 HB3 TYR A 457 4.676 60.625 18.842 1.00 0.00 H ATOM 1305 HB2 TYR A 457 6.099 61.575 19.329 1.00 0.00 H ATOM 1306 HD2 TYR A 457 3.509 61.352 16.968 1.00 0.00 H ATOM 1307 HE2 TYR A 457 2.939 63.117 15.312 1.00 0.00 H ATOM 1308 HE1 TYR A 457 5.064 66.005 17.660 1.00 0.00 H ATOM 1309 HD1 TYR A 457 5.645 64.245 19.305 1.00 0.00 H ATOM 1310 HH TYR A 457 4.014 66.516 15.790 1.00 0.00 H ATOM 1311 H TYR A 457 2.420 62.482 20.543 1.00 0.00 H ATOM 1312 N VAL A 458 6.110 63.031 21.801 1.00 12.57 N ATOM 1313 CA VAL A 458 6.813 64.269 22.109 1.00 13.68 C ATOM 1314 C VAL A 458 8.172 64.120 21.449 1.00 11.57 C ATOM 1315 O VAL A 458 8.718 63.009 21.392 1.00 14.92 O ATOM 1316 CB VAL A 458 7.000 64.464 23.645 1.00 18.09 C ATOM 1317 CG1 VAL A 458 5.638 64.483 24.347 1.00 16.05 C ATOM 1318 CG2 VAL A 458 7.862 63.360 24.205 1.00 27.99 C ATOM 1319 HA VAL A 458 6.253 65.134 21.753 1.00 0.00 H ATOM 1320 HB VAL A 458 7.495 65.419 23.821 1.00 0.00 H ATOM 1321 HG11 VAL A 458 5.039 65.304 23.953 1.00 0.00 H ATOM 1322 HG12 VAL A 458 5.125 63.538 24.167 1.00 0.00 H ATOM 1323 HG13 VAL A 458 5.785 64.620 25.418 1.00 0.00 H ATOM 1324 HG21 VAL A 458 7.383 62.398 24.021 1.00 0.00 H ATOM 1325 HG22 VAL A 458 8.838 63.381 23.719 1.00 0.00 H ATOM 1326 HG23 VAL A 458 7.986 63.506 25.278 1.00 0.00 H ATOM 1327 H VAL A 458 6.589 62.124 21.975 1.00 0.00 H ATOM 1328 N THR A 459 8.712 65.211 20.915 1.00 12.57 N ATOM 1329 CA THR A 459 9.990 65.102 20.213 1.00 13.94 C ATOM 1330 C THR A 459 11.054 65.958 20.864 1.00 16.93 C ATOM 1331 O THR A 459 10.751 66.858 21.651 1.00 13.75 O ATOM 1332 CB THR A 459 9.894 65.525 18.739 1.00 12.10 C ATOM 1333 OG1 THR A 459 10.010 66.952 18.626 1.00 14.09 O ATOM 1334 CG2 THR A 459 8.558 65.079 18.150 1.00 13.80 C ATOM 1335 HA THR A 459 10.259 64.047 20.269 1.00 0.00 H ATOM 1336 HB THR A 459 10.707 65.051 18.189 1.00 0.00 H ATOM 1337 HG1 THR A 459 9.947 67.213 17.673 1.00 0.00 H ATOM 1338 HG23 THR A 459 8.468 63.996 18.235 1.00 0.00 H ATOM 1339 HG21 THR A 459 7.744 65.556 18.696 1.00 0.00 H ATOM 1340 HG22 THR A 459 8.511 65.367 17.100 1.00 0.00 H ATOM 1341 H THR A 459 8.232 66.130 20.995 1.00 0.00 H ATOM 1342 N ASN A 460 12.308 65.684 20.518 1.00 13.13 N ATOM 1343 CA ASN A 460 13.401 66.463 21.077 1.00 17.78 C ATOM 1344 C ASN A 460 13.548 67.829 20.425 1.00 22.36 C ATOM 1345 O ASN A 460 14.463 68.579 20.764 1.00 23.84 O ATOM 1346 CB ASN A 460 14.721 65.693 20.974 1.00 14.80 C ATOM 1347 CG ASN A 460 15.169 65.466 19.546 1.00 18.95 C ATOM 1348 OD1 ASN A 460 14.412 65.643 18.596 1.00 18.24 O ATOM 1349 ND2 ASN A 460 16.427 65.061 19.391 1.00 33.24 N ATOM 1350 HA ASN A 460 13.155 66.630 22.126 1.00 0.00 H ATOM 1351 HB2 ASN A 460 15.494 66.259 21.494 1.00 0.00 H ATOM 1352 HB3 ASN A 460 14.595 64.724 21.456 1.00 0.00 H ATOM 1353 HD22 ASN A 460 17.035 64.923 20.223 1.00 0.00 H ATOM 1354 HD21 ASN A 460 16.802 64.882 18.438 1.00 0.00 H ATOM 1355 H ASN A 460 12.507 64.913 19.848 1.00 0.00 H ATOM 1356 N ARG A 461 12.651 68.155 19.494 1.00 11.92 N ATOM 1357 CA ARG A 461 12.600 69.492 18.931 1.00 14.92 C ATOM 1358 C ARG A 461 11.407 70.269 19.468 1.00 14.47 C ATOM 1359 O ARG A 461 11.077 71.334 18.961 1.00 17.96 O ATOM 1360 CB ARG A 461 12.539 69.429 17.412 1.00 13.86 C ATOM 1361 CG ARG A 461 13.781 68.807 16.803 1.00 16.72 C ATOM 1362 CD ARG A 461 13.735 68.814 15.297 1.00 18.86 C ATOM 1363 NE ARG A 461 14.978 68.301 14.726 1.00 17.64 N ATOM 1364 CZ ARG A 461 15.185 68.137 13.422 1.00 18.36 C ATOM 1365 NH1 ARG A 461 14.232 68.445 12.546 1.00 23.07 N ATOM 1366 NH2 ARG A 461 16.342 67.652 12.993 1.00 23.03 N ATOM 1367 HA ARG A 461 13.510 70.013 19.228 1.00 0.00 H ATOM 1368 HB2 ARG A 461 11.673 68.835 17.122 1.00 0.00 H ATOM 1369 HB3 ARG A 461 12.430 70.442 17.025 1.00 0.00 H ATOM 1370 HG2 ARG A 461 14.654 69.370 17.131 1.00 0.00 H ATOM 1371 HG3 ARG A 461 13.864 67.776 17.148 1.00 0.00 H ATOM 1372 HD2 ARG A 461 13.580 69.836 14.951 1.00 0.00 H ATOM 1373 HD3 ARG A 461 12.906 68.189 14.964 1.00 0.00 H ATOM 1374 HE ARG A 461 15.748 68.049 15.378 1.00 0.00 H ATOM 1375 HH12 ARG A 461 14.400 68.315 11.528 1.00 0.00 H ATOM 1376 HH11 ARG A 461 13.319 68.816 12.879 1.00 0.00 H ATOM 1377 HH22 ARG A 461 16.506 67.523 11.974 1.00 0.00 H ATOM 1378 HH21 ARG A 461 17.086 67.401 13.675 1.00 0.00 H ATOM 1379 H ARG A 461 11.974 67.437 19.165 1.00 0.00 H ATOM 1380 N GLY A 462 10.769 69.717 20.492 1.00 13.92 N ATOM 1381 CA GLY A 462 9.789 70.482 21.244 1.00 17.17 C ATOM 1382 C GLY A 462 8.364 70.357 20.728 1.00 15.14 C ATOM 1383 O GLY A 462 7.501 71.130 21.132 1.00 16.79 O ATOM 1384 HA3 GLY A 462 10.075 71.533 21.206 1.00 0.00 H ATOM 1385 HA2 GLY A 462 9.809 70.139 22.278 1.00 0.00 H ATOM 1386 H GLY A 462 10.971 68.732 20.758 1.00 0.00 H ATOM 1387 N ARG A 463 8.124 69.403 19.832 1.00 16.13 N ATOM 1388 CA ARG A 463 6.784 69.180 19.275 1.00 15.49 C ATOM 1389 C ARG A 463 6.039 68.077 20.025 1.00 13.58 C ATOM 1390 O ARG A 463 6.638 67.079 20.414 1.00 14.00 O ATOM 1391 CB ARG A 463 6.882 68.755 17.803 1.00 16.32 C ATOM 1392 CG ARG A 463 7.590 69.732 16.902 1.00 27.78 C ATOM 1393 CD ARG A 463 7.086 69.548 15.491 1.00 23.11 C ATOM 1394 NE ARG A 463 7.730 68.435 14.796 1.00 19.65 N ATOM 1395 CZ ARG A 463 7.263 67.903 13.673 1.00 19.71 C ATOM 1396 NH1 ARG A 463 6.138 68.366 13.133 1.00 18.01 N ATOM 1397 NH2 ARG A 463 7.950 66.959 13.050 1.00 16.25 N ATOM 1398 HA ARG A 463 6.241 70.120 19.373 1.00 0.00 H ATOM 1399 HB2 ARG A 463 7.417 67.806 17.760 1.00 0.00 H ATOM 1400 HB3 ARG A 463 5.870 68.617 17.423 1.00 0.00 H ATOM 1401 HG2 ARG A 463 7.387 70.750 17.234 1.00 0.00 H ATOM 1402 HG3 ARG A 463 8.664 69.548 16.934 1.00 0.00 H ATOM 1403 HD2 ARG A 463 7.276 70.464 14.932 1.00 0.00 H ATOM 1404 HD3 ARG A 463 6.013 69.361 15.527 1.00 0.00 H ATOM 1405 HE ARG A 463 8.601 68.039 15.203 1.00 0.00 H ATOM 1406 HH12 ARG A 463 5.773 67.948 12.253 1.00 0.00 H ATOM 1407 HH11 ARG A 463 5.624 69.145 13.591 1.00 0.00 H ATOM 1408 HH22 ARG A 463 7.583 66.543 12.170 1.00 0.00 H ATOM 1409 HH21 ARG A 463 8.857 66.633 13.440 1.00 0.00 H ATOM 1410 H ARG A 463 8.909 68.798 19.517 1.00 0.00 H ATOM 1411 N GLN A 464 4.726 68.246 20.194 1.00 10.75 N ATOM 1412 CA GLN A 464 3.897 67.196 20.796 1.00 10.26 C ATOM 1413 C GLN A 464 2.618 67.061 19.996 1.00 11.93 C ATOM 1414 O GLN A 464 2.145 68.029 19.411 1.00 12.89 O ATOM 1415 CB GLN A 464 3.503 67.552 22.239 1.00 16.00 C ATOM 1416 CG GLN A 464 4.650 67.930 23.156 1.00 32.15 C ATOM 1417 CD GLN A 464 4.169 68.515 24.483 1.00 28.84 C ATOM 1418 OE1 GLN A 464 4.949 69.107 25.225 1.00 49.75 O ATOM 1419 NE2 GLN A 464 2.877 68.356 24.778 1.00 28.31 N ATOM 1420 HA GLN A 464 4.474 66.271 20.796 1.00 0.00 H ATOM 1421 HB2 GLN A 464 2.812 68.394 22.200 1.00 0.00 H ATOM 1422 HB3 GLN A 464 2.997 66.689 22.672 1.00 0.00 H ATOM 1423 HG2 GLN A 464 5.243 67.038 23.361 1.00 0.00 H ATOM 1424 HG3 GLN A 464 5.272 68.670 22.652 1.00 0.00 H ATOM 1425 HE22 GLN A 464 2.252 67.848 24.120 1.00 0.00 H ATOM 1426 HE21 GLN A 464 2.495 68.741 25.666 1.00 0.00 H ATOM 1427 H GLN A 464 4.283 69.138 19.894 1.00 0.00 H ATOM 1428 N LYS A 465 2.057 65.858 19.982 1.00 13.88 N ATOM 1429 CA LYS A 465 0.722 65.647 19.418 1.00 11.59 C ATOM 1430 C LYS A 465 0.068 64.504 20.176 1.00 13.71 C ATOM 1431 O LYS A 465 0.731 63.539 20.555 1.00 14.51 O ATOM 1432 CB LYS A 465 0.811 65.289 17.925 1.00 13.51 C ATOM 1433 CG LYS A 465 -0.541 64.952 17.282 1.00 14.92 C ATOM 1434 CD LYS A 465 -0.429 64.769 15.769 1.00 14.30 C ATOM 1435 CE LYS A 465 -0.241 66.116 15.067 1.00 21.89 C ATOM 1436 NZ LYS A 465 -0.256 66.051 13.553 1.00 24.80 N ATOM 1437 HA LYS A 465 0.136 66.561 19.512 1.00 0.00 H ATOM 1438 HB2 LYS A 465 1.241 66.138 17.394 1.00 0.00 H ATOM 1439 HB3 LYS A 465 1.467 64.425 17.818 1.00 0.00 H ATOM 1440 HG2 LYS A 465 -0.919 64.029 17.721 1.00 0.00 H ATOM 1441 HG3 LYS A 465 -1.240 65.763 17.487 1.00 0.00 H ATOM 1442 HD2 LYS A 465 0.426 64.130 15.549 1.00 0.00 H ATOM 1443 HD3 LYS A 465 -1.339 64.297 15.398 1.00 0.00 H ATOM 1444 HE2 LYS A 465 0.717 66.531 15.379 1.00 0.00 H ATOM 1445 HE3 LYS A 465 -1.044 66.780 15.386 1.00 0.00 H ATOM 1446 HZ1 LYS A 465 0.513 65.432 13.226 1.00 0.00 H ATOM 1447 HZ2 LYS A 465 -1.169 65.670 13.233 1.00 0.00 H ATOM 1448 HZ3 LYS A 465 -0.122 67.007 13.165 1.00 0.00 H ATOM 1449 H LYS A 465 2.576 65.049 20.380 1.00 0.00 H ATOM 1450 N VAL A 466 -1.235 64.624 20.395 1.00 11.20 N ATOM 1451 CA VAL A 466 -2.027 63.549 20.980 1.00 14.27 C ATOM 1452 C VAL A 466 -3.316 63.469 20.184 1.00 13.63 C ATOM 1453 O VAL A 466 -3.866 64.498 19.783 1.00 16.76 O ATOM 1454 CB VAL A 466 -2.384 63.851 22.451 1.00 14.92 C ATOM 1455 CG1 VAL A 466 -3.280 62.736 23.012 1.00 23.49 C ATOM 1456 CG2 VAL A 466 -1.125 63.984 23.274 1.00 19.24 C ATOM 1457 HA VAL A 466 -1.459 62.619 20.951 1.00 0.00 H ATOM 1458 HB VAL A 466 -2.929 64.794 22.499 1.00 0.00 H ATOM 1459 HG11 VAL A 466 -4.196 62.677 22.424 1.00 0.00 H ATOM 1460 HG12 VAL A 466 -2.751 61.785 22.958 1.00 0.00 H ATOM 1461 HG13 VAL A 466 -3.527 62.958 24.050 1.00 0.00 H ATOM 1462 HG21 VAL A 466 -0.561 63.052 23.226 1.00 0.00 H ATOM 1463 HG22 VAL A 466 -0.518 64.798 22.878 1.00 0.00 H ATOM 1464 HG23 VAL A 466 -1.390 64.197 24.310 1.00 0.00 H ATOM 1465 H VAL A 466 -1.707 65.515 20.141 1.00 0.00 H ATOM 1466 N VAL A 467 -3.784 62.250 19.937 1.00 13.96 N ATOM 1467 CA VAL A 467 -5.101 62.058 19.357 1.00 14.67 C ATOM 1468 C VAL A 467 -5.886 61.089 20.226 1.00 18.66 C ATOM 1469 O VAL A 467 -5.321 60.174 20.823 1.00 16.64 O ATOM 1470 CB VAL A 467 -5.014 61.509 17.920 1.00 15.71 C ATOM 1471 CG1 VAL A 467 -4.290 62.508 17.033 1.00 17.75 C ATOM 1472 CG2 VAL A 467 -4.311 60.177 17.902 1.00 17.63 C ATOM 1473 HA VAL A 467 -5.603 63.025 19.314 1.00 0.00 H ATOM 1474 HB VAL A 467 -6.024 61.362 17.536 1.00 0.00 H ATOM 1475 HG11 VAL A 467 -4.837 63.451 17.028 1.00 0.00 H ATOM 1476 HG12 VAL A 467 -3.284 62.673 17.419 1.00 0.00 H ATOM 1477 HG13 VAL A 467 -4.231 62.115 16.018 1.00 0.00 H ATOM 1478 HG21 VAL A 467 -3.302 60.295 18.297 1.00 0.00 H ATOM 1479 HG22 VAL A 467 -4.863 59.468 18.518 1.00 0.00 H ATOM 1480 HG23 VAL A 467 -4.261 59.808 16.878 1.00 0.00 H ATOM 1481 H VAL A 467 -3.198 61.421 20.163 1.00 0.00 H ATOM 1482 N THR A 468 -7.188 61.310 20.318 1.00 17.94 N ATOM 1483 CA THR A 468 -8.039 60.422 21.098 1.00 22.10 C ATOM 1484 C THR A 468 -8.685 59.406 20.161 1.00 22.37 C ATOM 1485 O THR A 468 -9.070 59.733 19.031 1.00 21.81 O ATOM 1486 CB THR A 468 -9.116 61.226 21.850 1.00 20.79 C ATOM 1487 OG1 THR A 468 -8.478 62.140 22.751 1.00 22.73 O ATOM 1488 CG2 THR A 468 -10.025 60.293 22.645 1.00 24.22 C ATOM 1489 HA THR A 468 -7.435 59.900 21.840 1.00 0.00 H ATOM 1490 HB THR A 468 -9.719 61.771 21.123 1.00 0.00 H ATOM 1491 HG1 THR A 468 -9.168 62.659 23.236 1.00 0.00 H ATOM 1492 HG23 THR A 468 -10.513 59.596 21.964 1.00 0.00 H ATOM 1493 HG21 THR A 468 -9.429 59.738 23.370 1.00 0.00 H ATOM 1494 HG22 THR A 468 -10.780 60.881 23.167 1.00 0.00 H ATOM 1495 H THR A 468 -7.607 62.126 19.828 1.00 0.00 H ATOM 1496 N LEU A 469 -8.771 58.160 20.624 1.00 19.90 N ATOM 1497 CA LEU A 469 -9.262 57.068 19.795 1.00 22.60 C ATOM 1498 C LEU A 469 -10.434 56.395 20.494 1.00 18.85 C ATOM 1499 O LEU A 469 -10.431 56.238 21.718 1.00 25.29 O ATOM 1500 CB LEU A 469 -8.152 56.039 19.557 1.00 26.47 C ATOM 1501 CG LEU A 469 -6.871 56.555 18.888 1.00 28.41 C ATOM 1502 CD1 LEU A 469 -5.779 55.493 18.963 1.00 27.98 C ATOM 1503 CD2 LEU A 469 -7.163 56.927 17.451 1.00 28.04 C ATOM 1504 HA LEU A 469 -9.583 57.469 18.833 1.00 0.00 H ATOM 1505 HB2 LEU A 469 -7.875 55.621 20.525 1.00 0.00 H ATOM 1506 HB3 LEU A 469 -8.561 55.250 18.925 1.00 0.00 H ATOM 1507 HG LEU A 469 -6.519 57.443 19.413 1.00 0.00 H ATOM 1508 HD21 LEU A 469 -7.523 56.049 16.916 1.00 0.00 H ATOM 1509 HD22 LEU A 469 -7.924 57.707 17.426 1.00 0.00 H ATOM 1510 HD23 LEU A 469 -6.251 57.293 16.979 1.00 0.00 H ATOM 1511 HD11 LEU A 469 -5.570 55.261 20.007 1.00 0.00 H ATOM 1512 HD12 LEU A 469 -6.114 54.592 18.450 1.00 0.00 H ATOM 1513 HD13 LEU A 469 -4.874 55.869 18.485 1.00 0.00 H ATOM 1514 H LEU A 469 -8.480 57.962 21.603 1.00 0.00 H ATOM 1515 N THR A 470 -11.436 56.016 19.712 1.00 26.72 N ATOM 1516 CA THR A 470 -12.591 55.318 20.253 1.00 28.23 C ATOM 1517 C THR A 470 -12.462 53.816 20.068 1.00 22.46 C ATOM 1518 O THR A 470 -11.947 53.343 19.050 1.00 27.92 O ATOM 1519 CB THR A 470 -13.898 55.805 19.580 1.00 29.21 C ATOM 1520 OG1 THR A 470 -14.153 57.158 19.973 1.00 44.79 O ATOM 1521 CG2 THR A 470 -15.080 54.934 19.995 1.00 37.68 C ATOM 1522 HA THR A 470 -12.632 55.541 21.319 1.00 0.00 H ATOM 1523 HB THR A 470 -13.778 55.739 18.499 1.00 0.00 H ATOM 1524 HG1 THR A 470 -14.988 57.473 19.545 1.00 0.00 H ATOM 1525 HG23 THR A 470 -14.891 53.902 19.698 1.00 0.00 H ATOM 1526 HG21 THR A 470 -15.205 54.985 21.077 1.00 0.00 H ATOM 1527 HG22 THR A 470 -15.985 55.295 19.506 1.00 0.00 H ATOM 1528 H THR A 470 -11.395 56.222 18.693 1.00 0.00 H ATOM 1529 N ASP A 471 -12.938 53.074 21.065 1.00 31.65 N ATOM 1530 CA ASP A 471 -13.031 51.623 20.980 1.00 28.79 C ATOM 1531 C ASP A 471 -11.672 51.040 20.611 1.00 27.45 C ATOM 1532 O ASP A 471 -11.537 50.338 19.611 1.00 30.71 O ATOM 1533 CB ASP A 471 -14.061 51.219 19.921 1.00 30.80 C ATOM 1534 CG ASP A 471 -14.424 49.749 19.996 1.00 43.70 C ATOM 1535 OD1 ASP A 471 -14.611 49.121 18.933 1.00 39.88 O ATOM 1536 OD2 ASP A 471 -14.520 49.223 21.124 1.00 37.68 O ATOM 1537 HA ASP A 471 -13.344 51.235 21.949 1.00 0.00 H ATOM 1538 HB2 ASP A 471 -14.965 51.811 20.068 1.00 0.00 H ATOM 1539 HB3 ASP A 471 -13.648 51.428 18.934 1.00 0.00 H ATOM 1540 H ASP A 471 -13.255 53.547 21.935 1.00 0.00 H ATOM 1541 N THR A 472 -10.665 51.348 21.415 1.00 25.91 N ATOM 1542 CA THR A 472 -9.311 50.969 21.057 1.00 26.53 C ATOM 1543 C THR A 472 -8.701 50.103 22.149 1.00 34.93 C ATOM 1544 O THR A 472 -9.354 49.795 23.147 1.00 26.06 O ATOM 1545 CB THR A 472 -8.439 52.223 20.830 1.00 18.36 C ATOM 1546 OG1 THR A 472 -7.232 51.842 20.160 1.00 21.24 O ATOM 1547 CG2 THR A 472 -8.120 52.897 22.146 1.00 24.27 C ATOM 1548 HA THR A 472 -9.348 50.397 20.130 1.00 0.00 H ATOM 1549 HB THR A 472 -8.989 52.934 20.213 1.00 0.00 H ATOM 1550 HG1 THR A 472 -7.456 51.430 19.288 1.00 0.00 H ATOM 1551 HG23 THR A 472 -9.048 53.180 22.642 1.00 0.00 H ATOM 1552 HG21 THR A 472 -7.563 52.207 22.780 1.00 0.00 H ATOM 1553 HG22 THR A 472 -7.519 53.788 21.960 1.00 0.00 H ATOM 1554 H THR A 472 -10.845 51.861 22.302 1.00 0.00 H ATOM 1555 N THR A 473 -7.449 49.706 21.950 1.00 22.50 N ATOM 1556 CA THR A 473 -6.729 48.875 22.916 1.00 20.71 C ATOM 1557 C THR A 473 -5.350 49.477 23.139 1.00 24.21 C ATOM 1558 O THR A 473 -4.901 50.306 22.353 1.00 18.99 O ATOM 1559 CB THR A 473 -6.534 47.443 22.387 1.00 24.98 C ATOM 1560 OG1 THR A 473 -5.698 47.469 21.224 1.00 21.67 O ATOM 1561 CG2 THR A 473 -7.882 46.815 22.018 1.00 25.09 C ATOM 1562 HA THR A 473 -7.311 48.839 23.837 1.00 0.00 H ATOM 1563 HB THR A 473 -6.066 46.847 23.171 1.00 0.00 H ATOM 1564 HG1 THR A 473 -5.575 46.546 20.887 1.00 0.00 H ATOM 1565 HG23 THR A 473 -8.524 46.792 22.899 1.00 0.00 H ATOM 1566 HG21 THR A 473 -8.356 47.409 21.237 1.00 0.00 H ATOM 1567 HG22 THR A 473 -7.721 45.799 21.657 1.00 0.00 H ATOM 1568 H THR A 473 -6.963 49.996 21.077 1.00 0.00 H ATOM 1569 N ASN A 474 -4.667 49.061 24.199 1.00 19.38 N ATOM 1570 CA ASN A 474 -3.320 49.572 24.429 1.00 15.34 C ATOM 1571 C ASN A 474 -2.453 49.313 23.198 1.00 19.51 C ATOM 1572 O ASN A 474 -1.756 50.216 22.736 1.00 18.22 O ATOM 1573 CB ASN A 474 -2.690 48.913 25.664 1.00 19.78 C ATOM 1574 CG ASN A 474 -3.302 49.403 26.976 1.00 31.32 C ATOM 1575 OD1 ASN A 474 -3.703 48.604 27.825 1.00 37.73 O ATOM 1576 ND2 ASN A 474 -3.363 50.715 27.150 1.00 22.41 N ATOM 1577 HA ASN A 474 -3.382 50.645 24.609 1.00 0.00 H ATOM 1578 HB2 ASN A 474 -2.833 47.835 25.594 1.00 0.00 H ATOM 1579 HB3 ASN A 474 -1.623 49.137 25.672 1.00 0.00 H ATOM 1580 HD22 ASN A 474 -3.013 51.355 26.408 1.00 0.00 H ATOM 1581 HD21 ASN A 474 -3.760 51.105 28.028 1.00 0.00 H ATOM 1582 H ASN A 474 -5.089 48.377 24.859 1.00 0.00 H ATOM 1583 N GLN A 475 -2.506 48.093 22.664 1.00 17.78 N ATOM 1584 CA GLN A 475 -1.701 47.724 21.500 1.00 19.77 C ATOM 1585 C GLN A 475 -2.004 48.583 20.282 1.00 20.63 C ATOM 1586 O GLN A 475 -1.087 49.035 19.595 1.00 19.79 O ATOM 1587 CB GLN A 475 -1.899 46.241 21.148 1.00 22.55 C ATOM 1588 CG GLN A 475 -1.236 45.304 22.151 1.00 26.05 C ATOM 1589 CD GLN A 475 -1.279 43.840 21.742 1.00 29.21 C ATOM 1590 OE1 GLN A 475 -2.061 43.437 20.880 1.00 31.91 O ATOM 1591 NE2 GLN A 475 -0.430 43.036 22.369 1.00 26.17 N ATOM 1592 HA GLN A 475 -0.661 47.899 21.777 1.00 0.00 H ATOM 1593 HB2 GLN A 475 -2.968 46.028 21.125 1.00 0.00 H ATOM 1594 HB3 GLN A 475 -1.471 46.056 20.163 1.00 0.00 H ATOM 1595 HG2 GLN A 475 -0.193 45.600 22.261 1.00 0.00 H ATOM 1596 HG3 GLN A 475 -1.745 45.409 23.109 1.00 0.00 H ATOM 1597 HE22 GLN A 475 0.213 43.420 23.091 1.00 0.00 H ATOM 1598 HE21 GLN A 475 -0.407 42.022 22.139 1.00 0.00 H ATOM 1599 H GLN A 475 -3.138 47.383 23.087 1.00 0.00 H ATOM 1600 N LYS A 476 -3.285 48.833 20.020 1.00 16.61 N ATOM 1601 CA LYS A 476 -3.648 49.682 18.897 1.00 17.76 C ATOM 1602 C LYS A 476 -3.160 51.113 19.059 1.00 18.19 C ATOM 1603 O LYS A 476 -2.753 51.742 18.078 1.00 18.94 O ATOM 1604 CB LYS A 476 -5.167 49.683 18.687 1.00 22.18 C ATOM 1605 CG LYS A 476 -5.696 48.361 18.163 1.00 37.77 C ATOM 1606 CD LYS A 476 -7.204 48.392 17.967 1.00 51.10 C ATOM 1607 CE LYS A 476 -7.727 47.027 17.536 1.00 42.51 C ATOM 1608 NZ LYS A 476 -9.195 47.049 17.290 1.00 70.82 N ATOM 1609 HA LYS A 476 -3.153 49.260 18.022 1.00 0.00 H ATOM 1610 HB2 LYS A 476 -5.649 49.896 19.641 1.00 0.00 H ATOM 1611 HB3 LYS A 476 -5.418 50.466 17.971 1.00 0.00 H ATOM 1612 HG2 LYS A 476 -5.220 48.145 17.206 1.00 0.00 H ATOM 1613 HG3 LYS A 476 -5.449 47.575 18.876 1.00 0.00 H ATOM 1614 HD2 LYS A 476 -7.680 48.676 18.905 1.00 0.00 H ATOM 1615 HD3 LYS A 476 -7.449 49.126 17.200 1.00 0.00 H ATOM 1616 HE2 LYS A 476 -7.512 46.302 18.321 1.00 0.00 H ATOM 1617 HE3 LYS A 476 -7.220 46.728 16.619 1.00 0.00 H ATOM 1618 HZ1 LYS A 476 -9.687 47.327 18.163 1.00 0.00 H ATOM 1619 HZ2 LYS A 476 -9.409 47.734 16.537 1.00 0.00 H ATOM 1620 HZ3 LYS A 476 -9.511 46.102 16.999 1.00 0.00 H ATOM 1621 H LYS A 476 -4.028 48.420 20.620 1.00 0.00 H ATOM 1622 N THR A 477 -3.204 51.639 20.280 1.00 12.88 N ATOM 1623 CA THR A 477 -2.740 53.008 20.492 1.00 14.27 C ATOM 1624 C THR A 477 -1.238 53.114 20.267 1.00 17.70 C ATOM 1625 O THR A 477 -0.757 54.131 19.759 1.00 15.41 O ATOM 1626 CB THR A 477 -3.085 53.560 21.907 1.00 17.14 C ATOM 1627 OG1 THR A 477 -2.438 52.791 22.929 1.00 16.67 O ATOM 1628 CG2 THR A 477 -4.605 53.529 22.128 1.00 21.00 C ATOM 1629 HA THR A 477 -3.271 53.617 19.761 1.00 0.00 H ATOM 1630 HB THR A 477 -2.728 54.588 21.965 1.00 0.00 H ATOM 1631 HG1 THR A 477 -2.739 51.850 22.872 1.00 0.00 H ATOM 1632 HG23 THR A 477 -5.096 54.114 21.350 1.00 0.00 H ATOM 1633 HG21 THR A 477 -4.956 52.498 22.085 1.00 0.00 H ATOM 1634 HG22 THR A 477 -4.838 53.953 23.105 1.00 0.00 H ATOM 1635 H THR A 477 -3.566 51.079 21.078 1.00 0.00 H ATOM 1636 N GLU A 478 -0.496 52.070 20.627 1.00 15.62 N ATOM 1637 CA GLU A 478 0.956 52.102 20.417 1.00 12.86 C ATOM 1638 C GLU A 478 1.303 52.123 18.935 1.00 15.58 C ATOM 1639 O GLU A 478 2.223 52.831 18.521 1.00 16.23 O ATOM 1640 CB GLU A 478 1.636 50.893 21.067 1.00 15.05 C ATOM 1641 CG GLU A 478 1.431 50.790 22.563 1.00 13.90 C ATOM 1642 CD GLU A 478 2.401 51.622 23.386 1.00 19.48 C ATOM 1643 OE1 GLU A 478 2.315 51.535 24.627 1.00 17.41 O ATOM 1644 OE2 GLU A 478 3.241 52.361 22.819 1.00 17.62 O ATOM 1645 HA GLU A 478 1.321 53.017 20.883 1.00 0.00 H ATOM 1646 HB2 GLU A 478 1.239 49.989 20.605 1.00 0.00 H ATOM 1647 HB3 GLU A 478 2.707 50.958 20.873 1.00 0.00 H ATOM 1648 HG2 GLU A 478 0.418 51.120 22.793 1.00 0.00 H ATOM 1649 HG3 GLU A 478 1.546 49.745 22.852 1.00 0.00 H ATOM 1650 H GLU A 478 -0.943 51.235 21.056 1.00 0.00 H ATOM 1651 N LEU A 479 0.586 51.334 18.140 1.00 14.05 N ATOM 1652 CA LEU A 479 0.779 51.346 16.693 1.00 15.59 C ATOM 1653 C LEU A 479 0.349 52.683 16.111 1.00 16.30 C ATOM 1654 O LEU A 479 1.019 53.224 15.230 1.00 14.72 O ATOM 1655 CB LEU A 479 -0.018 50.214 16.033 1.00 15.94 C ATOM 1656 CG LEU A 479 0.468 48.786 16.299 1.00 14.28 C ATOM 1657 CD1 LEU A 479 -0.513 47.797 15.669 1.00 16.95 C ATOM 1658 CD2 LEU A 479 1.861 48.582 15.730 1.00 15.21 C ATOM 1659 HA LEU A 479 1.839 51.195 16.491 1.00 0.00 H ATOM 1660 HB2 LEU A 479 -1.047 50.284 16.386 1.00 0.00 H ATOM 1661 HB3 LEU A 479 0.007 50.377 14.955 1.00 0.00 H ATOM 1662 HG LEU A 479 0.515 48.617 17.375 1.00 0.00 H ATOM 1663 HD21 LEU A 479 1.841 48.755 14.654 1.00 0.00 H ATOM 1664 HD22 LEU A 479 2.550 49.284 16.199 1.00 0.00 H ATOM 1665 HD23 LEU A 479 2.188 47.561 15.930 1.00 0.00 H ATOM 1666 HD11 LEU A 479 -1.500 47.936 16.109 1.00 0.00 H ATOM 1667 HD12 LEU A 479 -0.565 47.973 14.595 1.00 0.00 H ATOM 1668 HD13 LEU A 479 -0.171 46.779 15.856 1.00 0.00 H ATOM 1669 H LEU A 479 -0.124 50.698 18.556 1.00 0.00 H ATOM 1670 N GLN A 480 -0.760 53.227 16.604 1.00 13.09 N ATOM 1671 CA GLN A 480 -1.226 54.511 16.096 1.00 14.51 C ATOM 1672 C GLN A 480 -0.221 55.622 16.393 1.00 12.71 C ATOM 1673 O GLN A 480 -0.043 56.525 15.584 1.00 14.76 O ATOM 1674 CB GLN A 480 -2.587 54.879 16.699 1.00 15.17 C ATOM 1675 CG GLN A 480 -3.143 56.216 16.196 1.00 29.62 C ATOM 1676 CD GLN A 480 -3.304 56.266 14.684 1.00 53.02 C ATOM 1677 OE1 GLN A 480 -3.069 57.301 14.054 1.00 39.11 O ATOM 1678 NE2 GLN A 480 -3.708 55.149 14.095 1.00 31.03 N ATOM 1679 HA GLN A 480 -1.330 54.411 15.016 1.00 0.00 H ATOM 1680 HB2 GLN A 480 -3.299 54.093 16.447 1.00 0.00 H ATOM 1681 HB3 GLN A 480 -2.480 54.936 17.782 1.00 0.00 H ATOM 1682 HG2 GLN A 480 -4.118 56.381 16.654 1.00 0.00 H ATOM 1683 HG3 GLN A 480 -2.462 57.011 16.499 1.00 0.00 H ATOM 1684 HE22 GLN A 480 -3.895 54.299 14.664 1.00 0.00 H ATOM 1685 HE21 GLN A 480 -3.838 55.123 13.064 1.00 0.00 H ATOM 1686 H GLN A 480 -1.293 52.737 17.350 1.00 0.00 H ATOM 1687 N ALA A 481 0.434 55.560 17.554 1.00 13.40 N ATOM 1688 CA ALA A 481 1.412 56.579 17.912 1.00 15.73 C ATOM 1689 C ALA A 481 2.612 56.537 16.961 1.00 14.88 C ATOM 1690 O ALA A 481 3.168 57.577 16.578 1.00 12.31 O ATOM 1691 CB ALA A 481 1.880 56.378 19.362 1.00 12.12 C ATOM 1692 HA ALA A 481 0.937 57.556 17.824 1.00 0.00 H ATOM 1693 HB1 ALA A 481 1.024 56.453 20.032 1.00 0.00 H ATOM 1694 HB2 ALA A 481 2.337 55.393 19.462 1.00 0.00 H ATOM 1695 HB3 ALA A 481 2.610 57.146 19.616 1.00 0.00 H ATOM 1696 H ALA A 481 0.244 54.776 18.210 1.00 0.00 H ATOM 1697 N ILE A 482 3.017 55.335 16.583 1.00 12.98 N ATOM 1698 CA ILE A 482 4.139 55.205 15.663 1.00 12.27 C ATOM 1699 C ILE A 482 3.757 55.735 14.284 1.00 16.07 C ATOM 1700 O ILE A 482 4.543 56.413 13.623 1.00 12.04 O ATOM 1701 CB ILE A 482 4.604 53.743 15.582 1.00 11.22 C ATOM 1702 CG1 ILE A 482 5.321 53.384 16.884 1.00 13.82 C ATOM 1703 CG2 ILE A 482 5.516 53.546 14.384 1.00 13.91 C ATOM 1704 CD1 ILE A 482 5.613 51.890 17.064 1.00 15.95 C ATOM 1705 HA ILE A 482 4.970 55.801 16.039 1.00 0.00 H ATOM 1706 HB ILE A 482 3.745 53.085 15.453 1.00 0.00 H ATOM 1707 HG12 ILE A 482 6.269 53.921 16.909 1.00 0.00 H ATOM 1708 HG13 ILE A 482 4.698 53.711 17.716 1.00 0.00 H ATOM 1709 HD11 ILE A 482 4.675 51.334 17.057 1.00 0.00 H ATOM 1710 HD12 ILE A 482 6.248 51.544 16.248 1.00 0.00 H ATOM 1711 HD13 ILE A 482 6.123 51.733 18.015 1.00 0.00 H ATOM 1712 HG21 ILE A 482 4.976 53.799 13.472 1.00 0.00 H ATOM 1713 HG22 ILE A 482 6.388 54.193 14.483 1.00 0.00 H ATOM 1714 HG23 ILE A 482 5.837 52.505 14.341 1.00 0.00 H ATOM 1715 H ILE A 482 2.536 54.486 16.942 1.00 0.00 H ATOM 1716 N TYR A 483 2.526 55.458 13.870 1.00 15.73 N ATOM 1717 CA TYR A 483 2.015 55.975 12.610 1.00 18.19 C ATOM 1718 C TYR A 483 2.044 57.509 12.588 1.00 15.64 C ATOM 1719 O TYR A 483 2.447 58.109 11.589 1.00 15.47 O ATOM 1720 CB TYR A 483 0.584 55.483 12.392 1.00 13.66 C ATOM 1721 CG TYR A 483 -0.006 55.951 11.079 1.00 14.84 C ATOM 1722 CD1 TYR A 483 -0.897 57.011 11.034 1.00 27.58 C ATOM 1723 CD2 TYR A 483 0.325 55.321 9.896 1.00 26.18 C ATOM 1724 CE1 TYR A 483 -1.446 57.428 9.833 1.00 35.76 C ATOM 1725 CE2 TYR A 483 -0.216 55.728 8.694 1.00 29.48 C ATOM 1726 CZ TYR A 483 -1.099 56.778 8.668 1.00 30.92 C ATOM 1727 OH TYR A 483 -1.639 57.169 7.463 1.00 33.89 O ATOM 1728 HA TYR A 483 2.655 55.610 11.807 1.00 0.00 H ATOM 1729 HB3 TYR A 483 -0.039 55.854 13.206 1.00 0.00 H ATOM 1730 HB2 TYR A 483 0.585 54.393 12.404 1.00 0.00 H ATOM 1731 HD2 TYR A 483 1.027 54.487 9.912 1.00 0.00 H ATOM 1732 HE2 TYR A 483 0.057 55.218 7.770 1.00 0.00 H ATOM 1733 HE1 TYR A 483 -2.146 58.263 9.809 1.00 0.00 H ATOM 1734 HD1 TYR A 483 -1.170 57.524 11.956 1.00 0.00 H ATOM 1735 HH TYR A 483 -2.252 57.933 7.610 1.00 0.00 H ATOM 1736 H TYR A 483 1.914 54.858 14.459 1.00 0.00 H ATOM 1737 N LEU A 484 1.626 58.133 13.688 1.00 13.72 N ATOM 1738 CA LEU A 484 1.651 59.590 13.800 1.00 14.92 C ATOM 1739 C LEU A 484 3.077 60.126 13.689 1.00 14.48 C ATOM 1740 O LEU A 484 3.309 61.124 13.009 1.00 14.33 O ATOM 1741 CB LEU A 484 1.046 60.054 15.131 1.00 18.12 C ATOM 1742 CG LEU A 484 -0.460 59.936 15.366 1.00 23.62 C ATOM 1743 CD1 LEU A 484 -0.787 60.513 16.742 1.00 24.35 C ATOM 1744 CD2 LEU A 484 -1.226 60.694 14.287 1.00 23.94 C ATOM 1745 HA LEU A 484 1.053 59.983 12.978 1.00 0.00 H ATOM 1746 HB2 LEU A 484 1.534 59.478 15.917 1.00 0.00 H ATOM 1747 HB3 LEU A 484 1.301 61.108 15.243 1.00 0.00 H ATOM 1748 HG LEU A 484 -0.756 58.888 15.322 1.00 0.00 H ATOM 1749 HD21 LEU A 484 -0.943 61.746 14.313 1.00 0.00 H ATOM 1750 HD22 LEU A 484 -0.984 60.276 13.310 1.00 0.00 H ATOM 1751 HD23 LEU A 484 -2.297 60.600 14.469 1.00 0.00 H ATOM 1752 HD11 LEU A 484 -0.247 59.954 17.507 1.00 0.00 H ATOM 1753 HD12 LEU A 484 -0.487 61.560 16.776 1.00 0.00 H ATOM 1754 HD13 LEU A 484 -1.859 60.435 16.922 1.00 0.00 H ATOM 1755 H LEU A 484 1.273 57.569 14.487 1.00 0.00 H ATOM 1756 N ALA A 485 4.028 59.465 14.348 1.00 12.89 N ATOM 1757 CA ALA A 485 5.426 59.901 14.278 1.00 13.77 C ATOM 1758 C ALA A 485 5.946 59.806 12.848 1.00 14.17 C ATOM 1759 O ALA A 485 6.656 60.693 12.379 1.00 13.64 O ATOM 1760 CB ALA A 485 6.302 59.045 15.219 1.00 12.54 C ATOM 1761 HA ALA A 485 5.478 60.942 14.598 1.00 0.00 H ATOM 1762 HB1 ALA A 485 5.946 59.153 16.243 1.00 0.00 H ATOM 1763 HB2 ALA A 485 6.239 57.999 14.920 1.00 0.00 H ATOM 1764 HB3 ALA A 485 7.337 59.381 15.156 1.00 0.00 H ATOM 1765 H ALA A 485 3.776 58.632 14.917 1.00 0.00 H ATOM 1766 N LEU A 486 5.592 58.735 12.148 1.00 12.65 N ATOM 1767 CA LEU A 486 5.997 58.605 10.754 1.00 15.06 C ATOM 1768 C LEU A 486 5.311 59.661 9.885 1.00 16.43 C ATOM 1769 O LEU A 486 5.949 60.261 9.013 1.00 15.05 O ATOM 1770 CB LEU A 486 5.690 57.186 10.248 1.00 12.03 C ATOM 1771 CG LEU A 486 6.561 56.119 10.920 1.00 13.17 C ATOM 1772 CD1 LEU A 486 6.002 54.727 10.614 1.00 14.66 C ATOM 1773 CD2 LEU A 486 8.004 56.243 10.436 1.00 16.00 C ATOM 1774 HA LEU A 486 7.072 58.772 10.685 1.00 0.00 H ATOM 1775 HB2 LEU A 486 4.643 56.961 10.452 1.00 0.00 H ATOM 1776 HB3 LEU A 486 5.865 57.153 9.173 1.00 0.00 H ATOM 1777 HG LEU A 486 6.548 56.268 12.000 1.00 0.00 H ATOM 1778 HD21 LEU A 486 8.036 56.105 9.355 1.00 0.00 H ATOM 1779 HD22 LEU A 486 8.387 57.232 10.689 1.00 0.00 H ATOM 1780 HD23 LEU A 486 8.615 55.480 10.919 1.00 0.00 H ATOM 1781 HD11 LEU A 486 4.983 54.654 10.995 1.00 0.00 H ATOM 1782 HD12 LEU A 486 6.001 54.566 9.536 1.00 0.00 H ATOM 1783 HD13 LEU A 486 6.625 53.973 11.094 1.00 0.00 H ATOM 1784 H LEU A 486 5.024 57.987 12.595 1.00 0.00 H ATOM 1785 N GLN A 487 4.026 59.921 10.129 1.00 13.88 N ATOM 1786 CA GLN A 487 3.325 60.931 9.339 1.00 10.71 C ATOM 1787 C GLN A 487 3.940 62.323 9.476 1.00 14.50 C ATOM 1788 O GLN A 487 4.025 63.070 8.497 1.00 14.88 O ATOM 1789 CB GLN A 487 1.855 61.032 9.758 1.00 16.64 C ATOM 1790 CG GLN A 487 0.943 59.985 9.168 1.00 30.75 C ATOM 1791 CD GLN A 487 -0.507 60.440 9.174 1.00 53.19 C ATOM 1792 OE1 GLN A 487 -0.972 61.044 10.138 1.00 40.97 O ATOM 1793 NE2 GLN A 487 -1.226 60.156 8.094 1.00 48.61 N ATOM 1794 HA GLN A 487 3.414 60.603 8.303 1.00 0.00 H ATOM 1795 HB2 GLN A 487 1.807 60.947 10.844 1.00 0.00 H ATOM 1796 HB3 GLN A 487 1.485 62.011 9.455 1.00 0.00 H ATOM 1797 HG2 GLN A 487 1.248 59.788 8.140 1.00 0.00 H ATOM 1798 HG3 GLN A 487 1.029 59.070 9.753 1.00 0.00 H ATOM 1799 HE22 GLN A 487 -0.792 59.643 7.301 1.00 0.00 H ATOM 1800 HE21 GLN A 487 -2.223 60.447 8.042 1.00 0.00 H ATOM 1801 H GLN A 487 3.524 59.406 10.880 1.00 0.00 H ATOM 1802 N ASP A 488 4.340 62.681 10.691 1.00 12.39 N ATOM 1803 CA ASP A 488 4.687 64.063 10.992 1.00 12.11 C ATOM 1804 C ASP A 488 6.179 64.364 10.893 1.00 14.83 C ATOM 1805 O ASP A 488 6.591 65.525 10.947 1.00 16.31 O ATOM 1806 CB ASP A 488 4.174 64.437 12.379 1.00 15.08 C ATOM 1807 CG ASP A 488 2.657 64.545 12.429 1.00 19.04 C ATOM 1808 OD1 ASP A 488 2.007 64.378 11.372 1.00 18.83 O ATOM 1809 OD2 ASP A 488 2.116 64.803 13.520 1.00 19.19 O ATOM 1810 HA ASP A 488 4.203 64.670 10.227 1.00 0.00 H ATOM 1811 HB2 ASP A 488 4.494 63.674 13.088 1.00 0.00 H ATOM 1812 HB3 ASP A 488 4.603 65.398 12.663 1.00 0.00 H ATOM 1813 H ASP A 488 4.406 61.962 11.440 1.00 0.00 H ATOM 1814 N SER A 489 6.984 63.323 10.735 1.00 13.96 N ATOM 1815 CA SER A 489 8.439 63.497 10.668 1.00 14.67 C ATOM 1816 C SER A 489 8.957 63.723 9.254 1.00 15.82 C ATOM 1817 O SER A 489 8.268 63.446 8.274 1.00 14.60 O ATOM 1818 CB SER A 489 9.142 62.275 11.255 1.00 13.50 C ATOM 1819 OG SER A 489 8.694 61.083 10.635 1.00 12.95 O ATOM 1820 HA SER A 489 8.662 64.393 11.248 1.00 0.00 H ATOM 1821 HB2 SER A 489 8.932 62.222 12.323 1.00 0.00 H ATOM 1822 HB3 SER A 489 10.217 62.374 11.102 1.00 0.00 H ATOM 1823 HG SER A 489 7.719 60.986 10.775 1.00 0.00 H ATOM 1824 H SER A 489 6.578 62.369 10.657 1.00 0.00 H ATOM 1825 N GLY A 490 10.183 64.231 9.161 1.00 14.39 N ATOM 1826 CA GLY A 490 10.835 64.348 7.869 1.00 14.85 C ATOM 1827 C GLY A 490 11.325 63.002 7.363 1.00 18.96 C ATOM 1828 O GLY A 490 10.982 61.949 7.910 1.00 15.10 O ATOM 1829 HA3 GLY A 490 11.687 65.022 7.962 1.00 0.00 H ATOM 1830 HA2 GLY A 490 10.125 64.759 7.151 1.00 0.00 H ATOM 1831 H GLY A 490 10.678 64.546 10.020 1.00 0.00 H ATOM 1832 N LEU A 491 12.134 63.031 6.310 1.00 16.34 N ATOM 1833 CA LEU A 491 12.561 61.806 5.652 1.00 15.73 C ATOM 1834 C LEU A 491 13.552 60.972 6.464 1.00 13.93 C ATOM 1835 O LEU A 491 13.743 59.787 6.177 1.00 14.79 O ATOM 1836 CB LEU A 491 13.170 62.146 4.287 1.00 15.67 C ATOM 1837 CG LEU A 491 12.175 62.679 3.260 1.00 25.72 C ATOM 1838 CD1 LEU A 491 12.917 63.194 2.027 1.00 23.89 C ATOM 1839 CD2 LEU A 491 11.208 61.568 2.878 1.00 20.75 C ATOM 1840 HA LEU A 491 11.668 61.191 5.542 1.00 0.00 H ATOM 1841 HB2 LEU A 491 13.941 62.902 4.438 1.00 0.00 H ATOM 1842 HB3 LEU A 491 13.624 61.241 3.883 1.00 0.00 H ATOM 1843 HG LEU A 491 11.614 63.509 3.690 1.00 0.00 H ATOM 1844 HD21 LEU A 491 11.765 60.734 2.451 1.00 0.00 H ATOM 1845 HD22 LEU A 491 10.673 61.232 3.766 1.00 0.00 H ATOM 1846 HD23 LEU A 491 10.495 61.945 2.144 1.00 0.00 H ATOM 1847 HD11 LEU A 491 13.593 63.997 2.321 1.00 0.00 H ATOM 1848 HD12 LEU A 491 13.489 62.380 1.582 1.00 0.00 H ATOM 1849 HD13 LEU A 491 12.196 63.571 1.302 1.00 0.00 H ATOM 1850 H LEU A 491 12.469 63.947 5.949 1.00 0.00 H ATOM 1851 N GLU A 492 14.194 61.585 7.459 1.00 12.90 N ATOM 1852 CA GLU A 492 15.025 60.842 8.405 1.00 14.93 C ATOM 1853 C GLU A 492 14.462 61.045 9.802 1.00 14.16 C ATOM 1854 O GLU A 492 14.184 62.177 10.193 1.00 17.64 O ATOM 1855 CB GLU A 492 16.483 61.339 8.349 1.00 17.04 C ATOM 1856 CG GLU A 492 17.091 61.192 6.954 1.00 16.46 C ATOM 1857 CD GLU A 492 18.591 61.436 6.899 1.00 28.73 C ATOM 1858 OE1 GLU A 492 19.176 61.892 7.898 1.00 28.87 O ATOM 1859 OE2 GLU A 492 19.185 61.166 5.837 1.00 43.34 O ATOM 1860 HA GLU A 492 15.017 59.783 8.146 1.00 0.00 H ATOM 1861 HB2 GLU A 492 16.507 62.391 8.633 1.00 0.00 H ATOM 1862 HB3 GLU A 492 17.079 60.760 9.055 1.00 0.00 H ATOM 1863 HG2 GLU A 492 16.896 60.179 6.601 1.00 0.00 H ATOM 1864 HG3 GLU A 492 16.604 61.907 6.291 1.00 0.00 H ATOM 1865 H GLU A 492 14.101 62.615 7.565 1.00 0.00 H ATOM 1866 N VAL A 493 14.299 59.957 10.559 1.00 13.51 N ATOM 1867 CA VAL A 493 13.647 60.056 11.854 1.00 14.27 C ATOM 1868 C VAL A 493 14.092 58.966 12.828 1.00 12.00 C ATOM 1869 O VAL A 493 14.335 57.821 12.437 1.00 15.22 O ATOM 1870 CB VAL A 493 12.095 60.016 11.693 1.00 11.43 C ATOM 1871 CG1 VAL A 493 11.649 58.663 11.122 1.00 13.18 C ATOM 1872 CG2 VAL A 493 11.426 60.298 13.035 1.00 13.09 C ATOM 1873 HA VAL A 493 13.949 61.014 12.277 1.00 0.00 H ATOM 1874 HB VAL A 493 11.789 60.790 10.989 1.00 0.00 H ATOM 1875 HG11 VAL A 493 12.111 58.512 10.146 1.00 0.00 H ATOM 1876 HG12 VAL A 493 11.956 57.865 11.799 1.00 0.00 H ATOM 1877 HG13 VAL A 493 10.564 58.654 11.017 1.00 0.00 H ATOM 1878 HG21 VAL A 493 11.733 59.542 13.758 1.00 0.00 H ATOM 1879 HG22 VAL A 493 11.726 61.284 13.389 1.00 0.00 H ATOM 1880 HG23 VAL A 493 10.343 60.268 12.913 1.00 0.00 H ATOM 1881 H VAL A 493 14.640 59.035 10.220 1.00 0.00 H ATOM 1882 N ASN A 494 14.220 59.349 14.093 1.00 11.09 N ATOM 1883 CA ASN A 494 14.429 58.406 15.190 1.00 14.34 C ATOM 1884 C ASN A 494 13.111 58.249 15.935 1.00 13.15 C ATOM 1885 O ASN A 494 12.476 59.240 16.284 1.00 13.81 O ATOM 1886 CB ASN A 494 15.471 58.949 16.168 1.00 13.77 C ATOM 1887 CG ASN A 494 16.793 59.267 15.490 1.00 16.36 C ATOM 1888 OD1 ASN A 494 17.307 60.391 15.579 1.00 20.86 O ATOM 1889 ND2 ASN A 494 17.339 58.287 14.807 1.00 11.87 N ATOM 1890 HA ASN A 494 14.776 57.454 14.788 1.00 0.00 H ATOM 1891 HB2 ASN A 494 15.083 59.860 16.623 1.00 0.00 H ATOM 1892 HB3 ASN A 494 15.646 58.203 16.943 1.00 0.00 H ATOM 1893 HD22 ASN A 494 16.869 57.360 14.761 1.00 0.00 H ATOM 1894 HD21 ASN A 494 18.241 58.438 14.312 1.00 0.00 H ATOM 1895 H ASN A 494 14.169 60.364 14.313 1.00 0.00 H ATOM 1896 N ILE A 495 12.717 57.010 16.188 1.00 13.51 N ATOM 1897 CA ILE A 495 11.488 56.753 16.933 1.00 10.63 C ATOM 1898 C ILE A 495 11.792 55.846 18.103 1.00 11.26 C ATOM 1899 O ILE A 495 12.357 54.764 17.925 1.00 14.80 O ATOM 1900 CB ILE A 495 10.426 56.091 16.035 1.00 13.28 C ATOM 1901 CG1 ILE A 495 10.113 57.011 14.849 1.00 15.87 C ATOM 1902 CG2 ILE A 495 9.148 55.825 16.841 1.00 13.46 C ATOM 1903 CD1 ILE A 495 9.071 56.448 13.874 1.00 14.50 C ATOM 1904 HA ILE A 495 11.094 57.705 17.289 1.00 0.00 H ATOM 1905 HB ILE A 495 10.811 55.141 15.664 1.00 0.00 H ATOM 1906 HG12 ILE A 495 9.740 57.958 15.240 1.00 0.00 H ATOM 1907 HG13 ILE A 495 11.037 57.186 14.298 1.00 0.00 H ATOM 1908 HD11 ILE A 495 9.433 55.506 13.462 1.00 0.00 H ATOM 1909 HD12 ILE A 495 8.134 56.278 14.404 1.00 0.00 H ATOM 1910 HD13 ILE A 495 8.909 57.161 13.066 1.00 0.00 H ATOM 1911 HG21 ILE A 495 9.377 55.161 17.675 1.00 0.00 H ATOM 1912 HG22 ILE A 495 8.758 56.768 17.223 1.00 0.00 H ATOM 1913 HG23 ILE A 495 8.404 55.357 16.196 1.00 0.00 H ATOM 1914 H ILE A 495 13.290 56.210 15.852 1.00 0.00 H ATOM 1915 N VAL A 496 11.424 56.300 19.296 1.00 13.94 N ATOM 1916 CA VAL A 496 11.676 55.558 20.528 1.00 14.70 C ATOM 1917 C VAL A 496 10.346 55.130 21.120 1.00 10.34 C ATOM 1918 O VAL A 496 9.563 55.967 21.561 1.00 12.50 O ATOM 1919 CB VAL A 496 12.408 56.428 21.561 1.00 15.41 C ATOM 1920 CG1 VAL A 496 12.606 55.647 22.866 1.00 16.72 C ATOM 1921 CG2 VAL A 496 13.739 56.872 20.994 1.00 19.38 C ATOM 1922 HA VAL A 496 12.299 54.696 20.290 1.00 0.00 H ATOM 1923 HB VAL A 496 11.808 57.310 21.782 1.00 0.00 H ATOM 1924 HG11 VAL A 496 11.634 55.358 23.266 1.00 0.00 H ATOM 1925 HG12 VAL A 496 13.198 54.754 22.667 1.00 0.00 H ATOM 1926 HG13 VAL A 496 13.126 56.276 23.589 1.00 0.00 H ATOM 1927 HG21 VAL A 496 14.344 55.996 20.762 1.00 0.00 H ATOM 1928 HG22 VAL A 496 13.571 57.450 20.085 1.00 0.00 H ATOM 1929 HG23 VAL A 496 14.257 57.489 21.728 1.00 0.00 H ATOM 1930 H VAL A 496 10.938 57.218 19.355 1.00 0.00 H ATOM 1931 N THR A 497 10.116 53.818 21.121 1.00 12.58 N ATOM 1932 CA THR A 497 8.884 53.235 21.653 1.00 13.55 C ATOM 1933 C THR A 497 9.216 52.456 22.923 1.00 17.56 C ATOM 1934 O THR A 497 10.359 52.022 23.109 1.00 15.26 O ATOM 1935 CB THR A 497 8.229 52.287 20.608 1.00 15.20 C ATOM 1936 OG1 THR A 497 7.004 51.751 21.131 1.00 14.69 O ATOM 1937 CG2 THR A 497 9.174 51.132 20.241 1.00 15.39 C ATOM 1938 HA THR A 497 8.177 54.034 21.878 1.00 0.00 H ATOM 1939 HB THR A 497 8.023 52.868 19.709 1.00 0.00 H ATOM 1940 HG1 THR A 497 6.381 52.493 21.334 1.00 0.00 H ATOM 1941 HG23 THR A 497 10.104 51.538 19.844 1.00 0.00 H ATOM 1942 HG21 THR A 497 9.385 50.540 21.132 1.00 0.00 H ATOM 1943 HG22 THR A 497 8.700 50.502 19.488 1.00 0.00 H ATOM 1944 H THR A 497 10.840 53.183 20.728 1.00 0.00 H ATOM 1945 N ASP A 498 8.230 52.293 23.801 1.00 14.14 N ATOM 1946 CA ASP A 498 8.385 51.363 24.917 1.00 15.31 C ATOM 1947 C ASP A 498 7.506 50.127 24.758 1.00 13.17 C ATOM 1948 O ASP A 498 7.388 49.314 25.680 1.00 15.03 O ATOM 1949 CB ASP A 498 8.118 52.060 26.273 1.00 12.96 C ATOM 1950 CG ASP A 498 6.685 52.559 26.427 1.00 15.73 C ATOM 1951 OD1 ASP A 498 6.459 53.482 27.232 1.00 16.43 O ATOM 1952 OD2 ASP A 498 5.787 52.034 25.752 1.00 15.70 O ATOM 1953 HA ASP A 498 9.422 51.028 24.907 1.00 0.00 H ATOM 1954 HB2 ASP A 498 8.324 51.349 27.073 1.00 0.00 H ATOM 1955 HB3 ASP A 498 8.792 52.912 26.362 1.00 0.00 H ATOM 1956 H ASP A 498 7.346 52.830 23.693 1.00 0.00 H ATOM 1957 N SER A 499 6.921 49.972 23.573 1.00 13.17 N ATOM 1958 CA SER A 499 6.008 48.867 23.311 1.00 14.88 C ATOM 1959 C SER A 499 6.717 47.647 22.740 1.00 12.75 C ATOM 1960 O SER A 499 7.146 47.647 21.586 1.00 15.06 O ATOM 1961 CB SER A 499 4.916 49.306 22.337 1.00 16.73 C ATOM 1962 OG SER A 499 4.045 48.227 22.058 1.00 13.73 O ATOM 1963 HA SER A 499 5.573 48.586 24.270 1.00 0.00 H ATOM 1964 HB2 SER A 499 5.376 49.646 21.409 1.00 0.00 H ATOM 1965 HB3 SER A 499 4.346 50.123 22.779 1.00 0.00 H ATOM 1966 HG SER A 499 3.624 47.918 22.899 1.00 0.00 H ATOM 1967 H SER A 499 7.120 50.656 22.815 1.00 0.00 H ATOM 1968 N GLN A 500 6.814 46.591 23.540 1.00 13.61 N ATOM 1969 CA GLN A 500 7.409 45.350 23.056 1.00 14.25 C ATOM 1970 C GLN A 500 6.593 44.788 21.902 1.00 13.90 C ATOM 1971 O GLN A 500 7.153 44.279 20.936 1.00 16.89 O ATOM 1972 CB GLN A 500 7.492 44.321 24.185 1.00 15.14 C ATOM 1973 CG GLN A 500 8.462 44.716 25.286 1.00 18.05 C ATOM 1974 CD GLN A 500 8.463 43.716 26.423 1.00 27.32 C ATOM 1975 OE1 GLN A 500 7.445 43.507 27.078 1.00 37.46 O ATOM 1976 NE2 GLN A 500 9.608 43.087 26.655 1.00 29.87 N ATOM 1977 HA GLN A 500 8.417 45.567 22.704 1.00 0.00 H ATOM 1978 HB2 GLN A 500 6.500 44.205 24.622 1.00 0.00 H ATOM 1979 HB3 GLN A 500 7.815 43.369 23.763 1.00 0.00 H ATOM 1980 HG2 GLN A 500 9.466 44.775 24.867 1.00 0.00 H ATOM 1981 HG3 GLN A 500 8.175 45.693 25.676 1.00 0.00 H ATOM 1982 HE22 GLN A 500 10.444 43.298 26.073 1.00 0.00 H ATOM 1983 HE21 GLN A 500 9.669 42.383 27.418 1.00 0.00 H ATOM 1984 H GLN A 500 6.464 46.649 24.517 1.00 0.00 H ATOM 1985 N TYR A 501 5.269 44.883 22.002 1.00 13.30 N ATOM 1986 CA TYR A 501 4.406 44.409 20.924 1.00 13.26 C ATOM 1987 C TYR A 501 4.666 45.177 19.625 1.00 15.61 C ATOM 1988 O TYR A 501 4.939 44.579 18.586 1.00 16.38 O ATOM 1989 CB TYR A 501 2.936 44.547 21.325 1.00 14.80 C ATOM 1990 CG TYR A 501 1.983 44.439 20.155 1.00 19.50 C ATOM 1991 CD1 TYR A 501 1.694 43.209 19.582 1.00 21.81 C ATOM 1992 CD2 TYR A 501 1.379 45.571 19.620 1.00 18.67 C ATOM 1993 CE1 TYR A 501 0.828 43.107 18.508 1.00 25.42 C ATOM 1994 CE2 TYR A 501 0.509 45.481 18.536 1.00 19.11 C ATOM 1995 CZ TYR A 501 0.240 44.245 17.987 1.00 26.11 C ATOM 1996 OH TYR A 501 -0.609 44.138 16.906 1.00 27.74 O ATOM 1997 HA TYR A 501 4.635 43.358 20.749 1.00 0.00 H ATOM 1998 HB3 TYR A 501 2.796 45.519 21.797 1.00 0.00 H ATOM 1999 HB2 TYR A 501 2.697 43.760 22.040 1.00 0.00 H ATOM 2000 HD2 TYR A 501 1.590 46.547 20.057 1.00 0.00 H ATOM 2001 HE2 TYR A 501 0.046 46.378 18.126 1.00 0.00 H ATOM 2002 HE1 TYR A 501 0.610 42.132 18.073 1.00 0.00 H ATOM 2003 HD1 TYR A 501 2.157 42.308 19.985 1.00 0.00 H ATOM 2004 HH TYR A 501 -0.688 43.187 16.643 1.00 0.00 H ATOM 2005 H TYR A 501 4.845 45.299 22.856 1.00 0.00 H ATOM 2006 N ALA A 502 4.604 46.501 19.681 1.00 18.28 N ATOM 2007 CA ALA A 502 4.732 47.280 18.453 1.00 18.98 C ATOM 2008 C ALA A 502 6.089 47.068 17.791 1.00 16.22 C ATOM 2009 O ALA A 502 6.167 46.901 16.572 1.00 19.13 O ATOM 2010 CB ALA A 502 4.502 48.759 18.739 1.00 19.79 C ATOM 2011 HA ALA A 502 3.969 46.931 17.757 1.00 0.00 H ATOM 2012 HB1 ALA A 502 3.501 48.898 19.146 1.00 0.00 H ATOM 2013 HB2 ALA A 502 5.241 49.107 19.461 1.00 0.00 H ATOM 2014 HB3 ALA A 502 4.601 49.326 17.814 1.00 0.00 H ATOM 2015 H ALA A 502 4.465 46.981 20.593 1.00 0.00 H ATOM 2016 N LEU A 503 7.162 47.067 18.580 1.00 15.23 N ATOM 2017 CA LEU A 503 8.498 46.864 18.018 1.00 18.67 C ATOM 2018 C LEU A 503 8.599 45.453 17.451 1.00 20.61 C ATOM 2019 O LEU A 503 9.191 45.235 16.390 1.00 21.69 O ATOM 2020 CB LEU A 503 9.576 47.052 19.087 1.00 23.56 C ATOM 2021 CG LEU A 503 11.005 46.813 18.582 1.00 29.88 C ATOM 2022 CD1 LEU A 503 11.400 47.921 17.619 1.00 36.50 C ATOM 2023 CD2 LEU A 503 11.966 46.760 19.757 1.00 46.82 C ATOM 2024 HA LEU A 503 8.655 47.600 17.230 1.00 0.00 H ATOM 2025 HB2 LEU A 503 9.512 48.073 19.463 1.00 0.00 H ATOM 2026 HB3 LEU A 503 9.378 46.353 19.900 1.00 0.00 H ATOM 2027 HG LEU A 503 11.049 45.860 18.055 1.00 0.00 H ATOM 2028 HD21 LEU A 503 11.929 47.705 20.298 1.00 0.00 H ATOM 2029 HD22 LEU A 503 11.679 45.947 20.423 1.00 0.00 H ATOM 2030 HD23 LEU A 503 12.978 46.590 19.390 1.00 0.00 H ATOM 2031 HD11 LEU A 503 10.713 47.927 16.773 1.00 0.00 H ATOM 2032 HD12 LEU A 503 11.354 48.881 18.133 1.00 0.00 H ATOM 2033 HD13 LEU A 503 12.415 47.747 17.263 1.00 0.00 H ATOM 2034 H LEU A 503 7.050 47.212 19.604 1.00 0.00 H ATOM 2035 N GLY A 504 8.003 44.503 18.162 1.00 17.57 N ATOM 2036 CA GLY A 504 8.050 43.114 17.741 1.00 20.33 C ATOM 2037 C GLY A 504 7.320 42.873 16.430 1.00 25.30 C ATOM 2038 O GLY A 504 7.853 42.226 15.528 1.00 27.41 O ATOM 2039 HA3 GLY A 504 7.590 42.499 18.515 1.00 0.00 H ATOM 2040 HA2 GLY A 504 9.093 42.822 17.619 1.00 0.00 H ATOM 2041 H GLY A 504 7.495 44.757 19.033 1.00 0.00 H ATOM 2042 N ILE A 505 6.105 43.402 16.310 1.00 21.59 N ATOM 2043 CA ILE A 505 5.285 43.104 15.146 1.00 25.80 C ATOM 2044 C ILE A 505 5.833 43.843 13.920 1.00 30.92 C ATOM 2045 O ILE A 505 5.827 43.306 12.810 1.00 27.02 O ATOM 2046 CB ILE A 505 3.789 43.462 15.419 1.00 24.73 C ATOM 2047 CG1 ILE A 505 2.876 42.742 14.421 1.00 40.48 C ATOM 2048 CG2 ILE A 505 3.574 44.957 15.327 1.00 24.63 C ATOM 2049 CD1 ILE A 505 2.934 43.286 13.014 1.00 64.78 C ATOM 2050 HA ILE A 505 5.327 42.034 14.942 1.00 0.00 H ATOM 2051 HB ILE A 505 3.539 43.133 16.428 1.00 0.00 H ATOM 2052 HG12 ILE A 505 3.164 41.691 14.392 1.00 0.00 H ATOM 2053 HG13 ILE A 505 1.849 42.826 14.777 1.00 0.00 H ATOM 2054 HD11 ILE A 505 2.635 44.334 13.019 1.00 0.00 H ATOM 2055 HD12 ILE A 505 3.952 43.198 12.634 1.00 0.00 H ATOM 2056 HD13 ILE A 505 2.257 42.717 12.377 1.00 0.00 H ATOM 2057 HG21 ILE A 505 4.198 45.459 16.066 1.00 0.00 H ATOM 2058 HG22 ILE A 505 3.844 45.301 14.328 1.00 0.00 H ATOM 2059 HG23 ILE A 505 2.526 45.185 15.520 1.00 0.00 H ATOM 2060 H ILE A 505 5.740 44.032 17.052 1.00 0.00 H ATOM 2061 N ILE A 506 6.348 45.055 14.126 1.00 21.58 N ATOM 2062 CA ILE A 506 6.985 45.806 13.047 1.00 19.58 C ATOM 2063 C ILE A 506 8.290 45.161 12.592 1.00 33.74 C ATOM 2064 O ILE A 506 8.504 44.952 11.395 1.00 30.08 O ATOM 2065 CB ILE A 506 7.263 47.264 13.478 1.00 19.39 C ATOM 2066 CG1 ILE A 506 5.933 48.005 13.626 1.00 17.22 C ATOM 2067 CG2 ILE A 506 8.180 47.945 12.475 1.00 24.68 C ATOM 2068 CD1 ILE A 506 6.056 49.420 14.192 1.00 20.26 C ATOM 2069 HA ILE A 506 6.287 45.799 12.210 1.00 0.00 H ATOM 2070 HB ILE A 506 7.773 47.276 14.441 1.00 0.00 H ATOM 2071 HG12 ILE A 506 5.468 48.071 12.642 1.00 0.00 H ATOM 2072 HG13 ILE A 506 5.292 47.426 14.291 1.00 0.00 H ATOM 2073 HD11 ILE A 506 6.507 49.375 15.183 1.00 0.00 H ATOM 2074 HD12 ILE A 506 6.683 50.020 13.533 1.00 0.00 H ATOM 2075 HD13 ILE A 506 5.065 49.869 14.262 1.00 0.00 H ATOM 2076 HG21 ILE A 506 9.124 47.403 12.421 1.00 0.00 H ATOM 2077 HG22 ILE A 506 7.705 47.948 11.494 1.00 0.00 H ATOM 2078 HG23 ILE A 506 8.366 48.971 12.793 1.00 0.00 H ATOM 2079 H ILE A 506 6.295 45.475 15.076 1.00 0.00 H ATOM 2080 N THR A 79 9.153 44.839 13.551 1.00 29.76 N ATOM 2081 CA THR A 79 10.412 44.155 13.267 1.00 38.01 C ATOM 2082 C THR A 79 10.187 42.840 12.525 1.00 31.41 C ATOM 2083 O THR A 79 10.931 42.500 11.605 1.00 40.39 O ATOM 2084 CB THR A 79 11.191 43.869 14.573 1.00 31.50 C ATOM 2085 OG1 THR A 79 11.696 45.101 15.103 1.00 38.59 O ATOM 2086 CG2 THR A 79 12.349 42.922 14.310 1.00 52.43 C ATOM 2087 HA THR A 79 10.995 44.821 12.631 1.00 0.00 H ATOM 2088 HB THR A 79 10.514 43.403 15.289 1.00 0.00 H ATOM 2089 HG1 THR A 79 10.940 45.711 15.294 1.00 0.00 H ATOM 2090 HG23 THR A 79 11.966 41.985 13.907 1.00 0.00 H ATOM 2091 HG21 THR A 79 13.032 43.376 13.592 1.00 0.00 H ATOM 2092 HG22 THR A 79 12.878 42.728 15.243 1.00 0.00 H ATOM 2093 H THR A 79 8.924 45.082 14.536 1.00 0.00 H ATOM 2094 N GLN A 80 9.156 42.107 12.922 1.00 32.97 N ATOM 2095 CA GLN A 80 8.831 40.838 12.282 1.00 38.47 C ATOM 2096 C GLN A 80 8.483 41.062 10.809 1.00 50.78 C ATOM 2097 O GLN A 80 8.607 40.160 9.980 1.00 36.16 O ATOM 2098 CB GLN A 80 7.650 40.183 13.001 1.00 29.34 C ATOM 2099 CG GLN A 80 7.162 38.883 12.375 1.00 59.37 C ATOM 2100 CD GLN A 80 8.156 37.745 12.524 1.00 76.50 C ATOM 2101 OE1 GLN A 80 9.207 37.899 13.148 1.00 74.01 O ATOM 2102 NE2 GLN A 80 7.826 36.593 11.948 1.00 60.56 N ATOM 2103 HA GLN A 80 9.698 40.180 12.342 1.00 0.00 H ATOM 2104 HB2 GLN A 80 7.952 39.973 14.027 1.00 0.00 H ATOM 2105 HB3 GLN A 80 6.821 40.890 13.005 1.00 0.00 H ATOM 2106 HG2 GLN A 80 6.228 38.594 12.856 1.00 0.00 H ATOM 2107 HG3 GLN A 80 6.985 39.053 11.313 1.00 0.00 H ATOM 2108 HE22 GLN A 80 6.928 36.509 11.431 1.00 0.00 H ATOM 2109 HE21 GLN A 80 8.466 35.776 12.015 1.00 0.00 H ATOM 2110 H GLN A 80 8.565 42.445 13.708 1.00 0.00 H ATOM 2111 N TRP A 81 8.046 42.273 10.487 1.00 36.84 N ATOM 2112 CA TRP A 81 7.658 42.606 9.122 1.00 24.99 C ATOM 2113 C TRP A 81 8.901 42.903 8.297 1.00 27.41 C ATOM 2114 O TRP A 81 9.091 42.352 7.213 1.00 45.81 O ATOM 2115 CB TRP A 81 6.728 43.818 9.137 1.00 35.68 C ATOM 2116 CG TRP A 81 5.685 43.793 8.073 1.00 42.24 C ATOM 2117 CD1 TRP A 81 4.350 43.560 8.240 1.00 42.11 C ATOM 2118 CD2 TRP A 81 5.883 44.016 6.671 1.00 43.56 C ATOM 2119 NE1 TRP A 81 3.704 43.623 7.027 1.00 52.76 N ATOM 2120 CE2 TRP A 81 4.623 43.901 6.048 1.00 47.97 C ATOM 2121 CE3 TRP A 81 7.003 44.300 5.882 1.00 40.65 C ATOM 2122 CZ2 TRP A 81 4.452 44.061 4.672 1.00 28.17 C ATOM 2123 CZ3 TRP A 81 6.830 44.458 4.514 1.00 44.09 C ATOM 2124 CH2 TRP A 81 5.565 44.337 3.924 1.00 36.94 C ATOM 2125 HA TRP A 81 7.132 41.763 8.674 1.00 0.00 H ATOM 2126 HB2 TRP A 81 6.230 43.856 10.106 1.00 0.00 H ATOM 2127 HB3 TRP A 81 7.332 44.716 9.005 1.00 0.00 H ATOM 2128 HE1 TRP A 81 2.685 43.483 6.877 1.00 0.00 H ATOM 2129 HD1 TRP A 81 3.867 43.354 9.195 1.00 0.00 H ATOM 2130 HZ2 TRP A 81 3.469 43.970 4.210 1.00 0.00 H ATOM 2131 HH2 TRP A 81 5.465 44.465 2.846 1.00 0.00 H ATOM 2132 HZ3 TRP A 81 7.694 44.680 3.887 1.00 0.00 H ATOM 2133 HE3 TRP A 81 7.991 44.395 6.332 1.00 0.00 H ATOM 2134 H TRP A 81 7.979 43.002 11.226 1.00 0.00 H ATOM 2135 N ILE A 82 9.765 43.754 8.832 1.00 28.20 N ATOM 2136 CA ILE A 82 10.959 44.183 8.126 1.00 24.94 C ATOM 2137 C ILE A 82 11.962 43.047 7.910 1.00 48.78 C ATOM 2138 O ILE A 82 12.712 43.049 6.932 1.00 45.19 O ATOM 2139 CB ILE A 82 11.627 45.336 8.878 1.00 35.69 C ATOM 2140 CG1 ILE A 82 10.676 46.535 8.889 1.00 34.18 C ATOM 2141 CG2 ILE A 82 12.958 45.689 8.233 1.00 43.21 C ATOM 2142 CD1 ILE A 82 11.064 47.618 9.857 1.00 44.22 C ATOM 2143 HA ILE A 82 10.641 44.518 7.139 1.00 0.00 H ATOM 2144 HB ILE A 82 11.834 45.039 9.906 1.00 0.00 H ATOM 2145 HG12 ILE A 82 10.653 46.963 7.887 1.00 0.00 H ATOM 2146 HG13 ILE A 82 9.680 46.180 9.154 1.00 0.00 H ATOM 2147 HD11 ILE A 82 11.080 47.211 10.868 1.00 0.00 H ATOM 2148 HD12 ILE A 82 12.054 47.995 9.600 1.00 0.00 H ATOM 2149 HD13 ILE A 82 10.339 48.430 9.802 1.00 0.00 H ATOM 2150 HG21 ILE A 82 13.615 44.820 8.259 1.00 0.00 H ATOM 2151 HG22 ILE A 82 12.791 45.989 7.198 1.00 0.00 H ATOM 2152 HG23 ILE A 82 13.419 46.511 8.781 1.00 0.00 H ATOM 2153 H ILE A 82 9.582 44.126 9.786 1.00 0.00 H ATOM 2154 N HIS A 83 11.970 42.071 8.812 1.00 43.76 N ATOM 2155 CA HIS A 83 12.805 40.885 8.629 1.00 36.35 C ATOM 2156 C HIS A 83 12.169 39.921 7.632 1.00 40.91 C ATOM 2157 O HIS A 83 12.859 39.332 6.798 1.00 45.75 O ATOM 2158 CB HIS A 83 13.017 40.162 9.960 1.00 43.68 C ATOM 2159 CG HIS A 83 13.810 38.899 9.839 1.00 55.47 C ATOM 2160 ND1 HIS A 83 15.183 38.867 9.967 1.00 59.41 N ATOM 2161 CD2 HIS A 83 13.425 37.623 9.599 1.00 48.02 C ATOM 2162 CE1 HIS A 83 15.608 37.626 9.811 1.00 55.36 C ATOM 2163 NE2 HIS A 83 14.561 36.852 9.587 1.00 54.56 N ATOM 2164 HA HIS A 83 13.768 41.218 8.241 1.00 0.00 H ATOM 2165 HB2 HIS A 83 13.542 40.835 10.638 1.00 0.00 H ATOM 2166 HB3 HIS A 83 12.041 39.917 10.378 1.00 0.00 H ATOM 2167 HD2 HIS A 83 12.404 37.273 9.444 1.00 0.00 H ATOM 2168 HE1 HIS A 83 16.646 37.297 9.859 1.00 0.00 H ATOM 2169 H HIS A 83 11.374 42.152 9.660 1.00 0.00 H ATOM 2170 N ASN A 84 10.851 39.760 7.728 1.00 27.30 N ATOM 2171 CA ASN A 84 10.105 38.918 6.800 1.00 25.75 C ATOM 2172 C ASN A 84 10.380 39.381 5.380 1.00 52.59 C ATOM 2173 O ASN A 84 10.807 38.611 4.518 1.00 50.67 O ATOM 2174 CB ASN A 84 8.609 39.030 7.112 1.00 34.11 C ATOM 2175 CG ASN A 84 7.720 38.687 5.921 1.00 72.72 C ATOM 2176 OD1 ASN A 84 8.190 38.253 4.868 1.00 70.25 O ATOM 2177 ND2 ASN A 84 6.417 38.885 6.091 1.00 76.17 N ATOM 2178 HA ASN A 84 10.414 37.878 6.903 1.00 0.00 H ATOM 2179 HB2 ASN A 84 8.373 38.348 7.929 1.00 0.00 H ATOM 2180 HB3 ASN A 84 8.395 40.053 7.421 1.00 0.00 H ATOM 2181 HD22 ASN A 84 6.061 39.253 6.996 1.00 0.00 H ATOM 2182 HD21 ASN A 84 5.754 38.672 5.319 1.00 0.00 H ATOM 2183 H ASN A 84 10.338 40.250 8.488 1.00 0.00 H ATOM 2184 N TRP A 85 10.121 40.659 5.157 1.00 54.84 N ATOM 2185 CA TRP A 85 10.399 41.315 3.895 1.00 44.69 C ATOM 2186 C TRP A 85 11.772 40.909 3.357 1.00 44.22 C ATOM 2187 O TRP A 85 11.913 40.560 2.186 1.00 54.06 O ATOM 2188 CB TRP A 85 10.335 42.825 4.128 1.00 53.27 C ATOM 2189 CG TRP A 85 10.466 43.650 2.911 1.00 55.56 C ATOM 2190 CD1 TRP A 85 10.356 43.232 1.623 1.00 55.70 C ATOM 2191 CD2 TRP A 85 10.717 45.058 2.860 1.00 51.16 C ATOM 2192 NE1 TRP A 85 10.523 44.293 0.768 1.00 52.64 N ATOM 2193 CE2 TRP A 85 10.746 45.427 1.504 1.00 43.70 C ATOM 2194 CE3 TRP A 85 10.922 46.041 3.833 1.00 57.51 C ATOM 2195 CZ2 TRP A 85 10.969 46.738 1.092 1.00 57.05 C ATOM 2196 CZ3 TRP A 85 11.145 47.342 3.423 1.00 60.27 C ATOM 2197 CH2 TRP A 85 11.167 47.679 2.064 1.00 62.46 C ATOM 2198 HA TRP A 85 9.662 41.016 3.150 1.00 0.00 H ATOM 2199 HB2 TRP A 85 9.376 43.056 4.592 1.00 0.00 H ATOM 2200 HB3 TRP A 85 11.141 43.097 4.809 1.00 0.00 H ATOM 2201 HE1 TRP A 85 10.486 44.244 -0.270 1.00 0.00 H ATOM 2202 HD1 TRP A 85 10.163 42.205 1.314 1.00 0.00 H ATOM 2203 HZ2 TRP A 85 10.985 47.004 0.035 1.00 0.00 H ATOM 2204 HH2 TRP A 85 11.346 48.715 1.775 1.00 0.00 H ATOM 2205 HZ3 TRP A 85 11.306 48.119 4.170 1.00 0.00 H ATOM 2206 HE3 TRP A 85 10.906 45.787 4.893 1.00 0.00 H ATOM 2207 H TRP A 85 9.698 41.220 5.924 1.00 0.00 H ATOM 2208 N LYS A 86 12.779 40.947 4.226 1.00 36.50 N ATOM 2209 CA LYS A 86 14.161 40.710 3.824 1.00 35.79 C ATOM 2210 C LYS A 86 14.425 39.271 3.392 1.00 51.13 C ATOM 2211 O LYS A 86 15.251 39.023 2.510 1.00 43.49 O ATOM 2212 CB LYS A 86 15.112 41.071 4.969 1.00 37.13 C ATOM 2213 CG LYS A 86 16.568 40.719 4.694 1.00 32.59 C ATOM 2214 CD LYS A 86 17.452 40.993 5.897 1.00 41.57 C ATOM 2215 CE LYS A 86 18.868 40.501 5.654 1.00 58.92 C ATOM 2216 NZ LYS A 86 19.736 40.684 6.850 1.00 88.83 N ATOM 2217 HA LYS A 86 14.341 41.348 2.958 1.00 0.00 H ATOM 2218 HB2 LYS A 86 15.045 42.144 5.146 1.00 0.00 H ATOM 2219 HB3 LYS A 86 14.792 40.536 5.863 1.00 0.00 H ATOM 2220 HG2 LYS A 86 16.634 39.661 4.441 1.00 0.00 H ATOM 2221 HG3 LYS A 86 16.922 41.315 3.853 1.00 0.00 H ATOM 2222 HD2 LYS A 86 17.475 42.066 6.086 1.00 0.00 H ATOM 2223 HD3 LYS A 86 17.040 40.481 6.767 1.00 0.00 H ATOM 2224 HE2 LYS A 86 19.296 41.057 4.820 1.00 0.00 H ATOM 2225 HE3 LYS A 86 18.834 39.441 5.402 1.00 0.00 H ATOM 2226 HZ1 LYS A 86 19.780 41.694 7.093 1.00 0.00 H ATOM 2227 HZ2 LYS A 86 19.339 40.150 7.650 1.00 0.00 H ATOM 2228 HZ3 LYS A 86 20.693 40.335 6.639 1.00 0.00 H ATOM 2229 H LYS A 86 12.574 41.152 5.225 1.00 0.00 H ATOM 2230 N LYS A 87 13.729 38.324 4.014 1.00 56.52 N ATOM 2231 CA LYS A 87 14.029 36.910 3.805 1.00 64.59 C ATOM 2232 C LYS A 87 12.897 36.132 3.136 1.00 48.98 C ATOM 2233 O LYS A 87 13.126 35.072 2.551 1.00 59.63 O ATOM 2234 CB LYS A 87 14.393 36.252 5.142 1.00 61.69 C ATOM 2235 CG LYS A 87 15.658 36.819 5.777 1.00 61.44 C ATOM 2236 CD LYS A 87 16.154 35.951 6.927 1.00 90.04 C ATOM 2237 CE LYS A 87 17.535 36.391 7.396 1.00 81.41 C ATOM 2238 NZ LYS A 87 18.011 35.597 8.566 1.00 85.32 N ATOM 2239 HA LYS A 87 14.874 36.874 3.117 1.00 0.00 H ATOM 2240 HB2 LYS A 87 13.564 36.397 5.835 1.00 0.00 H ATOM 2241 HB3 LYS A 87 14.540 35.185 4.973 1.00 0.00 H ATOM 2242 HG2 LYS A 87 16.438 36.878 5.018 1.00 0.00 H ATOM 2243 HG3 LYS A 87 15.445 37.819 6.156 1.00 0.00 H ATOM 2244 HD2 LYS A 87 15.454 36.029 7.759 1.00 0.00 H ATOM 2245 HD3 LYS A 87 16.205 34.915 6.594 1.00 0.00 H ATOM 2246 HE2 LYS A 87 17.492 37.443 7.679 1.00 0.00 H ATOM 2247 HE3 LYS A 87 18.241 36.266 6.575 1.00 0.00 H ATOM 2248 HZ1 LYS A 87 17.347 35.716 9.357 1.00 0.00 H ATOM 2249 HZ2 LYS A 87 18.063 34.592 8.303 1.00 0.00 H ATOM 2250 HZ3 LYS A 87 18.954 35.931 8.850 1.00 0.00 H ATOM 2251 H LYS A 87 12.959 38.594 4.659 1.00 0.00 H ATOM 2252 N ARG A 88 11.682 36.658 3.221 1.00 32.36 N ATOM 2253 CA ARG A 88 10.508 35.966 2.694 1.00 35.18 C ATOM 2254 C ARG A 88 9.691 36.821 1.720 1.00 70.72 C ATOM 2255 O ARG A 88 9.087 36.290 0.790 1.00 76.73 O ATOM 2256 CB ARG A 88 9.613 35.515 3.850 1.00 69.26 C ATOM 2257 CG ARG A 88 10.345 34.726 4.924 1.00 73.92 C ATOM 2258 CD ARG A 88 10.273 33.231 4.669 1.00 91.36 C ATOM 2259 NE ARG A 88 8.933 32.700 4.906 1.00 94.89 N ATOM 2260 CZ ARG A 88 8.440 32.429 6.111 1.00 77.56 C ATOM 2261 NH1 ARG A 88 9.176 32.640 7.194 1.00 75.89 N ATOM 2262 NH2 ARG A 88 7.212 31.946 6.234 1.00 83.73 N ATOM 2263 HA ARG A 88 10.875 35.106 2.133 1.00 0.00 H ATOM 2264 HB2 ARG A 88 9.176 36.400 4.312 1.00 0.00 H ATOM 2265 HB3 ARG A 88 8.818 34.888 3.445 1.00 0.00 H ATOM 2266 HG2 ARG A 88 11.391 35.033 4.937 1.00 0.00 H ATOM 2267 HG3 ARG A 88 9.892 34.942 5.892 1.00 0.00 H ATOM 2268 HD2 ARG A 88 10.975 32.726 5.333 1.00 0.00 H ATOM 2269 HD3 ARG A 88 10.551 33.036 3.633 1.00 0.00 H ATOM 2270 HE ARG A 88 8.326 32.523 4.080 1.00 0.00 H ATOM 2271 HH12 ARG A 88 8.789 32.427 8.135 1.00 0.00 H ATOM 2272 HH11 ARG A 88 10.140 33.018 7.102 1.00 0.00 H ATOM 2273 HH22 ARG A 88 6.828 31.735 7.177 1.00 0.00 H ATOM 2274 HH21 ARG A 88 6.632 31.778 5.387 1.00 0.00 H ATOM 2275 H ARG A 88 11.562 37.586 3.674 1.00 0.00 H ATOM 2276 N GLY A 89 9.666 38.136 1.938 1.00 73.84 N ATOM 2277 CA GLY A 89 8.950 39.034 1.040 1.00 69.42 C ATOM 2278 C GLY A 89 7.458 39.130 1.315 1.00 71.39 C ATOM 2279 O GLY A 89 6.856 38.177 1.809 1.00 82.95 O ATOM 2280 HA3 GLY A 89 9.088 38.678 0.019 1.00 0.00 H ATOM 2281 HA2 GLY A 89 9.381 40.031 1.137 1.00 0.00 H ATOM 2282 H GLY A 89 10.165 38.528 2.762 1.00 0.00 H ATOM 2283 N TRP A 90 6.851 40.271 0.992 1.00 69.65 N ATOM 2284 CA TRP A 90 5.430 40.480 1.276 1.00 56.17 C ATOM 2285 C TRP A 90 4.549 39.764 0.260 1.00 62.39 C ATOM 2286 O TRP A 90 3.345 39.611 0.467 1.00 71.06 O ATOM 2287 CB TRP A 90 5.084 41.980 1.289 1.00 61.96 C ATOM 2288 CG TRP A 90 5.016 42.630 -0.074 1.00 61.88 C ATOM 2289 CD1 TRP A 90 6.068 43.055 -0.831 1.00 65.44 C ATOM 2290 CD2 TRP A 90 3.832 42.913 -0.840 1.00 55.40 C ATOM 2291 NE1 TRP A 90 5.618 43.582 -2.019 1.00 65.10 N ATOM 2292 CE2 TRP A 90 4.250 43.507 -2.050 1.00 53.45 C ATOM 2293 CE3 TRP A 90 2.462 42.722 -0.620 1.00 62.32 C ATOM 2294 CZ2 TRP A 90 3.348 43.908 -3.039 1.00 49.49 C ATOM 2295 CZ3 TRP A 90 1.566 43.122 -1.604 1.00 57.29 C ATOM 2296 CH2 TRP A 90 2.015 43.709 -2.798 1.00 56.27 C ATOM 2297 HA TRP A 90 5.236 40.061 2.263 1.00 0.00 H ATOM 2298 HB2 TRP A 90 4.113 42.100 1.770 1.00 0.00 H ATOM 2299 HB3 TRP A 90 5.844 42.498 1.874 1.00 0.00 H ATOM 2300 HE1 TRP A 90 6.219 43.974 -2.772 1.00 0.00 H ATOM 2301 HD1 TRP A 90 7.115 42.987 -0.537 1.00 0.00 H ATOM 2302 HZ2 TRP A 90 3.693 44.362 -3.968 1.00 0.00 H ATOM 2303 HH2 TRP A 90 1.286 44.013 -3.549 1.00 0.00 H ATOM 2304 HZ3 TRP A 90 0.497 42.978 -1.446 1.00 0.00 H ATOM 2305 HE3 TRP A 90 2.106 42.269 0.305 1.00 0.00 H ATOM 2306 H TRP A 90 7.396 41.027 0.530 1.00 0.00 H TER 2307 TRP A 90 HETATM 2308 MN MN A 1 3.753 52.112 26.055 1.00 15.42 MN HETATM 2309 MN MN A 2 2.911 54.359 28.865 1.00 23.74 MN HETATM 2310 O HOH 3 8.620 56.608 24.210 1.00 14.86 O HETATM 2311 O HOH 4 3.767 45.465 24.481 1.00 17.96 O HETATM 2312 O HOH 5 11.563 65.420 11.452 1.00 18.52 O HETATM 2313 O HOH 6 2.921 48.102 24.545 1.00 16.73 O HETATM 2314 O HOH 7 5.743 53.465 23.062 1.00 16.32 O HETATM 2315 O HOH 8 8.798 72.696 18.359 1.00 19.14 O HETATM 2316 O HOH 9 4.662 46.456 30.134 1.00 21.23 O HETATM 2317 O HOH 10 7.907 61.688 5.202 1.00 22.15 O HETATM 2318 O HOH 11 6.920 55.652 30.891 1.00 18.03 O HETATM 2319 O HOH 12 14.181 64.718 11.254 1.00 16.58 O HETATM 2320 O HOH 13 14.948 52.999 -0.233 1.00 23.93 O HETATM 2321 O HOH 14 16.916 53.227 7.507 1.00 21.14 O HETATM 2322 O HOH 15 11.286 55.176 30.801 1.00 22.62 O HETATM 2323 O HOH 16 16.248 50.637 14.132 1.00 23.02 O HETATM 2324 O HOH 17 6.116 46.917 26.406 1.00 17.72 O HETATM 2325 O HOH 18 8.485 49.056 28.059 1.00 22.44 O HETATM 2326 O HOH 19 4.517 52.864 20.285 1.00 21.56 O HETATM 2327 O HOH 20 9.804 48.729 32.596 1.00 23.54 O HETATM 2328 O HOH 21 6.027 64.750 7.514 1.00 22.11 O HETATM 2329 O HOH 22 6.764 58.176 4.922 1.00 21.52 O HETATM 2330 O HOH 23 1.258 44.418 24.597 1.00 28.24 O HETATM 2331 O HOH 24 14.875 64.535 7.628 1.00 25.44 O HETATM 2332 O HOH 25 9.766 47.019 35.583 1.00 26.12 O HETATM 2333 O HOH 26 3.256 68.284 16.739 1.00 20.83 O HETATM 2334 O HOH 27 12.771 65.616 5.214 1.00 25.43 O HETATM 2335 O HOH 28 0.031 50.799 25.928 1.00 26.97 O HETATM 2336 O HOH 29 -3.697 64.366 27.107 1.00 29.59 O HETATM 2337 O HOH 30 6.922 56.439 35.636 1.00 31.56 O HETATM 2338 O HOH 31 17.378 51.358 3.386 1.00 26.62 O HETATM 2339 O HOH 32 12.161 44.205 24.989 1.00 33.28 O HETATM 2340 O HOH 33 15.720 46.249 9.219 1.00 30.03 O HETATM 2341 O HOH 34 15.738 48.482 20.389 1.00 32.50 O HETATM 2342 O HOH 35 10.943 67.654 9.816 1.00 28.72 O HETATM 2343 O HOH 36 16.297 62.887 22.284 1.00 34.83 O HETATM 2344 O HOH 37 17.851 53.623 4.892 1.00 28.01 O HETATM 2345 O HOH 38 13.340 42.748 10.994 1.00 39.24 O HETATM 2346 O HOH 39 17.275 67.134 16.137 1.00 35.20 O HETATM 2347 O HOH 40 4.060 65.396 29.660 1.00 29.84 O HETATM 2348 O HOH 41 -7.463 52.464 17.471 1.00 38.73 O HETATM 2349 O HOH 42 24.421 57.405 16.128 1.00 34.58 O HETATM 2350 O HOH 43 0.423 51.388 32.928 1.00 34.29 O HETATM 2351 O HOH 44 14.753 61.468 26.847 1.00 32.83 O HETATM 2352 O HOH 45 12.656 72.981 17.310 1.00 28.33 O HETATM 2353 O HOH 46 4.714 71.049 13.681 1.00 35.55 O HETATM 2354 O HOH 47 22.940 53.201 11.550 1.00 35.83 O HETATM 2355 O HOH 48 -0.036 40.088 21.385 1.00 39.59 O HETATM 2356 O HOH 49 17.732 63.590 17.625 1.00 34.31 O HETATM 2357 O HOH 50 -11.230 56.456 17.006 1.00 33.17 O HETATM 2358 O HOH 51 22.067 55.852 11.756 1.00 39.11 O HETATM 2359 O HOH 52 2.074 56.131 3.535 1.00 36.09 O HETATM 2360 O HOH 53 -4.067 55.538 10.525 1.00 62.19 O HETATM 2361 O HOH 54 -0.582 52.434 29.930 1.00 31.77 O HETATM 2362 O HOH 55 -12.335 59.629 18.007 1.00 50.56 O HETATM 2363 O HOH 56 14.476 44.551 5.265 1.00 32.84 O HETATM 2364 O HOH 57 4.843 67.975 10.530 1.00 35.09 O HETATM 2365 O HOH 58 19.669 63.735 9.836 1.00 36.02 O HETATM 2366 O HOH 59 17.169 55.178 1.725 1.00 40.22 O HETATM 2367 O HOH 60 -9.105 48.881 25.852 1.00 41.78 O HETATM 2368 O HOH 61 11.395 69.261 12.874 1.00 36.55 O HETATM 2369 O HOH 62 -3.008 51.802 29.626 1.00 36.43 O HETATM 2370 O HOH 63 15.105 67.874 24.235 1.00 53.79 O HETATM 2371 O HOH 64 -5.934 60.600 34.669 1.00 52.19 O HETATM 2372 O HOH 65 16.774 49.977 25.777 1.00 37.21 O HETATM 2373 O HOH 66 0.748 54.420 4.728 1.00 32.52 O HETATM 2374 O HOH 67 -14.436 54.056 23.695 1.00 40.24 O HETATM 2375 O HOH 68 16.917 58.721 22.798 1.00 43.53 O HETATM 2376 O HOH 69 22.041 60.838 7.860 1.00 38.58 O HETATM 2377 O HOH 70 19.825 50.650 3.576 1.00 36.45 O HETATM 2378 O HOH 71 -7.500 43.436 12.442 1.00 48.89 O HETATM 2379 O HOH 72 -1.215 61.491 32.958 1.00 42.63 O HETATM 2380 O HOH 73 16.306 60.988 30.277 1.00 49.64 O HETATM 2381 O HOH 74 -4.104 38.096 8.577 1.00 56.84 O HETATM 2382 O HOH 75 -1.477 57.248 35.923 1.00 43.43 O HETATM 2383 O HOH 76 16.523 56.865 24.614 1.00 43.85 O HETATM 2384 O HOH 77 17.267 62.255 3.389 1.00 49.10 O HETATM 2385 O HOH 78 23.939 59.207 12.115 1.00 35.76 O HETATM 2386 O HOH 79 -8.060 64.941 27.105 1.00 42.15 O HETATM 2387 O HOH 80 18.623 46.582 10.505 1.00 40.74 O HETATM 2388 O HOH 81 11.861 63.570 -1.465 1.00 21.18 O HETATM 2389 O HOH 82 8.400 64.090 4.180 1.00 29.98 O HETATM 2390 O HOH 83 8.665 72.992 15.605 1.00 30.26 O HETATM 2391 O HOH 84 4.214 41.219 10.968 1.00 47.91 O HETATM 2392 O HOH 85 5.910 65.731 31.914 1.00 43.70 O HETATM 2393 O HOH 86 16.151 62.468 1.088 1.00 42.75 O HETATM 2394 O HOH 87 15.284 72.347 17.810 1.00 41.27 O HETATM 2395 O HOH 88 6.752 67.380 27.397 1.00 43.52 O HETATM 2396 O HOH 89 6.507 72.820 14.090 1.00 48.55 O HETATM 2397 O HOH 90 -2.522 64.232 12.538 1.00 40.06 O HETATM 2398 O HOH 91 -11.889 47.864 22.306 1.00 43.83 O HETATM 2399 O HOH 92 4.552 58.916 5.911 1.00 56.04 O HETATM 2400 O HOH 93 10.903 66.814 1.681 1.00 38.11 O HETATM 2401 O HOH 94 9.932 64.882 0.001 1.00 28.53 O HETATM 2402 O HOH 95 14.435 64.881 -0.998 1.00 38.61 O HETATM 2403 O HOH 96 6.754 36.120 0.262 1.00 35.38 O HETATM 2404 O HOH 97 14.288 45.087 11.265 1.00 41.18 O HETATM 2405 O HOH 98 7.172 63.364 32.716 1.00 43.84 O HETATM 2406 O HOH 99 -0.247 42.486 14.583 1.00 43.97 O HETATM 2407 O HOH 100 -3.825 49.049 5.469 1.00 49.25 O HETATM 2408 O HOH 101 17.074 51.686 22.959 1.00 35.87 O HETATM 2409 O HOH 102 18.049 57.571 20.969 1.00 53.62 O HETATM 2410 O HOH 103 -0.278 59.903 5.734 1.00 53.25 O HETATM 2411 O HOH 104 2.032 58.732 5.918 1.00 48.55 O HETATM 2412 O HOH 105 11.263 72.164 14.706 1.00 41.32 O HETATM 2413 O HOH 106 -8.272 59.223 34.539 1.00 56.52 O HETATM 2414 O HOH 107 -5.313 53.775 15.639 1.00 65.19 O HETATM 2415 O HOH 108 18.062 59.723 18.893 1.00 45.76 O HETATM 2416 O HOH 109 12.772 45.423 -1.587 1.00 44.72 O HETATM 2417 O HOH 110 -11.638 56.628 29.946 1.00 43.55 O HETATM 2418 O HOH 111 17.237 52.436 27.672 1.00 42.85 O HETATM 2419 O HOH 112 -10.031 53.724 17.205 1.00 49.73 O HETATM 2420 O HOH 113 17.437 47.504 24.644 1.00 56.59 O HETATM 2421 O HOH 114 7.936 67.308 9.190 1.00 49.73 O HETATM 2422 O HOH 115 14.962 46.564 -1.605 1.00 36.42 O HETATM 2423 O HOH 116 23.187 61.878 10.151 1.00 44.14 O HETATM 2424 O HOH 117 10.216 40.311 16.032 1.00 50.18 O HETATM 2425 O HOH 118 -1.632 38.045 14.835 1.00 56.11 O HETATM 2426 O HOH 119 5.435 39.968 9.034 1.00 41.08 O HETATM 2427 O HOH 120 1.719 66.520 30.720 1.00 43.59 O HETATM 2428 O HOH 121 0.195 48.367 30.463 1.00 54.86 O HETATM 2429 O HOH 122 -2.508 66.442 29.427 1.00 59.90 O HETATM 2430 O HOH 123 0.080 50.028 28.445 1.00 50.70 O HETATM 2431 O HOH 124 12.295 55.816 37.237 1.00 52.06 O HETATM 2432 O HOH 125 11.570 46.719 37.919 1.00 48.67 O HETATM 2433 O HOH 126 6.291 65.337 4.952 1.00 41.14 O HETATM 2434 O HOH 127 5.270 58.415 33.025 1.00 54.56 O HETATM 2435 O HOH 128 -9.595 63.271 24.767 1.00 46.45 O HETATM 2436 O HOH 129 -10.594 50.035 17.268 1.00 55.87 O HETATM 2437 O HOH 130 -0.571 63.117 11.271 1.00 32.27 O HETATM 2438 O HOH 131 -7.118 45.605 10.613 1.00 50.85 O HETATM 2439 O HOH 132 17.885 49.652 21.571 1.00 52.11 O HETATM 2440 O HOH 133 5.436 61.725 6.116 1.00 41.13 O HETATM 2441 O HOH 134 -3.159 60.212 34.556 1.00 51.49 O HETATM 2442 O HOH 135 1.873 57.856 36.833 1.00 56.74 O HETATM 2443 O HOH 136 7.958 68.062 31.136 1.00 49.57 O HETATM 2444 O HOH 137 2.703 67.952 11.777 1.00 46.70 O HETATM 2445 O HOH 138 -7.340 65.105 29.849 1.00 54.96 O HETATM 2446 O HOH 139 22.596 57.532 9.691 1.00 38.82 O HETATM 2447 O HOH 140 -13.408 55.126 16.087 1.00 63.55 O HETATM 2448 O HOH 141 8.813 70.491 11.934 1.00 48.39 O HETATM 2449 O HOH 142 14.223 47.887 15.681 1.00 41.54 O HETATM 2450 O HOH 143 20.850 63.943 17.086 1.00 64.24 O HETATM 2451 O HOH 144 15.270 64.228 28.592 1.00 67.98 O HETATM 2452 O HOH 145 14.087 66.768 -2.792 1.00 58.47 O HETATM 2453 O HOH 146 -4.035 58.193 7.284 1.00 57.03 O HETATM 2454 O HOH 147 12.068 38.424 13.194 1.00 57.20 O HETATM 2455 O HOH 148 16.140 48.772 17.603 1.00 52.99 O HETATM 2456 O HOH 149 -0.680 65.492 31.044 1.00 45.55 O HETATM 2457 O HOH 150 24.877 57.523 4.551 1.00 58.32 O HETATM 2458 O HOH 151 19.330 50.307 19.276 1.00 51.84 O HETATM 2459 O HOH 152 0.942 58.926 2.260 1.00 55.58 O HETATM 2460 O HOH 153 -9.243 59.163 16.029 1.00 57.00 O HETATM 2461 O HOH 154 -0.610 66.896 10.322 1.00 53.56 O HETATM 2462 O HOH 155 17.411 48.305 15.051 1.00 59.19 O HETATM 2463 O HOH 156 19.085 48.775 17.010 1.00 47.91 O HETATM 2464 O HOH 157 0.150 59.403 34.634 1.00 52.61 O HETATM 2465 O HOH 158 11.209 68.059 6.555 1.00 57.34 O HETATM 2466 O HOH 159 18.827 42.757 10.755 1.00 61.16 O HETATM 2467 O HOH 160 -6.332 49.042 29.428 1.00 48.74 O HETATM 2468 O HOH 161 5.061 75.464 14.150 1.00 51.41 O HETATM 2469 O HOH 162 17.060 64.988 9.280 1.00 40.71 O HETATM 2470 O HOH 163 -5.402 66.542 30.866 1.00 55.12 O HETATM 2471 O HOH 164 -3.286 50.114 34.123 1.00 62.30 O HETATM 2472 O HOH 165 -2.290 48.475 31.206 1.00 60.89 O HETATM 2473 O HOH 166 0.787 54.278 28.504 1.00 15.02 O HETATM 2474 O HOH 167 5.045 54.252 29.285 1.00 16.42 O HETATM 2475 O HOH 168 1.543 65.915 9.149 1.00 38.31 O HETATM 2476 O HOH 169 9.928 59.530 0.000 1.00 17.88 O HETATM 2477 O HOH 170 -5.254 44.927 19.647 1.00 29.20 O HETATM 2478 O HOH 171 19.859 67.744 10.502 1.00 29.49 O HETATM 2479 O HOH 172 2.857 45.191 28.310 1.00 40.58 O HETATM 2480 O HOH 173 6.808 37.392 8.562 1.00 35.68 O HETATM 2481 O HOH 174 20.928 51.487 6.276 1.00 41.83 O HETATM 2482 O HOH 175 12.083 60.823 -0.918 1.00 20.39 O HETATM 2483 O HOH 176 8.199 59.775 3.502 1.00 28.12 O HETATM 2484 O HOH 177 -7.916 43.197 15.097 1.00 41.56 O HETATM 2485 O HOH 178 -0.538 46.028 26.109 1.00 38.75 O HETATM 2486 O HOH 179 0.162 48.139 24.729 1.00 29.77 O HETATM 2487 O HOH 180 17.648 52.740 0.699 1.00 33.44 O HETATM 2488 O HOH 181 16.323 44.271 7.567 1.00 36.32 O HETATM 2489 O HOH 182 22.575 51.129 10.139 1.00 41.35 O HETATM 2490 O HOH 183 21.022 49.312 8.450 1.00 47.84 O HETATM 2491 O HOH 184 20.207 61.067 17.392 1.00 37.53 O HETATM 2492 O HOH 185 16.425 64.698 5.276 1.00 54.05 O HETATM 2493 O HOH 186 10.324 66.023 4.396 1.00 40.48 O HETATM 2494 O HOH 187 6.488 70.678 23.686 1.00 41.97 O HETATM 2495 O HOH 188 9.235 67.906 23.901 1.00 52.89 O HETATM 2496 O HOH 189 11.612 44.932 22.643 1.00 37.78 O HETATM 2497 O HOH 190 14.518 43.540 24.906 1.00 41.11 O HETATM 2498 O HOH 191 -6.228 47.956 11.964 1.00 41.78 O HETATM 2499 C1 ON A 1 3.786 49.407 34.646 1.00 -0.04 C HETATM 2500 C2 ON A 1 4.791 49.723 35.621 1.00 0.05 C HETATM 2501 CL2 ON A 1 4.244 50.164 37.191 1.00 -0.07 CL HETATM 2502 C3 ON A 1 6.221 49.659 35.269 1.00 0.05 C HETATM 2503 CL1 ON A 1 7.479 50.023 36.395 1.00 -0.08 CL HETATM 2504 C4 ON A 1 6.611 49.278 33.934 1.00 -0.05 C HETATM 2505 C5 ON A 1 5.602 48.962 32.965 1.00 -0.06 C HETATM 2506 C6 ON A 1 4.190 49.023 33.309 1.00 -0.02 C HETATM 2507 C7 ON A 1 3.130 48.685 32.281 1.00 0.07 C HETATM 2508 C8 ON A 1 3.139 49.652 31.135 1.00 0.15 C HETATM 2509 N1 ON A 1 3.426 49.145 29.934 1.00 -0.31 N HETATM 2510 C9 ON A 1 3.453 49.998 28.834 1.00 0.07 C HETATM 2511 C10 ON A 1 3.179 51.420 28.999 1.00 0.17 C HETATM 2512 O1 ON A 1 3.180 52.362 28.019 1.00 -0.33 O HETATM 2513 H2 ON A 1 2.970 53.209 28.395 1.00 0.25 H HETATM 2514 C11 ON A 1 2.887 51.822 30.333 1.00 0.26 C HETATM 2515 N2 ON A 1 2.867 50.944 31.395 1.00 -0.20 N HETATM 2516 H3 ON A 1 2.659 51.255 32.322 1.00 0.25 H HETATM 2517 O2 ON A 1 2.620 53.085 30.599 1.00 -0.40 O HETATM 2518 C12 ON A 1 3.778 49.310 27.543 1.00 0.06 C HETATM 2519 O3 ON A 1 3.987 48.077 27.590 1.00 -0.56 O HETATM 2520 O4 ON A 1 3.832 49.930 26.476 1.00 -0.56 O HETATM 2521 H6 ON A 1 2.142 48.715 32.764 1.00 0.07 H HETATM 2522 H7 ON A 1 3.319 47.673 31.894 1.00 0.07 H HETATM 2523 H5 ON A 1 5.896 48.674 31.962 1.00 0.06 H HETATM 2524 H4 ON A 1 7.660 49.231 33.665 1.00 0.06 H HETATM 2525 H1 ON A 1 2.735 49.455 34.908 1.00 0.06 H CONECT 627 625 2309 CONECT 818 819 834 835 836 CONECT 834 818 CONECT 835 818 CONECT 836 818 CONECT 1104 1103 2308 CONECT 1105 1103 2309 CONECT 1643 1642 2308 CONECT 1952 1950 2308 CONECT 2308 1104 1643 1952 CONECT 2309 627 1105 CONECT 2499 2500 2506 2525 CONECT 2500 2499 2501 2502 CONECT 2501 2500 CONECT 2502 2500 2503 2504 CONECT 2503 2502 CONECT 2504 2502 2505 2524 CONECT 2505 2504 2506 2523 CONECT 2506 2499 2505 2507 CONECT 2507 2506 2508 2521 2522 CONECT 2508 2507 2509 2515 CONECT 2509 2508 2510 CONECT 2510 2509 2511 2518 CONECT 2511 2510 2512 2514 CONECT 2512 2511 2513 CONECT 2513 2512 CONECT 2514 2511 2515 2517 CONECT 2515 2508 2514 2516 CONECT 2516 2515 CONECT 2517 2514 CONECT 2518 2510 2519 2520 CONECT 2519 2518 CONECT 2520 2518 CONECT 2521 2507 CONECT 2522 2507 CONECT 2523 2505 CONECT 2524 2504 CONECT 2525 2499 MASTER 0 0 0 0 0 0 0 0 2523 2 38 12 END
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Related entries of code: 3hyf
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3qin
RCSB PDB
PDBbind
150aa, >3QIN_1|Chain... at 100%
3qio
RCSB PDB
PDBbind
150aa, >3QIO_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3hyf
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
HIV-1 RNase H p15
Ligand Name
ON1
EC.Number
E.C.3.1.26.4
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
IC50=1.2uM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) J.Med.Chem. Vol. 52: pp. 5781-5784
Ligand Properties
Formula
C
1
2
H
8
Cl
2
N
2
O
4
Molecular Weight
315.109
Exact Mass
313.986
No. of atoms
28
No. of bonds
29
Polar Surface Area
103.28
LOGP Value
3.15 (
Computed with XLOGP3
)
2.07 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 2
Canonical SMILES
OC(=O)c1nc(Cc2ccc(c(c2)Cl)Cl)[nH]c(=O)c1O
InChI String
InChI=1S/C12H8Cl2N2O4/c13-6-2-1-5(3-7(6)14)4-8-15-9(12(19)20)10(17)11(18)16-8/h1-3,17H,4H2,(H,19,20)(H,15,16,18)
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):
Q72547
P0A7Y4
Entrez Gene ID
NCBI Entrez Gene ID:
61755530
946955
ASD
Information of known allosteric effects of PDB entries
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