Browse entries in the PDBbind-CN Database
HEADER 4DST_COMPLEX COMPND 4DST_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 180 SER THR GLU TYR LYS LEU VAL VAL VAL GLY ALA ASP GLY SEQRES 2 A 180 VAL GLY LYS SER ALA LEU THR ILE GLN LEU ILE GLN ASN SEQRES 3 A 180 HIS PHE VAL ASP GLU TYR ASP PRO THR ILE GLU ASP SER SEQRES 4 A 180 TYR ARG LYS GLN VAL VAL ILE ASP GLY GLU THR CYS LEU SEQRES 5 A 180 LEU ASP ILE LEU ASP THR ALA GLY GLN GLU GLU TYR SER SEQRES 6 A 180 ALA MET ARG ASP GLN TYR MET ARG THR GLY GLU GLY PHE SEQRES 7 A 180 LEU CYS VAL PHE ALA ILE ASN ASN THR LYS SER PHE GLU SEQRES 8 A 180 ASP ILE HIS HIS TYR ARG GLU GLN ILE LYS ARG VAL LYS SEQRES 9 A 180 ASP SER GLU ASP VAL PRO MET VAL LEU VAL GLY ASN LYS SEQRES 10 A 180 CYS ASP LEU PRO SER ARG THR VAL ASP THR LYS GLN ALA SEQRES 11 A 180 GLN ASP LEU ALA ARG SER TYR GLY ILE PRO PHE ILE GLU SEQRES 12 A 180 THR SER ALA LYS THR ARG GLN GLY VAL ASP ASP ALA PHE SEQRES 13 A 180 TYR THR LEU VAL ARG GLU ILE ARG LYS HIS LYS GLU LYS SEQRES 14 A 180 MET SER LYS ASP GLY LYS LYS LYS LYS LYS LYS HET MG A 1 1 HET MG A 2 1 HET UNN A 273 28 ATOM 1 N SER A 1 38.831 18.260 0.753 1.00 95.57 N ATOM 2 CA SER A 1 38.659 19.544 1.423 1.00 95.43 C ATOM 3 C SER A 1 37.224 19.770 1.888 1.00 88.42 C ATOM 4 O SER A 1 36.966 19.896 3.085 1.00 93.99 O ATOM 5 CB SER A 1 39.080 20.695 0.506 1.00100.74 C ATOM 6 OG SER A 1 40.426 20.558 0.091 1.00106.40 O ATOM 7 HA SER A 1 39.300 19.521 2.304 1.00 0.00 H ATOM 8 HB2 SER A 1 38.968 21.636 1.044 1.00 0.00 H ATOM 9 HB3 SER A 1 38.436 20.702 -0.374 1.00 0.00 H ATOM 10 HG SER A 1 40.533 19.707 -0.403 1.00 0.00 H ATOM 11 HN3 SER A 1 38.212 18.220 -0.082 1.00 0.00 H ATOM 12 HN2 SER A 1 38.581 17.492 1.408 1.00 0.00 H ATOM 13 HN1 SER A 1 39.822 18.155 0.457 1.00 0.00 H ATOM 14 N THR A 2 36.294 19.824 0.939 1.00 72.50 N ATOM 15 CA THR A 2 34.925 20.234 1.245 1.00 58.63 C ATOM 16 C THR A 2 34.093 19.155 1.936 1.00 48.59 C ATOM 17 O THR A 2 34.149 17.973 1.586 1.00 39.37 O ATOM 18 CB THR A 2 34.173 20.737 -0.011 1.00 53.78 C ATOM 19 OG1 THR A 2 34.938 21.764 -0.654 1.00 54.72 O ATOM 20 CG2 THR A 2 32.806 21.296 0.373 1.00 46.56 C ATOM 21 HA THR A 2 35.041 21.056 1.951 1.00 0.00 H ATOM 22 HB THR A 2 34.036 19.897 -0.692 1.00 0.00 H ATOM 23 HG1 THR A 2 34.453 22.082 -1.456 1.00 0.00 H ATOM 24 HG23 THR A 2 32.221 20.517 0.863 1.00 0.00 H ATOM 25 HG21 THR A 2 32.937 22.137 1.054 1.00 0.00 H ATOM 26 HG22 THR A 2 32.287 21.632 -0.525 1.00 0.00 H ATOM 27 H THR A 2 36.545 19.570 -0.038 1.00 0.00 H ATOM 28 N GLU A 3 33.311 19.589 2.915 1.00 50.17 N ATOM 29 CA GLU A 3 32.459 18.699 3.682 1.00 51.17 C ATOM 30 C GLU A 3 31.001 18.772 3.209 1.00 49.57 C ATOM 31 O GLU A 3 30.443 19.860 3.038 1.00 50.36 O ATOM 32 CB GLU A 3 32.561 19.059 5.162 1.00 57.37 C ATOM 33 CG GLU A 3 31.520 18.398 6.036 1.00 67.09 C ATOM 34 CD GLU A 3 31.422 19.047 7.400 1.00 74.96 C ATOM 35 OE1 GLU A 3 32.404 19.704 7.815 1.00 77.04 O ATOM 36 OE2 GLU A 3 30.362 18.908 8.050 1.00 75.86 O ATOM 37 HA GLU A 3 32.798 17.674 3.530 1.00 0.00 H ATOM 38 HB2 GLU A 3 33.547 18.760 5.519 1.00 0.00 H ATOM 39 HB3 GLU A 3 32.453 20.139 5.259 1.00 0.00 H ATOM 40 HG2 GLU A 3 30.551 18.469 5.543 1.00 0.00 H ATOM 41 HG3 GLU A 3 31.784 17.348 6.165 1.00 0.00 H ATOM 42 H GLU A 3 33.308 20.604 3.141 1.00 0.00 H ATOM 43 N TYR A 4 30.395 17.607 2.995 1.00 44.05 N ATOM 44 CA TYR A 4 28.989 17.527 2.608 1.00 36.48 C ATOM 45 C TYR A 4 28.191 16.737 3.630 1.00 33.87 C ATOM 46 O TYR A 4 28.604 15.656 4.050 1.00 35.06 O ATOM 47 CB TYR A 4 28.839 16.860 1.241 1.00 33.00 C ATOM 48 CG TYR A 4 29.495 17.619 0.124 1.00 32.23 C ATOM 49 CD1 TYR A 4 28.779 18.537 -0.627 1.00 33.99 C ATOM 50 CD2 TYR A 4 30.837 17.424 -0.178 1.00 34.08 C ATOM 51 CE1 TYR A 4 29.381 19.246 -1.655 1.00 35.83 C ATOM 52 CE2 TYR A 4 31.445 18.120 -1.202 1.00 36.42 C ATOM 53 CZ TYR A 4 30.714 19.032 -1.938 1.00 36.43 C ATOM 54 OH TYR A 4 31.320 19.729 -2.957 1.00 38.99 O ATOM 55 HA TYR A 4 28.606 18.546 2.559 1.00 0.00 H ATOM 56 HB3 TYR A 4 27.776 16.768 1.017 1.00 0.00 H ATOM 57 HB2 TYR A 4 29.286 15.867 1.291 1.00 0.00 H ATOM 58 HD2 TYR A 4 31.419 16.709 0.404 1.00 0.00 H ATOM 59 HE2 TYR A 4 32.498 17.951 -1.429 1.00 0.00 H ATOM 60 HE1 TYR A 4 28.805 19.967 -2.235 1.00 0.00 H ATOM 61 HD1 TYR A 4 27.725 18.705 -0.406 1.00 0.00 H ATOM 62 HH TYR A 4 31.663 19.092 -3.633 1.00 0.00 H ATOM 63 H TYR A 4 30.939 16.727 3.107 1.00 0.00 H ATOM 64 N LYS A 5 27.040 17.275 4.015 1.00 32.82 N ATOM 65 CA LYS A 5 26.147 16.598 4.949 1.00 32.77 C ATOM 66 C LYS A 5 25.021 15.889 4.195 1.00 32.17 C ATOM 67 O LYS A 5 24.096 16.530 3.701 1.00 32.30 O ATOM 68 CB LYS A 5 25.555 17.600 5.940 1.00 35.07 C ATOM 69 CG LYS A 5 26.579 18.406 6.718 1.00 40.19 C ATOM 70 CD LYS A 5 25.889 19.427 7.614 1.00 47.77 C ATOM 71 CE LYS A 5 26.893 20.266 8.393 1.00 54.69 C ATOM 72 NZ LYS A 5 27.742 19.434 9.293 1.00 56.98 N ATOM 73 HA LYS A 5 26.726 15.855 5.498 1.00 0.00 H ATOM 74 HB2 LYS A 5 24.926 18.296 5.384 1.00 0.00 H ATOM 75 HB3 LYS A 5 24.943 17.050 6.654 1.00 0.00 H ATOM 76 HG2 LYS A 5 27.173 17.731 7.334 1.00 0.00 H ATOM 77 HG3 LYS A 5 27.232 18.927 6.018 1.00 0.00 H ATOM 78 HD2 LYS A 5 25.282 20.087 6.995 1.00 0.00 H ATOM 79 HD3 LYS A 5 25.246 18.900 8.319 1.00 0.00 H ATOM 80 HE2 LYS A 5 26.350 20.994 8.996 1.00 0.00 H ATOM 81 HE3 LYS A 5 27.537 20.789 7.686 1.00 0.00 H ATOM 82 HZ1 LYS A 5 27.136 18.936 9.976 1.00 0.00 H ATOM 83 HZ2 LYS A 5 28.270 18.740 8.726 1.00 0.00 H ATOM 84 HZ3 LYS A 5 28.410 20.047 9.802 1.00 0.00 H ATOM 85 H LYS A 5 26.767 18.206 3.640 1.00 0.00 H ATOM 86 N LEU A 6 25.103 14.565 4.102 1.00 30.48 N ATOM 87 CA LEU A 6 24.076 13.795 3.409 1.00 25.08 C ATOM 88 C LEU A 6 23.176 13.093 4.416 1.00 25.65 C ATOM 89 O LEU A 6 23.654 12.517 5.396 1.00 28.24 O ATOM 90 CB LEU A 6 24.707 12.767 2.460 1.00 22.65 C ATOM 91 CG LEU A 6 25.958 13.175 1.676 1.00 26.40 C ATOM 92 CD1 LEU A 6 26.251 12.171 0.574 1.00 28.39 C ATOM 93 CD2 LEU A 6 25.830 14.565 1.090 1.00 24.75 C ATOM 94 HA LEU A 6 23.476 14.485 2.816 1.00 0.00 H ATOM 95 HB2 LEU A 6 24.971 11.895 3.058 1.00 0.00 H ATOM 96 HB3 LEU A 6 23.945 12.490 1.731 1.00 0.00 H ATOM 97 HG LEU A 6 26.789 13.186 2.381 1.00 0.00 H ATOM 98 HD21 LEU A 6 24.977 14.595 0.412 1.00 0.00 H ATOM 99 HD22 LEU A 6 25.681 15.285 1.895 1.00 0.00 H ATOM 100 HD23 LEU A 6 26.740 14.812 0.543 1.00 0.00 H ATOM 101 HD11 LEU A 6 26.415 11.188 1.014 1.00 0.00 H ATOM 102 HD12 LEU A 6 25.404 12.127 -0.110 1.00 0.00 H ATOM 103 HD13 LEU A 6 27.143 12.481 0.030 1.00 0.00 H ATOM 104 H LEU A 6 25.912 14.071 4.530 1.00 0.00 H ATOM 105 N VAL A 7 21.870 13.156 4.176 1.00 25.07 N ATOM 106 CA VAL A 7 20.892 12.476 5.018 1.00 18.48 C ATOM 107 C VAL A 7 20.111 11.442 4.200 1.00 18.68 C ATOM 108 O VAL A 7 19.497 11.775 3.188 1.00 17.15 O ATOM 109 CB VAL A 7 19.899 13.478 5.646 1.00 18.83 C ATOM 110 CG1 VAL A 7 18.858 12.739 6.493 1.00 19.39 C ATOM 111 CG2 VAL A 7 20.641 14.534 6.490 1.00 13.65 C ATOM 112 HA VAL A 7 21.439 11.976 5.817 1.00 0.00 H ATOM 113 HB VAL A 7 19.382 13.997 4.839 1.00 0.00 H ATOM 114 HG11 VAL A 7 18.308 12.041 5.862 1.00 0.00 H ATOM 115 HG12 VAL A 7 19.362 12.191 7.289 1.00 0.00 H ATOM 116 HG13 VAL A 7 18.167 13.461 6.928 1.00 0.00 H ATOM 117 HG21 VAL A 7 21.191 14.037 7.290 1.00 0.00 H ATOM 118 HG22 VAL A 7 21.337 15.082 5.855 1.00 0.00 H ATOM 119 HG23 VAL A 7 19.918 15.227 6.920 1.00 0.00 H ATOM 120 H VAL A 7 21.535 13.708 3.361 1.00 0.00 H ATOM 121 N VAL A 8 20.136 10.188 4.643 1.00 20.54 N ATOM 122 CA VAL A 8 19.406 9.121 3.962 1.00 21.97 C ATOM 123 C VAL A 8 18.045 8.911 4.626 1.00 22.49 C ATOM 124 O VAL A 8 17.979 8.563 5.811 1.00 20.20 O ATOM 125 CB VAL A 8 20.221 7.810 3.960 1.00 21.76 C ATOM 126 CG1 VAL A 8 19.470 6.708 3.239 1.00 16.80 C ATOM 127 CG2 VAL A 8 21.618 8.049 3.328 1.00 11.62 C ATOM 128 HA VAL A 8 19.248 9.417 2.925 1.00 0.00 H ATOM 129 HB VAL A 8 20.365 7.487 4.991 1.00 0.00 H ATOM 130 HG11 VAL A 8 18.519 6.530 3.741 1.00 0.00 H ATOM 131 HG12 VAL A 8 19.287 7.009 2.208 1.00 0.00 H ATOM 132 HG13 VAL A 8 20.066 5.795 3.252 1.00 0.00 H ATOM 133 HG21 VAL A 8 21.497 8.396 2.302 1.00 0.00 H ATOM 134 HG22 VAL A 8 22.153 8.802 3.907 1.00 0.00 H ATOM 135 HG23 VAL A 8 22.182 7.116 3.333 1.00 0.00 H ATOM 136 H VAL A 8 20.688 9.962 5.495 1.00 0.00 H ATOM 137 N VAL A 9 16.966 9.140 3.868 1.00 15.68 N ATOM 138 CA VAL A 9 15.614 9.065 4.418 1.00 13.34 C ATOM 139 C VAL A 9 14.721 8.104 3.625 1.00 14.65 C ATOM 140 O VAL A 9 15.015 7.774 2.480 1.00 15.61 O ATOM 141 CB VAL A 9 14.937 10.467 4.493 1.00 22.91 C ATOM 142 CG1 VAL A 9 15.799 11.447 5.278 1.00 23.59 C ATOM 143 CG2 VAL A 9 14.658 11.015 3.095 1.00 19.26 C ATOM 144 HA VAL A 9 15.724 8.677 5.431 1.00 0.00 H ATOM 145 HB VAL A 9 13.987 10.348 5.014 1.00 0.00 H ATOM 146 HG11 VAL A 9 15.942 11.072 6.291 1.00 0.00 H ATOM 147 HG12 VAL A 9 16.767 11.551 4.788 1.00 0.00 H ATOM 148 HG13 VAL A 9 15.303 12.417 5.315 1.00 0.00 H ATOM 149 HG21 VAL A 9 15.597 11.108 2.549 1.00 0.00 H ATOM 150 HG22 VAL A 9 13.993 10.333 2.565 1.00 0.00 H ATOM 151 HG23 VAL A 9 14.186 11.994 3.177 1.00 0.00 H ATOM 152 H VAL A 9 17.093 9.377 2.863 1.00 0.00 H ATOM 153 N GLY A 10 13.631 7.657 4.245 1.00 16.29 N ATOM 154 CA GLY A 10 12.708 6.729 3.608 1.00 19.03 C ATOM 155 C GLY A 10 11.985 5.838 4.604 1.00 21.09 C ATOM 156 O GLY A 10 12.353 5.782 5.776 1.00 23.83 O ATOM 157 HA3 GLY A 10 13.269 6.098 2.919 1.00 0.00 H ATOM 158 HA2 GLY A 10 11.967 7.302 3.051 1.00 0.00 H ATOM 159 H GLY A 10 13.433 7.980 5.213 1.00 0.00 H ATOM 160 N ALA A 11 10.958 5.133 4.135 1.00 23.45 N ATOM 161 CA ALA A 11 10.139 4.276 4.993 1.00 22.92 C ATOM 162 C ALA A 11 10.923 3.107 5.598 1.00 23.32 C ATOM 163 O ALA A 11 12.104 2.912 5.306 1.00 22.99 O ATOM 164 CB ALA A 11 8.919 3.750 4.211 1.00 21.73 C ATOM 165 HA ALA A 11 9.805 4.894 5.826 1.00 0.00 H ATOM 166 HB1 ALA A 11 8.318 4.592 3.869 1.00 0.00 H ATOM 167 HB2 ALA A 11 9.261 3.173 3.352 1.00 0.00 H ATOM 168 HB3 ALA A 11 8.319 3.114 4.862 1.00 0.00 H ATOM 169 H ALA A 11 10.729 5.193 3.122 1.00 0.00 H ATOM 170 N ASP A 12 10.246 2.339 6.446 1.00 21.34 N ATOM 171 CA ASP A 12 10.799 1.133 7.044 1.00 22.87 C ATOM 172 C ASP A 12 11.186 0.138 5.974 1.00 22.77 C ATOM 173 O ASP A 12 10.371 -0.210 5.124 1.00 24.12 O ATOM 174 CB ASP A 12 9.738 0.441 7.913 1.00 28.37 C ATOM 175 CG ASP A 12 9.490 1.149 9.225 1.00 34.34 C ATOM 176 OD1 ASP A 12 8.313 1.439 9.520 1.00 37.62 O ATOM 177 OD2 ASP A 12 10.462 1.391 9.974 1.00 37.25 O ATOM 178 HA ASP A 12 11.666 1.431 7.633 1.00 0.00 H ATOM 179 HB2 ASP A 12 8.802 0.406 7.355 1.00 0.00 H ATOM 180 HB3 ASP A 12 10.072 -0.575 8.125 1.00 0.00 H ATOM 181 H ASP A 12 9.274 2.613 6.694 1.00 0.00 H ATOM 182 N GLY A 13 12.414 -0.354 6.036 1.00 23.21 N ATOM 183 CA GLY A 13 12.780 -1.539 5.287 1.00 24.50 C ATOM 184 C GLY A 13 13.174 -1.346 3.839 1.00 25.68 C ATOM 185 O GLY A 13 13.409 -2.329 3.129 1.00 27.48 O ATOM 186 HA3 GLY A 13 11.927 -2.217 5.308 1.00 0.00 H ATOM 187 HA2 GLY A 13 13.624 -2.003 5.798 1.00 0.00 H ATOM 188 H GLY A 13 13.126 0.117 6.631 1.00 0.00 H ATOM 189 N VAL A 14 13.250 -0.097 3.389 1.00 19.33 N ATOM 190 CA VAL A 14 13.580 0.166 1.988 1.00 21.58 C ATOM 191 C VAL A 14 15.059 -0.096 1.655 1.00 20.61 C ATOM 192 O VAL A 14 15.416 -0.249 0.488 1.00 21.80 O ATOM 193 CB VAL A 14 13.151 1.587 1.546 1.00 20.31 C ATOM 194 CG1 VAL A 14 11.657 1.770 1.747 1.00 17.89 C ATOM 195 CG2 VAL A 14 13.933 2.655 2.305 1.00 14.57 C ATOM 196 HA VAL A 14 12.999 -0.553 1.411 1.00 0.00 H ATOM 197 HB VAL A 14 13.376 1.699 0.485 1.00 0.00 H ATOM 198 HG11 VAL A 14 11.119 1.033 1.152 1.00 0.00 H ATOM 199 HG12 VAL A 14 11.414 1.635 2.801 1.00 0.00 H ATOM 200 HG13 VAL A 14 11.370 2.773 1.432 1.00 0.00 H ATOM 201 HG21 VAL A 14 13.746 2.549 3.374 1.00 0.00 H ATOM 202 HG22 VAL A 14 14.998 2.533 2.107 1.00 0.00 H ATOM 203 HG23 VAL A 14 13.611 3.643 1.975 1.00 0.00 H ATOM 204 H VAL A 14 13.074 0.697 4.037 1.00 0.00 H ATOM 205 N GLY A 15 15.913 -0.153 2.676 1.00 21.87 N ATOM 206 CA GLY A 15 17.321 -0.466 2.472 1.00 20.67 C ATOM 207 C GLY A 15 18.256 0.711 2.691 1.00 20.78 C ATOM 208 O GLY A 15 19.348 0.768 2.118 1.00 20.77 O ATOM 209 HA3 GLY A 15 17.449 -0.819 1.449 1.00 0.00 H ATOM 210 HA2 GLY A 15 17.600 -1.259 3.166 1.00 0.00 H ATOM 211 H GLY A 15 15.567 0.030 3.640 1.00 0.00 H ATOM 212 N LYS A 16 17.831 1.658 3.518 1.00 18.30 N ATOM 213 CA LYS A 16 18.648 2.826 3.802 1.00 22.47 C ATOM 214 C LYS A 16 20.021 2.422 4.353 1.00 28.69 C ATOM 215 O LYS A 16 21.057 2.918 3.907 1.00 26.36 O ATOM 216 CB LYS A 16 17.924 3.744 4.787 1.00 19.71 C ATOM 217 CG LYS A 16 16.588 4.276 4.270 1.00 19.73 C ATOM 218 CD LYS A 16 15.963 5.284 5.234 1.00 17.35 C ATOM 219 CE LYS A 16 15.573 4.633 6.556 1.00 18.06 C ATOM 220 NZ LYS A 16 14.474 3.654 6.414 1.00 16.15 N ATOM 221 HA LYS A 16 18.810 3.365 2.869 1.00 0.00 H ATOM 222 HB2 LYS A 16 17.739 3.186 5.705 1.00 0.00 H ATOM 223 HB3 LYS A 16 18.571 4.594 5.004 1.00 0.00 H ATOM 224 HG2 LYS A 16 16.751 4.762 3.308 1.00 0.00 H ATOM 225 HG3 LYS A 16 15.902 3.439 4.141 1.00 0.00 H ATOM 226 HD2 LYS A 16 16.683 6.079 5.430 1.00 0.00 H ATOM 227 HD3 LYS A 16 15.071 5.709 4.772 1.00 0.00 H ATOM 228 HE2 LYS A 16 15.257 5.413 7.248 1.00 0.00 H ATOM 229 HE3 LYS A 16 16.445 4.121 6.962 1.00 0.00 H ATOM 230 HZ1 LYS A 16 13.632 4.133 6.036 1.00 0.00 H ATOM 231 HZ2 LYS A 16 14.767 2.898 5.762 1.00 0.00 H ATOM 232 HZ3 LYS A 16 14.253 3.245 7.344 1.00 0.00 H ATOM 233 H LYS A 16 16.899 1.563 3.970 1.00 0.00 H ATOM 234 N SER A 17 20.025 1.508 5.315 1.00 27.57 N ATOM 235 CA SER A 17 21.271 1.080 5.938 1.00 26.21 C ATOM 236 C SER A 17 22.150 0.274 4.995 1.00 26.05 C ATOM 237 O SER A 17 23.362 0.470 4.948 1.00 34.37 O ATOM 238 CB SER A 17 20.984 0.265 7.198 1.00 26.25 C ATOM 239 OG SER A 17 20.533 1.102 8.245 1.00 24.36 O ATOM 240 HA SER A 17 21.818 1.986 6.200 1.00 0.00 H ATOM 241 HB2 SER A 17 21.897 -0.241 7.512 1.00 0.00 H ATOM 242 HB3 SER A 17 20.217 -0.477 6.977 1.00 0.00 H ATOM 243 HG SER A 17 21.229 1.775 8.451 1.00 0.00 H ATOM 244 H SER A 17 19.126 1.091 5.629 1.00 0.00 H ATOM 245 N ALA A 18 21.538 -0.640 4.252 1.00 24.93 N ATOM 246 CA ALA A 18 22.277 -1.499 3.339 1.00 24.76 C ATOM 247 C ALA A 18 23.021 -0.680 2.284 1.00 23.07 C ATOM 248 O ALA A 18 24.157 -0.987 1.939 1.00 24.07 O ATOM 249 CB ALA A 18 21.336 -2.507 2.680 1.00 23.69 C ATOM 250 HA ALA A 18 23.023 -2.045 3.917 1.00 0.00 H ATOM 251 HB1 ALA A 18 20.869 -3.122 3.449 1.00 0.00 H ATOM 252 HB2 ALA A 18 20.566 -1.973 2.123 1.00 0.00 H ATOM 253 HB3 ALA A 18 21.904 -3.142 2.000 1.00 0.00 H ATOM 254 H ALA A 18 20.506 -0.745 4.324 1.00 0.00 H ATOM 255 N LEU A 19 22.370 0.364 1.777 1.00 20.25 N ATOM 256 CA LEU A 19 22.978 1.249 0.789 1.00 20.96 C ATOM 257 C LEU A 19 24.180 1.957 1.385 1.00 24.27 C ATOM 258 O LEU A 19 25.264 1.988 0.802 1.00 27.49 O ATOM 259 CB LEU A 19 21.970 2.311 0.333 1.00 19.75 C ATOM 260 CG LEU A 19 20.835 1.886 -0.601 1.00 24.91 C ATOM 261 CD1 LEU A 19 19.820 3.006 -0.701 1.00 23.13 C ATOM 262 CD2 LEU A 19 21.394 1.530 -1.983 1.00 24.39 C ATOM 263 HA LEU A 19 23.288 0.641 -0.061 1.00 0.00 H ATOM 264 HB2 LEU A 19 21.511 2.726 1.230 1.00 0.00 H ATOM 265 HB3 LEU A 19 22.533 3.091 -0.179 1.00 0.00 H ATOM 266 HG LEU A 19 20.343 1.001 -0.198 1.00 0.00 H ATOM 267 HD21 LEU A 19 21.898 2.400 -2.405 1.00 0.00 H ATOM 268 HD22 LEU A 19 22.104 0.709 -1.886 1.00 0.00 H ATOM 269 HD23 LEU A 19 20.576 1.229 -2.638 1.00 0.00 H ATOM 270 HD11 LEU A 19 19.417 3.219 0.289 1.00 0.00 H ATOM 271 HD12 LEU A 19 20.304 3.899 -1.098 1.00 0.00 H ATOM 272 HD13 LEU A 19 19.011 2.703 -1.366 1.00 0.00 H ATOM 273 H LEU A 19 21.398 0.555 2.095 1.00 0.00 H ATOM 274 N THR A 20 23.955 2.561 2.544 1.00 22.26 N ATOM 275 CA THR A 20 24.984 3.311 3.229 1.00 24.35 C ATOM 276 C THR A 20 26.173 2.405 3.514 1.00 25.64 C ATOM 277 O THR A 20 27.301 2.765 3.229 1.00 24.14 O ATOM 278 CB THR A 20 24.445 3.875 4.550 1.00 27.75 C ATOM 279 OG1 THR A 20 23.258 4.638 4.292 1.00 25.07 O ATOM 280 CG2 THR A 20 25.483 4.754 5.222 1.00 27.65 C ATOM 281 HA THR A 20 25.296 4.139 2.592 1.00 0.00 H ATOM 282 HB THR A 20 24.213 3.045 5.217 1.00 0.00 H ATOM 283 HG1 THR A 20 22.575 4.053 3.878 1.00 0.00 H ATOM 284 HG23 THR A 20 26.382 4.169 5.415 1.00 0.00 H ATOM 285 HG21 THR A 20 25.726 5.591 4.568 1.00 0.00 H ATOM 286 HG22 THR A 20 25.084 5.131 6.164 1.00 0.00 H ATOM 287 H THR A 20 23.010 2.493 2.973 1.00 0.00 H ATOM 288 N ILE A 21 25.911 1.226 4.069 1.00 25.59 N ATOM 289 CA ILE A 21 26.983 0.301 4.428 1.00 26.57 C ATOM 290 C ILE A 21 27.720 -0.257 3.208 1.00 28.92 C ATOM 291 O ILE A 21 28.914 -0.554 3.281 1.00 29.81 O ATOM 292 CB ILE A 21 26.468 -0.850 5.321 1.00 26.45 C ATOM 293 CG1 ILE A 21 26.050 -0.301 6.684 1.00 25.77 C ATOM 294 CG2 ILE A 21 27.533 -1.916 5.501 1.00 25.53 C ATOM 295 CD1 ILE A 21 27.144 0.497 7.371 1.00 24.66 C ATOM 296 HA ILE A 21 27.703 0.887 5.000 1.00 0.00 H ATOM 297 HB ILE A 21 25.607 -1.305 4.831 1.00 0.00 H ATOM 298 HG12 ILE A 21 25.184 0.346 6.546 1.00 0.00 H ATOM 299 HG13 ILE A 21 25.777 -1.139 7.326 1.00 0.00 H ATOM 300 HD11 ILE A 21 28.014 -0.141 7.526 1.00 0.00 H ATOM 301 HD12 ILE A 21 27.421 1.346 6.745 1.00 0.00 H ATOM 302 HD13 ILE A 21 26.780 0.857 8.333 1.00 0.00 H ATOM 303 HG21 ILE A 21 27.806 -2.323 4.527 1.00 0.00 H ATOM 304 HG22 ILE A 21 28.412 -1.474 5.971 1.00 0.00 H ATOM 305 HG23 ILE A 21 27.144 -2.714 6.134 1.00 0.00 H ATOM 306 H ILE A 21 24.923 0.957 4.251 1.00 0.00 H ATOM 307 N GLN A 22 27.018 -0.401 2.088 1.00 28.18 N ATOM 308 CA GLN A 22 27.684 -0.787 0.845 1.00 29.23 C ATOM 309 C GLN A 22 28.681 0.304 0.472 1.00 32.38 C ATOM 310 O GLN A 22 29.820 0.023 0.100 1.00 36.75 O ATOM 311 CB GLN A 22 26.691 -0.996 -0.304 1.00 28.93 C ATOM 312 CG GLN A 22 26.225 -2.433 -0.499 1.00 25.50 C ATOM 313 CD GLN A 22 27.300 -3.349 -1.088 1.00 28.79 C ATOM 314 OE1 GLN A 22 28.454 -2.955 -1.253 1.00 31.48 O ATOM 315 NE2 GLN A 22 26.914 -4.582 -1.410 1.00 22.17 N ATOM 316 HA GLN A 22 28.191 -1.738 1.007 1.00 0.00 H ATOM 317 HB2 GLN A 22 25.814 -0.379 -0.109 1.00 0.00 H ATOM 318 HB3 GLN A 22 27.168 -0.667 -1.227 1.00 0.00 H ATOM 319 HG2 GLN A 22 25.924 -2.833 0.469 1.00 0.00 H ATOM 320 HG3 GLN A 22 25.368 -2.430 -1.172 1.00 0.00 H ATOM 321 HE22 GLN A 22 25.929 -4.876 -1.254 1.00 0.00 H ATOM 322 HE21 GLN A 22 27.598 -5.251 -1.817 1.00 0.00 H ATOM 323 H GLN A 22 25.991 -0.238 2.096 1.00 0.00 H ATOM 324 N LEU A 23 28.255 1.556 0.579 1.00 32.72 N ATOM 325 CA LEU A 23 29.132 2.668 0.234 1.00 31.34 C ATOM 326 C LEU A 23 30.360 2.712 1.144 1.00 34.99 C ATOM 327 O LEU A 23 31.488 2.875 0.678 1.00 39.14 O ATOM 328 CB LEU A 23 28.380 3.997 0.312 1.00 28.67 C ATOM 329 CG LEU A 23 29.206 5.219 -0.108 1.00 30.40 C ATOM 330 CD1 LEU A 23 29.200 5.389 -1.625 1.00 29.92 C ATOM 331 CD2 LEU A 23 28.706 6.485 0.579 1.00 29.76 C ATOM 332 HA LEU A 23 29.469 2.511 -0.791 1.00 0.00 H ATOM 333 HB2 LEU A 23 27.508 3.934 -0.339 1.00 0.00 H ATOM 334 HB3 LEU A 23 28.053 4.144 1.341 1.00 0.00 H ATOM 335 HG LEU A 23 30.234 5.048 0.210 1.00 0.00 H ATOM 336 HD21 LEU A 23 27.665 6.658 0.306 1.00 0.00 H ATOM 337 HD22 LEU A 23 28.785 6.366 1.660 1.00 0.00 H ATOM 338 HD23 LEU A 23 29.312 7.333 0.260 1.00 0.00 H ATOM 339 HD11 LEU A 23 29.627 4.501 -2.091 1.00 0.00 H ATOM 340 HD12 LEU A 23 28.175 5.524 -1.970 1.00 0.00 H ATOM 341 HD13 LEU A 23 29.793 6.263 -1.894 1.00 0.00 H ATOM 342 H LEU A 23 27.288 1.745 0.912 1.00 0.00 H ATOM 343 N ILE A 24 30.133 2.563 2.446 1.00 34.62 N ATOM 344 CA ILE A 24 31.191 2.718 3.436 1.00 34.63 C ATOM 345 C ILE A 24 32.061 1.471 3.588 1.00 42.68 C ATOM 346 O ILE A 24 33.283 1.559 3.544 1.00 47.77 O ATOM 347 CB ILE A 24 30.611 3.097 4.811 1.00 32.95 C ATOM 348 CG1 ILE A 24 29.621 4.255 4.673 1.00 31.43 C ATOM 349 CG2 ILE A 24 31.726 3.490 5.770 1.00 33.27 C ATOM 350 CD1 ILE A 24 30.280 5.566 4.265 1.00 34.00 C ATOM 351 HA ILE A 24 31.825 3.522 3.064 1.00 0.00 H ATOM 352 HB ILE A 24 30.089 2.228 5.210 1.00 0.00 H ATOM 353 HG12 ILE A 24 28.881 3.990 3.918 1.00 0.00 H ATOM 354 HG13 ILE A 24 29.123 4.401 5.632 1.00 0.00 H ATOM 355 HD11 ILE A 24 31.016 5.851 5.017 1.00 0.00 H ATOM 356 HD12 ILE A 24 30.773 5.439 3.301 1.00 0.00 H ATOM 357 HD13 ILE A 24 29.520 6.344 4.186 1.00 0.00 H ATOM 358 HG21 ILE A 24 32.410 2.651 5.893 1.00 0.00 H ATOM 359 HG22 ILE A 24 32.267 4.345 5.365 1.00 0.00 H ATOM 360 HG23 ILE A 24 31.296 3.754 6.736 1.00 0.00 H ATOM 361 H ILE A 24 29.172 2.329 2.767 1.00 0.00 H ATOM 362 N GLN A 25 31.433 0.311 3.757 1.00 46.20 N ATOM 363 CA GLN A 25 32.162 -0.913 4.093 1.00 46.73 C ATOM 364 C GLN A 25 32.265 -1.940 2.958 1.00 46.05 C ATOM 365 O GLN A 25 32.893 -2.987 3.122 1.00 47.86 O ATOM 366 CB GLN A 25 31.562 -1.567 5.342 1.00 47.03 C ATOM 367 CG GLN A 25 31.637 -0.698 6.587 1.00 51.78 C ATOM 368 CD GLN A 25 30.963 -1.331 7.794 1.00 57.25 C ATOM 369 OE1 GLN A 25 30.583 -2.504 7.771 1.00 59.49 O ATOM 370 NE2 GLN A 25 30.808 -0.550 8.857 1.00 57.61 N ATOM 371 HA GLN A 25 33.185 -0.590 4.285 1.00 0.00 H ATOM 372 HB2 GLN A 25 30.514 -1.792 5.143 1.00 0.00 H ATOM 373 HB3 GLN A 25 32.101 -2.494 5.537 1.00 0.00 H ATOM 374 HG2 GLN A 25 32.686 -0.523 6.826 1.00 0.00 H ATOM 375 HG3 GLN A 25 31.150 0.254 6.376 1.00 0.00 H ATOM 376 HE22 GLN A 25 31.144 0.434 8.833 1.00 0.00 H ATOM 377 HE21 GLN A 25 30.351 -0.922 9.714 1.00 0.00 H ATOM 378 H GLN A 25 30.399 0.273 3.648 1.00 0.00 H ATOM 379 N ASN A 26 31.652 -1.645 1.816 1.00 40.84 N ATOM 380 CA ASN A 26 31.779 -2.506 0.641 1.00 42.99 C ATOM 381 C ASN A 26 31.240 -3.914 0.832 1.00 42.32 C ATOM 382 O ASN A 26 31.706 -4.849 0.181 1.00 46.56 O ATOM 383 CB ASN A 26 33.241 -2.596 0.191 1.00 49.84 C ATOM 384 CG ASN A 26 33.844 -1.238 -0.108 1.00 55.63 C ATOM 385 OD1 ASN A 26 33.165 -0.336 -0.603 1.00 56.22 O ATOM 386 ND2 ASN A 26 35.130 -1.085 0.191 1.00 57.59 N ATOM 387 HA ASN A 26 31.163 -2.030 -0.122 1.00 0.00 H ATOM 388 HB2 ASN A 26 33.822 -3.069 0.983 1.00 0.00 H ATOM 389 HB3 ASN A 26 33.292 -3.207 -0.710 1.00 0.00 H ATOM 390 HD22 ASN A 26 35.664 -1.874 0.608 1.00 0.00 H ATOM 391 HD21 ASN A 26 35.602 -0.176 0.008 1.00 0.00 H ATOM 392 H ASN A 26 31.071 -0.785 1.757 1.00 0.00 H ATOM 393 N HIS A 27 30.270 -4.076 1.722 1.00 41.38 N ATOM 394 CA HIS A 27 29.612 -5.368 1.873 1.00 41.01 C ATOM 395 C HIS A 27 28.109 -5.214 2.090 1.00 39.79 C ATOM 396 O HIS A 27 27.636 -4.190 2.586 1.00 38.40 O ATOM 397 CB HIS A 27 30.246 -6.186 3.002 1.00 44.09 C ATOM 398 CG HIS A 27 29.940 -5.663 4.370 1.00 48.63 C ATOM 399 ND1 HIS A 27 28.828 -6.059 5.084 1.00 49.19 N ATOM 400 CD2 HIS A 27 30.590 -4.768 5.146 1.00 50.71 C ATOM 401 CE1 HIS A 27 28.812 -5.431 6.246 1.00 50.49 C ATOM 402 NE2 HIS A 27 29.868 -4.641 6.312 1.00 51.58 N ATOM 403 HA HIS A 27 29.756 -5.913 0.940 1.00 0.00 H ATOM 404 HB2 HIS A 27 29.877 -7.210 2.934 1.00 0.00 H ATOM 405 HB3 HIS A 27 31.327 -6.181 2.865 1.00 0.00 H ATOM 406 HD2 HIS A 27 31.513 -4.245 4.896 1.00 0.00 H ATOM 407 HE1 HIS A 27 28.054 -5.546 7.021 1.00 0.00 H ATOM 408 H HIS A 27 29.977 -3.275 2.317 1.00 0.00 H ATOM 409 N PHE A 28 27.369 -6.245 1.705 1.00 37.98 N ATOM 410 CA PHE A 28 25.923 -6.237 1.795 1.00 35.47 C ATOM 411 C PHE A 28 25.446 -6.828 3.115 1.00 40.18 C ATOM 412 O PHE A 28 25.779 -7.963 3.455 1.00 45.72 O ATOM 413 CB PHE A 28 25.327 -7.023 0.628 1.00 33.08 C ATOM 414 CG PHE A 28 23.834 -7.192 0.707 1.00 32.34 C ATOM 415 CD1 PHE A 28 22.995 -6.084 0.739 1.00 29.97 C ATOM 416 CD2 PHE A 28 23.268 -8.454 0.733 1.00 29.19 C ATOM 417 CE1 PHE A 28 21.619 -6.236 0.806 1.00 26.30 C ATOM 418 CE2 PHE A 28 21.896 -8.610 0.797 1.00 29.50 C ATOM 419 CZ PHE A 28 21.070 -7.497 0.833 1.00 28.01 C ATOM 420 HA PHE A 28 25.587 -5.201 1.748 1.00 0.00 H ATOM 421 HB2 PHE A 28 25.565 -6.498 -0.297 1.00 0.00 H ATOM 422 HB3 PHE A 28 25.784 -8.012 0.611 1.00 0.00 H ATOM 423 HD2 PHE A 28 23.910 -9.334 0.703 1.00 0.00 H ATOM 424 HE2 PHE A 28 21.463 -9.610 0.819 1.00 0.00 H ATOM 425 HZ PHE A 28 19.988 -7.621 0.883 1.00 0.00 H ATOM 426 HE1 PHE A 28 20.973 -5.358 0.837 1.00 0.00 H ATOM 427 HD1 PHE A 28 23.425 -5.083 0.711 1.00 0.00 H ATOM 428 H PHE A 28 27.843 -7.089 1.325 1.00 0.00 H ATOM 429 N VAL A 29 24.669 -6.046 3.857 1.00 38.38 N ATOM 430 CA VAL A 29 24.080 -6.510 5.106 1.00 38.83 C ATOM 431 C VAL A 29 22.769 -7.244 4.838 1.00 38.28 C ATOM 432 O VAL A 29 21.768 -6.642 4.443 1.00 36.07 O ATOM 433 CB VAL A 29 23.832 -5.349 6.094 1.00 39.00 C ATOM 434 CG1 VAL A 29 23.019 -4.244 5.434 1.00 38.31 C ATOM 435 CG2 VAL A 29 23.133 -5.857 7.346 1.00 38.66 C ATOM 436 HA VAL A 29 24.795 -7.195 5.563 1.00 0.00 H ATOM 437 HB VAL A 29 24.797 -4.932 6.384 1.00 0.00 H ATOM 438 HG11 VAL A 29 23.562 -3.862 4.570 1.00 0.00 H ATOM 439 HG12 VAL A 29 22.058 -4.645 5.112 1.00 0.00 H ATOM 440 HG13 VAL A 29 22.857 -3.437 6.149 1.00 0.00 H ATOM 441 HG21 VAL A 29 22.176 -6.301 7.072 1.00 0.00 H ATOM 442 HG22 VAL A 29 23.757 -6.608 7.830 1.00 0.00 H ATOM 443 HG23 VAL A 29 22.967 -5.025 8.030 1.00 0.00 H ATOM 444 H VAL A 29 24.476 -5.075 3.537 1.00 0.00 H ATOM 445 N ASP A 30 22.787 -8.553 5.050 1.00 39.69 N ATOM 446 CA ASP A 30 21.620 -9.386 4.808 1.00 40.91 C ATOM 447 C ASP A 30 20.611 -9.288 5.953 1.00 38.66 C ATOM 448 O ASP A 30 19.409 -9.470 5.754 1.00 37.77 O ATOM 449 CB ASP A 30 22.077 -10.836 4.604 1.00 48.92 C ATOM 450 CG ASP A 30 20.927 -11.818 4.576 1.00 55.74 C ATOM 451 OD1 ASP A 30 20.163 -11.808 3.586 1.00 56.06 O ATOM 452 OD2 ASP A 30 20.801 -12.611 5.536 1.00 60.78 O ATOM 453 HA ASP A 30 21.114 -9.032 3.910 1.00 0.00 H ATOM 454 HB2 ASP A 30 22.614 -10.902 3.658 1.00 0.00 H ATOM 455 HB3 ASP A 30 22.747 -11.108 5.420 1.00 0.00 H ATOM 456 H ASP A 30 23.661 -8.996 5.399 1.00 0.00 H ATOM 457 N GLU A 31 21.103 -8.996 7.152 1.00 40.11 N ATOM 458 CA GLU A 31 20.239 -8.900 8.323 1.00 42.45 C ATOM 459 C GLU A 31 19.368 -7.644 8.250 1.00 40.95 C ATOM 460 O GLU A 31 19.757 -6.642 7.653 1.00 39.93 O ATOM 461 CB GLU A 31 21.079 -8.879 9.602 1.00 49.76 C ATOM 462 CG GLU A 31 22.427 -9.596 9.488 1.00 60.72 C ATOM 463 CD GLU A 31 22.303 -11.114 9.422 1.00 69.48 C ATOM 464 OE1 GLU A 31 23.350 -11.789 9.286 1.00 71.48 O ATOM 465 OE2 GLU A 31 21.166 -11.633 9.509 1.00 71.04 O ATOM 466 HA GLU A 31 19.588 -9.774 8.340 1.00 0.00 H ATOM 467 HB2 GLU A 31 21.268 -7.839 9.869 1.00 0.00 H ATOM 468 HB3 GLU A 31 20.504 -9.358 10.395 1.00 0.00 H ATOM 469 HG2 GLU A 31 22.927 -9.250 8.583 1.00 0.00 H ATOM 470 HG3 GLU A 31 23.031 -9.336 10.357 1.00 0.00 H ATOM 471 H GLU A 31 22.125 -8.833 7.258 1.00 0.00 H ATOM 472 N TYR A 32 18.183 -7.710 8.847 1.00 35.82 N ATOM 473 CA TYR A 32 17.322 -6.544 8.988 1.00 35.47 C ATOM 474 C TYR A 32 17.395 -6.051 10.433 1.00 34.85 C ATOM 475 O TYR A 32 16.724 -6.586 11.316 1.00 31.76 O ATOM 476 CB TYR A 32 15.882 -6.912 8.623 1.00 36.23 C ATOM 477 CG TYR A 32 14.894 -5.758 8.588 1.00 34.22 C ATOM 478 CD1 TYR A 32 15.115 -4.587 9.308 1.00 33.11 C ATOM 479 CD2 TYR A 32 13.734 -5.848 7.832 1.00 33.59 C ATOM 480 CE1 TYR A 32 14.199 -3.543 9.277 1.00 30.77 C ATOM 481 CE2 TYR A 32 12.824 -4.814 7.788 1.00 34.30 C ATOM 482 CZ TYR A 32 13.057 -3.665 8.511 1.00 31.97 C ATOM 483 OH TYR A 32 12.131 -2.650 8.457 1.00 30.56 O ATOM 484 HA TYR A 32 17.654 -5.753 8.316 1.00 0.00 H ATOM 485 HB3 TYR A 32 15.525 -7.636 9.356 1.00 0.00 H ATOM 486 HB2 TYR A 32 15.894 -7.373 7.635 1.00 0.00 H ATOM 487 HD2 TYR A 32 13.538 -6.756 7.261 1.00 0.00 H ATOM 488 HE2 TYR A 32 11.922 -4.905 7.183 1.00 0.00 H ATOM 489 HE1 TYR A 32 14.380 -2.635 9.853 1.00 0.00 H ATOM 490 HD1 TYR A 32 16.021 -4.488 9.906 1.00 0.00 H ATOM 491 HH TYR A 32 12.435 -1.897 9.023 1.00 0.00 H ATOM 492 H TYR A 32 17.860 -8.623 9.226 1.00 0.00 H ATOM 493 N ASP A 33 18.224 -5.042 10.675 1.00 33.27 N ATOM 494 CA ASP A 33 18.353 -4.476 12.013 1.00 33.48 C ATOM 495 C ASP A 33 17.859 -3.027 12.020 1.00 30.14 C ATOM 496 O ASP A 33 18.564 -2.124 11.572 1.00 26.46 O ATOM 497 CB ASP A 33 19.805 -4.566 12.491 1.00 35.97 C ATOM 498 CG ASP A 33 20.025 -3.875 13.819 1.00 41.97 C ATOM 499 OD1 ASP A 33 21.136 -3.343 14.036 1.00 43.18 O ATOM 500 OD2 ASP A 33 19.085 -3.861 14.644 1.00 45.11 O ATOM 501 HA ASP A 33 17.736 -5.050 12.704 1.00 0.00 H ATOM 502 HB2 ASP A 33 20.074 -5.617 12.595 1.00 0.00 H ATOM 503 HB3 ASP A 33 20.448 -4.100 11.744 1.00 0.00 H ATOM 504 H ASP A 33 18.791 -4.649 9.897 1.00 0.00 H ATOM 505 N PRO A 34 16.636 -2.808 12.527 1.00 30.39 N ATOM 506 CA PRO A 34 15.974 -1.498 12.505 1.00 28.21 C ATOM 507 C PRO A 34 16.877 -0.393 13.045 1.00 31.57 C ATOM 508 O PRO A 34 17.510 -0.557 14.087 1.00 28.21 O ATOM 509 CB PRO A 34 14.774 -1.698 13.435 1.00 26.22 C ATOM 510 CG PRO A 34 14.484 -3.160 13.367 1.00 27.28 C ATOM 511 CD PRO A 34 15.830 -3.825 13.229 1.00 30.11 C ATOM 512 HA PRO A 34 15.706 -1.189 11.495 1.00 0.00 H ATOM 513 HD3 PRO A 34 16.255 -4.055 14.206 1.00 0.00 H ATOM 514 HD2 PRO A 34 15.756 -4.740 12.641 1.00 0.00 H ATOM 515 HG3 PRO A 34 13.856 -3.386 12.505 1.00 0.00 H ATOM 516 HG2 PRO A 34 13.984 -3.493 14.276 1.00 0.00 H ATOM 517 HB2 PRO A 34 15.023 -1.402 14.454 1.00 0.00 H ATOM 518 HB3 PRO A 34 13.918 -1.119 13.089 1.00 0.00 H ATOM 519 N THR A 35 16.929 0.729 12.336 1.00 31.46 N ATOM 520 CA THR A 35 17.792 1.831 12.726 1.00 26.17 C ATOM 521 C THR A 35 17.121 2.806 13.682 1.00 28.66 C ATOM 522 O THR A 35 15.937 3.131 13.553 1.00 30.98 O ATOM 523 CB THR A 35 18.316 2.587 11.492 1.00 26.78 C ATOM 524 OG1 THR A 35 19.335 1.802 10.867 1.00 30.94 O ATOM 525 CG2 THR A 35 18.912 3.934 11.879 1.00 25.17 C ATOM 526 HA THR A 35 18.629 1.380 13.259 1.00 0.00 H ATOM 527 HB THR A 35 17.480 2.757 10.814 1.00 0.00 H ATOM 528 HG1 THR A 35 18.955 0.931 10.590 1.00 0.00 H ATOM 529 HG23 THR A 35 18.146 4.545 12.357 1.00 0.00 H ATOM 530 HG21 THR A 35 19.739 3.778 12.571 1.00 0.00 H ATOM 531 HG22 THR A 35 19.275 4.440 10.984 1.00 0.00 H ATOM 532 H THR A 35 16.340 0.821 11.484 1.00 0.00 H ATOM 533 N ILE A 36 17.894 3.251 14.662 1.00 29.19 N ATOM 534 CA ILE A 36 17.512 4.377 15.486 1.00 28.52 C ATOM 535 C ILE A 36 18.115 5.593 14.806 1.00 29.04 C ATOM 536 O ILE A 36 17.399 6.472 14.321 1.00 27.04 O ATOM 537 CB ILE A 36 18.063 4.222 16.916 1.00 30.04 C ATOM 538 CG1 ILE A 36 17.403 3.020 17.606 1.00 28.31 C ATOM 539 CG2 ILE A 36 17.865 5.509 17.727 1.00 21.64 C ATOM 540 CD1 ILE A 36 17.944 2.724 19.006 1.00 29.50 C ATOM 541 HA ILE A 36 16.429 4.460 15.581 1.00 0.00 H ATOM 542 HB ILE A 36 19.136 4.039 16.858 1.00 0.00 H ATOM 543 HG12 ILE A 36 16.334 3.217 17.687 1.00 0.00 H ATOM 544 HG13 ILE A 36 17.563 2.139 16.984 1.00 0.00 H ATOM 545 HD11 ILE A 36 19.011 2.511 18.944 1.00 0.00 H ATOM 546 HD12 ILE A 36 17.782 3.590 19.648 1.00 0.00 H ATOM 547 HD13 ILE A 36 17.423 1.861 19.420 1.00 0.00 H ATOM 548 HG21 ILE A 36 18.390 6.330 17.238 1.00 0.00 H ATOM 549 HG22 ILE A 36 16.801 5.740 17.786 1.00 0.00 H ATOM 550 HG23 ILE A 36 18.264 5.369 18.732 1.00 0.00 H ATOM 551 H ILE A 36 18.802 2.777 14.844 1.00 0.00 H ATOM 552 N GLU A 37 19.443 5.605 14.739 1.00 31.89 N ATOM 553 CA GLU A 37 20.190 6.627 14.025 1.00 33.57 C ATOM 554 C GLU A 37 21.657 6.213 13.964 1.00 33.52 C ATOM 555 O GLU A 37 22.213 5.719 14.951 1.00 35.91 O ATOM 556 CB GLU A 37 20.038 7.975 14.727 1.00 42.57 C ATOM 557 CG GLU A 37 20.763 9.128 14.054 1.00 52.14 C ATOM 558 CD GLU A 37 20.436 10.469 14.693 1.00 56.51 C ATOM 559 OE1 GLU A 37 19.624 11.215 14.101 1.00 59.45 O ATOM 560 OE2 GLU A 37 20.982 10.771 15.780 1.00 53.20 O ATOM 561 HA GLU A 37 19.803 6.729 13.011 1.00 0.00 H ATOM 562 HB2 GLU A 37 18.976 8.219 14.768 1.00 0.00 H ATOM 563 HB3 GLU A 37 20.426 7.876 15.741 1.00 0.00 H ATOM 564 HG2 GLU A 37 21.837 8.957 14.127 1.00 0.00 H ATOM 565 HG3 GLU A 37 20.472 9.160 13.004 1.00 0.00 H ATOM 566 H GLU A 37 19.971 4.849 15.219 1.00 0.00 H ATOM 567 N ASP A 38 22.278 6.390 12.802 1.00 29.12 N ATOM 568 CA ASP A 38 23.681 6.026 12.631 1.00 31.86 C ATOM 569 C ASP A 38 24.440 7.080 11.828 1.00 35.82 C ATOM 570 O ASP A 38 23.933 7.587 10.829 1.00 39.44 O ATOM 571 CB ASP A 38 23.808 4.649 11.980 1.00 31.84 C ATOM 572 CG ASP A 38 23.384 3.527 12.905 1.00 37.29 C ATOM 573 OD1 ASP A 38 23.941 3.428 14.018 1.00 42.04 O ATOM 574 OD2 ASP A 38 22.486 2.748 12.526 1.00 39.54 O ATOM 575 HA ASP A 38 24.133 5.980 13.622 1.00 0.00 H ATOM 576 HB2 ASP A 38 23.180 4.624 11.089 1.00 0.00 H ATOM 577 HB3 ASP A 38 24.848 4.492 11.694 1.00 0.00 H ATOM 578 H ASP A 38 21.754 6.795 12.000 1.00 0.00 H ATOM 579 N SER A 39 25.649 7.409 12.280 1.00 36.12 N ATOM 580 CA SER A 39 26.453 8.463 11.660 1.00 38.90 C ATOM 581 C SER A 39 27.694 7.892 11.011 1.00 38.76 C ATOM 582 O SER A 39 28.457 7.168 11.646 1.00 44.40 O ATOM 583 CB SER A 39 26.870 9.505 12.693 1.00 41.47 C ATOM 584 OG SER A 39 25.735 10.054 13.329 1.00 46.00 O ATOM 585 HA SER A 39 25.834 8.934 10.897 1.00 0.00 H ATOM 586 HB2 SER A 39 27.423 10.302 12.196 1.00 0.00 H ATOM 587 HB3 SER A 39 27.508 9.034 13.441 1.00 0.00 H ATOM 588 HG SER A 39 25.232 9.333 13.784 1.00 0.00 H ATOM 589 H SER A 39 26.034 6.900 13.101 1.00 0.00 H ATOM 590 N TYR A 40 27.902 8.225 9.744 1.00 32.58 N ATOM 591 CA TYR A 40 29.044 7.688 9.021 1.00 35.11 C ATOM 592 C TYR A 40 29.882 8.773 8.392 1.00 39.56 C ATOM 593 O TYR A 40 29.407 9.884 8.143 1.00 35.14 O ATOM 594 CB TYR A 40 28.598 6.702 7.941 1.00 31.74 C ATOM 595 CG TYR A 40 27.881 5.500 8.491 1.00 32.45 C ATOM 596 CD1 TYR A 40 26.495 5.452 8.526 1.00 28.47 C ATOM 597 CD2 TYR A 40 28.589 4.411 8.979 1.00 34.13 C ATOM 598 CE1 TYR A 40 25.829 4.345 9.031 1.00 28.75 C ATOM 599 CE2 TYR A 40 27.933 3.296 9.484 1.00 33.08 C ATOM 600 CZ TYR A 40 26.555 3.272 9.514 1.00 34.45 C ATOM 601 OH TYR A 40 25.905 2.163 10.017 1.00 38.48 O ATOM 602 HA TYR A 40 29.656 7.167 9.757 1.00 0.00 H ATOM 603 HB3 TYR A 40 29.480 6.361 7.398 1.00 0.00 H ATOM 604 HB2 TYR A 40 27.928 7.220 7.254 1.00 0.00 H ATOM 605 HD2 TYR A 40 29.679 4.431 8.966 1.00 0.00 H ATOM 606 HE2 TYR A 40 28.504 2.445 9.854 1.00 0.00 H ATOM 607 HE1 TYR A 40 24.739 4.321 9.047 1.00 0.00 H ATOM 608 HD1 TYR A 40 25.920 6.298 8.150 1.00 0.00 H ATOM 609 HH TYR A 40 24.926 2.305 9.968 1.00 0.00 H ATOM 610 H TYR A 40 27.245 8.874 9.265 1.00 0.00 H ATOM 611 N ARG A 41 31.134 8.423 8.124 1.00 46.77 N ATOM 612 CA ARG A 41 32.085 9.323 7.504 1.00 49.05 C ATOM 613 C ARG A 41 32.772 8.597 6.359 1.00 49.00 C ATOM 614 O ARG A 41 33.351 7.528 6.553 1.00 49.04 O ATOM 615 CB ARG A 41 33.129 9.750 8.530 1.00 53.55 C ATOM 616 CG ARG A 41 33.367 11.233 8.570 1.00 59.06 C ATOM 617 CD ARG A 41 33.952 11.724 7.263 1.00 62.47 C ATOM 618 NE ARG A 41 33.864 13.175 7.186 1.00 64.90 N ATOM 619 CZ ARG A 41 34.695 14.004 7.805 1.00 66.87 C ATOM 620 NH1 ARG A 41 35.688 13.523 8.544 1.00 65.79 N ATOM 621 NH2 ARG A 41 34.532 15.314 7.683 1.00 68.92 N ATOM 622 HA ARG A 41 31.567 10.206 7.129 1.00 0.00 H ATOM 623 HB2 ARG A 41 32.794 9.428 9.516 1.00 0.00 H ATOM 624 HB3 ARG A 41 34.071 9.257 8.289 1.00 0.00 H ATOM 625 HG2 ARG A 41 32.420 11.742 8.750 1.00 0.00 H ATOM 626 HG3 ARG A 41 34.060 11.461 9.379 1.00 0.00 H ATOM 627 HD2 ARG A 41 33.398 11.285 6.433 1.00 0.00 H ATOM 628 HD3 ARG A 41 34.998 11.423 7.201 1.00 0.00 H ATOM 629 HE ARG A 41 33.103 13.588 6.610 1.00 0.00 H ATOM 630 HH12 ARG A 41 36.338 14.174 9.028 1.00 0.00 H ATOM 631 HH11 ARG A 41 35.815 12.495 8.638 1.00 0.00 H ATOM 632 HH22 ARG A 41 35.182 15.966 8.167 1.00 0.00 H ATOM 633 HH21 ARG A 41 33.754 15.690 7.103 1.00 0.00 H ATOM 634 H ARG A 41 31.446 7.462 8.370 1.00 0.00 H ATOM 635 N LYS A 42 32.702 9.165 5.162 1.00 47.36 N ATOM 636 CA LYS A 42 33.470 8.626 4.050 1.00 47.73 C ATOM 637 C LYS A 42 34.194 9.726 3.286 1.00 47.42 C ATOM 638 O LYS A 42 33.613 10.759 2.948 1.00 42.93 O ATOM 639 CB LYS A 42 32.593 7.817 3.095 1.00 48.34 C ATOM 640 CG LYS A 42 33.402 7.124 2.008 1.00 50.75 C ATOM 641 CD LYS A 42 32.542 6.260 1.114 1.00 53.96 C ATOM 642 CE LYS A 42 33.402 5.433 0.169 1.00 56.41 C ATOM 643 NZ LYS A 42 34.380 4.593 0.919 1.00 59.15 N ATOM 644 HA LYS A 42 34.214 7.956 4.481 1.00 0.00 H ATOM 645 HB2 LYS A 42 32.057 7.061 3.668 1.00 0.00 H ATOM 646 HB3 LYS A 42 31.877 8.489 2.623 1.00 0.00 H ATOM 647 HG2 LYS A 42 33.891 7.883 1.397 1.00 0.00 H ATOM 648 HG3 LYS A 42 34.158 6.497 2.480 1.00 0.00 H ATOM 649 HD2 LYS A 42 31.944 5.590 1.732 1.00 0.00 H ATOM 650 HD3 LYS A 42 31.881 6.899 0.529 1.00 0.00 H ATOM 651 HE2 LYS A 42 33.946 6.104 -0.495 1.00 0.00 H ATOM 652 HE3 LYS A 42 32.756 4.784 -0.422 1.00 0.00 H ATOM 653 HZ1 LYS A 42 35.003 5.207 1.481 1.00 0.00 H ATOM 654 HZ2 LYS A 42 33.867 3.946 1.551 1.00 0.00 H ATOM 655 HZ3 LYS A 42 34.950 4.042 0.246 1.00 0.00 H ATOM 656 H LYS A 42 32.096 9.998 5.018 1.00 0.00 H ATOM 657 N GLN A 43 35.473 9.498 3.023 1.00 50.99 N ATOM 658 CA GLN A 43 36.238 10.413 2.197 1.00 53.90 C ATOM 659 C GLN A 43 36.380 9.819 0.808 1.00 54.50 C ATOM 660 O GLN A 43 36.971 8.751 0.636 1.00 56.09 O ATOM 661 CB GLN A 43 37.612 10.686 2.804 1.00 57.80 C ATOM 662 CG GLN A 43 38.426 11.703 2.019 1.00 65.17 C ATOM 663 CD GLN A 43 39.848 11.849 2.536 1.00 71.55 C ATOM 664 OE1 GLN A 43 40.807 11.790 1.765 1.00 73.39 O ATOM 665 NE2 GLN A 43 39.989 12.047 3.843 1.00 72.91 N ATOM 666 HA GLN A 43 35.711 11.366 2.139 1.00 0.00 H ATOM 667 HB2 GLN A 43 37.474 11.061 3.818 1.00 0.00 H ATOM 668 HB3 GLN A 43 38.168 9.749 2.837 1.00 0.00 H ATOM 669 HG2 GLN A 43 38.465 11.387 0.976 1.00 0.00 H ATOM 670 HG3 GLN A 43 37.930 12.672 2.085 1.00 0.00 H ATOM 671 HE22 GLN A 43 39.150 12.090 4.456 1.00 0.00 H ATOM 672 HE21 GLN A 43 40.938 12.159 4.252 1.00 0.00 H ATOM 673 H GLN A 43 35.934 8.652 3.414 1.00 0.00 H ATOM 674 N VAL A 44 35.813 10.504 -0.178 1.00 52.90 N ATOM 675 CA VAL A 44 35.946 10.087 -1.564 1.00 54.21 C ATOM 676 C VAL A 44 36.425 11.245 -2.421 1.00 53.50 C ATOM 677 O VAL A 44 36.427 12.398 -1.989 1.00 53.42 O ATOM 678 CB VAL A 44 34.619 9.566 -2.141 1.00 55.10 C ATOM 679 CG1 VAL A 44 34.266 8.223 -1.534 1.00 57.39 C ATOM 680 CG2 VAL A 44 33.506 10.578 -1.914 1.00 55.54 C ATOM 681 HA VAL A 44 36.674 9.276 -1.580 1.00 0.00 H ATOM 682 HB VAL A 44 34.737 9.429 -3.216 1.00 0.00 H ATOM 683 HG11 VAL A 44 35.056 7.506 -1.758 1.00 0.00 H ATOM 684 HG12 VAL A 44 34.165 8.329 -0.454 1.00 0.00 H ATOM 685 HG13 VAL A 44 33.324 7.872 -1.955 1.00 0.00 H ATOM 686 HG21 VAL A 44 33.385 10.749 -0.844 1.00 0.00 H ATOM 687 HG22 VAL A 44 33.763 11.516 -2.407 1.00 0.00 H ATOM 688 HG23 VAL A 44 32.575 10.192 -2.329 1.00 0.00 H ATOM 689 H VAL A 44 35.262 11.357 0.046 1.00 0.00 H ATOM 690 N VAL A 45 36.844 10.925 -3.637 1.00 51.97 N ATOM 691 CA VAL A 45 37.190 11.946 -4.604 1.00 50.35 C ATOM 692 C VAL A 45 36.135 11.929 -5.694 1.00 45.49 C ATOM 693 O VAL A 45 35.830 10.881 -6.266 1.00 41.82 O ATOM 694 CB VAL A 45 38.585 11.721 -5.202 1.00 53.03 C ATOM 695 CG1 VAL A 45 38.934 12.854 -6.152 1.00 53.68 C ATOM 696 CG2 VAL A 45 39.618 11.615 -4.090 1.00 53.32 C ATOM 697 HA VAL A 45 37.218 12.916 -4.109 1.00 0.00 H ATOM 698 HB VAL A 45 38.586 10.787 -5.764 1.00 0.00 H ATOM 699 HG11 VAL A 45 38.200 12.890 -6.957 1.00 0.00 H ATOM 700 HG12 VAL A 45 38.925 13.798 -5.608 1.00 0.00 H ATOM 701 HG13 VAL A 45 39.926 12.683 -6.570 1.00 0.00 H ATOM 702 HG21 VAL A 45 39.621 12.538 -3.509 1.00 0.00 H ATOM 703 HG22 VAL A 45 39.366 10.776 -3.441 1.00 0.00 H ATOM 704 HG23 VAL A 45 40.604 11.455 -4.526 1.00 0.00 H ATOM 705 H VAL A 45 36.926 9.923 -3.902 1.00 0.00 H ATOM 706 N ILE A 46 35.564 13.097 -5.956 1.00 45.02 N ATOM 707 CA ILE A 46 34.495 13.236 -6.928 1.00 42.62 C ATOM 708 C ILE A 46 34.830 14.393 -7.859 1.00 44.68 C ATOM 709 O ILE A 46 34.954 15.539 -7.420 1.00 47.20 O ATOM 710 CB ILE A 46 33.149 13.497 -6.225 1.00 40.43 C ATOM 711 CG1 ILE A 46 32.875 12.398 -5.189 1.00 38.48 C ATOM 712 CG2 ILE A 46 32.019 13.597 -7.242 1.00 37.99 C ATOM 713 CD1 ILE A 46 31.721 12.699 -4.248 1.00 35.65 C ATOM 714 HA ILE A 46 34.403 12.312 -7.498 1.00 0.00 H ATOM 715 HB ILE A 46 33.203 14.452 -5.702 1.00 0.00 H ATOM 716 HG12 ILE A 46 32.649 11.475 -5.722 1.00 0.00 H ATOM 717 HG13 ILE A 46 33.776 12.260 -4.591 1.00 0.00 H ATOM 718 HD11 ILE A 46 31.934 13.614 -3.695 1.00 0.00 H ATOM 719 HD12 ILE A 46 30.806 12.828 -4.827 1.00 0.00 H ATOM 720 HD13 ILE A 46 31.598 11.871 -3.550 1.00 0.00 H ATOM 721 HG21 ILE A 46 32.222 14.418 -7.930 1.00 0.00 H ATOM 722 HG22 ILE A 46 31.950 12.663 -7.800 1.00 0.00 H ATOM 723 HG23 ILE A 46 31.079 13.781 -6.722 1.00 0.00 H ATOM 724 H ILE A 46 35.893 13.942 -5.448 1.00 0.00 H ATOM 725 N ASP A 47 34.998 14.089 -9.141 1.00 44.55 N ATOM 726 CA ASP A 47 35.330 15.114 -10.122 1.00 49.95 C ATOM 727 C ASP A 47 36.581 15.892 -9.718 1.00 53.47 C ATOM 728 O ASP A 47 36.648 17.113 -9.881 1.00 53.91 O ATOM 729 CB ASP A 47 34.153 16.075 -10.299 1.00 51.63 C ATOM 730 CG ASP A 47 32.893 15.373 -10.758 1.00 52.46 C ATOM 731 OD1 ASP A 47 32.999 14.399 -11.536 1.00 53.45 O ATOM 732 OD2 ASP A 47 31.797 15.796 -10.336 1.00 51.99 O ATOM 733 HA ASP A 47 35.535 14.614 -11.069 1.00 0.00 H ATOM 734 HB2 ASP A 47 33.954 16.563 -9.345 1.00 0.00 H ATOM 735 HB3 ASP A 47 34.424 16.827 -11.040 1.00 0.00 H ATOM 736 H ASP A 47 34.891 13.102 -9.450 1.00 0.00 H ATOM 737 N GLY A 48 37.569 15.184 -9.182 1.00 54.39 N ATOM 738 CA GLY A 48 38.822 15.806 -8.796 1.00 56.57 C ATOM 739 C GLY A 48 38.733 16.679 -7.558 1.00 57.52 C ATOM 740 O GLY A 48 39.556 17.573 -7.365 1.00 60.09 O ATOM 741 HA3 GLY A 48 39.166 16.424 -9.625 1.00 0.00 H ATOM 742 HA2 GLY A 48 39.550 15.017 -8.606 1.00 0.00 H ATOM 743 H GLY A 48 37.442 14.162 -9.036 1.00 0.00 H ATOM 744 N GLU A 49 37.729 16.431 -6.723 1.00 55.05 N ATOM 745 CA GLU A 49 37.635 17.099 -5.430 1.00 54.67 C ATOM 746 C GLU A 49 37.560 16.078 -4.302 1.00 54.16 C ATOM 747 O GLU A 49 36.786 15.121 -4.368 1.00 51.60 O ATOM 748 CB GLU A 49 36.412 18.013 -5.365 1.00 58.11 C ATOM 749 CG GLU A 49 36.254 18.698 -4.009 1.00 63.23 C ATOM 750 CD GLU A 49 34.958 19.487 -3.879 1.00 66.52 C ATOM 751 OE1 GLU A 49 34.969 20.537 -3.201 1.00 69.56 O ATOM 752 OE2 GLU A 49 33.927 19.056 -4.439 1.00 64.30 O ATOM 753 HA GLU A 49 38.533 17.705 -5.312 1.00 0.00 H ATOM 754 HB2 GLU A 49 36.509 18.780 -6.133 1.00 0.00 H ATOM 755 HB3 GLU A 49 35.521 17.416 -5.560 1.00 0.00 H ATOM 756 HG2 GLU A 49 36.274 17.935 -3.231 1.00 0.00 H ATOM 757 HG3 GLU A 49 37.091 19.382 -3.867 1.00 0.00 H ATOM 758 H GLU A 49 36.996 15.747 -6.997 1.00 0.00 H ATOM 759 N THR A 50 38.364 16.280 -3.266 1.00 53.84 N ATOM 760 CA THR A 50 38.298 15.411 -2.100 1.00 51.01 C ATOM 761 C THR A 50 37.098 15.809 -1.255 1.00 47.39 C ATOM 762 O THR A 50 37.022 16.931 -0.753 1.00 47.84 O ATOM 763 CB THR A 50 39.577 15.483 -1.240 1.00 52.54 C ATOM 764 OG1 THR A 50 40.731 15.368 -2.081 1.00 53.52 O ATOM 765 CG2 THR A 50 39.589 14.357 -0.212 1.00 49.35 C ATOM 766 HA THR A 50 38.201 14.385 -2.454 1.00 0.00 H ATOM 767 HB THR A 50 39.594 16.441 -0.720 1.00 0.00 H ATOM 768 HG1 THR A 50 41.549 15.415 -1.525 1.00 0.00 H ATOM 769 HG23 THR A 50 38.712 14.443 0.429 1.00 0.00 H ATOM 770 HG21 THR A 50 39.572 13.396 -0.727 1.00 0.00 H ATOM 771 HG22 THR A 50 40.492 14.430 0.394 1.00 0.00 H ATOM 772 H THR A 50 39.046 17.065 -3.287 1.00 0.00 H ATOM 773 N CYS A 51 36.156 14.888 -1.106 1.00 42.96 N ATOM 774 CA CYS A 51 34.932 15.187 -0.383 1.00 41.67 C ATOM 775 C CYS A 51 34.861 14.432 0.928 1.00 41.32 C ATOM 776 O CYS A 51 35.015 13.209 0.967 1.00 42.09 O ATOM 777 CB CYS A 51 33.708 14.852 -1.236 1.00 39.52 C ATOM 778 SG CYS A 51 33.669 15.710 -2.814 1.00 45.34 S ATOM 779 HA CYS A 51 34.938 16.255 -0.163 1.00 0.00 H ATOM 780 HB2 CYS A 51 32.813 15.122 -0.675 1.00 0.00 H ATOM 781 HB3 CYS A 51 33.705 13.779 -1.427 1.00 0.00 H ATOM 782 HG CYS A 51 34.787 15.370 -3.548 1.00 0.00 H ATOM 783 H CYS A 51 36.295 13.940 -1.511 1.00 0.00 H ATOM 784 N LEU A 52 34.629 15.172 2.002 1.00 39.69 N ATOM 785 CA LEU A 52 34.368 14.557 3.288 1.00 45.23 C ATOM 786 C LEU A 52 32.853 14.435 3.461 1.00 41.33 C ATOM 787 O LEU A 52 32.158 15.429 3.681 1.00 40.74 O ATOM 788 CB LEU A 52 35.014 15.374 4.408 1.00 53.63 C ATOM 789 CG LEU A 52 36.502 15.676 4.161 1.00 61.23 C ATOM 790 CD1 LEU A 52 37.106 16.530 5.270 1.00 63.37 C ATOM 791 CD2 LEU A 52 37.313 14.392 3.972 1.00 62.76 C ATOM 792 HA LEU A 52 34.808 13.561 3.336 1.00 0.00 H ATOM 793 HB2 LEU A 52 34.479 16.319 4.499 1.00 0.00 H ATOM 794 HB3 LEU A 52 34.924 14.816 5.340 1.00 0.00 H ATOM 795 HG LEU A 52 36.552 16.251 3.236 1.00 0.00 H ATOM 796 HD21 LEU A 52 37.230 13.776 4.868 1.00 0.00 H ATOM 797 HD22 LEU A 52 36.926 13.842 3.114 1.00 0.00 H ATOM 798 HD23 LEU A 52 38.359 14.646 3.800 1.00 0.00 H ATOM 799 HD11 LEU A 52 36.572 17.478 5.328 1.00 0.00 H ATOM 800 HD12 LEU A 52 37.019 16.003 6.220 1.00 0.00 H ATOM 801 HD13 LEU A 52 38.157 16.717 5.051 1.00 0.00 H ATOM 802 H LEU A 52 34.634 16.209 1.921 1.00 0.00 H ATOM 803 N LEU A 53 32.344 13.213 3.325 1.00 37.26 N ATOM 804 CA LEU A 53 30.905 12.966 3.401 1.00 36.68 C ATOM 805 C LEU A 53 30.462 12.651 4.825 1.00 33.92 C ATOM 806 O LEU A 53 30.913 11.673 5.416 1.00 35.10 O ATOM 807 CB LEU A 53 30.491 11.823 2.461 1.00 32.42 C ATOM 808 CG LEU A 53 30.837 11.972 0.974 1.00 31.11 C ATOM 809 CD1 LEU A 53 30.299 10.807 0.160 1.00 28.74 C ATOM 810 CD2 LEU A 53 30.315 13.287 0.431 1.00 30.14 C ATOM 811 HA LEU A 53 30.408 13.882 3.084 1.00 0.00 H ATOM 812 HB2 LEU A 53 30.973 10.913 2.820 1.00 0.00 H ATOM 813 HB3 LEU A 53 29.409 11.713 2.536 1.00 0.00 H ATOM 814 HG LEU A 53 31.923 11.967 0.885 1.00 0.00 H ATOM 815 HD21 LEU A 53 29.232 13.322 0.546 1.00 0.00 H ATOM 816 HD22 LEU A 53 30.767 14.111 0.983 1.00 0.00 H ATOM 817 HD23 LEU A 53 30.572 13.370 -0.625 1.00 0.00 H ATOM 818 HD11 LEU A 53 30.735 9.878 0.526 1.00 0.00 H ATOM 819 HD12 LEU A 53 29.214 10.765 0.261 1.00 0.00 H ATOM 820 HD13 LEU A 53 30.563 10.946 -0.889 1.00 0.00 H ATOM 821 H LEU A 53 32.987 12.412 3.160 1.00 0.00 H ATOM 822 N ASP A 54 29.586 13.489 5.370 1.00 32.95 N ATOM 823 CA ASP A 54 28.970 13.229 6.665 1.00 36.14 C ATOM 824 C ASP A 54 27.590 12.661 6.414 1.00 32.28 C ATOM 825 O ASP A 54 26.653 13.408 6.123 1.00 32.22 O ATOM 826 CB ASP A 54 28.842 14.514 7.483 1.00 45.52 C ATOM 827 CG ASP A 54 30.161 14.969 8.064 1.00 56.76 C ATOM 828 OD1 ASP A 54 30.464 16.181 7.991 1.00 59.84 O ATOM 829 OD2 ASP A 54 30.894 14.111 8.600 1.00 62.82 O ATOM 830 HA ASP A 54 29.591 12.532 7.228 1.00 0.00 H ATOM 831 HB2 ASP A 54 28.455 15.302 6.837 1.00 0.00 H ATOM 832 HB3 ASP A 54 28.142 14.339 8.300 1.00 0.00 H ATOM 833 H ASP A 54 29.332 14.357 4.856 1.00 0.00 H ATOM 834 N ILE A 55 27.461 11.344 6.525 1.00 27.46 N ATOM 835 CA ILE A 55 26.210 10.680 6.177 1.00 27.96 C ATOM 836 C ILE A 55 25.386 10.273 7.393 1.00 30.14 C ATOM 837 O ILE A 55 25.843 9.511 8.244 1.00 31.96 O ATOM 838 CB ILE A 55 26.458 9.451 5.285 1.00 23.97 C ATOM 839 CG1 ILE A 55 27.237 9.867 4.030 1.00 24.95 C ATOM 840 CG2 ILE A 55 25.134 8.789 4.910 1.00 23.78 C ATOM 841 CD1 ILE A 55 27.993 8.723 3.356 1.00 22.41 C ATOM 842 HA ILE A 55 25.631 11.419 5.624 1.00 0.00 H ATOM 843 HB ILE A 55 27.053 8.724 5.838 1.00 0.00 H ATOM 844 HG12 ILE A 55 26.531 10.282 3.311 1.00 0.00 H ATOM 845 HG13 ILE A 55 27.958 10.634 4.313 1.00 0.00 H ATOM 846 HD11 ILE A 55 28.714 8.303 4.057 1.00 0.00 H ATOM 847 HD12 ILE A 55 27.286 7.950 3.054 1.00 0.00 H ATOM 848 HD13 ILE A 55 28.516 9.102 2.478 1.00 0.00 H ATOM 849 HG21 ILE A 55 24.618 8.472 5.816 1.00 0.00 H ATOM 850 HG22 ILE A 55 24.513 9.502 4.368 1.00 0.00 H ATOM 851 HG23 ILE A 55 25.329 7.922 4.279 1.00 0.00 H ATOM 852 H ILE A 55 28.264 10.778 6.865 1.00 0.00 H ATOM 853 N LEU A 56 24.163 10.788 7.468 1.00 27.86 N ATOM 854 CA LEU A 56 23.248 10.396 8.528 1.00 25.88 C ATOM 855 C LEU A 56 22.252 9.355 8.013 1.00 24.14 C ATOM 856 O LEU A 56 21.543 9.578 7.035 1.00 23.86 O ATOM 857 CB LEU A 56 22.511 11.616 9.080 1.00 25.48 C ATOM 858 CG LEU A 56 21.631 11.402 10.315 1.00 26.50 C ATOM 859 CD1 LEU A 56 22.473 10.977 11.509 1.00 25.82 C ATOM 860 CD2 LEU A 56 20.855 12.669 10.642 1.00 28.04 C ATOM 861 HA LEU A 56 23.827 9.951 9.337 1.00 0.00 H ATOM 862 HB2 LEU A 56 23.261 12.364 9.337 1.00 0.00 H ATOM 863 HB3 LEU A 56 21.873 12.001 8.285 1.00 0.00 H ATOM 864 HG LEU A 56 20.921 10.605 10.093 1.00 0.00 H ATOM 865 HD21 LEU A 56 21.555 13.481 10.841 1.00 0.00 H ATOM 866 HD22 LEU A 56 20.221 12.934 9.796 1.00 0.00 H ATOM 867 HD23 LEU A 56 20.236 12.497 11.522 1.00 0.00 H ATOM 868 HD11 LEU A 56 22.987 10.044 11.276 1.00 0.00 H ATOM 869 HD12 LEU A 56 23.207 11.752 11.729 1.00 0.00 H ATOM 870 HD13 LEU A 56 21.826 10.831 12.374 1.00 0.00 H ATOM 871 H LEU A 56 23.856 11.482 6.757 1.00 0.00 H ATOM 872 N ASP A 57 22.220 8.206 8.674 1.00 22.78 N ATOM 873 CA ASP A 57 21.299 7.140 8.324 1.00 19.73 C ATOM 874 C ASP A 57 20.175 7.147 9.360 1.00 26.07 C ATOM 875 O ASP A 57 20.420 6.985 10.554 1.00 25.33 O ATOM 876 CB ASP A 57 22.042 5.806 8.298 1.00 21.83 C ATOM 877 CG ASP A 57 21.155 4.646 7.916 1.00 28.82 C ATOM 878 OD1 ASP A 57 20.096 4.885 7.304 1.00 31.73 O ATOM 879 OD2 ASP A 57 21.523 3.490 8.227 1.00 31.78 O ATOM 880 HA ASP A 57 20.874 7.288 7.331 1.00 0.00 H ATOM 881 HB2 ASP A 57 22.855 5.875 7.576 1.00 0.00 H ATOM 882 HB3 ASP A 57 22.453 5.618 9.290 1.00 0.00 H ATOM 883 H ASP A 57 22.876 8.064 9.469 1.00 0.00 H ATOM 884 N THR A 58 18.946 7.351 8.890 1.00 26.42 N ATOM 885 CA THR A 58 17.826 7.654 9.767 1.00 25.52 C ATOM 886 C THR A 58 16.886 6.466 9.944 1.00 26.85 C ATOM 887 O THR A 58 16.987 5.478 9.225 1.00 28.90 O ATOM 888 CB THR A 58 17.032 8.857 9.230 1.00 21.78 C ATOM 889 OG1 THR A 58 16.397 8.504 7.993 1.00 18.84 O ATOM 890 CG2 THR A 58 17.963 10.052 9.017 1.00 19.87 C ATOM 891 HA THR A 58 18.249 7.893 10.743 1.00 0.00 H ATOM 892 HB THR A 58 16.270 9.133 9.959 1.00 0.00 H ATOM 893 HG1 THR A 58 17.086 8.244 7.332 1.00 0.00 H ATOM 894 HG23 THR A 58 18.440 10.312 9.962 1.00 0.00 H ATOM 895 HG21 THR A 58 18.726 9.791 8.283 1.00 0.00 H ATOM 896 HG22 THR A 58 17.384 10.902 8.655 1.00 0.00 H ATOM 897 H THR A 58 18.782 7.292 7.865 1.00 0.00 H ATOM 898 N ALA A 59 15.971 6.574 10.907 1.00 21.14 N ATOM 899 CA ALA A 59 15.008 5.513 11.173 1.00 23.96 C ATOM 900 C ALA A 59 13.878 5.524 10.148 1.00 23.22 C ATOM 901 O ALA A 59 13.520 6.576 9.621 1.00 21.29 O ATOM 902 CB ALA A 59 14.442 5.653 12.587 1.00 24.66 C ATOM 903 HA ALA A 59 15.528 4.558 11.092 1.00 0.00 H ATOM 904 HB1 ALA A 59 15.255 5.587 13.310 1.00 0.00 H ATOM 905 HB2 ALA A 59 13.945 6.618 12.684 1.00 0.00 H ATOM 906 HB3 ALA A 59 13.724 4.853 12.771 1.00 0.00 H ATOM 907 H ALA A 59 15.943 7.439 11.484 1.00 0.00 H ATOM 908 N GLY A 60 13.315 4.354 9.870 1.00 26.88 N ATOM 909 CA GLY A 60 12.179 4.256 8.966 1.00 23.49 C ATOM 910 C GLY A 60 11.011 5.043 9.525 1.00 25.70 C ATOM 911 O GLY A 60 10.228 5.646 8.794 1.00 29.66 O ATOM 912 HA3 GLY A 60 11.892 3.210 8.856 1.00 0.00 H ATOM 913 HA2 GLY A 60 12.455 4.660 7.992 1.00 0.00 H ATOM 914 H GLY A 60 13.694 3.490 10.307 1.00 0.00 H ATOM 915 N GLN A 61 10.913 5.053 10.844 1.00 29.92 N ATOM 916 CA GLN A 61 9.816 5.708 11.532 1.00 41.56 C ATOM 917 C GLN A 61 10.341 6.371 12.795 1.00 44.11 C ATOM 918 O GLN A 61 10.928 5.714 13.652 1.00 45.94 O ATOM 919 CB GLN A 61 8.758 4.671 11.892 1.00 47.65 C ATOM 920 CG GLN A 61 7.377 5.222 12.116 1.00 54.28 C ATOM 921 CD GLN A 61 6.323 4.129 12.090 1.00 60.45 C ATOM 922 OE1 GLN A 61 6.733 2.913 11.730 1.00 65.68 O ATOM 923 NE2 GLN A 61 5.155 4.375 12.384 1.00 59.01 N ATOM 924 HA GLN A 61 9.372 6.466 10.886 1.00 0.00 H ATOM 925 HB2 GLN A 61 8.705 3.946 11.080 1.00 0.00 H ATOM 926 HB3 GLN A 61 9.074 4.169 12.806 1.00 0.00 H ATOM 927 HG2 GLN A 61 7.348 5.718 13.086 1.00 0.00 H ATOM 928 HG3 GLN A 61 7.154 5.946 11.332 1.00 0.00 H ATOM 929 HE22 GLN A 61 4.880 5.340 12.659 1.00 0.00 H ATOM 930 HE21 GLN A 61 4.442 3.619 12.357 1.00 0.00 H ATOM 931 H GLN A 61 11.646 4.576 11.406 1.00 0.00 H ATOM 932 N GLU A 62 10.141 7.677 12.900 1.00 44.59 N ATOM 933 CA GLU A 62 10.572 8.416 14.074 1.00 47.70 C ATOM 934 C GLU A 62 9.409 8.531 15.059 1.00 53.47 C ATOM 935 O GLU A 62 8.277 8.823 14.669 1.00 53.86 O ATOM 936 CB GLU A 62 11.063 9.803 13.661 1.00 49.00 C ATOM 937 CG GLU A 62 12.171 10.369 14.527 1.00 51.39 C ATOM 938 CD GLU A 62 13.490 9.638 14.353 1.00 49.52 C ATOM 939 OE1 GLU A 62 13.947 9.011 15.333 1.00 51.75 O ATOM 940 OE2 GLU A 62 14.075 9.701 13.246 1.00 43.23 O ATOM 941 HA GLU A 62 11.393 7.887 14.558 1.00 0.00 H ATOM 942 HB2 GLU A 62 11.431 9.742 12.637 1.00 0.00 H ATOM 943 HB3 GLU A 62 10.217 10.489 13.702 1.00 0.00 H ATOM 944 HG2 GLU A 62 12.317 11.417 14.265 1.00 0.00 H ATOM 945 HG3 GLU A 62 11.868 10.296 15.571 1.00 0.00 H ATOM 946 H GLU A 62 9.666 8.183 12.126 1.00 0.00 H ATOM 947 N GLU A 63 9.684 8.285 16.335 1.00 60.01 N ATOM 948 CA GLU A 63 8.650 8.386 17.359 1.00 66.97 C ATOM 949 C GLU A 63 8.380 9.847 17.698 1.00 67.72 C ATOM 950 O GLU A 63 7.252 10.219 18.021 1.00 68.24 O ATOM 951 CB GLU A 63 9.051 7.615 18.618 1.00 71.68 C ATOM 952 CG GLU A 63 10.268 8.183 19.324 1.00 75.77 C ATOM 953 CD GLU A 63 11.309 7.128 19.631 1.00 79.86 C ATOM 954 OE1 GLU A 63 12.507 7.477 19.703 1.00 82.27 O ATOM 955 OE2 GLU A 63 10.929 5.950 19.800 1.00 80.89 O ATOM 956 HA GLU A 63 7.736 7.942 16.964 1.00 0.00 H ATOM 957 HB2 GLU A 63 8.212 7.632 19.313 1.00 0.00 H ATOM 958 HB3 GLU A 63 9.267 6.585 18.336 1.00 0.00 H ATOM 959 HG2 GLU A 63 10.719 8.943 18.686 1.00 0.00 H ATOM 960 HG3 GLU A 63 9.947 8.640 20.260 1.00 0.00 H ATOM 961 H GLU A 63 10.651 8.016 16.608 1.00 0.00 H ATOM 962 N TYR A 64 9.421 10.671 17.620 1.00 66.28 N ATOM 963 CA TYR A 64 9.286 12.098 17.887 1.00 65.41 C ATOM 964 C TYR A 64 9.540 12.935 16.640 1.00 57.86 C ATOM 965 O TYR A 64 10.604 12.849 16.025 1.00 52.56 O ATOM 966 CB TYR A 64 10.222 12.532 19.018 1.00 72.69 C ATOM 967 CG TYR A 64 9.857 11.943 20.361 1.00 80.79 C ATOM 968 CD1 TYR A 64 8.673 12.297 20.997 1.00 85.86 C ATOM 969 CD2 TYR A 64 10.696 11.035 20.995 1.00 84.13 C ATOM 970 CE1 TYR A 64 8.331 11.761 22.228 1.00 90.04 C ATOM 971 CE2 TYR A 64 10.365 10.493 22.225 1.00 88.33 C ATOM 972 CZ TYR A 64 9.182 10.860 22.838 1.00 91.92 C ATOM 973 OH TYR A 64 8.849 10.324 24.062 1.00 95.58 O ATOM 974 HA TYR A 64 8.256 12.270 18.198 1.00 0.00 H ATOM 975 HB3 TYR A 64 10.188 13.619 19.097 1.00 0.00 H ATOM 976 HB2 TYR A 64 11.235 12.219 18.767 1.00 0.00 H ATOM 977 HD2 TYR A 64 11.631 10.744 20.516 1.00 0.00 H ATOM 978 HE2 TYR A 64 11.034 9.780 22.708 1.00 0.00 H ATOM 979 HE1 TYR A 64 7.397 12.048 22.712 1.00 0.00 H ATOM 980 HD1 TYR A 64 8.001 13.009 20.518 1.00 0.00 H ATOM 981 HH TYR A 64 7.977 10.691 24.355 1.00 0.00 H ATOM 982 H TYR A 64 10.353 10.289 17.363 1.00 0.00 H ATOM 983 N SER A 65 8.552 13.743 16.275 1.00 58.49 N ATOM 984 CA SER A 65 8.671 14.643 15.132 1.00 62.16 C ATOM 985 C SER A 65 9.914 15.530 15.204 1.00 61.55 C ATOM 986 O SER A 65 10.551 15.798 14.185 1.00 60.19 O ATOM 987 CB SER A 65 7.415 15.508 14.994 1.00 64.47 C ATOM 988 OG SER A 65 6.307 14.731 14.571 1.00 65.72 O ATOM 989 HA SER A 65 8.777 14.012 14.249 1.00 0.00 H ATOM 990 HB2 SER A 65 7.601 16.293 14.261 1.00 0.00 H ATOM 991 HB3 SER A 65 7.186 15.961 15.959 1.00 0.00 H ATOM 992 HG SER A 65 5.510 15.312 14.490 1.00 0.00 H ATOM 993 H SER A 65 7.666 13.735 16.820 1.00 0.00 H ATOM 994 N ALA A 66 10.257 15.981 16.407 1.00 61.14 N ATOM 995 CA ALA A 66 11.380 16.896 16.590 1.00 60.28 C ATOM 996 C ALA A 66 12.703 16.277 16.141 1.00 61.22 C ATOM 997 O ALA A 66 13.625 16.981 15.726 1.00 62.41 O ATOM 998 CB ALA A 66 11.465 17.356 18.043 1.00 58.62 C ATOM 999 HA ALA A 66 11.199 17.764 15.957 1.00 0.00 H ATOM 1000 HB1 ALA A 66 10.542 17.869 18.315 1.00 0.00 H ATOM 1001 HB2 ALA A 66 11.605 16.490 18.689 1.00 0.00 H ATOM 1002 HB3 ALA A 66 12.308 18.037 18.158 1.00 0.00 H ATOM 1003 H ALA A 66 9.712 15.674 17.238 1.00 0.00 H ATOM 1004 N MET A 67 12.795 14.957 16.220 1.00 60.21 N ATOM 1005 CA MET A 67 14.004 14.274 15.790 1.00 57.66 C ATOM 1006 C MET A 67 14.109 14.273 14.262 1.00 52.52 C ATOM 1007 O MET A 67 15.203 14.385 13.712 1.00 51.27 O ATOM 1008 CB MET A 67 14.044 12.853 16.349 1.00 60.35 C ATOM 1009 CG MET A 67 15.437 12.248 16.420 1.00 60.78 C ATOM 1010 SD MET A 67 15.444 10.696 17.337 1.00 95.77 S ATOM 1011 CE MET A 67 17.141 10.173 17.110 1.00 62.27 C ATOM 1012 HA MET A 67 14.866 14.813 16.183 1.00 0.00 H ATOM 1013 HB2 MET A 67 13.627 12.870 17.356 1.00 0.00 H ATOM 1014 HB3 MET A 67 13.428 12.218 15.713 1.00 0.00 H ATOM 1015 HG2 MET A 67 16.104 12.954 16.915 1.00 0.00 H ATOM 1016 HG3 MET A 67 15.794 12.062 15.407 1.00 0.00 H ATOM 1017 HE1 MET A 67 17.343 10.051 16.046 1.00 0.00 H ATOM 1018 HE2 MET A 67 17.811 10.927 17.524 1.00 0.00 H ATOM 1019 HE3 MET A 67 17.299 9.224 17.622 1.00 0.00 H ATOM 1020 H MET A 67 11.996 14.406 16.593 1.00 0.00 H ATOM 1021 N ARG A 68 12.970 14.153 13.582 1.00 50.99 N ATOM 1022 CA ARG A 68 12.935 14.258 12.124 1.00 52.41 C ATOM 1023 C ARG A 68 13.284 15.679 11.689 1.00 46.45 C ATOM 1024 O ARG A 68 14.052 15.886 10.748 1.00 42.35 O ATOM 1025 CB ARG A 68 11.549 13.911 11.576 1.00 58.93 C ATOM 1026 CG ARG A 68 10.903 12.679 12.170 1.00 66.43 C ATOM 1027 CD ARG A 68 9.431 12.945 12.490 1.00 74.35 C ATOM 1028 NE ARG A 68 8.506 12.061 11.782 1.00 76.97 N ATOM 1029 CZ ARG A 68 7.312 11.702 12.249 1.00 79.28 C ATOM 1030 NH1 ARG A 68 6.901 12.139 13.433 1.00 79.63 N ATOM 1031 NH2 ARG A 68 6.532 10.896 11.540 1.00 81.09 N ATOM 1032 HA ARG A 68 13.665 13.552 11.728 1.00 0.00 H ATOM 1033 HB2 ARG A 68 10.891 14.759 11.764 1.00 0.00 H ATOM 1034 HB3 ARG A 68 11.642 13.757 10.501 1.00 0.00 H ATOM 1035 HG2 ARG A 68 10.972 11.858 11.456 1.00 0.00 H ATOM 1036 HG3 ARG A 68 11.426 12.407 13.087 1.00 0.00 H ATOM 1037 HD2 ARG A 68 9.200 13.975 12.217 1.00 0.00 H ATOM 1038 HD3 ARG A 68 9.282 12.812 13.562 1.00 0.00 H ATOM 1039 HE ARG A 68 8.799 11.690 10.856 1.00 0.00 H ATOM 1040 HH12 ARG A 68 5.968 11.857 13.796 1.00 0.00 H ATOM 1041 HH11 ARG A 68 7.512 12.763 13.998 1.00 0.00 H ATOM 1042 HH22 ARG A 68 5.600 10.618 11.908 1.00 0.00 H ATOM 1043 HH21 ARG A 68 6.853 10.542 10.616 1.00 0.00 H ATOM 1044 H ARG A 68 12.085 13.981 14.100 1.00 0.00 H ATOM 1045 N ASP A 69 12.701 16.658 12.371 1.00 43.89 N ATOM 1046 CA ASP A 69 12.924 18.053 12.021 1.00 43.60 C ATOM 1047 C ASP A 69 14.403 18.412 12.138 1.00 40.09 C ATOM 1048 O ASP A 69 14.918 19.212 11.355 1.00 43.82 O ATOM 1049 CB ASP A 69 12.074 18.988 12.893 1.00 47.30 C ATOM 1050 CG ASP A 69 10.577 18.860 12.616 1.00 49.19 C ATOM 1051 OD1 ASP A 69 10.197 18.126 11.680 1.00 46.71 O ATOM 1052 OD2 ASP A 69 9.778 19.504 13.332 1.00 51.12 O ATOM 1053 HA ASP A 69 12.617 18.187 10.984 1.00 0.00 H ATOM 1054 HB2 ASP A 69 12.256 18.748 13.941 1.00 0.00 H ATOM 1055 HB3 ASP A 69 12.377 20.017 12.699 1.00 0.00 H ATOM 1056 H ASP A 69 12.075 16.424 13.168 1.00 0.00 H ATOM 1057 N GLN A 70 15.085 17.812 13.108 1.00 32.52 N ATOM 1058 CA GLN A 70 16.486 18.136 13.345 1.00 35.64 C ATOM 1059 C GLN A 70 17.393 17.776 12.169 1.00 38.87 C ATOM 1060 O GLN A 70 18.242 18.575 11.775 1.00 44.55 O ATOM 1061 CB GLN A 70 17.002 17.490 14.630 1.00 38.14 C ATOM 1062 CG GLN A 70 18.488 17.712 14.840 1.00 43.31 C ATOM 1063 CD GLN A 70 18.927 17.513 16.275 1.00 51.21 C ATOM 1064 OE1 GLN A 70 18.786 18.409 17.111 1.00 57.02 O ATOM 1065 NE2 GLN A 70 19.476 16.341 16.568 1.00 52.34 N ATOM 1066 HA GLN A 70 16.523 19.220 13.457 1.00 0.00 H ATOM 1067 HB2 GLN A 70 16.462 17.916 15.476 1.00 0.00 H ATOM 1068 HB3 GLN A 70 16.812 16.418 14.582 1.00 0.00 H ATOM 1069 HG2 GLN A 70 19.035 17.011 14.210 1.00 0.00 H ATOM 1070 HG3 GLN A 70 18.731 18.732 14.542 1.00 0.00 H ATOM 1071 HE22 GLN A 70 19.575 15.614 15.831 1.00 0.00 H ATOM 1072 HE21 GLN A 70 19.807 16.149 17.535 1.00 0.00 H ATOM 1073 H GLN A 70 14.613 17.103 13.705 1.00 0.00 H ATOM 1074 N TYR A 71 17.233 16.581 11.608 1.00 31.94 N ATOM 1075 CA TYR A 71 18.070 16.220 10.470 1.00 30.01 C ATOM 1076 C TYR A 71 17.626 16.902 9.168 1.00 30.14 C ATOM 1077 O TYR A 71 18.440 17.173 8.289 1.00 31.53 O ATOM 1078 CB TYR A 71 18.254 14.699 10.327 1.00 28.71 C ATOM 1079 CG TYR A 71 17.036 13.862 9.980 1.00 29.11 C ATOM 1080 CD1 TYR A 71 16.545 12.911 10.875 1.00 29.55 C ATOM 1081 CD2 TYR A 71 16.412 13.977 8.741 1.00 26.84 C ATOM 1082 CE1 TYR A 71 15.453 12.120 10.555 1.00 29.58 C ATOM 1083 CE2 TYR A 71 15.315 13.189 8.411 1.00 26.51 C ATOM 1084 CZ TYR A 71 14.841 12.261 9.320 1.00 30.67 C ATOM 1085 OH TYR A 71 13.750 11.473 8.997 1.00 28.86 O ATOM 1086 HA TYR A 71 19.063 16.616 10.684 1.00 0.00 H ATOM 1087 HB3 TYR A 71 18.642 14.329 11.276 1.00 0.00 H ATOM 1088 HB2 TYR A 71 18.994 14.534 9.544 1.00 0.00 H ATOM 1089 HD2 TYR A 71 16.790 14.698 8.016 1.00 0.00 H ATOM 1090 HE2 TYR A 71 14.831 13.302 7.441 1.00 0.00 H ATOM 1091 HE1 TYR A 71 15.077 11.390 11.272 1.00 0.00 H ATOM 1092 HD1 TYR A 71 17.029 12.788 11.844 1.00 0.00 H ATOM 1093 HH TYR A 71 13.545 10.869 9.754 1.00 0.00 H ATOM 1094 H TYR A 71 16.523 15.915 11.975 1.00 0.00 H ATOM 1095 N MET A 72 16.345 17.226 9.064 1.00 27.93 N ATOM 1096 CA MET A 72 15.869 17.977 7.912 1.00 29.90 C ATOM 1097 C MET A 72 16.417 19.414 7.877 1.00 31.65 C ATOM 1098 O MET A 72 16.532 20.014 6.807 1.00 34.63 O ATOM 1099 CB MET A 72 14.341 17.972 7.873 1.00 30.35 C ATOM 1100 CG MET A 72 13.752 16.582 7.664 1.00 28.49 C ATOM 1101 SD MET A 72 11.971 16.593 7.403 1.00 32.43 S ATOM 1102 CE MET A 72 11.748 14.980 6.653 1.00 25.81 C ATOM 1103 HA MET A 72 16.249 17.479 7.020 1.00 0.00 H ATOM 1104 HB2 MET A 72 13.968 18.368 8.818 1.00 0.00 H ATOM 1105 HB3 MET A 72 14.013 18.615 7.056 1.00 0.00 H ATOM 1106 HG2 MET A 72 13.969 15.978 8.545 1.00 0.00 H ATOM 1107 HG3 MET A 72 14.227 16.133 6.792 1.00 0.00 H ATOM 1108 HE1 MET A 72 12.329 14.925 5.732 1.00 0.00 H ATOM 1109 HE2 MET A 72 12.088 14.209 7.345 1.00 0.00 H ATOM 1110 HE3 MET A 72 10.692 14.828 6.428 1.00 0.00 H ATOM 1111 H MET A 72 15.677 16.942 9.809 1.00 0.00 H ATOM 1112 N ARG A 73 16.745 19.966 9.042 1.00 25.79 N ATOM 1113 CA ARG A 73 17.337 21.300 9.107 1.00 28.48 C ATOM 1114 C ARG A 73 18.815 21.275 8.742 1.00 28.69 C ATOM 1115 O ARG A 73 19.307 22.150 8.033 1.00 29.08 O ATOM 1116 CB ARG A 73 17.197 21.887 10.508 1.00 29.96 C ATOM 1117 CG ARG A 73 15.802 22.329 10.866 1.00 33.97 C ATOM 1118 CD ARG A 73 15.827 23.192 12.111 1.00 37.96 C ATOM 1119 NE ARG A 73 16.160 22.409 13.292 1.00 35.95 N ATOM 1120 CZ ARG A 73 15.254 21.848 14.081 1.00 33.81 C ATOM 1121 NH1 ARG A 73 15.636 21.150 15.142 1.00 32.19 N ATOM 1122 NH2 ARG A 73 13.963 21.994 13.806 1.00 32.34 N ATOM 1123 HA ARG A 73 16.800 21.918 8.388 1.00 0.00 H ATOM 1124 HB2 ARG A 73 17.509 21.130 11.227 1.00 0.00 H ATOM 1125 HB3 ARG A 73 17.857 22.751 10.583 1.00 0.00 H ATOM 1126 HG2 ARG A 73 15.383 22.902 10.039 1.00 0.00 H ATOM 1127 HG3 ARG A 73 15.182 21.451 11.049 1.00 0.00 H ATOM 1128 HD2 ARG A 73 14.845 23.644 12.250 1.00 0.00 H ATOM 1129 HD3 ARG A 73 16.572 23.977 11.984 1.00 0.00 H ATOM 1130 HE ARG A 73 17.164 22.283 13.530 1.00 0.00 H ATOM 1131 HH12 ARG A 73 14.924 20.711 15.760 1.00 0.00 H ATOM 1132 HH11 ARG A 73 16.648 21.042 15.357 1.00 0.00 H ATOM 1133 HH22 ARG A 73 13.248 21.556 14.421 1.00 0.00 H ATOM 1134 HH21 ARG A 73 13.667 22.546 12.976 1.00 0.00 H ATOM 1135 H ARG A 73 16.577 19.438 9.922 1.00 0.00 H ATOM 1136 N THR A 74 19.520 20.267 9.242 1.00 26.36 N ATOM 1137 CA THR A 74 20.973 20.205 9.126 1.00 29.01 C ATOM 1138 C THR A 74 21.456 19.643 7.788 1.00 29.27 C ATOM 1139 O THR A 74 22.466 20.093 7.246 1.00 28.31 O ATOM 1140 CB THR A 74 21.574 19.380 10.283 1.00 30.18 C ATOM 1141 OG1 THR A 74 20.980 18.076 10.301 1.00 31.28 O ATOM 1142 CG2 THR A 74 21.286 20.061 11.611 1.00 32.03 C ATOM 1143 HA THR A 74 21.322 21.236 9.180 1.00 0.00 H ATOM 1144 HB THR A 74 22.651 19.301 10.135 1.00 0.00 H ATOM 1145 HG1 THR A 74 20.002 18.162 10.430 1.00 0.00 H ATOM 1146 HG23 THR A 74 21.732 21.055 11.612 1.00 0.00 H ATOM 1147 HG21 THR A 74 20.208 20.145 11.749 1.00 0.00 H ATOM 1148 HG22 THR A 74 21.712 19.469 12.421 1.00 0.00 H ATOM 1149 H THR A 74 19.021 19.497 9.732 1.00 0.00 H ATOM 1150 N GLY A 75 20.738 18.660 7.256 1.00 26.64 N ATOM 1151 CA GLY A 75 21.147 18.032 6.013 1.00 25.46 C ATOM 1152 C GLY A 75 21.281 19.019 4.869 1.00 24.13 C ATOM 1153 O GLY A 75 20.392 19.837 4.639 1.00 20.61 O ATOM 1154 HA3 GLY A 75 20.404 17.282 5.741 1.00 0.00 H ATOM 1155 HA2 GLY A 75 22.111 17.547 6.169 1.00 0.00 H ATOM 1156 H GLY A 75 19.873 18.337 7.735 1.00 0.00 H ATOM 1157 N GLU A 76 22.389 18.945 4.141 1.00 25.20 N ATOM 1158 CA GLU A 76 22.548 19.769 2.944 1.00 27.74 C ATOM 1159 C GLU A 76 21.934 19.072 1.737 1.00 25.75 C ATOM 1160 O GLU A 76 21.407 19.716 0.836 1.00 27.24 O ATOM 1161 CB GLU A 76 24.019 20.086 2.693 1.00 31.50 C ATOM 1162 CG GLU A 76 24.652 20.939 3.784 1.00 38.66 C ATOM 1163 CD GLU A 76 26.139 21.145 3.570 1.00 44.33 C ATOM 1164 OE1 GLU A 76 26.856 20.144 3.362 1.00 42.77 O ATOM 1165 OE2 GLU A 76 26.587 22.310 3.605 1.00 50.61 O ATOM 1166 HA GLU A 76 22.024 20.711 3.104 1.00 0.00 H ATOM 1167 HB2 GLU A 76 24.568 19.147 2.627 1.00 0.00 H ATOM 1168 HB3 GLU A 76 24.100 20.620 1.746 1.00 0.00 H ATOM 1169 HG2 GLU A 76 24.162 21.913 3.796 1.00 0.00 H ATOM 1170 HG3 GLU A 76 24.502 20.447 4.745 1.00 0.00 H ATOM 1171 H GLU A 76 23.150 18.295 4.425 1.00 0.00 H ATOM 1172 N GLY A 77 22.000 17.746 1.731 1.00 28.13 N ATOM 1173 CA GLY A 77 21.417 16.962 0.655 1.00 28.92 C ATOM 1174 C GLY A 77 20.718 15.731 1.192 1.00 29.44 C ATOM 1175 O GLY A 77 21.140 15.163 2.205 1.00 30.51 O ATOM 1176 HA3 GLY A 77 22.208 16.653 -0.029 1.00 0.00 H ATOM 1177 HA2 GLY A 77 20.694 17.576 0.118 1.00 0.00 H ATOM 1178 H GLY A 77 22.480 17.257 2.514 1.00 0.00 H ATOM 1179 N PHE A 78 19.652 15.317 0.513 1.00 21.42 N ATOM 1180 CA PHE A 78 18.851 14.194 0.983 1.00 22.44 C ATOM 1181 C PHE A 78 18.734 13.087 -0.057 1.00 22.62 C ATOM 1182 O PHE A 78 18.350 13.332 -1.200 1.00 21.07 O ATOM 1183 CB PHE A 78 17.454 14.674 1.394 1.00 23.90 C ATOM 1184 CG PHE A 78 17.469 15.667 2.526 1.00 26.08 C ATOM 1185 CD1 PHE A 78 17.366 15.239 3.846 1.00 26.15 C ATOM 1186 CD2 PHE A 78 17.610 17.022 2.275 1.00 22.40 C ATOM 1187 CE1 PHE A 78 17.399 16.148 4.896 1.00 26.63 C ATOM 1188 CE2 PHE A 78 17.637 17.943 3.321 1.00 22.04 C ATOM 1189 CZ PHE A 78 17.532 17.505 4.631 1.00 24.47 C ATOM 1190 HA PHE A 78 19.365 13.775 1.848 1.00 0.00 H ATOM 1191 HB2 PHE A 78 16.982 15.142 0.530 1.00 0.00 H ATOM 1192 HB3 PHE A 78 16.868 13.808 1.702 1.00 0.00 H ATOM 1193 HD2 PHE A 78 17.701 17.372 1.247 1.00 0.00 H ATOM 1194 HE2 PHE A 78 17.741 19.007 3.108 1.00 0.00 H ATOM 1195 HZ PHE A 78 17.554 18.223 5.451 1.00 0.00 H ATOM 1196 HE1 PHE A 78 17.321 15.797 5.925 1.00 0.00 H ATOM 1197 HD1 PHE A 78 17.258 14.176 4.059 1.00 0.00 H ATOM 1198 H PHE A 78 19.386 15.802 -0.367 1.00 0.00 H ATOM 1199 N LEU A 79 19.068 11.867 0.352 1.00 18.32 N ATOM 1200 CA LEU A 79 18.870 10.697 -0.484 1.00 21.73 C ATOM 1201 C LEU A 79 17.512 10.115 -0.126 1.00 24.15 C ATOM 1202 O LEU A 79 17.323 9.587 0.975 1.00 23.55 O ATOM 1203 CB LEU A 79 19.984 9.674 -0.236 1.00 23.48 C ATOM 1204 CG LEU A 79 20.506 8.851 -1.414 1.00 23.33 C ATOM 1205 CD1 LEU A 79 21.291 9.716 -2.407 1.00 19.19 C ATOM 1206 CD2 LEU A 79 21.368 7.697 -0.900 1.00 24.70 C ATOM 1207 HA LEU A 79 18.903 10.962 -1.541 1.00 0.00 H ATOM 1208 HB2 LEU A 79 20.834 10.219 0.175 1.00 0.00 H ATOM 1209 HB3 LEU A 79 19.612 8.969 0.507 1.00 0.00 H ATOM 1210 HG LEU A 79 19.648 8.445 -1.950 1.00 0.00 H ATOM 1211 HD21 LEU A 79 22.212 8.098 -0.338 1.00 0.00 H ATOM 1212 HD22 LEU A 79 20.768 7.058 -0.251 1.00 0.00 H ATOM 1213 HD23 LEU A 79 21.736 7.116 -1.745 1.00 0.00 H ATOM 1214 HD11 LEU A 79 20.642 10.500 -2.797 1.00 0.00 H ATOM 1215 HD12 LEU A 79 22.143 10.168 -1.899 1.00 0.00 H ATOM 1216 HD13 LEU A 79 21.644 9.093 -3.229 1.00 0.00 H ATOM 1217 H LEU A 79 19.483 11.747 1.298 1.00 0.00 H ATOM 1218 N CYS A 80 16.564 10.226 -1.053 1.00 21.48 N ATOM 1219 CA CYS A 80 15.186 9.834 -0.788 1.00 19.45 C ATOM 1220 C CYS A 80 14.895 8.440 -1.313 1.00 23.65 C ATOM 1221 O CYS A 80 14.609 8.259 -2.497 1.00 20.09 O ATOM 1222 CB CYS A 80 14.232 10.853 -1.394 1.00 19.26 C ATOM 1223 SG CYS A 80 14.407 12.506 -0.658 1.00 29.63 S ATOM 1224 HA CYS A 80 15.038 9.810 0.292 1.00 0.00 H ATOM 1225 HB2 CYS A 80 13.210 10.509 -1.239 1.00 0.00 H ATOM 1226 HB3 CYS A 80 14.432 10.925 -2.463 1.00 0.00 H ATOM 1227 HG CYS A 80 13.513 13.371 -1.256 1.00 0.00 H ATOM 1228 H CYS A 80 16.813 10.602 -1.990 1.00 0.00 H ATOM 1229 N VAL A 81 14.952 7.464 -0.407 1.00 24.20 N ATOM 1230 CA VAL A 81 14.926 6.054 -0.772 1.00 22.15 C ATOM 1231 C VAL A 81 13.540 5.405 -0.662 1.00 23.57 C ATOM 1232 O VAL A 81 12.860 5.506 0.365 1.00 19.22 O ATOM 1233 CB VAL A 81 15.922 5.250 0.095 1.00 17.27 C ATOM 1234 CG1 VAL A 81 16.041 3.828 -0.421 1.00 16.92 C ATOM 1235 CG2 VAL A 81 17.293 5.932 0.107 1.00 12.36 C ATOM 1236 HA VAL A 81 15.213 6.024 -1.823 1.00 0.00 H ATOM 1237 HB VAL A 81 15.545 5.218 1.117 1.00 0.00 H ATOM 1238 HG11 VAL A 81 15.064 3.346 -0.382 1.00 0.00 H ATOM 1239 HG12 VAL A 81 16.398 3.845 -1.451 1.00 0.00 H ATOM 1240 HG13 VAL A 81 16.746 3.275 0.200 1.00 0.00 H ATOM 1241 HG21 VAL A 81 17.677 5.992 -0.912 1.00 0.00 H ATOM 1242 HG22 VAL A 81 17.194 6.936 0.519 1.00 0.00 H ATOM 1243 HG23 VAL A 81 17.981 5.352 0.722 1.00 0.00 H ATOM 1244 H VAL A 81 15.018 7.719 0.599 1.00 0.00 H ATOM 1245 N PHE A 82 13.125 4.741 -1.734 1.00 20.01 N ATOM 1246 CA PHE A 82 11.968 3.869 -1.665 1.00 19.28 C ATOM 1247 C PHE A 82 12.389 2.490 -2.155 1.00 19.90 C ATOM 1248 O PHE A 82 13.462 2.340 -2.740 1.00 21.90 O ATOM 1249 CB PHE A 82 10.784 4.440 -2.468 1.00 19.02 C ATOM 1250 CG PHE A 82 10.977 4.414 -3.969 1.00 14.87 C ATOM 1251 CD1 PHE A 82 10.528 3.335 -4.726 1.00 15.96 C ATOM 1252 CD2 PHE A 82 11.581 5.477 -4.625 1.00 13.95 C ATOM 1253 CE1 PHE A 82 10.696 3.311 -6.118 1.00 16.39 C ATOM 1254 CE2 PHE A 82 11.748 5.463 -6.016 1.00 16.94 C ATOM 1255 CZ PHE A 82 11.306 4.375 -6.762 1.00 12.87 C ATOM 1256 HA PHE A 82 11.615 3.792 -0.637 1.00 0.00 H ATOM 1257 HB2 PHE A 82 9.895 3.856 -2.228 1.00 0.00 H ATOM 1258 HB3 PHE A 82 10.631 5.475 -2.161 1.00 0.00 H ATOM 1259 HD2 PHE A 82 11.930 6.335 -4.050 1.00 0.00 H ATOM 1260 HE2 PHE A 82 12.225 6.306 -6.515 1.00 0.00 H ATOM 1261 HZ PHE A 82 11.439 4.360 -7.844 1.00 0.00 H ATOM 1262 HE1 PHE A 82 10.346 2.454 -6.694 1.00 0.00 H ATOM 1263 HD1 PHE A 82 10.039 2.497 -4.229 1.00 0.00 H ATOM 1264 H PHE A 82 13.635 4.847 -2.634 1.00 0.00 H ATOM 1265 N ALA A 83 11.571 1.477 -1.902 1.00 16.72 N ATOM 1266 CA ALA A 83 11.858 0.161 -2.451 1.00 16.33 C ATOM 1267 C ALA A 83 10.911 -0.074 -3.615 1.00 18.57 C ATOM 1268 O ALA A 83 9.727 0.248 -3.524 1.00 18.55 O ATOM 1269 CB ALA A 83 11.701 -0.918 -1.392 1.00 16.37 C ATOM 1270 HA ALA A 83 12.891 0.116 -2.795 1.00 0.00 H ATOM 1271 HB1 ALA A 83 12.391 -0.723 -0.571 1.00 0.00 H ATOM 1272 HB2 ALA A 83 10.678 -0.911 -1.017 1.00 0.00 H ATOM 1273 HB3 ALA A 83 11.922 -1.891 -1.831 1.00 0.00 H ATOM 1274 H ALA A 83 10.727 1.623 -1.313 1.00 0.00 H ATOM 1275 N ILE A 84 11.432 -0.614 -4.715 1.00 14.94 N ATOM 1276 CA ILE A 84 10.624 -0.796 -5.920 1.00 19.02 C ATOM 1277 C ILE A 84 9.502 -1.812 -5.746 1.00 20.99 C ATOM 1278 O ILE A 84 8.613 -1.909 -6.594 1.00 22.83 O ATOM 1279 CB ILE A 84 11.475 -1.211 -7.128 1.00 22.45 C ATOM 1280 CG1 ILE A 84 12.126 -2.573 -6.865 1.00 25.70 C ATOM 1281 CG2 ILE A 84 12.501 -0.136 -7.441 1.00 20.76 C ATOM 1282 CD1 ILE A 84 12.623 -3.271 -8.108 1.00 28.46 C ATOM 1283 HA ILE A 84 10.178 0.182 -6.102 1.00 0.00 H ATOM 1284 HB ILE A 84 10.838 -1.315 -8.006 1.00 0.00 H ATOM 1285 HG12 ILE A 84 12.972 -2.424 -6.195 1.00 0.00 H ATOM 1286 HG13 ILE A 84 11.390 -3.216 -6.382 1.00 0.00 H ATOM 1287 HD11 ILE A 84 11.787 -3.441 -8.787 1.00 0.00 H ATOM 1288 HD12 ILE A 84 13.370 -2.648 -8.599 1.00 0.00 H ATOM 1289 HD13 ILE A 84 13.069 -4.227 -7.833 1.00 0.00 H ATOM 1290 HG21 ILE A 84 11.988 0.798 -7.669 1.00 0.00 H ATOM 1291 HG22 ILE A 84 13.151 0.006 -6.578 1.00 0.00 H ATOM 1292 HG23 ILE A 84 13.097 -0.444 -8.300 1.00 0.00 H ATOM 1293 H ILE A 84 12.429 -0.911 -4.717 1.00 0.00 H ATOM 1294 N ASN A 85 9.544 -2.569 -4.653 1.00 23.06 N ATOM 1295 CA ASN A 85 8.482 -3.525 -4.336 1.00 21.17 C ATOM 1296 C ASN A 85 7.676 -3.056 -3.127 1.00 23.62 C ATOM 1297 O ASN A 85 7.082 -3.859 -2.408 1.00 29.12 O ATOM 1298 CB ASN A 85 9.075 -4.908 -4.061 1.00 20.69 C ATOM 1299 CG ASN A 85 9.850 -4.961 -2.755 1.00 26.35 C ATOM 1300 OD1 ASN A 85 10.396 -3.956 -2.300 1.00 27.57 O ATOM 1301 ND2 ASN A 85 9.894 -6.138 -2.140 1.00 31.38 N ATOM 1302 HA ASN A 85 7.815 -3.589 -5.196 1.00 0.00 H ATOM 1303 HB2 ASN A 85 8.263 -5.634 -4.015 1.00 0.00 H ATOM 1304 HB3 ASN A 85 9.748 -5.169 -4.878 1.00 0.00 H ATOM 1305 HD22 ASN A 85 9.418 -6.962 -2.560 1.00 0.00 H ATOM 1306 HD21 ASN A 85 10.404 -6.235 -1.239 1.00 0.00 H ATOM 1307 H ASN A 85 10.353 -2.479 -4.006 1.00 0.00 H ATOM 1308 N ASN A 86 7.679 -1.749 -2.901 1.00 19.66 N ATOM 1309 CA ASN A 86 6.988 -1.155 -1.770 1.00 18.21 C ATOM 1310 C ASN A 86 6.336 0.150 -2.207 1.00 18.22 C ATOM 1311 O ASN A 86 6.946 1.220 -2.129 1.00 14.60 O ATOM 1312 CB ASN A 86 7.961 -0.906 -0.609 1.00 17.79 C ATOM 1313 CG ASN A 86 7.253 -0.457 0.661 1.00 20.21 C ATOM 1314 OD1 ASN A 86 6.155 0.087 0.610 1.00 21.20 O ATOM 1315 ND2 ASN A 86 7.890 -0.668 1.806 1.00 21.35 N ATOM 1316 HA ASN A 86 6.219 -1.844 -1.421 1.00 0.00 H ATOM 1317 HB2 ASN A 86 8.500 -1.830 -0.401 1.00 0.00 H ATOM 1318 HB3 ASN A 86 8.669 -0.133 -0.906 1.00 0.00 H ATOM 1319 HD22 ASN A 86 8.820 -1.133 1.806 1.00 0.00 H ATOM 1320 HD21 ASN A 86 7.459 -0.368 2.704 1.00 0.00 H ATOM 1321 H ASN A 86 8.194 -1.128 -3.557 1.00 0.00 H ATOM 1322 N THR A 87 5.091 0.047 -2.666 1.00 17.83 N ATOM 1323 CA THR A 87 4.328 1.190 -3.160 1.00 18.14 C ATOM 1324 C THR A 87 4.181 2.285 -2.114 1.00 21.83 C ATOM 1325 O THR A 87 4.359 3.471 -2.415 1.00 22.69 O ATOM 1326 CB THR A 87 2.931 0.748 -3.636 1.00 18.89 C ATOM 1327 OG1 THR A 87 3.077 -0.156 -4.736 1.00 17.25 O ATOM 1328 CG2 THR A 87 2.084 1.946 -4.074 1.00 21.22 C ATOM 1329 HA THR A 87 4.891 1.599 -3.999 1.00 0.00 H ATOM 1330 HB THR A 87 2.423 0.260 -2.804 1.00 0.00 H ATOM 1331 HG1 THR A 87 3.597 -0.947 -4.445 1.00 0.00 H ATOM 1332 HG23 THR A 87 1.972 2.635 -3.237 1.00 0.00 H ATOM 1333 HG21 THR A 87 2.577 2.455 -4.902 1.00 0.00 H ATOM 1334 HG22 THR A 87 1.102 1.598 -4.393 1.00 0.00 H ATOM 1335 H THR A 87 4.641 -0.891 -2.673 1.00 0.00 H ATOM 1336 N LYS A 88 3.855 1.890 -0.885 1.00 21.33 N ATOM 1337 CA LYS A 88 3.698 2.854 0.198 1.00 22.88 C ATOM 1338 C LYS A 88 4.975 3.679 0.394 1.00 20.86 C ATOM 1339 O LYS A 88 4.905 4.898 0.567 1.00 22.20 O ATOM 1340 CB LYS A 88 3.288 2.148 1.494 1.00 27.52 C ATOM 1341 CG LYS A 88 3.358 3.002 2.762 1.00 28.29 C ATOM 1342 CD LYS A 88 2.159 3.915 2.908 1.00 36.43 C ATOM 1343 CE LYS A 88 1.976 4.339 4.365 1.00 38.59 C ATOM 1344 NZ LYS A 88 3.252 4.824 4.968 1.00 40.86 N ATOM 1345 HA LYS A 88 2.901 3.545 -0.076 1.00 0.00 H ATOM 1346 HB2 LYS A 88 2.261 1.803 1.378 1.00 0.00 H ATOM 1347 HB3 LYS A 88 3.945 1.289 1.631 1.00 0.00 H ATOM 1348 HG2 LYS A 88 3.403 2.341 3.628 1.00 0.00 H ATOM 1349 HG3 LYS A 88 4.261 3.612 2.725 1.00 0.00 H ATOM 1350 HD2 LYS A 88 2.308 4.802 2.293 1.00 0.00 H ATOM 1351 HD3 LYS A 88 1.265 3.388 2.573 1.00 0.00 H ATOM 1352 HE2 LYS A 88 1.617 3.484 4.939 1.00 0.00 H ATOM 1353 HE3 LYS A 88 1.238 5.140 4.409 1.00 0.00 H ATOM 1354 HZ1 LYS A 88 3.960 4.063 4.936 1.00 0.00 H ATOM 1355 HZ2 LYS A 88 3.598 5.644 4.431 1.00 0.00 H ATOM 1356 HZ3 LYS A 88 3.084 5.101 5.956 1.00 0.00 H ATOM 1357 H LYS A 88 3.710 0.878 -0.694 1.00 0.00 H ATOM 1358 N SER A 89 6.136 3.026 0.351 1.00 17.98 N ATOM 1359 CA SER A 89 7.403 3.737 0.519 1.00 17.17 C ATOM 1360 C SER A 89 7.622 4.761 -0.594 1.00 17.96 C ATOM 1361 O SER A 89 8.232 5.804 -0.371 1.00 20.02 O ATOM 1362 CB SER A 89 8.584 2.765 0.589 1.00 15.11 C ATOM 1363 OG SER A 89 8.875 2.214 -0.681 1.00 15.95 O ATOM 1364 HA SER A 89 7.346 4.273 1.467 1.00 0.00 H ATOM 1365 HB2 SER A 89 8.339 1.957 1.279 1.00 0.00 H ATOM 1366 HB3 SER A 89 9.462 3.299 0.954 1.00 0.00 H ATOM 1367 HG SER A 89 8.083 1.723 -1.016 1.00 0.00 H ATOM 1368 H SER A 89 6.141 1.998 0.196 1.00 0.00 H ATOM 1369 N PHE A 90 7.118 4.460 -1.789 1.00 18.60 N ATOM 1370 CA PHE A 90 7.215 5.380 -2.923 1.00 15.99 C ATOM 1371 C PHE A 90 6.304 6.573 -2.686 1.00 15.43 C ATOM 1372 O PHE A 90 6.687 7.719 -2.906 1.00 18.18 O ATOM 1373 CB PHE A 90 6.830 4.659 -4.225 1.00 19.59 C ATOM 1374 CG PHE A 90 6.745 5.567 -5.436 1.00 20.98 C ATOM 1375 CD1 PHE A 90 7.891 6.099 -6.004 1.00 19.39 C ATOM 1376 CD2 PHE A 90 5.518 5.874 -6.010 1.00 19.45 C ATOM 1377 CE1 PHE A 90 7.820 6.920 -7.115 1.00 19.38 C ATOM 1378 CE2 PHE A 90 5.437 6.705 -7.127 1.00 18.68 C ATOM 1379 CZ PHE A 90 6.588 7.226 -7.678 1.00 21.34 C ATOM 1380 HA PHE A 90 8.243 5.731 -3.017 1.00 0.00 H ATOM 1381 HB2 PHE A 90 7.577 3.891 -4.425 1.00 0.00 H ATOM 1382 HB3 PHE A 90 5.857 4.189 -4.081 1.00 0.00 H ATOM 1383 HD2 PHE A 90 4.606 5.460 -5.581 1.00 0.00 H ATOM 1384 HE2 PHE A 90 4.466 6.942 -7.563 1.00 0.00 H ATOM 1385 HZ PHE A 90 6.531 7.875 -8.552 1.00 0.00 H ATOM 1386 HE1 PHE A 90 8.733 7.328 -7.549 1.00 0.00 H ATOM 1387 HD1 PHE A 90 8.863 5.867 -5.569 1.00 0.00 H ATOM 1388 H PHE A 90 6.642 3.545 -1.920 1.00 0.00 H ATOM 1389 N GLU A 91 5.089 6.297 -2.235 1.00 15.94 N ATOM 1390 CA GLU A 91 4.137 7.354 -1.914 1.00 20.75 C ATOM 1391 C GLU A 91 4.640 8.253 -0.778 1.00 22.20 C ATOM 1392 O GLU A 91 4.311 9.438 -0.723 1.00 21.86 O ATOM 1393 CB GLU A 91 2.774 6.740 -1.572 1.00 21.08 C ATOM 1394 CG GLU A 91 2.174 5.950 -2.730 1.00 20.81 C ATOM 1395 CD GLU A 91 0.968 5.125 -2.336 1.00 24.32 C ATOM 1396 OE1 GLU A 91 0.795 4.830 -1.132 1.00 26.42 O ATOM 1397 OE2 GLU A 91 0.191 4.770 -3.243 1.00 22.17 O ATOM 1398 HA GLU A 91 4.028 7.990 -2.792 1.00 0.00 H ATOM 1399 HB2 GLU A 91 2.897 6.071 -0.720 1.00 0.00 H ATOM 1400 HB3 GLU A 91 2.087 7.543 -1.305 1.00 0.00 H ATOM 1401 HG2 GLU A 91 1.873 6.652 -3.508 1.00 0.00 H ATOM 1402 HG3 GLU A 91 2.938 5.279 -3.123 1.00 0.00 H ATOM 1403 H GLU A 91 4.808 5.304 -2.107 1.00 0.00 H ATOM 1404 N ASP A 92 5.444 7.689 0.121 1.00 21.38 N ATOM 1405 CA ASP A 92 6.000 8.448 1.244 1.00 20.71 C ATOM 1406 C ASP A 92 6.971 9.539 0.789 1.00 23.88 C ATOM 1407 O ASP A 92 7.188 10.524 1.491 1.00 26.33 O ATOM 1408 CB ASP A 92 6.730 7.516 2.213 1.00 22.55 C ATOM 1409 CG ASP A 92 5.789 6.789 3.154 1.00 28.97 C ATOM 1410 OD1 ASP A 92 4.593 7.139 3.194 1.00 32.08 O ATOM 1411 OD2 ASP A 92 6.252 5.876 3.867 1.00 33.30 O ATOM 1412 HA ASP A 92 5.155 8.926 1.741 1.00 0.00 H ATOM 1413 HB2 ASP A 92 7.284 6.777 1.634 1.00 0.00 H ATOM 1414 HB3 ASP A 92 7.427 8.108 2.806 1.00 0.00 H ATOM 1415 H ASP A 92 5.684 6.682 0.023 1.00 0.00 H ATOM 1416 N ILE A 93 7.572 9.349 -0.379 1.00 22.33 N ATOM 1417 CA ILE A 93 8.560 10.292 -0.883 1.00 22.37 C ATOM 1418 C ILE A 93 7.994 11.713 -0.931 1.00 26.14 C ATOM 1419 O ILE A 93 8.637 12.666 -0.504 1.00 27.78 O ATOM 1420 CB ILE A 93 9.065 9.880 -2.280 1.00 24.76 C ATOM 1421 CG1 ILE A 93 9.734 8.501 -2.220 1.00 20.66 C ATOM 1422 CG2 ILE A 93 10.045 10.921 -2.818 1.00 24.90 C ATOM 1423 CD1 ILE A 93 10.941 8.456 -1.279 1.00 18.05 C ATOM 1424 HA ILE A 93 9.403 10.276 -0.192 1.00 0.00 H ATOM 1425 HB ILE A 93 8.211 9.823 -2.955 1.00 0.00 H ATOM 1426 HG12 ILE A 93 8.999 7.774 -1.876 1.00 0.00 H ATOM 1427 HG13 ILE A 93 10.066 8.233 -3.223 1.00 0.00 H ATOM 1428 HD11 ILE A 93 11.691 9.172 -1.617 1.00 0.00 H ATOM 1429 HD12 ILE A 93 10.622 8.712 -0.269 1.00 0.00 H ATOM 1430 HD13 ILE A 93 11.367 7.453 -1.284 1.00 0.00 H ATOM 1431 HG21 ILE A 93 9.544 11.886 -2.891 1.00 0.00 H ATOM 1432 HG22 ILE A 93 10.895 11.001 -2.141 1.00 0.00 H ATOM 1433 HG23 ILE A 93 10.392 10.615 -3.805 1.00 0.00 H ATOM 1434 H ILE A 93 7.332 8.510 -0.945 1.00 0.00 H ATOM 1435 N HIS A 94 6.780 11.852 -1.443 1.00 29.69 N ATOM 1436 CA HIS A 94 6.147 13.162 -1.498 1.00 31.35 C ATOM 1437 C HIS A 94 6.124 13.841 -0.129 1.00 31.02 C ATOM 1438 O HIS A 94 6.423 15.032 -0.005 1.00 29.93 O ATOM 1439 CB HIS A 94 4.724 13.062 -2.044 1.00 32.96 C ATOM 1440 CG HIS A 94 4.034 14.386 -2.130 1.00 42.59 C ATOM 1441 ND1 HIS A 94 4.436 15.373 -3.007 1.00 46.99 N ATOM 1442 CD2 HIS A 94 3.004 14.903 -1.424 1.00 45.60 C ATOM 1443 CE1 HIS A 94 3.671 16.438 -2.844 1.00 46.96 C ATOM 1444 NE2 HIS A 94 2.793 16.179 -1.891 1.00 49.50 N ATOM 1445 HA HIS A 94 6.747 13.772 -2.173 1.00 0.00 H ATOM 1446 HB2 HIS A 94 4.765 12.626 -3.042 1.00 0.00 H ATOM 1447 HB3 HIS A 94 4.146 12.411 -1.388 1.00 0.00 H ATOM 1448 HD2 HIS A 94 2.445 14.402 -0.633 1.00 0.00 H ATOM 1449 HE1 HIS A 94 3.751 17.372 -3.401 1.00 0.00 H ATOM 1450 H HIS A 94 6.275 11.019 -1.808 1.00 0.00 H ATOM 1451 N HIS A 95 5.774 13.076 0.898 1.00 29.48 N ATOM 1452 CA HIS A 95 5.673 13.609 2.250 1.00 31.42 C ATOM 1453 C HIS A 95 7.031 14.004 2.829 1.00 32.12 C ATOM 1454 O HIS A 95 7.129 14.989 3.556 1.00 31.59 O ATOM 1455 CB HIS A 95 4.961 12.611 3.163 1.00 36.69 C ATOM 1456 CG HIS A 95 3.640 12.150 2.628 1.00 44.53 C ATOM 1457 ND1 HIS A 95 2.499 12.922 2.696 1.00 47.95 N ATOM 1458 CD2 HIS A 95 3.284 11.006 1.998 1.00 42.97 C ATOM 1459 CE1 HIS A 95 1.495 12.269 2.139 1.00 47.50 C ATOM 1460 NE2 HIS A 95 1.944 11.103 1.707 1.00 44.36 N ATOM 1461 HA HIS A 95 5.082 14.523 2.192 1.00 0.00 H ATOM 1462 HB2 HIS A 95 5.604 11.741 3.292 1.00 0.00 H ATOM 1463 HB3 HIS A 95 4.795 13.085 4.130 1.00 0.00 H ATOM 1464 HD2 HIS A 95 3.938 10.165 1.765 1.00 0.00 H ATOM 1465 HE1 HIS A 95 0.470 12.630 2.051 1.00 0.00 H ATOM 1466 H HIS A 95 5.567 12.070 0.733 1.00 0.00 H ATOM 1467 N TYR A 96 8.075 13.242 2.518 1.00 32.86 N ATOM 1468 CA TYR A 96 9.416 13.618 2.955 1.00 29.52 C ATOM 1469 C TYR A 96 9.846 14.922 2.296 1.00 25.87 C ATOM 1470 O TYR A 96 10.394 15.803 2.958 1.00 24.09 O ATOM 1471 CB TYR A 96 10.444 12.528 2.641 1.00 30.14 C ATOM 1472 CG TYR A 96 10.376 11.333 3.558 1.00 29.36 C ATOM 1473 CD1 TYR A 96 10.742 11.433 4.898 1.00 29.69 C ATOM 1474 CD2 TYR A 96 9.964 10.100 3.081 1.00 24.88 C ATOM 1475 CE1 TYR A 96 10.678 10.334 5.737 1.00 25.85 C ATOM 1476 CE2 TYR A 96 9.905 9.004 3.903 1.00 26.28 C ATOM 1477 CZ TYR A 96 10.255 9.126 5.230 1.00 25.35 C ATOM 1478 OH TYR A 96 10.179 8.022 6.039 1.00 24.62 O ATOM 1479 HA TYR A 96 9.375 13.749 4.036 1.00 0.00 H ATOM 1480 HB3 TYR A 96 11.440 12.964 2.720 1.00 0.00 H ATOM 1481 HB2 TYR A 96 10.279 12.185 1.620 1.00 0.00 H ATOM 1482 HD2 TYR A 96 9.681 9.999 2.033 1.00 0.00 H ATOM 1483 HE2 TYR A 96 9.583 8.040 3.508 1.00 0.00 H ATOM 1484 HE1 TYR A 96 10.959 10.424 6.786 1.00 0.00 H ATOM 1485 HD1 TYR A 96 11.084 12.390 5.292 1.00 0.00 H ATOM 1486 HH TYR A 96 9.246 7.690 6.056 1.00 0.00 H ATOM 1487 H TYR A 96 7.936 12.375 1.961 1.00 0.00 H ATOM 1488 N ARG A 97 9.607 15.042 0.991 1.00 26.35 N ATOM 1489 CA ARG A 97 10.030 16.244 0.276 1.00 33.58 C ATOM 1490 C ARG A 97 9.310 17.488 0.794 1.00 32.25 C ATOM 1491 O ARG A 97 9.918 18.553 0.924 1.00 31.44 O ATOM 1492 CB ARG A 97 9.861 16.109 -1.241 1.00 36.37 C ATOM 1493 CG ARG A 97 10.237 17.389 -1.977 1.00 41.66 C ATOM 1494 CD ARG A 97 10.552 17.165 -3.449 1.00 45.95 C ATOM 1495 NE ARG A 97 10.832 18.428 -4.136 1.00 49.48 N ATOM 1496 CZ ARG A 97 12.047 18.942 -4.318 1.00 50.02 C ATOM 1497 NH1 ARG A 97 13.123 18.305 -3.877 1.00 49.30 N ATOM 1498 NH2 ARG A 97 12.188 20.096 -4.954 1.00 53.71 N ATOM 1499 HA ARG A 97 11.095 16.362 0.474 1.00 0.00 H ATOM 1500 HB2 ARG A 97 10.499 15.299 -1.595 1.00 0.00 H ATOM 1501 HB3 ARG A 97 8.820 15.871 -1.459 1.00 0.00 H ATOM 1502 HG2 ARG A 97 9.404 18.088 -1.903 1.00 0.00 H ATOM 1503 HG3 ARG A 97 11.115 17.820 -1.496 1.00 0.00 H ATOM 1504 HD2 ARG A 97 9.698 16.684 -3.925 1.00 0.00 H ATOM 1505 HD3 ARG A 97 11.424 16.516 -3.530 1.00 0.00 H ATOM 1506 HE ARG A 97 10.022 18.963 -4.509 1.00 0.00 H ATOM 1507 HH12 ARG A 97 14.067 18.715 -4.024 1.00 0.00 H ATOM 1508 HH11 ARG A 97 13.023 17.395 -3.384 1.00 0.00 H ATOM 1509 HH22 ARG A 97 13.136 20.499 -5.097 1.00 0.00 H ATOM 1510 HH21 ARG A 97 11.350 20.599 -5.310 1.00 0.00 H ATOM 1511 H ARG A 97 9.119 14.279 0.480 1.00 0.00 H ATOM 1512 N GLU A 98 8.022 17.335 1.101 1.00 31.83 N ATOM 1513 CA GLU A 98 7.201 18.423 1.619 1.00 35.94 C ATOM 1514 C GLU A 98 7.661 18.886 2.991 1.00 32.07 C ATOM 1515 O GLU A 98 7.811 20.081 3.219 1.00 27.09 O ATOM 1516 CB GLU A 98 5.729 18.010 1.695 1.00 44.15 C ATOM 1517 CG GLU A 98 5.050 17.934 0.350 1.00 53.33 C ATOM 1518 CD GLU A 98 5.061 19.265 -0.369 1.00 63.74 C ATOM 1519 OE1 GLU A 98 5.239 19.275 -1.606 1.00 67.57 O ATOM 1520 OE2 GLU A 98 4.891 20.302 0.307 1.00 66.71 O ATOM 1521 HA GLU A 98 7.313 19.253 0.922 1.00 0.00 H ATOM 1522 HB2 GLU A 98 5.670 17.029 2.166 1.00 0.00 H ATOM 1523 HB3 GLU A 98 5.198 18.738 2.308 1.00 0.00 H ATOM 1524 HG2 GLU A 98 5.568 17.198 -0.265 1.00 0.00 H ATOM 1525 HG3 GLU A 98 4.016 17.621 0.495 1.00 0.00 H ATOM 1526 H GLU A 98 7.585 16.401 0.966 1.00 0.00 H ATOM 1527 N GLN A 99 7.865 17.940 3.904 1.00 31.61 N ATOM 1528 CA GLN A 99 8.307 18.272 5.252 1.00 33.31 C ATOM 1529 C GLN A 99 9.687 18.918 5.236 1.00 34.00 C ATOM 1530 O GLN A 99 9.966 19.812 6.035 1.00 35.23 O ATOM 1531 CB GLN A 99 8.303 17.036 6.158 1.00 35.57 C ATOM 1532 CG GLN A 99 7.104 16.951 7.099 1.00 46.20 C ATOM 1533 CD GLN A 99 7.006 18.138 8.061 1.00 57.69 C ATOM 1534 OE1 GLN A 99 6.101 18.969 7.952 1.00 61.88 O ATOM 1535 NE2 GLN A 99 7.931 18.210 9.016 1.00 60.50 N ATOM 1536 HA GLN A 99 7.598 18.993 5.659 1.00 0.00 H ATOM 1537 HB2 GLN A 99 8.304 16.148 5.525 1.00 0.00 H ATOM 1538 HB3 GLN A 99 9.211 17.052 6.761 1.00 0.00 H ATOM 1539 HG2 GLN A 99 6.195 16.915 6.499 1.00 0.00 H ATOM 1540 HG3 GLN A 99 7.188 16.036 7.685 1.00 0.00 H ATOM 1541 HE22 GLN A 99 8.677 17.488 9.072 1.00 0.00 H ATOM 1542 HE21 GLN A 99 7.907 18.988 9.706 1.00 0.00 H ATOM 1543 H GLN A 99 7.706 16.944 3.650 1.00 0.00 H ATOM 1544 N ILE A 100 10.546 18.466 4.324 1.00 32.58 N ATOM 1545 CA ILE A 100 11.886 19.031 4.203 1.00 33.05 C ATOM 1546 C ILE A 100 11.795 20.481 3.735 1.00 34.49 C ATOM 1547 O ILE A 100 12.431 21.368 4.308 1.00 34.63 O ATOM 1548 CB ILE A 100 12.775 18.206 3.245 1.00 29.71 C ATOM 1549 CG1 ILE A 100 13.149 16.869 3.890 1.00 28.72 C ATOM 1550 CG2 ILE A 100 14.028 18.965 2.897 1.00 25.89 C ATOM 1551 CD1 ILE A 100 13.688 15.830 2.911 1.00 23.72 C ATOM 1552 HA ILE A 100 12.355 18.997 5.186 1.00 0.00 H ATOM 1553 HB ILE A 100 12.210 18.021 2.332 1.00 0.00 H ATOM 1554 HG12 ILE A 100 13.912 17.055 4.645 1.00 0.00 H ATOM 1555 HG13 ILE A 100 12.259 16.459 4.368 1.00 0.00 H ATOM 1556 HD11 ILE A 100 12.933 15.620 2.154 1.00 0.00 H ATOM 1557 HD12 ILE A 100 14.587 16.217 2.431 1.00 0.00 H ATOM 1558 HD13 ILE A 100 13.928 14.914 3.451 1.00 0.00 H ATOM 1559 HG21 ILE A 100 13.760 19.903 2.410 1.00 0.00 H ATOM 1560 HG22 ILE A 100 14.589 19.174 3.808 1.00 0.00 H ATOM 1561 HG23 ILE A 100 14.639 18.366 2.222 1.00 0.00 H ATOM 1562 H ILE A 100 10.257 17.697 3.687 1.00 0.00 H ATOM 1563 N LYS A 101 10.979 20.718 2.710 1.00 33.52 N ATOM 1564 CA LYS A 101 10.752 22.065 2.192 1.00 37.70 C ATOM 1565 C LYS A 101 10.108 22.996 3.224 1.00 39.90 C ATOM 1566 O LYS A 101 10.387 24.195 3.251 1.00 39.71 O ATOM 1567 CB LYS A 101 9.905 22.010 0.918 1.00 41.25 C ATOM 1568 CG LYS A 101 10.699 21.673 -0.335 1.00 43.25 C ATOM 1569 CD LYS A 101 9.783 21.270 -1.477 1.00 45.56 C ATOM 1570 CE LYS A 101 8.693 22.303 -1.696 1.00 48.70 C ATOM 1571 NZ LYS A 101 7.665 21.813 -2.653 1.00 50.62 N ATOM 1572 HA LYS A 101 11.731 22.484 1.958 1.00 0.00 H ATOM 1573 HB2 LYS A 101 9.134 21.251 1.051 1.00 0.00 H ATOM 1574 HB3 LYS A 101 9.435 22.983 0.776 1.00 0.00 H ATOM 1575 HG2 LYS A 101 11.277 22.547 -0.635 1.00 0.00 H ATOM 1576 HG3 LYS A 101 11.377 20.848 -0.115 1.00 0.00 H ATOM 1577 HD2 LYS A 101 10.372 21.175 -2.389 1.00 0.00 H ATOM 1578 HD3 LYS A 101 9.322 20.311 -1.242 1.00 0.00 H ATOM 1579 HE2 LYS A 101 9.142 23.214 -2.093 1.00 0.00 H ATOM 1580 HE3 LYS A 101 8.214 22.521 -0.742 1.00 0.00 H ATOM 1581 HZ1 LYS A 101 8.115 21.608 -3.568 1.00 0.00 H ATOM 1582 HZ2 LYS A 101 7.229 20.947 -2.278 1.00 0.00 H ATOM 1583 HZ3 LYS A 101 6.935 22.543 -2.780 1.00 0.00 H ATOM 1584 H LYS A 101 10.487 19.918 2.263 1.00 0.00 H ATOM 1585 N ARG A 102 9.239 22.444 4.064 1.00 42.65 N ATOM 1586 CA ARG A 102 8.632 23.211 5.147 1.00 45.87 C ATOM 1587 C ARG A 102 9.730 23.658 6.100 1.00 43.39 C ATOM 1588 O ARG A 102 9.937 24.847 6.328 1.00 45.00 O ATOM 1589 CB ARG A 102 7.636 22.342 5.917 1.00 49.16 C ATOM 1590 CG ARG A 102 6.207 22.830 5.890 1.00 57.92 C ATOM 1591 CD ARG A 102 5.376 22.080 4.855 1.00 64.30 C ATOM 1592 NE ARG A 102 4.872 22.971 3.814 1.00 70.72 N ATOM 1593 CZ ARG A 102 5.177 22.868 2.524 1.00 72.89 C ATOM 1594 NH1 ARG A 102 4.673 23.729 1.649 1.00 75.97 N ATOM 1595 NH2 ARG A 102 5.982 21.901 2.108 1.00 69.79 N ATOM 1596 HA ARG A 102 8.108 24.071 4.730 1.00 0.00 H ATOM 1597 HB2 ARG A 102 7.659 21.340 5.488 1.00 0.00 H ATOM 1598 HB3 ARG A 102 7.959 22.298 6.957 1.00 0.00 H ATOM 1599 HG2 ARG A 102 5.764 22.681 6.875 1.00 0.00 H ATOM 1600 HG3 ARG A 102 6.200 23.892 5.647 1.00 0.00 H ATOM 1601 HD2 ARG A 102 4.530 21.608 5.356 1.00 0.00 H ATOM 1602 HD3 ARG A 102 5.997 21.313 4.393 1.00 0.00 H ATOM 1603 HE ARG A 102 4.231 23.738 4.101 1.00 0.00 H ATOM 1604 HH12 ARG A 102 4.913 23.646 0.641 1.00 0.00 H ATOM 1605 HH11 ARG A 102 4.038 24.487 1.972 1.00 0.00 H ATOM 1606 HH22 ARG A 102 6.220 21.821 1.099 1.00 0.00 H ATOM 1607 HH21 ARG A 102 6.375 21.222 2.791 1.00 0.00 H ATOM 1608 H ARG A 102 8.986 21.442 3.947 1.00 0.00 H ATOM 1609 N VAL A 103 10.428 22.669 6.648 1.00 41.13 N ATOM 1610 CA VAL A 103 11.505 22.861 7.609 1.00 42.05 C ATOM 1611 C VAL A 103 12.608 23.798 7.103 1.00 48.81 C ATOM 1612 O VAL A 103 13.172 24.585 7.867 1.00 52.84 O ATOM 1613 CB VAL A 103 12.116 21.495 7.973 1.00 39.74 C ATOM 1614 CG1 VAL A 103 13.455 21.659 8.662 1.00 41.79 C ATOM 1615 CG2 VAL A 103 11.142 20.686 8.826 1.00 34.25 C ATOM 1616 HA VAL A 103 11.066 23.336 8.487 1.00 0.00 H ATOM 1617 HB VAL A 103 12.295 20.943 7.050 1.00 0.00 H ATOM 1618 HG11 VAL A 103 14.143 22.182 7.997 1.00 0.00 H ATOM 1619 HG12 VAL A 103 13.323 22.236 9.577 1.00 0.00 H ATOM 1620 HG13 VAL A 103 13.860 20.677 8.906 1.00 0.00 H ATOM 1621 HG21 VAL A 103 10.923 21.233 9.743 1.00 0.00 H ATOM 1622 HG22 VAL A 103 10.219 20.525 8.268 1.00 0.00 H ATOM 1623 HG23 VAL A 103 11.591 19.724 9.074 1.00 0.00 H ATOM 1624 H VAL A 103 10.190 21.695 6.373 1.00 0.00 H ATOM 1625 N LYS A 104 12.912 23.709 5.813 1.00 51.34 N ATOM 1626 CA LYS A 104 13.930 24.559 5.206 1.00 51.15 C ATOM 1627 C LYS A 104 13.359 25.908 4.786 1.00 52.59 C ATOM 1628 O LYS A 104 14.107 26.816 4.426 1.00 54.97 O ATOM 1629 CB LYS A 104 14.524 23.878 3.975 1.00 47.45 C ATOM 1630 CG LYS A 104 15.254 22.583 4.257 1.00 47.46 C ATOM 1631 CD LYS A 104 16.606 22.832 4.881 1.00 46.42 C ATOM 1632 CE LYS A 104 17.519 21.627 4.704 1.00 45.43 C ATOM 1633 NZ LYS A 104 18.892 21.898 5.214 1.00 46.71 N ATOM 1634 HA LYS A 104 14.702 24.721 5.958 1.00 0.00 H ATOM 1635 HB2 LYS A 104 13.712 23.665 3.280 1.00 0.00 H ATOM 1636 HB3 LYS A 104 15.227 24.570 3.510 1.00 0.00 H ATOM 1637 HG2 LYS A 104 14.655 21.980 4.939 1.00 0.00 H ATOM 1638 HG3 LYS A 104 15.390 22.042 3.320 1.00 0.00 H ATOM 1639 HD2 LYS A 104 17.064 23.699 4.406 1.00 0.00 H ATOM 1640 HD3 LYS A 104 16.477 23.028 5.945 1.00 0.00 H ATOM 1641 HE2 LYS A 104 17.578 21.380 3.644 1.00 0.00 H ATOM 1642 HE3 LYS A 104 17.099 20.782 5.250 1.00 0.00 H ATOM 1643 HZ1 LYS A 104 19.302 22.700 4.694 1.00 0.00 H ATOM 1644 HZ2 LYS A 104 18.845 22.128 6.227 1.00 0.00 H ATOM 1645 HZ3 LYS A 104 19.484 21.054 5.076 1.00 0.00 H ATOM 1646 H LYS A 104 12.412 23.016 5.221 1.00 0.00 H ATOM 1647 N ASP A 105 12.036 26.032 4.825 1.00 49.91 N ATOM 1648 CA ASP A 105 11.364 27.202 4.281 1.00 52.96 C ATOM 1649 C ASP A 105 11.975 27.552 2.933 1.00 53.79 C ATOM 1650 O ASP A 105 12.392 28.686 2.707 1.00 52.25 O ATOM 1651 CB ASP A 105 11.474 28.400 5.225 1.00 55.43 C ATOM 1652 CG ASP A 105 10.605 29.567 4.782 1.00 57.16 C ATOM 1653 OD1 ASP A 105 11.013 30.736 4.969 1.00 54.50 O ATOM 1654 OD2 ASP A 105 9.509 29.307 4.238 1.00 57.01 O ATOM 1655 HA ASP A 105 10.307 26.965 4.162 1.00 0.00 H ATOM 1656 HB2 ASP A 105 11.163 28.090 6.223 1.00 0.00 H ATOM 1657 HB3 ASP A 105 12.513 28.728 5.255 1.00 0.00 H ATOM 1658 H ASP A 105 11.468 25.274 5.255 1.00 0.00 H ATOM 1659 N SER A 106 12.032 26.568 2.044 1.00 54.62 N ATOM 1660 CA SER A 106 12.718 26.732 0.771 1.00 54.52 C ATOM 1661 C SER A 106 12.144 25.799 -0.289 1.00 58.72 C ATOM 1662 O SER A 106 11.662 24.707 0.018 1.00 58.51 O ATOM 1663 CB SER A 106 14.222 26.485 0.944 1.00 49.68 C ATOM 1664 OG SER A 106 14.888 26.431 -0.306 1.00 46.88 O ATOM 1665 HA SER A 106 12.565 27.757 0.433 1.00 0.00 H ATOM 1666 HB2 SER A 106 14.368 25.538 1.464 1.00 0.00 H ATOM 1667 HB3 SER A 106 14.648 27.294 1.538 1.00 0.00 H ATOM 1668 HG SER A 106 15.854 26.271 -0.157 1.00 0.00 H ATOM 1669 H SER A 106 11.576 25.659 2.262 1.00 0.00 H ATOM 1670 N GLU A 107 12.197 26.243 -1.538 1.00 62.58 N ATOM 1671 CA GLU A 107 11.698 25.458 -2.657 1.00 62.26 C ATOM 1672 C GLU A 107 12.824 24.611 -3.241 1.00 56.33 C ATOM 1673 O GLU A 107 12.581 23.565 -3.842 1.00 51.96 O ATOM 1674 CB GLU A 107 11.129 26.387 -3.733 1.00 68.48 C ATOM 1675 CG GLU A 107 10.256 25.686 -4.760 1.00 73.13 C ATOM 1676 CD GLU A 107 8.962 25.170 -4.160 1.00 75.91 C ATOM 1677 OE1 GLU A 107 8.473 25.785 -3.185 1.00 77.22 O ATOM 1678 OE2 GLU A 107 8.440 24.149 -4.658 1.00 76.14 O ATOM 1679 HA GLU A 107 10.906 24.798 -2.303 1.00 0.00 H ATOM 1680 HB2 GLU A 107 10.531 27.154 -3.242 1.00 0.00 H ATOM 1681 HB3 GLU A 107 11.962 26.857 -4.255 1.00 0.00 H ATOM 1682 HG2 GLU A 107 10.017 26.391 -5.557 1.00 0.00 H ATOM 1683 HG3 GLU A 107 10.810 24.844 -5.175 1.00 0.00 H ATOM 1684 H GLU A 107 12.608 27.180 -1.723 1.00 0.00 H ATOM 1685 N ASP A 108 14.056 25.079 -3.059 1.00 57.06 N ATOM 1686 CA ASP A 108 15.233 24.404 -3.595 1.00 55.84 C ATOM 1687 C ASP A 108 15.977 23.643 -2.518 1.00 51.24 C ATOM 1688 O ASP A 108 16.637 24.238 -1.667 1.00 54.47 O ATOM 1689 CB ASP A 108 16.190 25.410 -4.225 1.00 59.30 C ATOM 1690 CG ASP A 108 15.697 25.920 -5.551 1.00 66.44 C ATOM 1691 OD1 ASP A 108 15.118 25.115 -6.314 1.00 67.73 O ATOM 1692 OD2 ASP A 108 15.885 27.125 -5.825 1.00 70.72 O ATOM 1693 HA ASP A 108 14.879 23.701 -4.349 1.00 0.00 H ATOM 1694 HB2 ASP A 108 16.306 26.255 -3.546 1.00 0.00 H ATOM 1695 HB3 ASP A 108 17.157 24.928 -4.373 1.00 0.00 H ATOM 1696 H ASP A 108 14.184 25.956 -2.516 1.00 0.00 H ATOM 1697 N VAL A 109 15.870 22.323 -2.558 1.00 41.69 N ATOM 1698 CA VAL A 109 16.630 21.489 -1.642 1.00 36.03 C ATOM 1699 C VAL A 109 17.246 20.337 -2.424 1.00 29.01 C ATOM 1700 O VAL A 109 16.539 19.599 -3.106 1.00 26.95 O ATOM 1701 CB VAL A 109 15.752 20.963 -0.502 1.00 34.01 C ATOM 1702 CG1 VAL A 109 16.622 20.345 0.587 1.00 35.63 C ATOM 1703 CG2 VAL A 109 14.905 22.094 0.070 1.00 29.52 C ATOM 1704 HA VAL A 109 17.418 22.089 -1.186 1.00 0.00 H ATOM 1705 HB VAL A 109 15.086 20.193 -0.893 1.00 0.00 H ATOM 1706 HG11 VAL A 109 17.196 19.519 0.167 1.00 0.00 H ATOM 1707 HG12 VAL A 109 17.303 21.101 0.979 1.00 0.00 H ATOM 1708 HG13 VAL A 109 15.987 19.975 1.392 1.00 0.00 H ATOM 1709 HG21 VAL A 109 15.559 22.878 0.453 1.00 0.00 H ATOM 1710 HG22 VAL A 109 14.268 22.502 -0.715 1.00 0.00 H ATOM 1711 HG23 VAL A 109 14.285 21.708 0.879 1.00 0.00 H ATOM 1712 H VAL A 109 15.235 21.879 -3.252 1.00 0.00 H ATOM 1713 N PRO A 110 18.577 20.195 -2.357 1.00 26.64 N ATOM 1714 CA PRO A 110 19.197 19.148 -3.174 1.00 27.49 C ATOM 1715 C PRO A 110 18.755 17.760 -2.708 1.00 26.82 C ATOM 1716 O PRO A 110 18.836 17.448 -1.518 1.00 23.46 O ATOM 1717 CB PRO A 110 20.699 19.360 -2.947 1.00 22.24 C ATOM 1718 CG PRO A 110 20.817 20.744 -2.386 1.00 25.88 C ATOM 1719 CD PRO A 110 19.572 20.964 -1.595 1.00 26.24 C ATOM 1720 HA PRO A 110 18.919 19.205 -4.226 1.00 0.00 H ATOM 1721 HD3 PRO A 110 19.676 20.580 -0.580 1.00 0.00 H ATOM 1722 HD2 PRO A 110 19.310 22.021 -1.557 1.00 0.00 H ATOM 1723 HG3 PRO A 110 20.891 21.476 -3.190 1.00 0.00 H ATOM 1724 HG2 PRO A 110 21.695 20.821 -1.744 1.00 0.00 H ATOM 1725 HB2 PRO A 110 21.087 18.626 -2.241 1.00 0.00 H ATOM 1726 HB3 PRO A 110 21.244 19.280 -3.888 1.00 0.00 H ATOM 1727 N MET A 111 18.270 16.958 -3.651 1.00 29.29 N ATOM 1728 CA MET A 111 17.768 15.617 -3.375 1.00 28.02 C ATOM 1729 C MET A 111 18.047 14.717 -4.557 1.00 23.07 C ATOM 1730 O MET A 111 18.166 15.186 -5.687 1.00 23.07 O ATOM 1731 CB MET A 111 16.259 15.633 -3.154 1.00 28.18 C ATOM 1732 CG MET A 111 15.782 16.558 -2.063 1.00 35.80 C ATOM 1733 SD MET A 111 14.014 16.339 -1.729 1.00 46.08 S ATOM 1734 CE MET A 111 13.804 17.475 -0.361 1.00 44.80 C ATOM 1735 HA MET A 111 18.268 15.253 -2.477 1.00 0.00 H ATOM 1736 HB2 MET A 111 15.784 15.937 -4.087 1.00 0.00 H ATOM 1737 HB3 MET A 111 15.944 14.621 -2.901 1.00 0.00 H ATOM 1738 HG2 MET A 111 15.959 17.589 -2.370 1.00 0.00 H ATOM 1739 HG3 MET A 111 16.343 16.350 -1.152 1.00 0.00 H ATOM 1740 HE1 MET A 111 14.450 17.172 0.463 1.00 0.00 H ATOM 1741 HE2 MET A 111 14.071 18.482 -0.682 1.00 0.00 H ATOM 1742 HE3 MET A 111 12.764 17.460 -0.034 1.00 0.00 H ATOM 1743 H MET A 111 18.248 17.303 -4.632 1.00 0.00 H ATOM 1744 N VAL A 112 18.150 13.422 -4.284 1.00 20.42 N ATOM 1745 CA VAL A 112 18.193 12.401 -5.323 1.00 18.39 C ATOM 1746 C VAL A 112 17.149 11.357 -4.954 1.00 20.67 C ATOM 1747 O VAL A 112 17.088 10.923 -3.803 1.00 20.08 O ATOM 1748 CB VAL A 112 19.586 11.730 -5.425 1.00 19.14 C ATOM 1749 CG1 VAL A 112 19.545 10.533 -6.369 1.00 18.63 C ATOM 1750 CG2 VAL A 112 20.632 12.740 -5.888 1.00 18.27 C ATOM 1751 HA VAL A 112 17.993 12.857 -6.293 1.00 0.00 H ATOM 1752 HB VAL A 112 19.864 11.371 -4.434 1.00 0.00 H ATOM 1753 HG11 VAL A 112 18.829 9.801 -5.995 1.00 0.00 H ATOM 1754 HG12 VAL A 112 19.242 10.865 -7.362 1.00 0.00 H ATOM 1755 HG13 VAL A 112 20.535 10.080 -6.423 1.00 0.00 H ATOM 1756 HG21 VAL A 112 20.352 13.128 -6.867 1.00 0.00 H ATOM 1757 HG22 VAL A 112 20.685 13.561 -5.172 1.00 0.00 H ATOM 1758 HG23 VAL A 112 21.604 12.251 -5.954 1.00 0.00 H ATOM 1759 H VAL A 112 18.202 13.124 -3.289 1.00 0.00 H ATOM 1760 N LEU A 113 16.318 10.981 -5.922 1.00 21.55 N ATOM 1761 CA LEU A 113 15.323 9.932 -5.725 1.00 19.73 C ATOM 1762 C LEU A 113 15.957 8.587 -6.024 1.00 22.85 C ATOM 1763 O LEU A 113 16.538 8.379 -7.095 1.00 21.68 O ATOM 1764 CB LEU A 113 14.121 10.146 -6.641 1.00 17.90 C ATOM 1765 CG LEU A 113 12.978 9.131 -6.529 1.00 20.34 C ATOM 1766 CD1 LEU A 113 12.306 9.212 -5.165 1.00 18.44 C ATOM 1767 CD2 LEU A 113 11.958 9.364 -7.627 1.00 18.84 C ATOM 1768 HA LEU A 113 14.977 9.963 -4.692 1.00 0.00 H ATOM 1769 HB2 LEU A 113 13.710 11.131 -6.422 1.00 0.00 H ATOM 1770 HB3 LEU A 113 14.482 10.125 -7.669 1.00 0.00 H ATOM 1771 HG LEU A 113 13.401 8.133 -6.642 1.00 0.00 H ATOM 1772 HD21 LEU A 113 11.551 10.371 -7.535 1.00 0.00 H ATOM 1773 HD22 LEU A 113 12.440 9.253 -8.598 1.00 0.00 H ATOM 1774 HD23 LEU A 113 11.153 8.635 -7.534 1.00 0.00 H ATOM 1775 HD11 LEU A 113 13.039 9.000 -4.387 1.00 0.00 H ATOM 1776 HD12 LEU A 113 11.900 10.213 -5.020 1.00 0.00 H ATOM 1777 HD13 LEU A 113 11.499 8.481 -5.115 1.00 0.00 H ATOM 1778 H LEU A 113 16.379 11.449 -6.849 1.00 0.00 H ATOM 1779 N VAL A 114 15.846 7.673 -5.071 1.00 22.60 N ATOM 1780 CA VAL A 114 16.517 6.389 -5.179 1.00 19.08 C ATOM 1781 C VAL A 114 15.513 5.257 -5.057 1.00 19.29 C ATOM 1782 O VAL A 114 14.824 5.146 -4.043 1.00 17.10 O ATOM 1783 CB VAL A 114 17.579 6.244 -4.072 1.00 16.28 C ATOM 1784 CG1 VAL A 114 18.218 4.855 -4.095 1.00 14.82 C ATOM 1785 CG2 VAL A 114 18.634 7.321 -4.225 1.00 20.00 C ATOM 1786 HA VAL A 114 17.002 6.340 -6.154 1.00 0.00 H ATOM 1787 HB VAL A 114 17.087 6.364 -3.107 1.00 0.00 H ATOM 1788 HG11 VAL A 114 17.448 4.100 -3.939 1.00 0.00 H ATOM 1789 HG12 VAL A 114 18.698 4.693 -5.060 1.00 0.00 H ATOM 1790 HG13 VAL A 114 18.962 4.786 -3.302 1.00 0.00 H ATOM 1791 HG21 VAL A 114 19.113 7.223 -5.199 1.00 0.00 H ATOM 1792 HG22 VAL A 114 18.164 8.302 -4.147 1.00 0.00 H ATOM 1793 HG23 VAL A 114 19.381 7.211 -3.438 1.00 0.00 H ATOM 1794 H VAL A 114 15.268 7.878 -4.231 1.00 0.00 H ATOM 1795 N GLY A 115 15.436 4.420 -6.090 1.00 16.73 N ATOM 1796 CA GLY A 115 14.572 3.250 -6.071 1.00 14.09 C ATOM 1797 C GLY A 115 15.417 2.014 -5.827 1.00 17.27 C ATOM 1798 O GLY A 115 16.101 1.512 -6.730 1.00 18.38 O ATOM 1799 HA3 GLY A 115 14.059 3.159 -7.028 1.00 0.00 H ATOM 1800 HA2 GLY A 115 13.836 3.352 -5.274 1.00 0.00 H ATOM 1801 H GLY A 115 16.011 4.609 -6.936 1.00 0.00 H ATOM 1802 N ASN A 116 15.378 1.524 -4.596 1.00 14.83 N ATOM 1803 CA ASN A 116 16.283 0.465 -4.178 1.00 18.64 C ATOM 1804 C ASN A 116 15.686 -0.935 -4.327 1.00 21.05 C ATOM 1805 O ASN A 116 14.490 -1.089 -4.550 1.00 21.71 O ATOM 1806 CB ASN A 116 16.756 0.702 -2.739 1.00 14.91 C ATOM 1807 CG ASN A 116 17.958 -0.147 -2.375 1.00 19.34 C ATOM 1808 OD1 ASN A 116 18.887 -0.278 -3.163 1.00 21.77 O ATOM 1809 ND2 ASN A 116 17.939 -0.735 -1.178 1.00 18.89 N ATOM 1810 HA ASN A 116 17.139 0.505 -4.851 1.00 0.00 H ATOM 1811 HB2 ASN A 116 17.023 1.753 -2.627 1.00 0.00 H ATOM 1812 HB3 ASN A 116 15.939 0.462 -2.058 1.00 0.00 H ATOM 1813 HD22 ASN A 116 17.128 -0.594 -0.542 1.00 0.00 H ATOM 1814 HD21 ASN A 116 18.735 -1.334 -0.880 1.00 0.00 H ATOM 1815 H ASN A 116 14.688 1.904 -3.917 1.00 0.00 H ATOM 1816 N LYS A 117 16.543 -1.946 -4.202 1.00 20.14 N ATOM 1817 CA LYS A 117 16.157 -3.337 -4.387 1.00 19.66 C ATOM 1818 C LYS A 117 15.775 -3.631 -5.835 1.00 23.38 C ATOM 1819 O LYS A 117 14.853 -4.412 -6.088 1.00 29.18 O ATOM 1820 CB LYS A 117 14.999 -3.719 -3.457 1.00 18.04 C ATOM 1821 CG LYS A 117 15.181 -3.311 -2.001 1.00 19.45 C ATOM 1822 CD LYS A 117 14.279 -4.152 -1.096 1.00 19.45 C ATOM 1823 CE LYS A 117 14.419 -3.762 0.369 1.00 23.27 C ATOM 1824 NZ LYS A 117 13.562 -4.588 1.274 1.00 24.84 N ATOM 1825 HA LYS A 117 17.028 -3.942 -4.134 1.00 0.00 H ATOM 1826 HB2 LYS A 117 14.093 -3.242 -3.831 1.00 0.00 H ATOM 1827 HB3 LYS A 117 14.880 -4.802 -3.493 1.00 0.00 H ATOM 1828 HG2 LYS A 117 16.221 -3.462 -1.712 1.00 0.00 H ATOM 1829 HG3 LYS A 117 14.923 -2.258 -1.888 1.00 0.00 H ATOM 1830 HD2 LYS A 117 13.242 -4.009 -1.401 1.00 0.00 H ATOM 1831 HD3 LYS A 117 14.548 -5.202 -1.208 1.00 0.00 H ATOM 1832 HE2 LYS A 117 14.135 -2.715 0.480 1.00 0.00 H ATOM 1833 HE3 LYS A 117 15.460 -3.888 0.665 1.00 0.00 H ATOM 1834 HZ1 LYS A 117 12.564 -4.470 1.007 1.00 0.00 H ATOM 1835 HZ2 LYS A 117 13.830 -5.589 1.185 1.00 0.00 H ATOM 1836 HZ3 LYS A 117 13.699 -4.278 2.257 1.00 0.00 H ATOM 1837 H LYS A 117 17.532 -1.732 -3.962 1.00 0.00 H ATOM 1838 N CYS A 118 16.478 -3.028 -6.792 1.00 21.15 N ATOM 1839 CA CYS A 118 16.150 -3.266 -8.205 1.00 25.81 C ATOM 1840 C CYS A 118 16.538 -4.675 -8.658 1.00 27.10 C ATOM 1841 O CYS A 118 16.283 -5.071 -9.796 1.00 27.95 O ATOM 1842 CB CYS A 118 16.741 -2.193 -9.129 1.00 29.16 C ATOM 1843 SG CYS A 118 18.531 -2.202 -9.260 1.00 34.74 S ATOM 1844 HA CYS A 118 15.065 -3.191 -8.284 1.00 0.00 H ATOM 1845 HB2 CYS A 118 16.435 -1.217 -8.753 1.00 0.00 H ATOM 1846 HB3 CYS A 118 16.328 -2.342 -10.127 1.00 0.00 H ATOM 1847 HG CYS A 118 19.083 -1.996 -8.012 1.00 0.00 H ATOM 1848 H CYS A 118 17.259 -2.389 -6.540 1.00 0.00 H ATOM 1849 N ASP A 119 17.134 -5.437 -7.748 1.00 28.30 N ATOM 1850 CA ASP A 119 17.468 -6.833 -8.004 1.00 27.29 C ATOM 1851 C ASP A 119 16.269 -7.776 -7.836 1.00 30.80 C ATOM 1852 O ASP A 119 16.313 -8.916 -8.292 1.00 35.78 O ATOM 1853 CB ASP A 119 18.603 -7.276 -7.077 1.00 30.64 C ATOM 1854 CG ASP A 119 18.263 -7.088 -5.599 1.00 29.93 C ATOM 1855 OD1 ASP A 119 18.409 -5.958 -5.094 1.00 24.43 O ATOM 1856 OD2 ASP A 119 17.852 -8.067 -4.940 1.00 33.00 O ATOM 1857 HA ASP A 119 17.783 -6.896 -9.046 1.00 0.00 H ATOM 1858 HB2 ASP A 119 18.809 -8.331 -7.257 1.00 0.00 H ATOM 1859 HB3 ASP A 119 19.492 -6.689 -7.308 1.00 0.00 H ATOM 1860 H ASP A 119 17.370 -5.025 -6.823 1.00 0.00 H ATOM 1861 N LEU A 120 15.210 -7.308 -7.177 1.00 31.00 N ATOM 1862 CA LEU A 120 14.034 -8.144 -6.910 1.00 32.48 C ATOM 1863 C LEU A 120 13.110 -8.270 -8.122 1.00 33.99 C ATOM 1864 O LEU A 120 13.019 -7.352 -8.940 1.00 35.46 O ATOM 1865 CB LEU A 120 13.234 -7.608 -5.711 1.00 32.96 C ATOM 1866 CG LEU A 120 13.898 -7.558 -4.330 1.00 32.87 C ATOM 1867 CD1 LEU A 120 12.917 -7.027 -3.296 1.00 26.12 C ATOM 1868 CD2 LEU A 120 14.423 -8.938 -3.916 1.00 32.67 C ATOM 1869 HA LEU A 120 14.418 -9.138 -6.678 1.00 0.00 H ATOM 1870 HB2 LEU A 120 12.935 -6.589 -5.958 1.00 0.00 H ATOM 1871 HB3 LEU A 120 12.346 -8.233 -5.615 1.00 0.00 H ATOM 1872 HG LEU A 120 14.751 -6.882 -4.387 1.00 0.00 H ATOM 1873 HD21 LEU A 120 13.594 -9.644 -3.878 1.00 0.00 H ATOM 1874 HD22 LEU A 120 15.159 -9.279 -4.644 1.00 0.00 H ATOM 1875 HD23 LEU A 120 14.888 -8.868 -2.933 1.00 0.00 H ATOM 1876 HD11 LEU A 120 12.602 -6.022 -3.578 1.00 0.00 H ATOM 1877 HD12 LEU A 120 12.048 -7.683 -3.252 1.00 0.00 H ATOM 1878 HD13 LEU A 120 13.401 -6.997 -2.320 1.00 0.00 H ATOM 1879 H LEU A 120 15.217 -6.323 -6.843 1.00 0.00 H ATOM 1880 N PRO A 121 12.420 -9.418 -8.237 1.00 36.79 N ATOM 1881 CA PRO A 121 11.395 -9.662 -9.262 1.00 39.28 C ATOM 1882 C PRO A 121 10.013 -9.155 -8.836 1.00 42.41 C ATOM 1883 O PRO A 121 9.085 -9.114 -9.647 1.00 46.94 O ATOM 1884 CB PRO A 121 11.379 -11.186 -9.366 1.00 36.70 C ATOM 1885 CG PRO A 121 11.734 -11.648 -7.995 1.00 33.96 C ATOM 1886 CD PRO A 121 12.694 -10.625 -7.435 1.00 35.61 C ATOM 1887 HA PRO A 121 11.616 -9.146 -10.196 1.00 0.00 H ATOM 1888 HD3 PRO A 121 12.497 -10.444 -6.378 1.00 0.00 H ATOM 1889 HD2 PRO A 121 13.727 -10.950 -7.561 1.00 0.00 H ATOM 1890 HG3 PRO A 121 12.210 -12.628 -8.038 1.00 0.00 H ATOM 1891 HG2 PRO A 121 10.840 -11.707 -7.374 1.00 0.00 H ATOM 1892 HB2 PRO A 121 10.390 -11.544 -9.651 1.00 0.00 H ATOM 1893 HB3 PRO A 121 12.113 -11.532 -10.093 1.00 0.00 H ATOM 1894 N SER A 122 9.901 -8.764 -7.570 1.00 41.94 N ATOM 1895 CA SER A 122 8.643 -8.334 -6.960 1.00 44.14 C ATOM 1896 C SER A 122 8.310 -6.841 -7.166 1.00 48.53 C ATOM 1897 O SER A 122 7.701 -6.217 -6.299 1.00 55.90 O ATOM 1898 CB SER A 122 8.676 -8.665 -5.458 1.00 39.22 C ATOM 1899 OG SER A 122 7.538 -8.162 -4.781 1.00 37.24 O ATOM 1900 HA SER A 122 7.849 -8.881 -7.468 1.00 0.00 H ATOM 1901 HB2 SER A 122 9.571 -8.224 -5.019 1.00 0.00 H ATOM 1902 HB3 SER A 122 8.709 -9.748 -5.336 1.00 0.00 H ATOM 1903 HG SER A 122 7.504 -7.178 -4.881 1.00 0.00 H ATOM 1904 H SER A 122 10.757 -8.764 -6.980 1.00 0.00 H ATOM 1905 N ARG A 123 8.687 -6.272 -8.308 1.00 42.63 N ATOM 1906 CA ARG A 123 8.442 -4.849 -8.567 1.00 38.75 C ATOM 1907 C ARG A 123 6.958 -4.466 -8.625 1.00 39.99 C ATOM 1908 O ARG A 123 6.175 -5.115 -9.319 1.00 44.10 O ATOM 1909 CB ARG A 123 9.116 -4.416 -9.869 1.00 35.42 C ATOM 1910 CG ARG A 123 8.840 -2.970 -10.252 1.00 33.37 C ATOM 1911 CD ARG A 123 9.477 -2.620 -11.590 1.00 31.74 C ATOM 1912 NE ARG A 123 10.932 -2.715 -11.526 1.00 32.70 N ATOM 1913 CZ ARG A 123 11.751 -1.683 -11.325 1.00 35.76 C ATOM 1914 NH1 ARG A 123 11.263 -0.456 -11.173 1.00 32.42 N ATOM 1915 NH2 ARG A 123 13.064 -1.879 -11.278 1.00 35.69 N ATOM 1916 HA ARG A 123 8.873 -4.326 -7.713 1.00 0.00 H ATOM 1917 HB2 ARG A 123 10.193 -4.543 -9.757 1.00 0.00 H ATOM 1918 HB3 ARG A 123 8.757 -5.059 -10.673 1.00 0.00 H ATOM 1919 HG2 ARG A 123 7.763 -2.820 -10.322 1.00 0.00 H ATOM 1920 HG3 ARG A 123 9.248 -2.315 -9.482 1.00 0.00 H ATOM 1921 HD2 ARG A 123 9.199 -1.601 -11.860 1.00 0.00 H ATOM 1922 HD3 ARG A 123 9.109 -3.309 -12.350 1.00 0.00 H ATOM 1923 HE ARG A 123 11.360 -3.655 -11.646 1.00 0.00 H ATOM 1924 HH12 ARG A 123 11.908 0.345 -11.016 1.00 0.00 H ATOM 1925 HH11 ARG A 123 10.236 -0.296 -11.211 1.00 0.00 H ATOM 1926 HH22 ARG A 123 13.705 -1.075 -11.121 1.00 0.00 H ATOM 1927 HH21 ARG A 123 13.451 -2.837 -11.398 1.00 0.00 H ATOM 1928 H ARG A 123 9.165 -6.847 -9.031 1.00 0.00 H ATOM 1929 N THR A 124 6.586 -3.406 -7.902 1.00 29.81 N ATOM 1930 CA THR A 124 5.244 -2.834 -7.997 1.00 25.93 C ATOM 1931 C THR A 124 5.295 -1.349 -8.329 1.00 28.14 C ATOM 1932 O THR A 124 4.265 -0.721 -8.552 1.00 28.43 O ATOM 1933 CB THR A 124 4.437 -3.011 -6.701 1.00 24.99 C ATOM 1934 OG1 THR A 124 5.174 -2.472 -5.603 1.00 27.72 O ATOM 1935 CG2 THR A 124 4.162 -4.473 -6.438 1.00 30.79 C ATOM 1936 HA THR A 124 4.748 -3.379 -8.800 1.00 0.00 H ATOM 1937 HB THR A 124 3.488 -2.486 -6.811 1.00 0.00 H ATOM 1938 HG1 THR A 124 4.653 -2.587 -4.769 1.00 0.00 H ATOM 1939 HG23 THR A 124 3.599 -4.891 -7.273 1.00 0.00 H ATOM 1940 HG21 THR A 124 5.107 -5.006 -6.332 1.00 0.00 H ATOM 1941 HG22 THR A 124 3.582 -4.573 -5.521 1.00 0.00 H ATOM 1942 H THR A 124 7.273 -2.974 -7.251 1.00 0.00 H ATOM 1943 N VAL A 125 6.500 -0.788 -8.338 1.00 29.35 N ATOM 1944 CA VAL A 125 6.692 0.606 -8.711 1.00 25.95 C ATOM 1945 C VAL A 125 7.517 0.664 -9.990 1.00 28.20 C ATOM 1946 O VAL A 125 8.670 0.245 -10.011 1.00 32.40 O ATOM 1947 CB VAL A 125 7.389 1.414 -7.593 1.00 21.37 C ATOM 1948 CG1 VAL A 125 7.459 2.896 -7.974 1.00 20.27 C ATOM 1949 CG2 VAL A 125 6.642 1.251 -6.276 1.00 16.50 C ATOM 1950 HA VAL A 125 5.713 1.057 -8.870 1.00 0.00 H ATOM 1951 HB VAL A 125 8.403 1.032 -7.472 1.00 0.00 H ATOM 1952 HG11 VAL A 125 8.025 3.006 -8.899 1.00 0.00 H ATOM 1953 HG12 VAL A 125 6.449 3.281 -8.116 1.00 0.00 H ATOM 1954 HG13 VAL A 125 7.952 3.452 -7.177 1.00 0.00 H ATOM 1955 HG21 VAL A 125 5.620 1.613 -6.392 1.00 0.00 H ATOM 1956 HG22 VAL A 125 6.626 0.198 -5.997 1.00 0.00 H ATOM 1957 HG23 VAL A 125 7.147 1.827 -5.500 1.00 0.00 H ATOM 1958 H VAL A 125 7.327 -1.360 -8.072 1.00 0.00 H ATOM 1959 N ASP A 126 6.919 1.177 -11.058 1.00 27.65 N ATOM 1960 CA ASP A 126 7.571 1.199 -12.360 1.00 33.51 C ATOM 1961 C ASP A 126 8.626 2.289 -12.455 1.00 28.62 C ATOM 1962 O ASP A 126 8.450 3.391 -11.935 1.00 25.11 O ATOM 1963 CB ASP A 126 6.539 1.408 -13.469 1.00 45.19 C ATOM 1964 CG ASP A 126 5.497 0.315 -13.505 1.00 59.90 C ATOM 1965 OD1 ASP A 126 5.858 -0.858 -13.266 1.00 67.30 O ATOM 1966 OD2 ASP A 126 4.316 0.628 -13.768 1.00 64.40 O ATOM 1967 HA ASP A 126 8.064 0.234 -12.482 1.00 0.00 H ATOM 1968 HB2 ASP A 126 6.039 2.363 -13.306 1.00 0.00 H ATOM 1969 HB3 ASP A 126 7.056 1.430 -14.428 1.00 0.00 H ATOM 1970 H ASP A 126 5.962 1.573 -10.963 1.00 0.00 H ATOM 1971 N THR A 127 9.714 1.980 -13.145 1.00 26.14 N ATOM 1972 CA THR A 127 10.759 2.961 -13.402 1.00 29.75 C ATOM 1973 C THR A 127 10.182 4.287 -13.892 1.00 30.78 C ATOM 1974 O THR A 127 10.548 5.352 -13.399 1.00 34.00 O ATOM 1975 CB THR A 127 11.768 2.433 -14.430 1.00 33.01 C ATOM 1976 OG1 THR A 127 12.342 1.214 -13.944 1.00 35.59 O ATOM 1977 CG2 THR A 127 12.873 3.453 -14.664 1.00 35.87 C ATOM 1978 HA THR A 127 11.268 3.135 -12.454 1.00 0.00 H ATOM 1979 HB THR A 127 11.251 2.253 -15.373 1.00 0.00 H ATOM 1980 HG1 THR A 127 12.802 1.387 -13.085 1.00 0.00 H ATOM 1981 HG23 THR A 127 12.437 4.381 -15.034 1.00 0.00 H ATOM 1982 HG21 THR A 127 13.394 3.644 -13.726 1.00 0.00 H ATOM 1983 HG22 THR A 127 13.577 3.062 -15.399 1.00 0.00 H ATOM 1984 H THR A 127 9.824 1.013 -13.512 1.00 0.00 H ATOM 1985 N LYS A 128 9.266 4.213 -14.850 1.00 32.85 N ATOM 1986 CA LYS A 128 8.696 5.406 -15.467 1.00 33.65 C ATOM 1987 C LYS A 128 7.971 6.310 -14.472 1.00 27.46 C ATOM 1988 O LYS A 128 8.221 7.511 -14.435 1.00 29.46 O ATOM 1989 CB LYS A 128 7.759 5.032 -16.620 1.00 40.15 C ATOM 1990 CG LYS A 128 7.498 6.173 -17.600 1.00 46.62 C ATOM 1991 CD LYS A 128 6.003 6.393 -17.817 1.00 56.64 C ATOM 1992 CE LYS A 128 5.723 7.377 -18.958 1.00 61.12 C ATOM 1993 NZ LYS A 128 6.316 8.728 -18.725 1.00 61.62 N ATOM 1994 HA LYS A 128 9.539 5.976 -15.857 1.00 0.00 H ATOM 1995 HB2 LYS A 128 8.204 4.203 -17.169 1.00 0.00 H ATOM 1996 HB3 LYS A 128 6.805 4.716 -16.198 1.00 0.00 H ATOM 1997 HG2 LYS A 128 7.937 7.088 -17.203 1.00 0.00 H ATOM 1998 HG3 LYS A 128 7.963 5.933 -18.556 1.00 0.00 H ATOM 1999 HD2 LYS A 128 5.538 5.436 -18.056 1.00 0.00 H ATOM 2000 HD3 LYS A 128 5.569 6.787 -16.898 1.00 0.00 H ATOM 2001 HE2 LYS A 128 4.644 7.485 -19.066 1.00 0.00 H ATOM 2002 HE3 LYS A 128 6.140 6.969 -19.879 1.00 0.00 H ATOM 2003 HZ1 LYS A 128 5.919 9.134 -17.854 1.00 0.00 H ATOM 2004 HZ2 LYS A 128 7.348 8.641 -18.630 1.00 0.00 H ATOM 2005 HZ3 LYS A 128 6.092 9.347 -19.530 1.00 0.00 H ATOM 2006 H LYS A 128 8.945 3.277 -15.170 1.00 0.00 H ATOM 2007 N GLN A 129 7.068 5.750 -13.673 1.00 26.60 N ATOM 2008 CA GLN A 129 6.375 6.570 -12.685 1.00 29.56 C ATOM 2009 C GLN A 129 7.359 7.247 -11.733 1.00 26.01 C ATOM 2010 O GLN A 129 7.150 8.387 -11.326 1.00 21.26 O ATOM 2011 CB GLN A 129 5.260 5.806 -11.937 1.00 36.45 C ATOM 2012 CG GLN A 129 5.622 4.461 -11.331 1.00 41.30 C ATOM 2013 CD GLN A 129 4.411 3.742 -10.722 1.00 39.72 C ATOM 2014 OE1 GLN A 129 4.394 2.515 -10.602 1.00 36.31 O ATOM 2015 NE2 GLN A 129 3.399 4.509 -10.335 1.00 41.48 N ATOM 2016 HA GLN A 129 5.864 7.358 -13.238 1.00 0.00 H ATOM 2017 HB2 GLN A 129 4.910 6.447 -11.127 1.00 0.00 H ATOM 2018 HB3 GLN A 129 4.447 5.639 -12.643 1.00 0.00 H ATOM 2019 HG2 GLN A 129 6.047 3.830 -12.111 1.00 0.00 H ATOM 2020 HG3 GLN A 129 6.364 4.619 -10.549 1.00 0.00 H ATOM 2021 HE22 GLN A 129 3.453 5.541 -10.454 1.00 0.00 H ATOM 2022 HE21 GLN A 129 2.552 4.078 -9.913 1.00 0.00 H ATOM 2023 H GLN A 129 6.857 4.735 -13.752 1.00 0.00 H ATOM 2024 N ALA A 130 8.446 6.558 -11.408 1.00 25.84 N ATOM 2025 CA ALA A 130 9.484 7.139 -10.568 1.00 22.01 C ATOM 2026 C ALA A 130 10.287 8.220 -11.304 1.00 22.98 C ATOM 2027 O ALA A 130 10.630 9.243 -10.724 1.00 25.54 O ATOM 2028 CB ALA A 130 10.396 6.060 -10.049 1.00 23.53 C ATOM 2029 HA ALA A 130 8.991 7.626 -9.726 1.00 0.00 H ATOM 2030 HB1 ALA A 130 9.817 5.348 -9.461 1.00 0.00 H ATOM 2031 HB2 ALA A 130 10.862 5.545 -10.889 1.00 0.00 H ATOM 2032 HB3 ALA A 130 11.167 6.508 -9.423 1.00 0.00 H ATOM 2033 H ALA A 130 8.558 5.586 -11.760 1.00 0.00 H ATOM 2034 N GLN A 131 10.589 7.990 -12.578 1.00 20.98 N ATOM 2035 CA GLN A 131 11.270 8.990 -13.398 1.00 23.72 C ATOM 2036 C GLN A 131 10.429 10.248 -13.517 1.00 25.18 C ATOM 2037 O GLN A 131 10.946 11.360 -13.435 1.00 26.20 O ATOM 2038 CB GLN A 131 11.525 8.454 -14.807 1.00 31.06 C ATOM 2039 CG GLN A 131 12.647 7.449 -14.921 1.00 44.79 C ATOM 2040 CD GLN A 131 12.744 6.843 -16.318 1.00 56.31 C ATOM 2041 OE1 GLN A 131 11.854 7.028 -17.152 1.00 58.22 O ATOM 2042 NE2 GLN A 131 13.828 6.114 -16.575 1.00 58.26 N ATOM 2043 HA GLN A 131 12.218 9.219 -12.910 1.00 0.00 H ATOM 2044 HB2 GLN A 131 10.609 7.978 -15.158 1.00 0.00 H ATOM 2045 HB3 GLN A 131 11.763 9.300 -15.452 1.00 0.00 H ATOM 2046 HG2 GLN A 131 13.588 7.947 -14.689 1.00 0.00 H ATOM 2047 HG3 GLN A 131 12.474 6.648 -14.203 1.00 0.00 H ATOM 2048 HE22 GLN A 131 14.554 5.985 -15.841 1.00 0.00 H ATOM 2049 HE21 GLN A 131 13.949 5.674 -17.510 1.00 0.00 H ATOM 2050 H GLN A 131 10.334 7.075 -13.002 1.00 0.00 H ATOM 2051 N ASP A 132 9.132 10.060 -13.738 1.00 26.01 N ATOM 2052 CA ASP A 132 8.202 11.174 -13.889 1.00 24.79 C ATOM 2053 C ASP A 132 8.092 11.989 -12.602 1.00 24.55 C ATOM 2054 O ASP A 132 7.964 13.214 -12.641 1.00 23.92 O ATOM 2055 CB ASP A 132 6.814 10.664 -14.305 1.00 26.50 C ATOM 2056 CG ASP A 132 6.808 10.033 -15.697 1.00 33.96 C ATOM 2057 OD1 ASP A 132 7.822 10.152 -16.411 1.00 35.45 O ATOM 2058 OD2 ASP A 132 5.785 9.423 -16.086 1.00 39.48 O ATOM 2059 HA ASP A 132 8.594 11.825 -14.671 1.00 0.00 H ATOM 2060 HB2 ASP A 132 6.486 9.917 -13.582 1.00 0.00 H ATOM 2061 HB3 ASP A 132 6.118 11.503 -14.300 1.00 0.00 H ATOM 2062 H ASP A 132 8.768 9.088 -13.805 1.00 0.00 H ATOM 2063 N LEU A 133 8.120 11.310 -11.459 1.00 21.72 N ATOM 2064 CA LEU A 133 8.091 12.016 -10.185 1.00 26.66 C ATOM 2065 C LEU A 133 9.338 12.883 -10.027 1.00 26.02 C ATOM 2066 O LEU A 133 9.244 14.063 -9.706 1.00 30.72 O ATOM 2067 CB LEU A 133 7.972 11.042 -9.010 1.00 26.56 C ATOM 2068 CG LEU A 133 7.810 11.758 -7.668 1.00 26.37 C ATOM 2069 CD1 LEU A 133 6.483 12.499 -7.655 1.00 25.85 C ATOM 2070 CD2 LEU A 133 7.919 10.798 -6.480 1.00 20.92 C ATOM 2071 HA LEU A 133 7.210 12.658 -10.181 1.00 0.00 H ATOM 2072 HB2 LEU A 133 7.104 10.403 -9.172 1.00 0.00 H ATOM 2073 HB3 LEU A 133 8.872 10.428 -8.972 1.00 0.00 H ATOM 2074 HG LEU A 133 8.627 12.471 -7.559 1.00 0.00 H ATOM 2075 HD21 LEU A 133 7.140 10.039 -6.555 1.00 0.00 H ATOM 2076 HD22 LEU A 133 8.897 10.318 -6.491 1.00 0.00 H ATOM 2077 HD23 LEU A 133 7.797 11.356 -5.551 1.00 0.00 H ATOM 2078 HD11 LEU A 133 6.468 13.229 -8.464 1.00 0.00 H ATOM 2079 HD12 LEU A 133 5.669 11.787 -7.791 1.00 0.00 H ATOM 2080 HD13 LEU A 133 6.363 13.011 -6.700 1.00 0.00 H ATOM 2081 H LEU A 133 8.163 10.271 -11.475 1.00 0.00 H ATOM 2082 N ALA A 134 10.505 12.287 -10.253 1.00 24.21 N ATOM 2083 CA ALA A 134 11.766 13.015 -10.167 1.00 23.20 C ATOM 2084 C ALA A 134 11.766 14.213 -11.106 1.00 22.88 C ATOM 2085 O ALA A 134 12.175 15.303 -10.728 1.00 26.04 O ATOM 2086 CB ALA A 134 12.933 12.095 -10.494 1.00 20.05 C ATOM 2087 HA ALA A 134 11.878 13.378 -9.145 1.00 0.00 H ATOM 2088 HB1 ALA A 134 12.951 11.267 -9.785 1.00 0.00 H ATOM 2089 HB2 ALA A 134 12.815 11.706 -11.505 1.00 0.00 H ATOM 2090 HB3 ALA A 134 13.866 12.655 -10.425 1.00 0.00 H ATOM 2091 H ALA A 134 10.519 11.276 -10.497 1.00 0.00 H ATOM 2092 N ARG A 135 11.314 14.003 -12.338 1.00 24.86 N ATOM 2093 CA ARG A 135 11.261 15.079 -13.319 1.00 27.11 C ATOM 2094 C ARG A 135 10.404 16.242 -12.807 1.00 24.12 C ATOM 2095 O ARG A 135 10.734 17.409 -13.007 1.00 22.80 O ATOM 2096 CB ARG A 135 10.737 14.563 -14.660 1.00 30.71 C ATOM 2097 CG ARG A 135 11.012 15.498 -15.824 1.00 40.36 C ATOM 2098 CD ARG A 135 11.416 14.723 -17.066 1.00 47.61 C ATOM 2099 NE ARG A 135 10.551 13.568 -17.292 1.00 53.75 N ATOM 2100 CZ ARG A 135 10.990 12.323 -17.467 1.00 54.26 C ATOM 2101 NH1 ARG A 135 12.292 12.063 -17.449 1.00 53.26 N ATOM 2102 NH2 ARG A 135 10.126 11.337 -17.665 1.00 52.89 N ATOM 2103 HA ARG A 135 12.274 15.450 -13.472 1.00 0.00 H ATOM 2104 HB2 ARG A 135 11.211 13.604 -14.869 1.00 0.00 H ATOM 2105 HB3 ARG A 135 9.659 14.423 -14.578 1.00 0.00 H ATOM 2106 HG2 ARG A 135 10.111 16.072 -16.040 1.00 0.00 H ATOM 2107 HG3 ARG A 135 11.818 16.179 -15.551 1.00 0.00 H ATOM 2108 HD2 ARG A 135 12.443 14.377 -16.947 1.00 0.00 H ATOM 2109 HD3 ARG A 135 11.354 15.384 -17.930 1.00 0.00 H ATOM 2110 HE ARG A 135 9.524 13.729 -17.318 1.00 0.00 H ATOM 2111 HH12 ARG A 135 12.630 11.089 -17.586 1.00 0.00 H ATOM 2112 HH11 ARG A 135 12.974 12.833 -17.298 1.00 0.00 H ATOM 2113 HH22 ARG A 135 10.469 10.365 -17.802 1.00 0.00 H ATOM 2114 HH21 ARG A 135 9.105 11.536 -17.684 1.00 0.00 H ATOM 2115 H ARG A 135 10.992 13.052 -12.607 1.00 0.00 H ATOM 2116 N SER A 136 9.317 15.918 -12.119 1.00 22.84 N ATOM 2117 CA SER A 136 8.439 16.954 -11.594 1.00 27.06 C ATOM 2118 C SER A 136 9.143 17.807 -10.553 1.00 26.71 C ATOM 2119 O SER A 136 8.951 19.017 -10.517 1.00 24.46 O ATOM 2120 CB SER A 136 7.175 16.342 -11.001 1.00 27.52 C ATOM 2121 OG SER A 136 6.596 15.448 -11.931 1.00 38.88 O ATOM 2122 HA SER A 136 8.162 17.598 -12.428 1.00 0.00 H ATOM 2123 HB2 SER A 136 6.463 17.134 -10.768 1.00 0.00 H ATOM 2124 HB3 SER A 136 7.427 15.802 -10.088 1.00 0.00 H ATOM 2125 HG SER A 136 7.242 14.728 -12.141 1.00 0.00 H ATOM 2126 H SER A 136 9.090 14.917 -11.953 1.00 0.00 H ATOM 2127 N TYR A 137 9.946 17.160 -9.709 1.00 25.86 N ATOM 2128 CA TYR A 137 10.671 17.833 -8.636 1.00 21.52 C ATOM 2129 C TYR A 137 11.897 18.548 -9.159 1.00 22.06 C ATOM 2130 O TYR A 137 12.412 19.447 -8.508 1.00 25.00 O ATOM 2131 CB TYR A 137 11.159 16.821 -7.604 1.00 20.61 C ATOM 2132 CG TYR A 137 10.080 16.136 -6.804 1.00 24.64 C ATOM 2133 CD1 TYR A 137 8.835 16.723 -6.625 1.00 25.66 C ATOM 2134 CD2 TYR A 137 10.317 14.900 -6.210 1.00 25.51 C ATOM 2135 CE1 TYR A 137 7.846 16.088 -5.877 1.00 25.88 C ATOM 2136 CE2 TYR A 137 9.340 14.261 -5.464 1.00 25.60 C ATOM 2137 CZ TYR A 137 8.110 14.859 -5.299 1.00 26.26 C ATOM 2138 OH TYR A 137 7.145 14.219 -4.556 1.00 31.84 O ATOM 2139 HA TYR A 137 9.977 18.547 -8.193 1.00 0.00 H ATOM 2140 HB3 TYR A 137 11.815 17.342 -6.906 1.00 0.00 H ATOM 2141 HB2 TYR A 137 11.727 16.053 -8.129 1.00 0.00 H ATOM 2142 HD2 TYR A 137 11.290 14.425 -6.334 1.00 0.00 H ATOM 2143 HE2 TYR A 137 9.543 13.291 -5.010 1.00 0.00 H ATOM 2144 HE1 TYR A 137 6.870 16.556 -5.748 1.00 0.00 H ATOM 2145 HD1 TYR A 137 8.628 17.694 -7.076 1.00 0.00 H ATOM 2146 HH TYR A 137 6.326 14.774 -4.533 1.00 0.00 H ATOM 2147 H TYR A 137 10.061 16.132 -9.820 1.00 0.00 H ATOM 2148 N GLY A 138 12.392 18.116 -10.314 1.00 23.78 N ATOM 2149 CA GLY A 138 13.630 18.651 -10.858 1.00 23.07 C ATOM 2150 C GLY A 138 14.855 18.017 -10.219 1.00 26.48 C ATOM 2151 O GLY A 138 15.890 18.667 -10.037 1.00 26.76 O ATOM 2152 HA3 GLY A 138 13.657 19.726 -10.680 1.00 0.00 H ATOM 2153 HA2 GLY A 138 13.654 18.461 -11.931 1.00 0.00 H ATOM 2154 H GLY A 138 11.882 17.378 -10.841 1.00 0.00 H ATOM 2155 N ILE A 139 14.745 16.739 -9.870 1.00 25.61 N ATOM 2156 CA ILE A 139 15.858 16.041 -9.232 1.00 22.68 C ATOM 2157 C ILE A 139 16.256 14.792 -10.000 1.00 23.34 C ATOM 2158 O ILE A 139 15.463 14.257 -10.777 1.00 23.51 O ATOM 2159 CB ILE A 139 15.542 15.651 -7.764 1.00 23.99 C ATOM 2160 CG1 ILE A 139 14.480 14.547 -7.698 1.00 22.54 C ATOM 2161 CG2 ILE A 139 15.107 16.872 -6.957 1.00 25.38 C ATOM 2162 CD1 ILE A 139 14.073 14.167 -6.256 1.00 19.20 C ATOM 2163 HA ILE A 139 16.690 16.745 -9.237 1.00 0.00 H ATOM 2164 HB ILE A 139 16.458 15.259 -7.321 1.00 0.00 H ATOM 2165 HG12 ILE A 139 13.592 14.890 -8.228 1.00 0.00 H ATOM 2166 HG13 ILE A 139 14.875 13.658 -8.191 1.00 0.00 H ATOM 2167 HD11 ILE A 139 14.949 13.810 -5.715 1.00 0.00 H ATOM 2168 HD12 ILE A 139 13.665 15.043 -5.752 1.00 0.00 H ATOM 2169 HD13 ILE A 139 13.319 13.381 -6.288 1.00 0.00 H ATOM 2170 HG21 ILE A 139 15.908 17.611 -6.959 1.00 0.00 H ATOM 2171 HG22 ILE A 139 14.212 17.303 -7.406 1.00 0.00 H ATOM 2172 HG23 ILE A 139 14.892 16.571 -5.932 1.00 0.00 H ATOM 2173 H ILE A 139 13.856 16.231 -10.053 1.00 0.00 H ATOM 2174 N PRO A 140 17.492 14.318 -9.781 1.00 23.64 N ATOM 2175 CA PRO A 140 17.934 13.061 -10.388 1.00 24.82 C ATOM 2176 C PRO A 140 17.213 11.840 -9.811 1.00 22.12 C ATOM 2177 O PRO A 140 16.776 11.841 -8.657 1.00 18.96 O ATOM 2178 CB PRO A 140 19.434 13.014 -10.050 1.00 28.62 C ATOM 2179 CG PRO A 140 19.811 14.441 -9.755 1.00 27.81 C ATOM 2180 CD PRO A 140 18.594 15.013 -9.090 1.00 25.51 C ATOM 2181 HA PRO A 140 17.720 13.029 -11.456 1.00 0.00 H ATOM 2182 HD3 PRO A 140 18.589 14.794 -8.022 1.00 0.00 H ATOM 2183 HD2 PRO A 140 18.534 16.091 -9.239 1.00 0.00 H ATOM 2184 HG3 PRO A 140 20.038 14.979 -10.675 1.00 0.00 H ATOM 2185 HG2 PRO A 140 20.672 14.484 -9.088 1.00 0.00 H ATOM 2186 HB2 PRO A 140 19.611 12.383 -9.179 1.00 0.00 H ATOM 2187 HB3 PRO A 140 20.006 12.633 -10.896 1.00 0.00 H ATOM 2188 N PHE A 141 17.081 10.812 -10.642 1.00 22.67 N ATOM 2189 CA PHE A 141 16.530 9.539 -10.224 1.00 22.36 C ATOM 2190 C PHE A 141 17.525 8.430 -10.543 1.00 22.87 C ATOM 2191 O PHE A 141 18.092 8.376 -11.638 1.00 23.48 O ATOM 2192 CB PHE A 141 15.199 9.271 -10.925 1.00 19.28 C ATOM 2193 CG PHE A 141 14.669 7.886 -10.691 1.00 15.79 C ATOM 2194 CD1 PHE A 141 14.544 7.392 -9.405 1.00 15.76 C ATOM 2195 CD2 PHE A 141 14.314 7.074 -11.754 1.00 18.01 C ATOM 2196 CE1 PHE A 141 14.066 6.115 -9.180 1.00 21.60 C ATOM 2197 CE2 PHE A 141 13.832 5.793 -11.538 1.00 21.32 C ATOM 2198 CZ PHE A 141 13.705 5.313 -10.249 1.00 20.61 C ATOM 2199 HA PHE A 141 16.348 9.567 -9.150 1.00 0.00 H ATOM 2200 HB2 PHE A 141 14.465 9.989 -10.559 1.00 0.00 H ATOM 2201 HB3 PHE A 141 15.339 9.411 -11.997 1.00 0.00 H ATOM 2202 HD2 PHE A 141 14.415 7.447 -12.773 1.00 0.00 H ATOM 2203 HE2 PHE A 141 13.553 5.165 -12.384 1.00 0.00 H ATOM 2204 HZ PHE A 141 13.322 4.307 -10.074 1.00 0.00 H ATOM 2205 HE1 PHE A 141 13.973 5.739 -8.161 1.00 0.00 H ATOM 2206 HD1 PHE A 141 14.826 8.018 -8.558 1.00 0.00 H ATOM 2207 H PHE A 141 17.385 10.925 -11.630 1.00 0.00 H ATOM 2208 N ILE A 142 17.742 7.546 -9.580 1.00 22.20 N ATOM 2209 CA ILE A 142 18.684 6.450 -9.755 1.00 23.07 C ATOM 2210 C ILE A 142 18.145 5.197 -9.084 1.00 22.54 C ATOM 2211 O ILE A 142 17.718 5.233 -7.930 1.00 24.27 O ATOM 2212 CB ILE A 142 20.081 6.812 -9.196 1.00 30.08 C ATOM 2213 CG1 ILE A 142 20.635 8.033 -9.936 1.00 36.22 C ATOM 2214 CG2 ILE A 142 21.045 5.644 -9.324 1.00 30.49 C ATOM 2215 CD1 ILE A 142 22.081 8.345 -9.630 1.00 39.82 C ATOM 2216 HA ILE A 142 18.799 6.262 -10.823 1.00 0.00 H ATOM 2217 HB ILE A 142 19.975 7.046 -8.137 1.00 0.00 H ATOM 2218 HG12 ILE A 142 20.544 7.853 -11.007 1.00 0.00 H ATOM 2219 HG13 ILE A 142 20.034 8.900 -9.662 1.00 0.00 H ATOM 2220 HD11 ILE A 142 22.191 8.542 -8.564 1.00 0.00 H ATOM 2221 HD12 ILE A 142 22.702 7.494 -9.910 1.00 0.00 H ATOM 2222 HD13 ILE A 142 22.390 9.224 -10.197 1.00 0.00 H ATOM 2223 HG21 ILE A 142 20.657 4.792 -8.766 1.00 0.00 H ATOM 2224 HG22 ILE A 142 21.150 5.375 -10.375 1.00 0.00 H ATOM 2225 HG23 ILE A 142 22.017 5.931 -8.922 1.00 0.00 H ATOM 2226 H ILE A 142 17.229 7.637 -8.680 1.00 0.00 H ATOM 2227 N GLU A 143 18.137 4.097 -9.828 1.00 23.23 N ATOM 2228 CA GLU A 143 17.744 2.804 -9.284 1.00 26.88 C ATOM 2229 C GLU A 143 18.978 2.072 -8.775 1.00 25.91 C ATOM 2230 O GLU A 143 20.038 2.123 -9.391 1.00 29.05 O ATOM 2231 CB GLU A 143 16.994 1.976 -10.332 1.00 31.66 C ATOM 2232 CG GLU A 143 15.496 2.281 -10.361 1.00 42.50 C ATOM 2233 CD GLU A 143 14.735 1.492 -11.409 1.00 51.73 C ATOM 2234 OE1 GLU A 143 13.614 1.027 -11.111 1.00 50.60 O ATOM 2235 OE2 GLU A 143 15.250 1.354 -12.537 1.00 60.47 O ATOM 2236 HA GLU A 143 17.061 2.959 -8.448 1.00 0.00 H ATOM 2237 HB2 GLU A 143 17.414 2.193 -11.314 1.00 0.00 H ATOM 2238 HB3 GLU A 143 17.131 0.919 -10.105 1.00 0.00 H ATOM 2239 HG2 GLU A 143 15.078 2.047 -9.382 1.00 0.00 H ATOM 2240 HG3 GLU A 143 15.364 3.343 -10.566 1.00 0.00 H ATOM 2241 H GLU A 143 18.419 4.160 -10.827 1.00 0.00 H ATOM 2242 N THR A 144 18.844 1.403 -7.638 1.00 21.37 N ATOM 2243 CA THR A 144 19.996 0.786 -7.007 1.00 17.24 C ATOM 2244 C THR A 144 19.679 -0.594 -6.466 1.00 19.87 C ATOM 2245 O THR A 144 18.524 -0.998 -6.362 1.00 21.41 O ATOM 2246 CB THR A 144 20.510 1.635 -5.818 1.00 14.36 C ATOM 2247 OG1 THR A 144 19.494 1.704 -4.817 1.00 17.65 O ATOM 2248 CG2 THR A 144 20.850 3.044 -6.251 1.00 14.39 C ATOM 2249 HA THR A 144 20.754 0.715 -7.787 1.00 0.00 H ATOM 2250 HB THR A 144 21.411 1.160 -5.430 1.00 0.00 H ATOM 2251 HG1 THR A 144 19.278 0.790 -4.504 1.00 0.00 H ATOM 2252 HG23 THR A 144 21.625 3.010 -7.016 1.00 0.00 H ATOM 2253 HG21 THR A 144 19.959 3.523 -6.656 1.00 0.00 H ATOM 2254 HG22 THR A 144 21.210 3.610 -5.392 1.00 0.00 H ATOM 2255 H THR A 144 17.907 1.320 -7.195 1.00 0.00 H ATOM 2256 N SER A 145 20.735 -1.307 -6.116 1.00 19.63 N ATOM 2257 CA SER A 145 20.631 -2.546 -5.384 1.00 21.08 C ATOM 2258 C SER A 145 21.809 -2.557 -4.425 1.00 20.97 C ATOM 2259 O SER A 145 22.953 -2.478 -4.852 1.00 19.78 O ATOM 2260 CB SER A 145 20.728 -3.729 -6.335 1.00 22.34 C ATOM 2261 OG SER A 145 20.668 -4.943 -5.612 1.00 26.10 O ATOM 2262 HA SER A 145 19.678 -2.623 -4.860 1.00 0.00 H ATOM 2263 HB2 SER A 145 21.672 -3.679 -6.877 1.00 0.00 H ATOM 2264 HB3 SER A 145 19.901 -3.690 -7.044 1.00 0.00 H ATOM 2265 HG SER A 145 19.810 -4.991 -5.121 1.00 0.00 H ATOM 2266 H SER A 145 21.680 -0.961 -6.379 1.00 0.00 H ATOM 2267 N ALA A 146 21.531 -2.607 -3.129 1.00 21.96 N ATOM 2268 CA ALA A 146 22.589 -2.655 -2.135 1.00 21.04 C ATOM 2269 C ALA A 146 23.146 -4.068 -2.073 1.00 24.31 C ATOM 2270 O ALA A 146 24.210 -4.306 -1.515 1.00 26.33 O ATOM 2271 CB ALA A 146 22.065 -2.217 -0.773 1.00 19.34 C ATOM 2272 HA ALA A 146 23.386 -1.967 -2.418 1.00 0.00 H ATOM 2273 HB1 ALA A 146 21.689 -1.196 -0.841 1.00 0.00 H ATOM 2274 HB2 ALA A 146 21.259 -2.882 -0.464 1.00 0.00 H ATOM 2275 HB3 ALA A 146 22.873 -2.260 -0.043 1.00 0.00 H ATOM 2276 H ALA A 146 20.538 -2.612 -2.819 1.00 0.00 H ATOM 2277 N LYS A 147 22.418 -5.004 -2.667 1.00 25.47 N ATOM 2278 CA LYS A 147 22.848 -6.387 -2.710 1.00 26.67 C ATOM 2279 C LYS A 147 23.880 -6.613 -3.813 1.00 30.32 C ATOM 2280 O LYS A 147 24.891 -7.278 -3.583 1.00 33.06 O ATOM 2281 CB LYS A 147 21.647 -7.310 -2.902 1.00 28.10 C ATOM 2282 CG LYS A 147 22.007 -8.777 -3.102 1.00 26.84 C ATOM 2283 CD LYS A 147 20.730 -9.598 -3.231 1.00 30.64 C ATOM 2284 CE LYS A 147 21.015 -11.089 -3.322 1.00 34.91 C ATOM 2285 NZ LYS A 147 19.746 -11.874 -3.317 1.00 37.05 N ATOM 2286 HA LYS A 147 23.323 -6.622 -1.757 1.00 0.00 H ATOM 2287 HB2 LYS A 147 21.012 -7.232 -2.020 1.00 0.00 H ATOM 2288 HB3 LYS A 147 21.093 -6.972 -3.778 1.00 0.00 H ATOM 2289 HG2 LYS A 147 22.603 -8.885 -4.008 1.00 0.00 H ATOM 2290 HG3 LYS A 147 22.582 -9.131 -2.246 1.00 0.00 H ATOM 2291 HD2 LYS A 147 20.103 -9.412 -2.359 1.00 0.00 H ATOM 2292 HD3 LYS A 147 20.200 -9.286 -4.131 1.00 0.00 H ATOM 2293 HE2 LYS A 147 21.624 -11.389 -2.469 1.00 0.00 H ATOM 2294 HE3 LYS A 147 21.558 -11.293 -4.245 1.00 0.00 H ATOM 2295 HZ1 LYS A 147 19.226 -11.685 -2.436 1.00 0.00 H ATOM 2296 HZ2 LYS A 147 19.163 -11.594 -4.132 1.00 0.00 H ATOM 2297 HZ3 LYS A 147 19.967 -12.888 -3.380 1.00 0.00 H ATOM 2298 H LYS A 147 21.517 -4.739 -3.113 1.00 0.00 H ATOM 2299 N THR A 148 23.627 -6.059 -5.001 1.00 26.68 N ATOM 2300 CA THR A 148 24.551 -6.188 -6.130 1.00 28.22 C ATOM 2301 C THR A 148 25.482 -4.980 -6.177 1.00 29.69 C ATOM 2302 O THR A 148 26.555 -5.030 -6.783 1.00 33.09 O ATOM 2303 CB THR A 148 23.815 -6.268 -7.496 1.00 29.45 C ATOM 2304 OG1 THR A 148 23.249 -4.994 -7.812 1.00 32.52 O ATOM 2305 CG2 THR A 148 22.711 -7.292 -7.475 1.00 26.00 C ATOM 2306 HA THR A 148 25.104 -7.114 -5.974 1.00 0.00 H ATOM 2307 HB THR A 148 24.548 -6.562 -8.247 1.00 0.00 H ATOM 2308 HG1 THR A 148 22.781 -5.049 -8.683 1.00 0.00 H ATOM 2309 HG23 THR A 148 23.129 -8.270 -7.235 1.00 0.00 H ATOM 2310 HG21 THR A 148 21.975 -7.015 -6.721 1.00 0.00 H ATOM 2311 HG22 THR A 148 22.234 -7.330 -8.454 1.00 0.00 H ATOM 2312 H THR A 148 22.747 -5.519 -5.129 1.00 0.00 H ATOM 2313 N ARG A 149 25.045 -3.899 -5.536 1.00 25.90 N ATOM 2314 CA ARG A 149 25.746 -2.613 -5.510 1.00 25.74 C ATOM 2315 C ARG A 149 25.518 -1.777 -6.771 1.00 26.46 C ATOM 2316 O ARG A 149 26.142 -0.726 -6.952 1.00 26.28 O ATOM 2317 CB ARG A 149 27.249 -2.760 -5.221 1.00 31.14 C ATOM 2318 CG ARG A 149 27.881 -1.448 -4.732 1.00 38.04 C ATOM 2319 CD ARG A 149 29.404 -1.455 -4.831 1.00 46.47 C ATOM 2320 NE ARG A 149 29.987 -0.171 -4.442 1.00 45.56 N ATOM 2321 CZ ARG A 149 30.539 0.069 -3.257 1.00 43.48 C ATOM 2322 NH1 ARG A 149 31.045 1.265 -2.987 1.00 44.63 N ATOM 2323 NH2 ARG A 149 30.593 -0.890 -2.342 1.00 39.47 N ATOM 2324 HA ARG A 149 25.300 -2.069 -4.677 1.00 0.00 H ATOM 2325 HB2 ARG A 149 27.386 -3.522 -4.454 1.00 0.00 H ATOM 2326 HB3 ARG A 149 27.753 -3.072 -6.136 1.00 0.00 H ATOM 2327 HG2 ARG A 149 27.496 -0.628 -5.338 1.00 0.00 H ATOM 2328 HG3 ARG A 149 27.600 -1.292 -3.691 1.00 0.00 H ATOM 2329 HD2 ARG A 149 29.689 -1.673 -5.860 1.00 0.00 H ATOM 2330 HD3 ARG A 149 29.796 -2.232 -4.175 1.00 0.00 H ATOM 2331 HE ARG A 149 29.968 0.603 -5.137 1.00 0.00 H ATOM 2332 HH12 ARG A 149 31.476 1.450 -2.059 1.00 0.00 H ATOM 2333 HH11 ARG A 149 31.010 2.018 -3.703 1.00 0.00 H ATOM 2334 HH22 ARG A 149 31.025 -0.701 -1.415 1.00 0.00 H ATOM 2335 HH21 ARG A 149 30.203 -1.831 -2.551 1.00 0.00 H ATOM 2336 H ARG A 149 24.146 -3.972 -5.019 1.00 0.00 H ATOM 2337 N GLN A 150 24.619 -2.224 -7.638 1.00 25.22 N ATOM 2338 CA GLN A 150 24.255 -1.403 -8.787 1.00 24.76 C ATOM 2339 C GLN A 150 23.779 -0.027 -8.339 1.00 24.45 C ATOM 2340 O GLN A 150 22.876 0.084 -7.513 1.00 24.08 O ATOM 2341 CB GLN A 150 23.156 -2.064 -9.618 1.00 25.32 C ATOM 2342 CG GLN A 150 22.713 -1.212 -10.805 1.00 29.65 C ATOM 2343 CD GLN A 150 21.638 -1.867 -11.667 1.00 37.86 C ATOM 2344 OE1 GLN A 150 21.050 -2.884 -11.297 1.00 33.38 O ATOM 2345 NE2 GLN A 150 21.376 -1.272 -12.827 1.00 42.87 N ATOM 2346 HA GLN A 150 25.149 -1.298 -9.402 1.00 0.00 H ATOM 2347 HB2 GLN A 150 23.529 -3.017 -9.994 1.00 0.00 H ATOM 2348 HB3 GLN A 150 22.293 -2.241 -8.976 1.00 0.00 H ATOM 2349 HG2 GLN A 150 22.321 -0.269 -10.424 1.00 0.00 H ATOM 2350 HG3 GLN A 150 23.583 -1.016 -11.431 1.00 0.00 H ATOM 2351 HE22 GLN A 150 21.897 -0.414 -13.101 1.00 0.00 H ATOM 2352 HE21 GLN A 150 20.651 -1.664 -13.461 1.00 0.00 H ATOM 2353 H GLN A 150 24.176 -3.155 -7.499 1.00 0.00 H ATOM 2354 N GLY A 151 24.395 1.016 -8.884 1.00 28.13 N ATOM 2355 CA GLY A 151 23.928 2.377 -8.700 1.00 25.38 C ATOM 2356 C GLY A 151 24.272 3.060 -7.390 1.00 22.67 C ATOM 2357 O GLY A 151 23.969 4.245 -7.220 1.00 23.65 O ATOM 2358 HA3 GLY A 151 22.842 2.365 -8.788 1.00 0.00 H ATOM 2359 HA2 GLY A 151 24.350 2.980 -9.504 1.00 0.00 H ATOM 2360 H GLY A 151 25.243 0.851 -9.464 1.00 0.00 H ATOM 2361 N VAL A 152 24.901 2.332 -6.471 1.00 21.21 N ATOM 2362 CA VAL A 152 25.172 2.849 -5.123 1.00 22.05 C ATOM 2363 C VAL A 152 26.105 4.076 -5.102 1.00 27.04 C ATOM 2364 O VAL A 152 25.737 5.133 -4.583 1.00 29.69 O ATOM 2365 CB VAL A 152 25.725 1.737 -4.185 1.00 28.35 C ATOM 2366 CG1 VAL A 152 26.250 2.324 -2.877 1.00 26.06 C ATOM 2367 CG2 VAL A 152 24.654 0.684 -3.912 1.00 27.09 C ATOM 2368 HA VAL A 152 24.206 3.186 -4.748 1.00 0.00 H ATOM 2369 HB VAL A 152 26.562 1.257 -4.693 1.00 0.00 H ATOM 2370 HG11 VAL A 152 27.054 3.028 -3.093 1.00 0.00 H ATOM 2371 HG12 VAL A 152 25.441 2.842 -2.362 1.00 0.00 H ATOM 2372 HG13 VAL A 152 26.629 1.520 -2.246 1.00 0.00 H ATOM 2373 HG21 VAL A 152 23.796 1.156 -3.434 1.00 0.00 H ATOM 2374 HG22 VAL A 152 24.343 0.231 -4.853 1.00 0.00 H ATOM 2375 HG23 VAL A 152 25.061 -0.084 -3.254 1.00 0.00 H ATOM 2376 H VAL A 152 25.210 1.369 -6.714 1.00 0.00 H ATOM 2377 N ASP A 153 27.309 3.935 -5.649 1.00 29.34 N ATOM 2378 CA ASP A 153 28.246 5.059 -5.727 1.00 31.63 C ATOM 2379 C ASP A 153 27.599 6.232 -6.449 1.00 30.21 C ATOM 2380 O ASP A 153 27.710 7.380 -6.022 1.00 31.79 O ATOM 2381 CB ASP A 153 29.512 4.662 -6.485 1.00 32.65 C ATOM 2382 CG ASP A 153 30.297 3.577 -5.787 1.00 40.51 C ATOM 2383 OD1 ASP A 153 30.429 3.633 -4.550 1.00 41.32 O ATOM 2384 OD2 ASP A 153 30.785 2.664 -6.483 1.00 49.27 O ATOM 2385 HA ASP A 153 28.508 5.343 -4.708 1.00 0.00 H ATOM 2386 HB2 ASP A 153 29.228 4.305 -7.475 1.00 0.00 H ATOM 2387 HB3 ASP A 153 30.148 5.542 -6.586 1.00 0.00 H ATOM 2388 H ASP A 153 27.591 3.009 -6.029 1.00 0.00 H ATOM 2389 N ASP A 154 26.930 5.922 -7.552 1.00 27.01 N ATOM 2390 CA ASP A 154 26.295 6.923 -8.400 1.00 33.67 C ATOM 2391 C ASP A 154 25.249 7.742 -7.654 1.00 30.56 C ATOM 2392 O ASP A 154 25.161 8.955 -7.834 1.00 32.25 O ATOM 2393 CB ASP A 154 25.651 6.243 -9.607 1.00 44.17 C ATOM 2394 CG ASP A 154 26.261 6.684 -10.910 1.00 60.92 C ATOM 2395 OD1 ASP A 154 27.382 6.223 -11.225 1.00 64.49 O ATOM 2396 OD2 ASP A 154 25.620 7.495 -11.614 1.00 67.71 O ATOM 2397 HA ASP A 154 27.074 7.612 -8.726 1.00 0.00 H ATOM 2398 HB2 ASP A 154 25.776 5.165 -9.509 1.00 0.00 H ATOM 2399 HB3 ASP A 154 24.588 6.484 -9.619 1.00 0.00 H ATOM 2400 H ASP A 154 26.855 4.921 -7.823 1.00 0.00 H ATOM 2401 N ALA A 155 24.451 7.072 -6.827 1.00 27.36 N ATOM 2402 CA ALA A 155 23.412 7.747 -6.056 1.00 23.86 C ATOM 2403 C ALA A 155 24.019 8.781 -5.119 1.00 23.03 C ATOM 2404 O ALA A 155 23.550 9.910 -5.045 1.00 25.45 O ATOM 2405 CB ALA A 155 22.579 6.741 -5.271 1.00 20.51 C ATOM 2406 HA ALA A 155 22.756 8.263 -6.757 1.00 0.00 H ATOM 2407 HB1 ALA A 155 22.106 6.044 -5.963 1.00 0.00 H ATOM 2408 HB2 ALA A 155 23.225 6.193 -4.585 1.00 0.00 H ATOM 2409 HB3 ALA A 155 21.812 7.269 -4.705 1.00 0.00 H ATOM 2410 H ALA A 155 24.570 6.044 -6.728 1.00 0.00 H ATOM 2411 N PHE A 156 25.069 8.389 -4.408 1.00 20.33 N ATOM 2412 CA PHE A 156 25.719 9.280 -3.461 1.00 20.66 C ATOM 2413 C PHE A 156 26.513 10.402 -4.135 1.00 28.12 C ATOM 2414 O PHE A 156 26.512 11.537 -3.660 1.00 30.44 O ATOM 2415 CB PHE A 156 26.634 8.474 -2.538 1.00 21.52 C ATOM 2416 CG PHE A 156 25.900 7.755 -1.441 1.00 24.98 C ATOM 2417 CD1 PHE A 156 25.550 8.418 -0.271 1.00 22.50 C ATOM 2418 CD2 PHE A 156 25.561 6.419 -1.575 1.00 23.95 C ATOM 2419 CE1 PHE A 156 24.878 7.756 0.746 1.00 22.49 C ATOM 2420 CE2 PHE A 156 24.884 5.750 -0.564 1.00 21.48 C ATOM 2421 CZ PHE A 156 24.542 6.417 0.594 1.00 22.13 C ATOM 2422 HA PHE A 156 24.928 9.760 -2.885 1.00 0.00 H ATOM 2423 HB2 PHE A 156 27.166 7.736 -3.138 1.00 0.00 H ATOM 2424 HB3 PHE A 156 27.352 9.156 -2.083 1.00 0.00 H ATOM 2425 HD2 PHE A 156 25.829 5.885 -2.487 1.00 0.00 H ATOM 2426 HE2 PHE A 156 24.623 4.699 -0.685 1.00 0.00 H ATOM 2427 HZ PHE A 156 24.009 5.894 1.388 1.00 0.00 H ATOM 2428 HE1 PHE A 156 24.614 8.285 1.662 1.00 0.00 H ATOM 2429 HD1 PHE A 156 25.807 9.471 -0.151 1.00 0.00 H ATOM 2430 H PHE A 156 25.435 7.423 -4.531 1.00 0.00 H ATOM 2431 N TYR A 157 27.199 10.079 -5.230 1.00 27.82 N ATOM 2432 CA TYR A 157 28.010 11.060 -5.941 1.00 27.83 C ATOM 2433 C TYR A 157 27.137 12.105 -6.602 1.00 24.87 C ATOM 2434 O TYR A 157 27.433 13.299 -6.555 1.00 22.02 O ATOM 2435 CB TYR A 157 28.869 10.388 -7.008 1.00 32.48 C ATOM 2436 CG TYR A 157 29.980 9.555 -6.437 1.00 41.33 C ATOM 2437 CD1 TYR A 157 30.077 9.347 -5.069 1.00 44.79 C ATOM 2438 CD2 TYR A 157 30.940 8.990 -7.260 1.00 46.64 C ATOM 2439 CE1 TYR A 157 31.089 8.587 -4.535 1.00 49.06 C ATOM 2440 CE2 TYR A 157 31.961 8.236 -6.735 1.00 53.05 C ATOM 2441 CZ TYR A 157 32.030 8.034 -5.371 1.00 55.23 C ATOM 2442 OH TYR A 157 33.046 7.279 -4.836 1.00 62.68 O ATOM 2443 HA TYR A 157 28.656 11.540 -5.206 1.00 0.00 H ATOM 2444 HB3 TYR A 157 29.306 11.162 -7.639 1.00 0.00 H ATOM 2445 HB2 TYR A 157 28.230 9.745 -7.613 1.00 0.00 H ATOM 2446 HD2 TYR A 157 30.885 9.146 -8.337 1.00 0.00 H ATOM 2447 HE2 TYR A 157 32.713 7.799 -7.392 1.00 0.00 H ATOM 2448 HE1 TYR A 157 31.145 8.424 -3.459 1.00 0.00 H ATOM 2449 HD1 TYR A 157 29.337 9.795 -4.406 1.00 0.00 H ATOM 2450 HH TYR A 157 32.942 7.238 -3.852 1.00 0.00 H ATOM 2451 H TYR A 157 27.155 9.103 -5.587 1.00 0.00 H ATOM 2452 N THR A 158 26.068 11.642 -7.235 1.00 19.22 N ATOM 2453 CA THR A 158 25.109 12.542 -7.848 1.00 26.99 C ATOM 2454 C THR A 158 24.558 13.510 -6.806 1.00 29.55 C ATOM 2455 O THR A 158 24.376 14.700 -7.078 1.00 30.82 O ATOM 2456 CB THR A 158 23.956 11.761 -8.475 1.00 26.23 C ATOM 2457 OG1 THR A 158 24.478 10.860 -9.461 1.00 25.91 O ATOM 2458 CG2 THR A 158 22.971 12.710 -9.123 1.00 23.28 C ATOM 2459 HA THR A 158 25.622 13.101 -8.631 1.00 0.00 H ATOM 2460 HB THR A 158 23.440 11.198 -7.697 1.00 0.00 H ATOM 2461 HG1 THR A 158 25.110 10.232 -9.030 1.00 0.00 H ATOM 2462 HG23 THR A 158 22.577 13.393 -8.370 1.00 0.00 H ATOM 2463 HG21 THR A 158 23.476 13.280 -9.903 1.00 0.00 H ATOM 2464 HG22 THR A 158 22.153 12.139 -9.561 1.00 0.00 H ATOM 2465 H THR A 158 25.914 10.615 -7.293 1.00 0.00 H ATOM 2466 N LEU A 159 24.295 12.999 -5.608 1.00 25.48 N ATOM 2467 CA LEU A 159 23.783 13.852 -4.545 1.00 23.52 C ATOM 2468 C LEU A 159 24.790 14.958 -4.248 1.00 27.41 C ATOM 2469 O LEU A 159 24.427 16.130 -4.191 1.00 29.45 O ATOM 2470 CB LEU A 159 23.467 13.046 -3.284 1.00 16.18 C ATOM 2471 CG LEU A 159 22.906 13.913 -2.157 1.00 18.77 C ATOM 2472 CD1 LEU A 159 21.710 14.707 -2.648 1.00 14.16 C ATOM 2473 CD2 LEU A 159 22.539 13.059 -0.940 1.00 18.33 C ATOM 2474 HA LEU A 159 22.848 14.302 -4.880 1.00 0.00 H ATOM 2475 HB2 LEU A 159 22.733 12.280 -3.534 1.00 0.00 H ATOM 2476 HB3 LEU A 159 24.383 12.570 -2.935 1.00 0.00 H ATOM 2477 HG LEU A 159 23.679 14.616 -1.846 1.00 0.00 H ATOM 2478 HD21 LEU A 159 21.785 12.325 -1.226 1.00 0.00 H ATOM 2479 HD22 LEU A 159 23.429 12.545 -0.577 1.00 0.00 H ATOM 2480 HD23 LEU A 159 22.143 13.701 -0.153 1.00 0.00 H ATOM 2481 HD11 LEU A 159 22.016 15.350 -3.473 1.00 0.00 H ATOM 2482 HD12 LEU A 159 20.935 14.021 -2.989 1.00 0.00 H ATOM 2483 HD13 LEU A 159 21.323 15.319 -1.833 1.00 0.00 H ATOM 2484 H LEU A 159 24.455 11.987 -5.429 1.00 0.00 H ATOM 2485 N VAL A 160 26.058 14.584 -4.073 1.00 27.78 N ATOM 2486 CA VAL A 160 27.124 15.564 -3.885 1.00 24.86 C ATOM 2487 C VAL A 160 27.115 16.613 -4.999 1.00 27.09 C ATOM 2488 O VAL A 160 27.262 17.813 -4.743 1.00 29.28 O ATOM 2489 CB VAL A 160 28.518 14.908 -3.846 1.00 23.09 C ATOM 2490 CG1 VAL A 160 29.607 15.983 -3.850 1.00 23.37 C ATOM 2491 CG2 VAL A 160 28.659 14.018 -2.628 1.00 21.05 C ATOM 2492 HA VAL A 160 26.929 16.039 -2.924 1.00 0.00 H ATOM 2493 HB VAL A 160 28.632 14.288 -4.735 1.00 0.00 H ATOM 2494 HG11 VAL A 160 29.519 16.584 -4.755 1.00 0.00 H ATOM 2495 HG12 VAL A 160 29.488 16.622 -2.975 1.00 0.00 H ATOM 2496 HG13 VAL A 160 30.587 15.506 -3.822 1.00 0.00 H ATOM 2497 HG21 VAL A 160 28.525 14.615 -1.726 1.00 0.00 H ATOM 2498 HG22 VAL A 160 27.902 13.235 -2.662 1.00 0.00 H ATOM 2499 HG23 VAL A 160 29.651 13.566 -2.623 1.00 0.00 H ATOM 2500 H VAL A 160 26.293 13.571 -4.070 1.00 0.00 H ATOM 2501 N ARG A 161 26.933 16.156 -6.234 1.00 22.96 N ATOM 2502 CA ARG A 161 26.886 17.060 -7.375 1.00 26.83 C ATOM 2503 C ARG A 161 25.694 18.005 -7.303 1.00 29.88 C ATOM 2504 O ARG A 161 25.793 19.159 -7.719 1.00 34.35 O ATOM 2505 CB ARG A 161 26.877 16.279 -8.690 1.00 29.49 C ATOM 2506 CG ARG A 161 28.221 15.642 -9.003 1.00 34.38 C ATOM 2507 CD ARG A 161 28.192 14.784 -10.260 1.00 39.04 C ATOM 2508 NE ARG A 161 29.469 14.097 -10.444 1.00 43.69 N ATOM 2509 CZ ARG A 161 29.613 12.777 -10.526 1.00 43.48 C ATOM 2510 NH1 ARG A 161 30.822 12.256 -10.682 1.00 45.75 N ATOM 2511 NH2 ARG A 161 28.554 11.978 -10.461 1.00 41.14 N ATOM 2512 HA ARG A 161 27.789 17.670 -7.340 1.00 0.00 H ATOM 2513 HB2 ARG A 161 26.125 15.493 -8.624 1.00 0.00 H ATOM 2514 HB3 ARG A 161 26.617 16.961 -9.499 1.00 0.00 H ATOM 2515 HG2 ARG A 161 28.958 16.433 -9.139 1.00 0.00 H ATOM 2516 HG3 ARG A 161 28.514 15.015 -8.161 1.00 0.00 H ATOM 2517 HD2 ARG A 161 27.999 15.420 -11.124 1.00 0.00 H ATOM 2518 HD3 ARG A 161 27.397 14.044 -10.171 1.00 0.00 H ATOM 2519 HE ARG A 161 30.326 14.682 -10.516 1.00 0.00 H ATOM 2520 HH12 ARG A 161 30.939 11.225 -10.747 1.00 0.00 H ATOM 2521 HH11 ARG A 161 31.653 12.879 -10.740 1.00 0.00 H ATOM 2522 HH22 ARG A 161 28.676 10.947 -10.526 1.00 0.00 H ATOM 2523 HH21 ARG A 161 27.603 12.383 -10.345 1.00 0.00 H ATOM 2524 H ARG A 161 26.822 15.134 -6.388 1.00 0.00 H ATOM 2525 N GLU A 162 24.574 17.519 -6.770 1.00 27.39 N ATOM 2526 CA GLU A 162 23.376 18.344 -6.618 1.00 26.39 C ATOM 2527 C GLU A 162 23.589 19.457 -5.586 1.00 28.07 C ATOM 2528 O GLU A 162 23.180 20.599 -5.798 1.00 24.28 O ATOM 2529 CB GLU A 162 22.165 17.481 -6.250 1.00 22.99 C ATOM 2530 CG GLU A 162 21.622 16.654 -7.419 1.00 22.04 C ATOM 2531 CD GLU A 162 21.116 17.526 -8.563 1.00 28.11 C ATOM 2532 OE1 GLU A 162 20.096 18.229 -8.376 1.00 28.46 O ATOM 2533 OE2 GLU A 162 21.736 17.505 -9.650 1.00 30.42 O ATOM 2534 HA GLU A 162 23.177 18.820 -7.578 1.00 0.00 H ATOM 2535 HB2 GLU A 162 22.458 16.799 -5.452 1.00 0.00 H ATOM 2536 HB3 GLU A 162 21.370 18.136 -5.893 1.00 0.00 H ATOM 2537 HG2 GLU A 162 22.419 16.012 -7.794 1.00 0.00 H ATOM 2538 HG3 GLU A 162 20.799 16.037 -7.059 1.00 0.00 H ATOM 2539 H GLU A 162 24.551 16.528 -6.454 1.00 0.00 H ATOM 2540 N ILE A 163 24.235 19.113 -4.477 1.00 28.94 N ATOM 2541 CA ILE A 163 24.619 20.093 -3.466 1.00 31.08 C ATOM 2542 C ILE A 163 25.507 21.199 -4.059 1.00 36.37 C ATOM 2543 O ILE A 163 25.245 22.389 -3.870 1.00 34.84 O ATOM 2544 CB ILE A 163 25.335 19.407 -2.288 1.00 30.12 C ATOM 2545 CG1 ILE A 163 24.404 18.366 -1.653 1.00 30.00 C ATOM 2546 CG2 ILE A 163 25.808 20.441 -1.265 1.00 23.99 C ATOM 2547 CD1 ILE A 163 25.059 17.503 -0.590 1.00 29.47 C ATOM 2548 HA ILE A 163 23.705 20.559 -3.098 1.00 0.00 H ATOM 2549 HB ILE A 163 26.222 18.892 -2.657 1.00 0.00 H ATOM 2550 HG12 ILE A 163 23.566 18.892 -1.196 1.00 0.00 H ATOM 2551 HG13 ILE A 163 24.034 17.712 -2.443 1.00 0.00 H ATOM 2552 HD11 ILE A 163 25.893 16.957 -1.030 1.00 0.00 H ATOM 2553 HD12 ILE A 163 25.424 18.138 0.217 1.00 0.00 H ATOM 2554 HD13 ILE A 163 24.328 16.797 -0.196 1.00 0.00 H ATOM 2555 HG21 ILE A 163 26.501 21.133 -1.744 1.00 0.00 H ATOM 2556 HG22 ILE A 163 24.948 20.991 -0.883 1.00 0.00 H ATOM 2557 HG23 ILE A 163 26.311 19.933 -0.442 1.00 0.00 H ATOM 2558 H ILE A 163 24.475 18.113 -4.324 1.00 0.00 H ATOM 2559 N ARG A 164 26.551 20.802 -4.781 1.00 39.29 N ATOM 2560 CA ARG A 164 27.413 21.763 -5.468 1.00 39.64 C ATOM 2561 C ARG A 164 26.626 22.742 -6.335 1.00 40.22 C ATOM 2562 O ARG A 164 26.840 23.949 -6.254 1.00 41.51 O ATOM 2563 CB ARG A 164 28.439 21.045 -6.338 1.00 38.20 C ATOM 2564 CG ARG A 164 29.537 20.337 -5.582 1.00 40.50 C ATOM 2565 CD ARG A 164 30.415 19.620 -6.587 1.00 45.34 C ATOM 2566 NE ARG A 164 31.505 18.861 -5.984 1.00 45.35 N ATOM 2567 CZ ARG A 164 32.136 17.874 -6.610 1.00 45.01 C ATOM 2568 NH1 ARG A 164 31.763 17.532 -7.836 1.00 43.65 N ATOM 2569 NH2 ARG A 164 33.124 17.221 -6.015 1.00 46.66 N ATOM 2570 HA ARG A 164 27.918 22.331 -4.687 1.00 0.00 H ATOM 2571 HB2 ARG A 164 27.912 20.305 -6.941 1.00 0.00 H ATOM 2572 HB3 ARG A 164 28.902 21.783 -6.993 1.00 0.00 H ATOM 2573 HG2 ARG A 164 30.130 21.063 -5.025 1.00 0.00 H ATOM 2574 HG3 ARG A 164 29.103 19.616 -4.889 1.00 0.00 H ATOM 2575 HD2 ARG A 164 30.844 20.363 -7.259 1.00 0.00 H ATOM 2576 HD3 ARG A 164 29.792 18.932 -7.158 1.00 0.00 H ATOM 2577 HE ARG A 164 31.802 19.104 -5.018 1.00 0.00 H ATOM 2578 HH12 ARG A 164 32.253 16.760 -8.332 1.00 0.00 H ATOM 2579 HH11 ARG A 164 30.981 18.036 -8.301 1.00 0.00 H ATOM 2580 HH22 ARG A 164 33.612 16.450 -6.513 1.00 0.00 H ATOM 2581 HH21 ARG A 164 33.411 17.480 -5.050 1.00 0.00 H ATOM 2582 H ARG A 164 26.759 19.786 -4.859 1.00 0.00 H ATOM 2583 N LYS A 165 25.725 22.223 -7.169 1.00 39.16 N ATOM 2584 CA LYS A 165 24.926 23.070 -8.055 1.00 36.92 C ATOM 2585 C LYS A 165 24.051 24.037 -7.273 1.00 38.28 C ATOM 2586 O LYS A 165 23.826 25.167 -7.701 1.00 41.50 O ATOM 2587 CB LYS A 165 24.041 22.232 -8.978 1.00 36.84 C ATOM 2588 CG LYS A 165 24.808 21.339 -9.936 1.00 44.58 C ATOM 2589 CD LYS A 165 23.944 20.907 -11.117 1.00 48.87 C ATOM 2590 CE LYS A 165 22.656 20.256 -10.665 1.00 52.20 C ATOM 2591 NZ LYS A 165 21.890 19.700 -11.816 1.00 54.86 N ATOM 2592 HA LYS A 165 25.634 23.641 -8.656 1.00 0.00 H ATOM 2593 HB2 LYS A 165 23.403 21.601 -8.359 1.00 0.00 H ATOM 2594 HB3 LYS A 165 23.421 22.910 -9.565 1.00 0.00 H ATOM 2595 HG2 LYS A 165 25.674 21.884 -10.312 1.00 0.00 H ATOM 2596 HG3 LYS A 165 25.144 20.451 -9.400 1.00 0.00 H ATOM 2597 HD2 LYS A 165 23.704 21.784 -11.718 1.00 0.00 H ATOM 2598 HD3 LYS A 165 24.505 20.196 -11.723 1.00 0.00 H ATOM 2599 HE2 LYS A 165 22.042 21.000 -10.157 1.00 0.00 H ATOM 2600 HE3 LYS A 165 22.892 19.448 -9.973 1.00 0.00 H ATOM 2601 HZ1 LYS A 165 21.656 20.467 -12.478 1.00 0.00 H ATOM 2602 HZ2 LYS A 165 22.468 18.985 -12.302 1.00 0.00 H ATOM 2603 HZ3 LYS A 165 21.013 19.262 -11.468 1.00 0.00 H ATOM 2604 H LYS A 165 25.587 21.192 -7.190 1.00 0.00 H ATOM 2605 N HIS A 166 23.543 23.584 -6.134 1.00 36.16 N ATOM 2606 CA HIS A 166 22.711 24.427 -5.289 1.00 35.18 C ATOM 2607 C HIS A 166 23.546 25.526 -4.628 1.00 39.97 C ATOM 2608 O HIS A 166 23.086 26.653 -4.492 1.00 43.82 O ATOM 2609 CB HIS A 166 21.977 23.579 -4.243 1.00 34.26 C ATOM 2610 CG HIS A 166 21.103 24.371 -3.319 1.00 36.11 C ATOM 2611 ND1 HIS A 166 21.391 24.534 -1.982 1.00 37.65 N ATOM 2612 CD2 HIS A 166 19.945 25.040 -3.539 1.00 41.24 C ATOM 2613 CE1 HIS A 166 20.449 25.270 -1.415 1.00 41.81 C ATOM 2614 NE2 HIS A 166 19.563 25.592 -2.340 1.00 45.18 N ATOM 2615 HA HIS A 166 21.962 24.913 -5.914 1.00 0.00 H ATOM 2616 HB2 HIS A 166 21.354 22.853 -4.766 1.00 0.00 H ATOM 2617 HB3 HIS A 166 22.721 23.053 -3.645 1.00 0.00 H ATOM 2618 HD2 HIS A 166 19.416 25.124 -4.488 1.00 0.00 H ATOM 2619 HE1 HIS A 166 20.411 25.561 -0.365 1.00 0.00 H ATOM 2620 H HIS A 166 23.744 22.607 -5.839 1.00 0.00 H ATOM 2621 N LYS A 167 24.771 25.203 -4.221 1.00 41.64 N ATOM 2622 CA LYS A 167 25.672 26.220 -3.681 1.00 48.36 C ATOM 2623 C LYS A 167 25.999 27.243 -4.759 1.00 54.86 C ATOM 2624 O LYS A 167 26.024 28.448 -4.505 1.00 53.58 O ATOM 2625 CB LYS A 167 26.969 25.594 -3.171 1.00 46.75 C ATOM 2626 CG LYS A 167 26.853 24.825 -1.865 1.00 45.95 C ATOM 2627 CD LYS A 167 28.213 24.259 -1.488 1.00 46.64 C ATOM 2628 CE LYS A 167 28.255 23.739 -0.064 1.00 47.37 C ATOM 2629 NZ LYS A 167 29.629 23.260 0.277 1.00 49.68 N ATOM 2630 HA LYS A 167 25.169 26.707 -2.845 1.00 0.00 H ATOM 2631 HB2 LYS A 167 27.334 24.907 -3.935 1.00 0.00 H ATOM 2632 HB3 LYS A 167 27.695 26.394 -3.027 1.00 0.00 H ATOM 2633 HG2 LYS A 167 26.507 25.495 -1.078 1.00 0.00 H ATOM 2634 HG3 LYS A 167 26.140 24.009 -1.985 1.00 0.00 H ATOM 2635 HD2 LYS A 167 28.450 23.439 -2.166 1.00 0.00 H ATOM 2636 HD3 LYS A 167 28.960 25.045 -1.595 1.00 0.00 H ATOM 2637 HE2 LYS A 167 27.551 22.913 0.038 1.00 0.00 H ATOM 2638 HE3 LYS A 167 27.974 24.540 0.619 1.00 0.00 H ATOM 2639 HZ1 LYS A 167 29.898 22.493 -0.372 1.00 0.00 H ATOM 2640 HZ2 LYS A 167 30.302 24.047 0.184 1.00 0.00 H ATOM 2641 HZ3 LYS A 167 29.639 22.908 1.255 1.00 0.00 H ATOM 2642 H LYS A 167 25.091 24.216 -4.288 1.00 0.00 H ATOM 2643 N GLU A 168 26.267 26.743 -5.962 1.00 59.62 N ATOM 2644 CA GLU A 168 26.526 27.588 -7.118 1.00 63.31 C ATOM 2645 C GLU A 168 25.337 28.504 -7.335 1.00 64.70 C ATOM 2646 O GLU A 168 25.486 29.721 -7.441 1.00 64.46 O ATOM 2647 CB GLU A 168 26.748 26.725 -8.359 1.00 67.57 C ATOM 2648 CG GLU A 168 27.113 27.504 -9.610 1.00 74.95 C ATOM 2649 CD GLU A 168 28.569 27.933 -9.626 1.00 80.51 C ATOM 2650 OE1 GLU A 168 29.423 27.151 -9.155 1.00 80.92 O ATOM 2651 OE2 GLU A 168 28.858 29.052 -10.105 1.00 82.74 O ATOM 2652 HA GLU A 168 27.422 28.182 -6.941 1.00 0.00 H ATOM 2653 HB2 GLU A 168 27.555 26.024 -8.147 1.00 0.00 H ATOM 2654 HB3 GLU A 168 25.830 26.171 -8.558 1.00 0.00 H ATOM 2655 HG2 GLU A 168 26.924 26.876 -10.480 1.00 0.00 H ATOM 2656 HG3 GLU A 168 26.486 28.394 -9.663 1.00 0.00 H ATOM 2657 H GLU A 168 26.292 25.710 -6.081 1.00 0.00 H ATOM 2658 N LYS A 169 24.153 27.901 -7.396 1.00 66.12 N ATOM 2659 CA LYS A 169 22.906 28.643 -7.520 1.00 69.76 C ATOM 2660 C LYS A 169 22.767 29.625 -6.357 1.00 73.03 C ATOM 2661 O LYS A 169 22.772 30.830 -6.570 1.00 74.80 O ATOM 2662 CB LYS A 169 21.714 27.683 -7.563 1.00 71.17 C ATOM 2663 CG LYS A 169 20.495 28.213 -8.305 1.00 74.66 C ATOM 2664 CD LYS A 169 19.393 27.164 -8.358 1.00 78.02 C ATOM 2665 CE LYS A 169 18.212 27.621 -9.206 1.00 81.73 C ATOM 2666 NZ LYS A 169 17.282 28.513 -8.454 1.00 83.62 N ATOM 2667 HA LYS A 169 22.921 29.206 -8.453 1.00 0.00 H ATOM 2668 HB2 LYS A 169 22.036 26.764 -8.052 1.00 0.00 H ATOM 2669 HB3 LYS A 169 21.418 27.463 -6.537 1.00 0.00 H ATOM 2670 HG2 LYS A 169 20.121 29.098 -7.791 1.00 0.00 H ATOM 2671 HG3 LYS A 169 20.784 28.480 -9.322 1.00 0.00 H ATOM 2672 HD2 LYS A 169 19.799 26.247 -8.785 1.00 0.00 H ATOM 2673 HD3 LYS A 169 19.044 26.968 -7.344 1.00 0.00 H ATOM 2674 HE2 LYS A 169 17.660 26.742 -9.541 1.00 0.00 H ATOM 2675 HE3 LYS A 169 18.592 28.162 -10.073 1.00 0.00 H ATOM 2676 HZ1 LYS A 169 16.907 28.004 -7.628 1.00 0.00 H ATOM 2677 HZ2 LYS A 169 17.796 29.359 -8.137 1.00 0.00 H ATOM 2678 HZ3 LYS A 169 16.497 28.795 -9.075 1.00 0.00 H ATOM 2679 H LYS A 169 24.116 26.863 -7.354 1.00 0.00 H ATOM 2680 N MET A 170 22.653 29.102 -5.136 1.00 73.73 N ATOM 2681 CA MET A 170 22.573 29.923 -3.921 1.00 75.42 C ATOM 2682 C MET A 170 23.399 31.207 -3.996 1.00 81.37 C ATOM 2683 O MET A 170 22.899 32.290 -3.693 1.00 81.71 O ATOM 2684 CB MET A 170 23.006 29.113 -2.696 1.00 73.20 C ATOM 2685 CG MET A 170 21.975 28.116 -2.204 1.00 71.69 C ATOM 2686 SD MET A 170 20.895 28.815 -0.948 1.00 99.07 S ATOM 2687 CE MET A 170 22.074 29.148 0.360 1.00 77.65 C ATOM 2688 HA MET A 170 21.528 30.218 -3.830 1.00 0.00 H ATOM 2689 HB2 MET A 170 23.913 28.566 -2.953 1.00 0.00 H ATOM 2690 HB3 MET A 170 23.220 29.810 -1.885 1.00 0.00 H ATOM 2691 HG2 MET A 170 22.493 27.255 -1.782 1.00 0.00 H ATOM 2692 HG3 MET A 170 21.367 27.794 -3.049 1.00 0.00 H ATOM 2693 HE1 MET A 170 22.551 28.216 0.663 1.00 0.00 H ATOM 2694 HE2 MET A 170 22.830 29.844 -0.003 1.00 0.00 H ATOM 2695 HE3 MET A 170 21.555 29.586 1.213 1.00 0.00 H ATOM 2696 H MET A 170 22.619 28.067 -5.040 1.00 0.00 H ATOM 2697 N SER A 171 24.665 31.081 -4.387 1.00 86.43 N ATOM 2698 CA SER A 171 25.537 32.243 -4.533 1.00 92.36 C ATOM 2699 C SER A 171 24.917 33.251 -5.488 1.00100.52 C ATOM 2700 O SER A 171 24.727 34.411 -5.138 1.00103.38 O ATOM 2701 CB SER A 171 26.918 31.831 -5.047 1.00 90.61 C ATOM 2702 OG SER A 171 27.594 31.016 -4.107 1.00 89.08 O ATOM 2703 HA SER A 171 25.653 32.700 -3.550 1.00 0.00 H ATOM 2704 HB2 SER A 171 27.510 32.727 -5.232 1.00 0.00 H ATOM 2705 HB3 SER A 171 26.800 31.277 -5.978 1.00 0.00 H ATOM 2706 HG SER A 171 27.063 30.198 -3.939 1.00 0.00 H ATOM 2707 H SER A 171 25.042 30.134 -4.593 1.00 0.00 H ATOM 2708 N LYS A 172 24.598 32.789 -6.692 1.00106.19 N ATOM 2709 CA LYS A 172 24.037 33.636 -7.738 1.00114.29 C ATOM 2710 C LYS A 172 22.527 33.788 -7.590 1.00121.54 C ATOM 2711 O LYS A 172 21.903 34.601 -8.273 1.00121.40 O ATOM 2712 CB LYS A 172 24.344 33.033 -9.107 1.00113.55 C ATOM 2713 CG LYS A 172 25.741 32.448 -9.234 1.00113.66 C ATOM 2714 CD LYS A 172 25.903 31.653 -10.524 1.00113.13 C ATOM 2715 CE LYS A 172 25.520 32.472 -11.749 1.00114.38 C ATOM 2716 NZ LYS A 172 24.046 32.527 -11.972 1.00114.81 N ATOM 2717 HA LYS A 172 24.492 34.622 -7.646 1.00 0.00 H ATOM 2718 HB2 LYS A 172 23.622 32.239 -9.300 1.00 0.00 H ATOM 2719 HB3 LYS A 172 24.232 33.815 -9.858 1.00 0.00 H ATOM 2720 HG2 LYS A 172 26.467 33.261 -9.226 1.00 0.00 H ATOM 2721 HG3 LYS A 172 25.927 31.788 -8.386 1.00 0.00 H ATOM 2722 HD2 LYS A 172 26.944 31.343 -10.619 1.00 0.00 H ATOM 2723 HD3 LYS A 172 25.265 30.770 -10.477 1.00 0.00 H ATOM 2724 HE2 LYS A 172 25.989 32.026 -12.626 1.00 0.00 H ATOM 2725 HE3 LYS A 172 25.891 33.489 -11.618 1.00 0.00 H ATOM 2726 HZ1 LYS A 172 23.681 31.563 -12.108 1.00 0.00 H ATOM 2727 HZ2 LYS A 172 23.587 32.959 -11.145 1.00 0.00 H ATOM 2728 HZ3 LYS A 172 23.846 33.097 -12.818 1.00 0.00 H ATOM 2729 H LYS A 172 24.755 31.782 -6.897 1.00 0.00 H ATOM 2730 N ASP A 173 21.948 33.000 -6.690 1.00128.21 N ATOM 2731 CA ASP A 173 20.505 32.969 -6.494 1.00134.80 C ATOM 2732 C ASP A 173 20.058 34.067 -5.540 1.00141.78 C ATOM 2733 O ASP A 173 20.614 34.227 -4.452 1.00142.74 O ATOM 2734 CB ASP A 173 20.065 31.599 -5.969 1.00134.04 C ATOM 2735 CG ASP A 173 19.147 30.871 -6.932 1.00134.04 C ATOM 2736 OD1 ASP A 173 18.662 29.777 -6.574 1.00133.67 O ATOM 2737 OD2 ASP A 173 18.912 31.393 -8.044 1.00134.40 O ATOM 2738 HA ASP A 173 20.031 33.144 -7.460 1.00 0.00 H ATOM 2739 HB2 ASP A 173 20.952 30.988 -5.802 1.00 0.00 H ATOM 2740 HB3 ASP A 173 19.540 31.739 -5.024 1.00 0.00 H ATOM 2741 H ASP A 173 22.547 32.383 -6.105 1.00 0.00 H ATOM 2742 N GLY A 174 19.050 34.825 -5.956 1.00146.99 N ATOM 2743 CA GLY A 174 18.419 34.624 -7.248 1.00150.38 C ATOM 2744 C GLY A 174 17.759 35.908 -7.700 1.00154.92 C ATOM 2745 O GLY A 174 17.625 36.174 -8.895 1.00154.82 O ATOM 2746 HA3 GLY A 174 17.667 33.839 -7.166 1.00 0.00 H ATOM 2747 HA2 GLY A 174 19.173 34.328 -7.977 1.00 0.00 H ATOM 2748 H GLY A 174 18.702 35.585 -5.338 1.00 0.00 H ATOM 2749 N LYS A 175 17.346 36.706 -6.724 1.00159.61 N ATOM 2750 CA LYS A 175 16.773 38.016 -6.983 1.00164.71 C ATOM 2751 C LYS A 175 17.381 39.024 -6.016 1.00169.92 C ATOM 2752 O LYS A 175 17.436 40.221 -6.302 1.00172.72 O ATOM 2753 CB LYS A 175 15.261 37.973 -6.832 1.00164.33 C ATOM 2754 HA LYS A 175 16.999 38.317 -8.006 1.00 0.00 H ATOM 2755 HB2 LYS A 175 14.846 37.257 -7.542 1.00 0.00 H ATOM 2756 HB3 LYS A 175 15.007 37.668 -5.817 1.00 0.00 H ATOM 2757 H LYS A 175 17.435 36.383 -5.740 1.00 0.00 H ATOM 2758 N LYS A 176 17.847 38.526 -4.874 1.00170.94 N ATOM 2759 CA LYS A 176 18.408 39.380 -3.834 1.00172.46 C ATOM 2760 C LYS A 176 19.935 39.385 -3.825 1.00173.54 C ATOM 2761 O LYS A 176 20.549 39.223 -2.771 1.00174.31 O ATOM 2762 CB LYS A 176 17.866 38.981 -2.464 1.00171.32 C ATOM 2763 HA LYS A 176 18.094 40.398 -4.063 1.00 0.00 H ATOM 2764 HB2 LYS A 176 16.781 39.084 -2.460 1.00 0.00 H ATOM 2765 HB3 LYS A 176 18.135 37.945 -2.256 1.00 0.00 H ATOM 2766 H LYS A 176 17.810 37.498 -4.719 1.00 0.00 H ATOM 2767 N LYS A 177 20.528 39.559 -5.005 1.00173.73 N ATOM 2768 CA LYS A 177 21.967 39.817 -5.151 1.00174.17 C ATOM 2769 C LYS A 177 22.469 39.658 -6.615 1.00166.20 C ATOM 2770 O LYS A 177 22.104 40.491 -7.446 1.00167.50 O ATOM 2771 CB LYS A 177 22.792 39.034 -4.124 1.00173.13 C ATOM 2772 HA LYS A 177 22.125 40.871 -4.922 1.00 0.00 H ATOM 2773 HB2 LYS A 177 22.491 39.327 -3.118 1.00 0.00 H ATOM 2774 HB3 LYS A 177 22.619 37.966 -4.259 1.00 0.00 H ATOM 2775 H LYS A 177 19.944 39.510 -5.864 1.00 0.00 H ATOM 2776 N LYS A 178 23.266 38.643 -6.975 1.00164.39 N ATOM 2777 CA LYS A 178 23.734 37.566 -6.111 1.00162.60 C ATOM 2778 C LYS A 178 25.140 37.088 -6.477 1.00161.43 C ATOM 2779 O LYS A 178 25.815 36.478 -5.644 1.00160.58 O ATOM 2780 CB LYS A 178 22.750 36.412 -6.112 1.00161.40 C ATOM 2781 HA LYS A 178 23.795 37.972 -5.101 1.00 0.00 H ATOM 2782 HB2 LYS A 178 21.783 36.760 -5.749 1.00 0.00 H ATOM 2783 HB3 LYS A 178 22.642 36.029 -7.127 1.00 0.00 H ATOM 2784 H LYS A 178 23.581 38.621 -7.966 1.00 0.00 H ATOM 2785 N LYS A 179 25.562 37.362 -7.715 1.00161.14 N ATOM 2786 CA LYS A 179 26.922 37.072 -8.195 1.00160.46 C ATOM 2787 C LYS A 179 26.954 36.263 -9.489 1.00159.91 C ATOM 2788 O LYS A 179 26.610 35.085 -9.493 1.00158.76 O ATOM 2789 CB LYS A 179 27.730 36.371 -7.146 1.00159.25 C ATOM 2790 HA LYS A 179 27.364 38.044 -8.412 1.00 0.00 H ATOM 2791 HB2 LYS A 179 27.801 37.003 -6.261 1.00 0.00 H ATOM 2792 HB3 LYS A 179 27.245 35.430 -6.884 1.00 0.00 H ATOM 2793 H LYS A 179 24.892 37.805 -8.376 1.00 0.00 H ATOM 2794 N LYS A 180 27.399 36.898 -10.572 1.00160.68 N ATOM 2795 CA LYS A 180 27.535 36.243 -11.875 1.00159.71 C ATOM 2796 C LYS A 180 26.196 36.092 -12.593 1.00158.71 C ATOM 2797 O LYS A 180 26.126 36.176 -13.819 1.00158.63 O ATOM 2798 CB LYS A 180 28.231 34.890 -11.733 1.00158.45 C ATOM 2799 HA LYS A 180 28.156 36.891 -12.493 1.00 0.00 H ATOM 2800 HB2 LYS A 180 29.224 35.036 -11.308 1.00 0.00 H ATOM 2801 HB3 LYS A 180 27.644 34.248 -11.076 1.00 0.00 H ATOM 2802 H LYS A 180 27.661 37.901 -10.489 1.00 0.00 H TER 2803 LYS A 180 HETATM 2804 MG MG A 1 18.308 1.342 8.691 1.00 32.23 MG HETATM 2805 MG MG A 2 11.818 7.424 7.750 1.00 37.97 MG HETATM 2806 O HOH 3 18.246 3.658 8.352 1.00 29.29 O HETATM 2807 O HOH 4 18.621 -0.878 9.277 1.00 24.70 O HETATM 2808 O HOH 5 12.131 -0.798 10.168 1.00 21.53 O HETATM 2809 O HOH 6 10.363 5.818 1.362 1.00 16.92 O HETATM 2810 O HOH 7 13.822 8.899 7.271 1.00 20.45 O HETATM 2811 O HOH 8 27.118 3.193 -9.037 1.00 27.50 O HETATM 2812 O HOH 9 -0.641 2.761 -0.147 1.00 16.43 O HETATM 2813 O HOH 10 10.885 9.226 9.269 1.00 39.47 O HETATM 2814 O HOH 11 25.066 -3.333 2.944 1.00 24.41 O HETATM 2815 O HOH 12 19.797 -3.972 8.479 1.00 26.66 O HETATM 2816 O HOH 13 21.580 -5.196 -9.682 1.00 33.67 O HETATM 2817 O HOH 14 23.346 2.098 9.633 1.00 42.44 O HETATM 2818 O HOH 15 18.694 4.264 -12.940 1.00 32.87 O HETATM 2819 O HOH 16 11.533 4.489 -19.199 1.00 42.67 O HETATM 2820 O HOH 17 18.427 17.986 -6.363 1.00 32.23 O HETATM 2821 O HOH 18 4.236 -1.174 2.199 1.00 30.15 O HETATM 2822 O HOH 19 12.324 23.514 12.099 1.00 32.34 O HETATM 2823 O HOH 20 10.923 -4.009 0.369 1.00 31.50 O HETATM 2824 O HOH 21 25.970 12.427 -11.390 1.00 46.30 O HETATM 2825 O HOH 22 17.780 11.273 -13.484 1.00 33.06 O HETATM 2826 O HOH 23 14.535 -7.310 1.054 1.00 28.29 O HETATM 2827 O HOH 24 7.652 0.471 4.562 1.00 29.89 O HETATM 2828 O HOH 25 7.918 6.690 5.917 1.00 24.34 O HETATM 2829 O HOH 26 27.101 37.346 -3.596 1.00 57.20 O HETATM 2830 O HOH 27 7.386 3.419 7.587 1.00 38.52 O HETATM 2831 O HOH 28 16.688 8.881 12.690 1.00 35.58 O HETATM 2832 O HOH 29 5.640 10.142 -3.936 1.00 28.00 O HETATM 2833 O HOH 30 39.408 19.703 -2.130 1.00 52.05 O HETATM 2834 O HOH 31 20.839 24.006 5.372 1.00 36.45 O HETATM 2835 O HOH 32 0.453 6.335 1.139 1.00 33.14 O HETATM 2836 O HOH 33 38.104 20.517 -7.720 1.00 58.33 O HETATM 2837 O HOH 34 -0.073 9.042 0.952 1.00 37.08 O HETATM 2838 O HOH 35 2.115 7.794 2.418 1.00 41.29 O HETATM 2839 O HOH 36 10.190 -2.266 2.251 1.00 47.41 O HETATM 2840 O HOH 37 13.390 9.128 10.636 1.00 32.30 O HETATM 2841 O HOH 38 28.127 1.257 -7.576 1.00 27.54 O HETATM 2842 O HOH 39 27.713 19.918 -9.885 1.00 50.92 O HETATM 2843 O HOH 40 9.695 -4.316 4.429 1.00 46.54 O HETATM 2844 O HOH 41 26.546 0.244 -10.697 1.00 51.68 O HETATM 2845 O HOH 42 17.346 -10.270 10.006 1.00 44.62 O HETATM 2846 O HOH 43 3.040 23.736 5.244 1.00 40.51 O HETATM 2847 O HOH 44 14.128 2.233 11.873 1.00 22.17 O HETATM 2848 O HOH 45 11.268 2.649 12.522 1.00 29.78 O HETATM 2849 O HOH 46 7.772 6.140 8.336 1.00 34.82 O HETATM 2850 O HOH 47 28.202 39.437 -11.112 1.00 51.69 O HETATM 2851 O HOH 48 20.799 15.187 18.764 1.00 39.21 O HETATM 2852 O HOH 49 16.791 1.304 -14.857 1.00 62.17 O HETATM 2853 O HOH 50 12.471 20.569 15.983 1.00 53.85 O HETATM 2854 O HOH 51 8.235 -2.712 5.830 1.00 57.29 O HETATM 2855 O HOH 52 24.203 9.462 15.252 1.00 40.54 O HETATM 2856 O HOH 53 14.472 19.628 17.461 1.00 49.87 O HETATM 2857 O HOH 54 37.756 12.489 -9.521 1.00 58.93 O HETATM 2858 O HOH 55 28.823 -8.614 0.818 1.00 33.64 O HETATM 2859 O HOH 56 4.138 19.103 5.775 1.00 53.69 O HETATM 2860 O HOH 57 19.863 17.591 20.126 1.00 56.65 O HETATM 2861 O HOH 58 19.846 10.623 18.315 1.00 44.50 O HETATM 2862 O HOH 59 18.345 -9.984 1.858 1.00 39.44 O HETATM 2863 O HOH 60 30.159 18.914 -9.630 1.00 49.46 O HETATM 2864 O HOH 61 22.055 -2.702 9.552 1.00 38.72 O HETATM 2865 O HOH 62 7.662 19.236 -4.065 1.00 45.39 O HETATM 2866 O HOH 63 25.943 23.241 6.259 1.00 40.40 O HETATM 2867 O HOH 64 34.769 11.360 -10.037 1.00 55.67 O HETATM 2868 O HOH 65 16.749 5.200 -14.344 1.00 49.85 O HETATM 2869 O HOH 66 3.600 -1.853 -12.051 1.00 41.48 O HETATM 2870 O HOH 67 21.372 2.185 -11.841 1.00 51.92 O HETATM 2871 O HOH 68 17.923 -11.105 -5.592 1.00 46.53 O HETATM 2872 O HOH 69 16.420 -0.832 -13.240 1.00 53.38 O HETATM 2873 O HOH 70 13.975 11.882 -14.364 1.00 42.12 O HETATM 2874 O HOH 71 2.834 0.441 -11.154 1.00 47.21 O HETATM 2875 O HOH 72 12.192 9.603 17.380 1.00 51.11 O HETATM 2876 O HOH 73 18.570 18.849 -10.541 1.00 49.04 O HETATM 2877 O HOH 74 14.774 14.340 -13.308 1.00 46.16 O HETATM 2878 O HOH 75 12.185 -5.325 3.972 1.00 33.92 O HETATM 2879 O HOH 76 14.395 1.101 16.331 1.00 54.28 O HETATM 2880 O HOH 77 24.047 15.296 -11.083 1.00 46.95 O HETATM 2881 O HOH 78 21.851 17.219 13.696 1.00 69.26 O HETATM 2882 O HOH 79 17.246 19.519 19.131 1.00 47.68 O HETATM 2883 O HOH 80 2.083 2.043 -7.954 1.00 43.89 O HETATM 2884 O HOH 81 4.472 9.573 -11.571 1.00 34.55 O HETATM 2885 O HOH 82 7.178 13.700 -18.122 1.00 46.25 O HETATM 2886 O HOH 83 6.682 7.972 9.859 1.00 56.45 O HETATM 2887 O HOH 84 5.879 1.990 5.314 1.00 40.45 O HETATM 2888 O HOH 85 28.059 -6.985 -2.959 1.00 47.01 O HETATM 2889 O HOH 86 27.989 -3.865 9.323 1.00 54.38 O HETATM 2890 O HOH 87 27.507 -8.332 7.171 1.00 62.37 O HETATM 2891 O HOH 88 25.205 -8.744 8.494 1.00 63.99 O HETATM 2892 O HOH 89 17.271 -10.697 -0.530 1.00 41.16 O HETATM 2893 O HOH 90 10.995 -2.167 12.699 1.00 45.51 O HETATM 2894 O HOH 91 34.681 20.006 -8.985 1.00 52.44 O HETATM 2895 O HOH 92 8.783 9.385 10.550 1.00 45.66 O HETATM 2896 C1 UNN A 93 24.262 14.237 15.368 1.00 -0.01 C HETATM 2897 C2 UNN A 93 24.320 14.376 13.871 1.00 0.04 C HETATM 2898 C3 UNN A 93 25.146 13.702 13.046 1.00 -0.04 C HETATM 2899 C4 UNN A 93 24.857 14.154 11.671 1.00 -0.02 C HETATM 2900 C5 UNN A 93 23.828 15.115 11.812 1.00 0.06 C HETATM 2901 N6 UNN A 93 23.530 15.224 13.151 1.00 -0.28 N HETATM 2902 H4 UNN A 93 22.817 15.852 13.550 1.00 0.22 H HETATM 2903 C8 UNN A 93 23.319 15.746 10.689 1.00 -0.03 C HETATM 2904 C9 UNN A 93 23.819 15.430 9.450 1.00 0.02 C HETATM 2905 CL2 UNN A 93 23.161 16.242 8.077 1.00 -0.08 CL HETATM 2906 C10 UNN A 93 24.825 14.489 9.287 1.00 -0.06 C HETATM 2907 C11 UNN A 93 25.355 13.845 10.387 1.00 0.02 C HETATM 2908 CL1 UNN A 93 26.612 12.662 10.139 1.00 -0.08 CL HETATM 2909 H6 UNN A 93 25.195 14.259 8.295 1.00 0.05 H HETATM 2910 H5 UNN A 93 22.531 16.484 10.788 1.00 0.05 H HETATM 2911 C14 UNN A 93 26.172 12.687 13.479 1.00 -0.00 C HETATM 2912 C15 UNN A 93 27.434 13.399 13.980 1.00 -0.03 C HETATM 2913 N16 UNN A 93 28.434 12.402 14.387 1.00 0.22 N HETATM 2914 H11 UNN A 93 29.263 12.872 14.716 1.00 0.20 H HETATM 2915 H12 UNN A 93 28.669 11.820 13.598 1.00 0.20 H HETATM 2916 H13 UNN A 93 28.057 11.830 15.126 1.00 0.20 H HETATM 2917 H9 UNN A 93 27.179 14.034 14.841 1.00 0.08 H HETATM 2918 H10 UNN A 93 27.847 14.023 13.174 1.00 0.08 H HETATM 2919 H7 UNN A 93 26.431 12.044 12.625 1.00 0.04 H HETATM 2920 H8 UNN A 93 25.756 12.071 14.289 1.00 0.04 H HETATM 2921 H1 UNN A 93 23.492 14.913 15.769 1.00 0.04 H HETATM 2922 H2 UNN A 93 25.240 14.498 15.799 1.00 0.04 H HETATM 2923 H3 UNN A 93 24.011 13.199 15.630 1.00 0.04 H CONECT 1 2 11 12 13 CONECT 11 1 CONECT 12 1 CONECT 13 1 CONECT 156 155 2805 CONECT 239 238 243 2804 CONECT 524 523 528 2804 CONECT 901 900 2805 CONECT 911 910 2805 CONECT 1478 1477 1486 2805 CONECT 2804 239 524 CONECT 2805 156 901 911 1478 CONECT 2896 2897 2921 2922 2923 CONECT 2897 2896 2898 2901 CONECT 2898 2897 2899 2911 CONECT 2899 2898 2900 2907 CONECT 2900 2899 2901 2903 CONECT 2901 2897 2900 2902 CONECT 2902 2901 CONECT 2903 2900 2904 2910 CONECT 2904 2903 2905 2906 CONECT 2905 2904 CONECT 2906 2904 2907 2909 CONECT 2907 2899 2906 2908 CONECT 2908 2907 CONECT 2909 2906 CONECT 2910 2903 CONECT 2911 2898 2912 2919 2920 CONECT 2912 2911 2913 2917 2918 CONECT 2913 2912 2914 2915 2916 CONECT 2914 2913 CONECT 2915 2913 CONECT 2916 2913 CONECT 2917 2912 CONECT 2918 2912 CONECT 2919 2911 CONECT 2920 2911 CONECT 2921 2896 CONECT 2922 2896 CONECT 2923 2896 MASTER 0 0 0 0 0 0 0 0 2922 1 40 14 END
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Related entries of code: 4dst
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1clu
RCSB PDB
PDBbind
166aa, >1CLU_1|Chain... at 92%
1d8e
RCSB PDB
PDBbind
11aa, >1D8E_3|Chain... at 100%
1he8
RCSB PDB
PDBbind
166aa, >1HE8_2|Chain... at 92%
1nvu
RCSB PDB
PDBbind
166aa, >1NVU_1|Chains... at 92%
1wq1
RCSB PDB
PDBbind
166aa, >1WQ1_1|Chain... at 92%
4dsu
RCSB PDB
PDBbind
189aa, >4DSU_1|Chain... at 100%
4epy
RCSB PDB
PDBbind
170aa, >4EPY_1|Chain... at 98%
4k81
RCSB PDB
PDBbind
171aa, >4K81_2|Chains... at 90%
4nyi
RCSB PDB
PDBbind
167aa, >4NYI_1|Chain... at 92%
4nyj
RCSB PDB
PDBbind
166aa, >4NYJ_2|Chain... at 92%
4nym
RCSB PDB
PDBbind
166aa, >4NYM_2|Chain... at 92%
5kyk
RCSB PDB
PDBbind
169aa, >5KYK_1|Chains... at 98%
6b0v
RCSB PDB
PDBbind
170aa, >6B0V_1|Chains... at 97%
6b0y
RCSB PDB
PDBbind
170aa, >6B0Y_1|Chains... at 97%
6d55
RCSB PDB
PDBbind
167aa, >6D55_3|Chain... at 92%
6d56
RCSB PDB
PDBbind
167aa, >6D56_3|Chain... at 92%
6d59
RCSB PDB
PDBbind
167aa, >6D59_3|Chain... at 92%
6d5e
RCSB PDB
PDBbind
167aa, >6D5E_3|Chain... at 92%
6d5g
RCSB PDB
PDBbind
167aa, >6D5G_3|Chain... at 92%
6d5h
RCSB PDB
PDBbind
167aa, >6D5H_3|Chain... at 92%
6d5j
RCSB PDB
PDBbind
167aa, >6D5J_3|Chain... at 92%
6fa2
RCSB PDB
PDBbind
171aa, >6FA2_3|Chain... at 96%
6fa3
RCSB PDB
PDBbind
172aa, >6FA3_2|Chain... at 96%
6fa4
RCSB PDB
PDBbind
173aa, >6FA4_2|Chains... at 96%
6quw
RCSB PDB
PDBbind
170aa, >6QUW_1|Chains... at 99%
6quv
RCSB PDB
PDBbind
170aa, >6QUV_1|Chains... at 99%
6pgp
RCSB PDB
PDBbind
183aa, >6PGP_1|Chains... at 90%
6pgo
RCSB PDB
PDBbind
183aa, >6PGO_1|Chains... at 90%
6p8z
RCSB PDB
PDBbind
183aa, >6P8Z_1|Chains... at 90%
6p8y
RCSB PDB
PDBbind
183aa, >6P8Y_1|Chains... at 90%
6p8x
RCSB PDB
PDBbind
183aa, >6P8X_1|Chains... at 90%
6gj8
RCSB PDB
PDBbind
169aa, >6GJ8_1|Chain... at 99%
6gj7
RCSB PDB
PDBbind
170aa, >6GJ7_1|Chain... at 99%
6gj6
RCSB PDB
PDBbind
170aa, >6GJ6_1|Chain... at 99%
6gj5
RCSB PDB
PDBbind
170aa, >6GJ5_1|Chains... at 98%
6d5w
RCSB PDB
PDBbind
167aa, >6D5W_2|Chain... at 92%
6ccx
RCSB PDB
PDBbind
187aa, >6CCX_2|Chain... at 97%
6oim
RCSB PDB
PDBbind
183aa, >6OIM_1|Chain... at 90%
6cc9
RCSB PDB
PDBbind
187aa, >6CC9_2|Chain... at 97%
6v5l
RCSB PDB
PDBbind
169aa, >6V5L_1|Chain... at 98%
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
4dst
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
GTPase KRas, isoform 2B
Ligand Name
9LI
EC.Number
E.C.3.6
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=1.1mM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2012) Proc.Natl.Acad.Sci.USA Vol. 109: pp. 5299-5304
Ligand Properties
Formula
C
1
1
H
1
3
Cl
2
N
2
Molecular Weight
244.140
Exact Mass
243.046
No. of atoms
28
No. of bonds
29
Polar Surface Area
43.43
LOGP Value
3.02 (
Computed with XLOGP3
)
2.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 0
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 2
No. of Rings: 2
Canonical SMILES
[NH3+]CCc1c(C)[nH]c2c1c(Cl)cc(c2)Cl
InChI String
InChI=1S/C11H12Cl2N2/c1-6-8(2-3-14)11-9(13)4-7(12)5-10(11)15-6/h4-5,15H,2-3,14H2,1H3/p+1
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):
P01112
Entrez Gene ID
NCBI Entrez Gene ID:
3265
ASD
Information of known allosteric effects of PDB entries
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