Browse entries in the PDBbind-CN Database
HEADER 3NFK_COMPLEX COMPND 3NFK_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 92 ASP ASN LEU VAL LEU ILE ARG MET LYS PRO ASP GLU ASN SEQRES 2 A 92 GLY ARG PHE GLY PHE ASN VAL LYS GLY GLY TYR ASP GLN SEQRES 3 A 92 LYS MET PRO VAL ILE VAL SER ARG VAL ALA PRO GLY THR SEQRES 4 A 92 PRO ALA ASP LEU CYS VAL PRO ARG LEU ASN GLU GLY ASP SEQRES 5 A 92 GLN VAL VAL LEU ILE ASN GLY ARG ASP ILE ALA GLU HIS SEQRES 6 A 92 THR HIS ASP GLN VAL VAL LEU PHE ILE LYS ALA SER CYS SEQRES 7 A 92 GLU ARG HIS SER GLY GLU LEU MET LEU LEU VAL ARG PRO SEQRES 8 A 92 ASN HET SER A 209 200 ATOM 1 N ASP A 513 48.264 -24.342 19.914 1.00 23.96 N ATOM 2 CA ASP A 513 48.245 -25.792 19.826 1.00 22.81 C ATOM 3 C ASP A 513 46.897 -26.289 20.311 1.00 25.07 C ATOM 4 O ASP A 513 46.123 -25.481 20.816 1.00 22.27 O ATOM 5 CB ASP A 513 49.418 -26.416 20.629 1.00 26.45 C ATOM 6 CG ASP A 513 49.324 -26.279 22.144 1.00 39.91 C ATOM 7 OD1 ASP A 513 48.640 -25.349 22.618 1.00 39.57 O ATOM 8 OD2 ASP A 513 49.942 -27.103 22.854 1.00 46.71 O ATOM 9 HA ASP A 513 48.384 -26.102 18.790 1.00 0.00 H ATOM 10 HB2 ASP A 513 49.461 -27.479 20.390 1.00 0.00 H ATOM 11 HB3 ASP A 513 50.341 -25.934 20.305 1.00 0.00 H ATOM 12 HN3 ASP A 513 48.115 -24.054 20.902 1.00 0.00 H ATOM 13 HN2 ASP A 513 47.507 -23.950 19.319 1.00 0.00 H ATOM 14 HN1 ASP A 513 49.184 -23.988 19.584 1.00 0.00 H ATOM 15 N ASN A 514 46.611 -27.595 20.121 1.00 22.55 N ATOM 16 CA ASN A 514 45.363 -28.292 20.470 1.00 20.93 C ATOM 17 C ASN A 514 44.167 -27.708 19.738 1.00 21.34 C ATOM 18 O ASN A 514 43.030 -27.795 20.188 1.00 23.82 O ATOM 19 CB ASN A 514 45.126 -28.337 22.004 1.00 29.15 C ATOM 20 CG ASN A 514 43.997 -29.271 22.400 1.00 53.59 C ATOM 21 OD1 ASN A 514 43.821 -30.360 21.833 1.00 56.28 O ATOM 22 ND2 ASN A 514 43.149 -28.829 23.314 1.00 39.57 N ATOM 23 HA ASN A 514 45.477 -29.323 20.136 1.00 0.00 H ATOM 24 HB2 ASN A 514 46.043 -28.674 22.488 1.00 0.00 H ATOM 25 HB3 ASN A 514 44.883 -27.332 22.348 1.00 0.00 H ATOM 26 HD22 ASN A 514 43.315 -27.913 23.778 1.00 0.00 H ATOM 27 HD21 ASN A 514 42.316 -29.398 23.569 1.00 0.00 H ATOM 28 H ASN A 514 47.355 -28.172 19.679 1.00 0.00 H ATOM 29 N LEU A 515 44.422 -27.172 18.576 1.00 15.29 N ATOM 30 CA LEU A 515 43.379 -26.493 17.833 1.00 12.33 C ATOM 31 C LEU A 515 42.508 -27.425 17.031 1.00 13.14 C ATOM 32 O LEU A 515 42.953 -28.496 16.612 1.00 13.87 O ATOM 33 CB LEU A 515 44.027 -25.440 16.936 1.00 12.13 C ATOM 34 CG LEU A 515 44.932 -24.435 17.664 1.00 15.03 C ATOM 35 CD1 LEU A 515 45.595 -23.485 16.650 1.00 17.90 C ATOM 36 CD2 LEU A 515 44.160 -23.621 18.671 1.00 14.40 C ATOM 37 HA LEU A 515 42.709 -26.022 18.552 1.00 0.00 H ATOM 38 HB2 LEU A 515 44.628 -25.956 16.188 1.00 0.00 H ATOM 39 HB3 LEU A 515 43.232 -24.882 16.440 1.00 0.00 H ATOM 40 HG LEU A 515 45.695 -25.007 18.192 1.00 0.00 H ATOM 41 HD21 LEU A 515 43.371 -23.068 18.161 1.00 0.00 H ATOM 42 HD22 LEU A 515 43.718 -24.287 19.412 1.00 0.00 H ATOM 43 HD23 LEU A 515 44.835 -22.922 19.165 1.00 0.00 H ATOM 44 HD11 LEU A 515 46.196 -24.065 15.950 1.00 0.00 H ATOM 45 HD12 LEU A 515 44.823 -22.941 16.105 1.00 0.00 H ATOM 46 HD13 LEU A 515 46.234 -22.778 17.180 1.00 0.00 H ATOM 47 H LEU A 515 45.382 -27.232 18.180 1.00 0.00 H ATOM 48 N VAL A 516 41.260 -27.020 16.840 1.00 11.18 N ATOM 49 CA VAL A 516 40.251 -27.798 16.148 1.00 10.91 C ATOM 50 C VAL A 516 39.722 -26.922 15.008 1.00 12.26 C ATOM 51 O VAL A 516 39.327 -25.762 15.232 1.00 11.18 O ATOM 52 CB VAL A 516 39.117 -28.178 17.148 1.00 14.78 C ATOM 53 CG1 VAL A 516 37.974 -28.919 16.450 1.00 15.91 C ATOM 54 CG2 VAL A 516 39.652 -29.007 18.306 1.00 15.96 C ATOM 55 HA VAL A 516 40.656 -28.727 15.746 1.00 0.00 H ATOM 56 HB VAL A 516 38.722 -27.244 17.548 1.00 0.00 H ATOM 57 HG11 VAL A 516 37.550 -28.282 15.674 1.00 0.00 H ATOM 58 HG12 VAL A 516 38.358 -29.835 16.000 1.00 0.00 H ATOM 59 HG13 VAL A 516 37.204 -29.166 17.180 1.00 0.00 H ATOM 60 HG21 VAL A 516 40.095 -29.925 17.920 1.00 0.00 H ATOM 61 HG22 VAL A 516 40.409 -28.434 18.842 1.00 0.00 H ATOM 62 HG23 VAL A 516 38.834 -29.254 18.983 1.00 0.00 H ATOM 63 H VAL A 516 40.988 -26.087 17.209 1.00 0.00 H ATOM 64 N LEU A 517 39.683 -27.488 13.795 1.00 11.31 N ATOM 65 CA LEU A 517 39.178 -26.782 12.626 1.00 11.71 C ATOM 66 C LEU A 517 37.784 -27.249 12.317 1.00 15.39 C ATOM 67 O LEU A 517 37.574 -28.435 12.024 1.00 17.22 O ATOM 68 CB LEU A 517 40.089 -27.069 11.424 1.00 13.63 C ATOM 69 CG LEU A 517 39.808 -26.266 10.127 1.00 16.58 C ATOM 70 CD1 LEU A 517 40.085 -24.809 10.323 1.00 18.92 C ATOM 71 CD2 LEU A 517 40.730 -26.733 8.985 1.00 20.66 C ATOM 72 HA LEU A 517 39.165 -25.711 12.828 1.00 0.00 H ATOM 73 HB2 LEU A 517 41.114 -26.857 11.728 1.00 0.00 H ATOM 74 HB3 LEU A 517 39.995 -28.128 11.184 1.00 0.00 H ATOM 75 HG LEU A 517 38.759 -26.432 9.882 1.00 0.00 H ATOM 76 HD21 LEU A 517 41.770 -26.582 9.275 1.00 0.00 H ATOM 77 HD22 LEU A 517 40.556 -27.791 8.789 1.00 0.00 H ATOM 78 HD23 LEU A 517 40.514 -26.155 8.086 1.00 0.00 H ATOM 79 HD11 LEU A 517 39.446 -24.423 11.117 1.00 0.00 H ATOM 80 HD12 LEU A 517 41.131 -24.673 10.597 1.00 0.00 H ATOM 81 HD13 LEU A 517 39.879 -24.273 9.396 1.00 0.00 H ATOM 82 H LEU A 517 40.025 -28.464 13.684 1.00 0.00 H ATOM 83 N ILE A 518 36.841 -26.321 12.378 1.00 12.93 N ATOM 84 CA ILE A 518 35.445 -26.648 12.122 1.00 14.64 C ATOM 85 C ILE A 518 34.931 -25.910 10.913 1.00 15.08 C ATOM 86 O ILE A 518 35.265 -24.747 10.715 1.00 13.88 O ATOM 87 CB ILE A 518 34.629 -26.265 13.357 1.00 18.27 C ATOM 88 CG1 ILE A 518 35.063 -27.127 14.578 1.00 21.07 C ATOM 89 CG2 ILE A 518 33.085 -26.429 13.079 1.00 21.73 C ATOM 90 CD1 ILE A 518 34.514 -26.688 15.910 1.00 22.78 C ATOM 91 HA ILE A 518 35.352 -27.715 11.922 1.00 0.00 H ATOM 92 HB ILE A 518 34.821 -25.217 13.587 1.00 0.00 H ATOM 93 HG12 ILE A 518 34.735 -28.151 14.400 1.00 0.00 H ATOM 94 HG13 ILE A 518 36.151 -27.101 14.638 1.00 0.00 H ATOM 95 HD11 ILE A 518 34.843 -25.670 16.119 1.00 0.00 H ATOM 96 HD12 ILE A 518 33.425 -26.721 15.881 1.00 0.00 H ATOM 97 HD13 ILE A 518 34.879 -27.356 16.690 1.00 0.00 H ATOM 98 HG21 ILE A 518 32.796 -25.782 12.251 1.00 0.00 H ATOM 99 HG22 ILE A 518 32.871 -27.467 12.823 1.00 0.00 H ATOM 100 HG23 ILE A 518 32.525 -26.151 13.972 1.00 0.00 H ATOM 101 H ILE A 518 37.102 -25.342 12.613 1.00 0.00 H ATOM 102 N ARG A 519 34.131 -26.595 10.103 1.00 15.67 N ATOM 103 CA ARG A 519 33.458 -26.000 8.974 1.00 15.92 C ATOM 104 C ARG A 519 31.968 -26.209 9.202 1.00 17.94 C ATOM 105 O ARG A 519 31.532 -27.237 9.735 1.00 17.79 O ATOM 106 CB ARG A 519 33.894 -26.640 7.665 1.00 19.70 C ATOM 107 CG ARG A 519 35.333 -26.329 7.312 1.00 28.35 C ATOM 108 CD ARG A 519 35.762 -27.066 6.062 1.00 48.48 C ATOM 109 NE ARG A 519 37.206 -26.955 5.852 1.00 60.62 N ATOM 110 CZ ARG A 519 38.093 -27.834 6.303 1.00 77.61 C ATOM 111 NH1 ARG A 519 37.695 -28.900 6.985 1.00 62.28 N ATOM 112 NH2 ARG A 519 39.385 -27.656 6.073 1.00 72.80 N ATOM 113 HA ARG A 519 33.705 -24.941 8.896 1.00 0.00 H ATOM 114 HB2 ARG A 519 33.782 -27.721 7.751 1.00 0.00 H ATOM 115 HB3 ARG A 519 33.251 -26.271 6.865 1.00 0.00 H ATOM 116 HG2 ARG A 519 35.435 -25.257 7.145 1.00 0.00 H ATOM 117 HG3 ARG A 519 35.975 -26.629 8.140 1.00 0.00 H ATOM 118 HD2 ARG A 519 35.244 -26.641 5.203 1.00 0.00 H ATOM 119 HD3 ARG A 519 35.497 -28.119 6.161 1.00 0.00 H ATOM 120 HE ARG A 519 37.559 -26.137 5.316 1.00 0.00 H ATOM 121 HH12 ARG A 519 38.395 -29.584 7.335 1.00 0.00 H ATOM 122 HH11 ARG A 519 36.683 -29.051 7.169 1.00 0.00 H ATOM 123 HH22 ARG A 519 40.076 -28.347 6.428 1.00 0.00 H ATOM 124 HH21 ARG A 519 39.708 -26.825 5.537 1.00 0.00 H ATOM 125 H ARG A 519 33.983 -27.607 10.292 1.00 0.00 H ATOM 126 N MET A 520 31.177 -25.205 8.864 1.00 13.33 N ATOM 127 CA MET A 520 29.722 -25.312 8.997 1.00 11.83 C ATOM 128 C MET A 520 29.034 -24.399 8.018 1.00 12.06 C ATOM 129 O MET A 520 29.479 -23.274 7.778 1.00 11.37 O ATOM 130 CB MET A 520 29.228 -24.979 10.416 1.00 12.39 C ATOM 131 CG MET A 520 29.516 -23.575 10.878 1.00 13.09 C ATOM 132 SD MET A 520 28.933 -23.202 12.587 1.00 17.09 S ATOM 133 CE MET A 520 30.260 -23.840 13.506 1.00 15.32 C ATOM 134 HA MET A 520 29.472 -26.352 8.787 1.00 0.00 H ATOM 135 HB2 MET A 520 28.149 -25.129 10.442 1.00 0.00 H ATOM 136 HB3 MET A 520 29.706 -25.669 11.111 1.00 0.00 H ATOM 137 HG2 MET A 520 29.028 -22.883 10.192 1.00 0.00 H ATOM 138 HG3 MET A 520 30.594 -23.419 10.843 1.00 0.00 H ATOM 139 HE1 MET A 520 30.367 -24.904 13.297 1.00 0.00 H ATOM 140 HE2 MET A 520 31.177 -23.320 13.227 1.00 0.00 H ATOM 141 HE3 MET A 520 30.067 -23.695 14.569 1.00 0.00 H ATOM 142 H MET A 520 31.594 -24.325 8.498 1.00 0.00 H ATOM 143 N LYS A 521 27.986 -24.897 7.426 1.00 12.62 N ATOM 144 CA LYS A 521 27.149 -24.065 6.566 1.00 12.26 C ATOM 145 C LYS A 521 26.056 -23.456 7.452 1.00 12.86 C ATOM 146 O LYS A 521 25.580 -24.104 8.382 1.00 11.60 O ATOM 147 CB LYS A 521 26.514 -24.904 5.458 1.00 15.53 C ATOM 148 CG LYS A 521 27.555 -25.389 4.467 1.00 18.79 C ATOM 149 CD LYS A 521 26.899 -25.956 3.225 1.00 24.84 C ATOM 150 CE LYS A 521 27.939 -26.230 2.163 1.00 34.10 C ATOM 151 NZ LYS A 521 27.834 -27.621 1.657 1.00 38.19 N ATOM 152 HA LYS A 521 27.747 -23.288 6.090 1.00 0.00 H ATOM 153 HB2 LYS A 521 26.020 -25.767 5.905 1.00 0.00 H ATOM 154 HB3 LYS A 521 25.777 -24.297 4.931 1.00 0.00 H ATOM 155 HG2 LYS A 521 28.194 -24.553 4.183 1.00 0.00 H ATOM 156 HG3 LYS A 521 28.160 -26.164 4.936 1.00 0.00 H ATOM 157 HD2 LYS A 521 26.390 -26.886 3.479 1.00 0.00 H ATOM 158 HD3 LYS A 521 26.173 -25.239 2.842 1.00 0.00 H ATOM 159 HE2 LYS A 521 28.931 -26.080 2.589 1.00 0.00 H ATOM 160 HE3 LYS A 521 27.792 -25.538 1.334 1.00 0.00 H ATOM 161 HZ1 LYS A 521 27.978 -28.286 2.443 1.00 0.00 H ATOM 162 HZ2 LYS A 521 26.891 -27.768 1.245 1.00 0.00 H ATOM 163 HZ3 LYS A 521 28.560 -27.780 0.930 1.00 0.00 H ATOM 164 H LYS A 521 27.743 -25.898 7.567 1.00 0.00 H ATOM 165 N PRO A 522 25.573 -22.252 7.144 1.00 10.02 N ATOM 166 CA PRO A 522 24.458 -21.688 7.915 1.00 9.71 C ATOM 167 C PRO A 522 23.148 -22.397 7.562 1.00 12.34 C ATOM 168 O PRO A 522 23.088 -23.152 6.559 1.00 12.55 O ATOM 169 CB PRO A 522 24.396 -20.237 7.425 1.00 11.63 C ATOM 170 CG PRO A 522 24.904 -20.307 5.991 1.00 14.26 C ATOM 171 CD PRO A 522 25.997 -21.359 6.043 1.00 11.73 C ATOM 172 HA PRO A 522 24.595 -21.788 8.992 1.00 0.00 H ATOM 173 HD3 PRO A 522 26.057 -21.904 5.101 1.00 0.00 H ATOM 174 HD2 PRO A 522 26.964 -20.905 6.261 1.00 0.00 H ATOM 175 HG3 PRO A 522 25.306 -19.345 5.674 1.00 0.00 H ATOM 176 HG2 PRO A 522 24.107 -20.608 5.311 1.00 0.00 H ATOM 177 HB2 PRO A 522 23.373 -19.861 7.456 1.00 0.00 H ATOM 178 HB3 PRO A 522 25.036 -19.596 8.032 1.00 0.00 H ATOM 179 N ASP A 523 22.102 -22.130 8.381 1.00 10.77 N ATOM 180 CA ASP A 523 20.791 -22.611 8.043 1.00 10.63 C ATOM 181 C ASP A 523 20.269 -21.797 6.849 1.00 16.06 C ATOM 182 O ASP A 523 20.958 -20.897 6.352 1.00 15.17 O ATOM 183 CB ASP A 523 19.868 -22.599 9.272 1.00 12.06 C ATOM 184 CG ASP A 523 19.498 -21.245 9.824 1.00 12.65 C ATOM 185 OD1 ASP A 523 19.695 -20.247 9.122 1.00 13.05 O ATOM 186 OD2 ASP A 523 18.979 -21.197 10.954 1.00 15.47 O ATOM 187 HA ASP A 523 20.824 -23.656 7.734 1.00 0.00 H ATOM 188 HB2 ASP A 523 18.944 -23.108 8.998 1.00 0.00 H ATOM 189 HB3 ASP A 523 20.366 -23.155 10.066 1.00 0.00 H ATOM 190 H ASP A 523 22.248 -21.579 9.251 1.00 0.00 H ATOM 191 N GLU A 524 19.064 -22.126 6.374 1.00 15.71 N ATOM 192 CA GLU A 524 18.481 -21.458 5.211 1.00 16.97 C ATOM 193 C GLU A 524 18.291 -19.971 5.396 1.00 21.92 C ATOM 194 O GLU A 524 18.268 -19.222 4.401 1.00 23.33 O ATOM 195 CB GLU A 524 17.188 -22.157 4.819 1.00 18.63 C ATOM 196 CG GLU A 524 17.430 -23.546 4.240 1.00 22.01 C ATOM 197 CD GLU A 524 16.182 -24.304 3.812 1.00 30.00 C ATOM 198 OE1 GLU A 524 15.079 -23.718 3.862 1.00 27.47 O ATOM 199 OE2 GLU A 524 16.298 -25.515 3.526 1.00 33.79 O ATOM 200 HA GLU A 524 19.196 -21.543 4.393 1.00 0.00 H ATOM 201 HB2 GLU A 524 16.559 -22.251 5.704 1.00 0.00 H ATOM 202 HB3 GLU A 524 16.675 -21.551 4.072 1.00 0.00 H ATOM 203 HG2 GLU A 524 18.074 -23.439 3.367 1.00 0.00 H ATOM 204 HG3 GLU A 524 17.942 -24.141 4.996 1.00 0.00 H ATOM 205 H GLU A 524 18.525 -22.880 6.846 1.00 0.00 H ATOM 206 N ASN A 525 18.250 -19.520 6.656 1.00 15.92 N ATOM 207 CA ASN A 525 18.149 -18.119 7.004 1.00 15.67 C ATOM 208 C ASN A 525 19.440 -17.435 7.432 1.00 16.78 C ATOM 209 O ASN A 525 19.401 -16.346 8.003 1.00 17.49 O ATOM 210 CB ASN A 525 16.989 -17.844 7.932 1.00 16.65 C ATOM 211 CG ASN A 525 15.683 -17.969 7.186 1.00 25.18 C ATOM 212 OD1 ASN A 525 15.242 -17.040 6.491 1.00 23.32 O ATOM 213 ND2 ASN A 525 15.136 -19.168 7.160 1.00 16.16 N ATOM 214 HA ASN A 525 17.931 -17.630 6.054 1.00 0.00 H ATOM 215 HB2 ASN A 525 17.006 -18.562 8.752 1.00 0.00 H ATOM 216 HB3 ASN A 525 17.080 -16.834 8.333 1.00 0.00 H ATOM 217 HD22 ASN A 525 15.524 -19.930 7.752 1.00 0.00 H ATOM 218 HD21 ASN A 525 14.316 -19.352 6.547 1.00 0.00 H ATOM 219 H ASN A 525 18.293 -20.216 7.428 1.00 0.00 H ATOM 220 N GLY A 526 20.584 -18.079 7.162 1.00 13.18 N ATOM 221 CA GLY A 526 21.895 -17.473 7.343 1.00 12.98 C ATOM 222 C GLY A 526 22.465 -17.531 8.749 1.00 13.62 C ATOM 223 O GLY A 526 23.474 -16.874 9.046 1.00 15.53 O ATOM 224 HA3 GLY A 526 21.821 -16.424 7.056 1.00 0.00 H ATOM 225 HA2 GLY A 526 22.593 -17.982 6.678 1.00 0.00 H ATOM 226 H GLY A 526 20.533 -19.055 6.807 1.00 0.00 H ATOM 227 N ARG A 527 21.817 -18.287 9.638 1.00 11.67 N ATOM 228 CA ARG A 527 22.214 -18.348 11.043 1.00 10.88 C ATOM 229 C ARG A 527 22.953 -19.624 11.377 1.00 10.60 C ATOM 230 O ARG A 527 22.660 -20.696 10.828 1.00 10.51 O ATOM 231 CB ARG A 527 21.016 -18.197 11.956 1.00 13.01 C ATOM 232 CG ARG A 527 20.313 -16.852 11.684 1.00 15.73 C ATOM 233 CD ARG A 527 19.251 -16.528 12.727 1.00 25.28 C ATOM 234 NE ARG A 527 18.508 -15.311 12.381 1.00 34.04 N ATOM 235 CZ ARG A 527 17.343 -15.290 11.734 1.00 47.67 C ATOM 236 NH1 ARG A 527 16.752 -16.425 11.373 1.00 26.81 N ATOM 237 NH2 ARG A 527 16.750 -14.135 11.462 1.00 41.28 N ATOM 238 HA ARG A 527 22.896 -17.514 11.206 1.00 0.00 H ATOM 239 HB2 ARG A 527 20.317 -19.013 11.773 1.00 0.00 H ATOM 240 HB3 ARG A 527 21.347 -18.229 12.994 1.00 0.00 H ATOM 241 HG2 ARG A 527 21.061 -16.059 11.688 1.00 0.00 H ATOM 242 HG3 ARG A 527 19.839 -16.897 10.704 1.00 0.00 H ATOM 243 HD2 ARG A 527 19.735 -16.385 13.693 1.00 0.00 H ATOM 244 HD3 ARG A 527 18.553 -17.363 12.793 1.00 0.00 H ATOM 245 HE ARG A 527 18.920 -14.398 12.661 1.00 0.00 H ATOM 246 HH12 ARG A 527 15.843 -16.400 10.868 1.00 0.00 H ATOM 247 HH11 ARG A 527 17.199 -17.337 11.595 1.00 0.00 H ATOM 248 HH22 ARG A 527 15.841 -14.123 10.957 1.00 0.00 H ATOM 249 HH21 ARG A 527 17.194 -13.241 11.754 1.00 0.00 H ATOM 250 H ARG A 527 21.003 -18.851 9.320 1.00 0.00 H ATOM 251 N PHE A 528 23.904 -19.503 12.281 1.00 8.72 N ATOM 252 CA PHE A 528 24.753 -20.634 12.676 1.00 8.16 C ATOM 253 C PHE A 528 24.363 -21.220 14.031 1.00 8.88 C ATOM 254 O PHE A 528 24.656 -22.395 14.247 1.00 9.87 O ATOM 255 CB PHE A 528 26.200 -20.189 12.727 1.00 8.83 C ATOM 256 CG PHE A 528 26.744 -19.815 11.375 1.00 8.31 C ATOM 257 CD1 PHE A 528 27.113 -20.796 10.455 1.00 9.52 C ATOM 258 CD2 PHE A 528 26.878 -18.487 11.015 1.00 9.42 C ATOM 259 CE1 PHE A 528 27.642 -20.455 9.217 1.00 11.27 C ATOM 260 CE2 PHE A 528 27.373 -18.138 9.752 1.00 10.39 C ATOM 261 CZ PHE A 528 27.749 -19.123 8.859 1.00 10.12 C ATOM 262 HA PHE A 528 24.613 -21.414 11.928 1.00 0.00 H ATOM 263 HB2 PHE A 528 26.275 -19.323 13.385 1.00 0.00 H ATOM 264 HB3 PHE A 528 26.801 -21.004 13.131 1.00 0.00 H ATOM 265 HD2 PHE A 528 26.596 -17.705 11.720 1.00 0.00 H ATOM 266 HE2 PHE A 528 27.462 -17.088 9.473 1.00 0.00 H ATOM 267 HZ PHE A 528 28.129 -18.851 7.874 1.00 0.00 H ATOM 268 HE1 PHE A 528 27.972 -21.234 8.530 1.00 0.00 H ATOM 269 HD1 PHE A 528 26.984 -21.847 10.712 1.00 0.00 H ATOM 270 H PHE A 528 24.058 -18.577 12.729 1.00 0.00 H ATOM 271 N GLY A 529 23.777 -20.435 14.933 1.00 7.35 N ATOM 272 CA GLY A 529 23.320 -20.988 16.206 1.00 8.47 C ATOM 273 C GLY A 529 24.267 -20.849 17.366 1.00 10.52 C ATOM 274 O GLY A 529 24.019 -21.453 18.410 1.00 11.88 O ATOM 275 HA3 GLY A 529 23.128 -22.051 16.058 1.00 0.00 H ATOM 276 HA2 GLY A 529 22.390 -20.486 16.473 1.00 0.00 H ATOM 277 H GLY A 529 23.644 -19.424 14.730 1.00 0.00 H ATOM 278 N PHE A 530 25.345 -20.082 17.223 1.00 7.72 N ATOM 279 CA PHE A 530 26.260 -19.845 18.314 1.00 7.61 C ATOM 280 C PHE A 530 26.316 -18.374 18.627 1.00 9.47 C ATOM 281 O PHE A 530 26.033 -17.519 17.778 1.00 9.03 O ATOM 282 CB PHE A 530 27.647 -20.444 18.053 1.00 8.58 C ATOM 283 CG PHE A 530 28.458 -19.756 16.986 1.00 7.63 C ATOM 284 CD1 PHE A 530 29.424 -18.808 17.326 1.00 9.83 C ATOM 285 CD2 PHE A 530 28.276 -20.071 15.642 1.00 9.11 C ATOM 286 CE1 PHE A 530 30.181 -18.183 16.343 1.00 10.84 C ATOM 287 CE2 PHE A 530 29.050 -19.455 14.658 1.00 9.42 C ATOM 288 CZ PHE A 530 29.988 -18.497 15.015 1.00 10.18 C ATOM 289 HA PHE A 530 25.882 -20.364 19.195 1.00 0.00 H ATOM 290 HB2 PHE A 530 28.212 -20.403 18.984 1.00 0.00 H ATOM 291 HB3 PHE A 530 27.514 -21.484 17.756 1.00 0.00 H ATOM 292 HD2 PHE A 530 27.523 -20.805 15.356 1.00 0.00 H ATOM 293 HE2 PHE A 530 28.918 -19.726 13.611 1.00 0.00 H ATOM 294 HZ PHE A 530 30.572 -17.993 14.245 1.00 0.00 H ATOM 295 HE1 PHE A 530 30.930 -17.442 16.623 1.00 0.00 H ATOM 296 HD1 PHE A 530 29.586 -18.555 18.374 1.00 0.00 H ATOM 297 H PHE A 530 25.533 -19.641 16.300 1.00 0.00 H ATOM 298 N ASN A 531 26.674 -18.108 19.885 1.00 8.65 N ATOM 299 CA ASN A 531 26.886 -16.730 20.323 1.00 8.62 C ATOM 300 C ASN A 531 28.337 -16.580 20.663 1.00 9.33 C ATOM 301 O ASN A 531 29.015 -17.537 21.022 1.00 9.67 O ATOM 302 CB ASN A 531 26.102 -16.440 21.619 1.00 9.80 C ATOM 303 CG ASN A 531 24.624 -16.522 21.504 1.00 10.53 C ATOM 304 OD1 ASN A 531 24.058 -16.913 20.491 1.00 10.98 O ATOM 305 ND2 ASN A 531 23.949 -16.264 22.620 1.00 14.23 N ATOM 306 HA ASN A 531 26.561 -16.055 19.531 1.00 0.00 H ATOM 307 HB2 ASN A 531 26.421 -17.160 22.373 1.00 0.00 H ATOM 308 HB3 ASN A 531 26.358 -15.433 21.949 1.00 0.00 H ATOM 309 HD22 ASN A 531 24.453 -15.933 23.468 1.00 0.00 H ATOM 310 HD21 ASN A 531 22.917 -16.393 22.645 1.00 0.00 H ATOM 311 H ASN A 531 26.803 -18.889 20.560 1.00 0.00 H ATOM 312 N VAL A 532 28.822 -15.331 20.572 1.00 9.18 N ATOM 313 CA VAL A 532 30.190 -15.037 20.996 1.00 9.64 C ATOM 314 C VAL A 532 30.219 -13.855 21.962 1.00 10.12 C ATOM 315 O VAL A 532 29.350 -12.983 21.894 1.00 9.25 O ATOM 316 CB VAL A 532 31.145 -14.716 19.822 1.00 12.93 C ATOM 317 CG1 VAL A 532 31.375 -15.949 18.941 1.00 13.58 C ATOM 318 CG2 VAL A 532 30.661 -13.521 18.985 1.00 14.07 C ATOM 319 HA VAL A 532 30.539 -15.948 21.482 1.00 0.00 H ATOM 320 HB VAL A 532 32.100 -14.430 20.262 1.00 0.00 H ATOM 321 HG11 VAL A 532 31.816 -16.745 19.541 1.00 0.00 H ATOM 322 HG12 VAL A 532 30.422 -16.285 18.533 1.00 0.00 H ATOM 323 HG13 VAL A 532 32.050 -15.690 18.125 1.00 0.00 H ATOM 324 HG21 VAL A 532 29.678 -13.744 18.570 1.00 0.00 H ATOM 325 HG22 VAL A 532 30.597 -12.637 19.619 1.00 0.00 H ATOM 326 HG23 VAL A 532 31.366 -13.337 18.174 1.00 0.00 H ATOM 327 H VAL A 532 28.221 -14.569 20.198 1.00 0.00 H ATOM 328 N LYS A 533 31.215 -13.855 22.865 1.00 9.68 N ATOM 329 CA LYS A 533 31.566 -12.727 23.719 1.00 10.03 C ATOM 330 C LYS A 533 33.040 -12.429 23.409 1.00 11.09 C ATOM 331 O LYS A 533 33.724 -13.262 22.775 1.00 10.57 O ATOM 332 CB LYS A 533 31.433 -13.055 25.225 1.00 12.09 C ATOM 333 CG LYS A 533 29.992 -13.208 25.701 1.00 15.65 C ATOM 334 CD LYS A 533 29.907 -13.623 27.149 1.00 17.24 C ATOM 335 CE LYS A 533 28.485 -13.814 27.592 1.00 20.69 C ATOM 336 NZ LYS A 533 28.428 -14.060 29.078 1.00 26.22 N ATOM 337 HA LYS A 533 30.896 -11.890 23.523 1.00 0.00 H ATOM 338 HB2 LYS A 533 31.960 -13.989 25.421 1.00 0.00 H ATOM 339 HB3 LYS A 533 31.899 -12.250 25.794 1.00 0.00 H ATOM 340 HG2 LYS A 533 29.479 -12.254 25.579 1.00 0.00 H ATOM 341 HG3 LYS A 533 29.499 -13.964 25.090 1.00 0.00 H ATOM 342 HD2 LYS A 533 30.447 -14.561 27.280 1.00 0.00 H ATOM 343 HD3 LYS A 533 30.368 -12.851 27.765 1.00 0.00 H ATOM 344 HE2 LYS A 533 28.057 -14.669 27.069 1.00 0.00 H ATOM 345 HE3 LYS A 533 27.910 -12.919 27.353 1.00 0.00 H ATOM 346 HZ1 LYS A 533 28.973 -14.915 29.308 1.00 0.00 H ATOM 347 HZ2 LYS A 533 28.833 -13.244 29.579 1.00 0.00 H ATOM 348 HZ3 LYS A 533 27.438 -14.190 29.369 1.00 0.00 H ATOM 349 H LYS A 533 31.777 -14.725 22.961 1.00 0.00 H ATOM 350 N GLY A 534 33.529 -11.276 23.861 1.00 9.59 N ATOM 351 CA GLY A 534 34.942 -10.966 23.689 1.00 10.22 C ATOM 352 C GLY A 534 35.289 -10.148 22.456 1.00 12.26 C ATOM 353 O GLY A 534 34.419 -9.726 21.689 1.00 10.37 O ATOM 354 HA3 GLY A 534 35.488 -11.908 23.632 1.00 0.00 H ATOM 355 HA2 GLY A 534 35.273 -10.409 24.566 1.00 0.00 H ATOM 356 H GLY A 534 32.902 -10.596 24.337 1.00 0.00 H ATOM 357 N GLY A 535 36.578 -9.941 22.271 1.00 11.19 N ATOM 358 CA GLY A 535 37.094 -9.099 21.203 1.00 11.25 C ATOM 359 C GLY A 535 38.021 -8.055 21.803 1.00 11.10 C ATOM 360 O GLY A 535 38.057 -7.826 23.022 1.00 11.72 O ATOM 361 HA3 GLY A 535 36.266 -8.605 20.694 1.00 0.00 H ATOM 362 HA2 GLY A 535 37.645 -9.710 20.488 1.00 0.00 H ATOM 363 H GLY A 535 37.254 -10.399 22.915 1.00 0.00 H ATOM 364 N TYR A 536 38.793 -7.409 20.950 1.00 10.66 N ATOM 365 CA TYR A 536 39.812 -6.460 21.394 1.00 10.53 C ATOM 366 C TYR A 536 39.233 -5.346 22.261 1.00 12.79 C ATOM 367 O TYR A 536 39.847 -4.932 23.237 1.00 14.22 O ATOM 368 CB TYR A 536 40.515 -5.862 20.181 1.00 13.69 C ATOM 369 CG TYR A 536 41.569 -4.851 20.536 1.00 17.24 C ATOM 370 CD1 TYR A 536 42.850 -5.251 20.903 1.00 19.19 C ATOM 371 CD2 TYR A 536 41.298 -3.485 20.488 1.00 19.41 C ATOM 372 CE1 TYR A 536 43.826 -4.316 21.236 1.00 20.52 C ATOM 373 CE2 TYR A 536 42.248 -2.548 20.866 1.00 22.15 C ATOM 374 CZ TYR A 536 43.514 -2.966 21.214 1.00 23.49 C ATOM 375 OH TYR A 536 44.442 -2.006 21.511 1.00 24.55 O ATOM 376 HA TYR A 536 40.525 -7.008 22.010 1.00 0.00 H ATOM 377 HB3 TYR A 536 39.768 -5.376 19.554 1.00 0.00 H ATOM 378 HB2 TYR A 536 40.986 -6.670 19.622 1.00 0.00 H ATOM 379 HD2 TYR A 536 40.320 -3.146 20.147 1.00 0.00 H ATOM 380 HE2 TYR A 536 41.995 -1.488 20.888 1.00 0.00 H ATOM 381 HE1 TYR A 536 44.828 -4.643 21.512 1.00 0.00 H ATOM 382 HD1 TYR A 536 43.093 -6.313 20.930 1.00 0.00 H ATOM 383 HH TYR A 536 45.301 -2.440 21.742 1.00 0.00 H ATOM 384 H TYR A 536 38.673 -7.580 19.931 1.00 0.00 H ATOM 385 N ASP A 537 38.036 -4.854 21.891 1.00 12.05 N ATOM 386 CA ASP A 537 37.372 -3.792 22.648 1.00 11.15 C ATOM 387 C ASP A 537 36.865 -4.255 24.006 1.00 13.62 C ATOM 388 O ASP A 537 36.618 -3.407 24.872 1.00 13.94 O ATOM 389 CB ASP A 537 36.209 -3.260 21.818 1.00 10.82 C ATOM 390 CG ASP A 537 35.219 -4.293 21.353 1.00 10.31 C ATOM 391 OD1 ASP A 537 35.641 -5.429 21.030 1.00 10.25 O ATOM 392 OD2 ASP A 537 34.017 -3.952 21.236 1.00 11.35 O ATOM 393 HA ASP A 537 38.108 -3.012 22.842 1.00 0.00 H ATOM 394 HB2 ASP A 537 35.672 -2.528 22.422 1.00 0.00 H ATOM 395 HB3 ASP A 537 36.622 -2.769 20.937 1.00 0.00 H ATOM 396 H ASP A 537 37.570 -5.239 21.044 1.00 0.00 H ATOM 397 N GLN A 538 36.718 -5.556 24.207 1.00 12.36 N ATOM 398 CA GLN A 538 36.286 -6.123 25.479 1.00 12.35 C ATOM 399 C GLN A 538 37.501 -6.588 26.307 1.00 16.63 C ATOM 400 O GLN A 538 37.314 -7.059 27.428 1.00 18.67 O ATOM 401 CB GLN A 538 35.304 -7.265 25.264 1.00 11.20 C ATOM 402 CG GLN A 538 33.992 -6.768 24.645 1.00 11.32 C ATOM 403 CD GLN A 538 32.953 -7.853 24.611 1.00 11.22 C ATOM 404 OE1 GLN A 538 33.069 -8.905 25.285 1.00 12.51 O ATOM 405 NE2 GLN A 538 31.937 -7.637 23.806 1.00 10.79 N ATOM 406 HA GLN A 538 35.770 -5.343 26.039 1.00 0.00 H ATOM 407 HB2 GLN A 538 35.755 -8.000 24.597 1.00 0.00 H ATOM 408 HB3 GLN A 538 35.088 -7.733 26.225 1.00 0.00 H ATOM 409 HG2 GLN A 538 33.614 -5.934 25.237 1.00 0.00 H ATOM 410 HG3 GLN A 538 34.186 -6.431 23.627 1.00 0.00 H ATOM 411 HE22 GLN A 538 31.881 -6.750 23.266 1.00 0.00 H ATOM 412 HE21 GLN A 538 31.189 -8.353 23.709 1.00 0.00 H ATOM 413 H GLN A 538 36.920 -6.204 23.419 1.00 0.00 H ATOM 414 N LYS A 539 38.717 -6.503 25.728 1.00 14.79 N ATOM 415 CA LYS A 539 39.969 -6.899 26.396 1.00 15.08 C ATOM 416 C LYS A 539 39.939 -8.347 26.807 1.00 19.18 C ATOM 417 O LYS A 539 40.492 -8.741 27.845 1.00 19.51 O ATOM 418 CB LYS A 539 40.301 -6.001 27.612 1.00 18.14 C ATOM 419 CG LYS A 539 40.329 -4.517 27.322 1.00 23.58 C ATOM 420 CD LYS A 539 40.585 -3.776 28.637 1.00 35.83 C ATOM 421 CE LYS A 539 39.664 -2.603 28.878 1.00 46.60 C ATOM 422 NZ LYS A 539 39.858 -1.528 27.868 1.00 45.37 N ATOM 423 HA LYS A 539 40.763 -6.762 25.662 1.00 0.00 H ATOM 424 HB2 LYS A 539 39.550 -6.181 28.381 1.00 0.00 H ATOM 425 HB3 LYS A 539 41.282 -6.291 27.989 1.00 0.00 H ATOM 426 HG2 LYS A 539 41.126 -4.295 26.612 1.00 0.00 H ATOM 427 HG3 LYS A 539 39.373 -4.205 26.903 1.00 0.00 H ATOM 428 HD2 LYS A 539 40.460 -4.483 29.457 1.00 0.00 H ATOM 429 HD3 LYS A 539 41.611 -3.409 28.628 1.00 0.00 H ATOM 430 HE2 LYS A 539 39.864 -2.196 29.869 1.00 0.00 H ATOM 431 HE3 LYS A 539 38.632 -2.950 28.830 1.00 0.00 H ATOM 432 HZ1 LYS A 539 40.839 -1.186 27.911 1.00 0.00 H ATOM 433 HZ2 LYS A 539 39.663 -1.906 26.919 1.00 0.00 H ATOM 434 HZ3 LYS A 539 39.207 -0.743 28.070 1.00 0.00 H ATOM 435 H LYS A 539 38.773 -6.138 24.756 1.00 0.00 H ATOM 436 N MET A 540 39.247 -9.157 25.995 1.00 16.74 N ATOM 437 CA MET A 540 39.241 -10.578 26.254 1.00 17.09 C ATOM 438 C MET A 540 39.165 -11.350 24.965 1.00 17.92 C ATOM 439 O MET A 540 38.767 -10.804 23.923 1.00 15.46 O ATOM 440 CB MET A 540 38.204 -10.996 27.303 1.00 20.22 C ATOM 441 CG MET A 540 36.804 -10.729 26.908 1.00 24.00 C ATOM 442 SD MET A 540 35.733 -11.350 28.207 1.00 29.80 S ATOM 443 CE MET A 540 34.171 -10.875 27.534 1.00 24.78 C ATOM 444 HA MET A 540 40.193 -10.839 26.717 1.00 0.00 H ATOM 445 HB2 MET A 540 38.311 -12.066 27.483 1.00 0.00 H ATOM 446 HB3 MET A 540 38.410 -10.451 28.224 1.00 0.00 H ATOM 447 HG2 MET A 540 36.581 -11.237 25.970 1.00 0.00 H ATOM 448 HG3 MET A 540 36.652 -9.657 26.784 1.00 0.00 H ATOM 449 HE1 MET A 540 34.145 -9.793 27.408 1.00 0.00 H ATOM 450 HE2 MET A 540 34.032 -11.358 26.567 1.00 0.00 H ATOM 451 HE3 MET A 540 33.376 -11.183 28.213 1.00 0.00 H ATOM 452 H MET A 540 38.720 -8.767 25.187 1.00 0.00 H ATOM 453 N PRO A 541 39.603 -12.629 24.967 1.00 16.60 N ATOM 454 CA PRO A 541 39.577 -13.369 23.705 1.00 14.45 C ATOM 455 C PRO A 541 38.122 -13.608 23.254 1.00 14.26 C ATOM 456 O PRO A 541 37.166 -13.543 24.067 1.00 13.48 O ATOM 457 CB PRO A 541 40.227 -14.712 24.055 1.00 17.90 C ATOM 458 CG PRO A 541 40.040 -14.849 25.540 1.00 24.64 C ATOM 459 CD PRO A 541 40.148 -13.462 26.073 1.00 19.04 C ATOM 460 HA PRO A 541 40.084 -12.838 22.899 1.00 0.00 H ATOM 461 HD3 PRO A 541 39.555 -13.344 26.980 1.00 0.00 H ATOM 462 HD2 PRO A 541 41.186 -13.203 26.283 1.00 0.00 H ATOM 463 HG3 PRO A 541 40.815 -15.485 25.967 1.00 0.00 H ATOM 464 HG2 PRO A 541 39.061 -15.271 25.766 1.00 0.00 H ATOM 465 HB2 PRO A 541 39.733 -15.528 23.528 1.00 0.00 H ATOM 466 HB3 PRO A 541 41.287 -14.705 23.799 1.00 0.00 H ATOM 467 N VAL A 542 37.949 -13.834 21.944 1.00 11.88 N ATOM 468 CA VAL A 542 36.635 -14.170 21.410 1.00 11.44 C ATOM 469 C VAL A 542 36.307 -15.595 21.841 1.00 12.52 C ATOM 470 O VAL A 542 37.087 -16.514 21.577 1.00 12.08 O ATOM 471 CB VAL A 542 36.559 -13.993 19.885 1.00 13.91 C ATOM 472 CG1 VAL A 542 35.222 -14.479 19.357 1.00 12.81 C ATOM 473 CG2 VAL A 542 36.765 -12.524 19.521 1.00 15.09 C ATOM 474 HA VAL A 542 35.891 -13.482 21.811 1.00 0.00 H ATOM 475 HB VAL A 542 37.348 -14.589 19.426 1.00 0.00 H ATOM 476 HG11 VAL A 542 35.100 -15.535 19.597 1.00 0.00 H ATOM 477 HG12 VAL A 542 34.419 -13.905 19.820 1.00 0.00 H ATOM 478 HG13 VAL A 542 35.189 -14.345 18.276 1.00 0.00 H ATOM 479 HG21 VAL A 542 35.988 -11.922 19.993 1.00 0.00 H ATOM 480 HG22 VAL A 542 37.744 -12.198 19.873 1.00 0.00 H ATOM 481 HG23 VAL A 542 36.710 -12.408 18.439 1.00 0.00 H ATOM 482 H VAL A 542 38.763 -13.769 21.300 1.00 0.00 H ATOM 483 N ILE A 543 35.234 -15.768 22.588 1.00 11.78 N ATOM 484 CA ILE A 543 34.833 -17.081 23.152 1.00 10.92 C ATOM 485 C ILE A 543 33.403 -17.378 22.731 1.00 12.74 C ATOM 486 O ILE A 543 32.535 -16.481 22.745 1.00 13.31 O ATOM 487 CB ILE A 543 34.933 -17.071 24.722 1.00 16.14 C ATOM 488 CG1 ILE A 543 36.326 -16.620 25.234 1.00 18.89 C ATOM 489 CG2 ILE A 543 34.524 -18.427 25.385 1.00 20.22 C ATOM 490 CD1 ILE A 543 37.442 -17.621 25.120 1.00 28.20 C ATOM 491 HA ILE A 543 35.505 -17.851 22.774 1.00 0.00 H ATOM 492 HB ILE A 543 34.201 -16.326 25.034 1.00 0.00 H ATOM 493 HG12 ILE A 543 36.616 -15.735 24.668 1.00 0.00 H ATOM 494 HG13 ILE A 543 36.223 -16.358 26.287 1.00 0.00 H ATOM 495 HD11 ILE A 543 37.189 -18.513 25.694 1.00 0.00 H ATOM 496 HD12 ILE A 543 37.582 -17.889 24.073 1.00 0.00 H ATOM 497 HD13 ILE A 543 38.361 -17.185 25.511 1.00 0.00 H ATOM 498 HG21 ILE A 543 33.491 -18.660 25.126 1.00 0.00 H ATOM 499 HG22 ILE A 543 35.178 -19.219 25.022 1.00 0.00 H ATOM 500 HG23 ILE A 543 34.618 -18.344 26.468 1.00 0.00 H ATOM 501 H ILE A 543 34.638 -14.941 22.793 1.00 0.00 H ATOM 502 N VAL A 544 33.136 -18.663 22.438 1.00 10.46 N ATOM 503 CA VAL A 544 31.772 -19.105 22.151 1.00 10.13 C ATOM 504 C VAL A 544 31.061 -19.153 23.485 1.00 12.45 C ATOM 505 O VAL A 544 31.490 -19.862 24.414 1.00 12.11 O ATOM 506 CB VAL A 544 31.793 -20.487 21.481 1.00 11.57 C ATOM 507 CG1 VAL A 544 30.364 -20.991 21.259 1.00 11.18 C ATOM 508 CG2 VAL A 544 32.539 -20.393 20.153 1.00 11.73 C ATOM 509 HA VAL A 544 31.262 -18.431 21.463 1.00 0.00 H ATOM 510 HB VAL A 544 32.307 -21.196 22.130 1.00 0.00 H ATOM 511 HG11 VAL A 544 29.854 -21.068 22.219 1.00 0.00 H ATOM 512 HG12 VAL A 544 29.829 -20.291 20.617 1.00 0.00 H ATOM 513 HG13 VAL A 544 30.396 -21.971 20.783 1.00 0.00 H ATOM 514 HG21 VAL A 544 32.033 -19.680 19.503 1.00 0.00 H ATOM 515 HG22 VAL A 544 33.561 -20.059 20.334 1.00 0.00 H ATOM 516 HG23 VAL A 544 32.555 -21.373 19.676 1.00 0.00 H ATOM 517 H VAL A 544 33.913 -19.354 22.415 1.00 0.00 H ATOM 518 N SER A 545 29.965 -18.398 23.612 1.00 10.11 N ATOM 519 CA SER A 545 29.248 -18.311 24.864 1.00 9.54 C ATOM 520 C SER A 545 27.966 -19.130 24.925 1.00 12.03 C ATOM 521 O SER A 545 27.409 -19.327 26.017 1.00 13.28 O ATOM 522 CB SER A 545 28.959 -16.846 25.166 1.00 11.99 C ATOM 523 OG SER A 545 28.298 -16.254 24.057 1.00 11.80 O ATOM 524 HA SER A 545 29.895 -18.750 25.623 1.00 0.00 H ATOM 525 HB2 SER A 545 29.896 -16.322 25.353 1.00 0.00 H ATOM 526 HB3 SER A 545 28.323 -16.775 26.048 1.00 0.00 H ATOM 527 HG SER A 545 27.447 -16.731 23.889 1.00 0.00 H ATOM 528 H SER A 545 29.620 -17.861 22.791 1.00 0.00 H ATOM 529 N ARG A 546 27.452 -19.581 23.762 1.00 8.37 N ATOM 530 CA ARG A 546 26.242 -20.386 23.716 1.00 8.80 C ATOM 531 C ARG A 546 26.237 -21.112 22.388 1.00 9.81 C ATOM 532 O ARG A 546 26.712 -20.577 21.370 1.00 9.44 O ATOM 533 CB ARG A 546 24.979 -19.487 23.785 1.00 11.29 C ATOM 534 CG ARG A 546 23.713 -20.313 24.012 1.00 18.08 C ATOM 535 CD ARG A 546 22.458 -19.497 24.259 1.00 30.78 C ATOM 536 NE ARG A 546 21.305 -20.401 24.271 1.00 43.48 N ATOM 537 CZ ARG A 546 20.528 -20.641 23.219 1.00 57.42 C ATOM 538 NH1 ARG A 546 20.717 -19.983 22.080 1.00 34.55 N ATOM 539 NH2 ARG A 546 19.532 -21.514 23.309 1.00 46.25 N ATOM 540 HA ARG A 546 26.226 -21.075 24.561 1.00 0.00 H ATOM 541 HB2 ARG A 546 25.092 -18.779 24.606 1.00 0.00 H ATOM 542 HB3 ARG A 546 24.882 -18.940 22.847 1.00 0.00 H ATOM 543 HG2 ARG A 546 23.548 -20.931 23.129 1.00 0.00 H ATOM 544 HG3 ARG A 546 23.877 -20.955 24.878 1.00 0.00 H ATOM 545 HD2 ARG A 546 22.338 -18.759 23.466 1.00 0.00 H ATOM 546 HD3 ARG A 546 22.535 -18.987 25.219 1.00 0.00 H ATOM 547 HE ARG A 546 21.079 -20.888 25.162 1.00 0.00 H ATOM 548 HH12 ARG A 546 20.106 -20.175 21.261 1.00 0.00 H ATOM 549 HH11 ARG A 546 21.476 -19.276 22.008 1.00 0.00 H ATOM 550 HH22 ARG A 546 18.926 -21.699 22.484 1.00 0.00 H ATOM 551 HH21 ARG A 546 19.357 -22.013 24.205 1.00 0.00 H ATOM 552 H ARG A 546 27.936 -19.346 22.872 1.00 0.00 H ATOM 553 N VAL A 547 25.707 -22.334 22.391 1.00 9.25 N ATOM 554 CA VAL A 547 25.478 -23.114 21.185 1.00 9.01 C ATOM 555 C VAL A 547 24.053 -23.628 21.328 1.00 11.60 C ATOM 556 O VAL A 547 23.748 -24.339 22.307 1.00 12.19 O ATOM 557 CB VAL A 547 26.474 -24.254 21.009 1.00 10.80 C ATOM 558 CG1 VAL A 547 26.087 -25.117 19.798 1.00 12.28 C ATOM 559 CG2 VAL A 547 27.908 -23.712 20.867 1.00 10.78 C ATOM 560 HA VAL A 547 25.617 -22.506 20.291 1.00 0.00 H ATOM 561 HB VAL A 547 26.444 -24.881 21.900 1.00 0.00 H ATOM 562 HG11 VAL A 547 25.092 -25.534 19.953 1.00 0.00 H ATOM 563 HG12 VAL A 547 26.088 -24.501 18.899 1.00 0.00 H ATOM 564 HG13 VAL A 547 26.808 -25.927 19.685 1.00 0.00 H ATOM 565 HG21 VAL A 547 27.964 -23.059 19.996 1.00 0.00 H ATOM 566 HG22 VAL A 547 28.173 -23.149 21.762 1.00 0.00 H ATOM 567 HG23 VAL A 547 28.599 -24.545 20.743 1.00 0.00 H ATOM 568 H VAL A 547 25.443 -22.753 23.305 1.00 0.00 H ATOM 569 N ALA A 548 23.180 -23.273 20.380 1.00 9.53 N ATOM 570 CA ALA A 548 21.772 -23.639 20.449 1.00 10.08 C ATOM 571 C ALA A 548 21.487 -25.049 19.883 1.00 10.15 C ATOM 572 O ALA A 548 22.062 -25.456 18.861 1.00 10.00 O ATOM 573 CB ALA A 548 20.929 -22.607 19.724 1.00 11.43 C ATOM 574 HA ALA A 548 21.503 -23.662 21.505 1.00 0.00 H ATOM 575 HB1 ALA A 548 21.069 -21.632 20.191 1.00 0.00 H ATOM 576 HB2 ALA A 548 21.236 -22.558 18.679 1.00 0.00 H ATOM 577 HB3 ALA A 548 19.878 -22.892 19.783 1.00 0.00 H ATOM 578 H ALA A 548 23.517 -22.718 19.568 1.00 0.00 H ATOM 579 N PRO A 549 20.572 -25.783 20.512 1.00 9.56 N ATOM 580 CA PRO A 549 20.291 -27.144 20.040 1.00 9.27 C ATOM 581 C PRO A 549 19.773 -27.213 18.601 1.00 9.85 C ATOM 582 O PRO A 549 18.931 -26.413 18.217 1.00 10.63 O ATOM 583 CB PRO A 549 19.182 -27.642 20.992 1.00 11.87 C ATOM 584 CG PRO A 549 19.321 -26.791 22.243 1.00 15.73 C ATOM 585 CD PRO A 549 19.795 -25.441 21.725 1.00 10.33 C ATOM 586 HA PRO A 549 21.206 -27.736 20.042 1.00 0.00 H ATOM 587 HD3 PRO A 549 18.949 -24.801 21.477 1.00 0.00 H ATOM 588 HD2 PRO A 549 20.424 -24.941 22.462 1.00 0.00 H ATOM 589 HG3 PRO A 549 20.053 -27.223 22.925 1.00 0.00 H ATOM 590 HG2 PRO A 549 18.363 -26.695 22.754 1.00 0.00 H ATOM 591 HB2 PRO A 549 18.199 -27.502 20.541 1.00 0.00 H ATOM 592 HB3 PRO A 549 19.325 -28.696 21.228 1.00 0.00 H ATOM 593 N GLY A 550 20.328 -28.138 17.815 1.00 9.60 N ATOM 594 CA GLY A 550 19.834 -28.422 16.469 1.00 9.98 C ATOM 595 C GLY A 550 20.229 -27.424 15.416 1.00 11.17 C ATOM 596 O GLY A 550 19.704 -27.485 14.301 1.00 12.22 O ATOM 597 HA3 GLY A 550 18.745 -28.456 16.510 1.00 0.00 H ATOM 598 HA2 GLY A 550 20.216 -29.398 16.169 1.00 0.00 H ATOM 599 H GLY A 550 21.142 -28.677 18.174 1.00 0.00 H ATOM 600 N THR A 551 21.132 -26.529 15.741 1.00 8.90 N ATOM 601 CA THR A 551 21.626 -25.541 14.809 1.00 9.16 C ATOM 602 C THR A 551 22.926 -26.015 14.180 1.00 8.33 C ATOM 603 O THR A 551 23.522 -27.003 14.644 1.00 9.58 O ATOM 604 CB THR A 551 21.859 -24.226 15.526 1.00 8.42 C ATOM 605 OG1 THR A 551 22.892 -24.371 16.506 1.00 8.05 O ATOM 606 CG2 THR A 551 20.551 -23.656 16.124 1.00 10.23 C ATOM 607 HA THR A 551 20.883 -25.398 14.025 1.00 0.00 H ATOM 608 HB THR A 551 22.198 -23.492 14.795 1.00 0.00 H ATOM 609 HG1 THR A 551 22.624 -25.057 17.167 1.00 0.00 H ATOM 610 HG23 THR A 551 19.802 -23.567 15.337 1.00 0.00 H ATOM 611 HG21 THR A 551 20.185 -24.327 16.901 1.00 0.00 H ATOM 612 HG22 THR A 551 20.747 -22.674 16.554 1.00 0.00 H ATOM 613 H THR A 551 21.508 -26.531 16.711 1.00 0.00 H ATOM 614 N PRO A 552 23.433 -25.362 13.125 1.00 8.43 N ATOM 615 CA PRO A 552 24.678 -25.835 12.502 1.00 9.11 C ATOM 616 C PRO A 552 25.833 -25.976 13.484 1.00 9.03 C ATOM 617 O PRO A 552 26.625 -26.936 13.388 1.00 9.57 O ATOM 618 CB PRO A 552 24.964 -24.771 11.425 1.00 9.92 C ATOM 619 CG PRO A 552 23.542 -24.360 11.012 1.00 10.78 C ATOM 620 CD PRO A 552 22.796 -24.288 12.324 1.00 9.51 C ATOM 621 HA PRO A 552 24.571 -26.842 12.097 1.00 0.00 H ATOM 622 HD3 PRO A 552 22.927 -23.315 12.797 1.00 0.00 H ATOM 623 HD2 PRO A 552 21.733 -24.482 12.182 1.00 0.00 H ATOM 624 HG3 PRO A 552 23.098 -25.105 10.352 1.00 0.00 H ATOM 625 HG2 PRO A 552 23.546 -23.391 10.513 1.00 0.00 H ATOM 626 HB2 PRO A 552 25.519 -23.928 11.836 1.00 0.00 H ATOM 627 HB3 PRO A 552 25.516 -25.193 10.585 1.00 0.00 H ATOM 628 N ALA A 553 25.932 -25.049 14.440 1.00 7.79 N ATOM 629 CA ALA A 553 27.017 -25.090 15.416 1.00 7.40 C ATOM 630 C ALA A 553 26.913 -26.300 16.357 1.00 8.50 C ATOM 631 O ALA A 553 27.915 -26.729 16.947 1.00 8.14 O ATOM 632 CB ALA A 553 27.069 -23.786 16.206 1.00 8.76 C ATOM 633 HA ALA A 553 27.949 -25.204 14.862 1.00 0.00 H ATOM 634 HB1 ALA A 553 27.237 -22.954 15.522 1.00 0.00 H ATOM 635 HB2 ALA A 553 26.124 -23.642 16.730 1.00 0.00 H ATOM 636 HB3 ALA A 553 27.883 -23.833 16.929 1.00 0.00 H ATOM 637 H ALA A 553 25.226 -24.287 14.490 1.00 0.00 H ATOM 638 N ASP A 554 25.670 -26.795 16.553 1.00 7.97 N ATOM 639 CA ASP A 554 25.456 -27.954 17.404 1.00 7.52 C ATOM 640 C ASP A 554 25.674 -29.251 16.630 1.00 8.86 C ATOM 641 O ASP A 554 25.886 -30.290 17.245 1.00 8.88 O ATOM 642 CB ASP A 554 24.009 -27.903 17.907 1.00 7.51 C ATOM 643 CG ASP A 554 23.619 -29.033 18.804 1.00 9.10 C ATOM 644 OD1 ASP A 554 24.342 -29.278 19.806 1.00 9.63 O ATOM 645 OD2 ASP A 554 22.614 -29.702 18.504 1.00 10.29 O ATOM 646 HA ASP A 554 26.164 -27.933 18.232 1.00 0.00 H ATOM 647 HB2 ASP A 554 23.873 -26.971 18.456 1.00 0.00 H ATOM 648 HB3 ASP A 554 23.348 -27.913 17.041 1.00 0.00 H ATOM 649 H ASP A 554 24.857 -26.341 16.089 1.00 0.00 H ATOM 650 N LEU A 555 25.501 -29.198 15.290 1.00 8.28 N ATOM 651 CA LEU A 555 25.509 -30.427 14.472 1.00 9.16 C ATOM 652 C LEU A 555 26.750 -30.625 13.632 1.00 10.34 C ATOM 653 O LEU A 555 26.846 -31.622 12.910 1.00 10.41 O ATOM 654 CB LEU A 555 24.267 -30.421 13.554 1.00 9.14 C ATOM 655 CG LEU A 555 22.926 -30.280 14.247 1.00 9.94 C ATOM 656 CD1 LEU A 555 21.815 -30.202 13.220 1.00 10.40 C ATOM 657 CD2 LEU A 555 22.681 -31.488 15.169 1.00 11.73 C ATOM 658 HA LEU A 555 25.496 -31.259 15.175 1.00 0.00 H ATOM 659 HB2 LEU A 555 24.371 -29.589 12.858 1.00 0.00 H ATOM 660 HB3 LEU A 555 24.258 -31.359 12.999 1.00 0.00 H ATOM 661 HG LEU A 555 22.935 -29.366 14.840 1.00 0.00 H ATOM 662 HD21 LEU A 555 22.685 -32.403 14.576 1.00 0.00 H ATOM 663 HD22 LEU A 555 23.470 -31.537 15.919 1.00 0.00 H ATOM 664 HD23 LEU A 555 21.715 -31.377 15.662 1.00 0.00 H ATOM 665 HD11 LEU A 555 21.978 -29.338 12.575 1.00 0.00 H ATOM 666 HD12 LEU A 555 21.814 -31.111 12.618 1.00 0.00 H ATOM 667 HD13 LEU A 555 20.857 -30.101 13.730 1.00 0.00 H ATOM 668 H LEU A 555 25.360 -28.277 14.828 1.00 0.00 H ATOM 669 N CYS A 556 27.725 -29.723 13.777 1.00 9.26 N ATOM 670 CA CYS A 556 28.920 -29.789 12.967 1.00 8.71 C ATOM 671 C CYS A 556 29.900 -30.843 13.417 1.00 10.74 C ATOM 672 O CYS A 556 29.700 -31.496 14.450 1.00 9.99 O ATOM 673 CB CYS A 556 29.543 -28.406 12.828 1.00 9.43 C ATOM 674 SG CYS A 556 29.826 -27.559 14.380 1.00 10.71 S ATOM 675 HA CYS A 556 28.619 -30.119 11.973 1.00 0.00 H ATOM 676 HB2 CYS A 556 28.877 -27.792 12.221 1.00 0.00 H ATOM 677 HB3 CYS A 556 30.501 -28.513 12.319 1.00 0.00 H ATOM 678 HG CYS A 556 30.681 -28.308 15.162 1.00 0.00 H ATOM 679 H CYS A 556 27.623 -28.964 14.481 1.00 0.00 H ATOM 680 N VAL A 557 30.972 -31.016 12.631 1.00 11.46 N ATOM 681 CA VAL A 557 31.971 -32.057 12.850 1.00 13.26 C ATOM 682 C VAL A 557 33.318 -31.461 13.251 1.00 15.42 C ATOM 683 O VAL A 557 34.032 -30.983 12.349 1.00 17.68 O ATOM 684 CB VAL A 557 32.120 -32.930 11.583 1.00 17.10 C ATOM 685 CG1 VAL A 557 33.241 -33.967 11.754 1.00 17.95 C ATOM 686 CG2 VAL A 557 30.796 -33.573 11.189 1.00 16.64 C ATOM 687 HA VAL A 557 31.629 -32.684 13.673 1.00 0.00 H ATOM 688 HB VAL A 557 32.409 -32.278 10.759 1.00 0.00 H ATOM 689 HG11 VAL A 557 34.185 -33.453 11.937 1.00 0.00 H ATOM 690 HG12 VAL A 557 33.009 -34.615 12.599 1.00 0.00 H ATOM 691 HG13 VAL A 557 33.322 -34.566 10.847 1.00 0.00 H ATOM 692 HG21 VAL A 557 30.443 -34.205 12.004 1.00 0.00 H ATOM 693 HG22 VAL A 557 30.061 -32.794 10.987 1.00 0.00 H ATOM 694 HG23 VAL A 557 30.940 -34.179 10.294 1.00 0.00 H ATOM 695 H VAL A 557 31.098 -30.374 11.822 1.00 0.00 H ATOM 696 N PRO A 558 33.744 -31.530 14.531 1.00 12.45 N ATOM 697 CA PRO A 558 32.955 -31.917 15.708 1.00 11.67 C ATOM 698 C PRO A 558 32.106 -30.717 16.121 1.00 11.51 C ATOM 699 O PRO A 558 32.172 -29.659 15.472 1.00 11.61 O ATOM 700 CB PRO A 558 34.039 -32.267 16.730 1.00 12.83 C ATOM 701 CG PRO A 558 35.091 -31.196 16.446 1.00 16.38 C ATOM 702 CD PRO A 558 35.075 -31.025 14.947 1.00 14.28 C ATOM 703 HA PRO A 558 32.260 -32.745 15.570 1.00 0.00 H ATOM 704 HD3 PRO A 558 35.191 -29.975 14.677 1.00 0.00 H ATOM 705 HD2 PRO A 558 35.871 -31.608 14.484 1.00 0.00 H ATOM 706 HG3 PRO A 558 36.074 -31.524 16.785 1.00 0.00 H ATOM 707 HG2 PRO A 558 34.831 -30.261 16.942 1.00 0.00 H ATOM 708 HB2 PRO A 558 33.662 -32.193 17.750 1.00 0.00 H ATOM 709 HB3 PRO A 558 34.436 -33.268 16.562 1.00 0.00 H ATOM 710 N ARG A 559 31.359 -30.859 17.197 1.00 10.43 N ATOM 711 CA ARG A 559 30.495 -29.784 17.665 1.00 8.26 C ATOM 712 C ARG A 559 31.305 -28.569 18.073 1.00 8.68 C ATOM 713 O ARG A 559 32.385 -28.729 18.626 1.00 10.77 O ATOM 714 CB ARG A 559 29.719 -30.290 18.884 1.00 9.26 C ATOM 715 CG ARG A 559 28.550 -29.372 19.185 1.00 11.18 C ATOM 716 CD ARG A 559 28.183 -29.507 20.631 1.00 14.23 C ATOM 717 NE ARG A 559 26.902 -28.881 20.942 1.00 9.81 N ATOM 718 CZ ARG A 559 26.742 -28.046 21.948 1.00 10.48 C ATOM 719 NH1 ARG A 559 27.796 -27.663 22.688 1.00 12.30 N ATOM 720 NH2 ARG A 559 25.539 -27.574 22.232 1.00 12.19 N ATOM 721 HA ARG A 559 29.822 -29.494 16.858 1.00 0.00 H ATOM 722 HB2 ARG A 559 29.345 -31.293 18.681 1.00 0.00 H ATOM 723 HB3 ARG A 559 30.384 -30.319 19.747 1.00 0.00 H ATOM 724 HG2 ARG A 559 28.831 -28.340 18.974 1.00 0.00 H ATOM 725 HG3 ARG A 559 27.698 -29.649 18.564 1.00 0.00 H ATOM 726 HD2 ARG A 559 28.959 -29.036 21.235 1.00 0.00 H ATOM 727 HD3 ARG A 559 28.124 -30.567 20.880 1.00 0.00 H ATOM 728 HE ARG A 559 26.081 -29.104 20.344 1.00 0.00 H ATOM 729 HH12 ARG A 559 27.662 -27.003 23.481 1.00 0.00 H ATOM 730 HH11 ARG A 559 28.745 -28.026 22.468 1.00 0.00 H ATOM 731 HH22 ARG A 559 25.413 -26.915 23.026 1.00 0.00 H ATOM 732 HH21 ARG A 559 24.719 -27.862 21.661 1.00 0.00 H ATOM 733 H ARG A 559 31.387 -31.756 17.722 1.00 0.00 H ATOM 734 N LEU A 560 30.748 -27.369 17.858 1.00 9.03 N ATOM 735 CA LEU A 560 31.339 -26.155 18.420 1.00 8.49 C ATOM 736 C LEU A 560 30.850 -26.133 19.874 1.00 12.37 C ATOM 737 O LEU A 560 29.684 -26.464 20.144 1.00 14.91 O ATOM 738 CB LEU A 560 30.834 -24.928 17.661 1.00 9.02 C ATOM 739 CG LEU A 560 31.487 -23.618 18.062 1.00 10.22 C ATOM 740 CD1 LEU A 560 32.969 -23.582 17.694 1.00 11.75 C ATOM 741 CD2 LEU A 560 30.752 -22.472 17.391 1.00 11.49 C ATOM 742 HA LEU A 560 32.427 -26.142 18.351 1.00 0.00 H ATOM 743 HB2 LEU A 560 31.017 -25.087 16.598 1.00 0.00 H ATOM 744 HB3 LEU A 560 29.761 -24.840 17.834 1.00 0.00 H ATOM 745 HG LEU A 560 31.423 -23.521 19.146 1.00 0.00 H ATOM 746 HD21 LEU A 560 30.804 -22.593 16.309 1.00 0.00 H ATOM 747 HD22 LEU A 560 29.709 -22.475 17.708 1.00 0.00 H ATOM 748 HD23 LEU A 560 31.217 -21.528 17.675 1.00 0.00 H ATOM 749 HD11 LEU A 560 33.489 -24.393 18.205 1.00 0.00 H ATOM 750 HD12 LEU A 560 33.077 -23.701 16.616 1.00 0.00 H ATOM 751 HD13 LEU A 560 33.395 -22.626 18.000 1.00 0.00 H ATOM 752 H LEU A 560 29.884 -27.300 17.284 1.00 0.00 H ATOM 753 N ASN A 561 31.720 -25.804 20.821 1.00 10.20 N ATOM 754 CA ASN A 561 31.330 -25.847 22.228 1.00 9.80 C ATOM 755 C ASN A 561 31.477 -24.526 22.934 1.00 10.40 C ATOM 756 O ASN A 561 32.393 -23.742 22.658 1.00 10.33 O ATOM 757 CB ASN A 561 32.146 -26.909 22.982 1.00 10.07 C ATOM 758 CG ASN A 561 31.820 -28.293 22.570 1.00 12.82 C ATOM 759 OD1 ASN A 561 30.660 -28.707 22.697 1.00 15.38 O ATOM 760 ND2 ASN A 561 32.814 -29.016 22.073 1.00 13.13 N ATOM 761 HA ASN A 561 30.270 -26.103 22.232 1.00 0.00 H ATOM 762 HB2 ASN A 561 33.205 -26.731 22.794 1.00 0.00 H ATOM 763 HB3 ASN A 561 31.946 -26.808 24.049 1.00 0.00 H ATOM 764 HD22 ASN A 561 33.766 -28.606 21.994 1.00 0.00 H ATOM 765 HD21 ASN A 561 32.641 -29.993 21.762 1.00 0.00 H ATOM 766 H ASN A 561 32.684 -25.514 20.560 1.00 0.00 H ATOM 767 N GLU A 562 30.630 -24.319 23.922 1.00 9.69 N ATOM 768 CA GLU A 562 30.791 -23.171 24.812 1.00 9.42 C ATOM 769 C GLU A 562 32.166 -23.214 25.447 1.00 12.74 C ATOM 770 O GLU A 562 32.654 -24.305 25.810 1.00 13.03 O ATOM 771 CB GLU A 562 29.716 -23.201 25.902 1.00 10.83 C ATOM 772 CG GLU A 562 28.350 -22.970 25.340 1.00 13.15 C ATOM 773 CD GLU A 562 27.574 -24.207 24.951 1.00 25.28 C ATOM 774 OE1 GLU A 562 28.179 -25.298 24.756 1.00 19.52 O ATOM 775 OE2 GLU A 562 26.329 -24.066 24.861 1.00 24.90 O ATOM 776 HA GLU A 562 30.686 -22.252 24.236 1.00 0.00 H ATOM 777 HB2 GLU A 562 29.737 -24.175 26.392 1.00 0.00 H ATOM 778 HB3 GLU A 562 29.933 -22.423 26.634 1.00 0.00 H ATOM 779 HG2 GLU A 562 27.768 -22.433 26.089 1.00 0.00 H ATOM 780 HG3 GLU A 562 28.456 -22.349 24.450 1.00 0.00 H ATOM 781 H GLU A 562 29.840 -24.979 24.070 1.00 0.00 H ATOM 782 N GLY A 563 32.818 -22.062 25.479 1.00 10.84 N ATOM 783 CA GLY A 563 34.160 -21.971 26.039 1.00 11.14 C ATOM 784 C GLY A 563 35.256 -22.083 24.999 1.00 11.83 C ATOM 785 O GLY A 563 36.416 -21.731 25.281 1.00 13.63 O ATOM 786 HA3 GLY A 563 34.287 -22.775 26.763 1.00 0.00 H ATOM 787 HA2 GLY A 563 34.259 -21.010 26.544 1.00 0.00 H ATOM 788 H GLY A 563 32.364 -21.207 25.098 1.00 0.00 H ATOM 789 N ASP A 564 34.888 -22.498 23.761 1.00 9.69 N ATOM 790 CA ASP A 564 35.895 -22.573 22.721 1.00 9.25 C ATOM 791 C ASP A 564 36.351 -21.170 22.383 1.00 10.69 C ATOM 792 O ASP A 564 35.521 -20.260 22.236 1.00 10.66 O ATOM 793 CB ASP A 564 35.318 -23.202 21.454 1.00 10.11 C ATOM 794 CG ASP A 564 35.141 -24.724 21.454 1.00 13.08 C ATOM 795 OD1 ASP A 564 35.553 -25.377 22.442 1.00 12.21 O ATOM 796 OD2 ASP A 564 34.556 -25.236 20.470 1.00 12.25 O ATOM 797 HA ASP A 564 36.724 -23.182 23.081 1.00 0.00 H ATOM 798 HB2 ASP A 564 34.338 -22.756 21.282 1.00 0.00 H ATOM 799 HB3 ASP A 564 35.982 -22.947 20.628 1.00 0.00 H ATOM 800 H ASP A 564 33.901 -22.758 23.562 1.00 0.00 H ATOM 801 N GLN A 565 37.671 -20.971 22.262 1.00 10.10 N ATOM 802 CA GLN A 565 38.221 -19.659 21.936 1.00 10.98 C ATOM 803 C GLN A 565 38.441 -19.601 20.430 1.00 12.04 C ATOM 804 O GLN A 565 39.087 -20.503 19.869 1.00 12.71 O ATOM 805 CB GLN A 565 39.560 -19.457 22.653 1.00 12.32 C ATOM 806 CG GLN A 565 40.182 -18.111 22.299 1.00 21.20 C ATOM 807 CD GLN A 565 41.544 -17.877 22.912 1.00 41.34 C ATOM 808 OE1 GLN A 565 41.890 -18.432 23.962 1.00 40.28 O ATOM 809 NE2 GLN A 565 42.328 -16.996 22.293 1.00 25.13 N ATOM 810 HA GLN A 565 37.533 -18.877 22.255 1.00 0.00 H ATOM 811 HB2 GLN A 565 39.396 -19.500 23.730 1.00 0.00 H ATOM 812 HB3 GLN A 565 40.244 -20.253 22.358 1.00 0.00 H ATOM 813 HG2 GLN A 565 40.280 -18.054 21.215 1.00 0.00 H ATOM 814 HG3 GLN A 565 39.512 -17.323 22.643 1.00 0.00 H ATOM 815 HE22 GLN A 565 42.009 -16.546 21.411 1.00 0.00 H ATOM 816 HE21 GLN A 565 43.259 -16.758 22.691 1.00 0.00 H ATOM 817 H GLN A 565 38.320 -21.772 22.404 1.00 0.00 H ATOM 818 N VAL A 566 37.906 -18.557 19.773 1.00 10.52 N ATOM 819 CA VAL A 566 38.039 -18.459 18.317 1.00 10.38 C ATOM 820 C VAL A 566 39.392 -17.856 17.958 1.00 12.17 C ATOM 821 O VAL A 566 39.698 -16.741 18.386 1.00 14.16 O ATOM 822 CB VAL A 566 36.862 -17.667 17.719 1.00 13.34 C ATOM 823 CG1 VAL A 566 36.953 -17.614 16.191 1.00 13.09 C ATOM 824 CG2 VAL A 566 35.534 -18.317 18.125 1.00 13.08 C ATOM 825 HA VAL A 566 38.001 -19.457 17.880 1.00 0.00 H ATOM 826 HB VAL A 566 36.910 -16.649 18.107 1.00 0.00 H ATOM 827 HG11 VAL A 566 37.884 -17.128 15.900 1.00 0.00 H ATOM 828 HG12 VAL A 566 36.931 -18.628 15.792 1.00 0.00 H ATOM 829 HG13 VAL A 566 36.108 -17.048 15.797 1.00 0.00 H ATOM 830 HG21 VAL A 566 35.504 -19.341 17.754 1.00 0.00 H ATOM 831 HG22 VAL A 566 35.450 -18.321 19.212 1.00 0.00 H ATOM 832 HG23 VAL A 566 34.707 -17.750 17.697 1.00 0.00 H ATOM 833 H VAL A 566 37.397 -17.818 20.299 1.00 0.00 H ATOM 834 N VAL A 567 40.217 -18.591 17.195 1.00 10.70 N ATOM 835 CA VAL A 567 41.555 -18.142 16.791 1.00 11.41 C ATOM 836 C VAL A 567 41.511 -17.569 15.378 1.00 13.88 C ATOM 837 O VAL A 567 42.017 -16.467 15.153 1.00 13.86 O ATOM 838 CB VAL A 567 42.565 -19.327 16.883 1.00 15.75 C ATOM 839 CG1 VAL A 567 43.955 -18.919 16.370 1.00 18.11 C ATOM 840 CG2 VAL A 567 42.642 -19.844 18.324 1.00 15.48 C ATOM 841 HA VAL A 567 41.889 -17.355 17.467 1.00 0.00 H ATOM 842 HB VAL A 567 42.205 -20.132 16.242 1.00 0.00 H ATOM 843 HG11 VAL A 567 43.879 -18.608 15.328 1.00 0.00 H ATOM 844 HG12 VAL A 567 44.334 -18.092 16.971 1.00 0.00 H ATOM 845 HG13 VAL A 567 44.634 -19.768 16.449 1.00 0.00 H ATOM 846 HG21 VAL A 567 42.974 -19.039 18.980 1.00 0.00 H ATOM 847 HG22 VAL A 567 41.657 -20.188 18.638 1.00 0.00 H ATOM 848 HG23 VAL A 567 43.350 -20.671 18.375 1.00 0.00 H ATOM 849 H VAL A 567 39.892 -19.525 16.874 1.00 0.00 H ATOM 850 N LEU A 568 40.886 -18.308 14.435 1.00 11.05 N ATOM 851 CA LEU A 568 40.759 -17.852 13.037 1.00 11.50 C ATOM 852 C LEU A 568 39.331 -17.951 12.596 1.00 11.43 C ATOM 853 O LEU A 568 38.597 -18.847 13.023 1.00 10.71 O ATOM 854 CB LEU A 568 41.530 -18.734 12.063 1.00 12.84 C ATOM 855 CG LEU A 568 43.038 -18.952 12.246 1.00 16.98 C ATOM 856 CD1 LEU A 568 43.592 -19.832 11.104 1.00 16.63 C ATOM 857 CD2 LEU A 568 43.813 -17.634 12.274 1.00 15.17 C ATOM 858 HA LEU A 568 41.145 -16.833 13.023 1.00 0.00 H ATOM 859 HB2 LEU A 568 41.064 -19.719 12.095 1.00 0.00 H ATOM 860 HB3 LEU A 568 41.393 -18.301 11.072 1.00 0.00 H ATOM 861 HG LEU A 568 43.172 -19.449 13.207 1.00 0.00 H ATOM 862 HD21 LEU A 568 43.659 -17.103 11.335 1.00 0.00 H ATOM 863 HD22 LEU A 568 43.456 -17.022 13.102 1.00 0.00 H ATOM 864 HD23 LEU A 568 44.875 -17.841 12.405 1.00 0.00 H ATOM 865 HD11 LEU A 568 43.087 -20.798 11.114 1.00 0.00 H ATOM 866 HD12 LEU A 568 43.416 -19.338 10.148 1.00 0.00 H ATOM 867 HD13 LEU A 568 44.663 -19.978 11.247 1.00 0.00 H ATOM 868 H LEU A 568 40.481 -19.228 14.703 1.00 0.00 H ATOM 869 N ILE A 569 38.924 -17.008 11.713 1.00 10.23 N ATOM 870 CA ILE A 569 37.632 -17.033 11.074 1.00 9.02 C ATOM 871 C ILE A 569 37.913 -16.979 9.595 1.00 11.76 C ATOM 872 O ILE A 569 38.464 -15.974 9.120 1.00 12.40 O ATOM 873 CB ILE A 569 36.714 -15.875 11.509 1.00 10.47 C ATOM 874 CG1 ILE A 569 36.476 -15.976 13.022 1.00 12.10 C ATOM 875 CG2 ILE A 569 35.385 -15.904 10.697 1.00 11.21 C ATOM 876 CD1 ILE A 569 35.697 -14.851 13.611 1.00 15.69 C ATOM 877 HA ILE A 569 37.088 -17.933 11.360 1.00 0.00 H ATOM 878 HB ILE A 569 37.187 -14.916 11.300 1.00 0.00 H ATOM 879 HG12 ILE A 569 35.936 -16.902 13.219 1.00 0.00 H ATOM 880 HG13 ILE A 569 37.447 -16.011 13.516 1.00 0.00 H ATOM 881 HD11 ILE A 569 36.227 -13.914 13.439 1.00 0.00 H ATOM 882 HD12 ILE A 569 34.715 -14.806 13.141 1.00 0.00 H ATOM 883 HD13 ILE A 569 35.582 -15.013 14.683 1.00 0.00 H ATOM 884 HG21 ILE A 569 35.607 -15.803 9.635 1.00 0.00 H ATOM 885 HG22 ILE A 569 34.873 -16.850 10.874 1.00 0.00 H ATOM 886 HG23 ILE A 569 34.748 -15.079 11.016 1.00 0.00 H ATOM 887 H ILE A 569 39.574 -16.229 11.485 1.00 0.00 H ATOM 888 N ASN A 570 37.523 -18.020 8.856 1.00 11.01 N ATOM 889 CA ASN A 570 37.829 -18.088 7.422 1.00 11.42 C ATOM 890 C ASN A 570 39.304 -17.765 7.161 1.00 14.84 C ATOM 891 O ASN A 570 39.636 -17.018 6.239 1.00 16.10 O ATOM 892 CB ASN A 570 36.904 -17.183 6.616 1.00 12.46 C ATOM 893 CG ASN A 570 35.480 -17.645 6.725 1.00 12.74 C ATOM 894 OD1 ASN A 570 35.201 -18.854 6.707 1.00 13.87 O ATOM 895 ND2 ASN A 570 34.574 -16.696 6.788 1.00 11.82 N ATOM 896 HA ASN A 570 37.652 -19.110 7.088 1.00 0.00 H ATOM 897 HB2 ASN A 570 36.980 -16.164 6.996 1.00 0.00 H ATOM 898 HB3 ASN A 570 37.207 -17.202 5.569 1.00 0.00 H ATOM 899 HD22 ASN A 570 34.866 -15.698 6.800 1.00 0.00 H ATOM 900 HD21 ASN A 570 33.564 -16.943 6.826 1.00 0.00 H ATOM 901 H ASN A 570 36.994 -18.795 9.304 1.00 0.00 H ATOM 902 N GLY A 571 40.163 -18.320 8.002 1.00 13.92 N ATOM 903 CA GLY A 571 41.617 -18.165 7.856 1.00 15.02 C ATOM 904 C GLY A 571 42.251 -16.907 8.396 1.00 19.08 C ATOM 905 O GLY A 571 43.491 -16.795 8.422 1.00 22.03 O ATOM 906 HA3 GLY A 571 41.843 -18.211 6.791 1.00 0.00 H ATOM 907 HA2 GLY A 571 42.086 -19.008 8.363 1.00 0.00 H ATOM 908 H GLY A 571 39.796 -18.886 8.794 1.00 0.00 H ATOM 909 N ARG A 572 41.417 -15.959 8.849 1.00 15.19 N ATOM 910 CA ARG A 572 41.880 -14.665 9.315 1.00 15.56 C ATOM 911 C ARG A 572 42.108 -14.644 10.792 1.00 16.13 C ATOM 912 O ARG A 572 41.236 -15.057 11.545 1.00 13.72 O ATOM 913 CB ARG A 572 40.844 -13.626 8.954 1.00 16.61 C ATOM 914 CG ARG A 572 41.272 -12.200 9.236 1.00 21.71 C ATOM 915 CD ARG A 572 40.077 -11.289 9.287 1.00 20.67 C ATOM 916 NE ARG A 572 39.256 -11.369 8.077 1.00 25.01 N ATOM 917 CZ ARG A 572 39.364 -10.557 7.031 1.00 40.51 C ATOM 918 NH1 ARG A 572 40.262 -9.576 7.030 1.00 30.90 N ATOM 919 NH2 ARG A 572 38.549 -10.691 5.997 1.00 28.17 N ATOM 920 HA ARG A 572 42.835 -14.452 8.835 1.00 0.00 H ATOM 921 HB2 ARG A 572 40.627 -13.714 7.889 1.00 0.00 H ATOM 922 HB3 ARG A 572 39.939 -13.831 9.526 1.00 0.00 H ATOM 923 HG2 ARG A 572 41.791 -12.164 10.194 1.00 0.00 H ATOM 924 HG3 ARG A 572 41.945 -11.865 8.447 1.00 0.00 H ATOM 925 HD2 ARG A 572 40.425 -10.263 9.406 1.00 0.00 H ATOM 926 HD3 ARG A 572 39.463 -11.565 10.145 1.00 0.00 H ATOM 927 HE ARG A 572 38.535 -12.117 8.033 1.00 0.00 H ATOM 928 HH12 ARG A 572 40.341 -8.944 6.208 1.00 0.00 H ATOM 929 HH11 ARG A 572 40.885 -9.441 7.851 1.00 0.00 H ATOM 930 HH22 ARG A 572 38.636 -10.054 5.180 1.00 0.00 H ATOM 931 HH21 ARG A 572 37.821 -11.434 6.001 1.00 0.00 H ATOM 932 H ARG A 572 40.397 -16.160 8.867 1.00 0.00 H ATOM 933 N ASP A 573 43.276 -14.147 11.215 1.00 16.65 N ATOM 934 CA ASP A 573 43.627 -13.973 12.601 1.00 15.93 C ATOM 935 C ASP A 573 42.825 -12.781 13.130 1.00 18.63 C ATOM 936 O ASP A 573 42.991 -11.650 12.653 1.00 20.86 O ATOM 937 CB ASP A 573 45.147 -13.701 12.680 1.00 18.31 C ATOM 938 CG ASP A 573 45.695 -13.441 14.060 1.00 25.64 C ATOM 939 OD1 ASP A 573 44.899 -13.402 15.022 1.00 22.14 O ATOM 940 OD2 ASP A 573 46.917 -13.214 14.174 1.00 33.63 O ATOM 941 HA ASP A 573 43.399 -14.855 13.199 1.00 0.00 H ATOM 942 HB2 ASP A 573 45.664 -14.570 12.272 1.00 0.00 H ATOM 943 HB3 ASP A 573 45.364 -12.828 12.064 1.00 0.00 H ATOM 944 H ASP A 573 43.975 -13.869 10.497 1.00 0.00 H ATOM 945 N ILE A 574 41.992 -13.018 14.128 1.00 14.44 N ATOM 946 CA ILE A 574 41.126 -11.958 14.668 1.00 14.49 C ATOM 947 C ILE A 574 41.587 -11.303 15.973 1.00 18.07 C ATOM 948 O ILE A 574 40.819 -10.560 16.581 1.00 17.45 O ATOM 949 CB ILE A 574 39.675 -12.497 14.786 1.00 16.17 C ATOM 950 CG1 ILE A 574 39.618 -13.739 15.727 1.00 17.06 C ATOM 951 CG2 ILE A 574 39.093 -12.768 13.389 1.00 19.78 C ATOM 952 CD1 ILE A 574 38.226 -14.068 16.244 1.00 20.69 C ATOM 953 HA ILE A 574 41.184 -11.140 13.950 1.00 0.00 H ATOM 954 HB ILE A 574 39.044 -11.738 15.249 1.00 0.00 H ATOM 955 HG12 ILE A 574 39.991 -14.603 15.176 1.00 0.00 H ATOM 956 HG13 ILE A 574 40.265 -13.549 16.584 1.00 0.00 H ATOM 957 HD11 ILE A 574 37.840 -13.220 16.810 1.00 0.00 H ATOM 958 HD12 ILE A 574 37.566 -14.275 15.401 1.00 0.00 H ATOM 959 HD13 ILE A 574 38.278 -14.944 16.890 1.00 0.00 H ATOM 960 HG21 ILE A 574 39.084 -11.842 12.815 1.00 0.00 H ATOM 961 HG22 ILE A 574 39.708 -13.508 12.878 1.00 0.00 H ATOM 962 HG23 ILE A 574 38.075 -13.145 13.488 1.00 0.00 H ATOM 963 H ILE A 574 41.948 -13.972 14.540 1.00 0.00 H ATOM 964 N ALA A 575 42.821 -11.567 16.419 1.00 17.99 N ATOM 965 CA ALA A 575 43.298 -11.049 17.711 1.00 19.03 C ATOM 966 C ALA A 575 43.153 -9.561 17.970 1.00 23.11 C ATOM 967 O ALA A 575 42.893 -9.161 19.105 1.00 26.10 O ATOM 968 CB ALA A 575 44.744 -11.485 17.942 1.00 20.98 C ATOM 969 HA ALA A 575 42.614 -11.495 18.433 1.00 0.00 H ATOM 970 HB1 ALA A 575 44.797 -12.574 17.948 1.00 0.00 H ATOM 971 HB2 ALA A 575 45.372 -11.093 17.142 1.00 0.00 H ATOM 972 HB3 ALA A 575 45.090 -11.098 18.900 1.00 0.00 H ATOM 973 H ALA A 575 43.457 -12.151 15.839 1.00 0.00 H ATOM 974 N GLU A 576 43.355 -8.739 16.962 1.00 18.70 N ATOM 975 CA GLU A 576 43.323 -7.294 17.219 1.00 18.74 C ATOM 976 C GLU A 576 42.003 -6.654 16.828 1.00 16.75 C ATOM 977 O GLU A 576 41.875 -5.430 16.878 1.00 18.33 O ATOM 978 CB GLU A 576 44.491 -6.599 16.492 1.00 22.32 C ATOM 979 CG GLU A 576 45.876 -7.189 16.771 1.00 36.39 C ATOM 980 CD GLU A 576 46.355 -7.260 18.213 1.00 69.33 C ATOM 981 OE1 GLU A 576 46.005 -6.363 19.015 1.00 68.29 O ATOM 982 OE2 GLU A 576 47.123 -8.198 18.529 1.00 70.46 O ATOM 983 HA GLU A 576 43.430 -7.161 18.296 1.00 0.00 H ATOM 984 HB2 GLU A 576 44.307 -6.663 15.420 1.00 0.00 H ATOM 985 HB3 GLU A 576 44.503 -5.552 16.796 1.00 0.00 H ATOM 986 HG2 GLU A 576 45.878 -8.206 16.380 1.00 0.00 H ATOM 987 HG3 GLU A 576 46.600 -6.588 16.220 1.00 0.00 H ATOM 988 H GLU A 576 43.533 -9.105 16.005 1.00 0.00 H ATOM 989 N HIS A 577 41.007 -7.495 16.476 1.00 13.65 N ATOM 990 CA HIS A 577 39.733 -7.025 15.992 1.00 12.91 C ATOM 991 C HIS A 577 38.696 -6.880 17.078 1.00 13.23 C ATOM 992 O HIS A 577 38.682 -7.635 18.057 1.00 13.34 O ATOM 993 CB HIS A 577 39.204 -7.953 14.878 1.00 13.20 C ATOM 994 CG HIS A 577 39.982 -7.854 13.602 1.00 16.41 C ATOM 995 ND1 HIS A 577 40.869 -8.847 13.219 1.00 20.54 N ATOM 996 CD2 HIS A 577 39.949 -6.901 12.645 1.00 19.13 C ATOM 997 CE1 HIS A 577 41.396 -8.434 12.071 1.00 20.30 C ATOM 998 NE2 HIS A 577 40.850 -7.294 11.667 1.00 20.23 N ATOM 999 HA HIS A 577 39.909 -6.027 15.591 1.00 0.00 H ATOM 1000 HB2 HIS A 577 39.252 -8.982 15.233 1.00 0.00 H ATOM 1001 HB3 HIS A 577 38.167 -7.689 14.672 1.00 0.00 H ATOM 1002 HD2 HIS A 577 39.335 -6.000 12.642 1.00 0.00 H ATOM 1003 HE1 HIS A 577 42.179 -8.965 11.529 1.00 0.00 H ATOM 1004 H HIS A 577 41.165 -8.520 16.557 1.00 0.00 H ATOM 1005 N THR A 578 37.833 -5.874 16.902 1.00 11.17 N ATOM 1006 CA THR A 578 36.792 -5.683 17.893 1.00 10.94 C ATOM 1007 C THR A 578 35.752 -6.791 17.748 1.00 11.55 C ATOM 1008 O THR A 578 35.656 -7.484 16.715 1.00 10.99 O ATOM 1009 CB THR A 578 36.081 -4.349 17.678 1.00 11.54 C ATOM 1010 OG1 THR A 578 35.315 -4.402 16.462 1.00 12.62 O ATOM 1011 CG2 THR A 578 37.011 -3.155 17.723 1.00 11.62 C ATOM 1012 HA THR A 578 37.253 -5.700 18.881 1.00 0.00 H ATOM 1013 HB THR A 578 35.401 -4.197 18.516 1.00 0.00 H ATOM 1014 HG1 THR A 578 34.855 -3.536 16.325 1.00 0.00 H ATOM 1015 HG23 THR A 578 37.565 -3.163 18.662 1.00 0.00 H ATOM 1016 HG21 THR A 578 37.709 -3.208 16.887 1.00 0.00 H ATOM 1017 HG22 THR A 578 36.426 -2.238 17.653 1.00 0.00 H ATOM 1018 H THR A 578 37.906 -5.246 16.077 1.00 0.00 H ATOM 1019 N HIS A 579 34.879 -6.877 18.760 1.00 9.91 N ATOM 1020 CA HIS A 579 33.764 -7.798 18.734 1.00 9.13 C ATOM 1021 C HIS A 579 32.940 -7.633 17.451 1.00 10.33 C ATOM 1022 O HIS A 579 32.620 -8.638 16.803 1.00 9.53 O ATOM 1023 CB HIS A 579 32.856 -7.502 19.951 1.00 9.33 C ATOM 1024 CG HIS A 579 31.687 -8.424 20.119 1.00 9.54 C ATOM 1025 ND1 HIS A 579 31.751 -9.541 20.934 1.00 9.89 N ATOM 1026 CD2 HIS A 579 30.452 -8.364 19.566 1.00 10.44 C ATOM 1027 CE1 HIS A 579 30.547 -10.114 20.865 1.00 8.86 C ATOM 1028 NE2 HIS A 579 29.730 -9.432 20.069 1.00 9.08 N ATOM 1029 HA HIS A 579 34.149 -8.817 18.769 1.00 0.00 H ATOM 1030 HB2 HIS A 579 33.468 -7.566 20.851 1.00 0.00 H ATOM 1031 HB3 HIS A 579 32.472 -6.487 19.846 1.00 0.00 H ATOM 1032 HD2 HIS A 579 30.094 -7.616 18.858 1.00 0.00 H ATOM 1033 HE1 HIS A 579 30.269 -11.025 21.394 1.00 0.00 H ATOM 1034 H HIS A 579 35.007 -6.263 19.590 1.00 0.00 H ATOM 1035 N ASP A 580 32.498 -6.397 17.140 1.00 10.04 N ATOM 1036 CA ASP A 580 31.639 -6.218 15.976 1.00 8.97 C ATOM 1037 C ASP A 580 32.392 -6.467 14.668 1.00 11.39 C ATOM 1038 O ASP A 580 31.754 -6.886 13.693 1.00 10.25 O ATOM 1039 CB ASP A 580 30.960 -4.859 16.015 1.00 10.04 C ATOM 1040 CG ASP A 580 29.845 -4.731 17.049 1.00 9.76 C ATOM 1041 OD1 ASP A 580 29.471 -5.771 17.684 1.00 9.56 O ATOM 1042 OD2 ASP A 580 29.344 -3.601 17.227 1.00 12.52 O ATOM 1043 HA ASP A 580 30.853 -6.972 16.014 1.00 0.00 H ATOM 1044 HB2 ASP A 580 31.717 -4.107 16.238 1.00 0.00 H ATOM 1045 HB3 ASP A 580 30.534 -4.664 15.031 1.00 0.00 H ATOM 1046 H ASP A 580 32.767 -5.580 17.725 1.00 0.00 H ATOM 1047 N GLN A 581 33.705 -6.248 14.634 1.00 10.25 N ATOM 1048 CA GLN A 581 34.468 -6.595 13.429 1.00 10.53 C ATOM 1049 C GLN A 581 34.443 -8.099 13.220 1.00 12.97 C ATOM 1050 O GLN A 581 34.241 -8.562 12.081 1.00 12.63 O ATOM 1051 CB GLN A 581 35.891 -6.100 13.545 1.00 12.17 C ATOM 1052 CG GLN A 581 35.994 -4.611 13.224 1.00 12.27 C ATOM 1053 CD GLN A 581 37.303 -4.003 13.636 1.00 16.95 C ATOM 1054 OE1 GLN A 581 38.142 -4.607 14.290 1.00 14.66 O ATOM 1055 NE2 GLN A 581 37.426 -2.701 13.406 1.00 24.40 N ATOM 1056 HA GLN A 581 34.008 -6.111 12.567 1.00 0.00 H ATOM 1057 HB2 GLN A 581 36.243 -6.268 14.563 1.00 0.00 H ATOM 1058 HB3 GLN A 581 36.518 -6.657 12.848 1.00 0.00 H ATOM 1059 HG2 GLN A 581 35.875 -4.480 12.149 1.00 0.00 H ATOM 1060 HG3 GLN A 581 35.191 -4.089 13.744 1.00 0.00 H ATOM 1061 HE22 GLN A 581 36.705 -2.201 12.848 1.00 0.00 H ATOM 1062 HE21 GLN A 581 38.244 -2.181 13.784 1.00 0.00 H ATOM 1063 H GLN A 581 34.187 -5.833 15.457 1.00 0.00 H ATOM 1064 N VAL A 582 34.533 -8.861 14.328 1.00 9.71 N ATOM 1065 CA VAL A 582 34.458 -10.334 14.303 1.00 9.93 C ATOM 1066 C VAL A 582 33.082 -10.774 13.852 1.00 10.72 C ATOM 1067 O VAL A 582 32.963 -11.725 13.057 1.00 10.82 O ATOM 1068 CB VAL A 582 34.846 -10.879 15.701 1.00 11.44 C ATOM 1069 CG1 VAL A 582 34.421 -12.340 15.884 1.00 12.12 C ATOM 1070 CG2 VAL A 582 36.354 -10.739 15.912 1.00 12.60 C ATOM 1071 HA VAL A 582 35.164 -10.747 13.582 1.00 0.00 H ATOM 1072 HB VAL A 582 34.315 -10.288 16.447 1.00 0.00 H ATOM 1073 HG11 VAL A 582 33.339 -12.419 15.775 1.00 0.00 H ATOM 1074 HG12 VAL A 582 34.910 -12.956 15.129 1.00 0.00 H ATOM 1075 HG13 VAL A 582 34.713 -12.680 16.878 1.00 0.00 H ATOM 1076 HG21 VAL A 582 36.881 -11.306 15.145 1.00 0.00 H ATOM 1077 HG22 VAL A 582 36.633 -9.687 15.845 1.00 0.00 H ATOM 1078 HG23 VAL A 582 36.619 -11.124 16.897 1.00 0.00 H ATOM 1079 H VAL A 582 34.662 -8.388 15.245 1.00 0.00 H ATOM 1080 N VAL A 583 31.999 -10.130 14.337 1.00 9.08 N ATOM 1081 CA VAL A 583 30.662 -10.460 13.889 1.00 8.48 C ATOM 1082 C VAL A 583 30.542 -10.271 12.369 1.00 11.30 C ATOM 1083 O VAL A 583 30.017 -11.186 11.693 1.00 10.05 O ATOM 1084 CB VAL A 583 29.608 -9.631 14.669 1.00 9.89 C ATOM 1085 CG1 VAL A 583 28.208 -9.718 14.046 1.00 10.25 C ATOM 1086 CG2 VAL A 583 29.589 -10.052 16.123 1.00 9.80 C ATOM 1087 HA VAL A 583 30.465 -11.511 14.099 1.00 0.00 H ATOM 1088 HB VAL A 583 29.904 -8.584 14.607 1.00 0.00 H ATOM 1089 HG11 VAL A 583 28.242 -9.340 13.024 1.00 0.00 H ATOM 1090 HG12 VAL A 583 27.879 -10.757 14.039 1.00 0.00 H ATOM 1091 HG13 VAL A 583 27.512 -9.119 14.634 1.00 0.00 H ATOM 1092 HG21 VAL A 583 29.335 -11.110 16.190 1.00 0.00 H ATOM 1093 HG22 VAL A 583 30.573 -9.885 16.561 1.00 0.00 H ATOM 1094 HG23 VAL A 583 28.846 -9.463 16.661 1.00 0.00 H ATOM 1095 H VAL A 583 32.128 -9.381 15.047 1.00 0.00 H ATOM 1096 N LEU A 584 31.063 -9.154 11.834 1.00 10.75 N ATOM 1097 CA LEU A 584 30.946 -8.980 10.379 1.00 10.39 C ATOM 1098 C LEU A 584 31.757 -10.059 9.649 1.00 12.32 C ATOM 1099 O LEU A 584 31.275 -10.575 8.631 1.00 12.28 O ATOM 1100 CB LEU A 584 31.406 -7.581 9.964 1.00 11.32 C ATOM 1101 CG LEU A 584 31.162 -7.242 8.450 1.00 14.96 C ATOM 1102 CD1 LEU A 584 29.714 -7.476 8.057 1.00 16.09 C ATOM 1103 CD2 LEU A 584 31.579 -5.823 8.140 1.00 17.78 C ATOM 1104 HA LEU A 584 29.898 -9.087 10.099 1.00 0.00 H ATOM 1105 HB2 LEU A 584 30.867 -6.851 10.568 1.00 0.00 H ATOM 1106 HB3 LEU A 584 32.474 -7.499 10.164 1.00 0.00 H ATOM 1107 HG LEU A 584 31.781 -7.916 7.858 1.00 0.00 H ATOM 1108 HD21 LEU A 584 30.998 -5.133 8.752 1.00 0.00 H ATOM 1109 HD22 LEU A 584 32.640 -5.701 8.360 1.00 0.00 H ATOM 1110 HD23 LEU A 584 31.399 -5.615 7.085 1.00 0.00 H ATOM 1111 HD11 LEU A 584 29.458 -8.522 8.224 1.00 0.00 H ATOM 1112 HD12 LEU A 584 29.067 -6.842 8.663 1.00 0.00 H ATOM 1113 HD13 LEU A 584 29.581 -7.232 7.003 1.00 0.00 H ATOM 1114 H LEU A 584 31.531 -8.439 12.427 1.00 0.00 H ATOM 1115 N PHE A 585 32.958 -10.431 10.143 1.00 10.28 N ATOM 1116 CA PHE A 585 33.700 -11.504 9.460 1.00 10.04 C ATOM 1117 C PHE A 585 32.866 -12.793 9.444 1.00 11.16 C ATOM 1118 O PHE A 585 32.843 -13.504 8.419 1.00 10.97 O ATOM 1119 CB PHE A 585 35.000 -11.812 10.189 1.00 11.22 C ATOM 1120 CG PHE A 585 36.010 -10.702 10.089 1.00 12.78 C ATOM 1121 CD1 PHE A 585 36.102 -9.916 8.935 1.00 16.72 C ATOM 1122 CD2 PHE A 585 36.867 -10.433 11.141 1.00 16.38 C ATOM 1123 CE1 PHE A 585 37.053 -8.889 8.834 1.00 19.79 C ATOM 1124 CE2 PHE A 585 37.797 -9.395 11.050 1.00 19.54 C ATOM 1125 CZ PHE A 585 37.870 -8.622 9.902 1.00 18.30 C ATOM 1126 HA PHE A 585 33.910 -11.163 8.446 1.00 0.00 H ATOM 1127 HB2 PHE A 585 34.775 -11.983 11.242 1.00 0.00 H ATOM 1128 HB3 PHE A 585 35.433 -12.715 9.760 1.00 0.00 H ATOM 1129 HD2 PHE A 585 36.816 -11.036 12.048 1.00 0.00 H ATOM 1130 HE2 PHE A 585 38.468 -9.192 11.885 1.00 0.00 H ATOM 1131 HZ PHE A 585 38.581 -7.797 9.848 1.00 0.00 H ATOM 1132 HE1 PHE A 585 37.141 -8.309 7.915 1.00 0.00 H ATOM 1133 HD1 PHE A 585 35.425 -10.104 8.102 1.00 0.00 H ATOM 1134 H PHE A 585 33.350 -9.969 10.988 1.00 0.00 H ATOM 1135 N ILE A 586 32.152 -13.098 10.536 1.00 9.75 N ATOM 1136 CA ILE A 586 31.315 -14.299 10.503 1.00 8.98 C ATOM 1137 C ILE A 586 30.207 -14.184 9.457 1.00 11.02 C ATOM 1138 O ILE A 586 29.849 -15.179 8.831 1.00 12.39 O ATOM 1139 CB ILE A 586 30.749 -14.559 11.927 1.00 10.26 C ATOM 1140 CG1 ILE A 586 31.929 -14.983 12.866 1.00 10.96 C ATOM 1141 CG2 ILE A 586 29.659 -15.675 11.927 1.00 11.73 C ATOM 1142 CD1 ILE A 586 31.630 -14.901 14.382 1.00 10.35 C ATOM 1143 HA ILE A 586 31.922 -15.153 10.205 1.00 0.00 H ATOM 1144 HB ILE A 586 30.280 -13.641 12.282 1.00 0.00 H ATOM 1145 HG12 ILE A 586 32.194 -16.014 12.630 1.00 0.00 H ATOM 1146 HG13 ILE A 586 32.778 -14.333 12.654 1.00 0.00 H ATOM 1147 HD11 ILE A 586 31.377 -13.874 14.646 1.00 0.00 H ATOM 1148 HD12 ILE A 586 30.792 -15.556 14.622 1.00 0.00 H ATOM 1149 HD13 ILE A 586 32.511 -15.215 14.942 1.00 0.00 H ATOM 1150 HG21 ILE A 586 28.834 -15.375 11.281 1.00 0.00 H ATOM 1151 HG22 ILE A 586 30.092 -16.604 11.557 1.00 0.00 H ATOM 1152 HG23 ILE A 586 29.292 -15.823 12.943 1.00 0.00 H ATOM 1153 H ILE A 586 32.191 -12.498 11.384 1.00 0.00 H ATOM 1154 N LYS A 587 29.655 -12.990 9.303 1.00 9.45 N ATOM 1155 CA LYS A 587 28.556 -12.760 8.357 1.00 10.76 C ATOM 1156 C LYS A 587 29.060 -12.501 6.938 1.00 13.70 C ATOM 1157 O LYS A 587 28.231 -12.358 6.023 1.00 14.15 O ATOM 1158 CB LYS A 587 27.669 -11.621 8.880 1.00 13.99 C ATOM 1159 CG LYS A 587 27.058 -12.015 10.225 1.00 15.81 C ATOM 1160 CD LYS A 587 25.979 -11.056 10.725 1.00 20.59 C ATOM 1161 CE LYS A 587 24.658 -11.241 9.993 1.00 20.24 C ATOM 1162 NZ LYS A 587 23.549 -10.566 10.742 1.00 25.16 N ATOM 1163 HA LYS A 587 27.955 -13.667 8.289 1.00 0.00 H ATOM 1164 HB2 LYS A 587 28.272 -10.721 9.006 1.00 0.00 H ATOM 1165 HB3 LYS A 587 26.871 -11.425 8.163 1.00 0.00 H ATOM 1166 HG2 LYS A 587 26.615 -13.006 10.123 1.00 0.00 H ATOM 1167 HG3 LYS A 587 27.856 -12.050 10.967 1.00 0.00 H ATOM 1168 HD2 LYS A 587 25.818 -11.232 11.789 1.00 0.00 H ATOM 1169 HD3 LYS A 587 26.323 -10.032 10.575 1.00 0.00 H ATOM 1170 HE2 LYS A 587 24.439 -12.306 9.909 1.00 0.00 H ATOM 1171 HE3 LYS A 587 24.735 -10.807 8.996 1.00 0.00 H ATOM 1172 HZ1 LYS A 587 23.472 -10.981 11.693 1.00 0.00 H ATOM 1173 HZ2 LYS A 587 23.754 -9.550 10.821 1.00 0.00 H ATOM 1174 HZ3 LYS A 587 22.654 -10.701 10.230 1.00 0.00 H ATOM 1175 H LYS A 587 30.010 -12.193 9.868 1.00 0.00 H ATOM 1176 N ALA A 588 30.385 -12.442 6.720 1.00 12.54 N ATOM 1177 CA ALA A 588 30.931 -12.159 5.378 1.00 12.81 C ATOM 1178 C ALA A 588 30.868 -13.441 4.550 1.00 12.90 C ATOM 1179 O ALA A 588 31.809 -14.229 4.494 1.00 13.85 O ATOM 1180 CB ALA A 588 32.368 -11.660 5.491 1.00 14.38 C ATOM 1181 HA ALA A 588 30.344 -11.381 4.890 1.00 0.00 H ATOM 1182 HB1 ALA A 588 32.388 -10.747 6.086 1.00 0.00 H ATOM 1183 HB2 ALA A 588 32.979 -12.423 5.973 1.00 0.00 H ATOM 1184 HB3 ALA A 588 32.759 -11.455 4.495 1.00 0.00 H ATOM 1185 H ALA A 588 31.039 -12.599 7.513 1.00 0.00 H ATOM 1186 N SER A 589 29.702 -13.663 3.932 1.00 12.10 N ATOM 1187 CA SER A 589 29.457 -14.897 3.188 1.00 10.34 C ATOM 1188 C SER A 589 30.433 -15.215 2.050 1.00 14.76 C ATOM 1189 O SER A 589 30.655 -16.383 1.736 1.00 14.66 O ATOM 1190 CB SER A 589 28.022 -14.930 2.662 1.00 11.97 C ATOM 1191 OG SER A 589 27.885 -13.959 1.631 1.00 15.04 O ATOM 1192 HA SER A 589 29.628 -15.682 3.925 1.00 0.00 H ATOM 1193 HB2 SER A 589 27.330 -14.703 3.473 1.00 0.00 H ATOM 1194 HB3 SER A 589 27.801 -15.920 2.264 1.00 0.00 H ATOM 1195 HG SER A 589 26.957 -13.975 1.285 1.00 0.00 H ATOM 1196 H SER A 589 28.954 -12.942 3.982 1.00 0.00 H ATOM 1197 N CYS A 590 31.007 -14.189 1.415 1.00 13.51 N ATOM 1198 CA CYS A 590 31.928 -14.436 0.306 1.00 14.19 C ATOM 1199 C CYS A 590 33.328 -14.855 0.710 1.00 17.31 C ATOM 1200 O CYS A 590 34.141 -15.203 -0.142 1.00 18.04 O ATOM 1201 CB CYS A 590 31.937 -13.272 -0.675 1.00 15.31 C ATOM 1202 SG CYS A 590 30.323 -13.005 -1.460 1.00 19.36 S ATOM 1203 HA CYS A 590 31.528 -15.314 -0.202 1.00 0.00 H ATOM 1204 HB2 CYS A 590 32.674 -13.476 -1.452 1.00 0.00 H ATOM 1205 HB3 CYS A 590 32.218 -12.366 -0.139 1.00 0.00 H ATOM 1206 HG CYS A 590 30.408 -11.939 -2.332 1.00 0.00 H ATOM 1207 H CYS A 590 30.799 -13.214 1.710 1.00 0.00 H ATOM 1208 N GLU A 591 33.628 -14.804 2.026 1.00 14.12 N ATOM 1209 CA GLU A 591 34.919 -15.232 2.569 1.00 13.81 C ATOM 1210 C GLU A 591 34.868 -16.683 2.987 1.00 15.21 C ATOM 1211 O GLU A 591 35.865 -17.233 3.441 1.00 15.01 O ATOM 1212 CB GLU A 591 35.321 -14.339 3.734 1.00 15.28 C ATOM 1213 CG GLU A 591 35.489 -12.909 3.276 1.00 17.17 C ATOM 1214 CD GLU A 591 35.823 -11.878 4.334 1.00 21.32 C ATOM 1215 OE1 GLU A 591 36.252 -12.266 5.447 1.00 21.61 O ATOM 1216 OE2 GLU A 591 35.676 -10.676 4.030 1.00 19.93 O ATOM 1217 HA GLU A 591 35.675 -15.138 1.790 1.00 0.00 H ATOM 1218 HB2 GLU A 591 34.548 -14.381 4.501 1.00 0.00 H ATOM 1219 HB3 GLU A 591 36.263 -14.695 4.150 1.00 0.00 H ATOM 1220 HG2 GLU A 591 36.291 -12.893 2.538 1.00 0.00 H ATOM 1221 HG3 GLU A 591 34.555 -12.604 2.804 1.00 0.00 H ATOM 1222 H GLU A 591 32.908 -14.444 2.685 1.00 0.00 H ATOM 1223 N ARG A 592 33.703 -17.334 2.789 1.00 14.93 N ATOM 1224 CA ARG A 592 33.543 -18.734 3.094 1.00 14.99 C ATOM 1225 C ARG A 592 34.063 -19.533 1.920 1.00 25.06 C ATOM 1226 O ARG A 592 34.051 -19.051 0.791 1.00 29.19 O ATOM 1227 CB ARG A 592 32.054 -19.036 3.333 1.00 13.06 C ATOM 1228 CG ARG A 592 31.527 -18.293 4.554 1.00 13.20 C ATOM 1229 CD ARG A 592 30.051 -18.492 4.792 1.00 12.87 C ATOM 1230 NE ARG A 592 29.580 -17.549 5.801 1.00 11.22 N ATOM 1231 CZ ARG A 592 28.311 -17.156 5.947 1.00 11.58 C ATOM 1232 NH1 ARG A 592 27.351 -17.654 5.157 1.00 11.91 N ATOM 1233 NH2 ARG A 592 28.003 -16.206 6.820 1.00 10.70 N ATOM 1234 HA ARG A 592 34.098 -19.000 3.994 1.00 0.00 H ATOM 1235 HB2 ARG A 592 31.484 -18.728 2.456 1.00 0.00 H ATOM 1236 HB3 ARG A 592 31.929 -20.108 3.488 1.00 0.00 H ATOM 1237 HG2 ARG A 592 32.068 -18.645 5.432 1.00 0.00 H ATOM 1238 HG3 ARG A 592 31.714 -17.228 4.417 1.00 0.00 H ATOM 1239 HD2 ARG A 592 29.874 -19.510 5.138 1.00 0.00 H ATOM 1240 HD3 ARG A 592 29.509 -18.327 3.861 1.00 0.00 H ATOM 1241 HE ARG A 592 30.285 -17.153 6.456 1.00 0.00 H ATOM 1242 HH12 ARG A 592 26.366 -17.343 5.277 1.00 0.00 H ATOM 1243 HH11 ARG A 592 27.591 -18.351 4.424 1.00 0.00 H ATOM 1244 HH22 ARG A 592 27.014 -15.903 6.931 1.00 0.00 H ATOM 1245 HH21 ARG A 592 28.750 -15.765 7.393 1.00 0.00 H ATOM 1246 H ARG A 592 32.893 -16.808 2.403 1.00 0.00 H ATOM 1247 N HIS A 593 34.538 -20.726 2.179 1.00 22.60 N ATOM 1248 CA HIS A 593 34.988 -21.595 1.100 1.00 23.03 C ATOM 1249 C HIS A 593 33.923 -22.658 0.913 1.00 25.40 C ATOM 1250 O HIS A 593 33.550 -23.369 1.852 1.00 23.04 O ATOM 1251 CB HIS A 593 36.374 -22.182 1.376 1.00 24.56 C ATOM 1252 HA HIS A 593 35.110 -21.030 0.176 1.00 0.00 H ATOM 1253 HB2 HIS A 593 37.095 -21.372 1.484 1.00 0.00 H ATOM 1254 HB3 HIS A 593 36.343 -22.768 2.295 1.00 0.00 H ATOM 1255 H HIS A 593 34.594 -21.056 3.164 1.00 0.00 H ATOM 1256 N SER A 594 33.378 -22.727 -0.310 1.00 24.19 N ATOM 1257 CA SER A 594 32.309 -23.665 -0.673 1.00 24.13 C ATOM 1258 C SER A 594 31.074 -23.499 0.240 1.00 24.15 C ATOM 1259 O SER A 594 30.391 -24.476 0.553 1.00 23.45 O ATOM 1260 CB SER A 594 32.825 -25.103 -0.692 1.00 30.35 C ATOM 1261 OG SER A 594 34.010 -25.174 -1.468 1.00 42.72 O ATOM 1262 HA SER A 594 31.982 -23.426 -1.685 1.00 0.00 H ATOM 1263 HB2 SER A 594 32.067 -25.755 -1.127 1.00 0.00 H ATOM 1264 HB3 SER A 594 33.039 -25.425 0.327 1.00 0.00 H ATOM 1265 HG SER A 594 34.341 -26.107 -1.478 1.00 0.00 H ATOM 1266 H SER A 594 33.733 -22.080 -1.043 1.00 0.00 H ATOM 1267 N GLY A 595 30.832 -22.253 0.673 1.00 19.57 N ATOM 1268 CA GLY A 595 29.688 -21.881 1.500 1.00 18.46 C ATOM 1269 C GLY A 595 29.865 -22.185 2.978 1.00 18.94 C ATOM 1270 O GLY A 595 28.949 -21.933 3.755 1.00 17.18 O ATOM 1271 HA3 GLY A 595 28.814 -22.425 1.141 1.00 0.00 H ATOM 1272 HA2 GLY A 595 29.519 -20.810 1.389 1.00 0.00 H ATOM 1273 H GLY A 595 31.502 -21.505 0.403 1.00 0.00 H ATOM 1274 N GLU A 596 31.026 -22.711 3.378 1.00 16.28 N ATOM 1275 CA GLU A 596 31.238 -23.078 4.776 1.00 14.64 C ATOM 1276 C GLU A 596 32.015 -22.028 5.524 1.00 14.32 C ATOM 1277 O GLU A 596 33.083 -21.563 5.065 1.00 14.77 O ATOM 1278 CB GLU A 596 32.042 -24.383 4.880 1.00 16.09 C ATOM 1279 CG GLU A 596 31.267 -25.608 4.444 1.00 22.47 C ATOM 1280 CD GLU A 596 32.114 -26.850 4.291 1.00 32.90 C ATOM 1281 OE1 GLU A 596 33.279 -26.729 3.850 1.00 31.21 O ATOM 1282 OE2 GLU A 596 31.610 -27.945 4.622 1.00 40.64 O ATOM 1283 HA GLU A 596 30.245 -23.188 5.212 1.00 0.00 H ATOM 1284 HB2 GLU A 596 32.928 -24.293 4.251 1.00 0.00 H ATOM 1285 HB3 GLU A 596 32.347 -24.519 5.918 1.00 0.00 H ATOM 1286 HG2 GLU A 596 30.496 -25.808 5.188 1.00 0.00 H ATOM 1287 HG3 GLU A 596 30.797 -25.393 3.484 1.00 0.00 H ATOM 1288 H GLU A 596 31.788 -22.861 2.686 1.00 0.00 H ATOM 1289 N LEU A 597 31.455 -21.613 6.652 1.00 10.01 N ATOM 1290 CA LEU A 597 32.188 -20.811 7.607 1.00 9.67 C ATOM 1291 C LEU A 597 33.258 -21.738 8.237 1.00 11.76 C ATOM 1292 O LEU A 597 32.940 -22.851 8.665 1.00 12.01 O ATOM 1293 CB LEU A 597 31.242 -20.341 8.716 1.00 9.45 C ATOM 1294 CG LEU A 597 31.895 -19.665 9.944 1.00 11.17 C ATOM 1295 CD1 LEU A 597 32.424 -18.288 9.575 1.00 11.13 C ATOM 1296 CD2 LEU A 597 30.905 -19.556 11.065 1.00 10.65 C ATOM 1297 HA LEU A 597 32.634 -19.942 7.123 1.00 0.00 H ATOM 1298 HB2 LEU A 597 30.546 -19.627 8.276 1.00 0.00 H ATOM 1299 HB3 LEU A 597 30.691 -21.212 9.072 1.00 0.00 H ATOM 1300 HG LEU A 597 32.732 -20.281 10.273 1.00 0.00 H ATOM 1301 HD21 LEU A 597 30.054 -18.958 10.739 1.00 0.00 H ATOM 1302 HD22 LEU A 597 30.565 -20.553 11.346 1.00 0.00 H ATOM 1303 HD23 LEU A 597 31.380 -19.078 11.922 1.00 0.00 H ATOM 1304 HD11 LEU A 597 33.169 -18.386 8.786 1.00 0.00 H ATOM 1305 HD12 LEU A 597 31.601 -17.666 9.224 1.00 0.00 H ATOM 1306 HD13 LEU A 597 32.880 -17.828 10.452 1.00 0.00 H ATOM 1307 H LEU A 597 30.468 -21.870 6.854 1.00 0.00 H ATOM 1308 N MET A 598 34.510 -21.287 8.245 1.00 11.12 N ATOM 1309 CA MET A 598 35.601 -22.035 8.848 1.00 11.88 C ATOM 1310 C MET A 598 36.000 -21.335 10.145 1.00 14.51 C ATOM 1311 O MET A 598 36.263 -20.115 10.153 1.00 16.02 O ATOM 1312 CB MET A 598 36.809 -22.022 7.873 1.00 16.17 C ATOM 1313 CG MET A 598 38.033 -22.747 8.391 1.00 23.82 C ATOM 1314 SD MET A 598 39.633 -21.870 8.146 1.00 34.28 S ATOM 1315 CE MET A 598 39.550 -20.786 9.669 1.00 28.10 C ATOM 1316 HA MET A 598 35.298 -23.062 9.050 1.00 0.00 H ATOM 1317 HB2 MET A 598 36.501 -22.494 6.940 1.00 0.00 H ATOM 1318 HB3 MET A 598 37.082 -20.984 7.680 1.00 0.00 H ATOM 1319 HG2 MET A 598 38.095 -23.709 7.882 1.00 0.00 H ATOM 1320 HG3 MET A 598 37.900 -22.911 9.460 1.00 0.00 H ATOM 1321 HE1 MET A 598 38.663 -20.155 9.616 1.00 0.00 H ATOM 1322 HE2 MET A 598 39.498 -21.414 10.558 1.00 0.00 H ATOM 1323 HE3 MET A 598 40.441 -20.160 9.717 1.00 0.00 H ATOM 1324 H MET A 598 34.715 -20.367 7.805 1.00 0.00 H ATOM 1325 N LEU A 599 35.993 -22.074 11.252 1.00 11.24 N ATOM 1326 CA LEU A 599 36.487 -21.543 12.516 1.00 10.35 C ATOM 1327 C LEU A 599 37.627 -22.410 12.961 1.00 11.40 C ATOM 1328 O LEU A 599 37.523 -23.656 12.927 1.00 13.66 O ATOM 1329 CB LEU A 599 35.433 -21.584 13.642 1.00 10.55 C ATOM 1330 CG LEU A 599 34.139 -20.832 13.321 1.00 11.70 C ATOM 1331 CD1 LEU A 599 33.141 -20.971 14.481 1.00 12.81 C ATOM 1332 CD2 LEU A 599 34.417 -19.330 13.110 1.00 13.61 C ATOM 1333 HA LEU A 599 36.768 -20.504 12.345 1.00 0.00 H ATOM 1334 HB2 LEU A 599 35.183 -22.627 13.838 1.00 0.00 H ATOM 1335 HB3 LEU A 599 35.872 -21.143 14.537 1.00 0.00 H ATOM 1336 HG LEU A 599 33.725 -21.264 12.410 1.00 0.00 H ATOM 1337 HD21 LEU A 599 34.852 -18.911 14.018 1.00 0.00 H ATOM 1338 HD22 LEU A 599 35.113 -19.204 12.281 1.00 0.00 H ATOM 1339 HD23 LEU A 599 33.482 -18.817 12.883 1.00 0.00 H ATOM 1340 HD11 LEU A 599 32.912 -22.025 14.637 1.00 0.00 H ATOM 1341 HD12 LEU A 599 33.580 -20.555 15.388 1.00 0.00 H ATOM 1342 HD13 LEU A 599 32.226 -20.431 14.238 1.00 0.00 H ATOM 1343 H LEU A 599 35.629 -23.047 11.214 1.00 0.00 H ATOM 1344 N LEU A 600 38.727 -21.784 13.405 1.00 9.43 N ATOM 1345 CA LEU A 600 39.821 -22.525 14.039 1.00 9.72 C ATOM 1346 C LEU A 600 39.680 -22.150 15.506 1.00 11.37 C ATOM 1347 O LEU A 600 39.726 -20.962 15.811 1.00 10.61 O ATOM 1348 CB LEU A 600 41.199 -22.149 13.472 1.00 10.77 C ATOM 1349 CG LEU A 600 42.323 -22.945 14.109 1.00 12.18 C ATOM 1350 CD1 LEU A 600 42.214 -24.429 13.795 1.00 12.42 C ATOM 1351 CD2 LEU A 600 43.665 -22.423 13.659 1.00 13.55 C ATOM 1352 HA LEU A 600 39.759 -23.599 13.863 1.00 0.00 H ATOM 1353 HB2 LEU A 600 41.200 -22.339 12.399 1.00 0.00 H ATOM 1354 HB3 LEU A 600 41.375 -21.088 13.652 1.00 0.00 H ATOM 1355 HG LEU A 600 42.233 -22.822 15.188 1.00 0.00 H ATOM 1356 HD21 LEU A 600 43.742 -22.508 12.575 1.00 0.00 H ATOM 1357 HD22 LEU A 600 43.763 -21.377 13.950 1.00 0.00 H ATOM 1358 HD23 LEU A 600 44.457 -23.008 14.128 1.00 0.00 H ATOM 1359 HD11 LEU A 600 41.266 -24.811 14.175 1.00 0.00 H ATOM 1360 HD12 LEU A 600 42.260 -24.575 12.716 1.00 0.00 H ATOM 1361 HD13 LEU A 600 43.038 -24.961 14.270 1.00 0.00 H ATOM 1362 H LEU A 600 38.805 -20.753 13.297 1.00 0.00 H ATOM 1363 N VAL A 601 39.410 -23.144 16.381 1.00 9.99 N ATOM 1364 CA VAL A 601 39.162 -22.839 17.792 1.00 9.76 C ATOM 1365 C VAL A 601 40.062 -23.619 18.721 1.00 11.40 C ATOM 1366 O VAL A 601 40.628 -24.661 18.353 1.00 11.40 O ATOM 1367 CB VAL A 601 37.665 -23.123 18.153 1.00 11.20 C ATOM 1368 CG1 VAL A 601 36.713 -22.374 17.227 1.00 11.00 C ATOM 1369 CG2 VAL A 601 37.356 -24.623 18.129 1.00 10.98 C ATOM 1370 HA VAL A 601 39.385 -21.781 17.929 1.00 0.00 H ATOM 1371 HB VAL A 601 37.510 -22.758 19.168 1.00 0.00 H ATOM 1372 HG11 VAL A 601 36.891 -21.302 17.314 1.00 0.00 H ATOM 1373 HG12 VAL A 601 36.886 -22.690 16.198 1.00 0.00 H ATOM 1374 HG13 VAL A 601 35.684 -22.596 17.509 1.00 0.00 H ATOM 1375 HG21 VAL A 601 37.552 -25.017 17.132 1.00 0.00 H ATOM 1376 HG22 VAL A 601 37.989 -25.135 18.854 1.00 0.00 H ATOM 1377 HG23 VAL A 601 36.308 -24.781 18.384 1.00 0.00 H ATOM 1378 H VAL A 601 39.378 -24.130 16.051 1.00 0.00 H ATOM 1379 N ARG A 602 40.217 -23.095 19.959 1.00 10.84 N ATOM 1380 CA ARG A 602 40.937 -23.789 21.000 1.00 11.15 C ATOM 1381 C ARG A 602 39.906 -24.210 22.049 1.00 14.34 C ATOM 1382 O ARG A 602 39.321 -23.333 22.728 1.00 13.35 O ATOM 1383 CB ARG A 602 42.008 -22.872 21.602 1.00 13.46 C ATOM 1384 CG ARG A 602 42.900 -23.611 22.602 1.00 22.78 C ATOM 1385 CD ARG A 602 43.952 -22.680 23.178 1.00 32.84 C ATOM 1386 NE ARG A 602 45.042 -22.450 22.229 1.00 42.06 N ATOM 1387 CZ ARG A 602 45.233 -21.326 21.545 1.00 49.96 C ATOM 1388 NH1 ARG A 602 44.410 -20.294 21.703 1.00 42.02 N ATOM 1389 NH2 ARG A 602 46.249 -21.224 20.698 1.00 27.36 N ATOM 1390 HA ARG A 602 41.454 -24.666 20.610 1.00 0.00 H ATOM 1391 HB2 ARG A 602 42.630 -22.481 20.797 1.00 0.00 H ATOM 1392 HB3 ARG A 602 41.516 -22.045 22.113 1.00 0.00 H ATOM 1393 HG2 ARG A 602 42.283 -23.999 23.413 1.00 0.00 H ATOM 1394 HG3 ARG A 602 43.395 -24.440 22.095 1.00 0.00 H ATOM 1395 HD2 ARG A 602 44.360 -23.125 24.086 1.00 0.00 H ATOM 1396 HD3 ARG A 602 43.486 -21.725 23.421 1.00 0.00 H ATOM 1397 HE ARG A 602 45.719 -23.225 22.078 1.00 0.00 H ATOM 1398 HH12 ARG A 602 44.565 -19.418 21.165 1.00 0.00 H ATOM 1399 HH11 ARG A 602 43.611 -20.363 22.365 1.00 0.00 H ATOM 1400 HH22 ARG A 602 46.395 -20.343 20.165 1.00 0.00 H ATOM 1401 HH21 ARG A 602 46.899 -22.025 20.567 1.00 0.00 H ATOM 1402 H ARG A 602 39.805 -22.163 20.167 1.00 0.00 H ATOM 1403 N PRO A 603 39.674 -25.522 22.230 1.00 13.78 N ATOM 1404 CA PRO A 603 38.748 -25.953 23.306 1.00 14.78 C ATOM 1405 C PRO A 603 39.234 -25.464 24.687 1.00 18.70 C ATOM 1406 O PRO A 603 40.436 -25.290 24.894 1.00 19.79 O ATOM 1407 CB PRO A 603 38.839 -27.485 23.241 1.00 17.96 C ATOM 1408 CG PRO A 603 39.217 -27.777 21.815 1.00 21.38 C ATOM 1409 CD PRO A 603 40.228 -26.681 21.504 1.00 15.93 C ATOM 1410 HA PRO A 603 37.740 -25.559 23.178 1.00 0.00 H ATOM 1411 HD3 PRO A 603 41.219 -26.942 21.875 1.00 0.00 H ATOM 1412 HD2 PRO A 603 40.282 -26.486 20.433 1.00 0.00 H ATOM 1413 HG3 PRO A 603 38.350 -27.711 21.157 1.00 0.00 H ATOM 1414 HG2 PRO A 603 39.667 -28.765 21.722 1.00 0.00 H ATOM 1415 HB2 PRO A 603 39.601 -27.856 23.926 1.00 0.00 H ATOM 1416 HB3 PRO A 603 37.879 -27.940 23.487 1.00 0.00 H ATOM 1417 N ASN A 604 38.285 -25.228 25.634 1.00 20.16 N ATOM 1418 CA ASN A 604 38.602 -24.751 26.993 1.00 34.42 C ATOM 1419 C ASN A 604 39.311 -25.807 27.824 1.00 58.61 C ATOM 1420 O ASN A 604 39.149 -26.989 27.546 1.00 37.43 O ATOM 1421 CB ASN A 604 37.347 -24.226 27.722 1.00 35.76 C ATOM 1422 CG ASN A 604 36.227 -25.216 27.992 1.00 57.59 C ATOM 1423 OD1 ASN A 604 36.245 -26.381 27.573 1.00 57.34 O ATOM 1424 ND2 ASN A 604 35.181 -24.742 28.657 1.00 43.75 N ATOM 1425 HA ASN A 604 39.293 -23.916 26.873 1.00 0.00 H ATOM 1426 HB2 ASN A 604 37.670 -23.828 28.684 1.00 0.00 H ATOM 1427 HB3 ASN A 604 36.932 -23.419 27.118 1.00 0.00 H ATOM 1428 HD22 ASN A 604 35.185 -23.761 29.001 1.00 0.00 H ATOM 1429 HD21 ASN A 604 34.358 -25.352 28.834 1.00 0.00 H ATOM 1430 H ASN A 604 37.288 -25.392 25.387 1.00 0.00 H TER 1431 ASN A 604 HETATM 1432 O HOH 1 27.754 -32.187 16.461 1.00 9.19 O HETATM 1433 O HOH 2 33.522 -30.971 19.805 1.00 13.87 O HETATM 1434 O HOH 3 21.583 -32.125 18.753 1.00 10.50 O HETATM 1435 O HOH 4 31.777 -15.886 6.769 1.00 12.59 O HETATM 1436 O HOH 5 32.481 -4.111 18.995 1.00 12.47 O HETATM 1437 O HOH 6 34.919 -27.633 19.247 1.00 14.84 O HETATM 1438 O HOH 7 30.178 -31.356 22.719 1.00 12.10 O HETATM 1439 O HOH 8 17.362 -19.150 11.479 1.00 15.96 O HETATM 1440 O HOH 9 27.318 -19.696 3.228 1.00 16.34 O HETATM 1441 O HOH 10 26.477 -28.419 11.034 1.00 15.21 O HETATM 1442 O HOH 11 31.372 -11.566 2.136 1.00 17.06 O HETATM 1443 O HOH 12 21.042 -21.617 13.315 1.00 14.57 O HETATM 1444 O HOH 13 33.654 -2.307 15.798 1.00 16.27 O HETATM 1445 O HOH 14 35.240 -13.940 7.181 1.00 12.57 O HETATM 1446 O HOH 15 30.925 -29.827 10.021 1.00 15.47 O HETATM 1447 O HOH 16 35.499 -28.064 22.621 1.00 16.56 O HETATM 1448 O HOH 17 22.591 -26.102 23.824 1.00 17.81 O HETATM 1449 O HOH 18 17.642 -24.174 19.186 1.00 17.39 O HETATM 1450 O HOH 19 23.110 -19.608 20.657 1.00 19.20 O HETATM 1451 O HOH 20 33.745 -10.099 2.100 1.00 21.88 O HETATM 1452 O HOH 21 18.979 -23.454 12.522 1.00 18.27 O HETATM 1453 O HOH 22 31.351 -1.893 17.589 1.00 9.96 O HETATM 1454 O HOH 23 34.985 -6.602 10.042 1.00 17.15 O HETATM 1455 O HOH 24 19.788 -26.075 11.964 1.00 16.61 O HETATM 1456 O HOH 25 36.119 -29.766 20.172 1.00 16.89 O HETATM 1457 O HOH 26 35.703 -2.508 27.267 1.00 19.84 O HETATM 1458 O HOH 27 19.941 -19.793 15.079 1.00 17.40 O HETATM 1459 O HOH 28 34.447 -8.765 5.419 1.00 25.48 O HETATM 1460 O HOH 29 13.464 -21.494 3.424 1.00 22.90 O HETATM 1461 O HOH 30 37.523 -13.521 8.480 1.00 20.75 O HETATM 1462 O HOH 31 42.640 -26.706 24.888 1.00 36.68 O HETATM 1463 O HOH 32 34.051 -29.536 10.224 1.00 19.99 O HETATM 1464 O HOH 33 37.561 -4.681 30.747 1.00 36.07 O HETATM 1465 O HOH 34 23.731 -28.294 10.111 1.00 18.71 O HETATM 1466 O HOH 35 38.305 -0.803 20.087 1.00 24.99 O HETATM 1467 O HOH 36 33.616 -3.040 31.018 1.00 25.56 O HETATM 1468 O HOH 37 23.990 -26.508 8.077 1.00 22.62 O HETATM 1469 O HOH 38 35.345 -28.260 25.335 1.00 21.58 O HETATM 1470 O HOH 39 34.994 -6.846 7.223 1.00 25.94 O HETATM 1471 O HOH 40 17.418 -19.470 14.174 1.00 21.40 O HETATM 1472 O HOH 41 36.815 -31.044 12.268 1.00 24.50 O HETATM 1473 O HOH 42 23.613 -23.184 3.807 1.00 33.79 O HETATM 1474 O HOH 43 21.040 -16.014 23.295 1.00 27.56 O HETATM 1475 O HOH 44 42.575 -8.918 8.828 1.00 32.65 O HETATM 1476 O HOH 45 19.933 -26.203 7.612 1.00 28.79 O HETATM 1477 O HOH 46 43.619 -15.043 16.776 1.00 21.87 O HETATM 1478 O HOH 47 35.321 -3.996 29.338 1.00 26.73 O HETATM 1479 O HOH 48 28.294 -29.572 9.329 1.00 25.43 O HETATM 1480 O HOH 49 31.873 -26.781 26.607 1.00 21.85 O HETATM 1481 O HOH 50 20.970 -27.604 10.015 1.00 27.47 O HETATM 1482 O HOH 51 37.568 1.808 19.738 1.00 27.63 O HETATM 1483 O HOH 52 34.245 -4.320 6.228 1.00 33.43 O HETATM 1484 O HOH 53 32.828 -31.052 8.088 1.00 34.58 O HETATM 1485 O HOH 54 44.136 -9.402 14.345 1.00 37.27 O HETATM 1486 O HOH 55 33.706 -4.086 10.496 1.00 25.51 O HETATM 1487 O HOH 56 45.165 -13.275 9.213 1.00 25.43 O HETATM 1488 O HOH 57 23.929 -30.862 9.309 1.00 28.90 O HETATM 1489 O HOH 58 38.838 -14.549 5.093 1.00 28.56 O HETATM 1490 O HOH 59 40.441 -3.135 16.155 1.00 35.21 O HETATM 1491 O HOH 60 37.368 -5.175 10.058 1.00 34.69 O HETATM 1492 O HOH 61 37.022 -20.792 27.827 1.00 29.49 O HETATM 1493 O HOH 62 36.689 -32.588 10.115 1.00 41.68 O HETATM 1494 O HOH 63 25.937 -32.901 10.831 1.00 30.85 O HETATM 1495 O HOH 64 23.277 -33.067 10.546 1.00 39.65 O HETATM 1496 O HOH 65 22.066 -9.064 4.991 1.00 33.46 O HETATM 1497 O HOH 66 16.791 -21.936 14.890 1.00 34.47 O HETATM 1498 O HOH 67 17.340 -21.953 17.697 1.00 36.30 O HETATM 1499 O HOH 68 40.168 -1.105 18.091 1.00 30.61 O HETATM 1500 O HOH 69 20.488 -25.196 25.462 1.00 34.18 O HETATM 1501 O HOH 70 40.017 2.835 20.035 1.00 40.04 O HETATM 1502 O HOH 71 34.961 -22.139 29.625 1.00 34.80 O HETATM 1503 O HOH 72 44.150 -10.299 10.456 1.00 35.87 O HETATM 1504 O HOH 73 16.838 -21.223 8.256 1.00 20.47 O HETATM 1505 O HOH 74 41.377 -20.807 25.089 1.00 39.67 O HETATM 1506 O HOH 75 42.436 -30.505 19.489 1.00 26.69 O HETATM 1507 O HOH 76 22.285 -25.708 6.337 1.00 42.53 O HETATM 1508 O HOH 77 35.346 -25.402 25.063 1.00 17.46 O HETATM 1509 O HOH 78 37.736 -28.982 26.516 1.00 37.41 O HETATM 1510 O HOH 79 25.158 -20.681 2.161 1.00 34.91 O HETATM 1511 O HOH 80 44.875 -7.541 12.452 1.00 50.84 O HETATM 1512 O HOH 81 23.238 -11.366 6.310 1.00 30.49 O HETATM 1513 O HOH 82 36.267 -17.264 -0.287 1.00 34.29 O HETATM 1514 O HOH 83 21.675 -10.480 8.562 1.00 38.23 O HETATM 1515 O HOH 84 33.223 -26.568 28.883 1.00 33.01 O HETATM 1516 O HOH 85 36.632 -20.179 4.573 1.00 30.57 O HETATM 1517 O HOH 86 40.627 -12.894 20.512 1.00 37.28 O HETATM 1518 O HOH 87 34.632 -6.429 28.536 1.00 32.19 O HETATM 1519 O HOH 88 29.576 -16.690 29.221 1.00 31.51 O HETATM 1520 O HOH 89 39.558 -10.427 19.123 1.00 32.56 O HETATM 1521 O HOH 90 27.598 -32.073 8.517 1.00 45.94 O HETATM 1522 O HOH 91 40.669 -10.020 21.586 1.00 36.75 O HETATM 1523 O HOH 92 13.162 -25.012 2.745 1.00 40.35 O HETATM 1524 O HOH 93 24.937 -22.858 27.009 1.00 32.53 O HETATM 1525 O HOH 94 19.458 -20.242 17.569 1.00 28.97 O HETATM 1526 O HOH 95 46.843 -18.475 21.441 1.00 30.45 O HETATM 1527 O HOH 96 27.686 -27.881 7.190 1.00 16.91 O HETATM 1528 O HOH 97 40.543 -2.556 24.285 1.00 28.66 O HETATM 1529 O HOH 98 35.309 -13.710 26.381 1.00 31.86 O HETATM 1530 O HOH 99 28.824 -19.102 28.420 1.00 38.54 O HETATM 1531 O HOH 100 27.274 -7.476 17.257 1.00 10.63 O HETATM 1532 O HOH 101 21.027 -5.739 19.246 1.00 12.24 O HETATM 1533 O HOH 102 32.386 -3.132 13.105 1.00 15.66 O HETATM 1534 O HOH 103 20.318 -12.156 16.189 1.00 27.71 O HETATM 1535 O HOH 104 24.627 -15.236 11.303 1.00 19.39 O HETATM 1536 O HOH 105 25.247 -2.510 12.864 1.00 22.90 O HETATM 1537 O HOH 106 22.950 -17.811 18.014 1.00 19.70 O HETATM 1538 O HOH 107 22.303 -10.183 27.899 1.00 21.55 O HETATM 1539 O HOH 108 24.778 -11.742 27.589 1.00 27.27 O HETATM 1540 O HOH 109 18.982 -5.964 17.500 1.00 26.27 O HETATM 1541 O HOH 110 18.636 -8.829 25.800 1.00 28.24 O HETATM 1542 O HOH 111 27.176 -10.720 29.165 1.00 34.30 O HETATM 1543 O HOH 112 30.792 -9.767 27.289 1.00 29.34 O HETATM 1544 O HOH 113 25.341 -16.952 27.141 1.00 32.47 O HETATM 1545 O HOH 114 22.051 -5.497 14.871 1.00 29.75 O HETATM 1546 O HOH 115 24.258 -0.278 14.362 1.00 25.49 O HETATM 1547 O HOH 116 23.045 -11.839 24.357 1.00 19.63 O HETATM 1548 N SER A 117 24.947 -6.077 16.597 1.00 0.24 N HETATM 1549 CA SER A 117 25.278 -5.205 15.460 1.00 0.09 C HETATM 1550 C SER A 117 25.254 -6.046 14.207 1.00 0.23 C HETATM 1551 O SER A 117 25.083 -7.273 14.299 1.00 -0.39 O HETATM 1552 N SER A 117 25.340 -5.376 13.025 1.00 -0.26 N HETATM 1553 CA SER A 117 25.342 -6.098 11.757 1.00 0.14 C HETATM 1554 C SER A 117 24.118 -7.007 11.639 1.00 0.21 C HETATM 1555 O SER A 117 24.220 -8.139 11.184 1.00 -0.39 O HETATM 1556 N SER A 117 22.950 -6.500 12.058 1.00 -0.26 N HETATM 1557 CA SER A 117 21.674 -7.226 11.990 1.00 0.13 C HETATM 1558 C SER A 117 21.601 -8.485 12.844 1.00 0.20 C HETATM 1559 O SER A 117 20.785 -9.369 12.600 1.00 -0.39 O HETATM 1560 N SER A 117 22.446 -8.543 13.877 1.00 -0.26 N HETATM 1561 CA SER A 117 22.433 -9.631 14.843 1.00 0.15 C HETATM 1562 C SER A 117 22.243 -9.005 16.220 1.00 0.21 C HETATM 1563 O SER A 117 22.721 -7.891 16.488 1.00 -0.39 O HETATM 1564 N SER A 117 21.507 -9.684 17.083 1.00 -0.26 N HETATM 1565 CA SER A 117 21.204 -9.194 18.421 1.00 0.14 C HETATM 1566 C SER A 117 22.427 -9.209 19.294 1.00 0.21 C HETATM 1567 O SER A 117 23.092 -10.246 19.411 1.00 -0.39 O HETATM 1568 N SER A 117 22.717 -8.076 19.931 1.00 -0.26 N HETATM 1569 CA SER A 117 23.840 -7.924 20.843 1.00 0.13 C HETATM 1570 C SER A 117 23.286 -7.452 22.188 1.00 0.20 C HETATM 1571 O SER A 117 22.502 -6.488 22.244 1.00 -0.39 O HETATM 1572 N SER A 117 23.699 -8.123 23.263 1.00 -0.26 N HETATM 1573 CA SER A 117 23.213 -7.780 24.590 1.00 0.15 C HETATM 1574 C SER A 117 24.296 -8.242 25.574 1.00 0.21 C HETATM 1575 O SER A 117 24.798 -9.381 25.423 1.00 -0.39 O HETATM 1576 N SER A 117 24.675 -7.399 26.533 1.00 -0.27 N HETATM 1577 CA SER A 117 25.714 -7.783 27.486 1.00 0.12 C HETATM 1578 C SER A 117 27.041 -8.085 26.807 1.00 0.20 C HETATM 1579 O SER A 117 27.843 -8.862 27.331 1.00 -0.39 O HETATM 1580 N SER A 117 27.280 -7.479 25.645 1.00 -0.27 N HETATM 1581 CA SER A 117 28.520 -7.707 24.911 1.00 0.12 C HETATM 1582 C SER A 117 28.580 -9.057 24.229 1.00 0.20 C HETATM 1583 O SER A 117 29.650 -9.500 23.826 1.00 -0.39 O HETATM 1584 N SER A 117 27.421 -9.720 24.068 1.00 -0.26 N HETATM 1585 CA SER A 117 27.325 -11.049 23.445 1.00 0.13 C HETATM 1586 C SER A 117 26.442 -10.938 22.215 1.00 0.20 C HETATM 1587 O SER A 117 25.350 -10.355 22.324 1.00 -0.39 O HETATM 1588 N SER A 117 26.869 -11.509 21.084 1.00 -0.26 N HETATM 1589 CA SER A 117 26.091 -11.446 19.858 1.00 0.16 C HETATM 1590 C SER A 117 25.655 -12.831 19.473 1.00 0.21 C HETATM 1591 O SER A 117 26.442 -13.770 19.601 1.00 -0.39 O HETATM 1592 N SER A 117 24.404 -12.965 18.985 1.00 -0.26 N HETATM 1593 CA SER A 117 23.850 -14.204 18.479 1.00 0.13 C HETATM 1594 C SER A 117 24.091 -14.285 16.976 1.00 0.20 C HETATM 1595 O SER A 117 23.651 -13.394 16.231 1.00 -0.39 O HETATM 1596 N SER A 117 24.722 -15.366 16.526 1.00 -0.27 N HETATM 1597 CA SER A 117 25.082 -15.606 15.115 1.00 0.09 C HETATM 1598 C SER A 117 24.369 -16.785 14.532 1.00 0.06 C HETATM 1599 O SER A 117 23.742 -17.577 15.294 1.00 -0.57 O HETATM 1600 OXT SER A 117 24.497 -16.988 13.313 1.00 -0.57 O HETATM 1601 CB SER A 117 26.619 -15.883 14.943 1.00 -0.02 C HETATM 1602 CG SER A 117 27.592 -14.714 15.072 1.00 -0.04 C HETATM 1603 CD1 SER A 117 27.246 -13.548 14.138 1.00 -0.06 C HETATM 1604 H SER A 117 27.273 -13.892 13.104 1.00 0.02 H HETATM 1605 H SER A 117 26.248 -13.179 14.374 1.00 0.02 H HETATM 1606 H SER A 117 27.972 -12.747 14.274 1.00 0.02 H HETATM 1607 CD2 SER A 117 27.933 -14.398 16.511 1.00 -0.06 C HETATM 1608 H SER A 117 27.022 -14.137 17.050 1.00 0.02 H HETATM 1609 H SER A 117 28.394 -15.271 16.974 1.00 0.02 H HETATM 1610 H SER A 117 28.628 -13.559 16.543 1.00 0.02 H HETATM 1611 H SER A 117 28.561 -15.023 14.680 1.00 0.03 H HETATM 1612 H SER A 117 26.731 -16.234 13.917 1.00 0.03 H HETATM 1613 H SER A 117 26.878 -16.559 15.758 1.00 0.03 H HETATM 1614 H SER A 117 24.789 -14.694 14.595 1.00 0.07 H HETATM 1615 H SER A 117 24.976 -16.082 17.206 1.00 0.19 H HETATM 1616 CB SER A 117 22.337 -14.246 18.727 1.00 -0.01 C HETATM 1617 CG SER A 117 21.896 -14.219 20.159 1.00 -0.02 C HETATM 1618 CD SER A 117 20.382 -14.340 20.172 1.00 0.06 C HETATM 1619 NE SER A 117 19.790 -13.907 21.435 1.00 -0.27 N HETATM 1620 CZ SER A 117 18.654 -13.221 21.526 1.00 0.29 C HETATM 1621 NH1 SER A 117 18.002 -12.852 20.429 1.00 -0.28 N HETATM 1622 H SER A 117 18.372 -13.095 19.510 1.00 0.26 H HETATM 1623 H SER A 117 17.131 -12.326 20.506 1.00 0.26 H HETATM 1624 NH2 SER A 117 18.174 -12.878 22.713 1.00 -0.28 N HETATM 1625 H SER A 117 18.676 -13.140 23.561 1.00 0.26 H HETATM 1626 H SER A 117 17.302 -12.352 22.778 1.00 0.26 H HETATM 1627 H SER A 117 20.277 -14.145 22.299 1.00 0.26 H HETATM 1628 H SER A 117 20.130 -15.391 20.028 1.00 0.07 H HETATM 1629 H SER A 117 19.989 -13.699 19.383 1.00 0.07 H HETATM 1630 H SER A 117 22.209 -13.291 20.637 1.00 0.03 H HETATM 1631 H SER A 117 22.349 -15.041 20.713 1.00 0.03 H HETATM 1632 H SER A 117 21.990 -15.196 18.321 1.00 0.03 H HETATM 1633 H SER A 117 21.930 -13.345 18.268 1.00 0.03 H HETATM 1634 H SER A 117 24.330 -15.038 18.990 1.00 0.08 H HETATM 1635 H SER A 117 23.808 -12.137 18.972 1.00 0.19 H HETATM 1636 CB SER A 117 26.910 -10.800 18.733 1.00 0.09 C HETATM 1637 OG1 SER A 117 27.257 -9.469 19.154 1.00 -0.39 O HETATM 1638 H SER A 117 27.775 -9.515 19.961 1.00 0.21 H HETATM 1639 CG2 SER A 117 26.119 -10.683 17.430 1.00 -0.03 C HETATM 1640 H SER A 117 25.817 -11.677 17.099 1.00 0.03 H HETATM 1641 H SER A 117 25.234 -10.070 17.598 1.00 0.03 H HETATM 1642 H SER A 117 26.744 -10.220 16.667 1.00 0.03 H HETATM 1643 H SER A 117 27.783 -11.426 18.546 1.00 0.06 H HETATM 1644 H SER A 117 25.208 -10.829 20.024 1.00 0.08 H HETATM 1645 H SER A 117 27.763 -12.001 21.081 1.00 0.19 H HETATM 1646 CB SER A 117 26.637 -11.976 24.482 1.00 -0.00 C HETATM 1647 CG SER A 117 26.346 -13.377 23.969 1.00 0.00 C HETATM 1648 CD SER A 117 25.654 -14.286 24.971 1.00 0.04 C HETATM 1649 OE1 SER A 117 24.901 -13.783 25.838 1.00 -0.57 O HETATM 1650 OE2 SER A 117 25.849 -15.513 24.884 1.00 -0.57 O HETATM 1651 H SER A 117 27.306 -13.836 23.733 1.00 0.04 H HETATM 1652 H SER A 117 25.673 -13.271 23.118 1.00 0.04 H HETATM 1653 H SER A 117 25.679 -11.521 24.735 1.00 0.03 H HETATM 1654 H SER A 117 27.320 -12.078 25.325 1.00 0.03 H HETATM 1655 H SER A 117 28.303 -11.435 23.158 1.00 0.08 H HETATM 1656 H SER A 117 26.562 -9.277 24.395 1.00 0.19 H HETATM 1657 H SER A 117 29.338 -7.667 25.630 1.00 0.08 H HETATM 1658 H SER A 117 28.585 -6.945 24.134 1.00 0.08 H HETATM 1659 H SER A 117 26.582 -6.843 25.261 1.00 0.19 H HETATM 1660 H SER A 117 25.384 -8.687 27.998 1.00 0.08 H HETATM 1661 H SER A 117 25.868 -6.949 28.171 1.00 0.08 H HETATM 1662 H SER A 117 24.238 -6.480 26.603 1.00 0.19 H HETATM 1663 CB SER A 117 21.900 -8.501 24.853 1.00 0.08 C HETATM 1664 OG SER A 117 21.400 -8.185 26.144 1.00 -0.39 O HETATM 1665 H SER A 117 20.573 -8.650 26.288 1.00 0.21 H HETATM 1666 H SER A 117 22.072 -9.576 24.797 1.00 0.06 H HETATM 1667 H SER A 117 21.171 -8.185 24.107 1.00 0.06 H HETATM 1668 H SER A 117 23.026 -6.711 24.694 1.00 0.08 H HETATM 1669 H SER A 117 24.365 -8.888 23.153 1.00 0.19 H HETATM 1670 CB SER A 117 24.869 -6.945 20.285 1.00 -0.01 C HETATM 1671 CG SER A 117 26.126 -6.828 21.146 1.00 -0.04 C HETATM 1672 CD SER A 117 27.225 -6.002 20.454 1.00 -0.01 C HETATM 1673 CE SER A 117 28.489 -5.901 21.257 1.00 -0.04 C HETATM 1674 NZ SER A 117 29.505 -5.105 20.464 1.00 0.22 N HETATM 1675 H SER A 117 30.369 -5.029 21.000 1.00 0.20 H HETATM 1676 H SER A 117 29.692 -5.579 19.580 1.00 0.20 H HETATM 1677 H SER A 117 29.135 -4.172 20.279 1.00 0.20 H HETATM 1678 H SER A 117 28.878 -6.898 21.462 1.00 0.08 H HETATM 1679 H SER A 117 28.287 -5.403 22.205 1.00 0.08 H HETATM 1680 H SER A 117 26.840 -4.991 20.318 1.00 0.03 H HETATM 1681 H SER A 117 27.470 -6.501 19.517 1.00 0.03 H HETATM 1682 H SER A 117 26.514 -7.832 21.321 1.00 0.03 H HETATM 1683 H SER A 117 25.857 -6.326 22.075 1.00 0.03 H HETATM 1684 H SER A 117 24.401 -5.961 20.252 1.00 0.03 H HETATM 1685 H SER A 117 25.175 -7.313 19.306 1.00 0.03 H HETATM 1686 H SER A 117 24.357 -8.875 20.970 1.00 0.08 H HETATM 1687 H SER A 117 22.116 -7.267 19.770 1.00 0.19 H HETATM 1688 CB SER A 117 20.108 -10.060 19.072 1.00 0.04 C HETATM 1689 CG SER A 117 19.512 -9.421 20.287 1.00 0.06 C HETATM 1690 ND1 SER A 117 19.868 -9.822 21.563 1.00 -0.26 N HETATM 1691 CE1 SER A 117 19.135 -9.078 22.388 1.00 0.09 C HETATM 1692 NE2 SER A 117 18.406 -8.179 21.724 1.00 -0.34 N HETATM 1693 CD2 SER A 117 18.633 -8.391 20.378 1.00 -0.03 C HETATM 1694 H SER A 117 18.191 -7.838 19.549 1.00 0.03 H HETATM 1695 H SER A 117 19.131 -9.189 23.472 1.00 0.11 H HETATM 1696 H SER A 117 20.549 -10.537 21.818 1.00 0.24 H HETATM 1697 H SER A 117 20.564 -11.002 19.379 1.00 0.05 H HETATM 1698 H SER A 117 19.311 -10.196 18.341 1.00 0.05 H HETATM 1699 H SER A 117 20.853 -8.167 18.325 1.00 0.08 H HETATM 1700 H SER A 117 21.135 -10.591 16.800 1.00 0.19 H HETATM 1701 CB SER A 117 23.699 -10.473 14.762 1.00 0.08 C HETATM 1702 OG SER A 117 23.547 -11.520 13.808 1.00 -0.39 O HETATM 1703 H SER A 117 24.354 -12.038 13.772 1.00 0.21 H HETATM 1704 H SER A 117 23.893 -10.913 15.740 1.00 0.06 H HETATM 1705 H SER A 117 24.528 -9.835 14.456 1.00 0.06 H HETATM 1706 H SER A 117 21.617 -10.321 14.631 1.00 0.08 H HETATM 1707 H SER A 117 23.128 -7.794 13.993 1.00 0.19 H HETATM 1708 CB SER A 117 21.181 -7.456 10.545 1.00 -0.00 C HETATM 1709 CG SER A 117 21.028 -6.171 9.738 1.00 0.00 C HETATM 1710 CD SER A 117 19.791 -5.344 10.019 1.00 0.04 C HETATM 1711 OE1 SER A 117 18.832 -5.435 9.219 1.00 -0.57 O HETATM 1712 OE2 SER A 117 19.800 -4.561 10.996 1.00 -0.57 O HETATM 1713 H SER A 117 20.958 -6.475 8.694 1.00 0.04 H HETATM 1714 H SER A 117 21.879 -5.543 10.003 1.00 0.04 H HETATM 1715 H SER A 117 20.197 -7.922 10.606 1.00 0.03 H HETATM 1716 H SER A 117 21.926 -8.071 10.040 1.00 0.03 H HETATM 1717 H SER A 117 20.964 -6.543 12.456 1.00 0.08 H HETATM 1718 H SER A 117 22.947 -5.557 12.446 1.00 0.19 H HETATM 1719 CB SER A 117 26.671 -6.884 11.580 1.00 0.00 C HETATM 1720 CG SER A 117 27.889 -5.997 11.582 1.00 -0.04 C HETATM 1721 CD1 SER A 117 28.900 -5.986 12.500 1.00 0.02 C HETATM 1722 NE1 SER A 117 29.805 -4.996 12.192 1.00 -0.29 N HETATM 1723 CE2 SER A 117 29.409 -4.370 11.032 1.00 0.06 C HETATM 1724 CD2 SER A 117 28.185 -4.958 10.642 1.00 -0.02 C HETATM 1725 CE3 SER A 117 27.569 -4.511 9.466 1.00 -0.07 C HETATM 1726 CZ3 SER A 117 28.162 -3.487 8.745 1.00 -0.08 C HETATM 1727 CH2 SER A 117 29.360 -2.893 9.177 1.00 -0.08 C HETATM 1728 CZ2 SER A 117 29.989 -3.310 10.333 1.00 -0.04 C HETATM 1729 H SER A 117 30.902 -2.831 10.686 1.00 0.05 H HETATM 1730 H SER A 117 29.801 -2.088 8.589 1.00 0.05 H HETATM 1731 H SER A 117 27.691 -3.136 7.827 1.00 0.05 H HETATM 1732 H SER A 117 26.638 -4.962 9.123 1.00 0.05 H HETATM 1733 H SER A 117 30.636 -4.763 12.736 1.00 0.22 H HETATM 1734 H SER A 117 28.979 -6.662 13.351 1.00 0.08 H HETATM 1735 H SER A 117 26.631 -7.388 10.614 1.00 0.04 H HETATM 1736 H SER A 117 26.762 -7.573 12.420 1.00 0.04 H HETATM 1737 H SER A 117 25.278 -5.373 10.945 1.00 0.08 H HETATM 1738 H SER A 117 25.404 -4.358 13.026 1.00 0.19 H HETATM 1739 CB SER A 117 26.643 -4.546 15.647 1.00 0.10 C HETATM 1740 OG SER A 117 26.659 -3.914 16.921 1.00 -0.39 O HETATM 1741 H SER A 117 27.511 -3.493 17.057 1.00 0.21 H HETATM 1742 H SER A 117 26.816 -3.811 14.861 1.00 0.06 H HETATM 1743 H SER A 117 27.433 -5.295 15.590 1.00 0.06 H HETATM 1744 H SER A 117 24.547 -4.400 15.387 1.00 0.11 H HETATM 1745 H SER A 117 24.032 -6.502 16.443 1.00 0.20 H HETATM 1746 H SER A 117 25.653 -6.808 16.680 1.00 0.20 H HETATM 1747 H SER A 117 24.927 -5.524 17.454 1.00 0.20 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 1548 1549 1745 1746 1747 CONECT 1549 1548 1550 1739 1744 CONECT 1550 1549 1551 1552 CONECT 1551 1550 CONECT 1552 1550 1553 1738 CONECT 1553 1552 1554 1719 1737 CONECT 1554 1553 1555 1556 CONECT 1555 1554 CONECT 1556 1554 1557 1718 CONECT 1557 1556 1558 1708 1717 CONECT 1558 1557 1559 1560 CONECT 1559 1558 CONECT 1560 1558 1561 1707 CONECT 1561 1560 1562 1701 1706 CONECT 1562 1561 1563 1564 CONECT 1563 1562 CONECT 1564 1562 1565 1700 CONECT 1565 1564 1566 1688 1699 CONECT 1566 1565 1567 1568 CONECT 1567 1566 CONECT 1568 1566 1569 1687 CONECT 1569 1568 1570 1670 1686 CONECT 1570 1569 1571 1572 CONECT 1571 1570 CONECT 1572 1570 1573 1669 CONECT 1573 1572 1574 1663 1668 CONECT 1574 1573 1575 1576 CONECT 1575 1574 CONECT 1576 1574 1577 1662 CONECT 1577 1576 1578 1660 1661 CONECT 1578 1577 1579 1580 CONECT 1579 1578 CONECT 1580 1578 1581 1659 CONECT 1581 1580 1582 1657 1658 CONECT 1582 1581 1583 1584 CONECT 1583 1582 CONECT 1584 1582 1585 1656 CONECT 1585 1584 1586 1646 1655 CONECT 1586 1585 1587 1588 CONECT 1587 1586 CONECT 1588 1586 1589 1645 CONECT 1589 1588 1590 1636 1644 CONECT 1590 1589 1591 1592 CONECT 1591 1590 CONECT 1592 1590 1593 1635 CONECT 1593 1592 1594 1616 1634 CONECT 1594 1593 1595 1596 CONECT 1595 1594 CONECT 1596 1594 1597 1615 CONECT 1597 1596 1598 1601 1614 CONECT 1598 1597 1599 1600 CONECT 1599 1598 CONECT 1600 1598 CONECT 1601 1597 1602 1612 1613 CONECT 1602 1601 1603 1607 1611 CONECT 1603 1602 1604 1605 1606 CONECT 1604 1603 CONECT 1605 1603 CONECT 1606 1603 CONECT 1607 1602 1608 1609 1610 CONECT 1608 1607 CONECT 1609 1607 CONECT 1610 1607 CONECT 1611 1602 CONECT 1612 1601 CONECT 1613 1601 CONECT 1614 1597 CONECT 1615 1596 CONECT 1616 1593 1617 1632 1633 CONECT 1617 1616 1618 1630 1631 CONECT 1618 1617 1619 1628 1629 CONECT 1619 1618 1620 1627 CONECT 1620 1619 1621 1624 CONECT 1621 1620 1622 1623 CONECT 1622 1621 CONECT 1623 1621 CONECT 1624 1620 1625 1626 CONECT 1625 1624 CONECT 1626 1624 CONECT 1627 1619 CONECT 1628 1618 CONECT 1629 1618 CONECT 1630 1617 CONECT 1631 1617 CONECT 1632 1616 CONECT 1633 1616 CONECT 1634 1593 CONECT 1635 1592 CONECT 1636 1589 1637 1639 1643 CONECT 1637 1636 1638 CONECT 1638 1637 CONECT 1639 1636 1640 1641 1642 CONECT 1640 1639 CONECT 1641 1639 CONECT 1642 1639 CONECT 1643 1636 CONECT 1644 1589 CONECT 1645 1588 CONECT 1646 1585 1647 1653 1654 CONECT 1647 1646 1648 1651 1652 CONECT 1648 1647 1649 1650 CONECT 1649 1648 CONECT 1650 1648 CONECT 1651 1647 CONECT 1652 1647 CONECT 1653 1646 CONECT 1654 1646 CONECT 1655 1585 CONECT 1656 1584 CONECT 1657 1581 CONECT 1658 1581 CONECT 1659 1580 CONECT 1660 1577 CONECT 1661 1577 CONECT 1662 1576 CONECT 1663 1573 1664 1666 1667 CONECT 1664 1663 1665 CONECT 1665 1664 CONECT 1666 1663 CONECT 1667 1663 CONECT 1668 1573 CONECT 1669 1572 CONECT 1670 1569 1671 1684 1685 CONECT 1671 1670 1672 1682 1683 CONECT 1672 1671 1673 1680 1681 CONECT 1673 1672 1674 1678 1679 CONECT 1674 1673 1675 1676 1677 CONECT 1675 1674 CONECT 1676 1674 CONECT 1677 1674 CONECT 1678 1673 CONECT 1679 1673 CONECT 1680 1672 CONECT 1681 1672 CONECT 1682 1671 CONECT 1683 1671 CONECT 1684 1670 CONECT 1685 1670 CONECT 1686 1569 CONECT 1687 1568 CONECT 1688 1565 1689 1697 1698 CONECT 1689 1688 1690 1693 CONECT 1690 1689 1691 1696 CONECT 1691 1690 1692 1695 CONECT 1692 1691 1693 CONECT 1693 1689 1692 1694 CONECT 1694 1693 CONECT 1695 1691 CONECT 1696 1690 CONECT 1697 1688 CONECT 1698 1688 CONECT 1699 1565 CONECT 1700 1564 CONECT 1701 1561 1702 1704 1705 CONECT 1702 1701 1703 CONECT 1703 1702 CONECT 1704 1701 CONECT 1705 1701 CONECT 1706 1561 CONECT 1707 1560 CONECT 1708 1557 1709 1715 1716 CONECT 1709 1708 1710 1713 1714 CONECT 1710 1709 1711 1712 CONECT 1711 1710 CONECT 1712 1710 CONECT 1713 1709 CONECT 1714 1709 CONECT 1715 1708 CONECT 1716 1708 CONECT 1717 1557 CONECT 1718 1556 CONECT 1719 1553 1720 1735 1736 CONECT 1720 1719 1721 1724 CONECT 1721 1720 1722 1734 CONECT 1722 1721 1723 1733 CONECT 1723 1722 1724 1728 CONECT 1724 1720 1723 1725 CONECT 1725 1724 1726 1732 CONECT 1726 1725 1727 1731 CONECT 1727 1726 1728 1730 CONECT 1728 1723 1727 1729 CONECT 1729 1728 CONECT 1730 1727 CONECT 1731 1726 CONECT 1732 1725 CONECT 1733 1722 CONECT 1734 1721 CONECT 1735 1719 CONECT 1736 1719 CONECT 1737 1553 CONECT 1738 1552 CONECT 1739 1549 1740 1742 1743 CONECT 1740 1739 1741 CONECT 1741 1740 CONECT 1742 1739 CONECT 1743 1739 CONECT 1744 1549 CONECT 1745 1548 CONECT 1746 1548 CONECT 1747 1548 MASTER 0 0 0 0 0 0 0 0 1746 1 204 8 END
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4um9
RCSB PDB
PDBbind
13-mer
4umn
RCSB PDB
PDBbind
13-mer
4w4z
RCSB PDB
PDBbind
13-mer
4wj7
RCSB PDB
PDBbind
13-mer
4x3e
RCSB PDB
PDBbind
13-mer
4yjl
RCSB PDB
PDBbind
13-mer
4z0d
RCSB PDB
PDBbind
13-mer
4z0e
RCSB PDB
PDBbind
13-mer
4z0f
RCSB PDB
PDBbind
13-mer
5cil
RCSB PDB
PDBbind
13-mer
5dd0
RCSB PDB
PDBbind
13-mer
5dhf
RCSB PDB
PDBbind
13-mer
5dx3
RCSB PDB
PDBbind
13-mer
5dxb
RCSB PDB
PDBbind
13-mer
5dxe
RCSB PDB
PDBbind
13-mer
5dxg
RCSB PDB
PDBbind
13-mer
5e0m
RCSB PDB
PDBbind
13-mer
5eay
RCSB PDB
PDBbind
13-mer
5eyz
RCSB PDB
PDBbind
13-mer
5fyq
RCSB PDB
PDBbind
13-mer
5gg4
RCSB PDB
PDBbind
13-mer
5h1e
RCSB PDB
PDBbind
13-mer
5h7g
RCSB PDB
PDBbind
13-mer
5hyr
RCSB PDB
PDBbind
13-mer
5hyx
RCSB PDB
PDBbind
13-mer
5jr2
RCSB PDB
PDBbind
13-mer
5kgn
RCSB PDB
PDBbind
13-mer
5lgp
RCSB PDB
PDBbind
13-mer
5lu2
RCSB PDB
PDBbind
13-mer
5n8b
RCSB PDB
PDBbind
13-mer
5n8e
RCSB PDB
PDBbind
13-mer
5n8t
RCSB PDB
PDBbind
13-mer
5t6j
RCSB PDB
PDBbind
13-mer
5u6k
RCSB PDB
PDBbind
13-mer
5umz
RCSB PDB
PDBbind
13-mer
5vqi
RCSB PDB
PDBbind
13-mer
5wgd
RCSB PDB
PDBbind
13-mer
5wgq
RCSB PDB
PDBbind
13-mer
5yyz
RCSB PDB
PDBbind
13-mer
6bij
RCSB PDB
PDBbind
13-mer
6bil
RCSB PDB
PDBbind
13-mer
6bin
RCSB PDB
PDBbind
13-mer
6bir
RCSB PDB
PDBbind
13-mer
6biv
RCSB PDB
PDBbind
13-mer
6bix
RCSB PDB
PDBbind
13-mer
6biy
RCSB PDB
PDBbind
13-mer
6bnh
RCSB PDB
PDBbind
13-mer
6cf6
RCSB PDB
PDBbind
13-mer
6drt
RCSB PDB
PDBbind
13-mer
6e8k
RCSB PDB
PDBbind
13-mer
6e8m
RCSB PDB
PDBbind
13-mer
6o7g
RCSB PDB
PDBbind
13-mer
6o3y
RCSB PDB
PDBbind
13-mer
6nkp
RCSB PDB
PDBbind
13-mer
6n9t
RCSB PDB
PDBbind
13-mer
6n87
RCSB PDB
PDBbind
13-mer
6n7q
RCSB PDB
PDBbind
13-mer
6hy7
RCSB PDB
PDBbind
13-mer
6bcy
RCSB PDB
PDBbind
13-mer
5yy9
RCSB PDB
PDBbind
13-mer
5mtw
RCSB PDB
PDBbind
13-mer
Entry Information
PDB ID
3nfk
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein phosphatase non-receptor type 4,PTPN4 PDZ domain
Ligand Name
13-mer
EC.Number
E.C.3.1.3.48
Resolution
1.43(Å)
Affinity (Kd/Ki/IC50)
Kd=160uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Structure Vol. 19: pp. 1518-1524
Ligand Properties
Formula
C
6
2
H
9
9
N
2
0
O
2
2
Molecular Weight
1476.570
Exact Mass
1475.720
No. of atoms
203
No. of bonds
205
Polar Surface Area
707.78
LOGP Value
-6.67 (
Computed with XLOGP3
)
-6.78 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 20
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 62
No. of Nitrogen and Oxygen Atoms: 42
No. of Rings: 3
Canonical SMILES
OC[C@@H](C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CCC[NH+]=C(N)N)[C@H](O)C)CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](CO)[NH3+])CCC(=O)O)CO)CCCC[NH3+]
InChI String
InChI=1S/C62H96N20O22/c1-30(2)19-43(61(103)104)79-53(95)38(12-8-18-68-62(65)66)76-60(102)50(31(3)86)82-56(98)39(13-15-48(89)90)73-47(88)25-70-46(87)24-71-52(94)44(27-84)80-54(96)37(11-6-7-17-63)74-58(100)42(21-33-23-67-29-72-33)78-59(101)45(28-85)81-55(97)40(14-16-49(91)92)75-57(99)41(77-51(93)35(64)26-83)20-32-22-69-36-10-5-4-9-34(32)36/h4-5,9-10,22-23,29-31,35,37-45,50,69,83-86H,6-8,11-21,24-28,63-64H2,1-3H3,(H,67,72)(H,70,87)(H,71,94)(H,73,88)(H,74,100)(H,75,99)(H,76,102)(H,77,93)(H,78,101)(H,79,95)(H,80,96)(H,81,97)(H,82,98)(H,89,90)(H,91,92)(H,103,104)(H4,65,66,68)/p+3/t31-,35+,37+,38+,39+,40+,41+,42+,43+,44+,45+,50+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03524
P29074
Entrez Gene ID
NCBI Entrez Gene ID:
5775
ASD
Information of known allosteric effects of PDB entries
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