Browse entries in the PDBbind-CN Database
HEADER 5MMP_COMPLEX COMPND 5MMP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 89 ILE LYS VAL LEU LYS GLY LEU ASP ALA VAL ARG LYS ARG SEQRES 2 A 89 PRO GLY MET TYR ILE GLY ASP THR ASP ASP GLY THR GLY SEQRES 3 A 89 LEU HIS HIS MET VAL PHE GLU VAL VAL ASP ASN ALA ILE SEQRES 4 A 89 ASP GLU ALA LEU ALA GLY HIS CYS LYS GLU ILE ILE VAL SEQRES 5 A 89 THR ILE HIS ALA ASP ASN SER VAL SER VAL GLN ASP ASP SEQRES 6 A 89 GLY ARG GLY ILE PRO THR GLY ILE HIS PRO GLU GLU GLY SEQRES 7 A 89 VAL SER ALA ALA GLU VAL ILE MET THR VAL LEU SEQRES 1 A 102 VAL GLY VAL SER VAL VAL ASN ALA LEU SER GLN LYS LEU SEQRES 2 A 102 GLU LEU VAL ILE GLN ARG GLU GLY LYS ILE HIS ARG GLN SEQRES 3 A 102 ILE TYR GLU HIS GLY VAL PRO GLN ALA PRO LEU ALA VAL SEQRES 4 A 102 THR GLY GLU THR GLU LYS THR GLY THR MET VAL ARG PHE SEQRES 5 A 102 TRP PRO SER LEU GLU THR PHE THR ASN VAL THR GLU PHE SEQRES 6 A 102 GLU TYR GLU ILE LEU ALA LYS ARG LEU ARG GLU LEU SER SEQRES 7 A 102 PHE LEU ASN SER GLY VAL SER ILE ARG LEU ARG ASP LYS SEQRES 8 A 102 ARG ASP GLY LYS GLU ASP HIS PHE HIS TYR GLU HET G A 3Z 49 ATOM 1 N ILE A 10 23.483 -19.481 -5.568 1.00 70.32 N ATOM 2 CA ILE A 10 22.890 -20.010 -4.298 1.00 70.39 C ATOM 3 C ILE A 10 23.874 -20.930 -3.554 1.00 70.26 C ATOM 4 O ILE A 10 24.038 -20.823 -2.333 1.00 70.14 O ATOM 5 CB ILE A 10 21.485 -20.692 -4.541 1.00 70.54 C ATOM 6 CG1 ILE A 10 20.758 -20.984 -3.216 1.00 70.45 C ATOM 7 CG2 ILE A 10 21.587 -21.946 -5.447 1.00 70.75 C ATOM 8 CD1 ILE A 10 19.898 -19.832 -2.705 1.00 69.89 C ATOM 9 HN3 ILE A 10 23.727 -20.276 -6.193 1.00 0.00 H ATOM 10 HN2 ILE A 10 24.341 -18.936 -5.348 1.00 0.00 H ATOM 11 HN1 ILE A 10 22.792 -18.865 -6.042 1.00 0.00 H ATOM 12 N LYS A 11 24.534 -21.810 -4.307 1.00 70.04 N ATOM 13 CA LYS A 11 25.537 -22.740 -3.780 1.00 69.74 C ATOM 14 C LYS A 11 26.824 -22.009 -3.370 1.00 69.53 C ATOM 15 O LYS A 11 27.499 -22.405 -2.408 1.00 69.48 O ATOM 16 CB LYS A 11 25.870 -23.780 -4.850 1.00 69.77 C ATOM 17 CG LYS A 11 25.765 -25.220 -4.405 1.00 69.81 C ATOM 18 CD LYS A 11 25.762 -26.136 -5.626 1.00 70.13 C ATOM 19 CE LYS A 11 24.829 -27.319 -5.441 1.00 70.39 C ATOM 20 NZ LYS A 11 25.328 -28.276 -4.414 1.00 70.72 N ATOM 21 HZ1 LYS A 11 26.258 -28.640 -4.704 1.00 0.00 H ATOM 22 HZ2 LYS A 11 25.415 -27.787 -3.500 1.00 0.00 H ATOM 23 HZ3 LYS A 11 24.658 -29.066 -4.323 1.00 0.00 H ATOM 24 H LYS A 11 24.326 -21.838 -5.326 1.00 0.00 H ATOM 25 N VAL A 12 27.155 -20.952 -4.119 1.00 69.07 N ATOM 26 CA VAL A 12 28.367 -20.150 -3.893 1.00 68.50 C ATOM 27 C VAL A 12 28.278 -19.300 -2.623 1.00 67.92 C ATOM 28 O VAL A 12 29.195 -19.318 -1.791 1.00 67.84 O ATOM 29 CB VAL A 12 28.735 -19.248 -5.124 1.00 68.66 C ATOM 30 CG1 VAL A 12 29.357 -20.084 -6.234 1.00 68.85 C ATOM 31 CG2 VAL A 12 27.517 -18.454 -5.647 1.00 68.86 C ATOM 32 H VAL A 12 26.524 -20.683 -4.901 1.00 0.00 H ATOM 33 N LEU A 13 27.169 -18.572 -2.482 1.00 67.15 N ATOM 34 CA LEU A 13 26.911 -17.726 -1.314 1.00 66.46 C ATOM 35 C LEU A 13 26.830 -18.566 -0.028 1.00 65.81 C ATOM 36 O LEU A 13 27.049 -18.054 1.071 1.00 65.93 O ATOM 37 CB LEU A 13 25.639 -16.879 -1.524 1.00 66.57 C ATOM 38 CG LEU A 13 25.582 -15.899 -2.720 1.00 66.84 C ATOM 39 CD1 LEU A 13 24.154 -15.700 -3.223 1.00 66.69 C ATOM 40 CD2 LEU A 13 26.255 -14.543 -2.438 1.00 65.95 C ATOM 41 H LEU A 13 26.454 -18.607 -3.237 1.00 0.00 H ATOM 42 N LYS A 14 26.542 -19.858 -0.184 1.00 64.82 N ATOM 43 CA LYS A 14 26.568 -20.811 0.923 1.00 63.86 C ATOM 44 C LYS A 14 28.005 -21.077 1.405 1.00 62.86 C ATOM 45 O LYS A 14 28.295 -20.969 2.601 1.00 62.83 O ATOM 46 CB LYS A 14 25.876 -22.122 0.515 1.00 64.03 C ATOM 47 CG LYS A 14 25.206 -22.862 1.660 1.00 64.53 C ATOM 48 CD LYS A 14 24.025 -22.071 2.210 1.00 64.72 C ATOM 49 CE LYS A 14 23.895 -22.267 3.711 1.00 64.43 C ATOM 50 NZ LYS A 14 23.692 -20.953 4.387 1.00 63.72 N ATOM 51 HZ1 LYS A 14 24.506 -20.335 4.193 1.00 0.00 H ATOM 52 HZ2 LYS A 14 22.824 -20.509 4.025 1.00 0.00 H ATOM 53 HZ3 LYS A 14 23.605 -21.102 5.413 1.00 0.00 H ATOM 54 H LYS A 14 26.288 -20.202 -1.132 1.00 0.00 H ATOM 55 N GLY A 15 28.894 -21.411 0.469 1.00 61.58 N ATOM 56 CA GLY A 15 30.297 -21.671 0.779 1.00 59.76 C ATOM 57 C GLY A 15 31.029 -20.460 1.339 1.00 58.64 C ATOM 58 O GLY A 15 31.828 -20.588 2.267 1.00 58.60 O ATOM 59 H GLY A 15 28.576 -21.489 -0.518 1.00 0.00 H ATOM 60 N LEU A 16 30.753 -19.285 0.777 1.00 57.20 N ATOM 61 CA LEU A 16 31.362 -18.034 1.249 1.00 55.94 C ATOM 62 C LEU A 16 30.855 -17.581 2.621 1.00 55.17 C ATOM 63 O LEU A 16 31.589 -16.938 3.370 1.00 54.75 O ATOM 64 CB LEU A 16 31.197 -16.906 0.226 1.00 55.59 C ATOM 65 CG LEU A 16 31.766 -17.128 -1.178 1.00 55.20 C ATOM 66 CD1 LEU A 16 31.644 -15.848 -1.957 1.00 55.31 C ATOM 67 CD2 LEU A 16 33.210 -17.619 -1.169 1.00 53.73 C ATOM 68 H LEU A 16 30.086 -19.252 -0.020 1.00 0.00 H ATOM 69 N ASP A 17 29.606 -17.910 2.946 1.00 54.33 N ATOM 70 CA ASP A 17 29.102 -17.692 4.302 1.00 53.61 C ATOM 71 C ASP A 17 29.819 -18.578 5.309 1.00 52.53 C ATOM 72 O ASP A 17 30.240 -18.097 6.352 1.00 52.62 O ATOM 73 CB ASP A 17 27.592 -17.904 4.382 1.00 54.04 C ATOM 74 CG ASP A 17 26.807 -16.641 4.065 1.00 55.39 C ATOM 75 OD1 ASP A 17 27.330 -15.522 4.291 1.00 56.39 O ATOM 76 OD2 ASP A 17 25.653 -16.774 3.603 1.00 56.51 O ATOM 77 H ASP A 17 28.981 -18.327 2.227 1.00 0.00 H ATOM 78 N ALA A 18 29.977 -19.860 4.983 1.00 51.23 N ATOM 79 CA ALA A 18 30.676 -20.800 5.867 1.00 50.13 C ATOM 80 C ALA A 18 32.140 -20.414 6.147 1.00 49.22 C ATOM 81 O ALA A 18 32.633 -20.628 7.253 1.00 48.94 O ATOM 82 CB ALA A 18 30.581 -22.232 5.327 1.00 50.03 C ATOM 83 H ALA A 18 29.595 -20.204 4.079 1.00 0.00 H ATOM 84 N VAL A 19 32.826 -19.847 5.153 1.00 48.19 N ATOM 85 CA VAL A 19 34.183 -19.326 5.366 1.00 47.21 C ATOM 86 C VAL A 19 34.128 -18.113 6.296 1.00 47.17 C ATOM 87 O VAL A 19 34.883 -18.025 7.264 1.00 46.72 O ATOM 88 CB VAL A 19 34.905 -18.958 4.034 1.00 47.12 C ATOM 89 CG1 VAL A 19 36.280 -18.360 4.311 1.00 45.63 C ATOM 90 CG2 VAL A 19 35.041 -20.179 3.135 1.00 46.30 C ATOM 91 H VAL A 19 32.392 -19.773 4.211 1.00 0.00 H ATOM 92 N ARG A 20 33.215 -17.193 5.998 1.00 47.21 N ATOM 93 CA ARG A 20 33.028 -15.980 6.794 1.00 47.90 C ATOM 94 C ARG A 20 32.639 -16.302 8.239 1.00 47.86 C ATOM 95 O ARG A 20 33.090 -15.628 9.168 1.00 47.93 O ATOM 96 CB ARG A 20 31.998 -15.048 6.136 1.00 47.96 C ATOM 97 CG ARG A 20 32.523 -14.309 4.888 1.00 49.33 C ATOM 98 CD ARG A 20 31.408 -13.581 4.141 1.00 51.07 C ATOM 99 NE ARG A 20 30.887 -12.456 4.921 1.00 52.64 N ATOM 100 CZ ARG A 20 29.965 -11.593 4.495 1.00 53.23 C ATOM 101 NH1 ARG A 20 29.439 -11.707 3.281 1.00 54.61 N ATOM 102 NH2 ARG A 20 29.566 -10.606 5.285 1.00 53.08 N ATOM 103 HE ARG A 20 31.265 -12.320 5.880 1.00 0.00 H ATOM 104 HH12 ARG A 20 28.720 -11.027 2.960 1.00 0.00 H ATOM 105 HH11 ARG A 20 29.746 -12.476 2.651 1.00 0.00 H ATOM 106 HH22 ARG A 20 28.847 -9.932 4.953 1.00 0.00 H ATOM 107 HH21 ARG A 20 29.972 -10.505 6.237 1.00 0.00 H ATOM 108 H ARG A 20 32.610 -17.342 5.166 1.00 0.00 H ATOM 109 N LYS A 21 31.832 -17.351 8.414 1.00 47.59 N ATOM 110 CA LYS A 21 31.373 -17.797 9.727 1.00 47.62 C ATOM 111 C LYS A 21 32.487 -18.375 10.583 1.00 46.97 C ATOM 112 O LYS A 21 32.551 -18.101 11.777 1.00 47.34 O ATOM 113 CB LYS A 21 30.239 -18.823 9.587 1.00 48.01 C ATOM 114 CG LYS A 21 28.875 -18.395 10.167 1.00 50.22 C ATOM 115 CD LYS A 21 28.276 -17.104 9.546 1.00 53.79 C ATOM 116 CE LYS A 21 27.692 -17.310 8.132 1.00 55.48 C ATOM 117 NZ LYS A 21 26.755 -18.479 8.014 1.00 55.87 N ATOM 118 HZ1 LYS A 21 27.260 -19.353 8.266 1.00 0.00 H ATOM 119 HZ2 LYS A 21 25.951 -18.344 8.659 1.00 0.00 H ATOM 120 HZ3 LYS A 21 26.409 -18.547 7.036 1.00 0.00 H ATOM 121 H LYS A 21 31.515 -17.876 7.574 1.00 0.00 H ATOM 122 N ARG A 22 33.365 -19.173 9.985 1.00 46.28 N ATOM 123 CA ARG A 22 34.441 -19.818 10.740 1.00 45.61 C ATOM 124 C ARG A 22 35.810 -19.647 10.074 1.00 44.18 C ATOM 125 O ARG A 22 36.421 -20.623 9.642 1.00 43.93 O ATOM 126 CB ARG A 22 34.111 -21.292 10.966 1.00 46.35 C ATOM 127 CG ARG A 22 32.924 -21.528 11.896 1.00 49.04 C ATOM 128 CD ARG A 22 33.383 -21.898 13.302 1.00 54.60 C ATOM 129 NE ARG A 22 33.814 -23.299 13.443 1.00 58.06 N ATOM 130 CZ ARG A 22 33.382 -24.335 12.714 1.00 59.88 C ATOM 131 NH1 ARG A 22 32.474 -24.182 11.749 1.00 59.94 N ATOM 132 NH2 ARG A 22 33.866 -25.547 12.961 1.00 61.10 N ATOM 133 HE ARG A 22 34.521 -23.503 14.178 1.00 0.00 H ATOM 134 HH12 ARG A 22 32.157 -25.005 11.198 1.00 0.00 H ATOM 135 HH11 ARG A 22 32.083 -23.240 11.547 1.00 0.00 H ATOM 136 HH22 ARG A 22 33.539 -26.361 12.402 1.00 0.00 H ATOM 137 HH21 ARG A 22 34.572 -25.682 13.713 1.00 0.00 H ATOM 138 H ARG A 22 33.287 -19.343 8.962 1.00 0.00 H ATOM 139 N PRO A 23 36.307 -18.394 10.014 1.00 43.16 N ATOM 140 CA PRO A 23 37.506 -18.066 9.231 1.00 42.18 C ATOM 141 C PRO A 23 38.784 -18.757 9.710 1.00 41.49 C ATOM 142 O PRO A 23 39.609 -19.166 8.885 1.00 40.81 O ATOM 143 CB PRO A 23 37.611 -16.544 9.378 1.00 42.44 C ATOM 144 CG PRO A 23 36.871 -16.232 10.639 1.00 42.80 C ATOM 145 CD PRO A 23 35.743 -17.200 10.672 1.00 42.79 C ATOM 146 N GLY A 24 38.939 -18.891 11.027 1.00 40.91 N ATOM 147 CA GLY A 24 40.071 -19.602 11.602 1.00 40.74 C ATOM 148 C GLY A 24 40.259 -20.970 10.982 1.00 40.53 C ATOM 149 O GLY A 24 41.381 -21.399 10.754 1.00 40.85 O ATOM 150 H GLY A 24 38.229 -18.475 11.663 1.00 0.00 H ATOM 151 N MET A 25 39.153 -21.646 10.694 1.00 40.80 N ATOM 152 CA MET A 25 39.190 -22.953 10.032 1.00 41.47 C ATOM 153 C MET A 25 39.965 -22.878 8.719 1.00 40.49 C ATOM 154 O MET A 25 40.807 -23.736 8.428 1.00 41.12 O ATOM 155 CB MET A 25 37.774 -23.449 9.719 1.00 41.75 C ATOM 156 CG MET A 25 37.118 -24.304 10.771 1.00 45.44 C ATOM 157 SD MET A 25 35.988 -25.516 10.007 1.00 51.60 S ATOM 158 CE MET A 25 34.742 -24.482 9.228 1.00 48.97 C ATOM 159 H MET A 25 38.232 -21.235 10.946 1.00 0.00 H ATOM 160 N TYR A 26 39.669 -21.850 7.926 1.00 38.83 N ATOM 161 CA TYR A 26 40.195 -21.766 6.569 1.00 37.53 C ATOM 162 C TYR A 26 41.553 -21.065 6.456 1.00 35.99 C ATOM 163 O TYR A 26 42.458 -21.580 5.797 1.00 35.76 O ATOM 164 CB TYR A 26 39.147 -21.166 5.626 1.00 37.54 C ATOM 165 CG TYR A 26 37.882 -21.990 5.567 1.00 39.08 C ATOM 166 CD1 TYR A 26 36.782 -21.673 6.368 1.00 39.63 C ATOM 167 CD2 TYR A 26 37.789 -23.106 4.726 1.00 40.95 C ATOM 168 CE1 TYR A 26 35.628 -22.431 6.328 1.00 41.72 C ATOM 169 CE2 TYR A 26 36.631 -23.871 4.676 1.00 41.25 C ATOM 170 CZ TYR A 26 35.557 -23.529 5.478 1.00 43.06 C ATOM 171 OH TYR A 26 34.405 -24.278 5.434 1.00 44.32 O ATOM 172 HH TYR A 26 33.742 -23.899 6.065 1.00 0.00 H ATOM 173 H TYR A 26 39.051 -21.093 8.281 1.00 0.00 H ATOM 174 N ILE A 27 41.701 -19.909 7.114 1.00 34.13 N ATOM 175 CA ILE A 27 42.865 -19.041 6.883 1.00 31.80 C ATOM 176 C ILE A 27 43.897 -19.062 8.027 1.00 30.95 C ATOM 177 O ILE A 27 45.035 -18.670 7.844 1.00 30.96 O ATOM 178 CB ILE A 27 42.411 -17.582 6.485 1.00 32.08 C ATOM 179 CG1 ILE A 27 43.501 -16.836 5.688 1.00 31.06 C ATOM 180 CG2 ILE A 27 41.954 -16.766 7.712 1.00 29.93 C ATOM 181 CD1 ILE A 27 43.698 -17.333 4.267 1.00 31.88 C ATOM 182 H ILE A 27 40.978 -19.619 7.803 1.00 0.00 H ATOM 183 N GLY A 28 43.507 -19.556 9.201 1.00 30.68 N ATOM 184 CA GLY A 28 44.373 -19.470 10.384 1.00 29.65 C ATOM 185 C GLY A 28 43.869 -18.383 11.328 1.00 28.81 C ATOM 186 O GLY A 28 42.842 -17.744 11.063 1.00 28.59 O ATOM 187 H GLY A 28 42.575 -20.010 9.281 1.00 0.00 H ATOM 188 N ASP A 29 44.579 -18.192 12.438 1.00 27.73 N ATOM 189 CA ASP A 29 44.146 -17.288 13.507 1.00 26.79 C ATOM 190 C ASP A 29 43.926 -15.867 12.987 1.00 25.23 C ATOM 191 O ASP A 29 44.782 -15.305 12.320 1.00 23.36 O ATOM 192 CB ASP A 29 45.183 -17.275 14.625 1.00 27.47 C ATOM 193 CG ASP A 29 44.824 -18.212 15.765 1.00 31.81 C ATOM 194 OD1 ASP A 29 43.993 -17.820 16.628 1.00 38.46 O ATOM 195 OD2 ASP A 29 45.382 -19.327 15.819 1.00 32.93 O ATOM 196 H ASP A 29 45.477 -18.705 12.551 1.00 0.00 H ATOM 197 N THR A 30 42.774 -15.309 13.314 1.00 25.23 N ATOM 198 CA THR A 30 42.385 -14.002 12.823 1.00 25.47 C ATOM 199 C THR A 30 42.781 -12.862 13.776 1.00 25.12 C ATOM 200 O THR A 30 42.595 -11.691 13.453 1.00 24.79 O ATOM 201 CB THR A 30 40.883 -13.954 12.549 1.00 25.61 C ATOM 202 OG1 THR A 30 40.161 -14.190 13.761 1.00 26.98 O ATOM 203 CG2 THR A 30 40.488 -15.007 11.538 1.00 26.24 C ATOM 204 HG1 THR A 30 40.396 -13.494 14.424 1.00 0.00 H ATOM 205 H THR A 30 42.126 -15.824 13.944 1.00 0.00 H ATOM 206 N ASP A 31 43.355 -13.206 14.928 1.00 24.66 N ATOM 207 CA ASP A 31 43.635 -12.214 15.976 1.00 24.25 C ATOM 208 C ASP A 31 45.115 -11.940 16.277 1.00 23.37 C ATOM 209 O ASP A 31 45.447 -11.254 17.239 1.00 24.15 O ATOM 210 CB ASP A 31 42.874 -12.591 17.261 1.00 25.03 C ATOM 211 CG ASP A 31 43.360 -13.895 17.889 1.00 27.14 C ATOM 212 OD1 ASP A 31 44.145 -14.638 17.264 1.00 29.14 O ATOM 213 OD2 ASP A 31 42.937 -14.180 19.025 1.00 30.07 O ATOM 214 H ASP A 31 43.611 -14.201 15.090 1.00 0.00 H ATOM 215 N ASP A 32 46.016 -12.456 15.467 1.00 22.25 N ATOM 216 CA ASP A 32 47.417 -12.309 15.799 1.00 22.28 C ATOM 217 C ASP A 32 48.267 -12.099 14.562 1.00 22.00 C ATOM 218 O ASP A 32 49.500 -12.167 14.636 1.00 21.38 O ATOM 219 CB ASP A 32 47.927 -13.528 16.613 1.00 22.92 C ATOM 220 CG ASP A 32 47.894 -14.829 15.804 1.00 24.39 C ATOM 221 OD1 ASP A 32 47.426 -14.810 14.648 1.00 25.94 O ATOM 222 OD2 ASP A 32 48.344 -15.870 16.315 1.00 28.22 O ATOM 223 H ASP A 32 45.726 -12.960 14.605 1.00 0.00 H ATOM 224 N GLY A 33 47.615 -11.843 13.429 1.00 21.80 N ATOM 225 CA GLY A 33 48.347 -11.593 12.195 1.00 21.69 C ATOM 226 C GLY A 33 48.699 -12.794 11.326 1.00 22.01 C ATOM 227 O GLY A 33 49.058 -12.620 10.154 1.00 21.52 O ATOM 228 H GLY A 33 46.575 -11.821 13.426 1.00 0.00 H ATOM 229 N THR A 34 48.622 -14.012 11.864 1.00 21.42 N ATOM 230 CA THR A 34 49.059 -15.171 11.079 1.00 21.17 C ATOM 231 C THR A 34 48.104 -15.441 9.918 1.00 20.75 C ATOM 232 O THR A 34 48.554 -15.589 8.792 1.00 21.62 O ATOM 233 CB THR A 34 49.314 -16.450 11.953 1.00 21.82 C ATOM 234 OG1 THR A 34 48.185 -16.676 12.798 1.00 21.81 O ATOM 235 CG2 THR A 34 50.545 -16.251 12.830 1.00 21.52 C ATOM 236 HG1 THR A 34 48.053 -15.892 13.387 1.00 0.00 H ATOM 237 H THR A 34 48.256 -14.138 12.829 1.00 0.00 H ATOM 238 N GLY A 35 46.806 -15.475 10.182 1.00 19.97 N ATOM 239 CA GLY A 35 45.800 -15.560 9.130 1.00 20.62 C ATOM 240 C GLY A 35 45.820 -14.402 8.117 1.00 20.66 C ATOM 241 O GLY A 35 45.685 -14.617 6.904 1.00 20.85 O ATOM 242 H GLY A 35 46.494 -15.440 11.174 1.00 0.00 H ATOM 243 N LEU A 36 46.032 -13.181 8.610 1.00 19.51 N ATOM 244 CA LEU A 36 46.118 -11.993 7.756 1.00 18.45 C ATOM 245 C LEU A 36 47.173 -12.169 6.676 1.00 18.41 C ATOM 246 O LEU A 36 46.939 -11.916 5.501 1.00 18.06 O ATOM 247 CB LEU A 36 46.456 -10.743 8.594 1.00 17.65 C ATOM 248 CG LEU A 36 46.641 -9.422 7.821 1.00 15.37 C ATOM 249 CD1 LEU A 36 45.283 -9.024 7.317 1.00 15.25 C ATOM 250 CD2 LEU A 36 47.187 -8.273 8.713 1.00 11.28 C ATOM 251 H LEU A 36 46.140 -13.068 9.638 1.00 0.00 H ATOM 252 N HIS A 37 48.353 -12.586 7.089 1.00 18.77 N ATOM 253 CA HIS A 37 49.437 -12.762 6.154 1.00 19.16 C ATOM 254 C HIS A 37 49.303 -14.011 5.275 1.00 19.08 C ATOM 255 O HIS A 37 49.822 -14.023 4.160 1.00 18.70 O ATOM 256 CB HIS A 37 50.768 -12.688 6.882 1.00 19.00 C ATOM 257 CG HIS A 37 50.980 -11.373 7.557 1.00 19.57 C ATOM 258 ND1 HIS A 37 51.629 -10.319 6.945 1.00 21.04 N ATOM 259 CD2 HIS A 37 50.588 -10.920 8.769 1.00 17.59 C ATOM 260 CE1 HIS A 37 51.646 -9.281 7.762 1.00 16.19 C ATOM 261 NE2 HIS A 37 51.016 -9.618 8.871 1.00 20.19 N ATOM 262 H HIS A 37 48.504 -12.790 8.098 1.00 0.00 H ATOM 263 N HIS A 38 48.600 -15.033 5.772 1.00 19.22 N ATOM 264 CA HIS A 38 48.271 -16.227 4.981 1.00 19.68 C ATOM 265 C HIS A 38 47.409 -15.840 3.780 1.00 19.28 C ATOM 266 O HIS A 38 47.508 -16.449 2.723 1.00 19.31 O ATOM 267 CB HIS A 38 47.552 -17.281 5.844 1.00 19.94 C ATOM 268 CG HIS A 38 47.445 -18.636 5.200 1.00 21.63 C ATOM 269 ND1 HIS A 38 46.331 -19.441 5.337 1.00 22.83 N ATOM 270 CD2 HIS A 38 48.314 -19.331 4.426 1.00 21.90 C ATOM 271 CE1 HIS A 38 46.518 -20.571 4.681 1.00 20.67 C ATOM 272 NE2 HIS A 38 47.711 -20.528 4.115 1.00 23.11 N ATOM 273 H HIS A 38 48.273 -14.981 6.758 1.00 0.00 H ATOM 274 N MET A 39 46.568 -14.822 3.955 1.00 19.50 N ATOM 275 CA MET A 39 45.778 -14.259 2.852 1.00 19.07 C ATOM 276 C MET A 39 46.673 -13.925 1.645 1.00 18.45 C ATOM 277 O MET A 39 46.361 -14.284 0.511 1.00 18.92 O ATOM 278 CB MET A 39 45.043 -13.004 3.319 1.00 19.66 C ATOM 279 CG MET A 39 43.998 -13.249 4.400 1.00 19.63 C ATOM 280 SD MET A 39 42.373 -13.701 3.781 1.00 22.98 S ATOM 281 CE MET A 39 41.641 -12.093 3.471 1.00 22.21 C ATOM 282 H MET A 39 46.467 -14.412 4.905 1.00 0.00 H ATOM 283 N VAL A 40 47.804 -13.293 1.912 1.00 17.73 N ATOM 284 CA VAL A 40 48.764 -12.921 0.868 1.00 17.64 C ATOM 285 C VAL A 40 49.428 -14.147 0.242 1.00 18.26 C ATOM 286 O VAL A 40 49.540 -14.224 -0.970 1.00 17.73 O ATOM 287 CB VAL A 40 49.860 -11.979 1.414 1.00 16.95 C ATOM 288 CG1 VAL A 40 50.787 -11.505 0.289 1.00 16.43 C ATOM 289 CG2 VAL A 40 49.224 -10.771 2.145 1.00 17.10 C ATOM 290 H VAL A 40 48.021 -13.051 2.900 1.00 0.00 H ATOM 291 N PHE A 41 49.882 -15.096 1.070 1.00 18.35 N ATOM 292 CA PHE A 41 50.515 -16.309 0.557 1.00 18.82 C ATOM 293 C PHE A 41 49.574 -17.152 -0.296 1.00 18.65 C ATOM 294 O PHE A 41 49.992 -17.714 -1.303 1.00 18.26 O ATOM 295 CB PHE A 41 51.141 -17.133 1.698 1.00 19.71 C ATOM 296 CG PHE A 41 51.996 -16.307 2.641 1.00 20.77 C ATOM 297 CD1 PHE A 41 52.841 -15.315 2.138 1.00 19.69 C ATOM 298 CD2 PHE A 41 51.958 -16.531 4.019 1.00 20.48 C ATOM 299 CE1 PHE A 41 53.629 -14.545 2.982 1.00 20.72 C ATOM 300 CE2 PHE A 41 52.750 -15.766 4.883 1.00 21.54 C ATOM 301 CZ PHE A 41 53.583 -14.765 4.363 1.00 21.65 C ATOM 302 H PHE A 41 49.782 -14.968 2.097 1.00 0.00 H ATOM 303 N GLU A 42 48.301 -17.206 0.066 1.00 18.75 N ATOM 304 CA GLU A 42 47.344 -17.918 -0.771 1.00 19.83 C ATOM 305 C GLU A 42 47.269 -17.330 -2.182 1.00 19.48 C ATOM 306 O GLU A 42 47.162 -18.066 -3.146 1.00 18.72 O ATOM 307 CB GLU A 42 45.948 -17.921 -0.156 1.00 20.78 C ATOM 308 CG GLU A 42 45.794 -18.819 1.042 1.00 24.71 C ATOM 309 CD GLU A 42 45.961 -20.303 0.711 1.00 30.32 C ATOM 310 OE1 GLU A 42 45.644 -20.741 -0.429 1.00 30.56 O ATOM 311 OE2 GLU A 42 46.407 -21.030 1.618 1.00 32.83 O ATOM 312 H GLU A 42 47.986 -16.743 0.942 1.00 0.00 H ATOM 313 N VAL A 43 47.331 -16.004 -2.296 1.00 18.69 N ATOM 314 CA VAL A 43 47.198 -15.373 -3.612 1.00 17.96 C ATOM 315 C VAL A 43 48.476 -15.657 -4.386 1.00 18.04 C ATOM 316 O VAL A 43 48.430 -16.032 -5.552 1.00 18.06 O ATOM 317 CB VAL A 43 46.905 -13.852 -3.508 1.00 17.67 C ATOM 318 CG1 VAL A 43 46.813 -13.210 -4.917 1.00 16.16 C ATOM 319 CG2 VAL A 43 45.595 -13.627 -2.741 1.00 17.10 C ATOM 320 H VAL A 43 47.474 -15.416 -1.450 1.00 0.00 H ATOM 321 N VAL A 44 49.607 -15.522 -3.698 1.00 18.23 N ATOM 322 CA VAL A 44 50.920 -15.814 -4.263 1.00 18.67 C ATOM 323 C VAL A 44 51.060 -17.272 -4.740 1.00 19.58 C ATOM 324 O VAL A 44 51.701 -17.527 -5.764 1.00 19.31 O ATOM 325 CB VAL A 44 52.031 -15.452 -3.254 1.00 19.19 C ATOM 326 CG1 VAL A 44 53.368 -15.990 -3.679 1.00 17.53 C ATOM 327 CG2 VAL A 44 52.093 -13.900 -3.039 1.00 18.42 C ATOM 328 H VAL A 44 49.552 -15.193 -2.713 1.00 0.00 H ATOM 329 N ASP A 45 50.456 -18.217 -4.014 1.00 20.48 N ATOM 330 CA ASP A 45 50.577 -19.643 -4.358 1.00 21.90 C ATOM 331 C ASP A 45 50.094 -19.906 -5.779 1.00 21.32 C ATOM 332 O ASP A 45 50.721 -20.654 -6.519 1.00 21.06 O ATOM 333 CB ASP A 45 49.824 -20.538 -3.361 1.00 22.63 C ATOM 334 CG ASP A 45 50.546 -20.667 -2.016 1.00 26.17 C ATOM 335 OD1 ASP A 45 51.770 -20.408 -1.934 1.00 28.52 O ATOM 336 OD2 ASP A 45 49.882 -21.040 -1.026 1.00 31.43 O ATOM 337 H ASP A 45 49.888 -17.939 -3.188 1.00 0.00 H ATOM 338 N ASN A 46 48.993 -19.263 -6.154 1.00 21.13 N ATOM 339 CA ASN A 46 48.423 -19.407 -7.495 1.00 21.43 C ATOM 340 C ASN A 46 49.270 -18.797 -8.603 1.00 21.16 C ATOM 341 O ASN A 46 49.294 -19.309 -9.729 1.00 21.09 O ATOM 342 CB ASN A 46 47.010 -18.836 -7.529 1.00 22.05 C ATOM 343 CG ASN A 46 46.058 -19.586 -6.610 1.00 23.74 C ATOM 344 OD1 ASN A 46 45.340 -18.982 -5.815 1.00 26.26 O ATOM 345 ND2 ASN A 46 46.041 -20.905 -6.728 1.00 22.70 N ATOM 346 HD22 ASN A 46 46.666 -21.374 -7.414 1.00 0.00 H ATOM 347 HD21 ASN A 46 45.403 -21.472 -6.134 1.00 0.00 H ATOM 348 H ASN A 46 48.520 -18.636 -5.472 1.00 0.00 H ATOM 349 N ALA A 47 49.952 -17.697 -8.290 1.00 20.88 N ATOM 350 CA ALA A 47 50.945 -17.122 -9.215 1.00 21.23 C ATOM 351 C ALA A 47 52.145 -18.061 -9.356 1.00 21.52 C ATOM 352 O ALA A 47 52.727 -18.190 -10.440 1.00 22.03 O ATOM 353 CB ALA A 47 51.409 -15.728 -8.726 1.00 20.55 C ATOM 354 H ALA A 47 49.781 -17.234 -7.374 1.00 0.00 H ATOM 355 N ILE A 48 52.536 -18.689 -8.247 1.00 21.39 N ATOM 356 CA ILE A 48 53.624 -19.674 -8.260 1.00 22.51 C ATOM 357 C ILE A 48 53.268 -20.841 -9.189 1.00 22.94 C ATOM 358 O ILE A 48 54.095 -21.252 -9.992 1.00 23.20 O ATOM 359 CB ILE A 48 53.922 -20.240 -6.835 1.00 22.83 C ATOM 360 CG1 ILE A 48 54.283 -19.120 -5.839 1.00 23.10 C ATOM 361 CG2 ILE A 48 54.987 -21.365 -6.889 1.00 21.50 C ATOM 362 CD1 ILE A 48 55.721 -18.741 -5.778 1.00 23.46 C ATOM 363 H ILE A 48 52.057 -18.475 -7.349 1.00 0.00 H ATOM 364 N ASP A 49 52.038 -21.359 -9.089 1.00 23.65 N ATOM 365 CA ASP A 49 51.592 -22.455 -9.954 1.00 24.53 C ATOM 366 C ASP A 49 51.695 -22.079 -11.426 1.00 25.28 C ATOM 367 O ASP A 49 52.132 -22.887 -12.249 1.00 26.12 O ATOM 368 CB ASP A 49 50.156 -22.882 -9.629 1.00 24.36 C ATOM 369 CG ASP A 49 50.061 -23.689 -8.346 1.00 25.31 C ATOM 370 OD1 ASP A 49 51.108 -23.975 -7.746 1.00 24.27 O ATOM 371 OD2 ASP A 49 48.936 -24.026 -7.929 1.00 26.89 O ATOM 372 H ASP A 49 51.382 -20.974 -8.380 1.00 0.00 H ATOM 373 N GLU A 50 51.284 -20.856 -11.746 1.00 25.58 N ATOM 374 CA GLU A 50 51.382 -20.328 -13.100 1.00 26.15 C ATOM 375 C GLU A 50 52.851 -20.256 -13.584 1.00 27.85 C ATOM 376 O GLU A 50 53.132 -20.517 -14.764 1.00 27.98 O ATOM 377 CB GLU A 50 50.671 -18.969 -13.181 1.00 25.14 C ATOM 378 CG GLU A 50 50.657 -18.324 -14.546 1.00 23.50 C ATOM 379 CD GLU A 50 49.838 -19.079 -15.591 1.00 22.42 C ATOM 380 OE1 GLU A 50 49.122 -20.051 -15.230 1.00 19.76 O ATOM 381 OE2 GLU A 50 49.911 -18.681 -16.782 1.00 20.03 O ATOM 382 H GLU A 50 50.877 -20.254 -11.002 1.00 0.00 H ATOM 383 N ALA A 51 53.774 -19.944 -12.668 1.00 29.53 N ATOM 384 CA ALA A 51 55.220 -19.986 -12.956 1.00 31.60 C ATOM 385 C ALA A 51 55.772 -21.396 -13.179 1.00 33.11 C ATOM 386 O ALA A 51 56.618 -21.607 -14.061 1.00 33.35 O ATOM 387 CB ALA A 51 56.014 -19.285 -11.854 1.00 31.69 C ATOM 388 H ALA A 51 53.461 -19.661 -11.717 1.00 0.00 H ATOM 389 N LEU A 52 55.292 -22.348 -12.382 1.00 34.86 N ATOM 390 CA LEU A 52 55.691 -23.751 -12.491 1.00 36.39 C ATOM 391 C LEU A 52 55.210 -24.409 -13.790 1.00 37.24 C ATOM 392 O LEU A 52 55.875 -25.295 -14.316 1.00 37.91 O ATOM 393 CB LEU A 52 55.172 -24.535 -11.289 1.00 36.49 C ATOM 394 CG LEU A 52 56.062 -24.709 -10.053 1.00 37.00 C ATOM 395 CD1 LEU A 52 57.239 -23.735 -9.972 1.00 38.24 C ATOM 396 CD2 LEU A 52 55.183 -24.617 -8.816 1.00 37.18 C ATOM 397 H LEU A 52 54.603 -22.083 -11.650 1.00 0.00 H ATOM 398 N ALA A 53 54.057 -23.972 -14.293 1.00 38.23 N ATOM 399 CA ALA A 53 53.558 -24.395 -15.608 1.00 38.50 C ATOM 400 C ALA A 53 54.440 -23.831 -16.726 1.00 38.88 C ATOM 401 O ALA A 53 54.229 -24.127 -17.907 1.00 38.60 O ATOM 402 CB ALA A 53 52.130 -23.940 -15.791 1.00 38.52 C ATOM 403 H ALA A 53 53.488 -23.305 -13.733 1.00 0.00 H ATOM 404 N GLY A 54 55.412 -23.000 -16.338 1.00 39.11 N ATOM 405 CA GLY A 54 56.377 -22.412 -17.264 1.00 39.15 C ATOM 406 C GLY A 54 55.933 -21.132 -17.939 1.00 39.34 C ATOM 407 O GLY A 54 56.563 -20.688 -18.896 1.00 39.59 O ATOM 408 H GLY A 54 55.485 -22.760 -15.329 1.00 0.00 H ATOM 409 N HIS A 55 54.869 -20.516 -17.435 1.00 39.36 N ATOM 410 CA HIS A 55 54.263 -19.360 -18.121 1.00 39.26 C ATOM 411 C HIS A 55 54.541 -17.984 -17.489 1.00 38.98 C ATOM 412 O HIS A 55 54.379 -16.947 -18.137 1.00 39.01 O ATOM 413 CB HIS A 55 52.768 -19.592 -18.294 1.00 39.20 C ATOM 414 CG HIS A 55 52.450 -20.763 -19.168 1.00 40.53 C ATOM 415 ND1 HIS A 55 52.560 -20.716 -20.544 1.00 41.73 N ATOM 416 CD2 HIS A 55 52.056 -22.021 -18.865 1.00 40.75 C ATOM 417 CE1 HIS A 55 52.232 -21.891 -21.050 1.00 41.76 C ATOM 418 NE2 HIS A 55 51.923 -22.701 -20.052 1.00 42.44 N ATOM 419 H HIS A 55 54.457 -20.855 -16.542 1.00 0.00 H ATOM 420 N CYS A 56 54.981 -17.991 -16.236 1.00 38.34 N ATOM 421 CA CYS A 56 55.218 -16.774 -15.479 1.00 37.79 C ATOM 422 C CYS A 56 56.675 -16.724 -15.048 1.00 36.85 C ATOM 423 O CYS A 56 57.209 -17.695 -14.527 1.00 37.30 O ATOM 424 CB CYS A 56 54.265 -16.725 -14.265 1.00 37.73 C ATOM 425 SG CYS A 56 54.811 -15.712 -12.855 1.00 39.18 S ATOM 426 H CYS A 56 55.164 -18.906 -15.777 1.00 0.00 H ATOM 427 N LYS A 57 57.320 -15.590 -15.275 1.00 35.73 N ATOM 428 CA LYS A 57 58.705 -15.399 -14.858 1.00 34.35 C ATOM 429 C LYS A 57 58.838 -14.515 -13.615 1.00 32.67 C ATOM 430 O LYS A 57 59.816 -14.627 -12.859 1.00 32.28 O ATOM 431 CB LYS A 57 59.510 -14.778 -15.992 1.00 35.02 C ATOM 432 CG LYS A 57 60.433 -15.726 -16.722 1.00 38.24 C ATOM 433 CD LYS A 57 61.399 -14.914 -17.596 1.00 43.15 C ATOM 434 CE LYS A 57 60.657 -14.247 -18.771 1.00 44.94 C ATOM 435 NZ LYS A 57 61.194 -12.880 -19.071 1.00 47.11 N ATOM 436 HZ1 LYS A 57 61.086 -12.275 -18.232 1.00 0.00 H ATOM 437 HZ2 LYS A 57 62.201 -12.952 -19.321 1.00 0.00 H ATOM 438 HZ3 LYS A 57 60.666 -12.469 -19.867 1.00 0.00 H ATOM 439 H LYS A 57 56.827 -14.816 -15.763 1.00 0.00 H ATOM 440 N GLU A 58 57.882 -13.615 -13.413 1.00 30.31 N ATOM 441 CA GLU A 58 57.993 -12.679 -12.291 1.00 28.12 C ATOM 442 C GLU A 58 56.700 -12.407 -11.546 1.00 25.44 C ATOM 443 O GLU A 58 55.650 -12.153 -12.147 1.00 24.51 O ATOM 444 CB GLU A 58 58.644 -11.360 -12.700 1.00 28.99 C ATOM 445 CG GLU A 58 59.292 -10.660 -11.481 1.00 32.34 C ATOM 446 CD GLU A 58 60.031 -9.400 -11.835 1.00 37.34 C ATOM 447 OE1 GLU A 58 59.399 -8.450 -12.367 1.00 38.80 O ATOM 448 OE2 GLU A 58 61.248 -9.353 -11.555 1.00 39.89 O ATOM 449 H GLU A 58 57.059 -13.575 -14.048 1.00 0.00 H ATOM 450 N ILE A 59 56.819 -12.482 -10.227 1.00 22.31 N ATOM 451 CA ILE A 59 55.752 -12.176 -9.291 1.00 20.62 C ATOM 452 C ILE A 59 56.153 -10.916 -8.490 1.00 19.82 C ATOM 453 O ILE A 59 57.276 -10.826 -7.997 1.00 20.61 O ATOM 454 CB ILE A 59 55.499 -13.379 -8.336 1.00 19.92 C ATOM 455 CG1 ILE A 59 55.320 -14.690 -9.147 1.00 19.15 C ATOM 456 CG2 ILE A 59 54.318 -13.096 -7.432 1.00 19.36 C ATOM 457 CD1 ILE A 59 55.009 -15.972 -8.283 1.00 16.84 C ATOM 458 H ILE A 59 57.736 -12.779 -9.838 1.00 0.00 H ATOM 459 N ILE A 60 55.247 -9.953 -8.385 1.00 18.96 N ATOM 460 CA ILE A 60 55.474 -8.726 -7.614 1.00 18.59 C ATOM 461 C ILE A 60 54.382 -8.577 -6.556 1.00 18.61 C ATOM 462 O ILE A 60 53.184 -8.555 -6.880 1.00 18.65 O ATOM 463 CB ILE A 60 55.469 -7.468 -8.516 1.00 18.87 C ATOM 464 CG1 ILE A 60 56.411 -7.644 -9.714 1.00 19.84 C ATOM 465 CG2 ILE A 60 55.859 -6.216 -7.701 1.00 18.37 C ATOM 466 CD1 ILE A 60 56.314 -6.545 -10.773 1.00 24.09 C ATOM 467 H ILE A 60 54.335 -10.073 -8.871 1.00 0.00 H ATOM 468 N VAL A 61 54.799 -8.487 -5.296 1.00 17.80 N ATOM 469 CA VAL A 61 53.881 -8.266 -4.183 1.00 17.15 C ATOM 470 C VAL A 61 54.127 -6.832 -3.669 1.00 17.49 C ATOM 471 O VAL A 61 55.274 -6.455 -3.414 1.00 17.08 O ATOM 472 CB VAL A 61 54.089 -9.307 -3.049 1.00 17.34 C ATOM 473 CG1 VAL A 61 53.110 -9.067 -1.865 1.00 17.55 C ATOM 474 CG2 VAL A 61 53.916 -10.721 -3.599 1.00 15.34 C ATOM 475 H VAL A 61 55.816 -8.577 -5.097 1.00 0.00 H ATOM 476 N THR A 62 53.047 -6.052 -3.551 1.00 17.30 N ATOM 477 CA THR A 62 53.130 -4.634 -3.180 1.00 17.36 C ATOM 478 C THR A 62 52.227 -4.335 -2.006 1.00 16.76 C ATOM 479 O THR A 62 51.033 -4.628 -2.047 1.00 16.40 O ATOM 480 CB THR A 62 52.707 -3.718 -4.341 1.00 16.99 C ATOM 481 OG1 THR A 62 53.474 -4.057 -5.490 1.00 18.08 O ATOM 482 CG2 THR A 62 52.944 -2.203 -3.996 1.00 17.64 C ATOM 483 HG1 THR A 62 53.308 -5.003 -5.729 1.00 0.00 H ATOM 484 H THR A 62 52.110 -6.467 -3.729 1.00 0.00 H ATOM 485 N ILE A 63 52.810 -3.757 -0.963 1.00 16.52 N ATOM 486 CA ILE A 63 52.049 -3.311 0.193 1.00 16.88 C ATOM 487 C ILE A 63 51.718 -1.835 -0.076 1.00 16.90 C ATOM 488 O ILE A 63 52.609 -1.001 -0.244 1.00 17.81 O ATOM 489 CB ILE A 63 52.848 -3.493 1.526 1.00 17.25 C ATOM 490 CG1 ILE A 63 53.392 -4.929 1.660 1.00 17.05 C ATOM 491 CG2 ILE A 63 51.977 -3.175 2.737 1.00 16.49 C ATOM 492 CD1 ILE A 63 54.374 -5.125 2.853 1.00 17.76 C ATOM 493 H ILE A 63 53.841 -3.619 -0.973 1.00 0.00 H ATOM 494 N HIS A 64 50.441 -1.527 -0.170 1.00 17.04 N ATOM 495 CA HIS A 64 50.028 -0.161 -0.427 1.00 17.28 C ATOM 496 C HIS A 64 49.758 0.571 0.899 1.00 17.76 C ATOM 497 O HIS A 64 49.756 -0.047 1.977 1.00 17.04 O ATOM 498 CB HIS A 64 48.803 -0.147 -1.334 1.00 16.54 C ATOM 499 CG HIS A 64 49.015 -0.837 -2.645 1.00 16.83 C ATOM 500 ND1 HIS A 64 49.630 -0.227 -3.719 1.00 13.93 N ATOM 501 CD2 HIS A 64 48.688 -2.089 -3.056 1.00 15.80 C ATOM 502 CE1 HIS A 64 49.671 -1.067 -4.735 1.00 16.05 C ATOM 503 NE2 HIS A 64 49.106 -2.205 -4.359 1.00 18.59 N ATOM 504 H HIS A 64 49.722 -2.270 -0.059 1.00 0.00 H ATOM 505 N ALA A 65 49.509 1.879 0.801 1.00 17.17 N ATOM 506 CA ALA A 65 49.314 2.743 1.964 1.00 17.12 C ATOM 507 C ALA A 65 47.842 2.849 2.365 1.00 16.16 C ATOM 508 O ALA A 65 47.464 3.611 3.289 1.00 16.21 O ATOM 509 CB ALA A 65 49.938 4.144 1.697 1.00 16.71 C ATOM 510 H ALA A 65 49.451 2.303 -0.147 1.00 0.00 H ATOM 511 N ASP A 66 47.006 2.075 1.691 1.00 15.13 N ATOM 512 CA ASP A 66 45.572 2.078 1.977 1.00 15.27 C ATOM 513 C ASP A 66 45.110 0.759 2.601 1.00 14.93 C ATOM 514 O ASP A 66 43.940 0.396 2.486 1.00 14.81 O ATOM 515 CB ASP A 66 44.766 2.339 0.693 1.00 15.35 C ATOM 516 CG ASP A 66 44.972 1.233 -0.346 1.00 15.20 C ATOM 517 OD1 ASP A 66 45.911 0.437 -0.181 1.00 16.25 O ATOM 518 OD2 ASP A 66 44.197 1.141 -1.303 1.00 14.04 O ATOM 519 H ASP A 66 47.376 1.453 0.944 1.00 0.00 H ATOM 520 N ASN A 67 46.020 0.046 3.253 1.00 15.77 N ATOM 521 CA ASN A 67 45.664 -1.224 3.941 1.00 16.25 C ATOM 522 C ASN A 67 45.292 -2.364 2.957 1.00 16.09 C ATOM 523 O ASN A 67 44.578 -3.298 3.324 1.00 16.32 O ATOM 524 CB ASN A 67 44.577 -0.946 5.005 1.00 16.72 C ATOM 525 CG ASN A 67 44.287 -2.136 5.936 1.00 18.70 C ATOM 526 OD1 ASN A 67 43.129 -2.350 6.309 1.00 23.57 O ATOM 527 ND2 ASN A 67 45.303 -2.912 6.290 1.00 17.50 N ATOM 528 HD22 ASN A 67 46.263 -2.697 5.954 1.00 0.00 H ATOM 529 HD21 ASN A 67 45.139 -3.736 6.904 1.00 0.00 H ATOM 530 H ASN A 67 47.004 0.383 3.284 1.00 0.00 H ATOM 531 N SER A 68 45.804 -2.279 1.723 1.00 15.13 N ATOM 532 CA SER A 68 45.655 -3.337 0.714 1.00 14.84 C ATOM 533 C SER A 68 47.024 -3.892 0.320 1.00 14.81 C ATOM 534 O SER A 68 48.068 -3.244 0.526 1.00 13.64 O ATOM 535 CB SER A 68 44.867 -2.884 -0.544 1.00 13.97 C ATOM 536 OG SER A 68 45.559 -1.902 -1.320 1.00 15.57 O ATOM 537 HG SER A 68 45.723 -1.099 -0.764 1.00 0.00 H ATOM 538 H SER A 68 46.333 -1.422 1.466 1.00 0.00 H ATOM 539 N VAL A 69 47.005 -5.127 -0.192 1.00 14.58 N ATOM 540 CA VAL A 69 48.173 -5.708 -0.829 1.00 15.26 C ATOM 541 C VAL A 69 47.758 -6.157 -2.203 1.00 14.79 C ATOM 542 O VAL A 69 46.626 -6.622 -2.403 1.00 15.26 O ATOM 543 CB VAL A 69 48.771 -6.943 -0.073 1.00 15.30 C ATOM 544 CG1 VAL A 69 49.777 -7.641 -0.958 1.00 15.70 C ATOM 545 CG2 VAL A 69 49.533 -6.494 1.138 1.00 17.51 C ATOM 546 H VAL A 69 46.130 -5.686 -0.132 1.00 0.00 H ATOM 547 N SER A 70 48.671 -6.002 -3.156 1.00 14.61 N ATOM 548 CA SER A 70 48.459 -6.579 -4.452 1.00 14.62 C ATOM 549 C SER A 70 49.550 -7.598 -4.799 1.00 15.02 C ATOM 550 O SER A 70 50.692 -7.535 -4.309 1.00 14.51 O ATOM 551 CB SER A 70 48.230 -5.502 -5.530 1.00 15.19 C ATOM 552 OG SER A 70 49.372 -4.719 -5.744 1.00 19.31 O ATOM 553 HG SER A 70 49.621 -4.264 -4.901 1.00 0.00 H ATOM 554 H SER A 70 49.539 -5.463 -2.962 1.00 0.00 H ATOM 555 N VAL A 71 49.158 -8.559 -5.631 1.00 14.99 N ATOM 556 CA VAL A 71 50.056 -9.572 -6.154 1.00 15.08 C ATOM 557 C VAL A 71 49.815 -9.544 -7.646 1.00 14.92 C ATOM 558 O VAL A 71 48.670 -9.617 -8.084 1.00 14.37 O ATOM 559 CB VAL A 71 49.708 -10.976 -5.600 1.00 15.95 C ATOM 560 CG1 VAL A 71 50.710 -12.038 -6.091 1.00 15.24 C ATOM 561 CG2 VAL A 71 49.616 -10.954 -4.042 1.00 14.72 C ATOM 562 H VAL A 71 48.160 -8.586 -5.921 1.00 0.00 H ATOM 563 N GLN A 72 50.900 -9.406 -8.404 1.00 15.61 N ATOM 564 CA GLN A 72 50.877 -9.354 -9.862 1.00 16.47 C ATOM 565 C GLN A 72 51.773 -10.444 -10.390 1.00 16.80 C ATOM 566 O GLN A 72 52.810 -10.735 -9.779 1.00 16.93 O ATOM 567 CB GLN A 72 51.478 -8.038 -10.347 1.00 16.33 C ATOM 568 CG GLN A 72 50.920 -6.809 -9.658 1.00 18.21 C ATOM 569 CD GLN A 72 51.424 -5.527 -10.277 1.00 17.50 C ATOM 570 OE1 GLN A 72 51.126 -5.239 -11.434 1.00 18.01 O ATOM 571 NE2 GLN A 72 52.176 -4.742 -9.507 1.00 14.52 N ATOM 572 HE22 GLN A 72 52.401 -5.030 -8.533 1.00 0.00 H ATOM 573 HE21 GLN A 72 52.538 -3.841 -9.880 1.00 0.00 H ATOM 574 H GLN A 72 51.821 -9.331 -7.928 1.00 0.00 H ATOM 575 N ASP A 73 51.404 -11.023 -11.531 1.00 16.94 N ATOM 576 CA ASP A 73 52.321 -11.887 -12.255 1.00 17.70 C ATOM 577 C ASP A 73 52.275 -11.527 -13.735 1.00 18.52 C ATOM 578 O ASP A 73 51.414 -10.736 -14.156 1.00 18.06 O ATOM 579 CB ASP A 73 52.042 -13.393 -11.981 1.00 18.11 C ATOM 580 CG ASP A 73 50.748 -13.881 -12.600 1.00 16.80 C ATOM 581 OD1 ASP A 73 50.489 -13.550 -13.761 1.00 17.69 O ATOM 582 OD2 ASP A 73 49.987 -14.624 -11.930 1.00 18.58 O ATOM 583 H ASP A 73 50.449 -10.855 -11.908 1.00 0.00 H ATOM 584 N ASP A 74 53.204 -12.087 -14.512 1.00 18.81 N ATOM 585 CA ASP A 74 53.216 -11.876 -15.950 1.00 20.11 C ATOM 586 C ASP A 74 52.861 -13.152 -16.704 1.00 19.77 C ATOM 587 O ASP A 74 53.362 -13.398 -17.811 1.00 19.44 O ATOM 588 CB ASP A 74 54.568 -11.279 -16.422 1.00 21.29 C ATOM 589 CG ASP A 74 55.773 -12.127 -16.015 1.00 24.72 C ATOM 590 OD1 ASP A 74 55.585 -13.179 -15.373 1.00 24.20 O ATOM 591 OD2 ASP A 74 56.929 -11.730 -16.348 1.00 29.70 O ATOM 592 H ASP A 74 53.935 -12.687 -14.080 1.00 0.00 H ATOM 593 N GLY A 75 51.984 -13.952 -16.100 1.00 18.96 N ATOM 594 CA GLY A 75 51.560 -15.237 -16.673 1.00 19.37 C ATOM 595 C GLY A 75 50.518 -15.081 -17.766 1.00 19.10 C ATOM 596 O GLY A 75 50.453 -14.040 -18.410 1.00 18.68 O ATOM 597 H GLY A 75 51.584 -13.656 -15.187 1.00 0.00 H ATOM 598 N ARG A 76 49.715 -16.123 -17.978 1.00 19.19 N ATOM 599 CA ARG A 76 48.764 -16.172 -19.096 1.00 18.92 C ATOM 600 C ARG A 76 47.532 -15.339 -18.854 1.00 18.78 C ATOM 601 O ARG A 76 46.805 -15.006 -19.794 1.00 18.12 O ATOM 602 CB ARG A 76 48.306 -17.606 -19.356 1.00 19.23 C ATOM 603 CG ARG A 76 49.347 -18.486 -20.030 1.00 20.88 C ATOM 604 CD ARG A 76 48.867 -19.950 -19.971 1.00 22.70 C ATOM 605 NE ARG A 76 48.921 -20.476 -18.605 1.00 21.45 N ATOM 606 CZ ARG A 76 48.721 -21.759 -18.289 1.00 23.52 C ATOM 607 NH1 ARG A 76 48.455 -22.648 -19.247 1.00 20.86 N ATOM 608 NH2 ARG A 76 48.804 -22.164 -17.023 1.00 19.75 N ATOM 609 HE ARG A 76 49.128 -19.810 -17.833 1.00 0.00 H ATOM 610 HH12 ARG A 76 48.299 -23.646 -19.001 1.00 0.00 H ATOM 611 HH11 ARG A 76 48.403 -22.343 -20.240 1.00 0.00 H ATOM 612 HH22 ARG A 76 48.647 -23.164 -16.786 1.00 0.00 H ATOM 613 HH21 ARG A 76 49.026 -21.480 -16.272 1.00 0.00 H ATOM 614 H ARG A 76 49.764 -16.932 -17.327 1.00 0.00 H ATOM 615 N GLY A 77 47.284 -15.038 -17.583 1.00 18.26 N ATOM 616 CA GLY A 77 46.095 -14.331 -17.190 1.00 18.70 C ATOM 617 C GLY A 77 45.053 -15.373 -16.871 1.00 18.90 C ATOM 618 O GLY A 77 44.972 -16.419 -17.534 1.00 18.25 O ATOM 619 H GLY A 77 47.968 -15.322 -16.853 1.00 0.00 H ATOM 620 N ILE A 78 44.275 -15.101 -15.836 1.00 19.15 N ATOM 621 CA ILE A 78 43.140 -15.947 -15.468 1.00 19.77 C ATOM 622 C ILE A 78 42.167 -15.909 -16.637 1.00 21.20 C ATOM 623 O ILE A 78 41.981 -14.848 -17.247 1.00 21.83 O ATOM 624 CB ILE A 78 42.509 -15.461 -14.127 1.00 18.80 C ATOM 625 CG1 ILE A 78 43.393 -15.890 -12.936 1.00 17.78 C ATOM 626 CG2 ILE A 78 41.083 -15.980 -13.932 1.00 19.73 C ATOM 627 CD1 ILE A 78 42.871 -15.431 -11.544 1.00 14.07 C ATOM 628 H ILE A 78 44.478 -14.256 -15.264 1.00 0.00 H ATOM 629 N PRO A 79 41.556 -17.060 -16.986 1.00 22.33 N ATOM 630 CA PRO A 79 40.669 -17.059 -18.162 1.00 22.49 C ATOM 631 C PRO A 79 39.456 -16.143 -17.982 1.00 23.60 C ATOM 632 O PRO A 79 38.970 -15.964 -16.866 1.00 23.14 O ATOM 633 CB PRO A 79 40.236 -18.530 -18.299 1.00 23.46 C ATOM 634 CG PRO A 79 40.691 -19.225 -17.055 1.00 22.30 C ATOM 635 CD PRO A 79 41.759 -18.409 -16.416 1.00 22.42 C ATOM 636 N THR A 80 38.988 -15.560 -19.081 1.00 24.80 N ATOM 637 CA THR A 80 37.991 -14.494 -19.042 1.00 26.83 C ATOM 638 C THR A 80 36.710 -14.909 -19.759 1.00 28.20 C ATOM 639 O THR A 80 35.734 -14.156 -19.789 1.00 28.78 O ATOM 640 CB THR A 80 38.533 -13.209 -19.726 1.00 26.94 C ATOM 641 OG1 THR A 80 38.985 -13.536 -21.045 1.00 29.40 O ATOM 642 CG2 THR A 80 39.715 -12.629 -18.960 1.00 26.31 C ATOM 643 HG1 THR A 80 38.229 -13.901 -21.571 1.00 0.00 H ATOM 644 H THR A 80 39.346 -15.876 -20.005 1.00 0.00 H ATOM 645 N GLY A 81 36.712 -16.108 -20.329 1.00 29.35 N ATOM 646 CA GLY A 81 35.589 -16.596 -21.120 1.00 31.70 C ATOM 647 C GLY A 81 34.282 -16.728 -20.365 1.00 32.88 C ATOM 648 O GLY A 81 34.274 -16.958 -19.167 1.00 32.15 O ATOM 649 H GLY A 81 37.544 -16.720 -20.207 1.00 0.00 H ATOM 650 N ILE A 82 33.175 -16.576 -21.083 1.00 35.23 N ATOM 651 CA ILE A 82 31.853 -16.727 -20.486 1.00 37.98 C ATOM 652 C ILE A 82 31.141 -17.985 -20.980 1.00 39.71 C ATOM 653 O ILE A 82 31.266 -18.384 -22.146 1.00 39.51 O ATOM 654 CB ILE A 82 30.940 -15.479 -20.697 1.00 37.89 C ATOM 655 CG1 ILE A 82 30.508 -15.343 -22.165 1.00 39.52 C ATOM 656 CG2 ILE A 82 31.632 -14.205 -20.181 1.00 38.64 C ATOM 657 CD1 ILE A 82 29.107 -14.721 -22.353 1.00 42.53 C ATOM 658 H ILE A 82 33.253 -16.344 -22.094 1.00 0.00 H ATOM 659 N HIS A 83 30.421 -18.622 -20.064 1.00 42.42 N ATOM 660 CA HIS A 83 29.509 -19.692 -20.426 1.00 44.85 C ATOM 661 C HIS A 83 28.335 -19.028 -21.113 1.00 46.22 C ATOM 662 O HIS A 83 27.654 -18.207 -20.500 1.00 46.67 O ATOM 663 CB HIS A 83 29.031 -20.431 -19.183 1.00 45.10 C ATOM 664 CG HIS A 83 28.233 -21.659 -19.485 1.00 46.36 C ATOM 665 ND1 HIS A 83 28.774 -22.927 -19.433 1.00 47.76 N ATOM 666 CD2 HIS A 83 26.938 -21.816 -19.845 1.00 47.17 C ATOM 667 CE1 HIS A 83 27.844 -23.811 -19.743 1.00 47.77 C ATOM 668 NE2 HIS A 83 26.720 -23.164 -19.995 1.00 48.35 N ATOM 669 H HIS A 83 30.512 -18.348 -19.065 1.00 0.00 H ATOM 670 N PRO A 84 28.106 -19.354 -22.394 1.00 47.69 N ATOM 671 CA PRO A 84 27.032 -18.704 -23.149 1.00 48.83 C ATOM 672 C PRO A 84 25.645 -18.742 -22.477 1.00 49.79 C ATOM 673 O PRO A 84 25.018 -17.688 -22.318 1.00 50.10 O ATOM 674 CB PRO A 84 27.050 -19.460 -24.484 1.00 49.09 C ATOM 675 CG PRO A 84 28.511 -19.820 -24.650 1.00 48.47 C ATOM 676 CD PRO A 84 28.923 -20.229 -23.259 1.00 47.75 C ATOM 677 N GLU A 85 25.184 -19.921 -22.062 1.00 50.85 N ATOM 678 CA GLU A 85 23.849 -20.033 -21.448 1.00 51.68 C ATOM 679 C GLU A 85 23.761 -19.598 -19.966 1.00 51.56 C ATOM 680 O GLU A 85 22.664 -19.322 -19.463 1.00 51.89 O ATOM 681 CB GLU A 85 23.186 -21.411 -21.709 1.00 52.19 C ATOM 682 CG GLU A 85 24.085 -22.656 -21.615 1.00 54.22 C ATOM 683 CD GLU A 85 24.600 -23.151 -22.972 1.00 57.00 C ATOM 684 OE1 GLU A 85 24.587 -24.386 -23.215 1.00 57.71 O ATOM 685 OE2 GLU A 85 25.021 -22.312 -23.800 1.00 58.33 O ATOM 686 H GLU A 85 25.772 -20.771 -22.173 1.00 0.00 H ATOM 687 N GLU A 86 24.907 -19.497 -19.289 1.00 51.06 N ATOM 688 CA GLU A 86 24.947 -19.091 -17.879 1.00 50.44 C ATOM 689 C GLU A 86 25.317 -17.631 -17.646 1.00 49.62 C ATOM 690 O GLU A 86 24.921 -17.050 -16.635 1.00 49.91 O ATOM 691 CB GLU A 86 25.918 -19.969 -17.097 1.00 50.77 C ATOM 692 CG GLU A 86 25.290 -21.226 -16.544 1.00 52.54 C ATOM 693 CD GLU A 86 26.261 -22.392 -16.497 1.00 55.22 C ATOM 694 OE1 GLU A 86 25.787 -23.553 -16.455 1.00 56.62 O ATOM 695 OE2 GLU A 86 27.492 -22.153 -16.505 1.00 55.53 O ATOM 696 H GLU A 86 25.800 -19.713 -19.776 1.00 0.00 H ATOM 697 N GLY A 87 26.096 -17.052 -18.559 1.00 48.31 N ATOM 698 CA GLY A 87 26.603 -15.683 -18.397 1.00 46.28 C ATOM 699 C GLY A 87 27.859 -15.537 -17.535 1.00 44.74 C ATOM 700 O GLY A 87 28.733 -14.730 -17.854 1.00 45.23 O ATOM 701 H GLY A 87 26.353 -17.586 -19.413 1.00 0.00 H ATOM 702 N VAL A 88 27.955 -16.317 -16.456 1.00 42.65 N ATOM 703 CA VAL A 88 29.032 -16.186 -15.462 1.00 39.78 C ATOM 704 C VAL A 88 30.414 -16.565 -16.011 1.00 37.53 C ATOM 705 O VAL A 88 30.622 -17.684 -16.485 1.00 37.05 O ATOM 706 CB VAL A 88 28.727 -17.029 -14.215 1.00 40.29 C ATOM 707 CG1 VAL A 88 29.826 -16.862 -13.154 1.00 39.70 C ATOM 708 CG2 VAL A 88 27.350 -16.642 -13.641 1.00 40.93 C ATOM 709 H VAL A 88 27.234 -17.052 -16.311 1.00 0.00 H ATOM 710 N SER A 89 31.349 -15.617 -15.919 1.00 34.39 N ATOM 711 CA SER A 89 32.690 -15.757 -16.472 1.00 31.27 C ATOM 712 C SER A 89 33.540 -16.789 -15.737 1.00 29.44 C ATOM 713 O SER A 89 33.336 -17.056 -14.556 1.00 29.29 O ATOM 714 CB SER A 89 33.414 -14.409 -16.477 1.00 31.20 C ATOM 715 OG SER A 89 33.954 -14.107 -15.205 1.00 30.27 O ATOM 716 HG SER A 89 33.223 -14.069 -14.538 1.00 0.00 H ATOM 717 H SER A 89 31.108 -14.733 -15.427 1.00 0.00 H ATOM 718 N ALA A 90 34.509 -17.346 -16.445 1.00 26.90 N ATOM 719 CA ALA A 90 35.453 -18.268 -15.835 1.00 26.06 C ATOM 720 C ALA A 90 36.152 -17.624 -14.624 1.00 25.05 C ATOM 721 O ALA A 90 36.260 -18.242 -13.571 1.00 25.16 O ATOM 722 CB ALA A 90 36.465 -18.753 -16.863 1.00 24.77 C ATOM 723 H ALA A 90 34.597 -17.120 -17.456 1.00 0.00 H ATOM 724 N ALA A 91 36.616 -16.390 -14.786 1.00 24.56 N ATOM 725 CA ALA A 91 37.302 -15.671 -13.705 1.00 24.58 C ATOM 726 C ALA A 91 36.436 -15.657 -12.450 1.00 24.33 C ATOM 727 O ALA A 91 36.914 -15.966 -11.356 1.00 24.55 O ATOM 728 CB ALA A 91 37.664 -14.257 -14.138 1.00 23.67 C ATOM 729 H ALA A 91 36.490 -15.920 -15.705 1.00 0.00 H ATOM 730 N GLU A 92 35.154 -15.362 -12.624 1.00 24.38 N ATOM 731 CA GLU A 92 34.229 -15.287 -11.495 1.00 24.91 C ATOM 732 C GLU A 92 34.087 -16.626 -10.766 1.00 24.82 C ATOM 733 O GLU A 92 34.072 -16.672 -9.530 1.00 24.87 O ATOM 734 CB GLU A 92 32.870 -14.744 -11.942 1.00 24.68 C ATOM 735 CG GLU A 92 31.892 -14.542 -10.807 1.00 25.63 C ATOM 736 CD GLU A 92 30.658 -13.773 -11.221 1.00 27.74 C ATOM 737 OE1 GLU A 92 30.775 -12.817 -12.015 1.00 28.42 O ATOM 738 OE2 GLU A 92 29.560 -14.122 -10.742 1.00 29.54 O ATOM 739 H GLU A 92 34.800 -15.180 -13.585 1.00 0.00 H ATOM 740 N VAL A 93 34.021 -17.711 -11.529 1.00 24.46 N ATOM 741 CA VAL A 93 33.910 -19.037 -10.940 1.00 24.75 C ATOM 742 C VAL A 93 35.133 -19.313 -10.059 1.00 24.60 C ATOM 743 O VAL A 93 34.995 -19.746 -8.913 1.00 24.53 O ATOM 744 CB VAL A 93 33.708 -20.149 -12.016 1.00 24.60 C ATOM 745 CG1 VAL A 93 33.798 -21.547 -11.385 1.00 26.31 C ATOM 746 CG2 VAL A 93 32.368 -19.973 -12.718 1.00 24.24 C ATOM 747 H VAL A 93 34.049 -17.611 -12.564 1.00 0.00 H ATOM 748 N ILE A 94 36.320 -19.023 -10.587 1.00 24.11 N ATOM 749 CA ILE A 94 37.553 -19.235 -9.834 1.00 24.02 C ATOM 750 C ILE A 94 37.595 -18.413 -8.529 1.00 24.37 C ATOM 751 O ILE A 94 38.056 -18.898 -7.499 1.00 23.89 O ATOM 752 CB ILE A 94 38.778 -18.929 -10.693 1.00 23.98 C ATOM 753 CG1 ILE A 94 38.878 -19.967 -11.831 1.00 24.59 C ATOM 754 CG2 ILE A 94 40.024 -18.903 -9.827 1.00 23.78 C ATOM 755 CD1 ILE A 94 39.808 -19.574 -12.976 1.00 24.78 C ATOM 756 H ILE A 94 36.370 -18.639 -11.552 1.00 0.00 H ATOM 757 N MET A 95 37.105 -17.179 -8.584 1.00 24.59 N ATOM 758 CA MET A 95 37.168 -16.282 -7.431 1.00 25.57 C ATOM 759 C MET A 95 36.104 -16.590 -6.365 1.00 26.17 C ATOM 760 O MET A 95 36.204 -16.118 -5.238 1.00 26.66 O ATOM 761 CB MET A 95 37.040 -14.811 -7.877 1.00 24.73 C ATOM 762 CG MET A 95 38.120 -14.326 -8.839 1.00 24.90 C ATOM 763 SD MET A 95 39.843 -14.498 -8.305 1.00 26.02 S ATOM 764 CE MET A 95 39.741 -13.564 -6.802 1.00 25.49 C ATOM 765 H MET A 95 36.667 -16.844 -9.466 1.00 0.00 H ATOM 766 N THR A 96 35.079 -17.358 -6.717 1.00 27.51 N ATOM 767 CA THR A 96 33.921 -17.505 -5.827 1.00 28.46 C ATOM 768 C THR A 96 33.675 -18.919 -5.305 1.00 29.59 C ATOM 769 O THR A 96 33.069 -19.093 -4.241 1.00 29.42 O ATOM 770 CB THR A 96 32.613 -16.947 -6.468 1.00 28.31 C ATOM 771 OG1 THR A 96 32.362 -17.608 -7.716 1.00 27.75 O ATOM 772 CG2 THR A 96 32.723 -15.443 -6.710 1.00 28.22 C ATOM 773 HG1 THR A 96 33.122 -17.449 -8.331 1.00 0.00 H ATOM 774 H THR A 96 35.097 -17.858 -7.629 1.00 0.00 H ATOM 775 N VAL A 97 34.145 -19.922 -6.044 1.00 30.83 N ATOM 776 CA VAL A 97 33.845 -21.327 -5.742 1.00 31.53 C ATOM 777 C VAL A 97 34.932 -21.939 -4.868 1.00 32.53 C ATOM 778 O VAL A 97 36.125 -21.706 -5.094 1.00 31.92 O ATOM 779 CB VAL A 97 33.641 -22.133 -7.063 1.00 32.11 C ATOM 780 CG1 VAL A 97 33.537 -23.644 -6.815 1.00 31.41 C ATOM 781 CG2 VAL A 97 32.396 -21.616 -7.801 1.00 31.28 C ATOM 782 H VAL A 97 34.746 -19.702 -6.864 1.00 0.00 H ATOM 783 N LEU A 98 34.516 -22.712 -3.862 1.00 33.60 N ATOM 784 CA LEU A 98 35.444 -23.286 -2.881 1.00 34.66 C ATOM 785 C LEU A 98 36.022 -24.605 -3.342 1.00 34.97 C ATOM 786 O LEU A 98 35.334 -25.383 -3.992 1.00 35.76 O ATOM 787 CB LEU A 98 34.742 -23.504 -1.550 1.00 34.90 C ATOM 788 CG LEU A 98 34.427 -22.279 -0.689 1.00 36.31 C ATOM 789 CD1 LEU A 98 33.786 -22.751 0.606 1.00 37.95 C ATOM 790 CD2 LEU A 98 35.677 -21.463 -0.395 1.00 35.81 C ATOM 791 H LEU A 98 33.500 -22.914 -3.771 1.00 0.00 H TER 792 LEU A 98 ATOM 793 N VAL A 118 44.013 -23.507 0.489 1.00 34.13 N ATOM 794 CA VAL A 118 42.570 -23.261 0.619 1.00 33.80 C ATOM 795 C VAL A 118 41.966 -22.534 -0.596 1.00 33.33 C ATOM 796 O VAL A 118 40.793 -22.726 -0.895 1.00 33.41 O ATOM 797 CB VAL A 118 42.189 -22.521 1.951 1.00 34.38 C ATOM 798 CG1 VAL A 118 42.463 -23.416 3.166 1.00 35.35 C ATOM 799 CG2 VAL A 118 42.916 -21.183 2.093 1.00 33.97 C ATOM 800 HN3 VAL A 118 44.510 -22.599 0.387 1.00 0.00 H ATOM 801 HN2 VAL A 118 44.189 -24.097 -0.350 1.00 0.00 H ATOM 802 HN1 VAL A 118 44.358 -23.999 1.338 1.00 0.00 H ATOM 803 N GLY A 119 42.764 -21.712 -1.283 1.00 32.43 N ATOM 804 CA GLY A 119 42.352 -21.096 -2.554 1.00 31.16 C ATOM 805 C GLY A 119 41.934 -19.636 -2.463 1.00 29.77 C ATOM 806 O GLY A 119 41.524 -19.193 -1.389 1.00 29.95 O ATOM 807 H GLY A 119 43.710 -21.500 -0.906 1.00 0.00 H ATOM 808 N VAL A 120 42.007 -18.897 -3.582 1.00 27.91 N ATOM 809 CA VAL A 120 41.618 -17.460 -3.573 1.00 26.07 C ATOM 810 C VAL A 120 40.190 -17.187 -3.165 1.00 24.44 C ATOM 811 O VAL A 120 39.900 -16.100 -2.697 1.00 23.37 O ATOM 812 CB VAL A 120 41.742 -16.697 -4.935 1.00 26.50 C ATOM 813 CG1 VAL A 120 42.998 -15.876 -5.015 1.00 26.05 C ATOM 814 CG2 VAL A 120 41.494 -17.577 -6.149 1.00 26.25 C ATOM 815 H VAL A 120 42.339 -19.334 -4.465 1.00 0.00 H ATOM 816 N SER A 121 39.285 -18.133 -3.395 1.00 23.30 N ATOM 817 CA SER A 121 37.892 -17.892 -3.048 1.00 22.92 C ATOM 818 C SER A 121 37.768 -17.600 -1.557 1.00 22.14 C ATOM 819 O SER A 121 36.911 -16.829 -1.151 1.00 21.56 O ATOM 820 CB SER A 121 37.000 -19.070 -3.440 1.00 22.85 C ATOM 821 OG SER A 121 37.545 -20.280 -2.957 1.00 24.34 O ATOM 822 HG SER A 121 36.957 -21.033 -3.218 1.00 0.00 H ATOM 823 H SER A 121 39.570 -19.039 -3.820 1.00 0.00 H ATOM 824 N VAL A 122 38.633 -18.219 -0.761 1.00 21.97 N ATOM 825 CA VAL A 122 38.719 -17.973 0.692 1.00 22.64 C ATOM 826 C VAL A 122 39.239 -16.539 0.974 1.00 22.14 C ATOM 827 O VAL A 122 38.689 -15.808 1.814 1.00 22.81 O ATOM 828 CB VAL A 122 39.625 -19.044 1.382 1.00 22.48 C ATOM 829 CG1 VAL A 122 39.989 -18.655 2.822 1.00 23.26 C ATOM 830 CG2 VAL A 122 38.936 -20.430 1.354 1.00 24.02 C ATOM 831 H VAL A 122 39.283 -18.912 -1.183 1.00 0.00 H ATOM 832 N VAL A 123 40.299 -16.141 0.285 1.00 21.38 N ATOM 833 CA VAL A 123 40.795 -14.764 0.399 1.00 20.79 C ATOM 834 C VAL A 123 39.704 -13.750 0.039 1.00 20.69 C ATOM 835 O VAL A 123 39.451 -12.796 0.790 1.00 20.60 O ATOM 836 CB VAL A 123 42.057 -14.573 -0.445 1.00 21.50 C ATOM 837 CG1 VAL A 123 42.598 -13.140 -0.299 1.00 20.33 C ATOM 838 CG2 VAL A 123 43.102 -15.626 -0.016 1.00 19.13 C ATOM 839 H VAL A 123 40.785 -16.812 -0.344 1.00 0.00 H ATOM 840 N ASN A 124 39.028 -13.990 -1.079 1.00 19.79 N ATOM 841 CA ASN A 124 37.892 -13.171 -1.504 1.00 19.76 C ATOM 842 C ASN A 124 36.793 -13.058 -0.423 1.00 19.32 C ATOM 843 O ASN A 124 36.319 -11.957 -0.089 1.00 19.24 O ATOM 844 CB ASN A 124 37.318 -13.757 -2.797 1.00 19.12 C ATOM 845 CG ASN A 124 36.570 -12.731 -3.641 1.00 20.25 C ATOM 846 OD1 ASN A 124 36.530 -11.540 -3.325 1.00 19.01 O ATOM 847 ND2 ASN A 124 35.953 -13.204 -4.724 1.00 21.15 N ATOM 848 HD22 ASN A 124 36.012 -14.216 -4.955 1.00 0.00 H ATOM 849 HD21 ASN A 124 35.413 -12.561 -5.337 1.00 0.00 H ATOM 850 H ASN A 124 39.317 -14.791 -1.676 1.00 0.00 H ATOM 851 N ALA A 125 36.391 -14.200 0.122 1.00 18.95 N ATOM 852 CA ALA A 125 35.352 -14.238 1.154 1.00 18.85 C ATOM 853 C ALA A 125 35.722 -13.372 2.364 1.00 18.27 C ATOM 854 O ALA A 125 34.876 -12.703 2.938 1.00 17.79 O ATOM 855 CB ALA A 125 35.081 -15.707 1.588 1.00 19.11 C ATOM 856 H ALA A 125 36.825 -15.091 -0.192 1.00 0.00 H ATOM 857 N LEU A 126 37.000 -13.378 2.726 1.00 18.32 N ATOM 858 CA LEU A 126 37.472 -12.626 3.880 1.00 19.22 C ATOM 859 C LEU A 126 38.068 -11.261 3.525 1.00 19.57 C ATOM 860 O LEU A 126 38.768 -10.651 4.351 1.00 20.29 O ATOM 861 CB LEU A 126 38.460 -13.474 4.689 1.00 18.85 C ATOM 862 CG LEU A 126 37.885 -14.864 4.986 1.00 20.34 C ATOM 863 CD1 LEU A 126 38.926 -15.811 5.593 1.00 19.55 C ATOM 864 CD2 LEU A 126 36.632 -14.729 5.863 1.00 20.37 C ATOM 865 H LEU A 126 37.681 -13.934 2.171 1.00 0.00 H ATOM 866 N SER A 127 37.791 -10.787 2.306 1.00 19.11 N ATOM 867 CA SER A 127 38.219 -9.456 1.893 1.00 19.33 C ATOM 868 C SER A 127 37.043 -8.494 1.845 1.00 19.15 C ATOM 869 O SER A 127 36.030 -8.783 1.210 1.00 19.26 O ATOM 870 CB SER A 127 38.909 -9.509 0.536 1.00 18.81 C ATOM 871 OG SER A 127 40.218 -10.009 0.680 1.00 20.86 O ATOM 872 HG SER A 127 40.181 -10.921 1.063 1.00 0.00 H ATOM 873 H SER A 127 37.259 -11.380 1.638 1.00 0.00 H ATOM 874 N GLN A 128 37.171 -7.373 2.554 1.00 19.20 N ATOM 875 CA GLN A 128 36.207 -6.267 2.490 1.00 19.60 C ATOM 876 C GLN A 128 36.017 -5.857 1.026 1.00 18.91 C ATOM 877 O GLN A 128 34.902 -5.620 0.574 1.00 18.48 O ATOM 878 CB GLN A 128 36.754 -5.097 3.321 1.00 20.76 C ATOM 879 CG GLN A 128 36.017 -3.764 3.178 1.00 26.37 C ATOM 880 CD GLN A 128 36.711 -2.620 3.927 1.00 33.12 C ATOM 881 OE1 GLN A 128 36.049 -1.716 4.438 1.00 39.75 O ATOM 882 NE2 GLN A 128 38.042 -2.655 3.998 1.00 35.77 N ATOM 883 HE22 GLN A 128 38.566 -3.436 3.553 1.00 0.00 H ATOM 884 HE21 GLN A 128 38.556 -1.902 4.498 1.00 0.00 H ATOM 885 H GLN A 128 37.993 -7.277 3.183 1.00 0.00 H ATOM 886 N LYS A 129 37.127 -5.822 0.282 1.00 18.16 N ATOM 887 CA LYS A 129 37.098 -5.562 -1.155 1.00 17.51 C ATOM 888 C LYS A 129 38.234 -6.337 -1.812 1.00 15.70 C ATOM 889 O LYS A 129 39.319 -6.464 -1.246 1.00 15.90 O ATOM 890 CB LYS A 129 37.279 -4.062 -1.411 1.00 18.03 C ATOM 891 CG LYS A 129 37.162 -3.624 -2.868 1.00 20.35 C ATOM 892 CD LYS A 129 37.156 -2.081 -2.931 1.00 25.98 C ATOM 893 CE LYS A 129 37.606 -1.588 -4.303 1.00 29.89 C ATOM 894 NZ LYS A 129 37.905 -0.123 -4.320 1.00 32.90 N ATOM 895 HZ1 LYS A 129 37.050 0.407 -4.055 1.00 0.00 H ATOM 896 HZ2 LYS A 129 38.666 0.082 -3.642 1.00 0.00 H ATOM 897 HZ3 LYS A 129 38.206 0.157 -5.275 1.00 0.00 H ATOM 898 H LYS A 129 38.045 -5.986 0.743 1.00 0.00 H ATOM 899 N LEU A 130 37.983 -6.864 -2.994 1.00 13.74 N ATOM 900 CA LEU A 130 39.047 -7.495 -3.751 1.00 13.55 C ATOM 901 C LEU A 130 38.910 -7.075 -5.209 1.00 13.38 C ATOM 902 O LEU A 130 37.813 -7.024 -5.755 1.00 13.60 O ATOM 903 CB LEU A 130 39.040 -9.032 -3.560 1.00 13.17 C ATOM 904 CG LEU A 130 40.073 -9.883 -4.312 1.00 13.52 C ATOM 905 CD1 LEU A 130 40.425 -11.212 -3.601 1.00 12.57 C ATOM 906 CD2 LEU A 130 39.580 -10.162 -5.733 1.00 11.18 C ATOM 907 H LEU A 130 37.020 -6.827 -3.385 1.00 0.00 H ATOM 908 N GLU A 131 40.033 -6.733 -5.817 1.00 13.63 N ATOM 909 CA GLU A 131 40.040 -6.287 -7.210 1.00 13.28 C ATOM 910 C GLU A 131 40.863 -7.255 -8.036 1.00 12.41 C ATOM 911 O GLU A 131 41.974 -7.596 -7.689 1.00 11.83 O ATOM 912 CB GLU A 131 40.622 -4.880 -7.303 1.00 13.45 C ATOM 913 CG GLU A 131 40.935 -4.416 -8.701 1.00 13.42 C ATOM 914 CD GLU A 131 41.741 -3.122 -8.678 1.00 16.92 C ATOM 915 OE1 GLU A 131 42.431 -2.906 -7.672 1.00 17.07 O ATOM 916 OE2 GLU A 131 41.684 -2.335 -9.645 1.00 15.12 O ATOM 917 H GLU A 131 40.930 -6.782 -5.294 1.00 0.00 H ATOM 918 N LEU A 132 40.290 -7.699 -9.130 1.00 12.55 N ATOM 919 CA LEU A 132 40.973 -8.629 -10.011 1.00 12.56 C ATOM 920 C LEU A 132 41.184 -7.890 -11.319 1.00 12.57 C ATOM 921 O LEU A 132 40.216 -7.390 -11.894 1.00 11.65 O ATOM 922 CB LEU A 132 40.042 -9.819 -10.275 1.00 12.37 C ATOM 923 CG LEU A 132 40.412 -10.786 -11.400 1.00 12.89 C ATOM 924 CD1 LEU A 132 41.786 -11.415 -11.160 1.00 11.96 C ATOM 925 CD2 LEU A 132 39.314 -11.857 -11.499 1.00 12.52 C ATOM 926 H LEU A 132 39.330 -7.379 -9.370 1.00 0.00 H ATOM 927 N VAL A 133 42.424 -7.826 -11.786 1.00 12.23 N ATOM 928 CA VAL A 133 42.666 -7.275 -13.112 1.00 12.89 C ATOM 929 C VAL A 133 43.484 -8.261 -13.931 1.00 13.17 C ATOM 930 O VAL A 133 44.545 -8.714 -13.489 1.00 14.10 O ATOM 931 CB VAL A 133 43.354 -5.867 -13.053 1.00 12.52 C ATOM 932 CG1 VAL A 133 43.651 -5.359 -14.454 1.00 12.52 C ATOM 933 CG2 VAL A 133 42.461 -4.887 -12.302 1.00 12.09 C ATOM 934 H VAL A 133 43.219 -8.167 -11.208 1.00 0.00 H ATOM 935 N ILE A 134 42.988 -8.562 -15.133 1.00 13.04 N ATOM 936 CA ILE A 134 43.576 -9.566 -16.004 1.00 13.39 C ATOM 937 C ILE A 134 43.948 -8.913 -17.329 1.00 13.66 C ATOM 938 O ILE A 134 43.119 -8.257 -17.951 1.00 14.63 O ATOM 939 CB ILE A 134 42.554 -10.743 -16.292 1.00 13.81 C ATOM 940 CG1 ILE A 134 42.172 -11.487 -15.003 1.00 13.40 C ATOM 941 CG2 ILE A 134 43.122 -11.726 -17.310 1.00 13.06 C ATOM 942 CD1 ILE A 134 40.791 -12.201 -15.073 1.00 14.62 C ATOM 943 H ILE A 134 42.142 -8.055 -15.462 1.00 0.00 H ATOM 944 N GLN A 135 45.180 -9.134 -17.763 1.00 14.32 N ATOM 945 CA GLN A 135 45.634 -8.742 -19.102 1.00 15.98 C ATOM 946 C GLN A 135 45.759 -10.032 -19.901 1.00 15.86 C ATOM 947 O GLN A 135 46.537 -10.913 -19.540 1.00 15.27 O ATOM 948 CB GLN A 135 46.990 -8.041 -19.012 1.00 15.19 C ATOM 949 CG GLN A 135 46.924 -6.775 -18.183 1.00 19.40 C ATOM 950 CD GLN A 135 48.271 -6.144 -18.004 1.00 23.74 C ATOM 951 OE1 GLN A 135 48.596 -5.184 -18.679 1.00 31.49 O ATOM 952 NE2 GLN A 135 49.076 -6.696 -17.122 1.00 23.69 N ATOM 953 HE22 GLN A 135 48.756 -7.515 -16.567 1.00 0.00 H ATOM 954 HE21 GLN A 135 50.032 -6.313 -16.980 1.00 0.00 H ATOM 955 H GLN A 135 45.854 -9.606 -17.127 1.00 0.00 H ATOM 956 N ARG A 136 44.981 -10.134 -20.975 1.00 16.94 N ATOM 957 CA ARG A 136 44.804 -11.386 -21.712 1.00 17.47 C ATOM 958 C ARG A 136 44.143 -11.091 -23.043 1.00 17.60 C ATOM 959 O ARG A 136 43.147 -10.370 -23.101 1.00 16.78 O ATOM 960 CB ARG A 136 43.873 -12.309 -20.917 1.00 18.41 C ATOM 961 CG ARG A 136 43.651 -13.671 -21.537 1.00 20.58 C ATOM 962 CD ARG A 136 43.041 -14.642 -20.528 1.00 23.63 C ATOM 963 NE ARG A 136 42.684 -15.866 -21.224 1.00 25.20 N ATOM 964 CZ ARG A 136 43.544 -16.833 -21.507 1.00 25.95 C ATOM 965 NH1 ARG A 136 44.811 -16.750 -21.121 1.00 25.04 N ATOM 966 NH2 ARG A 136 43.119 -17.901 -22.164 1.00 29.40 N ATOM 967 HE ARG A 136 41.694 -15.991 -21.518 1.00 0.00 H ATOM 968 HH12 ARG A 136 45.476 -17.516 -21.350 1.00 0.00 H ATOM 969 HH11 ARG A 136 45.139 -15.918 -20.590 1.00 0.00 H ATOM 970 HH22 ARG A 136 43.782 -18.668 -22.393 1.00 0.00 H ATOM 971 HH21 ARG A 136 42.122 -17.972 -22.451 1.00 0.00 H ATOM 972 H ARG A 136 44.476 -9.287 -21.306 1.00 0.00 H ATOM 973 N GLU A 137 44.685 -11.672 -24.109 1.00 18.25 N ATOM 974 CA GLU A 137 44.106 -11.533 -25.445 1.00 19.59 C ATOM 975 C GLU A 137 43.915 -10.079 -25.947 1.00 18.36 C ATOM 976 O GLU A 137 42.972 -9.772 -26.672 1.00 18.80 O ATOM 977 CB GLU A 137 42.828 -12.373 -25.526 1.00 19.55 C ATOM 978 CG GLU A 137 43.208 -13.883 -25.539 1.00 26.99 C ATOM 979 CD GLU A 137 42.036 -14.832 -25.370 1.00 31.49 C ATOM 980 OE1 GLU A 137 40.875 -14.376 -25.375 1.00 34.54 O ATOM 981 OE2 GLU A 137 42.288 -16.048 -25.241 1.00 35.51 O ATOM 982 H GLU A 137 45.546 -12.242 -23.989 1.00 0.00 H ATOM 983 N GLY A 138 44.828 -9.198 -25.555 1.00 18.76 N ATOM 984 CA GLY A 138 44.825 -7.803 -26.021 1.00 18.64 C ATOM 985 C GLY A 138 43.925 -6.845 -25.239 1.00 18.96 C ATOM 986 O GLY A 138 43.770 -5.679 -25.630 1.00 18.20 O ATOM 987 H GLY A 138 45.571 -9.505 -24.895 1.00 0.00 H ATOM 988 N LYS A 139 43.316 -7.324 -24.150 1.00 17.91 N ATOM 989 CA LYS A 139 42.377 -6.515 -23.372 1.00 18.08 C ATOM 990 C LYS A 139 42.727 -6.546 -21.875 1.00 18.23 C ATOM 991 O LYS A 139 43.347 -7.484 -21.386 1.00 17.63 O ATOM 992 CB LYS A 139 40.926 -7.007 -23.581 1.00 19.12 C ATOM 993 CG LYS A 139 40.381 -6.890 -25.028 1.00 22.37 C ATOM 994 CD LYS A 139 39.226 -7.861 -25.290 1.00 31.88 C ATOM 995 CE LYS A 139 38.760 -7.929 -26.793 1.00 35.69 C ATOM 996 NZ LYS A 139 39.884 -8.055 -27.816 1.00 38.20 N ATOM 997 HZ1 LYS A 139 40.516 -7.233 -27.738 1.00 0.00 H ATOM 998 HZ2 LYS A 139 40.422 -8.926 -27.632 1.00 0.00 H ATOM 999 HZ3 LYS A 139 39.478 -8.092 -28.773 1.00 0.00 H ATOM 1000 H LYS A 139 43.515 -8.299 -23.847 1.00 0.00 H ATOM 1001 N ILE A 140 42.348 -5.490 -21.166 1.00 18.28 N ATOM 1002 CA ILE A 140 42.432 -5.458 -19.717 1.00 17.53 C ATOM 1003 C ILE A 140 41.024 -5.737 -19.248 1.00 17.32 C ATOM 1004 O ILE A 140 40.086 -5.110 -19.727 1.00 17.32 O ATOM 1005 CB ILE A 140 42.942 -4.076 -19.160 1.00 17.30 C ATOM 1006 CG1 ILE A 140 44.289 -3.695 -19.794 1.00 16.40 C ATOM 1007 CG2 ILE A 140 43.023 -4.124 -17.629 1.00 15.97 C ATOM 1008 CD1 ILE A 140 44.769 -2.273 -19.482 1.00 18.43 C ATOM 1009 H ILE A 140 41.978 -4.656 -21.666 1.00 0.00 H ATOM 1010 N HIS A 141 40.873 -6.689 -18.329 1.00 16.70 N ATOM 1011 CA HIS A 141 39.558 -7.035 -17.778 1.00 16.50 C ATOM 1012 C HIS A 141 39.542 -6.813 -16.283 1.00 16.20 C ATOM 1013 O HIS A 141 40.513 -7.146 -15.624 1.00 15.99 O ATOM 1014 CB HIS A 141 39.264 -8.519 -18.018 1.00 16.50 C ATOM 1015 CG HIS A 141 39.419 -8.951 -19.445 1.00 18.88 C ATOM 1016 ND1 HIS A 141 38.340 -9.150 -20.286 1.00 23.29 N ATOM 1017 CD2 HIS A 141 40.519 -9.275 -20.164 1.00 21.01 C ATOM 1018 CE1 HIS A 141 38.772 -9.576 -21.460 1.00 21.45 C ATOM 1019 NE2 HIS A 141 40.089 -9.658 -21.413 1.00 22.62 N ATOM 1020 H HIS A 141 41.712 -7.202 -17.992 1.00 0.00 H ATOM 1021 N ARG A 142 38.444 -6.273 -15.740 1.00 15.73 N ATOM 1022 CA ARG A 142 38.399 -5.974 -14.318 1.00 15.90 C ATOM 1023 C ARG A 142 37.089 -6.407 -13.688 1.00 15.89 C ATOM 1024 O ARG A 142 36.016 -6.317 -14.311 1.00 15.93 O ATOM 1025 CB ARG A 142 38.657 -4.466 -14.069 1.00 15.55 C ATOM 1026 CG ARG A 142 38.772 -4.012 -12.588 1.00 16.37 C ATOM 1027 CD ARG A 142 39.224 -2.545 -12.516 1.00 14.96 C ATOM 1028 NE ARG A 142 39.421 -2.006 -11.161 1.00 14.58 N ATOM 1029 CZ ARG A 142 38.491 -1.318 -10.498 1.00 16.60 C ATOM 1030 NH1 ARG A 142 37.287 -1.112 -11.041 1.00 15.09 N ATOM 1031 NH2 ARG A 142 38.757 -0.822 -9.294 1.00 15.44 N ATOM 1032 HE ARG A 142 40.336 -2.171 -10.695 1.00 0.00 H ATOM 1033 HH12 ARG A 142 36.566 -0.575 -10.519 1.00 0.00 H ATOM 1034 HH11 ARG A 142 37.071 -1.489 -11.986 1.00 0.00 H ATOM 1035 HH22 ARG A 142 38.029 -0.286 -8.780 1.00 0.00 H ATOM 1036 HH21 ARG A 142 39.693 -0.970 -8.866 1.00 0.00 H ATOM 1037 H ARG A 142 37.619 -6.066 -16.338 1.00 0.00 H ATOM 1038 N GLN A 143 37.199 -6.898 -12.460 1.00 16.09 N ATOM 1039 CA GLN A 143 36.051 -7.215 -11.626 1.00 17.25 C ATOM 1040 C GLN A 143 36.356 -6.920 -10.169 1.00 17.87 C ATOM 1041 O GLN A 143 37.455 -7.183 -9.698 1.00 17.74 O ATOM 1042 CB GLN A 143 35.652 -8.687 -11.798 1.00 17.02 C ATOM 1043 CG GLN A 143 34.364 -9.055 -11.081 1.00 18.16 C ATOM 1044 CD GLN A 143 33.810 -10.387 -11.509 1.00 19.74 C ATOM 1045 OE1 GLN A 143 34.559 -11.336 -11.775 1.00 20.89 O ATOM 1046 NE2 GLN A 143 32.499 -10.472 -11.580 1.00 19.89 N ATOM 1047 HE22 GLN A 143 31.911 -9.647 -11.346 1.00 0.00 H ATOM 1048 HE21 GLN A 143 32.051 -11.365 -11.870 1.00 0.00 H ATOM 1049 H GLN A 143 38.151 -7.064 -12.076 1.00 0.00 H ATOM 1050 N ILE A 144 35.362 -6.362 -9.477 1.00 19.60 N ATOM 1051 CA ILE A 144 35.433 -5.981 -8.063 1.00 20.79 C ATOM 1052 C ILE A 144 34.498 -6.893 -7.270 1.00 21.59 C ATOM 1053 O ILE A 144 33.405 -7.232 -7.743 1.00 22.19 O ATOM 1054 CB ILE A 144 34.948 -4.504 -7.868 1.00 21.10 C ATOM 1055 CG1 ILE A 144 35.882 -3.512 -8.581 1.00 21.97 C ATOM 1056 CG2 ILE A 144 34.793 -4.131 -6.382 1.00 21.45 C ATOM 1057 CD1 ILE A 144 37.327 -3.725 -8.282 1.00 20.21 C ATOM 1058 H ILE A 144 34.469 -6.184 -9.978 1.00 0.00 H ATOM 1059 N TYR A 145 34.923 -7.274 -6.073 1.00 22.21 N ATOM 1060 CA TYR A 145 34.123 -8.077 -5.163 1.00 23.16 C ATOM 1061 C TYR A 145 34.103 -7.379 -3.813 1.00 23.81 C ATOM 1062 O TYR A 145 35.061 -6.685 -3.457 1.00 24.14 O ATOM 1063 CB TYR A 145 34.747 -9.478 -4.988 1.00 23.14 C ATOM 1064 CG TYR A 145 34.916 -10.274 -6.268 1.00 24.30 C ATOM 1065 CD1 TYR A 145 35.997 -10.049 -7.128 1.00 25.60 C ATOM 1066 CD2 TYR A 145 34.005 -11.278 -6.611 1.00 24.77 C ATOM 1067 CE1 TYR A 145 36.143 -10.793 -8.309 1.00 26.57 C ATOM 1068 CE2 TYR A 145 34.155 -12.024 -7.772 1.00 25.34 C ATOM 1069 CZ TYR A 145 35.205 -11.769 -8.610 1.00 27.55 C ATOM 1070 OH TYR A 145 35.318 -12.521 -9.747 1.00 32.95 O ATOM 1071 HH TYR A 145 34.509 -12.399 -10.304 1.00 0.00 H ATOM 1072 H TYR A 145 35.875 -6.984 -5.771 1.00 0.00 H ATOM 1073 N GLU A 146 33.013 -7.560 -3.069 1.00 24.36 N ATOM 1074 CA GLU A 146 32.947 -7.145 -1.661 1.00 25.67 C ATOM 1075 C GLU A 146 32.482 -8.335 -0.801 1.00 24.88 C ATOM 1076 O GLU A 146 31.417 -8.893 -1.052 1.00 24.29 O ATOM 1077 CB GLU A 146 32.014 -5.946 -1.494 1.00 25.99 C ATOM 1078 CG GLU A 146 32.523 -4.712 -2.222 1.00 30.71 C ATOM 1079 CD GLU A 146 31.743 -3.468 -1.865 1.00 36.07 C ATOM 1080 OE1 GLU A 146 31.096 -3.451 -0.789 1.00 37.18 O ATOM 1081 OE2 GLU A 146 31.789 -2.503 -2.659 1.00 38.48 O ATOM 1082 H GLU A 146 32.180 -8.010 -3.499 1.00 0.00 H ATOM 1083 N HIS A 147 33.298 -8.722 0.178 1.00 24.71 N ATOM 1084 CA HIS A 147 33.112 -9.977 0.927 1.00 25.38 C ATOM 1085 C HIS A 147 32.844 -11.167 0.000 1.00 25.72 C ATOM 1086 O HIS A 147 32.036 -12.043 0.310 1.00 25.95 O ATOM 1087 CB HIS A 147 31.998 -9.846 1.980 1.00 25.56 C ATOM 1088 CG HIS A 147 32.138 -8.639 2.853 1.00 24.95 C ATOM 1089 ND1 HIS A 147 33.140 -8.513 3.790 1.00 25.77 N ATOM 1090 CD2 HIS A 147 31.407 -7.503 2.926 1.00 25.43 C ATOM 1091 CE1 HIS A 147 33.028 -7.346 4.396 1.00 25.67 C ATOM 1092 NE2 HIS A 147 31.989 -6.710 3.886 1.00 25.75 N ATOM 1093 H HIS A 147 34.103 -8.111 0.425 1.00 0.00 H ATOM 1094 N GLY A 148 33.508 -11.178 -1.152 1.00 25.78 N ATOM 1095 CA GLY A 148 33.380 -12.280 -2.087 1.00 25.24 C ATOM 1096 C GLY A 148 32.216 -12.192 -3.052 1.00 25.38 C ATOM 1097 O GLY A 148 32.098 -13.031 -3.923 1.00 25.96 O ATOM 1098 H GLY A 148 34.132 -10.380 -1.388 1.00 0.00 H ATOM 1099 N VAL A 149 31.380 -11.166 -2.923 1.00 25.58 N ATOM 1100 CA VAL A 149 30.246 -10.961 -3.832 1.00 25.73 C ATOM 1101 C VAL A 149 30.640 -10.041 -5.001 1.00 26.14 C ATOM 1102 O VAL A 149 30.980 -8.883 -4.787 1.00 25.80 O ATOM 1103 CB VAL A 149 29.013 -10.344 -3.115 1.00 26.08 C ATOM 1104 CG1 VAL A 149 27.798 -10.262 -4.078 1.00 25.60 C ATOM 1105 CG2 VAL A 149 28.652 -11.126 -1.835 1.00 25.92 C ATOM 1106 H VAL A 149 31.535 -10.486 -2.152 1.00 0.00 H ATOM 1107 N PRO A 150 30.581 -10.557 -6.240 1.00 26.81 N ATOM 1108 CA PRO A 150 30.898 -9.735 -7.424 1.00 27.12 C ATOM 1109 C PRO A 150 29.972 -8.524 -7.501 1.00 27.66 C ATOM 1110 O PRO A 150 28.759 -8.654 -7.338 1.00 28.54 O ATOM 1111 CB PRO A 150 30.647 -10.681 -8.601 1.00 27.16 C ATOM 1112 CG PRO A 150 29.720 -11.781 -8.029 1.00 28.43 C ATOM 1113 CD PRO A 150 30.144 -11.924 -6.591 1.00 26.70 C ATOM 1114 N GLN A 151 30.535 -7.352 -7.734 1.00 27.53 N ATOM 1115 CA GLN A 151 29.732 -6.138 -7.759 1.00 27.65 C ATOM 1116 C GLN A 151 29.168 -5.848 -9.135 1.00 27.19 C ATOM 1117 O GLN A 151 28.177 -5.150 -9.266 1.00 27.71 O ATOM 1118 CB GLN A 151 30.540 -4.970 -7.215 1.00 27.91 C ATOM 1119 CG GLN A 151 30.925 -5.208 -5.748 1.00 28.94 C ATOM 1120 CD GLN A 151 29.706 -5.315 -4.845 1.00 28.94 C ATOM 1121 OE1 GLN A 151 29.454 -6.357 -4.246 1.00 29.76 O ATOM 1122 NE2 GLN A 151 28.938 -4.234 -4.753 1.00 28.39 N ATOM 1123 HE22 GLN A 151 29.189 -3.372 -5.278 1.00 0.00 H ATOM 1124 HE21 GLN A 151 28.086 -4.250 -4.156 1.00 0.00 H ATOM 1125 H GLN A 151 31.560 -7.296 -7.901 1.00 0.00 H ATOM 1126 N ALA A 152 29.796 -6.415 -10.151 1.00 26.71 N ATOM 1127 CA ALA A 152 29.348 -6.305 -11.535 1.00 26.74 C ATOM 1128 C ALA A 152 30.082 -7.394 -12.288 1.00 26.44 C ATOM 1129 O ALA A 152 31.038 -7.970 -11.757 1.00 26.73 O ATOM 1130 CB ALA A 152 29.685 -4.912 -12.127 1.00 26.26 C ATOM 1131 H ALA A 152 30.654 -6.968 -9.953 1.00 0.00 H ATOM 1132 N PRO A 153 29.646 -7.696 -13.517 1.00 26.22 N ATOM 1133 CA PRO A 153 30.358 -8.670 -14.346 1.00 25.50 C ATOM 1134 C PRO A 153 31.786 -8.243 -14.694 1.00 24.59 C ATOM 1135 O PRO A 153 32.107 -7.055 -14.633 1.00 24.42 O ATOM 1136 CB PRO A 153 29.490 -8.741 -15.620 1.00 25.85 C ATOM 1137 CG PRO A 153 28.097 -8.395 -15.114 1.00 27.07 C ATOM 1138 CD PRO A 153 28.387 -7.259 -14.153 1.00 27.08 C ATOM 1139 N LEU A 154 32.641 -9.217 -15.012 1.00 23.03 N ATOM 1140 CA LEU A 154 33.960 -8.945 -15.547 1.00 22.23 C ATOM 1141 C LEU A 154 33.804 -8.047 -16.769 1.00 21.83 C ATOM 1142 O LEU A 154 32.958 -8.304 -17.625 1.00 21.51 O ATOM 1143 CB LEU A 154 34.659 -10.249 -15.934 1.00 22.00 C ATOM 1144 CG LEU A 154 36.118 -10.204 -16.379 1.00 21.51 C ATOM 1145 CD1 LEU A 154 37.091 -9.862 -15.241 1.00 20.07 C ATOM 1146 CD2 LEU A 154 36.439 -11.556 -16.986 1.00 21.37 C ATOM 1147 H LEU A 154 32.351 -10.206 -14.871 1.00 0.00 H ATOM 1148 N ALA A 155 34.582 -6.972 -16.828 1.00 20.48 N ATOM 1149 CA ALA A 155 34.409 -6.005 -17.908 1.00 19.67 C ATOM 1150 C ALA A 155 35.739 -5.500 -18.426 1.00 18.92 C ATOM 1151 O ALA A 155 36.735 -5.436 -17.695 1.00 18.61 O ATOM 1152 CB ALA A 155 33.507 -4.852 -17.463 1.00 20.36 C ATOM 1153 H ALA A 155 35.314 -6.819 -16.105 1.00 0.00 H ATOM 1154 N VAL A 156 35.750 -5.153 -19.706 1.00 18.71 N ATOM 1155 CA VAL A 156 36.926 -4.567 -20.371 1.00 18.50 C ATOM 1156 C VAL A 156 37.196 -3.149 -19.868 1.00 17.68 C ATOM 1157 O VAL A 156 36.317 -2.310 -19.913 1.00 17.74 O ATOM 1158 CB VAL A 156 36.712 -4.524 -21.908 1.00 19.21 C ATOM 1159 CG1 VAL A 156 37.823 -3.722 -22.601 1.00 18.44 C ATOM 1160 CG2 VAL A 156 36.629 -5.981 -22.476 1.00 20.23 C ATOM 1161 H VAL A 156 34.887 -5.302 -20.267 1.00 0.00 H ATOM 1162 N THR A 157 38.412 -2.880 -19.421 1.00 17.25 N ATOM 1163 CA THR A 157 38.770 -1.536 -18.950 1.00 17.65 C ATOM 1164 C THR A 157 39.989 -0.974 -19.691 1.00 16.55 C ATOM 1165 O THR A 157 40.624 -0.068 -19.201 1.00 15.97 O ATOM 1166 CB THR A 157 39.095 -1.551 -17.446 1.00 17.66 C ATOM 1167 OG1 THR A 157 40.199 -2.442 -17.235 1.00 18.26 O ATOM 1168 CG2 THR A 157 37.910 -2.003 -16.636 1.00 18.46 C ATOM 1169 HG1 THR A 157 40.423 -2.465 -16.271 1.00 0.00 H ATOM 1170 H THR A 157 39.128 -3.634 -19.403 1.00 0.00 H ATOM 1171 N GLY A 158 40.347 -1.540 -20.842 1.00 17.09 N ATOM 1172 CA GLY A 158 41.486 -1.028 -21.630 1.00 16.70 C ATOM 1173 C GLY A 158 42.085 -2.064 -22.580 1.00 17.56 C ATOM 1174 O GLY A 158 41.560 -3.175 -22.706 1.00 17.29 O ATOM 1175 H GLY A 158 39.813 -2.360 -21.193 1.00 0.00 H ATOM 1176 N GLU A 159 43.186 -1.705 -23.234 1.00 16.76 N ATOM 1177 CA GLU A 159 43.862 -2.612 -24.153 1.00 17.89 C ATOM 1178 C GLU A 159 45.302 -2.676 -23.739 1.00 18.27 C ATOM 1179 O GLU A 159 45.809 -1.749 -23.095 1.00 19.01 O ATOM 1180 CB GLU A 159 43.761 -2.163 -25.630 1.00 16.87 C ATOM 1181 CG GLU A 159 42.397 -1.602 -26.047 1.00 16.71 C ATOM 1182 CD GLU A 159 42.165 -0.197 -25.504 1.00 16.75 C ATOM 1183 OE1 GLU A 159 43.140 0.586 -25.408 1.00 14.41 O ATOM 1184 OE2 GLU A 159 41.019 0.115 -25.143 1.00 19.15 O ATOM 1185 H GLU A 159 43.575 -0.752 -23.086 1.00 0.00 H ATOM 1186 N THR A 160 45.949 -3.784 -24.081 1.00 18.63 N ATOM 1187 CA THR A 160 47.332 -4.032 -23.719 1.00 19.32 C ATOM 1188 C THR A 160 47.933 -5.139 -24.618 1.00 20.15 C ATOM 1189 O THR A 160 47.201 -5.912 -25.207 1.00 20.46 O ATOM 1190 CB THR A 160 47.453 -4.468 -22.238 1.00 19.45 C ATOM 1191 OG1 THR A 160 48.823 -4.703 -21.947 1.00 19.79 O ATOM 1192 CG2 THR A 160 46.681 -5.784 -21.965 1.00 18.19 C ATOM 1193 HG1 THR A 160 48.915 -4.983 -21.002 1.00 0.00 H ATOM 1194 H THR A 160 45.442 -4.506 -24.632 1.00 0.00 H ATOM 1195 N GLU A 161 49.257 -5.206 -24.706 1.00 21.60 N ATOM 1196 CA GLU A 161 49.935 -6.366 -25.297 1.00 23.73 C ATOM 1197 C GLU A 161 50.595 -7.244 -24.220 1.00 23.17 C ATOM 1198 O GLU A 161 51.184 -8.300 -24.506 1.00 23.69 O ATOM 1199 CB GLU A 161 50.946 -5.943 -26.375 1.00 24.80 C ATOM 1200 CG GLU A 161 51.548 -4.541 -26.197 1.00 30.22 C ATOM 1201 CD GLU A 161 50.969 -3.529 -27.182 1.00 35.66 C ATOM 1202 OE1 GLU A 161 51.071 -3.786 -28.404 1.00 40.51 O ATOM 1203 OE2 GLU A 161 50.439 -2.483 -26.753 1.00 32.30 O ATOM 1204 H GLU A 161 49.829 -4.415 -24.346 1.00 0.00 H ATOM 1205 N LYS A 162 50.508 -6.815 -22.973 1.00 22.17 N ATOM 1206 CA LYS A 162 51.056 -7.634 -21.896 1.00 21.39 C ATOM 1207 C LYS A 162 50.033 -8.689 -21.496 1.00 19.47 C ATOM 1208 O LYS A 162 48.847 -8.561 -21.794 1.00 17.62 O ATOM 1209 CB LYS A 162 51.443 -6.766 -20.704 1.00 21.96 C ATOM 1210 CG LYS A 162 52.349 -5.566 -21.083 1.00 25.74 C ATOM 1211 CD LYS A 162 52.900 -4.873 -19.831 1.00 31.14 C ATOM 1212 CE LYS A 162 54.088 -3.957 -20.165 1.00 35.37 C ATOM 1213 NZ LYS A 162 55.321 -4.717 -20.637 1.00 39.01 N ATOM 1214 HZ1 LYS A 162 55.630 -5.372 -19.890 1.00 0.00 H ATOM 1215 HZ2 LYS A 162 55.088 -5.254 -21.496 1.00 0.00 H ATOM 1216 HZ3 LYS A 162 56.084 -4.042 -20.845 1.00 0.00 H ATOM 1217 H LYS A 162 50.054 -5.904 -22.761 1.00 0.00 H ATOM 1218 N THR A 163 50.497 -9.736 -20.823 1.00 18.04 N ATOM 1219 CA THR A 163 49.585 -10.714 -20.241 1.00 17.97 C ATOM 1220 C THR A 163 49.885 -10.920 -18.759 1.00 16.85 C ATOM 1221 O THR A 163 51.019 -10.763 -18.331 1.00 16.08 O ATOM 1222 CB THR A 163 49.636 -12.089 -20.991 1.00 18.66 C ATOM 1223 OG1 THR A 163 50.945 -12.667 -20.850 1.00 19.83 O ATOM 1224 CG2 THR A 163 49.285 -11.920 -22.488 1.00 18.49 C ATOM 1225 HG1 THR A 163 51.141 -12.808 -19.890 1.00 0.00 H ATOM 1226 H THR A 163 51.523 -9.860 -20.710 1.00 0.00 H ATOM 1227 N GLY A 164 48.862 -11.281 -17.985 1.00 16.54 N ATOM 1228 CA GLY A 164 49.058 -11.568 -16.575 1.00 15.34 C ATOM 1229 C GLY A 164 47.855 -11.258 -15.706 1.00 15.47 C ATOM 1230 O GLY A 164 46.786 -10.892 -16.199 1.00 15.24 O ATOM 1231 H GLY A 164 47.910 -11.358 -18.396 1.00 0.00 H ATOM 1232 N THR A 165 48.042 -11.409 -14.398 1.00 14.47 N ATOM 1233 CA THR A 165 46.938 -11.338 -13.454 1.00 14.95 C ATOM 1234 C THR A 165 47.367 -10.483 -12.264 1.00 14.52 C ATOM 1235 O THR A 165 48.505 -10.607 -11.794 1.00 15.03 O ATOM 1236 CB THR A 165 46.565 -12.779 -12.976 1.00 14.92 C ATOM 1237 OG1 THR A 165 46.135 -13.530 -14.111 1.00 16.38 O ATOM 1238 CG2 THR A 165 45.442 -12.782 -11.918 1.00 15.00 C ATOM 1239 HG1 THR A 165 46.868 -13.571 -14.775 1.00 0.00 H ATOM 1240 H THR A 165 49.003 -11.582 -14.041 1.00 0.00 H ATOM 1241 N MET A 166 46.455 -9.643 -11.777 1.00 13.68 N ATOM 1242 CA MET A 166 46.735 -8.754 -10.628 1.00 13.31 C ATOM 1243 C MET A 166 45.557 -8.949 -9.695 1.00 13.00 C ATOM 1244 O MET A 166 44.401 -8.832 -10.119 1.00 12.70 O ATOM 1245 CB MET A 166 46.818 -7.281 -11.072 1.00 13.59 C ATOM 1246 CG MET A 166 47.355 -6.286 -9.998 1.00 12.91 C ATOM 1247 SD MET A 166 46.208 -5.946 -8.646 1.00 19.17 S ATOM 1248 CE MET A 166 44.810 -5.306 -9.522 1.00 14.28 C ATOM 1249 H MET A 166 45.514 -9.611 -12.219 1.00 0.00 H ATOM 1250 N VAL A 167 45.848 -9.305 -8.450 1.00 12.66 N ATOM 1251 CA VAL A 167 44.814 -9.427 -7.434 1.00 13.63 C ATOM 1252 C VAL A 167 45.195 -8.475 -6.312 1.00 13.07 C ATOM 1253 O VAL A 167 46.304 -8.529 -5.810 1.00 13.78 O ATOM 1254 CB VAL A 167 44.685 -10.871 -6.909 1.00 13.12 C ATOM 1255 CG1 VAL A 167 43.920 -10.918 -5.598 1.00 12.19 C ATOM 1256 CG2 VAL A 167 44.008 -11.747 -7.972 1.00 14.87 C ATOM 1257 H VAL A 167 46.837 -9.501 -8.195 1.00 0.00 H ATOM 1258 N ARG A 168 44.259 -7.617 -5.931 1.00 13.19 N ATOM 1259 CA ARG A 168 44.478 -6.646 -4.853 1.00 13.08 C ATOM 1260 C ARG A 168 43.323 -6.764 -3.890 1.00 12.81 C ATOM 1261 O ARG A 168 42.182 -6.728 -4.295 1.00 12.35 O ATOM 1262 CB ARG A 168 44.569 -5.207 -5.389 1.00 13.47 C ATOM 1263 CG ARG A 168 44.921 -4.109 -4.334 1.00 13.41 C ATOM 1264 CD ARG A 168 45.049 -2.750 -5.034 1.00 13.77 C ATOM 1265 NE ARG A 168 45.315 -1.642 -4.109 1.00 15.69 N ATOM 1266 CZ ARG A 168 45.857 -0.481 -4.474 1.00 16.19 C ATOM 1267 NH1 ARG A 168 46.216 -0.271 -5.740 1.00 16.62 N ATOM 1268 NH2 ARG A 168 46.066 0.466 -3.572 1.00 17.09 N ATOM 1269 HE ARG A 168 45.065 -1.771 -3.108 1.00 0.00 H ATOM 1270 HH12 ARG A 168 46.638 0.638 -6.017 1.00 0.00 H ATOM 1271 HH11 ARG A 168 46.074 -1.016 -6.451 1.00 0.00 H ATOM 1272 HH22 ARG A 168 46.489 1.372 -3.858 1.00 0.00 H ATOM 1273 HH21 ARG A 168 45.807 0.304 -2.578 1.00 0.00 H ATOM 1274 H ARG A 168 43.338 -7.633 -6.413 1.00 0.00 H ATOM 1275 N PHE A 169 43.634 -6.914 -2.602 1.00 12.95 N ATOM 1276 CA PHE A 169 42.588 -7.109 -1.626 1.00 13.04 C ATOM 1277 C PHE A 169 42.800 -6.267 -0.369 1.00 13.68 C ATOM 1278 O PHE A 169 43.934 -5.963 0.019 1.00 13.29 O ATOM 1279 CB PHE A 169 42.419 -8.610 -1.294 1.00 12.43 C ATOM 1280 CG PHE A 169 43.565 -9.194 -0.485 1.00 12.86 C ATOM 1281 CD1 PHE A 169 44.692 -9.722 -1.116 1.00 11.93 C ATOM 1282 CD2 PHE A 169 43.493 -9.236 0.915 1.00 11.81 C ATOM 1283 CE1 PHE A 169 45.753 -10.262 -0.358 1.00 13.77 C ATOM 1284 CE2 PHE A 169 44.515 -9.773 1.673 1.00 10.41 C ATOM 1285 CZ PHE A 169 45.673 -10.280 1.042 1.00 11.34 C ATOM 1286 H PHE A 169 44.629 -6.891 -2.301 1.00 0.00 H ATOM 1287 N TRP A 170 41.671 -5.890 0.226 1.00 15.15 N ATOM 1288 CA TRP A 170 41.598 -5.122 1.460 1.00 16.89 C ATOM 1289 C TRP A 170 40.944 -6.089 2.463 1.00 17.52 C ATOM 1290 O TRP A 170 39.800 -6.508 2.256 1.00 16.98 O ATOM 1291 CB TRP A 170 40.699 -3.902 1.256 1.00 16.81 C ATOM 1292 CG TRP A 170 41.246 -2.800 0.325 1.00 19.42 C ATOM 1293 CD1 TRP A 170 41.747 -1.588 0.708 1.00 18.90 C ATOM 1294 CD2 TRP A 170 41.294 -2.811 -1.125 1.00 20.84 C ATOM 1295 NE1 TRP A 170 42.113 -0.846 -0.405 1.00 22.34 N ATOM 1296 CE2 TRP A 170 41.835 -1.568 -1.537 1.00 22.03 C ATOM 1297 CE3 TRP A 170 40.946 -3.750 -2.106 1.00 22.36 C ATOM 1298 CZ2 TRP A 170 42.043 -1.247 -2.887 1.00 23.25 C ATOM 1299 CZ3 TRP A 170 41.149 -3.423 -3.465 1.00 21.86 C ATOM 1300 CH2 TRP A 170 41.695 -2.190 -3.832 1.00 21.15 C ATOM 1301 HE1 TRP A 170 42.531 0.106 -0.384 1.00 0.00 H ATOM 1302 H TRP A 170 40.775 -6.164 -0.224 1.00 0.00 H ATOM 1303 N PRO A 171 41.679 -6.474 3.522 1.00 18.14 N ATOM 1304 CA PRO A 171 41.144 -7.510 4.398 1.00 19.15 C ATOM 1305 C PRO A 171 39.956 -7.003 5.227 1.00 20.34 C ATOM 1306 O PRO A 171 39.920 -5.833 5.602 1.00 20.34 O ATOM 1307 CB PRO A 171 42.338 -7.878 5.280 1.00 18.95 C ATOM 1308 CG PRO A 171 43.182 -6.618 5.318 1.00 19.53 C ATOM 1309 CD PRO A 171 43.028 -6.032 3.932 1.00 18.06 C ATOM 1310 N SER A 172 38.976 -7.872 5.459 1.00 21.86 N ATOM 1311 CA SER A 172 37.814 -7.540 6.263 1.00 23.48 C ATOM 1312 C SER A 172 38.206 -7.180 7.693 1.00 25.26 C ATOM 1313 O SER A 172 38.923 -7.929 8.374 1.00 24.74 O ATOM 1314 CB SER A 172 36.837 -8.711 6.304 1.00 23.49 C ATOM 1315 OG SER A 172 35.658 -8.337 7.000 1.00 24.68 O ATOM 1316 HG SER A 172 35.031 -9.103 7.021 1.00 0.00 H ATOM 1317 H SER A 172 39.045 -8.825 5.049 1.00 0.00 H ATOM 1318 N LEU A 173 37.709 -6.032 8.149 1.00 27.26 N ATOM 1319 CA LEU A 173 37.976 -5.568 9.503 1.00 29.29 C ATOM 1320 C LEU A 173 36.987 -6.158 10.512 1.00 29.64 C ATOM 1321 O LEU A 173 37.141 -5.950 11.712 1.00 29.44 O ATOM 1322 CB LEU A 173 37.962 -4.033 9.549 1.00 30.18 C ATOM 1323 CG LEU A 173 39.274 -3.283 9.260 1.00 32.13 C ATOM 1324 CD1 LEU A 173 40.380 -4.164 8.655 1.00 33.14 C ATOM 1325 CD2 LEU A 173 38.964 -2.064 8.379 1.00 32.80 C ATOM 1326 H LEU A 173 37.115 -5.452 7.522 1.00 0.00 H ATOM 1327 N GLU A 174 35.982 -6.884 10.008 1.00 30.14 N ATOM 1328 CA GLU A 174 35.107 -7.738 10.830 1.00 30.42 C ATOM 1329 C GLU A 174 35.778 -9.078 11.161 1.00 29.75 C ATOM 1330 O GLU A 174 35.540 -9.654 12.223 1.00 30.49 O ATOM 1331 CB GLU A 174 33.769 -7.997 10.119 1.00 31.22 C ATOM 1332 CG GLU A 174 32.859 -6.766 9.960 1.00 34.99 C ATOM 1333 CD GLU A 174 31.896 -6.878 8.754 1.00 41.25 C ATOM 1334 OE1 GLU A 174 31.523 -8.011 8.353 1.00 43.32 O ATOM 1335 OE2 GLU A 174 31.505 -5.823 8.197 1.00 44.00 O ATOM 1336 H GLU A 174 35.810 -6.843 8.983 1.00 0.00 H ATOM 1337 N THR A 175 36.618 -9.577 10.253 1.00 27.93 N ATOM 1338 CA THR A 175 37.319 -10.835 10.467 1.00 25.77 C ATOM 1339 C THR A 175 38.600 -10.660 11.282 1.00 24.99 C ATOM 1340 O THR A 175 38.811 -11.345 12.289 1.00 24.71 O ATOM 1341 CB THR A 175 37.619 -11.513 9.107 1.00 26.05 C ATOM 1342 OG1 THR A 175 36.380 -11.839 8.481 1.00 25.47 O ATOM 1343 CG2 THR A 175 38.450 -12.767 9.258 1.00 25.56 C ATOM 1344 HG1 THR A 175 36.556 -12.274 7.609 1.00 0.00 H ATOM 1345 H THR A 175 36.776 -9.053 9.368 1.00 0.00 H ATOM 1346 N PHE A 176 39.454 -9.739 10.855 1.00 23.62 N ATOM 1347 CA PHE A 176 40.783 -9.620 11.443 1.00 22.67 C ATOM 1348 C PHE A 176 40.849 -8.568 12.538 1.00 22.78 C ATOM 1349 O PHE A 176 40.254 -7.481 12.400 1.00 23.11 O ATOM 1350 CB PHE A 176 41.818 -9.369 10.357 1.00 22.10 C ATOM 1351 CG PHE A 176 41.846 -10.437 9.301 1.00 22.19 C ATOM 1352 CD1 PHE A 176 42.589 -11.597 9.493 1.00 22.51 C ATOM 1353 CD2 PHE A 176 41.106 -10.307 8.138 1.00 21.72 C ATOM 1354 CE1 PHE A 176 42.624 -12.595 8.526 1.00 21.77 C ATOM 1355 CE2 PHE A 176 41.128 -11.311 7.167 1.00 22.32 C ATOM 1356 CZ PHE A 176 41.893 -12.451 7.365 1.00 22.24 C ATOM 1357 H PHE A 176 39.172 -9.093 10.090 1.00 0.00 H ATOM 1358 N THR A 177 41.549 -8.908 13.622 1.00 21.67 N ATOM 1359 CA THR A 177 41.692 -8.035 14.787 1.00 22.09 C ATOM 1360 C THR A 177 43.137 -8.008 15.259 1.00 21.14 C ATOM 1361 O THR A 177 43.921 -8.891 14.915 1.00 20.91 O ATOM 1362 CB THR A 177 40.779 -8.502 15.977 1.00 22.60 C ATOM 1363 OG1 THR A 177 41.137 -9.835 16.343 1.00 23.01 O ATOM 1364 CG2 THR A 177 39.311 -8.494 15.595 1.00 23.52 C ATOM 1365 HG1 THR A 177 41.007 -10.435 15.567 1.00 0.00 H ATOM 1366 H THR A 177 42.015 -9.838 13.639 1.00 0.00 H ATOM 1367 N ASN A 178 43.472 -6.990 16.065 1.00 21.11 N ATOM 1368 CA ASN A 178 44.816 -6.758 16.638 1.00 19.92 C ATOM 1369 C ASN A 178 45.914 -6.431 15.636 1.00 19.67 C ATOM 1370 O ASN A 178 46.563 -5.388 15.757 1.00 18.92 O ATOM 1371 CB ASN A 178 45.283 -7.888 17.580 1.00 20.40 C ATOM 1372 CG ASN A 178 44.266 -8.233 18.654 1.00 21.52 C ATOM 1373 OD1 ASN A 178 44.119 -9.404 19.035 1.00 26.50 O ATOM 1374 ND2 ASN A 178 43.567 -7.241 19.148 1.00 18.17 N ATOM 1375 HD22 ASN A 178 43.721 -6.273 18.801 1.00 0.00 H ATOM 1376 HD21 ASN A 178 42.858 -7.422 19.887 1.00 0.00 H ATOM 1377 H ASN A 178 42.726 -6.307 16.307 1.00 0.00 H ATOM 1378 N VAL A 179 46.148 -7.326 14.672 1.00 18.82 N ATOM 1379 CA VAL A 179 47.087 -7.081 13.587 1.00 18.47 C ATOM 1380 C VAL A 179 46.203 -7.012 12.340 1.00 18.93 C ATOM 1381 O VAL A 179 45.691 -8.039 11.863 1.00 18.67 O ATOM 1382 CB VAL A 179 48.195 -8.183 13.490 1.00 19.61 C ATOM 1383 CG1 VAL A 179 49.257 -7.867 12.418 1.00 16.20 C ATOM 1384 CG2 VAL A 179 48.910 -8.380 14.847 1.00 21.20 C ATOM 1385 H VAL A 179 45.640 -8.233 14.698 1.00 0.00 H ATOM 1386 N THR A 180 45.965 -5.786 11.857 1.00 18.29 N ATOM 1387 CA THR A 180 45.094 -5.564 10.698 1.00 18.29 C ATOM 1388 C THR A 180 45.890 -4.936 9.555 1.00 17.90 C ATOM 1389 O THR A 180 45.349 -4.690 8.489 1.00 18.25 O ATOM 1390 CB THR A 180 43.877 -4.653 11.031 1.00 17.76 C ATOM 1391 OG1 THR A 180 44.349 -3.390 11.533 1.00 21.13 O ATOM 1392 CG2 THR A 180 42.992 -5.279 12.077 1.00 19.66 C ATOM 1393 HG1 THR A 180 44.912 -2.953 10.846 1.00 0.00 H ATOM 1394 H THR A 180 46.411 -4.967 12.317 1.00 0.00 H ATOM 1395 N GLU A 181 47.174 -4.691 9.791 1.00 17.41 N ATOM 1396 CA GLU A 181 48.051 -4.116 8.796 1.00 18.08 C ATOM 1397 C GLU A 181 49.144 -5.116 8.451 1.00 18.03 C ATOM 1398 O GLU A 181 49.656 -5.814 9.329 1.00 17.92 O ATOM 1399 CB GLU A 181 48.701 -2.816 9.296 1.00 17.63 C ATOM 1400 CG GLU A 181 47.696 -1.720 9.708 1.00 17.86 C ATOM 1401 CD GLU A 181 48.403 -0.452 10.177 1.00 19.28 C ATOM 1402 OE1 GLU A 181 48.477 -0.200 11.404 1.00 17.69 O ATOM 1403 OE2 GLU A 181 48.961 0.259 9.318 1.00 17.42 O ATOM 1404 H GLU A 181 47.563 -4.922 10.727 1.00 0.00 H ATOM 1405 N PHE A 182 49.507 -5.156 7.173 1.00 17.94 N ATOM 1406 CA PHE A 182 50.563 -6.048 6.696 1.00 18.24 C ATOM 1407 C PHE A 182 51.952 -5.628 7.145 1.00 18.88 C ATOM 1408 O PHE A 182 52.307 -4.440 7.099 1.00 18.00 O ATOM 1409 CB PHE A 182 50.487 -6.187 5.170 1.00 17.97 C ATOM 1410 CG PHE A 182 49.160 -6.686 4.695 1.00 17.96 C ATOM 1411 CD1 PHE A 182 48.841 -8.050 4.785 1.00 16.94 C ATOM 1412 CD2 PHE A 182 48.202 -5.806 4.229 1.00 16.84 C ATOM 1413 CE1 PHE A 182 47.631 -8.513 4.382 1.00 13.97 C ATOM 1414 CE2 PHE A 182 46.955 -6.281 3.807 1.00 17.62 C ATOM 1415 CZ PHE A 182 46.675 -7.633 3.887 1.00 16.63 C ATOM 1416 H PHE A 182 49.026 -4.534 6.492 1.00 0.00 H ATOM 1417 N GLU A 183 52.727 -6.617 7.593 1.00 19.27 N ATOM 1418 CA GLU A 183 54.064 -6.390 8.094 1.00 20.58 C ATOM 1419 C GLU A 183 55.083 -6.915 7.103 1.00 21.19 C ATOM 1420 O GLU A 183 55.092 -8.110 6.747 1.00 21.56 O ATOM 1421 CB GLU A 183 54.255 -7.010 9.501 1.00 21.06 C ATOM 1422 CG GLU A 183 53.142 -6.616 10.491 1.00 24.65 C ATOM 1423 CD GLU A 183 53.380 -7.060 11.961 1.00 28.61 C ATOM 1424 OE1 GLU A 183 54.128 -8.038 12.195 1.00 28.35 O ATOM 1425 OE2 GLU A 183 52.791 -6.423 12.876 1.00 26.64 O ATOM 1426 H GLU A 183 52.355 -7.588 7.581 1.00 0.00 H ATOM 1427 N TYR A 184 55.937 -6.002 6.658 1.00 21.79 N ATOM 1428 CA TYR A 184 56.973 -6.278 5.680 1.00 22.52 C ATOM 1429 C TYR A 184 57.823 -7.528 5.976 1.00 23.79 C ATOM 1430 O TYR A 184 58.000 -8.388 5.099 1.00 22.97 O ATOM 1431 CB TYR A 184 57.882 -5.059 5.557 1.00 22.44 C ATOM 1432 CG TYR A 184 58.792 -5.134 4.380 1.00 20.71 C ATOM 1433 CD1 TYR A 184 60.054 -5.716 4.489 1.00 21.93 C ATOM 1434 CD2 TYR A 184 58.393 -4.645 3.144 1.00 20.33 C ATOM 1435 CE1 TYR A 184 60.894 -5.800 3.397 1.00 20.64 C ATOM 1436 CE2 TYR A 184 59.230 -4.715 2.048 1.00 19.77 C ATOM 1437 CZ TYR A 184 60.480 -5.293 2.185 1.00 21.46 C ATOM 1438 OH TYR A 184 61.314 -5.374 1.092 1.00 23.77 O ATOM 1439 HH TYR A 184 62.162 -5.810 1.357 1.00 0.00 H ATOM 1440 H TYR A 184 55.860 -5.034 7.031 1.00 0.00 H ATOM 1441 N GLU A 185 58.365 -7.615 7.191 1.00 24.93 N ATOM 1442 CA GLU A 185 59.245 -8.743 7.566 1.00 26.61 C ATOM 1443 C GLU A 185 58.598 -10.124 7.392 1.00 25.59 C ATOM 1444 O GLU A 185 59.229 -11.032 6.869 1.00 25.91 O ATOM 1445 CB GLU A 185 59.748 -8.612 9.014 1.00 27.69 C ATOM 1446 CG GLU A 185 61.150 -8.007 9.136 1.00 33.29 C ATOM 1447 CD GLU A 185 62.045 -8.768 10.125 1.00 41.21 C ATOM 1448 OE1 GLU A 185 61.594 -9.819 10.663 1.00 44.31 O ATOM 1449 OE2 GLU A 185 63.207 -8.323 10.351 1.00 43.02 O ATOM 1450 H GLU A 185 58.164 -6.873 7.891 1.00 0.00 H ATOM 1451 N ILE A 186 57.358 -10.268 7.858 1.00 24.96 N ATOM 1452 CA ILE A 186 56.608 -11.510 7.698 1.00 24.94 C ATOM 1453 C ILE A 186 56.501 -11.886 6.219 1.00 24.00 C ATOM 1454 O ILE A 186 56.819 -13.023 5.842 1.00 22.72 O ATOM 1455 CB ILE A 186 55.229 -11.421 8.344 1.00 25.19 C ATOM 1456 CG1 ILE A 186 55.390 -11.156 9.857 1.00 26.76 C ATOM 1457 CG2 ILE A 186 54.399 -12.696 8.034 1.00 25.36 C ATOM 1458 CD1 ILE A 186 54.067 -11.042 10.621 1.00 26.07 C ATOM 1459 H ILE A 186 56.910 -9.470 8.352 1.00 0.00 H ATOM 1460 N LEU A 187 56.123 -10.911 5.384 1.00 22.45 N ATOM 1461 CA LEU A 187 56.087 -11.136 3.942 1.00 22.26 C ATOM 1462 C LEU A 187 57.459 -11.460 3.344 1.00 21.66 C ATOM 1463 O LEU A 187 57.580 -12.397 2.567 1.00 21.63 O ATOM 1464 CB LEU A 187 55.385 -9.990 3.180 1.00 21.78 C ATOM 1465 CG LEU A 187 53.909 -9.729 3.518 1.00 21.00 C ATOM 1466 CD1 LEU A 187 53.319 -8.603 2.620 1.00 17.23 C ATOM 1467 CD2 LEU A 187 53.046 -10.985 3.426 1.00 18.90 C ATOM 1468 H LEU A 187 55.852 -9.983 5.767 1.00 0.00 H ATOM 1469 N ALA A 188 58.483 -10.696 3.713 1.00 21.83 N ATOM 1470 CA ALA A 188 59.817 -10.889 3.164 1.00 22.61 C ATOM 1471 C ALA A 188 60.330 -12.296 3.445 1.00 22.87 C ATOM 1472 O ALA A 188 60.881 -12.933 2.557 1.00 22.98 O ATOM 1473 CB ALA A 188 60.801 -9.841 3.705 1.00 22.96 C ATOM 1474 H ALA A 188 58.327 -9.942 4.412 1.00 0.00 H ATOM 1475 N LYS A 189 60.119 -12.762 4.673 1.00 22.99 N ATOM 1476 CA LYS A 189 60.602 -14.057 5.128 1.00 24.18 C ATOM 1477 C LYS A 189 60.007 -15.206 4.315 1.00 23.91 C ATOM 1478 O LYS A 189 60.742 -16.035 3.785 1.00 24.00 O ATOM 1479 CB LYS A 189 60.317 -14.242 6.621 1.00 24.06 C ATOM 1480 CG LYS A 189 60.901 -15.516 7.211 1.00 27.21 C ATOM 1481 CD LYS A 189 60.571 -15.636 8.706 1.00 30.80 C ATOM 1482 CE LYS A 189 61.649 -16.439 9.442 1.00 34.22 C ATOM 1483 NZ LYS A 189 61.611 -17.878 9.082 1.00 34.55 N ATOM 1484 HZ1 LYS A 189 60.682 -18.273 9.333 1.00 0.00 H ATOM 1485 HZ2 LYS A 189 61.768 -17.983 8.059 1.00 0.00 H ATOM 1486 HZ3 LYS A 189 62.356 -18.384 9.602 1.00 0.00 H ATOM 1487 H LYS A 189 59.583 -12.172 5.341 1.00 0.00 H ATOM 1488 N ARG A 190 58.684 -15.227 4.193 1.00 23.78 N ATOM 1489 CA ARG A 190 58.000 -16.260 3.435 1.00 23.77 C ATOM 1490 C ARG A 190 58.141 -16.149 1.904 1.00 23.52 C ATOM 1491 O ARG A 190 58.251 -17.171 1.218 1.00 23.94 O ATOM 1492 CB ARG A 190 56.538 -16.375 3.874 1.00 24.36 C ATOM 1493 CG ARG A 190 55.752 -17.449 3.154 1.00 26.65 C ATOM 1494 CD ARG A 190 56.327 -18.846 3.442 1.00 29.63 C ATOM 1495 NE ARG A 190 55.488 -19.881 2.841 1.00 31.03 N ATOM 1496 CZ ARG A 190 55.848 -21.151 2.673 1.00 31.88 C ATOM 1497 NH1 ARG A 190 57.049 -21.564 3.052 1.00 31.08 N ATOM 1498 NH2 ARG A 190 54.995 -22.006 2.107 1.00 32.60 N ATOM 1499 HE ARG A 190 54.538 -19.604 2.521 1.00 0.00 H ATOM 1500 HH12 ARG A 190 57.323 -22.558 2.918 1.00 0.00 H ATOM 1501 HH11 ARG A 190 57.717 -20.894 3.484 1.00 0.00 H ATOM 1502 HH22 ARG A 190 55.268 -23.000 1.972 1.00 0.00 H ATOM 1503 HH21 ARG A 190 54.057 -21.678 1.801 1.00 0.00 H ATOM 1504 H ARG A 190 58.122 -14.483 4.653 1.00 0.00 H ATOM 1505 N LEU A 191 58.184 -14.933 1.363 1.00 22.29 N ATOM 1506 CA LEU A 191 58.463 -14.785 -0.072 1.00 22.09 C ATOM 1507 C LEU A 191 59.852 -15.297 -0.468 1.00 22.14 C ATOM 1508 O LEU A 191 60.019 -15.888 -1.541 1.00 21.17 O ATOM 1509 CB LEU A 191 58.241 -13.346 -0.568 1.00 21.38 C ATOM 1510 CG LEU A 191 56.789 -12.840 -0.505 1.00 20.62 C ATOM 1511 CD1 LEU A 191 56.735 -11.381 -0.964 1.00 15.96 C ATOM 1512 CD2 LEU A 191 55.823 -13.725 -1.319 1.00 19.39 C ATOM 1513 H LEU A 191 58.021 -14.092 1.953 1.00 0.00 H ATOM 1514 N ARG A 192 60.844 -15.051 0.383 1.00 22.48 N ATOM 1515 CA ARG A 192 62.172 -15.610 0.151 1.00 23.65 C ATOM 1516 C ARG A 192 62.153 -17.148 0.082 1.00 23.94 C ATOM 1517 O ARG A 192 62.694 -17.715 -0.859 1.00 24.59 O ATOM 1518 CB ARG A 192 63.177 -15.156 1.200 1.00 23.42 C ATOM 1519 CG ARG A 192 64.569 -15.653 0.862 1.00 26.39 C ATOM 1520 CD ARG A 192 65.563 -15.379 1.960 1.00 30.82 C ATOM 1521 NE ARG A 192 65.936 -13.976 2.056 1.00 34.89 N ATOM 1522 CZ ARG A 192 66.792 -13.348 1.239 1.00 38.39 C ATOM 1523 NH1 ARG A 192 67.056 -12.058 1.444 1.00 38.61 N ATOM 1524 NH2 ARG A 192 67.374 -13.987 0.218 1.00 38.07 N ATOM 1525 HE ARG A 192 65.504 -13.417 2.819 1.00 0.00 H ATOM 1526 HH12 ARG A 192 67.718 -11.557 0.818 1.00 0.00 H ATOM 1527 HH11 ARG A 192 66.600 -11.552 2.230 1.00 0.00 H ATOM 1528 HH22 ARG A 192 68.036 -13.480 -0.404 1.00 0.00 H ATOM 1529 HH21 ARG A 192 67.165 -14.991 0.046 1.00 0.00 H ATOM 1530 H ARG A 192 60.672 -14.457 1.219 1.00 0.00 H ATOM 1531 N GLU A 193 61.534 -17.803 1.069 1.00 24.36 N ATOM 1532 CA GLU A 193 61.367 -19.270 1.068 1.00 25.00 C ATOM 1533 C GLU A 193 60.686 -19.738 -0.227 1.00 24.93 C ATOM 1534 O GLU A 193 61.167 -20.671 -0.904 1.00 24.94 O ATOM 1535 CB GLU A 193 60.518 -19.744 2.264 1.00 25.22 C ATOM 1536 CG GLU A 193 61.069 -19.406 3.656 1.00 28.53 C ATOM 1537 CD GLU A 193 60.151 -19.832 4.809 1.00 32.64 C ATOM 1538 OE1 GLU A 193 59.088 -20.475 4.579 1.00 34.03 O ATOM 1539 OE2 GLU A 193 60.508 -19.524 5.963 1.00 33.50 O ATOM 1540 H GLU A 193 61.155 -17.258 1.869 1.00 0.00 H ATOM 1541 N LEU A 194 59.571 -19.084 -0.560 1.00 23.63 N ATOM 1542 CA LEU A 194 58.802 -19.453 -1.740 1.00 23.71 C ATOM 1543 C LEU A 194 59.642 -19.415 -2.992 1.00 23.89 C ATOM 1544 O LEU A 194 59.483 -20.296 -3.843 1.00 24.60 O ATOM 1545 CB LEU A 194 57.522 -18.620 -1.906 1.00 22.94 C ATOM 1546 CG LEU A 194 56.342 -18.947 -0.978 1.00 23.06 C ATOM 1547 CD1 LEU A 194 55.199 -17.889 -1.099 1.00 21.29 C ATOM 1548 CD2 LEU A 194 55.807 -20.404 -1.214 1.00 22.44 C ATOM 1549 H LEU A 194 59.245 -18.296 0.035 1.00 0.00 H ATOM 1550 N SER A 195 60.537 -18.429 -3.092 1.00 23.65 N ATOM 1551 CA SER A 195 61.459 -18.358 -4.220 1.00 24.90 C ATOM 1552 C SER A 195 62.495 -19.498 -4.242 1.00 25.35 C ATOM 1553 O SER A 195 62.797 -20.002 -5.316 1.00 25.79 O ATOM 1554 CB SER A 195 62.166 -17.007 -4.341 1.00 24.52 C ATOM 1555 OG SER A 195 63.152 -16.834 -3.341 1.00 26.64 O ATOM 1556 HG SER A 195 62.727 -16.883 -2.448 1.00 0.00 H ATOM 1557 H SER A 195 60.577 -17.699 -2.353 1.00 0.00 H ATOM 1558 N PHE A 196 63.047 -19.893 -3.094 1.00 25.22 N ATOM 1559 CA PHE A 196 63.972 -21.043 -3.124 1.00 25.30 C ATOM 1560 C PHE A 196 63.305 -22.436 -3.156 1.00 25.67 C ATOM 1561 O PHE A 196 63.927 -23.398 -3.570 1.00 25.97 O ATOM 1562 CB PHE A 196 65.161 -20.923 -2.136 1.00 24.65 C ATOM 1563 CG PHE A 196 64.803 -20.990 -0.662 1.00 23.49 C ATOM 1564 CD1 PHE A 196 65.256 -20.001 0.202 1.00 21.95 C ATOM 1565 CD2 PHE A 196 64.096 -22.065 -0.127 1.00 20.95 C ATOM 1566 CE1 PHE A 196 64.996 -20.069 1.573 1.00 22.27 C ATOM 1567 CE2 PHE A 196 63.819 -22.132 1.230 1.00 21.54 C ATOM 1568 CZ PHE A 196 64.274 -21.125 2.087 1.00 21.87 C ATOM 1569 H PHE A 196 62.832 -19.404 -2.202 1.00 0.00 H ATOM 1570 N LEU A 197 62.042 -22.529 -2.752 1.00 26.76 N ATOM 1571 CA LEU A 197 61.270 -23.772 -2.896 1.00 27.53 C ATOM 1572 C LEU A 197 60.659 -23.960 -4.302 1.00 28.53 C ATOM 1573 O LEU A 197 60.067 -25.001 -4.598 1.00 28.72 O ATOM 1574 CB LEU A 197 60.186 -23.887 -1.811 1.00 27.30 C ATOM 1575 CG LEU A 197 60.589 -23.816 -0.323 1.00 27.71 C ATOM 1576 CD1 LEU A 197 59.401 -23.400 0.533 1.00 29.09 C ATOM 1577 CD2 LEU A 197 61.138 -25.124 0.196 1.00 26.44 C ATOM 1578 H LEU A 197 61.587 -21.699 -2.322 1.00 0.00 H ATOM 1579 N ASN A 198 60.803 -22.961 -5.168 1.00 29.92 N ATOM 1580 CA ASN A 198 60.392 -23.083 -6.566 1.00 31.34 C ATOM 1581 C ASN A 198 61.396 -22.341 -7.428 1.00 32.42 C ATOM 1582 O ASN A 198 61.027 -21.389 -8.111 1.00 32.30 O ATOM 1583 CB ASN A 198 59.010 -22.450 -6.794 1.00 31.42 C ATOM 1584 CG ASN A 198 57.982 -22.900 -5.801 1.00 31.38 C ATOM 1585 OD1 ASN A 198 57.869 -22.351 -4.699 1.00 33.73 O ATOM 1586 ND2 ASN A 198 57.208 -23.891 -6.179 1.00 30.68 N ATOM 1587 HD22 ASN A 198 57.338 -24.324 -7.116 1.00 0.00 H ATOM 1588 HD21 ASN A 198 56.465 -24.243 -5.542 1.00 0.00 H ATOM 1589 H ASN A 198 61.220 -22.066 -4.841 1.00 0.00 H ATOM 1590 N SER A 199 62.659 -22.772 -7.403 1.00 33.75 N ATOM 1591 CA SER A 199 63.756 -21.943 -7.917 1.00 34.57 C ATOM 1592 C SER A 199 63.626 -21.614 -9.397 1.00 34.62 C ATOM 1593 O SER A 199 62.940 -22.306 -10.136 1.00 35.35 O ATOM 1594 CB SER A 199 65.135 -22.547 -7.580 1.00 35.90 C ATOM 1595 OG SER A 199 65.717 -23.265 -8.662 1.00 36.98 O ATOM 1596 HG SER A 199 66.596 -23.625 -8.383 1.00 0.00 H ATOM 1597 H SER A 199 62.870 -23.712 -7.012 1.00 0.00 H ATOM 1598 N GLY A 200 64.281 -20.545 -9.824 1.00 34.73 N ATOM 1599 CA GLY A 200 63.986 -19.964 -11.126 1.00 35.09 C ATOM 1600 C GLY A 200 62.843 -18.946 -11.098 1.00 35.01 C ATOM 1601 O GLY A 200 62.617 -18.261 -12.097 1.00 36.00 O ATOM 1602 H GLY A 200 65.014 -20.116 -9.223 1.00 0.00 H ATOM 1603 N VAL A 201 62.115 -18.834 -9.980 1.00 34.04 N ATOM 1604 CA VAL A 201 61.044 -17.821 -9.885 1.00 32.92 C ATOM 1605 C VAL A 201 61.488 -16.516 -9.192 1.00 31.63 C ATOM 1606 O VAL A 201 61.988 -16.516 -8.057 1.00 32.55 O ATOM 1607 CB VAL A 201 59.682 -18.368 -9.310 1.00 32.78 C ATOM 1608 CG1 VAL A 201 59.743 -18.606 -7.808 1.00 33.63 C ATOM 1609 CG2 VAL A 201 58.560 -17.389 -9.611 1.00 34.04 C ATOM 1610 H VAL A 201 62.305 -19.464 -9.174 1.00 0.00 H ATOM 1611 N SER A 202 61.304 -15.416 -9.907 1.00 29.15 N ATOM 1612 CA SER A 202 61.600 -14.097 -9.401 1.00 27.17 C ATOM 1613 C SER A 202 60.372 -13.497 -8.700 1.00 26.02 C ATOM 1614 O SER A 202 59.293 -13.399 -9.289 1.00 24.72 O ATOM 1615 CB SER A 202 62.050 -13.204 -10.546 1.00 26.59 C ATOM 1616 OG SER A 202 62.415 -11.935 -10.049 1.00 26.90 O ATOM 1617 HG SER A 202 63.157 -12.036 -9.402 1.00 0.00 H ATOM 1618 H SER A 202 60.931 -15.507 -10.873 1.00 0.00 H ATOM 1619 N ILE A 203 60.564 -13.121 -7.436 1.00 24.95 N ATOM 1620 CA ILE A 203 59.533 -12.518 -6.604 1.00 24.51 C ATOM 1621 C ILE A 203 60.075 -11.209 -6.043 1.00 24.31 C ATOM 1622 O ILE A 203 61.106 -11.200 -5.377 1.00 24.12 O ATOM 1623 CB ILE A 203 59.101 -13.436 -5.420 1.00 24.95 C ATOM 1624 CG1 ILE A 203 58.652 -14.827 -5.914 1.00 24.17 C ATOM 1625 CG2 ILE A 203 58.012 -12.745 -4.580 1.00 23.46 C ATOM 1626 CD1 ILE A 203 58.239 -15.821 -4.787 1.00 24.22 C ATOM 1627 H ILE A 203 61.506 -13.267 -7.020 1.00 0.00 H ATOM 1628 N ARG A 204 59.389 -10.105 -6.339 1.00 23.86 N ATOM 1629 CA ARG A 204 59.764 -8.808 -5.781 1.00 23.11 C ATOM 1630 C ARG A 204 58.743 -8.409 -4.737 1.00 22.15 C ATOM 1631 O ARG A 204 57.556 -8.664 -4.898 1.00 21.33 O ATOM 1632 CB ARG A 204 59.839 -7.720 -6.866 1.00 23.37 C ATOM 1633 CG ARG A 204 60.955 -7.928 -7.877 1.00 24.68 C ATOM 1634 CD ARG A 204 60.961 -6.833 -8.933 1.00 26.20 C ATOM 1635 NE ARG A 204 62.074 -6.989 -9.873 1.00 27.68 N ATOM 1636 CZ ARG A 204 63.310 -6.561 -9.639 1.00 29.66 C ATOM 1637 NH1 ARG A 204 63.602 -5.959 -8.494 1.00 30.84 N ATOM 1638 NH2 ARG A 204 64.260 -6.733 -10.548 1.00 30.74 N ATOM 1639 HE ARG A 204 61.885 -7.464 -10.779 1.00 0.00 H ATOM 1640 HH12 ARG A 204 64.570 -5.625 -8.314 1.00 0.00 H ATOM 1641 HH11 ARG A 204 62.863 -5.821 -7.776 1.00 0.00 H ATOM 1642 HH22 ARG A 204 65.226 -6.396 -10.361 1.00 0.00 H ATOM 1643 HH21 ARG A 204 64.039 -7.204 -11.448 1.00 0.00 H ATOM 1644 H ARG A 204 58.572 -10.168 -6.979 1.00 0.00 H ATOM 1645 N LEU A 205 59.227 -7.773 -3.672 1.00 21.20 N ATOM 1646 CA LEU A 205 58.376 -7.216 -2.635 1.00 20.63 C ATOM 1647 C LEU A 205 58.590 -5.696 -2.601 1.00 20.48 C ATOM 1648 O LEU A 205 59.711 -5.230 -2.486 1.00 19.42 O ATOM 1649 CB LEU A 205 58.731 -7.843 -1.272 1.00 19.75 C ATOM 1650 CG LEU A 205 57.993 -7.408 0.002 1.00 19.69 C ATOM 1651 CD1 LEU A 205 56.479 -7.626 -0.083 1.00 16.17 C ATOM 1652 CD2 LEU A 205 58.572 -8.132 1.237 1.00 15.79 C ATOM 1653 H LEU A 205 60.258 -7.671 -3.579 1.00 0.00 H ATOM 1654 N ARG A 206 57.508 -4.930 -2.704 1.00 21.54 N ATOM 1655 CA ARG A 206 57.591 -3.478 -2.605 1.00 21.87 C ATOM 1656 C ARG A 206 56.641 -2.977 -1.538 1.00 21.95 C ATOM 1657 O ARG A 206 55.482 -3.394 -1.482 1.00 22.24 O ATOM 1658 CB ARG A 206 57.230 -2.832 -3.936 1.00 22.58 C ATOM 1659 CG ARG A 206 57.981 -3.383 -5.096 1.00 24.77 C ATOM 1660 CD ARG A 206 57.487 -2.783 -6.371 1.00 29.39 C ATOM 1661 NE ARG A 206 58.383 -3.139 -7.465 1.00 33.28 N ATOM 1662 CZ ARG A 206 58.048 -3.111 -8.751 1.00 34.64 C ATOM 1663 NH1 ARG A 206 56.821 -2.731 -9.118 1.00 34.41 N ATOM 1664 NH2 ARG A 206 58.946 -3.467 -9.667 1.00 35.38 N ATOM 1665 HE ARG A 206 59.350 -3.435 -7.223 1.00 0.00 H ATOM 1666 HH12 ARG A 206 56.562 -2.710 -10.125 1.00 0.00 H ATOM 1667 HH11 ARG A 206 56.124 -2.456 -8.397 1.00 0.00 H ATOM 1668 HH22 ARG A 206 58.695 -3.449 -10.676 1.00 0.00 H ATOM 1669 HH21 ARG A 206 59.899 -3.763 -9.374 1.00 0.00 H ATOM 1670 H ARG A 206 56.582 -5.377 -2.859 1.00 0.00 H ATOM 1671 N ASP A 207 57.137 -2.091 -0.684 1.00 21.33 N ATOM 1672 CA ASP A 207 56.311 -1.438 0.318 1.00 21.32 C ATOM 1673 C ASP A 207 56.202 0.033 -0.079 1.00 22.49 C ATOM 1674 O ASP A 207 57.189 0.770 -0.023 1.00 22.57 O ATOM 1675 CB ASP A 207 56.970 -1.581 1.695 1.00 21.41 C ATOM 1676 CG ASP A 207 56.043 -1.237 2.851 1.00 20.70 C ATOM 1677 OD1 ASP A 207 55.069 -0.461 2.685 1.00 18.59 O ATOM 1678 OD2 ASP A 207 56.299 -1.772 3.955 1.00 23.57 O ATOM 1679 H ASP A 207 58.149 -1.856 -0.733 1.00 0.00 H ATOM 1680 N LYS A 208 55.017 0.439 -0.520 1.00 23.17 N ATOM 1681 CA LYS A 208 54.779 1.823 -0.907 1.00 24.44 C ATOM 1682 C LYS A 208 54.696 2.742 0.305 1.00 25.11 C ATOM 1683 O LYS A 208 54.790 3.951 0.154 1.00 24.93 O ATOM 1684 CB LYS A 208 53.489 1.944 -1.717 1.00 24.59 C ATOM 1685 CG LYS A 208 53.481 1.156 -3.002 1.00 26.01 C ATOM 1686 CD LYS A 208 54.640 1.541 -3.942 1.00 28.31 C ATOM 1687 CE LYS A 208 54.329 1.013 -5.349 1.00 31.83 C ATOM 1688 NZ LYS A 208 54.859 1.867 -6.466 1.00 32.85 N ATOM 1689 HZ1 LYS A 208 54.444 2.818 -6.401 1.00 0.00 H ATOM 1690 HZ2 LYS A 208 55.894 1.933 -6.389 1.00 0.00 H ATOM 1691 HZ3 LYS A 208 54.605 1.439 -7.379 1.00 0.00 H ATOM 1692 H LYS A 208 54.240 -0.248 -0.591 1.00 0.00 H ATOM 1693 N ARG A 209 54.499 2.172 1.497 1.00 25.20 N ATOM 1694 CA ARG A 209 54.396 2.979 2.716 1.00 25.84 C ATOM 1695 C ARG A 209 55.699 3.711 3.043 1.00 27.27 C ATOM 1696 O ARG A 209 55.669 4.878 3.439 1.00 27.48 O ATOM 1697 CB ARG A 209 53.912 2.153 3.903 1.00 24.98 C ATOM 1698 CG ARG A 209 52.458 1.725 3.760 1.00 23.73 C ATOM 1699 CD ARG A 209 52.026 0.653 4.779 1.00 23.81 C ATOM 1700 NE ARG A 209 52.946 -0.483 4.787 1.00 22.99 N ATOM 1701 CZ ARG A 209 52.897 -1.502 5.645 1.00 23.10 C ATOM 1702 NH1 ARG A 209 51.949 -1.573 6.562 1.00 21.29 N ATOM 1703 NH2 ARG A 209 53.806 -2.467 5.564 1.00 24.03 N ATOM 1704 HE ARG A 209 53.697 -0.497 4.068 1.00 0.00 H ATOM 1705 HH12 ARG A 209 51.925 -2.375 7.224 1.00 0.00 H ATOM 1706 HH11 ARG A 209 51.227 -0.827 6.622 1.00 0.00 H ATOM 1707 HH22 ARG A 209 53.776 -3.266 6.229 1.00 0.00 H ATOM 1708 HH21 ARG A 209 54.547 -2.423 4.836 1.00 0.00 H ATOM 1709 H ARG A 209 54.417 1.137 1.561 1.00 0.00 H ATOM 1710 N ASP A 210 56.833 3.036 2.839 1.00 28.08 N ATOM 1711 CA ASP A 210 58.131 3.585 3.189 1.00 29.31 C ATOM 1712 C ASP A 210 59.163 3.436 2.080 1.00 29.58 C ATOM 1713 O ASP A 210 60.296 3.846 2.249 1.00 30.30 O ATOM 1714 CB ASP A 210 58.661 2.958 4.479 1.00 29.40 C ATOM 1715 CG ASP A 210 58.822 1.437 4.376 1.00 32.58 C ATOM 1716 OD1 ASP A 210 58.705 0.876 3.261 1.00 33.55 O ATOM 1717 OD2 ASP A 210 59.070 0.801 5.420 1.00 34.38 O ATOM 1718 H ASP A 210 56.785 2.087 2.416 1.00 0.00 H ATOM 1719 N GLY A 211 58.775 2.858 0.949 1.00 29.66 N ATOM 1720 CA GLY A 211 59.686 2.683 -0.172 1.00 29.47 C ATOM 1721 C GLY A 211 60.645 1.504 -0.072 1.00 29.91 C ATOM 1722 O GLY A 211 61.503 1.345 -0.933 1.00 30.13 O ATOM 1723 H GLY A 211 57.795 2.522 0.862 1.00 0.00 H ATOM 1724 N LYS A 212 60.513 0.666 0.952 1.00 29.82 N ATOM 1725 CA LYS A 212 61.374 -0.522 1.052 1.00 30.54 C ATOM 1726 C LYS A 212 61.033 -1.592 -0.013 1.00 30.50 C ATOM 1727 O LYS A 212 59.863 -1.803 -0.343 1.00 29.81 O ATOM 1728 CB LYS A 212 61.325 -1.118 2.453 1.00 30.94 C ATOM 1729 CG LYS A 212 62.361 -2.217 2.690 1.00 33.82 C ATOM 1730 CD LYS A 212 62.487 -2.600 4.167 1.00 37.04 C ATOM 1731 CE LYS A 212 63.736 -3.476 4.359 1.00 38.98 C ATOM 1732 NZ LYS A 212 63.519 -4.520 5.403 1.00 40.87 N ATOM 1733 HZ1 LYS A 212 63.296 -4.061 6.309 1.00 0.00 H ATOM 1734 HZ2 LYS A 212 62.728 -5.133 5.120 1.00 0.00 H ATOM 1735 HZ3 LYS A 212 64.382 -5.091 5.505 1.00 0.00 H ATOM 1736 H LYS A 212 59.798 0.851 1.685 1.00 0.00 H ATOM 1737 N GLU A 213 62.071 -2.263 -0.520 1.00 30.47 N ATOM 1738 CA GLU A 213 61.958 -3.169 -1.656 1.00 30.82 C ATOM 1739 C GLU A 213 62.980 -4.319 -1.565 1.00 30.22 C ATOM 1740 O GLU A 213 64.088 -4.139 -1.060 1.00 29.77 O ATOM 1741 CB GLU A 213 62.182 -2.372 -2.936 1.00 31.28 C ATOM 1742 CG GLU A 213 61.614 -2.984 -4.182 1.00 35.56 C ATOM 1743 CD GLU A 213 61.903 -2.144 -5.422 1.00 40.01 C ATOM 1744 OE1 GLU A 213 62.776 -1.247 -5.324 1.00 41.21 O ATOM 1745 OE2 GLU A 213 61.266 -2.395 -6.487 1.00 41.97 O ATOM 1746 H GLU A 213 63.005 -2.132 -0.083 1.00 0.00 H ATOM 1747 N ASP A 214 62.597 -5.497 -2.053 1.00 28.86 N ATOM 1748 CA ASP A 214 63.485 -6.667 -2.084 1.00 28.16 C ATOM 1749 C ASP A 214 63.215 -7.476 -3.352 1.00 26.95 C ATOM 1750 O ASP A 214 62.094 -7.467 -3.864 1.00 26.76 O ATOM 1751 CB ASP A 214 63.267 -7.552 -0.845 1.00 28.54 C ATOM 1752 CG ASP A 214 64.068 -7.096 0.360 1.00 30.04 C ATOM 1753 OD1 ASP A 214 65.307 -7.219 0.312 1.00 33.08 O ATOM 1754 OD2 ASP A 214 63.470 -6.626 1.362 1.00 31.93 O ATOM 1755 H ASP A 214 61.631 -5.593 -2.427 1.00 0.00 H ATOM 1756 N HIS A 215 64.242 -8.154 -3.859 1.00 25.75 N ATOM 1757 CA HIS A 215 64.105 -9.067 -4.995 1.00 24.81 C ATOM 1758 C HIS A 215 64.618 -10.445 -4.569 1.00 25.23 C ATOM 1759 O HIS A 215 65.800 -10.582 -4.219 1.00 24.39 O ATOM 1760 CB HIS A 215 64.896 -8.535 -6.196 1.00 24.71 C ATOM 1761 CG HIS A 215 64.779 -9.374 -7.434 1.00 24.66 C ATOM 1762 ND1 HIS A 215 65.650 -9.254 -8.495 1.00 25.94 N ATOM 1763 CD2 HIS A 215 63.900 -10.346 -7.780 1.00 25.68 C ATOM 1764 CE1 HIS A 215 65.312 -10.111 -9.442 1.00 25.99 C ATOM 1765 NE2 HIS A 215 64.251 -10.784 -9.033 1.00 25.97 N ATOM 1766 H HIS A 215 65.181 -8.030 -3.430 1.00 0.00 H ATOM 1767 N PHE A 216 63.728 -11.446 -4.565 1.00 25.01 N ATOM 1768 CA PHE A 216 64.106 -12.828 -4.226 1.00 25.24 C ATOM 1769 C PHE A 216 64.105 -13.706 -5.467 1.00 26.07 C ATOM 1770 O PHE A 216 63.094 -13.800 -6.189 1.00 25.68 O ATOM 1771 CB PHE A 216 63.179 -13.433 -3.165 1.00 24.70 C ATOM 1772 CG PHE A 216 62.902 -12.515 -2.008 1.00 24.89 C ATOM 1773 CD1 PHE A 216 63.923 -12.154 -1.121 1.00 25.38 C ATOM 1774 CD2 PHE A 216 61.622 -11.998 -1.809 1.00 24.30 C ATOM 1775 CE1 PHE A 216 63.661 -11.278 -0.036 1.00 26.54 C ATOM 1776 CE2 PHE A 216 61.351 -11.132 -0.741 1.00 24.39 C ATOM 1777 CZ PHE A 216 62.373 -10.771 0.143 1.00 25.04 C ATOM 1778 H PHE A 216 62.738 -11.240 -4.809 1.00 0.00 H ATOM 1779 N HIS A 217 65.242 -14.347 -5.704 1.00 26.87 N ATOM 1780 CA HIS A 217 65.412 -15.261 -6.824 1.00 28.56 C ATOM 1781 C HIS A 217 66.663 -16.113 -6.604 1.00 28.73 C ATOM 1782 O HIS A 217 67.659 -15.624 -6.079 1.00 28.10 O ATOM 1783 CB HIS A 217 65.467 -14.501 -8.158 1.00 29.06 C ATOM 1784 CG HIS A 217 66.709 -13.693 -8.363 1.00 32.40 C ATOM 1785 ND1 HIS A 217 67.062 -12.640 -7.541 1.00 35.67 N ATOM 1786 CD2 HIS A 217 67.664 -13.755 -9.326 1.00 34.57 C ATOM 1787 CE1 HIS A 217 68.192 -12.102 -7.977 1.00 35.70 C ATOM 1788 NE2 HIS A 217 68.576 -12.759 -9.060 1.00 35.87 N ATOM 1789 H HIS A 217 66.046 -14.190 -5.063 1.00 0.00 H ATOM 1790 N TYR A 218 66.595 -17.383 -6.997 1.00 29.11 N ATOM 1791 CA TYR A 218 67.682 -18.341 -6.727 1.00 29.85 C ATOM 1792 C TYR A 218 68.027 -19.162 -7.955 1.00 30.98 C ATOM 1793 O TYR A 218 67.137 -19.579 -8.690 1.00 30.92 O ATOM 1794 CB TYR A 218 67.296 -19.299 -5.588 1.00 29.06 C ATOM 1795 CG TYR A 218 67.327 -18.658 -4.228 1.00 27.62 C ATOM 1796 CD1 TYR A 218 66.294 -17.810 -3.811 1.00 25.74 C ATOM 1797 CD2 TYR A 218 68.390 -18.887 -3.352 1.00 24.68 C ATOM 1798 CE1 TYR A 218 66.323 -17.202 -2.567 1.00 24.63 C ATOM 1799 CE2 TYR A 218 68.422 -18.289 -2.096 1.00 24.87 C ATOM 1800 CZ TYR A 218 67.389 -17.444 -1.713 1.00 24.15 C ATOM 1801 OH TYR A 218 67.406 -16.835 -0.487 1.00 24.02 O ATOM 1802 HH TYR A 218 66.596 -16.274 -0.387 1.00 0.00 H ATOM 1803 H TYR A 218 65.751 -17.709 -7.509 1.00 0.00 H ATOM 1804 N GLU A 219 69.320 -19.405 -8.157 1.00 32.61 N ATOM 1805 CA GLU A 219 69.792 -20.313 -9.209 1.00 34.25 C ATOM 1806 C GLU A 219 70.734 -21.376 -8.649 1.00 33.95 C ATOM 1807 O GLU A 219 71.603 -21.066 -7.827 1.00 34.16 O ATOM 1808 CB GLU A 219 70.466 -19.507 -10.322 1.00 35.02 C ATOM 1809 CG GLU A 219 69.454 -18.646 -11.112 1.00 39.48 C ATOM 1810 CD GLU A 219 70.094 -17.472 -11.845 1.00 44.48 C ATOM 1811 OE1 GLU A 219 69.699 -17.224 -13.011 1.00 46.99 O ATOM 1812 OE2 GLU A 219 70.980 -16.799 -11.261 1.00 45.78 O ATOM 1813 H GLU A 219 70.020 -18.935 -7.548 1.00 0.00 H TER 1814 GLU A 219 HETATM 1815 O HOH 1 35.082 -0.842 -18.367 1.00 38.03 O HETATM 1816 O HOH 2 29.197 -8.053 -0.284 1.00 34.18 O HETATM 1817 O HOH 3 53.300 -21.883 -3.273 1.00 38.77 O HETATM 1818 O HOH 4 39.212 -5.283 13.252 1.00 25.49 O HETATM 1819 O HOH 5 40.779 -13.134 19.973 1.00 33.41 O HETATM 1820 O HOH 6 52.652 -3.184 9.338 1.00 33.65 O HETATM 1821 O HOH 7 34.643 -10.571 4.396 1.00 27.48 O HETATM 1822 O HOH 8 48.402 -14.925 -14.915 1.00 13.56 O HETATM 1823 O HOH 9 47.673 -15.296 -22.230 1.00 20.29 O HETATM 1824 O HOH 10 44.091 -4.944 -28.115 1.00 26.78 O HETATM 1825 O HOH 11 50.092 -20.369 1.495 1.00 48.52 O HETATM 1826 O HOH 12 41.715 -0.185 6.745 1.00 26.85 O HETATM 1827 O HOH 13 33.529 -5.094 -13.620 1.00 28.43 O HETATM 1828 O HOH 14 50.079 -3.182 -30.766 1.00 24.54 O HETATM 1829 O HOH 15 63.953 -18.277 -8.136 1.00 28.12 O HETATM 1830 O HOH 16 51.196 -15.696 8.603 1.00 46.68 O HETATM 1831 O HOH 17 41.165 -3.502 4.949 1.00 17.97 O HETATM 1832 O HOH 18 41.750 -1.227 -15.456 1.00 17.78 O HETATM 1833 O HOH 19 42.919 2.992 -2.732 1.00 32.09 O HETATM 1834 O HOH 20 43.929 -0.960 -10.061 1.00 15.34 O HETATM 1835 O HOH 21 43.734 -1.779 9.499 1.00 21.06 O HETATM 1836 O HOH 22 46.954 -22.574 -8.967 1.00 33.48 O HETATM 1837 O HOH 23 51.009 -23.334 -0.237 1.00 59.02 O HETATM 1838 O HOH 24 62.411 -5.459 -6.148 1.00 48.84 O HETATM 1839 O HOH 25 35.652 -9.339 -20.194 1.00 38.32 O HETATM 1840 O HOH 26 45.281 -10.502 12.886 1.00 21.70 O HETATM 1841 O HOH 27 45.464 -20.173 -3.212 1.00 50.78 O HETATM 1842 O HOH 28 47.446 -20.972 -10.811 1.00 20.29 O HETATM 1843 O HOH 29 34.510 -11.745 -19.999 1.00 33.59 O HETATM 1844 O HOH 30 46.599 -13.610 -24.223 1.00 30.83 O HETATM 1845 O HOH 31 56.843 -15.262 7.403 1.00 31.15 O HETATM 1846 O HOH 32 48.570 2.681 10.517 1.00 12.16 O HETATM 1847 O HOH 33 37.285 -18.520 13.176 1.00 44.95 O HETATM 1848 O HOH 34 48.814 -2.332 3.166 1.00 14.67 O HETATM 1849 O HOH 35 52.125 -23.086 -5.359 1.00 29.08 O HETATM 1850 O HOH 36 35.947 -1.885 -13.308 1.00 26.88 O HETATM 1851 O HOH 37 54.587 -2.269 -7.258 1.00 34.14 O HETATM 1852 O HOH 38 42.452 -20.809 -5.811 1.00 24.45 O HETATM 1853 O HOH 39 52.108 -6.022 -6.849 1.00 12.58 O HETATM 1854 O HOH 40 36.142 -4.409 6.554 1.00 45.20 O HETATM 1855 O HOH 41 63.249 -16.750 4.715 1.00 30.96 O HETATM 1856 O HOH 42 35.789 -9.492 -1.597 1.00 18.05 O HETATM 1857 O HOH 43 45.374 -12.780 11.316 1.00 17.26 O HETATM 1858 O HOH 44 64.021 -12.786 3.687 1.00 33.77 O HETATM 1859 O HOH 45 47.235 -9.284 -24.159 1.00 19.06 O HETATM 1860 O HOH 46 51.761 -8.281 -17.299 1.00 31.91 O HETATM 1861 O HOH 47 36.621 0.424 -7.955 1.00 21.29 O HETATM 1862 O HOH 48 49.479 -8.404 -14.374 1.00 28.58 O HETATM 1863 O HOH 49 39.490 -11.855 15.249 1.00 30.87 O HETATM 1864 O HOH 50 54.962 -9.476 -12.748 1.00 23.08 O HETATM 1865 O HOH 51 57.024 -8.973 -16.991 1.00 46.10 O HETATM 1866 O HOH 52 38.014 -25.562 -3.086 1.00 39.77 O HETATM 1867 O HOH 53 47.462 -3.786 17.923 1.00 30.60 O HETATM 1868 O HOH 54 47.968 -21.820 -13.329 1.00 21.92 O HETATM 1869 O HOH 55 51.367 -4.537 11.288 1.00 35.08 O HETATM 1870 O HOH 56 46.960 -7.787 -14.689 1.00 16.12 O HETATM 1871 O HOH 57 52.880 -20.171 1.553 1.00 45.78 O HETATM 1872 O HOH 58 29.817 -14.739 -4.096 1.00 58.54 O HETATM 1873 O HOH 59 47.591 -2.261 -26.466 1.00 18.22 O HETATM 1874 O HOH 60 56.312 0.292 6.049 1.00 29.94 O HETATM 1875 O HOH 61 33.129 -5.611 -11.163 1.00 22.87 O HETATM 1876 O HOH 62 68.065 -22.630 -7.084 1.00 42.55 O HETATM 1877 O HOH 63 52.165 -6.617 15.707 1.00 33.46 O HETATM 1878 O HOH 64 56.205 -3.440 8.012 1.00 25.07 O HETATM 1879 O HOH 65 67.400 -6.992 -7.942 1.00 52.24 O HETATM 1880 O HOH 66 41.633 -4.779 16.619 1.00 28.92 O HETATM 1881 O HOH 67 31.827 -12.114 -14.664 1.00 34.65 O HETATM 1882 O HOH 68 42.460 -19.835 15.140 1.00 43.74 O HETATM 1883 O HOH 69 46.111 -1.837 -8.228 1.00 21.76 O HETATM 1884 O HOH 70 57.890 -5.396 9.114 1.00 27.91 O HETATM 1885 O HOH 71 28.444 -10.950 -12.394 1.00 42.04 O HETATM 1886 O HOH 72 33.248 -5.287 -21.378 1.00 37.08 O HETATM 1887 O HOH 73 64.842 -1.755 0.665 1.00 34.66 O HETATM 1888 O HOH 74 45.680 -16.116 -6.850 1.00 35.47 O HETATM 1889 O HOH 75 51.853 -12.196 12.698 1.00 34.43 O HETATM 1890 O HOH 76 57.011 -24.586 2.619 1.00 37.55 O HETATM 1891 O HOH 77 53.559 -9.972 -20.663 1.00 34.47 O HETATM 1892 O HOH 78 45.434 -22.899 -4.424 1.00 41.98 O HETATM 1893 O HOH 79 58.458 0.010 -2.765 1.00 45.46 O HETATM 1894 O HOH 80 39.971 -17.405 -21.535 1.00 38.35 O HETATM 1895 O HOH 81 37.419 -15.017 -23.359 1.00 42.88 O HETATM 1896 O HOH 82 38.143 -1.514 1.012 1.00 35.44 O HETATM 1897 O HOH 83 54.351 -22.610 5.185 1.00 58.34 O HETATM 1898 O HOH 84 67.007 -23.356 -4.565 1.00 33.87 O HETATM 1899 O HOH 85 53.303 -8.086 -14.352 1.00 42.44 O HETATM 1900 O HOH 86 39.534 -4.890 -26.954 1.00 39.57 O HETATM 1901 O HOH 87 64.969 -14.911 5.090 1.00 51.77 O HETATM 1902 O HOH 88 50.576 -15.690 -22.315 1.00 41.73 O HETATM 1903 O HOH 89 49.027 -24.031 -13.328 1.00 32.93 O HETATM 1904 O HOH 90 39.720 -5.782 -30.484 1.00 31.59 O HETATM 1905 O HOH 91 36.307 -13.747 12.873 1.00 37.32 O HETATM 1906 O HOH 92 54.610 1.381 7.288 1.00 35.37 O HETATM 1907 O HOH 93 47.094 -4.907 -14.360 1.00 25.93 O HETATM 1908 O HOH 94 66.359 -16.407 -10.447 1.00 38.64 O HETATM 1909 O HOH 95 58.227 6.412 0.591 1.00 63.67 O HETATM 1910 O HOH 96 46.235 -3.106 -16.124 1.00 23.25 O HETATM 1911 O HOH 97 32.430 -2.970 -14.368 1.00 32.34 O HETATM 1912 O HOH 98 44.315 1.428 -17.158 1.00 20.63 O HETATM 1913 O HOH 99 46.566 -3.860 -12.086 1.00 23.64 O HETATM 1914 O HOH 100 45.080 1.348 -19.761 1.00 22.49 O HETATM 1915 O HOH 101 44.985 -24.613 -10.403 1.00 36.66 O HETATM 1916 O1 G A 3 46.307 -16.206 -9.838 1.00 -0.39 O HETATM 1917 C2 G A 3 47.316 -15.762 -10.398 1.00 0.29 C HETATM 1918 N4 G A 3 48.010 -14.758 -9.865 1.00 -0.27 N HETATM 1919 C6 G A 3 47.696 -14.038 -8.641 1.00 0.03 C HETATM 1920 C9 G A 3 48.332 -12.656 -8.724 1.00 -0.04 C HETATM 1921 H4 G A 3 48.107 -12.093 -7.806 1.00 0.02 H HETATM 1922 H5 G A 3 47.927 -12.117 -9.593 1.00 0.02 H HETATM 1923 H6 G A 3 49.422 -12.760 -8.832 1.00 0.02 H HETATM 1924 H2 G A 3 48.100 -14.582 -7.775 1.00 0.05 H HETATM 1925 H3 G A 3 46.605 -13.940 -8.536 1.00 0.05 H HETATM 1926 H1 G A 3 48.831 -14.470 -10.357 1.00 0.19 H HETATM 1927 N3 G A 3 47.789 -16.241 -11.559 1.00 -0.21 N HETATM 1928 C5 G A 3 47.099 -17.062 -12.390 1.00 0.13 C HETATM 1929 C8 G A 3 46.165 -18.008 -11.924 1.00 -0.02 C HETATM 1930 C11 G A 3 45.500 -18.830 -12.845 1.00 -0.02 C HETATM 1931 C13 G A 3 44.545 -19.783 -12.437 1.00 -0.02 C HETATM 1932 C15 G A 3 44.123 -19.983 -11.011 1.00 -0.01 C HETATM 1933 C20 G A 3 43.856 -21.261 -10.493 1.00 -0.03 C HETATM 1934 C23 G A 3 43.410 -21.385 -9.169 1.00 0.01 C HETATM 1935 N26 G A 3 43.213 -20.293 -8.404 1.00 -0.30 N HETATM 1936 C22 G A 3 43.444 -19.048 -8.880 1.00 0.01 C HETATM 1937 C19 G A 3 43.875 -18.861 -10.197 1.00 -0.03 C HETATM 1938 H12 G A 3 44.017 -17.860 -10.588 1.00 0.07 H HETATM 1939 H11 G A 3 43.294 -18.189 -8.236 1.00 0.08 H HETATM 1940 H10 G A 3 43.222 -22.370 -8.757 1.00 0.08 H HETATM 1941 H9 G A 3 43.993 -22.142 -11.110 1.00 0.07 H HETATM 1942 C16 G A 3 43.919 -20.578 -13.408 1.00 -0.06 C HETATM 1943 C18 G A 3 44.214 -20.434 -14.768 1.00 -0.03 C HETATM 1944 C14 G A 3 45.151 -19.484 -15.190 1.00 0.08 C HETATM 1945 C12 G A 3 45.803 -18.703 -14.213 1.00 0.03 C HETATM 1946 C10 G A 3 46.749 -17.741 -14.609 1.00 0.01 C HETATM 1947 N7 G A 3 47.368 -16.974 -13.707 1.00 -0.28 N HETATM 1948 H15 G A 3 46.979 -17.620 -15.661 1.00 0.09 H HETATM 1949 N17 G A 3 45.448 -19.302 -16.518 1.00 -0.26 N HETATM 1950 C21 G A 3 45.190 -20.137 -17.577 1.00 0.09 C HETATM 1951 C25 G A 3 45.415 -21.515 -17.497 1.00 -0.02 C HETATM 1952 C28 G A 3 45.157 -22.322 -18.608 1.00 -0.04 C HETATM 1953 C29 G A 3 44.682 -21.741 -19.784 1.00 -0.00 C HETATM 1954 N27 G A 3 44.486 -20.409 -19.837 1.00 -0.31 N HETATM 1955 C24 G A 3 44.727 -19.609 -18.778 1.00 0.03 C HETATM 1956 H20 G A 3 44.558 -18.542 -18.864 1.00 0.07 H HETATM 1957 H19 G A 3 44.472 -22.358 -20.650 1.00 0.07 H HETATM 1958 H18 G A 3 45.325 -23.392 -18.556 1.00 0.07 H HETATM 1959 H17 G A 3 45.787 -21.954 -16.579 1.00 0.07 H HETATM 1960 H16 G A 3 45.929 -18.421 -16.751 1.00 0.22 H HETATM 1961 H14 G A 3 43.715 -21.061 -15.498 1.00 0.05 H HETATM 1962 H13 G A 3 43.191 -21.320 -13.098 1.00 0.06 H HETATM 1963 H8 G A 3 45.962 -18.100 -10.863 1.00 0.05 H HETATM 1964 H7 G A 3 48.714 -15.974 -11.830 1.00 0.23 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 793 794 800 801 802 CONECT 800 793 CONECT 801 793 CONECT 802 793 CONECT 1916 1917 CONECT 1917 1916 1918 1927 CONECT 1918 1917 1919 1926 CONECT 1919 1918 1920 1924 1925 CONECT 1920 1919 1921 1922 1923 CONECT 1921 1920 CONECT 1922 1920 CONECT 1923 1920 CONECT 1924 1919 CONECT 1925 1919 CONECT 1926 1918 CONECT 1927 1917 1928 1964 CONECT 1928 1927 1929 1947 CONECT 1929 1928 1930 1963 CONECT 1930 1929 1931 1945 CONECT 1931 1930 1932 1942 CONECT 1932 1931 1933 1937 CONECT 1933 1932 1934 1941 CONECT 1934 1933 1935 1940 CONECT 1935 1934 1936 CONECT 1936 1935 1937 1939 CONECT 1937 1932 1936 1938 CONECT 1938 1937 CONECT 1939 1936 CONECT 1940 1934 CONECT 1941 1933 CONECT 1942 1931 1943 1962 CONECT 1943 1942 1944 1961 CONECT 1944 1943 1945 1949 CONECT 1945 1930 1944 1946 CONECT 1946 1945 1947 1948 CONECT 1947 1928 1946 CONECT 1948 1946 CONECT 1949 1944 1950 1960 CONECT 1950 1949 1951 1955 CONECT 1951 1950 1952 1959 CONECT 1952 1951 1953 1958 CONECT 1953 1952 1954 1957 CONECT 1954 1953 1955 CONECT 1955 1950 1954 1956 CONECT 1956 1955 CONECT 1957 1953 CONECT 1958 1952 CONECT 1959 1951 CONECT 1960 1949 CONECT 1961 1943 CONECT 1962 1942 CONECT 1963 1929 CONECT 1964 1927 MASTER 0 0 0 0 0 0 0 0 1962 2 57 15 END
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Related entries of code: 5mmp
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5mmn
RCSB PDB
PDBbind
234aa, >5MMN_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5mmp
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DNA gyrase subunit B
Ligand Name
G3Z
EC.Number
E.C.5.99.1.3
Resolution
2.05(Å)
Affinity (Kd/Ki/IC50)
IC50=0.03uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 3755-3775
Ligand Properties
Formula
C
2
2
H
2
0
N
6
O
Molecular Weight
384.434
Exact Mass
384.170
No. of atoms
49
No. of bonds
52
Polar Surface Area
91.83
LOGP Value
2.84 (
Computed with XLOGP3
)
5.11 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
Canonical SMILES
CCNC(=O)Nc1ncc2c(c1)c(ccc2Nc1cccnc1)c1ccncc1
InChI String
InChI=1S/C22H20N6O/c1-2-25-22(29)28-21-12-18-17(15-7-10-23-11-8-15)5-6-20(19(18)14-26-21)27-16-4-3-9-24-13-16/h3-14,27H,2H2,1H3,(H2,25,26,28,29)
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P0AES6
Entrez Gene ID
NCBI Entrez Gene ID:
61752852
948211
ASD
Information of known allosteric effects of PDB entries
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