Browse entries in the PDBbind-CN Database
HEADER 6AHS_COMPLEX COMPND 6AHS_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 224 ILE ILE ASP GLY TYR LYS CYS LYS GLU GLY SER HIS PRO SEQRES 2 A 224 TRP GLN VAL ALA LEU LEU LYS GLY ASN GLN LEU HIS CYS SEQRES 3 A 224 GLY GLY VAL LEU VAL ASP LYS TYR TRP VAL LEU THR ALA SEQRES 4 A 224 ALA HIS CYS LYS MET GLY GLN TYR GLN VAL GLN LEU GLY SEQRES 5 A 224 SER ASP LYS ILE GLY ASP GLN SER ALA GLN LYS ILE LYS SEQRES 6 A 224 ALA THR LYS SER PHE ARG HIS PRO GLY TYR SER THR LYS SEQRES 7 A 224 THR HIS VAL ASN ASP ILE MET LEU VAL ARG LEU ASP GLU SEQRES 8 A 224 PRO VAL LYS MET SER SER LYS VAL GLU ALA VAL GLN LEU SEQRES 9 A 224 PRO GLU HIS CYS GLU PRO PRO GLY THR SER CYS THR VAL SEQRES 10 A 224 SER GLY TRP GLY THR THR THR SER PRO ASP VAL THR PHE SEQRES 11 A 224 PRO SER ASP LEU MET CYS SER ASP VAL LYS LEU ILE SER SEQRES 12 A 224 SER ARG GLU CYS LYS LYS VAL TYR LYS ASP LEU LEU GLY SEQRES 13 A 224 LYS THR MET LEU CYS ALA GLY ILE PRO ASP SER LYS THR SEQRES 14 A 224 ASN THR CYS ASN GLY ASP SER GLY GLY PRO LEU VAL CYS SEQRES 15 A 224 ASN ASP THR LEU GLN GLY LEU VAL SER TRP GLY THR TYR SEQRES 16 A 224 PRO CYS GLY GLN PRO ASN ASP PRO GLY VAL TYR THR GLN SEQRES 17 A 224 VAL CYS LYS TYR LYS ARG TRP VAL MET GLU THR MET LYS SEQRES 18 A 224 THR HIS ARG HET MOL A 367 44 SSBOND 1 CYS A 42 CYS A 58 SSBOND 2 CYS A 22 CYS A 157 SSBOND 3 CYS A 168 CYS A 182 SSBOND 4 CYS A 136 CYS A 201 SSBOND 5 CYS A 191 CYS A 220 SSBOND 6 CYS A 129 CYS A 232 ATOM 1 N ILE A 16 -10.720 17.149 45.544 1.00 22.22 N ATOM 2 CA ILE A 16 -11.784 16.092 45.593 1.00 22.38 C ATOM 3 C ILE A 16 -11.204 14.753 46.093 1.00 23.51 C ATOM 4 O ILE A 16 -10.196 14.287 45.538 1.00 22.84 O ATOM 5 CB ILE A 16 -12.451 15.864 44.227 1.00 21.30 C ATOM 6 CG1 ILE A 16 -13.113 17.144 43.690 1.00 21.00 C ATOM 7 CG2 ILE A 16 -13.431 14.681 44.283 1.00 22.80 C ATOM 8 CD1 ILE A 16 -14.325 17.610 44.337 1.00 19.75 C ATOM 9 HN3 ILE A 16 -9.964 16.848 44.897 1.00 0.00 H ATOM 10 HN2 ILE A 16 -10.327 17.288 46.497 1.00 0.00 H ATOM 11 HN1 ILE A 16 -11.134 18.041 45.205 1.00 0.00 H ATOM 12 N ILE A 17 -11.677 14.294 47.298 1.00 24.29 N ATOM 13 CA ILE A 17 -11.324 12.999 47.850 1.00 24.23 C ATOM 14 C ILE A 17 -12.143 11.867 47.257 1.00 23.40 C ATOM 15 O ILE A 17 -13.381 11.983 47.104 1.00 22.97 O ATOM 16 CB ILE A 17 -11.532 12.951 49.395 1.00 24.02 C ATOM 17 CG1 ILE A 17 -10.930 14.183 50.051 1.00 22.98 C ATOM 18 CG2 ILE A 17 -10.924 11.686 49.939 1.00 25.18 C ATOM 19 CD1 ILE A 17 -9.460 14.447 49.737 1.00 24.51 C ATOM 20 H ILE A 17 -12.320 14.905 47.842 1.00 0.00 H ATOM 21 N ASP A 18 -11.453 10.803 46.854 1.00 24.78 N ATOM 22 CA ASP A 18 -12.100 9.589 46.383 1.00 23.32 C ATOM 23 C ASP A 18 -13.104 9.947 45.265 1.00 22.24 C ATOM 24 O ASP A 18 -14.207 9.484 45.280 1.00 20.97 O ATOM 25 CB ASP A 18 -12.829 8.880 47.515 1.00 25.73 C ATOM 26 CG ASP A 18 -12.843 7.390 47.352 1.00 28.13 C ATOM 27 OD1 ASP A 18 -12.374 6.842 46.289 1.00 23.61 O ATOM 28 OD2 ASP A 18 -13.324 6.741 48.247 1.00 24.29 O ATOM 29 H ASP A 18 -10.414 10.841 46.877 1.00 0.00 H ATOM 30 N GLY A 19 -12.578 10.581 44.220 1.00 23.35 N ATOM 31 CA GLY A 19 -13.318 10.988 43.100 1.00 20.43 C ATOM 32 C GLY A 19 -12.828 10.287 41.837 1.00 23.17 C ATOM 33 O GLY A 19 -12.060 9.299 41.884 1.00 22.27 O ATOM 34 H GLY A 19 -11.559 10.787 44.234 1.00 0.00 H ATOM 35 N TYR A 20 -13.225 10.851 40.725 1.00 21.57 N ATOM 36 CA TYR A 20 -12.898 10.302 39.402 1.00 22.06 C ATOM 37 C TYR A 20 -12.597 11.497 38.502 1.00 22.19 C ATOM 38 O TYR A 20 -13.120 12.570 38.721 1.00 21.48 O ATOM 39 CB TYR A 20 -14.055 9.465 38.793 1.00 20.55 C ATOM 40 CG TYR A 20 -15.411 10.138 38.651 1.00 21.20 C ATOM 41 CD1 TYR A 20 -16.228 10.326 39.753 1.00 23.57 C ATOM 42 CD2 TYR A 20 -15.859 10.624 37.421 1.00 21.01 C ATOM 43 CE1 TYR A 20 -17.458 10.911 39.655 1.00 21.74 C ATOM 44 CE2 TYR A 20 -17.078 11.253 37.307 1.00 21.70 C ATOM 45 CZ TYR A 20 -17.874 11.420 38.450 1.00 26.35 C ATOM 46 OH TYR A 20 -19.092 12.042 38.389 1.00 27.53 O ATOM 47 HH TYR A 20 -19.497 12.062 39.292 1.00 0.00 H ATOM 48 H TYR A 20 -13.793 11.720 40.780 1.00 0.00 H ATOM 49 N LYS A 21 -11.842 11.291 37.428 1.00 23.96 N ATOM 50 CA LYS A 21 -11.670 12.347 36.470 1.00 24.89 C ATOM 51 C LYS A 21 -13.008 12.618 35.738 1.00 24.69 C ATOM 52 O LYS A 21 -13.578 11.688 35.097 1.00 26.42 O ATOM 53 CB LYS A 21 -10.590 11.978 35.414 1.00 29.61 C ATOM 54 CG LYS A 21 -9.198 11.795 35.969 1.00 33.05 C ATOM 55 CD LYS A 21 -8.239 11.226 34.878 1.00 37.73 C ATOM 56 CE LYS A 21 -6.965 10.678 35.479 1.00 46.59 C ATOM 57 NZ LYS A 21 -5.755 11.473 35.088 1.00 58.90 N ATOM 58 HZ1 LYS A 21 -5.652 11.460 34.053 1.00 0.00 H ATOM 59 HZ2 LYS A 21 -5.866 12.454 35.414 1.00 0.00 H ATOM 60 HZ3 LYS A 21 -4.910 11.055 35.527 1.00 0.00 H ATOM 61 H LYS A 21 -11.379 10.371 37.282 1.00 0.00 H ATOM 62 N CYS A 22 -13.459 13.882 35.781 1.00 23.74 N ATOM 63 CA CYS A 22 -14.691 14.317 35.152 1.00 25.21 C ATOM 64 C CYS A 22 -14.587 14.044 33.677 1.00 25.69 C ATOM 65 O CYS A 22 -13.545 14.227 33.094 1.00 26.80 O ATOM 66 CB CYS A 22 -14.907 15.820 35.349 1.00 24.03 C ATOM 67 SG CYS A 22 -14.894 16.380 37.108 1.00 23.74 S ATOM 68 H CYS A 22 -12.893 14.588 36.294 1.00 0.00 H ATOM 69 N LYS A 23 -15.686 13.645 33.094 1.00 28.11 N ATOM 70 CA LYS A 23 -15.742 13.324 31.686 1.00 30.47 C ATOM 71 C LYS A 23 -15.555 14.573 30.826 1.00 28.47 C ATOM 72 O LYS A 23 -16.132 15.641 31.083 1.00 25.16 O ATOM 73 CB LYS A 23 -17.086 12.657 31.403 1.00 33.91 C ATOM 74 CG LYS A 23 -17.095 11.742 30.218 1.00 37.86 C ATOM 75 CD LYS A 23 -18.382 10.918 30.216 1.00 36.38 C ATOM 76 CE LYS A 23 -18.740 10.498 28.794 1.00 36.56 C ATOM 77 NZ LYS A 23 -17.868 9.422 28.391 1.00 38.40 N ATOM 78 HZ1 LYS A 23 -16.881 9.747 28.424 1.00 0.00 H ATOM 79 HZ2 LYS A 23 -17.991 8.617 29.038 1.00 0.00 H ATOM 80 HZ3 LYS A 23 -18.106 9.129 27.422 1.00 0.00 H ATOM 81 H LYS A 23 -16.552 13.555 33.664 1.00 0.00 H ATOM 82 N GLU A 24 -14.704 14.455 29.827 1.00 30.62 N ATOM 83 CA GLU A 24 -14.488 15.517 28.841 1.00 33.55 C ATOM 84 C GLU A 24 -15.831 16.110 28.400 1.00 31.37 C ATOM 85 O GLU A 24 -16.749 15.360 28.159 1.00 33.71 O ATOM 86 CB GLU A 24 -13.803 14.864 27.618 1.00 39.89 C ATOM 87 CG GLU A 24 -13.524 15.804 26.471 1.00 50.09 C ATOM 88 CD GLU A 24 -12.373 16.745 26.766 1.00 54.19 C ATOM 89 OE1 GLU A 24 -11.677 16.548 27.791 1.00 63.57 O ATOM 90 OE2 GLU A 24 -12.126 17.643 25.940 1.00 67.80 O ATOM 91 H GLU A 24 -14.163 13.571 29.735 1.00 0.00 H ATOM 92 N GLY A 25 -15.977 17.443 28.470 1.00 31.41 N ATOM 93 CA GLY A 25 -17.188 18.165 27.994 1.00 31.52 C ATOM 94 C GLY A 25 -18.371 18.255 28.953 1.00 32.19 C ATOM 95 O GLY A 25 -19.295 19.004 28.730 1.00 29.87 O ATOM 96 H GLY A 25 -15.201 18.002 28.879 1.00 0.00 H ATOM 97 N SER A 26 -18.366 17.447 30.008 1.00 28.16 N ATOM 98 CA SER A 26 -19.496 17.395 30.920 1.00 29.31 C ATOM 99 C SER A 26 -19.545 18.578 31.962 1.00 27.22 C ATOM 100 O SER A 26 -20.564 18.749 32.668 1.00 27.82 O ATOM 101 CB SER A 26 -19.488 16.071 31.684 1.00 29.31 C ATOM 102 OG SER A 26 -19.997 15.017 30.894 1.00 30.76 O ATOM 103 HG SER A 26 -19.978 14.176 31.416 1.00 0.00 H ATOM 104 H SER A 26 -17.539 16.841 30.184 1.00 0.00 H ATOM 105 N HIS A 27 -18.449 19.353 32.058 1.00 24.81 N ATOM 106 CA HIS A 27 -18.353 20.424 33.050 1.00 23.68 C ATOM 107 C HIS A 27 -17.876 21.729 32.461 1.00 23.30 C ATOM 108 O HIS A 27 -16.873 22.271 32.873 1.00 23.06 O ATOM 109 CB HIS A 27 -17.531 19.948 34.265 1.00 22.88 C ATOM 110 CG HIS A 27 -18.004 18.654 34.788 1.00 22.85 C ATOM 111 ND1 HIS A 27 -18.930 18.552 35.825 1.00 26.40 N ATOM 112 CD2 HIS A 27 -17.887 17.409 34.268 1.00 23.42 C ATOM 113 CE1 HIS A 27 -19.283 17.284 35.958 1.00 26.41 C ATOM 114 NE2 HIS A 27 -18.643 16.569 35.042 1.00 27.75 N ATOM 115 H HIS A 27 -17.651 19.187 31.412 1.00 0.00 H ATOM 116 N PRO A 28 -18.567 22.214 31.399 1.00 24.01 N ATOM 117 CA PRO A 28 -18.063 23.362 30.632 1.00 24.22 C ATOM 118 C PRO A 28 -18.241 24.667 31.361 1.00 23.08 C ATOM 119 O PRO A 28 -17.679 25.638 30.983 1.00 22.63 O ATOM 120 CB PRO A 28 -18.923 23.335 29.354 1.00 25.24 C ATOM 121 CG PRO A 28 -20.216 22.762 29.819 1.00 24.05 C ATOM 122 CD PRO A 28 -19.823 21.703 30.843 1.00 24.68 C ATOM 123 N TRP A 29 -18.862 24.627 32.529 1.00 21.64 N ATOM 124 CA TRP A 29 -19.035 25.795 33.317 1.00 21.85 C ATOM 125 C TRP A 29 -17.946 25.931 34.392 1.00 21.92 C ATOM 126 O TRP A 29 -17.888 26.959 35.098 1.00 20.39 O ATOM 127 CB TRP A 29 -20.436 25.732 34.011 1.00 23.69 C ATOM 128 CG TRP A 29 -20.698 24.419 34.573 1.00 25.20 C ATOM 129 CD1 TRP A 29 -20.145 23.879 35.769 1.00 23.69 C ATOM 130 CD2 TRP A 29 -21.558 23.441 34.071 1.00 24.68 C ATOM 131 NE1 TRP A 29 -20.584 22.647 35.957 1.00 22.83 N ATOM 132 CE2 TRP A 29 -21.484 22.332 34.953 1.00 24.08 C ATOM 133 CE3 TRP A 29 -22.399 23.371 32.971 1.00 27.28 C ATOM 134 CZ2 TRP A 29 -22.137 21.176 34.722 1.00 27.24 C ATOM 135 CZ3 TRP A 29 -23.104 22.227 32.783 1.00 27.97 C ATOM 136 CH2 TRP A 29 -22.885 21.100 33.597 1.00 28.27 C ATOM 137 HE1 TRP A 29 -20.300 22.016 36.733 1.00 0.00 H ATOM 138 H TRP A 29 -19.232 23.719 32.877 1.00 0.00 H ATOM 139 N GLN A 30 -17.143 24.881 34.623 1.00 21.60 N ATOM 140 CA GLN A 30 -16.124 24.975 35.689 1.00 22.84 C ATOM 141 C GLN A 30 -15.080 26.022 35.282 1.00 22.01 C ATOM 142 O GLN A 30 -14.613 26.019 34.161 1.00 22.99 O ATOM 143 CB GLN A 30 -15.442 23.646 35.900 1.00 22.86 C ATOM 144 CG GLN A 30 -14.284 23.706 36.855 1.00 20.43 C ATOM 145 CD GLN A 30 -14.751 23.623 38.283 1.00 20.49 C ATOM 146 OE1 GLN A 30 -15.575 22.820 38.590 1.00 20.49 O ATOM 147 NE2 GLN A 30 -14.123 24.396 39.178 1.00 21.62 N ATOM 148 HE22 GLN A 30 -13.410 25.084 38.862 1.00 0.00 H ATOM 149 HE21 GLN A 30 -14.348 24.309 40.190 1.00 0.00 H ATOM 150 H GLN A 30 -17.237 24.012 34.059 1.00 0.00 H ATOM 151 N VAL A 31 -14.698 26.887 36.200 1.00 20.12 N ATOM 152 CA VAL A 31 -13.538 27.698 36.031 1.00 21.04 C ATOM 153 C VAL A 31 -12.615 27.586 37.207 1.00 21.56 C ATOM 154 O VAL A 31 -12.991 27.061 38.264 1.00 20.89 O ATOM 155 CB VAL A 31 -13.862 29.163 35.763 1.00 21.49 C ATOM 156 CG1 VAL A 31 -14.897 29.285 34.703 1.00 22.26 C ATOM 157 CG2 VAL A 31 -14.331 29.862 36.992 1.00 19.51 C ATOM 158 H VAL A 31 -15.258 26.980 37.071 1.00 0.00 H ATOM 159 N ALA A 32 -11.350 27.882 36.954 1.00 22.44 N ATOM 160 CA ALA A 32 -10.348 28.015 38.052 1.00 20.95 C ATOM 161 C ALA A 32 -10.095 29.469 38.284 1.00 23.62 C ATOM 162 O ALA A 32 -9.817 30.234 37.340 1.00 20.82 O ATOM 163 CB ALA A 32 -9.054 27.333 37.699 1.00 22.92 C ATOM 164 H ALA A 32 -11.048 28.025 35.969 1.00 0.00 H ATOM 165 N LEU A 33 -10.158 29.880 39.556 1.00 19.25 N ATOM 166 CA LEU A 33 -9.703 31.169 39.939 1.00 20.41 C ATOM 167 C LEU A 33 -8.287 31.101 40.405 1.00 21.09 C ATOM 168 O LEU A 33 -7.978 30.328 41.340 1.00 22.06 O ATOM 169 CB LEU A 33 -10.604 31.739 41.071 1.00 21.04 C ATOM 170 CG LEU A 33 -12.104 31.782 40.730 1.00 22.10 C ATOM 171 CD1 LEU A 33 -12.931 32.313 41.900 1.00 24.19 C ATOM 172 CD2 LEU A 33 -12.365 32.607 39.557 1.00 22.76 C ATOM 173 H LEU A 33 -10.548 29.242 40.279 1.00 0.00 H ATOM 174 N LEU A 34 -7.380 31.715 39.655 1.00 22.60 N ATOM 175 CA LEU A 34 -5.960 31.625 39.934 1.00 24.43 C ATOM 176 C LEU A 34 -5.419 32.873 40.570 1.00 25.86 C ATOM 177 O LEU A 34 -5.843 33.994 40.246 1.00 23.86 O ATOM 178 CB LEU A 34 -5.156 31.334 38.675 1.00 24.92 C ATOM 179 CG LEU A 34 -5.604 30.178 37.849 1.00 26.67 C ATOM 180 CD1 LEU A 34 -4.765 30.135 36.609 1.00 29.04 C ATOM 181 CD2 LEU A 34 -5.555 28.886 38.681 1.00 25.34 C ATOM 182 H LEU A 34 -7.698 32.279 38.841 1.00 0.00 H ATOM 183 N LYS A 35 -4.519 32.674 41.533 1.00 26.51 N ATOM 184 CA LYS A 35 -3.698 33.742 42.080 1.00 29.01 C ATOM 185 C LYS A 35 -2.375 33.724 41.360 1.00 30.61 C ATOM 186 O LYS A 35 -1.541 32.804 41.566 1.00 33.23 O ATOM 187 CB LYS A 35 -3.476 33.518 43.611 1.00 29.06 C ATOM 188 CG LYS A 35 -2.639 34.579 44.294 1.00 33.11 C ATOM 189 CD LYS A 35 -2.160 34.157 45.703 1.00 33.54 C ATOM 190 CE LYS A 35 -3.295 34.064 46.677 1.00 36.31 C ATOM 191 NZ LYS A 35 -2.879 33.470 48.021 1.00 39.19 N ATOM 192 HZ1 LYS A 35 -2.508 32.510 47.874 1.00 0.00 H ATOM 193 HZ2 LYS A 35 -2.142 34.066 48.449 1.00 0.00 H ATOM 194 HZ3 LYS A 35 -3.705 33.431 48.652 1.00 0.00 H ATOM 195 H LYS A 35 -4.399 31.712 41.910 1.00 0.00 H ATOM 196 N GLY A 36 -2.232 34.601 40.378 1.00 34.60 N ATOM 197 CA GLY A 36 -1.131 34.498 39.464 1.00 33.94 C ATOM 198 C GLY A 36 -1.329 33.268 38.561 1.00 35.57 C ATOM 199 O GLY A 36 -2.234 33.250 37.731 1.00 35.73 O ATOM 200 H GLY A 36 -2.923 35.370 40.269 1.00 0.00 H ATOM 201 N ASN A 38 -0.584 32.211 38.841 1.00 32.86 N ATOM 202 CA ASN A 38 -0.682 30.971 38.086 1.00 34.75 C ATOM 203 C ASN A 38 -1.118 29.848 38.934 1.00 34.75 C ATOM 204 O ASN A 38 -1.170 28.719 38.485 1.00 34.45 O ATOM 205 CB ASN A 38 0.665 30.602 37.528 1.00 41.60 C ATOM 206 CG ASN A 38 1.056 31.464 36.398 1.00 50.27 C ATOM 207 OD1 ASN A 38 0.200 32.047 35.723 1.00 61.08 O ATOM 208 ND2 ASN A 38 2.346 31.526 36.128 1.00 55.66 N ATOM 209 HD22 ASN A 38 3.028 31.017 36.726 1.00 0.00 H ATOM 210 HD21 ASN A 38 2.681 32.084 35.317 1.00 0.00 H ATOM 211 H ASN A 38 0.094 32.268 39.627 1.00 0.00 H ATOM 212 N GLN A 39 -1.355 30.116 40.201 1.00 31.34 N ATOM 213 CA GLN A 39 -1.604 29.047 41.089 1.00 32.27 C ATOM 214 C GLN A 39 -3.083 29.004 41.491 1.00 27.96 C ATOM 215 O GLN A 39 -3.754 30.041 41.510 1.00 27.08 O ATOM 216 CB GLN A 39 -0.668 29.176 42.255 1.00 35.77 C ATOM 217 CG GLN A 39 -1.232 28.845 43.587 1.00 46.73 C ATOM 218 CD GLN A 39 -0.146 28.858 44.621 1.00 52.15 C ATOM 219 OE1 GLN A 39 0.635 29.813 44.667 1.00 60.31 O ATOM 220 NE2 GLN A 39 0.104 27.700 45.214 1.00 54.92 N ATOM 221 HE22 GLN A 39 -0.584 26.923 45.148 1.00 0.00 H ATOM 222 HE21 GLN A 39 0.988 27.568 45.745 1.00 0.00 H ATOM 223 H GLN A 39 -1.359 31.099 40.542 1.00 0.00 H ATOM 224 N LEU A 40 -3.604 27.790 41.632 1.00 25.48 N ATOM 225 CA LEU A 40 -4.996 27.548 42.001 1.00 23.18 C ATOM 226 C LEU A 40 -5.328 28.226 43.346 1.00 24.32 C ATOM 227 O LEU A 40 -4.618 28.033 44.316 1.00 23.13 O ATOM 228 CB LEU A 40 -5.240 26.065 42.215 1.00 24.79 C ATOM 229 CG LEU A 40 -6.666 25.667 42.718 1.00 23.04 C ATOM 230 CD1 LEU A 40 -7.820 26.051 41.805 1.00 24.17 C ATOM 231 CD2 LEU A 40 -6.803 24.188 43.046 1.00 23.20 C ATOM 232 H LEU A 40 -2.987 26.968 41.471 1.00 0.00 H ATOM 233 N HIS A 41 -6.361 29.029 43.346 1.00 24.55 N ATOM 234 CA HIS A 41 -6.884 29.615 44.565 1.00 22.77 C ATOM 235 C HIS A 41 -8.241 29.007 44.888 1.00 23.34 C ATOM 236 O HIS A 41 -8.432 28.514 45.961 1.00 22.72 O ATOM 237 CB HIS A 41 -6.984 31.114 44.421 1.00 24.85 C ATOM 238 CG HIS A 41 -7.400 31.804 45.670 1.00 26.22 C ATOM 239 ND1 HIS A 41 -6.602 31.839 46.785 1.00 25.31 N ATOM 240 CD2 HIS A 41 -8.538 32.463 45.995 1.00 26.30 C ATOM 241 CE1 HIS A 41 -7.186 32.576 47.724 1.00 28.64 C ATOM 242 NE2 HIS A 41 -8.374 32.944 47.283 1.00 26.91 N ATOM 243 H HIS A 41 -6.822 29.255 42.442 1.00 0.00 H ATOM 244 N CYS A 42 -9.170 28.926 43.901 1.00 20.54 N ATOM 245 CA CYS A 42 -10.523 28.393 44.162 1.00 20.45 C ATOM 246 C CYS A 42 -11.088 27.913 42.839 1.00 22.62 C ATOM 247 O CYS A 42 -10.607 28.345 41.778 1.00 19.78 O ATOM 248 CB CYS A 42 -11.432 29.487 44.683 1.00 20.78 C ATOM 249 SG CYS A 42 -11.300 29.748 46.516 1.00 22.65 S ATOM 250 H CYS A 42 -8.924 29.245 42.942 1.00 0.00 H ATOM 251 N GLY A 43 -12.164 27.190 42.912 1.00 20.93 N ATOM 252 CA GLY A 43 -12.988 26.860 41.732 1.00 21.42 C ATOM 253 C GLY A 43 -14.049 27.931 41.612 1.00 20.68 C ATOM 254 O GLY A 43 -14.114 28.842 42.446 1.00 19.99 O ATOM 255 H GLY A 43 -12.458 26.828 43.841 1.00 0.00 H ATOM 256 N GLY A 44 -14.781 27.924 40.502 1.00 21.28 N ATOM 257 CA GLY A 44 -15.905 28.788 40.336 1.00 20.74 C ATOM 258 C GLY A 44 -16.725 28.300 39.162 1.00 20.63 C ATOM 259 O GLY A 44 -16.494 27.223 38.656 1.00 20.25 O ATOM 260 H GLY A 44 -14.528 27.271 39.733 1.00 0.00 H ATOM 261 N VAL A 45 -17.831 28.956 38.922 1.00 22.36 N ATOM 262 CA VAL A 45 -18.767 28.471 37.927 1.00 24.39 C ATOM 263 C VAL A 45 -19.337 29.554 37.073 1.00 21.95 C ATOM 264 O VAL A 45 -19.841 30.568 37.537 1.00 21.22 O ATOM 265 CB VAL A 45 -19.825 27.542 38.508 1.00 29.80 C ATOM 266 CG1 VAL A 45 -20.316 28.018 39.790 1.00 31.85 C ATOM 267 CG2 VAL A 45 -20.989 27.257 37.528 1.00 29.25 C ATOM 268 H VAL A 45 -18.040 29.829 39.447 1.00 0.00 H ATOM 269 N LEU A 46 -19.185 29.364 35.767 1.00 22.21 N ATOM 270 CA LEU A 46 -19.635 30.328 34.845 1.00 21.30 C ATOM 271 C LEU A 46 -21.126 30.407 34.765 1.00 20.11 C ATOM 272 O LEU A 46 -21.820 29.385 34.536 1.00 22.67 O ATOM 273 CB LEU A 46 -19.079 29.978 33.458 1.00 20.12 C ATOM 274 CG LEU A 46 -19.226 31.074 32.394 1.00 21.72 C ATOM 275 CD1 LEU A 46 -18.296 32.273 32.612 1.00 21.77 C ATOM 276 CD2 LEU A 46 -18.890 30.379 31.040 1.00 20.84 C ATOM 277 H LEU A 46 -18.729 28.495 35.422 1.00 0.00 H ATOM 278 N VAL A 47 -21.662 31.608 34.947 1.00 20.10 N ATOM 279 CA VAL A 47 -23.103 31.793 34.844 1.00 21.73 C ATOM 280 C VAL A 47 -23.579 32.640 33.643 1.00 22.17 C ATOM 281 O VAL A 47 -24.756 32.683 33.349 1.00 24.98 O ATOM 282 CB VAL A 47 -23.702 32.324 36.150 1.00 23.08 C ATOM 283 CG1 VAL A 47 -23.368 31.363 37.271 1.00 22.62 C ATOM 284 CG2 VAL A 47 -23.181 33.707 36.485 1.00 24.22 C ATOM 285 H VAL A 47 -21.050 32.420 35.164 1.00 0.00 H ATOM 286 N ASP A 48 -22.660 33.270 32.972 1.00 23.07 N ATOM 287 CA ASP A 48 -22.954 34.178 31.926 1.00 24.06 C ATOM 288 C ASP A 48 -21.616 34.403 31.229 1.00 24.12 C ATOM 289 O ASP A 48 -20.572 34.151 31.827 1.00 24.35 O ATOM 290 CB ASP A 48 -23.502 35.522 32.546 1.00 26.20 C ATOM 291 CG ASP A 48 -23.790 36.562 31.517 1.00 31.75 C ATOM 292 OD1 ASP A 48 -24.760 36.396 30.761 1.00 33.26 O ATOM 293 OD2 ASP A 48 -23.010 37.497 31.405 1.00 31.64 O ATOM 294 H ASP A 48 -21.663 33.099 33.215 1.00 0.00 H ATOM 295 N LYS A 49 -21.616 34.980 30.034 1.00 24.48 N ATOM 296 CA LYS A 49 -20.350 35.273 29.343 1.00 24.34 C ATOM 297 C LYS A 49 -19.377 36.123 30.165 1.00 22.98 C ATOM 298 O LYS A 49 -18.173 36.099 29.909 1.00 22.29 O ATOM 299 CB LYS A 49 -20.576 35.893 27.935 1.00 27.52 C ATOM 300 CG LYS A 49 -21.173 37.296 27.864 1.00 26.47 C ATOM 301 CD LYS A 49 -21.509 37.584 26.418 1.00 29.64 C ATOM 302 CE LYS A 49 -21.481 39.054 26.076 1.00 30.36 C ATOM 303 NZ LYS A 49 -22.570 39.701 26.821 1.00 33.03 N ATOM 304 HZ1 LYS A 49 -23.478 39.279 26.541 1.00 0.00 H ATOM 305 HZ2 LYS A 49 -22.421 39.561 27.841 1.00 0.00 H ATOM 306 HZ3 LYS A 49 -22.578 40.719 26.607 1.00 0.00 H ATOM 307 H LYS A 49 -22.519 35.227 29.581 1.00 0.00 H ATOM 308 N TYR A 50 -19.931 36.963 31.062 1.00 19.98 N ATOM 309 CA TYR A 50 -19.216 37.995 31.757 1.00 20.60 C ATOM 310 C TYR A 50 -19.072 37.705 33.251 1.00 20.91 C ATOM 311 O TYR A 50 -18.442 38.489 33.997 1.00 21.39 O ATOM 312 CB TYR A 50 -19.958 39.329 31.597 1.00 21.92 C ATOM 313 CG TYR A 50 -19.314 40.233 30.506 1.00 21.58 C ATOM 314 CD1 TYR A 50 -17.961 40.662 30.622 1.00 22.96 C ATOM 315 CD2 TYR A 50 -20.101 40.834 29.536 1.00 23.55 C ATOM 316 CE1 TYR A 50 -17.386 41.530 29.689 1.00 23.16 C ATOM 317 CE2 TYR A 50 -19.534 41.700 28.588 1.00 23.50 C ATOM 318 CZ TYR A 50 -18.176 42.070 28.699 1.00 23.95 C ATOM 319 OH TYR A 50 -17.638 42.928 27.778 1.00 26.43 O ATOM 320 HH TYR A 50 -16.685 43.086 27.994 1.00 0.00 H ATOM 321 H TYR A 50 -20.946 36.856 31.264 1.00 0.00 H ATOM 322 N TRP A 51 -19.703 36.648 33.694 1.00 20.75 N ATOM 323 CA TRP A 51 -19.890 36.463 35.148 1.00 20.51 C ATOM 324 C TRP A 51 -19.547 35.091 35.645 1.00 21.17 C ATOM 325 O TRP A 51 -20.071 34.073 35.158 1.00 21.64 O ATOM 326 CB TRP A 51 -21.316 36.792 35.513 1.00 21.37 C ATOM 327 CG TRP A 51 -21.657 38.218 35.433 1.00 20.96 C ATOM 328 CD1 TRP A 51 -22.408 38.781 34.505 1.00 21.82 C ATOM 329 CD2 TRP A 51 -21.465 39.254 36.482 1.00 20.61 C ATOM 330 NE1 TRP A 51 -22.704 40.088 34.838 1.00 22.19 N ATOM 331 CE2 TRP A 51 -22.088 40.411 36.020 1.00 20.48 C ATOM 332 CE3 TRP A 51 -20.796 39.286 37.717 1.00 22.85 C ATOM 333 CZ2 TRP A 51 -22.154 41.569 36.762 1.00 20.95 C ATOM 334 CZ3 TRP A 51 -20.856 40.402 38.445 1.00 20.24 C ATOM 335 CH2 TRP A 51 -21.476 41.591 37.928 1.00 21.55 C ATOM 336 HE1 TRP A 51 -23.302 40.729 34.278 1.00 0.00 H ATOM 337 H TRP A 51 -20.071 35.941 33.026 1.00 0.00 H ATOM 338 N VAL A 52 -18.813 35.041 36.764 1.00 21.40 N ATOM 339 CA VAL A 52 -18.518 33.808 37.465 1.00 21.39 C ATOM 340 C VAL A 52 -19.087 33.888 38.859 1.00 21.37 C ATOM 341 O VAL A 52 -18.983 34.936 39.506 1.00 23.00 O ATOM 342 CB VAL A 52 -16.989 33.638 37.571 1.00 20.78 C ATOM 343 CG1 VAL A 52 -16.627 32.576 38.600 1.00 20.39 C ATOM 344 CG2 VAL A 52 -16.435 33.256 36.167 1.00 21.81 C ATOM 345 H VAL A 52 -18.436 35.931 37.149 1.00 0.00 H ATOM 346 N LEU A 53 -19.666 32.792 39.321 1.00 20.54 N ATOM 347 CA LEU A 53 -20.147 32.629 40.715 1.00 21.87 C ATOM 348 C LEU A 53 -19.188 31.716 41.512 1.00 22.02 C ATOM 349 O LEU A 53 -18.645 30.753 40.986 1.00 22.76 O ATOM 350 CB LEU A 53 -21.559 32.092 40.657 1.00 22.65 C ATOM 351 CG LEU A 53 -22.483 32.108 41.912 1.00 24.89 C ATOM 352 CD1 LEU A 53 -22.847 33.507 42.343 1.00 22.88 C ATOM 353 CD2 LEU A 53 -23.756 31.308 41.597 1.00 26.28 C ATOM 354 H LEU A 53 -19.792 31.994 38.666 1.00 0.00 H ATOM 355 N THR A 54 -18.889 32.097 42.749 1.00 20.35 N ATOM 356 CA THR A 54 -17.964 31.381 43.572 1.00 20.26 C ATOM 357 C THR A 54 -18.273 31.691 45.033 1.00 21.73 C ATOM 358 O THR A 54 -19.319 32.270 45.329 1.00 20.68 O ATOM 359 CB THR A 54 -16.516 31.736 43.220 1.00 20.72 C ATOM 360 OG1 THR A 54 -15.587 30.901 43.908 1.00 21.47 O ATOM 361 CG2 THR A 54 -16.195 33.199 43.377 1.00 19.92 C ATOM 362 HG1 THR A 54 -15.747 29.956 43.659 1.00 0.00 H ATOM 363 H THR A 54 -19.345 32.949 43.134 1.00 0.00 H ATOM 364 N ALA A 55 -17.415 31.240 45.936 1.00 21.65 N ATOM 365 CA ALA A 55 -17.671 31.493 47.352 1.00 20.62 C ATOM 366 C ALA A 55 -17.130 32.873 47.725 1.00 20.22 C ATOM 367 O ALA A 55 -16.046 33.251 47.316 1.00 20.07 O ATOM 368 CB ALA A 55 -17.032 30.433 48.160 1.00 21.05 C ATOM 369 H ALA A 55 -16.569 30.712 45.640 1.00 0.00 H ATOM 370 N ALA A 56 -17.763 33.510 48.702 1.00 19.58 N ATOM 371 CA ALA A 56 -17.256 34.793 49.199 1.00 19.72 C ATOM 372 C ALA A 56 -15.827 34.653 49.791 1.00 20.26 C ATOM 373 O ALA A 56 -15.017 35.627 49.789 1.00 20.27 O ATOM 374 CB ALA A 56 -18.269 35.420 50.168 1.00 19.88 C ATOM 375 H ALA A 56 -18.623 33.097 49.117 1.00 0.00 H ATOM 376 N HIS A 57 -15.514 33.490 50.358 1.00 21.16 N ATOM 377 CA HIS A 57 -14.213 33.301 51.048 1.00 21.20 C ATOM 378 C HIS A 57 -13.052 33.203 50.065 1.00 21.16 C ATOM 379 O HIS A 57 -11.880 33.247 50.427 1.00 19.96 O ATOM 380 CB HIS A 57 -14.235 32.099 52.039 1.00 24.98 C ATOM 381 CG HIS A 57 -14.158 30.733 51.393 1.00 24.37 C ATOM 382 ND1 HIS A 57 -15.282 29.982 51.117 1.00 21.61 N ATOM 383 CD2 HIS A 57 -13.096 29.923 51.143 1.00 24.21 C ATOM 384 CE1 HIS A 57 -14.918 28.787 50.686 1.00 21.68 C ATOM 385 NE2 HIS A 57 -13.602 28.727 50.677 1.00 22.71 N ATOM 386 H HIS A 57 -16.191 32.702 50.317 1.00 0.00 H ATOM 387 N CYS A 58 -13.397 33.117 48.793 1.00 20.95 N ATOM 388 CA CYS A 58 -12.396 33.094 47.757 1.00 20.96 C ATOM 389 C CYS A 58 -11.920 34.479 47.234 1.00 23.02 C ATOM 390 O CYS A 58 -11.095 34.550 46.278 1.00 20.83 O ATOM 391 CB CYS A 58 -12.975 32.261 46.558 1.00 20.19 C ATOM 392 SG CYS A 58 -13.141 30.484 46.954 1.00 23.27 S ATOM 393 H CYS A 58 -14.403 33.065 48.536 1.00 0.00 H ATOM 394 N LYS A 59 -12.553 35.530 47.688 1.00 22.30 N ATOM 395 CA LYS A 59 -12.246 36.860 47.260 1.00 22.75 C ATOM 396 C LYS A 59 -10.771 37.240 47.298 1.00 23.45 C ATOM 397 O LYS A 59 -10.012 36.839 48.214 1.00 23.79 O ATOM 398 CB LYS A 59 -13.057 37.874 48.019 1.00 24.03 C ATOM 399 CG LYS A 59 -12.867 39.258 47.500 1.00 26.34 C ATOM 400 CD LYS A 59 -13.786 40.246 48.140 1.00 27.87 C ATOM 401 CE LYS A 59 -13.260 41.652 47.861 1.00 32.25 C ATOM 402 NZ LYS A 59 -14.135 42.682 48.399 1.00 37.29 N ATOM 403 HZ1 LYS A 59 -15.077 42.596 47.966 1.00 0.00 H ATOM 404 HZ2 LYS A 59 -14.214 42.564 49.429 1.00 0.00 H ATOM 405 HZ3 LYS A 59 -13.738 43.619 48.185 1.00 0.00 H ATOM 406 H LYS A 59 -13.310 35.393 48.388 1.00 0.00 H ATOM 407 N MET A 60 -10.349 37.852 46.200 1.00 24.07 N ATOM 408 CA MET A 60 -9.041 38.493 46.074 1.00 23.35 C ATOM 409 C MET A 60 -9.199 39.812 45.352 1.00 22.87 C ATOM 410 O MET A 60 -10.212 40.041 44.653 1.00 22.78 O ATOM 411 CB MET A 60 -8.082 37.592 45.264 1.00 25.21 C ATOM 412 CG MET A 60 -7.755 36.236 45.960 1.00 26.28 C ATOM 413 SD MET A 60 -6.459 35.336 45.073 1.00 27.49 S ATOM 414 CE MET A 60 -7.249 34.891 43.510 1.00 26.21 C ATOM 415 H MET A 60 -10.987 37.878 45.379 1.00 0.00 H ATOM 416 N GLY A 61 -8.179 40.638 45.406 1.00 21.71 N ATOM 417 CA GLY A 61 -8.193 41.899 44.653 1.00 23.20 C ATOM 418 C GLY A 61 -8.274 41.666 43.132 1.00 24.20 C ATOM 419 O GLY A 61 -8.767 42.543 42.371 1.00 26.19 O ATOM 420 H GLY A 61 -7.352 40.396 45.989 1.00 0.00 H ATOM 421 N GLN A 63 -7.618 40.630 42.667 1.00 23.30 N ATOM 422 CA GLN A 63 -7.800 40.229 41.257 1.00 28.18 C ATOM 423 C GLN A 63 -7.580 38.782 41.080 1.00 25.99 C ATOM 424 O GLN A 63 -7.054 38.123 41.940 1.00 25.73 O ATOM 425 CB GLN A 63 -6.841 40.997 40.366 1.00 30.81 C ATOM 426 CG GLN A 63 -5.404 40.797 40.716 1.00 36.81 C ATOM 427 CD GLN A 63 -4.481 41.594 39.800 1.00 42.26 C ATOM 428 OE1 GLN A 63 -3.898 41.050 38.866 1.00 44.56 O ATOM 429 NE2 GLN A 63 -4.438 42.904 40.003 1.00 43.13 N ATOM 430 HE22 GLN A 63 -4.947 43.323 40.807 1.00 0.00 H ATOM 431 HE21 GLN A 63 -3.895 43.513 39.358 1.00 0.00 H ATOM 432 H GLN A 63 -6.975 40.095 43.286 1.00 0.00 H ATOM 433 N TYR A 64 -7.991 38.261 39.923 1.00 24.27 N ATOM 434 CA TYR A 64 -7.926 36.870 39.662 1.00 25.05 C ATOM 435 C TYR A 64 -7.523 36.748 38.219 1.00 24.51 C ATOM 436 O TYR A 64 -7.785 37.661 37.438 1.00 24.51 O ATOM 437 CB TYR A 64 -9.300 36.182 39.811 1.00 24.42 C ATOM 438 CG TYR A 64 -10.180 36.641 40.949 1.00 22.67 C ATOM 439 CD1 TYR A 64 -10.889 37.803 40.884 1.00 23.39 C ATOM 440 CD2 TYR A 64 -10.332 35.841 42.076 1.00 23.60 C ATOM 441 CE1 TYR A 64 -11.728 38.201 41.915 1.00 24.05 C ATOM 442 CE2 TYR A 64 -11.045 36.280 43.145 1.00 23.95 C ATOM 443 CZ TYR A 64 -11.828 37.410 43.031 1.00 25.31 C ATOM 444 OH TYR A 64 -12.594 37.769 44.089 1.00 25.61 O ATOM 445 HH TYR A 64 -13.098 38.592 43.866 1.00 0.00 H ATOM 446 H TYR A 64 -8.370 38.895 39.191 1.00 0.00 H ATOM 447 N GLN A 65 -6.869 35.649 37.884 1.00 24.43 N ATOM 448 CA GLN A 65 -6.889 35.156 36.535 1.00 25.40 C ATOM 449 C GLN A 65 -7.824 33.960 36.472 1.00 24.52 C ATOM 450 O GLN A 65 -7.670 32.953 37.229 1.00 24.11 O ATOM 451 CB GLN A 65 -5.491 34.796 36.106 1.00 25.33 C ATOM 452 CG GLN A 65 -4.544 35.939 36.250 1.00 28.58 C ATOM 453 CD GLN A 65 -4.569 36.859 35.059 1.00 32.44 C ATOM 454 OE1 GLN A 65 -4.963 36.472 33.947 1.00 37.43 O ATOM 455 NE2 GLN A 65 -4.098 38.079 35.261 1.00 38.39 N ATOM 456 HE22 GLN A 65 -3.778 38.363 36.209 1.00 0.00 H ATOM 457 HE21 GLN A 65 -4.048 38.754 34.472 1.00 0.00 H ATOM 458 H GLN A 65 -6.331 35.133 38.609 1.00 0.00 H ATOM 459 N VAL A 66 -8.771 34.025 35.539 1.00 22.47 N ATOM 460 CA VAL A 66 -9.828 33.064 35.501 1.00 21.82 C ATOM 461 C VAL A 66 -9.564 32.140 34.344 1.00 23.61 C ATOM 462 O VAL A 66 -9.505 32.604 33.230 1.00 23.72 O ATOM 463 CB VAL A 66 -11.184 33.746 35.284 1.00 21.06 C ATOM 464 CG1 VAL A 66 -12.293 32.698 35.254 1.00 21.21 C ATOM 465 CG2 VAL A 66 -11.480 34.770 36.411 1.00 20.58 C ATOM 466 H VAL A 66 -8.741 34.784 34.829 1.00 0.00 H ATOM 467 N GLN A 67 -9.273 30.867 34.631 1.00 23.17 N ATOM 468 CA GLN A 67 -9.076 29.882 33.582 1.00 23.39 C ATOM 469 C GLN A 67 -10.383 29.225 33.159 1.00 23.75 C ATOM 470 O GLN A 67 -11.063 28.615 33.957 1.00 20.91 O ATOM 471 CB GLN A 67 -8.092 28.789 33.975 1.00 24.27 C ATOM 472 CG GLN A 67 -7.844 27.809 32.831 1.00 25.15 C ATOM 473 CD GLN A 67 -7.128 26.555 33.287 1.00 26.50 C ATOM 474 OE1 GLN A 67 -5.973 26.630 33.777 1.00 25.58 O ATOM 475 NE2 GLN A 67 -7.810 25.396 33.172 1.00 22.44 N ATOM 476 HE22 GLN A 67 -8.764 25.393 32.758 1.00 0.00 H ATOM 477 HE21 GLN A 67 -7.381 24.506 33.497 1.00 0.00 H ATOM 478 H GLN A 67 -9.186 30.576 35.626 1.00 0.00 H ATOM 479 N LEU A 68 -10.681 29.286 31.861 1.00 21.35 N ATOM 480 CA LEU A 68 -11.893 28.668 31.324 1.00 22.27 C ATOM 481 C LEU A 68 -11.600 27.657 30.213 1.00 22.48 C ATOM 482 O LEU A 68 -10.575 27.758 29.525 1.00 21.43 O ATOM 483 CB LEU A 68 -12.832 29.723 30.787 1.00 22.53 C ATOM 484 CG LEU A 68 -13.149 30.921 31.692 1.00 23.30 C ATOM 485 CD1 LEU A 68 -12.358 32.137 31.198 1.00 24.88 C ATOM 486 CD2 LEU A 68 -14.617 31.274 31.732 1.00 23.71 C ATOM 487 H LEU A 68 -10.036 29.785 31.215 1.00 0.00 H ATOM 488 N GLY A 69 -12.526 26.730 30.022 1.00 22.36 N ATOM 489 CA GLY A 69 -12.509 25.850 28.812 1.00 22.78 C ATOM 490 C GLY A 69 -11.439 24.769 28.813 1.00 23.63 C ATOM 491 O GLY A 69 -11.157 24.177 27.768 1.00 22.98 O ATOM 492 H GLY A 69 -13.281 26.611 30.728 1.00 0.00 H ATOM 493 N SER A 70 -11.033 24.290 29.997 1.00 21.92 N ATOM 494 CA SER A 70 -10.205 23.091 30.052 1.00 22.34 C ATOM 495 C SER A 70 -10.424 22.327 31.334 1.00 23.22 C ATOM 496 O SER A 70 -10.412 22.942 32.387 1.00 23.21 O ATOM 497 CB SER A 70 -8.738 23.468 29.963 1.00 22.67 C ATOM 498 OG SER A 70 -7.896 22.310 30.048 1.00 23.10 O ATOM 499 HG SER A 70 -6.948 22.588 29.987 1.00 0.00 H ATOM 500 H SER A 70 -11.308 24.773 30.876 1.00 0.00 H ATOM 501 N ASP A 71 -10.276 21.025 31.241 1.00 23.69 N ATOM 502 CA ASP A 71 -10.191 20.150 32.444 1.00 25.18 C ATOM 503 C ASP A 71 -8.847 20.114 33.090 1.00 23.89 C ATOM 504 O ASP A 71 -8.714 19.530 34.172 1.00 25.25 O ATOM 505 CB ASP A 71 -10.565 18.721 32.061 1.00 27.97 C ATOM 506 CG ASP A 71 -11.992 18.601 31.605 1.00 31.20 C ATOM 507 OD1 ASP A 71 -12.815 19.398 32.070 1.00 29.84 O ATOM 508 OD2 ASP A 71 -12.298 17.721 30.712 1.00 34.94 O ATOM 509 H ASP A 71 -10.216 20.591 30.298 1.00 0.00 H ATOM 510 N LYS A 72 -7.832 20.712 32.482 1.00 22.19 N ATOM 511 CA LYS A 72 -6.478 20.624 33.018 1.00 23.08 C ATOM 512 C LYS A 72 -6.065 21.931 33.716 1.00 22.85 C ATOM 513 O LYS A 72 -6.071 22.967 33.130 1.00 23.06 O ATOM 514 CB LYS A 72 -5.453 20.358 31.894 1.00 23.71 C ATOM 515 CG LYS A 72 -5.797 19.267 30.932 1.00 24.81 C ATOM 516 CD LYS A 72 -5.549 17.907 31.410 1.00 24.25 C ATOM 517 CE LYS A 72 -5.649 16.905 30.253 1.00 25.18 C ATOM 518 NZ LYS A 72 -5.508 15.570 30.820 1.00 24.29 N ATOM 519 HZ1 LYS A 72 -4.585 15.491 31.292 1.00 0.00 H ATOM 520 HZ2 LYS A 72 -6.268 15.406 31.511 1.00 0.00 H ATOM 521 HZ3 LYS A 72 -5.571 14.863 30.060 1.00 0.00 H ATOM 522 H LYS A 72 -8.004 21.252 31.610 1.00 0.00 H ATOM 523 N ILE A 73 -5.675 21.879 34.966 1.00 25.36 N ATOM 524 CA ILE A 73 -5.345 23.129 35.659 1.00 23.55 C ATOM 525 C ILE A 73 -3.989 23.686 35.203 1.00 25.77 C ATOM 526 O ILE A 73 -3.005 22.920 35.031 1.00 23.96 O ATOM 527 CB ILE A 73 -5.391 22.947 37.202 1.00 24.58 C ATOM 528 CG1 ILE A 73 -5.267 24.301 37.906 1.00 27.17 C ATOM 529 CG2 ILE A 73 -4.273 22.062 37.683 1.00 26.41 C ATOM 530 CD1 ILE A 73 -6.566 24.969 38.143 1.00 29.15 C ATOM 531 H ILE A 73 -5.601 20.966 35.459 1.00 0.00 H ATOM 532 N GLY A 74 -3.968 25.002 34.868 1.00 25.49 N ATOM 533 CA GLY A 74 -2.769 25.639 34.396 1.00 27.12 C ATOM 534 C GLY A 74 -2.493 25.304 32.951 1.00 29.81 C ATOM 535 O GLY A 74 -1.352 25.303 32.524 1.00 33.04 O ATOM 536 H GLY A 74 -4.840 25.562 34.955 1.00 0.00 H ATOM 537 N ASP A 75 -3.520 24.871 32.249 1.00 29.41 N ATOM 538 CA ASP A 75 -3.419 24.538 30.797 1.00 29.66 C ATOM 539 C ASP A 75 -3.049 25.800 30.039 1.00 31.25 C ATOM 540 O ASP A 75 -3.778 26.779 30.071 1.00 29.11 O ATOM 541 CB ASP A 75 -4.768 24.045 30.309 1.00 29.92 C ATOM 542 CG ASP A 75 -4.750 23.495 28.875 1.00 32.31 C ATOM 543 OD1 ASP A 75 -3.891 23.907 27.971 1.00 31.38 O ATOM 544 OD2 ASP A 75 -5.670 22.713 28.609 1.00 33.73 O ATOM 545 H ASP A 75 -4.438 24.757 32.725 1.00 0.00 H ATOM 546 N GLN A 76 -1.970 25.717 29.276 1.00 32.66 N ATOM 547 CA GLN A 76 -1.455 26.864 28.563 1.00 34.27 C ATOM 548 C GLN A 76 -2.267 27.232 27.358 1.00 31.56 C ATOM 549 O GLN A 76 -2.090 28.301 26.828 1.00 31.49 O ATOM 550 CB GLN A 76 -0.013 26.617 28.124 1.00 36.15 C ATOM 551 CG GLN A 76 1.022 26.914 29.191 1.00 39.29 C ATOM 552 CD GLN A 76 0.609 28.036 30.139 1.00 46.12 C ATOM 553 OE1 GLN A 76 -0.114 27.812 31.129 1.00 46.21 O ATOM 554 NE2 GLN A 76 1.126 29.216 29.897 1.00 42.37 N ATOM 555 HE22 GLN A 76 1.724 29.360 29.059 1.00 0.00 H ATOM 556 HE21 GLN A 76 0.938 30.009 30.543 1.00 0.00 H ATOM 557 H GLN A 76 -1.481 24.804 29.188 1.00 0.00 H ATOM 558 N SER A 79 -3.157 26.351 26.925 1.00 31.48 N ATOM 559 CA SER A 79 -3.976 26.596 25.743 1.00 31.98 C ATOM 560 C SER A 79 -5.305 27.167 26.076 1.00 31.48 C ATOM 561 O SER A 79 -6.051 27.581 25.197 1.00 30.00 O ATOM 562 CB SER A 79 -4.186 25.309 24.981 1.00 33.27 C ATOM 563 OG SER A 79 -4.991 24.419 25.713 1.00 35.26 O ATOM 564 HG SER A 79 -4.551 24.211 26.575 1.00 0.00 H ATOM 565 H SER A 79 -3.275 25.457 27.444 1.00 0.00 H ATOM 566 N ALA A 80 -5.665 27.078 27.330 1.00 29.27 N ATOM 567 CA ALA A 80 -6.976 27.504 27.790 1.00 28.97 C ATOM 568 C ALA A 80 -7.063 29.041 27.828 1.00 29.01 C ATOM 569 O ALA A 80 -6.131 29.709 28.276 1.00 31.47 O ATOM 570 CB ALA A 80 -7.212 26.944 29.152 1.00 27.93 C ATOM 571 H ALA A 80 -4.991 26.690 28.021 1.00 0.00 H ATOM 572 N GLN A 81 -8.265 29.548 27.654 1.00 30.15 N ATOM 573 CA GLN A 81 -8.482 30.954 27.831 1.00 31.31 C ATOM 574 C GLN A 81 -8.285 31.346 29.257 1.00 27.62 C ATOM 575 O GLN A 81 -8.821 30.687 30.153 1.00 27.83 O ATOM 576 CB GLN A 81 -9.840 31.384 27.418 1.00 33.77 C ATOM 577 CG GLN A 81 -9.921 32.916 27.458 1.00 39.69 C ATOM 578 CD GLN A 81 -10.879 33.493 26.464 1.00 42.56 C ATOM 579 OE1 GLN A 81 -11.857 32.817 26.023 1.00 45.27 O ATOM 580 NE2 GLN A 81 -10.634 34.756 26.089 1.00 37.20 N ATOM 581 HE22 GLN A 81 -9.817 35.266 26.482 1.00 0.00 H ATOM 582 HE21 GLN A 81 -11.261 35.226 25.405 1.00 0.00 H ATOM 583 H GLN A 81 -9.057 28.929 27.388 1.00 0.00 H ATOM 584 N LYS A 82 -7.600 32.465 29.446 1.00 28.47 N ATOM 585 CA LYS A 82 -7.417 33.072 30.725 1.00 30.42 C ATOM 586 C LYS A 82 -7.901 34.542 30.608 1.00 27.59 C ATOM 587 O LYS A 82 -7.339 35.314 29.862 1.00 26.11 O ATOM 588 CB LYS A 82 -5.915 33.036 31.116 1.00 33.60 C ATOM 589 CG LYS A 82 -5.644 33.114 32.627 1.00 36.63 C ATOM 590 CD LYS A 82 -4.112 33.127 32.930 1.00 43.84 C ATOM 591 CE LYS A 82 -3.815 32.716 34.390 1.00 44.83 C ATOM 592 NZ LYS A 82 -2.363 32.712 34.791 1.00 41.81 N ATOM 593 HZ1 LYS A 82 -1.840 32.044 34.190 1.00 0.00 H ATOM 594 HZ2 LYS A 82 -1.969 33.667 34.673 1.00 0.00 H ATOM 595 HZ3 LYS A 82 -2.280 32.422 35.786 1.00 0.00 H ATOM 596 H LYS A 82 -7.173 32.926 28.617 1.00 0.00 H ATOM 597 N ILE A 83 -8.834 34.920 31.465 1.00 25.97 N ATOM 598 CA ILE A 83 -9.373 36.271 31.499 1.00 25.21 C ATOM 599 C ILE A 83 -9.168 36.849 32.895 1.00 24.59 C ATOM 600 O ILE A 83 -9.397 36.188 33.877 1.00 23.97 O ATOM 601 CB ILE A 83 -10.854 36.260 31.168 1.00 24.76 C ATOM 602 CG1 ILE A 83 -11.037 35.633 29.789 1.00 22.80 C ATOM 603 CG2 ILE A 83 -11.420 37.650 31.269 1.00 24.06 C ATOM 604 CD1 ILE A 83 -12.486 35.433 29.374 1.00 22.25 C ATOM 605 H ILE A 83 -9.198 34.222 32.144 1.00 0.00 H ATOM 606 N LYS A 84 -8.622 38.037 32.952 1.00 25.09 N ATOM 607 CA LYS A 84 -8.408 38.680 34.195 1.00 27.29 C ATOM 608 C LYS A 84 -9.759 39.202 34.780 1.00 25.19 C ATOM 609 O LYS A 84 -10.680 39.538 34.057 1.00 24.81 O ATOM 610 CB LYS A 84 -7.429 39.814 33.981 1.00 30.84 C ATOM 611 CG LYS A 84 -6.992 40.496 35.233 1.00 32.37 C ATOM 612 CD LYS A 84 -5.978 41.597 34.907 1.00 36.60 C ATOM 613 CE LYS A 84 -5.955 42.655 35.952 1.00 43.56 C ATOM 614 NZ LYS A 84 -4.721 43.518 35.804 1.00 48.25 N ATOM 615 HZ1 LYS A 84 -3.872 42.926 35.903 1.00 0.00 H ATOM 616 HZ2 LYS A 84 -4.725 43.968 34.866 1.00 0.00 H ATOM 617 HZ3 LYS A 84 -4.722 44.251 36.542 1.00 0.00 H ATOM 618 H LYS A 84 -8.341 38.515 32.072 1.00 0.00 H ATOM 619 N ALA A 85 -9.832 39.328 36.091 1.00 24.72 N ATOM 620 CA ALA A 85 -11.014 39.875 36.725 1.00 25.56 C ATOM 621 C ALA A 85 -10.570 40.624 37.950 1.00 27.94 C ATOM 622 O ALA A 85 -9.584 40.220 38.584 1.00 27.81 O ATOM 623 CB ALA A 85 -11.977 38.735 37.115 1.00 22.89 C ATOM 624 H ALA A 85 -9.028 39.030 36.679 1.00 0.00 H ATOM 625 N THR A 86 -11.179 41.785 38.190 1.00 27.85 N ATOM 626 CA THR A 86 -10.794 42.613 39.272 1.00 29.17 C ATOM 627 C THR A 86 -11.970 43.165 40.075 1.00 29.78 C ATOM 628 O THR A 86 -11.734 43.875 41.027 1.00 30.95 O ATOM 629 CB THR A 86 -9.961 43.806 38.781 1.00 34.27 C ATOM 630 OG1 THR A 86 -10.793 44.691 38.006 1.00 35.12 O ATOM 631 CG2 THR A 86 -8.795 43.349 37.920 1.00 37.24 C ATOM 632 HG1 THR A 86 -11.158 44.201 37.227 1.00 0.00 H ATOM 633 H THR A 86 -11.955 42.090 37.568 1.00 0.00 H ATOM 634 N LYS A 87 -13.209 42.868 39.683 1.00 25.98 N ATOM 635 CA LYS A 87 -14.410 43.287 40.450 1.00 27.81 C ATOM 636 C LYS A 87 -15.147 42.114 41.014 1.00 26.98 C ATOM 637 O LYS A 87 -15.520 41.161 40.279 1.00 27.00 O ATOM 638 CB LYS A 87 -15.379 44.106 39.564 1.00 31.95 C ATOM 639 CG LYS A 87 -14.916 45.540 39.311 1.00 35.90 C ATOM 640 CD LYS A 87 -14.894 45.868 37.832 1.00 39.36 C ATOM 641 CE LYS A 87 -13.587 45.464 37.239 1.00 41.27 C ATOM 642 NZ LYS A 87 -13.637 45.490 35.780 1.00 35.20 N ATOM 643 HZ1 LYS A 87 -14.370 44.831 35.448 1.00 0.00 H ATOM 644 HZ2 LYS A 87 -13.863 46.453 35.459 1.00 0.00 H ATOM 645 HZ3 LYS A 87 -12.713 45.204 35.398 1.00 0.00 H ATOM 646 H LYS A 87 -13.340 42.322 38.807 1.00 0.00 H ATOM 647 N SER A 88 -15.326 42.148 42.324 1.00 24.87 N ATOM 648 CA SER A 88 -16.056 41.103 43.035 1.00 23.37 C ATOM 649 C SER A 88 -17.268 41.758 43.722 1.00 24.07 C ATOM 650 O SER A 88 -17.127 42.875 44.297 1.00 25.12 O ATOM 651 CB SER A 88 -15.160 40.421 44.073 1.00 23.69 C ATOM 652 OG SER A 88 -13.880 40.065 43.598 1.00 25.25 O ATOM 653 HG SER A 88 -13.403 40.878 43.296 1.00 0.00 H ATOM 654 H SER A 88 -14.934 42.945 42.865 1.00 0.00 H ATOM 655 N PHE A 89 -18.289 40.935 43.947 1.00 22.31 N ATOM 656 CA PHE A 89 -19.518 41.331 44.518 1.00 23.12 C ATOM 657 C PHE A 89 -19.950 40.253 45.456 1.00 24.06 C ATOM 658 O PHE A 89 -20.676 39.327 45.095 1.00 20.25 O ATOM 659 CB PHE A 89 -20.598 41.579 43.419 1.00 24.13 C ATOM 660 CG PHE A 89 -20.196 42.579 42.390 1.00 26.39 C ATOM 661 CD1 PHE A 89 -19.338 42.228 41.367 1.00 26.39 C ATOM 662 CD2 PHE A 89 -20.778 43.850 42.360 1.00 27.65 C ATOM 663 CE1 PHE A 89 -18.962 43.157 40.416 1.00 28.24 C ATOM 664 CE2 PHE A 89 -20.499 44.735 41.328 1.00 28.90 C ATOM 665 CZ PHE A 89 -19.500 44.427 40.434 1.00 28.28 C ATOM 666 H PHE A 89 -18.174 39.935 43.685 1.00 0.00 H ATOM 667 N ARG A 90 -19.450 40.330 46.699 1.00 22.90 N ATOM 668 CA ARG A 90 -19.994 39.478 47.767 1.00 26.53 C ATOM 669 C ARG A 90 -21.404 39.792 48.116 1.00 27.60 C ATOM 670 O ARG A 90 -21.764 40.959 48.267 1.00 27.05 O ATOM 671 CB ARG A 90 -19.176 39.629 49.044 1.00 26.96 C ATOM 672 CG ARG A 90 -17.807 39.072 48.986 1.00 28.06 C ATOM 673 CD ARG A 90 -17.206 39.181 50.364 1.00 31.44 C ATOM 674 NE ARG A 90 -16.041 38.371 50.547 1.00 30.13 N ATOM 675 CZ ARG A 90 -14.979 38.738 51.278 1.00 29.46 C ATOM 676 NH1 ARG A 90 -13.948 37.884 51.435 1.00 28.41 N ATOM 677 NH2 ARG A 90 -14.913 39.960 51.792 1.00 28.41 N ATOM 678 HE ARG A 90 -16.017 37.440 50.084 1.00 0.00 H ATOM 679 HH12 ARG A 90 -13.122 38.165 52.001 1.00 0.00 H ATOM 680 HH11 ARG A 90 -13.978 36.945 50.990 1.00 0.00 H ATOM 681 HH22 ARG A 90 -14.088 40.242 52.359 1.00 0.00 H ATOM 682 HH21 ARG A 90 -15.686 40.636 51.628 1.00 0.00 H ATOM 683 H ARG A 90 -18.677 40.993 46.907 1.00 0.00 H ATOM 684 N HIS A 91 -22.098 38.770 48.595 1.00 25.91 N ATOM 685 CA HIS A 91 -23.304 38.969 49.270 1.00 27.10 C ATOM 686 C HIS A 91 -22.998 39.732 50.611 1.00 27.43 C ATOM 687 O HIS A 91 -22.080 39.381 51.302 1.00 26.51 O ATOM 688 CB HIS A 91 -23.935 37.673 49.637 1.00 26.28 C ATOM 689 CG HIS A 91 -25.295 37.824 50.211 1.00 27.75 C ATOM 690 ND1 HIS A 91 -25.524 38.091 51.557 1.00 28.90 N ATOM 691 CD2 HIS A 91 -26.512 37.734 49.636 1.00 29.13 C ATOM 692 CE1 HIS A 91 -26.822 38.191 51.757 1.00 30.10 C ATOM 693 NE2 HIS A 91 -27.441 37.943 50.623 1.00 31.12 N ATOM 694 H HIS A 91 -21.738 37.803 48.466 1.00 0.00 H ATOM 695 N PRO A 92 -23.750 40.784 50.890 1.00 26.73 N ATOM 696 CA PRO A 92 -23.365 41.678 51.977 1.00 29.26 C ATOM 697 C PRO A 92 -23.387 41.003 53.313 1.00 28.28 C ATOM 698 O PRO A 92 -22.723 41.472 54.230 1.00 29.83 O ATOM 699 CB PRO A 92 -24.365 42.818 51.902 1.00 30.10 C ATOM 700 CG PRO A 92 -25.298 42.532 50.771 1.00 30.46 C ATOM 701 CD PRO A 92 -24.938 41.234 50.144 1.00 29.71 C ATOM 702 N GLY A 93 -24.052 39.854 53.406 1.00 27.06 N ATOM 703 CA GLY A 93 -24.268 39.174 54.706 1.00 25.57 C ATOM 704 C GLY A 93 -23.173 38.195 55.030 1.00 24.76 C ATOM 705 O GLY A 93 -23.254 37.446 56.007 1.00 24.88 O ATOM 706 H GLY A 93 -24.432 39.420 52.541 1.00 0.00 H ATOM 707 N TYR A 94 -22.185 38.104 54.156 1.00 23.97 N ATOM 708 CA TYR A 94 -21.104 37.122 54.306 1.00 24.71 C ATOM 709 C TYR A 94 -20.431 37.306 55.651 1.00 22.21 C ATOM 710 O TYR A 94 -20.042 38.423 56.011 1.00 24.42 O ATOM 711 CB TYR A 94 -20.041 37.316 53.244 1.00 24.26 C ATOM 712 CG TYR A 94 -18.766 36.539 53.510 1.00 24.53 C ATOM 713 CD1 TYR A 94 -18.785 35.150 53.608 1.00 24.49 C ATOM 714 CD2 TYR A 94 -17.549 37.173 53.585 1.00 25.38 C ATOM 715 CE1 TYR A 94 -17.649 34.447 53.913 1.00 24.98 C ATOM 716 CE2 TYR A 94 -16.385 36.471 53.828 1.00 25.13 C ATOM 717 CZ TYR A 94 -16.445 35.108 53.979 1.00 23.81 C ATOM 718 OH TYR A 94 -15.311 34.399 54.197 1.00 27.22 O ATOM 719 HH TYR A 94 -15.535 33.438 54.282 1.00 0.00 H ATOM 720 H TYR A 94 -22.173 38.747 53.338 1.00 0.00 H ATOM 721 N SER A 95 -20.275 36.216 56.370 1.00 23.08 N ATOM 722 CA SER A 95 -19.627 36.231 57.649 1.00 24.08 C ATOM 723 C SER A 95 -18.302 35.468 57.684 1.00 23.20 C ATOM 724 O SER A 95 -18.238 34.294 57.327 1.00 25.68 O ATOM 725 CB SER A 95 -20.551 35.685 58.738 1.00 24.79 C ATOM 726 OG SER A 95 -19.876 35.682 59.963 1.00 24.66 O ATOM 727 HG SER A 95 -19.605 36.606 60.192 1.00 0.00 H ATOM 728 H SER A 95 -20.634 35.313 55.999 1.00 0.00 H ATOM 729 N THR A 96 -17.274 36.112 58.219 1.00 23.42 N ATOM 730 CA THR A 96 -16.003 35.464 58.376 1.00 24.56 C ATOM 731 C THR A 96 -15.977 34.678 59.623 1.00 24.91 C ATOM 732 O THR A 96 -15.004 33.988 59.867 1.00 25.23 O ATOM 733 CB THR A 96 -14.841 36.448 58.425 1.00 23.57 C ATOM 734 OG1 THR A 96 -15.046 37.368 59.466 1.00 23.28 O ATOM 735 CG2 THR A 96 -14.712 37.172 57.104 1.00 21.76 C ATOM 736 HG1 THR A 96 -14.289 38.006 59.495 1.00 0.00 H ATOM 737 H THR A 96 -17.390 37.098 58.528 1.00 0.00 H ATOM 738 N LYS A 97 -17.002 34.834 60.459 1.00 24.55 N ATOM 739 CA LYS A 97 -17.093 34.085 61.707 1.00 26.39 C ATOM 740 C LYS A 97 -17.976 32.859 61.606 1.00 28.07 C ATOM 741 O LYS A 97 -17.667 31.835 62.213 1.00 28.54 O ATOM 742 CB LYS A 97 -17.639 34.975 62.848 1.00 27.87 C ATOM 743 CG LYS A 97 -16.753 36.140 63.270 1.00 30.06 C ATOM 744 CD LYS A 97 -15.590 35.634 64.099 1.00 30.46 C ATOM 745 CE LYS A 97 -14.782 36.758 64.699 1.00 32.50 C ATOM 746 NZ LYS A 97 -13.650 36.161 65.392 1.00 34.22 N ATOM 747 HZ1 LYS A 97 -13.998 35.524 66.137 1.00 0.00 H ATOM 748 HZ2 LYS A 97 -13.075 35.621 64.714 1.00 0.00 H ATOM 749 HZ3 LYS A 97 -13.071 36.912 65.818 1.00 0.00 H ATOM 750 H LYS A 97 -17.757 35.507 60.216 1.00 0.00 H ATOM 751 N THR A 98 -19.175 33.024 61.066 1.00 27.32 N ATOM 752 CA THR A 98 -20.127 31.930 61.040 1.00 29.82 C ATOM 753 C THR A 98 -20.228 31.306 59.639 1.00 27.49 C ATOM 754 O THR A 98 -20.943 30.318 59.464 1.00 28.60 O ATOM 755 CB THR A 98 -21.531 32.369 61.394 1.00 29.71 C ATOM 756 OG1 THR A 98 -21.990 33.272 60.393 1.00 31.81 O ATOM 757 CG2 THR A 98 -21.609 33.010 62.799 1.00 34.51 C ATOM 758 HG1 THR A 98 -22.909 33.567 60.613 1.00 0.00 H ATOM 759 H THR A 98 -19.435 33.945 60.658 1.00 0.00 H ATOM 760 N HIS A 99 -19.663 31.979 58.635 1.00 27.09 N ATOM 761 CA HIS A 99 -19.577 31.445 57.263 1.00 29.05 C ATOM 762 C HIS A 99 -20.890 31.446 56.518 1.00 27.74 C ATOM 763 O HIS A 99 -20.984 30.911 55.423 1.00 25.14 O ATOM 764 CB HIS A 99 -18.968 30.057 57.238 1.00 31.88 C ATOM 765 CG HIS A 99 -17.734 29.920 58.075 1.00 33.64 C ATOM 766 ND1 HIS A 99 -16.596 30.673 57.852 1.00 33.69 N ATOM 767 CD2 HIS A 99 -17.526 29.265 59.245 1.00 38.11 C ATOM 768 CE1 HIS A 99 -15.714 30.427 58.801 1.00 35.55 C ATOM 769 NE2 HIS A 99 -16.247 29.562 59.654 1.00 37.35 N ATOM 770 H HIS A 99 -19.266 32.921 58.828 1.00 0.00 H ATOM 771 N VAL A 100 -21.914 32.050 57.085 1.00 24.88 N ATOM 772 CA VAL A 100 -23.171 32.239 56.331 1.00 24.69 C ATOM 773 C VAL A 100 -23.002 33.157 55.124 1.00 24.15 C ATOM 774 O VAL A 100 -22.109 33.978 55.094 1.00 23.88 O ATOM 775 CB VAL A 100 -24.254 32.857 57.223 1.00 26.50 C ATOM 776 CG1 VAL A 100 -24.442 31.987 58.465 1.00 27.57 C ATOM 777 CG2 VAL A 100 -23.875 34.290 57.632 1.00 28.30 C ATOM 778 H VAL A 100 -21.838 32.394 58.064 1.00 0.00 H ATOM 779 N ASN A 101 -23.863 32.999 54.119 1.00 23.52 N ATOM 780 CA ASN A 101 -23.780 33.816 52.881 1.00 24.13 C ATOM 781 C ASN A 101 -22.435 33.771 52.152 1.00 23.61 C ATOM 782 O ASN A 101 -21.963 34.804 51.550 1.00 24.63 O ATOM 783 CB ASN A 101 -24.247 35.243 53.140 1.00 24.06 C ATOM 784 CG ASN A 101 -25.598 35.301 53.878 1.00 27.35 C ATOM 785 OD1 ASN A 101 -26.622 34.781 53.372 1.00 30.10 O ATOM 786 ND2 ASN A 101 -25.638 36.012 55.001 1.00 28.80 N ATOM 787 HD22 ASN A 101 -24.765 36.426 55.386 1.00 0.00 H ATOM 788 HD21 ASN A 101 -26.542 36.154 55.494 1.00 0.00 H ATOM 789 H ASN A 101 -24.614 32.284 54.204 1.00 0.00 H ATOM 790 N ASP A 102 -21.870 32.574 52.042 1.00 21.21 N ATOM 791 CA ASP A 102 -20.621 32.412 51.454 1.00 21.34 C ATOM 792 C ASP A 102 -20.791 32.336 49.917 1.00 20.01 C ATOM 793 O ASP A 102 -20.717 31.242 49.354 1.00 20.37 O ATOM 794 CB ASP A 102 -19.969 31.147 51.940 1.00 20.97 C ATOM 795 CG ASP A 102 -18.503 31.060 51.593 1.00 22.08 C ATOM 796 OD1 ASP A 102 -17.933 32.063 51.091 1.00 21.96 O ATOM 797 OD2 ASP A 102 -17.918 29.933 51.742 1.00 23.16 O ATOM 798 H ASP A 102 -22.373 31.739 52.404 1.00 0.00 H ATOM 799 N ILE A 103 -21.078 33.466 49.278 1.00 20.96 N ATOM 800 CA ILE A 103 -21.397 33.496 47.852 1.00 21.93 C ATOM 801 C ILE A 103 -20.957 34.841 47.227 1.00 22.08 C ATOM 802 O ILE A 103 -21.049 35.895 47.843 1.00 23.95 O ATOM 803 CB ILE A 103 -22.910 33.248 47.593 1.00 21.84 C ATOM 804 CG1 ILE A 103 -23.224 33.133 46.111 1.00 21.96 C ATOM 805 CG2 ILE A 103 -23.773 34.292 48.273 1.00 23.34 C ATOM 806 CD1 ILE A 103 -24.646 32.653 45.841 1.00 22.01 C ATOM 807 H ILE A 103 -21.075 34.359 49.811 1.00 0.00 H ATOM 808 N MET A 104 -20.438 34.797 46.016 1.00 21.41 N ATOM 809 CA MET A 104 -19.872 35.991 45.439 1.00 21.31 C ATOM 810 C MET A 104 -19.990 35.904 43.956 1.00 20.33 C ATOM 811 O MET A 104 -19.723 34.836 43.386 1.00 19.24 O ATOM 812 CB MET A 104 -18.386 36.123 45.823 1.00 21.56 C ATOM 813 CG MET A 104 -17.614 37.372 45.329 1.00 20.67 C ATOM 814 SD MET A 104 -15.928 37.462 46.045 1.00 22.16 S ATOM 815 CE MET A 104 -15.148 35.957 45.483 1.00 21.87 C ATOM 816 H MET A 104 -20.437 33.906 45.480 1.00 0.00 H ATOM 817 N LEU A 105 -20.223 37.019 43.331 1.00 20.88 N ATOM 818 CA LEU A 105 -20.090 37.091 41.841 1.00 20.70 C ATOM 819 C LEU A 105 -18.807 37.842 41.482 1.00 22.54 C ATOM 820 O LEU A 105 -18.366 38.744 42.235 1.00 22.97 O ATOM 821 CB LEU A 105 -21.286 37.800 41.264 1.00 21.00 C ATOM 822 CG LEU A 105 -22.544 37.014 41.131 1.00 21.67 C ATOM 823 CD1 LEU A 105 -23.763 37.935 41.073 1.00 23.46 C ATOM 824 CD2 LEU A 105 -22.487 36.092 39.933 1.00 23.70 C ATOM 825 H LEU A 105 -20.503 37.865 43.868 1.00 0.00 H ATOM 826 N VAL A 106 -18.172 37.429 40.379 1.00 20.90 N ATOM 827 CA VAL A 106 -16.981 38.026 39.917 1.00 20.88 C ATOM 828 C VAL A 106 -17.235 38.423 38.459 1.00 20.52 C ATOM 829 O VAL A 106 -17.737 37.586 37.671 1.00 22.93 O ATOM 830 CB VAL A 106 -15.809 37.042 40.008 1.00 21.92 C ATOM 831 CG1 VAL A 106 -14.608 37.576 39.268 1.00 23.71 C ATOM 832 CG2 VAL A 106 -15.436 36.750 41.462 1.00 21.76 C ATOM 833 H VAL A 106 -18.573 36.635 39.840 1.00 0.00 H ATOM 834 N ARG A 107 -16.953 39.688 38.109 1.00 21.29 N ATOM 835 CA ARG A 107 -17.149 40.193 36.729 1.00 22.70 C ATOM 836 C ARG A 107 -15.833 40.044 35.957 1.00 21.42 C ATOM 837 O ARG A 107 -14.807 40.608 36.330 1.00 20.94 O ATOM 838 CB ARG A 107 -17.556 41.693 36.776 1.00 22.80 C ATOM 839 CG ARG A 107 -17.650 42.403 35.431 1.00 21.27 C ATOM 840 CD ARG A 107 -18.862 41.995 34.627 1.00 20.89 C ATOM 841 NE ARG A 107 -18.920 42.731 33.382 1.00 19.65 N ATOM 842 CZ ARG A 107 -19.984 42.840 32.583 1.00 20.15 C ATOM 843 NH1 ARG A 107 -21.157 42.289 32.890 1.00 20.75 N ATOM 844 NH2 ARG A 107 -19.926 43.667 31.546 1.00 20.03 N ATOM 845 HE ARG A 107 -18.053 43.220 33.082 1.00 0.00 H ATOM 846 HH12 ARG A 107 -21.966 42.394 32.244 1.00 0.00 H ATOM 847 HH11 ARG A 107 -21.264 41.754 33.775 1.00 0.00 H ATOM 848 HH22 ARG A 107 -20.745 43.765 30.913 1.00 0.00 H ATOM 849 HH21 ARG A 107 -19.062 44.217 31.367 1.00 0.00 H ATOM 850 H ARG A 107 -16.584 40.337 38.832 1.00 0.00 H ATOM 851 N LEU A 108 -15.894 39.400 34.824 1.00 24.05 N ATOM 852 CA LEU A 108 -14.731 39.271 33.969 1.00 22.37 C ATOM 853 C LEU A 108 -14.401 40.574 33.204 1.00 23.68 C ATOM 854 O LEU A 108 -15.286 41.210 32.673 1.00 23.63 O ATOM 855 CB LEU A 108 -14.949 38.140 32.990 1.00 24.15 C ATOM 856 CG LEU A 108 -15.358 36.780 33.547 1.00 23.69 C ATOM 857 CD1 LEU A 108 -15.486 35.856 32.373 1.00 25.63 C ATOM 858 CD2 LEU A 108 -14.329 36.253 34.522 1.00 23.94 C ATOM 859 H LEU A 108 -16.794 38.971 34.529 1.00 0.00 H ATOM 860 N ASP A 109 -13.120 40.834 33.004 1.00 23.10 N ATOM 861 CA ASP A 109 -12.658 42.048 32.262 1.00 25.39 C ATOM 862 C ASP A 109 -13.149 41.997 30.822 1.00 24.97 C ATOM 863 O ASP A 109 -13.284 43.044 30.154 1.00 24.55 O ATOM 864 CB ASP A 109 -11.136 42.115 32.210 1.00 26.44 C ATOM 865 CG ASP A 109 -10.538 42.794 33.396 1.00 27.00 C ATOM 866 OD1 ASP A 109 -11.270 43.049 34.364 1.00 31.03 O ATOM 867 OD2 ASP A 109 -9.298 42.869 33.429 1.00 29.95 O ATOM 868 H ASP A 109 -12.409 40.172 33.375 1.00 0.00 H ATOM 869 N GLU A 110 -13.226 40.787 30.309 1.00 25.05 N ATOM 870 CA GLU A 110 -13.655 40.530 28.908 1.00 26.22 C ATOM 871 C GLU A 110 -14.633 39.367 28.859 1.00 26.64 C ATOM 872 O GLU A 110 -14.601 38.524 29.701 1.00 26.55 O ATOM 873 CB GLU A 110 -12.442 40.209 28.009 1.00 27.85 C ATOM 874 CG GLU A 110 -11.377 41.269 28.016 1.00 32.62 C ATOM 875 CD GLU A 110 -10.412 41.141 26.867 1.00 37.01 C ATOM 876 OE1 GLU A 110 -10.533 40.149 26.092 1.00 40.73 O ATOM 877 OE2 GLU A 110 -9.562 42.043 26.713 1.00 38.83 O ATOM 878 H GLU A 110 -12.976 39.975 30.909 1.00 0.00 H ATOM 879 N PRO A 111 -15.556 39.351 27.855 1.00 25.33 N ATOM 880 CA PRO A 111 -16.463 38.205 27.834 1.00 27.03 C ATOM 881 C PRO A 111 -15.858 36.937 27.254 1.00 27.10 C ATOM 882 O PRO A 111 -15.010 36.984 26.374 1.00 27.02 O ATOM 883 CB PRO A 111 -17.621 38.692 26.971 1.00 26.76 C ATOM 884 CG PRO A 111 -16.957 39.642 25.968 1.00 27.24 C ATOM 885 CD PRO A 111 -15.722 40.208 26.677 1.00 28.73 C ATOM 886 N VAL A 112 -16.273 35.787 27.764 1.00 26.73 N ATOM 887 CA VAL A 112 -15.743 34.565 27.240 1.00 27.26 C ATOM 888 C VAL A 112 -16.516 34.120 26.028 1.00 28.93 C ATOM 889 O VAL A 112 -17.706 34.255 25.974 1.00 30.49 O ATOM 890 CB VAL A 112 -15.747 33.464 28.279 1.00 30.06 C ATOM 891 CG1 VAL A 112 -17.124 32.874 28.445 1.00 29.59 C ATOM 892 CG2 VAL A 112 -14.721 32.409 27.936 1.00 31.40 C ATOM 893 H VAL A 112 -16.973 35.772 28.533 1.00 0.00 H ATOM 894 N LYS A 113 -15.841 33.522 25.075 1.00 29.61 N ATOM 895 CA LYS A 113 -16.588 32.942 23.948 1.00 32.30 C ATOM 896 C LYS A 113 -17.030 31.500 24.222 1.00 27.70 C ATOM 897 O LYS A 113 -16.260 30.688 24.670 1.00 28.28 O ATOM 898 CB LYS A 113 -15.793 33.100 22.667 1.00 37.35 C ATOM 899 CG LYS A 113 -15.247 34.560 22.487 1.00 45.30 C ATOM 900 CD LYS A 113 -16.253 35.556 21.780 1.00 50.19 C ATOM 901 CE LYS A 113 -15.900 37.060 21.995 1.00 49.38 C ATOM 902 NZ LYS A 113 -15.137 37.306 23.278 1.00 51.96 N ATOM 903 HZ1 LYS A 113 -15.712 36.995 24.087 1.00 0.00 H ATOM 904 HZ2 LYS A 113 -14.246 36.770 23.258 1.00 0.00 H ATOM 905 HZ3 LYS A 113 -14.930 38.321 23.368 1.00 0.00 H ATOM 906 H LYS A 113 -14.804 33.460 25.115 1.00 0.00 H ATOM 907 N MET A 114 -18.289 31.194 23.952 1.00 29.60 N ATOM 908 CA MET A 114 -18.824 29.861 24.256 1.00 31.52 C ATOM 909 C MET A 114 -18.396 28.807 23.185 1.00 33.33 C ATOM 910 O MET A 114 -17.876 29.174 22.145 1.00 33.87 O ATOM 911 CB MET A 114 -20.354 29.919 24.389 1.00 32.82 C ATOM 912 CG MET A 114 -20.864 31.003 25.326 1.00 33.54 C ATOM 913 SD MET A 114 -20.400 30.588 27.018 1.00 32.99 S ATOM 914 CE MET A 114 -20.956 32.038 27.876 1.00 32.23 C ATOM 915 H MET A 114 -18.908 31.908 23.518 1.00 0.00 H ATOM 916 N SER A 115 -18.352 27.542 23.592 1.00 31.20 N ATOM 917 CA SER A 115 -17.822 26.451 22.751 1.00 33.37 C ATOM 918 C SER A 115 -18.206 25.136 23.372 1.00 33.92 C ATOM 919 O SER A 115 -18.939 25.104 24.326 1.00 29.79 O ATOM 920 CB SER A 115 -16.290 26.533 22.622 1.00 31.91 C ATOM 921 OG SER A 115 -15.667 26.178 23.856 1.00 34.49 O ATOM 922 HG SER A 115 -14.684 26.236 23.756 1.00 0.00 H ATOM 923 H SER A 115 -18.706 27.312 24.542 1.00 0.00 H ATOM 924 N SER A 116 -17.712 24.041 22.832 1.00 32.65 N ATOM 925 CA SER A 116 -17.953 22.738 23.466 1.00 34.86 C ATOM 926 C SER A 116 -17.325 22.683 24.815 1.00 33.01 C ATOM 927 O SER A 116 -17.624 21.792 25.591 1.00 37.33 O ATOM 928 CB SER A 116 -17.420 21.602 22.647 1.00 34.53 C ATOM 929 OG SER A 116 -16.028 21.674 22.567 1.00 38.01 O ATOM 930 HG SER A 116 -15.690 20.918 22.024 1.00 0.00 H ATOM 931 H SER A 116 -17.152 24.099 21.958 1.00 0.00 H ATOM 932 N LYS A 117 -16.386 23.596 25.081 1.00 32.37 N ATOM 933 CA LYS A 117 -15.619 23.541 26.344 1.00 30.31 C ATOM 934 C LYS A 117 -16.017 24.592 27.314 1.00 27.22 C ATOM 935 O LYS A 117 -15.549 24.585 28.470 1.00 27.26 O ATOM 936 CB LYS A 117 -14.141 23.704 26.056 1.00 32.50 C ATOM 937 CG LYS A 117 -13.559 22.674 25.122 1.00 35.66 C ATOM 938 CD LYS A 117 -13.432 21.361 25.794 1.00 37.81 C ATOM 939 CE LYS A 117 -12.658 20.377 24.915 1.00 45.46 C ATOM 940 NZ LYS A 117 -13.502 19.219 24.520 1.00 45.95 N ATOM 941 HZ1 LYS A 117 -13.822 18.718 25.373 1.00 0.00 H ATOM 942 HZ2 LYS A 117 -14.327 19.559 23.986 1.00 0.00 H ATOM 943 HZ3 LYS A 117 -12.945 18.573 23.925 1.00 0.00 H ATOM 944 H LYS A 117 -16.193 24.352 24.393 1.00 0.00 H ATOM 945 N VAL A 118 -16.774 25.569 26.845 1.00 25.38 N ATOM 946 CA VAL A 118 -17.174 26.708 27.660 1.00 25.66 C ATOM 947 C VAL A 118 -18.676 26.998 27.527 1.00 27.23 C ATOM 948 O VAL A 118 -19.190 27.268 26.388 1.00 27.68 O ATOM 949 CB VAL A 118 -16.379 27.977 27.294 1.00 25.71 C ATOM 950 CG1 VAL A 118 -16.815 29.124 28.143 1.00 25.99 C ATOM 951 CG2 VAL A 118 -14.880 27.747 27.388 1.00 26.36 C ATOM 952 H VAL A 118 -17.096 25.523 25.857 1.00 0.00 H ATOM 953 N GLU A 119 -19.393 26.964 28.646 1.00 25.43 N ATOM 954 CA GLU A 119 -20.855 27.150 28.644 1.00 27.49 C ATOM 955 C GLU A 119 -21.328 27.478 30.059 1.00 27.71 C ATOM 956 O GLU A 119 -20.746 26.973 31.021 1.00 26.75 O ATOM 957 CB GLU A 119 -21.503 25.882 28.105 1.00 28.94 C ATOM 958 CG GLU A 119 -23.005 25.924 27.985 1.00 33.49 C ATOM 959 CD GLU A 119 -23.591 24.548 27.603 1.00 39.05 C ATOM 960 OE1 GLU A 119 -23.574 24.223 26.410 1.00 45.71 O ATOM 961 OE2 GLU A 119 -23.936 23.743 28.523 1.00 49.03 O ATOM 962 H GLU A 119 -18.907 26.801 29.551 1.00 0.00 H ATOM 963 N ALA A 120 -22.300 28.390 30.210 1.00 25.27 N ATOM 964 CA ALA A 120 -22.823 28.704 31.551 1.00 25.71 C ATOM 965 C ALA A 120 -23.630 27.572 32.070 1.00 24.93 C ATOM 966 O ALA A 120 -24.310 26.859 31.333 1.00 21.46 O ATOM 967 CB ALA A 120 -23.662 29.967 31.539 1.00 26.49 C ATOM 968 H ALA A 120 -22.686 28.878 29.377 1.00 0.00 H ATOM 969 N VAL A 121 -23.596 27.411 33.373 1.00 22.64 N ATOM 970 CA VAL A 121 -24.450 26.466 34.024 1.00 24.29 C ATOM 971 C VAL A 121 -25.880 27.064 34.110 1.00 26.31 C ATOM 972 O VAL A 121 -26.055 28.261 34.147 1.00 27.05 O ATOM 973 CB VAL A 121 -23.917 26.215 35.465 1.00 25.53 C ATOM 974 CG1 VAL A 121 -24.218 27.393 36.317 1.00 24.51 C ATOM 975 CG2 VAL A 121 -24.478 24.933 36.072 1.00 24.55 C ATOM 976 H VAL A 121 -22.937 27.980 33.941 1.00 0.00 H ATOM 977 N GLN A 122 -26.862 26.214 34.271 1.00 25.01 N ATOM 978 CA GLN A 122 -28.208 26.653 34.487 1.00 29.25 C ATOM 979 C GLN A 122 -28.415 26.948 35.955 1.00 28.92 C ATOM 980 O GLN A 122 -28.167 26.075 36.787 1.00 26.92 O ATOM 981 CB GLN A 122 -29.156 25.562 34.046 1.00 32.50 C ATOM 982 CG GLN A 122 -30.546 25.727 34.581 1.00 40.37 C ATOM 983 CD GLN A 122 -31.331 26.765 33.829 1.00 49.09 C ATOM 984 OE1 GLN A 122 -31.321 26.784 32.600 1.00 55.95 O ATOM 985 NE2 GLN A 122 -31.943 27.709 34.566 1.00 55.40 N ATOM 986 HE22 GLN A 122 -31.925 27.651 35.604 1.00 0.00 H ATOM 987 HE21 GLN A 122 -32.434 28.497 34.098 1.00 0.00 H ATOM 988 H GLN A 122 -26.660 25.194 34.241 1.00 0.00 H ATOM 989 N LEU A 123 -28.829 28.187 36.278 1.00 28.57 N ATOM 990 CA LEU A 123 -29.177 28.549 37.649 1.00 29.51 C ATOM 991 C LEU A 123 -30.540 27.949 38.069 1.00 30.78 C ATOM 992 O LEU A 123 -31.334 27.595 37.227 1.00 28.77 O ATOM 993 CB LEU A 123 -29.203 30.075 37.824 1.00 28.31 C ATOM 994 CG LEU A 123 -27.835 30.758 37.708 1.00 28.46 C ATOM 995 CD1 LEU A 123 -28.032 32.232 37.451 1.00 29.72 C ATOM 996 CD2 LEU A 123 -26.995 30.541 38.999 1.00 28.79 C ATOM 997 H LEU A 123 -28.903 28.906 35.531 1.00 0.00 H ATOM 998 N PRO A 124 -30.677 27.608 39.362 1.00 29.56 N ATOM 999 CA PRO A 124 -31.817 26.793 39.803 1.00 31.49 C ATOM 1000 C PRO A 124 -33.086 27.597 39.805 1.00 31.99 C ATOM 1001 O PRO A 124 -33.051 28.778 40.066 1.00 34.05 O ATOM 1002 CB PRO A 124 -31.428 26.395 41.242 1.00 29.92 C ATOM 1003 CG PRO A 124 -30.540 27.475 41.702 1.00 28.21 C ATOM 1004 CD PRO A 124 -29.798 27.971 40.473 1.00 30.13 C ATOM 1005 N GLU A 125 -34.202 26.970 39.504 1.00 39.02 N ATOM 1006 CA GLU A 125 -35.485 27.607 39.733 1.00 44.75 C ATOM 1007 C GLU A 125 -36.106 27.155 41.031 1.00 44.29 C ATOM 1008 O GLU A 125 -36.806 27.924 41.685 1.00 47.74 O ATOM 1009 CB GLU A 125 -36.432 27.343 38.580 1.00 51.77 C ATOM 1010 CG GLU A 125 -36.302 28.348 37.443 1.00 59.52 C ATOM 1011 CD GLU A 125 -37.121 27.955 36.221 1.00 67.74 C ATOM 1012 OE1 GLU A 125 -37.751 26.874 36.240 1.00 70.71 O ATOM 1013 OE2 GLU A 125 -37.143 28.734 35.245 1.00 73.37 O ATOM 1014 H GLU A 125 -34.165 26.013 39.100 1.00 0.00 H ATOM 1015 N HIS A 128 -35.798 25.937 41.453 1.00 39.62 N ATOM 1016 CA HIS A 128 -36.281 25.457 42.723 1.00 41.55 C ATOM 1017 C HIS A 128 -35.142 24.785 43.507 1.00 36.08 C ATOM 1018 O HIS A 128 -34.041 24.609 42.991 1.00 30.97 O ATOM 1019 CB HIS A 128 -37.488 24.531 42.505 1.00 44.12 C ATOM 1020 CG HIS A 128 -37.128 23.168 42.014 1.00 51.55 C ATOM 1021 ND1 HIS A 128 -36.337 22.957 40.905 1.00 63.33 N ATOM 1022 CD2 HIS A 128 -37.436 21.935 42.495 1.00 61.96 C ATOM 1023 CE1 HIS A 128 -36.178 21.655 40.719 1.00 59.01 C ATOM 1024 NE2 HIS A 128 -36.848 21.014 41.659 1.00 61.71 N ATOM 1025 H HIS A 128 -35.202 25.322 40.862 1.00 0.00 H ATOM 1026 N CYS A 129 -35.385 24.533 44.782 1.00 32.86 N ATOM 1027 CA CYS A 129 -34.449 23.826 45.637 1.00 32.02 C ATOM 1028 C CYS A 129 -34.656 22.331 45.521 1.00 31.22 C ATOM 1029 O CYS A 129 -35.731 21.845 45.796 1.00 34.59 O ATOM 1030 CB CYS A 129 -34.667 24.219 47.116 1.00 32.10 C ATOM 1031 SG CYS A 129 -34.488 25.973 47.491 1.00 32.49 S ATOM 1032 H CYS A 129 -36.286 24.855 45.190 1.00 0.00 H ATOM 1033 N GLU A 130 -33.627 21.594 45.147 1.00 28.86 N ATOM 1034 CA GLU A 130 -33.737 20.158 45.054 1.00 28.87 C ATOM 1035 C GLU A 130 -33.778 19.581 46.472 1.00 30.85 C ATOM 1036 O GLU A 130 -33.147 20.135 47.367 1.00 27.92 O ATOM 1037 CB GLU A 130 -32.550 19.586 44.264 1.00 30.30 C ATOM 1038 CG GLU A 130 -32.601 19.906 42.759 1.00 30.92 C ATOM 1039 CD GLU A 130 -33.757 19.215 42.050 1.00 37.78 C ATOM 1040 OE1 GLU A 130 -34.334 18.275 42.645 1.00 41.65 O ATOM 1041 OE2 GLU A 130 -33.952 19.459 40.832 1.00 41.19 O ATOM 1042 H GLU A 130 -32.724 22.055 44.916 1.00 0.00 H ATOM 1043 N PRO A 131 -34.506 18.467 46.668 1.00 31.16 N ATOM 1044 CA PRO A 131 -34.748 17.988 48.051 1.00 31.77 C ATOM 1045 C PRO A 131 -33.679 17.001 48.501 1.00 31.56 C ATOM 1046 O PRO A 131 -32.926 16.442 47.665 1.00 29.32 O ATOM 1047 CB PRO A 131 -36.118 17.264 47.926 1.00 33.29 C ATOM 1048 CG PRO A 131 -36.063 16.682 46.548 1.00 32.26 C ATOM 1049 CD PRO A 131 -35.431 17.822 45.719 1.00 30.46 C ATOM 1050 N PRO A 132 -33.726 16.622 49.774 1.00 31.70 N ATOM 1051 CA PRO A 132 -32.796 15.598 50.245 1.00 31.63 C ATOM 1052 C PRO A 132 -32.911 14.276 49.446 1.00 30.96 C ATOM 1053 O PRO A 132 -33.999 13.937 48.934 1.00 33.93 O ATOM 1054 CB PRO A 132 -33.200 15.408 51.729 1.00 32.29 C ATOM 1055 CG PRO A 132 -33.851 16.719 52.102 1.00 32.86 C ATOM 1056 CD PRO A 132 -34.527 17.224 50.867 1.00 34.10 C ATOM 1057 N GLY A 133 -31.778 13.629 49.216 1.00 29.71 N ATOM 1058 CA GLY A 133 -31.729 12.372 48.527 1.00 29.52 C ATOM 1059 C GLY A 133 -31.428 12.553 47.039 1.00 27.94 C ATOM 1060 O GLY A 133 -30.977 11.638 46.415 1.00 28.12 O ATOM 1061 H GLY A 133 -30.887 14.050 49.549 1.00 0.00 H ATOM 1062 N THR A 134 -31.473 13.795 46.567 1.00 28.91 N ATOM 1063 CA THR A 134 -31.220 14.100 45.120 1.00 28.93 C ATOM 1064 C THR A 134 -29.732 13.832 44.771 1.00 27.89 C ATOM 1065 O THR A 134 -28.865 14.174 45.545 1.00 27.76 O ATOM 1066 CB THR A 134 -31.544 15.575 44.805 1.00 27.22 C ATOM 1067 OG1 THR A 134 -32.951 15.850 45.035 1.00 26.60 O ATOM 1068 CG2 THR A 134 -31.241 15.878 43.349 1.00 28.17 C ATOM 1069 HG1 THR A 134 -33.499 15.269 44.451 1.00 0.00 H ATOM 1070 H THR A 134 -31.689 14.576 47.218 1.00 0.00 H ATOM 1071 N SER A 135 -29.472 13.157 43.650 1.00 27.22 N ATOM 1072 CA SER A 135 -28.109 12.840 43.216 1.00 28.51 C ATOM 1073 C SER A 135 -27.483 14.039 42.574 1.00 27.68 C ATOM 1074 O SER A 135 -28.132 14.706 41.758 1.00 28.67 O ATOM 1075 CB SER A 135 -28.084 11.681 42.181 1.00 32.44 C ATOM 1076 OG SER A 135 -28.287 10.477 42.869 1.00 39.76 O ATOM 1077 HG SER A 135 -28.274 9.725 42.226 1.00 0.00 H ATOM 1078 H SER A 135 -30.269 12.843 43.060 1.00 0.00 H ATOM 1079 N CYS A 136 -26.248 14.322 42.962 1.00 25.47 N ATOM 1080 CA CYS A 136 -25.502 15.488 42.482 1.00 25.89 C ATOM 1081 C CYS A 136 -24.068 15.130 42.183 1.00 25.00 C ATOM 1082 O CYS A 136 -23.589 14.056 42.551 1.00 25.32 O ATOM 1083 CB CYS A 136 -25.496 16.569 43.549 1.00 26.30 C ATOM 1084 SG CYS A 136 -27.081 16.935 44.240 1.00 28.82 S ATOM 1085 H CYS A 136 -25.785 13.685 43.641 1.00 0.00 H ATOM 1086 N THR A 137 -23.354 16.068 41.543 1.00 24.98 N ATOM 1087 CA THR A 137 -21.944 15.958 41.335 1.00 22.95 C ATOM 1088 C THR A 137 -21.259 17.286 41.622 1.00 21.93 C ATOM 1089 O THR A 137 -21.794 18.381 41.300 1.00 20.02 O ATOM 1090 CB THR A 137 -21.626 15.526 39.887 1.00 23.10 C ATOM 1091 OG1 THR A 137 -22.261 14.258 39.620 1.00 23.23 O ATOM 1092 CG2 THR A 137 -20.086 15.369 39.707 1.00 22.48 C ATOM 1093 HG1 THR A 137 -21.918 13.579 40.253 1.00 0.00 H ATOM 1094 H THR A 137 -23.847 16.910 41.183 1.00 0.00 H ATOM 1095 N VAL A 138 -20.137 17.202 42.332 1.00 21.11 N ATOM 1096 CA VAL A 138 -19.279 18.335 42.640 1.00 20.41 C ATOM 1097 C VAL A 138 -17.942 18.113 41.966 1.00 21.18 C ATOM 1098 O VAL A 138 -17.454 16.984 41.965 1.00 20.17 O ATOM 1099 CB VAL A 138 -19.068 18.501 44.173 1.00 22.28 C ATOM 1100 CG1 VAL A 138 -18.375 17.257 44.764 1.00 22.37 C ATOM 1101 CG2 VAL A 138 -18.323 19.825 44.487 1.00 22.55 C ATOM 1102 H VAL A 138 -19.856 16.267 42.689 1.00 0.00 H ATOM 1103 N SER A 139 -17.314 19.206 41.452 1.00 20.55 N ATOM 1104 CA SER A 139 -16.054 19.130 40.721 1.00 19.82 C ATOM 1105 C SER A 139 -15.053 20.140 41.199 1.00 21.39 C ATOM 1106 O SER A 139 -15.441 21.190 41.765 1.00 23.22 O ATOM 1107 CB SER A 139 -16.323 19.303 39.222 1.00 20.12 C ATOM 1108 OG SER A 139 -17.046 20.506 38.990 1.00 18.94 O ATOM 1109 HG SER A 139 -16.516 21.276 39.316 1.00 0.00 H ATOM 1110 H SER A 139 -17.753 20.139 41.587 1.00 0.00 H ATOM 1111 N GLY A 140 -13.775 19.787 41.124 1.00 21.07 N ATOM 1112 CA GLY A 140 -12.690 20.721 41.442 1.00 22.16 C ATOM 1113 C GLY A 140 -11.303 20.154 41.330 1.00 21.54 C ATOM 1114 O GLY A 140 -11.126 18.906 41.062 1.00 22.03 O ATOM 1115 H GLY A 140 -13.536 18.818 40.831 1.00 0.00 H ATOM 1116 N TRP A 141 -10.320 21.071 41.346 1.00 19.86 N ATOM 1117 CA TRP A 141 -8.918 20.745 41.239 1.00 20.04 C ATOM 1118 C TRP A 141 -8.242 20.663 42.623 1.00 21.45 C ATOM 1119 O TRP A 141 -6.998 20.710 42.762 1.00 21.09 O ATOM 1120 CB TRP A 141 -8.248 21.745 40.407 1.00 19.81 C ATOM 1121 CG TRP A 141 -8.579 21.581 38.916 1.00 19.54 C ATOM 1122 CD1 TRP A 141 -8.020 20.676 38.071 1.00 19.64 C ATOM 1123 CD2 TRP A 141 -9.385 22.478 38.064 1.00 19.42 C ATOM 1124 NE1 TRP A 141 -8.485 20.918 36.759 1.00 19.39 N ATOM 1125 CE2 TRP A 141 -9.273 22.011 36.741 1.00 18.87 C ATOM 1126 CE3 TRP A 141 -10.145 23.628 38.297 1.00 18.68 C ATOM 1127 CZ2 TRP A 141 -9.912 22.658 35.683 1.00 18.61 C ATOM 1128 CZ3 TRP A 141 -10.775 24.224 37.301 1.00 19.65 C ATOM 1129 CH2 TRP A 141 -10.714 23.700 35.995 1.00 18.76 C ATOM 1130 HE1 TRP A 141 -8.253 20.337 35.928 1.00 0.00 H ATOM 1131 H TRP A 141 -10.585 22.072 41.441 1.00 0.00 H ATOM 1132 N GLY A 142 -9.065 20.642 43.646 1.00 22.00 N ATOM 1133 CA GLY A 142 -8.532 20.547 45.002 1.00 24.50 C ATOM 1134 C GLY A 142 -7.768 19.275 45.249 1.00 25.02 C ATOM 1135 O GLY A 142 -7.672 18.360 44.380 1.00 23.25 O ATOM 1136 H GLY A 142 -10.092 20.693 43.491 1.00 0.00 H ATOM 1137 N THR A 143 -7.192 19.185 46.456 1.00 23.41 N ATOM 1138 CA THR A 143 -6.373 18.073 46.791 1.00 24.68 C ATOM 1139 C THR A 143 -7.196 16.764 46.850 1.00 23.40 C ATOM 1140 O THR A 143 -8.367 16.762 47.263 1.00 22.82 O ATOM 1141 CB THR A 143 -5.666 18.287 48.186 1.00 25.11 C ATOM 1142 OG1 THR A 143 -4.874 17.118 48.500 1.00 24.83 O ATOM 1143 CG2 THR A 143 -6.688 18.503 49.257 1.00 29.60 C ATOM 1144 HG1 THR A 143 -5.463 16.324 48.543 1.00 0.00 H ATOM 1145 H THR A 143 -7.346 19.938 47.156 1.00 0.00 H ATOM 1146 N THR A 144 -6.535 15.659 46.542 1.00 24.04 N ATOM 1147 CA THR A 144 -7.182 14.352 46.460 1.00 25.98 C ATOM 1148 C THR A 144 -6.807 13.517 47.709 1.00 27.69 C ATOM 1149 O THR A 144 -7.168 12.344 47.829 1.00 29.67 O ATOM 1150 CB THR A 144 -6.764 13.598 45.233 1.00 26.28 C ATOM 1151 OG1 THR A 144 -5.333 13.387 45.238 1.00 27.24 O ATOM 1152 CG2 THR A 144 -7.170 14.374 43.948 1.00 25.42 C ATOM 1153 HG1 THR A 144 -4.872 14.263 45.253 1.00 0.00 H ATOM 1154 H THR A 144 -5.515 15.724 46.351 1.00 0.00 H ATOM 1155 N THR A 145 -6.039 14.128 48.578 1.00 28.73 N ATOM 1156 CA THR A 145 -5.658 13.535 49.830 1.00 29.52 C ATOM 1157 C THR A 145 -5.703 14.582 50.923 1.00 27.99 C ATOM 1158 O THR A 145 -5.652 15.782 50.668 1.00 26.21 O ATOM 1159 CB THR A 145 -4.250 12.918 49.819 1.00 29.35 C ATOM 1160 OG1 THR A 145 -3.254 13.908 49.498 1.00 28.97 O ATOM 1161 CG2 THR A 145 -4.162 11.719 48.878 1.00 32.21 C ATOM 1162 HG1 THR A 145 -3.279 14.631 50.174 1.00 0.00 H ATOM 1163 H THR A 145 -5.691 15.082 48.352 1.00 0.00 H ATOM 1164 N SER A 146 -5.795 14.129 52.165 1.00 28.94 N ATOM 1165 CA SER A 146 -5.799 15.084 53.309 1.00 28.10 C ATOM 1166 C SER A 146 -5.469 14.300 54.544 1.00 31.74 C ATOM 1167 O SER A 146 -5.973 13.189 54.714 1.00 29.70 O ATOM 1168 CB SER A 146 -7.175 15.735 53.446 1.00 29.01 C ATOM 1169 OG SER A 146 -7.197 16.747 54.440 1.00 28.08 O ATOM 1170 HG SER A 146 -6.545 17.454 54.204 1.00 0.00 H ATOM 1171 H SER A 146 -5.864 13.106 52.341 1.00 0.00 H ATOM 1172 N PRO A 147 -4.596 14.820 55.396 1.00 33.11 N ATOM 1173 CA PRO A 147 -4.173 16.225 55.417 1.00 35.17 C ATOM 1174 C PRO A 147 -2.914 16.503 54.586 1.00 36.84 C ATOM 1175 O PRO A 147 -2.592 17.638 54.365 1.00 42.91 O ATOM 1176 CB PRO A 147 -3.857 16.456 56.894 1.00 36.94 C ATOM 1177 CG PRO A 147 -3.458 15.127 57.385 1.00 35.71 C ATOM 1178 CD PRO A 147 -4.315 14.141 56.662 1.00 36.64 C ATOM 1179 N ASP A 148 -2.168 15.469 54.252 1.00 41.78 N ATOM 1180 CA ASP A 148 -1.113 15.554 53.238 1.00 40.89 C ATOM 1181 C ASP A 148 -1.743 15.896 51.873 1.00 41.28 C ATOM 1182 O ASP A 148 -2.699 15.273 51.494 1.00 40.14 O ATOM 1183 CB ASP A 148 -0.429 14.194 53.143 1.00 47.41 C ATOM 1184 CG ASP A 148 -1.462 13.004 53.068 1.00 56.06 C ATOM 1185 OD1 ASP A 148 -2.444 12.971 53.899 1.00 51.20 O ATOM 1186 OD2 ASP A 148 -1.289 12.115 52.186 1.00 55.01 O ATOM 1187 H ASP A 148 -2.334 14.558 54.726 1.00 0.00 H ATOM 1188 N VAL A 149 -1.268 16.934 51.185 1.00 36.06 N ATOM 1189 CA VAL A 149 -2.017 17.397 49.975 1.00 34.12 C ATOM 1190 C VAL A 149 -1.374 16.826 48.739 1.00 30.80 C ATOM 1191 O VAL A 149 -0.194 16.609 48.718 1.00 33.23 O ATOM 1192 CB VAL A 149 -2.139 18.932 49.862 1.00 36.11 C ATOM 1193 CG1 VAL A 149 -2.803 19.533 51.111 1.00 39.83 C ATOM 1194 CG2 VAL A 149 -0.791 19.574 49.586 1.00 37.57 C ATOM 1195 H VAL A 149 -0.394 17.413 51.483 1.00 0.00 H ATOM 1196 N THR A 150 -2.191 16.531 47.741 1.00 31.22 N ATOM 1197 CA THR A 150 -1.734 16.083 46.439 1.00 29.97 C ATOM 1198 C THR A 150 -2.674 16.745 45.451 1.00 29.72 C ATOM 1199 O THR A 150 -3.853 16.396 45.432 1.00 27.63 O ATOM 1200 CB THR A 150 -1.945 14.565 46.241 1.00 31.95 C ATOM 1201 OG1 THR A 150 -1.476 13.844 47.374 1.00 34.21 O ATOM 1202 CG2 THR A 150 -1.226 14.084 45.003 1.00 33.24 C ATOM 1203 HG1 THR A 150 -1.974 14.136 48.179 1.00 0.00 H ATOM 1204 H THR A 150 -3.215 16.625 47.898 1.00 0.00 H ATOM 1205 N PHE A 151 -2.160 17.695 44.658 1.00 29.80 N ATOM 1206 CA PHE A 151 -2.983 18.434 43.727 1.00 26.81 C ATOM 1207 C PHE A 151 -2.986 17.816 42.329 1.00 27.15 C ATOM 1208 O PHE A 151 -1.930 17.603 41.730 1.00 28.04 O ATOM 1209 CB PHE A 151 -2.566 19.881 43.676 1.00 29.26 C ATOM 1210 CG PHE A 151 -2.922 20.655 44.940 1.00 27.24 C ATOM 1211 CD1 PHE A 151 -4.211 21.022 45.185 1.00 27.53 C ATOM 1212 CD2 PHE A 151 -1.966 20.944 45.882 1.00 30.15 C ATOM 1213 CE1 PHE A 151 -4.525 21.839 46.230 1.00 28.65 C ATOM 1214 CE2 PHE A 151 -2.301 21.654 47.029 1.00 29.35 C ATOM 1215 CZ PHE A 151 -3.588 22.074 47.214 1.00 30.30 C ATOM 1216 H PHE A 151 -1.143 17.906 44.714 1.00 0.00 H ATOM 1217 N PRO A 152 -4.180 17.603 41.775 1.00 25.01 N ATOM 1218 CA PRO A 152 -4.202 16.915 40.482 1.00 24.40 C ATOM 1219 C PRO A 152 -4.053 17.872 39.315 1.00 24.73 C ATOM 1220 O PRO A 152 -4.353 19.062 39.461 1.00 23.99 O ATOM 1221 CB PRO A 152 -5.568 16.268 40.474 1.00 23.59 C ATOM 1222 CG PRO A 152 -6.415 17.205 41.275 1.00 24.13 C ATOM 1223 CD PRO A 152 -5.523 17.700 42.360 1.00 24.12 C ATOM 1224 N SER A 153 -3.803 17.318 38.113 1.00 23.47 N ATOM 1225 CA SER A 153 -3.918 18.086 36.871 1.00 23.99 C ATOM 1226 C SER A 153 -5.379 18.149 36.388 1.00 23.26 C ATOM 1227 O SER A 153 -5.876 19.217 35.981 1.00 22.15 O ATOM 1228 CB SER A 153 -3.065 17.453 35.763 1.00 24.79 C ATOM 1229 OG SER A 153 -3.208 18.168 34.566 1.00 23.65 O ATOM 1230 HG SER A 153 -2.652 17.747 33.863 1.00 0.00 H ATOM 1231 H SER A 153 -3.521 16.318 38.065 1.00 0.00 H ATOM 1232 N ASP A 154 -6.005 16.980 36.332 1.00 24.02 N ATOM 1233 CA ASP A 154 -7.345 16.812 35.742 1.00 24.98 C ATOM 1234 C ASP A 154 -8.432 17.230 36.760 1.00 23.20 C ATOM 1235 O ASP A 154 -8.354 16.919 37.958 1.00 23.01 O ATOM 1236 CB ASP A 154 -7.576 15.360 35.322 1.00 27.69 C ATOM 1237 CG ASP A 154 -6.694 14.932 34.151 1.00 31.14 C ATOM 1238 OD1 ASP A 154 -6.936 15.353 33.033 1.00 32.26 O ATOM 1239 OD2 ASP A 154 -5.707 14.235 34.392 1.00 34.54 O ATOM 1240 H ASP A 154 -5.527 16.143 36.723 1.00 0.00 H ATOM 1241 N LEU A 155 -9.463 17.859 36.254 1.00 20.20 N ATOM 1242 CA LEU A 155 -10.654 18.189 37.018 1.00 20.27 C ATOM 1243 C LEU A 155 -11.268 16.925 37.555 1.00 20.68 C ATOM 1244 O LEU A 155 -11.516 16.013 36.811 1.00 20.63 O ATOM 1245 CB LEU A 155 -11.666 18.900 36.132 1.00 21.09 C ATOM 1246 CG LEU A 155 -12.944 19.456 36.790 1.00 19.81 C ATOM 1247 CD1 LEU A 155 -12.513 20.586 37.728 1.00 19.46 C ATOM 1248 CD2 LEU A 155 -13.967 19.972 35.761 1.00 20.50 C ATOM 1249 H LEU A 155 -9.427 18.137 35.252 1.00 0.00 H ATOM 1250 N MET A 156 -11.408 16.828 38.880 1.00 21.43 N ATOM 1251 CA MET A 156 -11.960 15.655 39.502 1.00 22.09 C ATOM 1252 C MET A 156 -13.438 15.869 39.872 1.00 22.63 C ATOM 1253 O MET A 156 -13.856 16.997 40.102 1.00 20.94 O ATOM 1254 CB MET A 156 -11.167 15.301 40.761 1.00 22.16 C ATOM 1255 CG MET A 156 -9.695 14.982 40.496 1.00 23.92 C ATOM 1256 SD MET A 156 -9.422 13.645 39.294 1.00 26.56 S ATOM 1257 CE MET A 156 -9.913 12.282 40.337 1.00 24.75 C ATOM 1258 H MET A 156 -11.109 17.624 39.479 1.00 0.00 H ATOM 1259 N CYS A 157 -14.193 14.766 39.936 1.00 23.48 N ATOM 1260 CA CYS A 157 -15.641 14.782 40.263 1.00 21.07 C ATOM 1261 C CYS A 157 -15.957 13.826 41.398 1.00 20.72 C ATOM 1262 O CYS A 157 -15.322 12.804 41.574 1.00 20.88 O ATOM 1263 CB CYS A 157 -16.435 14.383 39.057 1.00 22.00 C ATOM 1264 SG CYS A 157 -16.717 15.688 37.810 1.00 23.40 S ATOM 1265 H CYS A 157 -13.741 13.849 39.747 1.00 0.00 H ATOM 1266 N SER A 158 -16.957 14.168 42.179 1.00 21.64 N ATOM 1267 CA SER A 158 -17.464 13.297 43.221 1.00 21.92 C ATOM 1268 C SER A 158 -18.961 13.274 43.098 1.00 22.34 C ATOM 1269 O SER A 158 -19.574 14.319 43.035 1.00 22.63 O ATOM 1270 CB SER A 158 -17.118 13.861 44.600 1.00 23.02 C ATOM 1271 OG SER A 158 -17.791 13.126 45.602 1.00 23.79 O ATOM 1272 HG SER A 158 -17.512 12.177 45.557 1.00 0.00 H ATOM 1273 H SER A 158 -17.401 15.099 42.044 1.00 0.00 H ATOM 1274 N ASP A 159 -19.552 12.097 43.153 1.00 22.55 N ATOM 1275 CA ASP A 159 -20.974 11.976 43.147 1.00 23.63 C ATOM 1276 C ASP A 159 -21.483 11.918 44.616 1.00 23.45 C ATOM 1277 O ASP A 159 -21.062 11.060 45.383 1.00 24.49 O ATOM 1278 CB ASP A 159 -21.382 10.765 42.423 1.00 24.84 C ATOM 1279 CG ASP A 159 -21.031 10.816 40.948 1.00 27.05 C ATOM 1280 OD1 ASP A 159 -21.016 11.921 40.369 1.00 27.19 O ATOM 1281 OD2 ASP A 159 -20.628 9.792 40.402 1.00 27.49 O ATOM 1282 H ASP A 159 -18.969 11.237 43.202 1.00 0.00 H ATOM 1283 N VAL A 160 -22.369 12.835 44.966 1.00 24.41 N ATOM 1284 CA VAL A 160 -22.876 12.964 46.342 1.00 25.02 C ATOM 1285 C VAL A 160 -24.377 13.199 46.301 1.00 24.69 C ATOM 1286 O VAL A 160 -24.927 13.564 45.265 1.00 24.70 O ATOM 1287 CB VAL A 160 -22.172 14.086 47.088 1.00 25.22 C ATOM 1288 CG1 VAL A 160 -20.703 13.753 47.294 1.00 26.01 C ATOM 1289 CG2 VAL A 160 -22.285 15.396 46.369 1.00 28.04 C ATOM 1290 H VAL A 160 -22.722 13.491 44.240 1.00 0.00 H ATOM 1291 N LYS A 161 -25.065 12.961 47.431 1.00 25.19 N ATOM 1292 CA LYS A 161 -26.488 13.195 47.486 1.00 25.33 C ATOM 1293 C LYS A 161 -26.754 14.276 48.515 1.00 26.03 C ATOM 1294 O LYS A 161 -26.082 14.348 49.541 1.00 24.50 O ATOM 1295 CB LYS A 161 -27.245 11.895 47.881 1.00 27.15 C ATOM 1296 CG LYS A 161 -27.223 10.849 46.793 1.00 28.98 C ATOM 1297 CD LYS A 161 -27.810 9.519 47.215 1.00 30.70 C ATOM 1298 CE LYS A 161 -28.101 8.756 45.918 1.00 31.91 C ATOM 1299 NZ LYS A 161 -26.831 8.293 45.288 1.00 28.78 N ATOM 1300 HZ1 LYS A 161 -26.234 9.116 45.070 1.00 0.00 H ATOM 1301 HZ2 LYS A 161 -26.329 7.663 45.946 1.00 0.00 H ATOM 1302 HZ3 LYS A 161 -27.048 7.778 44.411 1.00 0.00 H ATOM 1303 H LYS A 161 -24.568 12.605 48.272 1.00 0.00 H ATOM 1304 N LEU A 162 -27.822 15.010 48.325 1.00 26.35 N ATOM 1305 CA LEU A 162 -28.185 16.045 49.328 1.00 25.21 C ATOM 1306 C LEU A 162 -28.624 15.416 50.639 1.00 25.80 C ATOM 1307 O LEU A 162 -29.275 14.414 50.654 1.00 27.57 O ATOM 1308 CB LEU A 162 -29.255 16.929 48.769 1.00 26.38 C ATOM 1309 CG LEU A 162 -28.815 17.587 47.445 1.00 27.18 C ATOM 1310 CD1 LEU A 162 -29.931 18.460 46.952 1.00 31.76 C ATOM 1311 CD2 LEU A 162 -27.569 18.418 47.647 1.00 28.38 C ATOM 1312 H LEU A 162 -28.411 14.870 47.479 1.00 0.00 H ATOM 1313 N ILE A 163 -28.214 16.006 51.739 1.00 27.23 N ATOM 1314 CA ILE A 163 -28.608 15.527 53.072 1.00 30.91 C ATOM 1315 C ILE A 163 -29.518 16.587 53.683 1.00 31.68 C ATOM 1316 O ILE A 163 -29.363 17.748 53.388 1.00 30.82 O ATOM 1317 CB ILE A 163 -27.331 15.287 53.902 1.00 33.01 C ATOM 1318 CG1 ILE A 163 -26.515 14.167 53.212 1.00 36.26 C ATOM 1319 CG2 ILE A 163 -27.639 14.863 55.288 1.00 34.32 C ATOM 1320 CD1 ILE A 163 -25.106 13.993 53.756 1.00 38.62 C ATOM 1321 H ILE A 163 -27.592 16.836 51.665 1.00 0.00 H ATOM 1322 N SER A 164 -30.565 16.182 54.411 1.00 35.37 N ATOM 1323 CA SER A 164 -31.456 17.176 54.981 1.00 34.79 C ATOM 1324 C SER A 164 -30.715 17.906 56.091 1.00 36.44 C ATOM 1325 O SER A 164 -29.784 17.369 56.662 1.00 33.96 O ATOM 1326 CB SER A 164 -32.732 16.554 55.509 1.00 36.79 C ATOM 1327 OG SER A 164 -32.460 15.534 56.454 1.00 36.52 O ATOM 1328 HG SER A 164 -31.919 14.824 56.025 1.00 0.00 H ATOM 1329 H SER A 164 -30.738 15.168 54.566 1.00 0.00 H ATOM 1330 N SER A 165 -31.190 19.097 56.414 1.00 38.53 N ATOM 1331 CA SER A 165 -30.731 19.853 57.573 1.00 42.43 C ATOM 1332 C SER A 165 -30.717 19.031 58.813 1.00 42.92 C ATOM 1333 O SER A 165 -29.735 19.021 59.544 1.00 44.61 O ATOM 1334 CB SER A 165 -31.649 21.035 57.801 1.00 47.07 C ATOM 1335 OG SER A 165 -31.740 21.778 56.622 1.00 49.75 O ATOM 1336 HG SER A 165 -32.340 22.552 56.767 1.00 0.00 H ATOM 1337 H SER A 165 -31.927 19.515 55.812 1.00 0.00 H ATOM 1338 N ARG A 166 -31.829 18.374 59.090 1.00 44.56 N ATOM 1339 CA ARG A 166 -31.953 17.656 60.322 1.00 46.42 C ATOM 1340 C ARG A 166 -30.867 16.586 60.464 1.00 44.08 C ATOM 1341 O ARG A 166 -30.282 16.423 61.531 1.00 40.42 O ATOM 1342 CB ARG A 166 -33.331 17.039 60.476 1.00 51.69 C ATOM 1343 CG ARG A 166 -33.413 16.184 61.729 1.00 58.82 C ATOM 1344 CD ARG A 166 -34.719 16.337 62.487 1.00 62.09 C ATOM 1345 NE ARG A 166 -34.655 15.602 63.746 1.00 68.44 N ATOM 1346 CZ ARG A 166 -34.563 14.273 63.840 1.00 75.84 C ATOM 1347 NH1 ARG A 166 -34.628 13.507 62.750 1.00 79.88 N ATOM 1348 NH2 ARG A 166 -34.423 13.705 65.032 1.00 76.26 N ATOM 1349 HE ARG A 166 -34.683 16.150 64.629 1.00 0.00 H ATOM 1350 HH12 ARG A 166 -34.555 12.473 62.836 1.00 0.00 H ATOM 1351 HH11 ARG A 166 -34.752 13.944 61.814 1.00 0.00 H ATOM 1352 HH22 ARG A 166 -34.351 12.670 65.110 1.00 0.00 H ATOM 1353 HH21 ARG A 166 -34.385 14.295 65.888 1.00 0.00 H ATOM 1354 H ARG A 166 -32.617 18.378 58.411 1.00 0.00 H ATOM 1355 N GLU A 167 -30.554 15.893 59.390 1.00 41.61 N ATOM 1356 CA GLU A 167 -29.520 14.855 59.457 1.00 40.66 C ATOM 1357 C GLU A 167 -28.165 15.491 59.546 1.00 37.89 C ATOM 1358 O GLU A 167 -27.280 15.019 60.302 1.00 36.30 O ATOM 1359 CB GLU A 167 -29.588 13.948 58.211 1.00 41.78 C ATOM 1360 CG GLU A 167 -30.720 12.944 58.262 1.00 50.00 C ATOM 1361 CD GLU A 167 -30.439 11.820 59.242 1.00 56.66 C ATOM 1362 OE1 GLU A 167 -29.553 11.002 58.942 1.00 63.12 O ATOM 1363 OE2 GLU A 167 -31.041 11.803 60.340 1.00 56.87 O ATOM 1364 H GLU A 167 -31.041 16.082 58.491 1.00 0.00 H ATOM 1365 N CYS A 168 -27.987 16.593 58.798 1.00 35.08 N ATOM 1366 CA CYS A 168 -26.697 17.281 58.802 1.00 35.34 C ATOM 1367 C CYS A 168 -26.385 17.921 60.145 1.00 37.33 C ATOM 1368 O CYS A 168 -25.242 18.063 60.510 1.00 34.95 O ATOM 1369 CB CYS A 168 -26.611 18.322 57.703 1.00 35.42 C ATOM 1370 SG CYS A 168 -24.899 18.668 57.327 1.00 34.06 S ATOM 1371 H CYS A 168 -28.768 16.957 58.215 1.00 0.00 H ATOM 1372 N LYS A 169 -27.413 18.348 60.833 1.00 38.62 N ATOM 1373 CA LYS A 169 -27.252 18.904 62.190 1.00 45.28 C ATOM 1374 C LYS A 169 -26.774 17.945 63.224 1.00 41.63 C ATOM 1375 O LYS A 169 -26.152 18.352 64.187 1.00 41.16 O ATOM 1376 CB LYS A 169 -28.527 19.537 62.653 1.00 46.54 C ATOM 1377 CG LYS A 169 -28.477 21.037 62.482 1.00 53.98 C ATOM 1378 CD LYS A 169 -29.689 21.589 61.763 1.00 57.80 C ATOM 1379 CE LYS A 169 -29.820 23.073 62.049 1.00 58.99 C ATOM 1380 NZ LYS A 169 -31.240 23.461 62.189 1.00 61.77 N ATOM 1381 HZ1 LYS A 169 -31.746 23.244 61.307 1.00 0.00 H ATOM 1382 HZ2 LYS A 169 -31.667 22.930 62.974 1.00 0.00 H ATOM 1383 HZ3 LYS A 169 -31.302 24.481 62.384 1.00 0.00 H ATOM 1384 H LYS A 169 -28.364 18.294 60.414 1.00 0.00 H ATOM 1385 N LYS A 170 -26.945 16.653 62.981 1.00 39.50 N ATOM 1386 CA LYS A 170 -26.405 15.657 63.889 1.00 44.28 C ATOM 1387 C LYS A 170 -24.872 15.677 63.911 1.00 43.97 C ATOM 1388 O LYS A 170 -24.246 15.223 64.892 1.00 42.07 O ATOM 1389 CB LYS A 170 -26.911 14.268 63.509 1.00 46.79 C ATOM 1390 CG LYS A 170 -28.407 14.101 63.710 1.00 48.78 C ATOM 1391 CD LYS A 170 -28.876 12.746 63.176 1.00 49.93 C ATOM 1392 CE LYS A 170 -30.383 12.726 63.017 1.00 52.44 C ATOM 1393 NZ LYS A 170 -30.971 11.425 63.437 1.00 53.58 N ATOM 1394 HZ1 LYS A 170 -30.572 10.661 62.854 1.00 0.00 H ATOM 1395 HZ2 LYS A 170 -30.747 11.252 64.438 1.00 0.00 H ATOM 1396 HZ3 LYS A 170 -32.003 11.456 63.312 1.00 0.00 H ATOM 1397 H LYS A 170 -27.469 16.351 62.135 1.00 0.00 H ATOM 1398 N VAL A 171 -24.273 16.134 62.810 1.00 37.65 N ATOM 1399 CA VAL A 171 -22.841 16.282 62.703 1.00 36.56 C ATOM 1400 C VAL A 171 -22.351 17.701 63.056 1.00 35.60 C ATOM 1401 O VAL A 171 -21.404 17.859 63.861 1.00 38.03 O ATOM 1402 CB VAL A 171 -22.353 15.922 61.279 1.00 35.77 C ATOM 1403 CG1 VAL A 171 -20.850 16.153 61.175 1.00 37.05 C ATOM 1404 CG2 VAL A 171 -22.710 14.478 60.974 1.00 37.23 C ATOM 1405 H VAL A 171 -24.863 16.395 61.994 1.00 0.00 H ATOM 1406 N TYR A 172 -23.031 18.716 62.538 1.00 33.54 N ATOM 1407 CA TYR A 172 -22.541 20.084 62.635 1.00 34.12 C ATOM 1408 C TYR A 172 -23.278 20.984 63.635 1.00 34.46 C ATOM 1409 O TYR A 172 -22.753 22.059 64.001 1.00 34.69 O ATOM 1410 CB TYR A 172 -22.544 20.726 61.262 1.00 32.64 C ATOM 1411 CG TYR A 172 -21.551 20.116 60.352 1.00 29.98 C ATOM 1412 CD1 TYR A 172 -20.244 19.817 60.793 1.00 30.99 C ATOM 1413 CD2 TYR A 172 -21.913 19.721 59.086 1.00 29.99 C ATOM 1414 CE1 TYR A 172 -19.326 19.195 59.953 1.00 32.08 C ATOM 1415 CE2 TYR A 172 -20.988 19.190 58.209 1.00 29.67 C ATOM 1416 CZ TYR A 172 -19.693 18.951 58.625 1.00 31.30 C ATOM 1417 OH TYR A 172 -18.837 18.337 57.771 1.00 29.31 O ATOM 1418 HH TYR A 172 -18.741 18.884 56.952 1.00 0.00 H ATOM 1419 H TYR A 172 -23.932 18.531 62.053 1.00 0.00 H ATOM 1420 N LYS A 173 -24.476 20.581 64.045 1.00 36.70 N ATOM 1421 CA LYS A 173 -25.198 21.237 65.149 1.00 45.21 C ATOM 1422 C LYS A 173 -25.460 22.717 64.852 1.00 44.38 C ATOM 1423 O LYS A 173 -25.960 23.069 63.762 1.00 44.12 O ATOM 1424 CB LYS A 173 -24.428 21.065 66.453 1.00 49.77 C ATOM 1425 CG LYS A 173 -24.549 19.663 67.035 1.00 56.61 C ATOM 1426 CD LYS A 173 -23.222 19.136 67.551 1.00 63.27 C ATOM 1427 CE LYS A 173 -23.164 17.609 67.453 1.00 66.68 C ATOM 1428 NZ LYS A 173 -21.900 17.043 68.014 1.00 69.72 N ATOM 1429 HZ1 LYS A 173 -21.087 17.428 67.491 1.00 0.00 H ATOM 1430 HZ2 LYS A 173 -21.822 17.302 69.018 1.00 0.00 H ATOM 1431 HZ3 LYS A 173 -21.914 16.007 67.922 1.00 0.00 H ATOM 1432 H LYS A 173 -24.921 19.771 63.568 1.00 0.00 H ATOM 1433 N ASP A 174 -25.022 23.600 65.739 1.00 42.48 N ATOM 1434 CA ASP A 174 -25.343 25.009 65.575 1.00 45.31 C ATOM 1435 C ASP A 174 -24.544 25.706 64.453 1.00 41.04 C ATOM 1436 O ASP A 174 -24.795 26.861 64.168 1.00 39.21 O ATOM 1437 CB ASP A 174 -25.129 25.765 66.896 1.00 49.02 C ATOM 1438 CG ASP A 174 -26.329 25.654 67.846 1.00 57.42 C ATOM 1439 OD1 ASP A 174 -27.386 25.122 67.442 1.00 60.47 O ATOM 1440 OD2 ASP A 174 -26.227 26.163 68.990 1.00 68.87 O ATOM 1441 H ASP A 174 -24.451 23.286 66.549 1.00 0.00 H ATOM 1442 N LEU A 175 -23.574 25.012 63.850 1.00 42.06 N ATOM 1443 CA LEU A 175 -22.707 25.615 62.858 1.00 35.97 C ATOM 1444 C LEU A 175 -23.425 25.770 61.529 1.00 36.45 C ATOM 1445 O LEU A 175 -22.985 26.531 60.658 1.00 33.35 O ATOM 1446 CB LEU A 175 -21.458 24.771 62.668 1.00 37.68 C ATOM 1447 CG LEU A 175 -20.578 24.574 63.900 1.00 41.78 C ATOM 1448 CD1 LEU A 175 -19.409 23.668 63.574 1.00 39.74 C ATOM 1449 CD2 LEU A 175 -20.097 25.888 64.530 1.00 42.58 C ATOM 1450 H LEU A 175 -23.438 24.012 64.100 1.00 0.00 H ATOM 1451 N LEU A 176 -24.499 25.003 61.343 1.00 34.59 N ATOM 1452 CA LEU A 176 -25.255 25.038 60.088 1.00 35.18 C ATOM 1453 C LEU A 176 -26.243 26.142 60.070 1.00 34.02 C ATOM 1454 O LEU A 176 -27.074 26.270 60.996 1.00 34.53 O ATOM 1455 CB LEU A 176 -26.007 23.734 59.870 1.00 35.53 C ATOM 1456 CG LEU A 176 -25.193 22.610 59.406 1.00 39.32 C ATOM 1457 CD1 LEU A 176 -26.005 21.306 59.552 1.00 40.37 C ATOM 1458 CD2 LEU A 176 -24.745 22.839 57.955 1.00 34.73 C ATOM 1459 H LEU A 176 -24.807 24.366 62.105 1.00 0.00 H ATOM 1460 N GLY A 177 -26.230 26.916 58.995 1.00 29.78 N ATOM 1461 CA GLY A 177 -27.168 27.988 58.821 1.00 29.41 C ATOM 1462 C GLY A 177 -28.298 27.582 57.884 1.00 29.72 C ATOM 1463 O GLY A 177 -28.187 26.589 57.148 1.00 28.50 O ATOM 1464 H GLY A 177 -25.519 26.742 58.256 1.00 0.00 H ATOM 1465 N LYS A 178 -29.286 28.453 57.784 1.00 28.82 N ATOM 1466 CA LYS A 178 -30.506 28.190 57.030 1.00 31.73 C ATOM 1467 C LYS A 178 -30.282 28.093 55.547 1.00 32.23 C ATOM 1468 O LYS A 178 -31.181 27.717 54.837 1.00 33.13 O ATOM 1469 CB LYS A 178 -31.510 29.316 57.260 1.00 35.16 C ATOM 1470 CG LYS A 178 -32.082 29.349 58.686 1.00 42.58 C ATOM 1471 CD LYS A 178 -33.251 30.341 58.765 1.00 46.81 C ATOM 1472 CE LYS A 178 -33.888 30.398 60.160 1.00 55.49 C ATOM 1473 NZ LYS A 178 -35.035 31.374 60.172 1.00 60.54 N ATOM 1474 HZ1 LYS A 178 -34.686 32.320 59.919 1.00 0.00 H ATOM 1475 HZ2 LYS A 178 -35.753 31.072 59.483 1.00 0.00 H ATOM 1476 HZ3 LYS A 178 -35.456 31.401 61.123 1.00 0.00 H ATOM 1477 H LYS A 178 -29.189 29.370 58.266 1.00 0.00 H ATOM 1478 N THR A 179 -29.180 28.625 55.061 1.00 28.88 N ATOM 1479 CA THR A 179 -28.910 28.573 53.590 1.00 30.34 C ATOM 1480 C THR A 179 -27.647 27.847 53.275 1.00 28.35 C ATOM 1481 O THR A 179 -27.029 28.062 52.187 1.00 27.96 O ATOM 1482 CB THR A 179 -28.883 29.960 52.920 1.00 29.62 C ATOM 1483 OG1 THR A 179 -27.816 30.763 53.478 1.00 27.51 O ATOM 1484 CG2 THR A 179 -30.240 30.675 53.116 1.00 30.66 C ATOM 1485 HG1 THR A 179 -26.949 30.311 53.324 1.00 0.00 H ATOM 1486 H THR A 179 -28.497 29.081 55.699 1.00 0.00 H ATOM 1487 N MET A 180 -27.247 26.977 54.189 1.00 26.74 N ATOM 1488 CA MET A 180 -26.238 26.007 53.893 1.00 28.76 C ATOM 1489 C MET A 180 -26.914 24.697 53.462 1.00 29.14 C ATOM 1490 O MET A 180 -27.900 24.270 54.077 1.00 31.81 O ATOM 1491 CB MET A 180 -25.347 25.767 55.104 1.00 24.89 C ATOM 1492 CG MET A 180 -24.555 27.008 55.516 1.00 25.72 C ATOM 1493 SD MET A 180 -23.539 26.758 56.999 1.00 25.74 S ATOM 1494 CE MET A 180 -23.098 28.463 57.355 1.00 29.04 C ATOM 1495 H MET A 180 -27.673 26.999 55.137 1.00 0.00 H ATOM 1496 N LEU A 181 -26.204 23.949 52.676 1.00 26.88 N ATOM 1497 CA LEU A 181 -26.722 22.757 52.056 1.00 26.78 C ATOM 1498 C LEU A 181 -25.687 21.657 52.190 1.00 26.51 C ATOM 1499 O LEU A 181 -24.548 21.881 51.875 1.00 27.01 O ATOM 1500 CB LEU A 181 -26.988 23.019 50.590 1.00 25.86 C ATOM 1501 CG LEU A 181 -27.457 21.814 49.791 1.00 26.05 C ATOM 1502 CD1 LEU A 181 -28.744 21.232 50.354 1.00 28.09 C ATOM 1503 CD2 LEU A 181 -27.647 22.171 48.322 1.00 26.04 C ATOM 1504 H LEU A 181 -25.219 24.222 52.485 1.00 0.00 H ATOM 1505 N CYS A 182 -26.061 20.522 52.811 1.00 24.90 N ATOM 1506 CA CYS A 182 -25.135 19.432 53.004 1.00 25.32 C ATOM 1507 C CYS A 182 -25.299 18.356 51.887 1.00 26.62 C ATOM 1508 O CYS A 182 -26.396 18.169 51.338 1.00 26.36 O ATOM 1509 CB CYS A 182 -25.338 18.810 54.367 1.00 28.09 C ATOM 1510 SG CYS A 182 -24.978 19.957 55.747 1.00 30.01 S ATOM 1511 H CYS A 182 -27.037 20.429 53.158 1.00 0.00 H ATOM 1512 N ALA A 183 -24.185 17.686 51.569 1.00 26.76 N ATOM 1513 CA ALA A 183 -24.147 16.572 50.626 1.00 25.18 C ATOM 1514 C ALA A 183 -22.989 15.605 50.945 1.00 24.46 C ATOM 1515 O ALA A 183 -21.849 16.016 51.268 1.00 22.50 O ATOM 1516 CB ALA A 183 -24.022 17.097 49.188 1.00 26.24 C ATOM 1517 H ALA A 183 -23.294 17.976 52.020 1.00 0.00 H ATOM 1518 N GLY A 184 -23.244 14.331 50.729 1.00 24.10 N ATOM 1519 CA GLY A 184 -22.242 13.307 50.861 1.00 23.96 C ATOM 1520 C GLY A 184 -22.812 11.989 50.472 1.00 26.49 C ATOM 1521 O GLY A 184 -23.972 11.916 50.030 1.00 26.07 O ATOM 1522 H GLY A 184 -24.208 14.054 50.452 1.00 0.00 H ATOM 1523 N ILE A 185 -22.049 10.920 50.738 1.00 26.62 N ATOM 1524 CA ILE A 185 -22.566 9.536 50.659 1.00 26.70 C ATOM 1525 C ILE A 185 -22.290 8.864 51.994 1.00 29.72 C ATOM 1526 O ILE A 185 -21.172 8.952 52.497 1.00 27.83 O ATOM 1527 CB ILE A 185 -21.859 8.746 49.541 1.00 27.75 C ATOM 1528 CG1 ILE A 185 -22.151 9.413 48.206 1.00 26.81 C ATOM 1529 CG2 ILE A 185 -22.295 7.307 49.517 1.00 28.60 C ATOM 1530 CD1 ILE A 185 -23.619 9.406 47.829 1.00 26.77 C ATOM 1531 H ILE A 185 -21.056 11.069 51.010 1.00 0.00 H ATOM 1532 N PRO A 186 -23.285 8.119 52.515 1.00 30.94 N ATOM 1533 CA PRO A 186 -23.136 7.468 53.847 1.00 35.55 C ATOM 1534 C PRO A 186 -21.958 6.540 53.826 1.00 34.98 C ATOM 1535 O PRO A 186 -21.737 5.841 52.822 1.00 34.15 O ATOM 1536 CB PRO A 186 -24.453 6.651 54.018 1.00 36.10 C ATOM 1537 CG PRO A 186 -25.321 6.979 52.820 1.00 36.37 C ATOM 1538 CD PRO A 186 -24.677 8.077 52.015 1.00 32.06 C ATOM 1539 N ASP A 186A -21.126 6.628 54.835 1.00 34.42 N ATOM 1540 CA ASP A 186A -19.991 5.716 54.965 1.00 38.39 C ATOM 1541 C ASP A 186A -18.941 5.778 53.888 1.00 37.69 C ATOM 1542 O ASP A 186A -18.193 4.814 53.722 1.00 40.62 O ATOM 1543 CB ASP A 186A -20.492 4.266 55.091 1.00 40.22 C ATOM 1544 CG ASP A 186A -21.295 4.041 56.355 1.00 44.62 C ATOM 1545 OD1 ASP A 186A -20.991 4.676 57.391 1.00 48.22 O ATOM 1546 OD2 ASP A 186A -22.274 3.273 56.304 1.00 52.04 O ATOM 1547 H ASP A 186A -21.276 7.361 55.557 1.00 0.00 H ATOM 1548 N SER A 186B -18.908 6.865 53.103 1.00 34.05 N ATOM 1549 CA SER A 186B -17.930 7.013 52.047 1.00 32.44 C ATOM 1550 C SER A 186B -17.093 8.246 52.309 1.00 29.74 C ATOM 1551 O SER A 186B -17.570 9.233 52.882 1.00 29.36 O ATOM 1552 CB SER A 186B -18.616 7.154 50.669 1.00 34.97 C ATOM 1553 OG SER A 186B -17.658 7.486 49.607 1.00 37.92 O ATOM 1554 HG SER A 186B -16.978 6.769 49.542 1.00 0.00 H ATOM 1555 H SER A 186B -19.604 7.622 53.258 1.00 0.00 H ATOM 1556 N LYS A 187 -15.865 8.219 51.778 1.00 27.73 N ATOM 1557 CA LYS A 187 -14.946 9.328 51.899 1.00 28.97 C ATOM 1558 C LYS A 187 -15.120 10.384 50.806 1.00 28.55 C ATOM 1559 O LYS A 187 -14.496 11.434 50.869 1.00 31.31 O ATOM 1560 CB LYS A 187 -13.548 8.812 51.838 1.00 30.62 C ATOM 1561 CG LYS A 187 -13.263 7.791 52.933 1.00 35.06 C ATOM 1562 CD LYS A 187 -11.952 7.053 52.702 1.00 39.72 C ATOM 1563 CE LYS A 187 -10.789 7.997 52.522 1.00 44.55 C ATOM 1564 NZ LYS A 187 -10.601 8.880 53.713 1.00 51.76 N ATOM 1565 HZ1 LYS A 187 -11.461 9.445 53.863 1.00 0.00 H ATOM 1566 HZ2 LYS A 187 -10.419 8.294 54.553 1.00 0.00 H ATOM 1567 HZ3 LYS A 187 -9.792 9.513 53.549 1.00 0.00 H ATOM 1568 H LYS A 187 -15.561 7.370 51.260 1.00 0.00 H ATOM 1569 N THR A 188 -15.868 10.046 49.760 1.00 27.35 N ATOM 1570 CA THR A 188 -15.977 10.914 48.564 1.00 24.48 C ATOM 1571 C THR A 188 -16.493 12.317 48.920 1.00 24.88 C ATOM 1572 O THR A 188 -17.470 12.461 49.677 1.00 23.36 O ATOM 1573 CB THR A 188 -16.884 10.275 47.499 1.00 26.00 C ATOM 1574 OG1 THR A 188 -16.508 10.739 46.199 1.00 25.09 O ATOM 1575 CG2 THR A 188 -18.357 10.528 47.766 1.00 26.11 C ATOM 1576 HG1 THR A 188 -15.567 10.489 46.020 1.00 0.00 H ATOM 1577 H THR A 188 -16.391 9.147 49.782 1.00 0.00 H ATOM 1578 N ASN A 189 -15.700 13.330 48.636 1.00 23.88 N ATOM 1579 CA ASN A 189 -15.990 14.657 49.210 1.00 24.05 C ATOM 1580 C ASN A 189 -15.067 15.720 48.666 1.00 24.67 C ATOM 1581 O ASN A 189 -14.161 15.440 47.899 1.00 25.62 O ATOM 1582 CB ASN A 189 -15.866 14.641 50.756 1.00 25.15 C ATOM 1583 CG ASN A 189 -16.981 15.386 51.410 1.00 24.99 C ATOM 1584 OD1 ASN A 189 -17.343 16.449 50.952 1.00 23.44 O ATOM 1585 ND2 ASN A 189 -17.407 14.929 52.616 1.00 27.70 N ATOM 1586 HD22 ASN A 189 -17.072 14.011 52.972 1.00 0.00 H ATOM 1587 HD21 ASN A 189 -18.068 15.497 53.183 1.00 0.00 H ATOM 1588 H ASN A 189 -14.878 13.195 48.013 1.00 0.00 H ATOM 1589 N THR A 190 -15.370 16.962 49.017 1.00 23.71 N ATOM 1590 CA THR A 190 -14.557 18.106 48.692 1.00 23.50 C ATOM 1591 C THR A 190 -13.377 18.299 49.648 1.00 25.60 C ATOM 1592 O THR A 190 -13.397 17.791 50.826 1.00 26.70 O ATOM 1593 CB THR A 190 -15.440 19.393 48.737 1.00 26.40 C ATOM 1594 OG1 THR A 190 -16.070 19.502 50.066 1.00 23.88 O ATOM 1595 CG2 THR A 190 -16.496 19.344 47.724 1.00 23.76 C ATOM 1596 HG1 THR A 190 -16.631 20.317 50.098 1.00 0.00 H ATOM 1597 H THR A 190 -16.244 17.119 49.558 1.00 0.00 H ATOM 1598 N CYS A 191 -12.413 19.103 49.220 1.00 24.60 N ATOM 1599 CA CYS A 191 -11.266 19.455 50.035 1.00 25.87 C ATOM 1600 C CYS A 191 -10.560 20.774 49.561 1.00 27.91 C ATOM 1601 O CYS A 191 -11.000 21.386 48.620 1.00 25.60 O ATOM 1602 CB CYS A 191 -10.288 18.284 50.021 1.00 27.26 C ATOM 1603 SG CYS A 191 -9.104 18.255 51.353 1.00 29.36 S ATOM 1604 H CYS A 191 -12.482 19.497 48.260 1.00 0.00 H ATOM 1605 N ASN A 192 -9.488 21.188 50.256 1.00 27.24 N ATOM 1606 CA ASN A 192 -8.774 22.429 49.952 1.00 29.88 C ATOM 1607 C ASN A 192 -8.546 22.587 48.446 1.00 27.74 C ATOM 1608 O ASN A 192 -7.943 21.691 47.832 1.00 26.98 O ATOM 1609 CB ASN A 192 -7.370 22.406 50.618 1.00 38.28 C ATOM 1610 CG ASN A 192 -7.425 22.233 52.108 1.00 48.41 C ATOM 1611 OD1 ASN A 192 -7.861 21.172 52.628 1.00 57.49 O ATOM 1612 ND2 ASN A 192 -6.951 23.260 52.843 1.00 59.63 N ATOM 1613 HD22 ASN A 192 -6.600 24.118 52.372 1.00 0.00 H ATOM 1614 HD21 ASN A 192 -6.936 23.193 53.881 1.00 0.00 H ATOM 1615 H ASN A 192 -9.150 20.601 51.045 1.00 0.00 H ATOM 1616 N GLY A 193 -8.932 23.740 47.903 1.00 25.02 N ATOM 1617 CA GLY A 193 -8.808 24.070 46.467 1.00 24.56 C ATOM 1618 C GLY A 193 -10.088 23.867 45.675 1.00 22.37 C ATOM 1619 O GLY A 193 -10.230 24.399 44.542 1.00 24.48 O ATOM 1620 H GLY A 193 -9.349 24.457 48.531 1.00 0.00 H ATOM 1621 N ASP A 194 -10.993 23.056 46.214 1.00 23.05 N ATOM 1622 CA ASP A 194 -12.311 22.860 45.648 1.00 20.84 C ATOM 1623 C ASP A 194 -13.284 24.040 45.932 1.00 22.54 C ATOM 1624 O ASP A 194 -14.258 24.227 45.184 1.00 21.27 O ATOM 1625 CB ASP A 194 -12.924 21.555 46.188 1.00 21.83 C ATOM 1626 CG ASP A 194 -12.274 20.294 45.602 1.00 22.77 C ATOM 1627 OD1 ASP A 194 -11.681 20.394 44.474 1.00 21.65 O ATOM 1628 OD2 ASP A 194 -12.119 19.314 46.393 1.00 21.13 O ATOM 1629 H ASP A 194 -10.743 22.539 47.081 1.00 0.00 H ATOM 1630 N SER A 195 -13.038 24.793 47.008 1.00 21.45 N ATOM 1631 CA SER A 195 -13.847 25.986 47.393 1.00 22.09 C ATOM 1632 C SER A 195 -14.349 26.747 46.245 1.00 21.57 C ATOM 1633 O SER A 195 -13.556 27.047 45.364 1.00 21.58 O ATOM 1634 CB SER A 195 -12.975 26.978 48.138 1.00 23.90 C ATOM 1635 OG SER A 195 -12.660 26.477 49.372 1.00 23.45 O ATOM 1636 HG SER A 195 -12.170 25.623 49.265 1.00 0.00 H ATOM 1637 H SER A 195 -12.234 24.532 47.614 1.00 0.00 H ATOM 1638 N GLY A 196 -15.630 27.119 46.278 1.00 19.93 N ATOM 1639 CA GLY A 196 -16.226 28.000 45.266 1.00 19.44 C ATOM 1640 C GLY A 196 -16.691 27.244 44.023 1.00 19.46 C ATOM 1641 O GLY A 196 -17.389 27.801 43.208 1.00 22.10 O ATOM 1642 H GLY A 196 -16.231 26.771 47.052 1.00 0.00 H ATOM 1643 N GLY A 197 -16.405 25.957 43.966 1.00 20.95 N ATOM 1644 CA GLY A 197 -16.820 25.128 42.780 1.00 20.76 C ATOM 1645 C GLY A 197 -18.312 24.733 42.870 1.00 21.13 C ATOM 1646 O GLY A 197 -18.943 24.850 43.891 1.00 22.84 O ATOM 1647 H GLY A 197 -15.887 25.510 44.749 1.00 0.00 H ATOM 1648 N PRO A 198 -18.827 24.149 41.796 1.00 20.57 N ATOM 1649 CA PRO A 198 -20.196 23.839 41.538 1.00 20.35 C ATOM 1650 C PRO A 198 -20.638 22.463 42.071 1.00 22.04 C ATOM 1651 O PRO A 198 -19.907 21.467 41.938 1.00 23.28 O ATOM 1652 CB PRO A 198 -20.254 23.855 40.013 1.00 21.01 C ATOM 1653 CG PRO A 198 -18.903 23.318 39.614 1.00 21.45 C ATOM 1654 CD PRO A 198 -17.966 23.902 40.637 1.00 20.74 C ATOM 1655 N LEU A 199 -21.773 22.455 42.753 1.00 21.85 N ATOM 1656 CA LEU A 199 -22.532 21.247 43.036 1.00 21.77 C ATOM 1657 C LEU A 199 -23.795 21.269 42.190 1.00 23.94 C ATOM 1658 O LEU A 199 -24.618 22.178 42.324 1.00 25.53 O ATOM 1659 CB LEU A 199 -22.894 21.197 44.524 1.00 22.92 C ATOM 1660 CG LEU A 199 -23.780 20.061 44.923 1.00 21.96 C ATOM 1661 CD1 LEU A 199 -22.974 18.775 44.970 1.00 23.45 C ATOM 1662 CD2 LEU A 199 -24.434 20.321 46.307 1.00 23.82 C ATOM 1663 H LEU A 199 -22.142 23.361 43.105 1.00 0.00 H ATOM 1664 N VAL A 200 -23.804 20.418 41.159 1.00 22.03 N ATOM 1665 CA VAL A 200 -24.882 20.375 40.142 1.00 22.43 C ATOM 1666 C VAL A 200 -25.761 19.118 40.345 1.00 22.85 C ATOM 1667 O VAL A 200 -25.217 18.041 40.580 1.00 23.43 O ATOM 1668 CB VAL A 200 -24.248 20.364 38.739 1.00 22.48 C ATOM 1669 CG1 VAL A 200 -25.308 20.299 37.637 1.00 23.40 C ATOM 1670 CG2 VAL A 200 -23.404 21.612 38.566 1.00 21.51 C ATOM 1671 H VAL A 200 -23.012 19.750 41.065 1.00 0.00 H ATOM 1672 N CYS A 201 -27.066 19.334 40.538 1.00 22.67 N ATOM 1673 CA CYS A 201 -28.066 18.283 40.686 1.00 26.10 C ATOM 1674 C CYS A 201 -29.203 18.465 39.638 1.00 29.34 C ATOM 1675 O CYS A 201 -29.720 19.562 39.459 1.00 27.86 O ATOM 1676 CB CYS A 201 -28.697 18.323 42.051 1.00 27.48 C ATOM 1677 SG CYS A 201 -27.579 18.746 43.366 1.00 27.05 S ATOM 1678 H CYS A 201 -27.391 20.321 40.586 1.00 0.00 H ATOM 1679 N ASN A 202 -29.587 17.389 38.979 1.00 33.72 N ATOM 1680 CA ASN A 202 -30.659 17.448 37.977 1.00 36.36 C ATOM 1681 C ASN A 202 -30.499 18.653 37.057 1.00 32.02 C ATOM 1682 O ASN A 202 -31.406 19.466 36.950 1.00 33.21 O ATOM 1683 CB ASN A 202 -31.994 17.518 38.678 1.00 41.06 C ATOM 1684 CG ASN A 202 -32.332 16.233 39.375 1.00 49.55 C ATOM 1685 OD1 ASN A 202 -32.050 15.139 38.857 1.00 54.64 O ATOM 1686 ND2 ASN A 202 -32.821 16.337 40.576 1.00 54.32 N ATOM 1687 HD22 ASN A 202 -33.042 17.275 40.968 1.00 0.00 H ATOM 1688 HD21 ASN A 202 -32.991 15.483 41.144 1.00 0.00 H ATOM 1689 H ASN A 202 -29.121 16.480 39.173 1.00 0.00 H ATOM 1690 N ASP A 207 -29.281 18.855 36.573 1.00 34.16 N ATOM 1691 CA ASP A 207 -28.981 19.865 35.548 1.00 36.80 C ATOM 1692 C ASP A 207 -29.017 21.328 36.011 1.00 33.14 C ATOM 1693 O ASP A 207 -28.835 22.189 35.178 1.00 33.50 O ATOM 1694 CB ASP A 207 -29.919 19.724 34.330 1.00 38.86 C ATOM 1695 CG ASP A 207 -29.826 18.368 33.680 1.00 47.50 C ATOM 1696 OD1 ASP A 207 -28.724 17.779 33.682 1.00 51.28 O ATOM 1697 OD2 ASP A 207 -30.850 17.889 33.166 1.00 47.52 O ATOM 1698 H ASP A 207 -28.501 18.271 36.936 1.00 0.00 H ATOM 1699 N THR A 208 -29.088 21.597 37.345 1.00 26.48 N ATOM 1700 CA THR A 208 -29.026 22.973 37.843 1.00 26.06 C ATOM 1701 C THR A 208 -27.969 23.071 38.945 1.00 23.39 C ATOM 1702 O THR A 208 -27.706 22.089 39.661 1.00 24.51 O ATOM 1703 CB THR A 208 -30.382 23.530 38.396 1.00 27.75 C ATOM 1704 OG1 THR A 208 -30.736 22.883 39.655 1.00 24.82 O ATOM 1705 CG2 THR A 208 -31.500 23.367 37.363 1.00 28.36 C ATOM 1706 HG1 THR A 208 -30.828 21.908 39.509 1.00 0.00 H ATOM 1707 H THR A 208 -29.188 20.813 38.020 1.00 0.00 H ATOM 1708 N LEU A 209 -27.395 24.260 39.064 1.00 23.49 N ATOM 1709 CA LEU A 209 -26.472 24.598 40.121 1.00 24.63 C ATOM 1710 C LEU A 209 -27.206 24.675 41.444 1.00 25.14 C ATOM 1711 O LEU A 209 -27.967 25.617 41.686 1.00 25.65 O ATOM 1712 CB LEU A 209 -25.849 25.916 39.837 1.00 26.12 C ATOM 1713 CG LEU A 209 -24.779 26.334 40.854 1.00 24.83 C ATOM 1714 CD1 LEU A 209 -23.557 25.396 40.642 1.00 26.42 C ATOM 1715 CD2 LEU A 209 -24.410 27.782 40.584 1.00 25.67 C ATOM 1716 H LEU A 209 -27.622 24.989 38.358 1.00 0.00 H ATOM 1717 N GLN A 210 -26.927 23.755 42.340 1.00 23.39 N ATOM 1718 CA GLN A 210 -27.634 23.732 43.636 1.00 23.25 C ATOM 1719 C GLN A 210 -26.707 24.160 44.785 1.00 23.95 C ATOM 1720 O GLN A 210 -27.185 24.701 45.802 1.00 24.19 O ATOM 1721 CB GLN A 210 -28.198 22.358 43.930 1.00 22.58 C ATOM 1722 CG GLN A 210 -29.428 21.934 43.129 1.00 23.52 C ATOM 1723 CD GLN A 210 -30.664 22.766 43.455 1.00 26.14 C ATOM 1724 OE1 GLN A 210 -31.048 22.900 44.645 1.00 25.80 O ATOM 1725 NE2 GLN A 210 -31.342 23.276 42.415 1.00 24.40 N ATOM 1726 HE22 GLN A 210 -30.988 23.141 41.447 1.00 0.00 H ATOM 1727 HE21 GLN A 210 -32.222 23.806 42.577 1.00 0.00 H ATOM 1728 H GLN A 210 -26.203 23.038 42.135 1.00 0.00 H ATOM 1729 N GLY A 211 -25.390 24.107 44.560 1.00 23.51 N ATOM 1730 CA GLY A 211 -24.415 24.458 45.642 1.00 23.95 C ATOM 1731 C GLY A 211 -23.125 25.053 45.136 1.00 22.68 C ATOM 1732 O GLY A 211 -22.711 24.793 43.950 1.00 21.16 O ATOM 1733 H GLY A 211 -25.039 23.819 43.624 1.00 0.00 H ATOM 1734 N LEU A 212 -22.452 25.782 46.021 1.00 22.14 N ATOM 1735 CA LEU A 212 -21.083 26.207 45.857 1.00 20.79 C ATOM 1736 C LEU A 212 -20.280 25.673 46.991 1.00 23.63 C ATOM 1737 O LEU A 212 -20.668 25.826 48.192 1.00 22.85 O ATOM 1738 CB LEU A 212 -20.994 27.724 45.844 1.00 21.59 C ATOM 1739 CG LEU A 212 -21.755 28.391 44.735 1.00 21.69 C ATOM 1740 CD1 LEU A 212 -22.011 29.853 44.949 1.00 20.97 C ATOM 1741 CD2 LEU A 212 -21.069 28.117 43.364 1.00 22.05 C ATOM 1742 H LEU A 212 -22.946 26.065 46.891 1.00 0.00 H ATOM 1743 N VAL A 213 -19.114 25.109 46.692 1.00 23.26 N ATOM 1744 CA VAL A 213 -18.361 24.422 47.764 1.00 22.66 C ATOM 1745 C VAL A 213 -17.962 25.465 48.857 1.00 21.25 C ATOM 1746 O VAL A 213 -17.329 26.471 48.538 1.00 21.80 O ATOM 1747 CB VAL A 213 -17.105 23.794 47.188 1.00 21.16 C ATOM 1748 CG1 VAL A 213 -16.196 23.228 48.306 1.00 21.30 C ATOM 1749 CG2 VAL A 213 -17.488 22.715 46.227 1.00 21.66 C ATOM 1750 H VAL A 213 -18.738 25.150 45.723 1.00 0.00 H ATOM 1751 N SER A 214 -18.267 25.202 50.141 1.00 23.40 N ATOM 1752 CA SER A 214 -18.026 26.203 51.177 1.00 22.72 C ATOM 1753 C SER A 214 -17.047 25.749 52.264 1.00 23.62 C ATOM 1754 O SER A 214 -16.007 26.393 52.498 1.00 23.49 O ATOM 1755 CB SER A 214 -19.351 26.644 51.816 1.00 23.38 C ATOM 1756 OG SER A 214 -19.195 27.840 52.490 1.00 22.27 O ATOM 1757 HG SER A 214 -18.897 28.539 51.855 1.00 0.00 H ATOM 1758 H SER A 214 -18.677 24.281 50.397 1.00 0.00 H ATOM 1759 N TRP A 215 -17.401 24.680 52.928 1.00 22.80 N ATOM 1760 CA TRP A 215 -16.557 24.076 53.883 1.00 25.69 C ATOM 1761 C TRP A 215 -16.915 22.608 54.179 1.00 27.10 C ATOM 1762 O TRP A 215 -17.691 21.982 53.443 1.00 27.25 O ATOM 1763 CB TRP A 215 -16.580 24.935 55.196 1.00 26.55 C ATOM 1764 CG TRP A 215 -17.920 25.139 55.797 1.00 27.09 C ATOM 1765 CD1 TRP A 215 -18.820 26.069 55.451 1.00 25.20 C ATOM 1766 CD2 TRP A 215 -18.438 24.524 57.028 1.00 27.21 C ATOM 1767 NE1 TRP A 215 -19.928 25.978 56.252 1.00 26.87 N ATOM 1768 CE2 TRP A 215 -19.726 25.031 57.215 1.00 27.83 C ATOM 1769 CE3 TRP A 215 -18.045 23.458 57.793 1.00 28.01 C ATOM 1770 CZ2 TRP A 215 -20.534 24.657 58.298 1.00 29.19 C ATOM 1771 CZ3 TRP A 215 -18.856 23.077 58.890 1.00 30.26 C ATOM 1772 CH2 TRP A 215 -20.090 23.638 59.083 1.00 29.82 C ATOM 1773 HE1 TRP A 215 -20.793 26.545 56.143 1.00 0.00 H ATOM 1774 H TRP A 215 -18.335 24.261 52.746 1.00 0.00 H ATOM 1775 N GLY A 216 -16.239 22.037 55.182 1.00 26.41 N ATOM 1776 CA GLY A 216 -16.491 20.639 55.629 1.00 26.87 C ATOM 1777 C GLY A 216 -15.663 20.412 56.873 1.00 29.60 C ATOM 1778 O GLY A 216 -15.258 21.375 57.529 1.00 28.28 O ATOM 1779 H GLY A 216 -15.507 22.592 55.670 1.00 0.00 H ATOM 1780 N THR A 217 -15.324 19.161 57.163 1.00 29.71 N ATOM 1781 CA THR A 217 -14.459 18.878 58.288 1.00 31.80 C ATOM 1782 C THR A 217 -13.068 18.594 57.797 1.00 32.20 C ATOM 1783 O THR A 217 -12.845 18.265 56.608 1.00 30.33 O ATOM 1784 CB THR A 217 -14.989 17.706 59.168 1.00 32.26 C ATOM 1785 OG1 THR A 217 -14.865 16.487 58.463 1.00 45.52 O ATOM 1786 CG2 THR A 217 -16.409 17.912 59.504 1.00 31.02 C ATOM 1787 HG1 THR A 217 -15.203 15.746 59.026 1.00 0.00 H ATOM 1788 H THR A 217 -15.683 18.380 56.578 1.00 0.00 H ATOM 1789 N TYR A 218 -12.109 18.958 58.602 1.00 28.05 N ATOM 1790 CA TYR A 218 -10.727 18.762 58.259 1.00 30.75 C ATOM 1791 C TYR A 218 -10.126 17.844 59.322 1.00 34.72 C ATOM 1792 O TYR A 218 -10.361 18.083 60.491 1.00 31.35 O ATOM 1793 CB TYR A 218 -10.020 20.112 58.263 1.00 32.24 C ATOM 1794 CG TYR A 218 -8.570 20.012 58.008 1.00 36.31 C ATOM 1795 CD1 TYR A 218 -7.687 19.870 59.052 1.00 41.27 C ATOM 1796 CD2 TYR A 218 -8.066 20.018 56.712 1.00 36.62 C ATOM 1797 CE1 TYR A 218 -6.334 19.744 58.836 1.00 44.67 C ATOM 1798 CE2 TYR A 218 -6.724 19.834 56.478 1.00 38.91 C ATOM 1799 CZ TYR A 218 -5.855 19.722 57.572 1.00 43.43 C ATOM 1800 OH TYR A 218 -4.515 19.533 57.397 1.00 45.30 O ATOM 1801 HH TYR A 218 -4.072 19.479 58.281 1.00 0.00 H ATOM 1802 H TYR A 218 -12.349 19.400 59.512 1.00 0.00 H ATOM 1803 N PRO A 219 -9.344 16.822 58.941 1.00 31.70 N ATOM 1804 CA PRO A 219 -9.033 16.502 57.549 1.00 31.87 C ATOM 1805 C PRO A 219 -10.248 16.096 56.732 1.00 31.14 C ATOM 1806 O PRO A 219 -11.292 15.700 57.271 1.00 32.27 O ATOM 1807 CB PRO A 219 -8.051 15.331 57.657 1.00 33.05 C ATOM 1808 CG PRO A 219 -7.468 15.406 59.058 1.00 32.91 C ATOM 1809 CD PRO A 219 -8.471 16.097 59.910 1.00 32.17 C ATOM 1810 N CYS A 220 -10.120 16.260 55.438 1.00 32.04 N ATOM 1811 CA CYS A 220 -11.221 16.030 54.513 1.00 31.75 C ATOM 1812 C CYS A 220 -11.533 14.546 54.372 1.00 32.10 C ATOM 1813 O CYS A 220 -10.677 13.710 54.554 1.00 32.12 O ATOM 1814 CB CYS A 220 -10.856 16.586 53.133 1.00 30.49 C ATOM 1815 SG CYS A 220 -10.239 18.283 53.091 1.00 30.31 S ATOM 1816 H CYS A 220 -9.201 16.565 55.059 1.00 0.00 H ATOM 1817 N GLY A 220A -12.739 14.225 53.934 1.00 31.54 N ATOM 1818 CA GLY A 220A -12.987 12.896 53.405 1.00 31.88 C ATOM 1819 C GLY A 220A -13.067 11.885 54.530 1.00 32.10 C ATOM 1820 O GLY A 220A -12.858 10.704 54.313 1.00 34.02 O ATOM 1821 H GLY A 220A -13.509 14.924 53.969 1.00 0.00 H ATOM 1822 N GLN A 221 -13.531 12.329 55.683 1.00 32.24 N ATOM 1823 CA GLN A 221 -13.898 11.392 56.771 1.00 32.12 C ATOM 1824 C GLN A 221 -15.318 10.926 56.507 1.00 29.36 C ATOM 1825 O GLN A 221 -16.191 11.735 56.296 1.00 30.03 O ATOM 1826 CB GLN A 221 -13.826 12.080 58.152 1.00 36.03 C ATOM 1827 CG GLN A 221 -12.425 12.502 58.615 1.00 36.93 C ATOM 1828 CD GLN A 221 -12.461 13.178 59.960 1.00 43.66 C ATOM 1829 OE1 GLN A 221 -12.962 12.594 60.952 1.00 48.74 O ATOM 1830 NE2 GLN A 221 -12.018 14.437 60.014 1.00 40.19 N ATOM 1831 HE22 GLN A 221 -11.610 14.881 59.167 1.00 0.00 H ATOM 1832 HE21 GLN A 221 -12.081 14.973 60.903 1.00 0.00 H ATOM 1833 H GLN A 221 -13.641 13.353 55.830 1.00 0.00 H ATOM 1834 N PRO A 222 -15.555 9.607 56.511 1.00 31.12 N ATOM 1835 CA PRO A 222 -16.913 9.097 56.314 1.00 30.97 C ATOM 1836 C PRO A 222 -17.905 9.709 57.263 1.00 32.18 C ATOM 1837 O PRO A 222 -17.603 9.912 58.426 1.00 34.37 O ATOM 1838 CB PRO A 222 -16.789 7.578 56.587 1.00 32.58 C ATOM 1839 CG PRO A 222 -15.465 7.376 57.187 1.00 34.60 C ATOM 1840 CD PRO A 222 -14.594 8.541 56.809 1.00 32.09 C ATOM 1841 N ASN A 223 -19.056 10.072 56.741 1.00 31.96 N ATOM 1842 CA ASN A 223 -20.137 10.632 57.542 1.00 35.72 C ATOM 1843 C ASN A 223 -19.847 12.035 58.105 1.00 35.22 C ATOM 1844 O ASN A 223 -20.571 12.504 58.938 1.00 33.45 O ATOM 1845 CB ASN A 223 -20.534 9.657 58.649 1.00 35.19 C ATOM 1846 CG ASN A 223 -20.978 8.321 58.092 1.00 37.65 C ATOM 1847 OD1 ASN A 223 -21.770 8.291 57.140 1.00 37.41 O ATOM 1848 ND2 ASN A 223 -20.275 7.259 58.471 1.00 37.30 N ATOM 1849 HD22 ASN A 223 -19.621 7.329 59.277 1.00 0.00 H ATOM 1850 HD21 ASN A 223 -20.379 6.358 57.962 1.00 0.00 H ATOM 1851 H ASN A 223 -19.200 9.955 55.718 1.00 0.00 H ATOM 1852 N ASP A 224 -18.942 12.764 57.441 1.00 32.20 N ATOM 1853 CA ASP A 224 -18.820 14.218 57.593 1.00 28.88 C ATOM 1854 C ASP A 224 -19.237 14.886 56.311 1.00 30.20 C ATOM 1855 O ASP A 224 -18.464 14.857 55.349 1.00 26.71 O ATOM 1856 CB ASP A 224 -17.374 14.582 57.848 1.00 29.55 C ATOM 1857 CG ASP A 224 -16.947 14.230 59.265 1.00 33.89 C ATOM 1858 OD1 ASP A 224 -17.762 13.718 59.943 1.00 35.17 O ATOM 1859 OD2 ASP A 224 -15.775 14.386 59.585 1.00 37.58 O ATOM 1860 H ASP A 224 -18.296 12.277 56.787 1.00 0.00 H ATOM 1861 N PRO A 225 -20.476 15.425 56.252 1.00 29.16 N ATOM 1862 CA PRO A 225 -20.917 15.904 54.942 1.00 26.71 C ATOM 1863 C PRO A 225 -20.137 17.132 54.503 1.00 29.00 C ATOM 1864 O PRO A 225 -19.636 17.895 55.346 1.00 24.37 O ATOM 1865 CB PRO A 225 -22.404 16.253 55.166 1.00 28.77 C ATOM 1866 CG PRO A 225 -22.814 15.367 56.272 1.00 32.23 C ATOM 1867 CD PRO A 225 -21.605 15.260 57.169 1.00 30.41 C ATOM 1868 N GLY A 226 -19.999 17.330 53.179 1.00 24.26 N ATOM 1869 CA GLY A 226 -19.558 18.611 52.680 1.00 24.37 C ATOM 1870 C GLY A 226 -20.650 19.655 52.835 1.00 23.24 C ATOM 1871 O GLY A 226 -21.827 19.324 52.716 1.00 23.78 O ATOM 1872 H GLY A 226 -20.210 16.559 52.514 1.00 0.00 H ATOM 1873 N VAL A 227 -20.256 20.899 53.170 1.00 23.74 N ATOM 1874 CA VAL A 227 -21.171 22.023 53.298 1.00 23.24 C ATOM 1875 C VAL A 227 -21.021 22.994 52.103 1.00 22.50 C ATOM 1876 O VAL A 227 -19.911 23.349 51.708 1.00 21.47 O ATOM 1877 CB VAL A 227 -20.947 22.754 54.591 1.00 23.39 C ATOM 1878 CG1 VAL A 227 -22.030 23.803 54.833 1.00 24.20 C ATOM 1879 CG2 VAL A 227 -20.952 21.749 55.704 1.00 23.36 C ATOM 1880 H VAL A 227 -19.245 21.065 53.346 1.00 0.00 H ATOM 1881 N TYR A 228 -22.161 23.355 51.545 1.00 24.02 N ATOM 1882 CA TYR A 228 -22.264 24.197 50.368 1.00 21.86 C ATOM 1883 C TYR A 228 -23.154 25.399 50.661 1.00 21.58 C ATOM 1884 O TYR A 228 -24.111 25.286 51.431 1.00 22.95 O ATOM 1885 CB TYR A 228 -22.900 23.364 49.212 1.00 21.96 C ATOM 1886 CG TYR A 228 -22.118 22.143 48.850 1.00 21.53 C ATOM 1887 CD1 TYR A 228 -22.169 20.975 49.631 1.00 21.67 C ATOM 1888 CD2 TYR A 228 -21.291 22.126 47.709 1.00 21.60 C ATOM 1889 CE1 TYR A 228 -21.403 19.874 49.324 1.00 22.24 C ATOM 1890 CE2 TYR A 228 -20.610 21.009 47.366 1.00 22.25 C ATOM 1891 CZ TYR A 228 -20.608 19.915 48.187 1.00 22.49 C ATOM 1892 OH TYR A 228 -19.956 18.777 47.765 1.00 23.26 O ATOM 1893 HH TYR A 228 -20.039 18.075 48.458 1.00 0.00 H ATOM 1894 H TYR A 228 -23.043 23.014 51.977 1.00 0.00 H ATOM 1895 N THR A 229 -22.963 26.477 49.911 1.00 21.83 N ATOM 1896 CA THR A 229 -23.950 27.524 49.855 1.00 23.06 C ATOM 1897 C THR A 229 -25.085 27.117 48.953 1.00 23.86 C ATOM 1898 O THR A 229 -24.860 26.663 47.797 1.00 22.44 O ATOM 1899 CB THR A 229 -23.344 28.820 49.379 1.00 22.68 C ATOM 1900 OG1 THR A 229 -22.192 29.146 50.175 1.00 22.44 O ATOM 1901 CG2 THR A 229 -24.351 29.945 49.369 1.00 22.94 C ATOM 1902 HG1 THR A 229 -21.802 29.998 49.855 1.00 0.00 H ATOM 1903 H THR A 229 -22.088 26.567 49.356 1.00 0.00 H ATOM 1904 N GLN A 230 -26.290 27.213 49.484 1.00 23.12 N ATOM 1905 CA GLN A 230 -27.495 26.755 48.809 1.00 23.80 C ATOM 1906 C GLN A 230 -28.004 27.760 47.797 1.00 24.75 C ATOM 1907 O GLN A 230 -28.654 28.736 48.142 1.00 24.01 O ATOM 1908 CB GLN A 230 -28.587 26.422 49.854 1.00 23.79 C ATOM 1909 CG GLN A 230 -29.739 25.596 49.297 1.00 24.44 C ATOM 1910 CD GLN A 230 -30.849 25.343 50.294 1.00 26.02 C ATOM 1911 OE1 GLN A 230 -31.699 24.444 50.096 1.00 32.84 O ATOM 1912 NE2 GLN A 230 -30.868 26.087 51.316 1.00 25.45 N ATOM 1913 HE22 GLN A 230 -30.141 26.821 51.439 1.00 0.00 H ATOM 1914 HE21 GLN A 230 -31.610 25.965 52.034 1.00 0.00 H ATOM 1915 H GLN A 230 -26.382 27.636 50.430 1.00 0.00 H ATOM 1916 N VAL A 231 -27.692 27.530 46.520 1.00 22.30 N ATOM 1917 CA VAL A 231 -27.824 28.544 45.520 1.00 23.92 C ATOM 1918 C VAL A 231 -29.294 28.985 45.259 1.00 25.50 C ATOM 1919 O VAL A 231 -29.546 30.186 45.074 1.00 26.63 O ATOM 1920 CB VAL A 231 -27.134 28.133 44.202 1.00 23.13 C ATOM 1921 CG1 VAL A 231 -27.320 29.200 43.108 1.00 23.30 C ATOM 1922 CG2 VAL A 231 -25.654 27.927 44.436 1.00 25.52 C ATOM 1923 H VAL A 231 -27.344 26.589 46.245 1.00 0.00 H ATOM 1924 N CYS A 232 -30.254 28.079 45.502 1.00 26.40 N ATOM 1925 CA CYS A 232 -31.656 28.351 45.210 1.00 25.95 C ATOM 1926 C CYS A 232 -32.198 29.409 46.151 1.00 28.22 C ATOM 1927 O CYS A 232 -33.254 29.943 45.921 1.00 27.69 O ATOM 1928 CB CYS A 232 -32.508 27.071 45.355 1.00 28.11 C ATOM 1929 SG CYS A 232 -32.501 26.367 47.015 1.00 30.95 S ATOM 1930 H CYS A 232 -29.991 27.159 45.909 1.00 0.00 H ATOM 1931 N LYS A 233 -31.457 29.688 47.232 1.00 26.37 N ATOM 1932 CA LYS A 233 -31.911 30.696 48.226 1.00 27.20 C ATOM 1933 C LYS A 233 -31.377 32.073 47.870 1.00 28.76 C ATOM 1934 O LYS A 233 -31.602 33.037 48.608 1.00 27.90 O ATOM 1935 CB LYS A 233 -31.429 30.291 49.606 1.00 27.04 C ATOM 1936 CG LYS A 233 -31.913 28.937 50.084 1.00 27.43 C ATOM 1937 CD LYS A 233 -33.405 28.969 50.361 1.00 31.37 C ATOM 1938 CE LYS A 233 -33.944 27.624 50.844 1.00 32.61 C ATOM 1939 NZ LYS A 233 -33.497 27.272 52.230 1.00 35.51 N ATOM 1940 HZ1 LYS A 233 -32.459 27.222 52.256 1.00 0.00 H ATOM 1941 HZ2 LYS A 233 -33.827 28.000 52.895 1.00 0.00 H ATOM 1942 HZ3 LYS A 233 -33.896 26.350 52.498 1.00 0.00 H ATOM 1943 H LYS A 233 -30.554 29.194 47.377 1.00 0.00 H ATOM 1944 N TYR A 234 -30.616 32.174 46.769 1.00 25.76 N ATOM 1945 CA TYR A 234 -29.996 33.432 46.384 1.00 26.51 C ATOM 1946 C TYR A 234 -30.335 33.826 44.957 1.00 28.39 C ATOM 1947 O TYR A 234 -29.633 34.634 44.377 1.00 25.85 O ATOM 1948 CB TYR A 234 -28.484 33.343 46.498 1.00 25.31 C ATOM 1949 CG TYR A 234 -28.002 33.202 47.885 1.00 25.31 C ATOM 1950 CD1 TYR A 234 -27.839 34.308 48.680 1.00 25.92 C ATOM 1951 CD2 TYR A 234 -27.824 31.954 48.444 1.00 25.34 C ATOM 1952 CE1 TYR A 234 -27.391 34.184 49.978 1.00 25.50 C ATOM 1953 CE2 TYR A 234 -27.499 31.815 49.774 1.00 26.91 C ATOM 1954 CZ TYR A 234 -27.230 32.941 50.519 1.00 27.10 C ATOM 1955 OH TYR A 234 -26.946 32.814 51.850 1.00 26.95 O ATOM 1956 HH TYR A 234 -26.778 33.709 52.237 1.00 0.00 H ATOM 1957 H TYR A 234 -30.466 31.332 46.177 1.00 0.00 H ATOM 1958 N LYS A 235 -31.472 33.331 44.435 1.00 31.87 N ATOM 1959 CA LYS A 235 -31.870 33.612 43.040 1.00 32.93 C ATOM 1960 C LYS A 235 -32.017 35.089 42.764 1.00 32.23 C ATOM 1961 O LYS A 235 -31.489 35.602 41.755 1.00 32.11 O ATOM 1962 CB LYS A 235 -33.195 32.913 42.690 1.00 37.01 C ATOM 1963 CG LYS A 235 -33.118 31.397 42.708 1.00 39.26 C ATOM 1964 CD LYS A 235 -34.456 30.742 42.303 1.00 43.70 C ATOM 1965 CE LYS A 235 -35.667 31.545 42.783 1.00 50.31 C ATOM 1966 NZ LYS A 235 -36.749 30.676 43.318 1.00 53.05 N ATOM 1967 HZ1 LYS A 235 -37.070 30.025 42.573 1.00 0.00 H ATOM 1968 HZ2 LYS A 235 -36.386 30.129 44.125 1.00 0.00 H ATOM 1969 HZ3 LYS A 235 -37.545 31.268 43.629 1.00 0.00 H ATOM 1970 H LYS A 235 -32.086 32.736 45.028 1.00 0.00 H ATOM 1971 N ARG A 236 -32.712 35.788 43.656 1.00 30.85 N ATOM 1972 CA ARG A 236 -32.965 37.227 43.490 1.00 33.01 C ATOM 1973 C ARG A 236 -31.692 38.020 43.515 1.00 29.72 C ATOM 1974 O ARG A 236 -31.517 38.932 42.738 1.00 28.11 O ATOM 1975 CB ARG A 236 -33.897 37.752 44.582 1.00 38.31 C ATOM 1976 CG ARG A 236 -35.342 37.802 44.167 1.00 45.60 C ATOM 1977 CD ARG A 236 -36.258 37.814 45.386 1.00 49.07 C ATOM 1978 NE ARG A 236 -36.058 39.022 46.190 1.00 50.37 N ATOM 1979 CZ ARG A 236 -36.637 39.237 47.364 1.00 51.12 C ATOM 1980 NH1 ARG A 236 -37.470 38.326 47.884 1.00 49.89 N ATOM 1981 NH2 ARG A 236 -36.362 40.334 48.031 1.00 46.13 N ATOM 1982 HE ARG A 236 -35.423 39.756 45.817 1.00 0.00 H ATOM 1983 HH12 ARG A 236 -37.921 38.500 48.805 1.00 0.00 H ATOM 1984 HH11 ARG A 236 -37.666 37.445 47.367 1.00 0.00 H ATOM 1985 HH22 ARG A 236 -36.812 40.509 48.952 1.00 0.00 H ATOM 1986 HH21 ARG A 236 -35.694 41.028 47.638 1.00 0.00 H ATOM 1987 H ARG A 236 -33.088 35.303 44.496 1.00 0.00 H ATOM 1988 N TRP A 237 -30.851 37.740 44.499 1.00 26.06 N ATOM 1989 CA TRP A 237 -29.597 38.423 44.631 1.00 26.05 C ATOM 1990 C TRP A 237 -28.651 38.232 43.432 1.00 24.75 C ATOM 1991 O TRP A 237 -28.096 39.208 42.879 1.00 24.65 O ATOM 1992 CB TRP A 237 -28.886 37.964 45.923 1.00 27.76 C ATOM 1993 CG TRP A 237 -27.547 38.615 46.083 1.00 29.29 C ATOM 1994 CD1 TRP A 237 -27.314 39.923 46.424 1.00 29.19 C ATOM 1995 CD2 TRP A 237 -26.272 38.080 45.696 1.00 27.54 C ATOM 1996 NE1 TRP A 237 -26.004 40.158 46.467 1.00 29.07 N ATOM 1997 CE2 TRP A 237 -25.334 39.091 45.900 1.00 27.58 C ATOM 1998 CE3 TRP A 237 -25.849 36.859 45.164 1.00 27.76 C ATOM 1999 CZ2 TRP A 237 -23.986 38.924 45.642 1.00 26.97 C ATOM 2000 CZ3 TRP A 237 -24.482 36.672 44.938 1.00 28.54 C ATOM 2001 CH2 TRP A 237 -23.571 37.718 45.162 1.00 27.14 C ATOM 2002 HE1 TRP A 237 -25.557 41.009 46.864 1.00 0.00 H ATOM 2003 H TRP A 237 -31.106 37.008 45.192 1.00 0.00 H ATOM 2004 N VAL A 238 -28.538 37.004 42.978 1.00 24.52 N ATOM 2005 CA VAL A 238 -27.725 36.698 41.796 1.00 25.91 C ATOM 2006 C VAL A 238 -28.253 37.474 40.598 1.00 28.93 C ATOM 2007 O VAL A 238 -27.496 38.203 39.931 1.00 29.10 O ATOM 2008 CB VAL A 238 -27.690 35.206 41.530 1.00 24.97 C ATOM 2009 CG1 VAL A 238 -27.094 34.922 40.218 1.00 26.35 C ATOM 2010 CG2 VAL A 238 -26.900 34.502 42.609 1.00 25.58 C ATOM 2011 H VAL A 238 -29.036 36.233 43.467 1.00 0.00 H ATOM 2012 N MET A 239 -29.551 37.427 40.369 1.00 27.83 N ATOM 2013 CA MET A 239 -30.104 38.108 39.157 1.00 31.46 C ATOM 2014 C MET A 239 -30.020 39.632 39.214 1.00 31.01 C ATOM 2015 O MET A 239 -29.543 40.276 38.250 1.00 28.72 O ATOM 2016 CB MET A 239 -31.518 37.632 38.842 1.00 34.16 C ATOM 2017 CG MET A 239 -31.595 36.113 38.484 1.00 45.23 C ATOM 2018 SD MET A 239 -30.601 35.495 37.033 1.00 54.80 S ATOM 2019 CE MET A 239 -30.849 36.812 35.829 1.00 56.59 C ATOM 2020 H MET A 239 -30.183 36.922 41.023 1.00 0.00 H ATOM 2021 N GLU A 240 -30.297 40.195 40.387 1.00 28.90 N ATOM 2022 CA GLU A 240 -30.179 41.631 40.630 1.00 31.29 C ATOM 2023 C GLU A 240 -28.786 42.154 40.474 1.00 30.35 C ATOM 2024 O GLU A 240 -28.571 43.167 39.840 1.00 28.40 O ATOM 2025 CB GLU A 240 -30.663 41.960 42.031 1.00 34.62 C ATOM 2026 CG GLU A 240 -30.578 43.422 42.361 1.00 38.40 C ATOM 2027 CD GLU A 240 -31.559 44.250 41.550 1.00 44.85 C ATOM 2028 OE1 GLU A 240 -32.698 43.765 41.308 1.00 55.79 O ATOM 2029 OE2 GLU A 240 -31.157 45.343 41.070 1.00 54.61 O ATOM 2030 H GLU A 240 -30.612 39.584 41.168 1.00 0.00 H ATOM 2031 N THR A 241 -27.826 41.465 41.086 1.00 28.54 N ATOM 2032 CA THR A 241 -26.472 41.876 41.046 1.00 28.08 C ATOM 2033 C THR A 241 -25.948 41.862 39.580 1.00 29.15 C ATOM 2034 O THR A 241 -25.197 42.730 39.207 1.00 28.13 O ATOM 2035 CB THR A 241 -25.596 40.970 41.925 1.00 27.87 C ATOM 2036 OG1 THR A 241 -26.054 41.008 43.299 1.00 30.19 O ATOM 2037 CG2 THR A 241 -24.190 41.399 41.853 1.00 30.15 C ATOM 2038 HG1 THR A 241 -26.991 40.693 43.342 1.00 0.00 H ATOM 2039 H THR A 241 -28.077 40.601 41.608 1.00 0.00 H ATOM 2040 N MET A 242 -26.411 40.894 38.761 1.00 28.60 N ATOM 2041 CA MET A 242 -25.969 40.741 37.336 1.00 29.73 C ATOM 2042 C MET A 242 -26.676 41.608 36.307 1.00 32.12 C ATOM 2043 O MET A 242 -26.437 41.446 35.093 1.00 33.05 O ATOM 2044 CB MET A 242 -26.150 39.271 36.868 1.00 29.99 C ATOM 2045 CG MET A 242 -25.141 38.328 37.406 1.00 31.41 C ATOM 2046 SD MET A 242 -25.556 36.603 36.998 1.00 32.76 S ATOM 2047 CE MET A 242 -25.312 36.603 35.233 1.00 33.47 C ATOM 2048 H MET A 242 -27.109 40.221 39.137 1.00 0.00 H ATOM 2049 N LYS A 243 -27.721 42.298 36.728 1.00 32.28 N ATOM 2050 CA LYS A 243 -28.599 43.000 35.772 1.00 38.70 C ATOM 2051 C LYS A 243 -27.772 43.905 34.852 1.00 37.63 C ATOM 2052 O LYS A 243 -26.751 44.477 35.259 1.00 35.72 O ATOM 2053 CB LYS A 243 -29.662 43.844 36.508 1.00 42.26 C ATOM 2054 CG LYS A 243 -30.971 43.120 36.722 1.00 48.11 C ATOM 2055 CD LYS A 243 -31.988 44.014 37.454 1.00 52.23 C ATOM 2056 CE LYS A 243 -32.780 44.885 36.490 1.00 57.25 C ATOM 2057 NZ LYS A 243 -33.364 44.102 35.356 1.00 58.07 N ATOM 2058 HZ1 LYS A 243 -32.598 43.646 34.820 1.00 0.00 H ATOM 2059 HZ2 LYS A 243 -34.006 43.375 35.732 1.00 0.00 H ATOM 2060 HZ3 LYS A 243 -33.893 44.743 34.730 1.00 0.00 H ATOM 2061 H LYS A 243 -27.927 42.347 37.746 1.00 0.00 H ATOM 2062 N THR A 244 -28.113 43.866 33.589 1.00 35.57 N ATOM 2063 CA THR A 244 -27.422 44.661 32.575 1.00 37.48 C ATOM 2064 C THR A 244 -28.348 45.781 32.049 1.00 38.73 C ATOM 2065 O THR A 244 -27.881 46.720 31.368 1.00 40.35 O ATOM 2066 CB THR A 244 -26.853 43.753 31.423 1.00 38.05 C ATOM 2067 OG1 THR A 244 -25.941 44.523 30.608 1.00 38.44 O ATOM 2068 CG2 THR A 244 -27.991 43.184 30.556 1.00 38.04 C ATOM 2069 HG1 THR A 244 -26.422 45.293 30.214 1.00 0.00 H ATOM 2070 H THR A 244 -28.899 43.251 33.298 1.00 0.00 H ATOM 2071 N HIS A 245 -29.627 45.732 32.446 1.00 37.15 N ATOM 2072 CA HIS A 245 -30.646 46.717 32.042 1.00 39.73 C ATOM 2073 C HIS A 245 -31.383 47.300 33.274 1.00 44.10 C ATOM 2074 O HIS A 245 -31.103 46.917 34.416 1.00 44.87 O ATOM 2075 CB HIS A 245 -31.705 46.063 31.121 1.00 42.79 C ATOM 2076 CG HIS A 245 -31.139 45.475 29.870 1.00 42.39 C ATOM 2077 ND1 HIS A 245 -30.637 46.247 28.849 1.00 41.01 N ATOM 2078 CD2 HIS A 245 -31.022 44.185 29.463 1.00 46.74 C ATOM 2079 CE1 HIS A 245 -30.221 45.456 27.872 1.00 43.03 C ATOM 2080 NE2 HIS A 245 -30.400 44.200 28.245 1.00 41.03 N ATOM 2081 H HIS A 245 -29.917 44.955 33.074 1.00 0.00 H ATOM 2082 N ARG A 246 -32.463 48.031 33.010 1.00 41.67 N ATOM 2083 CA ARG A 246 -33.284 48.624 34.087 1.00 48.41 C ATOM 2084 C ARG A 246 -33.937 47.495 34.915 1.00 51.62 C ATOM 2085 O ARG A 246 -34.305 47.693 36.078 1.00 53.07 O ATOM 2086 CB ARG A 246 -34.385 49.521 33.501 1.00 48.33 C ATOM 2087 CG ARG A 246 -35.668 48.761 33.227 1.00 51.90 C ATOM 2088 CD ARG A 246 -36.718 49.587 32.509 1.00 54.29 C ATOM 2089 NE ARG A 246 -36.246 50.921 32.198 1.00 56.32 N ATOM 2090 CZ ARG A 246 -37.009 52.000 32.236 1.00 58.45 C ATOM 2091 NH1 ARG A 246 -38.308 51.880 32.501 1.00 60.98 N ATOM 2092 NH2 ARG A 246 -36.488 53.203 31.945 1.00 55.68 N ATOM 2093 OXT ARG A 246 -34.131 46.370 34.411 1.00 47.27 O ATOM 2094 HE ARG A 246 -35.248 51.037 31.929 1.00 0.00 H ATOM 2095 HH12 ARG A 246 -38.913 52.726 32.532 1.00 0.00 H ATOM 2096 HH11 ARG A 246 -38.718 50.941 32.677 1.00 0.00 H ATOM 2097 HH22 ARG A 246 -37.089 54.051 31.975 1.00 0.00 H ATOM 2098 HH21 ARG A 246 -35.483 53.287 31.689 1.00 0.00 H ATOM 2099 H ARG A 246 -32.737 48.189 32.019 1.00 0.00 H TER 2100 ARG A 246 HETATM 2101 O HOH 1 -22.844 22.844 24.727 1.00 37.40 O HETATM 2102 O HOH 2 -8.623 9.916 30.837 1.00 42.96 O HETATM 2103 O HOH 3 -12.628 30.566 25.843 1.00 48.75 O HETATM 2104 O HOH 4 -14.067 15.079 56.696 1.00 37.82 O HETATM 2105 O HOH 5 -34.788 14.885 43.674 1.00 46.71 O HETATM 2106 O HOH 6 -32.814 21.097 39.314 1.00 43.44 O HETATM 2107 O HOH 7 -6.310 18.727 53.179 1.00 41.76 O HETATM 2108 O HOH 8 -21.018 37.170 61.677 1.00 40.14 O HETATM 2109 O HOH 9 -29.283 48.328 35.509 1.00 46.57 O HETATM 2110 O HOH 10 -11.967 41.789 43.424 1.00 35.80 O HETATM 2111 O HOH 11 -9.636 17.408 42.981 1.00 25.05 O HETATM 2112 O HOH 12 -26.648 30.789 34.166 1.00 36.85 O HETATM 2113 O HOH 13 -5.137 37.600 31.606 1.00 44.51 O HETATM 2114 O HOH 14 -24.765 44.157 36.916 1.00 32.57 O HETATM 2115 O HOH 15 -28.643 20.205 53.952 1.00 32.83 O HETATM 2116 O HOH 16 -29.754 25.206 45.952 1.00 31.12 O HETATM 2117 O HOH 17 -19.147 8.174 41.856 1.00 26.87 O HETATM 2118 O HOH 18 -19.363 20.498 37.738 1.00 31.85 O HETATM 2119 O HOH 19 -20.310 10.564 54.422 1.00 42.04 O HETATM 2120 O HOH 20 -20.759 13.051 32.519 1.00 36.73 O HETATM 2121 O HOH 21 -15.443 44.093 28.997 1.00 25.99 O HETATM 2122 O HOH 22 -12.661 7.086 43.649 1.00 28.66 O HETATM 2123 O HOH 23 -19.812 16.763 49.527 1.00 32.24 O HETATM 2124 O HOH 24 -24.057 34.694 61.339 1.00 42.74 O HETATM 2125 O HOH 25 -25.200 30.485 54.007 1.00 28.03 O HETATM 2126 O HOH 26 -7.876 45.017 34.200 1.00 49.20 O HETATM 2127 O HOH 27 -19.817 20.613 26.628 1.00 36.97 O HETATM 2128 O HOH 28 -12.542 38.444 66.316 1.00 30.51 O HETATM 2129 O HOH 29 -13.095 42.697 36.396 1.00 28.04 O HETATM 2130 O HOH 30 -24.506 9.331 44.380 1.00 32.07 O HETATM 2131 O HOH 31 -34.574 24.132 39.217 1.00 48.41 O HETATM 2132 O HOH 32 -22.955 29.682 52.719 1.00 27.17 O HETATM 2133 O HOH 33 -13.071 24.423 32.600 1.00 35.21 O HETATM 2134 O HOH 34 -14.068 23.486 42.575 1.00 27.25 O HETATM 2135 O HOH 35 -14.865 19.549 21.332 1.00 40.28 O HETATM 2136 O HOH 36 -20.614 27.860 60.743 1.00 45.49 O HETATM 2137 O HOH 37 -11.206 23.704 42.099 1.00 22.54 O HETATM 2138 O HOH 38 -9.641 34.408 49.401 1.00 26.98 O HETATM 2139 O HOH 39 -22.548 17.487 34.044 1.00 37.67 O HETATM 2140 O HOH 40 -14.196 16.453 53.065 1.00 31.21 O HETATM 2141 O HOH 41 -24.608 11.521 42.350 1.00 33.85 O HETATM 2142 O HOH 42 -4.772 21.138 41.221 1.00 25.98 O HETATM 2143 O HOH 43 -10.186 12.119 43.855 1.00 34.68 O HETATM 2144 O HOH 44 -21.093 28.350 54.412 1.00 28.22 O HETATM 2145 O HOH 45 -15.370 6.014 50.016 1.00 45.12 O HETATM 2146 O HOH 46 -11.281 15.800 34.077 1.00 29.17 O HETATM 2147 O HOH 47 -19.320 11.367 51.401 1.00 30.00 O HETATM 2148 O HOH 48 -29.341 9.255 63.921 1.00 55.68 O HETATM 2149 O HOH 49 -21.109 18.659 38.644 1.00 36.54 O HETATM 2150 O HOH 50 -14.105 21.808 32.453 1.00 33.26 O HETATM 2151 O HOH 51 -8.598 10.519 46.321 1.00 37.15 O HETATM 2152 O HOH 52 -11.450 6.896 40.657 1.00 28.34 O HETATM 2153 O HOH 53 -4.071 36.645 40.022 1.00 43.90 O HETATM 2154 O HOH 54 -14.350 22.408 29.703 1.00 31.97 O HETATM 2155 O HOH 55 -15.490 18.207 31.927 1.00 43.27 O HETATM 2156 O HOH 56 -7.972 42.226 31.064 1.00 37.55 O HETATM 2157 O HOH 57 -10.012 25.581 49.701 1.00 41.46 O HETATM 2158 O HOH 58 -31.545 9.062 47.338 1.00 46.42 O HETATM 2159 O HOH 59 -16.625 12.361 53.596 1.00 34.46 O HETATM 2160 O HOH 60 -6.677 24.246 55.459 1.00 54.93 O HETATM 2161 O HOH 61 -7.797 36.636 27.423 1.00 48.70 O HETATM 2162 O HOH 62 -29.135 11.703 51.394 1.00 38.11 O HETATM 2163 O HOH 63 -10.094 21.863 26.571 1.00 40.22 O HETATM 2164 O HOH 64 -29.394 30.163 34.346 1.00 30.37 O HETATM 2165 O HOH 65 -6.358 40.101 47.504 1.00 40.03 O HETATM 2166 O HOH 66 -5.324 44.121 42.409 1.00 53.24 O HETATM 2167 O HOH 67 0.416 25.046 44.238 1.00 60.84 O HETATM 2168 O HOH 68 -15.039 26.803 31.368 1.00 30.59 O HETATM 2169 O HOH 69 -26.543 23.415 33.812 1.00 37.37 O HETATM 2170 O HOH 70 -21.489 26.698 24.787 1.00 47.32 O HETATM 2171 O HOH 71 -7.363 22.881 26.309 1.00 47.95 O HETATM 2172 O HOH 72 -10.636 25.968 32.958 1.00 29.74 O HETATM 2173 O HOH 73 -31.438 22.495 47.453 1.00 35.24 O HETATM 2174 O HOH 74 -18.278 21.330 50.365 1.00 31.23 O HETATM 2175 O HOH 75 -3.847 30.917 47.097 1.00 44.06 O HETATM 2176 O HOH 76 -4.058 28.652 32.982 1.00 40.31 O HETATM 2177 O HOH 77 -17.829 9.745 43.820 1.00 28.03 O HETATM 2178 O HOH 78 -25.124 13.923 39.219 1.00 42.62 O HETATM 2179 O HOH 79 -16.161 19.963 30.349 1.00 40.28 O HETATM 2180 O HOH 80 -30.196 37.656 49.689 1.00 45.59 O HETATM 2181 O HOH 81 -19.808 12.954 53.562 1.00 39.91 O HETATM 2182 O HOH 82 -31.673 12.269 41.906 1.00 33.73 O HETATM 2183 O HOH 83 -23.790 34.701 28.062 1.00 30.82 O HETATM 2184 O HOH 84 -14.634 34.398 67.556 1.00 30.02 O HETATM 2185 O HOH 85 -19.844 33.097 22.290 1.00 39.37 O HETATM 2186 O HOH 86 -36.308 53.965 29.081 1.00 41.53 O HETATM 2187 O HOH 87 -38.028 25.294 45.905 1.00 41.39 O HETATM 2188 O HOH 88 -26.860 29.998 56.344 1.00 34.02 O HETATM 2189 O HOH 89 -13.977 44.157 44.080 1.00 31.72 O HETATM 2190 O HOH 90 -16.020 16.873 55.354 1.00 31.51 O HETATM 2191 O HOH 91 -31.369 13.288 54.357 1.00 37.69 O HETATM 2192 O HOH 92 -13.048 20.649 60.907 1.00 47.41 O HETATM 2193 O HOH 93 -8.091 39.615 30.444 1.00 27.20 O HETATM 2194 O HOH 94 -25.057 16.407 38.028 1.00 38.19 O HETATM 2195 O HOH 95 1.143 18.023 52.673 1.00 47.56 O HETATM 2196 O HOH 96 -3.638 29.760 30.662 1.00 35.42 O HETATM 2197 O HOH 97 -26.829 17.056 36.419 1.00 43.08 O HETATM 2198 O HOH 98 -4.633 14.458 37.349 1.00 30.00 O HETATM 2199 O HOH 99 -16.793 42.356 51.612 1.00 41.57 O HETATM 2200 O HOH 100 -23.818 29.588 27.837 1.00 41.74 O HETATM 2201 O HOH 101 -13.637 11.610 29.437 1.00 33.82 O HETATM 2202 O HOH 102 -25.674 17.911 33.996 1.00 47.41 O HETATM 2203 O HOH 103 0.922 33.376 43.318 1.00 50.77 O HETATM 2204 O HOH 104 -2.064 25.388 40.468 1.00 35.78 O HETATM 2205 O HOH 105 -18.462 13.512 34.440 1.00 25.54 O HETATM 2206 O HOH 106 -18.541 7.444 61.022 1.00 51.23 O HETATM 2207 O HOH 107 -30.999 24.186 54.042 1.00 63.14 O HETATM 2208 O HOH 108 -33.969 29.775 54.006 1.00 51.85 O HETATM 2209 O HOH 109 -31.059 43.002 33.104 1.00 36.40 O HETATM 2210 O HOH 110 -26.111 43.134 47.386 1.00 42.25 O HETATM 2211 O HOH 111 -26.938 27.802 29.904 1.00 55.98 O HETATM 2212 O HOH 112 -30.844 26.416 61.096 1.00 53.68 O HETATM 2213 O HOH 113 -31.684 36.340 47.245 1.00 30.67 O HETATM 2214 O HOH 114 -11.011 46.744 34.445 1.00 46.63 O HETATM 2215 O HOH 115 -4.929 40.287 44.514 1.00 51.68 O HETATM 2216 O HOH 116 -24.942 38.400 24.959 1.00 42.71 O HETATM 2217 O HOH 117 -5.300 34.672 49.905 1.00 46.48 O HETATM 2218 O HOH 118 -1.562 25.369 38.000 1.00 48.60 O HETATM 2219 O HOH 119 -12.286 35.731 62.282 1.00 54.71 O HETATM 2220 O HOH 120 -34.036 34.384 46.519 1.00 37.89 O HETATM 2221 O HOH 121 -4.288 36.607 48.541 1.00 49.87 O HETATM 2222 O HOH 122 -1.920 29.295 34.246 1.00 40.60 O HETATM 2223 O HOH 123 -15.687 24.035 19.963 1.00 52.86 O HETATM 2224 O HOH 124 -3.710 39.948 32.250 1.00 52.08 O HETATM 2225 O HOH 125 -20.232 23.436 20.347 1.00 57.53 O HETATM 2226 O HOH 126 -35.355 35.802 49.452 1.00 59.13 O HETATM 2227 O HOH 127 -31.334 21.241 53.033 1.00 48.91 O HETATM 2228 O HOH 128 -10.197 34.973 65.924 1.00 54.11 O HETATM 2229 O HOH 129 -32.583 20.798 50.984 1.00 56.88 O HETATM 2230 O HOH 130 -28.104 32.004 57.796 1.00 49.22 O HETATM 2231 O HOH 131 -33.492 30.634 36.349 1.00 59.77 O HETATM 2232 O HOH 132 -15.173 22.461 61.182 1.00 52.63 O HETATM 2233 O HOH 133 -9.233 30.505 50.244 1.00 51.79 O HETATM 2234 O HOH 134 2.354 27.030 37.813 1.00 46.79 O HETATM 2235 O HOH 135 -22.703 17.467 36.885 1.00 42.36 O HETATM 2236 O HOH 136 -24.768 32.336 29.099 1.00 46.82 O HETATM 2237 O HOH 137 -0.443 37.666 42.663 1.00 56.18 O HETATM 2238 O HOH 138 -27.601 30.084 30.630 1.00 59.30 O HETATM 2239 O HOH 139 -8.617 27.344 55.674 1.00 57.08 O HETATM 2240 O HOH 140 -10.472 26.139 58.699 1.00 54.05 O HETATM 2241 O HOH 141 -29.069 34.668 33.760 1.00 58.54 O HETATM 2242 O HOH 142 -22.998 34.421 25.296 1.00 43.17 O HETATM 2243 C1 MOL A 143 -12.377 21.808 53.501 1.00 0.14 C HETATM 2244 S19 MOL A 143 -11.178 22.772 54.031 1.00 0.12 S HETATM 2245 O18 MOL A 143 -10.514 22.107 55.122 1.00 -0.14 O HETATM 2246 O8 MOL A 143 -10.204 22.940 53.000 1.00 -0.14 O HETATM 2247 N14 MOL A 143 -11.783 24.264 54.521 1.00 -0.13 N HETATM 2248 C24 MOL A 143 -11.770 25.352 53.705 1.00 0.05 C HETATM 2249 C11 MOL A 143 -12.343 26.342 54.503 1.00 -0.05 C HETATM 2250 C3 MOL A 143 -12.714 27.687 53.973 1.00 0.02 C HETATM 2251 N6 MOL A 143 -14.174 27.864 53.861 1.00 -0.36 N HETATM 2252 C4 MOL A 143 -14.579 28.938 54.400 1.00 0.09 C HETATM 2253 N21 MOL A 143 -13.618 29.603 54.994 1.00 -0.29 N HETATM 2254 C10 MOL A 143 -12.360 28.880 54.912 1.00 0.04 C HETATM 2255 H13 MOL A 143 -11.569 29.508 54.476 1.00 0.06 H HETATM 2256 H14 MOL A 143 -12.041 28.524 55.903 1.00 0.06 H HETATM 2257 H15 MOL A 143 -13.738 30.515 55.457 1.00 0.19 H HETATM 2258 C22 MOL A 143 -16.021 29.340 54.452 1.00 0.02 C HETATM 2259 H16 MOL A 143 -16.623 28.621 53.876 1.00 0.05 H HETATM 2260 H17 MOL A 143 -16.137 30.345 54.020 1.00 0.05 H HETATM 2261 H18 MOL A 143 -16.362 29.349 55.498 1.00 0.05 H HETATM 2262 H2 MOL A 143 -12.228 27.813 52.994 1.00 0.04 H HETATM 2263 C25 MOL A 143 -13.005 25.784 55.568 1.00 -0.03 C HETATM 2264 C15 MOL A 143 -12.557 24.462 55.640 1.00 0.09 C HETATM 2265 C7 MOL A 143 -12.985 23.685 56.707 1.00 -0.05 C HETATM 2266 C13 MOL A 143 -13.776 24.250 57.713 1.00 -0.08 C HETATM 2267 C16 MOL A 143 -14.145 25.595 57.661 1.00 -0.07 C HETATM 2268 C5 MOL A 143 -15.000 26.190 58.744 1.00 -0.04 C HETATM 2269 H3 MOL A 143 -15.181 27.253 58.526 1.00 0.04 H HETATM 2270 H4 MOL A 143 -14.484 26.097 59.711 1.00 0.04 H HETATM 2271 H5 MOL A 143 -15.961 25.656 58.788 1.00 0.04 H HETATM 2272 C23 MOL A 143 -13.749 26.375 56.581 1.00 -0.08 C HETATM 2273 H11 MOL A 143 -14.016 27.424 56.530 1.00 0.04 H HETATM 2274 H12 MOL A 143 -14.106 23.636 58.543 1.00 0.05 H HETATM 2275 H10 MOL A 143 -12.706 22.639 56.761 1.00 0.05 H HETATM 2276 H9 MOL A 143 -11.403 25.431 52.683 1.00 0.08 H HETATM 2277 C12 MOL A 143 -12.744 20.693 54.257 1.00 -0.03 C HETATM 2278 C2 MOL A 143 -13.799 19.883 53.847 1.00 -0.06 C HETATM 2279 C17 MOL A 143 -14.489 20.176 52.679 1.00 -0.06 C HETATM 2280 C20 MOL A 143 -14.130 21.276 51.916 1.00 -0.05 C HETATM 2281 C26 MOL A 143 -13.067 22.072 52.307 1.00 0.07 C HETATM 2282 CL9 MOL A 143 -12.622 23.448 51.258 1.00 -0.07 CL HETATM 2283 H7 MOL A 143 -14.681 21.513 51.013 1.00 0.06 H HETATM 2284 H8 MOL A 143 -15.310 19.543 52.363 1.00 0.06 H HETATM 2285 H1 MOL A 143 -14.082 19.022 54.441 1.00 0.06 H HETATM 2286 H6 MOL A 143 -12.205 20.457 55.167 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 67 66 1264 CONECT 249 248 392 CONECT 392 249 391 CONECT 1031 1030 1929 CONECT 1084 1083 1677 CONECT 1264 67 1263 CONECT 1370 1369 1510 CONECT 1510 1370 1509 CONECT 1603 1602 1815 CONECT 1677 1084 1676 CONECT 1815 1603 1814 CONECT 1929 1031 1928 CONECT 2243 2244 2277 2281 CONECT 2244 2243 2245 2246 2247 CONECT 2245 2244 CONECT 2246 2244 CONECT 2247 2244 2248 2264 CONECT 2248 2247 2249 2276 CONECT 2249 2248 2250 2263 CONECT 2250 2249 2251 2254 2262 CONECT 2251 2250 2252 CONECT 2252 2251 2253 2258 CONECT 2253 2252 2254 2257 CONECT 2254 2250 2253 2255 2256 CONECT 2255 2254 CONECT 2256 2254 CONECT 2257 2253 CONECT 2258 2252 2259 2260 2261 CONECT 2259 2258 CONECT 2260 2258 CONECT 2261 2258 CONECT 2262 2250 CONECT 2263 2249 2264 2272 CONECT 2264 2247 2263 2265 CONECT 2265 2264 2266 2275 CONECT 2266 2265 2267 2274 CONECT 2267 2266 2268 2272 CONECT 2268 2267 2269 2270 2271 CONECT 2269 2268 CONECT 2270 2268 CONECT 2271 2268 CONECT 2272 2263 2267 2273 CONECT 2273 2272 CONECT 2274 2266 CONECT 2275 2265 CONECT 2276 2248 CONECT 2277 2243 2278 2286 CONECT 2278 2277 2279 2285 CONECT 2279 2278 2280 2284 CONECT 2280 2279 2281 2283 CONECT 2281 2243 2280 2282 CONECT 2282 2281 CONECT 2283 2280 CONECT 2284 2279 CONECT 2285 2278 CONECT 2286 2277 MASTER 0 0 0 0 0 0 0 0 2285 1 60 18 END
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Structure:
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Related entries of code: 6ahs
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5zfi
RCSB PDB
PDBbind
224aa, >5ZFI_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
6ahs
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Kallikrein-7
Ligand Name
9YO
EC.Number
E.C.3.4.21.117
Resolution
1.75(Å)
Affinity (Kd/Ki/IC50)
IC50=1.5uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Bioorg. Med. Chem. Lett. Vol. 29: pp. 334-338
Ligand Properties
Formula
C
1
9
H
1
8
ClN
3
O
2
S
Molecular Weight
387.883
Exact Mass
387.081
No. of atoms
44
No. of bonds
47
Polar Surface Area
71.84
LOGP Value
3.22 (
Computed with XLOGP3
)
4.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 4
Canonical SMILES
Cc1ccc2c(c1)c(cn2S(=O)(=O)c1ccccc1Cl)[C@@H]1CNC(=N1)C
InChI String
InChI=1S/C19H18ClN3O2S/c1-12-7-8-18-14(9-12)15(17-10-21-13(2)22-17)11-23(18)26(24,25)19-6-4-3-5-16(19)20/h3-9,11,17H,10H2,1-2H3,(H,21,22)/t17-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q91VE3
Entrez Gene ID
NCBI Entrez Gene ID:
23993
ASD
Information of known allosteric effects of PDB entries
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