Browse entries in the PDBbind-CN Database
HEADER 4XKB_COMPLEX COMPND 4XKB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 10 ASP ASN LEU THR GLU LEU SER GLN GLN LEU SEQRES 1 A 215 LYS GLN LEU THR ALA ILE ALA ALA LEU ALA GLU MET GLY SEQRES 2 A 215 GLU GLY GLY GLN GLY ILE LEU LEU ASP TYR LEU ALA LYS SEQRES 3 A 215 ASN VAL PRO LEU GLU LYS PRO VAL LEU ALA VAL GLY ASN SEQRES 4 A 215 VAL TYR GLN THR LEU ARG ASN LEU GLU GLN GLU THR ILE SEQRES 5 A 215 THR THR GLN LEU GLN ARG ASN TYR PRO THR GLY ILE PHE SEQRES 6 A 215 PRO LEU GLN SER ALA GLN GLY ILE ASP TYR LEU PRO LEU SEQRES 7 A 215 GLN GLU ALA LEU GLY SER GLN ASP PHE GLU THR ALA ASP SEQRES 8 A 215 GLU ILE THR ARG ASP LYS LEU CYS GLU LEU ALA GLY PRO SEQRES 9 A 215 GLY ALA SER GLN ARG GLN TRP LEU TYR PHE THR GLU VAL SEQRES 10 A 215 GLU LYS PHE PRO ALA LEU ASP LEU HIS THR ILE ASN ALA SEQRES 11 A 215 LEU TRP TRP LEU HIS SER ASN GLY ASN PHE GLY PHE SER SEQRES 12 A 215 VAL GLN ARG ARG LEU TRP LEU ALA SER GLY LYS GLU PHE SEQRES 13 A 215 THR LYS LEU TRP PRO LYS ILE GLY TRP LYS SER GLY ASN SEQRES 14 A 215 VAL TRP THR ARG TRP PRO LYS GLY PHE THR TRP ASP LEU SEQRES 15 A 215 SER ALA PRO GLN GLY HIS LEU PRO LEU LEU ASN GLN LEU SEQRES 16 A 215 ARG GLY VAL ARG VAL ALA GLU SER LEU TYR ARG HIS PRO SEQRES 17 A 215 VAL TRP SER GLN TYR GLY TRP HET DE A 9 64 ATOM 1 N ASP A 3 18.014 13.773 10.994 1.00 32.03 N ATOM 2 CA ASP A 3 16.880 13.194 11.711 1.00 31.84 C ATOM 3 C ASP A 3 16.460 11.860 11.100 1.00 31.83 C ATOM 4 O ASP A 3 16.846 11.528 9.975 1.00 31.89 O ATOM 5 CB ASP A 3 15.696 14.153 11.690 1.00 31.63 C ATOM 6 CG ASP A 3 15.174 14.374 10.296 1.00 31.63 C ATOM 7 OD1 ASP A 3 15.749 15.216 9.590 1.00 31.58 O ATOM 8 OD2 ASP A 3 14.213 13.686 9.892 1.00 31.65 O ATOM 9 HN3 ASP A 3 17.750 13.932 10.001 1.00 0.00 H ATOM 10 HN2 ASP A 3 18.821 13.119 11.039 1.00 0.00 H ATOM 11 HN1 ASP A 3 18.275 14.679 11.434 1.00 0.00 H ATOM 12 N ASN A 4 15.649 11.111 11.842 1.00 31.71 N ATOM 13 CA ASN A 4 15.252 9.759 11.445 1.00 31.83 C ATOM 14 C ASN A 4 14.613 9.639 10.058 1.00 31.79 C ATOM 15 O ASN A 4 14.923 8.714 9.292 1.00 31.73 O ATOM 16 CB ASN A 4 14.321 9.151 12.499 1.00 32.01 C ATOM 17 H ASN A 4 15.284 11.499 12.735 1.00 0.00 H ATOM 18 N LEU A 5 13.712 10.561 9.735 1.00 31.52 N ATOM 19 CA LEU A 5 12.990 10.472 8.473 1.00 31.27 C ATOM 20 C LEU A 5 13.929 10.749 7.309 1.00 30.49 C ATOM 21 O LEU A 5 13.858 10.093 6.263 1.00 30.15 O ATOM 22 CB LEU A 5 11.793 11.421 8.463 1.00 31.87 C ATOM 23 CG LEU A 5 10.609 11.027 9.353 1.00 32.21 C ATOM 24 CD1 LEU A 5 9.495 12.054 9.271 1.00 32.46 C ATOM 25 CD2 LEU A 5 10.084 9.653 8.971 1.00 32.34 C ATOM 26 H LEU A 5 13.522 11.349 10.386 1.00 0.00 H ATOM 27 N THR A 6 14.825 11.710 7.507 1.00 29.96 N ATOM 28 CA THR A 6 15.830 12.022 6.499 1.00 29.80 C ATOM 29 C THR A 6 16.725 10.804 6.246 1.00 29.82 C ATOM 30 O THR A 6 17.013 10.464 5.100 1.00 29.23 O ATOM 31 CB THR A 6 16.666 13.253 6.902 1.00 29.56 C ATOM 32 OG1 THR A 6 15.813 14.408 6.958 1.00 29.30 O ATOM 33 CG2 THR A 6 17.773 13.506 5.896 1.00 29.24 C ATOM 34 HG1 THR A 6 15.099 14.258 7.627 1.00 0.00 H ATOM 35 H THR A 6 14.809 12.249 8.396 1.00 0.00 H ATOM 36 N GLU A 7 17.145 10.132 7.315 1.00 30.44 N ATOM 37 CA GLU A 7 17.924 8.903 7.162 1.00 31.22 C ATOM 38 C GLU A 7 17.170 7.868 6.318 1.00 31.90 C ATOM 39 O GLU A 7 17.747 7.234 5.425 1.00 31.49 O ATOM 40 CB GLU A 7 18.304 8.324 8.529 1.00 31.43 C ATOM 41 H GLU A 7 16.918 10.483 8.267 1.00 0.00 H ATOM 42 N LEU A 8 15.872 7.727 6.577 1.00 32.80 N ATOM 43 CA LEU A 8 15.031 6.822 5.793 1.00 33.63 C ATOM 44 C LEU A 8 14.969 7.218 4.324 1.00 34.53 C ATOM 45 O LEU A 8 15.006 6.354 3.442 1.00 34.68 O ATOM 46 CB LEU A 8 13.622 6.740 6.380 1.00 33.72 C ATOM 47 CG LEU A 8 13.517 5.920 7.665 1.00 33.77 C ATOM 48 CD1 LEU A 8 12.157 6.093 8.317 1.00 33.86 C ATOM 49 CD2 LEU A 8 13.771 4.458 7.350 1.00 33.67 C ATOM 50 H LEU A 8 15.446 8.272 7.354 1.00 0.00 H ATOM 51 N SER A 9 14.871 8.520 4.064 1.00 35.35 N ATOM 52 CA SER A 9 14.871 9.031 2.699 1.00 36.24 C ATOM 53 C SER A 9 16.123 8.572 1.965 1.00 36.64 C ATOM 54 O SER A 9 16.076 8.183 0.796 1.00 36.86 O ATOM 55 CB SER A 9 14.798 10.561 2.695 1.00 36.66 C ATOM 56 OG SER A 9 14.773 11.068 1.368 1.00 37.09 O ATOM 57 HG SER A 9 14.726 12.057 1.394 1.00 0.00 H ATOM 58 H SER A 9 14.792 9.190 4.856 1.00 0.00 H ATOM 59 N GLN A 10 17.248 8.606 2.666 1.00 36.80 N ATOM 60 CA GLN A 10 18.514 8.218 2.068 1.00 36.99 C ATOM 61 C GLN A 10 18.567 6.720 1.793 1.00 37.07 C ATOM 62 O GLN A 10 19.263 6.278 0.877 1.00 37.17 O ATOM 63 CB GLN A 10 19.668 8.652 2.964 1.00 37.09 C ATOM 64 CG GLN A 10 19.705 10.155 3.182 1.00 37.26 C ATOM 65 CD GLN A 10 20.764 10.571 4.170 1.00 37.40 C ATOM 66 OE1 GLN A 10 21.416 9.728 4.782 1.00 37.66 O ATOM 67 NE2 GLN A 10 20.938 11.876 4.339 1.00 37.40 N ATOM 68 HE22 GLN A 10 20.362 12.552 3.798 1.00 0.00 H ATOM 69 HE21 GLN A 10 21.651 12.223 5.013 1.00 0.00 H ATOM 70 H GLN A 10 17.224 8.915 3.659 1.00 0.00 H ATOM 71 N GLN A 11 17.814 5.950 2.579 1.00 37.04 N ATOM 72 CA GLN A 11 17.773 4.498 2.437 1.00 37.14 C ATOM 73 C GLN A 11 17.021 4.064 1.176 1.00 37.39 C ATOM 74 O GLN A 11 17.094 2.903 0.772 1.00 37.38 O ATOM 75 CB GLN A 11 17.135 3.837 3.670 1.00 37.41 C ATOM 76 CG GLN A 11 17.985 3.799 4.943 1.00 37.51 C ATOM 77 CD GLN A 11 17.355 2.954 6.061 1.00 37.57 C ATOM 78 OE1 GLN A 11 16.748 1.909 5.808 1.00 37.56 O ATOM 79 NE2 GLN A 11 17.499 3.412 7.303 1.00 37.56 N ATOM 80 HE22 GLN A 11 18.018 4.297 7.474 1.00 0.00 H ATOM 81 HE21 GLN A 11 17.093 2.885 8.102 1.00 0.00 H ATOM 82 H GLN A 11 17.236 6.399 3.318 1.00 0.00 H ATOM 83 N LEU A 12 16.289 4.995 0.568 1.00 37.47 N ATOM 84 CA LEU A 12 15.555 4.715 -0.664 1.00 37.70 C ATOM 85 C LEU A 12 16.511 4.422 -1.821 1.00 37.98 C ATOM 86 O LEU A 12 16.162 3.721 -2.776 1.00 38.13 O ATOM 87 CB LEU A 12 14.640 5.893 -1.018 1.00 37.59 C ATOM 88 CG LEU A 12 13.198 5.914 -0.491 1.00 37.54 C ATOM 89 CD1 LEU A 12 13.001 4.977 0.688 1.00 37.66 C ATOM 90 CD2 LEU A 12 12.765 7.332 -0.130 1.00 37.41 C ATOM 91 H LEU A 12 16.238 5.948 0.981 1.00 0.00 H TER 92 LEU A 12 ATOM 93 N LYS A 19 17.125 -3.307 0.530 1.00 31.56 N ATOM 94 CA LYS A 19 16.974 -2.480 1.721 1.00 31.29 C ATOM 95 C LYS A 19 15.971 -1.368 1.480 1.00 31.39 C ATOM 96 O LYS A 19 15.363 -0.853 2.422 1.00 31.64 O ATOM 97 CB LYS A 19 18.311 -1.861 2.111 1.00 31.08 C ATOM 98 HN3 LYS A 19 17.459 -2.718 -0.259 1.00 0.00 H ATOM 99 HN2 LYS A 19 16.207 -3.730 0.284 1.00 0.00 H ATOM 100 HN1 LYS A 19 17.816 -4.061 0.718 1.00 0.00 H ATOM 101 N GLN A 20 15.826 -0.985 0.215 1.00 31.10 N ATOM 102 CA GLN A 20 14.947 0.114 -0.172 1.00 30.84 C ATOM 103 C GLN A 20 13.556 -0.113 0.387 1.00 30.41 C ATOM 104 O GLN A 20 12.929 0.800 0.928 1.00 30.64 O ATOM 105 CB GLN A 20 14.873 0.214 -1.697 1.00 31.21 C ATOM 106 CG GLN A 20 16.229 0.355 -2.373 1.00 31.59 C ATOM 107 CD GLN A 20 16.217 -0.083 -3.830 1.00 31.75 C ATOM 108 OE1 GLN A 20 15.168 -0.416 -4.389 1.00 32.09 O ATOM 109 NE2 GLN A 20 17.390 -0.089 -4.452 1.00 31.83 N ATOM 110 HE22 GLN A 20 18.250 0.199 -3.943 1.00 0.00 H ATOM 111 HE21 GLN A 20 17.449 -0.382 -5.448 1.00 0.00 H ATOM 112 H GLN A 20 16.358 -1.486 -0.525 1.00 0.00 H ATOM 113 N LEU A 21 13.092 -1.349 0.242 1.00 29.90 N ATOM 114 CA LEU A 21 11.770 -1.751 0.677 1.00 29.38 C ATOM 115 C LEU A 21 11.541 -1.442 2.154 1.00 28.20 C ATOM 116 O LEU A 21 10.496 -0.907 2.504 1.00 28.07 O ATOM 117 CB LEU A 21 11.548 -3.244 0.406 1.00 29.74 C ATOM 118 H LEU A 21 13.706 -2.060 -0.204 1.00 0.00 H ATOM 119 N THR A 22 12.511 -1.768 3.009 1.00 27.25 N ATOM 120 CA THR A 22 12.339 -1.560 4.455 1.00 25.72 C ATOM 121 C THR A 22 12.087 -0.099 4.827 1.00 24.41 C ATOM 122 O THR A 22 11.215 0.193 5.644 1.00 23.89 O ATOM 123 CB THR A 22 13.510 -2.126 5.312 1.00 25.77 C ATOM 124 OG1 THR A 22 14.652 -1.257 5.236 1.00 26.11 O ATOM 125 CG2 THR A 22 13.878 -3.532 4.863 1.00 25.76 C ATOM 126 HG1 THR A 22 14.947 -1.184 4.294 1.00 0.00 H ATOM 127 H THR A 22 13.399 -2.174 2.650 1.00 0.00 H ATOM 128 N ALA A 23 12.834 0.817 4.217 1.00 23.78 N ATOM 129 CA ALA A 23 12.643 2.237 4.486 1.00 23.12 C ATOM 130 C ALA A 23 11.277 2.689 4.010 1.00 21.99 C ATOM 131 O ALA A 23 10.584 3.436 4.701 1.00 21.71 O ATOM 132 CB ALA A 23 13.722 3.063 3.815 1.00 23.61 C ATOM 133 H ALA A 23 13.564 0.516 3.540 1.00 0.00 H ATOM 134 N ILE A 24 10.905 2.233 2.820 1.00 21.33 N ATOM 135 CA ILE A 24 9.628 2.588 2.215 1.00 20.99 C ATOM 136 C ILE A 24 8.473 2.158 3.110 1.00 21.09 C ATOM 137 O ILE A 24 7.543 2.930 3.359 1.00 20.81 O ATOM 138 CB ILE A 24 9.472 1.947 0.817 1.00 21.10 C ATOM 139 CG1 ILE A 24 10.476 2.554 -0.168 1.00 21.55 C ATOM 140 CG2 ILE A 24 8.058 2.134 0.292 1.00 20.95 C ATOM 141 CD1 ILE A 24 10.627 1.757 -1.455 1.00 21.98 C ATOM 142 H ILE A 24 11.547 1.600 2.302 1.00 0.00 H ATOM 143 N ALA A 25 8.539 0.927 3.605 1.00 21.49 N ATOM 144 CA ALA A 25 7.491 0.406 4.470 1.00 21.68 C ATOM 145 C ALA A 25 7.411 1.200 5.765 1.00 21.94 C ATOM 146 O ALA A 25 6.316 1.546 6.218 1.00 22.08 O ATOM 147 CB ALA A 25 7.725 -1.067 4.761 1.00 21.99 C ATOM 148 H ALA A 25 9.354 0.325 3.370 1.00 0.00 H ATOM 149 N ALA A 26 8.571 1.503 6.344 1.00 21.90 N ATOM 150 CA ALA A 26 8.639 2.280 7.583 1.00 22.18 C ATOM 151 C ALA A 26 8.078 3.687 7.394 1.00 22.86 C ATOM 152 O ALA A 26 7.293 4.162 8.214 1.00 23.55 O ATOM 153 CB ALA A 26 10.068 2.335 8.104 1.00 22.11 C ATOM 154 H ALA A 26 9.455 1.178 5.903 1.00 0.00 H ATOM 155 N LEU A 27 8.469 4.347 6.308 1.00 22.92 N ATOM 156 CA LEU A 27 7.983 5.695 6.019 1.00 23.23 C ATOM 157 C LEU A 27 6.467 5.736 5.854 1.00 23.88 C ATOM 158 O LEU A 27 5.812 6.677 6.294 1.00 24.09 O ATOM 159 CB LEU A 27 8.654 6.249 4.762 1.00 22.78 C ATOM 160 CG LEU A 27 10.104 6.700 4.941 1.00 22.48 C ATOM 161 CD1 LEU A 27 10.793 6.830 3.597 1.00 22.32 C ATOM 162 CD2 LEU A 27 10.139 8.014 5.704 1.00 22.36 C ATOM 163 H LEU A 27 9.135 3.894 5.650 1.00 0.00 H ATOM 164 N ALA A 28 5.904 4.716 5.216 1.00 24.49 N ATOM 165 CA ALA A 28 4.464 4.705 4.972 1.00 25.50 C ATOM 166 C ALA A 28 3.651 4.548 6.260 1.00 26.98 C ATOM 167 O ALA A 28 2.502 4.982 6.327 1.00 26.99 O ATOM 168 CB ALA A 28 4.100 3.625 3.974 1.00 25.28 C ATOM 169 H ALA A 28 6.491 3.922 4.889 1.00 0.00 H ATOM 170 N GLU A 29 4.249 3.930 7.275 1.00 28.58 N ATOM 171 CA GLU A 29 3.578 3.728 8.556 1.00 30.50 C ATOM 172 C GLU A 29 3.805 4.890 9.516 1.00 31.12 C ATOM 173 O GLU A 29 3.402 4.831 10.679 1.00 31.28 O ATOM 174 CB GLU A 29 4.041 2.419 9.201 1.00 31.82 C ATOM 175 CG GLU A 29 3.586 1.178 8.455 1.00 33.27 C ATOM 176 CD GLU A 29 4.336 -0.070 8.881 1.00 34.66 C ATOM 177 OE1 GLU A 29 5.007 -0.032 9.935 1.00 35.25 O ATOM 178 OE2 GLU A 29 4.259 -1.086 8.154 1.00 35.33 O ATOM 179 H GLU A 29 5.221 3.581 7.153 1.00 0.00 H ATOM 180 N MET A 30 4.448 5.944 9.024 1.00 31.57 N ATOM 181 CA MET A 30 4.779 7.099 9.856 1.00 32.11 C ATOM 182 C MET A 30 4.000 8.355 9.475 1.00 31.88 C ATOM 183 O MET A 30 4.531 9.467 9.515 1.00 32.10 O ATOM 184 CB MET A 30 6.285 7.361 9.820 1.00 32.94 C ATOM 185 CG MET A 30 7.077 6.306 10.565 1.00 33.84 C ATOM 186 SD MET A 30 8.823 6.230 10.140 1.00 34.82 S ATOM 187 CE MET A 30 9.343 4.871 11.186 1.00 34.69 C ATOM 188 H MET A 30 4.723 5.947 8.021 1.00 0.00 H ATOM 189 N GLY A 31 2.742 8.168 9.097 1.00 31.40 N ATOM 190 CA GLY A 31 1.824 9.274 8.916 1.00 31.31 C ATOM 191 C GLY A 31 2.182 10.268 7.828 1.00 31.10 C ATOM 192 O GLY A 31 2.851 9.928 6.849 1.00 31.02 O ATOM 193 H GLY A 31 2.405 7.199 8.926 1.00 0.00 H ATOM 194 N GLU A 32 1.732 11.505 8.011 1.00 30.76 N ATOM 195 CA GLU A 32 1.867 12.533 6.988 1.00 30.57 C ATOM 196 C GLU A 32 3.321 12.841 6.636 1.00 29.00 C ATOM 197 O GLU A 32 3.650 13.047 5.468 1.00 28.83 O ATOM 198 CB GLU A 32 1.130 13.804 7.416 1.00 32.01 C ATOM 199 CG GLU A 32 -0.356 13.584 7.640 1.00 33.46 C ATOM 200 CD GLU A 32 -1.042 14.778 8.274 1.00 34.71 C ATOM 201 OE1 GLU A 32 -0.349 15.765 8.615 1.00 35.23 O ATOM 202 OE2 GLU A 32 -2.281 14.728 8.438 1.00 35.33 O ATOM 203 H GLU A 32 1.270 11.746 8.911 1.00 0.00 H ATOM 204 N GLY A 33 4.188 12.866 7.643 1.00 27.68 N ATOM 205 CA GLY A 33 5.594 13.146 7.422 1.00 26.30 C ATOM 206 C GLY A 33 6.252 12.095 6.550 1.00 24.92 C ATOM 207 O GLY A 33 6.911 12.414 5.561 1.00 24.93 O ATOM 208 H GLY A 33 3.851 12.681 8.609 1.00 0.00 H ATOM 209 N GLY A 34 6.071 10.833 6.919 1.00 23.86 N ATOM 210 CA GLY A 34 6.627 9.739 6.146 1.00 22.52 C ATOM 211 C GLY A 34 6.045 9.661 4.749 1.00 21.55 C ATOM 212 O GLY A 34 6.768 9.449 3.782 1.00 20.89 O ATOM 213 H GLY A 34 5.521 10.625 7.777 1.00 0.00 H ATOM 214 N GLN A 35 4.736 9.843 4.644 1.00 21.20 N ATOM 215 CA GLN A 35 4.060 9.796 3.354 1.00 21.46 C ATOM 216 C GLN A 35 4.467 10.960 2.455 1.00 20.52 C ATOM 217 O GLN A 35 4.561 10.811 1.232 1.00 20.08 O ATOM 218 CB GLN A 35 2.544 9.738 3.554 1.00 22.92 C ATOM 219 CG GLN A 35 2.099 8.410 4.163 1.00 24.11 C ATOM 220 CD GLN A 35 0.793 8.503 4.919 1.00 25.26 C ATOM 221 OE1 GLN A 35 0.095 9.518 4.861 1.00 26.04 O ATOM 222 NE2 GLN A 35 0.463 7.443 5.656 1.00 25.64 N ATOM 223 HE22 GLN A 35 1.083 6.609 5.674 1.00 0.00 H ATOM 224 HE21 GLN A 35 -0.415 7.450 6.213 1.00 0.00 H ATOM 225 H GLN A 35 4.178 10.024 5.503 1.00 0.00 H ATOM 226 N GLY A 36 4.732 12.113 3.067 1.00 20.25 N ATOM 227 CA GLY A 36 5.226 13.264 2.332 1.00 19.90 C ATOM 228 C GLY A 36 6.570 12.985 1.692 1.00 20.00 C ATOM 229 O GLY A 36 6.827 13.373 0.556 1.00 19.94 O ATOM 230 H GLY A 36 4.582 12.191 4.093 1.00 0.00 H ATOM 231 N ILE A 37 7.434 12.303 2.430 1.00 19.88 N ATOM 232 CA ILE A 37 8.749 11.947 1.923 1.00 19.84 C ATOM 233 C ILE A 37 8.630 11.006 0.726 1.00 19.02 C ATOM 234 O ILE A 37 9.344 11.153 -0.274 1.00 18.92 O ATOM 235 CB ILE A 37 9.598 11.337 3.045 1.00 20.49 C ATOM 236 CG1 ILE A 37 10.054 12.457 3.989 1.00 21.22 C ATOM 237 CG2 ILE A 37 10.799 10.590 2.487 1.00 20.66 C ATOM 238 CD1 ILE A 37 10.439 11.988 5.358 1.00 21.69 C ATOM 239 H ILE A 37 7.165 12.016 3.393 1.00 0.00 H ATOM 240 N LEU A 38 7.699 10.061 0.819 1.00 18.23 N ATOM 241 CA LEU A 38 7.464 9.116 -0.269 1.00 17.57 C ATOM 242 C LEU A 38 6.934 9.828 -1.511 1.00 17.15 C ATOM 243 O LEU A 38 7.362 9.543 -2.635 1.00 16.88 O ATOM 244 CB LEU A 38 6.494 8.024 0.176 1.00 17.34 C ATOM 245 CG LEU A 38 7.041 7.105 1.271 1.00 17.42 C ATOM 246 CD1 LEU A 38 5.972 6.113 1.707 1.00 17.69 C ATOM 247 CD2 LEU A 38 8.301 6.385 0.794 1.00 17.68 C ATOM 248 H LEU A 38 7.126 9.994 1.685 1.00 0.00 H ATOM 249 N LEU A 39 6.013 10.763 -1.302 1.00 17.19 N ATOM 250 CA LEU A 39 5.443 11.523 -2.412 1.00 17.74 C ATOM 251 C LEU A 39 6.513 12.372 -3.102 1.00 18.35 C ATOM 252 O LEU A 39 6.553 12.473 -4.336 1.00 17.96 O ATOM 253 CB LEU A 39 4.269 12.379 -1.934 1.00 17.88 C ATOM 254 CG LEU A 39 2.976 11.621 -1.610 1.00 18.12 C ATOM 255 CD1 LEU A 39 2.032 12.480 -0.768 1.00 18.35 C ATOM 256 CD2 LEU A 39 2.289 11.168 -2.896 1.00 17.95 C ATOM 257 H LEU A 39 5.693 10.957 -0.332 1.00 0.00 H ATOM 258 N ASP A 40 7.393 12.971 -2.313 1.00 19.30 N ATOM 259 CA ASP A 40 8.468 13.761 -2.889 1.00 20.00 C ATOM 260 C ASP A 40 9.422 12.893 -3.698 1.00 19.91 C ATOM 261 O ASP A 40 9.932 13.321 -4.729 1.00 20.24 O ATOM 262 CB ASP A 40 9.245 14.515 -1.818 1.00 20.95 C ATOM 263 CG ASP A 40 10.450 15.227 -2.389 1.00 21.74 C ATOM 264 OD1 ASP A 40 10.265 16.288 -3.017 1.00 21.96 O ATOM 265 OD2 ASP A 40 11.576 14.713 -2.232 1.00 22.31 O ATOM 266 H ASP A 40 7.314 12.876 -1.280 1.00 0.00 H ATOM 267 N TYR A 41 9.651 11.671 -3.231 1.00 19.58 N ATOM 268 CA TYR A 41 10.486 10.719 -3.953 1.00 19.84 C ATOM 269 C TYR A 41 9.912 10.430 -5.343 1.00 19.54 C ATOM 270 O TYR A 41 10.648 10.411 -6.331 1.00 19.76 O ATOM 271 CB TYR A 41 10.657 9.430 -3.138 1.00 20.64 C ATOM 272 CG TYR A 41 11.468 8.363 -3.828 1.00 21.50 C ATOM 273 CD1 TYR A 41 12.858 8.358 -3.765 1.00 22.17 C ATOM 274 CD2 TYR A 41 10.841 7.352 -4.536 1.00 21.98 C ATOM 275 CE1 TYR A 41 13.598 7.371 -4.403 1.00 22.56 C ATOM 276 CE2 TYR A 41 11.563 6.369 -5.173 1.00 22.70 C ATOM 277 CZ TYR A 41 12.940 6.380 -5.105 1.00 23.27 C ATOM 278 OH TYR A 41 13.643 5.392 -5.755 1.00 24.39 O ATOM 279 HH TYR A 41 14.613 5.533 -5.616 1.00 0.00 H ATOM 280 H TYR A 41 9.224 11.386 -2.327 1.00 0.00 H ATOM 281 N LEU A 42 8.602 10.204 -5.421 1.00 18.91 N ATOM 282 CA LEU A 42 7.963 9.974 -6.716 1.00 18.94 C ATOM 283 C LEU A 42 8.119 11.181 -7.611 1.00 19.57 C ATOM 284 O LEU A 42 8.426 11.046 -8.791 1.00 19.75 O ATOM 285 CB LEU A 42 6.475 9.681 -6.561 1.00 18.50 C ATOM 286 CG LEU A 42 6.078 8.348 -5.947 1.00 18.20 C ATOM 287 CD1 LEU A 42 4.563 8.234 -5.936 1.00 17.87 C ATOM 288 CD2 LEU A 42 6.701 7.190 -6.723 1.00 17.68 C ATOM 289 H LEU A 42 8.028 10.191 -4.554 1.00 0.00 H ATOM 290 N ALA A 43 7.892 12.366 -7.045 1.00 19.92 N ATOM 291 CA ALA A 43 7.969 13.591 -7.826 1.00 20.74 C ATOM 292 C ALA A 43 9.344 13.747 -8.458 1.00 21.91 C ATOM 293 O ALA A 43 9.470 14.280 -9.564 1.00 22.51 O ATOM 294 CB ALA A 43 7.634 14.800 -6.963 1.00 20.36 C ATOM 295 H ALA A 43 7.657 12.416 -6.033 1.00 0.00 H ATOM 296 N LYS A 44 10.371 13.255 -7.770 1.00 22.34 N ATOM 297 CA LYS A 44 11.737 13.361 -8.272 1.00 23.26 C ATOM 298 C LYS A 44 12.143 12.243 -9.231 1.00 22.78 C ATOM 299 O LYS A 44 13.188 12.334 -9.876 1.00 23.06 O ATOM 300 CB LYS A 44 12.739 13.432 -7.113 1.00 24.81 C ATOM 301 CG LYS A 44 12.613 14.683 -6.250 1.00 26.25 C ATOM 302 CD LYS A 44 13.879 14.931 -5.442 1.00 27.71 C ATOM 303 CE LYS A 44 14.185 13.786 -4.494 1.00 28.93 C ATOM 304 NZ LYS A 44 13.444 13.910 -3.206 1.00 29.77 N ATOM 305 HZ1 LYS A 44 13.712 14.799 -2.738 1.00 0.00 H ATOM 306 HZ2 LYS A 44 12.421 13.910 -3.395 1.00 0.00 H ATOM 307 HZ3 LYS A 44 13.684 13.107 -2.591 1.00 0.00 H ATOM 308 H LYS A 44 10.197 12.786 -6.858 1.00 0.00 H ATOM 309 N ASN A 45 11.324 11.200 -9.348 1.00 22.22 N ATOM 310 CA ASN A 45 11.727 10.020 -10.115 1.00 21.93 C ATOM 311 C ASN A 45 10.738 9.531 -11.174 1.00 21.31 C ATOM 312 O ASN A 45 11.009 8.544 -11.862 1.00 21.69 O ATOM 313 CB ASN A 45 12.072 8.867 -9.167 1.00 22.36 C ATOM 314 CG ASN A 45 13.358 9.114 -8.398 1.00 22.93 C ATOM 315 OD1 ASN A 45 14.450 8.899 -8.924 1.00 23.53 O ATOM 316 ND2 ASN A 45 13.237 9.577 -7.155 1.00 22.61 N ATOM 317 HD22 ASN A 45 12.293 9.744 -6.752 1.00 0.00 H ATOM 318 HD21 ASN A 45 14.087 9.772 -6.588 1.00 0.00 H ATOM 319 H ASN A 45 10.390 11.224 -8.891 1.00 0.00 H ATOM 320 N VAL A 46 9.603 10.212 -11.304 1.00 20.34 N ATOM 321 CA VAL A 46 8.552 9.826 -12.250 1.00 19.67 C ATOM 322 C VAL A 46 8.369 10.950 -13.263 1.00 19.48 C ATOM 323 O VAL A 46 8.417 12.117 -12.877 1.00 20.30 O ATOM 324 CB VAL A 46 7.219 9.563 -11.503 1.00 19.38 C ATOM 325 CG1 VAL A 46 6.062 9.280 -12.471 1.00 19.35 C ATOM 326 CG2 VAL A 46 7.384 8.414 -10.535 1.00 19.23 C ATOM 327 H VAL A 46 9.455 11.053 -10.710 1.00 0.00 H ATOM 328 N PRO A 47 8.175 10.619 -14.560 1.00 18.55 N ATOM 329 CA PRO A 47 8.125 9.274 -15.150 1.00 17.73 C ATOM 330 C PRO A 47 9.471 8.582 -15.153 1.00 17.12 C ATOM 331 O PRO A 47 10.513 9.214 -15.314 1.00 16.93 O ATOM 332 CB PRO A 47 7.659 9.528 -16.594 1.00 18.00 C ATOM 333 CG PRO A 47 8.024 10.929 -16.861 1.00 18.77 C ATOM 334 CD PRO A 47 7.892 11.660 -15.566 1.00 18.81 C ATOM 335 N LEU A 48 9.432 7.273 -14.950 1.00 16.53 N ATOM 336 CA LEU A 48 10.627 6.457 -15.050 1.00 16.71 C ATOM 337 C LEU A 48 11.131 6.437 -16.482 1.00 17.62 C ATOM 338 O LEU A 48 10.351 6.529 -17.432 1.00 18.17 O ATOM 339 CB LEU A 48 10.315 5.029 -14.620 1.00 16.38 C ATOM 340 CG LEU A 48 10.074 4.795 -13.134 1.00 16.31 C ATOM 341 CD1 LEU A 48 9.530 3.388 -12.905 1.00 16.41 C ATOM 342 CD2 LEU A 48 11.362 5.028 -12.356 1.00 16.37 C ATOM 343 H LEU A 48 8.525 6.821 -14.714 1.00 0.00 H ATOM 344 N GLU A 49 12.441 6.320 -16.636 1.00 18.35 N ATOM 345 CA GLU A 49 12.995 5.931 -17.916 1.00 19.85 C ATOM 346 C GLU A 49 13.177 4.419 -17.838 1.00 20.76 C ATOM 347 O GLU A 49 12.394 3.657 -18.417 1.00 21.92 O ATOM 348 CB GLU A 49 14.299 6.678 -18.196 1.00 20.85 C ATOM 349 CG GLU A 49 14.066 8.142 -18.551 1.00 21.26 C ATOM 350 CD GLU A 49 15.198 9.053 -18.121 1.00 21.56 C ATOM 351 OE1 GLU A 49 16.153 8.568 -17.479 1.00 21.60 O ATOM 352 OE2 GLU A 49 15.125 10.262 -18.423 1.00 21.77 O ATOM 353 H GLU A 49 13.075 6.508 -15.834 1.00 0.00 H ATOM 354 N LYS A 50 14.160 3.976 -17.067 1.00 20.48 N ATOM 355 CA LYS A 50 14.320 2.550 -16.819 1.00 20.20 C ATOM 356 C LYS A 50 13.421 2.138 -15.666 1.00 18.09 C ATOM 357 O LYS A 50 13.138 2.939 -14.783 1.00 18.55 O ATOM 358 CB LYS A 50 15.780 2.224 -16.493 1.00 22.33 C ATOM 359 CG LYS A 50 16.705 2.250 -17.708 1.00 24.64 C ATOM 360 CD LYS A 50 17.950 1.393 -17.474 1.00 26.13 C ATOM 361 CE LYS A 50 18.965 2.086 -16.571 1.00 27.26 C ATOM 362 NZ LYS A 50 19.712 3.171 -17.285 1.00 28.02 N ATOM 363 HZ1 LYS A 50 20.224 2.764 -18.093 1.00 0.00 H ATOM 364 HZ2 LYS A 50 19.039 3.888 -17.625 1.00 0.00 H ATOM 365 HZ3 LYS A 50 20.390 3.612 -16.631 1.00 0.00 H ATOM 366 H LYS A 50 14.822 4.652 -16.636 1.00 0.00 H ATOM 367 N PRO A 51 12.954 0.886 -15.672 1.00 16.31 N ATOM 368 CA PRO A 51 12.221 0.397 -14.498 1.00 15.44 C ATOM 369 C PRO A 51 13.117 0.406 -13.260 1.00 14.97 C ATOM 370 O PRO A 51 14.223 -0.126 -13.306 1.00 15.87 O ATOM 371 CB PRO A 51 11.871 -1.045 -14.888 1.00 15.54 C ATOM 372 CG PRO A 51 11.904 -1.049 -16.393 1.00 15.77 C ATOM 373 CD PRO A 51 13.020 -0.118 -16.747 1.00 15.90 C ATOM 374 N VAL A 52 12.643 1.020 -12.179 1.00 14.34 N ATOM 375 CA VAL A 52 13.361 1.060 -10.907 1.00 14.03 C ATOM 376 C VAL A 52 12.404 0.546 -9.841 1.00 13.96 C ATOM 377 O VAL A 52 11.349 1.151 -9.601 1.00 13.75 O ATOM 378 CB VAL A 52 13.827 2.492 -10.547 1.00 14.48 C ATOM 379 CG1 VAL A 52 14.503 2.515 -9.183 1.00 14.46 C ATOM 380 CG2 VAL A 52 14.766 3.045 -11.624 1.00 14.84 C ATOM 381 H VAL A 52 11.719 1.493 -12.242 1.00 0.00 H ATOM 382 N LEU A 53 12.747 -0.587 -9.230 1.00 13.94 N ATOM 383 CA LEU A 53 11.795 -1.265 -8.354 1.00 14.62 C ATOM 384 C LEU A 53 11.365 -0.404 -7.173 1.00 14.42 C ATOM 385 O LEU A 53 10.187 -0.411 -6.803 1.00 14.42 O ATOM 386 CB LEU A 53 12.323 -2.614 -7.873 1.00 15.54 C ATOM 387 CG LEU A 53 11.262 -3.509 -7.225 1.00 16.52 C ATOM 388 CD1 LEU A 53 10.052 -3.691 -8.140 1.00 16.96 C ATOM 389 CD2 LEU A 53 11.863 -4.851 -6.852 1.00 17.33 C ATOM 390 H LEU A 53 13.695 -0.990 -9.377 1.00 0.00 H ATOM 391 N ALA A 54 12.308 0.341 -6.595 1.00 14.67 N ATOM 392 CA ALA A 54 11.981 1.224 -5.480 1.00 14.89 C ATOM 393 C ALA A 54 10.857 2.189 -5.822 1.00 15.11 C ATOM 394 O ALA A 54 10.001 2.462 -4.988 1.00 15.57 O ATOM 395 CB ALA A 54 13.215 1.990 -4.993 1.00 15.37 C ATOM 396 H ALA A 54 13.287 0.292 -6.943 1.00 0.00 H ATOM 397 N VAL A 55 10.859 2.710 -7.043 1.00 14.60 N ATOM 398 CA VAL A 55 9.834 3.661 -7.445 1.00 14.47 C ATOM 399 C VAL A 55 8.481 2.964 -7.563 1.00 13.30 C ATOM 400 O VAL A 55 7.454 3.507 -7.135 1.00 12.66 O ATOM 401 CB VAL A 55 10.227 4.401 -8.743 1.00 15.29 C ATOM 402 CG1 VAL A 55 9.114 5.331 -9.205 1.00 15.63 C ATOM 403 CG2 VAL A 55 11.518 5.188 -8.515 1.00 16.08 C ATOM 404 H VAL A 55 11.600 2.436 -7.719 1.00 0.00 H ATOM 405 N GLY A 56 8.476 1.757 -8.132 1.00 12.69 N ATOM 406 CA GLY A 56 7.268 0.955 -8.148 1.00 12.08 C ATOM 407 C GLY A 56 6.760 0.693 -6.741 1.00 12.13 C ATOM 408 O GLY A 56 5.567 0.814 -6.466 1.00 11.91 O ATOM 409 H GLY A 56 9.346 1.388 -8.568 1.00 0.00 H ATOM 410 N ASN A 57 7.666 0.316 -5.851 1.00 12.87 N ATOM 411 CA ASN A 57 7.289 0.047 -4.467 1.00 13.75 C ATOM 412 C ASN A 57 6.773 1.275 -3.703 1.00 13.77 C ATOM 413 O ASN A 57 5.836 1.171 -2.921 1.00 13.38 O ATOM 414 CB ASN A 57 8.437 -0.641 -3.718 1.00 15.21 C ATOM 415 CG ASN A 57 8.568 -2.105 -4.087 1.00 17.31 C ATOM 416 OD1 ASN A 57 7.579 -2.754 -4.434 1.00 18.52 O ATOM 417 ND2 ASN A 57 9.784 -2.639 -4.006 1.00 18.27 N ATOM 418 HD22 ASN A 57 10.590 -2.053 -3.708 1.00 0.00 H ATOM 419 HD21 ASN A 57 9.928 -3.642 -4.240 1.00 0.00 H ATOM 420 H ASN A 57 8.659 0.210 -6.142 1.00 0.00 H ATOM 421 N VAL A 58 7.356 2.442 -3.940 1.00 13.81 N ATOM 422 CA VAL A 58 6.831 3.647 -3.311 1.00 13.87 C ATOM 423 C VAL A 58 5.400 3.930 -3.787 1.00 13.54 C ATOM 424 O VAL A 58 4.490 4.133 -2.980 1.00 13.60 O ATOM 425 CB VAL A 58 7.724 4.869 -3.567 1.00 14.25 C ATOM 426 CG1 VAL A 58 7.032 6.146 -3.082 1.00 14.79 C ATOM 427 CG2 VAL A 58 9.059 4.705 -2.859 1.00 14.65 C ATOM 428 H VAL A 58 8.182 2.497 -4.570 1.00 0.00 H ATOM 429 N TYR A 59 5.195 3.934 -5.103 1.00 13.39 N ATOM 430 CA TYR A 59 3.864 4.167 -5.646 1.00 13.18 C ATOM 431 C TYR A 59 2.852 3.160 -5.108 1.00 13.06 C ATOM 432 O TYR A 59 1.781 3.535 -4.639 1.00 13.22 O ATOM 433 CB TYR A 59 3.899 4.112 -7.182 1.00 13.06 C ATOM 434 CG TYR A 59 2.541 4.237 -7.851 1.00 13.08 C ATOM 435 CD1 TYR A 59 1.771 3.113 -8.114 1.00 13.54 C ATOM 436 CD2 TYR A 59 2.036 5.475 -8.225 1.00 13.19 C ATOM 437 CE1 TYR A 59 0.534 3.218 -8.715 1.00 13.99 C ATOM 438 CE2 TYR A 59 0.797 5.596 -8.829 1.00 13.82 C ATOM 439 CZ TYR A 59 0.055 4.462 -9.077 1.00 13.87 C ATOM 440 OH TYR A 59 -1.172 4.565 -9.679 1.00 14.42 O ATOM 441 HH TYR A 59 -1.067 4.983 -10.570 1.00 0.00 H ATOM 442 H TYR A 59 5.993 3.769 -5.749 1.00 0.00 H ATOM 443 N GLN A 60 3.190 1.877 -5.177 1.00 13.26 N ATOM 444 CA GLN A 60 2.231 0.850 -4.801 1.00 13.41 C ATOM 445 C GLN A 60 1.955 0.830 -3.300 1.00 13.99 C ATOM 446 O GLN A 60 0.810 0.635 -2.879 1.00 13.96 O ATOM 447 CB GLN A 60 2.677 -0.527 -5.304 1.00 12.74 C ATOM 448 CG GLN A 60 1.534 -1.503 -5.365 1.00 12.36 C ATOM 449 CD GLN A 60 0.395 -0.972 -6.195 1.00 12.73 C ATOM 450 OE1 GLN A 60 0.578 -0.630 -7.364 1.00 12.85 O ATOM 451 NE2 GLN A 60 -0.786 -0.876 -5.592 1.00 11.96 N ATOM 452 HE22 GLN A 60 -0.891 -1.178 -4.602 1.00 0.00 H ATOM 453 HE21 GLN A 60 -1.605 -0.499 -6.110 1.00 0.00 H ATOM 454 H GLN A 60 4.141 1.607 -5.500 1.00 0.00 H ATOM 455 N THR A 61 2.995 1.054 -2.500 1.00 14.68 N ATOM 456 CA THR A 61 2.831 1.158 -1.050 1.00 15.36 C ATOM 457 C THR A 61 1.866 2.281 -0.694 1.00 15.66 C ATOM 458 O THR A 61 1.003 2.119 0.179 1.00 15.63 O ATOM 459 CB THR A 61 4.175 1.365 -0.345 1.00 15.57 C ATOM 460 OG1 THR A 61 4.995 0.207 -0.550 1.00 15.85 O ATOM 461 CG2 THR A 61 3.964 1.582 1.159 1.00 15.75 C ATOM 462 HG1 THR A 61 5.144 0.077 -1.520 1.00 0.00 H ATOM 463 H THR A 61 3.943 1.157 -2.914 1.00 0.00 H ATOM 464 N LEU A 62 1.995 3.416 -1.377 1.00 15.71 N ATOM 465 CA LEU A 62 1.080 4.534 -1.144 1.00 15.68 C ATOM 466 C LEU A 62 -0.331 4.196 -1.611 1.00 16.10 C ATOM 467 O LEU A 62 -1.301 4.486 -0.909 1.00 16.88 O ATOM 468 CB LEU A 62 1.570 5.811 -1.826 1.00 15.71 C ATOM 469 CG LEU A 62 2.787 6.502 -1.206 1.00 15.94 C ATOM 470 CD1 LEU A 62 3.353 7.529 -2.179 1.00 16.17 C ATOM 471 CD2 LEU A 62 2.444 7.153 0.150 1.00 16.08 C ATOM 472 H LEU A 62 2.753 3.509 -2.083 1.00 0.00 H ATOM 473 N ARG A 63 -0.456 3.566 -2.782 1.00 16.04 N ATOM 474 CA ARG A 63 -1.776 3.143 -3.257 1.00 16.51 C ATOM 475 C ARG A 63 -2.428 2.200 -2.254 1.00 17.67 C ATOM 476 O ARG A 63 -3.635 2.282 -2.004 1.00 17.90 O ATOM 477 CB ARG A 63 -1.686 2.444 -4.623 1.00 16.42 C ATOM 478 CG ARG A 63 -1.488 3.364 -5.838 1.00 16.70 C ATOM 479 CD ARG A 63 -2.698 4.276 -6.109 1.00 16.84 C ATOM 480 NE ARG A 63 -3.950 3.554 -6.365 1.00 16.92 N ATOM 481 CZ ARG A 63 -4.336 3.091 -7.558 1.00 16.52 C ATOM 482 NH1 ARG A 63 -3.577 3.262 -8.633 1.00 16.18 N ATOM 483 NH2 ARG A 63 -5.494 2.457 -7.677 1.00 16.22 N ATOM 484 HE ARG A 63 -4.585 3.390 -5.557 1.00 0.00 H ATOM 485 HH12 ARG A 63 -3.891 2.896 -9.555 1.00 0.00 H ATOM 486 HH11 ARG A 63 -2.668 3.762 -8.554 1.00 0.00 H ATOM 487 HH22 ARG A 63 -5.796 2.096 -8.604 1.00 0.00 H ATOM 488 HH21 ARG A 63 -6.100 2.321 -6.843 1.00 0.00 H ATOM 489 H ARG A 63 0.388 3.375 -3.359 1.00 0.00 H ATOM 490 N ASN A 64 -1.625 1.312 -1.678 1.00 18.58 N ATOM 491 CA ASN A 64 -2.146 0.278 -0.788 1.00 20.11 C ATOM 492 C ASN A 64 -2.682 0.813 0.538 1.00 22.21 C ATOM 493 O ASN A 64 -3.437 0.130 1.229 1.00 22.88 O ATOM 494 CB ASN A 64 -1.091 -0.800 -0.529 1.00 19.69 C ATOM 495 CG ASN A 64 -0.804 -1.650 -1.753 1.00 19.54 C ATOM 496 OD1 ASN A 64 -1.512 -1.582 -2.755 1.00 19.14 O ATOM 497 ND2 ASN A 64 0.232 -2.468 -1.667 1.00 19.53 N ATOM 498 HD22 ASN A 64 0.804 -2.493 -0.799 1.00 0.00 H ATOM 499 HD21 ASN A 64 0.474 -3.086 -2.467 1.00 0.00 H ATOM 500 H ASN A 64 -0.603 1.354 -1.865 1.00 0.00 H ATOM 501 N LEU A 65 -2.292 2.033 0.889 1.00 23.34 N ATOM 502 CA LEU A 65 -2.799 2.677 2.095 1.00 24.85 C ATOM 503 C LEU A 65 -4.303 2.869 2.002 1.00 26.31 C ATOM 504 O LEU A 65 -4.985 2.957 3.025 1.00 26.51 O ATOM 505 CB LEU A 65 -2.132 4.035 2.307 1.00 24.72 C ATOM 506 CG LEU A 65 -0.678 4.012 2.768 1.00 25.08 C ATOM 507 CD1 LEU A 65 -0.103 5.419 2.752 1.00 25.31 C ATOM 508 CD2 LEU A 65 -0.559 3.396 4.155 1.00 25.28 C ATOM 509 H LEU A 65 -1.610 2.540 0.290 1.00 0.00 H ATOM 510 N GLU A 66 -4.805 2.952 0.773 1.00 27.54 N ATOM 511 CA GLU A 66 -6.228 3.145 0.522 1.00 29.12 C ATOM 512 C GLU A 66 -6.773 4.345 1.300 1.00 29.65 C ATOM 513 O GLU A 66 -7.677 4.213 2.131 1.00 30.07 O ATOM 514 CB GLU A 66 -7.004 1.870 0.856 1.00 30.05 C ATOM 515 CG GLU A 66 -6.473 0.641 0.136 1.00 31.24 C ATOM 516 CD GLU A 66 -7.290 -0.600 0.421 1.00 32.42 C ATOM 517 OE1 GLU A 66 -7.197 -1.134 1.551 1.00 33.16 O ATOM 518 OE2 GLU A 66 -8.023 -1.046 -0.486 1.00 32.60 O ATOM 519 H GLU A 66 -4.159 2.876 -0.038 1.00 0.00 H ATOM 520 N GLN A 67 -6.186 5.509 1.039 1.00 29.75 N ATOM 521 CA GLN A 67 -6.640 6.771 1.617 1.00 30.06 C ATOM 522 C GLN A 67 -6.983 7.743 0.497 1.00 29.53 C ATOM 523 O GLN A 67 -6.166 7.967 -0.397 1.00 29.04 O ATOM 524 CB GLN A 67 -5.550 7.371 2.501 1.00 30.88 C ATOM 525 CG GLN A 67 -5.076 6.450 3.612 1.00 31.72 C ATOM 526 CD GLN A 67 -4.056 7.112 4.514 1.00 32.54 C ATOM 527 OE1 GLN A 67 -3.812 8.318 4.416 1.00 33.20 O ATOM 528 NE2 GLN A 67 -3.458 6.330 5.407 1.00 32.55 N ATOM 529 HE22 GLN A 67 -3.695 5.318 5.454 1.00 0.00 H ATOM 530 HE21 GLN A 67 -2.753 6.730 6.059 1.00 0.00 H ATOM 531 H GLN A 67 -5.369 5.521 0.396 1.00 0.00 H ATOM 532 N GLU A 68 -8.189 8.310 0.550 1.00 29.22 N ATOM 533 CA GLU A 68 -8.690 9.205 -0.497 1.00 29.22 C ATOM 534 C GLU A 68 -7.679 10.242 -0.979 1.00 27.93 C ATOM 535 O GLU A 68 -7.430 10.359 -2.171 1.00 27.76 O ATOM 536 CB GLU A 68 -9.970 9.925 -0.047 1.00 30.52 C ATOM 537 CG GLU A 68 -10.494 10.946 -1.068 1.00 31.78 C ATOM 538 CD GLU A 68 -11.444 11.985 -0.474 1.00 32.91 C ATOM 539 OE1 GLU A 68 -11.913 12.860 -1.237 1.00 33.39 O ATOM 540 OE2 GLU A 68 -11.720 11.949 0.747 1.00 33.29 O ATOM 541 H GLU A 68 -8.799 8.109 1.368 1.00 0.00 H ATOM 542 N THR A 69 -7.102 10.998 -0.054 1.00 27.04 N ATOM 543 CA THR A 69 -6.263 12.125 -0.446 1.00 26.37 C ATOM 544 C THR A 69 -4.991 11.667 -1.156 1.00 25.55 C ATOM 545 O THR A 69 -4.599 12.245 -2.176 1.00 26.15 O ATOM 546 CB THR A 69 -5.939 13.032 0.757 1.00 26.62 C ATOM 547 OG1 THR A 69 -7.156 13.605 1.251 1.00 27.14 O ATOM 548 CG2 THR A 69 -4.994 14.152 0.353 1.00 26.55 C ATOM 549 HG1 THR A 69 -7.769 12.881 1.534 1.00 0.00 H ATOM 550 H THR A 69 -7.248 10.786 0.954 1.00 0.00 H ATOM 551 N ILE A 70 -4.373 10.609 -0.638 1.00 24.19 N ATOM 552 CA ILE A 70 -3.184 10.038 -1.265 1.00 23.13 C ATOM 553 C ILE A 70 -3.527 9.479 -2.641 1.00 21.83 C ATOM 554 O ILE A 70 -2.854 9.776 -3.627 1.00 21.24 O ATOM 555 CB ILE A 70 -2.555 8.923 -0.394 1.00 23.67 C ATOM 556 CG1 ILE A 70 -2.054 9.507 0.932 1.00 24.58 C ATOM 557 CG2 ILE A 70 -1.416 8.228 -1.130 1.00 23.61 C ATOM 558 CD1 ILE A 70 -0.979 10.544 0.768 1.00 25.23 C ATOM 559 H ILE A 70 -4.745 10.179 0.233 1.00 0.00 H ATOM 560 N THR A 71 -4.587 8.685 -2.702 1.00 21.14 N ATOM 561 CA THR A 71 -5.007 8.087 -3.966 1.00 21.30 C ATOM 562 C THR A 71 -5.374 9.152 -4.997 1.00 21.41 C ATOM 563 O THR A 71 -4.986 9.055 -6.165 1.00 21.53 O ATOM 564 CB THR A 71 -6.182 7.119 -3.755 1.00 21.42 C ATOM 565 OG1 THR A 71 -5.764 6.080 -2.865 1.00 21.74 O ATOM 566 CG2 THR A 71 -6.608 6.489 -5.078 1.00 21.16 C ATOM 567 HG1 THR A 71 -5.495 6.477 -1.999 1.00 0.00 H ATOM 568 H THR A 71 -5.128 8.485 -1.836 1.00 0.00 H ATOM 569 N THR A 72 -6.100 10.180 -4.554 1.00 21.61 N ATOM 570 CA THR A 72 -6.477 11.283 -5.435 1.00 22.11 C ATOM 571 C THR A 72 -5.255 12.044 -5.948 1.00 21.62 C ATOM 572 O THR A 72 -5.179 12.382 -7.133 1.00 21.31 O ATOM 573 CB THR A 72 -7.472 12.246 -4.744 1.00 22.94 C ATOM 574 OG1 THR A 72 -8.704 11.553 -4.521 1.00 23.82 O ATOM 575 CG2 THR A 72 -7.739 13.472 -5.606 1.00 23.42 C ATOM 576 HG1 THR A 72 -8.539 10.767 -3.942 1.00 0.00 H ATOM 577 H THR A 72 -6.404 10.197 -3.560 1.00 0.00 H ATOM 578 N GLN A 73 -4.293 12.293 -5.064 1.00 21.60 N ATOM 579 CA GLN A 73 -3.078 12.989 -5.468 1.00 21.64 C ATOM 580 C GLN A 73 -2.276 12.165 -6.467 1.00 20.53 C ATOM 581 O GLN A 73 -1.734 12.705 -7.425 1.00 20.60 O ATOM 582 CB GLN A 73 -2.204 13.340 -4.263 1.00 22.94 C ATOM 583 CG GLN A 73 -0.958 14.132 -4.645 1.00 24.73 C ATOM 584 CD GLN A 73 -0.182 14.636 -3.446 1.00 26.11 C ATOM 585 OE1 GLN A 73 -0.724 14.777 -2.343 1.00 27.12 O ATOM 586 NE2 GLN A 73 1.099 14.916 -3.654 1.00 26.26 N ATOM 587 HE22 GLN A 73 1.514 14.782 -4.598 1.00 0.00 H ATOM 588 HE21 GLN A 73 1.688 15.269 -2.873 1.00 0.00 H ATOM 589 H GLN A 73 -4.409 11.989 -4.076 1.00 0.00 H ATOM 590 N LEU A 74 -2.197 10.862 -6.233 1.00 19.51 N ATOM 591 CA LEU A 74 -1.490 9.976 -7.150 1.00 19.00 C ATOM 592 C LEU A 74 -2.152 9.955 -8.526 1.00 18.61 C ATOM 593 O LEU A 74 -1.471 9.946 -9.544 1.00 18.10 O ATOM 594 CB LEU A 74 -1.407 8.555 -6.582 1.00 18.91 C ATOM 595 CG LEU A 74 -0.498 8.352 -5.366 1.00 18.76 C ATOM 596 CD1 LEU A 74 -0.565 6.912 -4.862 1.00 18.90 C ATOM 597 CD2 LEU A 74 0.937 8.740 -5.693 1.00 18.96 C ATOM 598 H LEU A 74 -2.646 10.466 -5.383 1.00 0.00 H ATOM 599 N GLN A 75 -3.482 9.950 -8.555 1.00 19.29 N ATOM 600 CA GLN A 75 -4.203 9.904 -9.821 1.00 20.45 C ATOM 601 C GLN A 75 -4.041 11.215 -10.576 1.00 21.30 C ATOM 602 O GLN A 75 -3.977 11.232 -11.802 1.00 21.57 O ATOM 603 CB GLN A 75 -5.691 9.618 -9.592 1.00 20.62 C ATOM 604 H GLN A 75 -4.015 9.979 -7.662 1.00 0.00 H ATOM 605 N ARG A 76 -3.981 12.307 -9.822 1.00 21.91 N ATOM 606 CA ARG A 76 -3.837 13.639 -10.393 1.00 22.22 C ATOM 607 C ARG A 76 -2.436 13.859 -10.957 1.00 22.22 C ATOM 608 O ARG A 76 -2.278 14.343 -12.080 1.00 22.58 O ATOM 609 CB ARG A 76 -4.133 14.696 -9.329 1.00 22.65 C ATOM 610 CG ARG A 76 -4.988 15.839 -9.816 1.00 22.95 C ATOM 611 CD ARG A 76 -5.014 16.968 -8.802 1.00 23.19 C ATOM 612 NE ARG A 76 -5.378 16.510 -7.463 1.00 23.36 N ATOM 613 CZ ARG A 76 -4.552 16.517 -6.422 1.00 23.47 C ATOM 614 NH1 ARG A 76 -3.312 16.968 -6.561 1.00 23.53 N ATOM 615 NH2 ARG A 76 -4.966 16.083 -5.239 1.00 23.48 N ATOM 616 HE ARG A 76 -6.345 16.156 -7.315 1.00 0.00 H ATOM 617 HH12 ARG A 76 -2.666 16.973 -5.746 1.00 0.00 H ATOM 618 HH11 ARG A 76 -2.986 17.316 -7.485 1.00 0.00 H ATOM 619 HH22 ARG A 76 -4.317 16.090 -4.426 1.00 0.00 H ATOM 620 HH21 ARG A 76 -5.940 15.736 -5.124 1.00 0.00 H ATOM 621 H ARG A 76 -4.039 12.207 -8.788 1.00 0.00 H ATOM 622 N ASN A 77 -1.421 13.496 -10.174 1.00 21.23 N ATOM 623 CA ASN A 77 -0.018 13.675 -10.547 1.00 20.62 C ATOM 624 C ASN A 77 0.444 12.644 -11.569 1.00 18.36 C ATOM 625 O ASN A 77 1.239 12.949 -12.462 1.00 17.91 O ATOM 626 CB ASN A 77 0.885 13.540 -9.306 1.00 22.59 C ATOM 627 CG ASN A 77 1.005 14.817 -8.497 1.00 24.81 C ATOM 628 OD1 ASN A 77 2.059 15.457 -8.483 1.00 26.20 O ATOM 629 ND2 ASN A 77 -0.064 15.186 -7.799 1.00 25.02 N ATOM 630 HD22 ASN A 77 -0.933 14.617 -7.839 1.00 0.00 H ATOM 631 HD21 ASN A 77 -0.031 16.044 -7.212 1.00 0.00 H ATOM 632 H ASN A 77 -1.637 13.064 -9.253 1.00 0.00 H ATOM 633 N TYR A 78 -0.047 11.417 -11.413 1.00 16.51 N ATOM 634 CA TYR A 78 0.417 10.285 -12.212 1.00 15.80 C ATOM 635 C TYR A 78 -0.783 9.540 -12.788 1.00 14.95 C ATOM 636 O TYR A 78 -1.027 8.378 -12.458 1.00 14.73 O ATOM 637 CB TYR A 78 1.297 9.355 -11.354 1.00 16.10 C ATOM 638 CG TYR A 78 2.300 10.146 -10.552 1.00 16.78 C ATOM 639 CD1 TYR A 78 3.270 10.911 -11.191 1.00 17.22 C ATOM 640 CD2 TYR A 78 2.252 10.177 -9.162 1.00 17.01 C ATOM 641 CE1 TYR A 78 4.170 11.670 -10.473 1.00 18.06 C ATOM 642 CE2 TYR A 78 3.159 10.936 -8.433 1.00 17.85 C ATOM 643 CZ TYR A 78 4.115 11.673 -9.095 1.00 18.41 C ATOM 644 OH TYR A 78 5.014 12.436 -8.389 1.00 19.36 O ATOM 645 HH TYR A 78 4.524 13.109 -7.853 1.00 0.00 H ATOM 646 H TYR A 78 -0.786 11.258 -10.698 1.00 0.00 H ATOM 647 N PRO A 79 -1.541 10.209 -13.666 1.00 14.62 N ATOM 648 CA PRO A 79 -2.787 9.603 -14.145 1.00 14.37 C ATOM 649 C PRO A 79 -2.566 8.327 -14.939 1.00 14.32 C ATOM 650 O PRO A 79 -3.481 7.509 -15.022 1.00 15.16 O ATOM 651 CB PRO A 79 -3.383 10.691 -15.042 1.00 14.75 C ATOM 652 CG PRO A 79 -2.223 11.517 -15.459 1.00 14.40 C ATOM 653 CD PRO A 79 -1.294 11.525 -14.285 1.00 14.39 C ATOM 654 N THR A 80 -1.372 8.150 -15.499 1.00 13.64 N ATOM 655 CA THR A 80 -1.070 6.931 -16.252 1.00 13.47 C ATOM 656 C THR A 80 -0.062 6.065 -15.505 1.00 12.78 C ATOM 657 O THR A 80 0.524 5.150 -16.062 1.00 13.35 O ATOM 658 CB THR A 80 -0.526 7.237 -17.668 1.00 14.05 C ATOM 659 OG1 THR A 80 0.648 8.060 -17.573 1.00 14.94 O ATOM 660 CG2 THR A 80 -1.591 7.946 -18.510 1.00 14.46 C ATOM 661 HG1 THR A 80 1.342 7.584 -17.052 1.00 0.00 H ATOM 662 H THR A 80 -0.644 8.886 -15.401 1.00 0.00 H ATOM 663 N GLY A 81 0.121 6.350 -14.225 1.00 11.99 N ATOM 664 CA GLY A 81 1.099 5.618 -13.437 1.00 11.57 C ATOM 665 C GLY A 81 2.505 6.162 -13.553 1.00 11.61 C ATOM 666 O GLY A 81 2.709 7.319 -13.929 1.00 11.36 O ATOM 667 H GLY A 81 -0.440 7.104 -13.779 1.00 0.00 H ATOM 668 N ILE A 82 3.482 5.320 -13.230 1.00 11.22 N ATOM 669 CA ILE A 82 4.866 5.775 -13.107 1.00 11.74 C ATOM 670 C ILE A 82 5.756 5.441 -14.296 1.00 12.00 C ATOM 671 O ILE A 82 6.893 5.890 -14.356 1.00 12.47 O ATOM 672 CB ILE A 82 5.520 5.196 -11.847 1.00 12.97 C ATOM 673 CG1 ILE A 82 5.610 3.667 -11.953 1.00 14.26 C ATOM 674 CG2 ILE A 82 4.738 5.640 -10.631 1.00 13.53 C ATOM 675 CD1 ILE A 82 6.295 3.013 -10.795 1.00 15.02 C ATOM 676 H ILE A 82 3.257 4.319 -13.062 1.00 0.00 H ATOM 677 N PHE A 83 5.237 4.647 -15.228 1.00 12.26 N ATOM 678 CA PHE A 83 6.029 4.144 -16.344 1.00 12.36 C ATOM 679 C PHE A 83 5.359 4.511 -17.668 1.00 12.14 C ATOM 680 O PHE A 83 4.145 4.355 -17.806 1.00 11.72 O ATOM 681 CB PHE A 83 6.188 2.623 -16.221 1.00 12.34 C ATOM 682 CG PHE A 83 7.258 2.062 -17.104 1.00 13.08 C ATOM 683 CD1 PHE A 83 8.595 2.168 -16.740 1.00 13.82 C ATOM 684 CD2 PHE A 83 6.936 1.453 -18.310 1.00 13.44 C ATOM 685 CE1 PHE A 83 9.593 1.661 -17.551 1.00 14.18 C ATOM 686 CE2 PHE A 83 7.931 0.939 -19.127 1.00 13.83 C ATOM 687 CZ PHE A 83 9.263 1.048 -18.748 1.00 14.32 C ATOM 688 H PHE A 83 4.235 4.376 -15.159 1.00 0.00 H ATOM 689 N PRO A 84 6.140 5.018 -18.641 1.00 12.30 N ATOM 690 CA PRO A 84 5.547 5.415 -19.926 1.00 12.52 C ATOM 691 C PRO A 84 4.810 4.252 -20.592 1.00 12.07 C ATOM 692 O PRO A 84 5.355 3.140 -20.698 1.00 12.58 O ATOM 693 CB PRO A 84 6.769 5.836 -20.753 1.00 13.26 C ATOM 694 CG PRO A 84 7.744 6.314 -19.707 1.00 13.65 C ATOM 695 CD PRO A 84 7.587 5.300 -18.605 1.00 13.22 C ATOM 696 N LEU A 85 3.579 4.502 -21.032 1.00 11.21 N ATOM 697 CA LEU A 85 2.770 3.418 -21.564 1.00 10.45 C ATOM 698 C LEU A 85 2.982 3.307 -23.074 1.00 10.95 C ATOM 699 O LEU A 85 2.085 3.584 -23.860 1.00 11.07 O ATOM 700 CB LEU A 85 1.298 3.625 -21.216 1.00 10.87 C ATOM 701 CG LEU A 85 0.991 3.656 -19.715 1.00 10.64 C ATOM 702 CD1 LEU A 85 -0.505 3.877 -19.500 1.00 10.50 C ATOM 703 CD2 LEU A 85 1.451 2.378 -19.016 1.00 11.46 C ATOM 704 H LEU A 85 3.198 5.469 -20.995 1.00 0.00 H ATOM 705 N GLN A 86 4.185 2.891 -23.459 1.00 10.92 N ATOM 706 CA GLN A 86 4.589 2.891 -24.855 1.00 11.58 C ATOM 707 C GLN A 86 4.234 1.611 -25.589 1.00 11.35 C ATOM 708 O GLN A 86 4.316 0.516 -25.038 1.00 11.60 O ATOM 709 CB GLN A 86 6.091 3.134 -24.967 1.00 12.89 C ATOM 710 CG GLN A 86 6.539 4.454 -24.378 1.00 14.88 C ATOM 711 CD GLN A 86 8.017 4.683 -24.548 1.00 17.33 C ATOM 712 OE1 GLN A 86 8.431 5.600 -25.247 1.00 18.82 O ATOM 713 NE2 GLN A 86 8.824 3.850 -23.908 1.00 18.45 N ATOM 714 HE22 GLN A 86 8.427 3.086 -23.326 1.00 0.00 H ATOM 715 HE21 GLN A 86 9.855 3.960 -23.988 1.00 0.00 H ATOM 716 H GLN A 86 4.857 2.556 -22.739 1.00 0.00 H ATOM 717 N SER A 87 3.868 1.772 -26.854 1.00 11.57 N ATOM 718 CA SER A 87 3.501 0.657 -27.718 1.00 12.35 C ATOM 719 C SER A 87 3.950 0.945 -29.137 1.00 12.86 C ATOM 720 O SER A 87 3.690 2.033 -29.659 1.00 13.68 O ATOM 721 CB SER A 87 1.983 0.491 -27.736 1.00 12.62 C ATOM 722 OG SER A 87 1.609 -0.491 -28.695 1.00 12.63 O ATOM 723 HG SER A 87 2.028 -1.357 -28.460 1.00 0.00 H ATOM 724 H SER A 87 3.842 2.735 -27.246 1.00 0.00 H ATOM 725 N ALA A 88 4.601 -0.036 -29.759 1.00 12.38 N ATOM 726 CA ALA A 88 5.012 0.077 -31.150 1.00 12.62 C ATOM 727 C ALA A 88 3.799 0.010 -32.080 1.00 13.63 C ATOM 728 O ALA A 88 3.921 0.266 -33.283 1.00 15.01 O ATOM 729 CB ALA A 88 6.012 -1.026 -31.505 1.00 12.78 C ATOM 730 H ALA A 88 4.822 -0.907 -29.236 1.00 0.00 H ATOM 731 N GLN A 89 2.641 -0.346 -31.526 1.00 13.50 N ATOM 732 CA GLN A 89 1.409 -0.475 -32.305 1.00 13.99 C ATOM 733 C GLN A 89 0.298 0.453 -31.829 1.00 13.49 C ATOM 734 O GLN A 89 -0.856 0.324 -32.248 1.00 14.11 O ATOM 735 CB GLN A 89 0.907 -1.922 -32.287 1.00 15.17 C ATOM 736 CG GLN A 89 1.690 -2.833 -33.196 1.00 16.50 C ATOM 737 CD GLN A 89 1.627 -2.404 -34.648 1.00 17.96 C ATOM 738 OE1 GLN A 89 0.634 -1.832 -35.102 1.00 18.38 O ATOM 739 NE2 GLN A 89 2.694 -2.684 -35.388 1.00 18.79 N ATOM 740 HE22 GLN A 89 3.510 -3.168 -34.962 1.00 0.00 H ATOM 741 HE21 GLN A 89 2.714 -2.419 -36.393 1.00 0.00 H ATOM 742 H GLN A 89 2.612 -0.539 -30.504 1.00 0.00 H ATOM 743 N GLY A 90 0.638 1.389 -30.951 1.00 12.66 N ATOM 744 CA GLY A 90 -0.338 2.361 -30.483 1.00 11.99 C ATOM 745 C GLY A 90 -1.395 1.833 -29.529 1.00 11.67 C ATOM 746 O GLY A 90 -2.424 2.469 -29.336 1.00 11.62 O ATOM 747 H GLY A 90 1.614 1.428 -30.593 1.00 0.00 H ATOM 748 N ILE A 91 -1.130 0.678 -28.929 1.00 11.66 N ATOM 749 CA ILE A 91 -2.054 0.030 -28.017 1.00 12.05 C ATOM 750 C ILE A 91 -2.201 0.817 -26.714 1.00 11.75 C ATOM 751 O ILE A 91 -1.244 1.451 -26.249 1.00 11.97 O ATOM 752 CB ILE A 91 -1.562 -1.418 -27.759 1.00 12.93 C ATOM 753 CG1 ILE A 91 -1.728 -2.237 -29.041 1.00 13.21 C ATOM 754 CG2 ILE A 91 -2.286 -2.067 -26.588 1.00 13.69 C ATOM 755 CD1 ILE A 91 -1.154 -3.624 -28.944 1.00 13.44 C ATOM 756 H ILE A 91 -0.218 0.217 -29.122 1.00 0.00 H ATOM 757 N ASP A 92 -3.410 0.806 -26.151 1.00 11.01 N ATOM 758 CA ASP A 92 -3.694 1.454 -24.863 1.00 11.18 C ATOM 759 C ASP A 92 -3.416 0.512 -23.694 1.00 11.11 C ATOM 760 O ASP A 92 -4.145 -0.467 -23.495 1.00 11.90 O ATOM 761 CB ASP A 92 -5.162 1.914 -24.847 1.00 12.07 C ATOM 762 CG ASP A 92 -5.566 2.607 -23.550 1.00 12.61 C ATOM 763 OD1 ASP A 92 -4.702 2.960 -22.730 1.00 12.36 O ATOM 764 OD2 ASP A 92 -6.783 2.825 -23.361 1.00 13.93 O ATOM 765 H ASP A 92 -4.185 0.318 -26.644 1.00 0.00 H ATOM 766 N TYR A 93 -2.375 0.815 -22.913 1.00 10.41 N ATOM 767 CA TYR A 93 -2.030 -0.011 -21.749 1.00 9.88 C ATOM 768 C TYR A 93 -2.530 0.570 -20.436 1.00 10.24 C ATOM 769 O TYR A 93 -2.243 0.028 -19.370 1.00 10.39 O ATOM 770 CB TYR A 93 -0.514 -0.284 -21.668 1.00 9.81 C ATOM 771 CG TYR A 93 -0.049 -1.219 -22.756 1.00 10.08 C ATOM 772 CD1 TYR A 93 -0.535 -2.522 -22.821 1.00 10.28 C ATOM 773 CD2 TYR A 93 0.843 -0.799 -23.738 1.00 10.21 C ATOM 774 CE1 TYR A 93 -0.139 -3.384 -23.819 1.00 10.85 C ATOM 775 CE2 TYR A 93 1.251 -1.668 -24.748 1.00 10.41 C ATOM 776 CZ TYR A 93 0.747 -2.951 -24.779 1.00 10.66 C ATOM 777 OH TYR A 93 1.123 -3.821 -25.775 1.00 11.19 O ATOM 778 HH TYR A 93 0.867 -3.445 -26.654 1.00 0.00 H ATOM 779 H TYR A 93 -1.798 1.652 -23.134 1.00 0.00 H ATOM 780 N LEU A 94 -3.310 1.642 -20.494 1.00 10.69 N ATOM 781 CA LEU A 94 -3.806 2.214 -19.243 1.00 11.02 C ATOM 782 C LEU A 94 -4.701 1.257 -18.443 1.00 11.63 C ATOM 783 O LEU A 94 -4.548 1.155 -17.225 1.00 11.49 O ATOM 784 CB LEU A 94 -4.485 3.576 -19.457 1.00 11.53 C ATOM 785 CG LEU A 94 -4.969 4.272 -18.172 1.00 12.22 C ATOM 786 CD1 LEU A 94 -3.853 4.479 -17.143 1.00 12.38 C ATOM 787 CD2 LEU A 94 -5.623 5.596 -18.517 1.00 12.96 C ATOM 788 H LEU A 94 -3.563 2.066 -21.409 1.00 0.00 H ATOM 789 N PRO A 95 -5.644 0.558 -19.108 1.00 11.91 N ATOM 790 CA PRO A 95 -6.436 -0.356 -18.271 1.00 12.11 C ATOM 791 C PRO A 95 -5.595 -1.427 -17.570 1.00 11.39 C ATOM 792 O PRO A 95 -5.929 -1.827 -16.461 1.00 11.19 O ATOM 793 CB PRO A 95 -7.409 -0.983 -19.271 1.00 12.40 C ATOM 794 CG PRO A 95 -7.576 0.080 -20.319 1.00 12.13 C ATOM 795 CD PRO A 95 -6.198 0.666 -20.473 1.00 12.03 C ATOM 796 N LEU A 96 -4.501 -1.854 -18.187 1.00 10.74 N ATOM 797 CA LEU A 96 -3.601 -2.798 -17.531 1.00 10.34 C ATOM 798 C LEU A 96 -2.950 -2.149 -16.311 1.00 10.70 C ATOM 799 O LEU A 96 -2.917 -2.736 -15.227 1.00 10.52 O ATOM 800 CB LEU A 96 -2.536 -3.309 -18.508 1.00 10.18 C ATOM 801 CG LEU A 96 -1.475 -4.232 -17.903 1.00 10.01 C ATOM 802 CD1 LEU A 96 -2.105 -5.440 -17.179 1.00 10.51 C ATOM 803 CD2 LEU A 96 -0.466 -4.692 -18.968 1.00 10.57 C ATOM 804 H LEU A 96 -4.283 -1.514 -19.145 1.00 0.00 H ATOM 805 N GLN A 97 -2.450 -0.929 -16.484 1.00 10.44 N ATOM 806 CA GLN A 97 -1.853 -0.200 -15.376 1.00 11.10 C ATOM 807 C GLN A 97 -2.861 -0.013 -14.244 1.00 11.17 C ATOM 808 O GLN A 97 -2.517 -0.137 -13.071 1.00 11.02 O ATOM 809 CB GLN A 97 -1.320 1.164 -15.844 1.00 11.19 C ATOM 810 CG GLN A 97 -0.457 1.911 -14.815 1.00 11.88 C ATOM 811 CD GLN A 97 -1.259 2.577 -13.709 1.00 11.91 C ATOM 812 OE1 GLN A 97 -2.428 2.939 -13.895 1.00 12.72 O ATOM 813 NE2 GLN A 97 -0.628 2.753 -12.551 1.00 11.85 N ATOM 814 HE22 GLN A 97 0.355 2.432 -12.441 1.00 0.00 H ATOM 815 HE21 GLN A 97 -1.118 3.211 -11.756 1.00 0.00 H ATOM 816 H GLN A 97 -2.486 -0.489 -17.426 1.00 0.00 H ATOM 817 N GLU A 98 -4.106 0.281 -14.592 1.00 11.21 N ATOM 818 CA GLU A 98 -5.100 0.578 -13.570 1.00 12.30 C ATOM 819 C GLU A 98 -5.418 -0.665 -12.756 1.00 11.92 C ATOM 820 O GLU A 98 -5.556 -0.601 -11.532 1.00 13.00 O ATOM 821 CB GLU A 98 -6.363 1.180 -14.198 1.00 13.91 C ATOM 822 CG GLU A 98 -6.138 2.624 -14.635 1.00 16.09 C ATOM 823 CD GLU A 98 -7.279 3.201 -15.460 1.00 18.94 C ATOM 824 OE1 GLU A 98 -7.916 2.447 -16.226 1.00 20.07 O ATOM 825 OE2 GLU A 98 -7.514 4.424 -15.358 1.00 20.77 O ATOM 826 H GLU A 98 -4.373 0.300 -15.597 1.00 0.00 H ATOM 827 N ALA A 99 -5.513 -1.807 -13.430 1.00 11.29 N ATOM 828 CA ALA A 99 -5.762 -3.057 -12.719 1.00 11.38 C ATOM 829 C ALA A 99 -4.592 -3.390 -11.789 1.00 11.20 C ATOM 830 O ALA A 99 -4.796 -3.794 -10.652 1.00 11.47 O ATOM 831 CB ALA A 99 -6.020 -4.195 -13.708 1.00 11.50 C ATOM 832 H ALA A 99 -5.410 -1.810 -14.465 1.00 0.00 H ATOM 833 N LEU A 100 -3.365 -3.196 -12.267 1.00 10.51 N ATOM 834 CA LEU A 100 -2.189 -3.450 -11.446 1.00 10.72 C ATOM 835 C LEU A 100 -2.071 -2.478 -10.262 1.00 11.04 C ATOM 836 O LEU A 100 -1.738 -2.886 -9.152 1.00 11.58 O ATOM 837 CB LEU A 100 -0.923 -3.433 -12.307 1.00 10.26 C ATOM 838 CG LEU A 100 -0.818 -4.666 -13.205 1.00 10.17 C ATOM 839 CD1 LEU A 100 0.274 -4.467 -14.246 1.00 10.08 C ATOM 840 CD2 LEU A 100 -0.559 -5.923 -12.384 1.00 10.03 C ATOM 841 H LEU A 100 -3.244 -2.857 -13.243 1.00 0.00 H ATOM 842 N GLY A 101 -2.367 -1.204 -10.492 1.00 11.43 N ATOM 843 CA GLY A 101 -2.352 -0.230 -9.408 1.00 11.85 C ATOM 844 C GLY A 101 -3.382 -0.525 -8.326 1.00 12.74 C ATOM 845 O GLY A 101 -3.208 -0.160 -7.158 1.00 12.99 O ATOM 846 H GLY A 101 -2.612 -0.898 -11.455 1.00 0.00 H ATOM 847 N SER A 102 -4.468 -1.181 -8.716 1.00 13.26 N ATOM 848 CA SER A 102 -5.503 -1.596 -7.769 1.00 13.85 C ATOM 849 C SER A 102 -5.213 -2.959 -7.154 1.00 13.84 C ATOM 850 O SER A 102 -5.989 -3.452 -6.323 1.00 14.50 O ATOM 851 CB SER A 102 -6.863 -1.645 -8.463 1.00 14.70 C ATOM 852 OG SER A 102 -7.265 -0.351 -8.862 1.00 16.13 O ATOM 853 HG SER A 102 -8.147 -0.404 -9.309 1.00 0.00 H ATOM 854 H SER A 102 -4.587 -1.407 -9.724 1.00 0.00 H ATOM 855 N GLN A 103 -4.101 -3.559 -7.574 1.00 12.90 N ATOM 856 CA GLN A 103 -3.700 -4.902 -7.153 1.00 13.05 C ATOM 857 C GLN A 103 -4.764 -5.947 -7.491 1.00 12.86 C ATOM 858 O GLN A 103 -4.929 -6.952 -6.785 1.00 13.73 O ATOM 859 CB GLN A 103 -3.339 -4.921 -5.666 1.00 13.21 C ATOM 860 CG GLN A 103 -2.205 -3.947 -5.296 1.00 13.04 C ATOM 861 CD GLN A 103 -0.823 -4.438 -5.709 1.00 13.36 C ATOM 862 OE1 GLN A 103 -0.158 -5.145 -4.954 1.00 14.43 O ATOM 863 NE2 GLN A 103 -0.379 -4.051 -6.906 1.00 12.69 N ATOM 864 HE22 GLN A 103 -0.975 -3.453 -7.513 1.00 0.00 H ATOM 865 HE21 GLN A 103 0.563 -4.348 -7.232 1.00 0.00 H ATOM 866 H GLN A 103 -3.485 -3.046 -8.236 1.00 0.00 H ATOM 867 N ASP A 104 -5.488 -5.696 -8.581 1.00 12.27 N ATOM 868 CA ASP A 104 -6.457 -6.649 -9.107 1.00 12.62 C ATOM 869 C ASP A 104 -5.730 -7.509 -10.134 1.00 12.25 C ATOM 870 O ASP A 104 -5.835 -7.295 -11.340 1.00 12.33 O ATOM 871 CB ASP A 104 -7.626 -5.908 -9.753 1.00 13.28 C ATOM 872 CG ASP A 104 -8.729 -6.841 -10.216 1.00 14.44 C ATOM 873 OD1 ASP A 104 -8.532 -8.076 -10.184 1.00 15.00 O ATOM 874 OD2 ASP A 104 -9.790 -6.334 -10.652 1.00 15.18 O ATOM 875 H ASP A 104 -5.357 -4.789 -9.073 1.00 0.00 H ATOM 876 N PHE A 105 -4.980 -8.483 -9.642 1.00 12.04 N ATOM 877 CA PHE A 105 -4.096 -9.242 -10.516 1.00 11.70 C ATOM 878 C PHE A 105 -4.866 -10.151 -11.452 1.00 11.44 C ATOM 879 O PHE A 105 -4.389 -10.454 -12.545 1.00 11.49 O ATOM 880 CB PHE A 105 -3.078 -10.037 -9.704 1.00 11.78 C ATOM 881 CG PHE A 105 -2.125 -9.167 -8.937 1.00 11.31 C ATOM 882 CD1 PHE A 105 -1.161 -8.421 -9.599 1.00 11.48 C ATOM 883 CD2 PHE A 105 -2.196 -9.086 -7.556 1.00 11.26 C ATOM 884 CE1 PHE A 105 -0.282 -7.613 -8.904 1.00 11.53 C ATOM 885 CE2 PHE A 105 -1.319 -8.275 -6.851 1.00 11.56 C ATOM 886 CZ PHE A 105 -0.361 -7.542 -7.522 1.00 11.57 C ATOM 887 H PHE A 105 -5.022 -8.707 -8.627 1.00 0.00 H ATOM 888 N GLU A 106 -6.059 -10.575 -11.047 1.00 12.22 N ATOM 889 CA GLU A 106 -6.851 -11.420 -11.927 1.00 12.96 C ATOM 890 C GLU A 106 -7.297 -10.647 -13.165 1.00 11.90 C ATOM 891 O GLU A 106 -7.175 -11.133 -14.295 1.00 11.76 O ATOM 892 CB GLU A 106 -8.051 -12.045 -11.202 1.00 14.69 C ATOM 893 CG GLU A 106 -8.713 -13.124 -12.048 1.00 16.98 C ATOM 894 CD GLU A 106 -9.813 -13.880 -11.332 1.00 19.62 C ATOM 895 OE1 GLU A 106 -10.139 -13.542 -10.172 1.00 20.88 O ATOM 896 OE2 GLU A 106 -10.344 -14.823 -11.952 1.00 20.49 O ATOM 897 H GLU A 106 -6.422 -10.305 -10.111 1.00 0.00 H ATOM 898 N THR A 107 -7.797 -9.436 -12.961 1.00 11.22 N ATOM 899 CA THR A 107 -8.158 -8.604 -14.092 1.00 11.32 C ATOM 900 C THR A 107 -6.921 -8.252 -14.917 1.00 10.68 C ATOM 901 O THR A 107 -6.972 -8.262 -16.136 1.00 10.54 O ATOM 902 CB THR A 107 -8.880 -7.331 -13.624 1.00 11.75 C ATOM 903 OG1 THR A 107 -10.101 -7.704 -12.961 1.00 12.65 O ATOM 904 CG2 THR A 107 -9.212 -6.426 -14.812 1.00 12.11 C ATOM 905 HG1 THR A 107 -10.678 -8.204 -13.591 1.00 0.00 H ATOM 906 H THR A 107 -7.930 -9.084 -11.992 1.00 0.00 H ATOM 907 N ALA A 108 -5.808 -7.940 -14.261 1.00 10.19 N ATOM 908 CA ALA A 108 -4.584 -7.641 -14.997 1.00 9.64 C ATOM 909 C ALA A 108 -4.159 -8.809 -15.886 1.00 9.49 C ATOM 910 O ALA A 108 -3.714 -8.606 -17.011 1.00 9.63 O ATOM 911 CB ALA A 108 -3.457 -7.256 -14.031 1.00 9.56 C ATOM 912 H ALA A 108 -5.809 -7.909 -13.221 1.00 0.00 H ATOM 913 N ASP A 109 -4.326 -10.027 -15.380 1.00 9.54 N ATOM 914 CA ASP A 109 -3.993 -11.209 -16.153 1.00 9.88 C ATOM 915 C ASP A 109 -4.883 -11.318 -17.400 1.00 9.72 C ATOM 916 O ASP A 109 -4.392 -11.591 -18.490 1.00 10.13 O ATOM 917 CB ASP A 109 -4.128 -12.455 -15.283 1.00 10.16 C ATOM 918 CG ASP A 109 -3.571 -13.678 -15.948 1.00 10.81 C ATOM 919 OD1 ASP A 109 -2.369 -13.668 -16.271 1.00 10.94 O ATOM 920 OD2 ASP A 109 -4.327 -14.647 -16.158 1.00 11.77 O ATOM 921 H ASP A 109 -4.701 -10.134 -14.416 1.00 0.00 H ATOM 922 N GLU A 110 -6.190 -11.103 -17.235 1.00 9.79 N ATOM 923 CA GLU A 110 -7.119 -11.174 -18.358 1.00 10.63 C ATOM 924 C GLU A 110 -6.770 -10.115 -19.394 1.00 10.34 C ATOM 925 O GLU A 110 -6.749 -10.381 -20.596 1.00 11.16 O ATOM 926 CB GLU A 110 -8.564 -10.997 -17.862 1.00 12.34 C ATOM 927 CG GLU A 110 -8.957 -12.095 -16.889 1.00 14.52 C ATOM 928 CD GLU A 110 -10.269 -11.842 -16.159 1.00 16.59 C ATOM 929 OE1 GLU A 110 -10.762 -10.683 -16.147 1.00 17.57 O ATOM 930 OE2 GLU A 110 -10.800 -12.817 -15.584 1.00 17.52 O ATOM 931 H GLU A 110 -6.554 -10.880 -16.286 1.00 0.00 H ATOM 932 N ILE A 111 -6.492 -8.907 -18.930 1.00 9.79 N ATOM 933 CA ILE A 111 -6.163 -7.825 -19.845 1.00 9.69 C ATOM 934 C ILE A 111 -4.872 -8.131 -20.605 1.00 9.71 C ATOM 935 O ILE A 111 -4.797 -7.911 -21.803 1.00 10.51 O ATOM 936 CB ILE A 111 -6.040 -6.484 -19.096 1.00 9.80 C ATOM 937 CG1 ILE A 111 -7.416 -6.028 -18.599 1.00 10.44 C ATOM 938 CG2 ILE A 111 -5.410 -5.400 -19.981 1.00 10.38 C ATOM 939 CD1 ILE A 111 -7.323 -4.851 -17.641 1.00 11.05 C ATOM 940 H ILE A 111 -6.509 -8.730 -17.905 1.00 0.00 H ATOM 941 N THR A 112 -3.863 -8.656 -19.910 1.00 8.99 N ATOM 942 CA THR A 112 -2.590 -8.977 -20.542 1.00 9.21 C ATOM 943 C THR A 112 -2.782 -10.006 -21.648 1.00 9.68 C ATOM 944 O THR A 112 -2.234 -9.873 -22.743 1.00 10.28 O ATOM 945 CB THR A 112 -1.594 -9.494 -19.488 1.00 8.97 C ATOM 946 OG1 THR A 112 -1.366 -8.456 -18.531 1.00 9.45 O ATOM 947 CG2 THR A 112 -0.254 -9.870 -20.116 1.00 8.80 C ATOM 948 HG1 THR A 112 -2.223 -8.215 -18.097 1.00 0.00 H ATOM 949 H THR A 112 -3.987 -8.841 -18.894 1.00 0.00 H ATOM 950 N ARG A 113 -3.601 -11.016 -21.383 1.00 10.65 N ATOM 951 CA ARG A 113 -3.875 -12.030 -22.398 1.00 11.62 C ATOM 952 C ARG A 113 -4.539 -11.407 -23.624 1.00 11.84 C ATOM 953 O ARG A 113 -4.153 -11.696 -24.764 1.00 11.81 O ATOM 954 CB ARG A 113 -4.741 -13.154 -21.830 1.00 12.57 C ATOM 955 CG ARG A 113 -4.657 -14.446 -22.628 1.00 13.37 C ATOM 956 CD ARG A 113 -5.494 -15.564 -22.017 1.00 14.18 C ATOM 957 NE ARG A 113 -5.445 -15.564 -20.556 1.00 14.55 N ATOM 958 CZ ARG A 113 -6.447 -15.147 -19.781 1.00 14.73 C ATOM 959 NH1 ARG A 113 -7.579 -14.706 -20.326 1.00 15.38 N ATOM 960 NH2 ARG A 113 -6.324 -15.176 -18.465 1.00 14.36 N ATOM 961 HE ARG A 113 -4.579 -15.909 -20.095 1.00 0.00 H ATOM 962 HH12 ARG A 113 -8.357 -14.382 -19.717 1.00 0.00 H ATOM 963 HH11 ARG A 113 -7.685 -14.686 -21.360 1.00 0.00 H ATOM 964 HH22 ARG A 113 -7.107 -14.850 -17.862 1.00 0.00 H ATOM 965 HH21 ARG A 113 -5.445 -15.524 -18.032 1.00 0.00 H ATOM 966 H ARG A 113 -4.050 -11.086 -20.448 1.00 0.00 H ATOM 967 N ASP A 114 -5.513 -10.540 -23.393 1.00 12.38 N ATOM 968 CA ASP A 114 -6.187 -9.879 -24.501 1.00 13.28 C ATOM 969 C ASP A 114 -5.230 -8.964 -25.253 1.00 13.22 C ATOM 970 O ASP A 114 -5.248 -8.930 -26.488 1.00 13.02 O ATOM 971 CB ASP A 114 -7.416 -9.114 -24.012 1.00 14.50 C ATOM 972 CG ASP A 114 -8.524 -10.041 -23.550 1.00 15.69 C ATOM 973 OD1 ASP A 114 -9.448 -9.585 -22.849 1.00 16.31 O ATOM 974 OD2 ASP A 114 -8.459 -11.240 -23.884 1.00 16.20 O ATOM 975 H ASP A 114 -5.798 -10.330 -22.415 1.00 0.00 H ATOM 976 N LYS A 115 -4.375 -8.249 -24.523 1.00 12.51 N ATOM 977 CA LYS A 115 -3.443 -7.325 -25.159 1.00 12.68 C ATOM 978 C LYS A 115 -2.416 -8.044 -26.024 1.00 12.34 C ATOM 979 O LYS A 115 -2.037 -7.545 -27.075 1.00 12.41 O ATOM 980 CB LYS A 115 -2.741 -6.452 -24.112 1.00 13.25 C ATOM 981 CG LYS A 115 -3.649 -5.407 -23.492 1.00 13.99 C ATOM 982 CD LYS A 115 -4.070 -4.399 -24.539 1.00 15.09 C ATOM 983 CE LYS A 115 -5.277 -3.608 -24.114 1.00 16.30 C ATOM 984 NZ LYS A 115 -5.611 -2.578 -25.130 1.00 17.16 N ATOM 985 HZ1 LYS A 115 -4.805 -1.930 -25.243 1.00 0.00 H ATOM 986 HZ2 LYS A 115 -5.814 -3.042 -26.038 1.00 0.00 H ATOM 987 HZ3 LYS A 115 -6.447 -2.043 -24.818 1.00 0.00 H ATOM 988 H LYS A 115 -4.372 -8.351 -23.488 1.00 0.00 H ATOM 989 N LEU A 116 -1.961 -9.217 -25.585 1.00 11.85 N ATOM 990 CA LEU A 116 -1.016 -9.981 -26.400 1.00 12.14 C ATOM 991 C LEU A 116 -1.641 -10.424 -27.723 1.00 12.19 C ATOM 992 O LEU A 116 -0.973 -10.413 -28.763 1.00 12.69 O ATOM 993 CB LEU A 116 -0.444 -11.174 -25.632 1.00 11.95 C ATOM 994 CG LEU A 116 0.540 -10.833 -24.507 1.00 12.17 C ATOM 995 CD1 LEU A 116 1.005 -12.113 -23.882 1.00 12.78 C ATOM 996 CD2 LEU A 116 1.743 -9.997 -24.978 1.00 11.98 C ATOM 997 H LEU A 116 -2.277 -9.588 -24.666 1.00 0.00 H ATOM 998 N CYS A 117 -2.921 -10.794 -27.692 1.00 12.61 N ATOM 999 CA CYS A 117 -3.626 -11.100 -28.933 1.00 13.30 C ATOM 1000 C CYS A 117 -3.777 -9.862 -29.824 1.00 13.79 C ATOM 1001 O CYS A 117 -3.552 -9.932 -31.034 1.00 14.27 O ATOM 1002 CB CYS A 117 -4.984 -11.739 -28.647 1.00 13.56 C ATOM 1003 SG CYS A 117 -4.865 -13.442 -28.065 1.00 14.74 S ATOM 1004 H CYS A 117 -3.419 -10.865 -26.782 1.00 0.00 H ATOM 1005 N GLU A 118 -4.140 -8.733 -29.218 1.00 13.52 N ATOM 1006 CA GLU A 118 -4.235 -7.461 -29.934 1.00 14.32 C ATOM 1007 C GLU A 118 -2.903 -7.113 -30.594 1.00 14.81 C ATOM 1008 O GLU A 118 -2.862 -6.683 -31.749 1.00 15.47 O ATOM 1009 CB GLU A 118 -4.667 -6.346 -28.978 1.00 14.79 C ATOM 1010 CG GLU A 118 -4.859 -4.985 -29.656 1.00 15.42 C ATOM 1011 CD GLU A 118 -5.263 -3.866 -28.693 1.00 16.57 C ATOM 1012 OE1 GLU A 118 -5.497 -4.146 -27.503 1.00 17.06 O ATOM 1013 OE2 GLU A 118 -5.345 -2.698 -29.136 1.00 17.20 O ATOM 1014 H GLU A 118 -4.363 -8.756 -28.203 1.00 0.00 H ATOM 1015 N LEU A 119 -1.813 -7.329 -29.864 1.00 14.90 N ATOM 1016 CA LEU A 119 -0.467 -7.064 -30.366 1.00 14.83 C ATOM 1017 C LEU A 119 -0.134 -7.941 -31.577 1.00 15.43 C ATOM 1018 O LEU A 119 0.484 -7.480 -32.544 1.00 16.00 O ATOM 1019 CB LEU A 119 0.554 -7.290 -29.241 1.00 14.76 C ATOM 1020 CG LEU A 119 2.024 -6.947 -29.483 1.00 14.61 C ATOM 1021 CD1 LEU A 119 2.160 -5.454 -29.810 1.00 13.91 C ATOM 1022 CD2 LEU A 119 2.858 -7.319 -28.275 1.00 15.18 C ATOM 1023 H LEU A 119 -1.923 -7.701 -28.899 1.00 0.00 H ATOM 1024 N ALA A 120 -0.538 -9.209 -31.516 1.00 15.71 N ATOM 1025 CA ALA A 120 -0.279 -10.148 -32.607 1.00 16.70 C ATOM 1026 C ALA A 120 -1.080 -9.824 -33.861 1.00 18.57 C ATOM 1027 O ALA A 120 -0.697 -10.214 -34.957 1.00 20.01 O ATOM 1028 CB ALA A 120 -0.553 -11.580 -32.159 1.00 16.28 C ATOM 1029 H ALA A 120 -1.050 -9.539 -30.673 1.00 0.00 H ATOM 1030 N GLY A 121 -2.205 -9.141 -33.705 1.00 18.82 N ATOM 1031 CA GLY A 121 -2.953 -8.704 -34.868 1.00 19.46 C ATOM 1032 C GLY A 121 -4.341 -9.292 -34.961 1.00 20.30 C ATOM 1033 O GLY A 121 -4.809 -9.959 -34.039 1.00 20.24 O ATOM 1034 H GLY A 121 -2.551 -8.919 -32.750 1.00 0.00 H ATOM 1035 N PRO A 122 -5.011 -9.049 -36.094 1.00 21.63 N ATOM 1036 CA PRO A 122 -6.400 -9.440 -36.356 1.00 22.09 C ATOM 1037 C PRO A 122 -6.671 -10.930 -36.178 1.00 22.08 C ATOM 1038 O PRO A 122 -7.692 -11.292 -35.587 1.00 22.40 O ATOM 1039 CB PRO A 122 -6.600 -9.040 -37.821 1.00 22.40 C ATOM 1040 CG PRO A 122 -5.640 -7.918 -38.023 1.00 22.46 C ATOM 1041 CD PRO A 122 -4.441 -8.262 -37.199 1.00 21.94 C ATOM 1042 N GLY A 123 -5.775 -11.772 -36.686 1.00 21.86 N ATOM 1043 CA GLY A 123 -5.944 -13.210 -36.629 1.00 21.05 C ATOM 1044 C GLY A 123 -5.959 -13.713 -35.205 1.00 20.15 C ATOM 1045 O GLY A 123 -6.863 -14.455 -34.811 1.00 19.94 O ATOM 1046 H GLY A 123 -4.923 -11.385 -37.140 1.00 0.00 H ATOM 1047 N ALA A 124 -4.962 -13.302 -34.424 1.00 18.89 N ATOM 1048 CA ALA A 124 -4.916 -13.714 -33.029 1.00 18.31 C ATOM 1049 C ALA A 124 -6.090 -13.129 -32.248 1.00 18.44 C ATOM 1050 O ALA A 124 -6.632 -13.781 -31.358 1.00 18.15 O ATOM 1051 CB ALA A 124 -3.593 -13.321 -32.386 1.00 17.65 C ATOM 1052 H ALA A 124 -4.217 -12.687 -34.810 1.00 0.00 H ATOM 1053 N SER A 125 -6.487 -11.905 -32.584 1.00 19.22 N ATOM 1054 CA SER A 125 -7.595 -11.274 -31.884 1.00 20.29 C ATOM 1055 C SER A 125 -8.891 -12.032 -32.147 1.00 20.38 C ATOM 1056 O SER A 125 -9.739 -12.165 -31.261 1.00 20.51 O ATOM 1057 CB SER A 125 -7.730 -9.812 -32.303 1.00 21.40 C ATOM 1058 OG SER A 125 -6.633 -9.066 -31.808 1.00 22.43 O ATOM 1059 HG SER A 125 -6.728 -8.120 -32.084 1.00 0.00 H ATOM 1060 H SER A 125 -6.003 -11.396 -33.351 1.00 0.00 H ATOM 1061 N GLN A 126 -9.028 -12.546 -33.363 1.00 20.26 N ATOM 1062 CA GLN A 126 -10.211 -13.316 -33.722 1.00 20.85 C ATOM 1063 C GLN A 126 -10.233 -14.686 -33.051 1.00 19.61 C ATOM 1064 O GLN A 126 -11.245 -15.075 -32.456 1.00 19.83 O ATOM 1065 CB GLN A 126 -10.292 -13.498 -35.236 1.00 22.80 C ATOM 1066 CG GLN A 126 -11.532 -14.244 -35.672 1.00 25.18 C ATOM 1067 CD GLN A 126 -12.787 -13.439 -35.421 1.00 27.53 C ATOM 1068 OE1 GLN A 126 -12.817 -12.227 -35.652 1.00 28.92 O ATOM 1069 NE2 GLN A 126 -13.831 -14.103 -34.940 1.00 28.36 N ATOM 1070 HE22 GLN A 126 -13.760 -15.125 -34.761 1.00 0.00 H ATOM 1071 HE21 GLN A 126 -14.720 -13.601 -34.743 1.00 0.00 H ATOM 1072 H GLN A 126 -8.280 -12.397 -34.070 1.00 0.00 H ATOM 1073 N ARG A 127 -9.125 -15.422 -33.149 1.00 18.40 N ATOM 1074 CA ARG A 127 -9.107 -16.797 -32.655 1.00 17.78 C ATOM 1075 C ARG A 127 -8.981 -16.819 -31.129 1.00 17.68 C ATOM 1076 O ARG A 127 -9.406 -17.778 -30.495 1.00 17.99 O ATOM 1077 CB ARG A 127 -8.030 -17.647 -33.359 1.00 17.40 C ATOM 1078 CG ARG A 127 -6.632 -17.512 -32.784 1.00 16.77 C ATOM 1079 CD ARG A 127 -5.612 -18.325 -33.590 1.00 16.62 C ATOM 1080 NE ARG A 127 -5.119 -17.606 -34.765 1.00 16.26 N ATOM 1081 CZ ARG A 127 -4.016 -16.859 -34.788 1.00 16.16 C ATOM 1082 NH1 ARG A 127 -3.270 -16.721 -33.696 1.00 15.76 N ATOM 1083 NH2 ARG A 127 -3.651 -16.246 -35.914 1.00 16.42 N ATOM 1084 HE ARG A 127 -5.668 -17.684 -35.645 1.00 0.00 H ATOM 1085 HH12 ARG A 127 -2.411 -16.136 -33.724 1.00 0.00 H ATOM 1086 HH11 ARG A 127 -3.546 -17.198 -32.814 1.00 0.00 H ATOM 1087 HH22 ARG A 127 -2.790 -15.663 -35.933 1.00 0.00 H ATOM 1088 HH21 ARG A 127 -4.227 -16.351 -36.774 1.00 0.00 H ATOM 1089 H ARG A 127 -8.270 -15.015 -33.579 1.00 0.00 H ATOM 1090 N GLN A 128 -8.424 -15.732 -30.581 1.00 17.29 N ATOM 1091 CA GLN A 128 -8.264 -15.546 -29.128 1.00 17.25 C ATOM 1092 C GLN A 128 -7.165 -16.417 -28.518 1.00 16.59 C ATOM 1093 O GLN A 128 -7.255 -16.807 -27.350 1.00 17.41 O ATOM 1094 CB GLN A 128 -9.580 -15.771 -28.357 1.00 18.33 C ATOM 1095 CG GLN A 128 -10.787 -15.003 -28.884 1.00 19.06 C ATOM 1096 CD GLN A 128 -12.059 -15.315 -28.109 1.00 20.04 C ATOM 1097 OE1 GLN A 128 -12.007 -15.840 -26.996 1.00 20.65 O ATOM 1098 NE2 GLN A 128 -13.207 -15.007 -28.703 1.00 20.31 N ATOM 1099 HE22 GLN A 128 -13.203 -14.564 -29.644 1.00 0.00 H ATOM 1100 HE21 GLN A 128 -14.109 -15.209 -28.227 1.00 0.00 H ATOM 1101 H GLN A 128 -8.086 -14.979 -31.214 1.00 0.00 H ATOM 1102 N TRP A 129 -6.146 -16.723 -29.308 1.00 14.74 N ATOM 1103 CA TRP A 129 -4.954 -17.403 -28.824 1.00 13.98 C ATOM 1104 C TRP A 129 -3.837 -17.196 -29.829 1.00 12.93 C ATOM 1105 O TRP A 129 -4.097 -16.806 -30.963 1.00 12.41 O ATOM 1106 CB TRP A 129 -5.191 -18.887 -28.516 1.00 15.02 C ATOM 1107 CG TRP A 129 -5.952 -19.668 -29.559 1.00 15.88 C ATOM 1108 CD1 TRP A 129 -7.317 -19.782 -29.670 1.00 16.63 C ATOM 1109 CD2 TRP A 129 -5.399 -20.479 -30.601 1.00 16.52 C ATOM 1110 NE1 TRP A 129 -7.639 -20.593 -30.729 1.00 16.67 N ATOM 1111 CE2 TRP A 129 -6.484 -21.042 -31.313 1.00 16.83 C ATOM 1112 CE3 TRP A 129 -4.094 -20.790 -31.002 1.00 17.01 C ATOM 1113 CZ2 TRP A 129 -6.305 -21.890 -32.408 1.00 17.23 C ATOM 1114 CZ3 TRP A 129 -3.917 -21.636 -32.089 1.00 17.37 C ATOM 1115 CH2 TRP A 129 -5.019 -22.181 -32.776 1.00 17.28 C ATOM 1116 HE1 TRP A 129 -8.604 -20.829 -31.038 1.00 0.00 H ATOM 1117 H TRP A 129 -6.200 -16.467 -30.314 1.00 0.00 H ATOM 1118 N LEU A 130 -2.605 -17.445 -29.395 1.00 12.01 N ATOM 1119 CA LEU A 130 -1.404 -17.091 -30.147 1.00 11.64 C ATOM 1120 C LEU A 130 -0.729 -18.270 -30.825 1.00 11.62 C ATOM 1121 O LEU A 130 -0.771 -19.393 -30.324 1.00 11.86 O ATOM 1122 CB LEU A 130 -0.377 -16.472 -29.195 1.00 12.12 C ATOM 1123 CG LEU A 130 -0.783 -15.172 -28.509 1.00 13.11 C ATOM 1124 CD1 LEU A 130 0.185 -14.856 -27.387 1.00 12.93 C ATOM 1125 CD2 LEU A 130 -0.818 -14.025 -29.518 1.00 13.86 C ATOM 1126 H LEU A 130 -2.491 -17.915 -28.474 1.00 0.00 H ATOM 1127 N TYR A 131 -0.077 -17.997 -31.956 1.00 11.19 N ATOM 1128 CA TYR A 131 0.881 -18.930 -32.544 1.00 11.19 C ATOM 1129 C TYR A 131 2.270 -18.491 -32.111 1.00 10.88 C ATOM 1130 O TYR A 131 2.533 -17.291 -31.960 1.00 11.29 O ATOM 1131 CB TYR A 131 0.851 -18.862 -34.070 1.00 11.83 C ATOM 1132 CG TYR A 131 -0.406 -19.348 -34.751 1.00 12.43 C ATOM 1133 CD1 TYR A 131 -1.087 -20.479 -34.318 1.00 12.75 C ATOM 1134 CD2 TYR A 131 -0.879 -18.689 -35.870 1.00 12.87 C ATOM 1135 CE1 TYR A 131 -2.230 -20.919 -34.981 1.00 13.27 C ATOM 1136 CE2 TYR A 131 -2.006 -19.109 -36.524 1.00 13.33 C ATOM 1137 CZ TYR A 131 -2.681 -20.226 -36.082 1.00 13.59 C ATOM 1138 OH TYR A 131 -3.806 -20.648 -36.753 1.00 14.56 O ATOM 1139 HH TYR A 131 -4.487 -19.929 -36.738 1.00 0.00 H ATOM 1140 H TYR A 131 -0.256 -17.091 -32.434 1.00 0.00 H ATOM 1141 N PHE A 132 3.176 -19.451 -31.945 1.00 10.36 N ATOM 1142 CA PHE A 132 4.523 -19.123 -31.472 1.00 10.92 C ATOM 1143 C PHE A 132 5.251 -18.157 -32.407 1.00 11.14 C ATOM 1144 O PHE A 132 6.050 -17.334 -31.959 1.00 11.09 O ATOM 1145 CB PHE A 132 5.359 -20.390 -31.238 1.00 12.29 C ATOM 1146 CG PHE A 132 5.826 -21.058 -32.500 1.00 13.08 C ATOM 1147 CD1 PHE A 132 7.078 -20.775 -33.030 1.00 13.51 C ATOM 1148 CD2 PHE A 132 5.018 -21.982 -33.152 1.00 13.65 C ATOM 1149 CE1 PHE A 132 7.511 -21.391 -34.193 1.00 13.86 C ATOM 1150 CE2 PHE A 132 5.455 -22.611 -34.308 1.00 13.83 C ATOM 1151 CZ PHE A 132 6.706 -22.310 -34.829 1.00 13.68 C ATOM 1152 H PHE A 132 2.927 -20.439 -32.152 1.00 0.00 H ATOM 1153 N THR A 133 4.973 -18.252 -33.703 1.00 11.48 N ATOM 1154 CA THR A 133 5.606 -17.350 -34.659 1.00 12.55 C ATOM 1155 C THR A 133 5.164 -15.903 -34.475 1.00 12.62 C ATOM 1156 O THR A 133 5.933 -14.992 -34.761 1.00 13.11 O ATOM 1157 CB THR A 133 5.296 -17.759 -36.095 1.00 13.54 C ATOM 1158 OG1 THR A 133 3.879 -17.877 -36.239 1.00 14.27 O ATOM 1159 CG2 THR A 133 5.967 -19.082 -36.426 1.00 14.42 C ATOM 1160 HG1 THR A 133 3.454 -17.006 -36.037 1.00 0.00 H ATOM 1161 H THR A 133 4.301 -18.972 -34.037 1.00 0.00 H ATOM 1162 N GLU A 134 3.929 -15.692 -34.023 1.00 12.11 N ATOM 1163 CA GLU A 134 3.459 -14.347 -33.716 1.00 12.03 C ATOM 1164 C GLU A 134 4.212 -13.776 -32.521 1.00 12.13 C ATOM 1165 O GLU A 134 4.576 -12.593 -32.498 1.00 12.70 O ATOM 1166 CB GLU A 134 1.950 -14.343 -33.455 1.00 12.33 C ATOM 1167 CG GLU A 134 1.148 -14.639 -34.724 1.00 12.66 C ATOM 1168 CD GLU A 134 -0.312 -14.987 -34.483 1.00 13.56 C ATOM 1169 OE1 GLU A 134 -0.672 -15.437 -33.369 1.00 12.68 O ATOM 1170 OE2 GLU A 134 -1.101 -14.821 -35.434 1.00 14.32 O ATOM 1171 H GLU A 134 3.289 -16.501 -33.887 1.00 0.00 H ATOM 1172 N VAL A 135 4.476 -14.632 -31.540 1.00 11.79 N ATOM 1173 CA VAL A 135 5.212 -14.220 -30.353 1.00 11.41 C ATOM 1174 C VAL A 135 6.633 -13.825 -30.736 1.00 11.96 C ATOM 1175 O VAL A 135 7.162 -12.815 -30.262 1.00 12.66 O ATOM 1176 CB VAL A 135 5.221 -15.344 -29.275 1.00 10.94 C ATOM 1177 CG1 VAL A 135 6.086 -14.957 -28.071 1.00 11.40 C ATOM 1178 CG2 VAL A 135 3.803 -15.666 -28.819 1.00 11.79 C ATOM 1179 H VAL A 135 4.150 -15.616 -31.621 1.00 0.00 H ATOM 1180 N GLU A 136 7.248 -14.611 -31.615 1.00 12.50 N ATOM 1181 CA GLU A 136 8.611 -14.309 -32.045 1.00 14.27 C ATOM 1182 C GLU A 136 8.705 -12.941 -32.709 1.00 15.34 C ATOM 1183 O GLU A 136 9.740 -12.275 -32.634 1.00 16.49 O ATOM 1184 CB GLU A 136 9.132 -15.396 -32.984 1.00 15.98 C ATOM 1185 CG GLU A 136 9.293 -16.729 -32.281 1.00 18.43 C ATOM 1186 CD GLU A 136 9.769 -17.846 -33.188 1.00 20.75 C ATOM 1187 OE1 GLU A 136 9.657 -17.721 -34.427 1.00 21.80 O ATOM 1188 OE2 GLU A 136 10.235 -18.870 -32.642 1.00 21.69 O ATOM 1189 H GLU A 136 6.757 -15.444 -31.998 1.00 0.00 H ATOM 1190 N LYS A 137 7.616 -12.516 -33.342 1.00 15.94 N ATOM 1191 CA LYS A 137 7.610 -11.253 -34.073 1.00 17.35 C ATOM 1192 C LYS A 137 7.055 -10.073 -33.273 1.00 16.02 C ATOM 1193 O LYS A 137 6.977 -8.953 -33.795 1.00 16.54 O ATOM 1194 CB LYS A 137 6.841 -11.418 -35.386 1.00 20.05 C ATOM 1195 CG LYS A 137 7.481 -12.410 -36.345 1.00 22.24 C ATOM 1196 CD LYS A 137 8.873 -11.948 -36.771 1.00 23.87 C ATOM 1197 CE LYS A 137 9.453 -12.846 -37.862 1.00 24.97 C ATOM 1198 NZ LYS A 137 9.838 -14.199 -37.372 1.00 25.68 N ATOM 1199 HZ1 LYS A 137 10.559 -14.105 -36.628 1.00 0.00 H ATOM 1200 HZ2 LYS A 137 9.000 -14.678 -36.985 1.00 0.00 H ATOM 1201 HZ3 LYS A 137 10.223 -14.756 -38.161 1.00 0.00 H ATOM 1202 H LYS A 137 6.752 -13.094 -33.316 1.00 0.00 H ATOM 1203 N PHE A 138 6.670 -10.305 -32.018 1.00 14.59 N ATOM 1204 CA PHE A 138 6.204 -9.202 -31.173 1.00 13.71 C ATOM 1205 C PHE A 138 7.244 -8.089 -31.157 1.00 13.67 C ATOM 1206 O PHE A 138 8.445 -8.361 -31.130 1.00 13.98 O ATOM 1207 CB PHE A 138 6.028 -9.658 -29.723 1.00 13.23 C ATOM 1208 CG PHE A 138 4.724 -10.359 -29.427 1.00 12.36 C ATOM 1209 CD1 PHE A 138 3.585 -10.148 -30.200 1.00 12.35 C ATOM 1210 CD2 PHE A 138 4.633 -11.205 -28.328 1.00 12.02 C ATOM 1211 CE1 PHE A 138 2.384 -10.789 -29.883 1.00 12.57 C ATOM 1212 CE2 PHE A 138 3.437 -11.838 -28.011 1.00 11.87 C ATOM 1213 CZ PHE A 138 2.315 -11.627 -28.788 1.00 12.35 C ATOM 1214 H PHE A 138 6.700 -11.272 -31.637 1.00 0.00 H ATOM 1215 N PRO A 139 6.794 -6.828 -31.156 1.00 13.51 N ATOM 1216 CA PRO A 139 7.771 -5.757 -30.931 1.00 13.52 C ATOM 1217 C PRO A 139 8.270 -5.776 -29.494 1.00 12.82 C ATOM 1218 O PRO A 139 7.486 -5.977 -28.559 1.00 13.02 O ATOM 1219 CB PRO A 139 6.972 -4.476 -31.204 1.00 13.97 C ATOM 1220 CG PRO A 139 5.544 -4.862 -31.152 1.00 14.54 C ATOM 1221 CD PRO A 139 5.436 -6.325 -31.421 1.00 14.29 C ATOM 1222 N ALA A 140 9.572 -5.572 -29.324 1.00 12.45 N ATOM 1223 CA ALA A 140 10.175 -5.565 -27.996 1.00 12.03 C ATOM 1224 C ALA A 140 9.559 -4.502 -27.097 1.00 12.55 C ATOM 1225 O ALA A 140 9.385 -4.725 -25.906 1.00 12.96 O ATOM 1226 CB ALA A 140 11.679 -5.339 -28.102 1.00 11.92 C ATOM 1227 H ALA A 140 10.175 -5.414 -30.157 1.00 0.00 H ATOM 1228 N LEU A 141 9.239 -3.341 -27.658 1.00 12.59 N ATOM 1229 CA LEU A 141 8.773 -2.224 -26.841 1.00 12.74 C ATOM 1230 C LEU A 141 7.512 -2.561 -26.033 1.00 11.95 C ATOM 1231 O LEU A 141 7.420 -2.238 -24.846 1.00 12.00 O ATOM 1232 CB LEU A 141 8.532 -1.003 -27.726 1.00 14.15 C ATOM 1233 CG LEU A 141 8.208 0.299 -27.001 1.00 15.38 C ATOM 1234 CD1 LEU A 141 9.298 0.597 -25.983 1.00 15.58 C ATOM 1235 CD2 LEU A 141 8.105 1.421 -28.018 1.00 15.72 C ATOM 1236 H LEU A 141 9.321 -3.227 -28.688 1.00 0.00 H ATOM 1237 N ASP A 142 6.540 -3.203 -26.671 1.00 11.29 N ATOM 1238 CA ASP A 142 5.291 -3.545 -25.994 1.00 10.36 C ATOM 1239 C ASP A 142 5.521 -4.569 -24.891 1.00 9.71 C ATOM 1240 O ASP A 142 4.917 -4.490 -23.817 1.00 9.95 O ATOM 1241 CB ASP A 142 4.288 -4.114 -26.990 1.00 10.68 C ATOM 1242 CG ASP A 142 3.755 -3.063 -27.911 1.00 11.20 C ATOM 1243 OD1 ASP A 142 4.527 -2.608 -28.778 1.00 11.73 O ATOM 1244 OD2 ASP A 142 2.582 -2.666 -27.743 1.00 11.55 O ATOM 1245 H ASP A 142 6.670 -3.467 -27.669 1.00 0.00 H ATOM 1246 N LEU A 143 6.388 -5.537 -25.157 1.00 9.91 N ATOM 1247 CA LEU A 143 6.677 -6.549 -24.153 1.00 9.64 C ATOM 1248 C LEU A 143 7.370 -5.913 -22.960 1.00 9.48 C ATOM 1249 O LEU A 143 7.118 -6.288 -21.812 1.00 9.26 O ATOM 1250 CB LEU A 143 7.539 -7.674 -24.731 1.00 10.25 C ATOM 1251 CG LEU A 143 6.861 -8.559 -25.778 1.00 10.64 C ATOM 1252 CD1 LEU A 143 7.845 -9.638 -26.225 1.00 10.39 C ATOM 1253 CD2 LEU A 143 5.562 -9.176 -25.243 1.00 11.16 C ATOM 1254 H LEU A 143 6.861 -5.572 -26.083 1.00 0.00 H ATOM 1255 N HIS A 144 8.228 -4.934 -23.231 1.00 9.45 N ATOM 1256 CA HIS A 144 8.898 -4.203 -22.161 1.00 9.70 C ATOM 1257 C HIS A 144 7.880 -3.437 -21.306 1.00 9.47 C ATOM 1258 O HIS A 144 7.933 -3.474 -20.074 1.00 9.60 O ATOM 1259 CB HIS A 144 9.933 -3.249 -22.772 1.00 10.17 C ATOM 1260 CG HIS A 144 10.691 -2.437 -21.770 1.00 10.93 C ATOM 1261 ND1 HIS A 144 11.469 -3.004 -20.782 1.00 10.92 N ATOM 1262 CD2 HIS A 144 10.807 -1.097 -21.615 1.00 11.68 C ATOM 1263 CE1 HIS A 144 12.027 -2.047 -20.062 1.00 11.52 C ATOM 1264 NE2 HIS A 144 11.645 -0.880 -20.551 1.00 11.85 N ATOM 1265 H HIS A 144 8.425 -4.685 -24.222 1.00 0.00 H ATOM 1266 N THR A 145 6.944 -2.750 -21.952 1.00 9.53 N ATOM 1267 CA THR A 145 5.929 -2.002 -21.215 1.00 9.51 C ATOM 1268 C THR A 145 5.080 -2.932 -20.350 1.00 9.23 C ATOM 1269 O THR A 145 4.904 -2.695 -19.150 1.00 9.63 O ATOM 1270 CB THR A 145 5.020 -1.221 -22.169 1.00 10.36 C ATOM 1271 OG1 THR A 145 5.807 -0.255 -22.875 1.00 11.20 O ATOM 1272 CG2 THR A 145 3.903 -0.505 -21.402 1.00 10.27 C ATOM 1273 HG1 THR A 145 6.225 0.366 -22.227 1.00 0.00 H ATOM 1274 H THR A 145 6.934 -2.745 -22.992 1.00 0.00 H ATOM 1275 N ILE A 146 4.569 -3.999 -20.961 1.00 8.66 N ATOM 1276 CA ILE A 146 3.750 -4.965 -20.235 1.00 8.87 C ATOM 1277 C ILE A 146 4.511 -5.574 -19.058 1.00 8.74 C ATOM 1278 O ILE A 146 4.017 -5.605 -17.931 1.00 8.85 O ATOM 1279 CB ILE A 146 3.263 -6.086 -21.182 1.00 8.80 C ATOM 1280 CG1 ILE A 146 2.301 -5.503 -22.220 1.00 8.77 C ATOM 1281 CG2 ILE A 146 2.627 -7.226 -20.396 1.00 9.26 C ATOM 1282 CD1 ILE A 146 1.993 -6.455 -23.363 1.00 8.77 C ATOM 1283 H ILE A 146 4.757 -4.147 -21.973 1.00 0.00 H ATOM 1284 N ASN A 147 5.729 -6.030 -19.313 1.00 8.23 N ATOM 1285 CA ASN A 147 6.528 -6.613 -18.248 1.00 8.59 C ATOM 1286 C ASN A 147 6.859 -5.627 -17.133 1.00 8.81 C ATOM 1287 O ASN A 147 6.757 -5.970 -15.944 1.00 9.11 O ATOM 1288 CB ASN A 147 7.814 -7.212 -18.798 1.00 9.28 C ATOM 1289 CG ASN A 147 8.478 -8.105 -17.793 1.00 9.74 C ATOM 1290 OD1 ASN A 147 8.039 -9.235 -17.589 1.00 10.04 O ATOM 1291 ND2 ASN A 147 9.515 -7.594 -17.120 1.00 9.96 N ATOM 1292 HD22 ASN A 147 9.848 -6.632 -17.331 1.00 0.00 H ATOM 1293 HD21 ASN A 147 9.988 -8.159 -16.386 1.00 0.00 H ATOM 1294 H ASN A 147 6.114 -5.971 -20.277 1.00 0.00 H ATOM 1295 N ALA A 148 7.255 -4.410 -17.515 1.00 8.73 N ATOM 1296 CA ALA A 148 7.589 -3.384 -16.532 1.00 9.46 C ATOM 1297 C ALA A 148 6.423 -3.132 -15.596 1.00 9.40 C ATOM 1298 O ALA A 148 6.612 -2.998 -14.377 1.00 9.48 O ATOM 1299 CB ALA A 148 8.017 -2.087 -17.219 1.00 10.14 C ATOM 1300 H ALA A 148 7.327 -4.190 -18.529 1.00 0.00 H ATOM 1301 N LEU A 149 5.215 -3.064 -16.151 1.00 8.89 N ATOM 1302 CA LEU A 149 4.043 -2.838 -15.313 1.00 8.78 C ATOM 1303 C LEU A 149 3.851 -3.968 -14.307 1.00 8.78 C ATOM 1304 O LEU A 149 3.683 -3.716 -13.122 1.00 9.12 O ATOM 1305 CB LEU A 149 2.777 -2.652 -16.154 1.00 8.95 C ATOM 1306 CG LEU A 149 2.707 -1.340 -16.944 1.00 9.80 C ATOM 1307 CD1 LEU A 149 1.506 -1.372 -17.877 1.00 10.01 C ATOM 1308 CD2 LEU A 149 2.619 -0.141 -15.995 1.00 9.98 C ATOM 1309 H LEU A 149 5.107 -3.172 -17.180 1.00 0.00 H ATOM 1310 N TRP A 150 3.908 -5.212 -14.767 1.00 8.92 N ATOM 1311 CA TRP A 150 3.747 -6.340 -13.851 1.00 8.98 C ATOM 1312 C TRP A 150 4.798 -6.333 -12.759 1.00 9.34 C ATOM 1313 O TRP A 150 4.495 -6.566 -11.590 1.00 9.96 O ATOM 1314 CB TRP A 150 3.818 -7.654 -14.630 1.00 8.62 C ATOM 1315 CG TRP A 150 2.504 -8.032 -15.196 1.00 8.53 C ATOM 1316 CD1 TRP A 150 2.047 -7.777 -16.461 1.00 8.35 C ATOM 1317 CD2 TRP A 150 1.448 -8.705 -14.511 1.00 8.63 C ATOM 1318 NE1 TRP A 150 0.764 -8.275 -16.606 1.00 8.27 N ATOM 1319 CE2 TRP A 150 0.380 -8.850 -15.421 1.00 8.33 C ATOM 1320 CE3 TRP A 150 1.304 -9.211 -13.212 1.00 8.73 C ATOM 1321 CZ2 TRP A 150 -0.814 -9.488 -15.076 1.00 8.90 C ATOM 1322 CZ3 TRP A 150 0.121 -9.843 -12.872 1.00 8.68 C ATOM 1323 CH2 TRP A 150 -0.925 -9.975 -13.800 1.00 8.88 C ATOM 1324 HE1 TRP A 150 0.187 -8.222 -17.470 1.00 0.00 H ATOM 1325 H TRP A 150 4.067 -5.384 -15.780 1.00 0.00 H ATOM 1326 N TRP A 151 6.036 -6.055 -13.147 1.00 9.12 N ATOM 1327 CA TRP A 151 7.163 -6.107 -12.232 1.00 9.70 C ATOM 1328 C TRP A 151 7.107 -4.957 -11.223 1.00 9.62 C ATOM 1329 O TRP A 151 7.257 -5.172 -10.020 1.00 10.23 O ATOM 1330 CB TRP A 151 8.443 -6.063 -13.074 1.00 10.17 C ATOM 1331 CG TRP A 151 9.760 -6.264 -12.366 1.00 11.68 C ATOM 1332 CD1 TRP A 151 10.336 -7.449 -12.008 1.00 12.43 C ATOM 1333 CD2 TRP A 151 10.699 -5.239 -12.031 1.00 12.30 C ATOM 1334 NE1 TRP A 151 11.575 -7.216 -11.432 1.00 13.31 N ATOM 1335 CE2 TRP A 151 11.817 -5.866 -11.439 1.00 12.95 C ATOM 1336 CE3 TRP A 151 10.700 -3.846 -12.170 1.00 12.54 C ATOM 1337 CZ2 TRP A 151 12.919 -5.145 -10.978 1.00 13.38 C ATOM 1338 CZ3 TRP A 151 11.794 -3.133 -11.708 1.00 13.00 C ATOM 1339 CH2 TRP A 151 12.887 -3.783 -11.120 1.00 13.48 C ATOM 1340 HE1 TRP A 151 12.215 -7.944 -11.057 1.00 0.00 H ATOM 1341 H TRP A 151 6.205 -5.791 -14.139 1.00 0.00 H ATOM 1342 N LEU A 152 6.871 -3.743 -11.712 1.00 9.27 N ATOM 1343 CA LEU A 152 6.841 -2.562 -10.843 1.00 9.49 C ATOM 1344 C LEU A 152 5.725 -2.610 -9.809 1.00 10.07 C ATOM 1345 O LEU A 152 5.855 -2.048 -8.726 1.00 10.86 O ATOM 1346 CB LEU A 152 6.688 -1.297 -11.693 1.00 9.80 C ATOM 1347 CG LEU A 152 7.943 -0.899 -12.475 1.00 9.35 C ATOM 1348 CD1 LEU A 152 7.591 0.150 -13.545 1.00 10.58 C ATOM 1349 CD2 LEU A 152 9.054 -0.388 -11.540 1.00 10.48 C ATOM 1350 H LEU A 152 6.704 -3.629 -12.732 1.00 0.00 H ATOM 1351 N HIS A 153 4.631 -3.284 -10.144 1.00 10.51 N ATOM 1352 CA HIS A 153 3.442 -3.309 -9.296 1.00 10.66 C ATOM 1353 C HIS A 153 3.311 -4.602 -8.484 1.00 11.07 C ATOM 1354 O HIS A 153 2.277 -4.859 -7.864 1.00 11.82 O ATOM 1355 CB HIS A 153 2.182 -3.028 -10.134 1.00 11.18 C ATOM 1356 CG HIS A 153 2.127 -1.631 -10.654 1.00 11.52 C ATOM 1357 ND1 HIS A 153 1.783 -0.555 -9.862 1.00 11.82 N ATOM 1358 CD2 HIS A 153 2.417 -1.124 -11.875 1.00 11.85 C ATOM 1359 CE1 HIS A 153 1.838 0.550 -10.582 1.00 12.12 C ATOM 1360 NE2 HIS A 153 2.222 0.234 -11.806 1.00 12.34 N ATOM 1361 H HIS A 153 4.620 -3.812 -11.040 1.00 0.00 H ATOM 1362 N SER A 154 4.377 -5.390 -8.454 1.00 10.52 N ATOM 1363 CA SER A 154 4.359 -6.655 -7.724 1.00 10.90 C ATOM 1364 C SER A 154 5.613 -6.867 -6.882 1.00 11.95 C ATOM 1365 O SER A 154 5.903 -7.995 -6.499 1.00 12.07 O ATOM 1366 CB SER A 154 4.206 -7.825 -8.700 1.00 10.67 C ATOM 1367 OG SER A 154 5.373 -7.931 -9.501 1.00 10.42 O ATOM 1368 HG SER A 154 5.500 -7.091 -10.010 1.00 0.00 H ATOM 1369 H SER A 154 5.240 -5.103 -8.958 1.00 0.00 H ATOM 1370 N ASN A 155 6.352 -5.791 -6.598 1.00 12.37 N ATOM 1371 CA ASN A 155 7.639 -5.897 -5.891 1.00 13.35 C ATOM 1372 C ASN A 155 8.573 -6.883 -6.586 1.00 13.16 C ATOM 1373 O ASN A 155 9.309 -7.626 -5.937 1.00 13.95 O ATOM 1374 CB ASN A 155 7.432 -6.303 -4.420 1.00 14.90 C ATOM 1375 CG ASN A 155 8.726 -6.288 -3.607 1.00 16.88 C ATOM 1376 OD1 ASN A 155 9.612 -5.471 -3.849 1.00 17.94 O ATOM 1377 ND2 ASN A 155 8.842 -7.213 -2.652 1.00 17.62 N ATOM 1378 HD22 ASN A 155 8.066 -7.885 -2.482 1.00 0.00 H ATOM 1379 HD21 ASN A 155 9.708 -7.262 -2.078 1.00 0.00 H ATOM 1380 H ASN A 155 6.009 -4.852 -6.884 1.00 0.00 H ATOM 1381 N GLY A 156 8.525 -6.890 -7.913 1.00 12.55 N ATOM 1382 CA GLY A 156 9.362 -7.761 -8.722 1.00 12.96 C ATOM 1383 C GLY A 156 8.982 -9.230 -8.681 1.00 13.31 C ATOM 1384 O GLY A 156 9.734 -10.062 -9.188 1.00 14.23 O ATOM 1385 H GLY A 156 7.863 -6.247 -8.392 1.00 0.00 H ATOM 1386 N ASN A 157 7.823 -9.559 -8.107 1.00 13.25 N ATOM 1387 CA ASN A 157 7.381 -10.954 -7.954 1.00 13.68 C ATOM 1388 C ASN A 157 6.786 -11.523 -9.242 1.00 12.89 C ATOM 1389 O ASN A 157 6.879 -12.725 -9.502 1.00 12.91 O ATOM 1390 CB ASN A 157 6.339 -11.073 -6.827 1.00 15.26 C ATOM 1391 CG ASN A 157 6.290 -12.468 -6.199 1.00 16.16 C ATOM 1392 OD1 ASN A 157 7.326 -13.067 -5.905 1.00 16.80 O ATOM 1393 ND2 ASN A 157 5.079 -12.983 -5.983 1.00 16.42 N ATOM 1394 HD22 ASN A 157 4.230 -12.443 -6.246 1.00 0.00 H ATOM 1395 HD21 ASN A 157 4.984 -13.924 -5.551 1.00 0.00 H ATOM 1396 H ASN A 157 7.208 -8.799 -7.754 1.00 0.00 H ATOM 1397 N PHE A 158 6.146 -10.654 -10.024 1.00 10.97 N ATOM 1398 CA PHE A 158 5.457 -11.080 -11.248 1.00 10.45 C ATOM 1399 C PHE A 158 6.090 -10.492 -12.505 1.00 10.16 C ATOM 1400 O PHE A 158 6.781 -9.463 -12.451 1.00 10.67 O ATOM 1401 CB PHE A 158 3.979 -10.673 -11.216 1.00 10.69 C ATOM 1402 CG PHE A 158 3.184 -11.286 -10.084 1.00 11.36 C ATOM 1403 CD1 PHE A 158 3.525 -12.520 -9.543 1.00 12.15 C ATOM 1404 CD2 PHE A 158 2.076 -10.617 -9.573 1.00 11.84 C ATOM 1405 CE1 PHE A 158 2.773 -13.073 -8.508 1.00 12.10 C ATOM 1406 CE2 PHE A 158 1.316 -11.162 -8.548 1.00 12.44 C ATOM 1407 CZ PHE A 158 1.666 -12.386 -8.003 1.00 12.32 C ATOM 1408 H PHE A 158 6.134 -9.648 -9.760 1.00 0.00 H ATOM 1409 N GLY A 159 5.837 -11.145 -13.639 1.00 9.90 N ATOM 1410 CA GLY A 159 6.363 -10.704 -14.920 1.00 9.77 C ATOM 1411 C GLY A 159 6.934 -11.861 -15.715 1.00 9.20 C ATOM 1412 O GLY A 159 7.427 -12.832 -15.144 1.00 9.20 O ATOM 1413 H GLY A 159 5.244 -11.998 -13.606 1.00 0.00 H ATOM 1414 N PHE A 160 6.864 -11.759 -17.042 1.00 8.67 N ATOM 1415 CA PHE A 160 7.512 -12.745 -17.901 1.00 8.46 C ATOM 1416 C PHE A 160 9.021 -12.786 -17.686 1.00 8.85 C ATOM 1417 O PHE A 160 9.632 -13.847 -17.795 1.00 9.20 O ATOM 1418 CB PHE A 160 7.194 -12.485 -19.369 1.00 8.61 C ATOM 1419 CG PHE A 160 5.730 -12.512 -19.680 1.00 8.75 C ATOM 1420 CD1 PHE A 160 4.953 -13.618 -19.364 1.00 8.50 C ATOM 1421 CD2 PHE A 160 5.133 -11.433 -20.321 1.00 9.18 C ATOM 1422 CE1 PHE A 160 3.597 -13.646 -19.680 1.00 8.51 C ATOM 1423 CE2 PHE A 160 3.789 -11.450 -20.623 1.00 9.46 C ATOM 1424 CZ PHE A 160 3.020 -12.561 -20.312 1.00 8.88 C ATOM 1425 H PHE A 160 6.342 -10.968 -17.470 1.00 0.00 H ATOM 1426 N SER A 161 9.614 -11.645 -17.353 1.00 8.57 N ATOM 1427 CA SER A 161 11.048 -11.605 -17.114 1.00 9.28 C ATOM 1428 C SER A 161 11.412 -12.485 -15.917 1.00 9.50 C ATOM 1429 O SER A 161 12.487 -13.091 -15.882 1.00 10.02 O ATOM 1430 CB SER A 161 11.498 -10.174 -16.830 1.00 10.10 C ATOM 1431 OG SER A 161 10.879 -9.685 -15.648 1.00 10.78 O ATOM 1432 HG SER A 161 11.131 -10.260 -14.883 1.00 0.00 H ATOM 1433 H SER A 161 9.050 -10.776 -17.263 1.00 0.00 H ATOM 1434 N VAL A 162 10.517 -12.527 -14.933 1.00 10.02 N ATOM 1435 CA VAL A 162 10.724 -13.296 -13.712 1.00 10.63 C ATOM 1436 C VAL A 162 10.638 -14.790 -14.021 1.00 10.57 C ATOM 1437 O VAL A 162 11.479 -15.583 -13.590 1.00 10.80 O ATOM 1438 CB VAL A 162 9.688 -12.911 -12.629 1.00 11.09 C ATOM 1439 CG1 VAL A 162 9.915 -13.712 -11.366 1.00 11.26 C ATOM 1440 CG2 VAL A 162 9.750 -11.407 -12.332 1.00 11.37 C ATOM 1441 H VAL A 162 9.633 -11.989 -15.040 1.00 0.00 H ATOM 1442 N GLN A 163 9.625 -15.164 -14.795 1.00 9.90 N ATOM 1443 CA GLN A 163 9.479 -16.541 -15.253 1.00 9.58 C ATOM 1444 C GLN A 163 10.680 -16.973 -16.078 1.00 10.50 C ATOM 1445 O GLN A 163 11.220 -18.062 -15.886 1.00 10.84 O ATOM 1446 CB GLN A 163 8.206 -16.673 -16.085 1.00 8.81 C ATOM 1447 CG GLN A 163 6.947 -16.444 -15.265 1.00 8.55 C ATOM 1448 CD GLN A 163 5.728 -16.231 -16.128 1.00 8.88 C ATOM 1449 OE1 GLN A 163 5.790 -16.334 -17.358 1.00 9.28 O ATOM 1450 NE2 GLN A 163 4.619 -15.907 -15.498 1.00 9.61 N ATOM 1451 HE22 GLN A 163 4.613 -15.832 -14.461 1.00 0.00 H ATOM 1452 HE21 GLN A 163 3.748 -15.726 -16.037 1.00 0.00 H ATOM 1453 H GLN A 163 8.918 -14.457 -15.082 1.00 0.00 H ATOM 1454 N ARG A 164 11.110 -16.111 -16.993 1.00 10.70 N ATOM 1455 CA ARG A 164 12.274 -16.411 -17.807 1.00 10.70 C ATOM 1456 C ARG A 164 13.515 -16.686 -16.961 1.00 11.27 C ATOM 1457 O ARG A 164 14.245 -17.629 -17.222 1.00 11.44 O ATOM 1458 CB ARG A 164 12.565 -15.270 -18.776 1.00 11.50 C ATOM 1459 CG ARG A 164 13.905 -15.419 -19.475 1.00 12.91 C ATOM 1460 CD ARG A 164 14.175 -14.219 -20.358 1.00 14.65 C ATOM 1461 NE ARG A 164 15.484 -14.300 -20.999 1.00 16.35 N ATOM 1462 CZ ARG A 164 16.594 -13.745 -20.517 1.00 17.12 C ATOM 1463 NH1 ARG A 164 16.567 -13.054 -19.383 1.00 17.22 N ATOM 1464 NH2 ARG A 164 17.740 -13.877 -21.178 1.00 18.26 N ATOM 1465 HE ARG A 164 15.554 -14.827 -21.893 1.00 0.00 H ATOM 1466 HH12 ARG A 164 17.440 -12.624 -19.015 1.00 0.00 H ATOM 1467 HH11 ARG A 164 15.673 -12.943 -18.863 1.00 0.00 H ATOM 1468 HH22 ARG A 164 18.609 -13.445 -20.804 1.00 0.00 H ATOM 1469 HH21 ARG A 164 17.768 -14.413 -22.069 1.00 0.00 H ATOM 1470 H ARG A 164 10.607 -15.211 -17.128 1.00 0.00 H ATOM 1471 N ARG A 165 13.755 -15.872 -15.942 1.00 11.31 N ATOM 1472 CA ARG A 165 14.925 -16.120 -15.111 1.00 12.81 C ATOM 1473 C ARG A 165 14.819 -17.423 -14.310 1.00 12.55 C ATOM 1474 O ARG A 165 15.810 -18.127 -14.153 1.00 12.62 O ATOM 1475 CB ARG A 165 15.242 -14.915 -14.240 1.00 14.11 C ATOM 1476 CG ARG A 165 15.993 -13.866 -15.032 1.00 15.71 C ATOM 1477 CD ARG A 165 16.460 -12.704 -14.209 1.00 16.81 C ATOM 1478 NE ARG A 165 17.228 -11.802 -15.055 1.00 16.29 N ATOM 1479 CZ ARG A 165 18.548 -11.857 -15.207 1.00 17.00 C ATOM 1480 NH1 ARG A 165 19.266 -12.767 -14.551 1.00 17.65 N ATOM 1481 NH2 ARG A 165 19.146 -10.991 -16.011 1.00 17.17 N ATOM 1482 HE ARG A 165 16.710 -11.065 -15.575 1.00 0.00 H ATOM 1483 HH12 ARG A 165 20.298 -12.803 -14.675 1.00 0.00 H ATOM 1484 HH11 ARG A 165 18.795 -13.441 -13.914 1.00 0.00 H ATOM 1485 HH22 ARG A 165 20.178 -11.025 -16.137 1.00 0.00 H ATOM 1486 HH21 ARG A 165 18.584 -10.277 -16.516 1.00 0.00 H ATOM 1487 H ARG A 165 13.121 -15.073 -15.740 1.00 0.00 H ATOM 1488 N LEU A 166 13.617 -17.758 -13.848 1.00 12.38 N ATOM 1489 CA LEU A 166 13.402 -19.040 -13.180 1.00 12.22 C ATOM 1490 C LEU A 166 13.573 -20.201 -14.154 1.00 12.49 C ATOM 1491 O LEU A 166 14.086 -21.254 -13.791 1.00 13.09 O ATOM 1492 CB LEU A 166 12.029 -19.086 -12.506 1.00 12.50 C ATOM 1493 CG LEU A 166 11.922 -18.166 -11.281 1.00 13.12 C ATOM 1494 CD1 LEU A 166 10.479 -17.995 -10.861 1.00 13.18 C ATOM 1495 CD2 LEU A 166 12.772 -18.699 -10.123 1.00 13.90 C ATOM 1496 H LEU A 166 12.821 -17.099 -13.964 1.00 0.00 H ATOM 1497 N TRP A 167 13.162 -19.997 -15.397 1.00 12.33 N ATOM 1498 CA TRP A 167 13.332 -21.013 -16.427 1.00 12.59 C ATOM 1499 C TRP A 167 14.815 -21.257 -16.709 1.00 13.15 C ATOM 1500 O TRP A 167 15.265 -22.400 -16.788 1.00 13.28 O ATOM 1501 CB TRP A 167 12.594 -20.556 -17.675 1.00 13.87 C ATOM 1502 CG TRP A 167 12.710 -21.420 -18.876 1.00 14.51 C ATOM 1503 CD1 TRP A 167 12.226 -22.691 -19.041 1.00 14.80 C ATOM 1504 CD2 TRP A 167 13.277 -21.037 -20.131 1.00 14.83 C ATOM 1505 NE1 TRP A 167 12.497 -23.129 -20.316 1.00 14.70 N ATOM 1506 CE2 TRP A 167 13.134 -22.129 -21.005 1.00 14.94 C ATOM 1507 CE3 TRP A 167 13.916 -19.877 -20.592 1.00 15.01 C ATOM 1508 CZ2 TRP A 167 13.603 -22.097 -22.319 1.00 15.48 C ATOM 1509 CZ3 TRP A 167 14.380 -19.850 -21.902 1.00 14.84 C ATOM 1510 CH2 TRP A 167 14.220 -20.950 -22.744 1.00 15.39 C ATOM 1511 HE1 TRP A 167 12.258 -24.067 -20.696 1.00 0.00 H ATOM 1512 H TRP A 167 12.709 -19.094 -15.642 1.00 0.00 H ATOM 1513 N LEU A 168 15.571 -20.175 -16.837 1.00 13.31 N ATOM 1514 CA LEU A 168 17.018 -20.270 -17.012 1.00 13.95 C ATOM 1515 C LEU A 168 17.659 -20.996 -15.841 1.00 14.76 C ATOM 1516 O LEU A 168 18.601 -21.768 -16.025 1.00 15.35 O ATOM 1517 CB LEU A 168 17.640 -18.877 -17.165 1.00 14.40 C ATOM 1518 CG LEU A 168 17.266 -18.142 -18.448 1.00 14.31 C ATOM 1519 CD1 LEU A 168 17.882 -16.755 -18.435 1.00 14.38 C ATOM 1520 CD2 LEU A 168 17.726 -18.934 -19.660 1.00 14.27 C ATOM 1521 H LEU A 168 15.123 -19.237 -16.812 1.00 0.00 H ATOM 1522 N ALA A 169 17.137 -20.753 -14.641 1.00 15.73 N ATOM 1523 CA ALA A 169 17.656 -21.384 -13.426 1.00 17.07 C ATOM 1524 C ALA A 169 17.133 -22.811 -13.241 1.00 19.10 C ATOM 1525 O ALA A 169 17.469 -23.486 -12.261 1.00 20.91 O ATOM 1526 CB ALA A 169 17.316 -20.536 -12.216 1.00 17.17 C ATOM 1527 H ALA A 169 16.336 -20.095 -14.564 1.00 0.00 H ATOM 1528 N SER A 170 16.323 -23.266 -14.195 1.00 18.65 N ATOM 1529 CA SER A 170 15.775 -24.618 -14.208 1.00 18.89 C ATOM 1530 C SER A 170 16.378 -25.414 -15.358 1.00 18.93 C ATOM 1531 O SER A 170 15.823 -26.437 -15.780 1.00 19.15 O ATOM 1532 CB SER A 170 14.255 -24.573 -14.389 1.00 18.75 C ATOM 1533 OG SER A 170 13.637 -23.801 -13.374 1.00 19.21 O ATOM 1534 HG SER A 170 13.986 -22.875 -13.407 1.00 0.00 H ATOM 1535 H SER A 170 16.068 -22.624 -14.972 1.00 0.00 H ATOM 1536 N GLY A 171 17.503 -24.932 -15.878 1.00 18.64 N ATOM 1537 CA GLY A 171 18.132 -25.554 -17.029 1.00 18.45 C ATOM 1538 C GLY A 171 17.223 -25.597 -18.245 1.00 18.15 C ATOM 1539 O GLY A 171 17.338 -26.489 -19.084 1.00 18.70 O ATOM 1540 H GLY A 171 17.942 -24.091 -15.451 1.00 0.00 H ATOM 1541 N LYS A 172 16.320 -24.622 -18.326 1.00 17.05 N ATOM 1542 CA LYS A 172 15.329 -24.519 -19.399 1.00 17.05 C ATOM 1543 C LYS A 172 14.416 -25.742 -19.478 1.00 17.46 C ATOM 1544 O LYS A 172 13.814 -26.012 -20.519 1.00 17.66 O ATOM 1545 CB LYS A 172 15.994 -24.243 -20.757 1.00 16.73 C ATOM 1546 CG LYS A 172 16.745 -22.908 -20.832 1.00 16.82 C ATOM 1547 CD LYS A 172 17.293 -22.683 -22.225 1.00 16.72 C ATOM 1548 CE LYS A 172 18.052 -21.367 -22.330 1.00 17.16 C ATOM 1549 NZ LYS A 172 19.346 -21.418 -21.584 1.00 17.93 N ATOM 1550 HZ1 LYS A 172 19.158 -21.610 -20.579 1.00 0.00 H ATOM 1551 HZ2 LYS A 172 19.942 -22.174 -21.977 1.00 0.00 H ATOM 1552 HZ3 LYS A 172 19.835 -20.505 -21.678 1.00 0.00 H ATOM 1553 H LYS A 172 16.318 -23.892 -17.585 1.00 0.00 H ATOM 1554 N GLU A 173 14.300 -26.470 -18.374 1.00 17.37 N ATOM 1555 CA GLU A 173 13.372 -27.591 -18.315 1.00 18.27 C ATOM 1556 C GLU A 173 12.022 -27.117 -17.814 1.00 16.60 C ATOM 1557 O GLU A 173 11.866 -26.793 -16.639 1.00 16.19 O ATOM 1558 CB GLU A 173 13.900 -28.693 -17.403 1.00 20.77 C ATOM 1559 CG GLU A 173 15.128 -29.385 -17.951 1.00 23.20 C ATOM 1560 CD GLU A 173 15.521 -30.585 -17.132 1.00 25.56 C ATOM 1561 OE1 GLU A 173 16.612 -30.554 -16.527 1.00 26.59 O ATOM 1562 OE2 GLU A 173 14.740 -31.562 -17.094 1.00 26.65 O ATOM 1563 H GLU A 173 14.878 -26.237 -17.542 1.00 0.00 H ATOM 1564 N PHE A 174 11.042 -27.079 -18.702 1.00 16.16 N ATOM 1565 CA PHE A 174 9.731 -26.589 -18.315 1.00 15.75 C ATOM 1566 C PHE A 174 9.107 -27.424 -17.202 1.00 15.89 C ATOM 1567 O PHE A 174 8.411 -26.881 -16.344 1.00 15.51 O ATOM 1568 CB PHE A 174 8.811 -26.496 -19.527 1.00 15.97 C ATOM 1569 CG PHE A 174 9.100 -25.316 -20.402 1.00 16.37 C ATOM 1570 CD1 PHE A 174 8.741 -24.038 -19.995 1.00 16.52 C ATOM 1571 CD2 PHE A 174 9.735 -25.471 -21.623 1.00 16.80 C ATOM 1572 CE1 PHE A 174 8.996 -22.940 -20.796 1.00 16.60 C ATOM 1573 CE2 PHE A 174 9.994 -24.371 -22.440 1.00 16.94 C ATOM 1574 CZ PHE A 174 9.630 -23.105 -22.020 1.00 16.89 C ATOM 1575 H PHE A 174 11.211 -27.400 -19.677 1.00 0.00 H ATOM 1576 N THR A 175 9.375 -28.729 -17.194 1.00 16.80 N ATOM 1577 CA THR A 175 8.840 -29.588 -16.134 1.00 17.50 C ATOM 1578 C THR A 175 9.357 -29.200 -14.752 1.00 16.12 C ATOM 1579 O THR A 175 8.697 -29.454 -13.751 1.00 16.21 O ATOM 1580 CB THR A 175 9.119 -31.086 -16.393 1.00 19.82 C ATOM 1581 OG1 THR A 175 10.534 -31.310 -16.441 1.00 21.42 O ATOM 1582 CG2 THR A 175 8.488 -31.523 -17.695 1.00 20.39 C ATOM 1583 HG1 THR A 175 10.928 -30.770 -17.172 1.00 0.00 H ATOM 1584 H THR A 175 9.967 -29.140 -17.944 1.00 0.00 H ATOM 1585 N LYS A 176 10.539 -28.592 -14.699 1.00 15.41 N ATOM 1586 CA LYS A 176 11.052 -28.069 -13.439 1.00 15.33 C ATOM 1587 C LYS A 176 10.508 -26.674 -13.149 1.00 14.96 C ATOM 1588 O LYS A 176 10.413 -26.269 -11.991 1.00 16.02 O ATOM 1589 CB LYS A 176 12.580 -28.054 -13.445 1.00 16.87 C ATOM 1590 CG LYS A 176 13.186 -29.444 -13.417 1.00 18.77 C ATOM 1591 CD LYS A 176 14.700 -29.370 -13.562 1.00 20.53 C ATOM 1592 CE LYS A 176 15.371 -30.689 -13.206 1.00 22.16 C ATOM 1593 NZ LYS A 176 14.905 -31.828 -14.039 1.00 23.36 N ATOM 1594 HZ1 LYS A 176 13.880 -31.952 -13.912 1.00 0.00 H ATOM 1595 HZ2 LYS A 176 15.110 -31.631 -15.039 1.00 0.00 H ATOM 1596 HZ3 LYS A 176 15.400 -32.695 -13.747 1.00 0.00 H ATOM 1597 H LYS A 176 11.103 -28.489 -15.566 1.00 0.00 H ATOM 1598 N LEU A 177 10.149 -25.935 -14.198 1.00 13.45 N ATOM 1599 CA LEU A 177 9.629 -24.589 -14.014 1.00 12.58 C ATOM 1600 C LEU A 177 8.219 -24.578 -13.412 1.00 12.41 C ATOM 1601 O LEU A 177 7.934 -23.788 -12.514 1.00 12.60 O ATOM 1602 CB LEU A 177 9.642 -23.831 -15.343 1.00 12.15 C ATOM 1603 CG LEU A 177 9.033 -22.429 -15.266 1.00 11.50 C ATOM 1604 CD1 LEU A 177 9.897 -21.523 -14.402 1.00 11.76 C ATOM 1605 CD2 LEU A 177 8.880 -21.865 -16.667 1.00 12.40 C ATOM 1606 H LEU A 177 10.241 -26.324 -15.158 1.00 0.00 H ATOM 1607 N TRP A 178 7.337 -25.447 -13.896 1.00 12.15 N ATOM 1608 CA TRP A 178 5.942 -25.381 -13.463 1.00 13.06 C ATOM 1609 C TRP A 178 5.729 -25.441 -11.947 1.00 13.47 C ATOM 1610 O TRP A 178 4.957 -24.646 -11.413 1.00 13.42 O ATOM 1611 CB TRP A 178 5.061 -26.434 -14.141 1.00 13.65 C ATOM 1612 CG TRP A 178 5.195 -26.559 -15.621 1.00 14.26 C ATOM 1613 CD1 TRP A 178 5.283 -27.727 -16.322 1.00 14.72 C ATOM 1614 CD2 TRP A 178 5.222 -25.502 -16.596 1.00 14.11 C ATOM 1615 NE1 TRP A 178 5.374 -27.468 -17.665 1.00 14.73 N ATOM 1616 CE2 TRP A 178 5.344 -26.115 -17.864 1.00 14.24 C ATOM 1617 CE3 TRP A 178 5.177 -24.103 -16.523 1.00 13.79 C ATOM 1618 CZ2 TRP A 178 5.404 -25.381 -19.051 1.00 14.53 C ATOM 1619 CZ3 TRP A 178 5.241 -23.371 -17.712 1.00 13.75 C ATOM 1620 CH2 TRP A 178 5.353 -24.015 -18.956 1.00 13.93 C ATOM 1621 HE1 TRP A 178 5.453 -28.186 -18.413 1.00 0.00 H ATOM 1622 H TRP A 178 7.638 -26.171 -14.580 1.00 0.00 H ATOM 1623 N PRO A 179 6.393 -26.382 -11.248 1.00 14.36 N ATOM 1624 CA PRO A 179 6.147 -26.397 -9.797 1.00 14.97 C ATOM 1625 C PRO A 179 6.718 -25.163 -9.112 1.00 14.86 C ATOM 1626 O PRO A 179 6.151 -24.686 -8.124 1.00 15.53 O ATOM 1627 CB PRO A 179 6.893 -27.647 -9.308 1.00 15.71 C ATOM 1628 CG PRO A 179 7.239 -28.422 -10.514 1.00 15.82 C ATOM 1629 CD PRO A 179 7.220 -27.517 -11.695 1.00 15.26 C ATOM 1630 N LYS A 180 7.826 -24.638 -9.627 1.00 14.53 N ATOM 1631 CA LYS A 180 8.423 -23.453 -9.015 1.00 14.64 C ATOM 1632 C LYS A 180 7.462 -22.278 -9.023 1.00 13.66 C ATOM 1633 O LYS A 180 7.343 -21.553 -8.031 1.00 13.61 O ATOM 1634 CB LYS A 180 9.720 -23.058 -9.719 1.00 15.80 C ATOM 1635 CG LYS A 180 10.835 -24.060 -9.523 1.00 17.34 C ATOM 1636 CD LYS A 180 12.131 -23.562 -10.135 1.00 18.36 C ATOM 1637 CE LYS A 180 13.215 -24.636 -10.065 1.00 19.28 C ATOM 1638 NZ LYS A 180 14.503 -24.156 -10.673 1.00 19.87 N ATOM 1639 HZ1 LYS A 180 14.344 -23.912 -11.671 1.00 0.00 H ATOM 1640 HZ2 LYS A 180 14.836 -23.316 -10.158 1.00 0.00 H ATOM 1641 HZ3 LYS A 180 15.217 -24.909 -10.609 1.00 0.00 H ATOM 1642 H LYS A 180 8.267 -25.070 -10.464 1.00 0.00 H ATOM 1643 N ILE A 181 6.764 -22.099 -10.140 1.00 12.66 N ATOM 1644 CA ILE A 181 5.874 -20.942 -10.290 1.00 11.89 C ATOM 1645 C ILE A 181 4.414 -21.253 -9.950 1.00 12.16 C ATOM 1646 O ILE A 181 3.554 -20.385 -10.070 1.00 12.80 O ATOM 1647 CB ILE A 181 6.016 -20.242 -11.670 1.00 11.45 C ATOM 1648 CG1 ILE A 181 5.518 -21.141 -12.799 1.00 11.51 C ATOM 1649 CG2 ILE A 181 7.473 -19.795 -11.876 1.00 11.10 C ATOM 1650 CD1 ILE A 181 5.608 -20.474 -14.171 1.00 11.19 C ATOM 1651 H ILE A 181 6.850 -22.786 -10.916 1.00 0.00 H ATOM 1652 N GLY A 182 4.142 -22.487 -9.518 1.00 12.10 N ATOM 1653 CA GLY A 182 2.824 -22.841 -9.015 1.00 12.41 C ATOM 1654 C GLY A 182 1.801 -23.257 -10.057 1.00 12.35 C ATOM 1655 O GLY A 182 0.598 -23.227 -9.788 1.00 12.84 O ATOM 1656 H GLY A 182 4.889 -23.211 -9.542 1.00 0.00 H ATOM 1657 N TRP A 183 2.263 -23.641 -11.245 1.00 12.50 N ATOM 1658 CA TRP A 183 1.332 -24.000 -12.323 1.00 12.94 C ATOM 1659 C TRP A 183 1.051 -25.492 -12.382 1.00 14.12 C ATOM 1660 O TRP A 183 0.133 -25.940 -13.068 1.00 13.94 O ATOM 1661 CB TRP A 183 1.821 -23.507 -13.685 1.00 12.25 C ATOM 1662 CG TRP A 183 1.892 -22.017 -13.808 1.00 11.08 C ATOM 1663 CD1 TRP A 183 1.606 -21.092 -12.845 1.00 10.64 C ATOM 1664 CD2 TRP A 183 2.268 -21.278 -14.974 1.00 10.78 C ATOM 1665 NE1 TRP A 183 1.791 -19.823 -13.337 1.00 9.95 N ATOM 1666 CE2 TRP A 183 2.198 -19.907 -14.640 1.00 10.55 C ATOM 1667 CE3 TRP A 183 2.674 -21.641 -16.268 1.00 11.18 C ATOM 1668 CZ2 TRP A 183 2.521 -18.898 -15.547 1.00 10.43 C ATOM 1669 CZ3 TRP A 183 2.998 -20.647 -17.161 1.00 10.93 C ATOM 1670 CH2 TRP A 183 2.923 -19.287 -16.801 1.00 10.48 C ATOM 1671 HE1 TRP A 183 1.645 -18.941 -12.805 1.00 0.00 H ATOM 1672 H TRP A 183 3.289 -23.687 -11.411 1.00 0.00 H ATOM 1673 N LYS A 184 1.854 -26.256 -11.657 1.00 15.54 N ATOM 1674 CA LYS A 184 1.616 -27.673 -11.517 1.00 17.79 C ATOM 1675 C LYS A 184 2.045 -28.041 -10.105 1.00 19.03 C ATOM 1676 O LYS A 184 2.961 -27.434 -9.547 1.00 19.30 O ATOM 1677 CB LYS A 184 2.399 -28.437 -12.587 1.00 18.89 C ATOM 1678 CG LYS A 184 1.756 -29.731 -13.041 1.00 20.31 C ATOM 1679 CD LYS A 184 2.489 -30.293 -14.244 1.00 20.89 C ATOM 1680 CE LYS A 184 1.976 -31.682 -14.586 1.00 21.71 C ATOM 1681 NZ LYS A 184 2.639 -32.222 -15.804 1.00 22.25 N ATOM 1682 HZ1 LYS A 184 2.448 -31.592 -16.609 1.00 0.00 H ATOM 1683 HZ2 LYS A 184 3.665 -32.279 -15.642 1.00 0.00 H ATOM 1684 HZ3 LYS A 184 2.266 -33.171 -16.009 1.00 0.00 H ATOM 1685 H LYS A 184 2.672 -25.827 -11.179 1.00 0.00 H ATOM 1686 N SER A 185 1.337 -28.996 -9.517 1.00 20.19 N ATOM 1687 CA SER A 185 1.655 -29.503 -8.190 1.00 22.30 C ATOM 1688 C SER A 185 1.713 -31.002 -8.363 1.00 23.18 C ATOM 1689 O SER A 185 0.680 -31.651 -8.511 1.00 23.46 O ATOM 1690 CB SER A 185 0.559 -29.108 -7.195 1.00 23.61 C ATOM 1691 OG SER A 185 0.891 -29.482 -5.860 1.00 24.39 O ATOM 1692 HG SER A 185 1.731 -29.031 -5.591 1.00 0.00 H ATOM 1693 H SER A 185 0.523 -29.398 -10.024 1.00 0.00 H ATOM 1694 N GLY A 186 2.922 -31.552 -8.379 1.00 24.12 N ATOM 1695 CA GLY A 186 3.105 -32.935 -8.771 1.00 24.65 C ATOM 1696 C GLY A 186 2.585 -33.175 -10.178 1.00 25.30 C ATOM 1697 O GLY A 186 2.974 -32.497 -11.134 1.00 25.06 O ATOM 1698 H GLY A 186 3.748 -30.982 -8.107 1.00 0.00 H ATOM 1699 N ASN A 187 1.686 -34.141 -10.307 1.00 26.11 N ATOM 1700 CA ASN A 187 1.142 -34.504 -11.609 1.00 26.87 C ATOM 1701 C ASN A 187 -0.104 -33.684 -11.961 1.00 25.60 C ATOM 1702 O ASN A 187 -0.679 -33.838 -13.036 1.00 25.95 O ATOM 1703 CB ASN A 187 0.808 -35.997 -11.623 1.00 28.86 C ATOM 1704 CG ASN A 187 1.015 -36.628 -12.982 1.00 30.37 C ATOM 1705 OD1 ASN A 187 0.101 -36.675 -13.805 1.00 31.24 O ATOM 1706 ND2 ASN A 187 2.225 -37.128 -13.224 1.00 30.97 N ATOM 1707 HD22 ASN A 187 2.968 -37.066 -12.499 1.00 0.00 H ATOM 1708 HD21 ASN A 187 2.427 -37.581 -14.138 1.00 0.00 H ATOM 1709 H ASN A 187 1.362 -34.651 -9.460 1.00 0.00 H ATOM 1710 N VAL A 188 -0.520 -32.819 -11.044 1.00 24.23 N ATOM 1711 CA VAL A 188 -1.768 -32.075 -11.199 1.00 23.04 C ATOM 1712 C VAL A 188 -1.521 -30.656 -11.713 1.00 20.87 C ATOM 1713 O VAL A 188 -0.875 -29.856 -11.043 1.00 20.70 O ATOM 1714 CB VAL A 188 -2.517 -31.978 -9.848 1.00 23.89 C ATOM 1715 CG1 VAL A 188 -3.879 -31.322 -10.035 1.00 24.14 C ATOM 1716 CG2 VAL A 188 -2.660 -33.355 -9.206 1.00 24.24 C ATOM 1717 H VAL A 188 0.058 -32.667 -10.193 1.00 0.00 H ATOM 1718 N TRP A 189 -2.044 -30.335 -12.895 1.00 19.32 N ATOM 1719 CA TRP A 189 -1.994 -28.956 -13.378 1.00 17.91 C ATOM 1720 C TRP A 189 -2.914 -28.085 -12.540 1.00 17.40 C ATOM 1721 O TRP A 189 -4.021 -28.493 -12.179 1.00 18.09 O ATOM 1722 CB TRP A 189 -2.423 -28.864 -14.845 1.00 17.40 C ATOM 1723 CG TRP A 189 -1.398 -29.363 -15.816 1.00 17.24 C ATOM 1724 CD1 TRP A 189 -1.348 -30.602 -16.392 1.00 17.32 C ATOM 1725 CD2 TRP A 189 -0.287 -28.629 -16.344 1.00 16.85 C ATOM 1726 NE1 TRP A 189 -0.271 -30.682 -17.243 1.00 17.63 N ATOM 1727 CE2 TRP A 189 0.402 -29.487 -17.223 1.00 17.16 C ATOM 1728 CE3 TRP A 189 0.201 -27.330 -16.148 1.00 16.84 C ATOM 1729 CZ2 TRP A 189 1.541 -29.083 -17.919 1.00 17.03 C ATOM 1730 CZ3 TRP A 189 1.335 -26.937 -16.833 1.00 17.27 C ATOM 1731 CH2 TRP A 189 1.996 -27.813 -17.704 1.00 17.20 C ATOM 1732 HE1 TRP A 189 -0.009 -31.514 -17.810 1.00 0.00 H ATOM 1733 H TRP A 189 -2.491 -31.071 -13.479 1.00 0.00 H ATOM 1734 N THR A 190 -2.454 -26.882 -12.228 1.00 16.56 N ATOM 1735 CA THR A 190 -3.297 -25.913 -11.555 1.00 16.92 C ATOM 1736 C THR A 190 -4.472 -25.572 -12.469 1.00 17.84 C ATOM 1737 O THR A 190 -4.289 -25.326 -13.657 1.00 17.85 O ATOM 1738 CB THR A 190 -2.472 -24.675 -11.194 1.00 16.87 C ATOM 1739 OG1 THR A 190 -1.345 -25.102 -10.421 1.00 17.22 O ATOM 1740 CG2 THR A 190 -3.297 -23.669 -10.395 1.00 16.66 C ATOM 1741 HG1 THR A 190 -0.797 -24.315 -10.176 1.00 0.00 H ATOM 1742 H THR A 190 -1.474 -26.629 -12.469 1.00 0.00 H ATOM 1743 N ARG A 191 -5.678 -25.595 -11.912 1.00 18.65 N ATOM 1744 CA ARG A 191 -6.898 -25.446 -12.701 1.00 19.44 C ATOM 1745 C ARG A 191 -7.305 -23.980 -12.788 1.00 19.53 C ATOM 1746 O ARG A 191 -7.396 -23.294 -11.772 1.00 20.07 O ATOM 1747 CB ARG A 191 -8.035 -26.260 -12.074 1.00 20.02 C ATOM 1748 H ARG A 191 -5.756 -25.723 -10.883 1.00 0.00 H ATOM 1749 N TRP A 192 -7.534 -23.501 -14.004 1.00 18.88 N ATOM 1750 CA TRP A 192 -7.952 -22.123 -14.216 1.00 18.88 C ATOM 1751 C TRP A 192 -9.471 -22.027 -14.141 1.00 20.15 C ATOM 1752 O TRP A 192 -10.162 -22.884 -14.682 1.00 21.16 O ATOM 1753 CB TRP A 192 -7.483 -21.667 -15.592 1.00 18.59 C ATOM 1754 CG TRP A 192 -7.806 -20.248 -15.893 1.00 18.20 C ATOM 1755 CD1 TRP A 192 -7.061 -19.151 -15.569 1.00 18.20 C ATOM 1756 CD2 TRP A 192 -8.970 -19.758 -16.571 1.00 18.26 C ATOM 1757 NE1 TRP A 192 -7.678 -18.014 -16.013 1.00 18.21 N ATOM 1758 CE2 TRP A 192 -8.854 -18.356 -16.630 1.00 18.41 C ATOM 1759 CE3 TRP A 192 -10.093 -20.371 -17.140 1.00 18.76 C ATOM 1760 CZ2 TRP A 192 -9.816 -17.555 -17.230 1.00 18.82 C ATOM 1761 CZ3 TRP A 192 -11.049 -19.573 -17.735 1.00 19.08 C ATOM 1762 CH2 TRP A 192 -10.905 -18.180 -17.778 1.00 18.88 C ATOM 1763 HE1 TRP A 192 -7.314 -17.046 -15.901 1.00 0.00 H ATOM 1764 H TRP A 192 -7.412 -24.126 -14.826 1.00 0.00 H ATOM 1765 N PRO A 193 -9.998 -20.974 -13.500 1.00 20.44 N ATOM 1766 CA PRO A 193 -9.272 -19.871 -12.863 1.00 21.20 C ATOM 1767 C PRO A 193 -9.094 -19.996 -11.349 1.00 21.47 C ATOM 1768 O PRO A 193 -8.237 -19.314 -10.783 1.00 21.79 O ATOM 1769 CB PRO A 193 -10.161 -18.667 -13.174 1.00 21.40 C ATOM 1770 CG PRO A 193 -11.545 -19.237 -13.152 1.00 21.27 C ATOM 1771 CD PRO A 193 -11.433 -20.659 -13.667 1.00 20.90 C ATOM 1772 N LYS A 194 -9.866 -20.866 -10.705 1.00 21.53 N ATOM 1773 CA LYS A 194 -9.914 -20.890 -9.242 1.00 21.97 C ATOM 1774 C LYS A 194 -8.657 -21.430 -8.552 1.00 21.70 C ATOM 1775 O LYS A 194 -8.413 -21.125 -7.388 1.00 22.39 O ATOM 1776 CB LYS A 194 -11.145 -21.664 -8.754 1.00 22.64 C ATOM 1777 H LYS A 194 -10.444 -21.539 -11.248 1.00 0.00 H ATOM 1778 N GLY A 195 -7.872 -22.240 -9.252 1.00 20.33 N ATOM 1779 CA GLY A 195 -6.709 -22.864 -8.640 1.00 19.61 C ATOM 1780 C GLY A 195 -5.541 -21.915 -8.449 1.00 18.87 C ATOM 1781 O GLY A 195 -4.615 -22.194 -7.685 1.00 18.69 O ATOM 1782 H GLY A 195 -8.091 -22.431 -10.251 1.00 0.00 H ATOM 1783 N PHE A 196 -5.579 -20.786 -9.143 1.00 17.95 N ATOM 1784 CA PHE A 196 -4.450 -19.866 -9.118 1.00 17.45 C ATOM 1785 C PHE A 196 -4.541 -18.891 -7.954 1.00 18.21 C ATOM 1786 O PHE A 196 -5.603 -18.732 -7.351 1.00 18.86 O ATOM 1787 CB PHE A 196 -4.335 -19.142 -10.462 1.00 16.59 C ATOM 1788 CG PHE A 196 -3.926 -20.052 -11.567 1.00 16.04 C ATOM 1789 CD1 PHE A 196 -2.585 -20.311 -11.795 1.00 15.76 C ATOM 1790 CD2 PHE A 196 -4.879 -20.704 -12.333 1.00 15.75 C ATOM 1791 CE1 PHE A 196 -2.191 -21.182 -12.791 1.00 15.45 C ATOM 1792 CE2 PHE A 196 -4.495 -21.573 -13.342 1.00 15.22 C ATOM 1793 CZ PHE A 196 -3.148 -21.812 -13.571 1.00 14.81 C ATOM 1794 H PHE A 196 -6.421 -20.556 -9.709 1.00 0.00 H ATOM 1795 N THR A 197 -3.415 -18.257 -7.644 1.00 18.74 N ATOM 1796 CA THR A 197 -3.301 -17.357 -6.505 1.00 19.14 C ATOM 1797 C THR A 197 -3.167 -15.920 -6.994 1.00 19.09 C ATOM 1798 O THR A 197 -2.116 -15.500 -7.483 1.00 19.18 O ATOM 1799 CB THR A 197 -2.109 -17.744 -5.614 1.00 19.73 C ATOM 1800 OG1 THR A 197 -2.296 -19.082 -5.132 1.00 19.96 O ATOM 1801 CG2 THR A 197 -2.001 -16.792 -4.429 1.00 20.09 C ATOM 1802 HG1 THR A 197 -2.353 -19.703 -5.901 1.00 0.00 H ATOM 1803 H THR A 197 -2.578 -18.410 -8.242 1.00 0.00 H ATOM 1804 N TRP A 198 -4.254 -15.171 -6.867 1.00 18.69 N ATOM 1805 CA TRP A 198 -4.355 -13.861 -7.488 1.00 19.12 C ATOM 1806 C TRP A 198 -3.905 -12.746 -6.556 1.00 19.30 C ATOM 1807 O TRP A 198 -4.486 -11.665 -6.546 1.00 19.47 O ATOM 1808 CB TRP A 198 -5.790 -13.628 -7.947 1.00 19.50 C ATOM 1809 CG TRP A 198 -6.270 -14.676 -8.894 1.00 19.47 C ATOM 1810 CD1 TRP A 198 -7.183 -15.665 -8.641 1.00 19.58 C ATOM 1811 CD2 TRP A 198 -5.852 -14.852 -10.250 1.00 19.27 C ATOM 1812 NE1 TRP A 198 -7.358 -16.444 -9.765 1.00 19.72 N ATOM 1813 CE2 TRP A 198 -6.555 -15.961 -10.766 1.00 19.69 C ATOM 1814 CE3 TRP A 198 -4.951 -14.178 -11.080 1.00 18.86 C ATOM 1815 CZ2 TRP A 198 -6.386 -16.407 -12.075 1.00 19.53 C ATOM 1816 CZ3 TRP A 198 -4.787 -14.622 -12.389 1.00 18.69 C ATOM 1817 CH2 TRP A 198 -5.501 -15.725 -12.870 1.00 19.07 C ATOM 1818 HE1 TRP A 198 -7.994 -17.263 -9.841 1.00 0.00 H ATOM 1819 H TRP A 198 -5.055 -15.530 -6.309 1.00 0.00 H ATOM 1820 N ASP A 199 -2.867 -13.009 -5.772 1.00 19.41 N ATOM 1821 CA ASP A 199 -2.320 -11.989 -4.884 1.00 19.57 C ATOM 1822 C ASP A 199 -0.830 -12.212 -4.671 1.00 18.58 C ATOM 1823 O ASP A 199 -0.259 -13.164 -5.198 1.00 17.92 O ATOM 1824 CB ASP A 199 -3.080 -11.938 -3.550 1.00 21.25 C ATOM 1825 CG ASP A 199 -3.038 -13.250 -2.800 1.00 22.73 C ATOM 1826 OD1 ASP A 199 -4.110 -13.725 -2.360 1.00 23.86 O ATOM 1827 OD2 ASP A 199 -1.935 -13.802 -2.630 1.00 23.17 O ATOM 1828 H ASP A 199 -2.437 -13.956 -5.791 1.00 0.00 H ATOM 1829 N LEU A 200 -0.204 -11.331 -3.901 1.00 18.54 N ATOM 1830 CA LEU A 200 1.245 -11.378 -3.714 1.00 18.71 C ATOM 1831 C LEU A 200 1.726 -12.482 -2.769 1.00 19.24 C ATOM 1832 O LEU A 200 2.923 -12.601 -2.509 1.00 19.48 O ATOM 1833 CB LEU A 200 1.779 -10.013 -3.274 1.00 18.72 C ATOM 1834 CG LEU A 200 1.744 -8.921 -4.344 1.00 18.66 C ATOM 1835 CD1 LEU A 200 2.293 -7.613 -3.804 1.00 18.99 C ATOM 1836 CD2 LEU A 200 2.516 -9.348 -5.572 1.00 18.48 C ATOM 1837 H LEU A 200 -0.756 -10.592 -3.421 1.00 0.00 H ATOM 1838 N SER A 201 0.810 -13.294 -2.260 1.00 19.55 N ATOM 1839 CA SER A 201 1.233 -14.479 -1.523 1.00 19.69 C ATOM 1840 C SER A 201 1.650 -15.591 -2.496 1.00 18.72 C ATOM 1841 O SER A 201 2.243 -16.587 -2.091 1.00 18.92 O ATOM 1842 CB SER A 201 0.145 -14.960 -0.556 1.00 20.58 C ATOM 1843 OG SER A 201 -0.913 -15.613 -1.235 1.00 21.64 O ATOM 1844 HG SER A 201 -1.326 -14.986 -1.881 1.00 0.00 H ATOM 1845 H SER A 201 -0.202 -13.088 -2.385 1.00 0.00 H ATOM 1846 N ALA A 202 1.351 -15.397 -3.780 1.00 17.54 N ATOM 1847 CA ALA A 202 1.710 -16.353 -4.830 1.00 16.77 C ATOM 1848 C ALA A 202 3.225 -16.490 -4.973 1.00 15.81 C ATOM 1849 O ALA A 202 3.969 -15.568 -4.637 1.00 15.77 O ATOM 1850 CB ALA A 202 1.101 -15.911 -6.159 1.00 16.99 C ATOM 1851 H ALA A 202 0.842 -14.531 -4.048 1.00 0.00 H ATOM 1852 N PRO A 203 3.691 -17.643 -5.478 1.00 15.26 N ATOM 1853 CA PRO A 203 5.134 -17.801 -5.671 1.00 15.34 C ATOM 1854 C PRO A 203 5.684 -16.843 -6.720 1.00 14.50 C ATOM 1855 O PRO A 203 4.940 -16.368 -7.576 1.00 13.87 O ATOM 1856 CB PRO A 203 5.281 -19.252 -6.147 1.00 15.93 C ATOM 1857 CG PRO A 203 3.945 -19.665 -6.585 1.00 16.15 C ATOM 1858 CD PRO A 203 2.948 -18.873 -5.800 1.00 15.67 C ATOM 1859 N GLN A 204 6.972 -16.541 -6.612 1.00 14.31 N ATOM 1860 CA GLN A 204 7.674 -15.748 -7.605 1.00 14.67 C ATOM 1861 C GLN A 204 7.399 -16.308 -8.988 1.00 13.17 C ATOM 1862 O GLN A 204 7.511 -17.511 -9.209 1.00 13.33 O ATOM 1863 CB GLN A 204 9.174 -15.811 -7.317 1.00 17.18 C ATOM 1864 CG GLN A 204 10.031 -14.839 -8.093 1.00 19.90 C ATOM 1865 CD GLN A 204 11.522 -15.085 -7.874 1.00 22.48 C ATOM 1866 OE1 GLN A 204 11.912 -15.928 -7.064 1.00 24.45 O ATOM 1867 NE2 GLN A 204 12.355 -14.363 -8.609 1.00 23.20 N ATOM 1868 HE22 GLN A 204 11.982 -13.662 -9.281 1.00 0.00 H ATOM 1869 HE21 GLN A 204 13.382 -14.497 -8.514 1.00 0.00 H ATOM 1870 H GLN A 204 7.499 -16.886 -5.784 1.00 0.00 H ATOM 1871 N GLY A 205 7.014 -15.434 -9.911 1.00 11.97 N ATOM 1872 CA GLY A 205 6.768 -15.846 -11.286 1.00 11.43 C ATOM 1873 C GLY A 205 5.382 -16.404 -11.577 1.00 10.83 C ATOM 1874 O GLY A 205 5.115 -16.847 -12.691 1.00 10.43 O ATOM 1875 H GLY A 205 6.886 -14.436 -9.647 1.00 0.00 H ATOM 1876 N HIS A 206 4.492 -16.390 -10.589 1.00 11.05 N ATOM 1877 CA HIS A 206 3.178 -17.016 -10.741 1.00 11.05 C ATOM 1878 C HIS A 206 2.350 -16.401 -11.870 1.00 10.74 C ATOM 1879 O HIS A 206 1.613 -17.109 -12.546 1.00 10.81 O ATOM 1880 CB HIS A 206 2.392 -16.903 -9.427 1.00 11.81 C ATOM 1881 CG HIS A 206 1.155 -17.755 -9.356 1.00 12.39 C ATOM 1882 ND1 HIS A 206 1.189 -19.133 -9.395 1.00 12.69 N ATOM 1883 CD2 HIS A 206 -0.142 -17.419 -9.150 1.00 12.61 C ATOM 1884 CE1 HIS A 206 -0.036 -19.609 -9.253 1.00 13.22 C ATOM 1885 NE2 HIS A 206 -0.863 -18.590 -9.100 1.00 13.20 N ATOM 1886 H HIS A 206 4.735 -15.925 -9.691 1.00 0.00 H ATOM 1887 N LEU A 207 2.454 -15.083 -12.040 1.00 10.23 N ATOM 1888 CA LEU A 207 1.698 -14.344 -13.066 1.00 9.67 C ATOM 1889 C LEU A 207 2.670 -13.553 -13.939 1.00 9.13 C ATOM 1890 O LEU A 207 3.757 -13.219 -13.485 1.00 9.00 O ATOM 1891 CB LEU A 207 0.728 -13.378 -12.385 1.00 10.58 C ATOM 1892 CG LEU A 207 -0.310 -14.041 -11.484 1.00 10.70 C ATOM 1893 CD1 LEU A 207 -1.189 -12.979 -10.843 1.00 10.47 C ATOM 1894 CD2 LEU A 207 -1.156 -15.049 -12.269 1.00 10.69 C ATOM 1895 H LEU A 207 3.098 -14.552 -11.420 1.00 0.00 H ATOM 1896 N PRO A 208 2.286 -13.230 -15.189 1.00 8.55 N ATOM 1897 CA PRO A 208 1.015 -13.562 -15.850 1.00 8.76 C ATOM 1898 C PRO A 208 0.955 -15.016 -16.291 1.00 9.05 C ATOM 1899 O PRO A 208 1.985 -15.639 -16.503 1.00 9.36 O ATOM 1900 CB PRO A 208 1.006 -12.652 -17.088 1.00 9.12 C ATOM 1901 CG PRO A 208 2.100 -11.654 -16.877 1.00 8.87 C ATOM 1902 CD PRO A 208 3.123 -12.354 -16.025 1.00 8.88 C ATOM 1903 N LEU A 209 -0.251 -15.544 -16.431 1.00 8.80 N ATOM 1904 CA LEU A 209 -0.422 -16.936 -16.846 1.00 8.57 C ATOM 1905 C LEU A 209 -0.233 -17.143 -18.345 1.00 9.47 C ATOM 1906 O LEU A 209 -0.618 -16.300 -19.158 1.00 10.81 O ATOM 1907 CB LEU A 209 -1.813 -17.432 -16.444 1.00 8.91 C ATOM 1908 CG LEU A 209 -2.146 -17.373 -14.954 1.00 9.66 C ATOM 1909 CD1 LEU A 209 -3.525 -17.982 -14.707 1.00 10.02 C ATOM 1910 CD2 LEU A 209 -1.084 -18.099 -14.152 1.00 10.28 C ATOM 1911 H LEU A 209 -1.090 -14.959 -16.243 1.00 0.00 H ATOM 1912 N LEU A 210 0.358 -18.282 -18.691 1.00 9.32 N ATOM 1913 CA LEU A 210 0.455 -18.728 -20.075 1.00 9.14 C ATOM 1914 C LEU A 210 -0.172 -20.112 -20.168 1.00 9.60 C ATOM 1915 O LEU A 210 0.422 -21.115 -19.762 1.00 10.50 O ATOM 1916 CB LEU A 210 1.915 -18.779 -20.535 1.00 9.22 C ATOM 1917 CG LEU A 210 2.620 -17.426 -20.562 1.00 9.24 C ATOM 1918 CD1 LEU A 210 4.141 -17.605 -20.642 1.00 9.83 C ATOM 1919 CD2 LEU A 210 2.108 -16.567 -21.731 1.00 9.70 C ATOM 1920 H LEU A 210 0.768 -18.879 -17.944 1.00 0.00 H ATOM 1921 N ASN A 211 -1.388 -20.160 -20.689 1.00 9.30 N ATOM 1922 CA ASN A 211 -2.122 -21.421 -20.795 1.00 9.76 C ATOM 1923 C ASN A 211 -1.302 -22.474 -21.536 1.00 10.02 C ATOM 1924 O ASN A 211 -0.746 -22.192 -22.593 1.00 10.43 O ATOM 1925 CB ASN A 211 -3.428 -21.153 -21.535 1.00 10.08 C ATOM 1926 CG ASN A 211 -4.354 -22.357 -21.584 1.00 11.67 C ATOM 1927 OD1 ASN A 211 -4.076 -23.434 -21.040 1.00 12.40 O ATOM 1928 ND2 ASN A 211 -5.490 -22.158 -22.228 1.00 12.17 N ATOM 1929 HD22 ASN A 211 -5.682 -21.237 -22.671 1.00 0.00 H ATOM 1930 HD21 ASN A 211 -6.192 -22.923 -22.292 1.00 0.00 H ATOM 1931 H ASN A 211 -1.831 -19.283 -21.030 1.00 0.00 H ATOM 1932 N GLN A 212 -1.220 -23.680 -20.978 1.00 10.09 N ATOM 1933 CA GLN A 212 -0.433 -24.758 -21.588 1.00 10.04 C ATOM 1934 C GLN A 212 -1.277 -25.726 -22.422 1.00 10.45 C ATOM 1935 O GLN A 212 -0.770 -26.720 -22.926 1.00 10.45 O ATOM 1936 CB GLN A 212 0.367 -25.501 -20.513 1.00 9.82 C ATOM 1937 CG GLN A 212 1.446 -24.620 -19.915 1.00 10.00 C ATOM 1938 CD GLN A 212 2.384 -24.125 -20.994 1.00 10.16 C ATOM 1939 OE1 GLN A 212 3.013 -24.922 -21.688 1.00 10.29 O ATOM 1940 NE2 GLN A 212 2.451 -22.810 -21.169 1.00 9.73 N ATOM 1941 HE22 GLN A 212 1.900 -22.175 -20.557 1.00 0.00 H ATOM 1942 HE21 GLN A 212 3.054 -22.415 -21.918 1.00 0.00 H ATOM 1943 H GLN A 212 -1.726 -23.863 -20.088 1.00 0.00 H ATOM 1944 N LEU A 213 -2.552 -25.393 -22.594 1.00 10.30 N ATOM 1945 CA LEU A 213 -3.474 -26.199 -23.391 1.00 10.45 C ATOM 1946 C LEU A 213 -2.937 -26.504 -24.791 1.00 10.83 C ATOM 1947 O LEU A 213 -3.183 -27.574 -25.328 1.00 11.27 O ATOM 1948 CB LEU A 213 -4.814 -25.483 -23.505 1.00 10.99 C ATOM 1949 CG LEU A 213 -5.841 -26.077 -24.465 1.00 11.70 C ATOM 1950 CD1 LEU A 213 -6.230 -27.489 -24.033 1.00 11.97 C ATOM 1951 CD2 LEU A 213 -7.039 -25.153 -24.513 1.00 12.02 C ATOM 1952 H LEU A 213 -2.907 -24.525 -22.144 1.00 0.00 H ATOM 1953 N ARG A 214 -2.210 -25.562 -25.383 1.00 10.67 N ATOM 1954 CA ARG A 214 -1.640 -25.791 -26.706 1.00 11.19 C ATOM 1955 C ARG A 214 -0.119 -25.941 -26.672 1.00 11.17 C ATOM 1956 O ARG A 214 0.562 -25.629 -27.645 1.00 11.52 O ATOM 1957 CB ARG A 214 -2.069 -24.683 -27.687 1.00 11.79 C ATOM 1958 CG ARG A 214 -3.579 -24.687 -27.961 1.00 13.12 C ATOM 1959 CD ARG A 214 -4.063 -23.385 -28.609 1.00 15.24 C ATOM 1960 NE ARG A 214 -3.857 -22.264 -27.694 1.00 17.65 N ATOM 1961 CZ ARG A 214 -4.740 -21.844 -26.794 1.00 19.00 C ATOM 1962 NH1 ARG A 214 -5.926 -22.418 -26.708 1.00 19.27 N ATOM 1963 NH2 ARG A 214 -4.439 -20.828 -25.990 1.00 20.35 N ATOM 1964 HE ARG A 214 -2.951 -21.757 -27.752 1.00 0.00 H ATOM 1965 HH12 ARG A 214 -6.614 -22.086 -26.002 1.00 0.00 H ATOM 1966 HH11 ARG A 214 -6.172 -23.202 -27.346 1.00 0.00 H ATOM 1967 HH22 ARG A 214 -5.130 -20.500 -25.286 1.00 0.00 H ATOM 1968 HH21 ARG A 214 -3.512 -20.362 -26.066 1.00 0.00 H ATOM 1969 H ARG A 214 -2.046 -24.656 -24.900 1.00 0.00 H ATOM 1970 N GLY A 215 0.407 -26.444 -25.563 1.00 10.61 N ATOM 1971 CA GLY A 215 1.829 -26.725 -25.485 1.00 10.16 C ATOM 1972 C GLY A 215 2.653 -25.518 -25.091 1.00 10.08 C ATOM 1973 O GLY A 215 2.141 -24.397 -24.933 1.00 10.95 O ATOM 1974 H GLY A 215 -0.204 -26.638 -24.744 1.00 0.00 H ATOM 1975 N VAL A 216 3.952 -25.757 -24.969 1.00 9.63 N ATOM 1976 CA VAL A 216 4.911 -24.791 -24.425 1.00 9.96 C ATOM 1977 C VAL A 216 5.486 -23.838 -25.467 1.00 9.93 C ATOM 1978 O VAL A 216 6.266 -22.951 -25.131 1.00 9.86 O ATOM 1979 CB VAL A 216 6.132 -25.506 -23.792 1.00 10.67 C ATOM 1980 CG1 VAL A 216 5.730 -26.347 -22.599 1.00 10.78 C ATOM 1981 CG2 VAL A 216 6.853 -26.360 -24.829 1.00 10.61 C ATOM 1982 H VAL A 216 4.311 -26.683 -25.277 1.00 0.00 H ATOM 1983 N ARG A 217 5.123 -24.030 -26.735 1.00 10.24 N ATOM 1984 CA ARG A 217 5.789 -23.301 -27.821 1.00 10.46 C ATOM 1985 C ARG A 217 5.696 -21.782 -27.653 1.00 9.95 C ATOM 1986 O ARG A 217 6.682 -21.066 -27.823 1.00 9.96 O ATOM 1987 CB ARG A 217 5.243 -23.743 -29.189 1.00 10.66 C ATOM 1988 CG ARG A 217 5.384 -25.251 -29.447 1.00 11.28 C ATOM 1989 CD ARG A 217 4.793 -25.672 -30.793 1.00 11.31 C ATOM 1990 NE ARG A 217 3.398 -25.263 -30.871 1.00 10.75 N ATOM 1991 CZ ARG A 217 2.397 -25.945 -30.330 1.00 11.56 C ATOM 1992 NH1 ARG A 217 2.624 -27.110 -29.727 1.00 11.72 N ATOM 1993 NH2 ARG A 217 1.165 -25.474 -30.414 1.00 11.78 N ATOM 1994 HE ARG A 217 3.173 -24.385 -31.381 1.00 0.00 H ATOM 1995 HH12 ARG A 217 1.835 -27.640 -29.305 1.00 0.00 H ATOM 1996 HH11 ARG A 217 3.591 -27.491 -29.678 1.00 0.00 H ATOM 1997 HH22 ARG A 217 0.376 -26.004 -29.992 1.00 0.00 H ATOM 1998 HH21 ARG A 217 0.985 -24.574 -30.902 1.00 0.00 H ATOM 1999 H ARG A 217 4.361 -24.702 -26.957 1.00 0.00 H ATOM 2000 N VAL A 218 4.508 -21.292 -27.321 1.00 9.74 N ATOM 2001 CA VAL A 218 4.340 -19.862 -27.066 1.00 9.40 C ATOM 2002 C VAL A 218 5.206 -19.353 -25.909 1.00 9.49 C ATOM 2003 O VAL A 218 5.897 -18.340 -26.049 1.00 9.14 O ATOM 2004 CB VAL A 218 2.856 -19.517 -26.847 1.00 9.51 C ATOM 2005 CG1 VAL A 218 2.708 -18.205 -26.091 1.00 10.36 C ATOM 2006 CG2 VAL A 218 2.154 -19.453 -28.198 1.00 10.06 C ATOM 2007 H VAL A 218 3.690 -21.930 -27.242 1.00 0.00 H ATOM 2008 N ALA A 219 5.191 -20.067 -24.786 1.00 8.99 N ATOM 2009 CA ALA A 219 5.993 -19.663 -23.641 1.00 9.56 C ATOM 2010 C ALA A 219 7.474 -19.657 -23.983 1.00 9.44 C ATOM 2011 O ALA A 219 8.195 -18.730 -23.621 1.00 9.43 O ATOM 2012 CB ALA A 219 5.726 -20.588 -22.439 1.00 9.43 C ATOM 2013 H ALA A 219 4.601 -20.921 -24.726 1.00 0.00 H ATOM 2014 N GLU A 220 7.937 -20.695 -24.678 1.00 9.73 N ATOM 2015 CA GLU A 220 9.354 -20.761 -25.016 1.00 10.29 C ATOM 2016 C GLU A 220 9.752 -19.620 -25.947 1.00 10.11 C ATOM 2017 O GLU A 220 10.794 -18.988 -25.764 1.00 10.20 O ATOM 2018 CB GLU A 220 9.724 -22.106 -25.635 1.00 11.16 C ATOM 2019 CG GLU A 220 11.207 -22.175 -25.934 1.00 12.31 C ATOM 2020 CD GLU A 220 11.720 -23.562 -26.235 1.00 14.14 C ATOM 2021 OE1 GLU A 220 12.939 -23.679 -26.490 1.00 15.29 O ATOM 2022 OE2 GLU A 220 10.929 -24.527 -26.213 1.00 14.71 O ATOM 2023 H GLU A 220 7.292 -21.454 -24.978 1.00 0.00 H ATOM 2024 N SER A 221 8.927 -19.359 -26.952 1.00 10.49 N ATOM 2025 CA SER A 221 9.204 -18.244 -27.851 1.00 10.72 C ATOM 2026 C SER A 221 9.206 -16.916 -27.111 1.00 10.26 C ATOM 2027 O SER A 221 10.008 -16.026 -27.418 1.00 10.39 O ATOM 2028 CB SER A 221 8.199 -18.218 -29.007 1.00 12.29 C ATOM 2029 OG SER A 221 8.391 -19.337 -29.856 1.00 13.19 O ATOM 2030 HG SER A 221 8.263 -20.170 -29.336 1.00 0.00 H ATOM 2031 H SER A 221 8.083 -19.949 -27.099 1.00 0.00 H ATOM 2032 N LEU A 222 8.324 -16.784 -26.126 1.00 9.92 N ATOM 2033 CA LEU A 222 8.278 -15.555 -25.339 1.00 9.80 C ATOM 2034 C LEU A 222 9.541 -15.397 -24.494 1.00 9.48 C ATOM 2035 O LEU A 222 10.145 -14.326 -24.460 1.00 9.69 O ATOM 2036 CB LEU A 222 7.033 -15.531 -24.451 1.00 9.96 C ATOM 2037 CG LEU A 222 6.832 -14.260 -23.628 1.00 10.20 C ATOM 2038 CD1 LEU A 222 6.746 -13.035 -24.526 1.00 11.15 C ATOM 2039 CD2 LEU A 222 5.548 -14.413 -22.821 1.00 10.46 C ATOM 2040 H LEU A 222 7.664 -17.559 -25.915 1.00 0.00 H ATOM 2041 N TYR A 223 9.956 -16.465 -23.818 1.00 9.37 N ATOM 2042 CA TYR A 223 11.137 -16.372 -22.959 1.00 9.73 C ATOM 2043 C TYR A 223 12.434 -16.194 -23.750 1.00 10.19 C ATOM 2044 O TYR A 223 13.419 -15.640 -23.234 1.00 10.72 O ATOM 2045 CB TYR A 223 11.278 -17.600 -22.054 1.00 9.72 C ATOM 2046 CG TYR A 223 10.120 -17.824 -21.092 1.00 9.21 C ATOM 2047 CD1 TYR A 223 9.265 -16.782 -20.727 1.00 9.35 C ATOM 2048 CD2 TYR A 223 9.893 -19.084 -20.535 1.00 9.92 C ATOM 2049 CE1 TYR A 223 8.204 -16.995 -19.856 1.00 9.38 C ATOM 2050 CE2 TYR A 223 8.841 -19.303 -19.667 1.00 10.01 C ATOM 2051 CZ TYR A 223 8.002 -18.257 -19.321 1.00 9.79 C ATOM 2052 OH TYR A 223 6.955 -18.491 -18.454 1.00 10.46 O ATOM 2053 HH TYR A 223 6.454 -17.650 -18.309 1.00 0.00 H ATOM 2054 H TYR A 223 9.442 -17.365 -23.900 1.00 0.00 H ATOM 2055 N ARG A 224 12.433 -16.647 -25.000 1.00 10.72 N ATOM 2056 CA ARG A 224 13.606 -16.495 -25.862 1.00 11.33 C ATOM 2057 C ARG A 224 13.625 -15.196 -26.657 1.00 11.56 C ATOM 2058 O ARG A 224 14.586 -14.926 -27.375 1.00 12.73 O ATOM 2059 CB ARG A 224 13.717 -17.676 -26.826 1.00 12.23 C ATOM 2060 CG ARG A 224 14.068 -18.980 -26.129 1.00 13.26 C ATOM 2061 CD ARG A 224 14.266 -20.092 -27.141 1.00 14.42 C ATOM 2062 NE ARG A 224 14.654 -21.362 -26.533 1.00 15.80 N ATOM 2063 CZ ARG A 224 15.902 -21.687 -26.198 1.00 17.64 C ATOM 2064 NH1 ARG A 224 16.886 -20.828 -26.400 1.00 18.37 N ATOM 2065 NH2 ARG A 224 16.163 -22.867 -25.649 1.00 18.66 N ATOM 2066 HE ARG A 224 13.905 -22.060 -26.349 1.00 0.00 H ATOM 2067 HH12 ARG A 224 17.860 -21.082 -26.138 1.00 0.00 H ATOM 2068 HH11 ARG A 224 16.686 -19.898 -26.821 1.00 0.00 H ATOM 2069 HH22 ARG A 224 17.139 -23.115 -25.390 1.00 0.00 H ATOM 2070 HH21 ARG A 224 15.391 -23.543 -25.478 1.00 0.00 H ATOM 2071 H ARG A 224 11.583 -17.118 -25.372 1.00 0.00 H ATOM 2072 N HIS A 225 12.567 -14.400 -26.538 1.00 11.87 N ATOM 2073 CA HIS A 225 12.446 -13.158 -27.312 1.00 11.99 C ATOM 2074 C HIS A 225 13.598 -12.211 -26.952 1.00 12.87 C ATOM 2075 O HIS A 225 14.008 -12.159 -25.799 1.00 12.89 O ATOM 2076 CB HIS A 225 11.091 -12.515 -26.997 1.00 12.02 C ATOM 2077 CG HIS A 225 10.717 -11.388 -27.912 1.00 12.27 C ATOM 2078 ND1 HIS A 225 11.295 -10.137 -27.827 1.00 12.78 N ATOM 2079 CD2 HIS A 225 9.803 -11.314 -28.907 1.00 12.77 C ATOM 2080 CE1 HIS A 225 10.767 -9.349 -28.747 1.00 12.89 C ATOM 2081 NE2 HIS A 225 9.857 -10.038 -29.415 1.00 12.63 N ATOM 2082 H HIS A 225 11.806 -14.664 -25.880 1.00 0.00 H ATOM 2083 N PRO A 226 14.133 -11.473 -27.939 1.00 13.59 N ATOM 2084 CA PRO A 226 15.261 -10.569 -27.679 1.00 14.35 C ATOM 2085 C PRO A 226 14.986 -9.430 -26.692 1.00 13.88 C ATOM 2086 O PRO A 226 15.937 -8.819 -26.207 1.00 14.30 O ATOM 2087 CB PRO A 226 15.600 -10.007 -29.067 1.00 15.13 C ATOM 2088 CG PRO A 226 14.399 -10.246 -29.898 1.00 15.55 C ATOM 2089 CD PRO A 226 13.781 -11.513 -29.367 1.00 14.49 C ATOM 2090 N VAL A 227 13.731 -9.159 -26.365 1.00 13.32 N ATOM 2091 CA VAL A 227 13.444 -8.028 -25.486 1.00 13.13 C ATOM 2092 C VAL A 227 14.151 -8.119 -24.132 1.00 13.01 C ATOM 2093 O VAL A 227 14.584 -7.105 -23.584 1.00 13.34 O ATOM 2094 CB VAL A 227 11.924 -7.845 -25.267 1.00 12.79 C ATOM 2095 CG1 VAL A 227 11.318 -9.085 -24.612 1.00 12.98 C ATOM 2096 CG2 VAL A 227 11.643 -6.589 -24.423 1.00 13.16 C ATOM 2097 H VAL A 227 12.956 -9.747 -26.732 1.00 0.00 H ATOM 2098 N TRP A 228 14.280 -9.326 -23.590 1.00 13.03 N ATOM 2099 CA TRP A 228 14.784 -9.444 -22.219 1.00 13.15 C ATOM 2100 C TRP A 228 16.232 -8.978 -22.135 1.00 14.78 C ATOM 2101 O TRP A 228 16.580 -8.146 -21.298 1.00 15.56 O ATOM 2102 CB TRP A 228 14.571 -10.863 -21.668 1.00 12.86 C ATOM 2103 CG TRP A 228 13.174 -11.327 -21.971 1.00 12.21 C ATOM 2104 CD1 TRP A 228 12.807 -12.371 -22.771 1.00 12.45 C ATOM 2105 CD2 TRP A 228 11.955 -10.692 -21.558 1.00 11.85 C ATOM 2106 NE1 TRP A 228 11.439 -12.454 -22.844 1.00 12.55 N ATOM 2107 CE2 TRP A 228 10.890 -11.435 -22.109 1.00 12.48 C ATOM 2108 CE3 TRP A 228 11.661 -9.575 -20.765 1.00 11.92 C ATOM 2109 CZ2 TRP A 228 9.558 -11.094 -21.900 1.00 12.63 C ATOM 2110 CZ3 TRP A 228 10.339 -9.230 -20.562 1.00 11.63 C ATOM 2111 CH2 TRP A 228 9.299 -9.991 -21.123 1.00 12.19 C ATOM 2112 HE1 TRP A 228 10.905 -13.174 -23.372 1.00 0.00 H ATOM 2113 H TRP A 228 14.026 -10.176 -24.132 1.00 0.00 H ATOM 2114 N SER A 229 17.053 -9.458 -23.054 1.00 15.65 N ATOM 2115 CA SER A 229 18.444 -9.023 -23.109 1.00 17.54 C ATOM 2116 C SER A 229 18.569 -7.563 -23.535 1.00 18.00 C ATOM 2117 O SER A 229 19.399 -6.815 -23.006 1.00 18.41 O ATOM 2118 CB SER A 229 19.225 -9.912 -24.064 1.00 19.61 C ATOM 2119 OG SER A 229 19.344 -11.214 -23.531 1.00 21.54 O ATOM 2120 HG SER A 229 18.441 -11.598 -23.395 1.00 0.00 H ATOM 2121 H SER A 229 16.703 -10.153 -23.744 1.00 0.00 H ATOM 2122 N GLN A 230 17.736 -7.157 -24.489 1.00 18.17 N ATOM 2123 CA GLN A 230 17.816 -5.809 -25.052 1.00 19.11 C ATOM 2124 C GLN A 230 17.562 -4.733 -23.995 1.00 18.70 C ATOM 2125 O GLN A 230 18.206 -3.680 -23.996 1.00 19.00 O ATOM 2126 CB GLN A 230 16.813 -5.659 -26.198 1.00 20.69 C ATOM 2127 CG GLN A 230 16.738 -4.276 -26.811 1.00 22.51 C ATOM 2128 CD GLN A 230 15.705 -4.196 -27.923 1.00 24.15 C ATOM 2129 OE1 GLN A 230 15.131 -5.213 -28.332 1.00 24.57 O ATOM 2130 NE2 GLN A 230 15.464 -2.984 -28.420 1.00 25.12 N ATOM 2131 HE22 GLN A 230 15.971 -2.158 -28.044 1.00 0.00 H ATOM 2132 HE21 GLN A 230 14.769 -2.864 -29.184 1.00 0.00 H ATOM 2133 H GLN A 230 17.011 -7.813 -24.843 1.00 0.00 H ATOM 2134 N TYR A 231 16.620 -5.002 -23.096 1.00 18.43 N ATOM 2135 CA TYR A 231 16.226 -4.021 -22.089 1.00 18.73 C ATOM 2136 C TYR A 231 16.764 -4.348 -20.698 1.00 19.73 C ATOM 2137 O TYR A 231 16.376 -3.718 -19.714 1.00 21.71 O ATOM 2138 CB TYR A 231 14.701 -3.864 -22.058 1.00 18.89 C ATOM 2139 CG TYR A 231 14.138 -3.086 -23.230 1.00 19.63 C ATOM 2140 CD1 TYR A 231 13.854 -1.731 -23.115 1.00 20.26 C ATOM 2141 CD2 TYR A 231 13.904 -3.700 -24.451 1.00 19.98 C ATOM 2142 CE1 TYR A 231 13.337 -1.014 -24.187 1.00 20.65 C ATOM 2143 CE2 TYR A 231 13.388 -2.989 -25.531 1.00 20.49 C ATOM 2144 CZ TYR A 231 13.110 -1.649 -25.391 1.00 20.91 C ATOM 2145 OH TYR A 231 12.605 -0.945 -26.461 1.00 21.65 O ATOM 2146 HH TYR A 231 12.462 -0.002 -26.196 1.00 0.00 H ATOM 2147 H TYR A 231 16.154 -5.931 -23.110 1.00 0.00 H ATOM 2148 N GLY A 232 17.659 -5.328 -20.614 1.00 18.86 N ATOM 2149 CA GLY A 232 18.348 -5.606 -19.365 1.00 18.69 C ATOM 2150 C GLY A 232 17.508 -6.276 -18.292 1.00 18.27 C ATOM 2151 O GLY A 232 17.717 -6.058 -17.093 1.00 19.09 O ATOM 2152 H GLY A 232 17.869 -5.904 -21.454 1.00 0.00 H ATOM 2153 N TRP A 233 16.568 -7.108 -18.718 1.00 16.60 N ATOM 2154 CA TRP A 233 15.756 -7.887 -17.793 1.00 16.06 C ATOM 2155 C TRP A 233 16.444 -9.178 -17.381 1.00 17.23 C ATOM 2156 O TRP A 233 15.900 -9.912 -16.546 1.00 16.67 O ATOM 2157 CB TRP A 233 14.413 -8.235 -18.428 1.00 14.49 C ATOM 2158 CG TRP A 233 13.496 -7.079 -18.571 1.00 13.45 C ATOM 2159 CD1 TRP A 233 13.181 -6.415 -19.722 1.00 12.55 C ATOM 2160 CD2 TRP A 233 12.766 -6.446 -17.523 1.00 13.17 C ATOM 2161 NE1 TRP A 233 12.287 -5.408 -19.452 1.00 12.65 N ATOM 2162 CE2 TRP A 233 12.015 -5.407 -18.107 1.00 12.76 C ATOM 2163 CE3 TRP A 233 12.668 -6.661 -16.141 1.00 12.99 C ATOM 2164 CZ2 TRP A 233 11.173 -4.580 -17.360 1.00 13.18 C ATOM 2165 CZ3 TRP A 233 11.829 -5.836 -15.397 1.00 12.79 C ATOM 2166 CH2 TRP A 233 11.104 -4.804 -16.008 1.00 13.22 C ATOM 2167 OXT TRP A 233 17.529 -9.509 -17.880 1.00 18.36 O ATOM 2168 HE1 TRP A 233 11.883 -4.754 -20.152 1.00 0.00 H ATOM 2169 H TRP A 233 16.406 -7.207 -19.740 1.00 0.00 H TER 2170 TRP A 233 HETATM 2171 O HOH 1 15.995 1.026 3.188 1.00 32.35 O HETATM 2172 O HOH 2 -10.517 -10.916 -25.646 1.00 45.86 O HETATM 2173 O HOH 3 0.360 -34.381 -15.007 1.00 46.99 O HETATM 2174 O HOH 4 -5.458 15.143 -3.197 1.00 32.76 O HETATM 2175 O HOH 5 -7.639 16.596 -6.890 1.00 35.32 O HETATM 2176 O HOH 6 -11.146 -11.004 -22.018 1.00 40.77 O HETATM 2177 O HOH 7 2.121 -27.781 -4.716 1.00 42.62 O HETATM 2178 O HOH 8 20.074 5.241 -1.190 1.00 33.26 O HETATM 2179 O HOH 9 0.441 17.154 6.720 1.00 39.60 O HETATM 2180 O HOH 10 8.680 15.636 2.650 1.00 31.11 O HETATM 2181 O HOH 11 5.381 15.996 -3.051 1.00 35.16 O HETATM 2182 O HOH 12 -12.903 -20.749 -25.748 1.00 33.96 O HETATM 2183 O HOH 13 -8.120 -5.710 -22.587 1.00 35.08 O HETATM 2184 O HOH 14 -8.518 -12.274 -21.493 1.00 28.85 O HETATM 2185 O HOH 15 12.392 13.002 11.629 1.00 39.59 O HETATM 2186 O HOH 16 5.771 1.139 -34.909 1.00 36.91 O HETATM 2187 O HOH 17 -4.520 -19.092 -38.745 1.00 29.13 O HETATM 2188 O HOH 18 -9.752 0.571 -16.076 1.00 30.80 O HETATM 2189 O HOH 19 3.358 15.176 -4.981 1.00 38.35 O HETATM 2190 O HOH 20 3.089 7.076 -17.770 1.00 13.31 O HETATM 2191 O HOH 21 -8.889 6.393 -16.459 1.00 45.26 O HETATM 2192 O HOH 22 -0.099 -14.765 -37.878 1.00 26.18 O HETATM 2193 O HOH 23 2.770 -16.212 -37.988 1.00 31.48 O HETATM 2194 O HOH 24 10.264 -1.751 7.197 1.00 29.85 O HETATM 2195 O HOH 25 -7.840 4.152 -21.288 1.00 23.81 O HETATM 2196 O HOH 26 7.642 16.957 -4.145 1.00 42.16 O HETATM 2197 O HOH 27 7.561 7.965 -24.307 1.00 35.88 O HETATM 2198 O HOH 28 -9.561 -15.023 -14.627 1.00 25.80 O HETATM 2199 O HOH 29 1.609 -11.311 -35.861 1.00 29.21 O HETATM 2200 O HOH 30 18.880 -23.116 -9.957 1.00 40.92 O HETATM 2201 O HOH 31 18.717 -23.821 -25.747 1.00 30.64 O HETATM 2202 O HOH 32 7.187 15.042 4.879 1.00 24.63 O HETATM 2203 O HOH 33 -4.498 3.399 -27.778 1.00 11.28 O HETATM 2204 O HOH 34 -0.596 2.956 -24.022 1.00 10.80 O HETATM 2205 O HOH 35 -2.551 -0.697 -34.180 1.00 38.13 O HETATM 2206 O HOH 36 -11.453 -10.096 -13.341 1.00 27.90 O HETATM 2207 O HOH 37 19.808 -26.349 -20.339 1.00 30.45 O HETATM 2208 O HOH 38 -11.149 -8.290 -17.502 1.00 29.61 O HETATM 2209 O HOH 39 8.761 -25.126 -27.850 1.00 22.49 O HETATM 2210 O HOH 40 1.212 9.387 -15.058 1.00 16.59 O HETATM 2211 O HOH 41 -8.380 4.184 -25.204 1.00 31.88 O HETATM 2212 O HOH 42 -8.693 3.235 -18.797 1.00 29.97 O HETATM 2213 O HOH 43 10.648 5.530 -26.964 1.00 35.81 O HETATM 2214 O HOH 44 19.995 -24.114 -14.863 1.00 36.53 O HETATM 2215 O HOH 45 -3.619 0.227 -31.715 1.00 34.45 O HETATM 2216 O HOH 46 19.748 -8.727 -19.429 1.00 28.82 O HETATM 2217 O HOH 47 10.253 8.601 -19.341 1.00 29.91 O HETATM 2218 O HOH 48 4.248 17.154 -7.897 1.00 39.83 O HETATM 2219 O HOH 49 18.438 -17.183 -13.619 1.00 26.28 O HETATM 2220 O HOH 50 -3.220 4.329 -31.358 1.00 13.79 O HETATM 2221 O HOH 51 4.381 8.544 -15.901 1.00 15.07 O HETATM 2222 O HOH 52 4.985 15.080 -9.483 1.00 40.25 O HETATM 2223 O HOH 53 17.406 -18.260 -27.559 1.00 30.09 O HETATM 2224 O HOH 54 21.474 -19.520 -21.894 1.00 35.07 O HETATM 2225 O HOH 55 -12.694 -17.489 -31.852 1.00 45.31 O HETATM 2226 O HOH 56 -13.196 -25.959 -22.983 1.00 36.40 O HETATM 2227 O HOH 57 2.415 7.125 -20.612 1.00 13.67 O HETATM 2228 O HOH 58 5.105 -29.074 -20.075 1.00 22.19 O HETATM 2229 O HOH 59 17.155 -15.898 -26.400 1.00 34.64 O HETATM 2230 O HOH 60 19.752 13.917 2.627 1.00 50.67 O HETATM 2231 O HOH 61 -11.953 -11.444 -11.102 1.00 37.52 O HETATM 2232 O HOH 62 19.643 -22.251 -18.729 1.00 23.07 O HETATM 2233 O HOH 63 19.077 -15.001 -12.595 1.00 38.58 O HETATM 2234 O HOH 64 -4.005 -32.096 -14.287 1.00 31.74 O HETATM 2235 O HOH 65 0.876 15.757 -0.014 1.00 48.28 O HETATM 2236 O HOH 66 14.476 -4.322 1.484 1.00 33.95 O HETATM 2237 O HOH 67 -11.275 -23.364 -11.575 1.00 37.73 O HETATM 2238 O HOH 68 15.052 12.342 14.519 1.00 26.47 O HETATM 2239 O HOH 69 19.760 8.400 -1.220 1.00 40.60 O HETATM 2240 O HOH 70 -6.376 -16.910 -37.464 1.00 27.29 O HETATM 2241 O HOH 71 -7.544 10.805 3.009 1.00 30.96 O HETATM 2242 O HOH 72 -6.734 10.760 -13.150 1.00 47.06 O HETATM 2243 O HOH 73 -13.342 -17.236 -34.820 1.00 50.10 O HETATM 2244 O HOH 74 20.325 -24.754 -12.831 1.00 43.86 O HETATM 2245 O HOH 75 -4.932 10.639 2.537 1.00 40.45 O HETATM 2246 O HOH 76 2.063 -22.320 -31.011 1.00 2.29 O HETATM 2247 O HOH 77 -3.034 -11.476 -38.344 1.00 29.89 O HETATM 2248 O HOH 78 -2.152 -3.402 -34.691 1.00 37.83 O HETATM 2249 O HOH 79 -11.834 -19.095 -27.194 1.00 46.82 O HETATM 2250 O HOH 80 -8.693 8.769 3.792 1.00 38.31 O HETATM 2251 O HOH 81 16.298 10.468 -1.599 1.00 51.81 O HETATM 2252 O HOH 82 -0.985 -22.883 -30.704 1.00 18.01 O HETATM 2253 O HOH 83 5.086 -30.862 -18.199 1.00 35.97 O HETATM 2254 O HOH 84 -10.495 6.704 2.551 1.00 40.65 O HETATM 2255 O HOH 85 -8.801 -16.386 -36.980 1.00 46.58 O HETATM 2256 O HOH 86 5.074 16.391 4.985 1.00 35.07 O HETATM 2257 O HOH 87 -6.090 -28.310 -16.350 1.00 38.46 O HETATM 2258 O HOH 88 -8.408 15.632 -9.497 1.00 52.02 O HETATM 2259 O HOH 89 -12.991 -19.154 -23.911 1.00 41.81 O HETATM 2260 O HOH 90 20.360 -16.315 -15.456 1.00 30.70 O HETATM 2261 O HOH 91 17.001 -17.031 -23.513 1.00 39.42 O HETATM 2262 O HOH 92 -6.936 -12.076 -40.348 1.00 42.44 O HETATM 2263 O HOH 93 -11.482 -14.673 -18.979 1.00 39.82 O HETATM 2264 O HOH 94 -11.836 -0.982 0.450 1.00 33.45 O HETATM 2265 O HOH 95 4.538 -14.804 -38.665 1.00 46.17 O HETATM 2266 O HOH 96 20.908 -24.764 -18.648 1.00 30.87 O HETATM 2267 O HOH 97 -7.357 13.314 -12.524 1.00 49.81 O HETATM 2268 O HOH 98 0.397 -16.820 -38.628 1.00 50.13 O HETATM 2269 O HOH 99 -0.500 -25.642 -6.467 1.00 42.78 O HETATM 2270 O HOH 100 -12.457 -4.444 -13.942 1.00 47.15 O HETATM 2271 O HOH 101 -10.816 -18.137 -35.781 1.00 40.98 O HETATM 2272 O HOH 102 -5.677 -30.582 -15.366 1.00 52.33 O HETATM 2273 O HOH 103 -6.895 2.148 -28.300 1.00 23.82 O HETATM 2274 O HOH 104 -2.605 12.830 2.629 1.00 44.77 O HETATM 2275 O HOH 105 8.018 1.668 -32.698 1.00 33.37 O HETATM 2276 O HOH 106 17.089 -26.726 -23.801 1.00 37.27 O HETATM 2277 O HOH 107 -12.625 -11.988 -19.976 1.00 47.39 O HETATM 2278 O HOH 108 -10.612 4.736 -1.226 1.00 39.81 O HETATM 2279 O HOH 109 -11.098 3.742 -24.512 1.00 40.56 O HETATM 2280 O HOH 110 21.786 -1.128 -3.395 1.00 42.97 O HETATM 2281 O HOH 111 21.237 1.588 -0.990 1.00 42.56 O HETATM 2282 O HOH 112 7.153 -29.784 -21.349 1.00 38.75 O HETATM 2283 O HOH 113 11.622 3.790 -28.306 1.00 33.89 O HETATM 2284 O HOH 114 -6.739 15.445 -13.412 1.00 44.39 O HETATM 2285 O HOH 115 -10.825 0.412 -22.499 1.00 43.25 O HETATM 2286 O HOH 116 -6.247 -18.022 -39.971 1.00 43.62 O HETATM 2287 O HOH 117 11.470 -3.439 8.855 1.00 51.50 O HETATM 2288 O HOH 118 -10.606 -3.242 -17.078 1.00 33.41 O HETATM 2289 O HOH 119 -11.079 -5.710 -17.960 1.00 35.34 O HETATM 2290 O HOH 120 23.090 -25.149 -17.322 1.00 48.47 O HETATM 2291 O HOH 121 2.468 2.581 -13.178 1.00 12.25 O HETATM 2292 O HOH 122 2.612 3.461 -15.890 1.00 11.73 O HETATM 2293 O HOH 123 -5.507 -0.548 -27.450 1.00 15.15 O HETATM 2294 O HOH 124 2.983 -21.826 -24.049 1.00 9.61 O HETATM 2295 O HOH 125 -2.341 -18.255 -26.443 1.00 19.36 O HETATM 2296 O HOH 126 0.703 -20.237 -23.728 1.00 14.46 O HETATM 2297 O HOH 127 12.671 -10.002 -13.687 1.00 15.44 O HETATM 2298 O HOH 128 -2.722 -17.738 -21.980 1.00 14.91 O HETATM 2299 O HOH 129 14.447 -12.088 -17.669 1.00 16.04 O HETATM 2300 O HOH 130 -0.257 -14.024 -20.780 1.00 14.45 O HETATM 2301 O HOH 131 10.125 -2.370 -30.407 1.00 17.77 O HETATM 2302 O HOH 132 15.434 -1.670 -9.398 1.00 17.99 O HETATM 2303 O HOH 133 -8.611 -1.881 -15.660 1.00 18.09 O HETATM 2304 O HOH 134 -6.969 -15.220 -16.041 1.00 19.34 O HETATM 2305 O HOH 135 -2.679 -14.144 -25.222 1.00 16.88 O HETATM 2306 O HOH 136 2.026 -22.956 -27.800 1.00 12.74 O HETATM 2307 O HOH 137 5.470 -3.031 -6.262 1.00 15.27 O HETATM 2308 O HOH 138 13.518 -11.883 -11.685 1.00 18.84 O HETATM 2309 O HOH 139 -2.174 -21.325 -6.695 1.00 20.75 O HETATM 2310 O HOH 140 8.963 -19.365 -7.685 1.00 16.90 O HETATM 2311 O HOH 141 -7.488 -10.251 -8.469 1.00 26.61 O HETATM 2312 O HOH 142 11.379 -5.235 -31.588 1.00 30.49 O HETATM 2313 O HOH 143 -0.567 -17.712 -24.257 1.00 23.68 O HETATM 2314 O HOH 144 -2.516 -12.471 -35.582 1.00 21.47 O HETATM 2315 O HOH 145 8.811 -22.350 -29.552 1.00 26.03 O HETATM 2316 O HOH 146 -1.092 -6.253 -2.765 1.00 23.76 O HETATM 2317 O HOH 147 0.976 -5.691 -0.702 1.00 27.11 O HETATM 2318 O HOH 148 -2.027 -13.053 -18.925 1.00 15.42 O HETATM 2319 O HOH 149 -1.501 -21.017 -28.481 1.00 24.77 O HETATM 2320 O HOH 150 -5.818 1.992 -10.566 1.00 20.79 O HETATM 2321 O HOH 151 -1.354 -15.211 -23.009 1.00 18.63 O HETATM 2322 O HOH 152 -4.474 -2.216 -31.733 1.00 28.59 O HETATM 2323 O HOH 153 0.685 0.364 2.330 1.00 25.11 O HETATM 2324 O HOH 154 -11.015 -9.415 -9.801 1.00 30.27 O HETATM 2325 O HOH 155 -1.871 -8.929 -3.120 1.00 23.15 O HETATM 2326 O HOH 156 -5.258 3.481 -3.761 1.00 24.39 O HETATM 2327 O HOH 157 12.141 -13.772 -31.241 1.00 30.59 O HETATM 2328 O HOH 158 14.199 5.712 -14.346 1.00 26.79 O HETATM 2329 O HOH 159 8.413 -17.817 -4.407 1.00 29.91 O HETATM 2330 O HOH 160 -4.094 3.610 -11.770 1.00 26.51 O HETATM 2331 O HOH 161 12.216 -9.822 -9.946 1.00 28.28 O HETATM 2332 O HOH 162 -0.276 -22.979 -7.079 1.00 23.14 O HETATM 2333 O HOH 163 -3.826 5.691 -0.717 1.00 21.08 O HETATM 2334 O HOH 164 3.176 -10.671 -33.940 1.00 23.86 O HETATM 2335 O HOH 165 -8.587 0.725 -24.100 1.00 23.91 O HETATM 2336 O HOH 166 15.365 -21.411 -9.041 1.00 30.93 O HETATM 2337 O HOH 167 -2.093 6.859 -10.424 1.00 24.17 O HETATM 2338 O HOH 168 11.250 -27.822 -9.804 1.00 28.76 O HETATM 2339 O HOH 169 15.193 -0.021 -6.933 1.00 19.48 O HETATM 2340 O HOH 170 -4.338 -16.313 -25.540 1.00 27.89 O HETATM 2341 O HOH 171 13.247 -14.783 -11.446 1.00 22.19 O HETATM 2342 O HOH 172 11.716 -15.949 -29.581 1.00 17.37 O HETATM 2343 O HOH 173 12.330 -6.031 -3.213 1.00 32.90 O HETATM 2344 O HOH 174 4.376 12.830 -5.919 1.00 23.39 O HETATM 2345 O HOH 175 8.191 -15.703 -36.648 1.00 33.32 O HETATM 2346 O HOH 176 -4.928 -18.686 -23.651 1.00 25.90 O HETATM 2347 O HOH 177 15.709 -26.628 -10.993 1.00 29.98 O HETATM 2348 O HOH 178 12.914 1.519 -19.983 1.00 28.54 O HETATM 2349 O HOH 179 1.766 -4.317 -3.172 1.00 27.24 O HETATM 2350 O HOH 180 16.388 -12.001 -24.523 1.00 22.04 O HETATM 2351 O HOH 181 -4.698 -2.135 -21.183 1.00 17.89 O HETATM 2352 O HOH 182 3.077 -8.084 -33.286 1.00 19.63 O HETATM 2353 O HOH 183 -4.155 -8.542 -4.528 1.00 25.05 O HETATM 2354 O HOH 184 16.689 2.188 -6.466 1.00 34.79 O HETATM 2355 O HOH 185 14.762 -3.023 -17.597 1.00 29.64 O HETATM 2356 O HOH 186 -7.598 -9.074 -28.307 1.00 28.90 O HETATM 2357 O HOH 187 10.550 4.226 -20.164 1.00 28.39 O HETATM 2358 O HOH 188 -9.116 -2.150 -12.890 1.00 30.65 O HETATM 2359 O HOH 189 -3.427 -15.789 -19.002 1.00 27.93 O HETATM 2360 O HOH 190 6.135 -0.964 1.709 1.00 37.76 O HETATM 2361 O HOH 191 10.521 -30.364 -9.831 1.00 35.26 O HETATM 2362 O HOH 192 -7.523 -3.125 -21.887 1.00 22.75 O HETATM 2363 O HOH 193 15.642 -15.974 -10.692 1.00 35.90 O HETATM 2364 O HOH 194 15.062 -8.732 -14.148 1.00 23.65 O HETATM 2365 O HOH 195 -9.482 -12.053 -8.032 1.00 26.90 O HETATM 2366 O HOH 196 6.137 -30.390 -13.672 1.00 19.25 O HETATM 2367 O HOH 197 13.627 7.721 -12.267 1.00 32.62 O HETATM 2368 O HOH 198 -6.008 -26.418 -9.098 1.00 24.79 O HETATM 2369 O HOH 199 7.383 1.942 -22.123 1.00 18.39 O HETATM 2370 O HOH 200 11.971 -18.617 -30.315 1.00 26.37 O HETATM 2371 O HOH 201 11.728 12.426 -0.468 1.00 31.37 O HETATM 2372 O HOH 202 11.910 -8.749 -5.894 1.00 35.75 O HETATM 2373 O HOH 203 -0.345 -23.298 -24.908 1.00 14.86 O HETATM 2374 O HOH 204 11.775 -28.374 -21.413 1.00 24.71 O HETATM 2375 O HOH 205 1.546 -2.026 1.061 1.00 31.51 O HETATM 2376 O HOH 206 -5.683 -24.821 -16.229 1.00 28.00 O HETATM 2377 O HOH 207 -4.149 -24.676 -6.711 1.00 32.99 O HETATM 2378 O HOH 208 -7.972 -20.934 -25.138 1.00 29.06 O HETATM 2379 O HOH 209 13.202 -25.513 -23.059 1.00 32.87 O HETATM 2380 O HOH 210 -4.926 -6.074 -33.581 1.00 29.82 O HETATM 2381 O HOH 211 12.497 -1.857 -3.877 1.00 28.76 O HETATM 2382 O HOH 212 -8.198 -1.743 -23.925 1.00 32.04 O HETATM 2383 O HOH 213 5.420 -32.284 -15.392 1.00 30.80 O HETATM 2384 O HOH 214 -10.286 -3.933 -11.659 1.00 33.61 O HETATM 2385 O HOH 215 13.933 -3.417 -1.693 1.00 38.39 O HETATM 2386 O HOH 216 4.981 -30.916 -11.237 1.00 33.06 O HETATM 2387 O HOH 217 14.149 -29.203 -22.045 1.00 32.35 O HETATM 2388 O HOH 218 -7.321 13.068 -9.569 1.00 42.52 O HETATM 2389 O HOH 219 11.416 -21.126 -33.566 1.00 38.05 O HETATM 2390 O HOH 220 -8.769 0.097 -11.219 1.00 33.17 O HETATM 2391 O HOH 221 7.116 -14.720 -3.560 1.00 35.70 O HETATM 2392 O HOH 222 -6.194 7.523 -14.754 1.00 36.10 O HETATM 2393 O HOH 223 -0.021 -21.485 -26.374 1.00 24.96 O HETATM 2394 O HOH 224 -3.315 -5.428 -1.772 1.00 31.11 O HETATM 2395 O HOH 225 11.007 -30.219 -19.289 1.00 29.95 O HETATM 2396 O HOH 226 11.443 -21.191 -29.195 1.00 30.07 O HETATM 2397 O HOH 227 -6.710 6.244 -8.921 1.00 34.99 O HETATM 2398 O HOH 228 14.572 -21.888 -11.068 1.00 47.79 O HETATM 2399 O HOH 229 8.369 0.308 -23.027 1.00 34.35 O HETATM 2400 O HOH 230 12.587 -1.858 -29.069 1.00 32.88 O HETATM 2401 O HOH 231 11.640 -7.516 -0.936 1.00 41.13 O HETATM 2402 O HOH 232 11.515 1.963 -30.377 1.00 31.82 O HETATM 2403 O HOH 233 6.846 -22.630 -5.514 1.00 32.13 O HETATM 2404 O HOH 234 0.170 -19.893 -4.008 1.00 30.81 O HETATM 2405 O HOH 235 15.877 -4.254 -8.478 1.00 34.57 O HETATM 2406 O HOH 236 9.680 0.207 -31.238 1.00 35.21 O HETATM 2407 O HOH 237 1.766 0.845 4.814 1.00 34.06 O HETATM 2408 O HOH 238 1.560 -22.106 -5.480 1.00 37.37 O HETATM 2409 O HOH 239 -4.692 -19.583 -3.602 1.00 39.29 O HETATM 2410 O HOH 240 15.834 4.705 -5.787 1.00 37.90 O HETATM 2411 O HOH 241 -4.313 6.804 -7.812 1.00 33.65 O HETATM 2412 O HOH 242 18.427 -8.864 -27.365 1.00 32.83 O HETATM 2413 O HOH 243 11.493 11.743 -15.009 1.00 35.37 O HETATM 2414 O HOH 244 15.271 -5.917 -7.079 1.00 32.56 O HETATM 2415 O HOH 245 -9.209 -18.753 -26.390 1.00 30.45 O HETATM 2416 O HOH 246 -6.488 -15.981 -5.066 1.00 33.48 O HETATM 2417 O HOH 247 16.442 -28.217 -21.217 1.00 34.95 O HETATM 2418 O HOH 248 -4.901 0.494 -4.964 1.00 29.63 O HETATM 2419 O HOH 249 15.549 10.794 -5.529 1.00 35.04 O HETATM 2420 O HOH 250 15.727 -4.840 -1.526 1.00 44.19 O HETATM 2421 O HOH 251 18.961 0.642 -0.467 1.00 36.76 O HETATM 2422 O HOH 252 -4.262 -1.399 -3.712 1.00 37.58 O HETATM 2423 O HOH 253 6.168 -8.680 -2.000 1.00 35.76 O HETATM 2424 O HOH 254 10.089 -28.652 -23.707 1.00 36.37 O HETATM 2425 O HOH 255 12.761 1.800 -26.407 1.00 30.88 O HETATM 2426 O HOH 256 14.995 -25.077 -24.733 1.00 34.54 O HETATM 2427 O HOH 257 12.164 2.385 -23.891 1.00 44.57 O HETATM 2428 O HOH 258 20.856 -29.017 -19.915 1.00 40.11 O HETATM 2429 O HOH 259 9.527 -31.538 -11.581 1.00 38.93 O HETATM 2430 O HOH 260 -9.131 0.159 -6.843 1.00 38.98 O HETATM 2431 O HOH 261 7.503 -20.680 -3.700 1.00 42.34 O HETATM 2432 O HOH 262 -8.066 -7.855 -6.269 1.00 38.73 O HETATM 2433 O HOH 263 11.342 -19.185 -6.682 1.00 35.26 O HETATM 2434 O HOH 264 12.858 -32.043 -18.491 1.00 43.64 O HETATM 2435 O HOH 265 -8.424 -26.076 -8.005 1.00 36.41 O HETATM 2436 O HOH 266 18.798 -1.351 -6.742 1.00 42.37 O HETATM 2437 O HOH 267 -9.865 -2.519 0.253 1.00 32.82 O HETATM 2438 O HOH 268 -7.783 -5.476 -5.511 1.00 41.43 O HETATM 2439 O HOH 269 11.351 2.273 12.611 1.00 57.42 O HETATM 2440 O HOH 270 -0.132 12.027 3.820 1.00 40.80 O HETATM 2441 O HOH 271 4.369 -1.852 3.552 1.00 38.61 O HETATM 2442 O HOH 272 -10.645 -25.379 -9.091 1.00 42.19 O HETATM 2443 O HOH 273 -13.337 -7.803 -10.905 1.00 39.29 O HETATM 2444 O HOH 274 3.482 12.733 10.340 1.00 45.13 O HETATM 2445 O HOH 275 15.429 -4.387 -4.317 1.00 37.06 O HETATM 2446 O HOH 276 -8.597 -13.886 -5.510 1.00 47.17 O HETATM 2447 O HOH 277 -8.166 5.229 -1.567 1.00 38.66 O HETATM 2448 O HOH 278 20.265 -3.077 -25.629 1.00 38.22 O HETATM 2449 O HOH 279 3.165 -17.177 0.498 1.00 41.04 O HETATM 2450 O HOH 280 19.672 2.376 0.971 1.00 45.74 O HETATM 2451 O HOH 281 20.360 -2.313 -4.666 1.00 43.50 O HETATM 2452 O HOH 282 5.181 -15.548 -1.885 1.00 45.15 O HETATM 2453 O HOH 283 3.802 0.073 5.395 1.00 39.24 O HETATM 2454 O HOH 284 10.903 -17.460 -4.264 1.00 42.61 O HETATM 2455 O HOH 285 -8.317 3.337 -11.242 1.00 38.81 O HETATM 2456 O HOH 286 9.158 1.323 11.494 1.00 43.86 O HETATM 2457 O HOH 287 -13.177 -13.754 -31.716 1.00 46.10 O HETATM 2458 O HOH 288 -7.265 -6.425 -31.968 1.00 43.45 O HETATM 2459 O HOH 289 17.849 -2.310 -1.488 1.00 35.62 O HETATM 2460 O HOH 290 3.197 -4.492 -4.846 1.00 32.74 O HETATM 2461 O HOH 291 11.615 -26.759 -24.861 1.00 32.55 O HETATM 2462 O HOH 292 -4.995 -2.568 -1.955 1.00 47.65 O HETATM 2463 O HOH 293 13.570 -7.837 -8.234 1.00 48.17 O HETATM 2464 O HOH 294 -2.388 -22.685 -24.937 1.00 29.29 O HETATM 2465 O HOH 295 -6.114 4.681 -11.130 1.00 45.13 O HETATM 2466 O HOH 296 -5.707 -6.752 -2.589 1.00 49.78 O HETATM 2467 O HOH 297 -8.137 -18.248 -6.472 1.00 38.76 O HETATM 2468 O HOH 298 0.265 1.191 6.675 1.00 42.79 O HETATM 2469 O HOH 299 -7.934 -5.352 -3.344 1.00 49.98 O HETATM 2470 O HOH 300 17.466 5.545 -10.563 1.00 38.64 O HETATM 2471 O HOH 301 10.215 13.943 -11.963 1.00 40.75 O HETATM 2472 O HOH 302 16.390 -18.352 -9.576 1.00 42.40 O HETATM 2473 O HOH 303 -8.594 -12.827 -39.063 1.00 46.71 O HETATM 2474 O HOH 304 13.521 -7.616 -4.400 1.00 49.50 O HETATM 2475 O HOH 305 10.986 -33.059 -19.311 1.00 59.63 O HETATM 2476 O HOH 306 14.084 -8.448 -10.578 1.00 42.62 O HETATM 2477 O HOH 307 -7.354 -12.257 -4.544 1.00 42.16 O HETATM 2478 O HOH 308 3.797 -19.064 -2.432 1.00 39.83 O HETATM 2479 O HOH 309 18.609 -29.531 -18.027 1.00 43.64 O HETATM 2480 O HOH 310 7.354 15.019 -11.151 1.00 46.17 O HETATM 2481 O HOH 311 15.622 5.866 -8.806 1.00 46.96 O HETATM 2482 O HOH 312 -7.636 -5.478 -26.850 1.00 47.19 O HETATM 2483 O HOH 313 -10.255 -11.739 -38.043 1.00 50.96 O HETATM 2484 O HOH 314 10.043 -5.049 -34.068 1.00 45.22 O HETATM 2485 O HOH 315 -9.646 4.024 -3.105 1.00 40.19 O HETATM 2486 O HOH 316 -9.361 8.140 -14.938 1.00 44.22 O HETATM 2487 O HOH 317 -2.011 -4.265 -32.695 1.00 35.21 O HETATM 2488 O HOH 318 -7.569 2.789 -5.924 1.00 34.16 O HETATM 2489 O HOH 319 -3.606 5.587 -12.611 1.00 33.91 O HETATM 2490 O HOH 320 -5.796 -29.958 -13.095 1.00 44.09 O HETATM 2491 O HOH 321 6.120 -34.436 -16.372 1.00 37.68 O HETATM 2492 O HOH 322 16.387 -7.796 -9.809 1.00 43.03 O HETATM 2493 O HOH 323 14.751 6.798 -10.616 1.00 49.55 O HETATM 2494 O HOH 324 8.592 -1.778 0.237 1.00 47.45 O HETATM 2495 O HOH 325 16.486 -0.138 -26.007 1.00 46.91 O HETATM 2496 O HOH 326 -9.403 9.383 -4.597 1.00 42.25 O HETATM 2497 O HOH 327 4.282 -5.989 -34.866 1.00 45.09 O HETATM 2498 O HOH 328 17.506 -0.709 -23.995 1.00 45.29 O HETATM 2499 O HOH 329 5.768 -31.044 -8.487 1.00 38.21 O HETATM 2500 O HOH 330 -9.181 11.277 -8.216 1.00 49.25 O HETATM 2501 O HOH 331 10.719 -22.157 -35.972 1.00 50.94 O HETATM 2502 O HOH 332 -8.465 -7.334 -29.879 1.00 40.59 O HETATM 2503 O HOH 333 16.010 -14.946 -23.624 1.00 37.85 O HETATM 2504 O HOH 334 -3.097 -17.464 -0.733 1.00 49.54 O HETATM 2505 O HOH 335 -7.678 5.509 -12.487 1.00 47.28 O HETATM 2506 O HOH 336 -8.718 -13.496 -2.251 1.00 52.23 O HETATM 2507 O HOH 337 -3.556 -22.276 -3.322 1.00 48.92 O HETATM 2508 O HOH 338 -6.095 -9.874 -6.610 1.00 36.39 O HETATM 2509 O HOH 339 14.089 11.029 -1.879 1.00 49.63 O HETATM 2510 O HOH 340 10.304 2.242 -21.921 1.00 41.30 O HETATM 2511 O HOH 341 10.726 -20.017 -35.361 1.00 47.87 O HETATM 2512 O HOH 342 4.457 -3.195 -0.106 1.00 39.64 O HETATM 2513 O HOH 343 3.669 -3.113 -2.125 1.00 44.93 O HETATM 2514 O HOH 344 -11.072 -12.704 -3.561 1.00 48.95 O HETATM 2515 O HOH 345 18.104 8.738 -4.589 1.00 47.73 O HETATM 2516 O HOH 346 -8.852 4.448 -6.891 1.00 49.56 O HETATM 2517 O HOH 347 9.789 -19.154 -37.208 1.00 40.80 O HETATM 2518 O HOH 348 1.550 -19.098 -2.193 1.00 43.51 O HETATM 2519 O HOH 349 17.555 6.855 -3.491 1.00 37.38 O HETATM 2520 CHA DE A 9 -8.156 -22.220 -20.133 1.00 0.02 C HETATM 2521 C1A DE A 9 -7.017 -21.534 -19.462 1.00 0.06 C HETATM 2522 NA DE A 9 -5.959 -22.068 -18.820 1.00 -0.31 N HETATM 2523 C4A DE A 9 -5.173 -21.074 -18.362 1.00 0.05 C HETATM 2524 CHB DE A 9 -3.902 -21.122 -17.595 1.00 0.03 C HETATM 2525 C1B DE A 9 -3.150 -22.401 -17.547 1.00 0.07 C HETATM 2526 NB DE A 9 -3.526 -23.608 -17.995 1.00 -0.30 N HETATM 2527 C4B DE A 9 -2.533 -24.477 -17.743 1.00 0.05 C HETATM 2528 CHC DE A 9 -2.432 -25.926 -18.042 1.00 0.03 C HETATM 2529 C1C DE A 9 -3.497 -26.568 -18.848 1.00 0.07 C HETATM 2530 NC DE A 9 -4.749 -26.157 -19.068 1.00 -0.30 N HETATM 2531 C4C DE A 9 -5.372 -27.056 -19.853 1.00 0.05 C HETATM 2532 CHD DE A 9 -6.764 -27.074 -20.359 1.00 0.02 C HETATM 2533 C1D DE A 9 -7.481 -25.788 -20.487 1.00 0.06 C HETATM 2534 ND DE A 9 -7.112 -24.574 -20.049 1.00 -0.31 N HETATM 2535 C4D DE A 9 -8.075 -23.691 -20.376 1.00 0.05 C HETATM 2536 C3D DE A 9 -9.093 -24.371 -21.027 1.00 -0.04 C HETATM 2537 C2D DE A 9 -8.730 -25.700 -21.107 1.00 -0.04 C HETATM 2538 CMD DE A 9 -9.534 -26.787 -21.746 1.00 -0.04 C HETATM 2539 H DE A 9 -8.995 -27.742 -21.658 1.00 0.03 H HETATM 2540 H DE A 9 -9.691 -26.551 -22.809 1.00 0.03 H HETATM 2541 H DE A 9 -10.508 -26.868 -21.241 1.00 0.03 H HETATM 2542 CAD DE A 9 -10.333 -23.768 -21.590 1.00 -0.02 C HETATM 2543 CBD DE A 9 -10.056 -23.116 -22.905 1.00 0.01 C HETATM 2544 CGD DE A 9 -11.178 -22.850 -23.840 1.00 0.04 C HETATM 2545 O1D DE A 9 -12.323 -23.261 -23.554 1.00 -0.57 O HETATM 2546 O2D DE A 9 -10.972 -22.219 -24.918 1.00 -0.57 O HETATM 2547 H DE A 9 -9.342 -23.761 -23.438 1.00 0.04 H HETATM 2548 H DE A 9 -9.584 -22.147 -22.688 1.00 0.04 H HETATM 2549 H DE A 9 -10.718 -23.014 -20.888 1.00 0.04 H HETATM 2550 H DE A 9 -11.086 -24.557 -21.730 1.00 0.04 H HETATM 2551 H DE A 9 -7.245 -28.007 -20.629 1.00 0.14 H HETATM 2552 C3C DE A 9 -4.482 -28.073 -20.150 1.00 -0.06 C HETATM 2553 C2C DE A 9 -3.293 -27.764 -19.506 1.00 -0.04 C HETATM 2554 CMC DE A 9 -2.037 -28.563 -19.536 1.00 -0.04 C HETATM 2555 H DE A 9 -1.269 -28.061 -18.929 1.00 0.04 H HETATM 2556 H DE A 9 -1.684 -28.652 -20.574 1.00 0.04 H HETATM 2557 H DE A 9 -2.230 -29.566 -19.127 1.00 0.04 H HETATM 2558 H DE A 9 -4.676 -28.943 -20.767 1.00 0.04 H HETATM 2559 H DE A 9 -1.592 -26.506 -17.677 1.00 0.14 H HETATM 2560 C3B DE A 9 -1.490 -23.808 -17.115 1.00 -0.06 C HETATM 2561 C2B DE A 9 -1.882 -22.482 -16.989 1.00 -0.04 C HETATM 2562 CMB DE A 9 -1.086 -21.374 -16.378 1.00 -0.04 C HETATM 2563 H DE A 9 -1.663 -20.439 -16.425 1.00 0.04 H HETATM 2564 H DE A 9 -0.144 -21.251 -16.932 1.00 0.04 H HETATM 2565 H DE A 9 -0.865 -21.617 -15.328 1.00 0.04 H HETATM 2566 H DE A 9 -0.551 -24.238 -16.787 1.00 0.04 H HETATM 2567 H DE A 9 -3.532 -20.242 -17.081 1.00 0.14 H HETATM 2568 C3A DE A 9 -5.743 -19.864 -18.707 1.00 -0.04 C HETATM 2569 C2A DE A 9 -6.919 -20.147 -19.401 1.00 -0.03 C HETATM 2570 CAA DE A 9 -7.847 -19.116 -19.955 1.00 -0.02 C HETATM 2571 CBA DE A 9 -7.526 -18.571 -21.299 1.00 0.01 C HETATM 2572 CGA DE A 9 -7.710 -19.549 -22.404 1.00 0.04 C HETATM 2573 O1A DE A 9 -6.746 -19.844 -23.155 1.00 -0.57 O HETATM 2574 O2A DE A 9 -8.842 -20.078 -22.568 1.00 -0.57 O HETATM 2575 H DE A 9 -6.476 -18.242 -21.298 1.00 0.04 H HETATM 2576 H DE A 9 -8.180 -17.707 -21.488 1.00 0.04 H HETATM 2577 H DE A 9 -7.864 -18.272 -19.250 1.00 0.04 H HETATM 2578 H DE A 9 -8.849 -19.567 -20.011 1.00 0.04 H HETATM 2579 CMA DE A 9 -5.185 -18.515 -18.381 1.00 -0.04 C HETATM 2580 H DE A 9 -5.851 -17.736 -18.781 1.00 0.04 H HETATM 2581 H DE A 9 -4.187 -18.412 -18.833 1.00 0.04 H HETATM 2582 H DE A 9 -5.106 -18.405 -17.289 1.00 0.04 H HETATM 2583 H DE A 9 -9.031 -21.659 -20.441 1.00 0.14 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 93 94 98 99 100 CONECT 98 93 CONECT 99 93 CONECT 100 93 CONECT 2520 2521 2535 2583 CONECT 2521 2520 2522 2569 CONECT 2522 2521 2523 CONECT 2523 2522 2524 2568 CONECT 2524 2523 2525 2567 CONECT 2525 2524 2526 2561 CONECT 2526 2525 2527 CONECT 2527 2526 2528 2560 CONECT 2528 2527 2529 2559 CONECT 2529 2528 2530 2553 CONECT 2530 2529 2531 CONECT 2531 2530 2532 2552 CONECT 2532 2531 2533 2551 CONECT 2533 2532 2534 2537 CONECT 2534 2533 2535 CONECT 2535 2520 2534 2536 CONECT 2536 2535 2537 2542 CONECT 2537 2533 2536 2538 CONECT 2538 2537 2539 2540 2541 CONECT 2539 2538 CONECT 2540 2538 CONECT 2541 2538 CONECT 2542 2536 2543 2549 2550 CONECT 2543 2542 2544 2547 2548 CONECT 2544 2543 2545 2546 CONECT 2545 2544 CONECT 2546 2544 CONECT 2547 2543 CONECT 2548 2543 CONECT 2549 2542 CONECT 2550 2542 CONECT 2551 2532 CONECT 2552 2531 2553 2558 CONECT 2553 2529 2552 2554 CONECT 2554 2553 2555 2556 2557 CONECT 2555 2554 CONECT 2556 2554 CONECT 2557 2554 CONECT 2558 2552 CONECT 2559 2528 CONECT 2560 2527 2561 2566 CONECT 2561 2525 2560 2562 CONECT 2562 2561 2563 2564 2565 CONECT 2563 2562 CONECT 2564 2562 CONECT 2565 2562 CONECT 2566 2560 CONECT 2567 2524 CONECT 2568 2523 2569 2579 CONECT 2569 2521 2568 2570 CONECT 2570 2569 2571 2577 2578 CONECT 2571 2570 2572 2575 2576 CONECT 2572 2571 2573 2574 CONECT 2573 2572 CONECT 2574 2572 CONECT 2575 2571 CONECT 2576 2571 CONECT 2577 2570 CONECT 2578 2570 CONECT 2579 2568 2580 2581 2582 CONECT 2580 2579 CONECT 2581 2579 CONECT 2582 2579 CONECT 2583 2520 MASTER 0 0 0 0 0 0 0 0 2581 2 72 18 END
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Structure:
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Related entries of code: 4xkb
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4xkc
RCSB PDB
PDBbind
233aa, >4XKC_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4xkb
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ycf53-like protein
Ligand Name
DE9
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=0.8uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Mol Plant Vol. 8: pp. 1125-1127
Ligand Properties
Formula
C
3
0
H
2
8
N
4
O
4
Molecular Weight
508.568
Exact Mass
508.211
No. of atoms
66
No. of bonds
70
Polar Surface Area
124.04
LOGP Value
4.27 (
Computed with XLOGP3
)
3.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 5
Canonical SMILES
OC(=O)CCC1=C(C)C2=N/C/1=C\C1=N/C(=C\C3=N/C(=C\C4=N/C(=C/2)/C=C4C)/C=C3C)/C(=C1CCC(=O)O)C
InChI String
InChI=1S/C30H28N4O4/c1-15-9-20-12-25-17(3)21(5-7-29(35)36)27(33-25)14-28-22(6-8-30(37)38)18(4)26(34-28)13-24-16(2)10-19(32-24)11-23(15)31-20/h9-14H,5-8H2,1-4H3,(H,35,36)(H,37,38)/b19-11-,20-12-,23-11-,24-13-,25-12-,26-13-,27-14-,28-14-
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):
P72583
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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