Browse entries in the PDBbind-CN Database
HEADER 5MM9_COMPLEX COMPND 5MM9_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 232 GLU TYR PRO THR VAL SER GLU ILE PRO VAL GLY GLU VAL SEQRES 2 A 232 ARG LEU TYR GLN ILE ALA ASP GLY VAL TRP SER HIS ILE SEQRES 3 A 232 ALA THR GLN SER PHE ASP GLY ALA VAL TYR PRO SER ASN SEQRES 4 A 232 GLY LEU ILE VAL ARG ASP GLY ASP GLU LEU LEU LEU ILE SEQRES 5 A 232 ASP THR ALA TRP GLY ALA LYS ASN THR ALA ALA LEU LEU SEQRES 6 A 232 ALA GLU ILE GLU LYS GLN ILE GLY LEU PRO VAL THR ARG SEQRES 7 A 232 ALA VAL SER THR HIS PHE HIS ASP ASP ARG VAL GLY GLY SEQRES 8 A 232 VAL ASP VAL LEU ARG ALA ALA GLY VAL ALA THR TYR ALA SEQRES 9 A 232 SER PRO SER THR ARG ARG LEU ALA GLU VAL GLU GLY ASN SEQRES 10 A 232 GLU ILE PRO THR HIS SER LEU GLU GLY LEU SER SER SER SEQRES 11 A 232 GLY ASP ALA VAL ARG PHE GLY PRO VAL GLU LEU PHE TYR SEQRES 12 A 232 PRO GLY ALA ALA HIS SER THR ASP ASN LEU VAL VAL TYR SEQRES 13 A 232 VAL PRO SER ALA SER VAL LEU TYR GLY GLY CYS ALA ILE SEQRES 14 A 232 TYR GLU LEU SER ARG THR SER ALA GLY ASN VAL ALA ASP SEQRES 15 A 232 ALA ASP LEU ALA GLU TRP PRO THR SER ILE GLU ARG ILE SEQRES 16 A 232 GLN GLN HIS TYR PRO GLU ALA GLN PHE VAL ILE PRO GLY SEQRES 17 A 232 HIS GLY LEU PRO GLY GLY LEU ASP LEU LEU LYS HIS THR SEQRES 18 A 232 THR ASN VAL VAL LYS ALA HIS THR ASN ARG SER HET ZN A 1 1 HET ZN A 2 1 HET ZN A 3 1 HET UNN A 506 45 ATOM 1 N GLU A 30 37.855 16.229 8.883 1.00 38.64 N ATOM 2 CA GLU A 30 37.499 15.092 9.728 1.00 28.74 C ATOM 3 C GLU A 30 37.302 13.864 8.849 1.00 32.18 C ATOM 4 O GLU A 30 38.125 12.945 8.858 1.00 27.58 O ATOM 5 CB GLU A 30 36.240 15.396 10.543 1.00 37.14 C ATOM 6 CG GLU A 30 35.876 14.322 11.559 1.00 42.35 C ATOM 7 CD GLU A 30 35.225 14.873 12.819 1.00 53.41 C ATOM 8 OE1 GLU A 30 34.795 16.048 12.820 1.00 46.58 O ATOM 9 OE2 GLU A 30 35.143 14.123 13.818 1.00 54.49 O ATOM 10 HN3 GLU A 30 37.091 16.405 8.200 1.00 0.00 H ATOM 11 HN2 GLU A 30 38.736 16.017 8.372 1.00 0.00 H ATOM 12 HN1 GLU A 30 37.991 17.072 9.477 1.00 0.00 H ATOM 13 N TYR A 31 36.235 13.859 8.057 1.00 31.06 N ATOM 14 CA TYR A 31 35.999 12.725 7.174 1.00 19.85 C ATOM 15 C TYR A 31 37.097 12.667 6.119 1.00 26.04 C ATOM 16 O TYR A 31 37.450 13.687 5.526 1.00 25.74 O ATOM 17 CB TYR A 31 34.617 12.802 6.513 1.00 24.89 C ATOM 18 CG TYR A 31 34.142 11.439 6.022 1.00 18.22 C ATOM 19 CD1 TYR A 31 33.550 10.547 6.900 1.00 20.69 C ATOM 20 CD2 TYR A 31 34.308 11.056 4.708 1.00 21.67 C ATOM 21 CE1 TYR A 31 33.110 9.301 6.479 1.00 18.76 C ATOM 22 CE2 TYR A 31 33.883 9.811 4.277 1.00 19.11 C ATOM 23 CZ TYR A 31 33.282 8.946 5.171 1.00 19.17 C ATOM 24 OH TYR A 31 32.855 7.693 4.764 1.00 18.36 O ATOM 25 HH TYR A 31 32.452 7.217 5.533 1.00 0.00 H ATOM 26 H TYR A 31 35.572 14.660 8.068 1.00 0.00 H ATOM 27 N PRO A 32 37.658 11.471 5.875 1.00 27.18 N ATOM 28 CA PRO A 32 38.734 11.360 4.880 1.00 28.48 C ATOM 29 C PRO A 32 38.289 11.633 3.439 1.00 38.51 C ATOM 30 O PRO A 32 37.218 11.154 3.037 1.00 29.63 O ATOM 31 CB PRO A 32 39.188 9.904 5.017 1.00 23.29 C ATOM 32 CG PRO A 32 38.693 9.459 6.319 1.00 35.12 C ATOM 33 CD PRO A 32 37.419 10.189 6.553 1.00 22.55 C ATOM 34 N THR A 33 39.117 12.359 2.681 1.00 34.26 N ATOM 35 CA THR A 33 38.822 12.686 1.284 1.00 35.05 C ATOM 36 C THR A 33 39.800 12.064 0.311 1.00 30.59 C ATOM 37 O THR A 33 40.890 11.639 0.684 1.00 30.26 O ATOM 38 CB THR A 33 38.844 14.204 1.024 1.00 44.22 C ATOM 39 OG1 THR A 33 40.149 14.717 1.308 1.00 44.41 O ATOM 40 CG2 THR A 33 37.820 14.915 1.867 1.00 40.64 C ATOM 41 HG1 THR A 33 40.812 14.272 0.723 1.00 0.00 H ATOM 42 H THR A 33 40.004 12.705 3.099 1.00 0.00 H ATOM 43 N VAL A 34 39.375 12.023 -0.949 1.00 36.49 N ATOM 44 CA VAL A 34 40.188 11.534 -2.066 1.00 36.19 C ATOM 45 C VAL A 34 41.644 11.966 -1.978 1.00 33.10 C ATOM 46 O VAL A 34 42.555 11.142 -2.083 1.00 41.24 O ATOM 47 CB VAL A 34 39.634 12.012 -3.447 1.00 42.48 C ATOM 48 CG1 VAL A 34 39.293 10.823 -4.315 1.00 32.11 C ATOM 49 CG2 VAL A 34 38.419 12.942 -3.302 1.00 39.89 C ATOM 50 H VAL A 34 38.411 12.357 -1.153 1.00 0.00 H ATOM 51 N SER A 35 41.856 13.260 -1.753 1.00 49.65 N ATOM 52 CA SER A 35 43.195 13.838 -1.701 1.00 40.57 C ATOM 53 C SER A 35 44.119 13.164 -0.685 1.00 41.35 C ATOM 54 O SER A 35 45.332 13.096 -0.892 1.00 34.83 O ATOM 55 CB SER A 35 43.094 15.327 -1.373 1.00 42.47 C ATOM 56 OG SER A 35 42.701 15.520 -0.025 1.00 45.43 O ATOM 57 HG SER A 35 41.817 15.099 0.123 1.00 0.00 H ATOM 58 H SER A 35 41.036 13.883 -1.609 1.00 0.00 H ATOM 59 N GLU A 36 43.536 12.645 0.393 1.00 46.78 N ATOM 60 CA GLU A 36 44.301 12.199 1.556 1.00 33.93 C ATOM 61 C GLU A 36 44.492 10.687 1.618 1.00 37.38 C ATOM 62 O GLU A 36 45.038 10.166 2.590 1.00 41.76 O ATOM 63 CB GLU A 36 43.613 12.675 2.842 1.00 44.86 C ATOM 64 CG GLU A 36 43.008 14.076 2.728 1.00 52.89 C ATOM 65 CD GLU A 36 42.234 14.517 3.964 1.00 58.88 C ATOM 66 OE1 GLU A 36 41.328 13.783 4.408 1.00 44.90 O ATOM 67 OE2 GLU A 36 42.523 15.616 4.485 1.00 80.57 O ATOM 68 H GLU A 36 42.500 12.554 0.408 1.00 0.00 H ATOM 69 N ILE A 37 44.036 9.980 0.590 1.00 31.19 N ATOM 70 CA ILE A 37 44.153 8.529 0.564 1.00 36.09 C ATOM 71 C ILE A 37 44.792 8.075 -0.731 1.00 35.57 C ATOM 72 O ILE A 37 44.149 8.111 -1.780 1.00 34.30 O ATOM 73 CB ILE A 37 42.787 7.832 0.693 1.00 28.31 C ATOM 74 CG1 ILE A 37 42.002 8.375 1.894 1.00 37.15 C ATOM 75 CG2 ILE A 37 42.984 6.348 0.827 1.00 26.21 C ATOM 76 CD1 ILE A 37 40.540 7.936 1.925 1.00 27.78 C ATOM 77 H ILE A 37 43.588 10.471 -0.210 1.00 0.00 H ATOM 78 N PRO A 38 46.054 7.640 -0.667 1.00 30.76 N ATOM 79 CA PRO A 38 46.628 7.029 -1.865 1.00 38.71 C ATOM 80 C PRO A 38 45.854 5.770 -2.238 1.00 31.87 C ATOM 81 O PRO A 38 45.403 5.059 -1.347 1.00 25.25 O ATOM 82 CB PRO A 38 48.062 6.680 -1.443 1.00 47.31 C ATOM 83 CG PRO A 38 48.330 7.496 -0.219 1.00 49.10 C ATOM 84 CD PRO A 38 47.008 7.666 0.455 1.00 37.48 C ATOM 85 N VAL A 39 45.688 5.503 -3.526 1.00 33.10 N ATOM 86 CA VAL A 39 45.095 4.247 -3.940 1.00 27.14 C ATOM 87 C VAL A 39 45.899 3.121 -3.310 1.00 22.22 C ATOM 88 O VAL A 39 47.125 3.093 -3.415 1.00 28.07 O ATOM 89 CB VAL A 39 45.071 4.114 -5.468 1.00 22.07 C ATOM 90 CG1 VAL A 39 44.632 2.717 -5.895 1.00 26.17 C ATOM 91 CG2 VAL A 39 44.147 5.180 -6.071 1.00 25.25 C ATOM 92 H VAL A 39 45.984 6.197 -4.242 1.00 0.00 H ATOM 93 N GLY A 40 45.203 2.218 -2.624 1.00 20.58 N ATOM 94 CA GLY A 40 45.839 1.092 -1.963 1.00 22.73 C ATOM 95 C GLY A 40 45.699 1.157 -0.453 1.00 22.99 C ATOM 96 O GLY A 40 45.820 0.131 0.223 1.00 27.16 O ATOM 97 H GLY A 40 44.170 2.322 -2.559 1.00 0.00 H ATOM 98 N GLU A 41 45.443 2.351 0.071 1.00 25.52 N ATOM 99 CA GLU A 41 45.223 2.524 1.500 1.00 25.88 C ATOM 100 C GLU A 41 43.733 2.657 1.799 1.00 27.79 C ATOM 101 O GLU A 41 42.949 3.106 0.964 1.00 25.19 O ATOM 102 CB GLU A 41 45.983 3.751 2.031 1.00 21.91 C ATOM 103 CG GLU A 41 47.505 3.594 1.960 1.00 30.89 C ATOM 104 CD GLU A 41 48.247 4.837 2.417 1.00 42.88 C ATOM 105 OE1 GLU A 41 47.711 5.569 3.275 1.00 53.94 O ATOM 106 OE2 GLU A 41 49.363 5.091 1.914 1.00 32.46 O ATOM 107 H GLU A 41 45.399 3.181 -0.554 1.00 0.00 H ATOM 108 N VAL A 42 43.364 2.270 3.010 1.00 22.11 N ATOM 109 CA VAL A 42 41.987 2.380 3.489 1.00 15.17 C ATOM 110 C VAL A 42 41.931 3.108 4.817 1.00 14.53 C ATOM 111 O VAL A 42 42.740 2.845 5.704 1.00 22.02 O ATOM 112 CB VAL A 42 41.344 0.971 3.634 1.00 16.74 C ATOM 113 CG1 VAL A 42 39.918 1.044 4.204 1.00 22.18 C ATOM 114 CG2 VAL A 42 41.340 0.266 2.296 1.00 18.66 C ATOM 115 H VAL A 42 44.083 1.871 3.647 1.00 0.00 H ATOM 116 N ARG A 43 40.957 3.999 4.959 1.00 18.67 N ATOM 117 CA ARG A 43 40.721 4.738 6.192 1.00 15.21 C ATOM 118 C ARG A 43 39.459 4.211 6.853 1.00 17.91 C ATOM 119 O ARG A 43 38.534 3.786 6.166 1.00 16.84 O ATOM 120 CB ARG A 43 40.582 6.237 5.916 1.00 18.35 C ATOM 121 CG ARG A 43 41.758 6.858 5.196 1.00 28.98 C ATOM 122 CD ARG A 43 42.959 7.077 6.112 1.00 28.43 C ATOM 123 NE ARG A 43 44.080 7.677 5.378 1.00 40.76 N ATOM 124 CZ ARG A 43 45.152 7.018 4.939 1.00 38.56 C ATOM 125 NH1 ARG A 43 45.294 5.718 5.167 1.00 29.99 N ATOM 126 NH2 ARG A 43 46.102 7.665 4.271 1.00 38.09 N ATOM 127 HE ARG A 43 44.034 8.698 5.185 1.00 0.00 H ATOM 128 HH12 ARG A 43 46.136 5.218 4.818 1.00 0.00 H ATOM 129 HH11 ARG A 43 44.563 5.200 5.695 1.00 0.00 H ATOM 130 HH22 ARG A 43 46.939 7.151 3.928 1.00 0.00 H ATOM 131 HH21 ARG A 43 46.009 8.685 4.091 1.00 0.00 H ATOM 132 H ARG A 43 40.330 4.179 4.149 1.00 0.00 H ATOM 133 N LEU A 44 39.411 4.220 8.185 1.00 17.49 N ATOM 134 CA LEU A 44 38.170 3.947 8.915 1.00 17.00 C ATOM 135 C LEU A 44 37.723 5.222 9.588 1.00 26.75 C ATOM 136 O LEU A 44 38.552 6.028 10.019 1.00 29.75 O ATOM 137 CB LEU A 44 38.344 2.828 9.939 1.00 17.99 C ATOM 138 CG LEU A 44 38.879 1.499 9.406 1.00 13.31 C ATOM 139 CD1 LEU A 44 38.988 0.418 10.503 1.00 18.52 C ATOM 140 CD2 LEU A 44 38.062 0.963 8.226 1.00 17.24 C ATOM 141 H LEU A 44 40.278 4.426 8.721 1.00 0.00 H ATOM 142 N TYR A 45 36.409 5.412 9.647 1.00 15.29 N ATOM 143 CA TYR A 45 35.818 6.581 10.290 1.00 15.55 C ATOM 144 C TYR A 45 34.687 6.137 11.212 1.00 21.16 C ATOM 145 O TYR A 45 33.655 5.638 10.754 1.00 17.52 O ATOM 146 CB TYR A 45 35.312 7.558 9.232 1.00 15.40 C ATOM 147 CG TYR A 45 34.729 8.824 9.806 1.00 19.65 C ATOM 148 CD1 TYR A 45 35.532 9.921 10.049 1.00 23.01 C ATOM 149 CD2 TYR A 45 33.387 8.907 10.106 1.00 16.30 C ATOM 150 CE1 TYR A 45 35.002 11.079 10.578 1.00 24.11 C ATOM 151 CE2 TYR A 45 32.840 10.064 10.633 1.00 26.55 C ATOM 152 CZ TYR A 45 33.653 11.145 10.864 1.00 30.62 C ATOM 153 OH TYR A 45 33.104 12.301 11.393 1.00 35.30 O ATOM 154 HH TYR A 45 33.814 12.983 11.500 1.00 0.00 H ATOM 155 H TYR A 45 35.780 4.703 9.220 1.00 0.00 H ATOM 156 N GLN A 47 34.885 6.285 12.524 1.00 19.75 N ATOM 157 CA GLN A 47 33.868 5.865 13.486 1.00 16.57 C ATOM 158 C GLN A 47 32.751 6.880 13.483 1.00 26.01 C ATOM 159 O GLN A 47 32.978 8.078 13.651 1.00 26.62 O ATOM 160 CB GLN A 47 34.461 5.705 14.897 1.00 26.98 C ATOM 161 CG GLN A 47 33.464 5.179 15.915 1.00 28.75 C ATOM 162 CD GLN A 47 34.085 4.239 16.948 1.00 36.41 C ATOM 163 OE1 GLN A 47 35.284 4.299 17.237 1.00 44.95 O ATOM 164 NE2 GLN A 47 33.264 3.348 17.495 1.00 42.12 N ATOM 165 HE22 GLN A 47 32.260 3.331 17.224 1.00 0.00 H ATOM 166 HE21 GLN A 47 33.626 2.668 18.194 1.00 0.00 H ATOM 167 H GLN A 47 35.773 6.704 12.866 1.00 0.00 H ATOM 168 N ILE A 48 31.540 6.390 13.255 1.00 20.85 N ATOM 169 CA ILE A 48 30.349 7.223 13.175 1.00 24.84 C ATOM 170 C ILE A 48 29.649 7.212 14.523 1.00 31.72 C ATOM 171 O ILE A 48 29.203 8.260 15.012 1.00 27.85 O ATOM 172 CB ILE A 48 29.380 6.715 12.075 1.00 32.05 C ATOM 173 CG1 ILE A 48 30.060 6.761 10.708 1.00 24.24 C ATOM 174 CG2 ILE A 48 28.078 7.540 12.041 1.00 31.01 C ATOM 175 CD1 ILE A 48 29.403 5.879 9.700 1.00 20.88 C ATOM 176 H ILE A 48 31.436 5.363 13.127 1.00 0.00 H ATOM 177 N ALA A 49 29.555 6.018 15.109 1.00 26.06 N ATOM 178 CA ALA A 49 28.894 5.825 16.401 1.00 27.76 C ATOM 179 C ALA A 49 29.483 4.620 17.110 1.00 29.70 C ATOM 180 O ALA A 49 30.398 3.986 16.589 1.00 27.77 O ATOM 181 CB ALA A 49 27.382 5.670 16.211 1.00 28.50 C ATOM 182 H ALA A 49 29.967 5.192 14.630 1.00 0.00 H ATOM 183 N ASP A 50 29.003 4.326 18.316 1.00 25.15 N ATOM 184 CA ASP A 50 29.356 3.080 18.970 1.00 26.78 C ATOM 185 C ASP A 50 29.054 1.947 18.005 1.00 27.33 C ATOM 186 O ASP A 50 27.938 1.859 17.485 1.00 26.35 O ATOM 187 CB ASP A 50 28.583 2.880 20.269 1.00 25.22 C ATOM 188 CG ASP A 50 29.492 2.768 21.462 1.00 35.61 C ATOM 189 OD1 ASP A 50 29.848 3.824 22.026 1.00 45.50 O ATOM 190 OD2 ASP A 50 29.855 1.632 21.829 1.00 51.26 O ATOM 191 H ASP A 50 28.368 4.996 18.795 1.00 0.00 H ATOM 192 N GLY A 51 30.077 1.150 17.721 1.00 23.25 N ATOM 193 CA GLY A 51 29.944 -0.044 16.912 1.00 22.20 C ATOM 194 C GLY A 51 29.624 0.214 15.450 1.00 19.11 C ATOM 195 O GLY A 51 29.229 -0.712 14.760 1.00 15.25 O ATOM 196 H GLY A 51 31.016 1.394 18.096 1.00 0.00 H ATOM 197 N VAL A 52 29.770 1.447 14.972 1.00 17.30 N ATOM 198 CA VAL A 52 29.513 1.715 13.552 1.00 15.86 C ATOM 199 C VAL A 52 30.612 2.572 12.929 1.00 16.59 C ATOM 200 O VAL A 52 30.920 3.646 13.434 1.00 19.67 O ATOM 201 CB VAL A 52 28.143 2.400 13.341 1.00 21.20 C ATOM 202 CG1 VAL A 52 27.848 2.543 11.867 1.00 18.52 C ATOM 203 CG2 VAL A 52 27.030 1.581 14.017 1.00 19.15 C ATOM 204 H VAL A 52 30.066 2.219 15.603 1.00 0.00 H ATOM 205 N TRP A 53 31.194 2.068 11.832 1.00 14.93 N ATOM 206 CA TRP A 53 32.242 2.751 11.092 1.00 15.65 C ATOM 207 C TRP A 53 31.902 2.825 9.620 1.00 15.75 C ATOM 208 O TRP A 53 31.183 1.958 9.109 1.00 15.03 O ATOM 209 CB TRP A 53 33.567 2.016 11.201 1.00 13.48 C ATOM 210 CG TRP A 53 34.112 1.810 12.584 1.00 12.61 C ATOM 211 CD1 TRP A 53 35.101 2.550 13.196 1.00 22.04 C ATOM 212 CD2 TRP A 53 33.744 0.787 13.513 1.00 11.22 C ATOM 213 NE1 TRP A 53 35.352 2.057 14.449 1.00 23.50 N ATOM 214 CE2 TRP A 53 34.548 0.969 14.666 1.00 18.49 C ATOM 215 CE3 TRP A 53 32.819 -0.264 13.494 1.00 16.37 C ATOM 216 CZ2 TRP A 53 34.444 0.151 15.777 1.00 19.17 C ATOM 217 CZ3 TRP A 53 32.722 -1.077 14.606 1.00 19.34 C ATOM 218 CH2 TRP A 53 33.538 -0.865 15.734 1.00 18.77 C ATOM 219 HE1 TRP A 53 36.040 2.445 15.125 1.00 0.00 H ATOM 220 H TRP A 53 30.878 1.137 11.492 1.00 0.00 H ATOM 221 N SER A 54 32.438 3.817 8.924 1.00 17.54 N ATOM 222 CA SER A 54 32.553 3.664 7.490 1.00 18.43 C ATOM 223 C SER A 54 33.987 3.286 7.171 1.00 17.98 C ATOM 224 O SER A 54 34.930 3.503 7.975 1.00 15.29 O ATOM 225 CB SER A 54 32.110 4.924 6.746 1.00 16.58 C ATOM 226 OG SER A 54 32.982 6.007 6.997 1.00 18.20 O ATOM 227 HG SER A 54 32.667 6.804 6.502 1.00 0.00 H ATOM 228 H SER A 54 32.767 4.683 9.396 1.00 0.00 H ATOM 229 N HIS A 55 34.153 2.652 6.018 1.00 13.30 N ATOM 230 CA HIS A 55 35.486 2.491 5.429 1.00 12.78 C ATOM 231 C HIS A 55 35.580 3.257 4.133 1.00 13.13 C ATOM 232 O HIS A 55 34.610 3.330 3.378 1.00 13.98 O ATOM 233 CB HIS A 55 35.876 0.998 5.252 1.00 12.67 C ATOM 234 CG HIS A 55 35.017 0.183 4.333 1.00 8.94 C ATOM 235 ND1 HIS A 55 35.193 0.160 2.965 1.00 14.73 N ATOM 236 CD2 HIS A 55 34.096 -0.772 4.605 1.00 11.76 C ATOM 237 CE1 HIS A 55 34.368 -0.727 2.433 1.00 12.51 C ATOM 238 NE2 HIS A 55 33.677 -1.295 3.403 1.00 13.05 N ATOM 239 H HIS A 55 33.325 2.263 5.524 1.00 0.00 H ATOM 240 N ILE A 56 36.744 3.858 3.913 1.00 13.47 N ATOM 241 CA ILE A 56 36.981 4.769 2.790 1.00 14.84 C ATOM 242 C ILE A 56 38.241 4.354 2.049 1.00 16.31 C ATOM 243 O ILE A 56 39.306 4.195 2.650 1.00 15.95 O ATOM 244 CB ILE A 56 37.126 6.242 3.221 1.00 14.53 C ATOM 245 CG1 ILE A 56 35.944 6.679 4.097 1.00 14.41 C ATOM 246 CG2 ILE A 56 37.208 7.155 1.970 1.00 19.01 C ATOM 247 CD1 ILE A 56 36.118 6.392 5.602 1.00 17.93 C ATOM 248 H ILE A 56 37.527 3.672 4.572 1.00 0.00 H ATOM 249 N ALA A 57 38.102 4.190 0.732 1.00 13.99 N ATOM 250 CA ALA A 57 39.180 3.769 -0.142 1.00 12.54 C ATOM 251 C ALA A 57 39.117 4.631 -1.399 1.00 12.47 C ATOM 252 O ALA A 57 38.191 5.424 -1.554 1.00 16.13 O ATOM 253 CB ALA A 57 39.058 2.307 -0.490 1.00 14.41 C ATOM 254 H ALA A 57 37.170 4.374 0.309 1.00 0.00 H ATOM 255 N THR A 58 40.134 4.497 -2.243 1.00 18.13 N ATOM 256 CA THR A 58 40.181 5.240 -3.491 1.00 18.43 C ATOM 257 C THR A 58 40.594 4.291 -4.598 1.00 14.68 C ATOM 258 O THR A 58 41.269 3.283 -4.371 1.00 16.31 O ATOM 259 CB THR A 58 41.143 6.446 -3.422 1.00 16.88 C ATOM 260 OG1 THR A 58 42.379 6.035 -2.825 1.00 21.27 O ATOM 261 CG2 THR A 58 40.541 7.573 -2.607 1.00 18.64 C ATOM 262 HG1 THR A 58 42.996 6.808 -2.781 1.00 0.00 H ATOM 263 H THR A 58 40.911 3.848 -2.006 1.00 0.00 H ATOM 264 N GLN A 59 40.152 4.613 -5.810 1.00 17.19 N ATOM 265 CA GLN A 59 40.493 3.813 -6.949 1.00 17.78 C ATOM 266 C GLN A 59 40.627 4.675 -8.177 1.00 15.68 C ATOM 267 O GLN A 59 39.919 5.662 -8.343 1.00 16.78 O ATOM 268 CB GLN A 59 39.435 2.737 -7.189 1.00 18.04 C ATOM 269 CG GLN A 59 39.849 1.658 -8.167 1.00 19.56 C ATOM 270 CD GLN A 59 41.183 1.020 -7.824 1.00 20.14 C ATOM 271 OE1 GLN A 59 42.204 1.362 -8.410 1.00 24.10 O ATOM 272 NE2 GLN A 59 41.184 0.091 -6.870 1.00 20.47 N ATOM 273 HE22 GLN A 59 40.295 -0.170 -6.397 1.00 0.00 H ATOM 274 HE21 GLN A 59 42.074 -0.373 -6.597 1.00 0.00 H ATOM 275 H GLN A 59 39.553 5.454 -5.933 1.00 0.00 H ATOM 276 N SER A 60 41.574 4.282 -9.014 1.00 18.80 N ATOM 277 CA SER A 60 41.747 4.857 -10.337 1.00 24.91 C ATOM 278 C SER A 60 40.766 4.266 -11.349 1.00 20.42 C ATOM 279 O SER A 60 40.584 3.051 -11.415 1.00 26.30 O ATOM 280 CB SER A 60 43.173 4.616 -10.813 1.00 23.28 C ATOM 281 OG SER A 60 44.089 5.302 -9.990 1.00 30.91 O ATOM 282 HG SER A 60 45.010 5.135 -10.313 1.00 0.00 H ATOM 283 H SER A 60 42.223 3.528 -8.711 1.00 0.00 H ATOM 284 N PHE A 61 40.110 5.116 -12.125 1.00 20.81 N ATOM 285 CA PHE A 61 39.245 4.629 -13.198 1.00 22.68 C ATOM 286 C PHE A 61 39.158 5.667 -14.315 1.00 29.85 C ATOM 287 O PHE A 61 38.834 6.818 -14.052 1.00 27.90 O ATOM 288 CB PHE A 61 37.849 4.316 -12.658 1.00 28.50 C ATOM 289 CG PHE A 61 36.959 3.592 -13.645 1.00 26.93 C ATOM 290 CD1 PHE A 61 36.797 2.219 -13.590 1.00 30.48 C ATOM 291 CD2 PHE A 61 36.293 4.302 -14.631 1.00 34.12 C ATOM 292 CE1 PHE A 61 35.977 1.565 -14.503 1.00 31.69 C ATOM 293 CE2 PHE A 61 35.471 3.659 -15.536 1.00 36.62 C ATOM 294 CZ PHE A 61 35.315 2.292 -15.475 1.00 33.30 C ATOM 295 H PHE A 61 40.211 6.139 -11.969 1.00 0.00 H ATOM 296 N ASP A 62 39.408 5.244 -15.553 1.00 38.28 N ATOM 297 CA ASP A 62 39.418 6.172 -16.694 1.00 40.74 C ATOM 298 C ASP A 62 40.233 7.420 -16.359 1.00 26.32 C ATOM 299 O ASP A 62 39.804 8.547 -16.611 1.00 38.31 O ATOM 300 CB ASP A 62 37.987 6.568 -17.101 1.00 38.07 C ATOM 301 CG ASP A 62 37.383 5.639 -18.147 1.00 38.79 C ATOM 302 OD1 ASP A 62 38.107 4.797 -18.719 1.00 35.41 O ATOM 303 OD2 ASP A 62 36.169 5.776 -18.411 1.00 54.34 O ATOM 304 H ASP A 62 39.600 4.235 -15.716 1.00 0.00 H ATOM 305 N GLY A 63 41.400 7.207 -15.764 1.00 28.93 N ATOM 306 CA GLY A 63 42.359 8.276 -15.567 1.00 28.67 C ATOM 307 C GLY A 63 42.075 9.257 -14.436 1.00 33.12 C ATOM 308 O GLY A 63 42.838 10.198 -14.266 1.00 23.26 O ATOM 309 H GLY A 63 41.632 6.250 -15.431 1.00 0.00 H ATOM 310 N ALA A 64 40.994 9.062 -13.678 1.00 24.84 N ATOM 311 CA ALA A 64 40.736 9.891 -12.493 1.00 20.62 C ATOM 312 C ALA A 64 40.701 9.006 -11.260 1.00 29.42 C ATOM 313 O ALA A 64 40.617 7.786 -11.384 1.00 21.46 O ATOM 314 CB ALA A 64 39.452 10.657 -12.631 1.00 17.85 C ATOM 315 H ALA A 64 40.322 8.310 -13.931 1.00 0.00 H ATOM 316 N VAL A 66 40.796 9.622 -10.082 1.00 18.61 N ATOM 317 CA VAL A 66 40.670 8.894 -8.829 1.00 15.81 C ATOM 318 C VAL A 66 39.382 9.266 -8.097 1.00 12.69 C ATOM 319 O VAL A 66 39.004 10.418 -7.989 1.00 15.48 O ATOM 320 CB VAL A 66 41.897 9.133 -7.952 1.00 16.89 C ATOM 321 CG1 VAL A 66 41.633 8.689 -6.505 1.00 23.40 C ATOM 322 CG2 VAL A 66 43.035 8.326 -8.528 1.00 29.47 C ATOM 323 H VAL A 66 40.964 10.648 -10.058 1.00 0.00 H ATOM 324 N TYR A 67 38.728 8.226 -7.584 1.00 15.62 N ATOM 325 CA TYR A 67 37.407 8.294 -6.970 1.00 18.68 C ATOM 326 C TYR A 67 37.477 7.716 -5.582 1.00 13.70 C ATOM 327 O TYR A 67 38.093 6.685 -5.394 1.00 17.18 O ATOM 328 CB TYR A 67 36.364 7.510 -7.783 1.00 20.72 C ATOM 329 CG TYR A 67 36.185 8.020 -9.205 1.00 19.41 C ATOM 330 CD1 TYR A 67 35.190 8.932 -9.510 1.00 24.38 C ATOM 331 CD2 TYR A 67 37.022 7.604 -10.220 1.00 20.04 C ATOM 332 CE1 TYR A 67 35.021 9.404 -10.809 1.00 24.29 C ATOM 333 CE2 TYR A 67 36.872 8.079 -11.509 1.00 23.78 C ATOM 334 CZ TYR A 67 35.870 8.980 -11.794 1.00 36.75 C ATOM 335 OH TYR A 67 35.707 9.454 -13.079 1.00 38.25 O ATOM 336 HH TYR A 67 34.946 10.087 -13.102 1.00 0.00 H ATOM 337 H TYR A 67 39.193 7.297 -7.624 1.00 0.00 H ATOM 338 N PRO A 68 36.825 8.373 -4.620 1.00 14.81 N ATOM 339 CA PRO A 68 36.722 7.776 -3.288 1.00 14.62 C ATOM 340 C PRO A 68 35.522 6.863 -3.242 1.00 17.42 C ATOM 341 O PRO A 68 34.625 6.965 -4.067 1.00 13.29 O ATOM 342 CB PRO A 68 36.515 8.979 -2.395 1.00 15.34 C ATOM 343 CG PRO A 68 35.668 9.895 -3.235 1.00 20.19 C ATOM 344 CD PRO A 68 36.006 9.592 -4.696 1.00 16.91 C ATOM 345 N SER A 69 35.505 5.959 -2.285 1.00 12.27 N ATOM 346 CA SER A 69 34.411 5.019 -2.171 1.00 13.12 C ATOM 347 C SER A 69 34.234 4.630 -0.719 1.00 15.12 C ATOM 348 O SER A 69 35.218 4.352 -0.024 1.00 15.45 O ATOM 349 CB SER A 69 34.686 3.787 -3.035 1.00 16.58 C ATOM 350 OG SER A 69 33.548 2.927 -3.171 1.00 16.09 O ATOM 351 HG SER A 69 33.267 2.609 -2.276 1.00 0.00 H ATOM 352 H SER A 69 36.288 5.920 -1.602 1.00 0.00 H ATOM 353 N ASN A 70 32.978 4.562 -0.294 1.00 12.33 N ATOM 354 CA ASN A 70 32.612 4.143 1.062 1.00 14.98 C ATOM 355 C ASN A 70 32.011 2.754 1.163 1.00 13.42 C ATOM 356 O ASN A 70 31.266 2.309 0.286 1.00 12.57 O ATOM 357 CB ASN A 70 31.581 5.087 1.653 1.00 11.12 C ATOM 358 CG ASN A 70 32.049 6.521 1.694 1.00 14.15 C ATOM 359 OD1 ASN A 70 33.187 6.812 2.089 1.00 15.26 O ATOM 360 ND2 ASN A 70 31.188 7.419 1.287 1.00 14.55 N ATOM 361 HD22 ASN A 70 30.244 7.126 0.964 1.00 0.00 H ATOM 362 HD21 ASN A 70 31.448 8.426 1.286 1.00 0.00 H ATOM 363 H ASN A 70 32.217 4.818 -0.955 1.00 0.00 H ATOM 364 N GLY A 71 32.285 2.110 2.289 1.00 11.06 N ATOM 365 CA GLY A 71 31.463 1.027 2.789 1.00 12.71 C ATOM 366 C GLY A 71 31.146 1.208 4.264 1.00 12.29 C ATOM 367 O GLY A 71 31.379 2.264 4.849 1.00 13.29 O ATOM 368 H GLY A 71 33.123 2.394 2.835 1.00 0.00 H ATOM 369 N LEU A 72 30.596 0.158 4.878 1.00 10.19 N ATOM 370 CA LEU A 72 30.162 0.235 6.271 1.00 12.98 C ATOM 371 C LEU A 72 30.653 -0.965 7.061 1.00 10.42 C ATOM 372 O LEU A 72 30.796 -2.050 6.523 1.00 11.13 O ATOM 373 CB LEU A 72 28.657 0.304 6.377 1.00 13.75 C ATOM 374 CG LEU A 72 28.093 1.059 7.588 1.00 16.19 C ATOM 375 CD1 LEU A 72 28.396 2.585 7.506 1.00 17.10 C ATOM 376 CD2 LEU A 72 26.614 0.781 7.639 1.00 18.61 C ATOM 377 H LEU A 72 30.474 -0.732 4.355 1.00 0.00 H ATOM 378 N ILE A 73 30.911 -0.737 8.347 1.00 13.10 N ATOM 379 CA ILE A 73 31.250 -1.825 9.267 1.00 12.78 C ATOM 380 C ILE A 73 30.333 -1.703 10.481 1.00 9.97 C ATOM 381 O ILE A 73 30.239 -0.599 11.061 1.00 15.04 O ATOM 382 CB ILE A 73 32.721 -1.744 9.721 1.00 12.98 C ATOM 383 CG1 ILE A 73 33.684 -1.707 8.528 1.00 15.10 C ATOM 384 CG2 ILE A 73 33.055 -2.940 10.620 1.00 15.33 C ATOM 385 CD1 ILE A 73 35.075 -1.257 8.868 1.00 13.75 C ATOM 386 H ILE A 73 30.871 0.238 8.707 1.00 0.00 H ATOM 387 N VAL A 74 29.707 -2.783 10.918 1.00 9.55 N ATOM 388 CA VAL A 74 28.739 -2.702 12.018 1.00 13.28 C ATOM 389 C VAL A 74 29.042 -3.804 13.006 1.00 13.72 C ATOM 390 O VAL A 74 29.075 -4.980 12.647 1.00 12.98 O ATOM 391 CB VAL A 74 27.282 -2.819 11.531 1.00 13.13 C ATOM 392 CG1 VAL A 74 26.327 -2.576 12.688 1.00 14.18 C ATOM 393 CG2 VAL A 74 27.001 -1.813 10.459 1.00 13.19 C ATOM 394 H VAL A 74 29.904 -3.703 10.475 1.00 0.00 H ATOM 395 N ARG A 75 29.318 -3.436 14.249 1.00 13.54 N ATOM 396 CA ARG A 75 29.554 -4.455 15.279 1.00 16.05 C ATOM 397 C ARG A 75 28.286 -5.208 15.676 1.00 17.83 C ATOM 398 O ARG A 75 27.208 -4.641 15.771 1.00 18.10 O ATOM 399 CB ARG A 75 30.166 -3.816 16.525 1.00 19.88 C ATOM 400 CG ARG A 75 30.438 -4.825 17.615 1.00 20.37 C ATOM 401 CD ARG A 75 31.251 -4.208 18.755 1.00 25.20 C ATOM 402 NE ARG A 75 31.681 -5.245 19.690 1.00 31.55 N ATOM 403 CZ ARG A 75 32.543 -5.057 20.686 1.00 34.43 C ATOM 404 NH1 ARG A 75 33.094 -3.870 20.888 1.00 30.92 N ATOM 405 NH2 ARG A 75 32.860 -6.066 21.478 1.00 40.02 N ATOM 406 HE ARG A 75 31.285 -6.199 19.568 1.00 0.00 H ATOM 407 HH12 ARG A 75 33.766 -3.735 21.670 1.00 0.00 H ATOM 408 HH11 ARG A 75 32.854 -3.073 20.265 1.00 0.00 H ATOM 409 HH22 ARG A 75 33.533 -5.923 22.258 1.00 0.00 H ATOM 410 HH21 ARG A 75 32.436 -7.003 21.322 1.00 0.00 H ATOM 411 H ARG A 75 29.367 -2.427 14.494 1.00 0.00 H ATOM 412 N ASP A 76 28.432 -6.501 15.933 1.00 19.73 N ATOM 413 CA ASP A 76 27.326 -7.298 16.423 1.00 25.69 C ATOM 414 C ASP A 76 27.906 -8.288 17.416 1.00 28.76 C ATOM 415 O ASP A 76 28.461 -9.305 17.035 1.00 26.18 O ATOM 416 CB ASP A 76 26.634 -7.980 15.262 1.00 19.35 C ATOM 417 CG ASP A 76 25.417 -8.804 15.667 1.00 28.59 C ATOM 418 OD1 ASP A 76 24.802 -8.545 16.731 1.00 32.73 O ATOM 419 OD2 ASP A 76 25.065 -9.713 14.880 1.00 24.21 O ATOM 420 H ASP A 76 29.357 -6.951 15.780 1.00 0.00 H ATOM 421 N GLY A 77 27.817 -7.959 18.696 1.00 35.07 N ATOM 422 CA GLY A 77 28.468 -8.771 19.696 1.00 30.94 C ATOM 423 C GLY A 77 29.973 -8.660 19.552 1.00 24.60 C ATOM 424 O GLY A 77 30.533 -7.568 19.610 1.00 32.61 O ATOM 425 H GLY A 77 27.278 -7.116 18.980 1.00 0.00 H ATOM 426 N ASP A 78 30.630 -9.798 19.377 1.00 22.35 N ATOM 427 CA ASP A 78 32.080 -9.822 19.240 1.00 20.21 C ATOM 428 C ASP A 78 32.500 -10.114 17.808 1.00 21.63 C ATOM 429 O ASP A 78 33.589 -10.594 17.576 1.00 21.43 O ATOM 430 CB ASP A 78 32.691 -10.868 20.177 1.00 33.07 C ATOM 431 H ASP A 78 30.100 -10.692 19.337 1.00 0.00 H ATOM 432 N GLU A 79 31.638 -9.815 16.844 1.00 23.00 N ATOM 433 CA GLU A 79 32.034 -9.911 15.440 1.00 22.16 C ATOM 434 C GLU A 79 31.520 -8.709 14.675 1.00 14.13 C ATOM 435 O GLU A 79 30.832 -7.867 15.234 1.00 17.22 O ATOM 436 CB GLU A 79 31.529 -11.200 14.805 1.00 23.57 C ATOM 437 CG GLU A 79 30.152 -11.641 15.215 1.00 36.43 C ATOM 438 CD GLU A 79 29.946 -13.138 14.996 1.00 32.99 C ATOM 439 OE1 GLU A 79 29.607 -13.535 13.867 1.00 25.27 O ATOM 440 OE2 GLU A 79 30.112 -13.916 15.957 1.00 50.72 O ATOM 441 H GLU A 79 30.674 -9.510 17.089 1.00 0.00 H ATOM 442 N LEU A 80 31.900 -8.630 13.406 1.00 13.83 N ATOM 443 CA LEU A 80 31.584 -7.484 12.556 1.00 14.50 C ATOM 444 C LEU A 80 30.849 -7.940 11.340 1.00 14.38 C ATOM 445 O LEU A 80 31.151 -8.969 10.773 1.00 13.84 O ATOM 446 CB LEU A 80 32.849 -6.757 12.111 1.00 12.81 C ATOM 447 CG LEU A 80 33.783 -6.271 13.218 1.00 14.51 C ATOM 448 CD1 LEU A 80 35.052 -5.762 12.596 1.00 16.68 C ATOM 449 CD2 LEU A 80 33.146 -5.191 14.081 1.00 17.33 C ATOM 450 H LEU A 80 32.446 -9.417 12.999 1.00 0.00 H ATOM 451 N LEU A 81 29.909 -7.108 10.934 1.00 12.09 N ATOM 452 CA LEU A 81 29.244 -7.209 9.647 1.00 14.70 C ATOM 453 C LEU A 81 29.827 -6.147 8.739 1.00 14.07 C ATOM 454 O LEU A 81 29.834 -4.979 9.097 1.00 12.70 O ATOM 455 CB LEU A 81 27.748 -7.002 9.806 1.00 15.85 C ATOM 456 CG LEU A 81 26.921 -6.841 8.530 1.00 8.57 C ATOM 457 CD1 LEU A 81 26.916 -8.105 7.728 1.00 13.54 C ATOM 458 CD2 LEU A 81 25.510 -6.407 8.863 1.00 14.26 C ATOM 459 H LEU A 81 29.628 -6.336 11.572 1.00 0.00 H ATOM 460 N LEU A 82 30.346 -6.579 7.596 1.00 11.96 N ATOM 461 CA LEU A 82 30.838 -5.663 6.560 1.00 11.31 C ATOM 462 C LEU A 82 29.816 -5.380 5.467 1.00 8.44 C ATOM 463 O LEU A 82 29.208 -6.308 4.939 1.00 11.38 O ATOM 464 CB LEU A 82 32.069 -6.257 5.917 1.00 9.80 C ATOM 465 CG LEU A 82 32.830 -5.436 4.860 1.00 11.70 C ATOM 466 CD1 LEU A 82 33.393 -4.227 5.484 1.00 16.11 C ATOM 467 CD2 LEU A 82 33.897 -6.296 4.229 1.00 12.06 C ATOM 468 H LEU A 82 30.406 -7.604 7.429 1.00 0.00 H ATOM 469 N ILE A 83 29.659 -4.097 5.136 1.00 10.86 N ATOM 470 CA ILE A 83 28.866 -3.676 3.984 1.00 10.33 C ATOM 471 C ILE A 83 29.819 -3.163 2.923 1.00 10.61 C ATOM 472 O ILE A 83 30.487 -2.134 3.102 1.00 11.75 O ATOM 473 CB ILE A 83 27.840 -2.604 4.349 1.00 10.30 C ATOM 474 CG1 ILE A 83 27.024 -3.004 5.591 1.00 11.09 C ATOM 475 CG2 ILE A 83 26.892 -2.348 3.149 1.00 13.63 C ATOM 476 CD1 ILE A 83 26.165 -4.246 5.442 1.00 11.32 C ATOM 477 H ILE A 83 30.118 -3.370 5.720 1.00 0.00 H ATOM 478 N ASP A 84 29.881 -3.945 1.842 1.00 10.28 N ATOM 479 CA ASP A 84 30.640 -3.663 0.611 1.00 10.71 C ATOM 480 C ASP A 84 32.166 -3.814 0.743 1.00 14.38 C ATOM 481 O ASP A 84 32.757 -3.664 1.817 1.00 13.45 O ATOM 482 CB ASP A 84 30.279 -2.280 0.056 1.00 9.92 C ATOM 483 CG ASP A 84 28.850 -2.229 -0.481 1.00 9.65 C ATOM 484 OD1 ASP A 84 28.403 -3.241 -1.073 1.00 10.92 O ATOM 485 OD2 ASP A 84 28.181 -1.187 -0.293 1.00 12.75 O ATOM 486 H ASP A 84 29.344 -4.835 1.872 1.00 0.00 H ATOM 487 N THR A 85 32.789 -4.181 -0.380 1.00 13.25 N ATOM 488 CA THR A 85 34.243 -4.296 -0.477 1.00 12.82 C ATOM 489 C THR A 85 34.831 -2.897 -0.587 1.00 15.08 C ATOM 490 O THR A 85 34.089 -1.920 -0.639 1.00 12.08 O ATOM 491 CB THR A 85 34.692 -5.077 -1.685 1.00 14.24 C ATOM 492 OG1 THR A 85 34.331 -4.332 -2.867 1.00 12.74 O ATOM 493 CG2 THR A 85 34.106 -6.472 -1.711 1.00 9.91 C ATOM 494 HG1 THR A 85 34.619 -4.832 -3.672 1.00 0.00 H ATOM 495 H THR A 85 32.215 -4.394 -1.221 1.00 0.00 H ATOM 496 N ALA A 86 36.157 -2.810 -0.630 1.00 14.62 N ATOM 497 CA ALA A 86 36.841 -1.533 -0.766 1.00 13.80 C ATOM 498 C ALA A 86 37.307 -1.303 -2.212 1.00 13.42 C ATOM 499 O ALA A 86 38.287 -0.594 -2.442 1.00 18.29 O ATOM 500 CB ALA A 86 38.041 -1.454 0.207 1.00 16.16 C ATOM 501 H ALA A 86 36.722 -3.681 -0.564 1.00 0.00 H ATOM 502 N TRP A 87 36.610 -1.903 -3.187 1.00 13.26 N ATOM 503 CA TRP A 87 36.827 -1.634 -4.614 1.00 14.21 C ATOM 504 C TRP A 87 38.157 -2.221 -5.074 1.00 20.42 C ATOM 505 O TRP A 87 39.111 -1.509 -5.399 1.00 16.13 O ATOM 506 CB TRP A 87 36.758 -0.131 -4.918 1.00 13.76 C ATOM 507 CG TRP A 87 36.551 0.230 -6.377 1.00 11.68 C ATOM 508 CD1 TRP A 87 36.623 -0.600 -7.450 1.00 17.23 C ATOM 509 CD2 TRP A 87 36.233 1.529 -6.895 1.00 13.72 C ATOM 510 NE1 TRP A 87 36.374 0.099 -8.612 1.00 14.69 N ATOM 511 CE2 TRP A 87 36.143 1.413 -8.290 1.00 13.96 C ATOM 512 CE3 TRP A 87 36.020 2.775 -6.307 1.00 19.57 C ATOM 513 CZ2 TRP A 87 35.845 2.505 -9.108 1.00 17.87 C ATOM 514 CZ3 TRP A 87 35.741 3.856 -7.118 1.00 17.46 C ATOM 515 CH2 TRP A 87 35.647 3.712 -8.503 1.00 17.18 C ATOM 516 HE1 TRP A 87 36.363 -0.302 -9.571 1.00 0.00 H ATOM 517 H TRP A 87 35.879 -2.593 -2.920 1.00 0.00 H ATOM 518 N GLY A 88 38.186 -3.542 -5.098 1.00 15.51 N ATOM 519 CA GLY A 88 39.310 -4.299 -5.610 1.00 16.05 C ATOM 520 C GLY A 88 39.951 -5.145 -4.529 1.00 18.62 C ATOM 521 O GLY A 88 39.791 -4.893 -3.331 1.00 18.63 O ATOM 522 H GLY A 88 37.363 -4.063 -4.732 1.00 0.00 H ATOM 523 N ALA A 89 40.717 -6.134 -4.970 1.00 17.20 N ATOM 524 CA ALA A 89 41.374 -7.071 -4.076 1.00 18.02 C ATOM 525 C ALA A 89 42.402 -6.395 -3.188 1.00 20.65 C ATOM 526 O ALA A 89 42.461 -6.653 -1.980 1.00 20.46 O ATOM 527 CB ALA A 89 42.019 -8.160 -4.881 1.00 22.18 C ATOM 528 H ALA A 89 40.852 -6.243 -5.995 1.00 0.00 H ATOM 529 N LYS A 90 43.240 -5.565 -3.783 1.00 16.82 N ATOM 530 CA LYS A 90 44.321 -4.941 -3.021 1.00 21.30 C ATOM 531 C LYS A 90 43.737 -4.083 -1.902 1.00 22.53 C ATOM 532 O LYS A 90 44.174 -4.165 -0.750 1.00 20.10 O ATOM 533 CB LYS A 90 45.207 -4.098 -3.942 1.00 23.48 C ATOM 534 CG LYS A 90 46.628 -3.911 -3.434 1.00 32.78 C ATOM 535 CD LYS A 90 46.729 -2.775 -2.430 1.00 31.63 C ATOM 536 CE LYS A 90 48.056 -2.793 -1.695 1.00 33.15 C ATOM 537 NZ LYS A 90 47.966 -2.059 -0.400 1.00 38.76 N ATOM 538 HZ1 LYS A 90 47.700 -1.070 -0.581 1.00 0.00 H ATOM 539 HZ2 LYS A 90 47.247 -2.508 0.202 1.00 0.00 H ATOM 540 HZ3 LYS A 90 48.889 -2.089 0.079 1.00 0.00 H ATOM 541 H LYS A 90 43.131 -5.355 -4.796 1.00 0.00 H ATOM 542 N ASN A 91 42.751 -3.261 -2.248 1.00 18.08 N ATOM 543 CA ASN A 91 42.105 -2.401 -1.260 1.00 22.57 C ATOM 544 C ASN A 91 41.370 -3.225 -0.219 1.00 14.32 C ATOM 545 O ASN A 91 41.365 -2.900 0.967 1.00 16.15 O ATOM 546 CB ASN A 91 41.111 -1.440 -1.917 1.00 16.27 C ATOM 547 CG ASN A 91 41.778 -0.305 -2.667 1.00 18.92 C ATOM 548 OD1 ASN A 91 42.994 -0.168 -2.665 1.00 21.58 O ATOM 549 ND2 ASN A 91 40.972 0.507 -3.330 1.00 19.02 N ATOM 550 HD22 ASN A 91 39.944 0.354 -3.304 1.00 0.00 H ATOM 551 HD21 ASN A 91 41.366 1.299 -3.877 1.00 0.00 H ATOM 552 H ASN A 91 42.435 -3.230 -3.238 1.00 0.00 H ATOM 553 N THR A 92 40.766 -4.325 -0.639 1.00 18.74 N ATOM 554 CA THR A 92 39.996 -5.123 0.309 1.00 13.78 C ATOM 555 C THR A 92 40.937 -5.867 1.279 1.00 17.92 C ATOM 556 O THR A 92 40.619 -6.045 2.439 1.00 17.51 O ATOM 557 CB THR A 92 39.062 -6.048 -0.440 1.00 12.94 C ATOM 558 OG1 THR A 92 38.183 -5.218 -1.200 1.00 14.18 O ATOM 559 CG2 THR A 92 38.203 -6.912 0.494 1.00 14.93 C ATOM 560 HG1 THR A 92 38.713 -4.667 -1.829 1.00 0.00 H ATOM 561 H THR A 92 40.839 -4.618 -1.634 1.00 0.00 H ATOM 562 N ALA A 93 42.126 -6.227 0.823 1.00 20.05 N ATOM 563 CA ALA A 93 43.150 -6.723 1.739 1.00 18.21 C ATOM 564 C ALA A 93 43.546 -5.693 2.795 1.00 20.21 C ATOM 565 O ALA A 93 43.693 -6.020 3.974 1.00 18.22 O ATOM 566 CB ALA A 93 44.376 -7.162 0.948 1.00 20.61 C ATOM 567 H ALA A 93 42.333 -6.156 -0.194 1.00 0.00 H ATOM 568 N ALA A 94 43.764 -4.462 2.358 1.00 17.32 N ATOM 569 CA ALA A 94 44.117 -3.362 3.260 1.00 15.63 C ATOM 570 C ALA A 94 42.964 -3.100 4.223 1.00 20.96 C ATOM 571 O ALA A 94 43.153 -2.751 5.389 1.00 19.55 O ATOM 572 CB ALA A 94 44.445 -2.122 2.465 1.00 20.84 C ATOM 573 H ALA A 94 43.682 -4.269 1.339 1.00 0.00 H ATOM 574 N LEU A 95 41.746 -3.271 3.728 1.00 14.93 N ATOM 575 CA LEU A 95 40.569 -3.063 4.570 1.00 14.70 C ATOM 576 C LEU A 95 40.559 -4.023 5.729 1.00 20.08 C ATOM 577 O LEU A 95 40.355 -3.612 6.865 1.00 16.01 O ATOM 578 CB LEU A 95 39.283 -3.230 3.736 1.00 12.65 C ATOM 579 CG LEU A 95 37.952 -3.260 4.509 1.00 16.01 C ATOM 580 CD1 LEU A 95 37.716 -1.989 5.300 1.00 18.71 C ATOM 581 CD2 LEU A 95 36.814 -3.469 3.535 1.00 14.24 C ATOM 582 H LEU A 95 41.627 -3.555 2.735 1.00 0.00 H ATOM 583 N LEU A 96 40.789 -5.304 5.441 1.00 16.93 N ATOM 584 CA LEU A 96 40.775 -6.318 6.487 1.00 16.39 C ATOM 585 C LEU A 96 41.891 -6.059 7.495 1.00 16.97 C ATOM 586 O LEU A 96 41.669 -6.196 8.690 1.00 17.76 O ATOM 587 CB LEU A 96 40.905 -7.706 5.888 1.00 15.15 C ATOM 588 CG LEU A 96 39.670 -8.189 5.127 1.00 14.43 C ATOM 589 CD1 LEU A 96 39.927 -9.575 4.509 1.00 20.52 C ATOM 590 CD2 LEU A 96 38.388 -8.213 5.988 1.00 15.82 C ATOM 591 H LEU A 96 40.981 -5.583 4.458 1.00 0.00 H ATOM 592 N ALA A 97 43.063 -5.659 7.002 1.00 21.84 N ATOM 593 CA ALA A 97 44.194 -5.324 7.875 1.00 22.42 C ATOM 594 C ALA A 97 43.878 -4.117 8.758 1.00 20.55 C ATOM 595 O ALA A 97 44.187 -4.109 9.951 1.00 22.29 O ATOM 596 CB ALA A 97 45.417 -5.050 7.058 1.00 16.99 C ATOM 597 H ALA A 97 43.179 -5.582 5.971 1.00 0.00 H ATOM 598 N GLU A 98 43.253 -3.102 8.176 1.00 18.96 N ATOM 599 CA GLU A 98 42.940 -1.894 8.921 1.00 15.16 C ATOM 600 C GLU A 98 41.868 -2.198 9.985 1.00 23.42 C ATOM 601 O GLU A 98 41.900 -1.656 11.092 1.00 24.45 O ATOM 602 CB GLU A 98 42.494 -0.803 7.963 1.00 20.91 C ATOM 603 CG GLU A 98 42.782 0.607 8.429 1.00 41.70 C ATOM 604 CD GLU A 98 44.266 0.890 8.657 1.00 23.70 C ATOM 605 OE1 GLU A 98 45.081 0.715 7.728 1.00 28.63 O ATOM 606 OE2 GLU A 98 44.616 1.295 9.773 1.00 46.92 O ATOM 607 H GLU A 98 42.984 -3.172 7.174 1.00 0.00 H ATOM 608 N ILE A 99 40.926 -3.075 9.661 1.00 15.78 N ATOM 609 CA ILE A 99 39.914 -3.507 10.623 1.00 14.87 C ATOM 610 C ILE A 99 40.612 -4.229 11.779 1.00 20.09 C ATOM 611 O ILE A 99 40.357 -3.932 12.942 1.00 18.01 O ATOM 612 CB ILE A 99 38.821 -4.412 9.957 1.00 19.89 C ATOM 613 CG1 ILE A 99 37.929 -3.549 9.052 1.00 17.16 C ATOM 614 CG2 ILE A 99 37.938 -5.118 11.004 1.00 15.05 C ATOM 615 CD1 ILE A 99 36.953 -4.359 8.207 1.00 16.16 C ATOM 616 H ILE A 99 40.907 -3.465 8.697 1.00 0.00 H ATOM 617 N GLU A 100 41.507 -5.155 11.460 1.00 19.76 N ATOM 618 CA GLU A 100 42.224 -5.891 12.498 1.00 19.52 C ATOM 619 C GLU A 100 43.013 -4.926 13.388 1.00 21.55 C ATOM 620 O GLU A 100 43.015 -5.069 14.611 1.00 27.19 O ATOM 621 CB GLU A 100 43.134 -6.951 11.861 1.00 21.83 C ATOM 622 CG GLU A 100 44.067 -7.648 12.845 1.00 27.20 C ATOM 623 CD GLU A 100 43.343 -8.250 14.020 1.00 26.29 C ATOM 624 OE1 GLU A 100 42.138 -8.534 13.910 1.00 25.93 O ATOM 625 OE2 GLU A 100 43.985 -8.439 15.062 1.00 24.19 O ATOM 626 H GLU A 100 41.700 -5.359 10.459 1.00 0.00 H ATOM 627 N LYS A 102 43.671 -3.944 12.785 1.00 20.05 N ATOM 628 CA LYS A 102 44.496 -2.987 13.519 1.00 22.32 C ATOM 629 C LYS A 102 43.678 -2.068 14.427 1.00 25.66 C ATOM 630 O LYS A 102 44.035 -1.847 15.593 1.00 30.02 O ATOM 631 CB LYS A 102 45.308 -2.122 12.551 1.00 21.50 C ATOM 632 CG LYS A 102 46.094 -0.999 13.217 1.00 23.53 C ATOM 633 CD LYS A 102 46.830 -0.185 12.176 1.00 24.21 C ATOM 634 CE LYS A 102 47.560 0.984 12.796 1.00 27.80 C ATOM 635 NZ LYS A 102 48.223 1.818 11.765 1.00 46.53 N ATOM 636 HZ1 LYS A 102 48.911 1.239 11.242 1.00 0.00 H ATOM 637 HZ2 LYS A 102 47.507 2.187 11.107 1.00 0.00 H ATOM 638 HZ3 LYS A 102 48.714 2.611 12.225 1.00 0.00 H ATOM 639 H LYS A 102 43.597 -3.852 11.752 1.00 0.00 H ATOM 640 N GLN A 103 42.602 -1.509 13.890 1.00 21.60 N ATOM 641 CA GLN A 103 41.867 -0.445 14.562 1.00 19.42 C ATOM 642 C GLN A 103 40.696 -0.949 15.405 1.00 26.16 C ATOM 643 O GLN A 103 40.251 -0.267 16.327 1.00 30.26 O ATOM 644 CB GLN A 103 41.347 0.540 13.523 1.00 23.38 C ATOM 645 CG GLN A 103 42.454 1.197 12.709 1.00 23.78 C ATOM 646 CD GLN A 103 41.968 2.405 11.926 1.00 29.35 C ATOM 647 OE1 GLN A 103 42.335 2.595 10.763 1.00 32.65 O ATOM 648 NE2 GLN A 103 41.156 3.237 12.563 1.00 26.83 N ATOM 649 HE22 GLN A 103 40.872 3.038 13.543 1.00 0.00 H ATOM 650 HE21 GLN A 103 40.803 4.089 12.082 1.00 0.00 H ATOM 651 H GLN A 103 42.273 -1.840 12.961 1.00 0.00 H ATOM 652 N ILE A 104 40.184 -2.120 15.062 1.00 19.26 N ATOM 653 CA ILE A 104 39.014 -2.670 15.745 1.00 17.81 C ATOM 654 C ILE A 104 39.304 -4.019 16.399 1.00 18.75 C ATOM 655 O ILE A 104 38.940 -4.243 17.554 1.00 24.99 O ATOM 656 CB ILE A 104 37.819 -2.820 14.776 1.00 17.00 C ATOM 657 CG1 ILE A 104 37.488 -1.465 14.139 1.00 19.63 C ATOM 658 CG2 ILE A 104 36.624 -3.406 15.536 1.00 17.98 C ATOM 659 CD1 ILE A 104 36.354 -1.528 13.122 1.00 18.05 C ATOM 660 H ILE A 104 40.623 -2.661 14.290 1.00 0.00 H ATOM 661 N GLY A 105 39.905 -4.939 15.657 1.00 17.25 N ATOM 662 CA GLY A 105 40.377 -6.180 16.252 1.00 20.15 C ATOM 663 C GLY A 105 39.359 -7.292 16.423 1.00 31.85 C ATOM 664 O GLY A 105 39.646 -8.312 17.082 1.00 27.47 O ATOM 665 H GLY A 105 40.040 -4.772 14.639 1.00 0.00 H ATOM 666 N LEU A 106 38.176 -7.092 15.844 1.00 21.03 N ATOM 667 CA LEU A 106 37.122 -8.100 15.827 1.00 18.00 C ATOM 668 C LEU A 106 37.027 -8.741 14.448 1.00 20.59 C ATOM 669 O LEU A 106 37.303 -8.085 13.444 1.00 18.49 O ATOM 670 CB LEU A 106 35.775 -7.479 16.204 1.00 17.12 C ATOM 671 CG LEU A 106 35.251 -7.571 17.644 1.00 21.61 C ATOM 672 CD1 LEU A 106 36.341 -7.850 18.672 1.00 23.79 C ATOM 673 CD2 LEU A 106 34.510 -6.291 18.008 1.00 21.70 C ATOM 674 H LEU A 106 37.996 -6.177 15.384 1.00 0.00 H ATOM 675 N PRO A 107 36.633 -10.025 14.393 1.00 18.24 N ATOM 676 CA PRO A 107 36.533 -10.715 13.106 1.00 20.48 C ATOM 677 C PRO A 107 35.323 -10.310 12.269 1.00 17.56 C ATOM 678 O PRO A 107 34.225 -10.146 12.776 1.00 16.95 O ATOM 679 CB PRO A 107 36.404 -12.181 13.510 1.00 20.88 C ATOM 680 CG PRO A 107 35.708 -12.142 14.817 1.00 21.59 C ATOM 681 CD PRO A 107 36.248 -10.917 15.513 1.00 24.43 C ATOM 682 N VAL A 109 35.539 -10.198 10.967 1.00 16.70 N ATOM 683 CA VAL A 109 34.444 -10.003 10.027 1.00 13.63 C ATOM 684 C VAL A 109 33.897 -11.355 9.684 1.00 14.92 C ATOM 685 O VAL A 109 34.615 -12.188 9.110 1.00 19.77 O ATOM 686 CB VAL A 109 34.909 -9.306 8.731 1.00 14.28 C ATOM 687 CG1 VAL A 109 33.753 -9.190 7.743 1.00 17.36 C ATOM 688 CG2 VAL A 109 35.534 -7.924 9.021 1.00 21.24 C ATOM 689 H VAL A 109 36.514 -10.251 10.608 1.00 0.00 H ATOM 690 N THR A 110 32.644 -11.605 10.012 1.00 16.00 N ATOM 691 CA THR A 110 32.092 -12.933 9.808 1.00 16.68 C ATOM 692 C THR A 110 31.098 -12.997 8.648 1.00 15.17 C ATOM 693 O THR A 110 30.938 -14.040 8.045 1.00 15.90 O ATOM 694 CB THR A 110 31.436 -13.437 11.084 1.00 16.37 C ATOM 695 OG1 THR A 110 30.507 -12.473 11.574 1.00 19.24 O ATOM 696 CG2 THR A 110 32.519 -13.698 12.154 1.00 20.78 C ATOM 697 HG1 THR A 110 30.087 -12.813 12.404 1.00 0.00 H ATOM 698 H THR A 110 32.052 -10.852 10.416 1.00 0.00 H ATOM 699 N ARG A 111 30.467 -11.875 8.313 1.00 16.11 N ATOM 700 CA ARG A 111 29.582 -11.829 7.160 1.00 12.35 C ATOM 701 C ARG A 111 29.792 -10.508 6.427 1.00 13.68 C ATOM 702 O ARG A 111 30.178 -9.497 7.048 1.00 12.61 O ATOM 703 CB ARG A 111 28.119 -11.956 7.572 1.00 15.31 C ATOM 704 CG ARG A 111 27.721 -13.315 8.167 1.00 15.90 C ATOM 705 CD ARG A 111 26.206 -13.399 8.437 1.00 17.27 C ATOM 706 NE ARG A 111 25.803 -12.515 9.528 1.00 17.12 N ATOM 707 CZ ARG A 111 24.564 -12.435 10.006 1.00 20.44 C ATOM 708 NH1 ARG A 111 23.595 -13.180 9.498 1.00 20.08 N ATOM 709 NH2 ARG A 111 24.292 -11.614 11.011 1.00 23.10 N ATOM 710 HE ARG A 111 26.531 -11.910 9.958 1.00 0.00 H ATOM 711 HH12 ARG A 111 22.630 -13.109 9.880 1.00 0.00 H ATOM 712 HH11 ARG A 111 23.799 -13.836 8.717 1.00 0.00 H ATOM 713 HH22 ARG A 111 23.323 -11.552 11.384 1.00 0.00 H ATOM 714 HH21 ARG A 111 25.047 -11.032 11.426 1.00 0.00 H ATOM 715 H ARG A 111 30.609 -11.018 8.884 1.00 0.00 H ATOM 716 N ALA A 112 29.522 -10.515 5.120 1.00 13.55 N ATOM 717 CA ALA A 112 29.591 -9.293 4.330 1.00 10.72 C ATOM 718 C ALA A 112 28.389 -9.253 3.408 1.00 12.39 C ATOM 719 O ALA A 112 27.980 -10.286 2.887 1.00 12.02 O ATOM 720 CB ALA A 112 30.893 -9.225 3.509 1.00 8.79 C ATOM 721 H ALA A 112 29.258 -11.408 4.658 1.00 0.00 H ATOM 722 N VAL A 113 27.882 -8.040 3.147 1.00 11.54 N ATOM 723 CA VAL A 113 26.799 -7.830 2.210 1.00 10.12 C ATOM 724 C VAL A 113 27.285 -6.867 1.149 1.00 8.25 C ATOM 725 O VAL A 113 27.872 -5.845 1.488 1.00 11.12 O ATOM 726 CB VAL A 113 25.559 -7.251 2.910 1.00 9.20 C ATOM 727 CG1 VAL A 113 24.494 -6.785 1.926 1.00 14.63 C ATOM 728 CG2 VAL A 113 25.000 -8.251 3.882 1.00 9.75 C ATOM 729 H VAL A 113 28.283 -7.216 3.638 1.00 0.00 H ATOM 730 N SER A 114 27.079 -7.205 -0.122 1.00 9.68 N ATOM 731 CA SER A 114 27.354 -6.269 -1.211 1.00 8.78 C ATOM 732 C SER A 114 26.029 -5.659 -1.658 1.00 10.38 C ATOM 733 O SER A 114 25.069 -6.404 -1.884 1.00 11.71 O ATOM 734 CB SER A 114 28.051 -6.983 -2.377 1.00 10.62 C ATOM 735 OG SER A 114 29.358 -7.407 -2.049 1.00 12.06 O ATOM 736 HG SER A 114 29.318 -8.037 -1.286 1.00 0.00 H ATOM 737 H SER A 114 26.715 -8.154 -0.345 1.00 0.00 H ATOM 738 N THR A 115 25.974 -4.334 -1.828 1.00 10.20 N ATOM 739 CA THR A 115 24.705 -3.651 -2.057 1.00 8.01 C ATOM 740 C THR A 115 24.309 -3.425 -3.516 1.00 12.57 C ATOM 741 O THR A 115 23.169 -3.016 -3.768 1.00 12.31 O ATOM 742 CB THR A 115 24.673 -2.286 -1.324 1.00 10.13 C ATOM 743 OG1 THR A 115 25.756 -1.462 -1.760 1.00 10.44 O ATOM 744 CG2 THR A 115 24.770 -2.502 0.146 1.00 13.91 C ATOM 745 HG1 THR A 115 26.614 -1.915 -1.563 1.00 0.00 H ATOM 746 H THR A 115 26.853 -3.779 -1.796 1.00 0.00 H ATOM 747 N HIS A 116 25.228 -3.681 -4.469 1.00 11.96 N ATOM 748 CA HIS A 116 24.863 -3.929 -5.878 1.00 10.03 C ATOM 749 C HIS A 116 26.062 -4.521 -6.579 1.00 13.82 C ATOM 750 O HIS A 116 27.053 -4.825 -5.944 1.00 11.10 O ATOM 751 CB HIS A 116 24.356 -2.699 -6.612 1.00 9.89 C ATOM 752 CG HIS A 116 25.352 -1.605 -6.802 1.00 9.22 C ATOM 753 ND1 HIS A 116 25.639 -0.687 -5.820 1.00 11.36 N ATOM 754 CD2 HIS A 116 26.062 -1.221 -7.899 1.00 11.51 C ATOM 755 CE1 HIS A 116 26.506 0.197 -6.287 1.00 10.43 C ATOM 756 NE2 HIS A 116 26.776 -0.103 -7.548 1.00 11.17 N ATOM 757 H HIS A 116 26.233 -3.705 -4.201 1.00 0.00 H ATOM 758 N PHE A 117 25.920 -4.770 -7.880 1.00 11.61 N ATOM 759 CA PHE A 117 26.827 -5.670 -8.563 1.00 8.78 C ATOM 760 C PHE A 117 28.109 -5.053 -9.109 1.00 11.20 C ATOM 761 O PHE A 117 28.947 -5.773 -9.659 1.00 12.95 O ATOM 762 CB PHE A 117 26.087 -6.378 -9.711 1.00 10.46 C ATOM 763 CG PHE A 117 25.826 -5.513 -10.907 1.00 11.51 C ATOM 764 CD1 PHE A 117 24.779 -4.636 -10.926 1.00 12.55 C ATOM 765 CD2 PHE A 117 26.648 -5.590 -12.021 1.00 12.28 C ATOM 766 CE1 PHE A 117 24.543 -3.831 -12.019 1.00 13.38 C ATOM 767 CE2 PHE A 117 26.419 -4.801 -13.134 1.00 13.44 C ATOM 768 CZ PHE A 117 25.374 -3.912 -13.138 1.00 16.26 C ATOM 769 H PHE A 117 25.151 -4.314 -8.411 1.00 0.00 H ATOM 770 N HIS A 118 28.281 -3.744 -8.970 1.00 11.58 N ATOM 771 CA HIS A 118 29.463 -3.076 -9.523 1.00 11.71 C ATOM 772 C HIS A 118 30.725 -3.417 -8.716 1.00 11.17 C ATOM 773 O HIS A 118 30.662 -3.842 -7.561 1.00 12.27 O ATOM 774 CB HIS A 118 29.278 -1.578 -9.557 1.00 13.55 C ATOM 775 CG HIS A 118 28.338 -1.104 -10.615 1.00 11.25 C ATOM 776 ND1 HIS A 118 27.647 0.074 -10.501 1.00 12.36 N ATOM 777 CD2 HIS A 118 27.957 -1.661 -11.792 1.00 13.47 C ATOM 778 CE1 HIS A 118 26.886 0.240 -11.572 1.00 14.23 C ATOM 779 NE2 HIS A 118 27.053 -0.800 -12.370 1.00 13.67 N ATOM 780 H HIS A 118 27.567 -3.184 -8.461 1.00 0.00 H ATOM 781 N ASP A 119 31.882 -3.239 -9.330 1.00 10.75 N ATOM 782 CA ASP A 119 33.139 -3.665 -8.700 1.00 11.58 C ATOM 783 C ASP A 119 33.535 -2.878 -7.461 1.00 13.48 C ATOM 784 O ASP A 119 34.316 -3.402 -6.656 1.00 14.60 O ATOM 785 CB ASP A 119 34.275 -3.627 -9.723 1.00 14.49 C ATOM 786 CG ASP A 119 34.394 -4.927 -10.494 1.00 30.51 C ATOM 787 OD1 ASP A 119 34.569 -4.873 -11.725 1.00 33.83 O ATOM 788 OD2 ASP A 119 34.302 -6.007 -9.866 1.00 31.76 O ATOM 789 H ASP A 119 31.903 -2.793 -10.269 1.00 0.00 H ATOM 790 N ASP A 120 32.982 -1.682 -7.242 1.00 13.78 N ATOM 791 CA ASP A 120 33.264 -0.964 -6.011 1.00 12.83 C ATOM 792 C ASP A 120 32.492 -1.586 -4.837 1.00 13.01 C ATOM 793 O ASP A 120 32.800 -1.275 -3.678 1.00 16.35 O ATOM 794 CB ASP A 120 32.972 0.547 -6.141 1.00 13.59 C ATOM 795 CG ASP A 120 31.530 0.877 -6.560 1.00 11.19 C ATOM 796 OD1 ASP A 120 30.893 0.110 -7.331 1.00 13.94 O ATOM 797 OD2 ASP A 120 31.035 1.940 -6.109 1.00 14.25 O ATOM 798 H ASP A 120 32.349 -1.264 -7.954 1.00 0.00 H ATOM 799 N ARG A 121 31.569 -2.516 -5.130 1.00 11.44 N ATOM 800 CA ARG A 121 30.791 -3.241 -4.097 1.00 11.69 C ATOM 801 C ARG A 121 31.160 -4.727 -3.948 1.00 14.27 C ATOM 802 O ARG A 121 31.035 -5.278 -2.853 1.00 12.75 O ATOM 803 CB ARG A 121 29.285 -3.133 -4.391 1.00 13.17 C ATOM 804 CG ARG A 121 28.743 -1.737 -4.745 1.00 10.91 C ATOM 805 CD ARG A 121 28.796 -0.791 -3.584 1.00 13.11 C ATOM 806 NE ARG A 121 29.660 0.356 -3.802 1.00 12.25 N ATOM 807 CZ ARG A 121 30.108 1.128 -2.827 1.00 12.44 C ATOM 808 NH1 ARG A 121 29.736 0.878 -1.586 1.00 16.19 N ATOM 809 NH2 ARG A 121 30.930 2.143 -3.081 1.00 17.30 N ATOM 810 HE ARG A 121 29.941 0.582 -4.777 1.00 0.00 H ATOM 811 HH12 ARG A 121 30.081 1.477 -0.809 1.00 0.00 H ATOM 812 HH11 ARG A 121 29.098 0.082 -1.385 1.00 0.00 H ATOM 813 HH22 ARG A 121 31.274 2.741 -2.303 1.00 0.00 H ATOM 814 HH21 ARG A 121 31.229 2.338 -4.058 1.00 0.00 H ATOM 815 H ARG A 121 31.391 -2.739 -6.130 1.00 0.00 H ATOM 816 N VAL A 122 31.547 -5.400 -5.044 1.00 11.01 N ATOM 817 CA VAL A 122 31.909 -6.814 -5.016 1.00 10.74 C ATOM 818 C VAL A 122 33.367 -7.094 -5.364 1.00 12.45 C ATOM 819 O VAL A 122 33.830 -8.236 -5.186 1.00 14.14 O ATOM 820 CB VAL A 122 31.020 -7.634 -5.982 1.00 14.65 C ATOM 821 CG1 VAL A 122 29.554 -7.555 -5.551 1.00 13.27 C ATOM 822 CG2 VAL A 122 31.183 -7.202 -7.445 1.00 11.64 C ATOM 823 H VAL A 122 31.591 -4.892 -5.951 1.00 0.00 H ATOM 824 N GLY A 123 34.072 -6.103 -5.893 1.00 14.26 N ATOM 825 CA GLY A 123 35.491 -6.282 -6.189 1.00 12.78 C ATOM 826 C GLY A 123 36.259 -6.474 -4.894 1.00 12.92 C ATOM 827 O GLY A 123 36.381 -5.533 -4.110 1.00 15.80 O ATOM 828 H GLY A 123 33.612 -5.193 -6.098 1.00 0.00 H ATOM 829 N GLY A 124 36.778 -7.679 -4.674 1.00 15.38 N ATOM 830 CA GLY A 124 37.404 -8.029 -3.399 1.00 15.63 C ATOM 831 C GLY A 124 36.646 -9.120 -2.648 1.00 15.10 C ATOM 832 O GLY A 124 37.063 -9.556 -1.578 1.00 15.11 O ATOM 833 H GLY A 124 36.738 -8.392 -5.430 1.00 0.00 H ATOM 834 N VAL A 125 35.511 -9.564 -3.178 1.00 15.44 N ATOM 835 CA VAL A 125 34.750 -10.629 -2.536 1.00 12.62 C ATOM 836 C VAL A 125 35.590 -11.919 -2.404 1.00 15.55 C ATOM 837 O VAL A 125 35.436 -12.672 -1.435 1.00 17.45 O ATOM 838 CB VAL A 125 33.421 -10.885 -3.314 1.00 13.93 C ATOM 839 CG1 VAL A 125 32.887 -12.283 -3.104 1.00 15.54 C ATOM 840 CG2 VAL A 125 32.398 -9.847 -2.903 1.00 16.61 C ATOM 841 H VAL A 125 35.161 -9.146 -4.063 1.00 0.00 H ATOM 842 N ASP A 126 36.464 -12.178 -3.378 1.00 19.43 N ATOM 843 CA ASP A 126 37.294 -13.382 -3.303 1.00 20.31 C ATOM 844 C ASP A 126 38.269 -13.262 -2.120 1.00 18.55 C ATOM 845 O ASP A 126 38.534 -14.243 -1.418 1.00 19.20 O ATOM 846 CB ASP A 126 38.060 -13.628 -4.615 1.00 15.63 C ATOM 847 CG ASP A 126 37.139 -13.978 -5.800 1.00 21.12 C ATOM 848 OD1 ASP A 126 35.930 -14.235 -5.612 1.00 27.24 O ATOM 849 OD2 ASP A 126 37.633 -14.009 -6.943 1.00 28.81 O ATOM 850 H ASP A 126 36.555 -11.529 -4.185 1.00 0.00 H ATOM 851 N VAL A 127 38.803 -12.066 -1.895 1.00 14.52 N ATOM 852 CA VAL A 127 39.672 -11.811 -0.746 1.00 16.91 C ATOM 853 C VAL A 127 38.921 -12.031 0.555 1.00 20.10 C ATOM 854 O VAL A 127 39.435 -12.674 1.477 1.00 20.47 O ATOM 855 CB VAL A 127 40.238 -10.386 -0.779 1.00 18.69 C ATOM 856 CG1 VAL A 127 40.925 -10.029 0.547 1.00 24.13 C ATOM 857 CG2 VAL A 127 41.225 -10.243 -1.950 1.00 18.31 C ATOM 858 H VAL A 127 38.597 -11.289 -2.555 1.00 0.00 H ATOM 859 N LEU A 128 37.715 -11.486 0.656 1.00 17.02 N ATOM 860 CA LEU A 128 36.916 -11.726 1.833 1.00 13.01 C ATOM 861 C LEU A 128 36.692 -13.215 2.072 1.00 16.37 C ATOM 862 O LEU A 128 36.865 -13.719 3.202 1.00 15.65 O ATOM 863 CB LEU A 128 35.557 -11.035 1.722 1.00 14.38 C ATOM 864 CG LEU A 128 35.558 -9.531 1.561 1.00 16.72 C ATOM 865 CD1 LEU A 128 34.108 -9.073 1.364 1.00 14.51 C ATOM 866 CD2 LEU A 128 36.186 -8.868 2.781 1.00 18.56 C ATOM 867 H LEU A 128 37.347 -10.888 -0.111 1.00 0.00 H ATOM 868 N ARG A 129 36.279 -13.918 1.020 1.00 15.69 N ATOM 869 CA ARG A 129 35.940 -15.344 1.121 1.00 16.42 C ATOM 870 C ARG A 129 37.156 -16.148 1.577 1.00 21.92 C ATOM 871 O ARG A 129 37.035 -17.023 2.440 1.00 21.95 O ATOM 872 CB ARG A 129 35.413 -15.884 -0.211 1.00 16.38 C ATOM 873 CG ARG A 129 35.080 -17.396 -0.166 1.00 18.76 C ATOM 874 CD ARG A 129 34.702 -17.937 -1.512 1.00 22.88 C ATOM 875 NE ARG A 129 33.548 -17.267 -2.106 1.00 24.81 N ATOM 876 CZ ARG A 129 33.595 -16.387 -3.103 1.00 25.29 C ATOM 877 NH1 ARG A 129 34.747 -16.001 -3.636 1.00 29.54 N ATOM 878 NH2 ARG A 129 32.462 -15.864 -3.565 1.00 20.04 N ATOM 879 HE ARG A 129 32.611 -17.497 -1.717 1.00 0.00 H ATOM 880 HH12 ARG A 129 34.755 -15.312 -4.415 1.00 0.00 H ATOM 881 HH11 ARG A 129 35.642 -16.388 -3.275 1.00 0.00 H ATOM 882 HH22 ARG A 129 32.487 -15.175 -4.344 1.00 0.00 H ATOM 883 HH21 ARG A 129 31.552 -16.144 -3.147 1.00 0.00 H ATOM 884 H ARG A 129 36.194 -13.443 0.099 1.00 0.00 H ATOM 885 N ALA A 130 38.321 -15.849 1.013 1.00 17.78 N ATOM 886 CA ALA A 130 39.556 -16.546 1.393 1.00 22.36 C ATOM 887 C ALA A 130 39.870 -16.332 2.864 1.00 35.36 C ATOM 888 O ALA A 130 40.430 -17.213 3.518 1.00 30.96 O ATOM 889 CB ALA A 130 40.712 -16.074 0.543 1.00 24.92 C ATOM 890 H ALA A 130 38.359 -15.105 0.287 1.00 0.00 H ATOM 891 N ALA A 131 39.511 -15.159 3.385 1.00 26.21 N ATOM 892 CA ALA A 131 39.734 -14.854 4.797 1.00 25.89 C ATOM 893 C ALA A 131 38.652 -15.442 5.709 1.00 21.94 C ATOM 894 O ALA A 131 38.672 -15.206 6.917 1.00 28.86 O ATOM 895 CB ALA A 131 39.823 -13.357 5.002 1.00 22.17 C ATOM 896 H ALA A 131 39.063 -14.446 2.774 1.00 0.00 H ATOM 897 N GLY A 133 37.722 -16.196 5.140 1.00 20.91 N ATOM 898 CA GLY A 133 36.712 -16.910 5.906 1.00 22.91 C ATOM 899 C GLY A 133 35.417 -16.138 6.109 1.00 30.75 C ATOM 900 O GLY A 133 34.548 -16.561 6.883 1.00 20.44 O ATOM 901 H GLY A 133 37.714 -16.281 4.103 1.00 0.00 H ATOM 902 N VAL A 134 35.278 -15.007 5.414 1.00 17.24 N ATOM 903 CA VAL A 134 34.049 -14.222 5.505 1.00 18.21 C ATOM 904 C VAL A 134 32.950 -14.862 4.674 1.00 15.74 C ATOM 905 O VAL A 134 33.183 -15.277 3.549 1.00 17.86 O ATOM 906 CB VAL A 134 34.253 -12.771 5.014 1.00 17.17 C ATOM 907 CG1 VAL A 134 32.941 -11.967 5.157 1.00 16.17 C ATOM 908 CG2 VAL A 134 35.422 -12.115 5.740 1.00 14.40 C ATOM 909 H VAL A 134 36.053 -14.681 4.801 1.00 0.00 H ATOM 910 N ALA A 135 31.751 -14.959 5.229 1.00 14.15 N ATOM 911 CA ALA A 135 30.604 -15.414 4.474 1.00 14.30 C ATOM 912 C ALA A 135 30.004 -14.222 3.721 1.00 19.73 C ATOM 913 O ALA A 135 29.475 -13.285 4.346 1.00 15.61 O ATOM 914 CB ALA A 135 29.563 -16.040 5.391 1.00 13.08 C ATOM 915 H ALA A 135 31.632 -14.702 6.230 1.00 0.00 H ATOM 916 N THR A 136 30.059 -14.290 2.395 1.00 14.93 N ATOM 917 CA THR A 136 29.674 -13.172 1.523 1.00 10.45 C ATOM 918 C THR A 136 28.269 -13.368 0.994 1.00 13.56 C ATOM 919 O THR A 136 27.866 -14.488 0.601 1.00 12.27 O ATOM 920 CB THR A 136 30.671 -12.984 0.353 1.00 11.47 C ATOM 921 OG1 THR A 136 30.761 -14.186 -0.424 1.00 16.72 O ATOM 922 CG2 THR A 136 32.046 -12.607 0.899 1.00 14.81 C ATOM 923 HG1 THR A 136 31.075 -14.927 0.152 1.00 0.00 H ATOM 924 H THR A 136 30.389 -15.173 1.955 1.00 0.00 H ATOM 925 N TYR A 137 27.520 -12.263 0.999 1.00 11.02 N ATOM 926 CA TYR A 137 26.097 -12.238 0.673 1.00 11.21 C ATOM 927 C TYR A 137 25.747 -11.155 -0.315 1.00 10.86 C ATOM 928 O TYR A 137 26.349 -10.072 -0.306 1.00 10.15 O ATOM 929 CB TYR A 137 25.228 -11.958 1.905 1.00 11.90 C ATOM 930 CG TYR A 137 25.142 -13.089 2.905 1.00 14.73 C ATOM 931 CD1 TYR A 137 26.224 -13.425 3.693 1.00 16.78 C ATOM 932 CD2 TYR A 137 23.964 -13.776 3.064 1.00 14.31 C ATOM 933 CE1 TYR A 137 26.133 -14.463 4.614 1.00 14.62 C ATOM 934 CE2 TYR A 137 23.862 -14.811 3.959 1.00 14.06 C ATOM 935 CZ TYR A 137 24.942 -15.137 4.738 1.00 15.65 C ATOM 936 OH TYR A 137 24.811 -16.196 5.640 1.00 20.93 O ATOM 937 HH TYR A 137 25.662 -16.317 6.131 1.00 0.00 H ATOM 938 H TYR A 137 27.979 -11.364 1.251 1.00 0.00 H ATOM 939 N ALA A 138 24.720 -11.440 -1.094 1.00 10.16 N ATOM 940 CA ALA A 138 24.091 -10.439 -1.954 1.00 11.24 C ATOM 941 C ALA A 138 22.716 -10.971 -2.383 1.00 13.25 C ATOM 942 O ALA A 138 22.428 -12.167 -2.236 1.00 12.75 O ATOM 943 CB ALA A 138 24.981 -10.105 -3.169 1.00 11.64 C ATOM 944 H ALA A 138 24.345 -12.410 -1.096 1.00 0.00 H ATOM 945 N SER A 139 21.849 -10.107 -2.886 1.00 12.12 N ATOM 946 CA SER A 139 20.545 -10.561 -3.379 1.00 12.70 C ATOM 947 C SER A 139 20.742 -11.434 -4.616 1.00 12.07 C ATOM 948 O SER A 139 21.763 -11.317 -5.311 1.00 14.26 O ATOM 949 CB SER A 139 19.668 -9.390 -3.753 1.00 15.13 C ATOM 950 OG SER A 139 20.178 -8.826 -4.930 1.00 13.65 O ATOM 951 HG SER A 139 19.617 -8.054 -5.195 1.00 0.00 H ATOM 952 H SER A 139 22.095 -9.097 -2.932 1.00 0.00 H ATOM 953 N PRO A 140 19.773 -12.312 -4.907 1.00 15.46 N ATOM 954 CA PRO A 140 19.865 -13.072 -6.155 1.00 13.45 C ATOM 955 C PRO A 140 20.028 -12.162 -7.384 1.00 13.47 C ATOM 956 O PRO A 140 20.782 -12.498 -8.295 1.00 17.56 O ATOM 957 CB PRO A 140 18.547 -13.846 -6.181 1.00 14.01 C ATOM 958 CG PRO A 140 18.246 -14.086 -4.717 1.00 15.51 C ATOM 959 CD PRO A 140 18.662 -12.776 -4.057 1.00 17.80 C ATOM 960 N SER A 141 19.352 -11.022 -7.408 1.00 14.46 N ATOM 961 CA SER A 141 19.512 -10.082 -8.508 1.00 13.61 C ATOM 962 C SER A 141 20.965 -9.591 -8.642 1.00 13.31 C ATOM 963 O SER A 141 21.494 -9.531 -9.731 1.00 14.58 O ATOM 964 CB SER A 141 18.564 -8.892 -8.324 1.00 21.37 C ATOM 965 OG SER A 141 18.691 -7.979 -9.387 1.00 25.63 O ATOM 966 HG SER A 141 18.070 -7.221 -9.246 1.00 0.00 H ATOM 967 H SER A 141 18.699 -10.796 -6.631 1.00 0.00 H ATOM 968 N THR A 142 21.607 -9.225 -7.540 1.00 12.03 N ATOM 969 CA THR A 142 22.989 -8.786 -7.574 1.00 15.16 C ATOM 970 C THR A 142 23.901 -9.915 -8.038 1.00 10.89 C ATOM 971 O THR A 142 24.768 -9.681 -8.853 1.00 11.43 O ATOM 972 CB THR A 142 23.408 -8.254 -6.193 1.00 11.19 C ATOM 973 OG1 THR A 142 22.592 -7.110 -5.899 1.00 11.79 O ATOM 974 CG2 THR A 142 24.917 -7.946 -6.140 1.00 11.68 C ATOM 975 HG1 THR A 142 22.734 -6.418 -6.592 1.00 0.00 H ATOM 976 H THR A 142 21.107 -9.254 -6.629 1.00 0.00 H ATOM 977 N ARG A 143 23.669 -11.123 -7.548 1.00 11.22 N ATOM 978 CA ARG A 143 24.497 -12.259 -7.935 1.00 13.83 C ATOM 979 C ARG A 143 24.401 -12.525 -9.426 1.00 17.17 C ATOM 980 O ARG A 143 25.426 -12.742 -10.080 1.00 14.62 O ATOM 981 CB ARG A 143 24.118 -13.493 -7.108 1.00 18.03 C ATOM 982 CG ARG A 143 24.451 -13.315 -5.631 1.00 12.79 C ATOM 983 CD ARG A 143 24.058 -14.514 -4.767 1.00 14.31 C ATOM 984 NE ARG A 143 24.999 -15.609 -4.968 1.00 19.36 N ATOM 985 CZ ARG A 143 24.810 -16.666 -5.748 1.00 24.98 C ATOM 986 NH1 ARG A 143 23.681 -16.842 -6.419 1.00 21.84 N ATOM 987 NH2 ARG A 143 25.769 -17.578 -5.837 1.00 29.22 N ATOM 988 HE ARG A 143 25.901 -15.557 -4.453 1.00 0.00 H ATOM 989 HH12 ARG A 143 23.560 -17.680 -7.023 1.00 0.00 H ATOM 990 HH11 ARG A 143 22.916 -16.142 -6.342 1.00 0.00 H ATOM 991 HH22 ARG A 143 25.638 -18.413 -6.443 1.00 0.00 H ATOM 992 HH21 ARG A 143 26.652 -17.458 -5.300 1.00 0.00 H ATOM 993 H ARG A 143 22.886 -11.263 -6.878 1.00 0.00 H ATOM 994 N ARG A 144 23.186 -12.439 -9.958 1.00 15.12 N ATOM 995 CA ARG A 144 22.891 -12.669 -11.379 1.00 12.42 C ATOM 996 C ARG A 144 23.568 -11.615 -12.264 1.00 16.00 C ATOM 997 O ARG A 144 24.242 -11.934 -13.253 1.00 16.39 O ATOM 998 CB ARG A 144 21.364 -12.664 -11.528 1.00 19.16 C ATOM 999 CG ARG A 144 20.736 -12.830 -12.882 1.00 36.20 C ATOM 1000 CD ARG A 144 19.194 -12.584 -12.741 1.00 37.60 C ATOM 1001 NE ARG A 144 18.569 -13.410 -11.688 1.00 38.71 N ATOM 1002 CZ ARG A 144 17.641 -13.002 -10.808 1.00 33.26 C ATOM 1003 NH1 ARG A 144 17.169 -11.761 -10.803 1.00 34.14 N ATOM 1004 NH2 ARG A 144 17.168 -13.858 -9.913 1.00 28.83 N ATOM 1005 HE ARG A 144 18.877 -14.401 -11.622 1.00 0.00 H ATOM 1006 HH12 ARG A 144 16.450 -11.481 -10.106 1.00 0.00 H ATOM 1007 HH11 ARG A 144 17.518 -11.069 -11.496 1.00 0.00 H ATOM 1008 HH22 ARG A 144 16.449 -13.550 -9.228 1.00 0.00 H ATOM 1009 HH21 ARG A 144 17.516 -14.838 -9.896 1.00 0.00 H ATOM 1010 H ARG A 144 22.395 -12.194 -9.329 1.00 0.00 H ATOM 1011 N LEU A 145 23.440 -10.360 -11.866 1.00 12.90 N ATOM 1012 CA LEU A 145 24.043 -9.248 -12.600 1.00 12.94 C ATOM 1013 C LEU A 145 25.569 -9.275 -12.514 1.00 14.11 C ATOM 1014 O LEU A 145 26.268 -8.910 -13.465 1.00 16.26 O ATOM 1015 CB LEU A 145 23.496 -7.922 -12.068 1.00 15.09 C ATOM 1016 CG LEU A 145 22.048 -7.652 -12.469 1.00 12.66 C ATOM 1017 CD1 LEU A 145 21.430 -6.542 -11.595 1.00 13.53 C ATOM 1018 CD2 LEU A 145 21.923 -7.325 -13.943 1.00 25.20 C ATOM 1019 H LEU A 145 22.894 -10.158 -11.004 1.00 0.00 H ATOM 1020 N ALA A 146 26.102 -9.658 -11.359 1.00 14.20 N ATOM 1021 CA ALA A 146 27.538 -9.759 -11.227 1.00 11.77 C ATOM 1022 C ALA A 146 28.058 -10.833 -12.180 1.00 13.63 C ATOM 1023 O ALA A 146 29.054 -10.633 -12.854 1.00 15.03 O ATOM 1024 CB ALA A 146 27.932 -10.053 -9.778 1.00 12.82 C ATOM 1025 H ALA A 146 25.487 -9.885 -10.551 1.00 0.00 H ATOM 1026 N GLU A 147 27.363 -11.958 -12.237 1.00 14.04 N ATOM 1027 CA GLU A 147 27.766 -13.066 -13.101 1.00 16.68 C ATOM 1028 C GLU A 147 27.790 -12.636 -14.577 1.00 20.44 C ATOM 1029 O GLU A 147 28.709 -12.992 -15.330 1.00 19.55 O ATOM 1030 CB GLU A 147 26.824 -14.251 -12.889 1.00 15.26 C ATOM 1031 CG GLU A 147 27.173 -15.465 -13.731 1.00 22.29 C ATOM 1032 CD GLU A 147 26.434 -16.720 -13.310 1.00 27.97 C ATOM 1033 OE1 GLU A 147 25.608 -16.659 -12.376 1.00 30.74 O ATOM 1034 OE2 GLU A 147 26.691 -17.778 -13.920 1.00 42.27 O ATOM 1035 H GLU A 147 26.509 -12.056 -11.652 1.00 0.00 H ATOM 1036 N VAL A 148 26.787 -11.856 -14.970 1.00 16.35 N ATOM 1037 CA VAL A 148 26.662 -11.333 -16.345 1.00 17.87 C ATOM 1038 C VAL A 148 27.768 -10.359 -16.688 1.00 21.13 C ATOM 1039 O VAL A 148 28.333 -10.353 -17.809 1.00 21.05 O ATOM 1040 CB VAL A 148 25.280 -10.624 -16.546 1.00 21.60 C ATOM 1041 CG1 VAL A 148 25.252 -9.812 -17.834 1.00 26.98 C ATOM 1042 CG2 VAL A 148 24.157 -11.655 -16.521 1.00 24.68 C ATOM 1043 H VAL A 148 26.056 -11.602 -14.275 1.00 0.00 H ATOM 1044 N GLU A 149 28.071 -9.521 -15.712 1.00 18.13 N ATOM 1045 CA GLU A 149 29.069 -8.493 -15.863 1.00 17.57 C ATOM 1046 C GLU A 149 30.487 -9.054 -15.818 1.00 22.91 C ATOM 1047 O GLU A 149 31.413 -8.418 -16.312 1.00 21.01 O ATOM 1048 CB GLU A 149 28.893 -7.444 -14.758 1.00 16.89 C ATOM 1049 CG GLU A 149 29.641 -6.136 -15.003 1.00 24.07 C ATOM 1050 CD GLU A 149 29.120 -5.405 -16.231 1.00 41.93 C ATOM 1051 OE1 GLU A 149 27.893 -5.449 -16.486 1.00 30.51 O ATOM 1052 OE2 GLU A 149 29.945 -4.796 -16.943 1.00 41.61 O ATOM 1053 H GLU A 149 27.572 -9.607 -14.804 1.00 0.00 H ATOM 1054 N GLY A 150 30.652 -10.225 -15.202 1.00 15.75 N ATOM 1055 CA GLY A 150 31.962 -10.823 -15.028 1.00 15.19 C ATOM 1056 C GLY A 150 32.626 -10.398 -13.743 1.00 18.98 C ATOM 1057 O GLY A 150 33.839 -10.545 -13.576 1.00 19.05 O ATOM 1058 H GLY A 150 29.817 -10.724 -14.835 1.00 0.00 H ATOM 1059 N ASN A 165 31.822 -9.850 -12.833 1.00 15.04 N ATOM 1060 CA ASN A 165 32.323 -9.421 -11.542 1.00 18.20 C ATOM 1061 C ASN A 165 32.267 -10.569 -10.532 1.00 14.76 C ATOM 1062 O ASN A 165 31.581 -11.559 -10.745 1.00 17.33 O ATOM 1063 CB ASN A 165 31.514 -8.224 -11.045 1.00 14.53 C ATOM 1064 CG ASN A 165 31.784 -6.976 -11.843 1.00 21.84 C ATOM 1065 OD1 ASN A 165 32.692 -6.955 -12.665 1.00 19.34 O ATOM 1066 ND2 ASN A 165 31.000 -5.917 -11.611 1.00 16.55 N ATOM 1067 HD22 ASN A 165 30.240 -5.978 -10.904 1.00 0.00 H ATOM 1068 HD21 ASN A 165 31.151 -5.033 -12.138 1.00 0.00 H ATOM 1069 H ASN A 165 30.813 -9.727 -13.054 1.00 0.00 H ATOM 1070 N GLU A 166 33.002 -10.431 -9.438 1.00 15.51 N ATOM 1071 CA GLU A 166 32.988 -11.436 -8.384 1.00 15.10 C ATOM 1072 C GLU A 166 31.585 -11.607 -7.800 1.00 17.39 C ATOM 1073 O GLU A 166 30.820 -10.644 -7.680 1.00 14.97 O ATOM 1074 CB GLU A 166 33.995 -11.054 -7.304 1.00 14.54 C ATOM 1075 CG GLU A 166 35.432 -11.116 -7.821 1.00 13.75 C ATOM 1076 CD GLU A 166 36.389 -10.259 -7.021 1.00 23.62 C ATOM 1077 OE1 GLU A 166 36.735 -10.647 -5.897 1.00 27.00 O ATOM 1078 OE2 GLU A 166 36.803 -9.197 -7.532 1.00 21.72 O ATOM 1079 H GLU A 166 33.601 -9.588 -9.330 1.00 0.00 H ATOM 1080 N ILE A 167 31.251 -12.848 -7.457 1.00 15.32 N ATOM 1081 CA ILE A 167 29.901 -13.216 -7.062 1.00 13.50 C ATOM 1082 C ILE A 167 29.875 -13.616 -5.585 1.00 11.18 C ATOM 1083 O ILE A 167 30.440 -14.648 -5.203 1.00 13.51 O ATOM 1084 CB ILE A 167 29.361 -14.370 -7.935 1.00 15.20 C ATOM 1085 CG1 ILE A 167 29.463 -14.020 -9.432 1.00 16.80 C ATOM 1086 CG2 ILE A 167 27.905 -14.650 -7.592 1.00 15.95 C ATOM 1087 CD1 ILE A 167 29.307 -15.221 -10.356 1.00 20.84 C ATOM 1088 H ILE A 167 31.985 -13.585 -7.472 1.00 0.00 H ATOM 1089 N PRO A 168 29.227 -12.803 -4.726 1.00 13.08 N ATOM 1090 CA PRO A 168 28.993 -13.222 -3.338 1.00 13.55 C ATOM 1091 C PRO A 168 28.345 -14.605 -3.298 1.00 12.95 C ATOM 1092 O PRO A 168 27.500 -14.919 -4.124 1.00 13.94 O ATOM 1093 CB PRO A 168 28.073 -12.113 -2.802 1.00 11.42 C ATOM 1094 CG PRO A 168 28.502 -10.875 -3.608 1.00 12.43 C ATOM 1095 CD PRO A 168 28.687 -11.458 -4.990 1.00 15.52 C ATOM 1096 N THR A 169 28.754 -15.422 -2.335 1.00 14.92 N ATOM 1097 CA THR A 169 28.348 -16.819 -2.273 1.00 13.63 C ATOM 1098 C THR A 169 26.893 -17.048 -1.866 1.00 14.62 C ATOM 1099 O THR A 169 26.197 -17.873 -2.473 1.00 14.39 O ATOM 1100 CB THR A 169 29.273 -17.579 -1.285 1.00 14.98 C ATOM 1101 OG1 THR A 169 30.611 -17.604 -1.827 1.00 20.32 O ATOM 1102 CG2 THR A 169 28.771 -19.011 -1.018 1.00 21.05 C ATOM 1103 HG1 THR A 169 30.603 -18.066 -2.703 1.00 0.00 H ATOM 1104 H THR A 169 29.387 -15.051 -1.598 1.00 0.00 H ATOM 1105 N HIS A 170 26.453 -16.339 -0.834 1.00 12.00 N ATOM 1106 CA HIS A 170 25.130 -16.510 -0.276 1.00 12.76 C ATOM 1107 C HIS A 170 24.123 -15.530 -0.832 1.00 15.34 C ATOM 1108 O HIS A 170 24.470 -14.401 -1.211 1.00 15.67 O ATOM 1109 CB HIS A 170 25.173 -16.338 1.227 1.00 13.55 C ATOM 1110 CG HIS A 170 26.067 -17.302 1.930 1.00 20.88 C ATOM 1111 ND1 HIS A 170 25.579 -18.384 2.629 1.00 29.28 N ATOM 1112 CD2 HIS A 170 27.410 -17.333 2.071 1.00 22.03 C ATOM 1113 CE1 HIS A 170 26.585 -19.040 3.174 1.00 23.21 C ATOM 1114 NE2 HIS A 170 27.708 -18.441 2.835 1.00 24.73 N ATOM 1115 H HIS A 170 27.086 -15.631 -0.409 1.00 0.00 H ATOM 1116 N SER A 171 22.874 -15.979 -0.857 1.00 18.80 N ATOM 1117 CA SER A 171 21.750 -15.200 -1.341 1.00 13.15 C ATOM 1118 C SER A 171 20.938 -14.585 -0.203 1.00 15.58 C ATOM 1119 O SER A 171 20.635 -15.238 0.793 1.00 22.42 O ATOM 1120 CB SER A 171 20.851 -16.080 -2.215 1.00 18.24 C ATOM 1121 OG SER A 171 21.520 -16.474 -3.402 1.00 18.97 O ATOM 1122 HG SER A 171 22.333 -16.987 -3.166 1.00 0.00 H ATOM 1123 H SER A 171 22.691 -16.942 -0.510 1.00 0.00 H ATOM 1124 N LEU A 172 20.608 -13.310 -0.359 1.00 13.72 N ATOM 1125 CA LEU A 172 19.713 -12.613 0.550 1.00 12.91 C ATOM 1126 C LEU A 172 18.299 -12.748 0.021 1.00 18.49 C ATOM 1127 O LEU A 172 17.978 -12.188 -1.031 1.00 20.32 O ATOM 1128 CB LEU A 172 20.097 -11.139 0.643 1.00 14.45 C ATOM 1129 CG LEU A 172 21.454 -10.886 1.274 1.00 12.77 C ATOM 1130 CD1 LEU A 172 21.929 -9.496 0.969 1.00 15.71 C ATOM 1131 CD2 LEU A 172 21.369 -11.130 2.776 1.00 15.22 C ATOM 1132 H LEU A 172 21.006 -12.787 -1.165 1.00 0.00 H ATOM 1133 N GLU A 173 17.448 -13.463 0.746 1.00 18.52 N ATOM 1134 CA GLU A 173 16.064 -13.623 0.321 1.00 22.76 C ATOM 1135 C GLU A 173 15.192 -12.512 0.908 1.00 17.73 C ATOM 1136 O GLU A 173 15.567 -11.841 1.868 1.00 17.27 O ATOM 1137 CB GLU A 173 15.514 -14.997 0.735 1.00 27.00 C ATOM 1138 CG GLU A 173 16.203 -16.185 0.058 1.00 36.09 C ATOM 1139 CD GLU A 173 16.182 -16.121 -1.458 1.00 24.54 C ATOM 1140 OE1 GLU A 173 17.230 -16.423 -2.067 1.00 31.36 O ATOM 1141 OE2 GLU A 173 15.129 -15.785 -2.043 1.00 23.18 O ATOM 1142 H GLU A 173 17.772 -13.913 1.626 1.00 0.00 H ATOM 1143 N GLY A 174 14.029 -12.325 0.297 1.00 17.51 N ATOM 1144 CA GLY A 174 13.036 -11.414 0.816 1.00 16.64 C ATOM 1145 C GLY A 174 13.231 -9.953 0.424 1.00 14.69 C ATOM 1146 O GLY A 174 12.675 -9.067 1.087 1.00 17.56 O ATOM 1147 H GLY A 174 13.827 -12.848 -0.579 1.00 0.00 H ATOM 1148 N LEU A 175 14.001 -9.701 -0.632 1.00 13.53 N ATOM 1149 CA LEU A 175 14.297 -8.342 -1.081 1.00 11.23 C ATOM 1150 C LEU A 175 14.011 -8.036 -2.562 1.00 14.02 C ATOM 1151 O LEU A 175 14.519 -7.033 -3.092 1.00 18.74 O ATOM 1152 CB LEU A 175 15.777 -8.026 -0.796 1.00 17.04 C ATOM 1153 CG LEU A 175 16.189 -7.903 0.668 1.00 17.04 C ATOM 1154 CD1 LEU A 175 17.712 -8.000 0.810 1.00 12.49 C ATOM 1155 CD2 LEU A 175 15.643 -6.606 1.262 1.00 14.29 C ATOM 1156 H LEU A 175 14.407 -10.501 -1.157 1.00 0.00 H ATOM 1157 N SER A 176 13.216 -8.862 -3.239 1.00 15.85 N ATOM 1158 CA SER A 176 13.056 -8.707 -4.683 1.00 14.23 C ATOM 1159 C SER A 176 12.006 -7.669 -5.099 1.00 16.37 C ATOM 1160 O SER A 176 11.958 -7.296 -6.265 1.00 20.62 O ATOM 1161 CB SER A 176 12.694 -10.043 -5.334 1.00 19.85 C ATOM 1162 OG SER A 176 11.488 -10.555 -4.817 1.00 20.68 O ATOM 1163 HG SER A 176 10.756 -9.911 -4.991 1.00 0.00 H ATOM 1164 H SER A 176 12.708 -9.619 -2.739 1.00 0.00 H ATOM 1165 N SER A 177 11.169 -7.225 -4.164 1.00 15.95 N ATOM 1166 CA SER A 177 10.101 -6.282 -4.467 1.00 20.71 C ATOM 1167 C SER A 177 10.355 -4.920 -3.813 1.00 13.44 C ATOM 1168 O SER A 177 10.790 -4.864 -2.661 1.00 15.44 O ATOM 1169 CB SER A 177 8.763 -6.831 -3.995 1.00 22.04 C ATOM 1170 OG SER A 177 7.715 -5.988 -4.418 1.00 31.72 O ATOM 1171 HG SER A 177 6.851 -6.356 -4.105 1.00 0.00 H ATOM 1172 H SER A 177 11.281 -7.562 -3.187 1.00 0.00 H ATOM 1173 N SER A 178 10.111 -3.841 -4.552 1.00 15.34 N ATOM 1174 CA SER A 178 10.323 -2.495 -4.031 1.00 16.32 C ATOM 1175 C SER A 178 9.627 -2.273 -2.683 1.00 15.19 C ATOM 1176 O SER A 178 8.435 -2.545 -2.550 1.00 18.54 O ATOM 1177 CB SER A 178 9.832 -1.460 -5.046 1.00 16.27 C ATOM 1178 OG SER A 178 10.474 -1.638 -6.293 1.00 23.94 O ATOM 1179 HG SER A 178 10.142 -0.960 -6.933 1.00 0.00 H ATOM 1180 H SER A 178 9.761 -3.960 -5.524 1.00 0.00 H ATOM 1181 N GLY A 179 10.375 -1.802 -1.674 1.00 15.72 N ATOM 1182 CA GLY A 179 9.831 -1.575 -0.349 1.00 18.91 C ATOM 1183 C GLY A 179 10.040 -2.719 0.614 1.00 15.96 C ATOM 1184 O GLY A 179 9.672 -2.631 1.791 1.00 20.53 O ATOM 1185 H GLY A 179 11.379 -1.593 -1.848 1.00 0.00 H ATOM 1186 N ASP A 180 10.642 -3.803 0.126 1.00 15.96 N ATOM 1187 CA ASP A 180 10.976 -4.970 0.959 1.00 14.64 C ATOM 1188 C ASP A 180 12.077 -4.618 1.937 1.00 21.05 C ATOM 1189 O ASP A 180 13.040 -3.941 1.576 1.00 16.72 O ATOM 1190 CB ASP A 180 11.437 -6.161 0.102 1.00 15.75 C ATOM 1191 CG ASP A 180 10.286 -6.945 -0.526 1.00 19.15 C ATOM 1192 OD1 ASP A 180 9.123 -6.702 -0.157 1.00 20.04 O ATOM 1193 OD2 ASP A 180 10.560 -7.841 -1.355 1.00 24.77 O ATOM 1194 H ASP A 180 10.886 -3.826 -0.885 1.00 0.00 H ATOM 1195 N ALA A 181 11.945 -5.086 3.170 1.00 18.39 N ATOM 1196 CA ALA A 181 13.007 -4.955 4.152 1.00 14.64 C ATOM 1197 C ALA A 181 13.208 -6.291 4.841 1.00 17.56 C ATOM 1198 O ALA A 181 12.258 -7.035 5.010 1.00 18.54 O ATOM 1199 CB ALA A 181 12.682 -3.901 5.151 1.00 17.44 C ATOM 1200 H ALA A 181 11.059 -5.559 3.441 1.00 0.00 H ATOM 1201 N VAL A 182 14.441 -6.595 5.233 1.00 14.64 N ATOM 1202 CA VAL A 182 14.701 -7.775 6.056 1.00 16.76 C ATOM 1203 C VAL A 182 15.758 -7.449 7.074 1.00 18.43 C ATOM 1204 O VAL A 182 16.599 -6.579 6.846 1.00 17.22 O ATOM 1205 CB VAL A 182 15.162 -9.003 5.239 1.00 18.29 C ATOM 1206 CG1 VAL A 182 14.139 -9.365 4.178 1.00 19.40 C ATOM 1207 CG2 VAL A 182 16.527 -8.763 4.593 1.00 20.26 C ATOM 1208 H VAL A 182 15.233 -5.984 4.950 1.00 0.00 H ATOM 1209 N ARG A 183 15.716 -8.147 8.206 1.00 16.13 N ATOM 1210 CA ARG A 183 16.742 -7.995 9.226 1.00 14.58 C ATOM 1211 C ARG A 183 17.955 -8.826 8.846 1.00 20.84 C ATOM 1212 O ARG A 183 17.824 -9.920 8.271 1.00 18.12 O ATOM 1213 CB ARG A 183 16.210 -8.413 10.604 1.00 22.56 C ATOM 1214 CG ARG A 183 16.576 -7.450 11.735 1.00 43.50 C ATOM 1215 CD ARG A 183 17.499 -8.071 12.778 1.00 41.55 C ATOM 1216 NE ARG A 183 16.766 -8.816 13.791 1.00 51.69 N ATOM 1217 CZ ARG A 183 17.185 -9.023 15.038 1.00 34.49 C ATOM 1218 NH1 ARG A 183 18.349 -8.553 15.464 1.00 34.70 N ATOM 1219 NH2 ARG A 183 16.431 -9.721 15.863 1.00 45.69 N ATOM 1220 HE ARG A 183 15.845 -9.217 13.520 1.00 0.00 H ATOM 1221 HH12 ARG A 183 18.654 -8.728 16.443 1.00 0.00 H ATOM 1222 HH11 ARG A 183 18.957 -8.009 14.819 1.00 0.00 H ATOM 1223 HH22 ARG A 183 16.747 -9.890 16.839 1.00 0.00 H ATOM 1224 HH21 ARG A 183 15.520 -10.103 15.538 1.00 0.00 H ATOM 1225 H ARG A 183 14.934 -8.814 8.365 1.00 0.00 H ATOM 1226 N PHE A 184 19.135 -8.288 9.137 1.00 14.36 N ATOM 1227 CA PHE A 184 20.388 -9.001 8.906 1.00 15.85 C ATOM 1228 C PHE A 184 21.346 -8.640 10.029 1.00 16.54 C ATOM 1229 O PHE A 184 22.107 -7.685 9.960 1.00 15.52 O ATOM 1230 CB PHE A 184 20.975 -8.676 7.523 1.00 11.93 C ATOM 1231 CG PHE A 184 21.954 -9.708 7.027 1.00 12.50 C ATOM 1232 CD1 PHE A 184 21.497 -10.902 6.458 1.00 13.79 C ATOM 1233 CD2 PHE A 184 23.321 -9.524 7.157 1.00 13.53 C ATOM 1234 CE1 PHE A 184 22.398 -11.865 6.006 1.00 15.85 C ATOM 1235 CE2 PHE A 184 24.221 -10.468 6.694 1.00 13.36 C ATOM 1236 CZ PHE A 184 23.767 -11.637 6.119 1.00 14.49 C ATOM 1237 H PHE A 184 19.167 -7.330 9.541 1.00 0.00 H ATOM 1238 N GLY A 185 21.270 -9.405 11.114 1.00 15.18 N ATOM 1239 CA GLY A 185 22.064 -9.118 12.285 1.00 14.07 C ATOM 1240 C GLY A 185 21.734 -7.724 12.796 1.00 13.96 C ATOM 1241 O GLY A 185 20.566 -7.407 13.039 1.00 17.68 O ATOM 1242 H GLY A 185 20.628 -10.223 11.119 1.00 0.00 H ATOM 1243 N PRO A 186 22.756 -6.862 12.910 1.00 14.18 N ATOM 1244 CA PRO A 186 22.550 -5.545 13.516 1.00 14.02 C ATOM 1245 C PRO A 186 22.014 -4.459 12.577 1.00 15.10 C ATOM 1246 O PRO A 186 21.937 -3.286 12.979 1.00 14.65 O ATOM 1247 CB PRO A 186 23.963 -5.181 13.989 1.00 17.84 C ATOM 1248 CG PRO A 186 24.828 -5.722 12.906 1.00 16.16 C ATOM 1249 CD PRO A 186 24.167 -7.052 12.525 1.00 15.78 C ATOM 1250 N VAL A 187 21.667 -4.837 11.349 1.00 15.29 N ATOM 1251 CA VAL A 187 21.107 -3.884 10.398 1.00 13.61 C ATOM 1252 C VAL A 187 19.808 -4.379 9.810 1.00 11.01 C ATOM 1253 O VAL A 187 19.425 -5.561 9.943 1.00 14.49 O ATOM 1254 CB VAL A 187 22.112 -3.581 9.240 1.00 11.84 C ATOM 1255 CG1 VAL A 187 23.433 -3.203 9.831 1.00 12.55 C ATOM 1256 CG2 VAL A 187 22.272 -4.760 8.292 1.00 14.68 C ATOM 1257 H VAL A 187 21.797 -5.828 11.063 1.00 0.00 H ATOM 1258 N GLU A 188 19.144 -3.457 9.134 1.00 11.11 N ATOM 1259 CA GLU A 188 18.044 -3.757 8.259 1.00 9.96 C ATOM 1260 C GLU A 188 18.499 -3.502 6.842 1.00 11.97 C ATOM 1261 O GLU A 188 19.141 -2.509 6.562 1.00 13.27 O ATOM 1262 CB GLU A 188 16.835 -2.890 8.591 1.00 15.66 C ATOM 1263 CG GLU A 188 15.585 -3.244 7.789 1.00 20.63 C ATOM 1264 CD GLU A 188 14.334 -2.616 8.383 1.00 33.17 C ATOM 1265 OE1 GLU A 188 14.070 -1.426 8.104 1.00 27.11 O ATOM 1266 OE2 GLU A 188 13.631 -3.310 9.144 1.00 31.76 O ATOM 1267 H GLU A 188 19.432 -2.464 9.241 1.00 0.00 H ATOM 1268 N LEU A 189 18.179 -4.441 5.975 1.00 12.71 N ATOM 1269 CA LEU A 189 18.406 -4.307 4.543 1.00 10.61 C ATOM 1270 C LEU A 189 17.098 -3.931 3.870 1.00 12.72 C ATOM 1271 O LEU A 189 16.045 -4.489 4.180 1.00 14.76 O ATOM 1272 CB LEU A 189 18.959 -5.608 3.977 1.00 10.36 C ATOM 1273 CG LEU A 189 20.193 -6.219 4.618 1.00 10.01 C ATOM 1274 CD1 LEU A 189 20.522 -7.575 3.969 1.00 15.36 C ATOM 1275 CD2 LEU A 189 21.388 -5.273 4.537 1.00 12.46 C ATOM 1276 H LEU A 189 17.745 -5.317 6.329 1.00 0.00 H ATOM 1277 N PHE A 190 17.177 -2.992 2.930 1.00 11.82 N ATOM 1278 CA PHE A 190 15.996 -2.428 2.287 1.00 13.31 C ATOM 1279 C PHE A 190 16.224 -2.337 0.776 1.00 11.91 C ATOM 1280 O PHE A 190 17.249 -1.835 0.310 1.00 11.83 O ATOM 1281 CB PHE A 190 15.681 -1.058 2.886 1.00 12.86 C ATOM 1282 CG PHE A 190 14.485 -0.377 2.298 1.00 13.48 C ATOM 1283 CD1 PHE A 190 13.211 -0.817 2.612 1.00 16.26 C ATOM 1284 CD2 PHE A 190 14.615 0.770 1.531 1.00 13.47 C ATOM 1285 CE1 PHE A 190 12.103 -0.161 2.139 1.00 13.49 C ATOM 1286 CE2 PHE A 190 13.485 1.436 1.034 1.00 14.42 C ATOM 1287 CZ PHE A 190 12.235 0.964 1.347 1.00 15.83 C ATOM 1288 H PHE A 190 18.116 -2.648 2.644 1.00 0.00 H ATOM 1289 N TYR A 191 15.261 -2.805 0.004 1.00 12.37 N ATOM 1290 CA TYR A 191 15.292 -2.640 -1.447 1.00 12.70 C ATOM 1291 C TYR A 191 14.335 -1.517 -1.800 1.00 14.94 C ATOM 1292 O TYR A 191 13.128 -1.707 -1.720 1.00 13.71 O ATOM 1293 CB TYR A 191 14.868 -3.904 -2.200 1.00 11.54 C ATOM 1294 CG TYR A 191 14.798 -3.703 -3.696 1.00 13.27 C ATOM 1295 CD1 TYR A 191 15.848 -3.123 -4.392 1.00 13.19 C ATOM 1296 CD2 TYR A 191 13.684 -4.082 -4.399 1.00 13.76 C ATOM 1297 CE1 TYR A 191 15.785 -2.924 -5.754 1.00 15.42 C ATOM 1298 CE2 TYR A 191 13.608 -3.908 -5.770 1.00 11.65 C ATOM 1299 CZ TYR A 191 14.664 -3.326 -6.449 1.00 14.06 C ATOM 1300 OH TYR A 191 14.574 -3.146 -7.812 1.00 15.18 O ATOM 1301 HH TYR A 191 15.405 -2.721 -8.143 1.00 0.00 H ATOM 1302 H TYR A 191 14.460 -3.304 0.440 1.00 0.00 H ATOM 1303 N PRO A 192 14.865 -0.356 -2.206 1.00 12.50 N ATOM 1304 CA PRO A 192 13.968 0.766 -2.459 1.00 13.71 C ATOM 1305 C PRO A 192 13.318 0.775 -3.817 1.00 12.97 C ATOM 1306 O PRO A 192 12.464 1.615 -4.063 1.00 14.10 O ATOM 1307 CB PRO A 192 14.902 1.973 -2.341 1.00 11.91 C ATOM 1308 CG PRO A 192 16.197 1.464 -2.890 1.00 11.44 C ATOM 1309 CD PRO A 192 16.286 0.056 -2.302 1.00 12.78 C ATOM 1310 N GLY A 193 13.739 -0.128 -4.697 1.00 12.37 N ATOM 1311 CA GLY A 193 13.368 -0.066 -6.098 1.00 15.10 C ATOM 1312 C GLY A 193 14.594 0.293 -6.927 1.00 11.85 C ATOM 1313 O GLY A 193 15.643 0.663 -6.376 1.00 11.46 O ATOM 1314 H GLY A 193 14.353 -0.902 -4.371 1.00 0.00 H ATOM 1315 N ALA A 194 14.463 0.211 -8.244 1.00 11.36 N ATOM 1316 CA ALA A 194 15.572 0.518 -9.145 1.00 13.12 C ATOM 1317 C ALA A 194 15.996 1.987 -9.037 1.00 15.31 C ATOM 1318 O ALA A 194 15.162 2.891 -8.896 1.00 13.58 O ATOM 1319 CB ALA A 194 15.213 0.183 -10.564 1.00 12.32 C ATOM 1320 H ALA A 194 13.549 -0.079 -8.646 1.00 0.00 H ATOM 1321 N ALA A 195 17.306 2.232 -9.092 1.00 11.78 N ATOM 1322 CA ALA A 195 17.805 3.593 -8.967 1.00 11.03 C ATOM 1323 C ALA A 195 19.142 3.696 -9.697 1.00 14.28 C ATOM 1324 O ALA A 195 19.159 3.709 -10.920 1.00 12.19 O ATOM 1325 CB ALA A 195 17.923 4.001 -7.501 1.00 11.15 C ATOM 1326 H ALA A 195 17.974 1.446 -9.225 1.00 0.00 H ATOM 1327 N HIS A 196 20.244 3.777 -8.958 1.00 11.26 N ATOM 1328 CA HIS A 196 21.577 3.735 -9.536 1.00 9.26 C ATOM 1329 C HIS A 196 21.762 2.447 -10.342 1.00 10.37 C ATOM 1330 O HIS A 196 22.396 2.443 -11.385 1.00 12.84 O ATOM 1331 CB HIS A 196 22.634 3.843 -8.426 1.00 10.97 C ATOM 1332 CG HIS A 196 24.013 3.447 -8.845 1.00 14.08 C ATOM 1333 ND1 HIS A 196 24.880 4.312 -9.475 1.00 15.01 N ATOM 1334 CD2 HIS A 196 24.701 2.291 -8.662 1.00 12.36 C ATOM 1335 CE1 HIS A 196 26.026 3.686 -9.709 1.00 10.90 C ATOM 1336 NE2 HIS A 196 25.942 2.460 -9.221 1.00 11.77 N ATOM 1337 H HIS A 196 20.149 3.874 -7.927 1.00 0.00 H ATOM 1338 N SER A 197 21.193 1.367 -9.835 1.00 11.62 N ATOM 1339 CA SER A 197 21.140 0.094 -10.542 1.00 14.85 C ATOM 1340 C SER A 197 19.818 -0.582 -10.178 1.00 12.13 C ATOM 1341 O SER A 197 19.104 -0.156 -9.265 1.00 11.77 O ATOM 1342 CB SER A 197 22.348 -0.753 -10.173 1.00 11.52 C ATOM 1343 OG SER A 197 22.294 -1.090 -8.808 1.00 12.07 O ATOM 1344 HG SER A 197 21.466 -1.603 -8.628 1.00 0.00 H ATOM 1345 H SER A 197 20.764 1.429 -8.890 1.00 0.00 H ATOM 1346 N THR A 198 19.428 -1.614 -10.899 1.00 10.42 N ATOM 1347 CA THR A 198 18.157 -2.250 -10.589 1.00 10.71 C ATOM 1348 C THR A 198 18.200 -3.040 -9.292 1.00 11.92 C ATOM 1349 O THR A 198 17.154 -3.301 -8.661 1.00 14.24 O ATOM 1350 CB THR A 198 17.690 -3.202 -11.741 1.00 17.24 C ATOM 1351 OG1 THR A 198 18.633 -4.259 -11.914 1.00 21.48 O ATOM 1352 CG2 THR A 198 17.517 -2.460 -13.049 1.00 16.20 C ATOM 1353 HG1 THR A 198 18.329 -4.855 -12.644 1.00 0.00 H ATOM 1354 H THR A 198 20.020 -1.968 -11.677 1.00 0.00 H ATOM 1355 N ASP A 199 19.394 -3.421 -8.859 1.00 9.75 N ATOM 1356 CA ASP A 199 19.559 -4.274 -7.691 1.00 11.75 C ATOM 1357 C ASP A 199 19.979 -3.536 -6.399 1.00 9.66 C ATOM 1358 O ASP A 199 20.177 -4.183 -5.341 1.00 11.20 O ATOM 1359 CB ASP A 199 20.600 -5.370 -7.990 1.00 11.69 C ATOM 1360 CG ASP A 199 21.967 -4.812 -8.320 1.00 12.69 C ATOM 1361 OD1 ASP A 199 22.038 -3.761 -8.976 1.00 11.01 O ATOM 1362 OD2 ASP A 199 22.991 -5.401 -7.892 1.00 11.58 O ATOM 1363 H ASP A 199 20.241 -3.100 -9.371 1.00 0.00 H ATOM 1364 N ASN A 200 20.099 -2.229 -6.456 1.00 10.20 N ATOM 1365 CA ASN A 200 20.737 -1.549 -5.335 1.00 8.57 C ATOM 1366 C ASN A 200 19.949 -1.694 -4.024 1.00 10.48 C ATOM 1367 O ASN A 200 18.736 -1.487 -3.978 1.00 11.62 O ATOM 1368 CB ASN A 200 21.054 -0.073 -5.659 1.00 10.32 C ATOM 1369 CG ASN A 200 19.889 0.735 -6.245 1.00 10.98 C ATOM 1370 OD1 ASN A 200 20.137 1.715 -6.961 1.00 11.19 O ATOM 1371 ND2 ASN A 200 18.651 0.399 -5.914 1.00 11.58 N ATOM 1372 HD22 ASN A 200 18.481 -0.431 -5.311 1.00 0.00 H ATOM 1373 HD21 ASN A 200 17.849 0.965 -6.258 1.00 0.00 H ATOM 1374 H ASN A 200 19.749 -1.695 -7.277 1.00 0.00 H ATOM 1375 N LEU A 201 20.681 -2.039 -2.969 1.00 12.39 N ATOM 1376 CA LEU A 201 20.150 -2.112 -1.600 1.00 9.21 C ATOM 1377 C LEU A 201 20.620 -0.960 -0.762 1.00 10.57 C ATOM 1378 O LEU A 201 21.715 -0.431 -0.979 1.00 9.98 O ATOM 1379 CB LEU A 201 20.594 -3.394 -0.876 1.00 13.59 C ATOM 1380 CG LEU A 201 20.220 -4.731 -1.491 1.00 11.21 C ATOM 1381 CD1 LEU A 201 20.783 -5.875 -0.678 1.00 13.09 C ATOM 1382 CD2 LEU A 201 18.716 -4.826 -1.623 1.00 14.25 C ATOM 1383 H LEU A 201 21.684 -2.270 -3.120 1.00 0.00 H ATOM 1384 N VAL A 202 19.800 -0.581 0.215 1.00 11.65 N ATOM 1385 CA VAL A 202 20.249 0.335 1.257 1.00 10.91 C ATOM 1386 C VAL A 202 20.270 -0.384 2.594 1.00 10.62 C ATOM 1387 O VAL A 202 19.665 -1.428 2.757 1.00 11.32 O ATOM 1388 CB VAL A 202 19.385 1.609 1.364 1.00 19.38 C ATOM 1389 CG1 VAL A 202 19.231 2.294 0.014 1.00 15.94 C ATOM 1390 CG2 VAL A 202 18.037 1.320 1.906 1.00 31.97 C ATOM 1391 H VAL A 202 18.825 -0.943 0.236 1.00 0.00 H ATOM 1392 N VAL A 203 21.020 0.181 3.535 1.00 10.60 N ATOM 1393 CA VAL A 203 21.281 -0.458 4.815 1.00 12.99 C ATOM 1394 C VAL A 203 21.020 0.540 5.921 1.00 13.23 C ATOM 1395 O VAL A 203 21.504 1.657 5.868 1.00 11.18 O ATOM 1396 CB VAL A 203 22.715 -0.989 4.897 1.00 11.87 C ATOM 1397 CG1 VAL A 203 22.964 -1.704 6.247 1.00 11.78 C ATOM 1398 CG2 VAL A 203 23.016 -1.912 3.709 1.00 11.84 C ATOM 1399 H VAL A 203 21.436 1.116 3.349 1.00 0.00 H ATOM 1400 N TYR A 204 20.226 0.135 6.911 1.00 12.08 N ATOM 1401 CA TYR A 204 19.933 0.979 8.050 1.00 11.69 C ATOM 1402 C TYR A 204 20.443 0.327 9.337 1.00 12.58 C ATOM 1403 O TYR A 204 20.228 -0.861 9.542 1.00 15.28 O ATOM 1404 CB TYR A 204 18.435 1.240 8.158 1.00 13.58 C ATOM 1405 CG TYR A 204 18.130 2.326 9.196 1.00 12.11 C ATOM 1406 CD1 TYR A 204 18.604 3.630 9.058 1.00 13.61 C ATOM 1407 CD2 TYR A 204 17.400 2.015 10.325 1.00 13.04 C ATOM 1408 CE1 TYR A 204 18.333 4.611 10.036 1.00 13.03 C ATOM 1409 CE2 TYR A 204 17.131 2.972 11.293 1.00 17.40 C ATOM 1410 CZ TYR A 204 17.599 4.253 11.136 1.00 12.55 C ATOM 1411 OH TYR A 204 17.339 5.227 12.090 1.00 18.54 O ATOM 1412 HH TYR A 204 17.719 4.945 12.960 1.00 0.00 H ATOM 1413 H TYR A 204 19.805 -0.815 6.864 1.00 0.00 H ATOM 1414 N VAL A 205 21.085 1.126 10.190 1.00 12.23 N ATOM 1415 CA VAL A 205 21.547 0.672 11.506 1.00 10.05 C ATOM 1416 C VAL A 205 20.678 1.350 12.567 1.00 13.46 C ATOM 1417 O VAL A 205 20.915 2.513 12.900 1.00 16.73 O ATOM 1418 CB VAL A 205 23.031 1.032 11.758 1.00 13.05 C ATOM 1419 CG1 VAL A 205 23.573 0.284 12.984 1.00 15.39 C ATOM 1420 CG2 VAL A 205 23.903 0.745 10.533 1.00 16.68 C ATOM 1421 H VAL A 205 21.266 2.111 9.911 1.00 0.00 H ATOM 1422 N PRO A 209 19.661 0.632 13.078 1.00 17.24 N ATOM 1423 CA PRO A 209 18.684 1.241 13.986 1.00 18.97 C ATOM 1424 C PRO A 209 19.293 1.795 15.260 1.00 18.88 C ATOM 1425 O PRO A 209 18.865 2.868 15.709 1.00 19.89 O ATOM 1426 CB PRO A 209 17.735 0.078 14.311 1.00 23.11 C ATOM 1427 CG PRO A 209 17.854 -0.842 13.188 1.00 23.00 C ATOM 1428 CD PRO A 209 19.279 -0.737 12.716 1.00 17.44 C ATOM 1429 N SER A 210 20.279 1.113 15.836 1.00 16.86 N ATOM 1430 CA SER A 210 20.845 1.573 17.105 1.00 21.70 C ATOM 1431 C SER A 210 21.573 2.912 17.000 1.00 23.64 C ATOM 1432 O SER A 210 21.815 3.581 18.013 1.00 24.84 O ATOM 1433 CB SER A 210 21.804 0.529 17.662 1.00 16.61 C ATOM 1434 OG SER A 210 22.928 0.358 16.809 1.00 28.51 O ATOM 1435 HG SER A 210 22.621 0.061 15.916 1.00 0.00 H ATOM 1436 H SER A 210 20.648 0.252 15.384 1.00 0.00 H ATOM 1437 N ALA A 211 21.915 3.303 15.774 1.00 19.49 N ATOM 1438 CA ALA A 211 22.780 4.453 15.528 1.00 16.27 C ATOM 1439 C ALA A 211 22.141 5.504 14.633 1.00 16.16 C ATOM 1440 O ALA A 211 22.741 6.545 14.408 1.00 20.76 O ATOM 1441 CB ALA A 211 24.094 3.999 14.906 1.00 17.45 C ATOM 1442 H ALA A 211 21.552 2.768 14.960 1.00 0.00 H ATOM 1443 N SER A 215 20.947 5.208 14.123 1.00 16.95 N ATOM 1444 CA SER A 215 20.248 6.066 13.155 1.00 16.40 C ATOM 1445 C SER A 215 21.120 6.387 11.949 1.00 16.97 C ATOM 1446 O SER A 215 21.113 7.515 11.424 1.00 14.31 O ATOM 1447 CB SER A 215 19.749 7.360 13.826 1.00 25.09 C ATOM 1448 OG SER A 215 18.946 7.021 14.950 1.00 20.39 O ATOM 1449 HG SER A 215 18.623 7.849 15.385 1.00 0.00 H ATOM 1450 H SER A 215 20.486 4.326 14.424 1.00 0.00 H ATOM 1451 N VAL A 216 21.844 5.361 11.485 1.00 11.82 N ATOM 1452 CA VAL A 216 22.732 5.509 10.337 1.00 13.42 C ATOM 1453 C VAL A 216 22.093 4.849 9.122 1.00 12.51 C ATOM 1454 O VAL A 216 21.808 3.638 9.131 1.00 12.31 O ATOM 1455 CB VAL A 216 24.120 4.892 10.597 1.00 15.85 C ATOM 1456 CG1 VAL A 216 24.959 4.851 9.296 1.00 16.63 C ATOM 1457 CG2 VAL A 216 24.849 5.661 11.655 1.00 17.25 C ATOM 1458 H VAL A 216 21.772 4.436 11.954 1.00 0.00 H ATOM 1459 N LEU A 217 21.901 5.655 8.083 1.00 13.24 N ATOM 1460 CA LEU A 217 21.359 5.179 6.816 1.00 11.81 C ATOM 1461 C LEU A 217 22.480 5.169 5.787 1.00 12.69 C ATOM 1462 O LEU A 217 23.064 6.210 5.444 1.00 12.12 O ATOM 1463 CB LEU A 217 20.216 6.052 6.350 1.00 12.15 C ATOM 1464 CG LEU A 217 19.599 5.710 4.991 1.00 16.03 C ATOM 1465 CD1 LEU A 217 18.876 4.398 5.057 1.00 19.25 C ATOM 1466 CD2 LEU A 217 18.647 6.828 4.562 1.00 17.06 C ATOM 1467 H LEU A 217 22.146 6.661 8.177 1.00 0.00 H ATOM 1468 N TYR A 218 22.776 3.976 5.290 1.00 15.12 N ATOM 1469 CA TYR A 218 23.773 3.819 4.253 1.00 12.75 C ATOM 1470 C TYR A 218 23.074 3.656 2.929 1.00 12.83 C ATOM 1471 O TYR A 218 22.441 2.648 2.661 1.00 13.25 O ATOM 1472 CB TYR A 218 24.648 2.628 4.588 1.00 11.79 C ATOM 1473 CG TYR A 218 25.684 2.211 3.598 1.00 13.39 C ATOM 1474 CD1 TYR A 218 26.963 2.744 3.637 1.00 18.80 C ATOM 1475 CD2 TYR A 218 25.411 1.227 2.663 1.00 10.65 C ATOM 1476 CE1 TYR A 218 27.934 2.310 2.787 1.00 18.07 C ATOM 1477 CE2 TYR A 218 26.370 0.787 1.813 1.00 12.94 C ATOM 1478 CZ TYR A 218 27.631 1.325 1.860 1.00 18.99 C ATOM 1479 OH TYR A 218 28.596 0.867 1.000 1.00 22.44 O ATOM 1480 HH TYR A 218 28.739 -0.101 1.151 1.00 0.00 H ATOM 1481 H TYR A 218 22.282 3.136 5.653 1.00 0.00 H ATOM 1482 N GLY A 219 23.160 4.692 2.112 1.00 13.09 N ATOM 1483 CA GLY A 219 22.401 4.744 0.869 1.00 12.69 C ATOM 1484 C GLY A 219 23.104 4.060 -0.271 1.00 13.14 C ATOM 1485 O GLY A 219 22.495 3.772 -1.300 1.00 14.27 O ATOM 1486 H GLY A 219 23.783 5.487 2.362 1.00 0.00 H ATOM 1487 N GLY A 220 24.376 3.751 -0.091 1.00 13.94 N ATOM 1488 CA GLY A 220 25.167 3.219 -1.187 1.00 12.54 C ATOM 1489 C GLY A 220 25.087 4.137 -2.400 1.00 14.86 C ATOM 1490 O GLY A 220 24.859 5.343 -2.268 1.00 12.33 O ATOM 1491 H GLY A 220 24.814 3.890 0.842 1.00 0.00 H ATOM 1492 N CYS A 221 25.236 3.586 -3.592 1.00 11.21 N ATOM 1493 CA CYS A 221 25.494 4.453 -4.737 1.00 12.40 C ATOM 1494 C CYS A 221 24.198 5.012 -5.321 1.00 12.76 C ATOM 1495 O CYS A 221 24.231 5.824 -6.245 1.00 12.20 O ATOM 1496 CB CYS A 221 26.334 3.695 -5.773 1.00 9.70 C ATOM 1497 SG CYS A 221 27.924 3.096 -5.023 1.00 14.27 S ATOM 1498 H CYS A 221 25.171 2.555 -3.712 1.00 0.00 H ATOM 1499 N ALA A 222 23.057 4.626 -4.738 1.00 11.27 N ATOM 1500 CA ALA A 222 21.774 5.256 -5.041 1.00 12.46 C ATOM 1501 C ALA A 222 21.660 6.677 -4.459 1.00 11.08 C ATOM 1502 O ALA A 222 20.759 7.432 -4.837 1.00 11.89 O ATOM 1503 CB ALA A 222 20.639 4.409 -4.525 1.00 12.44 C ATOM 1504 H ALA A 222 23.084 3.851 -4.045 1.00 0.00 H ATOM 1505 N ILE A 223 22.577 7.017 -3.554 1.00 10.89 N ATOM 1506 CA ILE A 223 22.626 8.360 -2.932 1.00 13.89 C ATOM 1507 C ILE A 223 23.956 9.054 -3.225 1.00 14.61 C ATOM 1508 O ILE A 223 25.026 8.481 -3.033 1.00 15.92 O ATOM 1509 CB ILE A 223 22.436 8.289 -1.401 1.00 12.30 C ATOM 1510 CG1 ILE A 223 21.119 7.572 -1.054 1.00 13.67 C ATOM 1511 CG2 ILE A 223 22.509 9.702 -0.726 1.00 12.84 C ATOM 1512 CD1 ILE A 223 19.858 8.170 -1.689 1.00 16.02 C ATOM 1513 H ILE A 223 23.287 6.311 -3.273 1.00 0.00 H ATOM 1514 N TYR A 224 23.879 10.305 -3.685 1.00 10.98 N ATOM 1515 CA TYR A 224 25.048 11.121 -4.021 1.00 12.09 C ATOM 1516 C TYR A 224 25.442 12.052 -2.887 1.00 10.59 C ATOM 1517 O TYR A 224 24.561 12.556 -2.201 1.00 11.67 O ATOM 1518 CB TYR A 224 24.777 12.006 -5.246 1.00 9.75 C ATOM 1519 CG TYR A 224 24.778 11.346 -6.598 1.00 13.00 C ATOM 1520 CD1 TYR A 224 24.864 9.975 -6.744 1.00 14.05 C ATOM 1521 CD2 TYR A 224 24.650 12.122 -7.741 1.00 18.96 C ATOM 1522 CE1 TYR A 224 24.862 9.397 -7.997 1.00 12.71 C ATOM 1523 CE2 TYR A 224 24.640 11.557 -8.991 1.00 26.01 C ATOM 1524 CZ TYR A 224 24.739 10.189 -9.117 1.00 14.61 C ATOM 1525 OH TYR A 224 24.719 9.594 -10.362 1.00 14.72 O ATOM 1526 HH TYR A 224 24.800 8.613 -10.259 1.00 0.00 H ATOM 1527 H TYR A 224 22.936 10.724 -3.812 1.00 0.00 H ATOM 1528 N GLU A 225 26.737 12.306 -2.706 1.00 13.39 N ATOM 1529 CA GLU A 225 27.163 13.358 -1.792 1.00 11.76 C ATOM 1530 C GLU A 225 26.801 14.729 -2.360 1.00 16.90 C ATOM 1531 O GLU A 225 26.611 14.883 -3.557 1.00 14.12 O ATOM 1532 CB GLU A 225 28.661 13.280 -1.534 1.00 11.43 C ATOM 1533 CG GLU A 225 29.500 13.750 -2.717 1.00 15.76 C ATOM 1534 CD GLU A 225 30.964 13.884 -2.388 1.00 18.06 C ATOM 1535 OE1 GLU A 225 31.282 14.350 -1.273 1.00 17.49 O ATOM 1536 OE2 GLU A 225 31.791 13.501 -3.240 1.00 19.25 O ATOM 1537 H GLU A 225 27.449 11.750 -3.221 1.00 0.00 H ATOM 1538 N LEU A 226 26.763 15.744 -1.506 1.00 14.94 N ATOM 1539 CA LEU A 226 26.326 17.072 -1.927 1.00 15.56 C ATOM 1540 C LEU A 226 27.272 17.706 -2.920 1.00 14.43 C ATOM 1541 O LEU A 226 26.842 18.487 -3.780 1.00 20.57 O ATOM 1542 CB LEU A 226 26.174 17.982 -0.698 1.00 15.28 C ATOM 1543 CG LEU A 226 25.103 17.583 0.317 1.00 11.76 C ATOM 1544 CD1 LEU A 226 25.065 18.595 1.491 1.00 17.23 C ATOM 1545 CD2 LEU A 226 23.725 17.502 -0.305 1.00 16.80 C ATOM 1546 H LEU A 226 27.050 15.591 -0.518 1.00 0.00 H ATOM 1547 N SER A 227 28.557 17.398 -2.800 1.00 16.46 N ATOM 1548 CA SER A 227 29.577 17.915 -3.709 1.00 15.40 C ATOM 1549 C SER A 227 29.422 17.471 -5.152 1.00 22.09 C ATOM 1550 O SER A 227 29.979 18.090 -6.042 1.00 21.71 O ATOM 1551 CB SER A 227 30.959 17.491 -3.231 1.00 24.02 C ATOM 1552 OG SER A 227 31.235 18.100 -1.989 1.00 35.97 O ATOM 1553 HG SER A 227 30.555 17.818 -1.326 1.00 0.00 H ATOM 1554 H SER A 227 28.849 16.764 -2.029 1.00 0.00 H ATOM 1555 N ARG A 228 28.675 16.395 -5.366 1.00 14.95 N ATOM 1556 CA ARG A 228 28.404 15.896 -6.709 1.00 14.69 C ATOM 1557 C ARG A 228 27.148 16.530 -7.265 1.00 14.36 C ATOM 1558 O ARG A 228 26.045 16.265 -6.792 1.00 16.65 O ATOM 1559 CB ARG A 228 28.265 14.376 -6.690 1.00 19.21 C ATOM 1560 CG ARG A 228 27.598 13.793 -7.925 1.00 26.30 C ATOM 1561 CD ARG A 228 28.160 12.411 -8.218 1.00 28.64 C ATOM 1562 NE ARG A 228 29.580 12.566 -8.518 1.00 36.24 N ATOM 1563 CZ ARG A 228 30.072 12.776 -9.735 1.00 41.75 C ATOM 1564 NH1 ARG A 228 29.274 12.792 -10.784 1.00 13.59 N ATOM 1565 NH2 ARG A 228 31.369 12.956 -9.911 1.00 56.59 N ATOM 1566 HE ARG A 228 30.252 12.508 -7.726 1.00 0.00 H ATOM 1567 HH12 ARG A 228 29.666 12.957 -11.733 1.00 0.00 H ATOM 1568 HH11 ARG A 228 28.252 12.640 -10.663 1.00 0.00 H ATOM 1569 HH22 ARG A 228 31.746 13.120 -10.866 1.00 0.00 H ATOM 1570 HH21 ARG A 228 32.013 12.934 -9.094 1.00 0.00 H ATOM 1571 H ARG A 228 28.270 15.892 -4.550 1.00 0.00 H ATOM 1572 N THR A 229 27.317 17.376 -8.278 1.00 16.07 N ATOM 1573 CA THR A 229 26.192 18.096 -8.851 1.00 16.59 C ATOM 1574 C THR A 229 25.895 17.628 -10.257 1.00 20.22 C ATOM 1575 O THR A 229 25.023 18.188 -10.914 1.00 21.68 O ATOM 1576 CB THR A 229 26.441 19.613 -8.868 1.00 19.45 C ATOM 1577 OG1 THR A 229 27.605 19.908 -9.663 1.00 17.71 O ATOM 1578 CG2 THR A 229 26.643 20.091 -7.444 1.00 18.49 C ATOM 1579 HG1 THR A 229 27.759 20.886 -9.670 1.00 0.00 H ATOM 1580 H THR A 229 28.270 17.525 -8.666 1.00 0.00 H ATOM 1581 N SER A 230 26.622 16.613 -10.723 1.00 16.70 N ATOM 1582 CA SER A 230 26.314 15.968 -11.995 1.00 15.33 C ATOM 1583 C SER A 230 26.269 14.452 -11.804 1.00 16.71 C ATOM 1584 O SER A 230 26.804 13.916 -10.843 1.00 17.05 O ATOM 1585 CB SER A 230 27.340 16.343 -13.067 1.00 19.62 C ATOM 1586 OG SER A 230 28.631 15.879 -12.738 1.00 35.58 O ATOM 1587 HG SER A 230 29.266 16.139 -13.452 1.00 0.00 H ATOM 1588 H SER A 230 27.431 16.271 -10.165 1.00 0.00 H ATOM 1589 N ALA A 231 25.581 13.757 -12.698 1.00 19.64 N ATOM 1590 CA ALA A 231 25.401 12.321 -12.530 1.00 22.85 C ATOM 1591 C ALA A 231 26.707 11.614 -12.805 1.00 16.28 C ATOM 1592 O ALA A 231 27.526 12.089 -13.575 1.00 23.17 O ATOM 1593 CB ALA A 231 24.295 11.805 -13.448 1.00 21.62 C ATOM 1594 H ALA A 231 25.168 14.238 -13.522 1.00 0.00 H ATOM 1595 N GLY A 232 26.908 10.469 -12.160 1.00 16.89 N ATOM 1596 CA GLY A 232 28.112 9.697 -12.367 1.00 24.24 C ATOM 1597 C GLY A 232 27.829 8.594 -13.353 1.00 28.84 C ATOM 1598 O GLY A 232 27.334 8.835 -14.455 1.00 29.82 O ATOM 1599 H GLY A 232 26.187 10.123 -11.495 1.00 0.00 H ATOM 1600 N ASN A 233 28.147 7.372 -12.949 1.00 26.38 N ATOM 1601 CA ASN A 233 27.859 6.210 -13.765 1.00 25.21 C ATOM 1602 C ASN A 233 26.379 5.899 -13.705 1.00 28.31 C ATOM 1603 O ASN A 233 25.898 5.387 -12.692 1.00 28.34 O ATOM 1604 CB ASN A 233 28.698 5.020 -13.284 1.00 27.58 C ATOM 1605 CG ASN A 233 28.370 3.729 -14.012 1.00 30.00 C ATOM 1606 OD1 ASN A 233 27.624 3.713 -14.988 1.00 35.59 O ATOM 1607 ND2 ASN A 233 28.949 2.637 -13.543 1.00 31.77 N ATOM 1608 HD22 ASN A 233 29.574 2.695 -12.714 1.00 0.00 H ATOM 1609 HD21 ASN A 233 28.780 1.720 -14.003 1.00 0.00 H ATOM 1610 H ASN A 233 28.613 7.245 -12.028 1.00 0.00 H ATOM 1611 N VAL A 234 25.655 6.200 -14.782 1.00 22.19 N ATOM 1612 CA VAL A 234 24.236 5.898 -14.829 1.00 17.54 C ATOM 1613 C VAL A 234 23.952 4.878 -15.931 1.00 12.84 C ATOM 1614 O VAL A 234 22.812 4.659 -16.298 1.00 19.51 O ATOM 1615 CB VAL A 234 23.406 7.201 -15.006 1.00 20.31 C ATOM 1616 CG1 VAL A 234 23.651 8.134 -13.811 1.00 20.61 C ATOM 1617 CG2 VAL A 234 23.768 7.915 -16.286 1.00 22.43 C ATOM 1618 H VAL A 234 26.111 6.656 -15.598 1.00 0.00 H ATOM 1619 N ALA A 235 25.002 4.204 -16.409 1.00 18.05 N ATOM 1620 CA ALA A 235 24.848 3.231 -17.484 1.00 18.53 C ATOM 1621 C ALA A 235 23.874 2.117 -17.112 1.00 16.25 C ATOM 1622 O ALA A 235 23.227 1.522 -17.984 1.00 16.83 O ATOM 1623 CB ALA A 235 26.219 2.618 -17.876 1.00 19.83 C ATOM 1624 H ALA A 235 25.946 4.376 -16.007 1.00 0.00 H ATOM 1625 N ASP A 236 23.776 1.815 -15.821 1.00 16.03 N ATOM 1626 CA ASP A 236 22.928 0.731 -15.368 1.00 12.91 C ATOM 1627 C ASP A 236 21.737 1.225 -14.565 1.00 11.17 C ATOM 1628 O ASP A 236 21.054 0.431 -13.903 1.00 12.98 O ATOM 1629 CB ASP A 236 23.744 -0.253 -14.525 1.00 13.56 C ATOM 1630 CG ASP A 236 24.805 -0.948 -15.335 1.00 18.89 C ATOM 1631 OD1 ASP A 236 24.470 -1.449 -16.424 1.00 22.37 O ATOM 1632 OD2 ASP A 236 25.962 -0.992 -14.894 1.00 16.31 O ATOM 1633 H ASP A 236 24.317 2.366 -15.125 1.00 0.00 H ATOM 1634 N ALA A 237 21.499 2.531 -14.640 1.00 14.01 N ATOM 1635 CA ALA A 237 20.497 3.193 -13.818 1.00 17.71 C ATOM 1636 C ALA A 237 19.110 3.101 -14.441 1.00 23.56 C ATOM 1637 O ALA A 237 18.977 2.901 -15.659 1.00 17.53 O ATOM 1638 CB ALA A 237 20.877 4.633 -13.607 1.00 14.22 C ATOM 1639 H ALA A 237 22.050 3.102 -15.312 1.00 0.00 H ATOM 1640 N ASP A 238 18.098 3.211 -13.578 1.00 14.46 N ATOM 1641 CA ASP A 238 16.705 3.380 -13.981 1.00 13.51 C ATOM 1642 C ASP A 238 16.373 4.823 -13.634 1.00 12.34 C ATOM 1643 O ASP A 238 15.915 5.116 -12.539 1.00 15.06 O ATOM 1644 CB ASP A 238 15.782 2.381 -13.268 1.00 15.69 C ATOM 1645 CG ASP A 238 14.356 2.386 -13.812 1.00 17.76 C ATOM 1646 OD1 ASP A 238 13.895 3.449 -14.281 1.00 16.43 O ATOM 1647 OD2 ASP A 238 13.695 1.318 -13.724 1.00 20.64 O ATOM 1648 H ASP A 238 18.314 3.174 -12.561 1.00 0.00 H ATOM 1649 N LEU A 239 16.686 5.728 -14.546 1.00 14.14 N ATOM 1650 CA LEU A 239 16.494 7.147 -14.281 1.00 14.98 C ATOM 1651 C LEU A 239 15.042 7.465 -13.995 1.00 11.43 C ATOM 1652 O LEU A 239 14.726 8.338 -13.159 1.00 14.12 O ATOM 1653 CB LEU A 239 16.979 7.994 -15.465 1.00 19.89 C ATOM 1654 CG LEU A 239 18.477 7.964 -15.747 1.00 19.47 C ATOM 1655 CD1 LEU A 239 18.784 8.729 -17.044 1.00 15.32 C ATOM 1656 CD2 LEU A 239 19.227 8.622 -14.635 1.00 20.17 C ATOM 1657 H LEU A 239 17.073 5.423 -15.462 1.00 0.00 H ATOM 1658 N ALA A 240 14.146 6.776 -14.696 1.00 13.51 N ATOM 1659 CA ALA A 240 12.713 7.037 -14.572 1.00 13.42 C ATOM 1660 C ALA A 240 12.186 6.730 -13.163 1.00 13.29 C ATOM 1661 O ALA A 240 11.300 7.401 -12.668 1.00 12.78 O ATOM 1662 CB ALA A 240 11.935 6.225 -15.615 1.00 13.85 C ATOM 1663 H ALA A 240 14.473 6.034 -15.348 1.00 0.00 H ATOM 1664 N GLU A 241 12.755 5.713 -12.523 1.00 12.47 N ATOM 1665 CA GLU A 241 12.264 5.249 -11.225 1.00 13.28 C ATOM 1666 C GLU A 241 13.087 5.752 -10.044 1.00 11.12 C ATOM 1667 O GLU A 241 12.651 5.652 -8.905 1.00 10.73 O ATOM 1668 CB GLU A 241 12.234 3.718 -11.195 1.00 13.93 C ATOM 1669 CG GLU A 241 11.235 3.124 -12.162 1.00 18.95 C ATOM 1670 CD GLU A 241 9.816 3.551 -11.880 1.00 18.61 C ATOM 1671 OE1 GLU A 241 9.369 3.355 -10.732 1.00 20.39 O ATOM 1672 OE2 GLU A 241 9.161 4.090 -12.806 1.00 15.17 O ATOM 1673 H GLU A 241 13.571 5.235 -12.956 1.00 0.00 H ATOM 1674 N TRP A 242 14.263 6.298 -10.318 1.00 13.26 N ATOM 1675 CA TRP A 242 15.217 6.639 -9.251 1.00 13.06 C ATOM 1676 C TRP A 242 14.641 7.635 -8.229 1.00 13.79 C ATOM 1677 O TRP A 242 14.779 7.428 -7.055 1.00 12.90 O ATOM 1678 CB TRP A 242 16.495 7.172 -9.881 1.00 9.51 C ATOM 1679 CG TRP A 242 17.720 7.300 -9.022 1.00 10.73 C ATOM 1680 CD1 TRP A 242 17.796 7.474 -7.658 1.00 12.49 C ATOM 1681 CD2 TRP A 242 19.064 7.296 -9.501 1.00 11.03 C ATOM 1682 NE1 TRP A 242 19.122 7.546 -7.274 1.00 11.16 N ATOM 1683 CE2 TRP A 242 19.915 7.465 -8.388 1.00 10.46 C ATOM 1684 CE3 TRP A 242 19.636 7.160 -10.769 1.00 13.03 C ATOM 1685 CZ2 TRP A 242 21.305 7.491 -8.513 1.00 14.60 C ATOM 1686 CZ3 TRP A 242 21.023 7.192 -10.890 1.00 11.10 C ATOM 1687 CH2 TRP A 242 21.833 7.359 -9.774 1.00 12.87 C ATOM 1688 HE1 TRP A 242 19.463 7.646 -6.296 1.00 0.00 H ATOM 1689 H TRP A 242 14.517 6.490 -11.308 1.00 0.00 H ATOM 1690 N PRO A 243 13.971 8.718 -8.674 1.00 10.00 N ATOM 1691 CA PRO A 243 13.378 9.582 -7.646 1.00 12.44 C ATOM 1692 C PRO A 243 12.296 8.919 -6.804 1.00 13.01 C ATOM 1693 O PRO A 243 12.158 9.200 -5.607 1.00 13.14 O ATOM 1694 CB PRO A 243 12.797 10.740 -8.481 1.00 14.94 C ATOM 1695 CG PRO A 243 13.650 10.751 -9.705 1.00 15.17 C ATOM 1696 CD PRO A 243 13.853 9.291 -10.017 1.00 9.34 C ATOM 1697 N THR A 244 11.516 8.037 -7.413 1.00 12.62 N ATOM 1698 CA THR A 244 10.494 7.292 -6.667 1.00 10.36 C ATOM 1699 C THR A 244 11.150 6.357 -5.659 1.00 13.25 C ATOM 1700 O THR A 244 10.657 6.170 -4.534 1.00 13.82 O ATOM 1701 CB THR A 244 9.581 6.472 -7.625 1.00 13.46 C ATOM 1702 OG1 THR A 244 8.859 7.384 -8.469 1.00 15.67 O ATOM 1703 CG2 THR A 244 8.570 5.656 -6.874 1.00 14.50 C ATOM 1704 HG1 THR A 244 9.501 7.923 -8.996 1.00 0.00 H ATOM 1705 H THR A 244 11.629 7.870 -8.433 1.00 0.00 H ATOM 1706 N SER A 245 12.259 5.747 -6.057 1.00 12.78 N ATOM 1707 CA SER A 245 12.957 4.877 -5.114 1.00 11.74 C ATOM 1708 C SER A 245 13.527 5.681 -3.945 1.00 11.37 C ATOM 1709 O SER A 245 13.524 5.225 -2.807 1.00 13.35 O ATOM 1710 CB SER A 245 14.060 4.102 -5.844 1.00 11.00 C ATOM 1711 OG SER A 245 13.467 3.242 -6.820 1.00 11.27 O ATOM 1712 HG SER A 245 14.178 2.741 -7.292 1.00 0.00 H ATOM 1713 H SER A 245 12.624 5.886 -7.021 1.00 0.00 H ATOM 1714 N ILE A 246 13.981 6.882 -4.221 1.00 11.63 N ATOM 1715 CA ILE A 246 14.493 7.733 -3.159 1.00 10.22 C ATOM 1716 C ILE A 246 13.362 8.134 -2.227 1.00 10.13 C ATOM 1717 O ILE A 246 13.545 8.178 -1.015 1.00 12.41 O ATOM 1718 CB ILE A 246 15.215 8.986 -3.727 1.00 14.11 C ATOM 1719 CG1 ILE A 246 16.585 8.582 -4.265 1.00 14.39 C ATOM 1720 CG2 ILE A 246 15.389 10.081 -2.669 1.00 12.30 C ATOM 1721 CD1 ILE A 246 17.292 9.672 -5.033 1.00 17.74 C ATOM 1722 H ILE A 246 13.974 7.226 -5.203 1.00 0.00 H ATOM 1723 N GLU A 247 12.187 8.408 -2.777 1.00 14.90 N ATOM 1724 CA GLU A 247 11.027 8.699 -1.934 1.00 12.96 C ATOM 1725 C GLU A 247 10.684 7.522 -1.013 1.00 13.66 C ATOM 1726 O GLU A 247 10.285 7.740 0.118 1.00 13.74 O ATOM 1727 CB GLU A 247 9.813 9.048 -2.805 1.00 20.89 C ATOM 1728 CG GLU A 247 8.616 9.585 -2.060 1.00 27.46 C ATOM 1729 CD GLU A 247 7.496 9.986 -3.022 1.00 50.74 C ATOM 1730 OE1 GLU A 247 7.555 9.585 -4.213 1.00 35.67 O ATOM 1731 OE2 GLU A 247 6.568 10.709 -2.598 1.00 68.45 O ATOM 1732 H GLU A 247 12.089 8.416 -3.812 1.00 0.00 H ATOM 1733 N ARG A 248 10.870 6.280 -1.479 1.00 13.29 N ATOM 1734 CA ARG A 248 10.596 5.120 -0.624 1.00 12.21 C ATOM 1735 C ARG A 248 11.577 5.098 0.539 1.00 16.28 C ATOM 1736 O ARG A 248 11.195 4.705 1.650 1.00 15.64 O ATOM 1737 CB ARG A 248 10.676 3.806 -1.389 1.00 11.37 C ATOM 1738 CG ARG A 248 9.622 3.619 -2.444 1.00 17.32 C ATOM 1739 CD ARG A 248 9.472 2.143 -2.841 1.00 13.96 C ATOM 1740 NE ARG A 248 8.525 2.007 -3.946 1.00 19.45 N ATOM 1741 CZ ARG A 248 8.852 2.148 -5.230 1.00 17.54 C ATOM 1742 NH1 ARG A 248 10.106 2.393 -5.590 1.00 15.31 N ATOM 1743 NH2 ARG A 248 7.926 2.038 -6.166 1.00 27.34 N ATOM 1744 HE ARG A 248 7.535 1.787 -3.716 1.00 0.00 H ATOM 1745 HH12 ARG A 248 10.347 2.501 -6.596 1.00 0.00 H ATOM 1746 HH11 ARG A 248 10.848 2.477 -4.866 1.00 0.00 H ATOM 1747 HH22 ARG A 248 8.183 2.148 -7.168 1.00 0.00 H ATOM 1748 HH21 ARG A 248 6.940 1.841 -5.901 1.00 0.00 H ATOM 1749 H ARG A 248 11.210 6.138 -2.451 1.00 0.00 H ATOM 1750 N ILE A 249 12.828 5.495 0.290 1.00 11.14 N ATOM 1751 CA ILE A 249 13.841 5.505 1.357 1.00 13.22 C ATOM 1752 C ILE A 249 13.434 6.526 2.420 1.00 14.12 C ATOM 1753 O ILE A 249 13.442 6.218 3.618 1.00 15.62 O ATOM 1754 CB ILE A 249 15.249 5.852 0.839 1.00 11.74 C ATOM 1755 CG1 ILE A 249 15.797 4.795 -0.109 1.00 13.30 C ATOM 1756 CG2 ILE A 249 16.192 5.971 1.985 1.00 14.03 C ATOM 1757 CD1 ILE A 249 17.013 5.250 -0.915 1.00 12.25 C ATOM 1758 H ILE A 249 13.089 5.801 -0.669 1.00 0.00 H ATOM 1759 N GLN A 250 13.114 7.741 1.978 1.00 13.63 N ATOM 1760 CA GLN A 250 12.624 8.803 2.865 1.00 14.88 C ATOM 1761 C GLN A 250 11.429 8.308 3.697 1.00 13.29 C ATOM 1762 O GLN A 250 11.391 8.491 4.911 1.00 21.70 O ATOM 1763 CB GLN A 250 12.214 10.029 2.053 1.00 19.09 C ATOM 1764 CG GLN A 250 11.533 11.125 2.878 1.00 20.74 C ATOM 1765 CD GLN A 250 12.440 11.725 3.929 1.00 21.53 C ATOM 1766 OE1 GLN A 250 13.603 12.025 3.669 1.00 21.65 O ATOM 1767 NE2 GLN A 250 11.917 11.883 5.139 1.00 27.66 N ATOM 1768 HE22 GLN A 250 10.928 11.616 5.317 1.00 0.00 H ATOM 1769 HE21 GLN A 250 12.497 12.274 5.909 1.00 0.00 H ATOM 1770 H GLN A 250 13.215 7.946 0.963 1.00 0.00 H ATOM 1771 N GLN A 251 10.461 7.682 3.059 1.00 14.42 N ATOM 1772 CA GLN A 251 9.254 7.263 3.759 1.00 18.24 C ATOM 1773 C GLN A 251 9.500 6.157 4.793 1.00 18.82 C ATOM 1774 O GLN A 251 8.805 6.079 5.804 1.00 20.23 O ATOM 1775 CB GLN A 251 8.213 6.791 2.752 1.00 21.68 C ATOM 1776 CG GLN A 251 7.792 7.832 1.738 1.00 22.46 C ATOM 1777 CD GLN A 251 6.647 8.672 2.222 1.00 36.05 C ATOM 1778 OE1 GLN A 251 6.437 8.821 3.426 1.00 29.72 O ATOM 1779 NE2 GLN A 251 5.885 9.228 1.285 1.00 38.76 N ATOM 1780 HE22 GLN A 251 6.101 9.074 0.280 1.00 0.00 H ATOM 1781 HE21 GLN A 251 5.072 9.817 1.558 1.00 0.00 H ATOM 1782 H GLN A 251 10.560 7.484 2.043 1.00 0.00 H ATOM 1783 N HIS A 252 10.502 5.318 4.541 1.00 16.58 N ATOM 1784 CA HIS A 252 10.792 4.175 5.405 1.00 14.73 C ATOM 1785 C HIS A 252 11.761 4.530 6.539 1.00 14.59 C ATOM 1786 O HIS A 252 11.693 3.931 7.616 1.00 17.72 O ATOM 1787 CB HIS A 252 11.370 3.019 4.578 1.00 21.35 C ATOM 1788 CG HIS A 252 11.088 1.657 5.139 1.00 22.12 C ATOM 1789 ND1 HIS A 252 11.992 0.963 5.917 1.00 23.15 N ATOM 1790 CD2 HIS A 252 10.004 0.853 5.019 1.00 20.53 C ATOM 1791 CE1 HIS A 252 11.478 -0.210 6.248 1.00 13.05 C ATOM 1792 NE2 HIS A 252 10.270 -0.296 5.725 1.00 20.62 N ATOM 1793 H HIS A 252 11.097 5.481 3.704 1.00 0.00 H ATOM 1794 N TYR A 253 12.650 5.497 6.300 1.00 15.06 N ATOM 1795 CA TYR A 253 13.705 5.866 7.267 1.00 14.41 C ATOM 1796 C TYR A 253 13.785 7.361 7.540 1.00 15.48 C ATOM 1797 O TYR A 253 14.855 7.929 7.547 1.00 14.44 O ATOM 1798 CB TYR A 253 15.071 5.367 6.769 1.00 15.89 C ATOM 1799 CG TYR A 253 15.071 3.863 6.616 1.00 16.40 C ATOM 1800 CD1 TYR A 253 15.177 3.039 7.720 1.00 14.70 C ATOM 1801 CD2 TYR A 253 14.924 3.272 5.370 1.00 21.69 C ATOM 1802 CE1 TYR A 253 15.144 1.635 7.594 1.00 16.43 C ATOM 1803 CE2 TYR A 253 14.907 1.882 5.230 1.00 16.48 C ATOM 1804 CZ TYR A 253 15.021 1.068 6.340 1.00 18.03 C ATOM 1805 OH TYR A 253 14.975 -0.312 6.155 1.00 22.05 O ATOM 1806 HH TYR A 253 15.068 -0.764 7.031 1.00 0.00 H ATOM 1807 H TYR A 253 12.598 6.011 5.397 1.00 0.00 H ATOM 1808 N PRO A 254 12.633 7.985 7.842 1.00 20.76 N ATOM 1809 CA PRO A 254 12.589 9.425 8.105 1.00 22.00 C ATOM 1810 C PRO A 254 13.348 9.863 9.356 1.00 11.33 C ATOM 1811 O PRO A 254 13.677 11.036 9.505 1.00 18.22 O ATOM 1812 CB PRO A 254 11.087 9.706 8.261 1.00 20.29 C ATOM 1813 CG PRO A 254 10.502 8.399 8.710 1.00 20.29 C ATOM 1814 CD PRO A 254 11.316 7.346 7.972 1.00 20.16 C ATOM 1815 N GLU A 255 13.621 8.906 10.233 1.00 14.17 N ATOM 1816 CA GLU A 255 14.327 9.185 11.473 1.00 15.26 C ATOM 1817 C GLU A 255 15.844 9.165 11.293 1.00 18.26 C ATOM 1818 O GLU A 255 16.574 9.405 12.237 1.00 18.51 O ATOM 1819 CB GLU A 255 13.911 8.185 12.555 1.00 20.93 C ATOM 1820 CG GLU A 255 14.518 6.758 12.450 1.00 20.60 C ATOM 1821 CD GLU A 255 13.762 5.820 11.528 1.00 20.70 C ATOM 1822 OE1 GLU A 255 13.062 6.280 10.605 1.00 19.20 O ATOM 1823 OE2 GLU A 255 13.875 4.593 11.727 1.00 22.15 O ATOM 1824 H GLU A 255 13.322 7.931 10.028 1.00 0.00 H ATOM 1825 N ALA A 256 16.331 8.836 10.092 1.00 16.89 N ATOM 1826 CA ALA A 256 17.767 8.726 9.901 1.00 16.03 C ATOM 1827 C ALA A 256 18.512 10.030 10.199 1.00 14.91 C ATOM 1828 O ALA A 256 18.136 11.087 9.715 1.00 18.03 O ATOM 1829 CB ALA A 256 18.072 8.279 8.470 1.00 14.77 C ATOM 1830 H ALA A 256 15.684 8.659 9.297 1.00 0.00 H ATOM 1831 N GLN A 257 19.607 9.923 10.934 1.00 17.95 N ATOM 1832 CA GLN A 257 20.390 11.096 11.299 1.00 26.21 C ATOM 1833 C GLN A 257 21.708 11.230 10.558 1.00 22.27 C ATOM 1834 O GLN A 257 22.220 12.332 10.411 1.00 26.70 O ATOM 1835 CB GLN A 257 20.641 11.084 12.801 1.00 26.28 C ATOM 1836 CG GLN A 257 19.438 11.566 13.583 1.00 26.37 C ATOM 1837 CD GLN A 257 19.055 13.005 13.255 1.00 23.06 C ATOM 1838 OE1 GLN A 257 19.714 13.943 13.690 1.00 30.32 O ATOM 1839 NE2 GLN A 257 17.988 13.181 12.478 1.00 29.45 N ATOM 1840 HE22 GLN A 257 17.457 12.358 12.130 1.00 0.00 H ATOM 1841 HE21 GLN A 257 17.686 14.142 12.219 1.00 0.00 H ATOM 1842 H GLN A 257 19.915 8.984 11.257 1.00 0.00 H ATOM 1843 N PHE A 258 22.257 10.113 10.084 1.00 14.96 N ATOM 1844 CA PHE A 258 23.570 10.104 9.447 1.00 14.21 C ATOM 1845 C PHE A 258 23.366 9.336 8.149 1.00 14.57 C ATOM 1846 O PHE A 258 22.992 8.173 8.206 1.00 21.70 O ATOM 1847 CB PHE A 258 24.585 9.404 10.348 1.00 20.14 C ATOM 1848 CG PHE A 258 26.029 9.672 10.027 1.00 29.41 C ATOM 1849 CD1 PHE A 258 26.713 10.691 10.673 1.00 37.08 C ATOM 1850 CD2 PHE A 258 26.730 8.859 9.152 1.00 30.09 C ATOM 1851 CE1 PHE A 258 28.058 10.928 10.412 1.00 37.67 C ATOM 1852 CE2 PHE A 258 28.072 9.086 8.889 1.00 25.38 C ATOM 1853 CZ PHE A 258 28.738 10.130 9.523 1.00 34.24 C ATOM 1854 H PHE A 258 21.733 9.219 10.171 1.00 0.00 H ATOM 1855 N VAL A 259 23.532 9.993 7.008 1.00 11.00 N ATOM 1856 CA VAL A 259 23.286 9.354 5.718 1.00 14.28 C ATOM 1857 C VAL A 259 24.616 9.253 4.982 1.00 14.30 C ATOM 1858 O VAL A 259 25.301 10.265 4.794 1.00 13.79 O ATOM 1859 CB VAL A 259 22.273 10.144 4.900 1.00 14.18 C ATOM 1860 CG1 VAL A 259 22.004 9.489 3.553 1.00 15.79 C ATOM 1861 CG2 VAL A 259 20.988 10.307 5.705 1.00 18.39 C ATOM 1862 H VAL A 259 23.844 10.985 7.033 1.00 0.00 H ATOM 1863 N ILE A 260 24.966 8.029 4.577 1.00 13.80 N ATOM 1864 CA ILE A 260 26.239 7.754 3.932 1.00 15.01 C ATOM 1865 C ILE A 260 26.004 7.429 2.455 1.00 12.78 C ATOM 1866 O ILE A 260 25.347 6.457 2.146 1.00 13.78 O ATOM 1867 CB ILE A 260 26.967 6.566 4.582 1.00 11.49 C ATOM 1868 CG1 ILE A 260 27.098 6.787 6.095 1.00 16.59 C ATOM 1869 CG2 ILE A 260 28.326 6.339 3.933 1.00 14.86 C ATOM 1870 CD1 ILE A 260 27.545 5.582 6.850 1.00 22.10 C ATOM 1871 H ILE A 260 24.302 7.243 4.729 1.00 0.00 H ATOM 1872 N PRO A 261 26.580 8.232 1.546 1.00 12.51 N ATOM 1873 CA PRO A 261 26.559 7.906 0.126 1.00 13.54 C ATOM 1874 C PRO A 261 27.603 6.834 -0.216 1.00 9.54 C ATOM 1875 O PRO A 261 28.509 6.550 0.560 1.00 11.52 O ATOM 1876 CB PRO A 261 26.896 9.253 -0.522 1.00 13.92 C ATOM 1877 CG PRO A 261 27.874 9.850 0.423 1.00 15.21 C ATOM 1878 CD PRO A 261 27.401 9.422 1.809 1.00 12.49 C ATOM 1879 N GLY A 262 27.467 6.230 -1.389 1.00 11.51 N ATOM 1880 CA GLY A 262 28.442 5.249 -1.846 1.00 11.74 C ATOM 1881 C GLY A 262 29.824 5.858 -2.068 1.00 11.91 C ATOM 1882 O GLY A 262 30.837 5.156 -1.975 1.00 12.76 O ATOM 1883 H GLY A 262 26.651 6.460 -1.992 1.00 0.00 H ATOM 1884 N HIS A 263 29.840 7.156 -2.382 1.00 12.22 N ATOM 1885 CA HIS A 263 31.056 7.889 -2.709 1.00 15.70 C ATOM 1886 C HIS A 263 30.976 9.267 -2.068 1.00 12.31 C ATOM 1887 O HIS A 263 30.047 10.014 -2.346 1.00 13.95 O ATOM 1888 CB HIS A 263 31.221 7.998 -4.241 1.00 12.83 C ATOM 1889 CG HIS A 263 31.232 6.665 -4.918 1.00 14.52 C ATOM 1890 ND1 HIS A 263 32.367 5.884 -4.986 1.00 12.50 N ATOM 1891 CD2 HIS A 263 30.248 5.953 -5.524 1.00 14.02 C ATOM 1892 CE1 HIS A 263 32.084 4.748 -5.601 1.00 13.60 C ATOM 1893 NE2 HIS A 263 30.805 4.758 -5.930 1.00 11.97 N ATOM 1894 H HIS A 263 28.936 7.671 -2.394 1.00 0.00 H ATOM 1895 N GLY A 264 31.936 9.589 -1.206 1.00 13.67 N ATOM 1896 CA GLY A 264 32.096 10.931 -0.691 1.00 14.00 C ATOM 1897 C GLY A 264 31.547 11.178 0.697 1.00 17.22 C ATOM 1898 O GLY A 264 31.390 10.255 1.496 1.00 14.84 O ATOM 1899 H GLY A 264 32.595 8.849 -0.891 1.00 0.00 H ATOM 1900 N LEU A 265 31.266 12.443 0.988 1.00 14.16 N ATOM 1901 CA LEU A 265 31.017 12.895 2.353 1.00 15.04 C ATOM 1902 C LEU A 265 29.623 12.556 2.844 1.00 10.62 C ATOM 1903 O LEU A 265 28.639 12.758 2.124 1.00 13.67 O ATOM 1904 CB LEU A 265 31.236 14.404 2.462 1.00 12.76 C ATOM 1905 CG LEU A 265 32.638 14.877 2.843 1.00 31.67 C ATOM 1906 CD1 LEU A 265 33.761 14.063 2.243 1.00 32.71 C ATOM 1907 CD2 LEU A 265 32.771 16.349 2.427 1.00 37.88 C ATOM 1908 H LEU A 265 31.222 13.137 0.215 1.00 0.00 H ATOM 1909 N PRO A 277 29.520 12.025 4.072 1.00 13.68 N ATOM 1910 CA PRO A 277 28.193 11.820 4.651 1.00 14.36 C ATOM 1911 C PRO A 277 27.507 13.138 4.998 1.00 16.25 C ATOM 1912 O PRO A 277 28.139 14.208 5.033 1.00 17.26 O ATOM 1913 CB PRO A 277 28.470 10.978 5.903 1.00 18.50 C ATOM 1914 CG PRO A 277 29.906 11.178 6.206 1.00 40.58 C ATOM 1915 CD PRO A 277 30.587 11.436 4.901 1.00 22.38 C ATOM 1916 N GLY A 278 26.207 13.057 5.202 1.00 16.00 N ATOM 1917 CA GLY A 278 25.425 14.181 5.664 1.00 14.87 C ATOM 1918 C GLY A 278 24.161 13.666 6.308 1.00 14.23 C ATOM 1919 O GLY A 278 24.156 12.624 6.946 1.00 16.77 O ATOM 1920 H GLY A 278 25.727 12.152 5.024 1.00 0.00 H ATOM 1921 N GLY A 279 23.076 14.404 6.121 1.00 18.16 N ATOM 1922 CA GLY A 279 21.796 14.027 6.671 1.00 17.91 C ATOM 1923 C GLY A 279 20.839 13.614 5.576 1.00 14.30 C ATOM 1924 O GLY A 279 21.247 13.332 4.433 1.00 14.53 O ATOM 1925 H GLY A 279 23.149 15.278 5.563 1.00 0.00 H ATOM 1926 N LEU A 280 19.553 13.597 5.903 1.00 17.22 N ATOM 1927 CA LEU A 280 18.538 13.191 4.951 1.00 15.23 C ATOM 1928 C LEU A 280 18.432 14.149 3.783 1.00 19.91 C ATOM 1929 O LEU A 280 17.805 13.800 2.786 1.00 15.78 O ATOM 1930 CB LEU A 280 17.178 13.023 5.630 1.00 18.06 C ATOM 1931 CG LEU A 280 16.923 11.631 6.259 1.00 16.23 C ATOM 1932 CD1 LEU A 280 15.593 11.591 7.055 1.00 17.75 C ATOM 1933 CD2 LEU A 280 16.950 10.486 5.234 1.00 19.04 C ATOM 1934 H LEU A 280 19.267 13.881 6.862 1.00 0.00 H ATOM 1935 N ASP A 281 19.066 15.318 3.825 1.00 18.20 N ATOM 1936 CA ASP A 281 19.028 16.188 2.646 1.00 15.33 C ATOM 1937 C ASP A 281 19.669 15.575 1.371 1.00 17.95 C ATOM 1938 O ASP A 281 19.711 16.192 0.351 1.00 15.60 O ATOM 1939 CB ASP A 281 19.666 17.574 2.951 1.00 18.76 C ATOM 1940 CG ASP A 281 20.951 17.491 3.735 1.00 26.16 C ATOM 1941 OD1 ASP A 281 21.526 16.389 3.853 1.00 18.11 O ATOM 1942 OD2 ASP A 281 21.384 18.551 4.244 1.00 27.00 O ATOM 1943 H ASP A 281 19.580 15.610 4.681 1.00 0.00 H ATOM 1944 N LEU A 282 20.579 14.630 1.630 1.00 11.65 N ATOM 1945 CA LEU A 282 21.303 14.020 0.523 1.00 11.28 C ATOM 1946 C LEU A 282 20.290 13.419 -0.413 1.00 9.99 C ATOM 1947 O LEU A 282 20.564 13.295 -1.598 1.00 10.54 O ATOM 1948 CB LEU A 282 22.284 12.944 0.951 1.00 13.75 C ATOM 1949 CG LEU A 282 23.645 13.344 1.498 1.00 16.04 C ATOM 1950 CD1 LEU A 282 24.526 12.145 1.765 1.00 13.17 C ATOM 1951 CD2 LEU A 282 24.356 14.299 0.619 1.00 26.03 C ATOM 1952 H LEU A 282 20.767 14.334 2.609 1.00 0.00 H ATOM 1953 N LEU A 283 19.148 12.994 0.132 1.00 12.89 N ATOM 1954 CA LEU A 283 18.163 12.320 -0.701 1.00 10.23 C ATOM 1955 C LEU A 283 17.623 13.314 -1.695 1.00 8.46 C ATOM 1956 O LEU A 283 17.584 13.035 -2.885 1.00 8.78 O ATOM 1957 CB LEU A 283 17.000 11.700 0.117 1.00 12.06 C ATOM 1958 CG LEU A 283 17.299 10.559 1.086 1.00 19.90 C ATOM 1959 CD1 LEU A 283 16.006 9.951 1.638 1.00 13.39 C ATOM 1960 CD2 LEU A 283 18.145 9.522 0.493 1.00 32.11 C ATOM 1961 H LEU A 283 18.963 13.143 1.145 1.00 0.00 H ATOM 1962 N LYS A 284 17.200 14.478 -1.210 1.00 15.67 N ATOM 1963 CA LYS A 284 16.625 15.473 -2.138 1.00 18.00 C ATOM 1964 C LYS A 284 17.644 15.981 -3.145 1.00 13.23 C ATOM 1965 O LYS A 284 17.358 16.188 -4.335 1.00 14.43 O ATOM 1966 CB LYS A 284 16.039 16.642 -1.317 1.00 24.76 C ATOM 1967 CG LYS A 284 15.705 17.904 -2.102 1.00 34.52 C ATOM 1968 CD LYS A 284 14.571 17.670 -3.072 1.00 37.56 C ATOM 1969 CE LYS A 284 14.068 18.994 -3.648 1.00 51.22 C ATOM 1970 NZ LYS A 284 12.865 18.832 -4.513 1.00 69.19 N ATOM 1971 HZ1 LYS A 284 13.095 18.206 -5.311 1.00 0.00 H ATOM 1972 HZ2 LYS A 284 12.092 18.415 -3.956 1.00 0.00 H ATOM 1973 HZ3 LYS A 284 12.571 19.762 -4.874 1.00 0.00 H ATOM 1974 H LYS A 284 17.273 14.684 -0.193 1.00 0.00 H ATOM 1975 N HIS A 285 18.852 16.190 -2.657 1.00 12.04 N ATOM 1976 CA HIS A 285 19.979 16.506 -3.507 1.00 11.12 C ATOM 1977 C HIS A 285 20.118 15.497 -4.654 1.00 14.94 C ATOM 1978 O HIS A 285 20.297 15.881 -5.805 1.00 12.91 O ATOM 1979 CB HIS A 285 21.255 16.523 -2.708 1.00 12.94 C ATOM 1980 CG HIS A 285 22.472 16.538 -3.568 1.00 13.05 C ATOM 1981 ND1 HIS A 285 22.802 17.611 -4.373 1.00 11.82 N ATOM 1982 CD2 HIS A 285 23.392 15.578 -3.812 1.00 12.34 C ATOM 1983 CE1 HIS A 285 23.909 17.325 -5.038 1.00 18.06 C ATOM 1984 NE2 HIS A 285 24.279 16.090 -4.725 1.00 13.59 N ATOM 1985 H HIS A 285 18.998 16.126 -1.629 1.00 0.00 H ATOM 1986 N THR A 286 20.107 14.203 -4.325 1.00 11.06 N ATOM 1987 CA THR A 286 20.299 13.202 -5.347 1.00 9.79 C ATOM 1988 C THR A 286 19.175 13.290 -6.363 1.00 13.04 C ATOM 1989 O THR A 286 19.431 13.213 -7.560 1.00 13.43 O ATOM 1990 CB THR A 286 20.407 11.803 -4.698 1.00 10.84 C ATOM 1991 OG1 THR A 286 21.517 11.802 -3.779 1.00 11.06 O ATOM 1992 CG2 THR A 286 20.611 10.687 -5.765 1.00 14.12 C ATOM 1993 HG1 THR A 286 21.366 12.486 -3.080 1.00 0.00 H ATOM 1994 H THR A 286 19.961 13.917 -3.336 1.00 0.00 H ATOM 1995 N THR A 287 17.937 13.434 -5.897 1.00 11.36 N ATOM 1996 CA THR A 287 16.821 13.557 -6.803 1.00 13.05 C ATOM 1997 C THR A 287 17.011 14.738 -7.730 1.00 11.32 C ATOM 1998 O THR A 287 16.745 14.626 -8.903 1.00 11.68 O ATOM 1999 CB THR A 287 15.517 13.664 -6.020 1.00 15.58 C ATOM 2000 OG1 THR A 287 15.282 12.378 -5.409 1.00 17.60 O ATOM 2001 CG2 THR A 287 14.338 14.011 -6.918 1.00 20.55 C ATOM 2002 HG1 THR A 287 14.440 12.410 -4.890 1.00 0.00 H ATOM 2003 H THR A 287 17.772 13.458 -4.870 1.00 0.00 H ATOM 2004 N ASN A 288 17.448 15.873 -7.201 1.00 13.75 N ATOM 2005 CA ASN A 288 17.726 17.047 -8.036 1.00 12.70 C ATOM 2006 C ASN A 288 18.692 16.708 -9.167 1.00 14.77 C ATOM 2007 O ASN A 288 18.431 16.999 -10.337 1.00 14.67 O ATOM 2008 CB ASN A 288 18.333 18.204 -7.208 1.00 15.73 C ATOM 2009 CG ASN A 288 17.331 18.920 -6.295 1.00 21.86 C ATOM 2010 OD1 ASN A 288 17.741 19.639 -5.368 1.00 21.90 O ATOM 2011 ND2 ASN A 288 16.046 18.754 -6.548 1.00 18.73 N ATOM 2012 HD22 ASN A 288 15.745 18.143 -7.334 1.00 0.00 H ATOM 2013 HD21 ASN A 288 15.334 19.234 -5.961 1.00 0.00 H ATOM 2014 H ASN A 288 17.597 15.932 -6.173 1.00 0.00 H ATOM 2015 N VAL A 289 19.823 16.107 -8.810 1.00 12.94 N ATOM 2016 CA VAL A 289 20.872 15.789 -9.791 1.00 12.08 C ATOM 2017 C VAL A 289 20.379 14.768 -10.814 1.00 17.23 C ATOM 2018 O VAL A 289 20.615 14.899 -12.029 1.00 13.82 O ATOM 2019 CB VAL A 289 22.135 15.258 -9.088 1.00 14.92 C ATOM 2020 CG1 VAL A 289 23.178 14.790 -10.106 1.00 15.84 C ATOM 2021 CG2 VAL A 289 22.737 16.324 -8.169 1.00 16.97 C ATOM 2022 H VAL A 289 19.970 15.855 -7.812 1.00 0.00 H ATOM 2023 N VAL A 290 19.675 13.748 -10.343 1.00 12.47 N ATOM 2024 CA VAL A 290 19.135 12.747 -11.254 1.00 11.52 C ATOM 2025 C VAL A 290 18.128 13.386 -12.219 1.00 13.09 C ATOM 2026 O VAL A 290 18.215 13.164 -13.413 1.00 14.37 O ATOM 2027 CB VAL A 290 18.483 11.589 -10.480 1.00 14.49 C ATOM 2028 CG1 VAL A 290 17.656 10.704 -11.399 1.00 16.63 C ATOM 2029 CG2 VAL A 290 19.561 10.817 -9.777 1.00 14.82 C ATOM 2030 H VAL A 290 19.508 13.662 -9.320 1.00 0.00 H ATOM 2031 N LYS A 291 17.188 14.177 -11.711 1.00 12.43 N ATOM 2032 CA LYS A 291 16.217 14.840 -12.585 1.00 12.52 C ATOM 2033 C LYS A 291 16.914 15.772 -13.581 1.00 13.95 C ATOM 2034 O LYS A 291 16.511 15.837 -14.742 1.00 16.09 O ATOM 2035 CB LYS A 291 15.169 15.612 -11.750 1.00 12.96 C ATOM 2036 CG LYS A 291 14.174 14.709 -11.066 1.00 13.25 C ATOM 2037 CD LYS A 291 13.120 15.480 -10.333 1.00 8.72 C ATOM 2038 CE LYS A 291 11.959 14.577 -9.925 1.00 16.18 C ATOM 2039 NZ LYS A 291 10.823 15.318 -9.288 1.00 28.66 N ATOM 2040 HZ1 LYS A 291 11.162 15.798 -8.430 1.00 0.00 H ATOM 2041 HZ2 LYS A 291 10.451 16.022 -9.957 1.00 0.00 H ATOM 2042 HZ3 LYS A 291 10.070 14.646 -9.036 1.00 0.00 H ATOM 2043 H LYS A 291 17.141 14.327 -10.683 1.00 0.00 H ATOM 2044 N ALA A 292 17.968 16.454 -13.163 1.00 14.90 N ATOM 2045 CA ALA A 292 18.691 17.332 -14.091 1.00 14.67 C ATOM 2046 C ALA A 292 19.380 16.531 -15.202 1.00 19.79 C ATOM 2047 O ALA A 292 19.450 16.972 -16.356 1.00 19.30 O ATOM 2048 CB ALA A 292 19.713 18.188 -13.332 1.00 17.45 C ATOM 2049 H ALA A 292 18.284 16.368 -12.176 1.00 0.00 H ATOM 2050 N HIS A 293 19.860 15.344 -14.881 1.00 15.24 N ATOM 2051 CA HIS A 293 20.471 14.484 -15.879 1.00 14.28 C ATOM 2052 C HIS A 293 19.388 13.959 -16.797 1.00 16.32 C ATOM 2053 O HIS A 293 19.558 13.908 -18.002 1.00 21.15 O ATOM 2054 CB HIS A 293 21.228 13.332 -15.227 1.00 20.60 C ATOM 2055 CG HIS A 293 21.980 12.503 -16.212 1.00 18.60 C ATOM 2056 ND1 HIS A 293 23.206 12.885 -16.712 1.00 18.81 N ATOM 2057 CD2 HIS A 293 21.658 11.347 -16.836 1.00 17.19 C ATOM 2058 CE1 HIS A 293 23.632 11.969 -17.565 1.00 20.85 C ATOM 2059 NE2 HIS A 293 22.711 11.029 -17.663 1.00 21.68 N ATOM 2060 H HIS A 293 19.799 15.019 -13.895 1.00 0.00 H ATOM 2061 N THR A 294 18.246 13.604 -16.234 1.00 16.14 N ATOM 2062 CA THR A 294 17.125 13.110 -17.014 1.00 15.73 C ATOM 2063 C THR A 294 16.766 14.113 -18.079 1.00 23.36 C ATOM 2064 O THR A 294 16.407 13.740 -19.199 1.00 22.34 O ATOM 2065 CB THR A 294 15.914 12.846 -16.116 1.00 18.40 C ATOM 2066 OG1 THR A 294 16.214 11.720 -15.267 1.00 17.45 O ATOM 2067 CG2 THR A 294 14.669 12.550 -16.955 1.00 18.82 C ATOM 2068 HG1 THR A 294 15.439 11.536 -14.679 1.00 0.00 H ATOM 2069 H THR A 294 18.147 13.681 -15.202 1.00 0.00 H ATOM 2070 N ASN A 295 16.904 15.385 -17.733 1.00 17.52 N ATOM 2071 CA ASN A 295 16.536 16.447 -18.655 1.00 21.46 C ATOM 2072 C ASN A 295 17.711 16.927 -19.526 1.00 28.51 C ATOM 2073 O ASN A 295 17.693 18.076 -19.987 1.00 42.15 O ATOM 2074 CB ASN A 295 15.923 17.615 -17.876 1.00 22.80 C ATOM 2075 CG ASN A 295 14.548 17.284 -17.303 1.00 24.16 C ATOM 2076 OD1 ASN A 295 13.866 16.366 -17.760 1.00 21.86 O ATOM 2077 ND2 ASN A 295 14.137 18.037 -16.297 1.00 18.64 N ATOM 2078 HD22 ASN A 295 14.743 18.803 -15.939 1.00 0.00 H ATOM 2079 HD21 ASN A 295 13.208 17.863 -15.863 1.00 0.00 H ATOM 2080 H ASN A 295 17.279 15.626 -16.793 1.00 0.00 H ATOM 2081 N ARG A 296 18.686 16.042 -19.783 1.00 33.59 N ATOM 2082 CA ARG A 296 19.728 16.270 -20.812 1.00 41.74 C ATOM 2083 C ARG A 296 19.131 16.970 -22.021 1.00 34.54 C ATOM 2084 O ARG A 296 18.161 16.483 -22.596 1.00 50.77 O ATOM 2085 CB ARG A 296 20.377 14.957 -21.327 1.00 41.19 C ATOM 2086 CG ARG A 296 21.025 14.075 -20.299 1.00 39.98 C ATOM 2087 CD ARG A 296 21.917 12.963 -20.826 1.00 27.32 C ATOM 2088 NE ARG A 296 21.174 11.843 -21.408 1.00 41.35 N ATOM 2089 CZ ARG A 296 20.384 11.013 -20.730 1.00 46.65 C ATOM 2090 NH1 ARG A 296 20.203 11.166 -19.426 1.00 51.81 N ATOM 2091 NH2 ARG A 296 19.764 10.024 -21.363 1.00 53.14 N ATOM 2092 HE ARG A 296 21.271 11.684 -22.431 1.00 0.00 H ATOM 2093 HH12 ARG A 296 19.584 10.512 -18.907 1.00 0.00 H ATOM 2094 HH11 ARG A 296 20.680 11.940 -18.922 1.00 0.00 H ATOM 2095 HH22 ARG A 296 19.147 9.375 -20.835 1.00 0.00 H ATOM 2096 HH21 ARG A 296 19.896 9.899 -22.387 1.00 0.00 H ATOM 2097 H ARG A 296 18.712 15.158 -19.236 1.00 0.00 H ATOM 2098 N SER A 297 19.727 18.093 -22.409 1.00 50.04 N ATOM 2099 CA SER A 297 19.278 18.861 -23.559 1.00 44.14 C ATOM 2100 C SER A 297 20.331 18.872 -24.646 1.00 40.58 C ATOM 2101 O SER A 297 21.476 18.473 -24.410 1.00 55.68 O ATOM 2102 H SER A 297 20.547 18.436 -21.869 1.00 0.00 H TER 2103 SER A 297 HETATM 2104 ZN ZN A 1 27.518 1.269 -8.935 1.00 10.72 ZN HETATM 2105 ZN ZN A 2 29.534 3.176 -6.520 1.00 13.26 ZN HETATM 2106 ZN ZN A 3 22.145 19.613 -4.416 1.00 15.50 ZN HETATM 2107 O HOH 4 34.351 -6.226 -13.393 1.00 19.40 O HETATM 2108 O HOH 5 14.215 17.851 -7.281 1.00 32.77 O HETATM 2109 O HOH 6 32.085 -4.759 -16.439 1.00 38.92 O HETATM 2110 O HOH 7 26.927 10.383 -15.973 1.00 41.43 O HETATM 2111 O HOH 8 38.003 18.161 7.803 1.00 42.63 O HETATM 2112 O HOH 9 17.265 -6.368 -10.032 1.00 32.51 O HETATM 2113 O HOH 10 8.722 11.189 -5.377 1.00 38.92 O HETATM 2114 O HOH 11 45.919 3.213 10.060 1.00 37.29 O HETATM 2115 O HOH 12 4.304 9.778 3.538 1.00 47.81 O HETATM 2116 O HOH 13 15.014 19.012 -9.825 1.00 32.48 O HETATM 2117 O HOH 14 40.765 -19.385 2.656 1.00 43.97 O HETATM 2118 O HOH 15 42.648 17.985 4.248 1.00 49.80 O HETATM 2119 O HOH 16 25.085 -16.273 -10.080 1.00 31.30 O HETATM 2120 O HOH 17 4.810 11.869 -1.461 1.00 55.74 O HETATM 2121 O HOH 18 29.099 -17.988 -12.699 1.00 39.17 O HETATM 2122 O HOH 19 34.817 -8.337 -9.583 1.00 21.23 O HETATM 2123 O HOH 20 19.789 19.999 -4.076 1.00 17.84 O HETATM 2124 O HOH 21 21.342 3.405 20.437 1.00 41.03 O HETATM 2125 O HOH 22 34.389 13.026 15.908 1.00 54.37 O HETATM 2126 O HOH 23 23.499 19.826 4.576 1.00 22.61 O HETATM 2127 O HOH 24 13.720 13.260 1.507 1.00 31.61 O HETATM 2128 O HOH 25 42.375 -9.139 16.833 1.00 42.89 O HETATM 2129 O HOH 26 14.312 -9.172 14.153 1.00 45.95 O HETATM 2130 O HOH 27 9.252 -10.006 -5.808 1.00 21.74 O HETATM 2131 O HOH 28 30.756 -14.430 -15.116 1.00 25.60 O HETATM 2132 O HOH 29 15.540 12.353 10.580 1.00 28.14 O HETATM 2133 O HOH 30 42.652 3.132 -1.552 1.00 21.36 O HETATM 2134 O HOH 31 19.286 19.436 -16.934 1.00 28.48 O HETATM 2135 O HOH 32 50.554 3.901 0.000 1.00 36.60 O HETATM 2136 O HOH 33 33.364 13.799 -11.279 1.00 31.21 O HETATM 2137 O HOH 34 34.311 0.752 -1.994 1.00 18.24 O HETATM 2138 O HOH 35 16.471 -12.212 16.574 1.00 27.51 O HETATM 2139 O HOH 36 16.828 19.131 -11.336 1.00 27.74 O HETATM 2140 O HOH 37 9.937 -0.050 -8.276 1.00 30.05 O HETATM 2141 O HOH 38 16.736 4.395 14.490 1.00 22.32 O HETATM 2142 O HOH 39 44.595 4.058 7.086 1.00 33.56 O HETATM 2143 O HOH 40 20.811 -15.065 -8.790 1.00 35.75 O HETATM 2144 O HOH 41 10.667 -9.569 2.690 1.00 29.76 O HETATM 2145 O HOH 42 42.084 4.863 9.472 1.00 26.78 O HETATM 2146 O HOH 43 10.535 8.319 -10.282 1.00 16.09 O HETATM 2147 O HOH 44 26.521 -10.194 12.727 1.00 28.01 O HETATM 2148 O HOH 45 46.669 2.809 8.026 1.00 39.16 O HETATM 2149 O HOH 46 15.865 15.001 1.433 1.00 20.06 O HETATM 2150 O HOH 47 12.543 2.997 10.076 1.00 20.37 O HETATM 2151 O HOH 48 31.770 20.052 -6.032 1.00 34.84 O HETATM 2152 O HOH 49 14.150 -7.401 -7.765 1.00 29.28 O HETATM 2153 O HOH 50 23.414 -18.330 -3.177 1.00 17.24 O HETATM 2154 O HOH 51 27.354 7.896 -4.193 1.00 15.63 O HETATM 2155 O HOH 52 31.911 -13.533 -12.521 1.00 27.69 O HETATM 2156 O HOH 53 37.427 -2.985 19.369 1.00 37.25 O HETATM 2157 O HOH 54 25.032 0.522 -3.406 1.00 13.11 O HETATM 2158 O HOH 55 18.830 -6.480 -5.020 1.00 17.15 O HETATM 2159 O HOH 56 31.049 -18.796 -4.191 1.00 30.91 O HETATM 2160 O HOH 57 42.033 -13.156 1.955 1.00 26.59 O HETATM 2161 O HOH 58 21.487 -1.730 15.121 1.00 20.60 O HETATM 2162 O HOH 59 9.901 2.053 8.306 1.00 47.29 O HETATM 2163 O HOH 60 17.010 8.881 14.850 1.00 22.07 O HETATM 2164 O HOH 61 10.609 6.269 11.701 1.00 29.20 O HETATM 2165 O HOH 62 26.736 -16.786 7.425 1.00 26.70 O HETATM 2166 O HOH 63 35.319 -17.492 9.288 1.00 38.60 O HETATM 2167 O HOH 64 25.356 2.500 17.910 1.00 30.47 O HETATM 2168 O HOH 65 45.270 -10.807 15.105 1.00 29.83 O HETATM 2169 O HOH 66 39.051 -10.479 -4.524 1.00 21.13 O HETATM 2170 O HOH 67 14.326 -13.499 -3.235 1.00 29.67 O HETATM 2171 O HOH 68 17.769 4.868 -17.064 1.00 33.04 O HETATM 2172 O HOH 69 29.721 16.370 -0.375 1.00 16.48 O HETATM 2173 O HOH 70 12.703 11.718 -4.775 1.00 19.96 O HETATM 2174 O HOH 71 9.522 -10.330 -1.623 1.00 28.63 O HETATM 2175 O HOH 72 28.359 0.066 -15.587 1.00 38.73 O HETATM 2176 O HOH 73 46.676 -4.527 0.241 1.00 30.94 O HETATM 2177 O HOH 74 18.238 -5.641 -14.230 1.00 38.54 O HETATM 2178 O HOH 75 12.686 0.197 9.803 1.00 37.53 O HETATM 2179 O HOH 76 25.349 6.891 -10.481 1.00 14.79 O HETATM 2180 O HOH 77 14.127 10.969 -13.587 1.00 20.70 O HETATM 2181 O HOH 78 29.922 -17.258 -5.830 1.00 24.63 O HETATM 2182 O HOH 79 34.967 -12.885 18.147 1.00 36.63 O HETATM 2183 O HOH 80 11.774 0.006 -12.288 1.00 33.20 O HETATM 2184 O HOH 81 7.399 -4.706 -1.229 1.00 28.28 O HETATM 2185 O HOH 82 39.837 -8.173 12.410 1.00 26.72 O HETATM 2186 O HOH 83 44.643 -8.441 4.834 1.00 28.77 O HETATM 2187 O HOH 84 46.442 -5.404 10.812 1.00 21.89 O HETATM 2188 O HOH 85 34.508 13.316 -2.944 1.00 26.77 O HETATM 2189 O HOH 86 34.274 8.362 0.101 1.00 18.42 O HETATM 2190 O HOH 87 18.196 23.033 -8.617 1.00 33.04 O HETATM 2191 O HOH 88 40.127 -8.271 9.618 1.00 21.54 O HETATM 2192 O HOH 89 33.391 -4.586 -14.196 1.00 26.62 O HETATM 2193 O HOH 90 28.445 10.700 -4.535 1.00 19.90 O HETATM 2194 O HOH 91 21.083 -2.224 -13.160 1.00 16.27 O HETATM 2195 O HOH 92 6.731 -3.241 -4.605 1.00 39.35 O HETATM 2196 O HOH 93 26.747 6.867 -6.689 1.00 18.20 O HETATM 2197 O HOH 94 22.834 15.864 -13.357 1.00 29.11 O HETATM 2198 O HOH 95 20.926 -16.451 -6.104 1.00 32.85 O HETATM 2199 O HOH 96 15.789 -11.192 -2.402 1.00 18.11 O HETATM 2200 O HOH 97 35.454 10.788 0.928 1.00 23.76 O HETATM 2201 O HOH 98 39.263 8.638 9.403 1.00 39.22 O HETATM 2202 O HOH 99 22.670 -7.340 -3.132 1.00 11.23 O HETATM 2203 O HOH 100 33.568 15.928 -1.214 1.00 41.36 O HETATM 2204 O HOH 101 22.452 1.488 -2.882 1.00 12.75 O HETATM 2205 O HOH 102 43.146 5.325 -14.698 1.00 42.75 O HETATM 2206 O HOH 103 12.421 12.815 7.777 1.00 21.89 O HETATM 2207 O HOH 104 23.304 -18.127 4.325 1.00 33.04 O HETATM 2208 O HOH 105 27.716 15.219 1.215 1.00 14.76 O HETATM 2209 O HOH 106 20.332 1.431 -17.597 1.00 27.36 O HETATM 2210 O HOH 107 32.537 1.373 19.320 1.00 42.49 O HETATM 2211 O HOH 108 35.601 17.857 9.067 1.00 46.01 O HETATM 2212 O HOH 109 11.759 16.670 -7.033 1.00 31.49 O HETATM 2213 O HOH 110 11.983 -11.871 -2.400 1.00 27.80 O HETATM 2214 O HOH 111 24.712 7.930 15.828 1.00 37.38 O HETATM 2215 O HOH 112 23.252 -15.439 7.843 1.00 24.61 O HETATM 2216 O HOH 113 13.426 -9.626 8.890 1.00 30.16 O HETATM 2217 O HOH 114 9.974 9.252 -14.316 1.00 22.09 O HETATM 2218 O HOH 115 27.669 -2.646 -16.533 1.00 45.46 O HETATM 2219 O HOH 116 37.844 0.941 17.147 1.00 38.49 O HETATM 2220 O HOH 117 33.855 -7.195 -15.218 1.00 28.51 O HETATM 2221 O HOH 118 11.920 -0.390 -9.309 1.00 27.94 O HETATM 2222 O HOH 119 17.992 -11.962 6.323 1.00 39.00 O HETATM 2223 O HOH 120 15.967 -12.052 8.223 1.00 41.02 O HETATM 2224 O HOH 121 24.660 2.793 -13.045 1.00 15.85 O HETATM 2225 O HOH 122 35.614 1.594 0.474 1.00 17.35 O HETATM 2226 O HOH 123 20.792 14.776 10.368 1.00 29.16 O HETATM 2227 O HOH 124 8.832 -3.229 4.431 1.00 41.14 O HETATM 2228 O HOH 125 26.775 -13.422 13.777 1.00 37.93 O HETATM 2229 O HOH 126 43.375 10.412 5.651 1.00 39.81 O HETATM 2230 O HOH 127 27.262 9.011 16.943 1.00 42.78 O HETATM 2231 O HOH 128 30.047 -12.579 19.424 1.00 43.18 O HETATM 2232 O HOH 129 31.882 -16.280 1.139 1.00 15.45 O HETATM 2233 O HOH 130 24.591 15.014 -15.421 1.00 31.19 O HETATM 2234 O HOH 131 18.165 18.580 0.134 1.00 25.17 O HETATM 2235 O HOH 132 18.804 13.660 8.666 1.00 25.27 O HETATM 2236 O HOH 133 27.360 22.750 -9.843 1.00 26.54 O HETATM 2237 O HOH 134 34.534 -17.919 3.504 1.00 28.34 O HETATM 2238 O HOH 135 35.160 -7.291 22.674 1.00 40.87 O HETATM 2239 O HOH 136 27.063 16.507 3.698 1.00 20.14 O HETATM 2240 O HOH 137 46.327 -6.851 15.590 1.00 25.92 O HETATM 2241 O HOH 138 21.051 -17.542 2.499 1.00 33.88 O HETATM 2242 O HOH 139 28.265 -10.728 10.991 1.00 23.44 O HETATM 2243 O HOH 140 38.007 -16.788 -2.719 1.00 36.28 O HETATM 2244 O HOH 141 38.185 -10.395 9.775 1.00 34.11 O HETATM 2245 O HOH 142 43.859 -0.664 -5.427 1.00 26.09 O HETATM 2246 O HOH 143 31.258 11.814 -5.588 1.00 33.56 O HETATM 2247 O HOH 144 35.438 -8.007 -12.845 1.00 36.73 O HETATM 2248 O HOH 145 33.176 -14.984 -8.116 1.00 32.35 O HETATM 2249 O HOH 146 24.270 17.148 4.684 1.00 30.18 O HETATM 2250 O HOH 147 14.177 2.718 14.007 1.00 36.76 O HETATM 2251 O HOH 148 26.275 -1.313 -18.777 1.00 38.99 O HETATM 2252 O HOH 149 22.768 -19.412 -7.602 1.00 36.56 O HETATM 2253 O HOH 150 9.477 -6.622 4.035 1.00 39.65 O HETATM 2254 O HOH 151 27.595 13.899 -15.937 1.00 40.90 O HETATM 2255 O HOH 152 29.360 -9.828 -0.313 1.00 13.08 O HETATM 2256 O HOH 153 23.151 -10.683 17.990 1.00 39.74 O HETATM 2257 O HOH 154 45.613 1.082 4.564 1.00 24.08 O HETATM 2258 O HOH 155 22.511 -18.652 0.412 1.00 21.86 O HETATM 2259 O HOH 156 37.075 -1.255 -11.178 1.00 34.64 O HETATM 2260 O HOH 157 19.804 6.544 17.774 1.00 44.11 O HETATM 2261 O HOH 158 5.669 -5.897 -2.236 1.00 38.10 O HETATM 2262 O HOH 159 35.752 -11.894 -11.710 1.00 37.04 O HETATM 2263 O HOH 160 19.764 16.817 6.322 1.00 28.81 O HETATM 2264 O HOH 161 11.406 2.253 -15.448 1.00 43.34 O HETATM 2265 O HOH 162 25.032 -20.125 -7.271 1.00 40.92 O HETATM 2266 O HOH 163 14.030 14.742 4.903 1.00 39.74 O HETATM 2267 O HOH 164 16.253 -6.904 -5.557 1.00 26.98 O HETATM 2268 O HOH 165 27.115 6.778 -17.359 1.00 27.24 O HETATM 2269 O HOH 166 9.493 12.712 -8.537 1.00 25.36 O HETATM 2270 O HOH 167 41.966 -2.576 -5.094 1.00 21.21 O HETATM 2271 O HOH 168 7.802 6.256 -3.506 1.00 36.47 O HETATM 2272 O HOH 169 49.280 2.108 -1.508 1.00 43.27 O HETATM 2273 O HOH 170 23.011 8.889 -19.810 1.00 36.35 O HETATM 2274 O HOH 171 35.777 16.237 5.529 1.00 32.99 O HETATM 2275 O HOH 172 39.783 -8.302 20.132 1.00 35.42 O HETATM 2276 O HOH 173 44.606 9.420 -4.510 1.00 31.22 O HETATM 2277 O HOH 174 35.270 9.962 14.416 1.00 38.64 O HETATM 2278 O HOH 175 22.225 -12.527 13.086 1.00 30.69 O HETATM 2279 O HOH 176 43.333 -5.146 -6.840 1.00 26.33 O HETATM 2280 O HOH 177 25.891 -1.896 16.354 1.00 37.22 O HETATM 2281 O HOH 178 42.740 17.916 1.942 1.00 46.68 O HETATM 2282 O HOH 179 16.484 -12.447 14.358 1.00 37.93 O HETATM 2283 O HOH 180 28.116 6.861 -9.580 1.00 13.94 O HETATM 2284 O HOH 181 26.938 -5.079 19.610 1.00 33.87 O HETATM 2285 O HOH 182 36.999 8.408 13.488 1.00 33.71 O HETATM 2286 O HOH 183 33.300 10.543 15.584 1.00 40.96 O HETATM 2287 O HOH 184 40.394 -6.783 -8.035 1.00 40.27 O HETATM 2288 O HOH 185 21.937 -9.583 15.914 1.00 40.37 O HETATM 2289 O HOH 186 48.131 10.785 2.846 1.00 40.66 O HETATM 2290 O HOH 187 12.609 -6.302 9.306 1.00 42.07 O HETATM 2291 O HOH 188 18.320 -13.954 3.751 1.00 38.23 O HETATM 2292 O HOH 189 47.612 -0.022 2.831 1.00 44.34 O HETATM 2293 O HOH 190 9.890 17.789 -4.178 1.00 45.57 O HETATM 2294 O HOH 191 21.774 -2.951 -15.684 1.00 38.08 O HETATM 2295 O HOH 192 5.533 -8.181 -3.705 1.00 38.80 O HETATM 2296 O HOH 193 40.120 -10.845 14.739 1.00 40.13 O HETATM 2297 O HOH 194 17.392 21.888 -10.969 1.00 31.71 O HETATM 2298 O HOH 195 15.005 16.534 -23.072 1.00 35.98 O HETATM 2299 O HOH 196 38.137 3.207 15.522 1.00 36.25 O HETATM 2300 O HOH 197 8.812 11.303 5.662 1.00 36.14 O HETATM 2301 O HOH 198 18.993 -11.568 11.750 1.00 29.46 O HETATM 2302 O HOH 199 31.480 -2.763 -12.498 1.00 9.06 O HETATM 2303 O HOH 200 22.934 -16.568 -10.551 1.00 37.07 O HETATM 2304 O HOH 201 18.356 -4.530 12.828 1.00 32.35 O HETATM 2305 O HOH 202 15.802 19.452 -13.877 1.00 33.21 O HETATM 2306 O HOH 203 44.472 -8.542 7.619 1.00 31.31 O HETATM 2307 O HOH 204 32.520 -0.901 19.623 1.00 36.27 O HETATM 2308 O HOH 205 29.851 18.969 0.884 1.00 23.79 O HETATM 2309 O HOH 206 22.598 20.075 -6.581 1.00 11.41 O HETATM 2310 O HOH 207 16.629 -10.218 -5.635 1.00 22.46 O HETATM 2311 O HOH 208 24.528 5.347 18.865 1.00 34.79 O HETATM 2312 O HOH 209 33.580 3.615 -18.387 1.00 45.10 O HETATM 2313 O HOH 210 25.789 -21.027 -13.653 1.00 52.13 O HETATM 2314 O HOH 211 35.353 4.491 20.614 1.00 46.74 O HETATM 2315 O HOH 212 21.677 -19.502 -5.740 1.00 41.20 O HETATM 2316 O HOH 213 44.819 -9.108 -2.385 1.00 41.49 O HETATM 2317 O HOH 214 18.284 -19.395 -0.721 1.00 39.96 O HETATM 2318 O HOH 215 21.612 8.087 17.260 1.00 44.98 O HETATM 2319 O HOH 216 36.162 -5.713 -14.672 1.00 35.03 O HETATM 2320 O HOH 217 22.073 9.287 -23.829 1.00 46.47 O HETATM 2321 O HOH 218 9.071 -6.970 6.351 1.00 45.10 O HETATM 2322 O HOH 219 33.645 -19.795 -4.482 1.00 37.67 O HETATM 2323 O HOH 220 24.856 9.302 14.235 1.00 35.16 O HETATM 2324 O HOH 221 36.356 -9.328 -11.482 1.00 34.51 O HETATM 2325 O HOH 222 39.581 17.503 4.364 1.00 50.66 O HETATM 2326 O HOH 223 23.986 -20.528 -5.223 1.00 43.74 O HETATM 2327 O HOH 224 17.603 4.967 18.235 1.00 37.76 O HETATM 2328 O HOH 225 41.718 -14.507 -2.975 1.00 35.68 O HETATM 2329 O HOH 226 18.241 -0.725 18.098 1.00 41.78 O HETATM 2330 O HOH 227 35.031 -13.396 21.666 1.00 42.70 O HETATM 2331 O HOH 228 42.134 -9.743 8.956 1.00 34.29 O HETATM 2332 O HOH 229 32.062 -18.998 1.222 1.00 24.12 O HETATM 2333 O HOH 230 38.885 -11.234 -9.747 1.00 41.54 O HETATM 2334 O HOH 231 47.272 -5.343 2.976 1.00 34.25 O HETATM 2335 O HOH 232 24.670 17.281 7.755 1.00 40.88 O HETATM 2336 O HOH 233 35.800 12.984 -0.808 1.00 25.78 O HETATM 2337 O HOH 234 38.502 -18.965 -0.985 1.00 33.00 O HETATM 2338 O HOH 235 21.279 -6.563 16.712 1.00 40.27 O HETATM 2339 O HOH 236 38.640 -11.699 8.263 1.00 32.40 O HETATM 2340 O HOH 237 17.132 17.123 6.499 1.00 44.42 O HETATM 2341 O HOH 238 21.446 19.899 -10.225 1.00 34.68 O HETATM 2342 O HOH 239 6.094 10.707 -7.562 1.00 38.43 O HETATM 2343 O HOH 240 30.453 -17.275 -14.738 1.00 44.30 O HETATM 2344 O HOH 241 25.421 14.773 10.013 1.00 39.02 O HETATM 2345 O HOH 242 31.717 21.615 -3.738 1.00 45.17 O HETATM 2346 O HOH 243 10.601 13.020 -6.057 1.00 39.92 O HETATM 2347 O HOH 244 47.212 -7.903 3.935 1.00 42.48 O HETATM 2348 O HOH 245 6.971 -5.152 3.303 1.00 43.40 O HETATM 2349 O HOH 246 29.695 21.991 -5.183 1.00 38.83 O HETATM 2350 O HOH 247 31.818 10.611 -13.175 1.00 42.12 O HETATM 2351 O HOH 248 12.460 12.111 -1.160 1.00 27.68 O HETATM 2352 O HOH 249 10.015 2.408 11.021 1.00 41.83 O HETATM 2353 O HOH 250 19.334 -2.808 16.701 1.00 35.71 O HETATM 2354 O HOH 251 16.666 -0.487 -16.178 1.00 40.91 O HETATM 2355 O HOH 252 26.479 -3.320 -19.752 1.00 50.54 O HETATM 2356 O HOH 253 46.998 4.851 8.907 1.00 47.00 O HETATM 2357 O HOH 254 25.108 11.395 13.349 1.00 43.25 O HETATM 2358 O HOH 255 9.883 10.932 -10.540 1.00 19.91 O HETATM 2359 O HOH 256 24.294 22.587 -9.827 1.00 31.29 O HETATM 2360 O HOH 257 41.342 -11.849 -5.332 1.00 30.34 O HETATM 2361 O HOH 258 35.858 -20.640 -3.425 1.00 48.60 O HETATM 2362 O HOH 259 41.175 -16.906 -3.554 1.00 54.12 O HETATM 2363 O HOH 260 22.021 -20.769 -3.401 1.00 26.38 O HETATM 2364 O HOH 261 10.615 -0.248 10.493 1.00 39.23 O HETATM 2365 O HOH 262 15.937 17.856 1.942 1.00 26.41 O HETATM 2366 O HOH 263 35.145 -15.094 19.298 1.00 45.61 O HETATM 2367 O HOH 264 41.408 9.843 8.791 1.00 38.80 O HETATM 2368 O HOH 265 32.430 10.227 17.620 1.00 41.54 O HETATM 2369 O HOH 266 33.556 8.391 18.243 1.00 44.54 O HETATM 2370 O HOH 267 43.600 -10.569 3.566 1.00 38.40 O HETATM 2371 O HOH 268 20.302 -14.826 6.657 1.00 40.68 O HETATM 2372 O HOH 269 45.862 -1.444 -7.033 1.00 47.85 O HETATM 2373 O HOH 270 28.806 -18.331 14.530 1.00 44.88 O HETATM 2374 O HOH 271 21.426 -19.064 -11.413 1.00 59.02 O HETATM 2375 O HOH 272 13.872 -12.501 6.449 1.00 38.64 O HETATM 2376 O HOH 273 41.157 -19.569 -0.841 1.00 45.89 O HETATM 2377 CAA UNN A 274 33.910 6.535 -13.296 1.00 -0.04 C HETATM 2378 CAB UNN A 274 33.636 5.015 -13.146 1.00 0.09 C HETATM 2379 OAC UNN A 274 32.635 4.860 -12.126 1.00 -0.23 O HETATM 2380 PAD UNN A 274 32.097 3.419 -11.643 1.00 0.28 P HETATM 2381 OAE UNN A 274 31.305 2.740 -12.793 1.00 -0.54 O HETATM 2382 OAF UNN A 274 33.359 2.455 -11.254 1.00 -0.23 O HETATM 2383 CAG UNN A 274 33.506 1.101 -11.747 1.00 0.09 C HETATM 2384 CAH UNN A 274 33.208 0.071 -10.613 1.00 -0.04 C HETATM 2385 H8 UNN A 274 33.324 -0.950 -11.005 1.00 0.03 H HETATM 2386 H9 UNN A 274 32.178 0.210 -10.253 1.00 0.03 H HETATM 2387 H10 UNN A 274 33.911 0.227 -9.782 1.00 0.03 H HETATM 2388 H6 UNN A 274 34.536 0.956 -12.106 1.00 0.06 H HETATM 2389 H7 UNN A 274 32.802 0.940 -12.577 1.00 0.06 H HETATM 2390 CAI UNN A 274 31.107 3.649 -10.203 1.00 0.09 C HETATM 2391 CAJ UNN A 274 30.383 2.351 -9.821 1.00 0.02 C HETATM 2392 SAK UNN A 274 29.133 2.924 -8.566 1.00 -0.18 S HETATM 2393 H14 UNN A 274 28.595 2.135 -8.245 1.00 0.10 H HETATM 2394 H12 UNN A 274 31.081 1.624 -9.380 1.00 0.04 H HETATM 2395 H13 UNN A 274 29.889 1.902 -10.695 1.00 0.04 H HETATM 2396 CAL UNN A 274 32.027 4.046 -9.000 1.00 -0.02 C HETATM 2397 CAM UNN A 274 32.537 5.547 -9.090 1.00 -0.04 C HETATM 2398 CAN UNN A 274 31.308 6.569 -8.971 1.00 -0.02 C HETATM 2399 CAO UNN A 274 31.775 8.003 -8.814 1.00 -0.04 C HETATM 2400 CAP UNN A 274 32.278 8.462 -7.584 1.00 -0.06 C HETATM 2401 CAQ UNN A 274 32.729 9.815 -7.411 1.00 -0.07 C HETATM 2402 CAR UNN A 274 32.664 10.708 -8.502 1.00 -0.07 C HETATM 2403 CAS UNN A 274 32.159 10.241 -9.736 1.00 -0.07 C HETATM 2404 CAT UNN A 274 31.714 8.891 -9.884 1.00 -0.06 C HETATM 2405 H25 UNN A 274 31.325 8.556 -10.839 1.00 0.06 H HETATM 2406 H24 UNN A 274 32.108 10.916 -10.582 1.00 0.06 H HETATM 2407 H23 UNN A 274 32.996 11.734 -8.395 1.00 0.06 H HETATM 2408 H22 UNN A 274 33.115 10.146 -6.454 1.00 0.06 H HETATM 2409 H21 UNN A 274 32.327 7.778 -6.745 1.00 0.06 H HETATM 2410 H19 UNN A 274 30.702 6.295 -8.095 1.00 0.04 H HETATM 2411 H20 UNN A 274 30.694 6.493 -9.880 1.00 0.04 H HETATM 2412 H17 UNN A 274 33.042 5.700 -10.055 1.00 0.03 H HETATM 2413 H18 UNN A 274 33.246 5.737 -8.271 1.00 0.03 H HETATM 2414 H15 UNN A 274 32.900 3.377 -8.989 1.00 0.03 H HETATM 2415 H16 UNN A 274 31.459 3.922 -8.066 1.00 0.03 H HETATM 2416 H11 UNN A 274 30.369 4.443 -10.391 1.00 0.06 H HETATM 2417 H4 UNN A 274 34.558 4.494 -12.851 1.00 0.06 H HETATM 2418 H5 UNN A 274 33.270 4.603 -14.098 1.00 0.06 H HETATM 2419 H1 UNN A 274 34.674 6.695 -14.071 1.00 0.03 H HETATM 2420 H2 UNN A 274 34.269 6.939 -12.338 1.00 0.03 H HETATM 2421 H3 UNN A 274 32.981 7.048 -13.585 1.00 0.03 H HETATM 2422 OD1 UNK 275 31.630 -8.902 22.173 1.00 42.57 O HETATM 2423 OD2 UNK 276 31.506 -13.986 21.685 1.00 56.40 O CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 756 754 755 2104 CONECT 776 775 778 2104 CONECT 797 795 2105 CONECT 1336 1334 1335 2104 CONECT 1497 1496 2105 CONECT 1893 1891 1892 2105 CONECT 1981 1980 1983 2106 CONECT 2104 756 776 1336 CONECT 2105 797 1497 1893 CONECT 2106 1981 CONECT 2377 2378 2419 2420 2421 CONECT 2378 2377 2379 2417 2418 CONECT 2379 2378 2380 CONECT 2380 2379 2381 2382 2390 CONECT 2381 2380 CONECT 2382 2380 2383 CONECT 2383 2382 2384 2388 2389 CONECT 2384 2383 2385 2386 2387 CONECT 2385 2384 CONECT 2386 2384 CONECT 2387 2384 CONECT 2388 2383 CONECT 2389 2383 CONECT 2390 2380 2391 2396 2416 CONECT 2391 2390 2392 2394 2395 CONECT 2392 2391 2393 CONECT 2393 2392 CONECT 2394 2391 CONECT 2395 2391 CONECT 2396 2390 2397 2414 2415 CONECT 2397 2396 2398 2412 2413 CONECT 2398 2397 2399 2410 2411 CONECT 2399 2398 2400 2404 CONECT 2400 2399 2401 2409 CONECT 2401 2400 2402 2408 CONECT 2402 2401 2403 2407 CONECT 2403 2402 2404 2406 CONECT 2404 2399 2403 2405 CONECT 2405 2404 CONECT 2406 2403 CONECT 2407 2402 CONECT 2408 2401 CONECT 2409 2400 CONECT 2410 2398 CONECT 2411 2398 CONECT 2412 2397 CONECT 2413 2397 CONECT 2414 2396 CONECT 2415 2396 CONECT 2416 2390 CONECT 2417 2378 CONECT 2418 2378 CONECT 2419 2377 CONECT 2420 2377 CONECT 2421 2377 MASTER 0 0 0 0 0 0 0 0 2422 1 59 18 END
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Structure:
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Related entries of code: 5mm9
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2yz3
RCSB PDB
PDBbind
266aa, >2YZ3_1|Chains... *
4c1d
RCSB PDB
PDBbind
242aa, >4C1D_1|Chains... at 99%
4c1e
RCSB PDB
PDBbind
242aa, >4C1E_1|Chains... at 99%
4pvo
RCSB PDB
PDBbind
242aa, >4PVO_1|Chains... at 99%
4pvt
RCSB PDB
PDBbind
242aa, >4PVT_1|Chains... at 99%
5acw
RCSB PDB
PDBbind
266aa, >5ACW_1|Chains... at 100%
5acx
RCSB PDB
PDBbind
266aa, >5ACX_1|Chains... at 100%
5fqc
RCSB PDB
PDBbind
242aa, >5FQC_1|Chains... at 99%
5k48
RCSB PDB
PDBbind
242aa, >5K48_1|Chains... at 99%
5lca
RCSB PDB
PDBbind
266aa, >5LCA_1|Chain... at 100%
5lcf
RCSB PDB
PDBbind
266aa, >5LCF_1|Chain... at 100%
5lch
RCSB PDB
PDBbind
266aa, >5LCH_1|Chain... at 100%
5le1
RCSB PDB
PDBbind
266aa, >5LE1_1|Chain... at 100%
5lm6
RCSB PDB
PDBbind
266aa, >5LM6_1|Chains... at 100%
5lsc
RCSB PDB
PDBbind
240aa, >5LSC_1|Chains... at 100%
5mxq
RCSB PDB
PDBbind
231aa, >5MXQ_1|Chain... at 100%
5mxr
RCSB PDB
PDBbind
232aa, >5MXR_1|Chain... at 100%
5n4s
RCSB PDB
PDBbind
232aa, >5N4S_1|Chains... at 99%
5n4t
RCSB PDB
PDBbind
234aa, >5N4T_1|Chains... at 100%
5nhz
RCSB PDB
PDBbind
266aa, >5NHZ_1|Chains... at 100%
5ni0
RCSB PDB
PDBbind
266aa, >5NI0_1|Chains... at 100%
5y6d
RCSB PDB
PDBbind
231aa, >5Y6D_1|Chains... at 100%
5y6e
RCSB PDB
PDBbind
231aa, >5Y6E_1|Chains... at 100%
6ew3
RCSB PDB
PDBbind
232aa, >6EW3_1|Chains... at 100%
6hf5
RCSB PDB
PDBbind
231aa, >6HF5_1|Chain... at 100%
6o5t
RCSB PDB
PDBbind
242aa, >6O5T_1|Chains... at 99%
6jn6
RCSB PDB
PDBbind
231aa, >6JN6_1|Chains... at 100%
6j8r
RCSB PDB
PDBbind
231aa, >6J8R_1|Chain... at 100%
6dd1
RCSB PDB
PDBbind
242aa, >6DD1_1|Chains... at 99%
5o7n
RCSB PDB
PDBbind
254aa, >5O7N_1|Chains... at 94%
6dd0
RCSB PDB
PDBbind
242aa, >6DD0_1|Chains... at 99%
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
5mm9
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Metallo-beta-lactamase VIM-17
Ligand Name
8SH
EC.Number
E.C.-.-.-.-
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
IC50=0.38uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Eur J Med Chem Vol. 135: pp. 159-173
Ligand Properties
Formula
C
1
5
H
2
5
O
3
PS
Molecular Weight
316.396
Exact Mass
316.126
No. of atoms
45
No. of bonds
45
Polar Surface Area
84.14
LOGP Value
3.23 (
Computed with XLOGP3
)
4.57 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
Canonical SMILES
CCOP(=O)([C@H](CCCc1ccccc1)CS)OCC
InChI String
InChI=1S/C15H25O3PS/c1-3-17-19(16,18-4-2)15(13-20)12-8-11-14-9-6-5-7-10-14/h5-7,9-10,15,20H,3-4,8,11-13H2,1-2H3/t15-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
B5KVR9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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