Browse entries in the PDBbind-CN Database
HEADER 6DD1_COMPLEX COMPND 6DD1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 231 GLU TYR PRO THR VAL SER GLU ILE PRO VAL GLY GLU VAL SEQRES 2 A 231 ARG LEU TYR GLN ILE ALA ASP GLY VAL TRP SER HIS ILE SEQRES 3 A 231 ALA THR GLN SER PHE ASP GLY ALA VAL TYR PRO SER ASN SEQRES 4 A 231 GLY LEU ILE VAL ARG ASP GLY ASP GLU LEU LEU LEU ILE SEQRES 5 A 231 ASP THR ALA TRP GLY ALA LYS ASN THR ALA ALA LEU LEU SEQRES 6 A 231 ALA GLU ILE GLU LYS GLN ILE GLY LEU PRO VAL THR ARG SEQRES 7 A 231 ALA VAL SER THR HIS PHE HIS ASP ASP ARG VAL GLY GLY SEQRES 8 A 231 VAL ASP VAL LEU ARG ALA ALA GLY VAL ALA THR TYR ALA SEQRES 9 A 231 SER PRO SER THR ARG ARG LEU ALA GLU VAL GLU GLY ASN SEQRES 10 A 231 GLU ILE PRO THR HIS SER LEU GLU GLY LEU SER SER SER SEQRES 11 A 231 GLY ASP ALA VAL ARG PHE GLY PRO VAL GLU LEU PHE TYR SEQRES 12 A 231 PRO GLY ALA ALA HIS SER THR ASP ASN LEU VAL VAL TYR SEQRES 13 A 231 VAL PRO SER ALA SER VAL LEU TYR GLY GLY CYS ALA ILE SEQRES 14 A 231 TYR GLU LEU SER ARG THR SER ALA GLY ASN VAL ALA ASP SEQRES 15 A 231 ALA ASP LEU ALA GLU TRP PRO THR SER ILE GLU ARG ILE SEQRES 16 A 231 GLN GLN HIS TYR PRO GLU ALA GLN PHE VAL ILE PRO GLY SEQRES 17 A 231 HIS GLY LEU PRO GLY GLY LEU ASP LEU LEU LYS HIS THR SEQRES 18 A 231 THR ASN VAL VAL LYS ALA HIS THR ASN ARG HET ZN A 1 1 HET ZN A 2 1 HET ZN A 3 1 HET M A 3Q 23 ATOM 1 N GLU A 30 6.182 44.176 12.677 1.00 33.21 N ATOM 2 CA GLU A 30 7.081 43.053 12.905 1.00 32.63 C ATOM 3 C GLU A 30 6.312 41.776 13.255 1.00 27.71 C ATOM 4 O GLU A 30 6.566 40.729 12.666 1.00 28.85 O ATOM 5 CB GLU A 30 8.084 43.382 14.009 1.00 37.45 C ATOM 6 CG GLU A 30 9.127 42.293 14.239 1.00 43.95 C ATOM 7 CD GLU A 30 9.708 42.329 15.643 1.00 50.51 C ATOM 8 OE1 GLU A 30 10.926 42.073 15.799 1.00 52.53 O ATOM 9 OE2 GLU A 30 8.940 42.616 16.589 1.00 51.90 O ATOM 10 HN3 GLU A 30 5.625 44.353 13.537 1.00 0.00 H ATOM 11 HN2 GLU A 30 5.542 43.952 11.889 1.00 0.00 H ATOM 12 HN1 GLU A 30 6.739 45.022 12.443 1.00 0.00 H ATOM 13 N TYR A 31 5.384 41.848 14.207 1.00 24.45 N ATOM 14 CA TYR A 31 4.544 40.687 14.490 1.00 19.56 C ATOM 15 C TYR A 31 3.584 40.471 13.327 1.00 21.44 C ATOM 16 O TYR A 31 2.947 41.427 12.872 1.00 20.43 O ATOM 17 CB TYR A 31 3.760 40.860 15.791 1.00 19.62 C ATOM 18 CG TYR A 31 3.230 39.551 16.339 1.00 14.28 C ATOM 19 CD1 TYR A 31 4.066 38.683 17.024 1.00 14.90 C ATOM 20 CD2 TYR A 31 1.903 39.185 16.164 1.00 12.48 C ATOM 21 CE1 TYR A 31 3.597 37.470 17.525 1.00 13.50 C ATOM 22 CE2 TYR A 31 1.416 37.968 16.661 1.00 14.52 C ATOM 23 CZ TYR A 31 2.271 37.122 17.340 1.00 13.42 C ATOM 24 OH TYR A 31 1.806 35.935 17.844 1.00 11.89 O ATOM 25 HH TYR A 31 2.546 35.458 18.297 1.00 0.00 H ATOM 26 H TYR A 31 5.258 42.728 14.747 1.00 0.00 H ATOM 27 N PRO A 32 3.457 39.250 12.817 1.00 21.50 N ATOM 28 CA PRO A 32 2.613 39.035 11.637 1.00 24.47 C ATOM 29 C PRO A 32 1.144 39.297 11.920 1.00 23.29 C ATOM 30 O PRO A 32 0.640 39.071 13.022 1.00 23.04 O ATOM 31 CB PRO A 32 2.854 37.560 11.286 1.00 23.45 C ATOM 32 CG PRO A 32 3.413 36.952 12.512 1.00 21.93 C ATOM 33 CD PRO A 32 4.162 38.026 13.226 1.00 18.90 C ATOM 34 N THR A 33 0.462 39.785 10.895 1.00 23.76 N ATOM 35 CA THR A 33 -0.970 40.023 10.902 1.00 30.11 C ATOM 36 C THR A 33 -1.607 39.209 9.776 1.00 34.32 C ATOM 37 O THR A 33 -0.920 38.525 9.013 1.00 37.13 O ATOM 38 CB THR A 33 -1.269 41.519 10.766 1.00 31.54 C ATOM 39 OG1 THR A 33 -0.851 41.973 9.476 1.00 35.40 O ATOM 40 CG2 THR A 33 -0.518 42.312 11.828 1.00 31.62 C ATOM 41 HG1 THR A 33 0.122 41.819 9.373 1.00 0.00 H ATOM 42 H THR A 33 0.988 40.013 10.027 1.00 0.00 H ATOM 43 N VAL A 34 -2.938 39.288 9.686 1.00 39.12 N ATOM 44 CA VAL A 34 -3.699 38.432 8.776 1.00 41.10 C ATOM 45 C VAL A 34 -3.265 38.637 7.330 1.00 47.93 C ATOM 46 O VAL A 34 -3.153 37.674 6.559 1.00 51.21 O ATOM 47 CB VAL A 34 -5.202 38.702 8.945 1.00 37.63 C ATOM 48 CG1 VAL A 34 -5.728 38.018 10.198 1.00 34.72 C ATOM 49 CG2 VAL A 34 -5.417 40.181 9.032 1.00 40.72 C ATOM 50 H VAL A 34 -3.446 39.976 10.278 1.00 0.00 H ATOM 51 N SER A 35 -3.025 39.891 6.932 1.00 48.95 N ATOM 52 CA SER A 35 -2.717 40.177 5.537 1.00 51.57 C ATOM 53 C SER A 35 -1.348 39.653 5.129 1.00 51.43 C ATOM 54 O SER A 35 -1.088 39.504 3.931 1.00 53.10 O ATOM 55 CB SER A 35 -2.808 41.680 5.272 1.00 53.68 C ATOM 56 OG SER A 35 -4.075 42.188 5.668 1.00 55.24 O ATOM 57 HG SER A 35 -4.206 42.026 6.636 1.00 0.00 H ATOM 58 H SER A 35 -3.058 40.667 7.623 1.00 0.00 H ATOM 59 N GLU A 36 -0.473 39.376 6.094 1.00 49.53 N ATOM 60 CA GLU A 36 0.789 38.708 5.814 1.00 48.01 C ATOM 61 C GLU A 36 0.636 37.204 5.649 1.00 46.48 C ATOM 62 O GLU A 36 1.575 36.555 5.176 1.00 48.43 O ATOM 63 CB GLU A 36 1.797 38.972 6.936 1.00 48.83 C ATOM 64 CG GLU A 36 2.634 40.219 6.759 1.00 49.54 C ATOM 65 CD GLU A 36 2.014 41.424 7.424 1.00 49.90 C ATOM 66 OE1 GLU A 36 1.783 42.434 6.727 1.00 52.20 O ATOM 67 OE2 GLU A 36 1.754 41.362 8.644 1.00 47.89 O ATOM 68 H GLU A 36 -0.698 39.644 7.073 1.00 0.00 H ATOM 69 N ILE A 37 -0.503 36.637 6.022 1.00 43.19 N ATOM 70 CA ILE A 37 -0.654 35.198 6.175 1.00 39.99 C ATOM 71 C ILE A 37 -1.752 34.711 5.240 1.00 44.87 C ATOM 72 O ILE A 37 -2.940 34.846 5.535 1.00 43.03 O ATOM 73 CB ILE A 37 -0.972 34.821 7.632 1.00 34.65 C ATOM 74 CG1 ILE A 37 0.088 35.405 8.560 1.00 30.21 C ATOM 75 CG2 ILE A 37 -1.065 33.306 7.776 1.00 36.73 C ATOM 76 CD1 ILE A 37 -0.081 34.976 9.968 1.00 27.84 C ATOM 77 H ILE A 37 -1.323 37.247 6.213 1.00 0.00 H ATOM 78 N PRO A 38 -1.389 34.102 4.113 1.00 50.22 N ATOM 79 CA PRO A 38 -2.398 33.437 3.283 1.00 49.83 C ATOM 80 C PRO A 38 -3.043 32.290 4.047 1.00 49.65 C ATOM 81 O PRO A 38 -2.448 31.705 4.955 1.00 47.82 O ATOM 82 CB PRO A 38 -1.597 32.928 2.079 1.00 51.44 C ATOM 83 CG PRO A 38 -0.277 33.653 2.135 1.00 52.35 C ATOM 84 CD PRO A 38 -0.029 33.943 3.577 1.00 52.10 C ATOM 85 N VAL A 39 -4.287 31.978 3.674 1.00 48.27 N ATOM 86 CA VAL A 39 -5.006 30.917 4.365 1.00 47.27 C ATOM 87 C VAL A 39 -4.301 29.590 4.123 1.00 41.22 C ATOM 88 O VAL A 39 -3.777 29.326 3.031 1.00 36.23 O ATOM 89 CB VAL A 39 -6.479 30.877 3.921 1.00 49.44 C ATOM 90 CG1 VAL A 39 -6.637 30.175 2.566 1.00 44.31 C ATOM 91 CG2 VAL A 39 -7.341 30.215 5.000 1.00 52.24 C ATOM 92 H VAL A 39 -4.741 32.492 2.892 1.00 0.00 H ATOM 93 N GLY A 40 -4.251 28.760 5.163 1.00 35.94 N ATOM 94 CA GLY A 40 -3.528 27.512 5.097 1.00 30.45 C ATOM 95 C GLY A 40 -2.051 27.614 5.395 1.00 28.02 C ATOM 96 O GLY A 40 -1.375 26.578 5.452 1.00 29.61 O ATOM 97 H GLY A 40 -4.744 29.016 6.042 1.00 0.00 H ATOM 98 N GLU A 41 -1.523 28.820 5.584 1.00 25.85 N ATOM 99 CA GLU A 41 -0.115 29.036 5.876 1.00 24.45 C ATOM 100 C GLU A 41 0.066 29.446 7.330 1.00 21.60 C ATOM 101 O GLU A 41 -0.860 29.941 7.976 1.00 24.73 O ATOM 102 CB GLU A 41 0.474 30.109 4.966 1.00 30.08 C ATOM 103 CG GLU A 41 1.141 29.554 3.735 1.00 36.84 C ATOM 104 CD GLU A 41 2.325 30.391 3.324 1.00 42.93 C ATOM 105 OE1 GLU A 41 2.148 31.623 3.166 1.00 43.11 O ATOM 106 OE2 GLU A 41 3.431 29.821 3.184 1.00 43.30 O ATOM 107 H GLU A 41 -2.148 29.649 5.520 1.00 0.00 H ATOM 108 N VAL A 42 1.285 29.247 7.834 1.00 15.98 N ATOM 109 CA VAL A 42 1.613 29.489 9.232 1.00 12.55 C ATOM 110 C VAL A 42 2.925 30.257 9.314 1.00 17.01 C ATOM 111 O VAL A 42 3.881 29.949 8.593 1.00 24.19 O ATOM 112 CB VAL A 42 1.707 28.159 10.013 1.00 11.70 C ATOM 113 CG1 VAL A 42 2.230 28.396 11.429 1.00 13.16 C ATOM 114 CG2 VAL A 42 0.355 27.486 10.062 1.00 13.39 C ATOM 115 H VAL A 42 2.035 28.904 7.200 1.00 0.00 H ATOM 116 N ARG A 43 2.974 31.252 10.195 1.00 15.35 N ATOM 117 CA ARG A 43 4.199 31.970 10.518 1.00 15.95 C ATOM 118 C ARG A 43 4.645 31.636 11.935 1.00 13.73 C ATOM 119 O ARG A 43 3.816 31.430 12.827 1.00 12.59 O ATOM 120 CB ARG A 43 4.000 33.487 10.407 1.00 18.34 C ATOM 121 CG ARG A 43 3.701 33.976 9.013 1.00 23.03 C ATOM 122 CD ARG A 43 4.980 34.306 8.279 1.00 33.02 C ATOM 123 NE ARG A 43 4.729 34.997 7.016 1.00 45.38 N ATOM 124 CZ ARG A 43 4.577 36.314 6.897 1.00 52.03 C ATOM 125 NH1 ARG A 43 4.637 37.094 7.970 1.00 52.89 N ATOM 126 NH2 ARG A 43 4.361 36.854 5.702 1.00 55.26 N ATOM 127 HE ARG A 43 4.665 34.421 6.152 1.00 0.00 H ATOM 128 HH12 ARG A 43 4.518 38.123 7.873 1.00 0.00 H ATOM 129 HH11 ARG A 43 4.803 36.676 8.908 1.00 0.00 H ATOM 130 HH22 ARG A 43 4.242 37.883 5.610 1.00 0.00 H ATOM 131 HH21 ARG A 43 4.311 36.247 4.859 1.00 0.00 H ATOM 132 H ARG A 43 2.095 31.531 10.676 1.00 0.00 H ATOM 133 N LEU A 44 5.961 31.595 12.139 1.00 15.78 N ATOM 134 CA LEU A 44 6.560 31.498 13.465 1.00 13.59 C ATOM 135 C LEU A 44 7.180 32.835 13.847 1.00 13.70 C ATOM 136 O LEU A 44 7.693 33.559 12.995 1.00 17.43 O ATOM 137 CB LEU A 44 7.631 30.408 13.514 1.00 13.81 C ATOM 138 CG LEU A 44 7.152 29.062 12.980 1.00 14.68 C ATOM 139 CD1 LEU A 44 8.243 28.015 13.123 1.00 19.54 C ATOM 140 CD2 LEU A 44 5.890 28.632 13.729 1.00 11.14 C ATOM 141 H LEU A 44 6.591 31.634 11.313 1.00 0.00 H ATOM 142 N TYR A 45 7.145 33.156 15.140 1.00 14.64 N ATOM 143 CA TYR A 45 7.696 34.412 15.634 1.00 13.40 C ATOM 144 C TYR A 45 8.431 34.127 16.931 1.00 15.64 C ATOM 145 O TYR A 45 7.820 33.670 17.902 1.00 15.93 O ATOM 146 CB TYR A 45 6.583 35.449 15.838 1.00 12.63 C ATOM 147 CG TYR A 45 7.040 36.807 16.320 1.00 15.29 C ATOM 148 CD1 TYR A 45 7.156 37.079 17.678 1.00 19.50 C ATOM 149 CD2 TYR A 45 7.331 37.823 15.419 1.00 14.61 C ATOM 150 CE1 TYR A 45 7.564 38.323 18.126 1.00 21.62 C ATOM 151 CE2 TYR A 45 7.734 39.071 15.854 1.00 18.65 C ATOM 152 CZ TYR A 45 7.852 39.316 17.210 1.00 23.34 C ATOM 153 OH TYR A 45 8.252 40.555 17.654 1.00 25.29 O ATOM 154 HH TYR A 45 9.152 40.758 17.295 1.00 0.00 H ATOM 155 H TYR A 45 6.713 32.493 15.815 1.00 0.00 H ATOM 156 N GLN A 47 9.738 34.374 16.944 1.00 17.34 N ATOM 157 CA GLN A 47 10.547 34.082 18.119 1.00 20.11 C ATOM 158 C GLN A 47 10.364 35.181 19.154 1.00 21.49 C ATOM 159 O GLN A 47 10.753 36.332 18.921 1.00 20.24 O ATOM 160 CB GLN A 47 12.019 33.947 17.748 1.00 27.40 C ATOM 161 CG GLN A 47 12.918 33.751 18.954 1.00 32.27 C ATOM 162 CD GLN A 47 14.253 33.131 18.593 1.00 39.17 C ATOM 163 OE1 GLN A 47 14.347 31.928 18.352 1.00 38.57 O ATOM 164 NE2 GLN A 47 15.298 33.954 18.557 1.00 43.08 N ATOM 165 HE22 GLN A 47 15.172 34.964 18.768 1.00 0.00 H ATOM 166 HE21 GLN A 47 16.241 33.587 18.318 1.00 0.00 H ATOM 167 H GLN A 47 10.190 34.782 16.101 1.00 0.00 H ATOM 168 N ILE A 48 9.790 34.817 20.297 1.00 21.68 N ATOM 169 CA ILE A 48 9.509 35.753 21.382 1.00 18.63 C ATOM 170 C ILE A 48 10.723 35.939 22.279 1.00 22.72 C ATOM 171 O ILE A 48 11.092 37.065 22.619 1.00 24.05 O ATOM 172 CB ILE A 48 8.290 35.253 22.189 1.00 18.90 C ATOM 173 CG1 ILE A 48 7.021 35.296 21.336 1.00 21.26 C ATOM 174 CG2 ILE A 48 8.114 36.044 23.479 1.00 20.23 C ATOM 175 CD1 ILE A 48 5.998 34.277 21.768 1.00 23.13 C ATOM 176 H ILE A 48 9.529 33.818 20.424 1.00 0.00 H ATOM 177 N ALA A 49 11.332 34.832 22.696 1.00 23.09 N ATOM 178 CA ALA A 49 12.591 34.830 23.419 1.00 25.59 C ATOM 179 C ALA A 49 13.374 33.605 22.981 1.00 26.32 C ATOM 180 O ALA A 49 12.925 32.831 22.130 1.00 27.47 O ATOM 181 CB ALA A 49 12.373 34.832 24.938 1.00 24.14 C ATOM 182 H ALA A 49 10.881 33.917 22.493 1.00 0.00 H ATOM 183 N ASP A 50 14.544 33.420 23.582 1.00 28.97 N ATOM 184 CA ASP A 50 15.363 32.246 23.314 1.00 31.71 C ATOM 185 C ASP A 50 14.584 30.966 23.604 1.00 28.85 C ATOM 186 O ASP A 50 14.124 30.749 24.731 1.00 27.81 O ATOM 187 CB ASP A 50 16.629 32.301 24.166 1.00 41.85 C ATOM 188 CG ASP A 50 17.659 31.279 23.742 1.00 51.64 C ATOM 189 OD1 ASP A 50 17.684 30.919 22.545 1.00 54.44 O ATOM 190 OD2 ASP A 50 18.435 30.823 24.610 1.00 56.89 O ATOM 191 H ASP A 50 14.884 34.131 24.261 1.00 0.00 H ATOM 192 N GLY A 51 14.441 30.116 22.585 1.00 26.10 N ATOM 193 CA GLY A 51 13.700 28.878 22.733 1.00 23.23 C ATOM 194 C GLY A 51 12.200 29.025 22.866 1.00 20.36 C ATOM 195 O GLY A 51 11.522 28.048 23.206 1.00 17.50 O ATOM 196 H GLY A 51 14.870 30.346 21.666 1.00 0.00 H ATOM 197 N VAL A 52 11.643 30.208 22.616 1.00 17.30 N ATOM 198 CA VAL A 52 10.205 30.404 22.725 1.00 13.33 C ATOM 199 C VAL A 52 9.718 31.113 21.472 1.00 14.08 C ATOM 200 O VAL A 52 10.208 32.200 21.135 1.00 13.94 O ATOM 201 CB VAL A 52 9.817 31.194 23.984 1.00 13.07 C ATOM 202 CG1 VAL A 52 8.316 31.363 24.028 1.00 13.94 C ATOM 203 CG2 VAL A 52 10.300 30.472 25.218 1.00 15.03 C ATOM 204 H VAL A 52 12.247 31.007 22.337 1.00 0.00 H ATOM 205 N TRP A 53 8.772 30.487 20.774 1.00 12.82 N ATOM 206 CA TRP A 53 8.126 31.054 19.605 1.00 13.37 C ATOM 207 C TRP A 53 6.620 31.028 19.806 1.00 12.63 C ATOM 208 O TRP A 53 6.088 30.158 20.496 1.00 13.35 O ATOM 209 CB TRP A 53 8.423 30.268 18.314 1.00 17.40 C ATOM 210 CG TRP A 53 9.855 30.025 17.972 1.00 18.57 C ATOM 211 CD1 TRP A 53 10.582 30.657 17.005 1.00 18.52 C ATOM 212 CD2 TRP A 53 10.718 29.034 18.542 1.00 21.08 C ATOM 213 NE1 TRP A 53 11.850 30.140 16.956 1.00 19.83 N ATOM 214 CE2 TRP A 53 11.962 29.140 17.888 1.00 22.85 C ATOM 215 CE3 TRP A 53 10.563 28.072 19.549 1.00 19.17 C ATOM 216 CZ2 TRP A 53 13.048 28.327 18.210 1.00 21.20 C ATOM 217 CZ3 TRP A 53 11.640 27.265 19.866 1.00 19.90 C ATOM 218 CH2 TRP A 53 12.868 27.397 19.198 1.00 21.28 C ATOM 219 HE1 TRP A 53 12.606 30.455 16.315 1.00 0.00 H ATOM 220 H TRP A 53 8.480 29.538 21.084 1.00 0.00 H ATOM 221 N SER A 54 5.932 31.970 19.178 1.00 13.28 N ATOM 222 CA SER A 54 4.521 31.778 18.900 1.00 11.88 C ATOM 223 C SER A 54 4.377 31.308 17.460 1.00 10.55 C ATOM 224 O SER A 54 5.229 31.584 16.610 1.00 11.19 O ATOM 225 CB SER A 54 3.710 33.059 19.137 1.00 11.57 C ATOM 226 OG SER A 54 4.163 34.124 18.324 1.00 12.84 O ATOM 227 HG SER A 54 3.618 34.930 18.504 1.00 0.00 H ATOM 228 H SER A 54 6.404 32.849 18.884 1.00 0.00 H ATOM 229 N HIS A 55 3.323 30.547 17.200 1.00 8.17 N ATOM 230 CA HIS A 55 2.913 30.270 15.836 1.00 8.31 C ATOM 231 C HIS A 55 1.620 31.022 15.559 1.00 9.62 C ATOM 232 O HIS A 55 0.757 31.152 16.438 1.00 6.96 O ATOM 233 CB HIS A 55 2.776 28.759 15.563 1.00 6.50 C ATOM 234 CG HIS A 55 1.794 28.037 16.435 1.00 8.66 C ATOM 235 ND1 HIS A 55 0.442 28.000 16.167 1.00 8.63 N ATOM 236 CD2 HIS A 55 1.980 27.261 17.532 1.00 10.87 C ATOM 237 CE1 HIS A 55 -0.166 27.261 17.078 1.00 9.74 C ATOM 238 NE2 HIS A 55 0.745 26.802 17.920 1.00 9.41 N ATOM 239 H HIS A 55 2.780 30.141 17.988 1.00 0.00 H ATOM 240 N ILE A 56 1.524 31.575 14.353 1.00 11.08 N ATOM 241 CA ILE A 56 0.402 32.411 13.957 1.00 8.73 C ATOM 242 C ILE A 56 -0.186 31.833 12.684 1.00 12.10 C ATOM 243 O ILE A 56 0.554 31.498 11.751 1.00 16.51 O ATOM 244 CB ILE A 56 0.831 33.877 13.747 1.00 11.74 C ATOM 245 CG1 ILE A 56 1.627 34.383 14.957 1.00 10.44 C ATOM 246 CG2 ILE A 56 -0.388 34.764 13.505 1.00 9.76 C ATOM 247 CD1 ILE A 56 3.143 34.216 14.849 1.00 13.57 C ATOM 248 H ILE A 56 2.284 31.402 13.664 1.00 0.00 H ATOM 249 N ALA A 57 -1.512 31.709 12.647 1.00 7.22 N ATOM 250 CA ALA A 57 -2.213 31.223 11.471 1.00 9.43 C ATOM 251 C ALA A 57 -3.497 32.023 11.329 1.00 11.17 C ATOM 252 O ALA A 57 -3.816 32.878 12.163 1.00 13.83 O ATOM 253 CB ALA A 57 -2.491 29.716 11.565 1.00 10.99 C ATOM 254 H ALA A 57 -2.064 31.969 13.489 1.00 0.00 H ATOM 255 N THR A 58 -4.239 31.755 10.262 1.00 12.95 N ATOM 256 CA THR A 58 -5.496 32.444 10.030 1.00 15.53 C ATOM 257 C THR A 58 -6.573 31.435 9.677 1.00 14.87 C ATOM 258 O THR A 58 -6.298 30.329 9.207 1.00 16.08 O ATOM 259 CB THR A 58 -5.395 33.500 8.914 1.00 18.59 C ATOM 260 OG1 THR A 58 -4.922 32.889 7.710 1.00 22.07 O ATOM 261 CG2 THR A 58 -4.455 34.616 9.313 1.00 17.82 C ATOM 262 HG1 THR A 58 -4.028 32.495 7.870 1.00 0.00 H ATOM 263 H THR A 58 -3.915 31.039 9.580 1.00 0.00 H ATOM 264 N GLN A 59 -7.814 31.834 9.918 1.00 14.71 N ATOM 265 CA GLN A 59 -8.953 31.000 9.589 1.00 14.59 C ATOM 266 C GLN A 59 -10.097 31.913 9.178 1.00 14.44 C ATOM 267 O GLN A 59 -10.251 33.008 9.727 1.00 17.21 O ATOM 268 CB GLN A 59 -9.336 30.120 10.786 1.00 15.11 C ATOM 269 CG GLN A 59 -10.246 28.970 10.475 1.00 16.53 C ATOM 270 CD GLN A 59 -9.869 28.257 9.200 1.00 21.03 C ATOM 271 OE1 GLN A 59 -10.416 28.545 8.137 1.00 21.46 O ATOM 272 NE2 GLN A 59 -8.944 27.309 9.299 1.00 19.02 N ATOM 273 HE22 GLN A 59 -8.509 27.101 10.221 1.00 0.00 H ATOM 274 HE21 GLN A 59 -8.654 26.775 8.455 1.00 0.00 H ATOM 275 H GLN A 59 -7.974 32.765 10.352 1.00 0.00 H ATOM 276 N SER A 60 -10.874 31.477 8.196 1.00 17.63 N ATOM 277 CA SER A 60 -12.072 32.203 7.802 1.00 23.18 C ATOM 278 C SER A 60 -13.278 31.624 8.510 1.00 26.68 C ATOM 279 O SER A 60 -13.395 30.406 8.671 1.00 27.85 O ATOM 280 CB SER A 60 -12.301 32.148 6.294 1.00 29.06 C ATOM 281 OG SER A 60 -11.730 33.272 5.668 1.00 35.65 O ATOM 282 HG SER A 60 -11.888 33.220 4.692 1.00 0.00 H ATOM 283 H SER A 60 -10.622 30.599 7.698 1.00 0.00 H ATOM 284 N PHE A 61 -14.178 32.505 8.924 1.00 24.22 N ATOM 285 CA PHE A 61 -15.364 32.061 9.638 1.00 26.77 C ATOM 286 C PHE A 61 -16.420 33.142 9.502 1.00 29.22 C ATOM 287 O PHE A 61 -16.153 34.307 9.820 1.00 29.95 O ATOM 288 CB PHE A 61 -15.035 31.784 11.104 1.00 28.05 C ATOM 289 CG PHE A 61 -16.160 31.166 11.862 1.00 32.32 C ATOM 290 CD1 PHE A 61 -16.367 29.797 11.825 1.00 37.21 C ATOM 291 CD2 PHE A 61 -17.027 31.955 12.605 1.00 35.38 C ATOM 292 CE1 PHE A 61 -17.418 29.219 12.529 1.00 41.93 C ATOM 293 CE2 PHE A 61 -18.082 31.385 13.307 1.00 39.12 C ATOM 294 CZ PHE A 61 -18.276 30.016 13.271 1.00 42.51 C ATOM 295 H PHE A 61 -14.035 33.518 8.737 1.00 0.00 H ATOM 296 N ASP A 62 -17.598 32.768 8.998 1.00 30.46 N ATOM 297 CA ASP A 62 -18.728 33.689 8.901 1.00 30.35 C ATOM 298 C ASP A 62 -18.361 34.946 8.120 1.00 26.49 C ATOM 299 O ASP A 62 -18.801 36.046 8.452 1.00 27.78 O ATOM 300 CB ASP A 62 -19.248 34.064 10.289 1.00 35.64 C ATOM 301 CG ASP A 62 -20.490 33.305 10.670 1.00 39.91 C ATOM 302 OD1 ASP A 62 -21.117 32.701 9.776 1.00 38.07 O ATOM 303 OD2 ASP A 62 -20.836 33.310 11.868 1.00 43.20 O ATOM 304 H ASP A 62 -17.715 31.790 8.664 1.00 0.00 H ATOM 305 N GLY A 63 -17.518 34.794 7.100 1.00 25.44 N ATOM 306 CA GLY A 63 -17.214 35.878 6.193 1.00 25.93 C ATOM 307 C GLY A 63 -16.041 36.754 6.585 1.00 23.49 C ATOM 308 O GLY A 63 -15.633 37.606 5.785 1.00 27.02 O ATOM 309 H GLY A 63 -17.066 33.869 6.952 1.00 0.00 H ATOM 310 N ALA A 64 -15.488 36.579 7.778 1.00 20.66 N ATOM 311 CA ALA A 64 -14.370 37.378 8.245 1.00 18.87 C ATOM 312 C ALA A 64 -13.156 36.480 8.434 1.00 17.76 C ATOM 313 O ALA A 64 -13.269 35.252 8.467 1.00 21.49 O ATOM 314 CB ALA A 64 -14.711 38.097 9.556 1.00 18.18 C ATOM 315 H ALA A 64 -15.870 35.841 8.403 1.00 0.00 H ATOM 316 N VAL A 66 -11.984 37.098 8.553 1.00 14.98 N ATOM 317 CA VAL A 66 -10.738 36.363 8.731 1.00 13.83 C ATOM 318 C VAL A 66 -10.123 36.750 10.066 1.00 14.27 C ATOM 319 O VAL A 66 -10.000 37.941 10.380 1.00 14.20 O ATOM 320 CB VAL A 66 -9.762 36.612 7.570 1.00 12.61 C ATOM 321 CG1 VAL A 66 -8.409 35.946 7.853 1.00 17.27 C ATOM 322 CG2 VAL A 66 -10.378 36.064 6.298 1.00 14.23 C ATOM 323 H VAL A 66 -11.956 38.137 8.518 1.00 0.00 H ATOM 324 N TYR A 67 -9.751 35.736 10.852 1.00 14.56 N ATOM 325 CA TYR A 67 -9.213 35.897 12.190 1.00 14.08 C ATOM 326 C TYR A 67 -7.808 35.322 12.281 1.00 13.71 C ATOM 327 O TYR A 67 -7.545 34.248 11.729 1.00 10.83 O ATOM 328 CB TYR A 67 -10.088 35.186 13.232 1.00 14.01 C ATOM 329 CG TYR A 67 -11.534 35.599 13.216 1.00 13.07 C ATOM 330 CD1 TYR A 67 -12.445 34.995 12.353 1.00 13.21 C ATOM 331 CD2 TYR A 67 -11.998 36.581 14.086 1.00 12.98 C ATOM 332 CE1 TYR A 67 -13.768 35.367 12.346 1.00 13.12 C ATOM 333 CE2 TYR A 67 -13.312 36.963 14.084 1.00 17.29 C ATOM 334 CZ TYR A 67 -14.196 36.358 13.217 1.00 16.19 C ATOM 335 OH TYR A 67 -15.513 36.754 13.231 1.00 20.60 O ATOM 336 HH TYR A 67 -15.569 37.718 13.014 1.00 0.00 H ATOM 337 H TYR A 67 -9.853 34.770 10.481 1.00 0.00 H ATOM 338 N PRO A 68 -6.897 35.997 12.976 1.00 12.03 N ATOM 339 CA PRO A 68 -5.624 35.372 13.331 1.00 12.36 C ATOM 340 C PRO A 68 -5.776 34.561 14.612 1.00 12.76 C ATOM 341 O PRO A 68 -6.708 34.749 15.398 1.00 13.32 O ATOM 342 CB PRO A 68 -4.706 36.572 13.551 1.00 10.30 C ATOM 343 CG PRO A 68 -5.656 37.589 14.204 1.00 9.82 C ATOM 344 CD PRO A 68 -7.033 37.340 13.578 1.00 11.18 C ATOM 345 N SER A 69 -4.841 33.638 14.808 1.00 10.52 N ATOM 346 CA SER A 69 -4.830 32.838 16.023 1.00 8.82 C ATOM 347 C SER A 69 -3.391 32.475 16.342 1.00 7.79 C ATOM 348 O SER A 69 -2.610 32.170 15.432 1.00 10.74 O ATOM 349 CB SER A 69 -5.691 31.579 15.869 1.00 8.52 C ATOM 350 OG SER A 69 -5.744 30.864 17.089 1.00 8.59 O ATOM 351 HG SER A 69 -4.828 30.598 17.354 1.00 0.00 H ATOM 352 H SER A 69 -4.109 33.486 14.085 1.00 0.00 H ATOM 353 N ASN A 70 -3.054 32.508 17.633 1.00 7.05 N ATOM 354 CA ASN A 70 -1.721 32.225 18.149 1.00 8.70 C ATOM 355 C ASN A 70 -1.701 30.896 18.890 1.00 9.42 C ATOM 356 O ASN A 70 -2.690 30.495 19.512 1.00 11.25 O ATOM 357 CB ASN A 70 -1.247 33.301 19.140 1.00 9.75 C ATOM 358 CG ASN A 70 -1.187 34.687 18.531 1.00 9.58 C ATOM 359 OD1 ASN A 70 -0.662 34.873 17.436 1.00 12.07 O ATOM 360 ND2 ASN A 70 -1.717 35.676 19.255 1.00 9.61 N ATOM 361 HD22 ASN A 70 -2.151 35.470 20.177 1.00 0.00 H ATOM 362 HD21 ASN A 70 -1.696 36.652 18.896 1.00 0.00 H ATOM 363 H ASN A 70 -3.796 32.753 18.320 1.00 0.00 H ATOM 364 N GLY A 71 -0.548 30.231 18.835 1.00 10.32 N ATOM 365 CA GLY A 71 -0.199 29.194 19.784 1.00 7.32 C ATOM 366 C GLY A 71 1.246 29.382 20.204 1.00 9.39 C ATOM 367 O GLY A 71 1.860 30.397 19.863 1.00 10.39 O ATOM 368 H GLY A 71 0.128 30.466 18.081 1.00 0.00 H ATOM 369 N LEU A 72 1.814 28.426 20.933 1.00 9.86 N ATOM 370 CA LEU A 72 3.159 28.580 21.464 1.00 10.97 C ATOM 371 C LEU A 72 4.010 27.375 21.080 1.00 10.50 C ATOM 372 O LEU A 72 3.491 26.281 20.837 1.00 8.85 O ATOM 373 CB LEU A 72 3.138 28.762 22.999 1.00 10.12 C ATOM 374 CG LEU A 72 4.234 29.629 23.633 1.00 11.79 C ATOM 375 CD1 LEU A 72 4.174 31.072 23.132 1.00 14.19 C ATOM 376 CD2 LEU A 72 4.152 29.578 25.166 1.00 11.88 C ATOM 377 H LEU A 72 1.286 27.551 21.127 1.00 0.00 H ATOM 378 N ILE A 73 5.324 27.601 21.012 1.00 9.62 N ATOM 379 CA ILE A 73 6.323 26.558 20.811 1.00 10.21 C ATOM 380 C ILE A 73 7.445 26.805 21.810 1.00 10.50 C ATOM 381 O ILE A 73 7.988 27.914 21.868 1.00 14.12 O ATOM 382 CB ILE A 73 6.904 26.565 19.383 1.00 9.00 C ATOM 383 CG1 ILE A 73 5.810 26.528 18.316 1.00 9.60 C ATOM 384 CG2 ILE A 73 7.873 25.399 19.202 1.00 10.97 C ATOM 385 CD1 ILE A 73 6.346 26.775 16.895 1.00 8.07 C ATOM 386 H ILE A 73 5.656 28.582 21.108 1.00 0.00 H ATOM 387 N VAL A 74 7.802 25.784 22.585 1.00 9.28 N ATOM 388 CA VAL A 74 8.805 25.934 23.631 1.00 9.65 C ATOM 389 C VAL A 74 9.848 24.836 23.470 1.00 13.05 C ATOM 390 O VAL A 74 9.514 23.647 23.516 1.00 12.98 O ATOM 391 CB VAL A 74 8.191 25.880 25.040 1.00 12.04 C ATOM 392 CG1 VAL A 74 9.264 26.215 26.066 1.00 11.15 C ATOM 393 CG2 VAL A 74 7.009 26.846 25.162 1.00 10.27 C ATOM 394 H VAL A 74 7.354 24.857 22.441 1.00 0.00 H ATOM 395 N ARG A 75 11.109 25.230 23.308 1.00 14.12 N ATOM 396 CA ARG A 75 12.181 24.247 23.231 1.00 18.45 C ATOM 397 C ARG A 75 12.361 23.566 24.582 1.00 17.99 C ATOM 398 O ARG A 75 12.245 24.198 25.634 1.00 19.99 O ATOM 399 CB ARG A 75 13.487 24.911 22.793 1.00 19.77 C ATOM 400 CG ARG A 75 14.596 23.920 22.445 1.00 20.00 C ATOM 401 CD ARG A 75 15.775 24.614 21.759 1.00 27.75 C ATOM 402 NE ARG A 75 16.394 25.624 22.618 1.00 38.58 N ATOM 403 CZ ARG A 75 16.685 26.870 22.242 1.00 42.85 C ATOM 404 NH1 ARG A 75 16.425 27.281 21.005 1.00 42.93 N ATOM 405 NH2 ARG A 75 17.241 27.710 23.107 1.00 43.87 N ATOM 406 HE ARG A 75 16.624 25.350 23.594 1.00 0.00 H ATOM 407 HH12 ARG A 75 16.656 28.255 20.721 1.00 0.00 H ATOM 408 HH11 ARG A 75 15.991 26.629 20.321 1.00 0.00 H ATOM 409 HH22 ARG A 75 17.468 28.682 22.815 1.00 0.00 H ATOM 410 HH21 ARG A 75 17.449 27.396 24.076 1.00 0.00 H ATOM 411 H ARG A 75 11.330 26.244 23.236 1.00 0.00 H ATOM 412 N ASP A 76 12.628 22.258 24.554 1.00 22.89 N ATOM 413 CA ASP A 76 12.898 21.479 25.772 1.00 25.09 C ATOM 414 C ASP A 76 14.050 20.524 25.463 1.00 28.13 C ATOM 415 O ASP A 76 13.835 19.409 24.982 1.00 27.49 O ATOM 416 CB ASP A 76 11.661 20.731 26.242 1.00 27.09 C ATOM 417 CG ASP A 76 11.871 20.043 27.581 1.00 35.34 C ATOM 418 OD1 ASP A 76 12.758 20.488 28.350 1.00 39.84 O ATOM 419 OD2 ASP A 76 11.156 19.056 27.863 1.00 34.37 O ATOM 420 H ASP A 76 12.646 21.771 23.635 1.00 0.00 H ATOM 421 N GLY A 77 15.270 20.964 25.757 1.00 27.60 N ATOM 422 CA GLY A 77 16.438 20.220 25.336 1.00 24.91 C ATOM 423 C GLY A 77 16.516 20.158 23.825 1.00 27.14 C ATOM 424 O GLY A 77 16.587 21.196 23.161 1.00 28.35 O ATOM 425 H GLY A 77 15.386 21.848 26.293 1.00 0.00 H ATOM 426 N ASP A 78 16.491 18.949 23.264 1.00 25.74 N ATOM 427 CA ASP A 78 16.532 18.770 21.822 1.00 27.45 C ATOM 428 C ASP A 78 15.169 18.408 21.238 1.00 25.87 C ATOM 429 O ASP A 78 15.106 17.812 20.160 1.00 25.44 O ATOM 430 CB ASP A 78 17.561 17.702 21.452 1.00 31.90 C ATOM 431 CG ASP A 78 18.945 18.011 21.998 1.00 39.94 C ATOM 432 OD1 ASP A 78 19.366 19.187 21.928 1.00 44.10 O ATOM 433 OD2 ASP A 78 19.610 17.078 22.499 1.00 40.95 O ATOM 434 H ASP A 78 16.441 18.109 23.876 1.00 0.00 H ATOM 435 N GLU A 79 14.076 18.748 21.927 1.00 24.38 N ATOM 436 CA GLU A 79 12.740 18.511 21.400 1.00 20.65 C ATOM 437 C GLU A 79 11.900 19.758 21.632 1.00 16.68 C ATOM 438 O GLU A 79 12.348 20.729 22.255 1.00 17.87 O ATOM 439 CB GLU A 79 12.096 17.266 22.029 1.00 26.79 C ATOM 440 CG GLU A 79 12.012 17.265 23.550 1.00 33.97 C ATOM 441 CD GLU A 79 11.651 15.890 24.113 1.00 39.12 C ATOM 442 OE1 GLU A 79 10.544 15.740 24.681 1.00 37.04 O ATOM 443 OE2 GLU A 79 12.473 14.955 23.983 1.00 40.99 O ATOM 444 H GLU A 79 14.182 19.192 22.861 1.00 0.00 H ATOM 445 N LEU A 80 10.668 19.733 21.127 1.00 10.62 N ATOM 446 CA LEU A 80 9.773 20.873 21.235 1.00 13.29 C ATOM 447 C LEU A 80 8.457 20.471 21.882 1.00 14.58 C ATOM 448 O LEU A 80 7.912 19.398 21.598 1.00 15.22 O ATOM 449 CB LEU A 80 9.491 21.487 19.864 1.00 14.10 C ATOM 450 CG LEU A 80 10.686 21.982 19.053 1.00 14.34 C ATOM 451 CD1 LEU A 80 10.204 22.467 17.708 1.00 12.91 C ATOM 452 CD2 LEU A 80 11.444 23.079 19.785 1.00 16.41 C ATOM 453 H LEU A 80 10.337 18.874 20.642 1.00 0.00 H ATOM 454 N LEU A 81 7.952 21.351 22.747 1.00 12.67 N ATOM 455 CA LEU A 81 6.591 21.280 23.259 1.00 10.37 C ATOM 456 C LEU A 81 5.719 22.279 22.502 1.00 10.18 C ATOM 457 O LEU A 81 6.060 23.467 22.421 1.00 10.95 O ATOM 458 CB LEU A 81 6.572 21.575 24.763 1.00 9.32 C ATOM 459 CG LEU A 81 5.202 21.839 25.387 1.00 11.10 C ATOM 460 CD1 LEU A 81 4.368 20.567 25.385 1.00 10.08 C ATOM 461 CD2 LEU A 81 5.335 22.407 26.809 1.00 10.64 C ATOM 462 H LEU A 81 8.562 22.128 23.073 1.00 0.00 H ATOM 463 N LEU A 82 4.603 21.799 21.946 1.00 8.66 N ATOM 464 CA LEU A 82 3.663 22.625 21.194 1.00 8.26 C ATOM 465 C LEU A 82 2.462 22.966 22.072 1.00 7.53 C ATOM 466 O LEU A 82 1.908 22.086 22.733 1.00 9.47 O ATOM 467 CB LEU A 82 3.189 21.898 19.929 1.00 8.38 C ATOM 468 CG LEU A 82 2.118 22.609 19.088 1.00 8.12 C ATOM 469 CD1 LEU A 82 2.671 23.923 18.512 1.00 9.83 C ATOM 470 CD2 LEU A 82 1.584 21.703 17.958 1.00 9.44 C ATOM 471 H LEU A 82 4.393 20.786 22.054 1.00 0.00 H ATOM 472 N ILE A 83 2.063 24.236 22.086 1.00 7.46 N ATOM 473 CA ILE A 83 0.868 24.664 22.802 1.00 6.75 C ATOM 474 C ILE A 83 -0.163 25.065 21.757 1.00 7.58 C ATOM 475 O ILE A 83 0.012 26.063 21.044 1.00 9.75 O ATOM 476 CB ILE A 83 1.154 25.819 23.777 1.00 8.06 C ATOM 477 CG1 ILE A 83 2.385 25.515 24.636 1.00 6.30 C ATOM 478 CG2 ILE A 83 -0.063 26.107 24.650 1.00 10.05 C ATOM 479 CD1 ILE A 83 2.152 24.420 25.671 1.00 5.48 C ATOM 480 H ILE A 83 2.622 24.945 21.570 1.00 0.00 H ATOM 481 N ASP A 84 -1.227 24.271 21.662 1.00 5.22 N ATOM 482 CA ASP A 84 -2.398 24.479 20.806 1.00 4.24 C ATOM 483 C ASP A 84 -2.125 24.239 19.325 1.00 7.31 C ATOM 484 O ASP A 84 -1.024 24.499 18.825 1.00 7.84 O ATOM 485 CB ASP A 84 -2.979 25.887 21.014 1.00 6.71 C ATOM 486 CG ASP A 84 -3.693 26.010 22.345 1.00 8.10 C ATOM 487 OD1 ASP A 84 -4.299 24.994 22.761 1.00 8.14 O ATOM 488 OD2 ASP A 84 -3.651 27.105 22.969 1.00 11.86 O ATOM 489 H ASP A 84 -1.227 23.417 22.255 1.00 0.00 H ATOM 490 N THR A 85 -3.139 23.736 18.618 1.00 5.06 N ATOM 491 CA THR A 85 -3.051 23.524 17.187 1.00 5.22 C ATOM 492 C THR A 85 -3.068 24.867 16.467 1.00 8.13 C ATOM 493 O THR A 85 -3.202 25.930 17.075 1.00 9.33 O ATOM 494 CB THR A 85 -4.223 22.687 16.699 1.00 6.87 C ATOM 495 OG1 THR A 85 -5.426 23.452 16.849 1.00 8.01 O ATOM 496 CG2 THR A 85 -4.343 21.364 17.484 1.00 4.82 C ATOM 497 HG1 THR A 85 -6.197 22.917 16.534 1.00 0.00 H ATOM 498 H THR A 85 -4.021 23.488 19.110 1.00 0.00 H ATOM 499 N ALA A 86 -2.965 24.822 15.140 1.00 7.73 N ATOM 500 CA ALA A 86 -3.067 26.038 14.347 1.00 9.46 C ATOM 501 C ALA A 86 -4.455 26.209 13.734 1.00 11.50 C ATOM 502 O ALA A 86 -4.590 26.836 12.676 1.00 12.24 O ATOM 503 CB ALA A 86 -1.986 26.064 13.268 1.00 10.91 C ATOM 504 H ALA A 86 -2.810 23.909 14.666 1.00 0.00 H ATOM 505 N TRP A 87 -5.488 25.659 14.386 1.00 11.94 N ATOM 506 CA TRP A 87 -6.883 25.868 14.003 1.00 11.85 C ATOM 507 C TRP A 87 -7.211 25.155 12.691 1.00 10.09 C ATOM 508 O TRP A 87 -7.347 25.794 11.645 1.00 12.03 O ATOM 509 CB TRP A 87 -7.184 27.375 13.906 1.00 9.67 C ATOM 510 CG TRP A 87 -8.630 27.754 13.945 1.00 10.67 C ATOM 511 CD1 TRP A 87 -9.722 26.917 13.879 1.00 9.51 C ATOM 512 CD2 TRP A 87 -9.147 29.076 14.074 1.00 9.35 C ATOM 513 NE1 TRP A 87 -10.882 27.653 13.962 1.00 9.13 N ATOM 514 CE2 TRP A 87 -10.553 28.981 14.079 1.00 10.73 C ATOM 515 CE3 TRP A 87 -8.552 30.339 14.188 1.00 10.89 C ATOM 516 CZ2 TRP A 87 -11.373 30.102 14.187 1.00 13.15 C ATOM 517 CZ3 TRP A 87 -9.365 31.448 14.290 1.00 14.10 C ATOM 518 CH2 TRP A 87 -10.760 31.326 14.290 1.00 14.09 C ATOM 519 HE1 TRP A 87 -11.848 27.267 13.940 1.00 0.00 H ATOM 520 H TRP A 87 -5.287 25.052 15.207 1.00 0.00 H ATOM 521 N GLY A 88 -7.329 23.838 12.736 1.00 10.70 N ATOM 522 CA GLY A 88 -7.701 23.069 11.566 1.00 10.36 C ATOM 523 C GLY A 88 -6.587 22.137 11.105 1.00 12.31 C ATOM 524 O GLY A 88 -5.400 22.333 11.380 1.00 11.46 O ATOM 525 H GLY A 88 -7.150 23.343 13.633 1.00 0.00 H ATOM 526 N ALA A 89 -7.002 21.101 10.365 1.00 12.49 N ATOM 527 CA ALA A 89 -6.065 20.089 9.892 1.00 13.59 C ATOM 528 C ALA A 89 -5.024 20.687 8.954 1.00 13.16 C ATOM 529 O ALA A 89 -3.822 20.442 9.106 1.00 12.94 O ATOM 530 CB ALA A 89 -6.824 18.962 9.194 1.00 15.51 C ATOM 531 H ALA A 89 -8.010 21.017 10.123 1.00 0.00 H ATOM 532 N LYS A 90 -5.471 21.481 7.976 1.00 13.10 N ATOM 533 CA LYS A 90 -4.557 21.986 6.958 1.00 13.75 C ATOM 534 C LYS A 90 -3.546 22.959 7.555 1.00 15.16 C ATOM 535 O LYS A 90 -2.355 22.910 7.218 1.00 15.39 O ATOM 536 CB LYS A 90 -5.356 22.644 5.826 1.00 17.73 C ATOM 537 CG LYS A 90 -4.501 23.211 4.711 1.00 25.74 C ATOM 538 CD LYS A 90 -5.328 24.023 3.725 1.00 32.11 C ATOM 539 CE LYS A 90 -4.430 24.745 2.728 1.00 35.90 C ATOM 540 NZ LYS A 90 -4.314 24.017 1.431 1.00 40.97 N ATOM 541 HZ1 LYS A 90 -3.912 23.073 1.600 1.00 0.00 H ATOM 542 HZ2 LYS A 90 -5.257 23.922 1.003 1.00 0.00 H ATOM 543 HZ3 LYS A 90 -3.693 24.550 0.790 1.00 0.00 H ATOM 544 H LYS A 90 -6.478 21.740 7.941 1.00 0.00 H ATOM 545 N ASN A 91 -4.003 23.856 8.435 1.00 14.19 N ATOM 546 CA ASN A 91 -3.083 24.760 9.117 1.00 16.40 C ATOM 547 C ASN A 91 -2.088 23.990 9.968 1.00 12.21 C ATOM 548 O ASN A 91 -0.912 24.357 10.051 1.00 13.61 O ATOM 549 CB ASN A 91 -3.854 25.732 10.003 1.00 14.37 C ATOM 550 CG ASN A 91 -4.493 26.871 9.226 1.00 16.15 C ATOM 551 OD1 ASN A 91 -4.233 27.055 8.035 1.00 16.62 O ATOM 552 ND2 ASN A 91 -5.332 27.651 9.909 1.00 11.87 N ATOM 553 HD22 ASN A 91 -5.521 27.457 10.913 1.00 0.00 H ATOM 554 HD21 ASN A 91 -5.797 28.453 9.437 1.00 0.00 H ATOM 555 H ASN A 91 -5.022 23.910 8.635 1.00 0.00 H ATOM 556 N THR A 92 -2.556 22.937 10.639 1.00 9.84 N ATOM 557 CA THR A 92 -1.712 22.228 11.590 1.00 8.77 C ATOM 558 C THR A 92 -0.664 21.384 10.867 1.00 11.81 C ATOM 559 O THR A 92 0.489 21.306 11.305 1.00 13.18 O ATOM 560 CB THR A 92 -2.597 21.378 12.508 1.00 11.25 C ATOM 561 OG1 THR A 92 -3.534 22.239 13.185 1.00 10.56 O ATOM 562 CG2 THR A 92 -1.764 20.628 13.529 1.00 11.95 C ATOM 563 HG1 THR A 92 -4.096 22.704 12.516 1.00 0.00 H ATOM 564 H THR A 92 -3.534 22.619 10.481 1.00 0.00 H ATOM 565 N ALA A 93 -1.028 20.769 9.743 1.00 12.28 N ATOM 566 CA ALA A 93 -0.002 20.136 8.918 1.00 11.25 C ATOM 567 C ALA A 93 1.035 21.158 8.460 1.00 11.78 C ATOM 568 O ALA A 93 2.243 20.898 8.519 1.00 10.31 O ATOM 569 CB ALA A 93 -0.641 19.439 7.715 1.00 10.80 C ATOM 570 H ALA A 93 -2.027 20.740 9.457 1.00 0.00 H ATOM 571 N ALA A 94 0.584 22.333 8.012 1.00 10.87 N ATOM 572 CA ALA A 94 1.522 23.385 7.626 1.00 11.21 C ATOM 573 C ALA A 94 2.361 23.844 8.813 1.00 12.92 C ATOM 574 O ALA A 94 3.555 24.131 8.664 1.00 13.11 O ATOM 575 CB ALA A 94 0.765 24.562 7.011 1.00 9.39 C ATOM 576 H ALA A 94 -0.440 22.500 7.938 1.00 0.00 H ATOM 577 N LEU A 95 1.751 23.921 10.002 1.00 11.91 N ATOM 578 CA LEU A 95 2.510 24.226 11.212 1.00 9.99 C ATOM 579 C LEU A 95 3.661 23.244 11.395 1.00 10.94 C ATOM 580 O LEU A 95 4.808 23.647 11.631 1.00 12.03 O ATOM 581 CB LEU A 95 1.587 24.197 12.436 1.00 8.36 C ATOM 582 CG LEU A 95 2.280 24.326 13.796 1.00 9.34 C ATOM 583 CD1 LEU A 95 3.012 25.658 13.922 1.00 8.65 C ATOM 584 CD2 LEU A 95 1.275 24.163 14.939 1.00 9.15 C ATOM 585 H LEU A 95 0.725 23.762 10.065 1.00 0.00 H ATOM 586 N LEU A 96 3.371 21.944 11.292 1.00 11.48 N ATOM 587 CA LEU A 96 4.420 20.946 11.471 1.00 11.93 C ATOM 588 C LEU A 96 5.513 21.103 10.425 1.00 12.60 C ATOM 589 O LEU A 96 6.705 21.020 10.747 1.00 14.11 O ATOM 590 CB LEU A 96 3.827 19.535 11.431 1.00 12.37 C ATOM 591 CG LEU A 96 2.977 19.118 12.633 1.00 10.97 C ATOM 592 CD1 LEU A 96 2.612 17.638 12.523 1.00 12.64 C ATOM 593 CD2 LEU A 96 3.727 19.418 13.935 1.00 12.40 C ATOM 594 H LEU A 96 2.397 21.643 11.084 1.00 0.00 H ATOM 595 N ALA A 97 5.134 21.349 9.169 1.00 10.84 N ATOM 596 CA ALA A 97 6.146 21.498 8.124 1.00 14.36 C ATOM 597 C ALA A 97 6.994 22.750 8.343 1.00 14.95 C ATOM 598 O ALA A 97 8.201 22.737 8.078 1.00 15.09 O ATOM 599 CB ALA A 97 5.483 21.523 6.747 1.00 13.85 C ATOM 600 H ALA A 97 4.124 21.434 8.935 1.00 0.00 H ATOM 601 N GLU A 98 6.389 23.833 8.851 1.00 12.00 N ATOM 602 CA GLU A 98 7.146 25.061 9.096 1.00 16.55 C ATOM 603 C GLU A 98 8.079 24.917 10.299 1.00 17.20 C ATOM 604 O GLU A 98 9.199 25.449 10.294 1.00 15.20 O ATOM 605 CB GLU A 98 6.182 26.233 9.288 1.00 16.07 C ATOM 606 CG GLU A 98 6.839 27.621 9.324 1.00 22.11 C ATOM 607 CD GLU A 98 7.445 28.045 7.989 1.00 28.62 C ATOM 608 OE1 GLU A 98 7.078 27.471 6.943 1.00 31.76 O ATOM 609 OE2 GLU A 98 8.292 28.962 7.989 1.00 30.16 O ATOM 610 H GLU A 98 5.373 23.800 9.073 1.00 0.00 H ATOM 611 N ILE A 99 7.636 24.207 11.343 1.00 15.67 N ATOM 612 CA ILE A 99 8.518 23.911 12.469 1.00 13.16 C ATOM 613 C ILE A 99 9.702 23.076 11.999 1.00 13.73 C ATOM 614 O ILE A 99 10.852 23.317 12.377 1.00 16.05 O ATOM 615 CB ILE A 99 7.735 23.191 13.583 1.00 10.99 C ATOM 616 CG1 ILE A 99 6.786 24.155 14.277 1.00 9.21 C ATOM 617 CG2 ILE A 99 8.689 22.562 14.598 1.00 11.08 C ATOM 618 CD1 ILE A 99 5.928 23.506 15.338 1.00 8.49 C ATOM 619 H ILE A 99 6.655 23.863 11.353 1.00 0.00 H ATOM 620 N GLU A 100 9.424 22.061 11.185 1.00 13.48 N ATOM 621 CA GLU A 100 10.482 21.208 10.651 1.00 14.77 C ATOM 622 C GLU A 100 11.472 22.016 9.815 1.00 17.82 C ATOM 623 O GLU A 100 12.687 21.808 9.901 1.00 19.06 O ATOM 624 CB GLU A 100 9.841 20.091 9.834 1.00 20.36 C ATOM 625 CG GLU A 100 10.758 19.083 9.214 1.00 25.26 C ATOM 626 CD GLU A 100 9.962 17.964 8.555 1.00 32.66 C ATOM 627 OE1 GLU A 100 8.994 18.267 7.815 1.00 29.61 O ATOM 628 OE2 GLU A 100 10.293 16.782 8.791 1.00 37.04 O ATOM 629 H GLU A 100 8.435 21.872 10.924 1.00 0.00 H ATOM 630 N LYS A 102 10.966 22.972 9.033 1.00 17.56 N ATOM 631 CA LYS A 102 11.814 23.754 8.142 1.00 17.67 C ATOM 632 C LYS A 102 12.630 24.797 8.899 1.00 18.67 C ATOM 633 O LYS A 102 13.822 24.976 8.623 1.00 20.29 O ATOM 634 CB LYS A 102 10.954 24.424 7.071 1.00 18.54 C ATOM 635 CG LYS A 102 11.704 25.407 6.183 1.00 22.25 C ATOM 636 CD LYS A 102 10.748 26.128 5.248 1.00 22.14 C ATOM 637 CE LYS A 102 11.487 27.075 4.318 1.00 25.99 C ATOM 638 NZ LYS A 102 10.543 27.874 3.472 1.00 26.51 N ATOM 639 HZ1 LYS A 102 9.968 27.229 2.893 1.00 0.00 H ATOM 640 HZ2 LYS A 102 9.921 28.438 4.086 1.00 0.00 H ATOM 641 HZ3 LYS A 102 11.087 28.508 2.852 1.00 0.00 H ATOM 642 H LYS A 102 9.944 23.163 9.060 1.00 0.00 H ATOM 643 N GLN A 103 12.015 25.505 9.844 1.00 16.14 N ATOM 644 CA GLN A 103 12.692 26.646 10.455 1.00 20.28 C ATOM 645 C GLN A 103 13.443 26.287 11.728 1.00 19.51 C ATOM 646 O GLN A 103 14.477 26.896 12.019 1.00 21.72 O ATOM 647 CB GLN A 103 11.689 27.767 10.748 1.00 30.40 C ATOM 648 CG GLN A 103 12.345 29.037 11.270 1.00 43.56 C ATOM 649 CD GLN A 103 11.377 30.200 11.408 1.00 51.41 C ATOM 650 OE1 GLN A 103 11.453 30.977 12.363 1.00 56.12 O ATOM 651 NE2 GLN A 103 10.456 30.320 10.456 1.00 50.63 N ATOM 652 HE22 GLN A 103 10.430 29.641 9.669 1.00 0.00 H ATOM 653 HE21 GLN A 103 9.762 31.093 10.499 1.00 0.00 H ATOM 654 H GLN A 103 11.054 25.246 10.147 1.00 0.00 H ATOM 655 N ILE A 104 12.969 25.316 12.495 1.00 17.37 N ATOM 656 CA ILE A 104 13.582 24.952 13.763 1.00 16.73 C ATOM 657 C ILE A 104 14.306 23.612 13.667 1.00 18.87 C ATOM 658 O ILE A 104 15.459 23.489 14.084 1.00 18.55 O ATOM 659 CB ILE A 104 12.535 24.947 14.898 1.00 15.26 C ATOM 660 CG1 ILE A 104 11.910 26.340 15.026 1.00 15.68 C ATOM 661 CG2 ILE A 104 13.171 24.546 16.212 1.00 17.76 C ATOM 662 CD1 ILE A 104 10.645 26.382 15.853 1.00 14.27 C ATOM 663 H ILE A 104 12.127 24.794 12.178 1.00 0.00 H ATOM 664 N GLY A 105 13.644 22.599 13.104 1.00 17.50 N ATOM 665 CA GLY A 105 14.289 21.323 12.880 1.00 16.49 C ATOM 666 C GLY A 105 14.462 20.460 14.105 1.00 17.89 C ATOM 667 O GLY A 105 15.367 19.622 14.135 1.00 22.61 O ATOM 668 H GLY A 105 12.651 22.728 12.822 1.00 0.00 H ATOM 669 N LEU A 106 13.629 20.646 15.125 1.00 18.35 N ATOM 670 CA LEU A 106 13.574 19.757 16.266 1.00 19.57 C ATOM 671 C LEU A 106 12.208 19.078 16.307 1.00 20.25 C ATOM 672 O LEU A 106 11.214 19.653 15.851 1.00 18.26 O ATOM 673 CB LEU A 106 13.828 20.517 17.579 1.00 21.03 C ATOM 674 CG LEU A 106 15.202 21.183 17.719 1.00 20.84 C ATOM 675 CD1 LEU A 106 15.272 22.030 18.989 1.00 19.80 C ATOM 676 CD2 LEU A 106 16.307 20.135 17.709 1.00 21.13 C ATOM 677 H LEU A 106 12.989 21.466 15.102 1.00 0.00 H ATOM 678 N PRO A 107 12.124 17.853 16.821 1.00 20.48 N ATOM 679 CA PRO A 107 10.843 17.138 16.783 1.00 18.66 C ATOM 680 C PRO A 107 9.849 17.692 17.789 1.00 16.40 C ATOM 681 O PRO A 107 10.192 17.997 18.930 1.00 14.87 O ATOM 682 CB PRO A 107 11.232 15.694 17.119 1.00 18.83 C ATOM 683 CG PRO A 107 12.479 15.825 17.932 1.00 18.42 C ATOM 684 CD PRO A 107 13.206 17.024 17.384 1.00 21.35 C ATOM 685 N VAL A 109 8.602 17.822 17.349 1.00 17.54 N ATOM 686 CA VAL A 109 7.503 18.153 18.248 1.00 14.61 C ATOM 687 C VAL A 109 7.064 16.849 18.903 1.00 16.56 C ATOM 688 O VAL A 109 6.464 15.990 18.250 1.00 19.78 O ATOM 689 CB VAL A 109 6.344 18.822 17.501 1.00 13.08 C ATOM 690 CG1 VAL A 109 5.192 19.110 18.453 1.00 11.36 C ATOM 691 CG2 VAL A 109 6.821 20.087 16.812 1.00 12.67 C ATOM 692 H VAL A 109 8.405 17.684 16.337 1.00 0.00 H ATOM 693 N THR A 110 7.394 16.678 20.182 1.00 13.53 N ATOM 694 CA THR A 110 7.129 15.419 20.863 1.00 14.97 C ATOM 695 C THR A 110 5.829 15.422 21.659 1.00 14.89 C ATOM 696 O THR A 110 5.208 14.364 21.804 1.00 15.87 O ATOM 697 CB THR A 110 8.298 15.068 21.792 1.00 19.13 C ATOM 698 OG1 THR A 110 8.560 16.168 22.666 1.00 23.33 O ATOM 699 CG2 THR A 110 9.563 14.785 20.983 1.00 17.19 C ATOM 700 HG1 THR A 110 9.315 15.940 23.265 1.00 0.00 H ATOM 701 H THR A 110 7.848 17.456 20.702 1.00 0.00 H ATOM 702 N ARG A 111 5.391 16.581 22.162 1.00 12.77 N ATOM 703 CA ARG A 111 4.163 16.687 22.938 1.00 12.78 C ATOM 704 C ARG A 111 3.431 17.959 22.545 1.00 12.23 C ATOM 705 O ARG A 111 4.055 18.943 22.137 1.00 13.29 O ATOM 706 CB ARG A 111 4.445 16.685 24.458 1.00 12.22 C ATOM 707 CG ARG A 111 5.115 15.396 24.941 1.00 15.07 C ATOM 708 CD ARG A 111 5.308 15.388 26.439 1.00 16.86 C ATOM 709 NE ARG A 111 6.340 16.331 26.850 1.00 21.53 N ATOM 710 CZ ARG A 111 6.747 16.501 28.104 1.00 24.60 C ATOM 711 NH1 ARG A 111 6.198 15.801 29.090 1.00 22.86 N ATOM 712 NH2 ARG A 111 7.697 17.384 28.374 1.00 25.50 N ATOM 713 HE ARG A 111 6.789 16.910 26.112 1.00 0.00 H ATOM 714 HH12 ARG A 111 6.522 15.939 30.069 1.00 0.00 H ATOM 715 HH11 ARG A 111 5.445 15.115 28.883 1.00 0.00 H ATOM 716 HH22 ARG A 111 8.018 17.519 29.354 1.00 0.00 H ATOM 717 HH21 ARG A 111 8.122 17.942 27.606 1.00 0.00 H ATOM 718 H ARG A 111 5.950 17.442 21.992 1.00 0.00 H ATOM 719 N ALA A 112 2.102 17.928 22.656 1.00 8.24 N ATOM 720 CA ALA A 112 1.289 19.126 22.472 1.00 8.99 C ATOM 721 C ALA A 112 0.228 19.206 23.565 1.00 7.92 C ATOM 722 O ALA A 112 -0.278 18.182 24.037 1.00 9.91 O ATOM 723 CB ALA A 112 0.625 19.155 21.076 1.00 9.06 C ATOM 724 H ALA A 112 1.633 17.027 22.879 1.00 0.00 H ATOM 725 N VAL A 113 -0.096 20.438 23.974 1.00 5.70 N ATOM 726 CA VAL A 113 -1.151 20.704 24.946 1.00 7.55 C ATOM 727 C VAL A 113 -2.189 21.614 24.305 1.00 8.22 C ATOM 728 O VAL A 113 -1.835 22.661 23.748 1.00 10.41 O ATOM 729 CB VAL A 113 -0.609 21.373 26.220 1.00 8.09 C ATOM 730 CG1 VAL A 113 -1.773 21.749 27.126 1.00 9.33 C ATOM 731 CG2 VAL A 113 0.396 20.477 26.934 1.00 8.20 C ATOM 732 H VAL A 113 0.429 21.245 23.580 1.00 0.00 H ATOM 733 N SER A 114 -3.462 21.232 24.404 1.00 7.33 N ATOM 734 CA SER A 114 -4.581 22.071 23.980 1.00 6.21 C ATOM 735 C SER A 114 -5.157 22.791 25.193 1.00 6.90 C ATOM 736 O SER A 114 -5.498 22.142 26.193 1.00 7.69 O ATOM 737 CB SER A 114 -5.668 21.232 23.304 1.00 7.68 C ATOM 738 OG SER A 114 -5.204 20.676 22.082 1.00 8.71 O ATOM 739 HG SER A 114 -4.422 20.095 22.261 1.00 0.00 H ATOM 740 H SER A 114 -3.669 20.293 24.801 1.00 0.00 H ATOM 741 N THR A 115 -5.296 24.123 25.100 1.00 8.69 N ATOM 742 CA THR A 115 -5.667 24.900 26.281 1.00 8.54 C ATOM 743 C THR A 115 -7.171 25.045 26.507 1.00 6.42 C ATOM 744 O THR A 115 -7.565 25.504 27.586 1.00 8.32 O ATOM 745 CB THR A 115 -5.039 26.311 26.239 1.00 9.07 C ATOM 746 OG1 THR A 115 -5.348 26.961 24.997 1.00 8.81 O ATOM 747 CG2 THR A 115 -3.538 26.226 26.416 1.00 7.59 C ATOM 748 HG1 THR A 115 -4.987 26.425 24.247 1.00 0.00 H ATOM 749 H THR A 115 -5.140 24.601 24.190 1.00 0.00 H ATOM 750 N HIS A 116 -8.018 24.734 25.530 1.00 6.03 N ATOM 751 CA HIS A 116 -9.431 24.468 25.806 1.00 9.75 C ATOM 752 C HIS A 116 -9.997 23.691 24.619 1.00 8.88 C ATOM 753 O HIS A 116 -9.263 23.294 23.709 1.00 11.20 O ATOM 754 CB HIS A 116 -10.224 25.754 26.169 1.00 9.29 C ATOM 755 CG HIS A 116 -10.470 26.707 25.035 1.00 10.70 C ATOM 756 ND1 HIS A 116 -9.538 27.639 24.622 1.00 8.78 N ATOM 757 CD2 HIS A 116 -11.573 26.919 24.274 1.00 8.03 C ATOM 758 CE1 HIS A 116 -10.048 28.365 23.641 1.00 10.05 C ATOM 759 NE2 HIS A 116 -11.280 27.946 23.406 1.00 9.79 N ATOM 760 H HIS A 116 -7.670 24.679 24.551 1.00 0.00 H ATOM 761 N PHE A 117 -11.304 23.429 24.652 1.00 7.63 N ATOM 762 CA PHE A 117 -11.858 22.375 23.804 1.00 7.98 C ATOM 763 C PHE A 117 -12.329 22.860 22.439 1.00 9.49 C ATOM 764 O PHE A 117 -12.801 22.036 21.644 1.00 9.75 O ATOM 765 CB PHE A 117 -13.017 21.666 24.522 1.00 8.24 C ATOM 766 CG PHE A 117 -14.266 22.497 24.639 1.00 8.29 C ATOM 767 CD1 PHE A 117 -14.395 23.438 25.651 1.00 9.05 C ATOM 768 CD2 PHE A 117 -15.322 22.314 23.758 1.00 8.75 C ATOM 769 CE1 PHE A 117 -15.551 24.192 25.777 1.00 12.13 C ATOM 770 CE2 PHE A 117 -16.474 23.062 23.874 1.00 16.46 C ATOM 771 CZ PHE A 117 -16.591 24.007 24.892 1.00 16.70 C ATOM 772 H PHE A 117 -11.929 23.974 25.280 1.00 0.00 H ATOM 773 N HIS A 118 -12.179 24.147 22.134 1.00 9.19 N ATOM 774 CA HIS A 118 -12.681 24.692 20.883 1.00 10.11 C ATOM 775 C HIS A 118 -11.739 24.356 19.723 1.00 10.43 C ATOM 776 O HIS A 118 -10.594 23.940 19.908 1.00 10.16 O ATOM 777 CB HIS A 118 -12.881 26.210 20.998 1.00 11.20 C ATOM 778 CG HIS A 118 -14.058 26.603 21.838 1.00 11.11 C ATOM 779 ND1 HIS A 118 -14.193 27.858 22.398 1.00 10.08 N ATOM 780 CD2 HIS A 118 -15.153 25.903 22.221 1.00 10.44 C ATOM 781 CE1 HIS A 118 -15.325 27.919 23.077 1.00 11.90 C ATOM 782 NE2 HIS A 118 -15.930 26.746 22.981 1.00 14.49 N ATOM 783 H HIS A 118 -11.693 24.776 22.805 1.00 0.00 H ATOM 784 N ASP A 119 -12.241 24.595 18.508 1.00 11.09 N ATOM 785 CA ASP A 119 -11.543 24.225 17.275 1.00 13.39 C ATOM 786 C ASP A 119 -10.202 24.933 17.085 1.00 13.73 C ATOM 787 O ASP A 119 -9.289 24.344 16.489 1.00 12.17 O ATOM 788 CB ASP A 119 -12.432 24.528 16.075 1.00 22.27 C ATOM 789 CG ASP A 119 -13.180 23.325 15.600 1.00 29.38 C ATOM 790 OD1 ASP A 119 -12.610 22.214 15.654 1.00 32.75 O ATOM 791 OD2 ASP A 119 -14.337 23.492 15.171 1.00 33.21 O ATOM 792 H ASP A 119 -13.167 25.064 18.435 1.00 0.00 H ATOM 793 N ASP A 120 -10.066 26.205 17.522 1.00 12.78 N ATOM 794 CA ASP A 120 -8.765 26.878 17.372 1.00 16.02 C ATOM 795 C ASP A 120 -7.712 26.304 18.319 1.00 16.85 C ATOM 796 O ASP A 120 -6.537 26.702 18.249 1.00 15.85 O ATOM 797 CB ASP A 120 -8.845 28.444 17.510 1.00 12.35 C ATOM 798 CG ASP A 120 -9.489 28.967 18.849 1.00 13.24 C ATOM 799 OD1 ASP A 120 -10.163 28.137 19.497 1.00 16.00 O ATOM 800 OD2 ASP A 120 -9.368 30.218 19.224 1.00 17.94 O ATOM 801 H ASP A 120 -10.869 26.701 17.958 1.00 0.00 H ATOM 802 N ARG A 121 -8.088 25.338 19.153 1.00 12.68 N ATOM 803 CA ARG A 121 -7.172 24.711 20.092 1.00 9.80 C ATOM 804 C ARG A 121 -7.000 23.213 19.881 1.00 11.65 C ATOM 805 O ARG A 121 -5.898 22.712 20.092 1.00 9.32 O ATOM 806 CB ARG A 121 -7.641 24.988 21.525 1.00 9.61 C ATOM 807 CG ARG A 121 -7.856 26.483 21.795 1.00 9.27 C ATOM 808 CD ARG A 121 -6.627 27.296 21.416 1.00 10.17 C ATOM 809 NE ARG A 121 -6.917 28.702 21.147 1.00 12.07 N ATOM 810 CZ ARG A 121 -6.074 29.536 20.533 1.00 14.38 C ATOM 811 NH1 ARG A 121 -4.903 29.101 20.117 1.00 15.72 N ATOM 812 NH2 ARG A 121 -6.398 30.811 20.343 1.00 14.93 N ATOM 813 HE ARG A 121 -7.838 29.077 21.453 1.00 0.00 H ATOM 814 HH12 ARG A 121 -4.247 29.751 19.639 1.00 0.00 H ATOM 815 HH11 ARG A 121 -4.634 28.108 20.267 1.00 0.00 H ATOM 816 HH22 ARG A 121 -5.733 31.451 19.863 1.00 0.00 H ATOM 817 HH21 ARG A 121 -7.317 31.169 20.674 1.00 0.00 H ATOM 818 H ARG A 121 -9.077 25.018 19.132 1.00 0.00 H ATOM 819 N VAL A 122 -8.052 22.477 19.490 1.00 11.98 N ATOM 820 CA VAL A 122 -7.942 21.036 19.244 1.00 7.81 C ATOM 821 C VAL A 122 -8.073 20.675 17.782 1.00 7.05 C ATOM 822 O VAL A 122 -7.821 19.506 17.428 1.00 5.92 O ATOM 823 CB VAL A 122 -8.978 20.210 20.043 1.00 4.47 C ATOM 824 CG1 VAL A 122 -8.785 20.329 21.545 1.00 6.15 C ATOM 825 CG2 VAL A 122 -10.425 20.571 19.622 1.00 5.29 C ATOM 826 H VAL A 122 -8.972 22.943 19.358 1.00 0.00 H ATOM 827 N GLY A 123 -8.501 21.602 16.935 1.00 7.62 N ATOM 828 CA GLY A 123 -8.666 21.324 15.520 1.00 9.75 C ATOM 829 C GLY A 123 -7.328 21.121 14.854 1.00 9.01 C ATOM 830 O GLY A 123 -6.550 22.067 14.713 1.00 10.24 O ATOM 831 H GLY A 123 -8.724 22.552 17.294 1.00 0.00 H ATOM 832 N GLY A 124 -7.047 19.884 14.454 1.00 10.21 N ATOM 833 CA GLY A 124 -5.717 19.485 14.048 1.00 8.62 C ATOM 834 C GLY A 124 -5.053 18.496 14.985 1.00 10.26 C ATOM 835 O GLY A 124 -3.929 18.064 14.705 1.00 11.51 O ATOM 836 H GLY A 124 -7.811 19.178 14.432 1.00 0.00 H ATOM 837 N VAL A 125 -5.703 18.132 16.094 1.00 9.84 N ATOM 838 CA VAL A 125 -5.141 17.125 16.989 1.00 9.83 C ATOM 839 C VAL A 125 -4.912 15.814 16.242 1.00 10.83 C ATOM 840 O VAL A 125 -3.913 15.122 16.466 1.00 9.65 O ATOM 841 CB VAL A 125 -6.053 16.942 18.217 1.00 9.18 C ATOM 842 CG1 VAL A 125 -5.943 15.521 18.789 1.00 8.98 C ATOM 843 CG2 VAL A 125 -5.688 17.962 19.290 1.00 9.87 C ATOM 844 H VAL A 125 -6.618 18.570 16.322 1.00 0.00 H ATOM 845 N ASP A 126 -5.824 15.458 15.335 1.00 12.45 N ATOM 846 CA ASP A 126 -5.659 14.201 14.607 1.00 12.72 C ATOM 847 C ASP A 126 -4.432 14.233 13.700 1.00 10.66 C ATOM 848 O ASP A 126 -3.758 13.209 13.537 1.00 12.59 O ATOM 849 CB ASP A 126 -6.923 13.881 13.800 1.00 16.81 C ATOM 850 CG ASP A 126 -8.106 13.474 14.683 1.00 17.56 C ATOM 851 OD1 ASP A 126 -7.951 13.332 15.923 1.00 17.43 O ATOM 852 OD2 ASP A 126 -9.206 13.295 14.124 1.00 21.22 O ATOM 853 H ASP A 126 -6.644 16.069 15.148 1.00 0.00 H ATOM 854 N VAL A 127 -4.109 15.397 13.128 1.00 12.27 N ATOM 855 CA VAL A 127 -2.882 15.519 12.343 1.00 11.88 C ATOM 856 C VAL A 127 -1.661 15.365 13.240 1.00 12.18 C ATOM 857 O VAL A 127 -0.698 14.667 12.891 1.00 10.60 O ATOM 858 CB VAL A 127 -2.866 16.861 11.584 1.00 12.63 C ATOM 859 CG1 VAL A 127 -1.445 17.249 11.204 1.00 17.01 C ATOM 860 CG2 VAL A 127 -3.738 16.778 10.352 1.00 12.77 C ATOM 861 H VAL A 127 -4.734 16.220 13.242 1.00 0.00 H ATOM 862 N LEU A 128 -1.681 16.015 14.407 1.00 10.33 N ATOM 863 CA LEU A 128 -0.595 15.871 15.365 1.00 8.96 C ATOM 864 C LEU A 128 -0.382 14.410 15.739 1.00 11.08 C ATOM 865 O LEU A 128 0.751 13.917 15.749 1.00 11.73 O ATOM 866 CB LEU A 128 -0.890 16.697 16.617 1.00 8.87 C ATOM 867 CG LEU A 128 -0.926 18.218 16.434 1.00 6.97 C ATOM 868 CD1 LEU A 128 -1.192 18.900 17.763 1.00 6.09 C ATOM 869 CD2 LEU A 128 0.387 18.724 15.834 1.00 9.10 C ATOM 870 H LEU A 128 -2.485 16.634 14.634 1.00 0.00 H ATOM 871 N ARG A 129 -1.469 13.703 16.048 1.00 9.96 N ATOM 872 CA ARG A 129 -1.357 12.312 16.476 1.00 9.17 C ATOM 873 C ARG A 129 -0.814 11.423 15.361 1.00 10.01 C ATOM 874 O ARG A 129 0.020 10.548 15.611 1.00 13.97 O ATOM 875 CB ARG A 129 -2.717 11.800 16.947 1.00 12.33 C ATOM 876 CG ARG A 129 -2.714 10.311 17.319 1.00 11.66 C ATOM 877 CD ARG A 129 -4.114 9.818 17.647 1.00 18.44 C ATOM 878 NE ARG A 129 -4.698 10.560 18.755 1.00 22.19 N ATOM 879 CZ ARG A 129 -5.759 11.354 18.659 1.00 19.17 C ATOM 880 NH1 ARG A 129 -6.378 11.515 17.497 1.00 19.62 N ATOM 881 NH2 ARG A 129 -6.205 11.979 19.736 1.00 18.13 N ATOM 882 HE ARG A 129 -4.252 10.461 19.690 1.00 0.00 H ATOM 883 HH12 ARG A 129 -7.208 12.139 17.432 1.00 0.00 H ATOM 884 HH11 ARG A 129 -6.034 11.018 16.651 1.00 0.00 H ATOM 885 HH22 ARG A 129 -7.035 12.602 19.669 1.00 0.00 H ATOM 886 HH21 ARG A 129 -5.726 11.847 20.650 1.00 0.00 H ATOM 887 H ARG A 129 -2.407 14.147 15.983 1.00 0.00 H ATOM 888 N ALA A 130 -1.278 11.633 14.127 1.00 9.90 N ATOM 889 CA ALA A 130 -0.761 10.858 13.008 1.00 13.19 C ATOM 890 C ALA A 130 0.726 11.109 12.789 1.00 15.02 C ATOM 891 O ALA A 130 1.435 10.223 12.306 1.00 19.90 O ATOM 892 CB ALA A 130 -1.554 11.173 11.741 1.00 15.07 C ATOM 893 H ALA A 130 -2.011 12.352 13.964 1.00 0.00 H ATOM 894 N ALA A 131 1.224 12.291 13.158 1.00 12.90 N ATOM 895 CA ALA A 131 2.639 12.608 13.017 1.00 14.18 C ATOM 896 C ALA A 131 3.499 12.075 14.159 1.00 16.66 C ATOM 897 O ALA A 131 4.716 12.295 14.150 1.00 16.31 O ATOM 898 CB ALA A 131 2.824 14.124 12.904 1.00 15.73 C ATOM 899 H ALA A 131 0.584 13.006 13.558 1.00 0.00 H ATOM 900 N GLY A 133 2.909 11.392 15.136 1.00 16.53 N ATOM 901 CA GLY A 133 3.653 10.892 16.274 1.00 12.65 C ATOM 902 C GLY A 133 3.754 11.842 17.444 1.00 12.23 C ATOM 903 O GLY A 133 4.559 11.596 18.351 1.00 11.64 O ATOM 904 H GLY A 133 1.886 11.212 15.081 1.00 0.00 H ATOM 905 N VAL A 134 2.979 12.924 17.452 1.00 12.42 N ATOM 906 CA VAL A 134 2.975 13.856 18.578 1.00 11.42 C ATOM 907 C VAL A 134 2.022 13.334 19.643 1.00 9.34 C ATOM 908 O VAL A 134 0.865 13.011 19.350 1.00 13.31 O ATOM 909 CB VAL A 134 2.553 15.262 18.129 1.00 12.75 C ATOM 910 CG1 VAL A 134 2.607 16.237 19.310 1.00 15.53 C ATOM 911 CG2 VAL A 134 3.396 15.752 16.954 1.00 11.76 C ATOM 912 H VAL A 134 2.361 13.111 16.637 1.00 0.00 H ATOM 913 N ALA A 135 2.493 13.265 20.881 1.00 7.81 N ATOM 914 CA ALA A 135 1.612 12.930 21.992 1.00 9.10 C ATOM 915 C ALA A 135 0.786 14.161 22.346 1.00 10.73 C ATOM 916 O ALA A 135 1.343 15.208 22.689 1.00 13.79 O ATOM 917 CB ALA A 135 2.423 12.454 23.198 1.00 13.16 C ATOM 918 H ALA A 135 3.500 13.452 21.060 1.00 0.00 H ATOM 919 N THR A 136 -0.535 14.041 22.262 1.00 9.57 N ATOM 920 CA THR A 136 -1.430 15.163 22.517 1.00 6.35 C ATOM 921 C THR A 136 -2.015 15.069 23.922 1.00 8.28 C ATOM 922 O THR A 136 -2.309 13.976 24.419 1.00 10.88 O ATOM 923 CB THR A 136 -2.544 15.205 21.474 1.00 6.68 C ATOM 924 OG1 THR A 136 -3.184 13.925 21.406 1.00 8.86 O ATOM 925 CG2 THR A 136 -1.960 15.545 20.100 1.00 8.73 C ATOM 926 HG1 THR A 136 -2.519 13.238 21.151 1.00 0.00 H ATOM 927 H THR A 136 -0.942 13.119 22.007 1.00 0.00 H ATOM 928 N TYR A 137 -2.184 16.233 24.554 1.00 9.76 N ATOM 929 CA TYR A 137 -2.557 16.345 25.957 1.00 8.18 C ATOM 930 C TYR A 137 -3.630 17.408 26.124 1.00 7.92 C ATOM 931 O TYR A 137 -3.625 18.424 25.429 1.00 8.13 O ATOM 932 CB TYR A 137 -1.368 16.744 26.832 1.00 9.22 C ATOM 933 CG TYR A 137 -0.342 15.658 27.040 1.00 13.59 C ATOM 934 CD1 TYR A 137 0.567 15.329 26.042 1.00 17.84 C ATOM 935 CD2 TYR A 137 -0.271 14.972 28.244 1.00 12.98 C ATOM 936 CE1 TYR A 137 1.519 14.338 26.236 1.00 17.97 C ATOM 937 CE2 TYR A 137 0.666 13.978 28.445 1.00 15.41 C ATOM 938 CZ TYR A 137 1.559 13.663 27.442 1.00 20.09 C ATOM 939 OH TYR A 137 2.496 12.675 27.655 1.00 25.12 O ATOM 940 HH TYR A 137 3.068 12.925 28.423 1.00 0.00 H ATOM 941 H TYR A 137 -2.041 17.110 24.013 1.00 0.00 H ATOM 942 N ALA A 138 -4.531 17.173 27.076 1.00 6.90 N ATOM 943 CA ALA A 138 -5.405 18.221 27.590 1.00 6.13 C ATOM 944 C ALA A 138 -5.913 17.770 28.950 1.00 7.95 C ATOM 945 O ALA A 138 -5.748 16.613 29.346 1.00 12.24 O ATOM 946 CB ALA A 138 -6.576 18.526 26.646 1.00 7.66 C ATOM 947 H ALA A 138 -4.614 16.212 27.465 1.00 0.00 H ATOM 948 N SER A 139 -6.544 18.698 29.664 1.00 9.70 N ATOM 949 CA SER A 139 -7.153 18.337 30.929 1.00 11.03 C ATOM 950 C SER A 139 -8.308 17.362 30.701 1.00 13.03 C ATOM 951 O SER A 139 -8.874 17.304 29.608 1.00 11.24 O ATOM 952 CB SER A 139 -7.671 19.580 31.643 1.00 8.97 C ATOM 953 OG SER A 139 -8.872 20.039 31.037 1.00 10.77 O ATOM 954 HG SER A 139 -9.193 20.845 31.513 1.00 0.00 H ATOM 955 H SER A 139 -6.600 19.677 29.317 1.00 0.00 H ATOM 956 N PRO A 140 -8.671 16.575 31.722 1.00 10.77 N ATOM 957 CA PRO A 140 -9.883 15.742 31.601 1.00 12.85 C ATOM 958 C PRO A 140 -11.125 16.551 31.295 1.00 12.85 C ATOM 959 O PRO A 140 -12.033 16.059 30.609 1.00 14.90 O ATOM 960 CB PRO A 140 -9.995 15.072 32.979 1.00 15.41 C ATOM 961 CG PRO A 140 -8.630 15.126 33.546 1.00 15.00 C ATOM 962 CD PRO A 140 -7.956 16.348 32.987 1.00 11.41 C ATOM 963 N SER A 141 -11.195 17.781 31.808 1.00 12.71 N ATOM 964 CA SER A 141 -12.334 18.650 31.536 1.00 12.95 C ATOM 965 C SER A 141 -12.402 19.010 30.056 1.00 11.20 C ATOM 966 O SER A 141 -13.463 18.910 29.426 1.00 12.30 O ATOM 967 CB SER A 141 -12.230 19.904 32.409 1.00 14.65 C ATOM 968 OG SER A 141 -13.300 20.796 32.179 1.00 18.76 O ATOM 969 HG SER A 141 -14.156 20.343 32.386 1.00 0.00 H ATOM 970 H SER A 141 -10.423 18.126 32.413 1.00 0.00 H ATOM 971 N THR A 142 -11.270 19.419 29.484 1.00 11.18 N ATOM 972 CA THR A 142 -11.209 19.724 28.061 1.00 9.58 C ATOM 973 C THR A 142 -11.561 18.510 27.209 1.00 10.42 C ATOM 974 O THR A 142 -12.300 18.634 26.223 1.00 9.37 O ATOM 975 CB THR A 142 -9.811 20.234 27.716 1.00 8.30 C ATOM 976 OG1 THR A 142 -9.606 21.494 28.362 1.00 8.40 O ATOM 977 CG2 THR A 142 -9.630 20.394 26.213 1.00 8.95 C ATOM 978 HG1 THR A 142 -10.286 22.140 28.046 1.00 0.00 H ATOM 979 H THR A 142 -10.414 19.522 30.065 1.00 0.00 H ATOM 980 N ARG A 143 -11.037 17.330 27.567 1.00 10.32 N ATOM 981 CA ARG A 143 -11.290 16.135 26.763 1.00 11.21 C ATOM 982 C ARG A 143 -12.769 15.781 26.749 1.00 12.12 C ATOM 983 O ARG A 143 -13.312 15.387 25.707 1.00 10.97 O ATOM 984 CB ARG A 143 -10.471 14.954 27.285 1.00 13.84 C ATOM 985 CG ARG A 143 -8.968 15.093 27.027 1.00 15.40 C ATOM 986 CD ARG A 143 -8.198 13.918 27.568 1.00 11.70 C ATOM 987 NE ARG A 143 -8.342 12.747 26.704 1.00 11.61 N ATOM 988 CZ ARG A 143 -9.136 11.718 26.979 1.00 17.88 C ATOM 989 NH1 ARG A 143 -9.850 11.722 28.099 1.00 15.65 N ATOM 990 NH2 ARG A 143 -9.208 10.680 26.145 1.00 19.60 N ATOM 991 HE ARG A 143 -7.791 12.718 25.823 1.00 0.00 H ATOM 992 HH12 ARG A 143 -10.474 10.920 28.321 1.00 0.00 H ATOM 993 HH11 ARG A 143 -9.785 12.527 28.754 1.00 0.00 H ATOM 994 HH22 ARG A 143 -9.832 9.878 26.366 1.00 0.00 H ATOM 995 HH21 ARG A 143 -8.641 10.673 25.273 1.00 0.00 H ATOM 996 H ARG A 143 -10.447 17.264 28.421 1.00 0.00 H ATOM 997 N ARG A 144 -13.437 15.908 27.897 1.00 8.61 N ATOM 998 CA ARG A 144 -14.860 15.598 27.954 1.00 11.83 C ATOM 999 C ARG A 144 -15.674 16.621 27.169 1.00 12.28 C ATOM 1000 O ARG A 144 -16.595 16.254 26.430 1.00 12.58 O ATOM 1001 CB ARG A 144 -15.325 15.522 29.413 1.00 16.72 C ATOM 1002 CG ARG A 144 -16.822 15.760 29.589 1.00 19.84 C ATOM 1003 CD ARG A 144 -17.329 15.380 30.986 1.00 26.34 C ATOM 1004 NE ARG A 144 -16.336 15.631 32.019 1.00 31.29 N ATOM 1005 CZ ARG A 144 -15.859 14.699 32.835 1.00 38.08 C ATOM 1006 NH1 ARG A 144 -16.284 13.448 32.738 1.00 38.80 N ATOM 1007 NH2 ARG A 144 -14.954 15.019 33.751 1.00 39.12 N ATOM 1008 HE ARG A 144 -15.977 16.601 32.125 1.00 0.00 H ATOM 1009 HH12 ARG A 144 -15.908 12.720 33.379 1.00 0.00 H ATOM 1010 HH11 ARG A 144 -16.993 13.194 32.021 1.00 0.00 H ATOM 1011 HH22 ARG A 144 -14.580 14.289 34.390 1.00 0.00 H ATOM 1012 HH21 ARG A 144 -14.618 16.000 33.830 1.00 0.00 H ATOM 1013 H ARG A 144 -12.941 16.229 28.753 1.00 0.00 H ATOM 1014 N LEU A 145 -15.339 17.909 27.301 1.00 9.53 N ATOM 1015 CA LEU A 145 -16.068 18.935 26.558 1.00 10.54 C ATOM 1016 C LEU A 145 -15.858 18.783 25.058 1.00 12.20 C ATOM 1017 O LEU A 145 -16.797 18.972 24.275 1.00 11.71 O ATOM 1018 CB LEU A 145 -15.644 20.330 27.021 1.00 9.48 C ATOM 1019 CG LEU A 145 -16.251 20.723 28.368 1.00 11.43 C ATOM 1020 CD1 LEU A 145 -15.510 21.927 28.977 1.00 13.08 C ATOM 1021 CD2 LEU A 145 -17.739 21.028 28.224 1.00 12.33 C ATOM 1022 H LEU A 145 -14.559 18.181 27.933 1.00 0.00 H ATOM 1023 N ALA A 146 -14.634 18.444 24.640 1.00 13.29 N ATOM 1024 CA ALA A 146 -14.373 18.234 23.220 1.00 11.44 C ATOM 1025 C ALA A 146 -15.200 17.075 22.690 1.00 13.30 C ATOM 1026 O ALA A 146 -15.767 17.157 21.593 1.00 14.18 O ATOM 1027 CB ALA A 146 -12.881 17.982 22.975 1.00 9.08 C ATOM 1028 H ALA A 146 -13.865 18.329 25.330 1.00 0.00 H ATOM 1029 N GLU A 147 -15.300 15.996 23.473 1.00 13.77 N ATOM 1030 CA GLU A 147 -16.064 14.835 23.031 1.00 14.92 C ATOM 1031 C GLU A 147 -17.549 15.164 22.916 1.00 13.41 C ATOM 1032 O GLU A 147 -18.201 14.763 21.948 1.00 14.91 O ATOM 1033 CB GLU A 147 -15.841 13.660 23.982 1.00 17.94 C ATOM 1034 CG GLU A 147 -16.670 12.443 23.602 1.00 22.08 C ATOM 1035 CD GLU A 147 -16.506 11.285 24.552 1.00 34.46 C ATOM 1036 OE1 GLU A 147 -15.536 11.277 25.337 1.00 38.89 O ATOM 1037 OE2 GLU A 147 -17.352 10.375 24.508 1.00 41.23 O ATOM 1038 H GLU A 147 -14.831 15.984 24.401 1.00 0.00 H ATOM 1039 N VAL A 148 -18.099 15.910 23.880 1.00 14.27 N ATOM 1040 CA VAL A 148 -19.511 16.283 23.812 1.00 17.26 C ATOM 1041 C VAL A 148 -19.773 17.147 22.585 1.00 16.61 C ATOM 1042 O VAL A 148 -20.824 17.041 21.939 1.00 17.91 O ATOM 1043 CB VAL A 148 -19.935 17.000 25.109 1.00 19.47 C ATOM 1044 CG1 VAL A 148 -21.307 17.659 24.949 1.00 20.00 C ATOM 1045 CG2 VAL A 148 -19.933 16.029 26.263 1.00 18.64 C ATOM 1046 H VAL A 148 -17.519 16.227 24.683 1.00 0.00 H ATOM 1047 N GLU A 149 -18.817 18.005 22.240 1.00 14.31 N ATOM 1048 CA GLU A 149 -18.926 18.903 21.099 1.00 11.69 C ATOM 1049 C GLU A 149 -18.663 18.220 19.768 1.00 11.29 C ATOM 1050 O GLU A 149 -18.866 18.854 18.724 1.00 12.54 O ATOM 1051 CB GLU A 149 -17.940 20.065 21.257 1.00 14.32 C ATOM 1052 CG GLU A 149 -18.367 21.349 20.575 1.00 20.02 C ATOM 1053 CD GLU A 149 -19.595 21.963 21.212 1.00 24.79 C ATOM 1054 OE1 GLU A 149 -19.851 21.692 22.404 1.00 23.74 O ATOM 1055 OE2 GLU A 149 -20.301 22.717 20.516 1.00 29.71 O ATOM 1056 H GLU A 149 -17.950 18.036 22.813 1.00 0.00 H ATOM 1057 N GLY A 150 -18.211 16.965 19.777 1.00 9.44 N ATOM 1058 CA GLY A 150 -17.827 16.293 18.548 1.00 11.35 C ATOM 1059 C GLY A 150 -16.528 16.773 17.938 1.00 10.27 C ATOM 1060 O GLY A 150 -16.298 16.564 16.741 1.00 10.81 O ATOM 1061 H GLY A 150 -18.132 16.458 20.682 1.00 0.00 H ATOM 1062 N ASN A 165 -15.675 17.426 18.720 1.00 15.60 N ATOM 1063 CA ASN A 165 -14.384 17.917 18.257 1.00 14.87 C ATOM 1064 C ASN A 165 -13.311 16.839 18.431 1.00 12.15 C ATOM 1065 O ASN A 165 -13.542 15.776 19.013 1.00 13.50 O ATOM 1066 CB ASN A 165 -13.993 19.190 19.020 1.00 12.70 C ATOM 1067 CG ASN A 165 -14.936 20.360 18.748 1.00 9.73 C ATOM 1068 OD1 ASN A 165 -15.718 20.338 17.799 1.00 11.21 O ATOM 1069 ND2 ASN A 165 -14.863 21.394 19.588 1.00 9.60 N ATOM 1070 HD22 ASN A 165 -14.188 21.375 20.379 1.00 0.00 H ATOM 1071 HD21 ASN A 165 -15.481 22.219 19.452 1.00 0.00 H ATOM 1072 H ASN A 165 -15.942 17.595 19.711 1.00 0.00 H ATOM 1073 N GLU A 166 -12.121 17.120 17.912 1.00 12.75 N ATOM 1074 CA GLU A 166 -11.012 16.197 18.097 1.00 12.20 C ATOM 1075 C GLU A 166 -10.605 16.161 19.566 1.00 12.95 C ATOM 1076 O GLU A 166 -10.701 17.164 20.287 1.00 12.68 O ATOM 1077 CB GLU A 166 -9.830 16.593 17.212 1.00 9.80 C ATOM 1078 CG GLU A 166 -10.138 16.422 15.723 1.00 11.41 C ATOM 1079 CD GLU A 166 -9.296 17.319 14.829 1.00 13.54 C ATOM 1080 OE1 GLU A 166 -8.099 17.033 14.655 1.00 15.43 O ATOM 1081 OE2 GLU A 166 -9.836 18.313 14.289 1.00 18.26 O ATOM 1082 H GLU A 166 -11.982 17.999 17.374 1.00 0.00 H ATOM 1083 N ILE A 167 -10.180 14.983 20.017 1.00 11.26 N ATOM 1084 CA ILE A 167 -9.922 14.746 21.439 1.00 9.73 C ATOM 1085 C ILE A 167 -8.446 14.439 21.665 1.00 10.30 C ATOM 1086 O ILE A 167 -7.960 13.380 21.238 1.00 11.63 O ATOM 1087 CB ILE A 167 -10.796 13.599 21.975 1.00 12.03 C ATOM 1088 CG1 ILE A 167 -12.276 13.871 21.701 1.00 9.07 C ATOM 1089 CG2 ILE A 167 -10.536 13.352 23.476 1.00 10.37 C ATOM 1090 CD1 ILE A 167 -13.117 12.587 21.707 1.00 13.47 C ATOM 1091 H ILE A 167 -10.027 14.209 19.340 1.00 0.00 H ATOM 1092 N PRO A 168 -7.701 15.325 22.320 1.00 7.57 N ATOM 1093 CA PRO A 168 -6.340 14.982 22.738 1.00 7.34 C ATOM 1094 C PRO A 168 -6.332 13.671 23.507 1.00 6.84 C ATOM 1095 O PRO A 168 -7.257 13.373 24.260 1.00 9.58 O ATOM 1096 CB PRO A 168 -5.940 16.160 23.629 1.00 8.86 C ATOM 1097 CG PRO A 168 -6.741 17.321 23.079 1.00 6.13 C ATOM 1098 CD PRO A 168 -8.063 16.714 22.675 1.00 8.57 C ATOM 1099 N THR A 169 -5.274 12.887 23.296 1.00 10.17 N ATOM 1100 CA THR A 169 -5.222 11.510 23.785 1.00 9.51 C ATOM 1101 C THR A 169 -4.973 11.447 25.288 1.00 10.38 C ATOM 1102 O THR A 169 -5.647 10.703 26.018 1.00 10.44 O ATOM 1103 CB THR A 169 -4.128 10.752 23.024 1.00 8.23 C ATOM 1104 OG1 THR A 169 -4.514 10.613 21.651 1.00 10.61 O ATOM 1105 CG2 THR A 169 -3.875 9.370 23.632 1.00 12.06 C ATOM 1106 HG1 THR A 169 -3.808 10.124 21.159 1.00 0.00 H ATOM 1107 H THR A 169 -4.462 13.266 22.768 1.00 0.00 H ATOM 1108 N HIS A 170 -3.998 12.201 25.761 1.00 9.61 N ATOM 1109 CA HIS A 170 -3.536 12.076 27.126 1.00 10.15 C ATOM 1110 C HIS A 170 -4.241 13.090 28.006 1.00 10.44 C ATOM 1111 O HIS A 170 -4.553 14.194 27.561 1.00 11.63 O ATOM 1112 CB HIS A 170 -2.030 12.290 27.201 1.00 10.23 C ATOM 1113 CG HIS A 170 -1.228 11.158 26.636 1.00 11.16 C ATOM 1114 ND1 HIS A 170 -0.939 10.023 27.357 1.00 10.80 N ATOM 1115 CD2 HIS A 170 -0.637 10.999 25.428 1.00 12.47 C ATOM 1116 CE1 HIS A 170 -0.201 9.213 26.618 1.00 11.24 C ATOM 1117 NE2 HIS A 170 -0.002 9.784 25.443 1.00 11.10 N ATOM 1118 H HIS A 170 -3.551 12.902 25.137 1.00 0.00 H ATOM 1119 N SER A 171 -4.474 12.700 29.264 1.00 10.71 N ATOM 1120 CA SER A 171 -5.141 13.524 30.268 1.00 11.85 C ATOM 1121 C SER A 171 -4.116 14.146 31.207 1.00 12.48 C ATOM 1122 O SER A 171 -3.264 13.442 31.757 1.00 16.65 O ATOM 1123 CB SER A 171 -6.126 12.687 31.088 1.00 13.14 C ATOM 1124 OG SER A 171 -7.146 12.155 30.266 1.00 19.62 O ATOM 1125 HG SER A 171 -6.741 11.578 29.571 1.00 0.00 H ATOM 1126 H SER A 171 -4.160 11.749 29.545 1.00 0.00 H ATOM 1127 N LEU A 172 -4.223 15.457 31.416 1.00 12.21 N ATOM 1128 CA LEU A 172 -3.348 16.178 32.331 1.00 13.11 C ATOM 1129 C LEU A 172 -3.982 16.217 33.718 1.00 17.17 C ATOM 1130 O LEU A 172 -5.026 16.857 33.906 1.00 17.53 O ATOM 1131 CB LEU A 172 -3.114 17.605 31.837 1.00 12.17 C ATOM 1132 CG LEU A 172 -2.392 17.746 30.499 1.00 11.95 C ATOM 1133 CD1 LEU A 172 -2.610 19.147 29.951 1.00 12.69 C ATOM 1134 CD2 LEU A 172 -0.914 17.458 30.696 1.00 13.48 C ATOM 1135 H LEU A 172 -4.959 15.986 30.907 1.00 0.00 H ATOM 1136 N GLU A 173 -3.343 15.576 34.688 1.00 17.09 N ATOM 1137 CA GLU A 173 -3.836 15.621 36.059 1.00 20.45 C ATOM 1138 C GLU A 173 -3.319 16.860 36.789 1.00 15.87 C ATOM 1139 O GLU A 173 -2.373 17.520 36.358 1.00 14.22 O ATOM 1140 CB GLU A 173 -3.420 14.364 36.830 1.00 27.28 C ATOM 1141 CG GLU A 173 -3.673 13.056 36.092 1.00 34.64 C ATOM 1142 CD GLU A 173 -5.152 12.776 35.878 1.00 40.95 C ATOM 1143 OE1 GLU A 173 -5.491 12.069 34.904 1.00 44.25 O ATOM 1144 OE2 GLU A 173 -5.976 13.262 36.683 1.00 43.72 O ATOM 1145 H GLU A 173 -2.482 15.036 34.468 1.00 0.00 H ATOM 1146 N GLY A 174 -3.953 17.162 37.919 1.00 14.38 N ATOM 1147 CA GLY A 174 -3.512 18.243 38.783 1.00 12.04 C ATOM 1148 C GLY A 174 -4.045 19.614 38.443 1.00 10.90 C ATOM 1149 O GLY A 174 -3.567 20.604 39.012 1.00 12.53 O ATOM 1150 H GLY A 174 -4.789 16.607 38.192 1.00 0.00 H ATOM 1151 N LEU A 175 -5.025 19.716 37.546 1.00 11.03 N ATOM 1152 CA LEU A 175 -5.501 21.016 37.080 1.00 11.84 C ATOM 1153 C LEU A 175 -7.002 21.195 37.292 1.00 15.91 C ATOM 1154 O LEU A 175 -7.621 22.035 36.632 1.00 15.20 O ATOM 1155 CB LEU A 175 -5.146 21.212 35.602 1.00 10.49 C ATOM 1156 CG LEU A 175 -3.652 21.320 35.295 1.00 10.98 C ATOM 1157 CD1 LEU A 175 -3.400 21.142 33.799 1.00 10.44 C ATOM 1158 CD2 LEU A 175 -3.089 22.662 35.810 1.00 8.44 C ATOM 1159 H LEU A 175 -5.461 18.850 37.169 1.00 0.00 H ATOM 1160 N SER A 176 -7.602 20.438 38.215 1.00 17.15 N ATOM 1161 CA SER A 176 -9.059 20.396 38.303 1.00 20.05 C ATOM 1162 C SER A 176 -9.672 21.562 39.074 1.00 19.86 C ATOM 1163 O SER A 176 -10.878 21.796 38.937 1.00 21.55 O ATOM 1164 CB SER A 176 -9.505 19.085 38.945 1.00 24.84 C ATOM 1165 OG SER A 176 -9.015 18.989 40.270 1.00 26.12 O ATOM 1166 HG SER A 176 -9.314 18.134 40.670 1.00 0.00 H ATOM 1167 H SER A 176 -7.028 19.875 38.875 1.00 0.00 H ATOM 1168 N SER A 177 -8.890 22.290 39.875 1.00 16.83 N ATOM 1169 CA SER A 177 -9.402 23.359 40.729 1.00 14.79 C ATOM 1170 C SER A 177 -8.731 24.683 40.389 1.00 13.60 C ATOM 1171 O SER A 177 -7.526 24.724 40.125 1.00 14.82 O ATOM 1172 CB SER A 177 -9.164 23.051 42.215 1.00 19.75 C ATOM 1173 OG SER A 177 -9.840 21.876 42.615 1.00 20.66 O ATOM 1174 HG SER A 177 -9.666 21.707 43.575 1.00 0.00 H ATOM 1175 H SER A 177 -7.870 22.087 39.892 1.00 0.00 H ATOM 1176 N SER A 178 -9.513 25.766 40.430 1.00 12.47 N ATOM 1177 CA SER A 178 -8.982 27.110 40.211 1.00 11.03 C ATOM 1178 C SER A 178 -7.732 27.349 41.048 1.00 14.92 C ATOM 1179 O SER A 178 -7.704 27.055 42.247 1.00 18.10 O ATOM 1180 CB SER A 178 -10.043 28.157 40.557 1.00 15.29 C ATOM 1181 OG SER A 178 -11.214 27.956 39.789 1.00 22.95 O ATOM 1182 HG SER A 178 -11.580 27.055 39.977 1.00 0.00 H ATOM 1183 H SER A 178 -10.528 25.649 40.623 1.00 0.00 H ATOM 1184 N GLY A 179 -6.696 27.885 40.411 1.00 12.75 N ATOM 1185 CA GLY A 179 -5.428 28.092 41.073 1.00 14.13 C ATOM 1186 C GLY A 179 -4.469 26.923 41.005 1.00 16.68 C ATOM 1187 O GLY A 179 -3.329 27.054 41.474 1.00 19.12 O ATOM 1188 H GLY A 179 -6.800 28.162 39.414 1.00 0.00 H ATOM 1189 N ASP A 180 -4.891 25.786 40.452 1.00 12.24 N ATOM 1190 CA ASP A 180 -3.988 24.651 40.298 1.00 15.96 C ATOM 1191 C ASP A 180 -2.928 24.940 39.243 1.00 16.37 C ATOM 1192 O ASP A 180 -3.217 25.507 38.185 1.00 15.08 O ATOM 1193 CB ASP A 180 -4.762 23.390 39.906 1.00 14.45 C ATOM 1194 CG ASP A 180 -5.464 22.745 41.083 1.00 19.92 C ATOM 1195 OD1 ASP A 180 -5.263 23.216 42.231 1.00 20.10 O ATOM 1196 OD2 ASP A 180 -6.217 21.768 40.855 1.00 19.02 O ATOM 1197 H ASP A 180 -5.876 25.707 40.127 1.00 0.00 H ATOM 1198 N ALA A 181 -1.700 24.519 39.530 1.00 16.26 N ATOM 1199 CA ALA A 181 -0.579 24.632 38.610 1.00 18.66 C ATOM 1200 C ALA A 181 0.202 23.324 38.610 1.00 18.03 C ATOM 1201 O ALA A 181 0.376 22.706 39.663 1.00 16.83 O ATOM 1202 CB ALA A 181 0.349 25.788 39.005 1.00 20.82 C ATOM 1203 H ALA A 181 -1.532 24.086 40.461 1.00 0.00 H ATOM 1204 N VAL A 182 0.655 22.892 37.430 1.00 15.33 N ATOM 1205 CA VAL A 182 1.539 21.735 37.321 1.00 13.43 C ATOM 1206 C VAL A 182 2.657 22.060 36.340 1.00 15.28 C ATOM 1207 O VAL A 182 2.448 22.759 35.345 1.00 12.65 O ATOM 1208 CB VAL A 182 0.790 20.455 36.883 1.00 19.74 C ATOM 1209 CG1 VAL A 182 -0.288 20.076 37.894 1.00 20.43 C ATOM 1210 CG2 VAL A 182 0.198 20.618 35.484 1.00 19.10 C ATOM 1211 H VAL A 182 0.370 23.394 36.565 1.00 0.00 H ATOM 1212 N ARG A 183 3.853 21.554 36.623 1.00 14.05 N ATOM 1213 CA ARG A 183 4.936 21.644 35.660 1.00 16.88 C ATOM 1214 C ARG A 183 4.718 20.626 34.547 1.00 13.18 C ATOM 1215 O ARG A 183 4.268 19.503 34.793 1.00 14.96 O ATOM 1216 CB ARG A 183 6.280 21.408 36.355 1.00 19.77 C ATOM 1217 CG ARG A 183 7.498 21.618 35.462 1.00 23.75 C ATOM 1218 CD ARG A 183 7.912 23.092 35.372 1.00 26.67 C ATOM 1219 NE ARG A 183 8.940 23.274 34.348 1.00 25.15 N ATOM 1220 CZ ARG A 183 9.905 24.187 34.391 1.00 22.69 C ATOM 1221 NH1 ARG A 183 9.989 25.032 35.412 1.00 22.22 N ATOM 1222 NH2 ARG A 183 10.798 24.245 33.415 1.00 23.39 N ATOM 1223 HE ARG A 183 8.914 22.641 33.523 1.00 0.00 H ATOM 1224 HH12 ARG A 183 10.747 25.743 35.437 1.00 0.00 H ATOM 1225 HH11 ARG A 183 9.296 24.983 36.186 1.00 0.00 H ATOM 1226 HH22 ARG A 183 11.555 24.958 33.444 1.00 0.00 H ATOM 1227 HH21 ARG A 183 10.743 23.578 32.619 1.00 0.00 H ATOM 1228 H ARG A 183 4.014 21.091 37.540 1.00 0.00 H ATOM 1229 N PHE A 184 5.015 21.029 33.311 1.00 14.34 N ATOM 1230 CA PHE A 184 4.896 20.133 32.160 1.00 12.38 C ATOM 1231 C PHE A 184 6.043 20.453 31.214 1.00 14.38 C ATOM 1232 O PHE A 184 5.938 21.379 30.406 1.00 16.15 O ATOM 1233 CB PHE A 184 3.551 20.274 31.460 1.00 10.74 C ATOM 1234 CG PHE A 184 3.256 19.149 30.509 1.00 10.64 C ATOM 1235 CD1 PHE A 184 2.834 17.920 30.984 1.00 10.80 C ATOM 1236 CD2 PHE A 184 3.420 19.317 29.149 1.00 11.58 C ATOM 1237 CE1 PHE A 184 2.572 16.869 30.108 1.00 9.69 C ATOM 1238 CE2 PHE A 184 3.166 18.284 28.267 1.00 12.71 C ATOM 1239 CZ PHE A 184 2.736 17.060 28.739 1.00 10.66 C ATOM 1240 H PHE A 184 5.340 22.006 33.161 1.00 0.00 H ATOM 1241 N GLY A 185 7.124 19.678 31.312 1.00 18.40 N ATOM 1242 CA GLY A 185 8.326 19.950 30.567 1.00 18.03 C ATOM 1243 C GLY A 185 8.843 21.337 30.889 1.00 17.29 C ATOM 1244 O GLY A 185 9.017 21.704 32.052 1.00 17.49 O ATOM 1245 H GLY A 185 7.098 18.853 31.945 1.00 0.00 H ATOM 1246 N PRO A 186 9.068 22.147 29.852 1.00 17.22 N ATOM 1247 CA PRO A 186 9.652 23.480 30.047 1.00 15.77 C ATOM 1248 C PRO A 186 8.659 24.558 30.459 1.00 16.81 C ATOM 1249 O PRO A 186 9.055 25.727 30.562 1.00 14.94 O ATOM 1250 CB PRO A 186 10.239 23.792 28.666 1.00 17.51 C ATOM 1251 CG PRO A 186 9.298 23.081 27.709 1.00 17.37 C ATOM 1252 CD PRO A 186 8.856 21.818 28.427 1.00 15.88 C ATOM 1253 N VAL A 187 7.388 24.225 30.693 1.00 12.32 N ATOM 1254 CA VAL A 187 6.380 25.224 31.025 1.00 11.14 C ATOM 1255 C VAL A 187 5.663 24.837 32.315 1.00 11.65 C ATOM 1256 O VAL A 187 5.748 23.707 32.799 1.00 12.54 O ATOM 1257 CB VAL A 187 5.346 25.419 29.899 1.00 9.18 C ATOM 1258 CG1 VAL A 187 6.037 25.745 28.586 1.00 10.05 C ATOM 1259 CG2 VAL A 187 4.454 24.178 29.775 1.00 13.09 C ATOM 1260 H VAL A 187 7.109 23.225 30.637 1.00 0.00 H ATOM 1261 N GLU A 188 4.955 25.810 32.871 1.00 11.17 N ATOM 1262 CA GLU A 188 3.978 25.579 33.919 1.00 11.25 C ATOM 1263 C GLU A 188 2.588 25.742 33.314 1.00 13.17 C ATOM 1264 O GLU A 188 2.327 26.726 32.612 1.00 11.70 O ATOM 1265 CB GLU A 188 4.168 26.553 35.082 1.00 12.40 C ATOM 1266 CG GLU A 188 3.175 26.352 36.207 1.00 15.00 C ATOM 1267 CD GLU A 188 3.575 27.108 37.459 1.00 18.33 C ATOM 1268 OE1 GLU A 188 3.406 28.344 37.489 1.00 18.77 O ATOM 1269 OE2 GLU A 188 4.067 26.468 38.408 1.00 17.84 O ATOM 1270 H GLU A 188 5.107 26.784 32.541 1.00 0.00 H ATOM 1271 N LEU A 189 1.719 24.761 33.554 1.00 10.88 N ATOM 1272 CA LEU A 189 0.317 24.864 33.180 1.00 9.66 C ATOM 1273 C LEU A 189 -0.492 25.373 34.370 1.00 11.26 C ATOM 1274 O LEU A 189 -0.235 24.994 35.514 1.00 12.85 O ATOM 1275 CB LEU A 189 -0.212 23.510 32.712 1.00 9.24 C ATOM 1276 CG LEU A 189 0.594 22.808 31.620 1.00 7.02 C ATOM 1277 CD1 LEU A 189 -0.071 21.467 31.270 1.00 6.05 C ATOM 1278 CD2 LEU A 189 0.737 23.695 30.380 1.00 8.80 C ATOM 1279 H LEU A 189 2.053 23.895 34.023 1.00 0.00 H ATOM 1280 N PHE A 190 -1.454 26.254 34.101 1.00 9.44 N ATOM 1281 CA PHE A 190 -2.210 26.906 35.164 1.00 9.53 C ATOM 1282 C PHE A 190 -3.688 26.905 34.806 1.00 10.74 C ATOM 1283 O PHE A 190 -4.067 27.338 33.713 1.00 10.06 O ATOM 1284 CB PHE A 190 -1.688 28.346 35.380 1.00 9.00 C ATOM 1285 CG PHE A 190 -2.294 29.071 36.559 1.00 8.63 C ATOM 1286 CD1 PHE A 190 -2.069 28.632 37.852 1.00 12.03 C ATOM 1287 CD2 PHE A 190 -3.034 30.228 36.373 1.00 10.69 C ATOM 1288 CE1 PHE A 190 -2.597 29.318 38.936 1.00 14.89 C ATOM 1289 CE2 PHE A 190 -3.563 30.924 37.455 1.00 12.53 C ATOM 1290 CZ PHE A 190 -3.347 30.465 38.736 1.00 12.53 C ATOM 1291 H PHE A 190 -1.671 26.482 33.110 1.00 0.00 H ATOM 1292 N TYR A 191 -4.519 26.399 35.722 1.00 9.87 N ATOM 1293 CA TYR A 191 -5.958 26.509 35.562 1.00 8.46 C ATOM 1294 C TYR A 191 -6.442 27.675 36.418 1.00 10.08 C ATOM 1295 O TYR A 191 -6.554 27.531 37.648 1.00 12.14 O ATOM 1296 CB TYR A 191 -6.667 25.214 35.964 1.00 6.89 C ATOM 1297 CG TYR A 191 -8.157 25.372 35.892 1.00 6.90 C ATOM 1298 CD1 TYR A 191 -8.769 25.854 34.728 1.00 5.24 C ATOM 1299 CD2 TYR A 191 -8.957 25.055 36.978 1.00 5.28 C ATOM 1300 CE1 TYR A 191 -10.149 26.020 34.661 1.00 9.01 C ATOM 1301 CE2 TYR A 191 -10.331 25.215 36.922 1.00 8.63 C ATOM 1302 CZ TYR A 191 -10.922 25.691 35.770 1.00 10.59 C ATOM 1303 OH TYR A 191 -12.280 25.829 35.752 1.00 8.25 O ATOM 1304 HH TYR A 191 -12.563 26.177 34.870 1.00 0.00 H ATOM 1305 H TYR A 191 -4.130 25.921 36.560 1.00 0.00 H ATOM 1306 N PRO A 192 -6.732 28.839 35.829 1.00 10.60 N ATOM 1307 CA PRO A 192 -7.087 30.022 36.633 1.00 8.60 C ATOM 1308 C PRO A 192 -8.530 30.053 37.079 1.00 10.05 C ATOM 1309 O PRO A 192 -8.897 30.943 37.861 1.00 12.23 O ATOM 1310 CB PRO A 192 -6.818 31.179 35.667 1.00 8.47 C ATOM 1311 CG PRO A 192 -7.191 30.586 34.318 1.00 7.30 C ATOM 1312 CD PRO A 192 -6.712 29.137 34.383 1.00 8.46 C ATOM 1313 N GLY A 193 -9.349 29.132 36.600 1.00 9.67 N ATOM 1314 CA GLY A 193 -10.789 29.195 36.744 1.00 10.55 C ATOM 1315 C GLY A 193 -11.466 29.454 35.410 1.00 10.09 C ATOM 1316 O GLY A 193 -10.834 29.783 34.405 1.00 9.37 O ATOM 1317 H GLY A 193 -8.938 28.321 36.094 1.00 0.00 H ATOM 1318 N ALA A 194 -12.789 29.286 35.412 1.00 9.64 N ATOM 1319 CA ALA A 194 -13.553 29.494 34.187 1.00 10.18 C ATOM 1320 C ALA A 194 -13.412 30.937 33.700 1.00 9.93 C ATOM 1321 O ALA A 194 -13.391 31.887 34.489 1.00 8.97 O ATOM 1322 CB ALA A 194 -15.028 29.146 34.404 1.00 7.67 C ATOM 1323 H ALA A 194 -13.276 29.007 36.287 1.00 0.00 H ATOM 1324 N ALA A 195 -13.312 31.091 32.384 1.00 9.20 N ATOM 1325 CA ALA A 195 -13.195 32.403 31.764 1.00 4.51 C ATOM 1326 C ALA A 195 -13.835 32.366 30.386 1.00 5.82 C ATOM 1327 O ALA A 195 -15.061 32.359 30.274 1.00 6.92 O ATOM 1328 CB ALA A 195 -11.735 32.838 31.669 1.00 5.69 C ATOM 1329 H ALA A 195 -13.317 30.247 31.777 1.00 0.00 H ATOM 1330 N HIS A 196 -13.005 32.347 29.335 1.00 9.03 N ATOM 1331 CA HIS A 196 -13.515 32.164 27.979 1.00 6.46 C ATOM 1332 C HIS A 196 -14.262 30.843 27.844 1.00 9.57 C ATOM 1333 O HIS A 196 -15.214 30.740 27.056 1.00 11.28 O ATOM 1334 CB HIS A 196 -12.348 32.246 26.985 1.00 5.02 C ATOM 1335 CG HIS A 196 -12.686 31.801 25.592 1.00 5.15 C ATOM 1336 ND1 HIS A 196 -13.219 32.651 24.647 1.00 7.11 N ATOM 1337 CD2 HIS A 196 -12.531 30.601 24.976 1.00 7.53 C ATOM 1338 CE1 HIS A 196 -13.392 31.990 23.512 1.00 8.23 C ATOM 1339 NE2 HIS A 196 -12.977 30.747 23.683 1.00 7.06 N ATOM 1340 H HIS A 196 -11.983 32.464 29.487 1.00 0.00 H ATOM 1341 N SER A 197 -13.828 29.829 28.593 1.00 6.90 N ATOM 1342 CA SER A 197 -14.510 28.542 28.700 1.00 6.35 C ATOM 1343 C SER A 197 -14.261 28.017 30.106 1.00 6.57 C ATOM 1344 O SER A 197 -13.395 28.522 30.825 1.00 11.81 O ATOM 1345 CB SER A 197 -14.022 27.560 27.629 1.00 9.43 C ATOM 1346 OG SER A 197 -12.617 27.351 27.728 1.00 8.94 O ATOM 1347 HG SER A 197 -12.402 26.980 28.620 1.00 0.00 H ATOM 1348 H SER A 197 -12.950 29.963 29.134 1.00 0.00 H ATOM 1349 N THR A 198 -15.023 26.987 30.510 1.00 7.98 N ATOM 1350 CA THR A 198 -14.852 26.487 31.875 1.00 10.70 C ATOM 1351 C THR A 198 -13.539 25.743 32.062 1.00 8.18 C ATOM 1352 O THR A 198 -13.119 25.532 33.204 1.00 8.54 O ATOM 1353 CB THR A 198 -16.001 25.563 32.289 1.00 12.54 C ATOM 1354 OG1 THR A 198 -16.088 24.467 31.377 1.00 16.48 O ATOM 1355 CG2 THR A 198 -17.296 26.295 32.280 1.00 13.40 C ATOM 1356 HG1 THR A 198 -16.832 23.872 31.648 1.00 0.00 H ATOM 1357 H THR A 198 -15.718 26.555 29.868 1.00 0.00 H ATOM 1358 N ASP A 199 -12.886 25.346 30.971 1.00 10.88 N ATOM 1359 CA ASP A 199 -11.715 24.492 31.024 1.00 8.95 C ATOM 1360 C ASP A 199 -10.421 25.222 30.676 1.00 9.75 C ATOM 1361 O ASP A 199 -9.352 24.603 30.720 1.00 11.96 O ATOM 1362 CB ASP A 199 -11.913 23.295 30.073 1.00 9.31 C ATOM 1363 CG ASP A 199 -12.134 23.732 28.636 1.00 10.33 C ATOM 1364 OD1 ASP A 199 -12.899 24.699 28.432 1.00 7.91 O ATOM 1365 OD2 ASP A 199 -11.536 23.124 27.715 1.00 9.52 O ATOM 1366 H ASP A 199 -13.230 25.662 30.042 1.00 0.00 H ATOM 1367 N ASN A 200 -10.474 26.518 30.356 1.00 8.13 N ATOM 1368 CA ASN A 200 -9.322 27.129 29.709 1.00 7.70 C ATOM 1369 C ASN A 200 -8.105 27.143 30.631 1.00 9.77 C ATOM 1370 O ASN A 200 -8.208 27.424 31.829 1.00 10.89 O ATOM 1371 CB ASN A 200 -9.633 28.541 29.192 1.00 7.78 C ATOM 1372 CG ASN A 200 -10.370 29.450 30.193 1.00 7.73 C ATOM 1373 OD1 ASN A 200 -11.097 30.349 29.760 1.00 10.05 O ATOM 1374 ND2 ASN A 200 -10.155 29.265 31.499 1.00 5.79 N ATOM 1375 HD22 ASN A 200 -9.535 28.494 31.820 1.00 0.00 H ATOM 1376 HD21 ASN A 200 -10.608 29.892 32.194 1.00 0.00 H ATOM 1377 H ASN A 200 -11.323 27.080 30.565 1.00 0.00 H ATOM 1378 N LEU A 201 -6.956 26.791 30.059 1.00 6.34 N ATOM 1379 CA LEU A 201 -5.664 26.806 30.730 1.00 5.42 C ATOM 1380 C LEU A 201 -4.832 27.962 30.195 1.00 6.75 C ATOM 1381 O LEU A 201 -5.029 28.410 29.062 1.00 5.95 O ATOM 1382 CB LEU A 201 -4.889 25.495 30.507 1.00 7.09 C ATOM 1383 CG LEU A 201 -5.571 24.165 30.823 1.00 5.34 C ATOM 1384 CD1 LEU A 201 -4.677 22.996 30.406 1.00 8.65 C ATOM 1385 CD2 LEU A 201 -5.877 24.097 32.307 1.00 6.40 C ATOM 1386 H LEU A 201 -6.983 26.485 29.066 1.00 0.00 H ATOM 1387 N VAL A 202 -3.903 28.453 31.018 1.00 8.17 N ATOM 1388 CA VAL A 202 -2.871 29.356 30.532 1.00 7.32 C ATOM 1389 C VAL A 202 -1.517 28.705 30.797 1.00 9.29 C ATOM 1390 O VAL A 202 -1.402 27.731 31.549 1.00 7.90 O ATOM 1391 CB VAL A 202 -2.960 30.766 31.158 1.00 6.20 C ATOM 1392 CG1 VAL A 202 -4.339 31.338 30.936 1.00 6.17 C ATOM 1393 CG2 VAL A 202 -2.644 30.708 32.633 1.00 6.58 C ATOM 1394 H VAL A 202 -3.917 28.186 32.023 1.00 0.00 H ATOM 1395 N VAL A 203 -0.487 29.234 30.137 1.00 9.78 N ATOM 1396 CA VAL A 203 0.823 28.586 30.071 1.00 8.55 C ATOM 1397 C VAL A 203 1.905 29.622 30.337 1.00 9.25 C ATOM 1398 O VAL A 203 1.913 30.690 29.715 1.00 11.99 O ATOM 1399 CB VAL A 203 1.061 27.923 28.698 1.00 7.36 C ATOM 1400 CG1 VAL A 203 2.440 27.249 28.654 1.00 4.73 C ATOM 1401 CG2 VAL A 203 -0.051 26.945 28.366 1.00 10.01 C ATOM 1402 H VAL A 203 -0.620 30.143 29.650 1.00 0.00 H ATOM 1403 N TYR A 204 2.836 29.300 31.231 1.00 7.64 N ATOM 1404 CA TYR A 204 3.929 30.209 31.547 1.00 9.40 C ATOM 1405 C TYR A 204 5.265 29.537 31.273 1.00 12.75 C ATOM 1406 O TYR A 204 5.454 28.360 31.596 1.00 12.83 O ATOM 1407 CB TYR A 204 3.869 30.654 33.006 1.00 8.93 C ATOM 1408 CG TYR A 204 4.871 31.735 33.357 1.00 10.62 C ATOM 1409 CD1 TYR A 204 4.832 32.980 32.732 1.00 12.30 C ATOM 1410 CD2 TYR A 204 5.848 31.513 34.326 1.00 12.70 C ATOM 1411 CE1 TYR A 204 5.753 33.964 33.053 1.00 10.78 C ATOM 1412 CE2 TYR A 204 6.765 32.492 34.658 1.00 10.87 C ATOM 1413 CZ TYR A 204 6.709 33.711 34.024 1.00 12.70 C ATOM 1414 OH TYR A 204 7.619 34.678 34.354 1.00 14.29 O ATOM 1415 HH TYR A 204 8.533 34.346 34.170 1.00 0.00 H ATOM 1416 H TYR A 204 2.782 28.381 31.714 1.00 0.00 H ATOM 1417 N VAL A 205 6.183 30.284 30.666 1.00 14.11 N ATOM 1418 CA VAL A 205 7.529 29.779 30.404 1.00 13.09 C ATOM 1419 C VAL A 205 8.487 30.502 31.339 1.00 17.78 C ATOM 1420 O VAL A 205 8.922 31.623 31.037 1.00 19.69 O ATOM 1421 CB VAL A 205 7.940 29.967 28.938 1.00 12.96 C ATOM 1422 CG1 VAL A 205 9.243 29.186 28.645 1.00 9.65 C ATOM 1423 CG2 VAL A 205 6.820 29.520 28.028 1.00 10.66 C ATOM 1424 H VAL A 205 5.937 31.250 30.371 1.00 0.00 H ATOM 1425 N PRO A 209 8.832 29.904 32.477 1.00 18.13 N ATOM 1426 CA PRO A 209 9.633 30.635 33.476 1.00 19.59 C ATOM 1427 C PRO A 209 11.015 31.037 32.986 1.00 19.82 C ATOM 1428 O PRO A 209 11.521 32.086 33.399 1.00 19.62 O ATOM 1429 CB PRO A 209 9.706 29.653 34.656 1.00 20.71 C ATOM 1430 CG PRO A 209 9.327 28.314 34.094 1.00 22.43 C ATOM 1431 CD PRO A 209 8.385 28.585 32.960 1.00 17.90 C ATOM 1432 N SER A 210 11.642 30.247 32.110 1.00 18.94 N ATOM 1433 CA SER A 210 12.963 30.621 31.614 1.00 23.96 C ATOM 1434 C SER A 210 12.925 31.934 30.840 1.00 23.79 C ATOM 1435 O SER A 210 13.901 32.695 30.858 1.00 24.41 O ATOM 1436 CB SER A 210 13.531 29.504 30.735 1.00 29.26 C ATOM 1437 OG SER A 210 12.880 29.460 29.470 1.00 32.87 O ATOM 1438 HG SER A 210 13.268 28.730 28.926 1.00 0.00 H ATOM 1439 H SER A 210 11.191 29.369 31.783 1.00 0.00 H ATOM 1440 N ALA A 211 11.809 32.227 30.175 1.00 20.88 N ATOM 1441 CA ALA A 211 11.689 33.389 29.307 1.00 17.13 C ATOM 1442 C ALA A 211 10.714 34.442 29.816 1.00 17.15 C ATOM 1443 O ALA A 211 10.601 35.503 29.189 1.00 17.29 O ATOM 1444 CB ALA A 211 11.259 32.947 27.906 1.00 20.01 C ATOM 1445 H ALA A 211 10.987 31.598 30.281 1.00 0.00 H ATOM 1446 N SER A 215 10.001 34.179 30.916 1.00 14.84 N ATOM 1447 CA SER A 215 8.972 35.086 31.439 1.00 18.81 C ATOM 1448 C SER A 215 7.888 35.373 30.403 1.00 15.84 C ATOM 1449 O SER A 215 7.450 36.516 30.231 1.00 15.57 O ATOM 1450 CB SER A 215 9.582 36.393 31.948 1.00 18.48 C ATOM 1451 OG SER A 215 10.559 36.137 32.937 1.00 24.77 O ATOM 1452 HG SER A 215 10.140 35.661 33.698 1.00 0.00 H ATOM 1453 H SER A 215 10.184 33.291 31.425 1.00 0.00 H ATOM 1454 N VAL A 216 7.439 34.330 29.712 1.00 12.33 N ATOM 1455 CA VAL A 216 6.414 34.446 28.682 1.00 9.25 C ATOM 1456 C VAL A 216 5.135 33.818 29.215 1.00 9.57 C ATOM 1457 O VAL A 216 5.121 32.638 29.575 1.00 12.42 O ATOM 1458 CB VAL A 216 6.839 33.761 27.375 1.00 7.77 C ATOM 1459 CG1 VAL A 216 5.668 33.739 26.396 1.00 8.69 C ATOM 1460 CG2 VAL A 216 8.052 34.453 26.761 1.00 9.37 C ATOM 1461 H VAL A 216 7.836 33.391 29.915 1.00 0.00 H ATOM 1462 N LEU A 217 4.063 34.596 29.257 1.00 9.14 N ATOM 1463 CA LEU A 217 2.749 34.102 29.653 1.00 7.52 C ATOM 1464 C LEU A 217 1.863 34.021 28.415 1.00 8.91 C ATOM 1465 O LEU A 217 1.645 35.030 27.740 1.00 12.33 O ATOM 1466 CB LEU A 217 2.126 35.015 30.710 1.00 8.40 C ATOM 1467 CG LEU A 217 0.687 34.726 31.134 1.00 10.57 C ATOM 1468 CD1 LEU A 217 0.554 33.378 31.841 1.00 9.86 C ATOM 1469 CD2 LEU A 217 0.184 35.857 32.027 1.00 14.76 C ATOM 1470 H LEU A 217 4.163 35.598 28.997 1.00 0.00 H ATOM 1471 N TYR A 218 1.366 32.824 28.112 1.00 9.11 N ATOM 1472 CA TYR A 218 0.453 32.614 26.994 1.00 7.42 C ATOM 1473 C TYR A 218 -0.949 32.458 27.561 1.00 8.23 C ATOM 1474 O TYR A 218 -1.211 31.518 28.316 1.00 8.53 O ATOM 1475 CB TYR A 218 0.846 31.379 26.176 1.00 7.56 C ATOM 1476 CG TYR A 218 -0.216 30.912 25.193 1.00 11.32 C ATOM 1477 CD1 TYR A 218 -0.554 31.685 24.084 1.00 12.48 C ATOM 1478 CD2 TYR A 218 -0.876 29.698 25.369 1.00 9.36 C ATOM 1479 CE1 TYR A 218 -1.522 31.276 23.182 1.00 10.84 C ATOM 1480 CE2 TYR A 218 -1.846 29.268 24.460 1.00 9.70 C ATOM 1481 CZ TYR A 218 -2.161 30.064 23.370 1.00 12.54 C ATOM 1482 OH TYR A 218 -3.120 29.659 22.471 1.00 13.41 O ATOM 1483 HH TYR A 218 -2.848 28.798 22.066 1.00 0.00 H ATOM 1484 H TYR A 218 1.639 32.007 28.695 1.00 0.00 H ATOM 1485 N GLY A 219 -1.848 33.383 27.208 1.00 9.06 N ATOM 1486 CA GLY A 219 -3.174 33.363 27.801 1.00 4.60 C ATOM 1487 C GLY A 219 -4.227 32.544 27.073 1.00 8.97 C ATOM 1488 O GLY A 219 -5.327 32.326 27.610 1.00 7.26 O ATOM 1489 H GLY A 219 -1.599 34.114 26.511 1.00 0.00 H ATOM 1490 N GLY A 220 -3.926 32.078 25.863 1.00 8.44 N ATOM 1491 CA GLY A 220 -5.030 31.473 25.134 1.00 6.62 C ATOM 1492 C GLY A 220 -6.165 32.482 24.952 1.00 7.65 C ATOM 1493 O GLY A 220 -5.994 33.701 25.077 1.00 6.70 O ATOM 1494 H GLY A 220 -2.967 32.142 25.466 1.00 0.00 H ATOM 1495 N CYS A 221 -7.356 31.944 24.698 1.00 6.84 N ATOM 1496 CA CYS A 221 -8.499 32.806 24.413 1.00 5.47 C ATOM 1497 C CYS A 221 -9.047 33.492 25.656 1.00 5.85 C ATOM 1498 O CYS A 221 -9.947 34.335 25.528 1.00 7.20 O ATOM 1499 CB CYS A 221 -9.602 32.007 23.727 1.00 7.68 C ATOM 1500 SG CYS A 221 -9.001 31.244 22.199 1.00 9.56 S ATOM 1501 H CYS A 221 -7.472 30.910 24.703 1.00 0.00 H ATOM 1502 N ALA A 222 -8.538 33.149 26.844 1.00 6.33 N ATOM 1503 CA ALA A 222 -8.938 33.853 28.054 1.00 6.18 C ATOM 1504 C ALA A 222 -8.358 35.258 28.144 1.00 6.52 C ATOM 1505 O ALA A 222 -8.815 36.040 28.991 1.00 8.77 O ATOM 1506 CB ALA A 222 -8.534 33.036 29.290 1.00 6.05 C ATOM 1507 H ALA A 222 -7.850 32.372 26.904 1.00 0.00 H ATOM 1508 N ILE A 223 -7.382 35.604 27.306 1.00 5.38 N ATOM 1509 CA ILE A 223 -6.749 36.922 27.328 1.00 7.61 C ATOM 1510 C ILE A 223 -6.909 37.539 25.946 1.00 6.83 C ATOM 1511 O ILE A 223 -6.504 36.937 24.939 1.00 8.41 O ATOM 1512 CB ILE A 223 -5.264 36.847 27.726 1.00 8.56 C ATOM 1513 CG1 ILE A 223 -5.102 36.317 29.150 1.00 9.37 C ATOM 1514 CG2 ILE A 223 -4.590 38.219 27.606 1.00 10.51 C ATOM 1515 CD1 ILE A 223 -5.931 37.059 30.206 1.00 10.52 C ATOM 1516 H ILE A 223 -7.056 34.907 26.606 1.00 0.00 H ATOM 1517 N TYR A 224 -7.493 38.734 25.904 1.00 6.61 N ATOM 1518 CA TYR A 224 -7.717 39.494 24.678 1.00 8.85 C ATOM 1519 C TYR A 224 -6.521 40.393 24.365 1.00 9.98 C ATOM 1520 O TYR A 224 -5.868 40.914 25.274 1.00 9.54 O ATOM 1521 CB TYR A 224 -8.962 40.374 24.821 1.00 8.01 C ATOM 1522 CG TYR A 224 -10.306 39.681 24.712 1.00 13.35 C ATOM 1523 CD1 TYR A 224 -10.420 38.300 24.776 1.00 10.81 C ATOM 1524 CD2 TYR A 224 -11.469 40.422 24.563 1.00 19.24 C ATOM 1525 CE1 TYR A 224 -11.651 37.684 24.680 1.00 11.79 C ATOM 1526 CE2 TYR A 224 -12.698 39.813 24.463 1.00 20.17 C ATOM 1527 CZ TYR A 224 -12.785 38.442 24.525 1.00 15.19 C ATOM 1528 OH TYR A 224 -14.016 37.829 24.435 1.00 18.14 O ATOM 1529 HH TYR A 224 -13.900 36.848 24.497 1.00 0.00 H ATOM 1530 H TYR A 224 -7.810 39.153 26.802 1.00 0.00 H ATOM 1531 N GLU A 225 -6.257 40.597 23.066 1.00 10.49 N ATOM 1532 CA GLU A 225 -5.341 41.655 22.645 1.00 9.73 C ATOM 1533 C GLU A 225 -5.977 43.030 22.854 1.00 8.28 C ATOM 1534 O GLU A 225 -7.199 43.173 22.911 1.00 9.88 O ATOM 1535 CB GLU A 225 -4.941 41.498 21.171 1.00 8.91 C ATOM 1536 CG GLU A 225 -6.035 41.823 20.168 1.00 11.27 C ATOM 1537 CD GLU A 225 -5.519 41.850 18.730 1.00 14.90 C ATOM 1538 OE1 GLU A 225 -4.380 42.333 18.504 1.00 15.02 O ATOM 1539 OE2 GLU A 225 -6.244 41.378 17.822 1.00 13.97 O ATOM 1540 H GLU A 225 -6.710 39.995 22.349 1.00 0.00 H ATOM 1541 N LEU A 226 -5.113 44.051 22.968 1.00 10.17 N ATOM 1542 CA LEU A 226 -5.571 45.408 23.276 1.00 9.56 C ATOM 1543 C LEU A 226 -6.489 45.971 22.194 1.00 10.44 C ATOM 1544 O LEU A 226 -7.380 46.774 22.498 1.00 15.52 O ATOM 1545 CB LEU A 226 -4.370 46.337 23.470 1.00 8.93 C ATOM 1546 CG LEU A 226 -3.377 46.046 24.593 1.00 6.94 C ATOM 1547 CD1 LEU A 226 -2.255 47.066 24.601 1.00 5.98 C ATOM 1548 CD2 LEU A 226 -4.084 46.006 25.966 1.00 9.72 C ATOM 1549 H LEU A 226 -4.097 43.875 22.835 1.00 0.00 H ATOM 1550 N SER A 227 -6.289 45.576 20.931 1.00 10.07 N ATOM 1551 CA SER A 227 -7.114 46.093 19.843 1.00 12.68 C ATOM 1552 C SER A 227 -8.568 45.649 19.918 1.00 16.67 C ATOM 1553 O SER A 227 -9.414 46.218 19.219 1.00 18.27 O ATOM 1554 CB SER A 227 -6.544 45.653 18.500 1.00 13.92 C ATOM 1555 OG SER A 227 -5.468 46.498 18.166 1.00 23.95 O ATOM 1556 HG SER A 227 -4.770 46.434 18.865 1.00 0.00 H ATOM 1557 H SER A 227 -5.535 44.891 20.722 1.00 0.00 H ATOM 1558 N ARG A 228 -8.882 44.640 20.716 1.00 16.89 N ATOM 1559 CA ARG A 228 -10.244 44.149 20.811 1.00 17.99 C ATOM 1560 C ARG A 228 -10.958 44.908 21.915 1.00 18.54 C ATOM 1561 O ARG A 228 -10.565 44.832 23.083 1.00 19.68 O ATOM 1562 CB ARG A 228 -10.253 42.649 21.057 1.00 18.46 C ATOM 1563 CG ARG A 228 -9.688 41.908 19.870 1.00 18.02 C ATOM 1564 CD ARG A 228 -9.791 40.422 20.058 1.00 18.73 C ATOM 1565 NE ARG A 228 -11.158 40.002 20.357 1.00 16.62 N ATOM 1566 CZ ARG A 228 -11.458 38.837 20.921 1.00 18.55 C ATOM 1567 NH1 ARG A 228 -10.488 37.989 21.245 1.00 18.14 N ATOM 1568 NH2 ARG A 228 -12.719 38.515 21.156 1.00 21.48 N ATOM 1569 HE ARG A 228 -11.936 40.648 20.116 1.00 0.00 H ATOM 1570 HH12 ARG A 228 -10.721 37.077 21.687 1.00 0.00 H ATOM 1571 HH11 ARG A 228 -9.496 38.238 21.057 1.00 0.00 H ATOM 1572 HH22 ARG A 228 -12.949 37.602 21.598 1.00 0.00 H ATOM 1573 HH21 ARG A 228 -13.481 39.175 20.899 1.00 0.00 H ATOM 1574 H ARG A 228 -8.137 44.190 21.286 1.00 0.00 H ATOM 1575 N THR A 229 -11.980 45.662 21.530 1.00 20.70 N ATOM 1576 CA THR A 229 -12.725 46.540 22.418 1.00 26.79 C ATOM 1577 C THR A 229 -14.073 45.962 22.813 1.00 22.72 C ATOM 1578 O THR A 229 -14.782 46.571 23.617 1.00 23.60 O ATOM 1579 CB THR A 229 -12.925 47.909 21.755 1.00 37.62 C ATOM 1580 OG1 THR A 229 -13.870 47.790 20.679 1.00 40.48 O ATOM 1581 CG2 THR A 229 -11.603 48.431 21.206 1.00 42.07 C ATOM 1582 HG1 THR A 229 -13.997 48.675 20.253 1.00 0.00 H ATOM 1583 H THR A 229 -12.266 45.622 20.531 1.00 0.00 H ATOM 1584 N SER A 230 -14.439 44.806 22.267 1.00 19.57 N ATOM 1585 CA SER A 230 -15.702 44.155 22.577 1.00 21.15 C ATOM 1586 C SER A 230 -15.478 42.652 22.656 1.00 19.04 C ATOM 1587 O SER A 230 -14.505 42.117 22.119 1.00 17.22 O ATOM 1588 CB SER A 230 -16.758 44.468 21.523 1.00 23.32 C ATOM 1589 OG SER A 230 -16.345 43.930 20.279 1.00 25.58 O ATOM 1590 HG SER A 230 -16.239 42.949 20.364 1.00 0.00 H ATOM 1591 H SER A 230 -13.795 44.348 21.590 1.00 0.00 H ATOM 1592 N ALA A 231 -16.399 41.966 23.323 1.00 16.63 N ATOM 1593 CA ALA A 231 -16.229 40.536 23.524 1.00 14.20 C ATOM 1594 C ALA A 231 -16.419 39.782 22.215 1.00 16.86 C ATOM 1595 O ALA A 231 -17.168 40.201 21.324 1.00 18.06 O ATOM 1596 CB ALA A 231 -17.210 40.023 24.574 1.00 18.94 C ATOM 1597 H ALA A 231 -17.239 42.450 23.700 1.00 0.00 H ATOM 1598 N GLY A 232 -15.715 38.662 22.099 1.00 13.45 N ATOM 1599 CA GLY A 232 -15.879 37.807 20.940 1.00 11.27 C ATOM 1600 C GLY A 232 -16.921 36.740 21.192 1.00 17.70 C ATOM 1601 O GLY A 232 -18.017 37.031 21.696 1.00 19.45 O ATOM 1602 H GLY A 232 -15.041 38.396 22.845 1.00 0.00 H ATOM 1603 N ASN A 233 -16.584 35.497 20.846 1.00 14.41 N ATOM 1604 CA ASN A 233 -17.447 34.370 21.155 1.00 13.34 C ATOM 1605 C ASN A 233 -17.440 34.131 22.654 1.00 16.31 C ATOM 1606 O ASN A 233 -16.413 33.743 23.221 1.00 20.62 O ATOM 1607 CB ASN A 233 -16.980 33.117 20.421 1.00 13.03 C ATOM 1608 CG ASN A 233 -17.585 31.860 21.013 1.00 15.26 C ATOM 1609 OD1 ASN A 233 -18.790 31.803 21.229 1.00 14.47 O ATOM 1610 ND2 ASN A 233 -16.753 30.865 21.311 1.00 16.07 N ATOM 1611 HD22 ASN A 233 -15.737 30.959 21.109 1.00 0.00 H ATOM 1612 HD21 ASN A 233 -17.119 29.994 21.746 1.00 0.00 H ATOM 1613 H ASN A 233 -15.687 35.331 20.346 1.00 0.00 H ATOM 1614 N VAL A 234 -18.579 34.353 23.305 1.00 14.40 N ATOM 1615 CA VAL A 234 -18.704 34.070 24.729 1.00 13.63 C ATOM 1616 C VAL A 234 -19.774 33.014 24.995 1.00 13.92 C ATOM 1617 O VAL A 234 -20.252 32.890 26.120 1.00 13.76 O ATOM 1618 CB VAL A 234 -18.980 35.356 25.529 1.00 17.83 C ATOM 1619 CG1 VAL A 234 -17.768 36.293 25.469 1.00 18.42 C ATOM 1620 CG2 VAL A 234 -20.234 36.042 24.997 1.00 17.77 C ATOM 1621 H VAL A 234 -19.396 34.736 22.788 1.00 0.00 H ATOM 1622 N ALA A 235 -20.155 32.244 23.966 1.00 12.61 N ATOM 1623 CA ALA A 235 -21.236 31.276 24.129 1.00 14.39 C ATOM 1624 C ALA A 235 -20.921 30.227 25.190 1.00 16.10 C ATOM 1625 O ALA A 235 -21.839 29.700 25.830 1.00 16.53 O ATOM 1626 CB ALA A 235 -21.536 30.594 22.797 1.00 14.76 C ATOM 1627 H ALA A 235 -19.678 32.337 23.046 1.00 0.00 H ATOM 1628 N ASP A 236 -19.644 29.900 25.385 1.00 11.62 N ATOM 1629 CA ASP A 236 -19.245 28.898 26.362 1.00 10.85 C ATOM 1630 C ASP A 236 -18.518 29.511 27.546 1.00 11.24 C ATOM 1631 O ASP A 236 -17.883 28.785 28.318 1.00 11.05 O ATOM 1632 CB ASP A 236 -18.372 27.836 25.693 1.00 12.94 C ATOM 1633 CG ASP A 236 -19.138 27.037 24.665 1.00 14.92 C ATOM 1634 OD1 ASP A 236 -20.348 26.832 24.867 1.00 18.08 O ATOM 1635 OD2 ASP A 236 -18.546 26.630 23.651 1.00 13.63 O ATOM 1636 H ASP A 236 -18.910 30.375 24.822 1.00 0.00 H ATOM 1637 N ALA A 237 -18.601 30.826 27.705 1.00 9.10 N ATOM 1638 CA ALA A 237 -17.840 31.556 28.699 1.00 7.64 C ATOM 1639 C ALA A 237 -18.581 31.565 30.029 1.00 10.16 C ATOM 1640 O ALA A 237 -19.790 31.335 30.097 1.00 14.57 O ATOM 1641 CB ALA A 237 -17.591 32.995 28.231 1.00 6.67 C ATOM 1642 H ALA A 237 -19.244 31.359 27.085 1.00 0.00 H ATOM 1643 N ASP A 238 -17.832 31.824 31.089 1.00 11.72 N ATOM 1644 CA ASP A 238 -18.389 32.130 32.399 1.00 11.52 C ATOM 1645 C ASP A 238 -18.050 33.595 32.651 1.00 12.64 C ATOM 1646 O ASP A 238 -17.006 33.923 33.222 1.00 12.16 O ATOM 1647 CB ASP A 238 -17.836 31.207 33.490 1.00 14.40 C ATOM 1648 CG ASP A 238 -18.577 31.359 34.814 1.00 17.90 C ATOM 1649 OD1 ASP A 238 -18.911 32.502 35.191 1.00 16.80 O ATOM 1650 OD2 ASP A 238 -18.825 30.333 35.480 1.00 21.56 O ATOM 1651 H ASP A 238 -16.798 31.808 30.981 1.00 0.00 H ATOM 1652 N LEU A 239 -18.941 34.476 32.194 1.00 10.05 N ATOM 1653 CA LEU A 239 -18.711 35.908 32.338 1.00 9.53 C ATOM 1654 C LEU A 239 -18.641 36.317 33.801 1.00 10.51 C ATOM 1655 O LEU A 239 -17.925 37.263 34.149 1.00 13.28 O ATOM 1656 CB LEU A 239 -19.814 36.681 31.622 1.00 13.72 C ATOM 1657 CG LEU A 239 -19.835 36.428 30.112 1.00 14.87 C ATOM 1658 CD1 LEU A 239 -21.148 36.883 29.496 1.00 21.80 C ATOM 1659 CD2 LEU A 239 -18.647 37.119 29.451 1.00 15.68 C ATOM 1660 H LEU A 239 -19.808 34.138 31.730 1.00 0.00 H ATOM 1661 N ALA A 240 -19.369 35.613 34.669 1.00 9.87 N ATOM 1662 CA ALA A 240 -19.388 35.984 36.081 1.00 10.79 C ATOM 1663 C ALA A 240 -18.047 35.724 36.752 1.00 11.96 C ATOM 1664 O ALA A 240 -17.676 36.448 37.684 1.00 11.92 O ATOM 1665 CB ALA A 240 -20.491 35.226 36.814 1.00 9.41 C ATOM 1666 H ALA A 240 -19.924 34.798 34.339 1.00 0.00 H ATOM 1667 N GLU A 241 -17.318 34.698 36.302 1.00 11.53 N ATOM 1668 CA GLU A 241 -16.059 34.298 36.917 1.00 8.83 C ATOM 1669 C GLU A 241 -14.834 34.783 36.159 1.00 9.14 C ATOM 1670 O GLU A 241 -13.724 34.707 36.701 1.00 9.82 O ATOM 1671 CB GLU A 241 -15.974 32.773 37.031 1.00 9.34 C ATOM 1672 CG GLU A 241 -16.877 32.175 38.077 1.00 13.42 C ATOM 1673 CD GLU A 241 -16.606 32.725 39.463 1.00 13.89 C ATOM 1674 OE1 GLU A 241 -15.431 33.018 39.791 1.00 12.57 O ATOM 1675 OE2 GLU A 241 -17.580 32.861 40.229 1.00 17.42 O ATOM 1676 H GLU A 241 -17.663 34.163 35.479 1.00 0.00 H ATOM 1677 N TRP A 242 -14.998 35.250 34.922 1.00 9.50 N ATOM 1678 CA TRP A 242 -13.841 35.620 34.109 1.00 10.28 C ATOM 1679 C TRP A 242 -12.938 36.634 34.805 1.00 9.54 C ATOM 1680 O TRP A 242 -11.728 36.378 34.890 1.00 8.71 O ATOM 1681 CB TRP A 242 -14.342 36.104 32.740 1.00 10.36 C ATOM 1682 CG TRP A 242 -13.348 36.143 31.588 1.00 5.84 C ATOM 1683 CD1 TRP A 242 -12.007 36.380 31.646 1.00 7.27 C ATOM 1684 CD2 TRP A 242 -13.669 35.987 30.200 1.00 4.60 C ATOM 1685 NE1 TRP A 242 -11.468 36.354 30.377 1.00 7.44 N ATOM 1686 CE2 TRP A 242 -12.471 36.112 29.475 1.00 6.14 C ATOM 1687 CE3 TRP A 242 -14.854 35.722 29.506 1.00 6.02 C ATOM 1688 CZ2 TRP A 242 -12.424 36.002 28.083 1.00 7.79 C ATOM 1689 CZ3 TRP A 242 -14.806 35.607 28.113 1.00 6.69 C ATOM 1690 CH2 TRP A 242 -13.602 35.752 27.425 1.00 7.42 C ATOM 1691 HE1 TRP A 242 -10.465 36.495 30.143 1.00 0.00 H ATOM 1692 H TRP A 242 -15.957 35.352 34.532 1.00 0.00 H ATOM 1693 N PRO A 243 -13.429 37.761 35.344 1.00 9.50 N ATOM 1694 CA PRO A 243 -12.487 38.692 36.000 1.00 9.38 C ATOM 1695 C PRO A 243 -11.768 38.070 37.188 1.00 10.00 C ATOM 1696 O PRO A 243 -10.576 38.333 37.388 1.00 11.92 O ATOM 1697 CB PRO A 243 -13.378 39.873 36.419 1.00 10.38 C ATOM 1698 CG PRO A 243 -14.587 39.788 35.523 1.00 10.41 C ATOM 1699 CD PRO A 243 -14.803 38.299 35.316 1.00 9.15 C ATOM 1700 N THR A 244 -12.457 37.242 37.982 1.00 11.91 N ATOM 1701 CA THR A 244 -11.796 36.577 39.103 1.00 12.54 C ATOM 1702 C THR A 244 -10.689 35.648 38.617 1.00 11.79 C ATOM 1703 O THR A 244 -9.616 35.565 39.225 1.00 11.43 O ATOM 1704 CB THR A 244 -12.823 35.802 39.935 1.00 10.18 C ATOM 1705 OG1 THR A 244 -13.772 36.721 40.489 1.00 13.02 O ATOM 1706 CG2 THR A 244 -12.144 35.045 41.068 1.00 9.00 C ATOM 1707 HG1 THR A 244 -14.437 36.223 41.027 1.00 0.00 H ATOM 1708 H THR A 244 -13.467 37.071 37.801 1.00 0.00 H ATOM 1709 N SER A 245 -10.931 34.941 37.520 1.00 9.36 N ATOM 1710 CA SER A 245 -9.898 34.060 36.991 1.00 5.63 C ATOM 1711 C SER A 245 -8.689 34.846 36.514 1.00 8.37 C ATOM 1712 O SER A 245 -7.548 34.430 36.744 1.00 13.44 O ATOM 1713 CB SER A 245 -10.480 33.212 35.859 1.00 7.92 C ATOM 1714 OG SER A 245 -11.577 32.458 36.349 1.00 7.81 O ATOM 1715 HG SER A 245 -11.953 31.910 35.615 1.00 0.00 H ATOM 1716 H SER A 245 -11.851 35.015 37.041 1.00 0.00 H ATOM 1717 N ILE A 246 -8.917 35.981 35.846 1.00 8.52 N ATOM 1718 CA ILE A 246 -7.804 36.821 35.405 1.00 7.27 C ATOM 1719 C ILE A 246 -6.980 37.284 36.604 1.00 10.93 C ATOM 1720 O ILE A 246 -5.741 37.330 36.556 1.00 10.75 O ATOM 1721 CB ILE A 246 -8.340 38.006 34.579 1.00 6.67 C ATOM 1722 CG1 ILE A 246 -8.668 37.528 33.158 1.00 8.44 C ATOM 1723 CG2 ILE A 246 -7.344 39.149 34.564 1.00 9.22 C ATOM 1724 CD1 ILE A 246 -9.427 38.554 32.287 1.00 10.53 C ATOM 1725 H ILE A 246 -9.894 36.269 35.638 1.00 0.00 H ATOM 1726 N GLU A 247 -7.650 37.604 37.709 1.00 13.14 N ATOM 1727 CA GLU A 247 -6.916 38.038 38.892 1.00 14.53 C ATOM 1728 C GLU A 247 -6.030 36.918 39.444 1.00 14.59 C ATOM 1729 O GLU A 247 -4.917 37.183 39.925 1.00 14.79 O ATOM 1730 CB GLU A 247 -7.892 38.563 39.949 1.00 18.20 C ATOM 1731 CG GLU A 247 -7.219 39.085 41.200 1.00 24.17 C ATOM 1732 CD GLU A 247 -6.317 40.297 40.942 1.00 34.06 C ATOM 1733 OE1 GLU A 247 -5.390 40.527 41.749 1.00 39.61 O ATOM 1734 OE2 GLU A 247 -6.532 41.023 39.942 1.00 36.48 O ATOM 1735 H GLU A 247 -8.688 37.545 37.728 1.00 0.00 H ATOM 1736 N ARG A 248 -6.486 35.657 39.365 1.00 10.67 N ATOM 1737 CA ARG A 248 -5.612 34.545 39.733 1.00 10.79 C ATOM 1738 C ARG A 248 -4.373 34.508 38.848 1.00 10.13 C ATOM 1739 O ARG A 248 -3.261 34.250 39.330 1.00 11.33 O ATOM 1740 CB ARG A 248 -6.362 33.209 39.654 1.00 10.80 C ATOM 1741 CG ARG A 248 -7.500 33.069 40.655 1.00 11.31 C ATOM 1742 CD ARG A 248 -7.860 31.606 40.917 1.00 12.12 C ATOM 1743 NE ARG A 248 -9.045 31.511 41.766 1.00 11.14 N ATOM 1744 CZ ARG A 248 -10.294 31.573 41.312 1.00 13.19 C ATOM 1745 NH1 ARG A 248 -10.529 31.704 40.008 1.00 9.49 N ATOM 1746 NH2 ARG A 248 -11.312 31.493 42.161 1.00 12.95 N ATOM 1747 HE ARG A 248 -8.903 31.387 42.789 1.00 0.00 H ATOM 1748 HH12 ARG A 248 -11.507 31.752 39.658 1.00 0.00 H ATOM 1749 HH11 ARG A 248 -9.734 31.758 39.339 1.00 0.00 H ATOM 1750 HH22 ARG A 248 -12.289 31.541 41.808 1.00 0.00 H ATOM 1751 HH21 ARG A 248 -11.132 31.382 43.179 1.00 0.00 H ATOM 1752 H ARG A 248 -7.458 35.473 39.043 1.00 0.00 H ATOM 1753 N ILE A 249 -4.539 34.773 37.551 1.00 8.90 N ATOM 1754 CA ILE A 249 -3.380 34.812 36.668 1.00 10.01 C ATOM 1755 C ILE A 249 -2.436 35.929 37.085 1.00 12.80 C ATOM 1756 O ILE A 249 -1.214 35.746 37.143 1.00 14.34 O ATOM 1757 CB ILE A 249 -3.811 34.981 35.201 1.00 11.12 C ATOM 1758 CG1 ILE A 249 -4.827 33.913 34.812 1.00 11.21 C ATOM 1759 CG2 ILE A 249 -2.578 34.956 34.299 1.00 10.50 C ATOM 1760 CD1 ILE A 249 -5.348 34.060 33.386 1.00 10.87 C ATOM 1761 H ILE A 249 -5.491 34.951 37.172 1.00 0.00 H ATOM 1762 N GLN A 250 -2.989 37.108 37.374 1.00 13.52 N ATOM 1763 CA GLN A 250 -2.152 38.231 37.760 1.00 14.38 C ATOM 1764 C GLN A 250 -1.397 37.922 39.045 1.00 14.42 C ATOM 1765 O GLN A 250 -0.201 38.211 39.155 1.00 14.28 O ATOM 1766 CB GLN A 250 -3.015 39.484 37.910 1.00 19.76 C ATOM 1767 CG GLN A 250 -2.322 40.650 38.602 1.00 26.25 C ATOM 1768 CD GLN A 250 -1.237 41.275 37.756 1.00 26.54 C ATOM 1769 OE1 GLN A 250 -1.476 41.679 36.616 1.00 23.75 O ATOM 1770 NE2 GLN A 250 -0.032 41.365 38.313 1.00 26.23 N ATOM 1771 HE22 GLN A 250 0.122 41.010 39.278 1.00 0.00 H ATOM 1772 HE21 GLN A 250 0.755 41.790 37.783 1.00 0.00 H ATOM 1773 H GLN A 250 -4.021 37.224 37.323 1.00 0.00 H ATOM 1774 N GLN A 251 -2.069 37.288 40.010 1.00 12.76 N ATOM 1775 CA GLN A 251 -1.433 36.996 41.290 1.00 16.20 C ATOM 1776 C GLN A 251 -0.344 35.942 41.154 1.00 14.57 C ATOM 1777 O GLN A 251 0.628 35.962 41.915 1.00 15.83 O ATOM 1778 CB GLN A 251 -2.476 36.540 42.310 1.00 20.76 C ATOM 1779 CG GLN A 251 -3.447 37.633 42.755 1.00 26.22 C ATOM 1780 CD GLN A 251 -2.743 38.823 43.395 1.00 35.44 C ATOM 1781 OE1 GLN A 251 -2.031 38.677 44.393 1.00 40.29 O ATOM 1782 NE2 GLN A 251 -2.939 40.008 42.821 1.00 34.86 N ATOM 1783 HE22 GLN A 251 -3.547 40.085 41.981 1.00 0.00 H ATOM 1784 HE21 GLN A 251 -2.484 40.857 43.213 1.00 0.00 H ATOM 1785 H GLN A 251 -3.055 37.000 39.847 1.00 0.00 H ATOM 1786 N HIS A 252 -0.484 35.019 40.205 1.00 12.03 N ATOM 1787 CA HIS A 252 0.454 33.911 40.080 1.00 13.45 C ATOM 1788 C HIS A 252 1.646 34.236 39.185 1.00 14.74 C ATOM 1789 O HIS A 252 2.724 33.664 39.375 1.00 15.89 O ATOM 1790 CB HIS A 252 -0.269 32.674 39.543 1.00 13.79 C ATOM 1791 CG HIS A 252 0.339 31.380 39.980 1.00 19.25 C ATOM 1792 ND1 HIS A 252 0.087 30.823 41.216 1.00 20.07 N ATOM 1793 CD2 HIS A 252 1.182 30.531 39.347 1.00 21.42 C ATOM 1794 CE1 HIS A 252 0.756 29.689 41.327 1.00 19.91 C ATOM 1795 NE2 HIS A 252 1.429 29.489 40.207 1.00 18.67 N ATOM 1796 H HIS A 252 -1.280 35.090 39.539 1.00 0.00 H ATOM 1797 N TYR A 253 1.489 35.154 38.226 1.00 11.73 N ATOM 1798 CA TYR A 253 2.565 35.498 37.291 1.00 12.13 C ATOM 1799 C TYR A 253 2.802 37.009 37.214 1.00 12.41 C ATOM 1800 O TYR A 253 2.803 37.597 36.132 1.00 14.48 O ATOM 1801 CB TYR A 253 2.251 34.928 35.910 1.00 11.94 C ATOM 1802 CG TYR A 253 2.021 33.431 35.933 1.00 12.93 C ATOM 1803 CD1 TYR A 253 3.077 32.558 36.166 1.00 9.60 C ATOM 1804 CD2 TYR A 253 0.749 32.892 35.741 1.00 11.12 C ATOM 1805 CE1 TYR A 253 2.885 31.187 36.199 1.00 9.97 C ATOM 1806 CE2 TYR A 253 0.543 31.506 35.775 1.00 11.41 C ATOM 1807 CZ TYR A 253 1.625 30.664 36.005 1.00 9.87 C ATOM 1808 OH TYR A 253 1.463 29.292 36.051 1.00 12.70 O ATOM 1809 HH TYR A 253 2.338 28.863 36.224 1.00 0.00 H ATOM 1810 H TYR A 253 0.574 35.640 38.140 1.00 0.00 H ATOM 1811 N PRO A 254 3.043 37.671 38.351 1.00 14.55 N ATOM 1812 CA PRO A 254 3.264 39.125 38.296 1.00 11.66 C ATOM 1813 C PRO A 254 4.562 39.508 37.607 1.00 11.68 C ATOM 1814 O PRO A 254 4.706 40.671 37.194 1.00 12.35 O ATOM 1815 CB PRO A 254 3.271 39.529 39.771 1.00 14.88 C ATOM 1816 CG PRO A 254 3.815 38.309 40.465 1.00 14.30 C ATOM 1817 CD PRO A 254 3.259 37.134 39.707 1.00 14.04 C ATOM 1818 N GLU A 255 5.503 38.568 37.467 1.00 12.53 N ATOM 1819 CA GLU A 255 6.791 38.817 36.834 1.00 11.50 C ATOM 1820 C GLU A 255 6.777 38.595 35.327 1.00 13.28 C ATOM 1821 O GLU A 255 7.822 38.776 34.686 1.00 17.70 O ATOM 1822 CB GLU A 255 7.873 37.934 37.465 1.00 12.19 C ATOM 1823 CG GLU A 255 7.913 36.489 36.945 1.00 18.68 C ATOM 1824 CD GLU A 255 6.898 35.555 37.628 1.00 20.38 C ATOM 1825 OE1 GLU A 255 5.878 36.032 38.177 1.00 16.13 O ATOM 1826 OE2 GLU A 255 7.121 34.323 37.605 1.00 22.56 O ATOM 1827 H GLU A 255 5.305 37.613 37.828 1.00 0.00 H ATOM 1828 N ALA A 256 5.639 38.204 34.748 1.00 10.75 N ATOM 1829 CA ALA A 256 5.576 38.000 33.301 1.00 13.13 C ATOM 1830 C ALA A 256 6.005 39.263 32.563 1.00 13.38 C ATOM 1831 O ALA A 256 5.625 40.381 32.929 1.00 15.30 O ATOM 1832 CB ALA A 256 4.163 37.597 32.872 1.00 14.27 C ATOM 1833 H ALA A 256 4.792 38.043 35.330 1.00 0.00 H ATOM 1834 N GLN A 257 6.811 39.079 31.523 1.00 13.30 N ATOM 1835 CA GLN A 257 7.293 40.178 30.697 1.00 12.83 C ATOM 1836 C GLN A 257 6.643 40.225 29.329 1.00 12.54 C ATOM 1837 O GLN A 257 6.517 41.311 28.759 1.00 14.34 O ATOM 1838 CB GLN A 257 8.810 40.077 30.513 1.00 15.90 C ATOM 1839 CG GLN A 257 9.578 40.122 31.822 1.00 22.17 C ATOM 1840 CD GLN A 257 9.583 41.504 32.435 1.00 30.46 C ATOM 1841 OE1 GLN A 257 8.993 41.734 33.497 1.00 35.88 O ATOM 1842 NE2 GLN A 257 10.240 42.441 31.765 1.00 31.05 N ATOM 1843 HE22 GLN A 257 10.722 42.202 30.875 1.00 0.00 H ATOM 1844 HE21 GLN A 257 10.273 43.414 32.129 1.00 0.00 H ATOM 1845 H GLN A 257 7.110 38.111 31.289 1.00 0.00 H ATOM 1846 N PHE A 258 6.241 39.076 28.793 1.00 10.37 N ATOM 1847 CA PHE A 258 5.553 38.984 27.512 1.00 15.05 C ATOM 1848 C PHE A 258 4.246 38.241 27.729 1.00 13.32 C ATOM 1849 O PHE A 258 4.235 37.178 28.352 1.00 14.85 O ATOM 1850 CB PHE A 258 6.402 38.254 26.461 1.00 16.63 C ATOM 1851 CG PHE A 258 7.816 38.747 26.372 1.00 23.69 C ATOM 1852 CD1 PHE A 258 8.807 38.207 27.179 1.00 25.67 C ATOM 1853 CD2 PHE A 258 8.157 39.743 25.477 1.00 28.11 C ATOM 1854 CE1 PHE A 258 10.114 38.661 27.101 1.00 27.04 C ATOM 1855 CE2 PHE A 258 9.463 40.201 25.392 1.00 31.31 C ATOM 1856 CZ PHE A 258 10.443 39.658 26.205 1.00 28.43 C ATOM 1857 H PHE A 258 6.428 38.197 29.316 1.00 0.00 H ATOM 1858 N VAL A 259 3.150 38.799 27.231 1.00 11.32 N ATOM 1859 CA VAL A 259 1.835 38.184 27.371 1.00 10.96 C ATOM 1860 C VAL A 259 1.283 37.979 25.977 1.00 12.85 C ATOM 1861 O VAL A 259 1.138 38.946 25.216 1.00 14.89 O ATOM 1862 CB VAL A 259 0.872 39.036 28.210 1.00 11.33 C ATOM 1863 CG1 VAL A 259 -0.490 38.344 28.302 1.00 9.20 C ATOM 1864 CG2 VAL A 259 1.450 39.292 29.586 1.00 13.96 C ATOM 1865 H VAL A 259 3.231 39.704 26.725 1.00 0.00 H ATOM 1866 N ILE A 260 0.972 36.731 25.650 1.00 11.52 N ATOM 1867 CA ILE A 260 0.502 36.351 24.321 1.00 9.53 C ATOM 1868 C ILE A 260 -0.997 36.098 24.403 1.00 6.68 C ATOM 1869 O ILE A 260 -1.418 35.180 25.120 1.00 7.48 O ATOM 1870 CB ILE A 260 1.227 35.107 23.792 1.00 10.02 C ATOM 1871 CG1 ILE A 260 2.738 35.188 24.066 1.00 15.93 C ATOM 1872 CG2 ILE A 260 0.887 34.900 22.323 1.00 10.81 C ATOM 1873 CD1 ILE A 260 3.424 36.376 23.452 1.00 15.46 C ATOM 1874 H ILE A 260 1.067 35.990 26.373 1.00 0.00 H ATOM 1875 N PRO A 261 -1.821 36.858 23.700 1.00 7.75 N ATOM 1876 CA PRO A 261 -3.250 36.555 23.666 1.00 8.73 C ATOM 1877 C PRO A 261 -3.518 35.395 22.717 1.00 9.06 C ATOM 1878 O PRO A 261 -2.679 35.023 21.894 1.00 10.64 O ATOM 1879 CB PRO A 261 -3.860 37.857 23.143 1.00 9.76 C ATOM 1880 CG PRO A 261 -2.803 38.347 22.195 1.00 9.92 C ATOM 1881 CD PRO A 261 -1.483 37.991 22.817 1.00 8.64 C ATOM 1882 N GLY A 262 -4.720 34.833 22.836 1.00 6.88 N ATOM 1883 CA GLY A 262 -5.116 33.782 21.909 1.00 7.08 C ATOM 1884 C GLY A 262 -5.183 34.257 20.468 1.00 8.04 C ATOM 1885 O GLY A 262 -5.032 33.458 19.538 1.00 7.58 O ATOM 1886 H GLY A 262 -5.371 35.143 23.586 1.00 0.00 H ATOM 1887 N HIS A 263 -5.403 35.559 20.264 1.00 6.19 N ATOM 1888 CA HIS A 263 -5.526 36.131 18.929 1.00 5.60 C ATOM 1889 C HIS A 263 -4.925 37.526 18.955 1.00 7.41 C ATOM 1890 O HIS A 263 -5.256 38.318 19.839 1.00 9.71 O ATOM 1891 CB HIS A 263 -6.993 36.220 18.468 1.00 6.11 C ATOM 1892 CG HIS A 263 -7.773 34.951 18.624 1.00 8.23 C ATOM 1893 ND1 HIS A 263 -7.840 33.997 17.631 1.00 6.50 N ATOM 1894 CD2 HIS A 263 -8.541 34.491 19.642 1.00 8.83 C ATOM 1895 CE1 HIS A 263 -8.618 33.005 18.029 1.00 12.76 C ATOM 1896 NE2 HIS A 263 -9.055 33.280 19.246 1.00 14.03 N ATOM 1897 H HIS A 263 -5.490 36.187 21.088 1.00 0.00 H ATOM 1898 N GLY A 264 -4.046 37.821 18.006 1.00 7.77 N ATOM 1899 CA GLY A 264 -3.538 39.169 17.841 1.00 8.52 C ATOM 1900 C GLY A 264 -2.210 39.418 18.525 1.00 10.56 C ATOM 1901 O GLY A 264 -1.418 38.514 18.794 1.00 13.35 O ATOM 1902 H GLY A 264 -3.715 37.070 17.367 1.00 0.00 H ATOM 1903 N LEU A 265 -1.986 40.680 18.829 1.00 12.03 N ATOM 1904 CA LEU A 265 -0.650 41.166 19.143 1.00 12.19 C ATOM 1905 C LEU A 265 -0.293 40.889 20.597 1.00 11.67 C ATOM 1906 O LEU A 265 -1.107 41.142 21.493 1.00 10.80 O ATOM 1907 CB LEU A 265 -0.546 42.670 18.868 1.00 12.80 C ATOM 1908 CG LEU A 265 -0.771 43.143 17.431 1.00 24.20 C ATOM 1909 CD1 LEU A 265 -0.588 44.655 17.334 1.00 27.56 C ATOM 1910 CD2 LEU A 265 0.143 42.406 16.446 1.00 27.99 C ATOM 1911 H LEU A 265 -2.784 41.346 18.845 1.00 0.00 H ATOM 1912 N PRO A 277 0.905 40.388 20.869 1.00 12.48 N ATOM 1913 CA PRO A 277 1.364 40.286 22.257 1.00 14.34 C ATOM 1914 C PRO A 277 1.530 41.659 22.895 1.00 14.22 C ATOM 1915 O PRO A 277 1.528 42.709 22.241 1.00 14.04 O ATOM 1916 CB PRO A 277 2.707 39.555 22.145 1.00 17.14 C ATOM 1917 CG PRO A 277 3.084 39.610 20.694 1.00 19.22 C ATOM 1918 CD PRO A 277 1.802 39.691 19.931 1.00 15.39 C ATOM 1919 N GLY A 278 1.692 41.639 24.199 1.00 12.92 N ATOM 1920 CA GLY A 278 1.894 42.861 24.955 1.00 10.40 C ATOM 1921 C GLY A 278 2.442 42.540 26.313 1.00 12.09 C ATOM 1922 O GLY A 278 3.102 41.517 26.504 1.00 12.49 O ATOM 1923 H GLY A 278 1.675 40.728 24.700 1.00 0.00 H ATOM 1924 N GLY A 279 2.176 43.428 27.264 1.00 13.44 N ATOM 1925 CA GLY A 279 2.562 43.236 28.645 1.00 14.14 C ATOM 1926 C GLY A 279 1.406 42.756 29.495 1.00 10.73 C ATOM 1927 O GLY A 279 0.366 42.321 28.990 1.00 12.38 O ATOM 1928 H GLY A 279 1.669 44.298 27.005 1.00 0.00 H ATOM 1929 N LEU A 280 1.577 42.871 30.815 1.00 11.07 N ATOM 1930 CA LEU A 280 0.544 42.414 31.735 1.00 10.24 C ATOM 1931 C LEU A 280 -0.711 43.274 31.691 1.00 12.99 C ATOM 1932 O LEU A 280 -1.734 42.856 32.248 1.00 14.60 O ATOM 1933 CB LEU A 280 1.094 42.358 33.164 1.00 9.66 C ATOM 1934 CG LEU A 280 1.836 41.058 33.534 1.00 13.61 C ATOM 1935 CD1 LEU A 280 2.647 41.232 34.821 1.00 13.04 C ATOM 1936 CD2 LEU A 280 0.903 39.867 33.669 1.00 15.94 C ATOM 1937 H LEU A 280 2.453 43.289 31.188 1.00 0.00 H ATOM 1938 N ASP A 281 -0.653 44.446 31.039 1.00 11.79 N ATOM 1939 CA ASP A 281 -1.842 45.277 30.852 1.00 11.42 C ATOM 1940 C ASP A 281 -2.955 44.523 30.137 1.00 10.80 C ATOM 1941 O ASP A 281 -4.136 44.850 30.306 1.00 11.01 O ATOM 1942 CB ASP A 281 -1.495 46.538 30.054 1.00 12.75 C ATOM 1943 CG ASP A 281 -0.762 47.578 30.882 1.00 15.08 C ATOM 1944 OD1 ASP A 281 -0.493 47.319 32.073 1.00 16.25 O ATOM 1945 OD2 ASP A 281 -0.450 48.657 30.331 1.00 14.05 O ATOM 1946 H ASP A 281 0.259 44.771 30.658 1.00 0.00 H ATOM 1947 N LEU A 282 -2.603 43.523 29.326 1.00 11.66 N ATOM 1948 CA LEU A 282 -3.619 42.785 28.588 1.00 8.63 C ATOM 1949 C LEU A 282 -4.591 42.086 29.530 1.00 8.59 C ATOM 1950 O LEU A 282 -5.738 41.829 29.144 1.00 10.01 O ATOM 1951 CB LEU A 282 -2.965 41.778 27.646 1.00 4.32 C ATOM 1952 CG LEU A 282 -2.629 42.243 26.222 1.00 7.08 C ATOM 1953 CD1 LEU A 282 -1.495 43.265 26.211 1.00 10.87 C ATOM 1954 CD2 LEU A 282 -2.246 41.015 25.376 1.00 8.59 C ATOM 1955 H LEU A 282 -1.600 43.270 29.221 1.00 0.00 H ATOM 1956 N LEU A 283 -4.169 41.807 30.765 1.00 6.68 N ATOM 1957 CA LEU A 283 -5.065 41.140 31.711 1.00 6.46 C ATOM 1958 C LEU A 283 -6.171 42.083 32.158 1.00 11.46 C ATOM 1959 O LEU A 283 -7.361 41.754 32.064 1.00 11.70 O ATOM 1960 CB LEU A 283 -4.280 40.633 32.922 1.00 9.16 C ATOM 1961 CG LEU A 283 -3.679 39.222 32.857 1.00 12.73 C ATOM 1962 CD1 LEU A 283 -2.793 39.064 31.638 1.00 16.25 C ATOM 1963 CD2 LEU A 283 -2.886 38.965 34.125 1.00 11.59 C ATOM 1964 H LEU A 283 -3.204 42.063 31.055 1.00 0.00 H ATOM 1965 N LYS A 284 -5.793 43.262 32.657 1.00 12.25 N ATOM 1966 CA LYS A 284 -6.791 44.256 33.040 1.00 10.85 C ATOM 1967 C LYS A 284 -7.626 44.688 31.843 1.00 9.45 C ATOM 1968 O LYS A 284 -8.831 44.934 31.981 1.00 10.34 O ATOM 1969 CB LYS A 284 -6.112 45.462 33.686 1.00 14.41 C ATOM 1970 CG LYS A 284 -7.085 46.528 34.161 1.00 15.06 C ATOM 1971 CD LYS A 284 -8.111 45.961 35.144 1.00 16.32 C ATOM 1972 CE LYS A 284 -8.782 47.074 35.938 1.00 18.46 C ATOM 1973 NZ LYS A 284 -9.768 46.542 36.926 1.00 21.72 N ATOM 1974 HZ1 LYS A 284 -10.507 46.010 36.424 1.00 0.00 H ATOM 1975 HZ2 LYS A 284 -9.281 45.913 37.596 1.00 0.00 H ATOM 1976 HZ3 LYS A 284 -10.200 47.334 37.443 1.00 0.00 H ATOM 1977 H LYS A 284 -4.781 43.474 32.774 1.00 0.00 H ATOM 1978 N HIS A 285 -7.014 44.755 30.658 1.00 8.20 N ATOM 1979 CA HIS A 285 -7.778 45.070 29.455 1.00 10.71 C ATOM 1980 C HIS A 285 -8.897 44.063 29.231 1.00 11.61 C ATOM 1981 O HIS A 285 -10.032 44.438 28.915 1.00 14.69 O ATOM 1982 CB HIS A 285 -6.872 45.104 28.223 1.00 9.99 C ATOM 1983 CG HIS A 285 -7.642 45.138 26.945 1.00 11.03 C ATOM 1984 ND1 HIS A 285 -8.284 46.275 26.500 1.00 12.56 N ATOM 1985 CD2 HIS A 285 -7.933 44.165 26.051 1.00 11.68 C ATOM 1986 CE1 HIS A 285 -8.917 46.007 25.372 1.00 12.49 C ATOM 1987 NE2 HIS A 285 -8.714 44.735 25.074 1.00 12.48 N ATOM 1988 H HIS A 285 -5.991 44.582 30.592 1.00 0.00 H ATOM 1989 N THR A 286 -8.590 42.771 29.362 1.00 9.57 N ATOM 1990 CA THR A 286 -9.620 41.761 29.135 1.00 10.04 C ATOM 1991 C THR A 286 -10.727 41.875 30.175 1.00 11.07 C ATOM 1992 O THR A 286 -11.917 41.767 29.848 1.00 10.89 O ATOM 1993 CB THR A 286 -8.993 40.365 29.143 1.00 6.29 C ATOM 1994 OG1 THR A 286 -7.932 40.319 28.178 1.00 9.26 O ATOM 1995 CG2 THR A 286 -10.017 39.302 28.799 1.00 7.46 C ATOM 1996 HG1 THR A 286 -7.246 40.993 28.411 1.00 0.00 H ATOM 1997 H THR A 286 -7.625 42.486 29.624 1.00 0.00 H ATOM 1998 N THR A 287 -10.351 42.110 31.430 1.00 8.17 N ATOM 1999 CA THR A 287 -11.342 42.316 32.480 1.00 8.07 C ATOM 2000 C THR A 287 -12.265 43.481 32.136 1.00 9.10 C ATOM 2001 O THR A 287 -13.491 43.373 32.257 1.00 11.49 O ATOM 2002 CB THR A 287 -10.634 42.558 33.814 1.00 11.22 C ATOM 2003 OG1 THR A 287 -10.040 41.328 34.259 1.00 13.99 O ATOM 2004 CG2 THR A 287 -11.612 43.064 34.863 1.00 14.43 C ATOM 2005 HG1 THR A 287 -9.580 41.479 35.123 1.00 0.00 H ATOM 2006 H THR A 287 -9.338 42.147 31.665 1.00 0.00 H ATOM 2007 N ASN A 288 -11.683 44.601 31.693 1.00 9.15 N ATOM 2008 CA ASN A 288 -12.479 45.769 31.307 1.00 8.44 C ATOM 2009 C ASN A 288 -13.496 45.416 30.234 1.00 10.95 C ATOM 2010 O ASN A 288 -14.658 45.841 30.292 1.00 9.89 O ATOM 2011 CB ASN A 288 -11.575 46.883 30.777 1.00 6.94 C ATOM 2012 CG ASN A 288 -10.695 47.509 31.837 1.00 12.41 C ATOM 2013 OD1 ASN A 288 -10.863 47.294 33.041 1.00 14.69 O ATOM 2014 ND2 ASN A 288 -9.755 48.331 31.384 1.00 11.80 N ATOM 2015 HD22 ASN A 288 -9.647 48.484 30.361 1.00 0.00 H ATOM 2016 HD21 ASN A 288 -9.127 48.821 32.052 1.00 0.00 H ATOM 2017 H ASN A 288 -10.646 44.644 31.621 1.00 0.00 H ATOM 2018 N VAL A 289 -13.054 44.683 29.211 1.00 10.21 N ATOM 2019 CA VAL A 289 -13.926 44.341 28.095 1.00 9.23 C ATOM 2020 C VAL A 289 -15.014 43.378 28.551 1.00 9.97 C ATOM 2021 O VAL A 289 -16.195 43.547 28.225 1.00 10.60 O ATOM 2022 CB VAL A 289 -13.096 43.750 26.936 1.00 9.31 C ATOM 2023 CG1 VAL A 289 -14.008 43.139 25.876 1.00 10.77 C ATOM 2024 CG2 VAL A 289 -12.191 44.817 26.310 1.00 6.08 C ATOM 2025 H VAL A 289 -12.069 44.350 29.210 1.00 0.00 H ATOM 2026 N VAL A 290 -14.629 42.346 29.304 1.00 9.17 N ATOM 2027 CA VAL A 290 -15.608 41.377 29.792 1.00 12.30 C ATOM 2028 C VAL A 290 -16.643 42.052 30.686 1.00 13.51 C ATOM 2029 O VAL A 290 -17.848 41.804 30.558 1.00 10.24 O ATOM 2030 CB VAL A 290 -14.895 40.226 30.523 1.00 13.80 C ATOM 2031 CG1 VAL A 290 -15.908 39.396 31.294 1.00 12.78 C ATOM 2032 CG2 VAL A 290 -14.123 39.369 29.522 1.00 13.10 C ATOM 2033 H VAL A 290 -13.624 42.230 29.546 1.00 0.00 H ATOM 2034 N LYS A 291 -16.197 42.921 31.600 1.00 12.24 N ATOM 2035 CA LYS A 291 -17.144 43.616 32.470 1.00 11.63 C ATOM 2036 C LYS A 291 -18.082 44.514 31.668 1.00 12.26 C ATOM 2037 O LYS A 291 -19.278 44.612 31.978 1.00 14.85 O ATOM 2038 CB LYS A 291 -16.394 44.434 33.523 1.00 9.47 C ATOM 2039 CG LYS A 291 -15.813 43.612 34.642 1.00 11.39 C ATOM 2040 CD LYS A 291 -15.356 44.503 35.797 1.00 17.74 C ATOM 2041 CE LYS A 291 -14.760 43.683 36.932 1.00 19.49 C ATOM 2042 NZ LYS A 291 -14.583 44.478 38.193 1.00 20.33 N ATOM 2043 HZ1 LYS A 291 -13.945 45.279 38.010 1.00 0.00 H ATOM 2044 HZ2 LYS A 291 -15.507 44.835 38.509 1.00 0.00 H ATOM 2045 HZ3 LYS A 291 -14.174 43.869 38.931 1.00 0.00 H ATOM 2046 H LYS A 291 -15.177 43.102 31.692 1.00 0.00 H ATOM 2047 N ALA A 292 -17.558 45.192 30.641 1.00 11.78 N ATOM 2048 CA ALA A 292 -18.419 46.007 29.790 1.00 12.08 C ATOM 2049 C ALA A 292 -19.440 45.143 29.060 1.00 13.17 C ATOM 2050 O ALA A 292 -20.608 45.527 28.933 1.00 13.29 O ATOM 2051 CB ALA A 292 -17.575 46.822 28.797 1.00 10.74 C ATOM 2052 H ALA A 292 -16.537 45.138 30.449 1.00 0.00 H ATOM 2053 N HIS A 293 -19.026 43.958 28.592 1.00 12.07 N ATOM 2054 CA HIS A 293 -19.976 43.058 27.944 1.00 15.53 C ATOM 2055 C HIS A 293 -21.030 42.568 28.927 1.00 17.75 C ATOM 2056 O HIS A 293 -22.209 42.438 28.575 1.00 17.60 O ATOM 2057 CB HIS A 293 -19.249 41.864 27.325 1.00 14.02 C ATOM 2058 CG HIS A 293 -20.160 40.938 26.585 1.00 20.90 C ATOM 2059 ND1 HIS A 293 -20.626 41.212 25.314 1.00 22.18 N ATOM 2060 CD2 HIS A 293 -20.712 39.755 26.943 1.00 21.22 C ATOM 2061 CE1 HIS A 293 -21.416 40.229 24.919 1.00 21.93 C ATOM 2062 NE2 HIS A 293 -21.486 39.334 25.889 1.00 23.74 N ATOM 2063 H HIS A 293 -18.029 43.679 28.690 1.00 0.00 H ATOM 2064 N THR A 294 -20.612 42.277 30.160 1.00 15.55 N ATOM 2065 CA THR A 294 -21.545 41.834 31.193 1.00 16.13 C ATOM 2066 C THR A 294 -22.684 42.829 31.365 1.00 15.63 C ATOM 2067 O THR A 294 -23.847 42.441 31.518 1.00 20.71 O ATOM 2068 CB THR A 294 -20.785 41.639 32.504 1.00 18.45 C ATOM 2069 OG1 THR A 294 -19.869 40.541 32.360 1.00 20.10 O ATOM 2070 CG2 THR A 294 -21.738 41.375 33.660 1.00 18.32 C ATOM 2071 HG1 THR A 294 -19.375 40.412 33.208 1.00 0.00 H ATOM 2072 H THR A 294 -19.602 42.367 30.390 1.00 0.00 H ATOM 2073 N ASN A 295 -22.372 44.116 31.302 1.00 14.82 N ATOM 2074 CA ASN A 295 -23.350 45.173 31.488 1.00 19.32 C ATOM 2075 C ASN A 295 -24.082 45.526 30.198 1.00 26.52 C ATOM 2076 O ASN A 295 -24.875 46.474 30.191 1.00 31.49 O ATOM 2077 CB ASN A 295 -22.660 46.405 32.078 1.00 19.03 C ATOM 2078 CG ASN A 295 -22.199 46.178 33.520 1.00 19.41 C ATOM 2079 OD1 ASN A 295 -22.608 45.208 34.166 1.00 20.74 O ATOM 2080 ND2 ASN A 295 -21.362 47.076 34.031 1.00 18.88 N ATOM 2081 HD22 ASN A 295 -21.043 47.878 33.451 1.00 0.00 H ATOM 2082 HD21 ASN A 295 -21.027 46.976 35.010 1.00 0.00 H ATOM 2083 H ASN A 295 -21.384 44.380 31.111 1.00 0.00 H ATOM 2084 N ARG A 296 -23.846 44.775 29.121 1.00 30.69 N ATOM 2085 CA ARG A 296 -24.455 45.024 27.813 1.00 36.62 C ATOM 2086 C ARG A 296 -24.113 46.423 27.302 1.00 40.83 C ATOM 2087 O ARG A 296 -22.938 46.767 27.137 1.00 40.65 O ATOM 2088 CB ARG A 296 -25.975 44.843 27.871 1.00 37.62 C ATOM 2089 CG ARG A 296 -26.427 43.422 28.163 1.00 43.25 C ATOM 2090 CD ARG A 296 -27.770 43.417 28.902 1.00 52.07 C ATOM 2091 NE ARG A 296 -27.616 43.708 30.330 1.00 58.23 N ATOM 2092 CZ ARG A 296 -28.601 44.118 31.128 1.00 60.84 C ATOM 2093 NH1 ARG A 296 -28.364 44.359 32.412 1.00 59.09 N ATOM 2094 NH2 ARG A 296 -29.826 44.288 30.647 1.00 63.02 N ATOM 2095 HE ARG A 296 -26.672 43.586 30.750 1.00 0.00 H ATOM 2096 HH12 ARG A 296 -29.135 44.679 33.032 1.00 0.00 H ATOM 2097 HH11 ARG A 296 -27.407 44.228 32.798 1.00 0.00 H ATOM 2098 HH22 ARG A 296 -30.591 44.608 31.274 1.00 0.00 H ATOM 2099 HH21 ARG A 296 -30.021 44.101 29.643 1.00 0.00 H ATOM 2100 H ARG A 296 -23.195 43.970 29.215 1.00 0.00 H TER 2101 ARG A 296 HETATM 2102 ZN ZN A 1 -12.692 29.139 22.404 1.00 9.70 ZN HETATM 2103 ZN ZN A 2 -10.249 32.152 20.455 1.00 17.57 ZN HETATM 2104 ZN ZN A 3 1.045 8.634 24.160 1.00 15.02 ZN HETATM 2105 O HOH 4 9.507 15.014 7.707 1.00 27.84 O HETATM 2106 O HOH 5 9.610 18.380 26.336 1.00 31.56 O HETATM 2107 O HOH 6 -4.130 42.887 7.924 1.00 41.50 O HETATM 2108 O HOH 7 -16.998 8.108 25.304 1.00 41.54 O HETATM 2109 O HOH 8 10.227 19.400 13.634 1.00 18.43 O HETATM 2110 O HOH 9 2.818 17.536 34.585 1.00 34.11 O HETATM 2111 O HOH 10 0.314 48.246 26.894 1.00 19.06 O HETATM 2112 O HOH 11 1.460 50.156 29.910 1.00 23.60 O HETATM 2113 O HOH 12 16.501 16.441 18.643 1.00 28.02 O HETATM 2114 O HOH 13 5.404 32.902 38.692 1.00 19.91 O HETATM 2115 O HOH 14 -13.162 16.449 34.752 1.00 44.60 O HETATM 2116 O HOH 15 -13.739 41.148 19.940 1.00 22.91 O HETATM 2117 O HOH 16 6.316 38.106 9.532 1.00 37.45 O HETATM 2118 O HOH 17 -15.797 47.428 25.749 1.00 35.22 O HETATM 2119 O HOH 18 -9.064 22.310 32.095 1.00 14.69 O HETATM 2120 O HOH 19 -12.413 46.671 34.924 1.00 22.36 O HETATM 2121 O HOH 20 -0.254 47.398 34.607 1.00 47.49 O HETATM 2122 O HOH 21 -11.787 45.485 38.070 1.00 42.51 O HETATM 2123 O HOH 22 14.293 31.394 27.195 1.00 31.53 O HETATM 2124 O HOH 23 -1.818 12.127 20.197 1.00 10.48 O HETATM 2125 O HOH 24 -16.521 38.980 14.000 1.00 32.23 O HETATM 2126 O HOH 25 -20.565 32.943 19.770 1.00 39.37 O HETATM 2127 O HOH 26 -4.866 10.934 13.969 1.00 30.75 O HETATM 2128 O HOH 27 7.758 28.792 4.849 1.00 35.22 O HETATM 2129 O HOH 28 -14.179 25.505 37.450 1.00 48.18 O HETATM 2130 O HOH 29 9.915 33.806 35.173 1.00 27.48 O HETATM 2131 O HOH 30 -3.045 43.684 34.325 1.00 20.83 O HETATM 2132 O HOH 31 -6.592 10.305 28.536 1.00 13.74 O HETATM 2133 O HOH 32 -6.637 16.951 12.508 1.00 16.72 O HETATM 2134 O HOH 33 -7.393 36.377 22.558 1.00 8.03 O HETATM 2135 O HOH 34 -2.413 36.223 16.049 1.00 11.43 O HETATM 2136 O HOH 35 6.032 41.919 35.324 1.00 21.39 O HETATM 2137 O HOH 36 -4.529 28.635 16.481 1.00 12.50 O HETATM 2138 O HOH 37 3.361 27.511 40.697 1.00 29.51 O HETATM 2139 O HOH 38 -15.413 37.489 38.498 1.00 13.66 O HETATM 2140 O HOH 39 -6.847 29.876 27.852 1.00 12.44 O HETATM 2141 O HOH 40 -20.599 46.887 25.933 1.00 30.97 O HETATM 2142 O HOH 41 -1.324 22.125 4.919 1.00 17.87 O HETATM 2143 O HOH 42 -19.026 20.642 24.682 1.00 24.30 O HETATM 2144 O HOH 43 14.993 20.926 8.956 1.00 22.61 O HETATM 2145 O HOH 44 -3.494 30.188 7.898 1.00 20.77 O HETATM 2146 O HOH 45 -9.730 40.806 36.851 1.00 26.28 O HETATM 2147 O HOH 46 -6.094 25.467 43.661 1.00 23.01 O HETATM 2148 O HOH 47 10.293 39.604 35.260 1.00 47.35 O HETATM 2149 O HOH 48 -15.621 35.678 42.113 1.00 29.41 O HETATM 2150 O HOH 49 -6.500 10.234 15.153 1.00 39.33 O HETATM 2151 O HOH 50 3.100 18.429 7.951 1.00 31.06 O HETATM 2152 O HOH 51 1.634 38.104 43.165 1.00 22.01 O HETATM 2153 O HOH 52 -6.625 24.307 8.742 1.00 17.78 O HETATM 2154 O HOH 53 -12.468 21.553 36.793 1.00 31.86 O HETATM 2155 O HOH 54 -13.109 32.182 38.743 1.00 11.71 O HETATM 2156 O HOH 55 -17.279 13.057 20.086 1.00 26.16 O HETATM 2157 O HOH 56 -7.269 28.885 25.362 1.00 8.28 O HETATM 2158 O HOH 57 -18.312 39.894 34.593 1.00 23.01 O HETATM 2159 O HOH 58 -17.006 26.252 28.657 1.00 12.22 O HETATM 2160 O HOH 59 -2.692 29.263 42.896 1.00 29.11 O HETATM 2161 O HOH 60 -9.834 35.317 23.011 1.00 11.57 O HETATM 2162 O HOH 61 -21.651 48.550 28.713 1.00 29.35 O HETATM 2163 O HOH 62 -4.227 40.513 11.725 1.00 36.93 O HETATM 2164 O HOH 63 3.211 42.696 10.493 1.00 30.96 O HETATM 2165 O HOH 64 -14.059 35.193 23.800 1.00 12.46 O HETATM 2166 O HOH 65 -20.520 30.165 37.592 1.00 28.80 O HETATM 2167 O HOH 66 -13.201 12.326 26.247 1.00 28.03 O HETATM 2168 O HOH 67 -1.755 20.701 41.034 1.00 28.98 O HETATM 2169 O HOH 68 5.255 30.045 38.524 1.00 27.66 O HETATM 2170 O HOH 69 -1.545 38.507 14.546 1.00 13.95 O HETATM 2171 O HOH 70 -22.915 26.677 25.773 1.00 47.95 O HETATM 2172 O HOH 71 -15.500 47.920 31.844 1.00 16.31 O HETATM 2173 O HOH 72 -19.778 31.331 39.685 1.00 20.27 O HETATM 2174 O HOH 73 -20.987 34.732 22.069 1.00 19.63 O HETATM 2175 O HOH 74 -15.156 13.609 18.596 1.00 18.09 O HETATM 2176 O HOH 75 -18.164 41.863 19.389 1.00 40.75 O HETATM 2177 O HOH 76 -7.817 39.247 17.116 1.00 26.66 O HETATM 2178 O HOH 77 -7.553 38.671 21.294 1.00 9.73 O HETATM 2179 O HOH 78 -11.094 48.292 38.573 1.00 37.55 O HETATM 2180 O HOH 79 11.244 27.236 31.250 1.00 19.82 O HETATM 2181 O HOH 80 7.553 17.900 24.557 1.00 25.35 O HETATM 2182 O HOH 81 -9.694 20.958 9.794 1.00 26.76 O HETATM 2183 O HOH 82 -22.616 23.632 21.705 1.00 36.07 O HETATM 2184 O HOH 83 -9.688 21.860 34.806 1.00 14.17 O HETATM 2185 O HOH 84 -6.864 21.285 28.641 1.00 8.83 O HETATM 2186 O HOH 85 2.431 44.004 13.729 1.00 39.78 O HETATM 2187 O HOH 86 15.221 24.182 6.374 1.00 21.31 O HETATM 2188 O HOH 87 -0.141 16.955 34.821 1.00 44.85 O HETATM 2189 O HOH 88 -6.690 17.967 35.824 1.00 13.21 O HETATM 2190 O HOH 89 5.787 11.773 21.003 1.00 35.84 O HETATM 2191 O HOH 90 -14.072 31.614 41.908 1.00 22.57 O HETATM 2192 O HOH 91 -4.426 43.822 16.160 1.00 25.37 O HETATM 2193 O HOH 92 4.516 13.604 29.351 1.00 33.25 O HETATM 2194 O HOH 93 -2.228 43.578 22.230 1.00 9.04 O HETATM 2195 O HOH 94 -18.561 43.590 23.983 1.00 31.21 O HETATM 2196 O HOH 95 -8.974 11.126 32.099 1.00 21.93 O HETATM 2197 O HOH 96 -3.675 44.593 19.974 1.00 9.20 O HETATM 2198 O HOH 97 -3.043 22.745 43.854 1.00 48.08 O HETATM 2199 O HOH 98 -21.193 20.331 18.282 1.00 30.84 O HETATM 2200 O HOH 99 6.516 25.059 5.655 1.00 26.26 O HETATM 2201 O HOH 100 -5.779 15.301 38.928 1.00 31.38 O HETATM 2202 O HOH 101 -15.623 19.255 31.797 1.00 31.03 O HETATM 2203 O HOH 102 -1.843 29.463 15.343 1.00 13.36 O HETATM 2204 O HOH 103 7.450 19.365 12.908 1.00 20.37 O HETATM 2205 O HOH 104 -9.796 26.700 44.108 1.00 47.73 O HETATM 2206 O HOH 105 -18.109 14.948 15.294 1.00 22.42 O HETATM 2207 O HOH 106 4.252 42.783 31.724 1.00 30.29 O HETATM 2208 O HOH 107 4.155 25.187 6.111 1.00 23.40 O HETATM 2209 O HOH 108 -11.989 19.512 16.410 1.00 13.50 O HETATM 2210 O HOH 109 9.600 44.695 33.348 1.00 48.46 O HETATM 2211 O HOH 110 -19.358 38.343 38.944 1.00 13.66 O HETATM 2212 O HOH 111 -20.306 48.754 32.001 1.00 40.59 O HETATM 2213 O HOH 112 0.306 14.273 10.262 1.00 19.78 O HETATM 2214 O HOH 113 -8.099 49.843 33.131 1.00 8.75 O HETATM 2215 O HOH 114 -3.448 18.446 22.320 1.00 7.81 O HETATM 2216 O HOH 115 -13.996 29.188 38.001 1.00 21.45 O HETATM 2217 O HOH 116 17.123 25.372 15.446 1.00 44.30 O HETATM 2218 O HOH 117 -10.103 43.770 37.545 1.00 53.38 O HETATM 2219 O HOH 118 12.629 27.340 27.565 1.00 53.36 O HETATM 2220 O HOH 119 2.808 42.677 37.979 1.00 18.93 O HETATM 2221 O HOH 120 -3.421 33.043 41.931 1.00 31.27 O HETATM 2222 O HOH 121 -1.293 32.558 43.046 1.00 31.72 O HETATM 2223 O HOH 122 -3.182 10.922 33.141 1.00 34.05 O HETATM 2224 O HOH 123 -9.941 12.960 17.979 1.00 24.67 O HETATM 2225 O HOH 124 -14.378 16.180 14.625 1.00 20.67 O HETATM 2226 O HOH 125 -17.329 28.532 37.168 1.00 27.84 O HETATM 2227 O HOH 126 -6.782 26.539 6.778 1.00 32.11 O HETATM 2228 O HOH 127 -10.761 14.830 12.231 1.00 51.10 O HETATM 2229 O HOH 128 4.123 19.791 38.902 1.00 33.09 O HETATM 2230 O HOH 129 -13.716 27.127 14.242 1.00 30.53 O HETATM 2231 O HOH 130 -0.040 45.066 22.860 1.00 11.80 O HETATM 2232 O HOH 131 7.579 31.721 9.734 1.00 29.28 O HETATM 2233 O HOH 132 3.656 43.755 20.562 1.00 37.34 O HETATM 2234 O HOH 133 -16.828 30.952 24.648 1.00 11.11 O HETATM 2235 O HOH 134 -23.665 37.768 24.767 1.00 38.29 O HETATM 2236 O HOH 135 -7.217 20.083 43.007 1.00 39.44 O HETATM 2237 O HOH 136 -18.340 28.186 21.195 1.00 23.15 O HETATM 2238 O HOH 137 3.206 27.915 6.092 1.00 22.31 O HETATM 2239 O HOH 138 -16.238 23.968 19.572 1.00 22.09 O HETATM 2240 O HOH 139 -11.490 13.219 30.194 1.00 22.40 O HETATM 2241 O HOH 140 1.886 45.884 30.533 1.00 32.71 O HETATM 2242 O HOH 141 -16.487 32.369 5.796 1.00 28.40 O HETATM 2243 O HOH 142 6.190 43.913 30.089 1.00 30.19 O HETATM 2244 O HOH 143 18.387 22.271 21.091 1.00 43.67 O HETATM 2245 O HOH 144 13.574 30.893 14.688 1.00 36.23 O HETATM 2246 O HOH 145 0.014 40.921 41.228 1.00 34.95 O HETATM 2247 O HOH 146 -18.870 24.010 30.509 1.00 33.08 O HETATM 2248 O HOH 147 -14.850 25.935 18.184 1.00 25.91 O HETATM 2249 O HOH 148 -17.060 22.756 16.734 1.00 31.52 O HETATM 2250 O HOH 149 -16.093 27.867 19.246 1.00 26.54 O HETATM 2251 O HOH 150 -13.963 41.935 39.598 1.00 21.40 O HETATM 2252 O HOH 151 1.073 45.930 26.084 1.00 21.62 O HETATM 2253 O HOH 152 -12.527 22.826 34.298 1.00 28.60 O HETATM 2254 O HOH 153 -12.524 39.142 41.701 1.00 35.31 O HETATM 2255 O HOH 154 -17.429 44.762 25.797 1.00 26.85 O HETATM 2256 O HOH 155 0.481 7.478 11.621 1.00 35.17 O HETATM 2257 O HOH 156 6.358 42.990 26.295 1.00 34.98 O HETATM 2258 O HOH 157 -0.633 14.427 34.145 1.00 27.74 O HETATM 2259 O HOH 158 -8.322 22.350 7.628 1.00 28.76 O HETATM 2260 O HOH 159 -7.840 42.402 36.002 1.00 32.72 O HETATM 2261 O HOH 160 0.509 41.583 2.445 1.00 35.43 O HETATM 2262 O HOH 161 -21.825 29.464 28.860 1.00 37.26 O HETATM 2263 O HOH 162 7.976 16.069 14.956 1.00 26.06 O HETATM 2264 O HOH 163 18.390 19.717 13.806 1.00 50.09 O HETATM 2265 O HOH 164 -22.575 33.318 28.052 1.00 33.93 O HETATM 2266 O HOH 165 0.220 44.204 36.345 1.00 32.67 O HETATM 2267 O HOH 166 16.521 31.464 31.834 1.00 51.18 O HETATM 2268 O HOH 167 -7.163 30.844 44.084 1.00 33.56 O HETATM 2269 O HOH 168 -21.465 24.056 24.195 1.00 44.54 O HETATM 2270 O HOH 169 -0.856 24.415 42.480 1.00 45.63 O HETATM 2271 O HOH 170 11.035 35.642 14.463 1.00 30.67 O HETATM 2272 O HOH 171 -11.586 18.822 41.946 1.00 32.65 O HETATM 2273 O HOH 172 10.077 16.602 30.171 1.00 42.10 O HETATM 2274 O HOH 173 -32.750 44.792 31.508 1.00 40.60 O HETATM 2275 O HOH 174 -15.061 18.094 33.439 1.00 36.76 O HETATM 2276 O HOH 175 12.842 26.567 33.030 1.00 34.78 O HETATM 2277 O HOH 176 -12.588 25.184 40.593 1.00 30.93 O HETATM 2278 O HOH 177 -22.614 26.562 22.715 1.00 45.75 O HETATM 2279 O HOH 178 6.304 41.966 19.676 1.00 40.80 O HETATM 2280 O HOH 179 7.627 12.061 17.717 1.00 43.37 O HETATM 2281 O HOH 180 -2.750 10.030 29.963 1.00 21.29 O HETATM 2282 O HOH 181 8.625 43.785 19.523 1.00 59.14 O HETATM 2283 O HOH 182 -8.923 35.888 42.320 1.00 22.59 O HETATM 2284 O HOH 183 12.424 21.707 32.327 1.00 32.12 O HETATM 2285 O HOH 184 4.003 44.404 15.607 1.00 32.53 O HETATM 2286 O HOH 185 4.303 23.598 39.867 1.00 43.79 O HETATM 2287 O HOH 186 1.801 12.057 9.668 1.00 22.17 O HETATM 2288 O HOH 187 -19.962 41.784 20.908 1.00 32.71 O HETATM 2289 O HOH 188 11.129 25.860 0.966 1.00 45.12 O HETATM 2290 O HOH 189 5.716 43.716 16.872 1.00 37.67 O HETATM 2291 O HOH 190 0.689 40.006 43.112 1.00 31.88 O HETATM 2292 O HOH 191 15.335 28.572 14.720 1.00 42.81 O HETATM 2293 O HOH 192 -8.207 15.630 37.279 1.00 34.72 O HETATM 2294 O HOH 193 -15.806 26.470 15.077 1.00 26.90 O HETATM 2295 O HOH 194 11.526 38.168 16.249 1.00 28.60 O HETATM 2296 O HOH 195 7.859 44.776 31.613 1.00 42.93 O HETATM 2297 O HOH 196 -17.892 29.541 8.073 1.00 44.45 O HETATM 2298 O HOH 197 -13.180 18.394 13.780 1.00 30.34 O HETATM 2299 O HOH 198 -12.410 9.939 25.195 1.00 32.98 O HETATM 2300 O HOH 199 8.533 44.398 35.596 1.00 30.17 O HETATM 2301 O HOH 200 -24.923 49.683 31.438 1.00 34.01 O HETATM 2302 O HOH 201 -11.519 25.133 8.576 1.00 43.18 O HETATM 2303 O HOH 202 5.025 45.330 26.651 1.00 49.08 O HETATM 2304 O HOH 203 8.297 13.482 26.150 1.00 44.18 O HETATM 2305 O HOH 204 0.751 9.612 8.919 1.00 45.06 O HETATM 2306 O HOH 205 -9.478 19.078 34.586 1.00 17.22 O HETATM 2307 O HOH 206 14.536 36.285 21.089 1.00 37.58 O HETATM 2308 O HOH 207 -28.568 47.010 28.784 1.00 50.67 O HETATM 2309 O HOH 208 6.046 34.492 41.370 1.00 40.53 O HETATM 2310 O HOH 209 13.381 38.416 20.128 1.00 36.15 O HETATM 2311 O HOH 210 14.539 26.931 25.974 1.00 47.74 O HETATM 2312 O HOH 211 -20.468 28.169 31.636 1.00 34.64 O HETATM 2313 O HOH 212 7.173 17.432 34.303 1.00 33.17 O HETATM 2314 O HOH 213 -15.931 13.015 16.230 1.00 24.42 O HETATM 2315 O HOH 214 12.937 16.424 13.589 1.00 43.01 O HETATM 2316 O HOH 215 -25.393 49.916 29.144 1.00 46.50 O HETATM 2317 O HOH 216 8.769 35.245 40.731 1.00 32.55 O HETATM 2318 O HOH 217 -5.189 13.155 10.162 1.00 35.74 O HETATM 2319 O HOH 218 -10.029 34.129 44.388 1.00 40.62 O HETATM 2320 O HOH 219 -3.852 17.902 6.436 1.00 40.85 O HETATM 2321 O HOH 220 -13.455 51.410 21.272 1.00 32.94 O HETATM 2322 O HOH 221 14.038 25.970 29.012 1.00 39.73 O HETATM 2323 O HOH 222 1.592 21.139 4.616 1.00 31.96 O HETATM 2324 O HOH 223 -2.898 46.354 34.780 1.00 27.57 O HETATM 2325 O HOH 224 -10.562 9.669 22.799 1.00 24.93 O HETATM 2326 O HOH 225 -13.886 12.212 28.571 1.00 22.91 O HETATM 2327 O HOH 226 -19.966 22.610 26.055 1.00 33.79 O HETATM 2328 O HOH 227 -17.963 48.364 32.940 1.00 31.64 O HETATM 2329 O HOH 228 -22.741 29.424 31.540 1.00 43.48 O HETATM 2330 O HOH 229 -18.276 24.655 17.934 1.00 38.97 O HETATM 2331 O HOH 230 -6.702 35.929 43.172 1.00 26.97 O HETATM 2332 O HOH 231 7.180 29.037 37.327 1.00 36.92 O HETATM 2333 O HOH 232 -3.267 8.332 14.382 1.00 37.22 O HETATM 2334 O HOH 233 -11.105 23.533 11.950 1.00 37.13 O HETATM 2335 O HOH 234 13.240 40.694 18.613 1.00 54.27 O HETATM 2336 O HOH 235 3.352 46.700 29.032 1.00 32.67 O HETATM 2337 O HOH 236 -22.740 24.648 27.071 1.00 53.02 O HETATM 2338 O HOH 237 5.371 17.210 8.890 1.00 37.58 O HETATM 2339 O HOH 238 2.616 19.142 5.019 1.00 38.16 O HETATM 2340 O HOH 239 -11.007 41.794 39.225 1.00 42.63 O HETATM 2341 O HOH 240 12.264 18.394 11.875 1.00 31.62 O HETATM 2342 O HOH 241 -17.676 27.470 15.750 1.00 30.68 O HETATM 2343 O HOH 242 -9.106 9.398 15.436 1.00 41.73 O HETATM 2344 O HOH 243 15.769 27.579 6.180 1.00 40.05 O HETATM 2345 O HOH 244 -14.764 50.964 23.088 1.00 41.53 O HETATM 2346 O HOH 245 -19.950 35.754 18.304 1.00 38.61 O HETATM 2347 O HOH 246 -10.078 10.147 18.769 1.00 36.19 O HETATM 2348 O HOH 247 -23.670 34.250 23.072 1.00 41.67 O HETATM 2349 O HOH 248 3.899 44.908 33.658 1.00 41.35 O HETATM 2350 O HOH 249 10.876 11.268 25.218 1.00 55.71 O HETATM 2351 O HOH 250 -15.760 40.066 38.891 1.00 13.89 O HETATM 2352 O HOH 251 18.582 36.188 17.134 1.00 37.45 O HETATM 2353 O HOH 252 -4.404 15.161 41.626 1.00 37.46 O HETATM 2354 O HOH 253 -19.229 24.673 28.458 1.00 26.61 O HETATM 2355 O HOH 254 -4.690 36.407 46.911 1.00 40.94 O HETATM 2356 O HOH 255 -7.329 15.625 10.222 1.00 26.94 O HETATM 2357 O HOH 256 10.248 15.716 13.473 1.00 43.33 O HETATM 2358 O HOH 257 -4.378 31.194 42.511 1.00 28.81 O HETATM 2359 O HOH 258 6.898 45.187 19.521 1.00 44.46 O HETATM 2360 O HOH 259 -6.966 7.765 29.953 1.00 30.22 O HETATM 2361 O HOH 260 -13.937 13.438 14.649 1.00 45.36 O HETATM 2362 O HOH 261 -10.116 38.395 42.617 1.00 36.16 O HETATM 2363 O HOH 262 -20.782 26.750 37.260 1.00 33.39 O HETATM 2364 O HOH 263 -3.360 40.736 14.105 1.00 19.15 O HETATM 2365 O HOH 264 6.267 16.478 13.777 1.00 35.96 O HETATM 2366 O HOH 265 -15.334 50.809 24.962 1.00 39.96 O HETATM 2367 O HOH 266 -15.073 48.127 34.349 1.00 43.06 O HETATM 2368 O HOH 267 -23.151 42.415 21.772 1.00 50.54 O HETATM 2369 O HOH 268 -11.609 11.902 32.364 1.00 46.89 O HETATM 2370 O HOH 269 -8.009 39.405 45.293 1.00 47.46 O HETATM 2371 O HOH 270 5.560 28.935 42.046 1.00 33.27 O HETATM 2372 O HOH 271 1.503 16.396 8.574 1.00 31.44 O HETATM 2373 O HOH 272 -16.846 26.266 36.262 1.00 31.31 O HETATM 2374 O HOH 273 -2.117 19.493 4.122 1.00 39.46 O HETATM 2375 O HOH 274 3.125 23.411 4.119 1.00 22.86 O HETATM 2376 O HOH 275 -19.762 25.806 35.724 1.00 33.11 O HETATM 2377 O HOH 276 -8.548 25.906 4.819 1.00 41.61 O HETATM 2378 O HOH 277 -5.331 33.536 43.694 1.00 38.24 O HETATM 2379 O HOH 278 -2.616 13.483 8.816 1.00 29.02 O HETATM 2380 O HOH 279 0.699 11.273 33.069 1.00 49.62 O HETATM 2381 O HOH 280 -19.905 13.763 28.731 1.00 37.53 O HETATM 2382 O HOH 281 19.116 23.463 17.131 1.00 37.13 O HETATM 2383 O HOH 282 -21.706 21.579 26.875 1.00 41.25 O HETATM 2384 O HOH 283 -2.463 35.951 48.460 1.00 40.40 O HETATM 2385 O HOH 284 -15.491 50.018 27.838 1.00 46.71 O HETATM 2386 O HOH 285 5.721 15.747 10.711 1.00 31.41 O HETATM 2387 O HOH 286 -18.664 25.569 13.669 1.00 36.13 O HETATM 2388 O HOH 287 6.517 40.023 22.448 1.00 31.19 O HETATM 2389 O HOH 288 7.904 30.757 41.352 1.00 35.65 O HETATM 2390 O HOH 289 -2.302 15.782 6.846 1.00 30.86 O HETATM 2391 O HOH 290 11.603 10.963 27.825 1.00 38.07 O HETATM 2392 O HOH 291 -0.138 16.058 6.324 1.00 38.87 O HETATM 2393 O HOH 292 -1.082 34.231 48.726 1.00 43.38 O HETATM 2394 O HOH 293 22.838 32.857 15.652 1.00 38.74 O HETATM 2395 C05 M A 3 -13.318 30.109 18.181 1.00 0.06 C HETATM 2396 C06 M A 3 -13.909 31.248 17.342 1.00 -0.00 C HETATM 2397 C07 M A 3 -13.105 32.119 16.676 1.00 -0.05 C HETATM 2398 C08 M A 3 -13.696 33.100 15.901 1.00 -0.07 C HETATM 2399 C09 M A 3 -15.072 33.216 15.813 1.00 -0.05 C HETATM 2400 C10 M A 3 -15.889 32.299 16.447 1.00 0.00 C HETATM 2401 C11 M A 3 -17.279 32.345 16.396 1.00 -0.04 C HETATM 2402 C12 M A 3 -18.041 31.439 17.104 1.00 -0.03 C HETATM 2403 C13 M A 3 -17.341 30.462 17.821 1.00 0.01 C HETATM 2404 N14 M A 3 -16.057 30.470 17.816 1.00 -0.30 N HETATM 2405 C15 M A 3 -15.302 31.344 17.192 1.00 0.05 C HETATM 2406 H8 M A 3 -17.880 29.703 18.377 1.00 0.08 H HETATM 2407 H7 M A 3 -19.124 31.482 17.105 1.00 0.07 H HETATM 2408 H6 M A 3 -17.768 33.101 15.793 1.00 0.08 H HETATM 2409 H5 M A 3 -15.511 34.029 15.245 1.00 0.06 H HETATM 2410 H4 M A 3 -13.069 33.792 15.351 1.00 0.06 H HETATM 2411 H3 M A 3 -12.026 32.046 16.751 1.00 0.06 H HETATM 2412 P02 M A 3 -12.779 30.645 19.921 1.00 0.07 P HETATM 2413 O01 M A 3 -13.896 31.130 20.694 1.00 -0.56 O HETATM 2414 O03 M A 3 -12.039 31.602 19.429 1.00 -0.56 O HETATM 2415 O04 M A 3 -12.095 29.591 20.365 1.00 -0.56 O HETATM 2416 H1 M A 3 -12.440 29.708 17.653 1.00 0.06 H HETATM 2417 H2 M A 3 -14.078 29.320 18.280 1.00 0.06 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 759 757 758 2102 CONECT 779 778 781 2102 CONECT 800 798 2103 CONECT 1117 1115 1116 2104 CONECT 1339 1337 1338 2102 CONECT 1500 1499 2103 CONECT 1896 1894 1895 2103 CONECT 2102 759 779 1339 CONECT 2103 800 1500 1896 CONECT 2104 1117 CONECT 2395 2396 2412 2416 2417 CONECT 2396 2395 2397 2405 CONECT 2397 2396 2398 2411 CONECT 2398 2397 2399 2410 CONECT 2399 2398 2400 2409 CONECT 2400 2399 2401 2405 CONECT 2401 2400 2402 2408 CONECT 2402 2401 2403 2407 CONECT 2403 2402 2404 2406 CONECT 2404 2403 2405 CONECT 2405 2396 2400 2404 CONECT 2406 2403 CONECT 2407 2402 CONECT 2408 2401 CONECT 2409 2399 CONECT 2410 2398 CONECT 2411 2397 CONECT 2412 2395 2413 2414 2415 CONECT 2413 2412 CONECT 2414 2412 CONECT 2415 2412 CONECT 2416 2395 CONECT 2417 2395 MASTER 0 0 0 0 0 0 0 0 2416 1 37 18 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6dd1
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%
5mm9
RCSB PDB
PDBbind
241aa, >5MM9_1|Chains... at 99%
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%
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
6d1k
RCSB PDB
PDBbind
M3Q
Entry Information
PDB ID
6dd1
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Beta-lactamase class B VIM-2
Ligand Name
M3Q
EC.Number
E.C.-.-.-.-
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Ki=22.3uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 8480-8496
Ligand Properties
Formula
C
1
0
H
1
1
NO
3
P
Molecular Weight
224.173
Exact Mass
224.048
No. of atoms
26
No. of bonds
27
Polar Surface Area
87.17
LOGP Value
0.00 (
Computed with XLOGP3
)
1.47 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
Canonical SMILES
OP(Cc1cccc2c1nccc2)(O)O
InChI String
InChI=1S/C10H12NO3P/c12-15(13,14)7-9-4-1-3-8-5-2-6-11-10(8)9/h1-6,12-15H,7H2
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):
Q9K2N0
Entrez Gene ID
NCBI Entrez Gene ID:
61723701
ASD
Information of known allosteric effects of PDB entries
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