Browse entries in the PDBbind-CN Database
HEADER 6JN6_COMPLEX COMPND 6JN6_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 BY A 0 40 ATOM 1 N GLU A 32 -52.424 2.013 64.970 1.00 24.78 N ATOM 2 CA GLU A 32 -50.987 1.789 65.039 1.00 36.76 C ATOM 3 C GLU A 32 -50.259 3.123 65.087 1.00 28.97 C ATOM 4 O GLU A 32 -50.576 4.051 64.358 1.00 21.21 O ATOM 5 CB GLU A 32 -50.501 0.973 63.854 1.00 32.07 C ATOM 6 HN3 GLU A 32 -52.648 2.558 64.113 1.00 0.00 H ATOM 7 HN2 GLU A 32 -52.732 2.543 65.810 1.00 0.00 H ATOM 8 HN1 GLU A 32 -52.915 1.097 64.937 1.00 0.00 H ATOM 9 N TYR A 33 -49.264 3.207 65.943 1.00 25.63 N ATOM 10 CA TYR A 33 -48.504 4.436 66.060 1.00 24.41 C ATOM 11 C TYR A 33 -47.611 4.615 64.836 1.00 19.50 C ATOM 12 O TYR A 33 -47.007 3.645 64.356 1.00 23.78 O ATOM 13 CB TYR A 33 -47.659 4.380 67.321 1.00 20.72 C ATOM 14 CG TYR A 33 -47.172 5.710 67.823 1.00 13.52 C ATOM 15 CD1 TYR A 33 -47.993 6.515 68.593 1.00 15.80 C ATOM 16 CD2 TYR A 33 -45.891 6.145 67.544 1.00 15.94 C ATOM 17 CE1 TYR A 33 -47.543 7.732 69.081 1.00 18.26 C ATOM 18 CE2 TYR A 33 -45.438 7.372 68.025 1.00 12.72 C ATOM 19 CZ TYR A 33 -46.274 8.144 68.788 1.00 12.41 C ATOM 20 OH TYR A 33 -45.835 9.349 69.285 1.00 14.80 O ATOM 21 HH TYR A 33 -46.560 9.772 69.809 1.00 0.00 H ATOM 22 H TYR A 33 -49.022 2.389 66.538 1.00 0.00 H ATOM 23 N PRO A 34 -47.486 5.832 64.312 1.00 17.83 N ATOM 24 CA PRO A 34 -46.652 6.020 63.123 1.00 21.66 C ATOM 25 C PRO A 34 -45.187 5.768 63.406 1.00 27.56 C ATOM 26 O PRO A 34 -44.667 6.031 64.495 1.00 26.26 O ATOM 27 CB PRO A 34 -46.902 7.479 62.721 1.00 26.82 C ATOM 28 CG PRO A 34 -47.479 8.123 63.900 1.00 25.25 C ATOM 29 CD PRO A 34 -48.204 7.063 64.674 1.00 22.20 C ATOM 30 N THR A 35 -44.532 5.252 62.384 1.00 23.80 N ATOM 31 CA THR A 35 -43.173 4.761 62.449 1.00 20.15 C ATOM 32 C THR A 35 -42.302 5.619 61.557 1.00 24.25 C ATOM 33 O THR A 35 -42.775 6.227 60.594 1.00 25.95 O ATOM 34 CB THR A 35 -43.097 3.300 61.990 1.00 35.38 C ATOM 35 OG1 THR A 35 -43.542 3.213 60.630 1.00 45.40 O ATOM 36 CG2 THR A 35 -43.975 2.421 62.863 1.00 36.05 C ATOM 37 HG1 THR A 35 -42.961 3.774 60.057 1.00 0.00 H ATOM 38 H THR A 35 -45.026 5.194 61.470 1.00 0.00 H ATOM 39 N VAL A 36 -41.021 5.671 61.904 1.00 33.32 N ATOM 40 CA VAL A 36 -40.093 6.522 61.175 1.00 40.35 C ATOM 41 C VAL A 36 -40.145 6.214 59.688 1.00 34.64 C ATOM 42 O VAL A 36 -39.964 7.110 58.856 1.00 42.61 O ATOM 43 CB VAL A 36 -38.668 6.382 61.766 1.00 37.94 C ATOM 44 CG1 VAL A 36 -38.326 4.920 62.106 1.00 44.77 C ATOM 45 CG2 VAL A 36 -37.639 6.977 60.828 1.00 38.08 C ATOM 46 H VAL A 36 -40.679 5.099 62.703 1.00 0.00 H ATOM 47 N SER A 37 -40.447 4.964 59.324 1.00 40.93 N ATOM 48 CA SER A 37 -40.517 4.589 57.915 1.00 43.63 C ATOM 49 C SER A 37 -41.750 5.146 57.217 1.00 49.69 C ATOM 50 O SER A 37 -41.770 5.212 55.981 1.00 42.70 O ATOM 51 H SER A 37 -40.635 4.248 60.055 1.00 0.00 H ATOM 52 N GLU A 38 -42.768 5.557 57.974 1.00 49.37 N ATOM 53 CA GLU A 38 -44.016 6.064 57.417 1.00 34.29 C ATOM 54 C GLU A 38 -44.080 7.589 57.353 1.00 41.05 C ATOM 55 O GLU A 38 -45.091 8.128 56.890 1.00 40.16 O ATOM 56 CB GLU A 38 -45.202 5.537 58.238 1.00 45.50 C ATOM 57 CG GLU A 38 -45.233 4.006 58.420 1.00 39.40 C ATOM 58 H GLU A 38 -42.667 5.514 59.008 1.00 0.00 H ATOM 59 N ILE A 39 -43.042 8.297 57.796 1.00 33.98 N ATOM 60 CA ILE A 39 -43.065 9.761 57.790 1.00 47.40 C ATOM 61 C ILE A 39 -41.884 10.316 56.998 1.00 36.86 C ATOM 62 O ILE A 39 -40.737 10.242 57.466 1.00 47.80 O ATOM 63 CB ILE A 39 -43.044 10.337 59.216 1.00 28.13 C ATOM 64 CG1 ILE A 39 -44.155 9.721 60.062 1.00 33.35 C ATOM 65 CG2 ILE A 39 -43.216 11.870 59.174 1.00 31.11 C ATOM 66 CD1 ILE A 39 -44.039 10.051 61.525 1.00 23.40 C ATOM 67 H ILE A 39 -42.200 7.801 58.152 1.00 0.00 H ATOM 68 N PRO A 40 -42.106 10.913 55.832 1.00 47.81 N ATOM 69 CA PRO A 40 -41.023 11.667 55.181 1.00 48.08 C ATOM 70 C PRO A 40 -40.609 12.870 56.019 1.00 48.29 C ATOM 71 O PRO A 40 -41.454 13.542 56.617 1.00 28.75 O ATOM 72 CB PRO A 40 -41.646 12.109 53.851 1.00 44.74 C ATOM 73 CG PRO A 40 -42.851 11.229 53.661 1.00 40.20 C ATOM 74 CD PRO A 40 -43.344 10.912 55.030 1.00 39.01 C ATOM 75 N VAL A 41 -39.297 13.147 56.061 1.00 47.28 N ATOM 76 CA VAL A 41 -38.818 14.347 56.747 1.00 48.37 C ATOM 77 C VAL A 41 -39.558 15.525 56.127 1.00 46.79 C ATOM 78 O VAL A 41 -39.938 15.486 54.949 1.00 39.81 O ATOM 79 CB VAL A 41 -37.287 14.544 56.662 1.00 42.12 C ATOM 80 CG1 VAL A 41 -36.876 15.821 57.411 1.00 36.76 C ATOM 81 CG2 VAL A 41 -36.526 13.359 57.247 1.00 27.18 C ATOM 82 H VAL A 41 -38.618 12.506 55.604 1.00 0.00 H ATOM 83 N GLY A 42 -39.781 16.574 56.918 1.00 33.24 N ATOM 84 CA GLY A 42 -40.609 17.678 56.506 1.00 28.54 C ATOM 85 C GLY A 42 -42.088 17.485 56.749 1.00 16.51 C ATOM 86 O GLY A 42 -42.833 18.466 56.717 1.00 22.97 O ATOM 87 H GLY A 42 -39.344 16.596 57.861 1.00 0.00 H ATOM 88 N GLU A 43 -42.538 16.248 56.953 1.00 21.97 N ATOM 89 CA GLU A 43 -43.927 15.958 57.272 1.00 25.58 C ATOM 90 C GLU A 43 -44.083 15.688 58.760 1.00 17.34 C ATOM 91 O GLU A 43 -43.150 15.244 59.435 1.00 18.19 O ATOM 92 CB GLU A 43 -44.441 14.742 56.503 1.00 25.20 C ATOM 93 CG GLU A 43 -44.564 14.937 55.009 1.00 41.77 C ATOM 94 CD GLU A 43 -45.265 13.767 54.343 1.00 62.39 C ATOM 95 OE1 GLU A 43 -45.995 13.032 55.044 1.00 63.20 O ATOM 96 OE2 GLU A 43 -45.084 13.576 53.121 1.00 82.18 O ATOM 97 H GLU A 43 -41.868 15.456 56.881 1.00 0.00 H ATOM 98 N VAL A 44 -45.284 15.944 59.265 1.00 16.82 N ATOM 99 CA VAL A 44 -45.618 15.667 60.654 1.00 14.47 C ATOM 100 C VAL A 44 -46.937 14.913 60.720 1.00 18.11 C ATOM 101 O VAL A 44 -47.898 15.257 60.022 1.00 19.38 O ATOM 102 CB VAL A 44 -45.698 16.969 61.468 1.00 13.48 C ATOM 103 CG1 VAL A 44 -46.164 16.680 62.888 1.00 20.14 C ATOM 104 CG2 VAL A 44 -44.349 17.664 61.481 1.00 17.29 C ATOM 105 H VAL A 44 -46.011 16.357 58.646 1.00 0.00 H ATOM 106 N ARG A 45 -46.984 13.894 61.570 1.00 12.40 N ATOM 107 CA ARG A 45 -48.203 13.172 61.884 1.00 11.35 C ATOM 108 C ARG A 45 -48.669 13.500 63.296 1.00 14.33 C ATOM 109 O ARG A 45 -47.859 13.716 64.216 1.00 14.01 O ATOM 110 CB ARG A 45 -48.022 11.655 61.797 1.00 19.99 C ATOM 111 CG ARG A 45 -47.429 11.163 60.521 1.00 27.13 C ATOM 112 CD ARG A 45 -48.447 10.644 59.532 1.00 39.06 C ATOM 113 NE ARG A 45 -47.735 10.203 58.332 1.00 55.93 N ATOM 114 CZ ARG A 45 -47.327 11.016 57.358 1.00 54.48 C ATOM 115 NH1 ARG A 45 -47.584 12.318 57.413 1.00 48.85 N ATOM 116 NH2 ARG A 45 -46.665 10.525 56.319 1.00 54.30 N ATOM 117 HE ARG A 45 -47.534 9.187 58.233 1.00 0.00 H ATOM 118 HH12 ARG A 45 -47.261 12.944 56.648 1.00 0.00 H ATOM 119 HH11 ARG A 45 -48.108 12.711 58.221 1.00 0.00 H ATOM 120 HH22 ARG A 45 -46.346 11.159 55.559 1.00 0.00 H ATOM 121 HH21 ARG A 45 -46.464 9.506 56.265 1.00 0.00 H ATOM 122 H ARG A 45 -46.102 13.598 62.035 1.00 0.00 H ATOM 123 N LEU A 46 -49.985 13.490 63.467 1.00 14.83 N ATOM 124 CA LEU A 46 -50.611 13.601 64.774 1.00 13.77 C ATOM 125 C LEU A 46 -51.262 12.272 65.122 1.00 17.42 C ATOM 126 O LEU A 46 -51.833 11.601 64.257 1.00 17.38 O ATOM 127 CB LEU A 46 -51.651 14.722 64.809 1.00 12.37 C ATOM 128 CG LEU A 46 -51.164 16.058 64.282 1.00 13.07 C ATOM 129 CD1 LEU A 46 -52.271 17.110 64.368 1.00 18.86 C ATOM 130 CD2 LEU A 46 -49.945 16.506 65.048 1.00 14.48 C ATOM 131 H LEU A 46 -50.595 13.399 62.629 1.00 0.00 H ATOM 132 N TYR A 47 -51.160 11.886 66.385 1.00 13.39 N ATOM 133 CA TYR A 47 -51.730 10.646 66.876 1.00 9.86 C ATOM 134 C TYR A 47 -52.534 10.965 68.118 1.00 13.31 C ATOM 135 O TYR A 47 -51.987 11.467 69.102 1.00 13.95 O ATOM 136 CB TYR A 47 -50.630 9.643 67.202 1.00 13.43 C ATOM 137 CG TYR A 47 -51.103 8.308 67.688 1.00 15.22 C ATOM 138 CD1 TYR A 47 -51.377 7.284 66.797 1.00 22.73 C ATOM 139 CD2 TYR A 47 -51.250 8.068 69.035 1.00 16.93 C ATOM 140 CE1 TYR A 47 -51.787 6.041 67.246 1.00 28.41 C ATOM 141 CE2 TYR A 47 -51.660 6.839 69.497 1.00 17.85 C ATOM 142 CZ TYR A 47 -51.921 5.831 68.598 1.00 24.46 C ATOM 143 OH TYR A 47 -52.333 4.616 69.076 1.00 27.83 O ATOM 144 HH TYR A 47 -52.480 3.997 68.318 1.00 0.00 H ATOM 145 H TYR A 47 -50.649 12.498 67.053 1.00 0.00 H ATOM 146 N GLN A 48 -53.821 10.679 68.079 1.00 14.99 N ATOM 147 CA GLN A 48 -54.669 10.965 69.228 1.00 14.43 C ATOM 148 C GLN A 48 -54.536 9.857 70.267 1.00 26.07 C ATOM 149 O GLN A 48 -54.807 8.684 69.985 1.00 21.50 O ATOM 150 CB GLN A 48 -56.123 11.136 68.801 1.00 24.30 C ATOM 151 CG GLN A 48 -57.040 11.542 69.959 1.00 29.58 C ATOM 152 CD GLN A 48 -58.260 12.347 69.512 1.00 36.90 C ATOM 153 OE1 GLN A 48 -58.762 13.199 70.253 1.00 43.70 O ATOM 154 NE2 GLN A 48 -58.738 12.080 68.304 1.00 37.88 N ATOM 155 HE22 GLN A 48 -58.284 11.354 67.714 1.00 0.00 H ATOM 156 HE21 GLN A 48 -59.567 12.596 67.947 1.00 0.00 H ATOM 157 H GLN A 48 -54.231 10.248 67.226 1.00 0.00 H ATOM 158 N ILE A 49 -54.134 10.245 71.470 1.00 19.16 N ATOM 159 CA ILE A 49 -53.841 9.311 72.555 1.00 18.54 C ATOM 160 C ILE A 49 -55.050 9.111 73.445 1.00 26.73 C ATOM 161 O ILE A 49 -55.270 8.016 73.976 1.00 26.35 O ATOM 162 CB ILE A 49 -52.648 9.844 73.371 1.00 19.89 C ATOM 163 CG1 ILE A 49 -51.418 9.983 72.487 1.00 22.34 C ATOM 164 CG2 ILE A 49 -52.360 8.940 74.571 1.00 27.74 C ATOM 165 CD1 ILE A 49 -50.411 10.859 73.095 1.00 24.28 C ATOM 166 H ILE A 49 -54.022 11.263 71.650 1.00 0.00 H ATOM 167 N ALA A 50 -55.797 10.190 73.625 1.00 22.63 N ATOM 168 CA ALA A 50 -56.958 10.265 74.497 1.00 21.50 C ATOM 169 C ALA A 50 -57.693 11.525 74.092 1.00 26.31 C ATOM 170 O ALA A 50 -57.164 12.352 73.347 1.00 29.77 O ATOM 171 CB ALA A 50 -56.570 10.304 75.974 1.00 22.43 C ATOM 172 H ALA A 50 -55.533 11.049 73.102 1.00 0.00 H ATOM 173 N ASP A 51 -58.913 11.676 74.589 1.00 25.28 N ATOM 174 CA ASP A 51 -59.690 12.865 74.269 1.00 23.65 C ATOM 175 C ASP A 51 -58.902 14.121 74.627 1.00 28.77 C ATOM 176 O ASP A 51 -58.498 14.305 75.779 1.00 28.17 O ATOM 177 CB ASP A 51 -61.025 12.847 75.012 1.00 37.96 C ATOM 178 CG ASP A 51 -60.852 12.915 76.513 1.00 38.12 C ATOM 179 H ASP A 51 -59.316 10.944 75.208 1.00 0.00 H ATOM 180 N GLY A 52 -58.668 14.973 73.628 1.00 23.43 N ATOM 181 CA GLY A 52 -57.941 16.209 73.846 1.00 23.31 C ATOM 182 C GLY A 52 -56.451 16.059 74.086 1.00 14.66 C ATOM 183 O GLY A 52 -55.818 17.006 74.574 1.00 13.46 O ATOM 184 H GLY A 52 -59.014 14.747 72.674 1.00 0.00 H ATOM 185 N VAL A 53 -55.865 14.900 73.771 1.00 17.46 N ATOM 186 CA VAL A 53 -54.420 14.722 73.895 1.00 13.05 C ATOM 187 C VAL A 53 -53.923 13.993 72.658 1.00 14.19 C ATOM 188 O VAL A 53 -54.422 12.914 72.318 1.00 16.19 O ATOM 189 CB VAL A 53 -54.005 13.963 75.163 1.00 12.88 C ATOM 190 CG1 VAL A 53 -52.519 14.037 75.311 1.00 16.87 C ATOM 191 CG2 VAL A 53 -54.689 14.538 76.392 1.00 16.35 C ATOM 192 H VAL A 53 -56.449 14.109 73.431 1.00 0.00 H ATOM 193 N TRP A 54 -52.958 14.594 71.973 1.00 11.74 N ATOM 194 CA TRP A 54 -52.295 13.991 70.837 1.00 11.10 C ATOM 195 C TRP A 54 -50.797 13.972 71.075 1.00 11.31 C ATOM 196 O TRP A 54 -50.265 14.775 71.829 1.00 11.11 O ATOM 197 CB TRP A 54 -52.542 14.788 69.565 1.00 13.63 C ATOM 198 CG TRP A 54 -53.962 15.023 69.177 1.00 13.83 C ATOM 199 CD1 TRP A 54 -54.649 14.393 68.184 1.00 16.74 C ATOM 200 CD2 TRP A 54 -54.860 15.991 69.738 1.00 11.25 C ATOM 201 NE1 TRP A 54 -55.918 14.905 68.088 1.00 16.57 N ATOM 202 CE2 TRP A 54 -56.079 15.882 69.034 1.00 17.11 C ATOM 203 CE3 TRP A 54 -54.756 16.939 70.760 1.00 14.30 C ATOM 204 CZ2 TRP A 54 -57.178 16.691 69.319 1.00 18.06 C ATOM 205 CZ3 TRP A 54 -55.846 17.720 71.054 1.00 15.98 C ATOM 206 CH2 TRP A 54 -57.044 17.598 70.329 1.00 16.86 C ATOM 207 HE1 TRP A 54 -56.642 14.600 67.406 1.00 0.00 H ATOM 208 H TRP A 54 -52.663 15.547 72.268 1.00 0.00 H ATOM 209 N SER A 55 -50.104 13.086 70.383 1.00 11.12 N ATOM 210 CA SER A 55 -48.685 13.290 70.165 1.00 11.95 C ATOM 211 C SER A 55 -48.497 13.778 68.744 1.00 11.52 C ATOM 212 O SER A 55 -49.370 13.607 67.885 1.00 10.77 O ATOM 213 CB SER A 55 -47.875 12.009 70.408 1.00 16.04 C ATOM 214 OG SER A 55 -48.239 11.002 69.490 1.00 15.91 O ATOM 215 HG SER A 55 -47.704 10.188 69.666 1.00 0.00 H ATOM 216 H SER A 55 -50.575 12.244 69.995 1.00 0.00 H ATOM 217 N HIS A 56 -47.387 14.448 68.523 1.00 9.84 N ATOM 218 CA HIS A 56 -46.958 14.813 67.188 1.00 9.10 C ATOM 219 C HIS A 56 -45.650 14.092 66.918 1.00 10.44 C ATOM 220 O HIS A 56 -44.806 13.950 67.818 1.00 10.81 O ATOM 221 CB HIS A 56 -46.844 16.344 66.964 1.00 8.11 C ATOM 222 CG HIS A 56 -45.877 17.085 67.851 1.00 7.32 C ATOM 223 ND1 HIS A 56 -44.536 17.223 67.557 1.00 9.81 N ATOM 224 CD2 HIS A 56 -46.104 17.866 68.935 1.00 9.22 C ATOM 225 CE1 HIS A 56 -43.967 17.990 68.469 1.00 12.70 C ATOM 226 NE2 HIS A 56 -44.900 18.405 69.310 1.00 12.36 N ATOM 227 H HIS A 56 -46.797 14.725 69.334 1.00 0.00 H ATOM 228 N ILE A 57 -45.515 13.583 65.700 1.00 8.56 N ATOM 229 CA ILE A 57 -44.369 12.765 65.314 1.00 11.89 C ATOM 230 C ILE A 57 -43.756 13.351 64.055 1.00 11.57 C ATOM 231 O ILE A 57 -44.461 13.575 63.063 1.00 12.42 O ATOM 232 CB ILE A 57 -44.740 11.295 65.053 1.00 11.29 C ATOM 233 CG1 ILE A 57 -45.558 10.705 66.198 1.00 11.41 C ATOM 234 CG2 ILE A 57 -43.461 10.482 64.801 1.00 14.25 C ATOM 235 CD1 ILE A 57 -47.036 10.890 66.066 1.00 18.87 C ATOM 236 H ILE A 57 -46.254 13.774 64.993 1.00 0.00 H ATOM 237 N ALA A 58 -42.461 13.605 64.105 1.00 8.57 N ATOM 238 CA ALA A 58 -41.706 14.132 62.973 1.00 8.86 C ATOM 239 C ALA A 58 -40.411 13.339 62.842 1.00 11.01 C ATOM 240 O ALA A 58 -40.106 12.483 63.667 1.00 13.34 O ATOM 241 CB ALA A 58 -41.436 15.635 63.128 1.00 11.80 C ATOM 242 H ALA A 58 -41.955 13.420 64.994 1.00 0.00 H ATOM 243 N THR A 59 -39.637 13.625 61.795 1.00 13.01 N ATOM 244 CA THR A 59 -38.398 12.898 61.563 1.00 13.83 C ATOM 245 C THR A 59 -37.285 13.853 61.153 1.00 13.67 C ATOM 246 O THR A 59 -37.526 14.938 60.621 1.00 14.69 O ATOM 247 CB THR A 59 -38.556 11.814 60.474 1.00 19.55 C ATOM 248 OG1 THR A 59 -38.964 12.436 59.260 1.00 21.64 O ATOM 249 CG2 THR A 59 -39.590 10.774 60.875 1.00 17.91 C ATOM 250 HG1 THR A 59 -39.828 12.898 59.401 1.00 0.00 H ATOM 251 H THR A 59 -39.922 14.377 61.136 1.00 0.00 H ATOM 252 N GLN A 60 -36.056 13.426 61.421 1.00 12.90 N ATOM 253 CA GLN A 60 -34.864 14.111 60.942 1.00 15.29 C ATOM 254 C GLN A 60 -33.842 13.073 60.508 1.00 13.87 C ATOM 255 O GLN A 60 -33.822 11.952 61.020 1.00 16.10 O ATOM 256 CB GLN A 60 -34.240 15.007 62.027 1.00 25.52 C ATOM 257 CG GLN A 60 -34.815 16.392 62.103 1.00 25.56 C ATOM 258 CD GLN A 60 -34.575 17.169 60.822 1.00 30.73 C ATOM 259 OE1 GLN A 60 -33.673 16.841 60.040 1.00 35.79 O ATOM 260 NE2 GLN A 60 -35.394 18.188 60.586 1.00 37.97 N ATOM 261 HE22 GLN A 60 -36.138 18.427 61.272 1.00 0.00 H ATOM 262 HE21 GLN A 60 -35.291 18.747 59.715 1.00 0.00 H ATOM 263 H GLN A 60 -35.941 12.567 61.996 1.00 0.00 H ATOM 264 N SER A 61 -32.998 13.464 59.557 1.00 18.35 N ATOM 265 CA SER A 61 -31.876 12.647 59.107 1.00 22.02 C ATOM 266 C SER A 61 -30.592 13.074 59.812 1.00 23.90 C ATOM 267 O SER A 61 -30.320 14.270 59.969 1.00 37.99 O ATOM 268 CB SER A 61 -31.693 12.756 57.592 1.00 29.63 C ATOM 269 OG SER A 61 -32.923 12.534 56.925 1.00 54.48 O ATOM 270 HG SER A 61 -32.785 12.608 55.947 1.00 0.00 H ATOM 271 H SER A 61 -33.144 14.394 59.114 1.00 0.00 H ATOM 272 N PHE A 62 -29.810 12.089 60.249 1.00 28.40 N ATOM 273 CA PHE A 62 -28.523 12.365 60.873 1.00 35.56 C ATOM 274 C PHE A 62 -27.557 11.232 60.564 1.00 39.32 C ATOM 275 O PHE A 62 -27.898 10.056 60.738 1.00 33.11 O ATOM 276 CB PHE A 62 -28.671 12.541 62.386 1.00 41.76 C ATOM 277 CG PHE A 62 -27.375 12.433 63.139 1.00 44.05 C ATOM 278 CD1 PHE A 62 -26.442 13.462 63.089 1.00 51.67 C ATOM 279 CD2 PHE A 62 -27.087 11.307 63.904 1.00 53.23 C ATOM 280 CE1 PHE A 62 -25.240 13.371 63.787 1.00 57.90 C ATOM 281 CE2 PHE A 62 -25.886 11.206 64.606 1.00 54.53 C ATOM 282 CZ PHE A 62 -24.960 12.239 64.544 1.00 58.19 C ATOM 283 H PHE A 62 -30.124 11.103 60.143 1.00 0.00 H ATOM 284 N ASP A 63 -26.348 11.600 60.131 1.00 35.30 N ATOM 285 CA ASP A 63 -25.317 10.640 59.764 1.00 29.87 C ATOM 286 C ASP A 63 -25.888 9.513 58.920 1.00 22.15 C ATOM 287 O ASP A 63 -25.537 8.342 59.109 1.00 34.01 O ATOM 288 CB ASP A 63 -24.629 10.079 61.013 1.00 37.94 C ATOM 289 CG ASP A 63 -23.584 11.033 61.584 1.00 35.56 C ATOM 290 OD1 ASP A 63 -23.311 12.086 60.957 1.00 29.70 O ATOM 291 OD2 ASP A 63 -23.038 10.726 62.660 1.00 39.08 O ATOM 292 H ASP A 63 -26.134 12.615 60.053 1.00 0.00 H ATOM 293 N GLY A 64 -26.778 9.857 57.989 1.00 26.25 N ATOM 294 CA GLY A 64 -27.299 8.908 57.035 1.00 29.74 C ATOM 295 C GLY A 64 -28.484 8.089 57.499 1.00 33.76 C ATOM 296 O GLY A 64 -29.071 7.369 56.681 1.00 32.26 O ATOM 297 H GLY A 64 -27.108 10.842 57.949 1.00 0.00 H ATOM 298 N ALA A 65 -28.868 8.176 58.769 1.00 25.62 N ATOM 299 CA ALA A 65 -30.031 7.460 59.265 1.00 25.40 C ATOM 300 C ALA A 65 -31.176 8.444 59.481 1.00 24.93 C ATOM 301 O ALA A 65 -31.002 9.660 59.422 1.00 21.26 O ATOM 302 CB ALA A 65 -29.706 6.713 60.558 1.00 26.64 C ATOM 303 H ALA A 65 -28.322 8.772 59.424 1.00 0.00 H ATOM 304 N VAL A 66 -32.367 7.907 59.699 1.00 16.09 N ATOM 305 CA VAL A 66 -33.546 8.735 59.912 1.00 15.25 C ATOM 306 C VAL A 66 -34.113 8.394 61.275 1.00 13.78 C ATOM 307 O VAL A 66 -34.316 7.217 61.598 1.00 13.61 O ATOM 308 CB VAL A 66 -34.609 8.534 58.820 1.00 17.49 C ATOM 309 CG1 VAL A 66 -35.825 9.375 59.148 1.00 18.73 C ATOM 310 CG2 VAL A 66 -34.059 8.917 57.469 1.00 25.15 C ATOM 311 H VAL A 66 -32.462 6.872 59.718 1.00 0.00 H ATOM 312 N TYR A 67 -34.376 9.436 62.071 1.00 15.77 N ATOM 313 CA TYR A 67 -34.811 9.293 63.440 1.00 14.61 C ATOM 314 C TYR A 67 -36.170 9.954 63.631 1.00 10.28 C ATOM 315 O TYR A 67 -36.389 11.057 63.120 1.00 12.73 O ATOM 316 CB TYR A 67 -33.799 9.934 64.417 1.00 13.12 C ATOM 317 CG TYR A 67 -32.434 9.312 64.354 1.00 13.71 C ATOM 318 CD1 TYR A 67 -31.484 9.765 63.448 1.00 25.02 C ATOM 319 CD2 TYR A 67 -32.107 8.255 65.183 1.00 30.29 C ATOM 320 CE1 TYR A 67 -30.235 9.187 63.388 1.00 27.98 C ATOM 321 CE2 TYR A 67 -30.860 7.666 65.128 1.00 38.99 C ATOM 322 CZ TYR A 67 -29.933 8.130 64.228 1.00 34.81 C ATOM 323 OH TYR A 67 -28.696 7.528 64.179 1.00 36.65 O ATOM 324 HH TYR A 67 -28.143 7.969 63.487 1.00 0.00 H ATOM 325 H TYR A 67 -34.262 10.395 61.685 1.00 0.00 H ATOM 326 N PRO A 68 -37.084 9.308 64.349 1.00 11.08 N ATOM 327 CA PRO A 68 -38.351 9.943 64.718 1.00 10.57 C ATOM 328 C PRO A 68 -38.195 10.707 66.023 1.00 10.49 C ATOM 329 O PRO A 68 -37.273 10.461 66.818 1.00 10.10 O ATOM 330 CB PRO A 68 -39.292 8.745 64.904 1.00 12.04 C ATOM 331 CG PRO A 68 -38.380 7.723 65.558 1.00 13.83 C ATOM 332 CD PRO A 68 -37.003 7.944 64.893 1.00 15.41 C ATOM 333 N SER A 69 -39.130 11.634 66.232 1.00 12.79 N ATOM 334 CA SER A 69 -39.186 12.427 67.450 1.00 10.60 C ATOM 335 C SER A 69 -40.635 12.730 67.785 1.00 10.93 C ATOM 336 O SER A 69 -41.427 13.051 66.890 1.00 10.99 O ATOM 337 CB SER A 69 -38.401 13.733 67.285 1.00 12.49 C ATOM 338 OG SER A 69 -38.262 14.351 68.527 1.00 12.53 O ATOM 339 HG SER A 69 -39.158 14.548 68.898 1.00 0.00 H ATOM 340 H SER A 69 -39.847 11.796 65.496 1.00 0.00 H ATOM 341 N ASN A 70 -40.971 12.631 69.077 1.00 10.22 N ATOM 342 CA ASN A 70 -42.299 12.926 69.608 1.00 10.31 C ATOM 343 C ASN A 70 -42.374 14.250 70.375 1.00 6.92 C ATOM 344 O ASN A 70 -41.453 14.616 71.116 1.00 10.57 O ATOM 345 CB ASN A 70 -42.754 11.853 70.597 1.00 7.73 C ATOM 346 CG ASN A 70 -42.813 10.466 69.998 1.00 14.60 C ATOM 347 OD1 ASN A 70 -43.339 10.260 68.908 1.00 17.30 O ATOM 348 ND2 ASN A 70 -42.298 9.500 70.733 1.00 14.30 N ATOM 349 HD22 ASN A 70 -41.862 9.721 71.651 1.00 0.00 H ATOM 350 HD21 ASN A 70 -42.328 8.517 70.395 1.00 0.00 H ATOM 351 H ASN A 70 -40.238 12.324 69.747 1.00 0.00 H ATOM 352 N GLY A 71 -43.531 14.909 70.245 1.00 9.46 N ATOM 353 CA GLY A 71 -44.014 15.919 71.184 1.00 9.59 C ATOM 354 C GLY A 71 -45.469 15.693 71.568 1.00 8.63 C ATOM 355 O GLY A 71 -46.036 14.632 71.276 1.00 9.92 O ATOM 356 H GLY A 71 -44.126 14.688 69.421 1.00 0.00 H ATOM 357 N LEU A 72 -46.078 16.631 72.290 1.00 7.05 N ATOM 358 CA LEU A 72 -47.436 16.445 72.786 1.00 11.20 C ATOM 359 C LEU A 72 -48.275 17.665 72.423 1.00 12.30 C ATOM 360 O LEU A 72 -47.754 18.762 72.290 1.00 7.82 O ATOM 361 CB LEU A 72 -47.466 16.230 74.311 1.00 9.38 C ATOM 362 CG LEU A 72 -48.595 15.404 74.925 1.00 13.49 C ATOM 363 CD1 LEU A 72 -48.503 13.991 74.482 1.00 13.88 C ATOM 364 CD2 LEU A 72 -48.502 15.485 76.457 1.00 11.45 C ATOM 365 H LEU A 72 -45.574 17.515 72.505 1.00 0.00 H ATOM 366 N ILE A 73 -49.578 17.461 72.247 1.00 9.14 N ATOM 367 CA ILE A 73 -50.542 18.553 72.111 1.00 7.70 C ATOM 368 C ILE A 73 -51.659 18.281 73.099 1.00 11.18 C ATOM 369 O ILE A 73 -52.179 17.167 73.128 1.00 10.44 O ATOM 370 CB ILE A 73 -51.121 18.624 70.688 1.00 9.15 C ATOM 371 CG1 ILE A 73 -50.004 18.710 69.633 1.00 10.32 C ATOM 372 CG2 ILE A 73 -52.085 19.807 70.574 1.00 12.98 C ATOM 373 CD1 ILE A 73 -50.474 18.329 68.266 1.00 12.86 C ATOM 374 H ILE A 73 -49.927 16.482 72.204 1.00 0.00 H ATOM 375 N VAL A 74 -52.029 19.277 73.898 1.00 8.97 N ATOM 376 CA VAL A 74 -53.070 19.110 74.913 1.00 11.05 C ATOM 377 C VAL A 74 -54.107 20.211 74.759 1.00 12.61 C ATOM 378 O VAL A 74 -53.774 21.398 74.805 1.00 11.69 O ATOM 379 CB VAL A 74 -52.495 19.125 76.336 1.00 8.24 C ATOM 380 CG1 VAL A 74 -53.609 18.816 77.353 1.00 11.78 C ATOM 381 CG2 VAL A 74 -51.351 18.105 76.454 1.00 9.13 C ATOM 382 H VAL A 74 -51.565 20.202 73.799 1.00 0.00 H ATOM 383 N ARG A 75 -55.369 19.815 74.654 1.00 14.06 N ATOM 384 CA ARG A 75 -56.430 20.796 74.542 1.00 14.60 C ATOM 385 C ARG A 75 -56.670 21.478 75.879 1.00 16.63 C ATOM 386 O ARG A 75 -56.721 20.830 76.936 1.00 17.53 O ATOM 387 CB ARG A 75 -57.716 20.140 74.038 1.00 16.56 C ATOM 388 CG ARG A 75 -58.835 21.155 73.865 1.00 16.80 C ATOM 389 CD ARG A 75 -60.025 20.587 73.130 1.00 29.98 C ATOM 390 NE ARG A 75 -61.029 21.629 72.946 1.00 34.85 N ATOM 391 CZ ARG A 75 -62.041 21.562 72.088 1.00 47.68 C ATOM 392 NH1 ARG A 75 -62.188 20.496 71.307 1.00 44.30 N ATOM 393 NH2 ARG A 75 -62.897 22.575 72.008 1.00 43.16 N ATOM 394 HE ARG A 75 -60.947 22.486 73.529 1.00 0.00 H ATOM 395 HH12 ARG A 75 -62.982 20.448 70.637 1.00 0.00 H ATOM 396 HH11 ARG A 75 -61.509 19.710 71.366 1.00 0.00 H ATOM 397 HH22 ARG A 75 -63.692 22.532 71.339 1.00 0.00 H ATOM 398 HH21 ARG A 75 -62.772 23.411 72.614 1.00 0.00 H ATOM 399 H ARG A 75 -55.597 18.800 74.652 1.00 0.00 H ATOM 400 N ASP A 76 -56.810 22.800 75.803 1.00 16.63 N ATOM 401 CA ASP A 76 -56.913 23.710 76.929 1.00 22.18 C ATOM 402 C ASP A 76 -58.139 24.598 76.653 1.00 18.85 C ATOM 403 O ASP A 76 -58.021 25.747 76.223 1.00 21.19 O ATOM 404 CB ASP A 76 -55.608 24.505 77.051 1.00 30.16 C ATOM 405 CG ASP A 76 -55.635 25.537 78.141 1.00 38.65 C ATOM 406 OD1 ASP A 76 -56.356 25.340 79.135 1.00 36.45 O ATOM 407 OD2 ASP A 76 -54.891 26.537 77.997 1.00 47.89 O ATOM 408 H ASP A 76 -56.849 23.218 74.851 1.00 0.00 H ATOM 409 N GLY A 77 -59.317 24.015 76.829 1.00 29.00 N ATOM 410 CA GLY A 77 -60.556 24.675 76.467 1.00 31.30 C ATOM 411 C GLY A 77 -60.719 24.833 74.968 1.00 27.09 C ATOM 412 O GLY A 77 -60.907 23.860 74.233 1.00 29.30 O ATOM 413 H GLY A 77 -59.353 23.059 77.237 1.00 0.00 H ATOM 414 N ASP A 78 -60.659 26.073 74.499 1.00 22.56 N ATOM 415 CA ASP A 78 -60.737 26.361 73.079 1.00 23.62 C ATOM 416 C ASP A 78 -59.371 26.712 72.497 1.00 22.96 C ATOM 417 O ASP A 78 -59.286 27.248 71.387 1.00 21.82 O ATOM 418 CB ASP A 78 -61.755 27.478 72.849 1.00 32.41 C ATOM 419 CG ASP A 78 -63.144 27.106 73.368 1.00 54.99 C ATOM 420 OD1 ASP A 78 -63.525 25.917 73.241 1.00 49.24 O ATOM 421 OD2 ASP A 78 -63.846 27.988 73.915 1.00 47.40 O ATOM 422 H ASP A 78 -60.553 26.861 75.169 1.00 0.00 H ATOM 423 N GLU A 79 -58.298 26.409 73.230 1.00 19.53 N ATOM 424 CA GLU A 79 -56.931 26.612 72.768 1.00 14.10 C ATOM 425 C GLU A 79 -56.149 25.306 72.938 1.00 12.75 C ATOM 426 O GLU A 79 -56.637 24.338 73.529 1.00 14.06 O ATOM 427 CB GLU A 79 -56.242 27.730 73.549 1.00 18.26 C ATOM 428 CG GLU A 79 -57.028 29.018 73.644 1.00 27.10 C ATOM 429 CD GLU A 79 -56.421 29.992 74.633 1.00 38.13 C ATOM 430 OE1 GLU A 79 -55.443 29.621 75.332 1.00 35.04 O ATOM 431 OE2 GLU A 79 -56.922 31.133 74.707 1.00 44.97 O ATOM 432 H GLU A 79 -58.445 26.008 74.178 1.00 0.00 H ATOM 433 N LEU A 80 -54.926 25.283 72.392 1.00 12.29 N ATOM 434 CA LEU A 80 -54.013 24.158 72.534 1.00 13.48 C ATOM 435 C LEU A 80 -52.716 24.582 73.218 1.00 12.25 C ATOM 436 O LEU A 80 -52.162 25.659 72.952 1.00 11.25 O ATOM 437 CB LEU A 80 -53.669 23.550 71.171 1.00 10.45 C ATOM 438 CG LEU A 80 -54.830 23.068 70.282 1.00 11.45 C ATOM 439 CD1 LEU A 80 -54.337 22.594 68.932 1.00 14.38 C ATOM 440 CD2 LEU A 80 -55.627 21.971 70.971 1.00 12.53 C ATOM 441 H LEU A 80 -54.614 26.108 71.841 1.00 0.00 H ATOM 442 N LEU A 81 -52.208 23.681 74.046 1.00 10.10 N ATOM 443 CA LEU A 81 -50.856 23.744 74.602 1.00 9.25 C ATOM 444 C LEU A 81 -49.976 22.768 73.831 1.00 8.96 C ATOM 445 O LEU A 81 -50.337 21.601 73.675 1.00 8.85 O ATOM 446 CB LEU A 81 -50.864 23.342 76.056 1.00 7.49 C ATOM 447 CG LEU A 81 -49.499 23.265 76.763 1.00 7.45 C ATOM 448 CD1 LEU A 81 -48.768 24.606 76.825 1.00 12.39 C ATOM 449 CD2 LEU A 81 -49.653 22.646 78.148 1.00 10.46 C ATOM 450 H LEU A 81 -52.809 22.877 74.318 1.00 0.00 H ATOM 451 N LEU A 82 -48.866 23.257 73.293 1.00 6.24 N ATOM 452 CA LEU A 82 -47.904 22.412 72.608 1.00 4.45 C ATOM 453 C LEU A 82 -46.754 22.070 73.552 1.00 5.86 C ATOM 454 O LEU A 82 -46.229 22.948 74.244 1.00 7.50 O ATOM 455 CB LEU A 82 -47.368 23.161 71.394 1.00 6.78 C ATOM 456 CG LEU A 82 -46.323 22.441 70.557 1.00 7.19 C ATOM 457 CD1 LEU A 82 -46.935 21.272 69.849 1.00 9.83 C ATOM 458 CD2 LEU A 82 -45.719 23.387 69.549 1.00 10.66 C ATOM 459 H LEU A 82 -48.679 24.278 73.364 1.00 0.00 H ATOM 460 N ILE A 83 -46.330 20.819 73.533 1.00 5.61 N ATOM 461 CA ILE A 83 -45.136 20.386 74.258 1.00 4.84 C ATOM 462 C ILE A 83 -44.111 19.984 73.208 1.00 7.16 C ATOM 463 O ILE A 83 -44.305 19.003 72.482 1.00 7.86 O ATOM 464 CB ILE A 83 -45.402 19.232 75.216 1.00 8.82 C ATOM 465 CG1 ILE A 83 -46.587 19.525 76.151 1.00 7.89 C ATOM 466 CG2 ILE A 83 -44.135 18.977 76.014 1.00 8.68 C ATOM 467 CD1 ILE A 83 -46.429 20.696 77.040 1.00 9.05 C ATOM 468 H ILE A 83 -46.865 20.117 72.983 1.00 0.00 H ATOM 469 N ASP A 84 -43.048 20.771 73.138 1.00 5.79 N ATOM 470 CA ASP A 84 -41.888 20.590 72.255 1.00 6.90 C ATOM 471 C ASP A 84 -42.171 20.892 70.792 1.00 7.63 C ATOM 472 O ASP A 84 -43.293 20.722 70.278 1.00 7.34 O ATOM 473 CB ASP A 84 -41.324 19.180 72.474 1.00 6.99 C ATOM 474 CG ASP A 84 -40.653 19.060 73.824 1.00 9.06 C ATOM 475 OD1 ASP A 84 -40.024 20.074 74.230 1.00 7.71 O ATOM 476 OD2 ASP A 84 -40.732 17.997 74.474 1.00 9.36 O ATOM 477 H ASP A 84 -43.033 21.597 73.769 1.00 0.00 H ATOM 478 N THR A 85 -41.135 21.408 70.116 1.00 8.22 N ATOM 479 CA THR A 85 -41.173 21.602 68.689 1.00 9.08 C ATOM 480 C THR A 85 -41.135 20.254 67.984 1.00 8.12 C ATOM 481 O THR A 85 -40.980 19.194 68.599 1.00 8.34 O ATOM 482 CB THR A 85 -39.983 22.422 68.216 1.00 10.35 C ATOM 483 OG1 THR A 85 -38.788 21.681 68.476 1.00 10.68 O ATOM 484 CG2 THR A 85 -39.889 23.746 68.927 1.00 10.48 C ATOM 485 HG1 THR A 85 -38.004 22.204 68.172 1.00 0.00 H ATOM 486 H THR A 85 -40.277 21.677 70.638 1.00 0.00 H ATOM 487 N ALA A 86 -41.236 20.307 66.657 1.00 10.07 N ATOM 488 CA ALA A 86 -41.123 19.119 65.820 1.00 9.84 C ATOM 489 C ALA A 86 -39.724 18.957 65.226 1.00 14.60 C ATOM 490 O ALA A 86 -39.567 18.388 64.144 1.00 12.64 O ATOM 491 CB ALA A 86 -42.189 19.157 64.726 1.00 10.94 C ATOM 492 H ALA A 86 -41.401 21.228 66.202 1.00 0.00 H ATOM 493 N TRP A 87 -38.700 19.418 65.938 1.00 11.38 N ATOM 494 CA TRP A 87 -37.310 19.182 65.589 1.00 13.35 C ATOM 495 C TRP A 87 -36.972 19.915 64.299 1.00 10.45 C ATOM 496 O TRP A 87 -36.770 19.291 63.245 1.00 13.64 O ATOM 497 CB TRP A 87 -37.023 17.685 65.458 1.00 10.18 C ATOM 498 CG TRP A 87 -35.587 17.316 65.496 1.00 7.17 C ATOM 499 CD1 TRP A 87 -34.499 18.161 65.575 1.00 11.95 C ATOM 500 CD2 TRP A 87 -35.056 15.989 65.463 1.00 8.37 C ATOM 501 NE1 TRP A 87 -33.332 17.426 65.588 1.00 14.88 N ATOM 502 CE2 TRP A 87 -33.652 16.093 65.534 1.00 16.58 C ATOM 503 CE3 TRP A 87 -35.633 14.720 65.398 1.00 12.79 C ATOM 504 CZ2 TRP A 87 -32.820 14.969 65.515 1.00 21.75 C ATOM 505 CZ3 TRP A 87 -34.802 13.608 65.388 1.00 18.03 C ATOM 506 CH2 TRP A 87 -33.416 13.745 65.449 1.00 19.27 C ATOM 507 HE1 TRP A 87 -32.369 17.817 65.632 1.00 0.00 H ATOM 508 H TRP A 87 -38.905 19.977 66.790 1.00 0.00 H ATOM 509 N GLY A 88 -36.909 21.231 64.384 1.00 11.59 N ATOM 510 CA GLY A 88 -36.476 22.041 63.269 1.00 10.30 C ATOM 511 C GLY A 88 -37.551 22.981 62.755 1.00 11.14 C ATOM 512 O GLY A 88 -38.747 22.738 62.917 1.00 10.90 O ATOM 513 H GLY A 88 -37.177 21.696 65.275 1.00 0.00 H ATOM 514 N ALA A 89 -37.101 24.051 62.094 1.00 11.36 N ATOM 515 CA ALA A 89 -38.002 25.088 61.617 1.00 10.57 C ATOM 516 C ALA A 89 -38.990 24.534 60.613 1.00 9.45 C ATOM 517 O ALA A 89 -40.188 24.828 60.676 1.00 13.28 O ATOM 518 CB ALA A 89 -37.187 26.225 61.004 1.00 17.93 C ATOM 519 H ALA A 89 -36.081 24.145 61.916 1.00 0.00 H ATOM 520 N LYS A 90 -38.501 23.776 59.625 1.00 13.00 N ATOM 521 CA LYS A 90 -39.388 23.303 58.564 1.00 13.95 C ATOM 522 C LYS A 90 -40.428 22.338 59.113 1.00 15.10 C ATOM 523 O LYS A 90 -41.615 22.429 58.776 1.00 15.26 O ATOM 524 CB LYS A 90 -38.551 22.651 57.463 1.00 19.41 C ATOM 525 CG LYS A 90 -39.326 21.727 56.555 1.00 34.75 C ATOM 526 H LYS A 90 -37.492 23.524 59.612 1.00 0.00 H ATOM 527 N ASN A 91 -39.993 21.388 59.946 1.00 10.43 N ATOM 528 CA ASN A 91 -40.925 20.462 60.582 1.00 9.01 C ATOM 529 C ASN A 91 -41.939 21.196 61.451 1.00 9.89 C ATOM 530 O ASN A 91 -43.103 20.809 61.502 1.00 9.72 O ATOM 531 CB ASN A 91 -40.178 19.446 61.452 1.00 10.84 C ATOM 532 CG ASN A 91 -39.553 18.308 60.656 1.00 13.06 C ATOM 533 OD1 ASN A 91 -39.809 18.138 59.461 1.00 19.79 O ATOM 534 ND2 ASN A 91 -38.755 17.507 61.337 1.00 12.61 N ATOM 535 HD22 ASN A 91 -38.569 17.691 62.344 1.00 0.00 H ATOM 536 HD21 ASN A 91 -38.312 16.692 60.867 1.00 0.00 H ATOM 537 H ASN A 91 -38.975 21.307 60.144 1.00 0.00 H ATOM 538 N THR A 92 -41.512 22.240 62.166 1.00 9.79 N ATOM 539 CA THR A 92 -42.421 22.919 63.087 1.00 7.51 C ATOM 540 C THR A 92 -43.455 23.740 62.326 1.00 8.78 C ATOM 541 O THR A 92 -44.609 23.833 62.753 1.00 11.69 O ATOM 542 CB THR A 92 -41.601 23.765 64.047 1.00 6.78 C ATOM 543 OG1 THR A 92 -40.767 22.895 64.808 1.00 10.15 O ATOM 544 CG2 THR A 92 -42.459 24.505 65.038 1.00 8.21 C ATOM 545 HG1 THR A 92 -40.168 22.396 64.197 1.00 0.00 H ATOM 546 H THR A 92 -40.531 22.570 62.067 1.00 0.00 H ATOM 547 N ALA A 93 -43.065 24.330 61.198 1.00 9.34 N ATOM 548 CA ALA A 93 -44.063 24.958 60.342 1.00 10.57 C ATOM 549 C ALA A 93 -45.078 23.937 59.856 1.00 9.87 C ATOM 550 O ALA A 93 -46.278 24.215 59.821 1.00 13.89 O ATOM 551 CB ALA A 93 -43.389 25.649 59.169 1.00 12.05 C ATOM 552 H ALA A 93 -42.060 24.342 60.931 1.00 0.00 H ATOM 553 N ALA A 94 -44.619 22.744 59.472 1.00 10.57 N ATOM 554 CA ALA A 94 -45.550 21.707 59.042 1.00 11.68 C ATOM 555 C ALA A 94 -46.434 21.250 60.193 1.00 13.38 C ATOM 556 O ALA A 94 -47.609 20.937 60.000 1.00 14.09 O ATOM 557 CB ALA A 94 -44.779 20.533 58.449 1.00 11.26 C ATOM 558 H ALA A 94 -43.597 22.554 59.479 1.00 0.00 H ATOM 559 N LEU A 95 -45.879 21.198 61.403 1.00 11.06 N ATOM 560 CA LEU A 95 -46.672 20.877 62.582 1.00 9.27 C ATOM 561 C LEU A 95 -47.829 21.849 62.762 1.00 11.39 C ATOM 562 O LEU A 95 -48.971 21.426 62.985 1.00 13.02 O ATOM 563 CB LEU A 95 -45.764 20.890 63.812 1.00 9.07 C ATOM 564 CG LEU A 95 -46.448 20.772 65.172 1.00 11.12 C ATOM 565 CD1 LEU A 95 -47.134 19.408 65.300 1.00 14.07 C ATOM 566 CD2 LEU A 95 -45.402 20.974 66.293 1.00 11.53 C ATOM 567 H LEU A 95 -44.862 21.390 61.508 1.00 0.00 H ATOM 568 N LEU A 96 -47.546 23.159 62.706 1.00 10.81 N ATOM 569 CA LEU A 96 -48.612 24.147 62.859 1.00 10.27 C ATOM 570 C LEU A 96 -49.658 23.992 61.766 1.00 11.09 C ATOM 571 O LEU A 96 -50.854 24.057 62.040 1.00 12.79 O ATOM 572 CB LEU A 96 -48.052 25.565 62.860 1.00 9.86 C ATOM 573 CG LEU A 96 -47.169 25.878 64.059 1.00 11.12 C ATOM 574 CD1 LEU A 96 -46.668 27.329 63.949 1.00 13.31 C ATOM 575 CD2 LEU A 96 -47.926 25.687 65.358 1.00 15.00 C ATOM 576 H LEU A 96 -46.566 23.472 62.553 1.00 0.00 H ATOM 577 N ALA A 97 -49.227 23.726 60.537 1.00 9.35 N ATOM 578 CA ALA A 97 -50.184 23.519 59.448 1.00 10.69 C ATOM 579 C ALA A 97 -51.021 22.268 59.673 1.00 14.35 C ATOM 580 O ALA A 97 -52.235 22.279 59.429 1.00 18.86 O ATOM 581 CB ALA A 97 -49.450 23.446 58.111 1.00 13.37 C ATOM 582 H ALA A 97 -48.206 23.665 60.348 1.00 0.00 H ATOM 583 N GLU A 98 -50.401 21.179 60.152 1.00 13.35 N ATOM 584 CA GLU A 98 -51.155 19.959 60.428 1.00 14.41 C ATOM 585 C GLU A 98 -52.140 20.146 61.582 1.00 15.01 C ATOM 586 O GLU A 98 -53.254 19.620 61.540 1.00 15.22 O ATOM 587 CB GLU A 98 -50.201 18.804 60.737 1.00 18.39 C ATOM 588 CG GLU A 98 -50.871 17.447 60.639 1.00 26.34 C ATOM 589 CD GLU A 98 -51.407 17.164 59.232 1.00 32.87 C ATOM 590 OE1 GLU A 98 -50.791 17.630 58.252 1.00 33.39 O ATOM 591 OE2 GLU A 98 -52.441 16.478 59.109 1.00 40.21 O ATOM 592 H GLU A 98 -49.376 21.204 60.328 1.00 0.00 H ATOM 593 N ILE A 99 -51.752 20.884 62.622 1.00 11.10 N ATOM 594 CA ILE A 99 -52.683 21.167 63.714 1.00 11.84 C ATOM 595 C ILE A 99 -53.879 21.963 63.194 1.00 12.81 C ATOM 596 O ILE A 99 -55.038 21.637 63.485 1.00 15.88 O ATOM 597 CB ILE A 99 -51.966 21.907 64.855 1.00 12.72 C ATOM 598 CG1 ILE A 99 -50.987 20.960 65.535 1.00 9.34 C ATOM 599 CG2 ILE A 99 -52.961 22.451 65.886 1.00 16.77 C ATOM 600 CD1 ILE A 99 -50.074 21.653 66.516 1.00 12.37 C ATOM 601 H ILE A 99 -50.783 21.260 62.657 1.00 0.00 H ATOM 602 N GLU A 100 -53.617 23.034 62.437 1.00 13.42 N ATOM 603 CA GLU A 100 -54.711 23.839 61.895 1.00 16.29 C ATOM 604 C GLU A 100 -55.666 22.989 61.058 1.00 15.99 C ATOM 605 O GLU A 100 -56.888 23.149 61.155 1.00 18.33 O ATOM 606 CB GLU A 100 -54.159 24.997 61.060 1.00 18.80 C ATOM 607 CG GLU A 100 -55.222 25.914 60.444 1.00 31.69 C ATOM 608 CD GLU A 100 -55.805 26.948 61.409 1.00 56.33 C ATOM 609 OE1 GLU A 100 -56.177 26.599 62.555 1.00 45.07 O ATOM 610 OE2 GLU A 100 -55.896 28.129 60.998 1.00 64.11 O ATOM 611 H GLU A 100 -52.631 23.295 62.233 1.00 0.00 H ATOM 612 N LYS A 101 -55.132 22.063 60.261 1.00 12.16 N ATOM 613 CA LYS A 101 -55.961 21.248 59.375 1.00 16.18 C ATOM 614 C LYS A 101 -56.762 20.202 60.143 1.00 18.00 C ATOM 615 O LYS A 101 -57.947 19.980 59.859 1.00 20.17 O ATOM 616 CB LYS A 101 -55.080 20.562 58.328 1.00 18.49 C ATOM 617 CG LYS A 101 -55.791 19.537 57.459 1.00 25.14 C ATOM 618 CD LYS A 101 -54.827 18.966 56.444 1.00 21.06 C ATOM 619 CE LYS A 101 -55.418 17.767 55.749 1.00 35.09 C ATOM 620 NZ LYS A 101 -54.426 17.161 54.840 1.00 31.41 N ATOM 621 HZ1 LYS A 101 -54.139 17.861 54.126 1.00 0.00 H ATOM 622 HZ2 LYS A 101 -53.594 16.861 55.387 1.00 0.00 H ATOM 623 HZ3 LYS A 101 -54.848 16.336 54.368 1.00 0.00 H ATOM 624 H LYS A 101 -54.102 21.917 60.270 1.00 0.00 H ATOM 625 N GLN A 102 -56.124 19.514 61.092 1.00 15.85 N ATOM 626 CA GLN A 102 -56.737 18.364 61.757 1.00 12.72 C ATOM 627 C GLN A 102 -57.510 18.712 63.027 1.00 22.07 C ATOM 628 O GLN A 102 -58.453 17.985 63.385 1.00 18.66 O ATOM 629 CB GLN A 102 -55.662 17.343 62.132 1.00 14.80 C ATOM 630 CG GLN A 102 -55.145 16.483 60.995 1.00 19.68 C ATOM 631 CD GLN A 102 -54.445 15.231 61.505 1.00 31.84 C ATOM 632 OE1 GLN A 102 -54.893 14.596 62.469 1.00 33.56 O ATOM 633 NE2 GLN A 102 -53.344 14.869 60.860 1.00 50.59 N ATOM 634 HE22 GLN A 102 -53.004 15.433 60.055 1.00 0.00 H ATOM 635 HE21 GLN A 102 -52.821 14.021 61.159 1.00 0.00 H ATOM 636 H GLN A 102 -55.164 19.804 61.367 1.00 0.00 H ATOM 637 N ILE A 103 -57.106 19.753 63.753 1.00 16.91 N ATOM 638 CA ILE A 103 -57.718 20.106 65.023 1.00 14.83 C ATOM 639 C ILE A 103 -58.428 21.452 64.945 1.00 18.43 C ATOM 640 O ILE A 103 -59.543 21.604 65.461 1.00 20.36 O ATOM 641 CB ILE A 103 -56.666 20.097 66.161 1.00 11.16 C ATOM 642 CG1 ILE A 103 -55.959 18.741 66.226 1.00 14.53 C ATOM 643 CG2 ILE A 103 -57.333 20.457 67.472 1.00 17.00 C ATOM 644 CD1 ILE A 103 -54.776 18.699 67.195 1.00 15.78 C ATOM 645 H ILE A 103 -56.322 20.336 63.397 1.00 0.00 H ATOM 646 N GLY A 104 -57.785 22.447 64.326 1.00 19.34 N ATOM 647 CA GLY A 104 -58.418 23.728 64.082 1.00 21.25 C ATOM 648 C GLY A 104 -58.622 24.591 65.298 1.00 21.76 C ATOM 649 O GLY A 104 -59.505 25.447 65.293 1.00 26.98 O ATOM 650 H GLY A 104 -56.805 22.298 64.011 1.00 0.00 H ATOM 651 N LEU A 105 -57.850 24.386 66.349 1.00 14.45 N ATOM 652 CA LEU A 105 -57.817 25.319 67.457 1.00 15.01 C ATOM 653 C LEU A 105 -56.449 25.984 67.529 1.00 17.46 C ATOM 654 O LEU A 105 -55.458 25.388 67.106 1.00 19.85 O ATOM 655 CB LEU A 105 -58.109 24.613 68.783 1.00 15.39 C ATOM 656 CG LEU A 105 -59.428 23.847 68.849 1.00 24.86 C ATOM 657 CD1 LEU A 105 -59.472 23.033 70.127 1.00 21.14 C ATOM 658 CD2 LEU A 105 -60.583 24.826 68.774 1.00 27.49 C ATOM 659 H LEU A 105 -57.252 23.536 66.382 1.00 0.00 H ATOM 660 N PRO A 106 -56.356 27.197 68.067 1.00 18.11 N ATOM 661 CA PRO A 106 -55.065 27.896 68.097 1.00 20.06 C ATOM 662 C PRO A 106 -54.113 27.332 69.148 1.00 14.72 C ATOM 663 O PRO A 106 -54.507 27.050 70.287 1.00 16.65 O ATOM 664 CB PRO A 106 -55.456 29.333 68.445 1.00 20.44 C ATOM 665 CG PRO A 106 -56.702 29.175 69.278 1.00 21.54 C ATOM 666 CD PRO A 106 -57.439 28.021 68.639 1.00 23.40 C ATOM 667 N VAL A 107 -52.855 27.163 68.739 1.00 14.92 N ATOM 668 CA VAL A 107 -51.743 26.933 69.665 1.00 11.89 C ATOM 669 C VAL A 107 -51.365 28.268 70.279 1.00 12.45 C ATOM 670 O VAL A 107 -50.813 29.136 69.601 1.00 18.15 O ATOM 671 CB VAL A 107 -50.538 26.297 68.961 1.00 12.30 C ATOM 672 CG1 VAL A 107 -49.393 26.053 69.952 1.00 10.18 C ATOM 673 CG2 VAL A 107 -50.918 24.999 68.303 1.00 13.98 C ATOM 674 H VAL A 107 -52.655 27.196 67.719 1.00 0.00 H ATOM 675 N THR A 108 -51.669 28.444 71.559 1.00 10.78 N ATOM 676 CA THR A 108 -51.384 29.692 72.224 1.00 9.46 C ATOM 677 C THR A 108 -50.114 29.661 73.057 1.00 9.59 C ATOM 678 O THR A 108 -49.492 30.712 73.237 1.00 11.82 O ATOM 679 CB THR A 108 -52.580 30.080 73.100 1.00 16.17 C ATOM 680 OG1 THR A 108 -52.824 29.039 74.040 1.00 18.72 O ATOM 681 CG2 THR A 108 -53.838 30.280 72.236 1.00 20.82 C ATOM 682 HG1 THR A 108 -53.596 29.284 74.609 1.00 0.00 H ATOM 683 H THR A 108 -52.119 27.671 72.090 1.00 0.00 H ATOM 684 N ARG A 109 -49.679 28.493 73.527 1.00 9.94 N ATOM 685 CA ARG A 109 -48.477 28.397 74.346 1.00 7.47 C ATOM 686 C ARG A 109 -47.737 27.119 73.971 1.00 7.99 C ATOM 687 O ARG A 109 -48.350 26.134 73.546 1.00 9.92 O ATOM 688 CB ARG A 109 -48.792 28.380 75.843 1.00 12.41 C ATOM 689 CG ARG A 109 -49.477 29.654 76.330 1.00 15.46 C ATOM 690 CD ARG A 109 -49.713 29.594 77.840 1.00 16.43 C ATOM 691 NE ARG A 109 -50.758 28.640 78.189 1.00 23.70 N ATOM 692 CZ ARG A 109 -51.223 28.464 79.426 1.00 23.04 C ATOM 693 NH1 ARG A 109 -50.723 29.159 80.436 1.00 28.13 N ATOM 694 NH2 ARG A 109 -52.186 27.587 79.657 1.00 31.56 N ATOM 695 HE ARG A 109 -51.166 28.061 77.427 1.00 0.00 H ATOM 696 HH12 ARG A 109 -51.091 29.016 81.398 1.00 0.00 H ATOM 697 HH11 ARG A 109 -49.962 29.848 80.267 1.00 0.00 H ATOM 698 HH22 ARG A 109 -52.546 27.453 80.623 1.00 0.00 H ATOM 699 HH21 ARG A 109 -52.583 27.032 78.872 1.00 0.00 H ATOM 700 H ARG A 109 -50.211 27.627 73.304 1.00 0.00 H ATOM 701 N ALA A 110 -46.427 27.128 74.191 1.00 8.48 N ATOM 702 CA ALA A 110 -45.584 25.976 73.917 1.00 6.03 C ATOM 703 C ALA A 110 -44.538 25.888 75.022 1.00 6.63 C ATOM 704 O ALA A 110 -43.981 26.911 75.432 1.00 9.99 O ATOM 705 CB ALA A 110 -44.905 26.082 72.541 1.00 6.02 C ATOM 706 H ALA A 110 -45.989 27.990 74.573 1.00 0.00 H ATOM 707 N VAL A 111 -44.278 24.673 75.498 1.00 6.79 N ATOM 708 CA VAL A 111 -43.245 24.393 76.498 1.00 6.53 C ATOM 709 C VAL A 111 -42.197 23.492 75.859 1.00 5.79 C ATOM 710 O VAL A 111 -42.556 22.459 75.284 1.00 7.79 O ATOM 711 CB VAL A 111 -43.829 23.681 77.730 1.00 7.64 C ATOM 712 CG1 VAL A 111 -42.714 23.265 78.685 1.00 9.11 C ATOM 713 CG2 VAL A 111 -44.817 24.614 78.435 1.00 9.81 C ATOM 714 H VAL A 111 -44.841 23.876 75.139 1.00 0.00 H ATOM 715 N SER A 112 -40.917 23.843 76.014 1.00 6.85 N ATOM 716 CA SER A 112 -39.816 22.999 75.562 1.00 6.11 C ATOM 717 C SER A 112 -39.263 22.295 76.793 1.00 8.60 C ATOM 718 O SER A 112 -38.995 22.950 77.810 1.00 8.07 O ATOM 719 CB SER A 112 -38.719 23.799 74.864 1.00 10.17 C ATOM 720 OG SER A 112 -39.188 24.340 73.649 1.00 8.57 O ATOM 721 HG SER A 112 -39.954 24.940 73.830 1.00 0.00 H ATOM 722 H SER A 112 -40.698 24.750 76.473 1.00 0.00 H ATOM 723 N THR A 113 -39.110 20.970 76.709 1.00 7.34 N ATOM 724 CA THR A 113 -38.786 20.171 77.894 1.00 6.47 C ATOM 725 C THR A 113 -37.300 19.972 78.130 1.00 8.97 C ATOM 726 O THR A 113 -36.933 19.501 79.206 1.00 9.74 O ATOM 727 CB THR A 113 -39.512 18.793 77.863 1.00 11.13 C ATOM 728 OG1 THR A 113 -39.187 18.029 76.683 1.00 9.19 O ATOM 729 CG2 THR A 113 -40.996 18.967 77.925 1.00 8.97 C ATOM 730 HG1 THR A 113 -39.458 18.537 75.877 1.00 0.00 H ATOM 731 H THR A 113 -39.223 20.499 75.789 1.00 0.00 H ATOM 732 N HIS A 114 -36.431 20.257 77.158 1.00 6.20 N ATOM 733 CA HIS A 114 -35.018 20.458 77.447 1.00 6.08 C ATOM 734 C HIS A 114 -34.444 21.232 76.261 1.00 4.50 C ATOM 735 O HIS A 114 -35.186 21.663 75.378 1.00 6.29 O ATOM 736 CB HIS A 114 -34.279 19.128 77.793 1.00 6.00 C ATOM 737 CG HIS A 114 -34.078 18.158 76.660 1.00 6.42 C ATOM 738 ND1 HIS A 114 -35.040 17.253 76.254 1.00 6.21 N ATOM 739 CD2 HIS A 114 -32.995 17.926 75.871 1.00 5.56 C ATOM 740 CE1 HIS A 114 -34.562 16.523 75.258 1.00 5.57 C ATOM 741 NE2 HIS A 114 -33.325 16.906 75.010 1.00 6.92 N ATOM 742 H HIS A 114 -36.769 20.337 76.178 1.00 0.00 H ATOM 743 N PHE A 115 -33.139 21.490 76.293 1.00 5.44 N ATOM 744 CA PHE A 115 -32.548 22.509 75.420 1.00 6.12 C ATOM 745 C PHE A 115 -32.090 22.001 74.067 1.00 7.23 C ATOM 746 O PHE A 115 -31.584 22.817 73.276 1.00 8.10 O ATOM 747 CB PHE A 115 -31.344 23.176 76.127 1.00 6.71 C ATOM 748 CG PHE A 115 -30.107 22.285 76.260 1.00 5.82 C ATOM 749 CD1 PHE A 115 -29.992 21.383 77.294 1.00 9.59 C ATOM 750 CD2 PHE A 115 -29.066 22.360 75.341 1.00 9.91 C ATOM 751 CE1 PHE A 115 -28.883 20.598 77.434 1.00 9.60 C ATOM 752 CE2 PHE A 115 -27.943 21.552 75.481 1.00 14.96 C ATOM 753 CZ PHE A 115 -27.860 20.670 76.516 1.00 10.55 C ATOM 754 H PHE A 115 -32.529 20.960 76.948 1.00 0.00 H ATOM 755 N HIS A 116 -32.209 20.703 73.790 1.00 6.47 N ATOM 756 CA HIS A 116 -31.742 20.162 72.516 1.00 5.96 C ATOM 757 C HIS A 116 -32.662 20.560 71.354 1.00 5.94 C ATOM 758 O HIS A 116 -33.801 20.996 71.524 1.00 8.82 O ATOM 759 CB HIS A 116 -31.654 18.646 72.572 1.00 5.07 C ATOM 760 CG HIS A 116 -30.522 18.157 73.393 1.00 5.52 C ATOM 761 ND1 HIS A 116 -30.461 16.882 73.900 1.00 8.71 N ATOM 762 CD2 HIS A 116 -29.384 18.775 73.779 1.00 12.62 C ATOM 763 CE1 HIS A 116 -29.337 16.737 74.577 1.00 8.14 C ATOM 764 NE2 HIS A 116 -28.665 17.871 74.519 1.00 11.92 N ATOM 765 H HIS A 116 -32.640 20.066 74.490 1.00 0.00 H ATOM 766 N ASP A 117 -32.122 20.417 70.139 1.00 8.38 N ATOM 767 CA ASP A 117 -32.808 20.928 68.954 1.00 7.88 C ATOM 768 C ASP A 117 -34.113 20.225 68.647 1.00 6.88 C ATOM 769 O ASP A 117 -34.934 20.802 67.926 1.00 9.37 O ATOM 770 CB ASP A 117 -31.899 20.786 67.739 1.00 14.79 C ATOM 771 CG ASP A 117 -31.224 22.067 67.366 1.00 42.65 C ATOM 772 OD1 ASP A 117 -31.945 23.060 67.108 1.00 39.16 O ATOM 773 OD2 ASP A 117 -29.973 22.069 67.319 1.00 48.40 O ATOM 774 H ASP A 117 -31.205 19.937 70.036 1.00 0.00 H ATOM 775 N ASP A 118 -34.341 19.004 69.155 1.00 9.96 N ATOM 776 CA ASP A 118 -35.632 18.358 68.936 1.00 10.21 C ATOM 777 C ASP A 118 -36.708 18.870 69.893 1.00 6.56 C ATOM 778 O ASP A 118 -37.860 18.441 69.812 1.00 11.36 O ATOM 779 CB ASP A 118 -35.510 16.830 69.048 1.00 9.74 C ATOM 780 CG ASP A 118 -34.942 16.355 70.365 1.00 8.88 C ATOM 781 OD1 ASP A 118 -34.266 17.124 71.089 1.00 9.43 O ATOM 782 OD2 ASP A 118 -35.216 15.159 70.673 1.00 9.05 O ATOM 783 H ASP A 118 -33.601 18.520 69.702 1.00 0.00 H ATOM 784 N ARG A 119 -36.356 19.822 70.736 1.00 7.09 N ATOM 785 CA ARG A 119 -37.270 20.424 71.693 1.00 5.18 C ATOM 786 C ARG A 119 -37.435 21.914 71.500 1.00 9.09 C ATOM 787 O ARG A 119 -38.538 22.427 71.705 1.00 8.86 O ATOM 788 CB ARG A 119 -36.768 20.169 73.118 1.00 7.02 C ATOM 789 CG ARG A 119 -36.452 18.693 73.424 1.00 9.62 C ATOM 790 CD ARG A 119 -37.655 17.789 73.423 1.00 8.80 C ATOM 791 NE ARG A 119 -37.443 16.616 72.582 1.00 10.46 N ATOM 792 CZ ARG A 119 -38.396 15.759 72.203 1.00 13.01 C ATOM 793 NH1 ARG A 119 -39.640 15.902 72.617 1.00 18.84 N ATOM 794 NH2 ARG A 119 -38.092 14.731 71.425 1.00 14.49 N ATOM 795 HE ARG A 119 -36.474 16.432 72.251 1.00 0.00 H ATOM 796 HH12 ARG A 119 -40.370 15.227 72.313 1.00 0.00 H ATOM 797 HH11 ARG A 119 -39.891 16.690 73.247 1.00 0.00 H ATOM 798 HH22 ARG A 119 -38.834 14.064 71.130 1.00 0.00 H ATOM 799 HH21 ARG A 119 -37.111 14.590 71.109 1.00 0.00 H ATOM 800 H ARG A 119 -35.373 20.160 70.715 1.00 0.00 H ATOM 801 N VAL A 120 -36.366 22.604 71.087 1.00 8.98 N ATOM 802 CA VAL A 120 -36.392 24.042 70.851 1.00 6.79 C ATOM 803 C VAL A 120 -36.205 24.409 69.401 1.00 8.60 C ATOM 804 O VAL A 120 -36.396 25.585 69.063 1.00 9.23 O ATOM 805 CB VAL A 120 -35.342 24.788 71.706 1.00 5.81 C ATOM 806 CG1 VAL A 120 -35.598 24.550 73.186 1.00 9.07 C ATOM 807 CG2 VAL A 120 -33.911 24.471 71.300 1.00 9.99 C ATOM 808 H VAL A 120 -35.476 22.091 70.927 1.00 0.00 H ATOM 809 N GLY A 121 -35.779 23.475 68.549 1.00 9.38 N ATOM 810 CA GLY A 121 -35.563 23.769 67.149 1.00 9.18 C ATOM 811 C GLY A 121 -36.900 24.029 66.496 1.00 7.19 C ATOM 812 O GLY A 121 -37.694 23.104 66.356 1.00 11.22 O ATOM 813 H GLY A 121 -35.598 22.513 68.900 1.00 0.00 H ATOM 814 N GLY A 122 -37.169 25.272 66.103 1.00 7.82 N ATOM 815 CA GLY A 122 -38.503 25.662 65.684 1.00 11.73 C ATOM 816 C GLY A 122 -39.174 26.668 66.599 1.00 10.89 C ATOM 817 O GLY A 122 -40.252 27.170 66.267 1.00 9.25 O ATOM 818 H GLY A 122 -36.407 25.979 66.096 1.00 0.00 H ATOM 819 N VAL A 123 -38.547 27.006 67.725 1.00 6.90 N ATOM 820 CA VAL A 123 -39.085 28.029 68.615 1.00 6.64 C ATOM 821 C VAL A 123 -39.278 29.350 67.875 1.00 7.69 C ATOM 822 O VAL A 123 -40.249 30.068 68.125 1.00 10.43 O ATOM 823 CB VAL A 123 -38.179 28.175 69.849 1.00 7.94 C ATOM 824 CG1 VAL A 123 -38.262 29.590 70.465 1.00 14.12 C ATOM 825 CG2 VAL A 123 -38.577 27.129 70.867 1.00 9.07 C ATOM 826 H VAL A 123 -37.656 26.531 67.974 1.00 0.00 H ATOM 827 N ASP A 124 -38.360 29.697 66.959 1.00 10.78 N ATOM 828 CA ASP A 124 -38.494 30.972 66.270 1.00 10.33 C ATOM 829 C ASP A 124 -39.716 30.970 65.346 1.00 10.21 C ATOM 830 O ASP A 124 -40.392 31.996 65.204 1.00 12.06 O ATOM 831 CB ASP A 124 -37.208 31.287 65.496 1.00 8.06 C ATOM 832 CG ASP A 124 -36.007 31.618 66.407 1.00 27.79 C ATOM 833 OD1 ASP A 124 -36.148 31.695 67.651 1.00 21.06 O ATOM 834 OD2 ASP A 124 -34.897 31.817 65.861 1.00 21.46 O ATOM 835 H ASP A 124 -37.564 29.063 66.745 1.00 0.00 H ATOM 836 N VAL A 125 -40.016 29.831 64.714 1.00 8.79 N ATOM 837 CA VAL A 125 -41.224 29.687 63.897 1.00 8.92 C ATOM 838 C VAL A 125 -42.473 29.837 64.762 1.00 9.70 C ATOM 839 O VAL A 125 -43.436 30.513 64.380 1.00 11.64 O ATOM 840 CB VAL A 125 -41.198 28.334 63.171 1.00 8.81 C ATOM 841 CG1 VAL A 125 -42.559 27.937 62.611 1.00 12.23 C ATOM 842 CG2 VAL A 125 -40.174 28.378 62.042 1.00 12.47 C ATOM 843 H VAL A 125 -39.371 29.020 64.805 1.00 0.00 H ATOM 844 N LEU A 126 -42.499 29.160 65.909 1.00 10.80 N ATOM 845 CA LEU A 126 -43.605 29.318 66.849 1.00 9.51 C ATOM 846 C LEU A 126 -43.787 30.772 67.261 1.00 10.06 C ATOM 847 O LEU A 126 -44.906 31.285 67.261 1.00 10.63 O ATOM 848 CB LEU A 126 -43.381 28.468 68.105 1.00 10.98 C ATOM 849 CG LEU A 126 -43.320 26.952 67.956 1.00 8.69 C ATOM 850 CD1 LEU A 126 -43.030 26.307 69.325 1.00 7.77 C ATOM 851 CD2 LEU A 126 -44.610 26.401 67.342 1.00 10.73 C ATOM 852 H LEU A 126 -41.720 28.510 66.138 1.00 0.00 H ATOM 853 N ARG A 127 -42.688 31.448 67.618 1.00 9.00 N ATOM 854 CA ARG A 127 -42.753 32.825 68.098 1.00 9.57 C ATOM 855 C ARG A 127 -43.225 33.784 67.007 1.00 10.41 C ATOM 856 O ARG A 127 -43.962 34.732 67.290 1.00 10.62 O ATOM 857 CB ARG A 127 -41.383 33.241 68.639 1.00 10.26 C ATOM 858 CG ARG A 127 -41.277 34.694 69.078 1.00 10.42 C ATOM 859 CD ARG A 127 -40.173 34.922 70.112 1.00 14.24 C ATOM 860 NE ARG A 127 -38.887 34.357 69.698 1.00 13.84 N ATOM 861 CZ ARG A 127 -38.193 33.439 70.368 1.00 11.87 C ATOM 862 NH1 ARG A 127 -38.617 32.955 71.532 1.00 14.70 N ATOM 863 NH2 ARG A 127 -37.045 33.014 69.873 1.00 9.85 N ATOM 864 HE ARG A 127 -38.481 34.702 68.805 1.00 0.00 H ATOM 865 HH12 ARG A 127 -38.054 32.238 72.033 1.00 0.00 H ATOM 866 HH11 ARG A 127 -39.511 33.293 71.941 1.00 0.00 H ATOM 867 HH22 ARG A 127 -36.492 32.297 70.385 1.00 0.00 H ATOM 868 HH21 ARG A 127 -36.694 33.396 68.971 1.00 0.00 H ATOM 869 H ARG A 127 -41.762 30.979 67.551 1.00 0.00 H ATOM 870 N ALA A 128 -42.790 33.566 65.760 1.00 12.37 N ATOM 871 CA ALA A 128 -43.276 34.367 64.633 1.00 16.26 C ATOM 872 C ALA A 128 -44.768 34.180 64.390 1.00 13.80 C ATOM 873 O ALA A 128 -45.438 35.103 63.898 1.00 16.55 O ATOM 874 CB ALA A 128 -42.500 34.008 63.364 1.00 13.83 C ATOM 875 H ALA A 128 -42.093 32.813 65.587 1.00 0.00 H ATOM 876 N ALA A 129 -45.305 33.009 64.720 1.00 13.78 N ATOM 877 CA ALA A 129 -46.707 32.680 64.532 1.00 14.96 C ATOM 878 C ALA A 129 -47.576 33.160 65.687 1.00 13.07 C ATOM 879 O ALA A 129 -48.785 32.922 65.672 1.00 15.89 O ATOM 880 CB ALA A 129 -46.872 31.165 64.381 1.00 14.88 C ATOM 881 H ALA A 129 -44.684 32.286 65.137 1.00 0.00 H ATOM 882 N GLY A 130 -46.987 33.815 66.680 1.00 10.96 N ATOM 883 CA GLY A 130 -47.726 34.312 67.823 1.00 10.57 C ATOM 884 C GLY A 130 -47.922 33.334 68.953 1.00 12.63 C ATOM 885 O GLY A 130 -48.731 33.599 69.850 1.00 14.61 O ATOM 886 H GLY A 130 -45.961 33.977 66.636 1.00 0.00 H ATOM 887 N VAL A 131 -47.171 32.240 68.970 1.00 10.93 N ATOM 888 CA VAL A 131 -47.201 31.290 70.072 1.00 9.47 C ATOM 889 C VAL A 131 -46.257 31.771 71.162 1.00 9.11 C ATOM 890 O VAL A 131 -45.085 32.063 70.895 1.00 9.43 O ATOM 891 CB VAL A 131 -46.791 29.897 69.586 1.00 7.38 C ATOM 892 CG1 VAL A 131 -46.828 28.919 70.733 1.00 10.90 C ATOM 893 CG2 VAL A 131 -47.699 29.458 68.437 1.00 9.86 C ATOM 894 H VAL A 131 -46.538 32.055 68.166 1.00 0.00 H ATOM 895 N ALA A 132 -46.759 31.836 72.398 1.00 6.85 N ATOM 896 CA ALA A 132 -45.903 32.154 73.530 1.00 6.41 C ATOM 897 C ALA A 132 -45.098 30.912 73.896 1.00 12.88 C ATOM 898 O ALA A 132 -45.683 29.850 74.175 1.00 11.50 O ATOM 899 CB ALA A 132 -46.719 32.633 74.735 1.00 8.97 C ATOM 900 H ALA A 132 -47.772 31.657 72.552 1.00 0.00 H ATOM 901 N THR A 133 -43.779 31.054 73.920 1.00 10.01 N ATOM 902 CA THR A 133 -42.862 29.937 74.136 1.00 4.91 C ATOM 903 C THR A 133 -42.259 30.031 75.524 1.00 9.19 C ATOM 904 O THR A 133 -41.892 31.118 75.979 1.00 10.31 O ATOM 905 CB THR A 133 -41.749 29.891 73.074 1.00 5.59 C ATOM 906 OG1 THR A 133 -41.022 31.130 73.036 1.00 9.06 O ATOM 907 CG2 THR A 133 -42.329 29.573 71.711 1.00 8.26 C ATOM 908 HG1 THR A 133 -40.611 31.297 73.921 1.00 0.00 H ATOM 909 H THR A 133 -43.380 32.004 73.779 1.00 0.00 H ATOM 910 N TYR A 134 -42.170 28.869 76.184 1.00 8.07 N ATOM 911 CA TYR A 134 -41.803 28.736 77.586 1.00 7.30 C ATOM 912 C TYR A 134 -40.767 27.636 77.767 1.00 5.98 C ATOM 913 O TYR A 134 -40.786 26.620 77.075 1.00 7.48 O ATOM 914 CB TYR A 134 -43.029 28.372 78.471 1.00 8.29 C ATOM 915 CG TYR A 134 -44.111 29.415 78.531 1.00 11.34 C ATOM 916 CD1 TYR A 134 -44.987 29.566 77.475 1.00 11.82 C ATOM 917 CD2 TYR A 134 -44.262 30.229 79.650 1.00 13.88 C ATOM 918 CE1 TYR A 134 -45.985 30.522 77.513 1.00 12.43 C ATOM 919 CE2 TYR A 134 -45.261 31.185 79.686 1.00 12.82 C ATOM 920 CZ TYR A 134 -46.116 31.310 78.618 1.00 18.49 C ATOM 921 OH TYR A 134 -47.130 32.248 78.627 1.00 24.65 O ATOM 922 HH TYR A 134 -47.638 32.191 77.779 1.00 0.00 H ATOM 923 H TYR A 134 -42.378 27.998 75.656 1.00 0.00 H ATOM 924 N ALA A 135 -39.864 27.856 78.715 1.00 6.19 N ATOM 925 CA ALA A 135 -38.952 26.828 79.193 1.00 7.23 C ATOM 926 C ALA A 135 -38.463 27.227 80.576 1.00 11.58 C ATOM 927 O ALA A 135 -38.606 28.374 81.002 1.00 10.04 O ATOM 928 CB ALA A 135 -37.767 26.613 78.247 1.00 8.51 C ATOM 929 H ALA A 135 -39.806 28.806 79.135 1.00 0.00 H ATOM 930 N SER A 136 -37.908 26.248 81.297 1.00 9.51 N ATOM 931 CA SER A 136 -37.279 26.574 82.563 1.00 11.92 C ATOM 932 C SER A 136 -36.094 27.509 82.343 1.00 9.61 C ATOM 933 O SER A 136 -35.476 27.516 81.272 1.00 8.79 O ATOM 934 CB SER A 136 -36.797 25.319 83.261 1.00 11.56 C ATOM 935 OG SER A 136 -35.619 24.872 82.637 1.00 11.36 O ATOM 936 HG SER A 136 -35.299 24.051 83.089 1.00 0.00 H ATOM 937 H SER A 136 -37.927 25.266 80.955 1.00 0.00 H ATOM 938 N PRO A 137 -35.716 28.294 83.355 1.00 10.64 N ATOM 939 CA PRO A 137 -34.512 29.116 83.193 1.00 9.83 C ATOM 940 C PRO A 137 -33.266 28.284 82.937 1.00 11.71 C ATOM 941 O PRO A 137 -32.347 28.754 82.252 1.00 12.13 O ATOM 942 CB PRO A 137 -34.428 29.911 84.502 1.00 16.56 C ATOM 943 CG PRO A 137 -35.422 29.303 85.413 1.00 18.87 C ATOM 944 CD PRO A 137 -36.404 28.530 84.638 1.00 12.50 C ATOM 945 N SER A 138 -33.213 27.054 83.465 1.00 10.22 N ATOM 946 CA SER A 138 -32.109 26.156 83.174 1.00 9.36 C ATOM 947 C SER A 138 -32.038 25.828 81.690 1.00 9.07 C ATOM 948 O SER A 138 -30.961 25.871 81.085 1.00 9.75 O ATOM 949 CB SER A 138 -32.247 24.881 84.007 1.00 13.72 C ATOM 950 OG SER A 138 -31.153 24.044 83.739 1.00 17.46 O ATOM 951 HG SER A 138 -30.314 24.512 83.978 1.00 0.00 H ATOM 952 H SER A 138 -33.977 26.736 84.095 1.00 0.00 H ATOM 953 N THR A 139 -33.185 25.495 81.090 1.00 9.76 N ATOM 954 CA THR A 139 -33.228 25.166 79.667 1.00 7.49 C ATOM 955 C THR A 139 -32.865 26.368 78.808 1.00 6.04 C ATOM 956 O THR A 139 -32.109 26.229 77.836 1.00 7.46 O ATOM 957 CB THR A 139 -34.620 24.648 79.298 1.00 10.30 C ATOM 958 OG1 THR A 139 -34.863 23.405 79.947 1.00 8.40 O ATOM 959 CG2 THR A 139 -34.797 24.464 77.792 1.00 10.22 C ATOM 960 HG1 THR A 139 -34.182 22.746 79.660 1.00 0.00 H ATOM 961 H THR A 139 -34.063 25.470 81.646 1.00 0.00 H ATOM 962 N ARG A 140 -33.388 27.549 79.156 1.00 7.27 N ATOM 963 CA ARG A 140 -33.070 28.751 78.394 1.00 8.79 C ATOM 964 C ARG A 140 -31.575 29.042 78.439 1.00 7.82 C ATOM 965 O ARG A 140 -30.981 29.419 77.423 1.00 9.55 O ATOM 966 CB ARG A 140 -33.869 29.949 78.928 1.00 11.77 C ATOM 967 CG ARG A 140 -35.375 29.806 78.715 1.00 11.70 C ATOM 968 CD ARG A 140 -36.185 31.001 79.236 1.00 11.33 C ATOM 969 NE ARG A 140 -36.005 32.175 78.387 1.00 14.42 N ATOM 970 CZ ARG A 140 -35.157 33.175 78.604 1.00 20.42 C ATOM 971 NH1 ARG A 140 -34.365 33.199 79.671 1.00 18.77 N ATOM 972 NH2 ARG A 140 -35.106 34.173 77.732 1.00 22.67 N ATOM 973 HE ARG A 140 -36.595 32.234 77.533 1.00 0.00 H ATOM 974 HH12 ARG A 140 -33.711 33.995 79.815 1.00 0.00 H ATOM 975 HH11 ARG A 140 -34.399 32.422 80.362 1.00 0.00 H ATOM 976 HH22 ARG A 140 -34.449 34.964 77.885 1.00 0.00 H ATOM 977 HH21 ARG A 140 -35.723 34.164 76.895 1.00 0.00 H ATOM 978 H ARG A 140 -34.026 27.610 79.975 1.00 0.00 H ATOM 979 N ARG A 141 -30.944 28.875 79.606 1.00 9.80 N ATOM 980 CA ARG A 141 -29.507 29.103 79.705 1.00 11.12 C ATOM 981 C ARG A 141 -28.727 28.117 78.842 1.00 8.74 C ATOM 982 O ARG A 141 -27.824 28.506 78.089 1.00 10.40 O ATOM 983 CB ARG A 141 -29.069 29.013 81.164 1.00 14.72 C ATOM 984 CG ARG A 141 -27.584 29.142 81.355 1.00 15.52 C ATOM 985 CD ARG A 141 -27.195 28.915 82.800 1.00 20.77 C ATOM 986 NE ARG A 141 -27.783 29.924 83.674 1.00 19.47 N ATOM 987 CZ ARG A 141 -28.707 29.690 84.610 1.00 33.26 C ATOM 988 NH1 ARG A 141 -29.189 28.472 84.822 1.00 33.31 N ATOM 989 NH2 ARG A 141 -29.161 30.697 85.344 1.00 36.78 N ATOM 990 HE ARG A 141 -27.457 30.905 83.559 1.00 0.00 H ATOM 991 HH12 ARG A 141 -29.908 28.318 85.557 1.00 0.00 H ATOM 992 HH11 ARG A 141 -28.848 27.671 84.253 1.00 0.00 H ATOM 993 HH22 ARG A 141 -29.880 30.525 86.075 1.00 0.00 H ATOM 994 HH21 ARG A 141 -28.798 31.659 85.189 1.00 0.00 H ATOM 995 H ARG A 141 -31.481 28.581 80.447 1.00 0.00 H ATOM 996 N LEU A 142 -29.048 26.819 78.949 1.00 8.31 N ATOM 997 CA LEU A 142 -28.315 25.826 78.178 1.00 7.39 C ATOM 998 C LEU A 142 -28.537 25.998 76.677 1.00 9.99 C ATOM 999 O LEU A 142 -27.605 25.802 75.881 1.00 10.40 O ATOM 1000 CB LEU A 142 -28.723 24.428 78.633 1.00 8.50 C ATOM 1001 CG LEU A 142 -28.164 24.071 80.010 1.00 9.89 C ATOM 1002 CD1 LEU A 142 -28.906 22.886 80.654 1.00 12.93 C ATOM 1003 CD2 LEU A 142 -26.674 23.787 79.931 1.00 21.94 C ATOM 1004 H LEU A 142 -29.819 26.523 79.581 1.00 0.00 H ATOM 1005 N ALA A 143 -29.767 26.337 76.262 1.00 11.49 N ATOM 1006 CA ALA A 143 -29.994 26.625 74.856 1.00 9.48 C ATOM 1007 C ALA A 143 -29.116 27.768 74.383 1.00 9.97 C ATOM 1008 O ALA A 143 -28.515 27.675 73.311 1.00 10.27 O ATOM 1009 CB ALA A 143 -31.463 26.944 74.600 1.00 9.80 C ATOM 1010 H ALA A 143 -30.552 26.393 76.942 1.00 0.00 H ATOM 1011 N GLU A 144 -28.987 28.832 75.189 1.00 10.87 N ATOM 1012 CA GLU A 144 -28.136 29.951 74.786 1.00 14.10 C ATOM 1013 C GLU A 144 -26.690 29.511 74.642 1.00 10.88 C ATOM 1014 O GLU A 144 -26.032 29.841 73.648 1.00 13.95 O ATOM 1015 CB GLU A 144 -28.240 31.103 75.781 1.00 15.19 C ATOM 1016 CG GLU A 144 -27.420 32.326 75.341 1.00 16.30 C ATOM 1017 CD GLU A 144 -27.708 33.570 76.142 1.00 33.96 C ATOM 1018 OE1 GLU A 144 -28.677 33.568 76.929 1.00 35.58 O ATOM 1019 OE2 GLU A 144 -26.956 34.557 75.978 1.00 50.19 O ATOM 1020 H GLU A 144 -29.491 28.861 76.098 1.00 0.00 H ATOM 1021 N VAL A 145 -26.180 28.735 75.606 1.00 11.58 N ATOM 1022 CA VAL A 145 -24.790 28.302 75.539 1.00 15.39 C ATOM 1023 C VAL A 145 -24.541 27.493 74.271 1.00 13.44 C ATOM 1024 O VAL A 145 -23.491 27.641 73.621 1.00 16.76 O ATOM 1025 CB VAL A 145 -24.401 27.503 76.800 1.00 15.31 C ATOM 1026 CG1 VAL A 145 -23.018 26.885 76.614 1.00 16.62 C ATOM 1027 CG2 VAL A 145 -24.433 28.396 78.009 1.00 17.92 C ATOM 1028 H VAL A 145 -26.777 28.440 76.405 1.00 0.00 H ATOM 1029 N GLU A 146 -25.493 26.633 73.896 1.00 12.95 N ATOM 1030 CA GLU A 146 -25.392 25.744 72.741 1.00 11.77 C ATOM 1031 C GLU A 146 -25.582 26.474 71.413 1.00 15.85 C ATOM 1032 O GLU A 146 -25.395 25.859 70.358 1.00 15.01 O ATOM 1033 CB GLU A 146 -26.456 24.631 72.841 1.00 14.28 C ATOM 1034 CG GLU A 146 -26.145 23.348 72.100 1.00 28.22 C ATOM 1035 CD GLU A 146 -25.023 22.554 72.748 1.00 43.59 C ATOM 1036 OE1 GLU A 146 -24.560 22.947 73.847 1.00 35.71 O ATOM 1037 OE2 GLU A 146 -24.614 21.532 72.157 1.00 44.82 O ATOM 1038 H GLU A 146 -26.363 26.594 74.464 1.00 0.00 H ATOM 1039 N GLY A 147 -25.991 27.734 71.442 1.00 12.98 N ATOM 1040 CA GLY A 147 -26.359 28.454 70.239 1.00 15.03 C ATOM 1041 C GLY A 147 -27.682 28.043 69.626 1.00 13.88 C ATOM 1042 O GLY A 147 -27.942 28.368 68.466 1.00 13.52 O ATOM 1043 H GLY A 147 -26.050 28.223 72.358 1.00 0.00 H ATOM 1044 N ASN A 148 -28.548 27.375 70.393 1.00 7.84 N ATOM 1045 CA ASN A 148 -29.861 26.961 69.920 1.00 8.03 C ATOM 1046 C ASN A 148 -30.898 28.088 70.100 1.00 7.93 C ATOM 1047 O ASN A 148 -30.657 29.119 70.733 1.00 11.52 O ATOM 1048 CB ASN A 148 -30.331 25.708 70.682 1.00 7.76 C ATOM 1049 CG ASN A 148 -29.462 24.475 70.437 1.00 10.30 C ATOM 1050 OD1 ASN A 148 -28.576 24.449 69.551 1.00 13.13 O ATOM 1051 ND2 ASN A 148 -29.721 23.418 71.217 1.00 12.73 N ATOM 1052 HD22 ASN A 148 -30.464 23.477 71.942 1.00 0.00 H ATOM 1053 HD21 ASN A 148 -29.179 22.538 71.098 1.00 0.00 H ATOM 1054 H ASN A 148 -28.273 27.141 71.368 1.00 0.00 H ATOM 1055 N GLU A 149 -32.089 27.866 69.549 1.00 8.53 N ATOM 1056 CA GLU A 149 -33.197 28.792 69.738 1.00 8.03 C ATOM 1057 C GLU A 149 -33.637 28.796 71.195 1.00 8.79 C ATOM 1058 O GLU A 149 -33.548 27.781 71.885 1.00 9.15 O ATOM 1059 CB GLU A 149 -34.360 28.400 68.818 1.00 11.20 C ATOM 1060 CG GLU A 149 -33.955 28.513 67.337 1.00 11.56 C ATOM 1061 CD GLU A 149 -34.874 27.766 66.390 1.00 18.01 C ATOM 1062 OE1 GLU A 149 -36.046 28.143 66.287 1.00 14.76 O ATOM 1063 OE2 GLU A 149 -34.412 26.787 65.758 1.00 25.13 O ATOM 1064 H GLU A 149 -32.231 27.013 68.971 1.00 0.00 H ATOM 1065 N ILE A 150 -34.095 29.953 71.663 1.00 11.68 N ATOM 1066 CA ILE A 150 -34.307 30.183 73.097 1.00 11.35 C ATOM 1067 C ILE A 150 -35.767 30.551 73.339 1.00 11.97 C ATOM 1068 O ILE A 150 -36.199 31.643 72.922 1.00 10.36 O ATOM 1069 CB ILE A 150 -33.405 31.301 73.656 1.00 12.74 C ATOM 1070 CG1 ILE A 150 -31.922 31.024 73.393 1.00 12.19 C ATOM 1071 CG2 ILE A 150 -33.644 31.476 75.158 1.00 15.29 C ATOM 1072 CD1 ILE A 150 -31.083 32.292 73.474 1.00 16.08 C ATOM 1073 H ILE A 150 -34.310 30.719 70.993 1.00 0.00 H ATOM 1074 N PRO A 151 -36.555 29.697 74.011 1.00 8.05 N ATOM 1075 CA PRO A 151 -37.906 30.101 74.402 1.00 7.71 C ATOM 1076 C PRO A 151 -37.934 31.435 75.138 1.00 10.05 C ATOM 1077 O PRO A 151 -37.033 31.769 75.907 1.00 10.11 O ATOM 1078 CB PRO A 151 -38.365 28.959 75.314 1.00 10.03 C ATOM 1079 CG PRO A 151 -37.558 27.764 74.847 1.00 10.95 C ATOM 1080 CD PRO A 151 -36.237 28.323 74.460 1.00 6.70 C ATOM 1081 N THR A 152 -39.006 32.187 74.911 1.00 9.19 N ATOM 1082 CA THR A 152 -39.089 33.545 75.440 1.00 9.58 C ATOM 1083 C THR A 152 -39.276 33.578 76.950 1.00 9.92 C ATOM 1084 O THR A 152 -38.582 34.328 77.654 1.00 9.49 O ATOM 1085 CB THR A 152 -40.237 34.300 74.757 1.00 10.62 C ATOM 1086 OG1 THR A 152 -39.874 34.549 73.407 1.00 14.16 O ATOM 1087 CG2 THR A 152 -40.475 35.643 75.419 1.00 12.20 C ATOM 1088 HG1 THR A 152 -40.607 35.036 72.954 1.00 0.00 H ATOM 1089 H THR A 152 -39.794 31.804 74.351 1.00 0.00 H ATOM 1090 N HIS A 153 -40.254 32.845 77.452 1.00 8.39 N ATOM 1091 CA HIS A 153 -40.717 32.946 78.824 1.00 8.43 C ATOM 1092 C HIS A 153 -40.038 31.904 79.699 1.00 11.09 C ATOM 1093 O HIS A 153 -39.718 30.810 79.231 1.00 9.46 O ATOM 1094 CB HIS A 153 -42.201 32.734 78.887 1.00 9.36 C ATOM 1095 CG HIS A 153 -42.988 33.868 78.331 1.00 10.69 C ATOM 1096 ND1 HIS A 153 -43.278 34.989 79.075 1.00 12.28 N ATOM 1097 CD2 HIS A 153 -43.564 34.042 77.126 1.00 10.87 C ATOM 1098 CE1 HIS A 153 -43.998 35.814 78.338 1.00 13.32 C ATOM 1099 NE2 HIS A 153 -44.176 35.263 77.152 1.00 11.00 N ATOM 1100 H HIS A 153 -40.719 32.155 76.828 1.00 0.00 H ATOM 1101 N SER A 154 -39.800 32.264 80.960 1.00 11.17 N ATOM 1102 CA SER A 154 -39.148 31.395 81.930 1.00 10.38 C ATOM 1103 C SER A 154 -40.171 30.818 82.892 1.00 11.18 C ATOM 1104 O SER A 154 -40.954 31.562 83.506 1.00 15.27 O ATOM 1105 CB SER A 154 -38.088 32.145 82.737 1.00 10.72 C ATOM 1106 OG SER A 154 -37.144 32.778 81.914 1.00 16.35 O ATOM 1107 HG SER A 154 -37.603 33.430 81.328 1.00 0.00 H ATOM 1108 H SER A 154 -40.095 33.213 81.267 1.00 0.00 H ATOM 1109 N LEU A 155 -40.139 29.500 83.054 1.00 11.02 N ATOM 1110 CA LEU A 155 -41.037 28.796 83.965 1.00 9.80 C ATOM 1111 C LEU A 155 -40.445 28.767 85.365 1.00 17.27 C ATOM 1112 O LEU A 155 -39.391 28.160 85.586 1.00 16.05 O ATOM 1113 CB LEU A 155 -41.285 27.382 83.471 1.00 13.40 C ATOM 1114 CG LEU A 155 -42.008 27.240 82.140 1.00 15.02 C ATOM 1115 CD1 LEU A 155 -41.885 25.804 81.653 1.00 18.34 C ATOM 1116 CD2 LEU A 155 -43.440 27.629 82.322 1.00 19.00 C ATOM 1117 H LEU A 155 -39.446 28.947 82.510 1.00 0.00 H ATOM 1118 N GLU A 156 -41.143 29.379 86.319 1.00 18.36 N ATOM 1119 CA GLU A 156 -40.673 29.339 87.693 1.00 26.82 C ATOM 1120 C GLU A 156 -41.160 28.069 88.384 1.00 16.68 C ATOM 1121 O GLU A 156 -42.107 27.414 87.944 1.00 16.67 O ATOM 1122 CB GLU A 156 -41.151 30.577 88.461 1.00 31.18 C ATOM 1123 CG GLU A 156 -40.602 31.903 87.915 1.00 37.96 C ATOM 1124 CD GLU A 156 -39.102 31.874 87.675 1.00 54.15 C ATOM 1125 OE1 GLU A 156 -38.378 31.186 88.432 1.00 56.87 O ATOM 1126 OE2 GLU A 156 -38.648 32.537 86.716 1.00 49.89 O ATOM 1127 H GLU A 156 -42.021 29.884 86.082 1.00 0.00 H ATOM 1128 N GLY A 157 -40.489 27.732 89.481 1.00 18.23 N ATOM 1129 CA GLY A 157 -40.948 26.673 90.364 1.00 15.27 C ATOM 1130 C GLY A 157 -40.468 25.285 90.024 1.00 12.48 C ATOM 1131 O GLY A 157 -41.013 24.306 90.562 1.00 15.80 O ATOM 1132 H GLY A 157 -39.612 28.240 89.714 1.00 0.00 H ATOM 1133 N LEU A 158 -39.469 25.165 89.160 1.00 13.35 N ATOM 1134 CA LEU A 158 -39.003 23.863 88.694 1.00 12.04 C ATOM 1135 C LEU A 158 -37.510 23.665 88.928 1.00 10.12 C ATOM 1136 O LEU A 158 -36.880 22.850 88.251 1.00 17.04 O ATOM 1137 CB LEU A 158 -39.339 23.697 87.213 1.00 12.05 C ATOM 1138 CG LEU A 158 -40.830 23.617 86.936 1.00 12.33 C ATOM 1139 CD1 LEU A 158 -41.139 23.862 85.455 1.00 12.91 C ATOM 1140 CD2 LEU A 158 -41.394 22.275 87.404 1.00 13.46 C ATOM 1141 H LEU A 158 -39.004 26.024 88.804 1.00 0.00 H ATOM 1142 N SER A 159 -36.933 24.382 89.882 1.00 15.55 N ATOM 1143 CA SER A 159 -35.492 24.440 90.013 1.00 20.71 C ATOM 1144 C SER A 159 -34.914 23.296 90.824 1.00 16.06 C ATOM 1145 O SER A 159 -33.725 23.005 90.672 1.00 18.84 O ATOM 1146 CB SER A 159 -35.077 25.758 90.662 1.00 28.41 C ATOM 1147 OG SER A 159 -35.533 25.798 91.988 1.00 30.00 O ATOM 1148 HG SER A 159 -35.261 26.654 92.404 1.00 0.00 H ATOM 1149 H SER A 159 -37.527 24.914 90.550 1.00 0.00 H ATOM 1150 N SER A 160 -35.721 22.639 91.655 1.00 16.33 N ATOM 1151 CA SER A 160 -35.261 21.539 92.501 1.00 17.80 C ATOM 1152 C SER A 160 -35.914 20.225 92.104 1.00 9.74 C ATOM 1153 O SER A 160 -37.101 20.184 91.771 1.00 14.69 O ATOM 1154 CB SER A 160 -35.567 21.830 93.968 1.00 23.60 C ATOM 1155 OG SER A 160 -34.802 22.937 94.384 1.00 28.79 O ATOM 1156 HG SER A 160 -34.995 23.132 95.335 1.00 0.00 H ATOM 1157 H SER A 160 -36.721 22.920 91.704 1.00 0.00 H ATOM 1158 N SER A 161 -35.121 19.157 92.156 1.00 13.61 N ATOM 1159 CA SER A 161 -35.634 17.812 91.920 1.00 11.30 C ATOM 1160 C SER A 161 -36.878 17.558 92.751 1.00 16.28 C ATOM 1161 O SER A 161 -36.893 17.798 93.957 1.00 14.87 O ATOM 1162 CB SER A 161 -34.568 16.764 92.247 1.00 16.11 C ATOM 1163 OG SER A 161 -33.501 16.853 91.324 1.00 27.99 O ATOM 1164 HG SER A 161 -32.818 16.171 91.544 1.00 0.00 H ATOM 1165 H SER A 161 -34.111 19.285 92.370 1.00 0.00 H ATOM 1166 N GLY A 162 -37.923 17.062 92.091 1.00 12.53 N ATOM 1167 CA GLY A 162 -39.187 16.804 92.732 1.00 14.44 C ATOM 1168 C GLY A 162 -40.191 17.943 92.637 1.00 17.67 C ATOM 1169 O GLY A 162 -41.343 17.766 93.058 1.00 17.40 O ATOM 1170 H GLY A 162 -37.823 16.854 91.077 1.00 0.00 H ATOM 1171 N ASP A 163 -39.788 19.099 92.104 1.00 14.41 N ATOM 1172 CA ASP A 163 -40.699 20.228 91.935 1.00 12.73 C ATOM 1173 C ASP A 163 -41.712 19.959 90.832 1.00 14.16 C ATOM 1174 O ASP A 163 -41.369 19.436 89.769 1.00 12.84 O ATOM 1175 CB ASP A 163 -39.934 21.513 91.576 1.00 17.26 C ATOM 1176 CG ASP A 163 -39.210 22.151 92.769 1.00 24.93 C ATOM 1177 OD1 ASP A 163 -39.487 21.764 93.922 1.00 23.73 O ATOM 1178 OD2 ASP A 163 -38.390 23.072 92.540 1.00 20.19 O ATOM 1179 H ASP A 163 -38.798 19.198 91.801 1.00 0.00 H ATOM 1180 N ALA A 164 -42.948 20.387 91.067 1.00 11.50 N ATOM 1181 CA ALA A 164 -44.016 20.321 90.079 1.00 9.58 C ATOM 1182 C ALA A 164 -44.781 21.631 90.085 1.00 18.67 C ATOM 1183 O ALA A 164 -44.946 22.280 91.130 1.00 15.59 O ATOM 1184 CB ALA A 164 -44.971 19.171 90.339 1.00 14.16 C ATOM 1185 H ALA A 164 -43.163 20.789 92.002 1.00 0.00 H ATOM 1186 N VAL A 165 -45.276 22.003 88.912 1.00 12.10 N ATOM 1187 CA VAL A 165 -46.139 23.166 88.786 1.00 11.82 C ATOM 1188 C VAL A 165 -47.205 22.852 87.754 1.00 15.41 C ATOM 1189 O VAL A 165 -46.984 22.087 86.811 1.00 14.35 O ATOM 1190 CB VAL A 165 -45.371 24.445 88.396 1.00 16.45 C ATOM 1191 CG1 VAL A 165 -44.201 24.659 89.320 1.00 22.85 C ATOM 1192 CG2 VAL A 165 -44.893 24.373 86.969 1.00 19.40 C ATOM 1193 H VAL A 165 -45.041 21.450 88.063 1.00 0.00 H ATOM 1194 N ARG A 166 -48.372 23.449 87.950 1.00 12.47 N ATOM 1195 CA ARG A 166 -49.462 23.358 87.006 1.00 11.13 C ATOM 1196 C ARG A 166 -49.283 24.413 85.925 1.00 15.57 C ATOM 1197 O ARG A 166 -48.973 25.570 86.225 1.00 15.27 O ATOM 1198 CB ARG A 166 -50.801 23.567 87.722 1.00 16.78 C ATOM 1199 CG ARG A 166 -51.984 23.273 86.852 1.00 19.69 C ATOM 1200 CD ARG A 166 -52.274 21.780 86.758 1.00 32.40 C ATOM 1201 NE ARG A 166 -53.356 21.588 85.810 1.00 26.86 N ATOM 1202 CZ ARG A 166 -54.324 20.696 85.919 1.00 27.23 C ATOM 1203 NH1 ARG A 166 -55.264 20.665 84.991 1.00 21.74 N ATOM 1204 NH2 ARG A 166 -54.371 19.860 86.945 1.00 26.09 N ATOM 1205 HE ARG A 166 -53.370 22.206 84.973 1.00 0.00 H ATOM 1206 HH12 ARG A 166 -56.036 19.971 85.056 1.00 0.00 H ATOM 1207 HH11 ARG A 166 -55.232 21.334 84.196 1.00 0.00 H ATOM 1208 HH22 ARG A 166 -55.141 19.164 87.014 1.00 0.00 H ATOM 1209 HH21 ARG A 166 -53.638 19.899 87.682 1.00 0.00 H ATOM 1210 H ARG A 166 -48.509 24.005 88.818 1.00 0.00 H ATOM 1211 N PHE A 167 -49.473 24.001 84.672 1.00 13.06 N ATOM 1212 CA PHE A 167 -49.385 24.895 83.516 1.00 11.21 C ATOM 1213 C PHE A 167 -50.557 24.565 82.598 1.00 13.12 C ATOM 1214 O PHE A 167 -50.519 23.591 81.839 1.00 13.23 O ATOM 1215 CB PHE A 167 -48.047 24.720 82.812 1.00 10.32 C ATOM 1216 CG PHE A 167 -47.703 25.837 81.869 1.00 11.20 C ATOM 1217 CD1 PHE A 167 -47.103 26.992 82.350 1.00 13.68 C ATOM 1218 CD2 PHE A 167 -47.962 25.736 80.513 1.00 15.38 C ATOM 1219 CE1 PHE A 167 -46.776 28.026 81.497 1.00 12.08 C ATOM 1220 CE2 PHE A 167 -47.620 26.756 79.653 1.00 12.27 C ATOM 1221 CZ PHE A 167 -47.025 27.905 80.155 1.00 11.54 C ATOM 1222 H PHE A 167 -49.694 22.998 84.508 1.00 0.00 H ATOM 1223 N GLY A 168 -51.628 25.339 82.694 1.00 12.97 N ATOM 1224 CA GLY A 168 -52.797 25.037 81.915 1.00 13.30 C ATOM 1225 C GLY A 168 -53.306 23.634 82.223 1.00 13.98 C ATOM 1226 O GLY A 168 -53.506 23.280 83.393 1.00 15.47 O ATOM 1227 H GLY A 168 -51.623 26.162 83.330 1.00 0.00 H ATOM 1228 N PRO A 169 -53.535 22.809 81.196 1.00 14.43 N ATOM 1229 CA PRO A 169 -54.116 21.481 81.423 1.00 11.29 C ATOM 1230 C PRO A 169 -53.123 20.402 81.829 1.00 12.12 C ATOM 1231 O PRO A 169 -53.516 19.233 81.907 1.00 14.66 O ATOM 1232 CB PRO A 169 -54.741 21.156 80.059 1.00 18.81 C ATOM 1233 CG PRO A 169 -53.809 21.810 79.093 1.00 16.73 C ATOM 1234 CD PRO A 169 -53.391 23.091 79.751 1.00 17.66 C ATOM 1235 N VAL A 170 -51.867 20.746 82.116 1.00 12.24 N ATOM 1236 CA VAL A 170 -50.860 19.741 82.421 1.00 8.90 C ATOM 1237 C VAL A 170 -50.174 20.114 83.718 1.00 8.68 C ATOM 1238 O VAL A 170 -50.279 21.237 84.213 1.00 10.31 O ATOM 1239 CB VAL A 170 -49.797 19.608 81.298 1.00 7.80 C ATOM 1240 CG1 VAL A 170 -50.435 19.330 79.935 1.00 9.42 C ATOM 1241 CG2 VAL A 170 -48.927 20.841 81.258 1.00 7.94 C ATOM 1242 H VAL A 170 -51.602 21.752 82.122 1.00 0.00 H ATOM 1243 N GLU A 171 -49.464 19.139 84.274 1.00 8.66 N ATOM 1244 CA GLU A 171 -48.485 19.368 85.320 1.00 8.60 C ATOM 1245 C GLU A 171 -47.098 19.197 84.714 1.00 8.57 C ATOM 1246 O GLU A 171 -46.873 18.264 83.933 1.00 9.52 O ATOM 1247 CB GLU A 171 -48.690 18.405 86.483 1.00 10.08 C ATOM 1248 CG GLU A 171 -47.803 18.689 87.655 1.00 13.39 C ATOM 1249 CD GLU A 171 -48.202 17.887 88.891 1.00 22.64 C ATOM 1250 OE1 GLU A 171 -48.066 16.647 88.871 1.00 18.73 O ATOM 1251 OE2 GLU A 171 -48.659 18.504 89.871 1.00 32.63 O ATOM 1252 H GLU A 171 -49.617 18.165 83.944 1.00 0.00 H ATOM 1253 N LEU A 172 -46.201 20.128 85.046 1.00 9.39 N ATOM 1254 CA LEU A 172 -44.796 20.069 84.664 1.00 8.98 C ATOM 1255 C LEU A 172 -44.000 19.609 85.876 1.00 11.55 C ATOM 1256 O LEU A 172 -44.272 20.049 86.992 1.00 11.09 O ATOM 1257 CB LEU A 172 -44.286 21.430 84.202 1.00 7.24 C ATOM 1258 CG LEU A 172 -45.090 22.098 83.083 1.00 10.49 C ATOM 1259 CD1 LEU A 172 -44.570 23.509 82.825 1.00 11.64 C ATOM 1260 CD2 LEU A 172 -45.082 21.268 81.800 1.00 9.63 C ATOM 1261 H LEU A 172 -46.523 20.941 85.609 1.00 0.00 H ATOM 1262 N PHE A 173 -43.081 18.673 85.673 1.00 5.69 N ATOM 1263 CA PHE A 173 -42.349 18.065 86.776 1.00 7.87 C ATOM 1264 C PHE A 173 -40.874 18.045 86.441 1.00 7.23 C ATOM 1265 O PHE A 173 -40.495 17.618 85.350 1.00 6.50 O ATOM 1266 CB PHE A 173 -42.888 16.640 87.008 1.00 8.64 C ATOM 1267 CG PHE A 173 -42.249 15.877 88.147 1.00 9.75 C ATOM 1268 CD1 PHE A 173 -42.472 16.242 89.462 1.00 10.58 C ATOM 1269 CD2 PHE A 173 -41.491 14.739 87.896 1.00 10.75 C ATOM 1270 CE1 PHE A 173 -41.907 15.501 90.514 1.00 14.51 C ATOM 1271 CE2 PHE A 173 -40.928 14.015 88.929 1.00 9.13 C ATOM 1272 CZ PHE A 173 -41.141 14.399 90.237 1.00 10.96 C ATOM 1273 H PHE A 173 -42.878 18.365 84.700 1.00 0.00 H ATOM 1274 N TYR A 174 -40.038 18.506 87.369 1.00 8.90 N ATOM 1275 CA TYR A 174 -38.607 18.372 87.189 1.00 9.11 C ATOM 1276 C TYR A 174 -38.144 17.195 88.026 1.00 9.21 C ATOM 1277 O TYR A 174 -38.114 17.310 89.254 1.00 9.59 O ATOM 1278 CB TYR A 174 -37.867 19.638 87.610 1.00 9.78 C ATOM 1279 CG TYR A 174 -36.366 19.482 87.567 1.00 7.34 C ATOM 1280 CD1 TYR A 174 -35.722 19.066 86.403 1.00 7.07 C ATOM 1281 CD2 TYR A 174 -35.577 19.764 88.674 1.00 9.45 C ATOM 1282 CE1 TYR A 174 -34.356 18.920 86.362 1.00 7.65 C ATOM 1283 CE2 TYR A 174 -34.216 19.629 88.635 1.00 9.57 C ATOM 1284 CZ TYR A 174 -33.601 19.210 87.477 1.00 9.49 C ATOM 1285 OH TYR A 174 -32.234 19.072 87.453 1.00 12.59 O ATOM 1286 HH TYR A 174 -31.950 18.766 86.555 1.00 0.00 H ATOM 1287 H TYR A 174 -40.413 18.963 88.225 1.00 0.00 H ATOM 1288 N PRO A 175 -37.801 16.053 87.430 1.00 7.27 N ATOM 1289 CA PRO A 175 -37.461 14.869 88.234 1.00 7.53 C ATOM 1290 C PRO A 175 -36.036 14.863 88.735 1.00 9.76 C ATOM 1291 O PRO A 175 -35.666 13.963 89.501 1.00 9.64 O ATOM 1292 CB PRO A 175 -37.709 13.729 87.249 1.00 9.65 C ATOM 1293 CG PRO A 175 -37.303 14.322 85.920 1.00 10.07 C ATOM 1294 CD PRO A 175 -37.763 15.759 85.985 1.00 9.36 C ATOM 1295 N GLY A 176 -35.219 15.814 88.310 1.00 11.78 N ATOM 1296 CA GLY A 176 -33.785 15.754 88.489 1.00 10.09 C ATOM 1297 C GLY A 176 -33.092 15.508 87.156 1.00 8.98 C ATOM 1298 O GLY A 176 -33.717 15.209 86.141 1.00 7.35 O ATOM 1299 H GLY A 176 -35.626 16.640 87.826 1.00 0.00 H ATOM 1300 N ALA A 177 -31.780 15.656 87.190 1.00 9.29 N ATOM 1301 CA ALA A 177 -30.953 15.459 86.001 1.00 7.56 C ATOM 1302 C ALA A 177 -31.045 14.007 85.509 1.00 8.80 C ATOM 1303 O ALA A 177 -31.092 13.049 86.299 1.00 8.24 O ATOM 1304 CB ALA A 177 -29.505 15.839 86.325 1.00 9.74 C ATOM 1305 H ALA A 177 -31.323 15.920 88.086 1.00 0.00 H ATOM 1306 N ALA A 178 -31.050 13.844 84.188 1.00 8.50 N ATOM 1307 CA ALA A 178 -31.195 12.519 83.603 1.00 8.29 C ATOM 1308 C ALA A 178 -30.576 12.575 82.212 1.00 7.55 C ATOM 1309 O ALA A 178 -29.362 12.635 82.098 1.00 9.26 O ATOM 1310 CB ALA A 178 -32.663 12.100 83.599 1.00 9.51 C ATOM 1311 H ALA A 178 -30.949 14.672 83.567 1.00 0.00 H ATOM 1312 N HIS A 179 -31.402 12.594 81.157 1.00 5.11 N ATOM 1313 CA HIS A 179 -30.903 12.785 79.791 1.00 4.24 C ATOM 1314 C HIS A 179 -30.162 14.111 79.660 1.00 7.00 C ATOM 1315 O HIS A 179 -29.190 14.225 78.899 1.00 8.68 O ATOM 1316 CB HIS A 179 -32.093 12.696 78.813 1.00 8.15 C ATOM 1317 CG HIS A 179 -31.794 13.167 77.422 1.00 5.82 C ATOM 1318 ND1 HIS A 179 -31.226 12.342 76.480 1.00 7.67 N ATOM 1319 CD2 HIS A 179 -32.010 14.354 76.798 1.00 5.28 C ATOM 1320 CE1 HIS A 179 -31.055 13.005 75.352 1.00 8.99 C ATOM 1321 NE2 HIS A 179 -31.536 14.224 75.512 1.00 6.34 N ATOM 1322 H HIS A 179 -32.423 12.470 81.311 1.00 0.00 H ATOM 1323 N SER A 180 -30.656 15.133 80.335 1.00 6.83 N ATOM 1324 CA SER A 180 -29.991 16.426 80.459 1.00 9.35 C ATOM 1325 C SER A 180 -30.217 16.924 81.875 1.00 7.30 C ATOM 1326 O SER A 180 -31.076 16.408 82.607 1.00 8.37 O ATOM 1327 CB SER A 180 -30.514 17.416 79.407 1.00 11.56 C ATOM 1328 OG SER A 180 -31.909 17.570 79.508 1.00 12.82 O ATOM 1329 HG SER A 180 -32.138 17.913 80.408 1.00 0.00 H ATOM 1330 H SER A 180 -31.575 15.009 80.807 1.00 0.00 H ATOM 1331 N THR A 181 -29.468 17.966 82.281 1.00 9.02 N ATOM 1332 CA THR A 181 -29.646 18.473 83.641 1.00 8.54 C ATOM 1333 C THR A 181 -30.943 19.230 83.822 1.00 10.48 C ATOM 1334 O THR A 181 -31.420 19.339 84.959 1.00 11.37 O ATOM 1335 CB THR A 181 -28.461 19.354 84.063 1.00 18.80 C ATOM 1336 OG1 THR A 181 -28.352 20.480 83.194 1.00 21.85 O ATOM 1337 CG2 THR A 181 -27.184 18.592 83.981 1.00 17.68 C ATOM 1338 HG1 THR A 181 -28.210 20.166 82.266 1.00 0.00 H ATOM 1339 H THR A 181 -28.776 18.402 81.639 1.00 0.00 H ATOM 1340 N ASP A 182 -31.588 19.632 82.727 1.00 8.06 N ATOM 1341 CA ASP A 182 -32.758 20.492 82.725 1.00 11.43 C ATOM 1342 C ASP A 182 -34.035 19.766 82.343 1.00 8.76 C ATOM 1343 O ASP A 182 -35.097 20.398 82.305 1.00 10.34 O ATOM 1344 CB ASP A 182 -32.529 21.661 81.752 1.00 10.67 C ATOM 1345 CG ASP A 182 -32.314 21.193 80.298 1.00 10.96 C ATOM 1346 OD1 ASP A 182 -31.591 20.207 80.098 1.00 9.82 O ATOM 1347 OD2 ASP A 182 -32.877 21.818 79.362 1.00 8.67 O ATOM 1348 H ASP A 182 -31.227 19.306 81.808 1.00 0.00 H ATOM 1349 N ASN A 183 -33.982 18.461 82.098 1.00 7.38 N ATOM 1350 CA ASN A 183 -35.117 17.834 81.448 1.00 5.24 C ATOM 1351 C ASN A 183 -36.369 17.871 82.337 1.00 7.78 C ATOM 1352 O ASN A 183 -36.328 17.597 83.537 1.00 9.27 O ATOM 1353 CB ASN A 183 -34.796 16.410 80.967 1.00 6.16 C ATOM 1354 CG ASN A 183 -34.070 15.509 81.977 1.00 8.59 C ATOM 1355 OD1 ASN A 183 -33.390 14.586 81.528 1.00 9.60 O ATOM 1356 ND2 ASN A 183 -34.295 15.673 83.283 1.00 6.59 N ATOM 1357 HD22 ASN A 183 -34.877 16.469 83.615 1.00 0.00 H ATOM 1358 HD21 ASN A 183 -33.889 15.005 83.969 1.00 0.00 H ATOM 1359 H ASN A 183 -33.147 17.903 82.366 1.00 0.00 H ATOM 1360 N LEU A 184 -37.498 18.211 81.704 1.00 5.56 N ATOM 1361 CA LEU A 184 -38.809 18.207 82.347 1.00 6.41 C ATOM 1362 C LEU A 184 -39.639 17.037 81.831 1.00 6.64 C ATOM 1363 O LEU A 184 -39.471 16.568 80.698 1.00 7.51 O ATOM 1364 CB LEU A 184 -39.585 19.492 82.043 1.00 8.82 C ATOM 1365 CG LEU A 184 -39.001 20.820 82.493 1.00 9.43 C ATOM 1366 CD1 LEU A 184 -40.021 21.881 82.150 1.00 9.55 C ATOM 1367 CD2 LEU A 184 -38.725 20.848 83.960 1.00 10.61 C ATOM 1368 H LEU A 184 -37.439 18.492 80.704 1.00 0.00 H ATOM 1369 N VAL A 185 -40.562 16.571 82.659 1.00 5.44 N ATOM 1370 CA VAL A 185 -41.605 15.670 82.175 1.00 8.03 C ATOM 1371 C VAL A 185 -42.969 16.344 82.343 1.00 8.24 C ATOM 1372 O VAL A 185 -43.128 17.321 83.072 1.00 9.19 O ATOM 1373 CB VAL A 185 -41.575 14.280 82.850 1.00 16.68 C ATOM 1374 CG1 VAL A 185 -40.235 13.610 82.632 1.00 13.30 C ATOM 1375 CG2 VAL A 185 -41.900 14.327 84.295 1.00 16.66 C ATOM 1376 H VAL A 185 -40.544 16.849 83.661 1.00 0.00 H ATOM 1377 N VAL A 186 -43.954 15.837 81.601 1.00 7.37 N ATOM 1378 CA VAL A 186 -45.275 16.460 81.531 1.00 10.16 C ATOM 1379 C VAL A 186 -46.352 15.408 81.801 1.00 6.95 C ATOM 1380 O VAL A 186 -46.371 14.347 81.171 1.00 9.32 O ATOM 1381 CB VAL A 186 -45.483 17.129 80.162 1.00 8.22 C ATOM 1382 CG1 VAL A 186 -46.842 17.786 80.081 1.00 9.58 C ATOM 1383 CG2 VAL A 186 -44.392 18.136 79.895 1.00 11.20 C ATOM 1384 H VAL A 186 -43.777 14.970 81.054 1.00 0.00 H ATOM 1385 N TYR A 187 -47.267 15.710 82.720 1.00 7.52 N ATOM 1386 CA TYR A 187 -48.396 14.815 82.981 1.00 9.03 C ATOM 1387 C TYR A 187 -49.723 15.505 82.666 1.00 7.03 C ATOM 1388 O TYR A 187 -49.923 16.673 83.017 1.00 9.81 O ATOM 1389 CB TYR A 187 -48.384 14.366 84.419 1.00 9.36 C ATOM 1390 CG TYR A 187 -49.359 13.274 84.734 1.00 9.97 C ATOM 1391 CD1 TYR A 187 -49.264 12.037 84.136 1.00 11.08 C ATOM 1392 CD2 TYR A 187 -50.356 13.479 85.664 1.00 12.88 C ATOM 1393 CE1 TYR A 187 -50.145 11.027 84.444 1.00 15.51 C ATOM 1394 CE2 TYR A 187 -51.232 12.481 85.978 1.00 10.34 C ATOM 1395 CZ TYR A 187 -51.125 11.266 85.381 1.00 13.26 C ATOM 1396 OH TYR A 187 -52.018 10.253 85.690 1.00 17.32 O ATOM 1397 HH TYR A 187 -52.937 10.546 85.468 1.00 0.00 H ATOM 1398 H TYR A 187 -47.178 16.594 83.260 1.00 0.00 H ATOM 1399 N VAL A 188 -50.611 14.766 82.003 1.00 8.37 N ATOM 1400 CA VAL A 188 -51.979 15.215 81.701 1.00 8.65 C ATOM 1401 C VAL A 188 -52.946 14.489 82.634 1.00 8.70 C ATOM 1402 O VAL A 188 -53.323 13.335 82.354 1.00 13.86 O ATOM 1403 CB VAL A 188 -52.368 14.949 80.244 1.00 12.38 C ATOM 1404 CG1 VAL A 188 -53.635 15.713 79.869 1.00 14.19 C ATOM 1405 CG2 VAL A 188 -51.241 15.347 79.313 1.00 9.85 C ATOM 1406 H VAL A 188 -50.322 13.820 81.681 1.00 0.00 H ATOM 1407 N PRO A 189 -53.387 15.108 83.726 1.00 12.92 N ATOM 1408 CA PRO A 189 -54.168 14.332 84.709 1.00 14.96 C ATOM 1409 C PRO A 189 -55.492 13.822 84.162 1.00 16.74 C ATOM 1410 O PRO A 189 -55.908 12.716 84.527 1.00 21.09 O ATOM 1411 CB PRO A 189 -54.344 15.317 85.873 1.00 19.78 C ATOM 1412 CG PRO A 189 -54.007 16.661 85.332 1.00 26.68 C ATOM 1413 CD PRO A 189 -53.020 16.438 84.237 1.00 16.36 C ATOM 1414 N SER A 190 -56.144 14.576 83.272 1.00 14.60 N ATOM 1415 CA SER A 190 -57.432 14.154 82.718 1.00 15.71 C ATOM 1416 C SER A 190 -57.351 12.817 81.994 1.00 22.06 C ATOM 1417 O SER A 190 -58.324 12.056 81.979 1.00 25.96 O ATOM 1418 CB SER A 190 -57.959 15.231 81.756 1.00 23.96 C ATOM 1419 OG SER A 190 -57.231 15.259 80.520 1.00 27.47 O ATOM 1420 HG SER A 190 -57.604 15.965 79.935 1.00 0.00 H ATOM 1421 H SER A 190 -55.729 15.479 82.967 1.00 0.00 H ATOM 1422 N ALA A 191 -56.216 12.521 81.370 1.00 13.95 N ATOM 1423 CA ALA A 191 -56.058 11.371 80.504 1.00 15.54 C ATOM 1424 C ALA A 191 -55.054 10.356 81.038 1.00 12.97 C ATOM 1425 O ALA A 191 -54.826 9.332 80.388 1.00 16.95 O ATOM 1426 CB ALA A 191 -55.615 11.849 79.116 1.00 22.33 C ATOM 1427 H ALA A 191 -55.398 13.148 81.511 1.00 0.00 H ATOM 1428 N SER A 192 -54.415 10.647 82.170 1.00 12.83 N ATOM 1429 CA SER A 192 -53.339 9.819 82.740 1.00 13.42 C ATOM 1430 C SER A 192 -52.245 9.525 81.709 1.00 10.83 C ATOM 1431 O SER A 192 -51.754 8.400 81.580 1.00 12.44 O ATOM 1432 CB SER A 192 -53.895 8.524 83.326 1.00 18.12 C ATOM 1433 OG SER A 192 -54.993 8.803 84.195 1.00 22.29 O ATOM 1434 HG SER A 192 -55.708 9.260 83.685 1.00 0.00 H ATOM 1435 H SER A 192 -54.692 11.509 82.681 1.00 0.00 H ATOM 1436 N VAL A 193 -51.853 10.576 80.987 1.00 11.06 N ATOM 1437 CA VAL A 193 -50.778 10.523 79.991 1.00 9.69 C ATOM 1438 C VAL A 193 -49.530 11.155 80.596 1.00 8.86 C ATOM 1439 O VAL A 193 -49.554 12.304 81.060 1.00 9.84 O ATOM 1440 CB VAL A 193 -51.190 11.230 78.699 1.00 11.55 C ATOM 1441 CG1 VAL A 193 -49.986 11.386 77.748 1.00 11.47 C ATOM 1442 CG2 VAL A 193 -52.325 10.438 78.030 1.00 12.79 C ATOM 1443 H VAL A 193 -52.337 11.484 81.139 1.00 0.00 H ATOM 1444 N LEU A 194 -48.450 10.386 80.600 1.00 10.79 N ATOM 1445 CA LEU A 194 -47.156 10.836 81.069 1.00 8.02 C ATOM 1446 C LEU A 194 -46.254 10.989 79.858 1.00 6.90 C ATOM 1447 O LEU A 194 -45.956 10.009 79.163 1.00 10.77 O ATOM 1448 CB LEU A 194 -46.565 9.835 82.045 1.00 9.66 C ATOM 1449 CG LEU A 194 -45.181 10.190 82.560 1.00 11.86 C ATOM 1450 CD1 LEU A 194 -45.194 11.482 83.345 1.00 12.99 C ATOM 1451 CD2 LEU A 194 -44.685 9.042 83.378 1.00 13.11 C ATOM 1452 H LEU A 194 -48.536 9.411 80.249 1.00 0.00 H ATOM 1453 N TYR A 195 -45.770 12.183 79.643 1.00 9.01 N ATOM 1454 CA TYR A 195 -44.833 12.453 78.553 1.00 7.37 C ATOM 1455 C TYR A 195 -43.447 12.571 79.164 1.00 8.24 C ATOM 1456 O TYR A 195 -43.185 13.487 79.944 1.00 8.81 O ATOM 1457 CB TYR A 195 -45.261 13.716 77.841 1.00 9.27 C ATOM 1458 CG TYR A 195 -44.303 14.193 76.802 1.00 9.63 C ATOM 1459 CD1 TYR A 195 -44.287 13.625 75.548 1.00 12.01 C ATOM 1460 CD2 TYR A 195 -43.440 15.244 77.078 1.00 7.47 C ATOM 1461 CE1 TYR A 195 -43.407 14.086 74.573 1.00 16.26 C ATOM 1462 CE2 TYR A 195 -42.561 15.706 76.119 1.00 10.99 C ATOM 1463 CZ TYR A 195 -42.542 15.132 74.891 1.00 20.55 C ATOM 1464 OH TYR A 195 -41.654 15.637 73.972 1.00 22.24 O ATOM 1465 HH TYR A 195 -41.854 16.594 73.813 1.00 0.00 H ATOM 1466 H TYR A 195 -46.059 12.965 80.265 1.00 0.00 H ATOM 1467 N GLY A 196 -42.584 11.589 78.880 1.00 8.22 N ATOM 1468 CA GLY A 196 -41.293 11.554 79.529 1.00 9.09 C ATOM 1469 C GLY A 196 -40.237 12.334 78.812 1.00 8.30 C ATOM 1470 O GLY A 196 -39.166 12.585 79.387 1.00 10.09 O ATOM 1471 H GLY A 196 -42.842 10.852 78.193 1.00 0.00 H ATOM 1472 N GLY A 197 -40.523 12.748 77.589 1.00 10.58 N ATOM 1473 CA GLY A 197 -39.475 13.381 76.823 1.00 11.70 C ATOM 1474 C GLY A 197 -38.271 12.458 76.706 1.00 9.84 C ATOM 1475 O GLY A 197 -38.345 11.234 76.850 1.00 8.87 O ATOM 1476 H GLY A 197 -41.475 12.621 77.190 1.00 0.00 H ATOM 1477 N CYS A 198 -37.125 13.073 76.466 1.00 7.80 N ATOM 1478 CA CYS A 198 -35.968 12.266 76.116 1.00 6.68 C ATOM 1479 C CYS A 198 -35.289 11.651 77.336 1.00 9.42 C ATOM 1480 O CYS A 198 -34.371 10.849 77.173 1.00 8.83 O ATOM 1481 CB CYS A 198 -35.008 13.083 75.247 1.00 6.73 C ATOM 1482 SG CYS A 198 -35.878 13.682 73.774 1.00 8.54 S ATOM 1483 H CYS A 198 -37.053 14.109 76.526 1.00 0.00 H ATOM 1484 N ALA A 199 -35.791 11.927 78.544 1.00 6.93 N ATOM 1485 CA ALA A 199 -35.401 11.180 79.739 1.00 8.70 C ATOM 1486 C ALA A 199 -35.937 9.751 79.750 1.00 7.80 C ATOM 1487 O ALA A 199 -35.481 8.949 80.584 1.00 9.36 O ATOM 1488 CB ALA A 199 -35.900 11.913 80.990 1.00 9.17 C ATOM 1489 H ALA A 199 -36.482 12.699 78.637 1.00 0.00 H ATOM 1490 N ILE A 200 -36.903 9.413 78.882 1.00 6.67 N ATOM 1491 CA ILE A 200 -37.500 8.080 78.837 1.00 8.76 C ATOM 1492 C ILE A 200 -37.260 7.488 77.452 1.00 8.43 C ATOM 1493 O ILE A 200 -37.521 8.141 76.434 1.00 8.82 O ATOM 1494 CB ILE A 200 -39.009 8.094 79.166 1.00 7.28 C ATOM 1495 CG1 ILE A 200 -39.219 8.693 80.562 1.00 9.26 C ATOM 1496 CG2 ILE A 200 -39.635 6.701 79.049 1.00 10.28 C ATOM 1497 CD1 ILE A 200 -38.549 7.929 81.713 1.00 12.45 C ATOM 1498 H ILE A 200 -37.242 10.132 78.211 1.00 0.00 H ATOM 1499 N TYR A 201 -36.765 6.256 77.423 1.00 7.38 N ATOM 1500 CA TYR A 201 -36.485 5.530 76.192 1.00 6.44 C ATOM 1501 C TYR A 201 -37.639 4.621 75.792 1.00 8.02 C ATOM 1502 O TYR A 201 -38.307 4.035 76.656 1.00 9.02 O ATOM 1503 CB TYR A 201 -35.237 4.651 76.357 1.00 8.16 C ATOM 1504 CG TYR A 201 -33.903 5.381 76.373 1.00 9.54 C ATOM 1505 CD1 TYR A 201 -33.770 6.677 75.899 1.00 10.81 C ATOM 1506 CD2 TYR A 201 -32.762 4.744 76.814 1.00 12.29 C ATOM 1507 CE1 TYR A 201 -32.510 7.331 75.881 1.00 11.42 C ATOM 1508 CE2 TYR A 201 -31.531 5.382 76.805 1.00 15.76 C ATOM 1509 CZ TYR A 201 -31.412 6.662 76.325 1.00 9.92 C ATOM 1510 OH TYR A 201 -30.167 7.234 76.331 1.00 12.65 O ATOM 1511 HH TYR A 201 -30.224 8.150 75.961 1.00 0.00 H ATOM 1512 H TYR A 201 -36.567 5.784 78.328 1.00 0.00 H ATOM 1513 N GLU A 202 -37.862 4.501 74.492 1.00 9.31 N ATOM 1514 CA GLU A 202 -38.781 3.469 74.029 1.00 7.24 C ATOM 1515 C GLU A 202 -38.178 2.075 74.259 1.00 8.66 C ATOM 1516 O GLU A 202 -36.963 1.901 74.404 1.00 9.23 O ATOM 1517 CB GLU A 202 -39.129 3.658 72.551 1.00 7.98 C ATOM 1518 CG GLU A 202 -38.011 3.335 71.574 1.00 8.90 C ATOM 1519 CD GLU A 202 -38.480 3.284 70.113 1.00 19.92 C ATOM 1520 OE1 GLU A 202 -39.606 2.763 69.799 1.00 16.30 O ATOM 1521 OE2 GLU A 202 -37.706 3.785 69.268 1.00 18.77 O ATOM 1522 H GLU A 202 -37.390 5.132 73.814 1.00 0.00 H ATOM 1523 N LEU A 203 -39.062 1.069 74.303 1.00 10.42 N ATOM 1524 CA LEU A 203 -38.642 -0.313 74.592 1.00 8.71 C ATOM 1525 C LEU A 203 -37.670 -0.858 73.559 1.00 13.92 C ATOM 1526 O LEU A 203 -36.769 -1.630 73.902 1.00 14.83 O ATOM 1527 CB LEU A 203 -39.869 -1.220 74.663 1.00 9.22 C ATOM 1528 CG LEU A 203 -40.805 -0.936 75.833 1.00 10.52 C ATOM 1529 CD1 LEU A 203 -41.945 -1.934 75.871 1.00 15.22 C ATOM 1530 CD2 LEU A 203 -40.052 -0.903 77.201 1.00 13.12 C ATOM 1531 H LEU A 203 -40.068 1.268 74.129 1.00 0.00 H ATOM 1532 N SER A 204 -37.839 -0.490 72.292 1.00 12.41 N ATOM 1533 CA SER A 204 -36.949 -0.986 71.253 1.00 9.93 C ATOM 1534 C SER A 204 -35.538 -0.403 71.311 1.00 14.83 C ATOM 1535 O SER A 204 -34.651 -0.922 70.624 1.00 17.99 O ATOM 1536 CB SER A 204 -37.535 -0.703 69.880 1.00 19.21 C ATOM 1537 OG SER A 204 -38.753 -1.408 69.742 1.00 25.74 O ATOM 1538 HG SER A 204 -39.386 -1.111 70.443 1.00 0.00 H ATOM 1539 H SER A 204 -38.613 0.157 72.042 1.00 0.00 H ATOM 1540 N ARG A 205 -35.300 0.672 72.075 1.00 13.72 N ATOM 1541 CA ARG A 205 -33.953 1.205 72.225 1.00 11.57 C ATOM 1542 C ARG A 205 -33.227 0.402 73.296 1.00 10.31 C ATOM 1543 O ARG A 205 -33.596 0.455 74.466 1.00 12.86 O ATOM 1544 CB ARG A 205 -33.976 2.680 72.595 1.00 12.88 C ATOM 1545 CG ARG A 205 -32.592 3.270 72.579 1.00 21.23 C ATOM 1546 CD ARG A 205 -32.536 4.660 73.145 1.00 21.81 C ATOM 1547 NE ARG A 205 -33.202 5.668 72.333 1.00 28.00 N ATOM 1548 CZ ARG A 205 -32.644 6.311 71.310 1.00 49.12 C ATOM 1549 NH1 ARG A 205 -31.401 6.027 70.932 1.00 33.28 N ATOM 1550 NH2 ARG A 205 -33.338 7.237 70.652 1.00 40.69 N ATOM 1551 HE ARG A 205 -34.187 5.903 72.570 1.00 0.00 H ATOM 1552 HH12 ARG A 205 -30.972 6.534 70.132 1.00 0.00 H ATOM 1553 HH11 ARG A 205 -30.858 5.298 71.437 1.00 0.00 H ATOM 1554 HH22 ARG A 205 -32.905 7.741 69.852 1.00 0.00 H ATOM 1555 HH21 ARG A 205 -34.314 7.456 70.938 1.00 0.00 H ATOM 1556 H ARG A 205 -36.090 1.133 72.569 1.00 0.00 H ATOM 1557 N THR A 206 -32.211 -0.358 72.887 1.00 16.01 N ATOM 1558 CA THR A 206 -31.513 -1.278 73.772 1.00 19.49 C ATOM 1559 C THR A 206 -30.186 -0.730 74.265 1.00 19.19 C ATOM 1560 O THR A 206 -29.612 -1.302 75.193 1.00 22.81 O ATOM 1561 CB THR A 206 -31.283 -2.635 73.069 1.00 23.77 C ATOM 1562 OG1 THR A 206 -30.538 -2.445 71.859 1.00 27.04 O ATOM 1563 CG2 THR A 206 -32.607 -3.285 72.741 1.00 40.10 C ATOM 1564 HG1 THR A 206 -30.397 -3.320 71.419 1.00 0.00 H ATOM 1565 H THR A 206 -31.905 -0.291 71.895 1.00 0.00 H ATOM 1566 N SER A 207 -29.702 0.360 73.686 1.00 14.82 N ATOM 1567 CA SER A 207 -28.431 0.962 74.046 1.00 15.11 C ATOM 1568 C SER A 207 -28.639 2.461 74.170 1.00 14.92 C ATOM 1569 O SER A 207 -29.594 3.024 73.628 1.00 16.49 O ATOM 1570 CB SER A 207 -27.342 0.671 73.000 1.00 23.62 C ATOM 1571 OG SER A 207 -27.713 1.231 71.750 1.00 32.61 O ATOM 1572 HG SER A 207 -27.008 1.040 71.082 1.00 0.00 H ATOM 1573 H SER A 207 -30.263 0.808 72.933 1.00 0.00 H ATOM 1574 N ALA A 208 -27.742 3.111 74.885 1.00 16.04 N ATOM 1575 CA ALA A 208 -27.955 4.521 75.158 1.00 13.47 C ATOM 1576 C ALA A 208 -27.912 5.334 73.870 1.00 13.58 C ATOM 1577 O ALA A 208 -27.177 5.025 72.930 1.00 16.84 O ATOM 1578 CB ALA A 208 -26.911 5.046 76.140 1.00 19.47 C ATOM 1579 H ALA A 208 -26.898 2.623 75.247 1.00 0.00 H ATOM 1580 N GLY A 209 -28.730 6.372 73.826 1.00 15.49 N ATOM 1581 CA GLY A 209 -28.682 7.307 72.727 1.00 16.78 C ATOM 1582 C GLY A 209 -27.696 8.418 73.035 1.00 15.35 C ATOM 1583 O GLY A 209 -26.616 8.175 73.591 1.00 17.11 O ATOM 1584 H GLY A 209 -29.417 6.517 74.593 1.00 0.00 H ATOM 1585 N ASN A 210 -28.062 9.644 72.697 1.00 14.40 N ATOM 1586 CA ASN A 210 -27.193 10.792 72.924 1.00 16.94 C ATOM 1587 C ASN A 210 -27.128 11.074 74.415 1.00 15.53 C ATOM 1588 O ASN A 210 -28.112 11.542 75.008 1.00 15.80 O ATOM 1589 CB ASN A 210 -27.733 11.996 72.156 1.00 14.47 C ATOM 1590 CG ASN A 210 -26.904 13.243 72.334 1.00 20.71 C ATOM 1591 OD1 ASN A 210 -25.856 13.253 72.997 1.00 20.59 O ATOM 1592 ND2 ASN A 210 -27.375 14.322 71.733 1.00 26.91 N ATOM 1593 HD22 ASN A 210 -28.258 14.269 71.187 1.00 0.00 H ATOM 1594 HD21 ASN A 210 -26.862 15.224 71.807 1.00 0.00 H ATOM 1595 H ASN A 210 -28.993 9.792 72.258 1.00 0.00 H ATOM 1596 N VAL A 211 -25.984 10.775 75.034 1.00 14.86 N ATOM 1597 CA VAL A 211 -25.816 11.003 76.458 1.00 14.68 C ATOM 1598 C VAL A 211 -24.745 12.048 76.742 1.00 11.20 C ATOM 1599 O VAL A 211 -24.286 12.167 77.875 1.00 15.08 O ATOM 1600 CB VAL A 211 -25.532 9.683 77.204 1.00 17.53 C ATOM 1601 CG1 VAL A 211 -26.755 8.784 77.091 1.00 16.98 C ATOM 1602 CG2 VAL A 211 -24.273 8.989 76.659 1.00 20.48 C ATOM 1603 H VAL A 211 -25.198 10.371 74.486 1.00 0.00 H ATOM 1604 N ALA A 212 -24.365 12.845 75.735 1.00 13.84 N ATOM 1605 CA ALA A 212 -23.285 13.813 75.936 1.00 12.81 C ATOM 1606 C ALA A 212 -23.604 14.823 77.030 1.00 11.89 C ATOM 1607 O ALA A 212 -22.689 15.311 77.710 1.00 15.11 O ATOM 1608 CB ALA A 212 -22.983 14.550 74.634 1.00 18.81 C ATOM 1609 H ALA A 212 -24.837 12.776 74.811 1.00 0.00 H ATOM 1610 N ASP A 213 -24.885 15.128 77.233 1.00 13.22 N ATOM 1611 CA ASP A 213 -25.322 16.117 78.212 1.00 9.18 C ATOM 1612 C ASP A 213 -26.011 15.474 79.411 1.00 7.83 C ATOM 1613 O ASP A 213 -26.604 16.185 80.245 1.00 10.55 O ATOM 1614 CB ASP A 213 -26.238 17.115 77.518 1.00 10.24 C ATOM 1615 CG ASP A 213 -25.508 17.913 76.432 1.00 16.41 C ATOM 1616 OD1 ASP A 213 -24.425 18.451 76.736 1.00 18.24 O ATOM 1617 OD2 ASP A 213 -25.997 17.992 75.288 1.00 15.88 O ATOM 1618 H ASP A 213 -25.607 14.638 76.667 1.00 0.00 H ATOM 1619 N ALA A 214 -25.904 14.156 79.541 1.00 9.41 N ATOM 1620 CA ALA A 214 -26.636 13.427 80.570 1.00 7.46 C ATOM 1621 C ALA A 214 -25.916 13.442 81.911 1.00 11.42 C ATOM 1622 O ALA A 214 -24.715 13.667 82.003 1.00 13.06 O ATOM 1623 CB ALA A 214 -26.821 11.977 80.171 1.00 9.45 C ATOM 1624 H ALA A 214 -25.283 13.631 78.893 1.00 0.00 H ATOM 1625 N ASP A 215 -26.684 13.144 82.957 1.00 9.58 N ATOM 1626 CA ASP A 215 -26.160 12.851 84.286 1.00 11.16 C ATOM 1627 C ASP A 215 -26.482 11.381 84.516 1.00 9.24 C ATOM 1628 O ASP A 215 -27.532 11.024 85.054 1.00 10.36 O ATOM 1629 CB ASP A 215 -26.804 13.769 85.349 1.00 11.06 C ATOM 1630 CG ASP A 215 -26.098 13.698 86.686 1.00 17.74 C ATOM 1631 OD1 ASP A 215 -25.637 12.601 87.055 1.00 16.18 O ATOM 1632 OD2 ASP A 215 -26.025 14.742 87.371 1.00 22.89 O ATOM 1633 H ASP A 215 -27.714 13.119 82.819 1.00 0.00 H ATOM 1634 N LEU A 216 -25.596 10.512 84.024 1.00 11.93 N ATOM 1635 CA LEU A 216 -25.849 9.087 84.135 1.00 9.94 C ATOM 1636 C LEU A 216 -25.986 8.663 85.586 1.00 9.56 C ATOM 1637 O LEU A 216 -26.760 7.757 85.906 1.00 9.78 O ATOM 1638 CB LEU A 216 -24.717 8.293 83.487 1.00 10.84 C ATOM 1639 CG LEU A 216 -24.516 8.450 81.997 1.00 12.42 C ATOM 1640 CD1 LEU A 216 -23.201 7.816 81.588 1.00 17.42 C ATOM 1641 CD2 LEU A 216 -25.677 7.805 81.286 1.00 11.65 C ATOM 1642 H LEU A 216 -24.729 10.854 83.563 1.00 0.00 H ATOM 1643 N ALA A 217 -25.237 9.307 86.479 1.00 9.54 N ATOM 1644 CA ALA A 217 -25.250 8.878 87.870 1.00 12.04 C ATOM 1645 C ALA A 217 -26.576 9.158 88.548 1.00 11.05 C ATOM 1646 O ALA A 217 -26.966 8.420 89.460 1.00 11.93 O ATOM 1647 CB ALA A 217 -24.127 9.570 88.638 1.00 12.57 C ATOM 1648 H ALA A 217 -24.647 10.111 86.185 1.00 0.00 H ATOM 1649 N GLU A 218 -27.276 10.204 88.119 1.00 9.01 N ATOM 1650 CA GLU A 218 -28.533 10.613 88.721 1.00 8.87 C ATOM 1651 C GLU A 218 -29.744 10.082 87.964 1.00 7.31 C ATOM 1652 O GLU A 218 -30.848 10.077 88.525 1.00 7.92 O ATOM 1653 CB GLU A 218 -28.615 12.142 88.773 1.00 8.70 C ATOM 1654 CG GLU A 218 -27.655 12.745 89.783 1.00 15.63 C ATOM 1655 CD GLU A 218 -27.912 12.239 91.206 1.00 20.30 C ATOM 1656 OE1 GLU A 218 -29.089 11.956 91.544 1.00 20.68 O ATOM 1657 OE2 GLU A 218 -26.922 12.092 91.969 1.00 25.96 O ATOM 1658 H GLU A 218 -26.907 10.754 87.317 1.00 0.00 H ATOM 1659 N TRP A 219 -29.553 9.603 86.746 1.00 8.71 N ATOM 1660 CA TRP A 219 -30.705 9.304 85.891 1.00 6.12 C ATOM 1661 C TRP A 219 -31.610 8.248 86.513 1.00 9.19 C ATOM 1662 O TRP A 219 -32.829 8.451 86.543 1.00 8.22 O ATOM 1663 CB TRP A 219 -30.158 8.949 84.506 1.00 5.85 C ATOM 1664 CG TRP A 219 -31.115 8.902 83.336 1.00 6.46 C ATOM 1665 CD1 TRP A 219 -32.462 8.718 83.354 1.00 8.96 C ATOM 1666 CD2 TRP A 219 -30.735 9.027 81.971 1.00 3.95 C ATOM 1667 NE1 TRP A 219 -32.952 8.734 82.062 1.00 7.28 N ATOM 1668 CE2 TRP A 219 -31.908 8.921 81.194 1.00 6.30 C ATOM 1669 CE3 TRP A 219 -29.515 9.238 81.325 1.00 7.95 C ATOM 1670 CZ2 TRP A 219 -31.878 9.009 79.823 1.00 9.05 C ATOM 1671 CZ3 TRP A 219 -29.481 9.311 79.980 1.00 8.97 C ATOM 1672 CH2 TRP A 219 -30.667 9.197 79.221 1.00 7.58 C ATOM 1673 HE1 TRP A 219 -33.950 8.622 81.792 1.00 0.00 H ATOM 1674 H TRP A 219 -28.588 9.439 86.396 1.00 0.00 H ATOM 1675 N PRO A 220 -31.113 7.131 87.054 1.00 8.71 N ATOM 1676 CA PRO A 220 -32.048 6.180 87.683 1.00 7.91 C ATOM 1677 C PRO A 220 -32.838 6.791 88.828 1.00 7.68 C ATOM 1678 O PRO A 220 -34.007 6.456 88.999 1.00 10.37 O ATOM 1679 CB PRO A 220 -31.124 5.048 88.148 1.00 7.70 C ATOM 1680 CG PRO A 220 -29.948 5.130 87.199 1.00 9.56 C ATOM 1681 CD PRO A 220 -29.741 6.595 86.987 1.00 8.43 C ATOM 1682 N THR A 221 -32.203 7.613 89.664 1.00 6.66 N ATOM 1683 CA THR A 221 -32.913 8.243 90.778 1.00 4.99 C ATOM 1684 C THR A 221 -33.987 9.181 90.270 1.00 6.17 C ATOM 1685 O THR A 221 -35.069 9.281 90.861 1.00 9.62 O ATOM 1686 CB THR A 221 -31.930 9.003 91.656 1.00 8.98 C ATOM 1687 OG1 THR A 221 -31.001 8.082 92.199 1.00 11.44 O ATOM 1688 CG2 THR A 221 -32.634 9.723 92.823 1.00 12.59 C ATOM 1689 HG1 THR A 221 -30.516 7.631 91.463 1.00 0.00 H ATOM 1690 H THR A 221 -31.191 7.809 89.523 1.00 0.00 H ATOM 1691 N SER A 222 -33.688 9.893 89.191 1.00 6.24 N ATOM 1692 CA SER A 222 -34.668 10.812 88.641 1.00 6.87 C ATOM 1693 C SER A 222 -35.859 10.050 88.091 1.00 7.16 C ATOM 1694 O SER A 222 -37.010 10.471 88.270 1.00 9.18 O ATOM 1695 CB SER A 222 -34.000 11.683 87.574 1.00 7.85 C ATOM 1696 OG SER A 222 -32.980 12.455 88.191 1.00 8.92 O ATOM 1697 HG SER A 222 -32.540 13.023 87.510 1.00 0.00 H ATOM 1698 H SER A 222 -32.756 9.793 88.741 1.00 0.00 H ATOM 1699 N ILE A 223 -35.605 8.906 87.470 1.00 7.09 N ATOM 1700 CA ILE A 223 -36.687 8.057 86.997 1.00 5.95 C ATOM 1701 C ILE A 223 -37.526 7.587 88.180 1.00 8.42 C ATOM 1702 O ILE A 223 -38.755 7.544 88.100 1.00 10.84 O ATOM 1703 CB ILE A 223 -36.125 6.889 86.167 1.00 10.46 C ATOM 1704 CG1 ILE A 223 -35.728 7.414 84.786 1.00 13.97 C ATOM 1705 CG2 ILE A 223 -37.137 5.787 86.041 1.00 11.64 C ATOM 1706 CD1 ILE A 223 -35.027 6.390 83.869 1.00 15.19 C ATOM 1707 H ILE A 223 -34.619 8.612 87.319 1.00 0.00 H ATOM 1708 N GLU A 224 -36.875 7.234 89.299 1.00 8.82 N ATOM 1709 CA GLU A 224 -37.629 6.801 90.473 1.00 9.92 C ATOM 1710 C GLU A 224 -38.570 7.904 90.946 1.00 12.81 C ATOM 1711 O GLU A 224 -39.697 7.626 91.373 1.00 12.73 O ATOM 1712 CB GLU A 224 -36.673 6.370 91.600 1.00 12.26 C ATOM 1713 CG GLU A 224 -37.393 6.023 92.894 1.00 30.51 C ATOM 1714 H GLU A 224 -35.836 7.269 89.330 1.00 0.00 H ATOM 1715 N ARG A 225 -38.139 9.165 90.850 1.00 9.94 N ATOM 1716 CA ARG A 225 -39.014 10.268 91.244 1.00 8.12 C ATOM 1717 C ARG A 225 -40.232 10.328 90.335 1.00 10.98 C ATOM 1718 O ARG A 225 -41.330 10.675 90.779 1.00 10.67 O ATOM 1719 CB ARG A 225 -38.270 11.594 91.205 1.00 9.08 C ATOM 1720 CG ARG A 225 -37.165 11.703 92.207 1.00 9.98 C ATOM 1721 CD ARG A 225 -36.788 13.155 92.453 1.00 11.06 C ATOM 1722 NE ARG A 225 -35.639 13.251 93.346 1.00 14.32 N ATOM 1723 CZ ARG A 225 -34.365 13.178 92.973 1.00 17.79 C ATOM 1724 NH1 ARG A 225 -34.027 13.077 91.685 1.00 14.28 N ATOM 1725 NH2 ARG A 225 -33.410 13.240 93.903 1.00 18.56 N ATOM 1726 HE ARG A 225 -35.832 13.388 94.359 1.00 0.00 H ATOM 1727 HH12 ARG A 225 -33.025 13.021 91.413 1.00 0.00 H ATOM 1728 HH11 ARG A 225 -34.766 13.054 90.954 1.00 0.00 H ATOM 1729 HH22 ARG A 225 -32.409 13.184 93.625 1.00 0.00 H ATOM 1730 HH21 ARG A 225 -33.666 13.344 94.906 1.00 0.00 H ATOM 1731 H ARG A 225 -37.181 9.362 90.495 1.00 0.00 H ATOM 1732 N ILE A 226 -40.046 10.047 89.048 1.00 7.40 N ATOM 1733 CA ILE A 226 -41.192 10.059 88.131 1.00 6.03 C ATOM 1734 C ILE A 226 -42.187 8.972 88.534 1.00 10.75 C ATOM 1735 O ILE A 226 -43.406 9.199 88.588 1.00 11.93 O ATOM 1736 CB ILE A 226 -40.723 9.880 86.680 1.00 6.70 C ATOM 1737 CG1 ILE A 226 -39.819 11.015 86.254 1.00 8.03 C ATOM 1738 CG2 ILE A 226 -41.958 9.850 85.730 1.00 8.24 C ATOM 1739 CD1 ILE A 226 -39.125 10.711 84.959 1.00 10.69 C ATOM 1740 H ILE A 226 -39.095 9.820 88.694 1.00 0.00 H ATOM 1741 N GLN A 227 -41.676 7.761 88.782 1.00 10.68 N ATOM 1742 CA GLN A 227 -42.519 6.636 89.189 1.00 10.93 C ATOM 1743 C GLN A 227 -43.271 6.956 90.479 1.00 11.39 C ATOM 1744 O GLN A 227 -44.466 6.660 90.588 1.00 15.25 O ATOM 1745 CB GLN A 227 -41.652 5.380 89.340 1.00 14.29 C ATOM 1746 CG GLN A 227 -42.347 4.165 90.009 1.00 14.73 C ATOM 1747 CD GLN A 227 -43.497 3.605 89.200 1.00 21.85 C ATOM 1748 OE1 GLN A 227 -43.341 3.245 88.032 1.00 28.94 O ATOM 1749 NE2 GLN A 227 -44.671 3.504 89.833 1.00 27.77 N ATOM 1750 HE22 GLN A 227 -44.759 3.820 90.820 1.00 0.00 H ATOM 1751 HE21 GLN A 227 -45.496 3.109 89.338 1.00 0.00 H ATOM 1752 H GLN A 227 -40.651 7.615 88.683 1.00 0.00 H ATOM 1753 N GLN A 228 -42.599 7.579 91.455 1.00 10.50 N ATOM 1754 CA GLN A 228 -43.257 7.925 92.719 1.00 12.69 C ATOM 1755 C GLN A 228 -44.354 8.960 92.526 1.00 12.42 C ATOM 1756 O GLN A 228 -45.378 8.935 93.227 1.00 15.30 O ATOM 1757 CB GLN A 228 -42.227 8.443 93.718 1.00 14.87 C ATOM 1758 CG GLN A 228 -41.283 7.375 94.236 1.00 31.90 C ATOM 1759 CD GLN A 228 -42.017 6.259 94.974 1.00 48.74 C ATOM 1760 OE1 GLN A 228 -42.098 5.126 94.493 1.00 54.43 O ATOM 1761 NE2 GLN A 228 -42.565 6.583 96.140 1.00 49.42 N ATOM 1762 HE22 GLN A 228 -42.471 7.551 96.507 1.00 0.00 H ATOM 1763 HE21 GLN A 228 -43.088 5.868 96.685 1.00 0.00 H ATOM 1764 H GLN A 228 -41.597 7.821 91.315 1.00 0.00 H ATOM 1765 N HIS A 229 -44.158 9.895 91.608 1.00 11.13 N ATOM 1766 CA HIS A 229 -45.080 11.000 91.466 1.00 9.66 C ATOM 1767 C HIS A 229 -46.248 10.669 90.543 1.00 10.30 C ATOM 1768 O HIS A 229 -47.344 11.218 90.733 1.00 12.51 O ATOM 1769 CB HIS A 229 -44.320 12.217 90.942 1.00 12.99 C ATOM 1770 CG HIS A 229 -44.809 13.529 91.468 1.00 19.27 C ATOM 1771 ND1 HIS A 229 -44.361 14.068 92.654 1.00 27.33 N ATOM 1772 CD2 HIS A 229 -45.681 14.428 90.949 1.00 24.87 C ATOM 1773 CE1 HIS A 229 -44.954 15.232 92.857 1.00 35.59 C ATOM 1774 NE2 HIS A 229 -45.762 15.473 91.839 1.00 29.29 N ATOM 1775 H HIS A 229 -43.330 9.833 90.981 1.00 0.00 H ATOM 1776 N TYR A 230 -46.063 9.745 89.591 1.00 10.18 N ATOM 1777 CA TYR A 230 -47.089 9.433 88.588 1.00 9.64 C ATOM 1778 C TYR A 230 -47.321 7.931 88.460 1.00 9.13 C ATOM 1779 O TYR A 230 -47.368 7.386 87.358 1.00 11.38 O ATOM 1780 CB TYR A 230 -46.700 10.032 87.231 1.00 12.80 C ATOM 1781 CG TYR A 230 -46.547 11.529 87.312 1.00 11.19 C ATOM 1782 CD1 TYR A 230 -47.648 12.359 87.559 1.00 9.78 C ATOM 1783 CD2 TYR A 230 -45.299 12.127 87.165 1.00 13.02 C ATOM 1784 CE1 TYR A 230 -47.509 13.733 87.657 1.00 10.39 C ATOM 1785 CE2 TYR A 230 -45.151 13.504 87.263 1.00 14.93 C ATOM 1786 CZ TYR A 230 -46.245 14.296 87.510 1.00 15.54 C ATOM 1787 OH TYR A 230 -46.076 15.649 87.609 1.00 20.83 O ATOM 1788 HH TYR A 230 -46.950 16.077 87.787 1.00 0.00 H ATOM 1789 H TYR A 230 -45.160 9.230 89.561 1.00 0.00 H ATOM 1790 N PRO A 231 -47.542 7.236 89.585 1.00 12.82 N ATOM 1791 CA PRO A 231 -47.752 5.779 89.539 1.00 12.93 C ATOM 1792 C PRO A 231 -49.012 5.351 88.809 1.00 11.76 C ATOM 1793 O PRO A 231 -49.114 4.183 88.413 1.00 11.75 O ATOM 1794 CB PRO A 231 -47.835 5.407 91.024 1.00 13.75 C ATOM 1795 CG PRO A 231 -48.339 6.625 91.678 1.00 15.27 C ATOM 1796 CD PRO A 231 -47.731 7.792 90.928 1.00 11.43 C ATOM 1797 N GLU A 232 -49.981 6.241 88.664 1.00 13.95 N ATOM 1798 CA GLU A 232 -51.225 5.927 87.991 1.00 12.86 C ATOM 1799 C GLU A 232 -51.169 6.148 86.487 1.00 12.74 C ATOM 1800 O GLU A 232 -52.185 5.939 85.806 1.00 13.59 O ATOM 1801 CB GLU A 232 -52.362 6.759 88.609 1.00 11.95 C ATOM 1802 CG GLU A 232 -52.315 8.260 88.264 1.00 11.81 C ATOM 1803 CD GLU A 232 -51.407 9.111 89.121 1.00 22.76 C ATOM 1804 OE1 GLU A 232 -51.701 10.325 89.239 1.00 29.47 O ATOM 1805 OE2 GLU A 232 -50.411 8.612 89.680 1.00 22.19 O ATOM 1806 H GLU A 232 -49.845 7.199 89.046 1.00 0.00 H ATOM 1807 N ALA A 233 -50.020 6.548 85.935 1.00 10.71 N ATOM 1808 CA ALA A 233 -49.954 6.820 84.505 1.00 14.65 C ATOM 1809 C ALA A 233 -50.352 5.591 83.704 1.00 9.32 C ATOM 1810 O ALA A 233 -49.897 4.481 83.990 1.00 13.14 O ATOM 1811 CB ALA A 233 -48.543 7.261 84.117 1.00 12.95 C ATOM 1812 H ALA A 233 -49.172 6.665 86.526 1.00 0.00 H ATOM 1813 N GLN A 234 -51.204 5.797 82.697 1.00 11.19 N ATOM 1814 CA GLN A 234 -51.661 4.718 81.838 1.00 15.22 C ATOM 1815 C GLN A 234 -50.967 4.687 80.482 1.00 14.07 C ATOM 1816 O GLN A 234 -50.969 3.644 79.819 1.00 18.86 O ATOM 1817 CB GLN A 234 -53.168 4.841 81.610 1.00 20.69 C ATOM 1818 CG GLN A 234 -53.977 4.739 82.888 1.00 38.05 C ATOM 1819 CD GLN A 234 -53.882 3.366 83.534 1.00 40.10 C ATOM 1820 OE1 GLN A 234 -53.398 3.228 84.658 1.00 37.79 O ATOM 1821 NE2 GLN A 234 -54.357 2.346 82.829 1.00 39.06 N ATOM 1822 HE22 GLN A 234 -54.757 2.509 81.883 1.00 0.00 H ATOM 1823 HE21 GLN A 234 -54.329 1.384 83.223 1.00 0.00 H ATOM 1824 H GLN A 234 -51.552 6.761 82.522 1.00 0.00 H ATOM 1825 N PHE A 235 -50.438 5.821 80.031 1.00 13.07 N ATOM 1826 CA PHE A 235 -49.788 5.952 78.740 1.00 12.49 C ATOM 1827 C PHE A 235 -48.500 6.705 79.008 1.00 11.94 C ATOM 1828 O PHE A 235 -48.526 7.743 79.675 1.00 15.19 O ATOM 1829 CB PHE A 235 -50.618 6.749 77.723 1.00 14.37 C ATOM 1830 CG PHE A 235 -52.048 6.337 77.590 1.00 19.73 C ATOM 1831 CD1 PHE A 235 -53.011 6.834 78.464 1.00 27.77 C ATOM 1832 CD2 PHE A 235 -52.453 5.522 76.554 1.00 32.67 C ATOM 1833 CE1 PHE A 235 -54.339 6.485 78.331 1.00 34.49 C ATOM 1834 CE2 PHE A 235 -53.794 5.179 76.410 1.00 31.04 C ATOM 1835 CZ PHE A 235 -54.732 5.663 77.301 1.00 31.59 C ATOM 1836 H PHE A 235 -50.493 6.663 80.639 1.00 0.00 H ATOM 1837 N VAL A 236 -47.376 6.188 78.524 1.00 10.04 N ATOM 1838 CA VAL A 236 -46.082 6.820 78.728 1.00 9.89 C ATOM 1839 C VAL A 236 -45.455 7.049 77.363 1.00 10.53 C ATOM 1840 O VAL A 236 -45.289 6.103 76.578 1.00 10.55 O ATOM 1841 CB VAL A 236 -45.174 5.973 79.627 1.00 10.54 C ATOM 1842 CG1 VAL A 236 -43.819 6.632 79.767 1.00 8.37 C ATOM 1843 CG2 VAL A 236 -45.830 5.769 80.988 1.00 16.09 C ATOM 1844 H VAL A 236 -47.423 5.302 77.981 1.00 0.00 H ATOM 1845 N ILE A 237 -45.143 8.302 77.066 1.00 8.66 N ATOM 1846 CA ILE A 237 -44.650 8.699 75.752 1.00 9.10 C ATOM 1847 C ILE A 237 -43.171 9.023 75.880 1.00 9.85 C ATOM 1848 O ILE A 237 -42.832 9.983 76.579 1.00 8.44 O ATOM 1849 CB ILE A 237 -45.405 9.920 75.214 1.00 8.95 C ATOM 1850 CG1 ILE A 237 -46.904 9.665 75.185 1.00 18.92 C ATOM 1851 CG2 ILE A 237 -44.863 10.318 73.845 1.00 12.49 C ATOM 1852 CD1 ILE A 237 -47.677 10.935 74.999 1.00 21.15 C ATOM 1853 H ILE A 237 -45.254 9.031 77.799 1.00 0.00 H ATOM 1854 N PRO A 238 -42.284 8.314 75.171 1.00 8.11 N ATOM 1855 CA PRO A 238 -40.867 8.669 75.153 1.00 7.72 C ATOM 1856 C PRO A 238 -40.606 9.814 74.187 1.00 6.91 C ATOM 1857 O PRO A 238 -41.422 10.129 73.312 1.00 9.08 O ATOM 1858 CB PRO A 238 -40.198 7.364 74.668 1.00 9.53 C ATOM 1859 CG PRO A 238 -41.197 6.840 73.699 1.00 8.84 C ATOM 1860 CD PRO A 238 -42.545 7.140 74.321 1.00 10.18 C ATOM 1861 N GLY A 239 -39.432 10.422 74.335 1.00 9.68 N ATOM 1862 CA GLY A 239 -39.065 11.488 73.422 1.00 10.95 C ATOM 1863 C GLY A 239 -38.920 11.016 71.983 1.00 9.24 C ATOM 1864 O GLY A 239 -39.127 11.791 71.046 1.00 10.44 O ATOM 1865 H GLY A 239 -38.784 10.136 75.097 1.00 0.00 H ATOM 1866 N HIS A 240 -38.573 9.744 71.793 1.00 8.85 N ATOM 1867 CA HIS A 240 -38.342 9.162 70.479 1.00 8.82 C ATOM 1868 C HIS A 240 -38.927 7.762 70.464 1.00 8.86 C ATOM 1869 O HIS A 240 -38.544 6.922 71.282 1.00 11.03 O ATOM 1870 CB HIS A 240 -36.849 9.118 70.160 1.00 9.62 C ATOM 1871 CG HIS A 240 -36.174 10.448 70.242 1.00 9.74 C ATOM 1872 ND1 HIS A 240 -36.167 11.339 69.195 1.00 6.67 N ATOM 1873 CD2 HIS A 240 -35.468 11.033 71.240 1.00 9.47 C ATOM 1874 CE1 HIS A 240 -35.502 12.427 69.547 1.00 11.34 C ATOM 1875 NE2 HIS A 240 -35.051 12.256 70.776 1.00 7.47 N ATOM 1876 H HIS A 240 -38.461 9.134 72.628 1.00 0.00 H ATOM 1877 N GLY A 241 -39.853 7.518 69.547 1.00 9.70 N ATOM 1878 CA GLY A 241 -40.363 6.180 69.335 1.00 10.79 C ATOM 1879 C GLY A 241 -41.694 5.892 69.995 1.00 9.76 C ATOM 1880 O GLY A 241 -42.482 6.779 70.330 1.00 11.91 O ATOM 1881 H GLY A 241 -40.219 8.302 68.970 1.00 0.00 H ATOM 1882 N LEU A 242 -41.923 4.609 70.223 1.00 10.53 N ATOM 1883 CA LEU A 242 -43.274 4.124 70.472 1.00 9.72 C ATOM 1884 C LEU A 242 -43.683 4.323 71.930 1.00 11.92 C ATOM 1885 O LEU A 242 -42.933 3.954 72.844 1.00 11.74 O ATOM 1886 CB LEU A 242 -43.386 2.631 70.123 1.00 13.53 C ATOM 1887 CG LEU A 242 -43.150 2.225 68.669 1.00 25.16 C ATOM 1888 CD1 LEU A 242 -43.333 0.707 68.522 1.00 25.61 C ATOM 1889 CD2 LEU A 242 -44.069 2.935 67.720 1.00 23.10 C ATOM 1890 H LEU A 242 -41.128 3.938 70.224 1.00 0.00 H ATOM 1891 N PRO A 243 -44.872 4.838 72.183 1.00 9.40 N ATOM 1892 CA PRO A 243 -45.402 4.875 73.553 1.00 7.71 C ATOM 1893 C PRO A 243 -45.621 3.489 74.132 1.00 11.97 C ATOM 1894 O PRO A 243 -45.747 2.486 73.417 1.00 15.25 O ATOM 1895 CB PRO A 243 -46.736 5.610 73.394 1.00 14.27 C ATOM 1896 CG PRO A 243 -46.598 6.406 72.131 1.00 20.09 C ATOM 1897 CD PRO A 243 -45.783 5.493 71.229 1.00 15.36 C ATOM 1898 N GLY A 244 -45.740 3.459 75.443 1.00 12.68 N ATOM 1899 CA GLY A 244 -46.057 2.236 76.157 1.00 10.95 C ATOM 1900 C GLY A 244 -46.664 2.564 77.487 1.00 11.32 C ATOM 1901 O GLY A 244 -47.366 3.568 77.638 1.00 12.67 O ATOM 1902 H GLY A 244 -45.603 4.337 75.983 1.00 0.00 H ATOM 1903 N GLY A 245 -46.413 1.702 78.470 1.00 15.30 N ATOM 1904 CA GLY A 245 -46.799 1.952 79.832 1.00 11.95 C ATOM 1905 C GLY A 245 -45.614 2.276 80.720 1.00 11.48 C ATOM 1906 O GLY A 245 -44.514 2.599 80.253 1.00 12.05 O ATOM 1907 H GLY A 245 -45.919 0.815 78.244 1.00 0.00 H ATOM 1908 N LEU A 246 -45.847 2.204 82.024 1.00 8.92 N ATOM 1909 CA LEU A 246 -44.810 2.579 82.983 1.00 9.59 C ATOM 1910 C LEU A 246 -43.582 1.676 82.940 1.00 11.90 C ATOM 1911 O LEU A 246 -42.542 2.056 83.501 1.00 11.62 O ATOM 1912 CB LEU A 246 -45.393 2.608 84.390 1.00 11.91 C ATOM 1913 CG LEU A 246 -46.165 3.884 84.713 1.00 10.98 C ATOM 1914 CD1 LEU A 246 -46.988 3.709 85.998 1.00 15.87 C ATOM 1915 CD2 LEU A 246 -45.232 5.082 84.851 1.00 15.34 C ATOM 1916 H LEU A 246 -46.774 1.879 82.366 1.00 0.00 H ATOM 1917 N ASP A 247 -43.687 0.501 82.308 1.00 11.79 N ATOM 1918 CA ASP A 247 -42.519 -0.347 82.067 1.00 13.60 C ATOM 1919 C ASP A 247 -41.381 0.436 81.418 1.00 11.00 C ATOM 1920 O ASP A 247 -40.202 0.135 81.649 1.00 8.19 O ATOM 1921 CB ASP A 247 -42.904 -1.522 81.162 1.00 15.50 C ATOM 1922 CG ASP A 247 -43.625 -2.637 81.907 1.00 18.43 C ATOM 1923 OD1 ASP A 247 -43.975 -2.459 83.097 1.00 18.83 O ATOM 1924 OD2 ASP A 247 -43.854 -3.697 81.283 1.00 17.53 O ATOM 1925 H ASP A 247 -44.621 0.183 81.980 1.00 0.00 H ATOM 1926 N LEU A 248 -41.712 1.449 80.617 1.00 10.40 N ATOM 1927 CA LEU A 248 -40.672 2.216 79.930 1.00 9.06 C ATOM 1928 C LEU A 248 -39.701 2.847 80.919 1.00 8.87 C ATOM 1929 O LEU A 248 -38.555 3.124 80.553 1.00 9.62 O ATOM 1930 CB LEU A 248 -41.270 3.317 79.048 1.00 10.79 C ATOM 1931 CG LEU A 248 -41.595 2.863 77.631 1.00 8.91 C ATOM 1932 CD1 LEU A 248 -42.686 1.824 77.645 1.00 11.00 C ATOM 1933 CD2 LEU A 248 -41.984 4.023 76.744 1.00 9.93 C ATOM 1934 H LEU A 248 -42.713 1.695 80.480 1.00 0.00 H ATOM 1935 N LEU A 249 -40.153 3.150 82.145 1.00 6.91 N ATOM 1936 CA LEU A 249 -39.248 3.756 83.122 1.00 6.53 C ATOM 1937 C LEU A 249 -38.168 2.770 83.557 1.00 8.57 C ATOM 1938 O LEU A 249 -36.974 3.077 83.492 1.00 10.46 O ATOM 1939 CB LEU A 249 -40.025 4.267 84.324 1.00 8.79 C ATOM 1940 CG LEU A 249 -40.629 5.668 84.212 1.00 15.39 C ATOM 1941 CD1 LEU A 249 -41.523 5.852 83.002 1.00 17.07 C ATOM 1942 CD2 LEU A 249 -41.421 5.939 85.468 1.00 14.90 C ATOM 1943 H LEU A 249 -41.142 2.955 82.400 1.00 0.00 H ATOM 1944 N LYS A 250 -38.561 1.583 84.030 1.00 9.76 N ATOM 1945 CA LYS A 250 -37.566 0.578 84.380 1.00 8.71 C ATOM 1946 C LYS A 250 -36.698 0.187 83.178 1.00 7.62 C ATOM 1947 O LYS A 250 -35.492 -0.041 83.321 1.00 11.22 O ATOM 1948 CB LYS A 250 -38.247 -0.655 84.974 1.00 12.61 C ATOM 1949 CG LYS A 250 -37.290 -1.586 85.702 1.00 26.38 C ATOM 1950 CD LYS A 250 -36.521 -0.805 86.788 1.00 27.01 C ATOM 1951 CE LYS A 250 -35.814 -1.718 87.770 1.00 36.12 C ATOM 1952 NZ LYS A 250 -36.793 -2.174 88.793 1.00 43.31 N ATOM 1953 HZ1 LYS A 250 -37.179 -1.348 89.294 1.00 0.00 H ATOM 1954 HZ2 LYS A 250 -37.566 -2.690 88.326 1.00 0.00 H ATOM 1955 HZ3 LYS A 250 -36.316 -2.802 89.472 1.00 0.00 H ATOM 1956 H LYS A 250 -39.574 1.378 84.148 1.00 0.00 H ATOM 1957 N HIS A 251 -37.299 0.073 81.993 1.00 7.44 N ATOM 1958 CA HIS A 251 -36.523 -0.164 80.787 1.00 6.40 C ATOM 1959 C HIS A 251 -35.410 0.868 80.639 1.00 11.18 C ATOM 1960 O HIS A 251 -34.253 0.519 80.375 1.00 10.04 O ATOM 1961 CB HIS A 251 -37.420 -0.128 79.541 1.00 7.60 C ATOM 1962 CG HIS A 251 -36.633 -0.172 78.275 1.00 10.63 C ATOM 1963 ND1 HIS A 251 -35.934 -1.286 77.857 1.00 8.30 N ATOM 1964 CD2 HIS A 251 -36.330 0.802 77.393 1.00 7.20 C ATOM 1965 CE1 HIS A 251 -35.283 -1.005 76.744 1.00 10.39 C ATOM 1966 NE2 HIS A 251 -35.513 0.257 76.443 1.00 8.76 N ATOM 1967 H HIS A 251 -38.334 0.155 81.931 1.00 0.00 H ATOM 1968 N THR A 252 -35.752 2.156 80.770 1.00 7.48 N ATOM 1969 CA THR A 252 -34.746 3.199 80.615 1.00 5.30 C ATOM 1970 C THR A 252 -33.660 3.059 81.670 1.00 7.48 C ATOM 1971 O THR A 252 -32.479 3.144 81.354 1.00 7.73 O ATOM 1972 CB THR A 252 -35.383 4.596 80.676 1.00 7.11 C ATOM 1973 OG1 THR A 252 -36.437 4.668 79.710 1.00 8.83 O ATOM 1974 CG2 THR A 252 -34.371 5.675 80.357 1.00 7.86 C ATOM 1975 HG1 THR A 252 -37.118 3.980 79.915 1.00 0.00 H ATOM 1976 H THR A 252 -36.737 2.412 80.983 1.00 0.00 H ATOM 1977 N THR A 253 -34.043 2.813 82.918 1.00 6.76 N ATOM 1978 CA THR A 253 -33.036 2.575 83.957 1.00 8.37 C ATOM 1979 C THR A 253 -32.110 1.425 83.588 1.00 8.39 C ATOM 1980 O THR A 253 -30.896 1.510 83.794 1.00 10.17 O ATOM 1981 CB THR A 253 -33.741 2.291 85.272 1.00 8.91 C ATOM 1982 OG1 THR A 253 -34.419 3.486 85.677 1.00 12.74 O ATOM 1983 CG2 THR A 253 -32.760 1.910 86.354 1.00 10.39 C ATOM 1984 HG1 THR A 253 -34.887 3.324 86.534 1.00 0.00 H ATOM 1985 H THR A 253 -35.055 2.789 83.158 1.00 0.00 H ATOM 1986 N ASN A 254 -32.660 0.323 83.069 1.00 7.84 N ATOM 1987 CA ASN A 254 -31.806 -0.801 82.687 1.00 10.39 C ATOM 1988 C ASN A 254 -30.785 -0.396 81.634 1.00 9.35 C ATOM 1989 O ASN A 254 -29.602 -0.744 81.727 1.00 9.78 O ATOM 1990 CB ASN A 254 -32.647 -1.952 82.151 1.00 8.72 C ATOM 1991 CG ASN A 254 -33.524 -2.578 83.198 1.00 12.23 C ATOM 1992 OD1 ASN A 254 -33.292 -2.453 84.404 1.00 18.02 O ATOM 1993 ND2 ASN A 254 -34.542 -3.285 82.735 1.00 14.20 N ATOM 1994 HD22 ASN A 254 -34.698 -3.362 81.710 1.00 0.00 H ATOM 1995 HD21 ASN A 254 -35.186 -3.764 83.396 1.00 0.00 H ATOM 1996 H ASN A 254 -33.690 0.265 82.937 1.00 0.00 H ATOM 1997 N VAL A 255 -31.226 0.325 80.607 1.00 7.06 N ATOM 1998 CA VAL A 255 -30.318 0.724 79.535 1.00 6.34 C ATOM 1999 C VAL A 255 -29.263 1.691 80.058 1.00 6.57 C ATOM 2000 O VAL A 255 -28.096 1.632 79.661 1.00 9.75 O ATOM 2001 CB VAL A 255 -31.116 1.347 78.377 1.00 9.04 C ATOM 2002 CG1 VAL A 255 -30.195 1.932 77.318 1.00 10.34 C ATOM 2003 CG2 VAL A 255 -32.018 0.285 77.761 1.00 8.28 C ATOM 2004 H VAL A 255 -32.226 0.607 80.567 1.00 0.00 H ATOM 2005 N VAL A 256 -29.675 2.632 80.889 1.00 7.28 N ATOM 2006 CA VAL A 256 -28.745 3.616 81.427 1.00 7.72 C ATOM 2007 C VAL A 256 -27.696 2.944 82.297 1.00 8.32 C ATOM 2008 O VAL A 256 -26.510 3.267 82.223 1.00 9.74 O ATOM 2009 CB VAL A 256 -29.515 4.694 82.212 1.00 9.09 C ATOM 2010 CG1 VAL A 256 -28.566 5.560 83.060 1.00 16.05 C ATOM 2011 CG2 VAL A 256 -30.348 5.518 81.200 1.00 12.19 C ATOM 2012 H VAL A 256 -30.678 2.671 81.163 1.00 0.00 H ATOM 2013 N LYS A 257 -28.120 2.030 83.162 1.00 7.49 N ATOM 2014 CA LYS A 257 -27.170 1.349 84.028 1.00 7.71 C ATOM 2015 C LYS A 257 -26.211 0.479 83.214 1.00 8.49 C ATOM 2016 O LYS A 257 -25.026 0.392 83.546 1.00 11.58 O ATOM 2017 CB LYS A 257 -27.916 0.529 85.080 1.00 8.02 C ATOM 2018 CG LYS A 257 -28.541 1.361 86.163 1.00 9.06 C ATOM 2019 CD LYS A 257 -29.165 0.481 87.216 1.00 14.72 C ATOM 2020 CE LYS A 257 -29.680 1.290 88.367 1.00 22.40 C ATOM 2021 NZ LYS A 257 -30.103 0.350 89.440 1.00 27.38 N ATOM 2022 HZ1 LYS A 257 -30.851 -0.274 89.077 1.00 0.00 H ATOM 2023 HZ2 LYS A 257 -29.288 -0.222 89.740 1.00 0.00 H ATOM 2024 HZ3 LYS A 257 -30.465 0.892 90.251 1.00 0.00 H ATOM 2025 H LYS A 257 -29.133 1.801 83.220 1.00 0.00 H ATOM 2026 N ALA A 258 -26.707 -0.184 82.174 1.00 8.36 N ATOM 2027 CA ALA A 258 -25.826 -0.959 81.302 1.00 8.83 C ATOM 2028 C ALA A 258 -24.792 -0.073 80.634 1.00 12.37 C ATOM 2029 O ALA A 258 -23.609 -0.424 80.553 1.00 10.97 O ATOM 2030 CB ALA A 258 -26.645 -1.694 80.245 1.00 13.76 C ATOM 2031 H ALA A 258 -27.728 -0.151 81.980 1.00 0.00 H ATOM 2032 N HIS A 259 -25.209 1.095 80.174 1.00 10.61 N ATOM 2033 CA HIS A 259 -24.260 2.031 79.587 1.00 7.89 C ATOM 2034 C HIS A 259 -23.233 2.488 80.621 1.00 10.32 C ATOM 2035 O HIS A 259 -22.044 2.609 80.310 1.00 12.31 O ATOM 2036 CB HIS A 259 -24.995 3.232 79.018 1.00 10.21 C ATOM 2037 CG HIS A 259 -24.080 4.216 78.381 1.00 10.09 C ATOM 2038 ND1 HIS A 259 -23.532 4.004 77.140 1.00 18.12 N ATOM 2039 CD2 HIS A 259 -23.574 5.393 78.827 1.00 13.24 C ATOM 2040 CE1 HIS A 259 -22.753 5.027 76.832 1.00 18.26 C ATOM 2041 NE2 HIS A 259 -22.752 5.875 77.844 1.00 17.77 N ATOM 2042 H HIS A 259 -26.217 1.346 80.232 1.00 0.00 H ATOM 2043 N THR A 260 -23.689 2.776 81.849 1.00 8.34 N ATOM 2044 CA THR A 260 -22.786 3.187 82.915 1.00 8.23 C ATOM 2045 C THR A 260 -21.679 2.171 83.102 1.00 12.02 C ATOM 2046 O THR A 260 -20.523 2.538 83.336 1.00 14.24 O ATOM 2047 CB THR A 260 -23.593 3.340 84.205 1.00 9.91 C ATOM 2048 OG1 THR A 260 -24.458 4.471 84.084 1.00 14.77 O ATOM 2049 CG2 THR A 260 -22.714 3.503 85.420 1.00 9.39 C ATOM 2050 HG1 THR A 260 -24.983 4.574 84.917 1.00 0.00 H ATOM 2051 H THR A 260 -24.708 2.704 82.044 1.00 0.00 H ATOM 2052 N ASN A 261 -22.013 0.893 83.007 1.00 11.30 N ATOM 2053 CA ASN A 261 -21.044 -0.158 83.268 1.00 11.65 C ATOM 2054 C ASN A 261 -20.249 -0.558 82.029 1.00 18.45 C ATOM 2055 O ASN A 261 -19.382 -1.424 82.138 1.00 20.10 O ATOM 2056 CB ASN A 261 -21.744 -1.383 83.862 1.00 13.28 C ATOM 2057 CG ASN A 261 -22.198 -1.148 85.279 1.00 14.96 C ATOM 2058 OD1 ASN A 261 -21.848 -0.139 85.882 1.00 17.36 O ATOM 2059 ND2 ASN A 261 -22.957 -2.074 85.829 1.00 18.73 N ATOM 2060 HD22 ASN A 261 -23.231 -2.915 85.281 1.00 0.00 H ATOM 2061 HD21 ASN A 261 -23.282 -1.964 86.811 1.00 0.00 H ATOM 2062 H ASN A 261 -22.985 0.637 82.741 1.00 0.00 H ATOM 2063 N ARG A 262 -20.500 0.061 80.878 1.00 18.33 N ATOM 2064 CA ARG A 262 -19.839 -0.291 79.603 1.00 19.36 C ATOM 2065 C ARG A 262 -18.330 -0.506 79.720 1.00 28.46 C ATOM 2066 O ARG A 262 -17.613 0.322 80.285 1.00 27.69 O ATOM 2067 CB ARG A 262 -20.112 0.781 78.570 1.00 28.67 C ATOM 2068 H ARG A 262 -21.197 0.833 80.875 1.00 0.00 H TER 2069 ARG A 262 HETATM 2070 ZN ZN A 1 -31.978 15.614 74.104 1.00 8.08 ZN HETATM 2071 ZN ZN A 2 -34.481 13.825 71.993 1.00 10.72 ZN HETATM 2072 ZN ZN A 3 -36.089 -3.209 78.684 1.00 12.18 ZN HETATM 2073 O HOH 4 -34.449 -1.568 85.385 1.00 37.01 O HETATM 2074 O HOH 5 -28.278 21.515 65.855 1.00 40.22 O HETATM 2075 O HOH 6 -31.703 23.167 91.853 1.00 43.30 O HETATM 2076 O HOH 7 -44.447 -3.381 78.074 1.00 21.37 O HETATM 2077 O HOH 8 -60.746 28.616 70.061 1.00 30.05 O HETATM 2078 O HOH 9 -29.923 4.130 71.025 1.00 26.16 O HETATM 2079 O HOH 10 -42.780 31.171 86.096 1.00 37.45 O HETATM 2080 O HOH 11 -31.819 -1.867 86.267 1.00 22.33 O HETATM 2081 O HOH 12 -45.667 -5.303 80.894 1.00 27.09 O HETATM 2082 O HOH 13 -51.566 13.184 61.042 1.00 25.40 O HETATM 2083 O HOH 14 -46.999 34.571 79.453 1.00 27.66 O HETATM 2084 O HOH 15 -60.136 14.954 71.374 1.00 37.91 O HETATM 2085 O HOH 16 -31.481 15.643 92.152 1.00 37.05 O HETATM 2086 O HOH 17 -49.013 32.921 77.132 1.00 28.24 O HETATM 2087 O HOH 18 -56.858 30.460 60.960 1.00 28.72 O HETATM 2088 O HOH 19 -31.144 28.310 86.428 1.00 32.92 O HETATM 2089 O HOH 20 -32.319 25.451 67.899 1.00 15.03 O HETATM 2090 O HOH 21 -50.575 19.845 57.002 1.00 34.14 O HETATM 2091 O HOH 22 -49.987 27.062 88.040 1.00 37.27 O HETATM 2092 O HOH 23 -34.252 9.945 74.534 1.00 12.54 O HETATM 2093 O HOH 24 -53.846 11.632 88.636 1.00 33.42 O HETATM 2094 O HOH 25 -35.460 22.570 83.806 1.00 15.79 O HETATM 2095 O HOH 26 -41.049 2.260 87.342 1.00 27.22 O HETATM 2096 O HOH 27 -42.618 22.966 56.438 1.00 21.01 O HETATM 2097 O HOH 28 -41.148 0.755 85.272 1.00 20.89 O HETATM 2098 O HOH 29 -30.248 9.800 75.548 1.00 8.99 O HETATM 2099 O HOH 30 -23.415 20.607 75.654 1.00 45.62 O HETATM 2100 O HOH 31 -40.531 15.205 59.425 1.00 16.59 O HETATM 2101 O HOH 32 -38.571 -6.637 82.637 1.00 12.36 O HETATM 2102 O HOH 33 -42.799 24.335 92.484 1.00 25.37 O HETATM 2103 O HOH 34 -42.289 20.547 55.206 1.00 30.72 O HETATM 2104 O HOH 35 -37.785 34.747 80.293 1.00 14.25 O HETATM 2105 O HOH 36 -36.768 29.141 88.826 1.00 38.14 O HETATM 2106 O HOH 37 -30.532 19.231 89.456 1.00 29.21 O HETATM 2107 O HOH 38 -58.688 13.475 78.272 1.00 31.61 O HETATM 2108 O HOH 39 -48.195 12.933 92.550 1.00 35.68 O HETATM 2109 O HOH 40 -61.253 20.058 66.755 1.00 32.91 O HETATM 2110 O HOH 41 -29.754 28.569 66.546 1.00 26.20 O HETATM 2111 O HOH 42 -43.991 31.143 61.867 1.00 21.41 O HETATM 2112 O HOH 43 -34.944 22.917 86.437 1.00 17.54 O HETATM 2113 O HOH 44 -59.336 20.609 57.686 1.00 30.98 O HETATM 2114 O HOH 45 -31.464 12.609 90.551 1.00 18.57 O HETATM 2115 O HOH 46 -36.605 8.735 74.010 1.00 10.90 O HETATM 2116 O HOH 47 -50.266 2.961 86.345 1.00 18.82 O HETATM 2117 O HOH 48 -29.310 7.397 90.256 1.00 15.14 O HETATM 2118 O HOH 49 -49.972 12.118 90.194 1.00 20.91 O HETATM 2119 O HOH 50 -39.586 16.644 68.199 1.00 16.11 O HETATM 2120 O HOH 51 -57.307 18.254 77.349 1.00 37.76 O HETATM 2121 O HOH 52 -30.725 13.220 93.713 1.00 25.03 O HETATM 2122 O HOH 53 -18.054 2.228 82.137 1.00 27.38 O HETATM 2123 O HOH 54 -40.427 0.673 71.289 1.00 12.95 O HETATM 2124 O HOH 55 -41.950 1.525 73.490 1.00 10.65 O HETATM 2125 O HOH 56 -37.542 28.039 64.043 1.00 17.89 O HETATM 2126 O HOH 57 -23.555 23.931 69.918 1.00 31.83 O HETATM 2127 O HOH 58 -41.809 15.626 94.644 1.00 30.52 O HETATM 2128 O HOH 59 -30.952 32.428 77.849 1.00 22.88 O HETATM 2129 O HOH 60 -25.352 23.901 76.257 1.00 22.79 O HETATM 2130 O HOH 61 -34.776 18.140 95.627 1.00 37.10 O HETATM 2131 O HOH 62 -28.986 31.230 70.359 1.00 19.73 O HETATM 2132 O HOH 63 -44.480 28.117 86.814 1.00 29.54 O HETATM 2133 O HOH 64 -26.748 31.672 71.764 1.00 24.41 O HETATM 2134 O HOH 65 -38.584 19.618 95.347 1.00 25.09 O HETATM 2135 O HOH 66 -54.317 25.714 64.647 1.00 22.94 O HETATM 2136 O HOH 67 -60.579 28.552 75.645 1.00 42.22 O HETATM 2137 O HOH 68 -27.491 22.146 68.546 1.00 25.96 O HETATM 2138 O HOH 69 -37.335 16.028 77.105 1.00 9.74 O HETATM 2139 O HOH 70 -48.244 19.998 57.503 1.00 20.17 O HETATM 2140 O HOH 71 -34.873 3.859 88.359 1.00 20.22 O HETATM 2141 O HOH 72 -31.025 34.931 76.512 1.00 33.86 O HETATM 2142 O HOH 73 -27.371 18.819 80.443 1.00 12.94 O HETATM 2143 O HOH 74 -54.533 11.114 86.397 1.00 26.00 O HETATM 2144 O HOH 75 -52.100 27.058 75.809 1.00 18.89 O HETATM 2145 O HOH 76 -47.355 2.198 89.157 1.00 19.23 O HETATM 2146 O HOH 77 -44.963 34.799 69.868 1.00 17.20 O HETATM 2147 O HOH 78 -37.572 14.897 79.578 1.00 11.26 O HETATM 2148 O HOH 79 -50.661 1.171 81.031 1.00 30.23 O HETATM 2149 O HOH 80 -26.180 5.077 86.310 1.00 17.52 O HETATM 2150 O HOH 81 -36.856 19.017 58.382 1.00 35.37 O HETATM 2151 O HOH 82 -28.809 -2.935 83.228 1.00 17.69 O HETATM 2152 O HOH 83 -31.890 6.058 93.873 1.00 33.32 O HETATM 2153 O HOH 84 -47.790 17.504 92.314 1.00 32.65 O HETATM 2154 O HOH 85 -50.014 15.000 89.980 1.00 31.77 O HETATM 2155 O HOH 86 -25.170 6.615 90.587 1.00 16.84 O HETATM 2156 O HOH 87 -44.442 0.720 87.624 1.00 29.67 O HETATM 2157 O HOH 88 -51.538 9.242 62.802 1.00 40.13 O HETATM 2158 O HOH 89 -48.826 0.880 67.418 1.00 35.50 O HETATM 2159 O HOH 90 -32.299 31.537 82.030 1.00 24.12 O HETATM 2160 O HOH 91 -41.401 8.784 67.543 1.00 14.11 O HETATM 2161 O HOH 92 -23.113 11.434 82.501 1.00 26.36 O HETATM 2162 O HOH 93 -41.212 33.863 85.068 1.00 32.14 O HETATM 2163 O HOH 94 -54.847 5.418 86.472 1.00 32.80 O HETATM 2164 O HOH 95 -35.425 5.156 70.125 1.00 25.54 O HETATM 2165 O HOH 96 -44.218 0.210 73.967 1.00 16.72 O HETATM 2166 O HOH 97 -34.188 32.013 69.774 1.00 20.09 O HETATM 2167 O HOH 98 -50.401 33.043 74.488 1.00 27.58 O HETATM 2168 O HOH 99 -56.785 17.841 79.538 1.00 38.13 O HETATM 2169 O HOH 100 -39.194 34.461 65.779 1.00 25.57 O HETATM 2170 O HOH 101 -46.037 6.502 94.454 1.00 27.54 O HETATM 2171 O HOH 102 -21.156 28.978 74.427 1.00 34.60 O HETATM 2172 O HOH 103 -26.262 30.074 66.997 1.00 27.83 O HETATM 2173 O HOH 104 -42.381 6.612 66.032 1.00 19.53 O HETATM 2174 O HOH 105 -37.660 23.581 80.225 1.00 8.26 O HETATM 2175 O HOH 106 -51.725 25.718 64.142 1.00 18.33 O HETATM 2176 O HOH 107 -49.056 31.457 80.526 1.00 30.29 O HETATM 2177 O HOH 108 -36.207 6.269 72.724 1.00 11.70 O HETATM 2178 O HOH 109 -27.654 14.071 76.532 1.00 12.62 O HETATM 2179 O HOH 110 -28.416 20.928 70.926 1.00 30.27 O HETATM 2180 O HOH 111 -48.772 2.174 82.788 1.00 20.26 O HETATM 2181 O HOH 112 -50.325 9.544 92.356 1.00 19.85 O HETATM 2182 O HOH 113 -37.706 26.911 87.507 1.00 14.92 O HETATM 2183 O HOH 114 -22.959 -3.172 80.933 1.00 22.88 O HETATM 2184 O HOH 115 -50.577 35.713 69.358 1.00 25.40 O HETATM 2185 O HOH 116 -55.749 17.523 82.376 1.00 20.05 O HETATM 2186 O HOH 117 -33.159 23.291 64.535 1.00 29.47 O HETATM 2187 O HOH 118 -48.111 9.540 93.799 1.00 29.02 O HETATM 2188 O HOH 119 -57.611 9.468 83.253 1.00 33.92 O HETATM 2189 O HOH 120 -43.709 32.048 82.897 1.00 42.36 O HETATM 2190 O HOH 121 -26.954 0.872 77.142 1.00 27.63 O HETATM 2191 O HOH 122 -33.061 36.131 78.240 1.00 35.88 O HETATM 2192 O HOH 123 -37.245 20.710 60.476 1.00 17.81 O HETATM 2193 O HOH 124 -55.592 7.270 67.599 1.00 32.45 O HETATM 2194 O HOH 125 -42.072 15.890 66.874 1.00 13.74 O HETATM 2195 O HOH 126 -51.490 27.707 84.349 1.00 30.77 O HETATM 2196 O HOH 127 -40.877 26.674 73.928 1.00 10.14 O HETATM 2197 O HOH 128 -52.398 19.210 88.977 1.00 40.62 O HETATM 2198 O HOH 129 -43.359 21.913 93.541 1.00 31.59 O HETATM 2199 O HOH 130 -29.547 19.110 69.747 1.00 20.72 O HETATM 2200 O HOH 131 -20.174 4.845 80.309 1.00 24.30 O HETATM 2201 O HOH 132 -34.216 24.102 61.664 1.00 24.17 O HETATM 2202 O HOH 133 -35.846 -4.220 72.922 1.00 33.68 O HETATM 2203 O HOH 134 -35.735 22.866 59.396 1.00 28.57 O HETATM 2204 O HOH 135 -22.726 15.377 80.706 1.00 34.37 O HETATM 2205 O HOH 136 -28.665 25.568 83.509 1.00 32.86 O HETATM 2206 O HOH 137 -39.901 4.953 92.563 1.00 36.21 O HETATM 2207 O HOH 138 -22.319 11.175 79.818 1.00 31.65 O HETATM 2208 O HOH 139 -32.075 22.057 85.867 1.00 23.68 O HETATM 2209 O HOH 140 -41.842 12.175 93.255 1.00 32.46 O HETATM 2210 O HOH 141 -57.612 14.328 65.750 1.00 32.52 O HETATM 2211 O HOH 142 -30.548 18.353 65.331 1.00 22.33 O HETATM 2212 O HOH 143 -30.466 15.996 89.815 1.00 23.12 O HETATM 2213 O HOH 144 -21.402 8.315 78.853 1.00 24.10 O HETATM 2214 O HOH 145 -52.212 27.897 65.928 1.00 18.89 O HETATM 2215 O HOH 146 -47.229 17.232 57.416 1.00 21.40 O HETATM 2216 O HOH 147 -62.476 25.696 65.469 1.00 34.49 O HETATM 2217 O HOH 148 -25.127 1.829 75.567 1.00 29.63 O HETATM 2218 O HOH 149 -50.322 1.965 77.425 1.00 35.55 O HETATM 2219 O HOH 150 -23.487 10.227 73.467 1.00 21.22 O HETATM 2220 O HOH 151 -48.843 25.045 90.452 1.00 26.53 O HETATM 2221 O HOH 152 -19.966 5.494 83.046 1.00 24.14 O HETATM 2222 O HOH 153 -45.300 -0.855 77.285 1.00 26.86 O HETATM 2223 O HOH 154 -30.561 2.685 91.335 1.00 23.46 O HETATM 2224 O HOH 155 -32.106 19.648 92.236 1.00 27.58 O HETATM 2225 O HOH 156 -41.402 34.921 81.492 1.00 19.80 O HETATM 2226 O HOH 157 -53.458 28.525 82.295 1.00 34.07 O HETATM 2227 O HOH 158 -51.655 32.640 69.772 1.00 38.07 O HETATM 2228 O HOH 159 -35.693 8.684 93.826 1.00 27.58 O HETATM 2229 O HOH 160 -55.044 9.333 65.565 1.00 30.19 O HETATM 2230 O HOH 161 -60.148 9.486 76.532 1.00 33.76 O HETATM 2231 O HOH 162 -44.699 4.123 92.951 1.00 27.37 O HETATM 2232 O HOH 163 -43.911 19.678 94.036 1.00 34.89 O HETATM 2233 O HOH 164 -41.795 -1.927 70.798 1.00 34.54 O HETATM 2234 O HOH 165 -44.186 30.204 85.456 1.00 23.97 O HETATM 2235 O HOH 166 -46.132 17.821 94.090 1.00 41.30 O HETATM 2236 O HOH 167 -50.612 17.040 92.057 1.00 38.36 O HETATM 2237 O HOH 168 -27.525 31.735 68.071 1.00 27.26 O HETATM 2238 O HOH 169 -45.584 33.156 61.094 1.00 27.93 O HETATM 2239 O HOH 170 -51.365 15.839 88.233 1.00 42.67 O HETATM 2240 O HOH 171 -38.946 32.284 62.047 1.00 32.90 O HETATM 2241 O HOH 172 -52.862 0.602 86.929 1.00 30.90 O HETATM 2242 O HOH 173 -25.492 20.469 81.082 1.00 34.33 O HETATM 2243 O HOH 174 -55.403 28.188 81.110 1.00 42.02 O HETATM 2244 O HOH 175 -35.011 25.842 86.297 1.00 17.00 O HETATM 2245 O HOH 176 -40.629 17.989 96.603 1.00 43.43 O HETATM 2246 O HOH 177 -29.600 6.132 94.927 1.00 45.53 O HETATM 2247 O HOH 178 -34.872 10.459 95.771 1.00 34.77 O HETATM 2248 O HOH 179 -19.469 14.340 79.220 1.00 40.97 O HETATM 2249 O HOH 180 -40.410 -2.798 88.286 1.00 31.36 O HETATM 2250 O HOH 181 -30.524 32.541 80.332 1.00 27.89 O HETATM 2251 O HOH 182 -40.546 4.625 65.572 1.00 22.74 O HETATM 2252 O HOH 183 -33.091 2.707 90.106 1.00 33.88 O HETATM 2253 O HOH 184 -38.134 8.578 94.787 1.00 38.61 O HETATM 2254 O HOH 185 -51.137 -1.328 66.450 1.00 41.34 O HETATM 2255 O HOH 186 -14.245 0.553 78.332 1.00 42.17 O HETATM 2256 O HOH 187 -33.132 35.208 74.462 1.00 28.80 O HETATM 2257 O HOH 188 -15.748 2.095 83.402 1.00 29.12 O HETATM 2258 O HOH 189 -18.944 6.159 79.220 1.00 28.38 O HETATM 2259 O HOH 190 -45.487 0.984 92.973 1.00 35.35 O HETATM 2260 O HOH 191 -32.613 34.552 63.787 1.00 45.66 O HETATM 2261 O HOH 192 -23.719 22.797 77.887 1.00 41.91 O HETATM 2262 O HOH 193 -39.977 13.929 94.298 1.00 29.23 O HETATM 2263 O HOH 194 -36.720 29.833 62.017 1.00 24.55 O HETATM 2264 O HOH 195 -28.802 4.705 90.633 1.00 17.17 O HETATM 2265 O HOH 196 -16.526 4.422 81.220 1.00 25.81 O HETATM 2266 O HOH 197 -48.959 0.359 85.010 1.00 34.75 O HETATM 2267 O HOH 198 -20.624 20.543 76.173 1.00 42.88 O HETATM 2268 O HOH 199 -38.628 3.168 88.511 1.00 27.87 O HETATM 2269 O HOH 200 -34.724 6.099 93.893 1.00 28.14 O HETATM 2270 O HOH 201 -34.340 4.093 92.720 1.00 31.53 O HETATM 2271 O HOH 202 -46.492 0.118 87.323 1.00 36.45 O HETATM 2272 O HOH 203 -37.028 37.339 81.829 1.00 41.51 O HETATM 2273 O HOH 204 -13.870 2.762 79.292 1.00 46.02 O HETATM 2274 O HOH 205 -49.806 11.384 94.590 1.00 41.50 O HETATM 2275 O HOH 206 -42.215 25.770 55.691 1.00 41.21 O HETATM 2276 O HOH 207 -47.007 21.832 55.540 1.00 29.27 O HETATM 2277 O HOH 208 -41.215 31.889 60.529 1.00 31.90 O HETATM 2278 O HOH 209 -65.597 19.662 68.158 1.00 50.10 O HETATM 2279 O HOH 210 -58.269 7.599 77.660 1.00 37.75 O HETATM 2280 O HOH 211 -31.388 5.108 95.916 1.00 39.16 O HETATM 2281 O HOH 212 -14.176 4.728 78.795 1.00 37.93 O HETATM 2282 C17 BY A 0 -28.737 12.899 66.569 1.00 -0.01 C HETATM 2283 C13 BY A 0 -28.562 11.803 67.445 1.00 -0.06 C HETATM 2284 C14 BY A 0 -27.361 11.993 68.116 1.00 0.08 C HETATM 2285 O15 BY A 0 -26.813 13.142 67.668 1.00 -0.27 O HETATM 2286 C16 BY A 0 -27.645 13.711 66.719 1.00 0.12 C HETATM 2287 C21 BY A 0 -27.534 14.899 65.954 1.00 -0.03 C HETATM 2288 C20 BY A 0 -28.539 15.234 65.056 1.00 -0.07 C HETATM 2289 C19 BY A 0 -29.646 14.401 64.910 1.00 -0.08 C HETATM 2290 C18 BY A 0 -29.757 13.232 65.653 1.00 -0.07 C HETATM 2291 H18 BY A 0 -30.617 12.584 65.530 1.00 0.06 H HETATM 2292 H19 BY A 0 -30.429 14.668 64.209 1.00 0.05 H HETATM 2293 H20 BY A 0 -28.462 16.142 64.469 1.00 0.05 H HETATM 2294 H21 BY A 0 -26.669 15.543 66.069 1.00 0.06 H HETATM 2295 H1 BY A 0 -26.937 11.332 68.870 1.00 0.09 H HETATM 2296 C1 BY A 0 -29.543 10.660 67.635 1.00 -0.14 C HETATM 2297 C2 BY A 0 -30.197 10.807 69.012 1.00 -0.22 C HETATM 2298 N3 BY A 0 -31.114 11.971 69.090 1.00 -0.44 N HETATM 2299 C4 BY A 0 -30.727 13.332 69.506 1.00 0.15 C HETATM 2300 O5 BY A 0 -29.618 13.634 69.806 1.00 -0.40 O HETATM 2301 C6 BY A 0 -31.772 14.447 69.570 1.00 0.05 C HETATM 2302 C7 BY A 0 -31.679 15.242 70.894 1.00 0.01 C HETATM 2303 S8 BY A 0 -32.195 14.202 72.291 1.00 -0.18 S HETATM 2304 H10 BY A 0 -32.129 14.732 73.146 1.00 0.10 H HETATM 2305 H8 BY A 0 -32.335 16.123 70.835 1.00 0.04 H HETATM 2306 H9 BY A 0 -30.640 15.569 71.049 1.00 0.04 H HETATM 2307 C9 BY A 0 -31.523 15.403 68.403 1.00 -0.04 C HETATM 2308 H11 BY A 0 -31.587 14.849 67.455 1.00 0.03 H HETATM 2309 H12 BY A 0 -30.522 15.848 68.501 1.00 0.03 H HETATM 2310 H13 BY A 0 -32.281 16.200 68.413 1.00 0.03 H HETATM 2311 H7 BY A 0 -32.777 14.007 69.484 1.00 0.05 H HETATM 2312 H6 BY A 0 -32.071 11.821 68.841 1.00 0.15 H HETATM 2313 O11 BY A 0 -30.257 8.279 69.071 1.00 -0.41 O HETATM 2314 H14 BY A 0 -30.469 7.655 69.755 1.00 0.21 H HETATM 2315 H15 BY A 0 -30.469 7.655 69.755 1.00 0.21 H HETATM 2316 O12 BY A 0 -32.278 9.355 69.305 1.00 -0.87 O HETATM 2317 H16 BY A 0 -32.588 9.031 68.468 1.00 -0.13 H HETATM 2318 H4 BY A 0 -29.406 10.932 69.766 1.00 -0.18 H HETATM 2319 H2 BY A 0 -29.010 9.700 67.578 1.00 0.00 H HETATM 2320 H3 BY A 0 -30.314 10.698 66.852 1.00 0.00 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 741 739 740 2070 CONECT 761 760 763 2070 CONECT 782 780 2071 CONECT 1321 1319 1320 2070 CONECT 1482 1481 2071 CONECT 1875 1873 1874 2071 CONECT 1963 1962 1965 2072 CONECT 2070 741 761 1321 CONECT 2071 782 1482 1875 CONECT 2072 1963 CONECT 2282 2283 2286 2290 CONECT 2283 2282 2284 2296 CONECT 2284 2283 2285 2295 CONECT 2285 2284 2286 CONECT 2286 2282 2285 2287 CONECT 2287 2286 2288 2294 CONECT 2288 2287 2289 2293 CONECT 2289 2288 2290 2292 CONECT 2290 2282 2289 2291 CONECT 2291 2290 CONECT 2292 2289 CONECT 2293 2288 CONECT 2294 2287 CONECT 2295 2284 CONECT 2296 2283 2297 2319 2320 CONECT 2297 0 2296 2298 2318 CONECT 2298 2297 2299 2312 CONECT 2299 2298 2300 2301 CONECT 2300 2299 CONECT 2301 2299 2302 2307 2311 CONECT 2302 2301 2303 2305 2306 CONECT 2303 2302 2304 CONECT 2304 2303 CONECT 2305 2302 CONECT 2306 2302 CONECT 2307 2301 2308 2309 2310 CONECT 2308 2307 CONECT 2309 2307 CONECT 2310 2307 CONECT 2311 2301 CONECT 2312 2298 CONECT 2313 0 2314 2315 CONECT 2314 2313 CONECT 2315 2313 CONECT 2316 0 2317 CONECT 2317 2316 CONECT 2318 2297 CONECT 2319 2296 CONECT 2320 2296 MASTER 0 0 0 0 0 0 0 0 2319 1 53 18 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 6jn6
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%
6j8r
RCSB PDB
PDBbind
231aa, >6J8R_1|Chain... at 100%
6dd1
RCSB PDB
PDBbind
242aa, >6DD1_1|Chains... at 99%
5o7n
RCSB PDB
PDBbind
254aa, >5O7N_1|Chains... at 94%
6dd0
RCSB PDB
PDBbind
242aa, >6DD0_1|Chains... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6jn6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
VIM-2
Ligand Name
BY0
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Ki=0.07uM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 7160-7184
Ligand Properties
Formula
C
1
4
H
1
9
BNO
4
S
Molecular Weight
308.181
Exact Mass
308.113
No. of atoms
40
No. of bonds
41
Polar Surface Area
110.5
LOGP Value
1.70 (
Computed with XLOGP3
)
1.58 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
SC[C@H](C(=O)N[C@@H](B([OH2])O)Cc1coc2c1cccc2)C
InChI String
InChI=1S/C14H19BNO4S/c1-9(8-21)14(17)16-13(15(18)19)6-10-7-20-12-5-3-2-4-11(10)12/h2-5,7,9,13,18,21H,6,8,19H2,1H3,(H,16,17)/t9-,13-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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UniProt accession number (AC):
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NCBI Entrez Gene ID:
61723701
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Information of known allosteric effects of PDB entries
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