Browse entries in the PDBbind-CN Database
HEADER 6ARM_COMPLEX COMPND 6ARM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 110 PHE SER CYS ASN VAL ASP GLY GLY SER SER ILE GLY ALA SEQRES 2 A 110 GLY THR THR SER VAL TYR VAL ASN LEU ASP PRO VAL ILE SEQRES 3 A 110 GLN PRO GLY GLN ASN LEU VAL VAL ASP LEU SER GLN HIS SEQRES 4 A 110 ILE SER CYS TRP ASN ASP TYR GLY GLY TRP TYR ASP THR SEQRES 5 A 110 ASP HIS ILE ASN LEU VAL GLN GLY SER ALA PHE ALA GLY SEQRES 6 A 110 SER LEU GLN SER TYR LYS GLY SER LEU TYR TRP ASN ASN SEQRES 7 A 110 VAL THR TYR PRO PHE PRO LEU THR THR ASN THR ASN VAL SEQRES 8 A 110 LEU ASP ILE GLY ASP LYS THR PRO MET PRO LEU PRO LEU SEQRES 9 A 110 LYS LEU TYR ILE THR PRO SEQRES 1 A 41 GLY VAL VAL ILE LYS ALA GLY GLU VAL ILE ALA ARG ILE SEQRES 2 A 41 HIS MET TYR LYS ILE ALA THR LEU GLY SER GLY ASN PRO SEQRES 3 A 41 ARG ASN PHE THR TRP ASN ILE ILE SER ASN ASN SER VAL SEQRES 4 A 41 VAL MET HET MOL A 315 36 SSBOND 1 CYS A 3 CYS A 42 ATOM 1 N PHE A 1 68.808 74.312 242.205 1.00 20.31 N ATOM 2 CA PHE A 1 67.391 74.574 241.975 1.00 18.47 C ATOM 3 C PHE A 1 66.657 74.687 243.300 1.00 18.87 C ATOM 4 O PHE A 1 66.886 73.880 244.207 1.00 21.43 O ATOM 5 CB PHE A 1 66.790 73.463 241.107 1.00 14.99 C ATOM 6 CG PHE A 1 65.302 73.578 240.901 1.00 13.42 C ATOM 7 CD1 PHE A 1 64.422 72.787 241.622 1.00 15.78 C ATOM 8 CD2 PHE A 1 64.776 74.467 239.964 1.00 16.90 C ATOM 9 CE1 PHE A 1 63.052 72.888 241.433 1.00 16.66 C ATOM 10 CE2 PHE A 1 63.405 74.571 239.771 1.00 16.66 C ATOM 11 CZ PHE A 1 62.542 73.780 240.511 1.00 16.17 C ATOM 12 HN3 PHE A 1 68.914 73.421 242.731 1.00 0.00 H ATOM 13 HN2 PHE A 1 69.218 75.092 242.757 1.00 0.00 H ATOM 14 HN1 PHE A 1 69.298 74.237 241.291 1.00 0.00 H ATOM 15 N SER A 2 65.792 75.695 243.414 1.00 16.21 N ATOM 16 CA SER A 2 65.084 75.978 244.661 1.00 16.57 C ATOM 17 C SER A 2 63.654 76.441 244.385 1.00 15.47 C ATOM 18 O SER A 2 63.371 77.060 243.354 1.00 15.76 O ATOM 19 CB SER A 2 65.812 77.057 245.474 1.00 21.86 C ATOM 20 OG SER A 2 67.151 76.692 245.742 1.00 26.74 O ATOM 21 HG SER A 2 67.634 76.565 244.888 1.00 0.00 H ATOM 22 H SER A 2 65.615 76.301 242.587 1.00 0.00 H ATOM 23 N CYS A 3 62.766 76.146 245.326 1.00 18.58 N ATOM 24 CA CYS A 3 61.408 76.663 245.282 1.00 18.66 C ATOM 25 C CYS A 3 61.053 77.322 246.595 1.00 18.60 C ATOM 26 O CYS A 3 61.763 77.166 247.587 1.00 21.67 O ATOM 27 CB CYS A 3 60.406 75.547 245.003 1.00 14.87 C ATOM 28 SG CYS A 3 60.695 74.638 243.483 1.00 15.81 S ATOM 29 H CYS A 3 63.049 75.530 246.115 1.00 0.00 H ATOM 30 N ASN A 4 59.945 78.052 246.602 1.00 15.19 N ATOM 31 CA ASN A 4 59.320 78.434 247.859 1.00 20.51 C ATOM 32 C ASN A 4 57.800 78.474 247.733 1.00 20.87 C ATOM 33 O ASN A 4 57.229 78.414 246.631 1.00 17.07 O ATOM 34 CB ASN A 4 59.876 79.781 248.399 1.00 19.68 C ATOM 35 CG ASN A 4 59.603 80.979 247.486 1.00 20.60 C ATOM 36 OD1 ASN A 4 58.935 80.884 246.457 1.00 20.67 O ATOM 37 ND2 ASN A 4 60.138 82.140 247.885 1.00 25.67 N ATOM 38 HD22 ASN A 4 60.697 82.181 248.761 1.00 0.00 H ATOM 39 HD21 ASN A 4 59.995 83.000 247.319 1.00 0.00 H ATOM 40 H ASN A 4 59.520 78.353 245.702 1.00 0.00 H ATOM 41 N VAL A 5 57.159 78.532 248.892 1.00 18.23 N ATOM 42 CA VAL A 5 55.716 78.571 249.011 1.00 17.77 C ATOM 43 C VAL A 5 55.308 79.869 249.682 1.00 20.62 C ATOM 44 O VAL A 5 55.789 80.180 250.775 1.00 21.74 O ATOM 45 CB VAL A 5 55.191 77.383 249.832 1.00 16.99 C ATOM 46 CG1 VAL A 5 53.687 77.455 249.943 1.00 19.57 C ATOM 47 CG2 VAL A 5 55.636 76.056 249.184 1.00 18.22 C ATOM 48 H VAL A 5 57.724 78.551 249.765 1.00 0.00 H ATOM 49 N ASP A 6 54.424 80.607 249.022 1.00 18.39 N ATOM 50 CA ASP A 6 53.980 81.911 249.507 1.00 22.36 C ATOM 51 C ASP A 6 55.156 82.797 249.904 1.00 22.16 C ATOM 52 O ASP A 6 55.096 83.477 250.923 1.00 22.51 O ATOM 53 CB ASP A 6 53.037 81.748 250.698 1.00 22.69 C ATOM 54 CG ASP A 6 51.737 81.057 250.336 1.00 23.04 C ATOM 55 OD1 ASP A 6 51.336 81.069 249.152 1.00 22.53 O ATOM 56 OD2 ASP A 6 51.104 80.497 251.251 1.00 23.69 O ATOM 57 H ASP A 6 54.034 80.244 248.129 1.00 0.00 H ATOM 58 N GLY A 7 56.230 82.767 249.118 1.00 22.24 N ATOM 59 CA GLY A 7 57.380 83.628 249.351 1.00 21.10 C ATOM 60 C GLY A 7 58.196 83.293 250.590 1.00 23.58 C ATOM 61 O GLY A 7 58.965 84.122 251.067 1.00 24.85 O ATOM 62 H GLY A 7 56.248 82.108 248.313 1.00 0.00 H ATOM 63 N GLY A 8 58.044 82.079 251.106 1.00 22.21 N ATOM 64 CA GLY A 8 58.770 81.647 252.294 1.00 24.31 C ATOM 65 C GLY A 8 60.217 81.256 252.046 1.00 22.72 C ATOM 66 O GLY A 8 60.791 81.589 251.008 1.00 25.01 O ATOM 67 H GLY A 8 57.387 81.416 250.648 1.00 0.00 H ATOM 68 N SER A 9 60.810 80.533 252.994 1.00 24.88 N ATOM 69 CA SER A 9 62.213 80.148 252.867 1.00 26.55 C ATOM 70 C SER A 9 62.389 79.118 251.758 1.00 26.49 C ATOM 71 O SER A 9 61.438 78.431 251.366 1.00 24.34 O ATOM 72 CB SER A 9 62.769 79.617 254.197 1.00 29.03 C ATOM 73 OG SER A 9 62.039 78.502 254.673 1.00 36.53 O ATOM 74 HG SER A 9 62.430 78.194 255.529 1.00 0.00 H ATOM 75 H SER A 9 60.269 80.240 253.832 1.00 0.00 H ATOM 76 N SER A 10 63.612 79.032 251.246 1.00 26.16 N ATOM 77 CA SER A 10 63.920 78.186 250.101 1.00 23.66 C ATOM 78 C SER A 10 63.792 76.706 250.416 1.00 25.92 C ATOM 79 O SER A 10 64.078 76.266 251.534 1.00 24.04 O ATOM 80 CB SER A 10 65.335 78.474 249.593 1.00 25.88 C ATOM 81 OG SER A 10 65.441 79.823 249.181 1.00 31.07 O ATOM 82 HG SER A 10 65.244 80.417 249.948 1.00 0.00 H ATOM 83 H SER A 10 64.377 79.589 251.678 1.00 0.00 H ATOM 84 N ILE A 11 63.370 75.953 249.403 1.00 21.46 N ATOM 85 CA ILE A 11 63.169 74.513 249.477 1.00 24.86 C ATOM 86 C ILE A 11 63.946 73.809 248.365 1.00 21.58 C ATOM 87 O ILE A 11 63.841 74.174 247.180 1.00 19.27 O ATOM 88 CB ILE A 11 61.679 74.160 249.364 1.00 19.78 C ATOM 89 CG1 ILE A 11 60.867 75.045 250.316 1.00 20.81 C ATOM 90 CG2 ILE A 11 61.472 72.661 249.616 1.00 22.40 C ATOM 91 CD1 ILE A 11 59.360 74.951 250.142 1.00 20.20 C ATOM 92 H ILE A 11 63.170 76.425 248.498 1.00 0.00 H ATOM 93 N GLY A 12 64.738 72.812 248.738 1.00 20.76 N ATOM 94 CA GLY A 12 65.587 72.135 247.775 1.00 24.87 C ATOM 95 C GLY A 12 65.140 70.725 247.436 1.00 22.17 C ATOM 96 O GLY A 12 65.599 70.135 246.468 1.00 22.30 O ATOM 97 H GLY A 12 64.751 72.512 249.734 1.00 0.00 H ATOM 98 N ALA A 13 64.250 70.182 248.251 1.00 19.84 N ATOM 99 CA ALA A 13 63.725 68.835 248.055 1.00 20.37 C ATOM 100 C ALA A 13 62.772 68.546 249.188 1.00 19.11 C ATOM 101 O ALA A 13 62.675 69.333 250.138 1.00 22.17 O ATOM 102 CB ALA A 13 64.844 67.795 248.017 1.00 19.98 C ATOM 103 H ALA A 13 63.912 70.737 249.063 1.00 0.00 H ATOM 104 N GLY A 14 62.056 67.434 249.080 1.00 18.50 N ATOM 105 CA GLY A 14 61.205 66.980 250.160 1.00 19.19 C ATOM 106 C GLY A 14 59.754 67.377 250.040 1.00 19.86 C ATOM 107 O GLY A 14 59.291 67.843 248.988 1.00 16.60 O ATOM 108 H GLY A 14 62.107 66.878 248.203 1.00 0.00 H ATOM 109 N THR A 15 59.039 67.217 251.148 1.00 18.53 N ATOM 110 CA THR A 15 57.597 67.391 251.169 1.00 17.36 C ATOM 111 C THR A 15 57.231 68.679 251.860 1.00 17.77 C ATOM 112 O THR A 15 57.724 68.965 252.951 1.00 22.97 O ATOM 113 CB THR A 15 56.910 66.208 251.880 1.00 16.40 C ATOM 114 OG1 THR A 15 57.236 64.997 251.195 1.00 18.62 O ATOM 115 CG2 THR A 15 55.411 66.379 251.895 1.00 17.76 C ATOM 116 HG1 THR A 15 56.797 64.234 251.648 1.00 0.00 H ATOM 117 H THR A 15 59.527 66.959 252.029 1.00 0.00 H ATOM 118 N THR A 16 56.365 69.455 251.225 1.00 15.89 N ATOM 119 CA THR A 16 55.942 70.750 251.773 1.00 18.41 C ATOM 120 C THR A 16 54.431 70.916 251.691 1.00 19.74 C ATOM 121 O THR A 16 53.815 70.608 250.664 1.00 17.78 O ATOM 122 CB THR A 16 56.602 71.940 251.031 1.00 17.57 C ATOM 123 OG1 THR A 16 58.027 71.774 250.999 1.00 20.42 O ATOM 124 CG2 THR A 16 56.261 73.264 251.716 1.00 20.35 C ATOM 125 HG1 THR A 16 58.374 71.736 251.925 1.00 0.00 H ATOM 126 H THR A 16 55.975 69.139 250.314 1.00 0.00 H ATOM 127 N SER A 17 53.833 71.421 252.767 1.00 16.53 N ATOM 128 CA SER A 17 52.419 71.768 252.749 1.00 17.52 C ATOM 129 C SER A 17 52.189 73.060 251.966 1.00 19.57 C ATOM 130 O SER A 17 52.951 74.023 252.110 1.00 19.91 O ATOM 131 CB SER A 17 51.885 71.914 254.171 1.00 19.43 C ATOM 132 OG SER A 17 52.009 70.685 254.864 1.00 22.11 O ATOM 133 HG SER A 17 51.490 69.987 254.391 1.00 0.00 H ATOM 134 H SER A 17 54.385 71.570 253.636 1.00 0.00 H ATOM 135 N VAL A 18 51.142 73.062 251.137 1.00 16.65 N ATOM 136 CA VAL A 18 50.748 74.238 250.377 1.00 16.99 C ATOM 137 C VAL A 18 49.289 74.543 250.701 1.00 17.99 C ATOM 138 O VAL A 18 48.386 73.772 250.344 1.00 17.52 O ATOM 139 CB VAL A 18 50.924 74.026 248.860 1.00 17.19 C ATOM 140 CG1 VAL A 18 50.639 75.313 248.096 1.00 18.36 C ATOM 141 CG2 VAL A 18 52.329 73.513 248.567 1.00 18.25 C ATOM 142 H VAL A 18 50.587 72.189 251.031 1.00 0.00 H ATOM 143 N TYR A 19 49.062 75.646 251.410 1.00 18.17 N ATOM 144 CA TYR A 19 47.710 75.984 251.846 1.00 18.24 C ATOM 145 C TYR A 19 47.014 76.862 250.822 1.00 20.15 C ATOM 146 O TYR A 19 47.605 77.788 250.280 1.00 19.95 O ATOM 147 CB TYR A 19 47.745 76.653 253.226 1.00 19.97 C ATOM 148 CG TYR A 19 48.144 75.682 254.323 1.00 19.74 C ATOM 149 CD1 TYR A 19 47.181 74.969 255.024 1.00 22.20 C ATOM 150 CD2 TYR A 19 49.478 75.474 254.648 1.00 21.87 C ATOM 151 CE1 TYR A 19 47.532 74.082 256.023 1.00 23.37 C ATOM 152 CE2 TYR A 19 49.843 74.584 255.649 1.00 23.83 C ATOM 153 CZ TYR A 19 48.865 73.887 256.328 1.00 26.00 C ATOM 154 OH TYR A 19 49.216 72.999 257.325 1.00 31.61 O ATOM 155 HH TYR A 19 48.398 72.590 257.704 1.00 0.00 H ATOM 156 H TYR A 19 49.855 76.273 251.656 1.00 0.00 H ATOM 157 N VAL A 20 45.750 76.562 250.557 1.00 19.77 N ATOM 158 CA VAL A 20 45.024 77.227 249.490 1.00 19.66 C ATOM 159 C VAL A 20 43.638 77.639 249.957 1.00 22.28 C ATOM 160 O VAL A 20 43.001 76.937 250.738 1.00 22.77 O ATOM 161 CB VAL A 20 44.910 76.308 248.245 1.00 20.46 C ATOM 162 CG1 VAL A 20 46.296 75.956 247.710 1.00 19.58 C ATOM 163 CG2 VAL A 20 44.140 75.015 248.571 1.00 21.13 C ATOM 164 H VAL A 20 45.269 75.836 251.125 1.00 0.00 H ATOM 165 N ASN A 21 43.171 78.786 249.485 1.00 24.76 N ATOM 166 CA ASN A 21 41.800 79.189 249.746 1.00 24.89 C ATOM 167 C ASN A 21 40.936 78.707 248.590 1.00 29.07 C ATOM 168 O ASN A 21 41.234 78.987 247.431 1.00 32.82 O ATOM 169 CB ASN A 21 41.697 80.705 249.922 1.00 28.30 C ATOM 170 CG ASN A 21 42.552 81.226 251.071 1.00 28.56 C ATOM 171 OD1 ASN A 21 42.581 80.652 252.162 1.00 29.11 O ATOM 172 ND2 ASN A 21 43.252 82.327 250.827 1.00 35.68 N ATOM 173 HD22 ASN A 21 43.199 82.780 249.892 1.00 0.00 H ATOM 174 HD21 ASN A 21 43.853 82.736 251.570 1.00 0.00 H ATOM 175 H ASN A 21 43.791 79.403 248.923 1.00 0.00 H ATOM 176 N LEU A 22 39.890 77.947 248.893 1.00 29.35 N ATOM 177 CA LEU A 22 39.028 77.426 247.841 1.00 29.26 C ATOM 178 C LEU A 22 37.644 78.054 247.897 1.00 31.83 C ATOM 179 O LEU A 22 37.264 78.669 248.895 1.00 30.65 O ATOM 180 CB LEU A 22 38.904 75.903 247.937 1.00 30.55 C ATOM 181 CG LEU A 22 40.188 75.075 248.028 1.00 27.55 C ATOM 182 CD1 LEU A 22 39.858 73.593 248.095 1.00 26.50 C ATOM 183 CD2 LEU A 22 41.119 75.382 246.876 1.00 27.72 C ATOM 184 H LEU A 22 39.685 77.722 249.888 1.00 0.00 H ATOM 185 N ASP A 23 36.897 77.898 246.809 1.00 34.82 N ATOM 186 CA ASP A 23 35.496 78.284 246.786 1.00 34.13 C ATOM 187 C ASP A 23 34.744 77.481 247.844 1.00 32.34 C ATOM 188 O ASP A 23 34.789 76.251 247.841 1.00 32.61 O ATOM 189 CB ASP A 23 34.895 78.051 245.399 1.00 35.22 C ATOM 190 CG ASP A 23 33.540 78.691 245.244 1.00 39.51 C ATOM 191 OD1 ASP A 23 33.293 79.715 245.916 1.00 41.16 O ATOM 192 OD2 ASP A 23 32.725 78.174 244.452 1.00 42.06 O ATOM 193 H ASP A 23 37.325 77.490 245.954 1.00 0.00 H ATOM 194 N PRO A 24 34.059 78.177 248.765 1.00 30.07 N ATOM 195 CA PRO A 24 33.395 77.518 249.899 1.00 29.67 C ATOM 196 C PRO A 24 32.259 76.566 249.510 1.00 28.23 C ATOM 197 O PRO A 24 31.848 75.767 250.346 1.00 28.08 O ATOM 198 CB PRO A 24 32.855 78.698 250.720 1.00 31.89 C ATOM 199 CG PRO A 24 32.797 79.837 249.774 1.00 29.75 C ATOM 200 CD PRO A 24 33.949 79.642 248.842 1.00 29.94 C ATOM 201 N VAL A 25 31.759 76.649 248.280 1.00 31.20 N ATOM 202 CA VAL A 25 30.751 75.699 247.804 1.00 34.96 C ATOM 203 C VAL A 25 31.164 75.126 246.446 1.00 39.42 C ATOM 204 O VAL A 25 31.670 75.853 245.591 1.00 38.53 O ATOM 205 CB VAL A 25 29.353 76.349 247.692 1.00 37.18 C ATOM 206 CG1 VAL A 25 28.954 76.996 249.015 1.00 32.72 C ATOM 207 CG2 VAL A 25 29.331 77.376 246.578 1.00 40.43 C ATOM 208 H VAL A 25 32.090 77.403 247.644 1.00 0.00 H ATOM 209 N ILE A 26 30.972 73.821 246.258 1.00 37.21 N ATOM 210 CA ILE A 26 31.307 73.177 244.985 1.00 40.85 C ATOM 211 C ILE A 26 30.072 72.736 244.224 1.00 44.71 C ATOM 212 O ILE A 26 29.403 71.775 244.598 1.00 44.00 O ATOM 213 CB ILE A 26 32.197 71.940 245.163 1.00 39.24 C ATOM 214 CG1 ILE A 26 31.700 71.093 246.334 1.00 39.33 C ATOM 215 CG2 ILE A 26 33.641 72.350 245.344 1.00 43.23 C ATOM 216 CD1 ILE A 26 31.987 69.629 246.180 1.00 42.51 C ATOM 217 H ILE A 26 30.576 73.248 247.030 1.00 0.00 H ATOM 218 N GLN A 27 29.791 73.419 243.127 1.00 45.84 N ATOM 219 CA GLN A 27 28.563 73.171 242.397 1.00 44.17 C ATOM 220 C GLN A 27 28.626 71.887 241.584 1.00 43.65 C ATOM 221 O GLN A 27 29.587 71.659 240.844 1.00 43.62 O ATOM 222 CB GLN A 27 28.257 74.363 241.500 1.00 43.08 C ATOM 223 CG GLN A 27 28.270 75.699 242.245 1.00 41.67 C ATOM 224 CD GLN A 27 27.293 75.754 243.414 1.00 42.91 C ATOM 225 OE1 GLN A 27 26.629 74.765 243.746 1.00 43.30 O ATOM 226 NE2 GLN A 27 27.203 76.920 244.047 1.00 47.11 N ATOM 227 HE22 GLN A 27 27.780 77.727 243.735 1.00 0.00 H ATOM 228 HE21 GLN A 27 26.556 77.025 244.854 1.00 0.00 H ATOM 229 H GLN A 27 30.457 74.141 242.785 1.00 0.00 H ATOM 230 N PRO A 28 27.595 71.037 241.734 1.00 45.23 N ATOM 231 CA PRO A 28 27.475 69.781 240.986 1.00 41.87 C ATOM 232 C PRO A 28 27.743 69.981 239.496 1.00 40.61 C ATOM 233 O PRO A 28 27.206 70.908 238.887 1.00 38.92 O ATOM 234 CB PRO A 28 26.024 69.365 241.238 1.00 40.58 C ATOM 235 CG PRO A 28 25.722 69.928 242.597 1.00 39.46 C ATOM 236 CD PRO A 28 26.471 71.235 242.668 1.00 39.38 C ATOM 237 N GLY A 29 28.592 69.131 238.928 1.00 42.04 N ATOM 238 CA GLY A 29 28.922 69.212 237.519 1.00 40.89 C ATOM 239 C GLY A 29 29.874 70.337 237.155 1.00 40.57 C ATOM 240 O GLY A 29 30.144 70.561 235.975 1.00 41.99 O ATOM 241 H GLY A 29 29.031 68.389 239.509 1.00 0.00 H ATOM 242 N GLN A 30 30.385 71.048 238.159 1.00 39.65 N ATOM 243 CA GLN A 30 31.328 72.138 237.912 1.00 41.75 C ATOM 244 C GLN A 30 32.677 71.905 238.600 1.00 39.01 C ATOM 245 O GLN A 30 32.730 71.483 239.755 1.00 41.16 O ATOM 246 CB GLN A 30 30.739 73.474 238.373 1.00 43.10 C ATOM 247 CG GLN A 30 29.513 73.934 237.598 1.00 42.17 C ATOM 248 CD GLN A 30 29.393 75.450 237.568 1.00 43.35 C ATOM 249 OE1 GLN A 30 30.167 76.128 236.891 1.00 50.59 O ATOM 250 NE2 GLN A 30 28.432 75.989 238.311 1.00 41.82 N ATOM 251 HE22 GLN A 30 27.800 75.378 238.867 1.00 0.00 H ATOM 252 HE21 GLN A 30 28.311 77.022 238.336 1.00 0.00 H ATOM 253 H GLN A 30 30.108 70.824 239.136 1.00 0.00 H ATOM 254 N ASN A 31 33.760 72.189 237.878 1.00 40.78 N ATOM 255 CA ASN A 31 35.119 72.059 238.409 1.00 34.67 C ATOM 256 C ASN A 31 35.440 73.064 239.506 1.00 34.57 C ATOM 257 O ASN A 31 35.190 74.262 239.356 1.00 37.62 O ATOM 258 CB ASN A 31 36.157 72.231 237.294 1.00 35.69 C ATOM 259 CG ASN A 31 36.210 71.055 236.346 1.00 38.15 C ATOM 260 OD1 ASN A 31 36.087 69.900 236.756 1.00 42.67 O ATOM 261 ND2 ASN A 31 36.406 71.343 235.063 1.00 41.16 N ATOM 262 HD22 ASN A 31 36.504 72.333 234.762 1.00 0.00 H ATOM 263 HD21 ASN A 31 36.461 70.578 234.361 1.00 0.00 H ATOM 264 H ASN A 31 33.636 72.516 236.899 1.00 0.00 H ATOM 265 N LEU A 32 36.006 72.569 240.599 1.00 27.33 N ATOM 266 CA LEU A 32 36.616 73.423 241.607 1.00 25.36 C ATOM 267 C LEU A 32 38.074 73.640 241.216 1.00 25.54 C ATOM 268 O LEU A 32 38.796 72.673 240.970 1.00 20.61 O ATOM 269 CB LEU A 32 36.499 72.782 242.990 1.00 28.43 C ATOM 270 CG LEU A 32 36.824 73.590 244.248 1.00 31.51 C ATOM 271 CD1 LEU A 32 36.723 72.686 245.466 1.00 32.70 C ATOM 272 CD2 LEU A 32 38.199 74.206 244.176 1.00 30.64 C ATOM 273 H LEU A 32 36.014 71.539 240.740 1.00 0.00 H ATOM 274 N VAL A 33 38.510 74.899 241.157 1.00 21.05 N ATOM 275 CA VAL A 33 39.866 75.217 240.719 1.00 21.46 C ATOM 276 C VAL A 33 40.828 75.449 241.878 1.00 19.16 C ATOM 277 O VAL A 33 40.537 76.204 242.815 1.00 21.06 O ATOM 278 CB VAL A 33 39.888 76.467 239.819 1.00 24.50 C ATOM 279 CG1 VAL A 33 41.326 76.846 239.485 1.00 25.22 C ATOM 280 CG2 VAL A 33 39.101 76.219 238.549 1.00 25.99 C ATOM 281 H VAL A 33 37.870 75.672 241.429 1.00 0.00 H ATOM 282 N VAL A 34 41.981 74.795 241.806 1.00 17.23 N ATOM 283 CA VAL A 34 43.049 75.010 242.762 1.00 18.73 C ATOM 284 C VAL A 34 44.242 75.552 241.989 1.00 19.13 C ATOM 285 O VAL A 34 45.011 74.797 241.403 1.00 15.18 O ATOM 286 CB VAL A 34 43.429 73.713 243.518 1.00 20.23 C ATOM 287 CG1 VAL A 34 44.451 74.011 244.602 1.00 19.93 C ATOM 288 CG2 VAL A 34 42.189 73.053 244.127 1.00 20.60 C ATOM 289 H VAL A 34 42.122 74.107 241.039 1.00 0.00 H ATOM 290 N ASP A 35 44.377 76.874 241.971 1.00 16.64 N ATOM 291 CA ASP A 35 45.455 77.523 241.250 1.00 17.25 C ATOM 292 C ASP A 35 46.737 77.535 242.081 1.00 16.25 C ATOM 293 O ASP A 35 46.909 78.376 242.973 1.00 18.53 O ATOM 294 CB ASP A 35 45.050 78.953 240.885 1.00 18.04 C ATOM 295 CG ASP A 35 46.092 79.665 240.040 1.00 18.85 C ATOM 296 OD1 ASP A 35 47.176 79.102 239.786 1.00 17.34 O ATOM 297 OD2 ASP A 35 45.827 80.817 239.628 1.00 23.35 O ATOM 298 H ASP A 35 43.690 77.459 242.488 1.00 0.00 H ATOM 299 N LEU A 36 47.657 76.627 241.786 1.00 13.60 N ATOM 300 CA LEU A 36 48.885 76.564 242.552 1.00 12.54 C ATOM 301 C LEU A 36 49.956 77.556 242.084 1.00 15.25 C ATOM 302 O LEU A 36 50.934 77.753 242.784 1.00 15.71 O ATOM 303 CB LEU A 36 49.428 75.135 242.539 1.00 15.38 C ATOM 304 CG LEU A 36 48.466 74.128 243.175 1.00 18.74 C ATOM 305 CD1 LEU A 36 48.991 72.700 243.062 1.00 15.17 C ATOM 306 CD2 LEU A 36 48.188 74.477 244.623 1.00 14.80 C ATOM 307 H LEU A 36 47.497 75.960 241.004 1.00 0.00 H ATOM 308 N SER A 37 49.764 78.201 240.930 1.00 14.77 N ATOM 309 CA SER A 37 50.687 79.262 240.508 1.00 16.19 C ATOM 310 C SER A 37 50.643 80.410 241.515 1.00 16.35 C ATOM 311 O SER A 37 51.556 81.234 241.581 1.00 15.80 O ATOM 312 CB SER A 37 50.349 79.782 239.104 1.00 17.21 C ATOM 313 OG SER A 37 49.218 80.643 239.132 1.00 15.99 O ATOM 314 HG SER A 37 48.436 80.147 239.482 1.00 0.00 H ATOM 315 H SER A 37 48.955 77.950 240.326 1.00 0.00 H ATOM 316 N GLN A 38 49.576 80.468 242.304 1.00 14.01 N ATOM 317 CA GLN A 38 49.425 81.551 243.278 1.00 17.04 C ATOM 318 C GLN A 38 50.259 81.312 244.529 1.00 17.71 C ATOM 319 O GLN A 38 50.332 82.192 245.392 1.00 19.13 O ATOM 320 CB GLN A 38 47.945 81.726 243.656 1.00 17.62 C ATOM 321 CG GLN A 38 47.087 82.260 242.504 1.00 19.48 C ATOM 322 CD GLN A 38 45.652 82.544 242.916 1.00 22.92 C ATOM 323 OE1 GLN A 38 45.379 82.877 244.072 1.00 31.44 O ATOM 324 NE2 GLN A 38 44.729 82.424 241.971 1.00 24.23 N ATOM 325 HE22 GLN A 38 45.004 82.141 241.009 1.00 0.00 H ATOM 326 HE21 GLN A 38 43.731 82.613 242.192 1.00 0.00 H ATOM 327 H GLN A 38 48.840 79.737 242.229 1.00 0.00 H ATOM 328 N HIS A 39 50.886 80.131 244.633 1.00 12.97 N ATOM 329 CA HIS A 39 51.607 79.771 245.862 1.00 14.76 C ATOM 330 C HIS A 39 53.016 79.208 245.691 1.00 15.71 C ATOM 331 O HIS A 39 53.865 79.419 246.550 1.00 18.91 O ATOM 332 CB HIS A 39 50.796 78.755 246.669 1.00 14.50 C ATOM 333 CG HIS A 39 49.405 79.205 246.960 1.00 16.07 C ATOM 334 ND1 HIS A 39 49.112 80.093 247.972 1.00 19.67 N ATOM 335 CD2 HIS A 39 48.230 78.915 246.357 1.00 14.35 C ATOM 336 CE1 HIS A 39 47.813 80.326 247.982 1.00 19.67 C ATOM 337 NE2 HIS A 39 47.254 79.622 247.015 1.00 18.89 N ATOM 338 H HIS A 39 50.862 79.463 243.836 1.00 0.00 H ATOM 339 N ILE A 40 53.270 78.472 244.611 1.00 13.49 N ATOM 340 CA ILE A 40 54.563 77.817 244.455 1.00 16.38 C ATOM 341 C ILE A 40 55.370 78.491 243.361 1.00 13.97 C ATOM 342 O ILE A 40 54.873 78.664 242.257 1.00 14.86 O ATOM 343 CB ILE A 40 54.416 76.316 244.103 1.00 15.58 C ATOM 344 CG1 ILE A 40 53.409 75.649 245.040 1.00 14.68 C ATOM 345 CG2 ILE A 40 55.767 75.618 244.164 1.00 17.23 C ATOM 346 CD1 ILE A 40 53.025 74.227 244.613 1.00 14.73 C ATOM 347 H ILE A 40 52.543 78.364 243.875 1.00 0.00 H ATOM 348 N SER A 41 56.613 78.848 243.669 1.00 15.14 N ATOM 349 CA SER A 41 57.516 79.413 242.672 1.00 15.92 C ATOM 350 C SER A 41 58.872 78.739 242.799 1.00 15.30 C ATOM 351 O SER A 41 59.264 78.329 243.888 1.00 17.56 O ATOM 352 CB SER A 41 57.659 80.937 242.845 1.00 14.55 C ATOM 353 OG SER A 41 56.419 81.601 242.682 1.00 19.37 O ATOM 354 HG SER A 41 55.777 81.269 243.358 1.00 0.00 H ATOM 355 H SER A 41 56.950 78.721 244.645 1.00 0.00 H ATOM 356 N CYS A 42 59.594 78.639 241.690 1.00 13.56 N ATOM 357 CA CYS A 42 60.914 78.017 241.690 1.00 14.52 C ATOM 358 C CYS A 42 61.876 78.829 240.841 1.00 15.96 C ATOM 359 O CYS A 42 61.445 79.614 240.004 1.00 14.07 O ATOM 360 CB CYS A 42 60.841 76.583 241.158 1.00 13.13 C ATOM 361 SG CYS A 42 59.636 75.538 242.019 1.00 15.57 S ATOM 362 H CYS A 42 59.210 79.013 240.799 1.00 0.00 H ATOM 363 N TRP A 43 63.174 78.620 241.027 1.00 16.43 N ATOM 364 CA TRP A 43 64.154 79.373 240.250 1.00 13.79 C ATOM 365 C TRP A 43 65.452 78.602 240.094 1.00 17.28 C ATOM 366 O TRP A 43 65.713 77.639 240.809 1.00 14.62 O ATOM 367 CB TRP A 43 64.424 80.748 240.900 1.00 16.10 C ATOM 368 CG TRP A 43 64.881 80.639 242.320 1.00 16.60 C ATOM 369 CD1 TRP A 43 66.167 80.569 242.766 1.00 19.22 C ATOM 370 CD2 TRP A 43 64.048 80.540 243.476 1.00 16.06 C ATOM 371 NE1 TRP A 43 66.188 80.447 244.132 1.00 21.84 N ATOM 372 CE2 TRP A 43 64.897 80.419 244.595 1.00 21.57 C ATOM 373 CE3 TRP A 43 62.664 80.535 243.673 1.00 18.33 C ATOM 374 CZ2 TRP A 43 64.408 80.303 245.899 1.00 20.87 C ATOM 375 CZ3 TRP A 43 62.172 80.411 244.971 1.00 19.75 C ATOM 376 CH2 TRP A 43 63.044 80.294 246.065 1.00 19.54 C ATOM 377 HE1 TRP A 43 67.043 80.386 244.721 1.00 0.00 H ATOM 378 H TRP A 43 63.493 77.920 241.727 1.00 0.00 H ATOM 379 N ASN A 44 66.256 79.054 239.138 1.00 16.35 N ATOM 380 CA ASN A 44 67.585 78.529 238.903 1.00 16.43 C ATOM 381 C ASN A 44 68.537 79.212 239.879 1.00 17.34 C ATOM 382 O ASN A 44 68.464 80.432 240.055 1.00 19.94 O ATOM 383 CB ASN A 44 67.996 78.783 237.457 1.00 16.78 C ATOM 384 CG ASN A 44 69.295 78.124 237.108 1.00 18.86 C ATOM 385 OD1 ASN A 44 70.366 78.586 237.519 1.00 19.91 O ATOM 386 ND2 ASN A 44 69.225 77.033 236.341 1.00 15.60 N ATOM 387 HD22 ASN A 44 68.300 76.682 236.019 1.00 0.00 H ATOM 388 HD21 ASN A 44 70.095 76.535 236.065 1.00 0.00 H ATOM 389 H ASN A 44 65.914 79.823 238.528 1.00 0.00 H ATOM 390 N ASP A 45 69.410 78.454 240.531 1.00 17.69 N ATOM 391 CA ASP A 45 70.187 79.038 241.617 1.00 21.88 C ATOM 392 C ASP A 45 71.439 79.769 241.128 1.00 24.15 C ATOM 393 O ASP A 45 72.132 80.402 241.922 1.00 24.60 O ATOM 394 CB ASP A 45 70.545 77.971 242.653 1.00 21.91 C ATOM 395 CG ASP A 45 69.435 77.773 243.682 1.00 21.99 C ATOM 396 OD1 ASP A 45 68.976 78.770 244.276 1.00 25.23 O ATOM 397 OD2 ASP A 45 68.999 76.622 243.877 1.00 24.61 O ATOM 398 H ASP A 45 69.538 77.455 240.270 1.00 0.00 H ATOM 399 N TYR A 46 71.702 79.716 239.828 1.00 22.85 N ATOM 400 CA TYR A 46 72.744 80.558 239.222 1.00 24.15 C ATOM 401 C TYR A 46 72.169 81.676 238.381 1.00 22.55 C ATOM 402 O TYR A 46 72.678 82.801 238.393 1.00 21.32 O ATOM 403 CB TYR A 46 73.671 79.750 238.325 1.00 22.92 C ATOM 404 CG TYR A 46 74.223 78.524 238.966 1.00 25.72 C ATOM 405 CD1 TYR A 46 74.619 78.534 240.294 1.00 27.15 C ATOM 406 CD2 TYR A 46 74.326 77.343 238.250 1.00 26.97 C ATOM 407 CE1 TYR A 46 75.115 77.397 240.886 1.00 34.84 C ATOM 408 CE2 TYR A 46 74.821 76.215 238.824 1.00 31.49 C ATOM 409 CZ TYR A 46 75.211 76.241 240.142 1.00 35.44 C ATOM 410 OH TYR A 46 75.698 75.093 240.710 1.00 35.66 O ATOM 411 HH TYR A 46 75.935 75.268 241.655 1.00 0.00 H ATOM 412 H TYR A 46 71.159 79.065 239.225 1.00 0.00 H ATOM 413 N GLY A 47 71.129 81.348 237.620 1.00 20.80 N ATOM 414 CA GLY A 47 70.596 82.248 236.619 1.00 19.28 C ATOM 415 C GLY A 47 71.432 82.166 235.351 1.00 19.35 C ATOM 416 O GLY A 47 72.391 81.398 235.278 1.00 20.34 O ATOM 417 H GLY A 47 70.685 80.416 237.748 1.00 0.00 H ATOM 418 N GLY A 48 71.043 82.938 234.343 1.00 20.59 N ATOM 419 CA GLY A 48 71.789 83.025 233.096 1.00 19.27 C ATOM 420 C GLY A 48 71.760 81.817 232.177 1.00 22.20 C ATOM 421 O GLY A 48 72.530 81.753 231.219 1.00 22.33 O ATOM 422 H GLY A 48 70.175 83.500 234.448 1.00 0.00 H ATOM 423 N TRP A 49 70.890 80.853 232.466 1.00 22.32 N ATOM 424 CA TRP A 49 70.770 79.658 231.630 1.00 17.27 C ATOM 425 C TRP A 49 72.102 78.918 231.493 1.00 20.04 C ATOM 426 O TRP A 49 72.448 78.424 230.414 1.00 18.98 O ATOM 427 CB TRP A 49 70.179 80.042 230.257 1.00 19.51 C ATOM 428 CG TRP A 49 68.808 80.608 230.462 1.00 19.63 C ATOM 429 CD1 TRP A 49 68.485 81.920 230.662 1.00 17.95 C ATOM 430 CD2 TRP A 49 67.585 79.869 230.596 1.00 17.45 C ATOM 431 NE1 TRP A 49 67.136 82.045 230.879 1.00 19.05 N ATOM 432 CE2 TRP A 49 66.558 80.804 230.840 1.00 17.65 C ATOM 433 CE3 TRP A 49 67.256 78.509 230.506 1.00 17.97 C ATOM 434 CZ2 TRP A 49 65.225 80.426 231.012 1.00 17.44 C ATOM 435 CZ3 TRP A 49 65.922 78.130 230.672 1.00 15.99 C ATOM 436 CH2 TRP A 49 64.927 79.088 230.924 1.00 16.18 C ATOM 437 HE1 TRP A 49 66.633 82.940 231.046 1.00 0.00 H ATOM 438 H TRP A 49 70.282 80.951 233.304 1.00 0.00 H ATOM 439 N TYR A 50 72.829 78.828 232.611 1.00 21.54 N ATOM 440 CA TYR A 50 74.140 78.169 232.631 1.00 21.31 C ATOM 441 C TYR A 50 74.035 76.655 232.924 1.00 25.34 C ATOM 442 O TYR A 50 74.548 75.819 232.165 1.00 25.02 O ATOM 443 CB TYR A 50 75.066 78.846 233.654 1.00 25.33 C ATOM 444 CG TYR A 50 76.414 78.175 233.720 1.00 23.84 C ATOM 445 CD1 TYR A 50 77.354 78.380 232.720 1.00 32.47 C ATOM 446 CD2 TYR A 50 76.735 77.305 234.756 1.00 34.17 C ATOM 447 CE1 TYR A 50 78.588 77.750 232.756 1.00 39.58 C ATOM 448 CE2 TYR A 50 77.965 76.671 234.801 1.00 35.83 C ATOM 449 CZ TYR A 50 78.887 76.895 233.797 1.00 39.80 C ATOM 450 OH TYR A 50 80.113 76.269 233.832 1.00 42.11 O ATOM 451 HH TYR A 50 80.644 76.541 233.042 1.00 0.00 H ATOM 452 H TYR A 50 72.455 79.236 233.491 1.00 0.00 H ATOM 453 N ASP A 51 73.387 76.315 234.033 1.00 23.35 N ATOM 454 CA ASP A 51 73.055 74.924 234.356 1.00 20.11 C ATOM 455 C ASP A 51 71.534 74.812 234.459 1.00 19.06 C ATOM 456 O ASP A 51 70.973 74.878 235.556 1.00 21.25 O ATOM 457 CB ASP A 51 73.728 74.500 235.668 1.00 19.83 C ATOM 458 CG ASP A 51 73.543 73.029 235.980 1.00 23.68 C ATOM 459 OD1 ASP A 51 73.055 72.287 235.100 1.00 20.46 O ATOM 460 OD2 ASP A 51 73.916 72.617 237.106 1.00 22.35 O ATOM 461 H ASP A 51 73.105 77.064 234.697 1.00 0.00 H ATOM 462 N THR A 52 70.876 74.687 233.310 1.00 18.84 N ATOM 463 CA THR A 52 69.415 74.811 233.238 1.00 15.44 C ATOM 464 C THR A 52 68.716 73.663 233.961 1.00 15.33 C ATOM 465 O THR A 52 69.117 72.513 233.834 1.00 16.11 O ATOM 466 CB THR A 52 68.940 74.868 231.765 1.00 14.76 C ATOM 467 OG1 THR A 52 69.489 76.037 231.140 1.00 15.63 O ATOM 468 CG2 THR A 52 67.408 74.920 231.677 1.00 15.81 C ATOM 469 HG1 THR A 52 69.188 76.078 230.198 1.00 0.00 H ATOM 470 H THR A 52 71.411 74.496 232.439 1.00 0.00 H ATOM 471 N ASP A 53 67.694 73.995 234.744 1.00 14.49 N ATOM 472 CA ASP A 53 66.871 72.989 235.432 1.00 14.03 C ATOM 473 C ASP A 53 65.698 72.512 234.586 1.00 15.07 C ATOM 474 O ASP A 53 65.112 73.279 233.826 1.00 14.35 O ATOM 475 CB ASP A 53 66.339 73.543 236.750 1.00 14.39 C ATOM 476 CG ASP A 53 67.452 73.869 237.730 1.00 18.04 C ATOM 477 OD1 ASP A 53 68.296 72.985 237.965 1.00 15.56 O ATOM 478 OD2 ASP A 53 67.489 75.010 238.235 1.00 17.95 O ATOM 479 H ASP A 53 67.469 75.002 234.875 1.00 0.00 H ATOM 480 N HIS A 54 65.351 71.235 234.739 1.00 14.16 N ATOM 481 CA HIS A 54 64.282 70.626 233.957 1.00 15.05 C ATOM 482 C HIS A 54 63.314 69.967 234.894 1.00 14.38 C ATOM 483 O HIS A 54 63.687 69.043 235.617 1.00 15.22 O ATOM 484 CB HIS A 54 64.854 69.618 232.962 1.00 14.53 C ATOM 485 CG HIS A 54 66.006 70.161 232.173 1.00 17.81 C ATOM 486 ND1 HIS A 54 65.863 71.158 231.228 1.00 16.44 N ATOM 487 CD2 HIS A 54 67.328 69.872 232.218 1.00 18.36 C ATOM 488 CE1 HIS A 54 67.046 71.445 230.714 1.00 17.42 C ATOM 489 NE2 HIS A 54 67.951 70.676 231.294 1.00 17.67 N ATOM 490 H HIS A 54 65.858 70.655 235.438 1.00 0.00 H ATOM 491 N ILE A 55 62.081 70.458 234.885 1.00 13.26 N ATOM 492 CA ILE A 55 61.099 70.118 235.906 1.00 13.09 C ATOM 493 C ILE A 55 59.871 69.468 235.300 1.00 13.26 C ATOM 494 O ILE A 55 59.350 69.955 234.304 1.00 12.74 O ATOM 495 CB ILE A 55 60.674 71.387 236.687 1.00 18.08 C ATOM 496 CG1 ILE A 55 61.918 72.167 237.120 1.00 20.26 C ATOM 497 CG2 ILE A 55 59.795 71.012 237.861 1.00 17.14 C ATOM 498 CD1 ILE A 55 62.743 71.418 238.140 1.00 15.65 C ATOM 499 H ILE A 55 61.806 71.109 234.122 1.00 0.00 H ATOM 500 N ASN A 56 59.417 68.357 235.876 1.00 12.53 N ATOM 501 CA ASN A 56 58.141 67.781 235.461 1.00 12.63 C ATOM 502 C ASN A 56 57.371 67.212 236.641 1.00 11.37 C ATOM 503 O ASN A 56 57.929 67.008 237.723 1.00 12.56 O ATOM 504 CB ASN A 56 58.334 66.687 234.390 1.00 11.93 C ATOM 505 CG ASN A 56 59.070 65.456 234.921 1.00 13.12 C ATOM 506 OD1 ASN A 56 60.295 65.390 234.871 1.00 14.67 O ATOM 507 ND2 ASN A 56 58.315 64.469 235.419 1.00 11.53 N ATOM 508 HD22 ASN A 56 57.280 64.567 235.442 1.00 0.00 H ATOM 509 HD21 ASN A 56 58.764 63.604 235.783 1.00 0.00 H ATOM 510 H ASN A 56 59.973 67.897 236.625 1.00 0.00 H ATOM 511 N LEU A 57 56.082 66.964 236.429 1.00 11.89 N ATOM 512 CA LEU A 57 55.266 66.319 237.451 1.00 11.36 C ATOM 513 C LEU A 57 55.228 64.833 237.148 1.00 12.08 C ATOM 514 O LEU A 57 55.381 64.421 235.998 1.00 11.47 O ATOM 515 CB LEU A 57 53.865 66.910 237.490 1.00 10.77 C ATOM 516 CG LEU A 57 53.850 68.430 237.691 1.00 11.45 C ATOM 517 CD1 LEU A 57 52.421 68.914 237.908 1.00 13.33 C ATOM 518 CD2 LEU A 57 54.756 68.802 238.867 1.00 13.72 C ATOM 519 H LEU A 57 55.650 67.234 235.522 1.00 0.00 H ATOM 520 N VAL A 58 55.047 64.035 238.191 1.00 11.24 N ATOM 521 CA VAL A 58 55.329 62.603 238.108 1.00 12.53 C ATOM 522 C VAL A 58 54.105 61.705 238.206 1.00 12.36 C ATOM 523 O VAL A 58 53.206 61.911 239.036 1.00 12.79 O ATOM 524 CB VAL A 58 56.333 62.174 239.209 1.00 12.34 C ATOM 525 CG1 VAL A 58 56.737 60.697 239.040 1.00 13.79 C ATOM 526 CG2 VAL A 58 57.585 63.058 239.196 1.00 11.99 C ATOM 527 H VAL A 58 54.698 64.435 239.085 1.00 0.00 H ATOM 528 N GLN A 59 54.101 60.705 237.328 1.00 12.61 N ATOM 529 CA GLN A 59 53.143 59.611 237.376 1.00 12.37 C ATOM 530 C GLN A 59 52.863 59.145 238.803 1.00 12.05 C ATOM 531 O GLN A 59 53.787 58.946 239.587 1.00 13.19 O ATOM 532 CB GLN A 59 53.673 58.452 236.556 1.00 12.52 C ATOM 533 CG GLN A 59 52.757 57.240 236.530 1.00 12.88 C ATOM 534 CD GLN A 59 53.481 56.056 235.950 1.00 12.84 C ATOM 535 OE1 GLN A 59 54.501 55.609 236.492 1.00 13.24 O ATOM 536 NE2 GLN A 59 53.001 55.574 234.820 1.00 13.30 N ATOM 537 HE22 GLN A 59 52.140 55.984 234.404 1.00 0.00 H ATOM 538 HE21 GLN A 59 53.483 54.784 234.345 1.00 0.00 H ATOM 539 H GLN A 59 54.816 60.705 236.573 1.00 0.00 H ATOM 540 N GLY A 60 51.589 59.004 239.140 1.00 11.55 N ATOM 541 CA GLY A 60 51.208 58.570 240.471 1.00 13.48 C ATOM 542 C GLY A 60 50.681 59.693 241.343 1.00 14.09 C ATOM 543 O GLY A 60 50.001 59.439 242.337 1.00 15.30 O ATOM 544 H GLY A 60 50.849 59.208 238.438 1.00 0.00 H ATOM 545 N SER A 61 51.012 60.936 240.998 1.00 13.67 N ATOM 546 CA SER A 61 50.422 62.070 241.699 1.00 12.27 C ATOM 547 C SER A 61 48.905 61.937 241.706 1.00 11.93 C ATOM 548 O SER A 61 48.299 61.645 240.673 1.00 14.94 O ATOM 549 CB SER A 61 50.836 63.395 241.044 1.00 12.25 C ATOM 550 OG SER A 61 52.240 63.562 241.054 1.00 13.83 O ATOM 551 HG SER A 61 52.663 62.819 240.554 1.00 0.00 H ATOM 552 H SER A 61 51.692 61.098 240.228 1.00 0.00 H ATOM 553 N ALA A 62 48.287 62.156 242.864 1.00 13.80 N ATOM 554 CA ALA A 62 46.901 61.760 243.036 1.00 13.89 C ATOM 555 C ALA A 62 46.175 62.586 244.077 1.00 16.94 C ATOM 556 O ALA A 62 46.786 63.337 244.831 1.00 17.13 O ATOM 557 CB ALA A 62 46.830 60.264 243.425 1.00 13.42 C ATOM 558 H ALA A 62 48.798 62.612 243.647 1.00 0.00 H ATOM 559 N PHE A 63 44.860 62.409 244.119 1.00 17.75 N ATOM 560 CA PHE A 63 44.074 62.923 245.224 1.00 21.55 C ATOM 561 C PHE A 63 44.441 62.166 246.481 1.00 23.24 C ATOM 562 O PHE A 63 44.959 61.051 246.433 1.00 22.19 O ATOM 563 CB PHE A 63 42.576 62.805 244.946 1.00 23.33 C ATOM 564 CG PHE A 63 42.081 63.765 243.910 1.00 24.11 C ATOM 565 CD1 PHE A 63 41.592 63.306 242.706 1.00 24.70 C ATOM 566 CD2 PHE A 63 42.126 65.133 244.131 1.00 21.92 C ATOM 567 CE1 PHE A 63 41.143 64.189 241.749 1.00 23.03 C ATOM 568 CE2 PHE A 63 41.680 66.022 243.173 1.00 26.53 C ATOM 569 CZ PHE A 63 41.181 65.546 241.984 1.00 22.77 C ATOM 570 H PHE A 63 44.387 61.895 243.349 1.00 0.00 H ATOM 571 N ALA A 64 44.210 62.814 247.610 1.00 22.97 N ATOM 572 CA ALA A 64 44.396 62.217 248.908 1.00 26.07 C ATOM 573 C ALA A 64 43.023 62.233 249.505 1.00 32.82 C ATOM 574 O ALA A 64 42.361 63.272 249.546 1.00 31.66 O ATOM 575 CB ALA A 64 45.377 62.999 249.756 1.00 27.66 C ATOM 576 H ALA A 64 43.879 63.799 247.559 1.00 0.00 H ATOM 577 N GLY A 65 42.726 61.111 250.066 1.00 40.35 N ATOM 578 CA GLY A 65 43.600 59.964 250.093 1.00 42.26 C ATOM 579 C GLY A 65 43.754 59.855 251.589 1.00 49.53 C ATOM 580 O GLY A 65 44.903 59.889 252.123 1.00 43.70 O ATOM 581 H GLY A 65 41.798 61.028 250.528 1.00 0.00 H ATOM 582 N SER A 66 42.596 59.784 252.288 1.00 52.41 N ATOM 583 CA SER A 66 41.148 59.693 251.782 1.00 49.01 C ATOM 584 C SER A 66 40.274 60.813 251.047 1.00 47.30 C ATOM 585 O SER A 66 39.883 61.826 251.616 1.00 45.91 O ATOM 586 CB SER A 66 40.330 59.181 252.961 1.00 54.52 C ATOM 587 OG SER A 66 40.575 60.017 254.067 1.00 60.71 O ATOM 588 HG SER A 66 40.307 60.944 253.845 1.00 0.00 H ATOM 589 H SER A 66 42.703 59.792 253.322 1.00 0.00 H ATOM 590 N LEU A 67 40.067 60.570 249.752 1.00 44.04 N ATOM 591 CA LEU A 67 39.325 61.413 248.797 1.00 39.40 C ATOM 592 C LEU A 67 39.685 60.995 247.368 1.00 35.94 C ATOM 593 O LEU A 67 39.477 61.715 246.408 1.00 33.53 O ATOM 594 CB LEU A 67 39.603 62.912 249.012 1.00 40.04 C ATOM 595 CG LEU A 67 38.952 63.823 248.017 1.00 39.10 C ATOM 596 CD1 LEU A 67 37.913 64.570 248.821 1.00 42.18 C ATOM 597 CD2 LEU A 67 39.879 64.803 247.342 1.00 31.89 C ATOM 598 H LEU A 67 40.473 59.690 249.375 1.00 0.00 H ATOM 599 N GLN A 68 40.236 59.791 247.284 1.00 37.11 N ATOM 600 CA GLN A 68 40.714 59.128 246.068 1.00 36.33 C ATOM 601 C GLN A 68 39.664 58.811 245.097 1.00 36.88 C ATOM 602 O GLN A 68 39.940 58.448 243.980 1.00 41.69 O ATOM 603 CB GLN A 68 41.390 57.807 246.456 1.00 41.57 C ATOM 604 H GLN A 68 40.339 59.263 248.174 1.00 0.00 H ATOM 605 N SER A 69 38.428 58.920 245.518 1.00 37.57 N ATOM 606 CA SER A 69 37.344 58.611 244.648 1.00 36.59 C ATOM 607 C SER A 69 37.121 59.676 243.597 1.00 35.81 C ATOM 608 O SER A 69 36.479 59.439 242.608 1.00 36.21 O ATOM 609 CB SER A 69 36.056 58.342 245.456 1.00 38.32 C ATOM 610 OG SER A 69 35.507 59.501 245.974 1.00 40.40 O ATOM 611 HG SER A 69 34.687 59.278 246.482 1.00 0.00 H ATOM 612 H SER A 69 38.238 59.233 246.491 1.00 0.00 H ATOM 613 N TYR A 70 37.668 60.854 243.824 1.00 33.84 N ATOM 614 CA TYR A 70 37.483 61.920 242.903 1.00 29.27 C ATOM 615 C TYR A 70 38.315 61.873 241.644 1.00 28.32 C ATOM 616 O TYR A 70 39.382 61.353 241.629 1.00 29.74 O ATOM 617 CB TYR A 70 37.756 63.239 243.588 1.00 30.71 C ATOM 618 CG TYR A 70 36.580 63.715 244.366 1.00 36.63 C ATOM 619 CD1 TYR A 70 35.826 64.750 243.926 1.00 34.02 C ATOM 620 CD2 TYR A 70 36.208 63.089 245.523 1.00 37.22 C ATOM 621 CE1 TYR A 70 34.733 65.173 244.618 1.00 42.27 C ATOM 622 CE2 TYR A 70 35.123 63.501 246.237 1.00 38.86 C ATOM 623 CZ TYR A 70 34.380 64.542 245.788 1.00 42.68 C ATOM 624 OH TYR A 70 33.309 64.943 246.513 1.00 42.61 O ATOM 625 HH TYR A 70 32.872 65.707 246.059 1.00 0.00 H ATOM 626 H TYR A 70 38.238 61.004 244.681 1.00 0.00 H ATOM 627 N LYS A 71 37.760 62.451 240.601 1.00 26.45 N ATOM 628 CA LYS A 71 38.499 62.629 239.365 1.00 29.70 C ATOM 629 C LYS A 71 38.671 64.108 239.071 1.00 26.27 C ATOM 630 O LYS A 71 38.060 64.980 239.707 1.00 25.85 O ATOM 631 CB LYS A 71 37.797 61.939 238.195 1.00 32.41 C ATOM 632 H LYS A 71 36.777 62.785 240.663 1.00 0.00 H ATOM 633 N GLY A 72 39.514 64.394 238.094 1.00 21.53 N ATOM 634 CA GLY A 72 39.804 65.773 237.770 1.00 22.47 C ATOM 635 C GLY A 72 40.801 65.927 236.650 1.00 17.69 C ATOM 636 O GLY A 72 41.007 65.019 235.843 1.00 15.46 O ATOM 637 H GLY A 72 39.969 63.627 237.558 1.00 0.00 H ATOM 638 N SER A 73 41.408 67.106 236.594 1.00 18.39 N ATOM 639 CA SER A 73 42.402 67.425 235.591 1.00 16.13 C ATOM 640 C SER A 73 43.543 68.173 236.260 1.00 16.11 C ATOM 641 O SER A 73 43.340 68.876 237.243 1.00 19.03 O ATOM 642 CB SER A 73 41.807 68.276 234.471 1.00 19.06 C ATOM 643 OG SER A 73 40.660 67.658 233.918 1.00 21.91 O ATOM 644 HG SER A 73 40.909 66.774 233.548 1.00 0.00 H ATOM 645 H SER A 73 41.160 67.829 237.299 1.00 0.00 H ATOM 646 N LEU A 74 44.742 68.020 235.721 1.00 14.93 N ATOM 647 CA LEU A 74 45.888 68.777 236.197 1.00 14.65 C ATOM 648 C LEU A 74 46.488 69.540 235.021 1.00 15.25 C ATOM 649 O LEU A 74 46.951 68.941 234.042 1.00 14.25 O ATOM 650 CB LEU A 74 46.923 67.851 236.852 1.00 13.68 C ATOM 651 CG LEU A 74 48.135 68.571 237.464 1.00 15.11 C ATOM 652 CD1 LEU A 74 48.809 67.701 238.476 1.00 18.95 C ATOM 653 CD2 LEU A 74 49.134 68.960 236.379 1.00 19.79 C ATOM 654 H LEU A 74 44.867 67.344 234.941 1.00 0.00 H ATOM 655 N TYR A 75 46.460 70.868 235.114 1.00 12.63 N ATOM 656 CA TYR A 75 47.100 71.716 234.116 1.00 15.07 C ATOM 657 C TYR A 75 48.565 71.920 234.478 1.00 14.08 C ATOM 658 O TYR A 75 48.864 72.330 235.605 1.00 12.40 O ATOM 659 CB TYR A 75 46.388 73.071 234.003 1.00 14.14 C ATOM 660 CG TYR A 75 47.115 73.997 233.061 1.00 14.12 C ATOM 661 CD1 TYR A 75 46.948 73.896 231.683 1.00 14.94 C ATOM 662 CD2 TYR A 75 48.027 74.918 233.549 1.00 16.84 C ATOM 663 CE1 TYR A 75 47.635 74.731 230.821 1.00 14.89 C ATOM 664 CE2 TYR A 75 48.724 75.748 232.696 1.00 16.51 C ATOM 665 CZ TYR A 75 48.522 75.647 231.337 1.00 14.34 C ATOM 666 OH TYR A 75 49.217 76.460 230.473 1.00 19.60 O ATOM 667 HH TYR A 75 48.951 76.254 229.542 1.00 0.00 H ATOM 668 H TYR A 75 45.970 71.311 235.918 1.00 0.00 H ATOM 669 N TRP A 76 49.466 71.599 233.548 1.00 11.41 N ATOM 670 CA TRP A 76 50.900 71.829 233.742 1.00 12.11 C ATOM 671 C TRP A 76 51.532 72.292 232.465 1.00 13.01 C ATOM 672 O TRP A 76 51.591 71.538 231.505 1.00 12.15 O ATOM 673 CB TRP A 76 51.636 70.552 234.210 1.00 11.12 C ATOM 674 CG TRP A 76 53.161 70.672 234.237 1.00 13.14 C ATOM 675 CD1 TRP A 76 54.039 70.182 233.311 1.00 11.74 C ATOM 676 CD2 TRP A 76 53.964 71.310 235.244 1.00 10.63 C ATOM 677 NE1 TRP A 76 55.335 70.468 233.676 1.00 13.45 N ATOM 678 CE2 TRP A 76 55.321 71.149 234.864 1.00 11.66 C ATOM 679 CE3 TRP A 76 53.672 71.970 236.442 1.00 11.60 C ATOM 680 CZ2 TRP A 76 56.388 71.633 235.637 1.00 12.67 C ATOM 681 CZ3 TRP A 76 54.728 72.458 237.206 1.00 13.10 C ATOM 682 CH2 TRP A 76 56.071 72.299 236.795 1.00 14.38 C ATOM 683 HE1 TRP A 76 56.186 70.209 233.137 1.00 0.00 H ATOM 684 H TRP A 76 49.140 71.172 232.657 1.00 0.00 H ATOM 685 N ASN A 77 52.016 73.535 232.461 1.00 11.34 N ATOM 686 CA ASN A 77 52.873 74.009 231.380 1.00 12.40 C ATOM 687 C ASN A 77 52.374 73.673 229.980 1.00 12.85 C ATOM 688 O ASN A 77 53.028 72.928 229.228 1.00 14.14 O ATOM 689 CB ASN A 77 54.280 73.440 231.566 1.00 13.80 C ATOM 690 CG ASN A 77 55.303 74.189 230.775 1.00 12.83 C ATOM 691 OD1 ASN A 77 55.233 75.427 230.651 1.00 12.74 O ATOM 692 ND2 ASN A 77 56.253 73.460 230.200 1.00 11.35 N ATOM 693 HD22 ASN A 77 56.269 72.429 230.333 1.00 0.00 H ATOM 694 HD21 ASN A 77 56.980 73.921 229.617 1.00 0.00 H ATOM 695 H ASN A 77 51.778 74.178 233.243 1.00 0.00 H ATOM 696 N ASN A 78 51.189 74.197 229.669 1.00 14.00 N ATOM 697 CA ASN A 78 50.578 74.189 228.341 1.00 12.42 C ATOM 698 C ASN A 78 49.798 72.928 228.009 1.00 16.14 C ATOM 699 O ASN A 78 49.236 72.842 226.918 1.00 17.01 O ATOM 700 CB ASN A 78 51.635 74.409 227.255 1.00 14.00 C ATOM 701 CG ASN A 78 52.297 75.747 227.362 1.00 15.40 C ATOM 702 OD1 ASN A 78 51.619 76.770 227.430 1.00 12.91 O ATOM 703 ND2 ASN A 78 53.621 75.756 227.394 1.00 15.36 N ATOM 704 HD22 ASN A 78 54.149 74.862 227.333 1.00 0.00 H ATOM 705 HD21 ASN A 78 54.133 76.657 227.480 1.00 0.00 H ATOM 706 H ASN A 78 50.653 74.650 230.436 1.00 0.00 H ATOM 707 N VAL A 79 49.739 71.972 228.938 1.00 13.75 N ATOM 708 CA VAL A 79 48.973 70.729 228.706 1.00 13.04 C ATOM 709 C VAL A 79 48.048 70.442 229.882 1.00 13.43 C ATOM 710 O VAL A 79 48.436 70.628 231.036 1.00 13.01 O ATOM 711 CB VAL A 79 49.901 69.492 228.498 1.00 13.20 C ATOM 712 CG1 VAL A 79 49.065 68.216 228.268 1.00 13.14 C ATOM 713 CG2 VAL A 79 50.858 69.725 227.341 1.00 16.32 C ATOM 714 H VAL A 79 50.240 72.103 229.840 1.00 0.00 H ATOM 715 N THR A 80 46.828 69.989 229.603 1.00 14.22 N ATOM 716 CA THR A 80 45.907 69.583 230.664 1.00 12.24 C ATOM 717 C THR A 80 45.823 68.064 230.660 1.00 15.27 C ATOM 718 O THR A 80 45.431 67.470 229.653 1.00 15.31 O ATOM 719 CB THR A 80 44.518 70.208 230.485 1.00 15.28 C ATOM 720 OG1 THR A 80 44.647 71.639 230.489 1.00 15.54 O ATOM 721 CG2 THR A 80 43.606 69.812 231.625 1.00 15.24 C ATOM 722 HG1 THR A 80 43.754 72.050 230.374 1.00 0.00 H ATOM 723 H THR A 80 46.524 69.922 228.611 1.00 0.00 H ATOM 724 N TYR A 81 46.262 67.456 231.763 1.00 12.63 N ATOM 725 CA TYR A 81 46.312 66.003 231.946 1.00 13.32 C ATOM 726 C TYR A 81 45.149 65.496 232.778 1.00 14.52 C ATOM 727 O TYR A 81 44.682 66.194 233.678 1.00 12.83 O ATOM 728 CB TYR A 81 47.618 65.597 232.640 1.00 13.52 C ATOM 729 CG TYR A 81 48.848 65.991 231.889 1.00 12.37 C ATOM 730 CD1 TYR A 81 49.434 65.118 230.990 1.00 13.63 C ATOM 731 CD2 TYR A 81 49.418 67.253 232.057 1.00 13.50 C ATOM 732 CE1 TYR A 81 50.560 65.477 230.277 1.00 12.29 C ATOM 733 CE2 TYR A 81 50.538 67.622 231.363 1.00 11.65 C ATOM 734 CZ TYR A 81 51.110 66.731 230.470 1.00 12.34 C ATOM 735 OH TYR A 81 52.227 67.084 229.756 1.00 12.52 O ATOM 736 HH TYR A 81 52.496 66.331 229.172 1.00 0.00 H ATOM 737 H TYR A 81 46.592 68.054 232.547 1.00 0.00 H ATOM 738 N PRO A 82 44.675 64.273 232.496 1.00 13.66 N ATOM 739 CA PRO A 82 43.771 63.660 233.468 1.00 14.05 C ATOM 740 C PRO A 82 44.467 63.527 234.818 1.00 12.03 C ATOM 741 O PRO A 82 45.690 63.329 234.873 1.00 13.53 O ATOM 742 CB PRO A 82 43.454 62.288 232.850 1.00 14.12 C ATOM 743 CG PRO A 82 43.787 62.438 231.396 1.00 14.29 C ATOM 744 CD PRO A 82 44.943 63.391 231.347 1.00 11.12 C ATOM 745 N PHE A 83 43.698 63.627 235.895 1.00 13.96 N ATOM 746 CA PHE A 83 44.225 63.520 237.251 1.00 14.44 C ATOM 747 C PHE A 83 43.323 62.554 238.028 1.00 13.80 C ATOM 748 O PHE A 83 42.101 62.669 237.962 1.00 17.93 O ATOM 749 CB PHE A 83 44.288 64.899 237.927 1.00 13.98 C ATOM 750 CG PHE A 83 45.067 64.910 239.210 1.00 13.60 C ATOM 751 CD1 PHE A 83 46.450 64.943 239.190 1.00 12.93 C ATOM 752 CD2 PHE A 83 44.415 64.885 240.434 1.00 15.72 C ATOM 753 CE1 PHE A 83 47.187 64.940 240.374 1.00 15.65 C ATOM 754 CE2 PHE A 83 45.131 64.892 241.623 1.00 17.05 C ATOM 755 CZ PHE A 83 46.525 64.922 241.596 1.00 14.76 C ATOM 756 H PHE A 83 42.679 63.788 235.767 1.00 0.00 H ATOM 757 N PRO A 84 43.917 61.589 238.756 1.00 15.12 N ATOM 758 CA PRO A 84 45.356 61.441 239.005 1.00 13.76 C ATOM 759 C PRO A 84 46.208 61.161 237.768 1.00 13.15 C ATOM 760 O PRO A 84 45.741 60.664 236.746 1.00 11.91 O ATOM 761 CB PRO A 84 45.419 60.260 239.983 1.00 13.56 C ATOM 762 CG PRO A 84 44.234 59.463 239.668 1.00 16.67 C ATOM 763 CD PRO A 84 43.160 60.489 239.378 1.00 15.58 C ATOM 764 N LEU A 85 47.477 61.531 237.875 1.00 12.01 N ATOM 765 CA LEU A 85 48.402 61.443 236.742 1.00 12.31 C ATOM 766 C LEU A 85 48.801 60.002 236.457 1.00 13.36 C ATOM 767 O LEU A 85 49.273 59.313 237.350 1.00 13.55 O ATOM 768 CB LEU A 85 49.668 62.270 237.012 1.00 14.10 C ATOM 769 CG LEU A 85 49.612 63.795 236.987 1.00 16.53 C ATOM 770 CD1 LEU A 85 51.024 64.296 237.124 1.00 15.16 C ATOM 771 CD2 LEU A 85 48.964 64.322 235.708 1.00 16.54 C ATOM 772 H LEU A 85 47.824 61.893 238.786 1.00 0.00 H ATOM 773 N THR A 86 48.651 59.568 235.210 1.00 12.08 N ATOM 774 CA THR A 86 49.014 58.199 234.839 1.00 16.03 C ATOM 775 C THR A 86 50.296 58.163 234.005 1.00 15.31 C ATOM 776 O THR A 86 50.699 57.111 233.499 1.00 15.32 O ATOM 777 CB THR A 86 47.879 57.512 234.056 1.00 14.69 C ATOM 778 OG1 THR A 86 47.823 58.058 232.731 1.00 16.33 O ATOM 779 CG2 THR A 86 46.548 57.724 234.760 1.00 15.76 C ATOM 780 HG1 THR A 86 47.650 59.031 232.783 1.00 0.00 H ATOM 781 H THR A 86 48.270 60.211 234.487 1.00 0.00 H ATOM 782 N THR A 87 50.946 59.317 233.871 1.00 12.83 N ATOM 783 CA THR A 87 52.154 59.424 233.070 1.00 12.42 C ATOM 784 C THR A 87 52.932 60.628 233.594 1.00 15.78 C ATOM 785 O THR A 87 52.401 61.382 234.400 1.00 14.90 O ATOM 786 CB THR A 87 51.816 59.574 231.565 1.00 17.78 C ATOM 787 OG1 THR A 87 52.993 59.378 230.774 1.00 22.00 O ATOM 788 CG2 THR A 87 51.212 60.941 231.275 1.00 17.36 C ATOM 789 HG1 THR A 87 53.352 58.470 230.938 1.00 0.00 H ATOM 790 H THR A 87 50.580 60.164 234.352 1.00 0.00 H ATOM 791 N ASN A 88 54.186 60.778 233.181 1.00 12.71 N ATOM 792 CA ASN A 88 54.943 61.983 233.531 1.00 13.54 C ATOM 793 C ASN A 88 54.537 63.085 232.573 1.00 13.63 C ATOM 794 O ASN A 88 54.172 62.826 231.421 1.00 14.93 O ATOM 795 CB ASN A 88 56.464 61.742 233.500 1.00 13.21 C ATOM 796 CG ASN A 88 56.931 60.715 234.540 1.00 12.56 C ATOM 797 OD1 ASN A 88 56.213 60.396 235.491 1.00 12.83 O ATOM 798 ND2 ASN A 88 58.147 60.202 234.358 1.00 14.89 N ATOM 799 HD22 ASN A 88 58.720 60.499 233.542 1.00 0.00 H ATOM 800 HD21 ASN A 88 58.523 59.505 235.032 1.00 0.00 H ATOM 801 H ASN A 88 54.633 60.036 232.606 1.00 0.00 H ATOM 802 N THR A 89 54.554 64.315 233.066 1.00 12.31 N ATOM 803 CA THR A 89 54.163 65.468 232.253 1.00 11.76 C ATOM 804 C THR A 89 55.305 65.949 231.386 1.00 11.68 C ATOM 805 O THR A 89 56.451 65.495 231.509 1.00 14.41 O ATOM 806 CB THR A 89 53.705 66.660 233.126 1.00 12.69 C ATOM 807 OG1 THR A 89 54.834 67.184 233.848 1.00 12.74 O ATOM 808 CG2 THR A 89 52.571 66.270 234.088 1.00 11.58 C ATOM 809 HG1 THR A 89 55.523 67.489 233.205 1.00 0.00 H ATOM 810 H THR A 89 54.851 64.464 234.051 1.00 0.00 H ATOM 811 N ASN A 90 54.985 66.888 230.505 1.00 13.10 N ATOM 812 CA ASN A 90 56.009 67.638 229.781 1.00 12.54 C ATOM 813 C ASN A 90 56.966 68.323 230.754 1.00 12.96 C ATOM 814 O ASN A 90 56.652 68.516 231.944 1.00 12.56 O ATOM 815 CB ASN A 90 55.373 68.677 228.855 1.00 16.17 C ATOM 816 CG ASN A 90 54.800 69.859 229.612 1.00 10.61 C ATOM 817 OD1 ASN A 90 55.530 70.765 230.015 1.00 13.81 O ATOM 818 ND2 ASN A 90 53.476 69.868 229.777 1.00 13.28 N ATOM 819 HD22 ASN A 90 52.902 69.078 229.418 1.00 0.00 H ATOM 820 HD21 ASN A 90 53.018 70.665 230.264 1.00 0.00 H ATOM 821 H ASN A 90 53.982 67.095 230.325 1.00 0.00 H ATOM 822 N VAL A 91 58.145 68.664 230.237 1.00 12.52 N ATOM 823 CA VAL A 91 59.191 69.329 231.002 1.00 13.78 C ATOM 824 C VAL A 91 59.115 70.852 230.885 1.00 12.88 C ATOM 825 O VAL A 91 58.946 71.395 229.785 1.00 14.85 O ATOM 826 CB VAL A 91 60.577 68.856 230.541 1.00 14.11 C ATOM 827 CG1 VAL A 91 61.670 69.637 231.235 1.00 16.55 C ATOM 828 CG2 VAL A 91 60.719 67.363 230.792 1.00 15.14 C ATOM 829 H VAL A 91 58.328 68.444 229.237 1.00 0.00 H ATOM 830 N LEU A 92 59.215 71.518 232.033 1.00 12.66 N ATOM 831 CA LEU A 92 59.352 72.973 232.121 1.00 13.74 C ATOM 832 C LEU A 92 60.814 73.271 232.393 1.00 14.15 C ATOM 833 O LEU A 92 61.414 72.655 233.267 1.00 12.55 O ATOM 834 CB LEU A 92 58.467 73.538 233.235 1.00 12.45 C ATOM 835 CG LEU A 92 58.711 75.003 233.625 1.00 12.35 C ATOM 836 CD1 LEU A 92 58.428 75.946 232.457 1.00 14.74 C ATOM 837 CD2 LEU A 92 57.867 75.382 234.833 1.00 15.75 C ATOM 838 H LEU A 92 59.195 70.973 232.919 1.00 0.00 H ATOM 839 N ASP A 93 61.390 74.214 231.655 1.00 13.40 N ATOM 840 CA ASP A 93 62.805 74.517 231.809 1.00 14.69 C ATOM 841 C ASP A 93 62.994 75.843 232.529 1.00 14.79 C ATOM 842 O ASP A 93 62.397 76.853 232.142 1.00 17.34 O ATOM 843 CB ASP A 93 63.471 74.516 230.444 1.00 14.11 C ATOM 844 CG ASP A 93 63.113 73.281 229.642 1.00 14.76 C ATOM 845 OD1 ASP A 93 63.670 72.197 229.928 1.00 14.45 O ATOM 846 OD2 ASP A 93 62.258 73.392 228.736 1.00 17.24 O ATOM 847 H ASP A 93 60.824 74.741 230.960 1.00 0.00 H ATOM 848 N ILE A 94 63.792 75.799 233.594 1.00 13.68 N ATOM 849 CA ILE A 94 64.001 76.916 234.515 1.00 17.80 C ATOM 850 C ILE A 94 65.484 77.310 234.533 1.00 18.18 C ATOM 851 O ILE A 94 66.339 76.513 234.929 1.00 16.00 O ATOM 852 CB ILE A 94 63.538 76.547 235.945 1.00 16.72 C ATOM 853 CG1 ILE A 94 62.030 76.253 235.983 1.00 15.73 C ATOM 854 CG2 ILE A 94 63.917 77.646 236.946 1.00 18.70 C ATOM 855 CD1 ILE A 94 61.167 77.440 235.816 1.00 20.16 C ATOM 856 H ILE A 94 64.300 74.912 233.784 1.00 0.00 H ATOM 857 N GLY A 95 65.781 78.536 234.107 1.00 16.23 N ATOM 858 CA GLY A 95 67.157 78.985 233.979 1.00 15.20 C ATOM 859 C GLY A 95 67.395 80.401 234.470 1.00 17.77 C ATOM 860 O GLY A 95 68.542 80.837 234.509 1.00 17.93 O ATOM 861 H GLY A 95 65.009 79.188 233.860 1.00 0.00 H ATOM 862 N ASP A 96 66.327 81.106 234.842 1.00 16.10 N ATOM 863 CA ASP A 96 66.453 82.456 235.438 1.00 15.57 C ATOM 864 C ASP A 96 66.518 82.385 236.963 1.00 20.07 C ATOM 865 O ASP A 96 65.970 81.471 237.574 1.00 17.84 O ATOM 866 CB ASP A 96 65.280 83.351 235.019 1.00 18.24 C ATOM 867 CG ASP A 96 65.208 83.566 233.523 1.00 19.10 C ATOM 868 OD1 ASP A 96 66.255 83.831 232.900 1.00 19.73 O ATOM 869 OD2 ASP A 96 64.098 83.465 232.970 1.00 19.66 O ATOM 870 H ASP A 96 65.380 80.697 234.710 1.00 0.00 H ATOM 871 N LYS A 97 67.166 83.364 237.589 1.00 20.30 N ATOM 872 CA LYS A 97 67.193 83.415 239.041 1.00 17.88 C ATOM 873 C LYS A 97 65.919 84.083 239.565 1.00 18.93 C ATOM 874 O LYS A 97 65.511 83.868 240.707 1.00 20.02 O ATOM 875 CB LYS A 97 68.439 84.150 239.536 1.00 21.08 C ATOM 876 CG LYS A 97 68.810 83.829 240.976 1.00 26.38 C ATOM 877 CD LYS A 97 70.254 84.218 241.282 1.00 28.69 C ATOM 878 CE LYS A 97 70.603 83.948 242.743 1.00 36.07 C ATOM 879 NZ LYS A 97 71.969 84.451 243.081 1.00 44.62 N ATOM 880 HZ1 LYS A 97 72.671 83.974 242.480 1.00 0.00 H ATOM 881 HZ2 LYS A 97 72.010 85.477 242.916 1.00 0.00 H ATOM 882 HZ3 LYS A 97 72.173 84.251 244.081 1.00 0.00 H ATOM 883 H LYS A 97 67.656 84.096 237.036 1.00 0.00 H ATOM 884 N THR A 98 65.285 84.883 238.717 1.00 15.50 N ATOM 885 CA THR A 98 63.976 85.438 239.036 1.00 17.43 C ATOM 886 C THR A 98 62.983 84.295 239.191 1.00 18.17 C ATOM 887 O THR A 98 62.876 83.451 238.296 1.00 18.01 O ATOM 888 CB THR A 98 63.482 86.384 237.957 1.00 19.72 C ATOM 889 OG1 THR A 98 64.335 87.535 237.916 1.00 22.01 O ATOM 890 CG2 THR A 98 62.048 86.810 238.255 1.00 22.62 C ATOM 891 HG1 THR A 98 64.017 88.155 237.213 1.00 0.00 H ATOM 892 H THR A 98 65.731 85.118 237.807 1.00 0.00 H ATOM 893 N PRO A 99 62.276 84.241 240.332 1.00 16.47 N ATOM 894 CA PRO A 99 61.365 83.106 240.521 1.00 16.08 C ATOM 895 C PRO A 99 60.280 83.060 239.466 1.00 17.00 C ATOM 896 O PRO A 99 59.752 84.096 239.044 1.00 16.16 O ATOM 897 CB PRO A 99 60.758 83.359 241.900 1.00 17.86 C ATOM 898 CG PRO A 99 61.740 84.242 242.598 1.00 19.41 C ATOM 899 CD PRO A 99 62.332 85.107 241.525 1.00 17.20 C ATOM 900 N MET A 100 59.952 81.841 239.044 1.00 17.69 N ATOM 901 CA MET A 100 58.837 81.605 238.150 1.00 18.79 C ATOM 902 C MET A 100 57.754 80.859 238.893 1.00 14.85 C ATOM 903 O MET A 100 57.963 79.729 239.315 1.00 15.46 O ATOM 904 CB MET A 100 59.245 80.783 236.918 1.00 21.22 C ATOM 905 CG MET A 100 58.123 80.719 235.868 1.00 20.14 C ATOM 906 SD MET A 100 58.349 79.430 234.623 1.00 25.58 S ATOM 907 CE MET A 100 56.766 79.537 233.776 1.00 21.85 C ATOM 908 H MET A 100 60.516 81.029 239.368 1.00 0.00 H ATOM 909 N PRO A 101 56.588 81.487 239.040 1.00 14.20 N ATOM 910 CA PRO A 101 55.404 80.796 239.563 1.00 14.66 C ATOM 911 C PRO A 101 55.146 79.527 238.746 1.00 14.28 C ATOM 912 O PRO A 101 55.236 79.566 237.515 1.00 13.15 O ATOM 913 CB PRO A 101 54.284 81.829 239.384 1.00 16.05 C ATOM 914 CG PRO A 101 55.007 83.162 239.391 1.00 19.81 C ATOM 915 CD PRO A 101 56.308 82.890 238.678 1.00 16.84 C ATOM 916 N LEU A 102 54.848 78.416 239.404 1.00 12.55 N ATOM 917 CA LEU A 102 54.614 77.204 238.641 1.00 12.15 C ATOM 918 C LEU A 102 53.304 77.299 237.853 1.00 11.36 C ATOM 919 O LEU A 102 52.258 77.688 238.403 1.00 13.76 O ATOM 920 CB LEU A 102 54.611 75.975 239.566 1.00 11.82 C ATOM 921 CG LEU A 102 55.952 75.676 240.231 1.00 13.49 C ATOM 922 CD1 LEU A 102 55.915 74.338 240.996 1.00 12.82 C ATOM 923 CD2 LEU A 102 57.072 75.675 239.214 1.00 15.28 C ATOM 924 H LEU A 102 54.783 78.413 240.442 1.00 0.00 H ATOM 925 N PRO A 103 53.351 76.956 236.544 1.00 12.56 N ATOM 926 CA PRO A 103 52.136 76.981 235.722 1.00 12.03 C ATOM 927 C PRO A 103 51.323 75.726 235.984 1.00 14.28 C ATOM 928 O PRO A 103 51.280 74.806 235.154 1.00 12.89 O ATOM 929 CB PRO A 103 52.674 77.011 234.293 1.00 12.52 C ATOM 930 CG PRO A 103 53.955 76.228 234.378 1.00 11.56 C ATOM 931 CD PRO A 103 54.532 76.556 235.756 1.00 13.42 C ATOM 932 N LEU A 104 50.697 75.703 237.158 1.00 12.71 N ATOM 933 CA LEU A 104 50.108 74.494 237.703 1.00 12.12 C ATOM 934 C LEU A 104 48.743 74.765 238.305 1.00 12.78 C ATOM 935 O LEU A 104 48.610 75.580 239.219 1.00 13.83 O ATOM 936 CB LEU A 104 51.037 73.903 238.754 1.00 12.79 C ATOM 937 CG LEU A 104 50.531 72.703 239.552 1.00 14.44 C ATOM 938 CD1 LEU A 104 50.244 71.491 238.643 1.00 14.39 C ATOM 939 CD2 LEU A 104 51.561 72.329 240.606 1.00 17.65 C ATOM 940 H LEU A 104 50.627 76.585 237.705 1.00 0.00 H ATOM 941 N LYS A 105 47.728 74.098 237.773 1.00 13.53 N ATOM 942 CA LYS A 105 46.373 74.238 238.285 1.00 13.89 C ATOM 943 C LYS A 105 45.734 72.867 238.383 1.00 14.81 C ATOM 944 O LYS A 105 45.848 72.051 237.463 1.00 17.48 O ATOM 945 CB LYS A 105 45.531 75.145 237.391 1.00 19.48 C ATOM 946 CG LYS A 105 46.028 76.577 237.309 1.00 18.52 C ATOM 947 CD LYS A 105 45.059 77.391 236.448 1.00 24.55 C ATOM 948 CE LYS A 105 45.331 78.881 236.525 1.00 31.69 C ATOM 949 NZ LYS A 105 46.724 79.227 236.126 1.00 33.18 N ATOM 950 HZ1 LYS A 105 47.394 78.745 236.758 1.00 0.00 H ATOM 951 HZ2 LYS A 105 46.889 78.921 235.146 1.00 0.00 H ATOM 952 HZ3 LYS A 105 46.858 80.256 236.196 1.00 0.00 H ATOM 953 H LYS A 105 47.904 73.460 236.971 1.00 0.00 H ATOM 954 N LEU A 106 45.062 72.618 239.492 1.00 12.75 N ATOM 955 CA LEU A 106 44.344 71.365 239.680 1.00 15.69 C ATOM 956 C LEU A 106 42.847 71.640 239.583 1.00 16.84 C ATOM 957 O LEU A 106 42.338 72.606 240.168 1.00 19.00 O ATOM 958 CB LEU A 106 44.713 70.731 241.033 1.00 17.12 C ATOM 959 CG LEU A 106 43.944 69.498 241.511 1.00 18.88 C ATOM 960 CD1 LEU A 106 44.160 68.333 240.559 1.00 19.41 C ATOM 961 CD2 LEU A 106 44.363 69.125 242.943 1.00 24.18 C ATOM 962 H LEU A 106 45.045 73.332 240.248 1.00 0.00 H ATOM 963 N TYR A 107 42.150 70.813 238.812 1.00 18.12 N ATOM 964 CA TYR A 107 40.706 70.931 238.678 1.00 18.21 C ATOM 965 C TYR A 107 40.033 69.718 239.289 1.00 20.80 C ATOM 966 O TYR A 107 40.365 68.576 238.945 1.00 22.37 O ATOM 967 CB TYR A 107 40.318 71.074 237.216 1.00 19.76 C ATOM 968 CG TYR A 107 40.875 72.323 236.590 1.00 22.18 C ATOM 969 CD1 TYR A 107 42.136 72.327 236.010 1.00 22.37 C ATOM 970 CD2 TYR A 107 40.147 73.507 236.595 1.00 26.24 C ATOM 971 CE1 TYR A 107 42.654 73.487 235.439 1.00 19.42 C ATOM 972 CE2 TYR A 107 40.653 74.661 236.030 1.00 26.21 C ATOM 973 CZ TYR A 107 41.908 74.648 235.458 1.00 27.07 C ATOM 974 OH TYR A 107 42.407 75.805 234.895 1.00 27.08 O ATOM 975 HH TYR A 107 42.460 76.511 235.587 1.00 0.00 H ATOM 976 H TYR A 107 42.648 70.063 238.292 1.00 0.00 H ATOM 977 N ILE A 108 39.091 69.967 240.191 1.00 20.68 N ATOM 978 CA ILE A 108 38.430 68.882 240.909 1.00 23.01 C ATOM 979 C ILE A 108 36.969 68.752 240.508 1.00 29.84 C ATOM 980 O ILE A 108 36.182 69.684 240.673 1.00 27.19 O ATOM 981 CB ILE A 108 38.532 69.080 242.432 1.00 25.79 C ATOM 982 CG1 ILE A 108 39.997 69.304 242.827 1.00 23.05 C ATOM 983 CG2 ILE A 108 37.939 67.882 243.158 1.00 29.30 C ATOM 984 CD1 ILE A 108 40.192 69.936 244.189 1.00 25.37 C ATOM 985 H ILE A 108 38.820 70.951 240.389 1.00 0.00 H ATOM 986 N THR A 109 36.620 67.581 239.979 1.00 26.53 N ATOM 987 CA THR A 109 35.279 67.320 239.463 1.00 34.29 C ATOM 988 C THR A 109 34.426 66.613 240.505 1.00 37.80 C ATOM 989 O THR A 109 34.747 65.502 240.923 1.00 37.98 O ATOM 990 CB THR A 109 35.325 66.453 238.183 1.00 34.80 C ATOM 991 OG1 THR A 109 35.886 67.210 237.105 1.00 37.47 O ATOM 992 CG2 THR A 109 33.928 65.991 237.798 1.00 39.67 C ATOM 993 HG1 THR A 109 35.327 68.010 236.939 1.00 0.00 H ATOM 994 H THR A 109 37.330 66.823 239.931 1.00 0.00 H ATOM 995 N PRO A 110 33.333 67.261 240.929 1.00 39.22 N ATOM 996 CA PRO A 110 32.449 66.701 241.954 1.00 44.05 C ATOM 997 C PRO A 110 31.455 65.697 241.373 1.00 47.89 C ATOM 998 O PRO A 110 30.393 66.119 240.911 1.00 51.77 O ATOM 999 CB PRO A 110 31.728 67.934 242.498 1.00 44.58 C ATOM 1000 CG PRO A 110 31.656 68.859 241.323 1.00 42.89 C ATOM 1001 CD PRO A 110 32.916 68.615 240.519 1.00 41.05 C TER 1002 PRO A 110 ATOM 1003 N GLY A 116 27.061 67.327 252.506 1.00 41.39 N ATOM 1004 CA GLY A 116 27.548 68.407 253.347 1.00 35.46 C ATOM 1005 C GLY A 116 28.968 68.789 252.988 1.00 33.38 C ATOM 1006 O GLY A 116 29.244 69.196 251.861 1.00 32.61 O ATOM 1007 HN3 GLY A 116 27.669 66.492 252.629 1.00 0.00 H ATOM 1008 HN2 GLY A 116 27.081 67.628 251.511 1.00 0.00 H ATOM 1009 HN1 GLY A 116 26.086 67.090 252.778 1.00 0.00 H ATOM 1010 N VAL A 117 29.879 68.646 253.945 1.00 34.86 N ATOM 1011 CA VAL A 117 31.278 68.988 253.709 1.00 34.41 C ATOM 1012 C VAL A 117 31.968 67.944 252.822 1.00 32.05 C ATOM 1013 O VAL A 117 32.045 66.766 253.175 1.00 37.21 O ATOM 1014 CB VAL A 117 32.048 69.137 255.042 1.00 32.79 C ATOM 1015 CG1 VAL A 117 33.526 69.400 254.779 1.00 29.31 C ATOM 1016 CG2 VAL A 117 31.443 70.265 255.877 1.00 30.35 C ATOM 1017 H VAL A 117 29.590 68.285 254.877 1.00 0.00 H ATOM 1018 N VAL A 118 32.458 68.386 251.666 1.00 28.95 N ATOM 1019 CA VAL A 118 33.178 67.513 250.741 1.00 32.46 C ATOM 1020 C VAL A 118 34.692 67.605 250.944 1.00 31.49 C ATOM 1021 O VAL A 118 35.416 66.613 250.781 1.00 29.98 O ATOM 1022 CB VAL A 118 32.853 67.857 249.277 1.00 34.63 C ATOM 1023 CG1 VAL A 118 31.384 67.590 248.982 1.00 37.62 C ATOM 1024 CG2 VAL A 118 33.192 69.304 248.995 1.00 34.73 C ATOM 1025 H VAL A 118 32.324 69.386 251.413 1.00 0.00 H ATOM 1026 N ILE A 119 35.161 68.806 251.271 1.00 27.58 N ATOM 1027 CA ILE A 119 36.568 69.040 251.574 1.00 22.98 C ATOM 1028 C ILE A 119 36.720 69.655 252.958 1.00 25.17 C ATOM 1029 O ILE A 119 36.120 70.701 253.247 1.00 24.40 O ATOM 1030 CB ILE A 119 37.224 69.971 250.554 1.00 24.80 C ATOM 1031 CG1 ILE A 119 37.246 69.313 249.176 1.00 27.37 C ATOM 1032 CG2 ILE A 119 38.632 70.354 251.006 1.00 25.04 C ATOM 1033 CD1 ILE A 119 37.877 70.167 248.114 1.00 23.48 C ATOM 1034 H ILE A 119 34.500 69.608 251.312 1.00 0.00 H ATOM 1035 N LYS A 120 37.512 69.003 253.802 1.00 21.57 N ATOM 1036 CA LYS A 120 37.795 69.499 255.142 1.00 19.39 C ATOM 1037 C LYS A 120 39.070 70.330 255.170 1.00 19.53 C ATOM 1038 O LYS A 120 40.120 69.888 254.701 1.00 23.12 O ATOM 1039 CB LYS A 120 37.940 68.349 256.140 1.00 24.27 C ATOM 1040 CG LYS A 120 36.699 67.498 256.333 1.00 24.54 C ATOM 1041 CD LYS A 120 36.962 66.398 257.364 1.00 27.05 C ATOM 1042 CE LYS A 120 35.939 65.278 257.250 1.00 36.19 C ATOM 1043 NZ LYS A 120 36.239 64.153 258.189 1.00 38.64 N ATOM 1044 HZ1 LYS A 120 37.178 63.762 257.971 1.00 0.00 H ATOM 1045 HZ2 LYS A 120 36.228 64.507 259.167 1.00 0.00 H ATOM 1046 HZ3 LYS A 120 35.519 63.411 258.080 1.00 0.00 H ATOM 1047 H LYS A 120 37.945 68.108 253.496 1.00 0.00 H ATOM 1048 N ALA A 121 38.983 71.522 255.747 1.00 18.33 N ATOM 1049 CA ALA A 121 40.153 72.359 255.942 1.00 20.39 C ATOM 1050 C ALA A 121 41.205 71.620 256.761 1.00 19.73 C ATOM 1051 O ALA A 121 40.869 70.921 257.729 1.00 20.02 O ATOM 1052 CB ALA A 121 39.760 73.654 256.624 1.00 21.25 C ATOM 1053 H ALA A 121 38.055 71.865 256.067 1.00 0.00 H ATOM 1054 N GLY A 122 42.469 71.752 256.364 1.00 18.96 N ATOM 1055 CA GLY A 122 43.569 71.188 257.126 1.00 22.12 C ATOM 1056 C GLY A 122 43.986 69.772 256.753 1.00 23.43 C ATOM 1057 O GLY A 122 45.042 69.297 257.180 1.00 25.53 O ATOM 1058 H GLY A 122 42.674 72.272 255.487 1.00 0.00 H ATOM 1059 N GLU A 123 43.151 69.082 255.983 1.00 21.87 N ATOM 1060 CA GLU A 123 43.475 67.736 255.510 1.00 23.96 C ATOM 1061 C GLU A 123 44.194 67.811 254.166 1.00 21.38 C ATOM 1062 O GLU A 123 43.858 68.636 253.325 1.00 19.86 O ATOM 1063 CB GLU A 123 42.209 66.884 255.358 1.00 26.57 C ATOM 1064 CG GLU A 123 41.370 67.265 254.126 1.00 28.76 C ATOM 1065 CD GLU A 123 40.271 66.260 253.777 1.00 34.83 C ATOM 1066 OE1 GLU A 123 40.505 65.038 253.918 1.00 35.60 O ATOM 1067 OE2 GLU A 123 39.171 66.700 253.359 1.00 32.23 O ATOM 1068 H GLU A 123 42.243 69.510 255.710 1.00 0.00 H ATOM 1069 N VAL A 124 45.171 66.940 253.951 1.00 22.42 N ATOM 1070 CA VAL A 124 45.771 66.842 252.622 1.00 20.39 C ATOM 1071 C VAL A 124 44.743 66.321 251.609 1.00 21.39 C ATOM 1072 O VAL A 124 44.124 65.274 251.830 1.00 22.02 O ATOM 1073 CB VAL A 124 47.002 65.925 252.614 1.00 21.59 C ATOM 1074 CG1 VAL A 124 47.553 65.816 251.204 1.00 18.70 C ATOM 1075 CG2 VAL A 124 48.071 66.460 253.550 1.00 20.25 C ATOM 1076 H VAL A 124 45.508 66.331 254.723 1.00 0.00 H ATOM 1077 N ILE A 125 44.545 67.047 250.509 1.00 17.84 N ATOM 1078 CA ILE A 125 43.583 66.623 249.495 1.00 20.14 C ATOM 1079 C ILE A 125 44.234 66.176 248.172 1.00 17.54 C ATOM 1080 O ILE A 125 43.588 65.551 247.338 1.00 20.89 O ATOM 1081 CB ILE A 125 42.555 67.729 249.201 1.00 26.00 C ATOM 1082 CG1 ILE A 125 43.251 69.042 248.831 1.00 24.76 C ATOM 1083 CG2 ILE A 125 41.642 67.923 250.405 1.00 27.90 C ATOM 1084 CD1 ILE A 125 42.289 70.247 248.701 1.00 27.19 C ATOM 1085 H ILE A 125 45.082 67.927 250.371 1.00 0.00 H ATOM 1086 N ALA A 126 45.508 66.508 247.984 1.00 16.08 N ATOM 1087 CA ALA A 126 46.258 65.972 246.854 1.00 18.61 C ATOM 1088 C ALA A 126 47.752 65.946 247.171 1.00 14.68 C ATOM 1089 O ALA A 126 48.259 66.787 247.927 1.00 15.28 O ATOM 1090 CB ALA A 126 45.992 66.779 245.586 1.00 17.91 C ATOM 1091 H ALA A 126 45.974 67.157 248.650 1.00 0.00 H ATOM 1092 N ARG A 127 48.451 64.986 246.579 1.00 13.89 N ATOM 1093 CA ARG A 127 49.898 64.878 246.715 1.00 14.47 C ATOM 1094 C ARG A 127 50.508 64.940 245.324 1.00 15.37 C ATOM 1095 O ARG A 127 50.346 64.013 244.530 1.00 14.94 O ATOM 1096 CB ARG A 127 50.294 63.575 247.425 1.00 19.26 C ATOM 1097 CG ARG A 127 49.577 63.370 248.765 1.00 21.11 C ATOM 1098 CD ARG A 127 50.155 62.201 249.565 1.00 28.81 C ATOM 1099 NE ARG A 127 49.891 62.360 250.997 1.00 29.30 N ATOM 1100 CZ ARG A 127 48.738 62.051 251.573 1.00 27.42 C ATOM 1101 NH1 ARG A 127 47.751 61.563 250.839 1.00 33.07 N ATOM 1102 NH2 ARG A 127 48.567 62.231 252.876 1.00 30.52 N ATOM 1103 HE ARG A 127 50.652 62.737 251.597 1.00 0.00 H ATOM 1104 HH12 ARG A 127 46.844 61.318 251.284 1.00 0.00 H ATOM 1105 HH11 ARG A 127 47.883 61.424 249.817 1.00 0.00 H ATOM 1106 HH22 ARG A 127 47.659 61.986 253.320 1.00 0.00 H ATOM 1107 HH21 ARG A 127 49.341 62.617 253.454 1.00 0.00 H ATOM 1108 H ARG A 127 47.948 64.286 245.997 1.00 0.00 H ATOM 1109 N ILE A 128 51.191 66.042 245.029 1.00 14.48 N ATOM 1110 CA ILE A 128 51.746 66.265 243.704 1.00 13.49 C ATOM 1111 C ILE A 128 53.258 66.083 243.767 1.00 15.23 C ATOM 1112 O ILE A 128 53.956 66.810 244.472 1.00 15.89 O ATOM 1113 CB ILE A 128 51.373 67.666 243.161 1.00 14.15 C ATOM 1114 CG1 ILE A 128 49.844 67.790 243.091 1.00 16.48 C ATOM 1115 CG2 ILE A 128 52.009 67.893 241.791 1.00 14.41 C ATOM 1116 CD1 ILE A 128 49.321 69.141 242.673 1.00 18.74 C ATOM 1117 H ILE A 128 51.332 66.763 245.765 1.00 0.00 H ATOM 1118 N HIS A 129 53.749 65.078 243.054 1.00 13.35 N ATOM 1119 CA HIS A 129 55.166 64.780 243.014 1.00 13.13 C ATOM 1120 C HIS A 129 55.815 65.496 241.840 1.00 14.29 C ATOM 1121 O HIS A 129 55.391 65.349 240.693 1.00 13.23 O ATOM 1122 CB HIS A 129 55.370 63.262 242.923 1.00 14.55 C ATOM 1123 CG HIS A 129 56.798 62.838 242.795 1.00 16.54 C ATOM 1124 ND1 HIS A 129 57.152 61.584 242.335 1.00 17.69 N ATOM 1125 CD2 HIS A 129 57.960 63.483 243.057 1.00 16.79 C ATOM 1126 CE1 HIS A 129 58.468 61.481 242.316 1.00 17.24 C ATOM 1127 NE2 HIS A 129 58.984 62.619 242.750 1.00 18.74 N ATOM 1128 H HIS A 129 53.095 64.484 242.505 1.00 0.00 H ATOM 1129 N MET A 130 56.854 66.266 242.133 1.00 13.11 N ATOM 1130 CA MET A 130 57.584 67.021 241.118 1.00 12.86 C ATOM 1131 C MET A 130 59.028 66.543 241.078 1.00 12.94 C ATOM 1132 O MET A 130 59.649 66.325 242.126 1.00 15.48 O ATOM 1133 CB MET A 130 57.528 68.518 241.428 1.00 12.55 C ATOM 1134 CG MET A 130 58.125 69.423 240.336 1.00 12.32 C ATOM 1135 SD MET A 130 58.009 71.170 240.822 1.00 13.93 S ATOM 1136 CE MET A 130 59.551 71.394 241.682 1.00 13.58 C ATOM 1137 H MET A 130 57.161 66.335 243.124 1.00 0.00 H ATOM 1138 N TYR A 131 59.564 66.394 239.872 1.00 11.28 N ATOM 1139 CA TYR A 131 60.921 65.900 239.682 1.00 11.32 C ATOM 1140 C TYR A 131 61.789 66.970 239.037 1.00 13.25 C ATOM 1141 O TYR A 131 61.357 67.632 238.099 1.00 14.48 O ATOM 1142 CB TYR A 131 60.895 64.632 238.825 1.00 13.82 C ATOM 1143 CG TYR A 131 62.244 64.039 238.504 1.00 12.00 C ATOM 1144 CD1 TYR A 131 62.961 63.337 239.461 1.00 13.23 C ATOM 1145 CD2 TYR A 131 62.795 64.181 237.237 1.00 13.84 C ATOM 1146 CE1 TYR A 131 64.201 62.781 239.167 1.00 13.91 C ATOM 1147 CE2 TYR A 131 64.023 63.635 236.931 1.00 14.63 C ATOM 1148 CZ TYR A 131 64.724 62.929 237.902 1.00 12.35 C ATOM 1149 OH TYR A 131 65.944 62.368 237.602 1.00 15.62 O ATOM 1150 HH TYR A 131 66.300 61.907 238.402 1.00 0.00 H ATOM 1151 H TYR A 131 58.996 66.638 239.036 1.00 0.00 H ATOM 1152 N LYS A 132 63.004 67.132 239.553 1.00 14.30 N ATOM 1153 CA LYS A 132 63.969 68.068 239.009 1.00 13.73 C ATOM 1154 C LYS A 132 65.234 67.346 238.573 1.00 12.88 C ATOM 1155 O LYS A 132 65.755 66.507 239.302 1.00 15.26 O ATOM 1156 CB LYS A 132 64.334 69.142 240.041 1.00 14.63 C ATOM 1157 CG LYS A 132 65.596 69.943 239.690 1.00 13.17 C ATOM 1158 CD LYS A 132 66.814 69.473 240.496 1.00 13.74 C ATOM 1159 CE LYS A 132 68.094 70.100 239.929 1.00 16.52 C ATOM 1160 NZ LYS A 132 69.267 69.901 240.835 1.00 17.03 N ATOM 1161 HZ1 LYS A 132 69.070 70.342 241.756 1.00 0.00 H ATOM 1162 HZ2 LYS A 132 69.434 68.883 240.965 1.00 0.00 H ATOM 1163 HZ3 LYS A 132 70.109 70.341 240.412 1.00 0.00 H ATOM 1164 H LYS A 132 63.273 66.564 240.381 1.00 0.00 H ATOM 1165 N ILE A 133 65.721 67.677 237.384 1.00 13.04 N ATOM 1166 CA ILE A 133 67.073 67.294 236.997 1.00 13.42 C ATOM 1167 C ILE A 133 67.674 68.441 236.189 1.00 16.75 C ATOM 1168 O ILE A 133 66.993 69.057 235.377 1.00 16.20 O ATOM 1169 CB ILE A 133 67.093 65.958 236.209 1.00 16.66 C ATOM 1170 CG1 ILE A 133 68.532 65.454 236.033 1.00 18.82 C ATOM 1171 CG2 ILE A 133 66.369 66.087 234.872 1.00 16.33 C ATOM 1172 CD1 ILE A 133 68.607 63.968 235.631 1.00 16.90 C ATOM 1173 H ILE A 133 65.130 68.217 236.720 1.00 0.00 H ATOM 1174 N ALA A 134 68.932 68.767 236.460 1.00 16.76 N ATOM 1175 CA ALA A 134 69.578 69.874 235.763 1.00 15.18 C ATOM 1176 C ALA A 134 70.325 69.378 234.521 1.00 18.62 C ATOM 1177 O ALA A 134 69.974 68.346 233.948 1.00 18.95 O ATOM 1178 CB ALA A 134 70.513 70.623 236.708 1.00 18.84 C ATOM 1179 H ALA A 134 69.462 68.229 237.175 1.00 0.00 H ATOM 1180 N THR A 135 71.354 70.111 234.110 1.00 17.51 N ATOM 1181 CA THR A 135 71.965 69.919 232.797 1.00 18.92 C ATOM 1182 C THR A 135 73.420 69.433 232.863 1.00 19.43 C ATOM 1183 O THR A 135 73.834 68.593 232.063 1.00 24.59 O ATOM 1184 CB THR A 135 71.915 71.241 231.987 1.00 20.88 C ATOM 1185 OG1 THR A 135 70.549 71.642 231.782 1.00 19.06 O ATOM 1186 CG2 THR A 135 72.611 71.096 230.640 1.00 22.78 C ATOM 1187 HG1 THR A 135 70.112 71.781 232.659 1.00 0.00 H ATOM 1188 H THR A 135 71.736 70.843 234.742 1.00 0.00 H ATOM 1189 N LEU A 136 74.183 69.958 233.822 1.00 24.30 N ATOM 1190 CA LEU A 136 75.600 69.616 233.961 1.00 22.72 C ATOM 1191 C LEU A 136 75.821 68.447 234.926 1.00 26.30 C ATOM 1192 O LEU A 136 75.048 68.246 235.864 1.00 25.88 O ATOM 1193 CB LEU A 136 76.394 70.839 234.440 1.00 22.65 C ATOM 1194 CG LEU A 136 76.288 72.132 233.627 1.00 22.13 C ATOM 1195 CD1 LEU A 136 76.944 73.284 234.375 1.00 28.20 C ATOM 1196 CD2 LEU A 136 76.884 71.985 232.231 1.00 24.03 C ATOM 1197 H LEU A 136 73.759 70.631 234.492 1.00 0.00 H ATOM 1198 N GLY A 137 76.889 67.685 234.701 1.00 25.89 N ATOM 1199 CA GLY A 137 77.182 66.529 235.530 1.00 28.26 C ATOM 1200 C GLY A 137 76.092 65.472 235.485 1.00 29.08 C ATOM 1201 O GLY A 137 75.617 65.102 234.415 1.00 30.68 O ATOM 1202 H GLY A 137 77.527 67.922 233.915 1.00 0.00 H ATOM 1203 N SER A 138 75.705 64.988 236.662 1.00 32.94 N ATOM 1204 CA SER A 138 74.620 64.018 236.804 1.00 32.58 C ATOM 1205 C SER A 138 73.259 64.683 236.645 1.00 31.61 C ATOM 1206 O SER A 138 72.255 64.020 236.350 1.00 30.56 O ATOM 1207 CB SER A 138 74.692 63.338 238.171 1.00 32.26 C ATOM 1208 OG SER A 138 74.456 64.278 239.212 1.00 26.84 O ATOM 1209 HG SER A 138 74.507 63.819 240.088 1.00 0.00 H ATOM 1210 H SER A 138 76.196 65.314 237.519 1.00 0.00 H ATOM 1211 N GLY A 139 73.233 65.994 236.858 1.00 29.89 N ATOM 1212 CA GLY A 139 71.993 66.743 236.852 1.00 24.52 C ATOM 1213 C GLY A 139 71.463 66.885 238.257 1.00 20.71 C ATOM 1214 O GLY A 139 70.507 67.634 238.490 1.00 18.76 O ATOM 1215 H GLY A 139 74.127 66.496 237.034 1.00 0.00 H ATOM 1216 N ASN A 140 72.070 66.156 239.197 1.00 23.00 N ATOM 1217 CA ASN A 140 71.742 66.324 240.607 1.00 20.46 C ATOM 1218 C ASN A 140 70.223 66.247 240.849 1.00 18.62 C ATOM 1219 O ASN A 140 69.597 67.185 241.351 1.00 17.25 O ATOM 1220 CB ASN A 140 72.325 67.662 241.092 1.00 20.99 C ATOM 1221 CG ASN A 140 72.021 67.949 242.534 1.00 25.10 C ATOM 1222 OD1 ASN A 140 71.883 67.035 243.353 1.00 28.25 O ATOM 1223 ND2 ASN A 140 71.899 69.231 242.861 1.00 25.32 N ATOM 1224 HD22 ASN A 140 72.024 69.967 242.137 1.00 0.00 H ATOM 1225 HD21 ASN A 140 71.678 69.499 243.841 1.00 0.00 H ATOM 1226 H ASN A 140 72.788 65.457 238.918 1.00 0.00 H ATOM 1227 N PRO A 141 69.611 65.125 240.447 1.00 17.38 N ATOM 1228 CA PRO A 141 68.149 65.010 240.487 1.00 17.41 C ATOM 1229 C PRO A 141 67.612 65.075 241.899 1.00 18.82 C ATOM 1230 O PRO A 141 68.232 64.564 242.834 1.00 18.40 O ATOM 1231 CB PRO A 141 67.885 63.630 239.876 1.00 17.62 C ATOM 1232 CG PRO A 141 69.147 62.865 240.150 1.00 16.68 C ATOM 1233 CD PRO A 141 70.244 63.884 239.973 1.00 17.95 C ATOM 1234 N ARG A 142 66.462 65.718 242.053 1.00 16.74 N ATOM 1235 CA ARG A 142 65.840 65.845 243.359 1.00 18.64 C ATOM 1236 C ARG A 142 64.333 65.694 243.242 1.00 15.59 C ATOM 1237 O ARG A 142 63.741 66.011 242.210 1.00 17.61 O ATOM 1238 CB ARG A 142 66.185 67.194 243.990 1.00 18.44 C ATOM 1239 CG ARG A 142 67.682 67.496 244.021 1.00 22.00 C ATOM 1240 CD ARG A 142 68.125 67.856 245.425 1.00 23.37 C ATOM 1241 NE ARG A 142 67.823 66.788 246.373 1.00 24.63 N ATOM 1242 CZ ARG A 142 68.005 66.877 247.688 1.00 23.44 C ATOM 1243 NH1 ARG A 142 67.701 65.848 248.471 1.00 27.96 N ATOM 1244 NH2 ARG A 142 68.493 67.989 248.221 1.00 24.19 N ATOM 1245 HE ARG A 142 67.440 65.898 245.995 1.00 0.00 H ATOM 1246 HH12 ARG A 142 67.843 65.917 249.499 1.00 0.00 H ATOM 1247 HH11 ARG A 142 67.321 64.973 248.056 1.00 0.00 H ATOM 1248 HH22 ARG A 142 68.634 68.054 249.249 1.00 0.00 H ATOM 1249 HH21 ARG A 142 68.735 68.796 247.611 1.00 0.00 H ATOM 1250 H ARG A 142 65.997 66.139 241.223 1.00 0.00 H ATOM 1251 N ASN A 143 63.721 65.198 244.299 1.00 17.05 N ATOM 1252 CA ASN A 143 62.280 65.038 244.350 1.00 17.04 C ATOM 1253 C ASN A 143 61.635 66.041 245.286 1.00 16.78 C ATOM 1254 O ASN A 143 62.147 66.279 246.380 1.00 17.01 O ATOM 1255 CB ASN A 143 61.912 63.644 244.835 1.00 18.54 C ATOM 1256 CG ASN A 143 62.355 62.557 243.889 1.00 17.27 C ATOM 1257 OD1 ASN A 143 61.788 62.394 242.818 1.00 17.36 O ATOM 1258 ND2 ASN A 143 63.349 61.783 244.301 1.00 22.45 N ATOM 1259 HD22 ASN A 143 63.800 61.962 245.221 1.00 0.00 H ATOM 1260 HD21 ASN A 143 63.678 60.997 243.704 1.00 0.00 H ATOM 1261 H ASN A 143 64.289 64.912 245.122 1.00 0.00 H ATOM 1262 N PHE A 144 60.517 66.616 244.852 1.00 15.79 N ATOM 1263 CA PHE A 144 59.667 67.437 245.707 1.00 14.25 C ATOM 1264 C PHE A 144 58.292 66.785 245.767 1.00 15.92 C ATOM 1265 O PHE A 144 57.852 66.207 244.779 1.00 14.39 O ATOM 1266 CB PHE A 144 59.493 68.865 245.166 1.00 13.54 C ATOM 1267 CG PHE A 144 60.765 69.649 245.018 1.00 15.05 C ATOM 1268 CD1 PHE A 144 60.973 70.809 245.780 1.00 16.66 C ATOM 1269 CD2 PHE A 144 61.730 69.284 244.090 1.00 15.92 C ATOM 1270 CE1 PHE A 144 62.131 71.573 245.638 1.00 17.81 C ATOM 1271 CE2 PHE A 144 62.902 70.048 243.943 1.00 18.91 C ATOM 1272 CZ PHE A 144 63.094 71.196 244.720 1.00 18.77 C ATOM 1273 H PHE A 144 60.237 66.474 243.861 1.00 0.00 H ATOM 1274 N THR A 145 57.609 66.910 246.897 1.00 15.77 N ATOM 1275 CA THR A 145 56.185 66.605 246.954 1.00 14.46 C ATOM 1276 C THR A 145 55.436 67.792 247.529 1.00 14.20 C ATOM 1277 O THR A 145 55.811 68.348 248.568 1.00 15.10 O ATOM 1278 CB THR A 145 55.888 65.364 247.797 1.00 15.67 C ATOM 1279 OG1 THR A 145 56.485 64.233 247.162 1.00 16.78 O ATOM 1280 CG2 THR A 145 54.389 65.121 247.874 1.00 14.34 C ATOM 1281 HG1 THR A 145 57.463 64.371 247.096 1.00 0.00 H ATOM 1282 H THR A 145 58.098 67.231 247.757 1.00 0.00 H ATOM 1283 N TRP A 146 54.377 68.184 246.837 1.00 14.27 N ATOM 1284 CA TRP A 146 53.532 69.268 247.305 1.00 15.30 C ATOM 1285 C TRP A 146 52.236 68.703 247.851 1.00 13.72 C ATOM 1286 O TRP A 146 51.431 68.107 247.122 1.00 13.82 O ATOM 1287 CB TRP A 146 53.259 70.274 246.179 1.00 13.86 C ATOM 1288 CG TRP A 146 54.522 70.750 245.462 1.00 17.58 C ATOM 1289 CD1 TRP A 146 54.927 70.402 244.200 1.00 16.17 C ATOM 1290 CD2 TRP A 146 55.543 71.628 245.979 1.00 14.68 C ATOM 1291 NE1 TRP A 146 56.127 71.016 243.901 1.00 13.85 N ATOM 1292 CE2 TRP A 146 56.525 71.763 244.974 1.00 14.42 C ATOM 1293 CE3 TRP A 146 55.708 72.322 247.185 1.00 16.03 C ATOM 1294 CZ2 TRP A 146 57.661 72.569 245.136 1.00 13.19 C ATOM 1295 CZ3 TRP A 146 56.845 73.104 247.352 1.00 15.83 C ATOM 1296 CH2 TRP A 146 57.802 73.225 246.328 1.00 17.21 C ATOM 1297 HE1 TRP A 146 56.645 70.925 243.004 1.00 0.00 H ATOM 1298 H TRP A 146 54.146 67.707 245.942 1.00 0.00 H ATOM 1299 N ASN A 147 52.055 68.857 249.157 1.00 14.28 N ATOM 1300 CA ASN A 147 50.849 68.387 249.818 1.00 14.25 C ATOM 1301 C ASN A 147 49.836 69.514 249.866 1.00 14.54 C ATOM 1302 O ASN A 147 50.027 70.489 250.601 1.00 15.15 O ATOM 1303 CB ASN A 147 51.158 67.900 251.229 1.00 14.20 C ATOM 1304 CG ASN A 147 51.793 66.516 251.252 1.00 19.03 C ATOM 1305 OD1 ASN A 147 51.816 65.811 250.245 1.00 19.32 O ATOM 1306 ND2 ASN A 147 52.301 66.119 252.414 1.00 17.92 N ATOM 1307 HD22 ASN A 147 52.260 66.748 253.241 1.00 0.00 H ATOM 1308 HD21 ASN A 147 52.739 65.179 252.496 1.00 0.00 H ATOM 1309 H ASN A 147 52.793 69.325 249.720 1.00 0.00 H ATOM 1310 N ILE A 148 48.774 69.392 249.079 1.00 13.30 N ATOM 1311 CA ILE A 148 47.794 70.473 248.943 1.00 15.47 C ATOM 1312 C ILE A 148 46.748 70.388 250.049 1.00 18.95 C ATOM 1313 O ILE A 148 46.108 69.345 250.224 1.00 17.39 O ATOM 1314 CB ILE A 148 47.096 70.441 247.563 1.00 15.24 C ATOM 1315 CG1 ILE A 148 48.135 70.320 246.444 1.00 14.82 C ATOM 1316 CG2 ILE A 148 46.243 71.675 247.354 1.00 17.85 C ATOM 1317 CD1 ILE A 148 49.318 71.315 246.574 1.00 15.31 C ATOM 1318 H ILE A 148 48.634 68.509 248.547 1.00 0.00 H ATOM 1319 N ILE A 149 46.612 71.485 250.793 1.00 17.40 N ATOM 1320 CA ILE A 149 45.728 71.569 251.952 1.00 17.62 C ATOM 1321 C ILE A 149 44.816 72.788 251.858 1.00 20.13 C ATOM 1322 O ILE A 149 45.292 73.902 251.649 1.00 18.02 O ATOM 1323 CB ILE A 149 46.547 71.649 253.249 1.00 16.74 C ATOM 1324 CG1 ILE A 149 47.458 70.422 253.390 1.00 19.97 C ATOM 1325 CG2 ILE A 149 45.628 71.837 254.452 1.00 19.46 C ATOM 1326 CD1 ILE A 149 48.366 70.466 254.605 1.00 20.10 C ATOM 1327 H ILE A 149 47.165 72.327 250.534 1.00 0.00 H ATOM 1328 N SER A 150 43.510 72.596 252.018 1.00 19.52 N ATOM 1329 CA SER A 150 42.593 73.737 251.973 1.00 19.69 C ATOM 1330 C SER A 150 42.553 74.491 253.311 1.00 18.90 C ATOM 1331 O SER A 150 42.623 73.882 254.374 1.00 18.06 O ATOM 1332 CB SER A 150 41.183 73.276 251.590 1.00 22.76 C ATOM 1333 OG SER A 150 40.280 74.367 251.598 1.00 24.39 O ATOM 1334 HG SER A 150 39.377 74.048 251.348 1.00 0.00 H ATOM 1335 H SER A 150 43.140 71.637 252.175 1.00 0.00 H ATOM 1336 N ASN A 151 42.454 75.815 253.246 1.00 21.88 N ATOM 1337 CA ASN A 151 42.269 76.638 254.438 1.00 22.47 C ATOM 1338 C ASN A 151 40.838 76.647 254.938 1.00 22.00 C ATOM 1339 O ASN A 151 40.575 77.077 256.067 1.00 23.78 O ATOM 1340 CB ASN A 151 42.682 78.087 254.178 1.00 23.39 C ATOM 1341 CG ASN A 151 44.173 78.283 254.196 1.00 22.34 C ATOM 1342 OD1 ASN A 151 44.889 77.651 254.968 1.00 24.01 O ATOM 1343 ND2 ASN A 151 44.651 79.185 253.349 1.00 25.11 N ATOM 1344 HD22 ASN A 151 44.005 79.696 252.714 1.00 0.00 H ATOM 1345 HD21 ASN A 151 45.672 79.382 253.320 1.00 0.00 H ATOM 1346 H ASN A 151 42.510 76.279 252.317 1.00 0.00 H ATOM 1347 N ASN A 152 39.910 76.222 254.091 1.00 20.84 N ATOM 1348 CA ASN A 152 38.496 76.316 254.426 1.00 21.72 C ATOM 1349 C ASN A 152 37.692 75.089 254.020 1.00 20.50 C ATOM 1350 O ASN A 152 38.110 74.299 253.172 1.00 22.66 O ATOM 1351 CB ASN A 152 37.880 77.568 253.777 1.00 18.17 C ATOM 1352 CG ASN A 152 38.027 77.582 252.252 1.00 23.12 C ATOM 1353 OD1 ASN A 152 39.028 78.063 251.725 1.00 27.60 O ATOM 1354 ND2 ASN A 152 37.022 77.077 251.547 1.00 23.31 N ATOM 1355 HD22 ASN A 152 36.193 76.680 252.034 1.00 0.00 H ATOM 1356 HD21 ASN A 152 37.063 77.079 250.508 1.00 0.00 H ATOM 1357 H ASN A 152 40.196 75.817 253.177 1.00 0.00 H ATOM 1358 N SER A 153 36.525 74.942 254.635 1.00 20.69 N ATOM 1359 CA SER A 153 35.574 73.922 254.225 1.00 22.30 C ATOM 1360 C SER A 153 35.096 74.173 252.801 1.00 25.17 C ATOM 1361 O SER A 153 35.003 75.316 252.351 1.00 22.98 O ATOM 1362 CB SER A 153 34.369 73.890 255.166 1.00 21.16 C ATOM 1363 OG SER A 153 34.775 73.760 256.516 1.00 23.86 O ATOM 1364 HG SER A 153 35.348 74.529 256.763 1.00 0.00 H ATOM 1365 H SER A 153 36.286 75.571 255.428 1.00 0.00 H ATOM 1366 N VAL A 154 34.793 73.092 252.094 1.00 23.31 N ATOM 1367 CA VAL A 154 34.065 73.190 250.833 1.00 26.21 C ATOM 1368 C VAL A 154 32.846 72.286 250.971 1.00 23.43 C ATOM 1369 O VAL A 154 32.968 71.149 251.412 1.00 26.43 O ATOM 1370 CB VAL A 154 34.932 72.776 249.618 1.00 24.98 C ATOM 1371 CG1 VAL A 154 34.151 72.929 248.322 1.00 29.77 C ATOM 1372 CG2 VAL A 154 36.203 73.600 249.551 1.00 25.18 C ATOM 1373 H VAL A 154 35.080 72.156 252.445 1.00 0.00 H ATOM 1374 N VAL A 155 31.665 72.798 250.638 1.00 26.76 N ATOM 1375 CA VAL A 155 30.431 72.040 250.844 1.00 31.04 C ATOM 1376 C VAL A 155 29.587 71.969 249.578 1.00 33.11 C ATOM 1377 O VAL A 155 29.755 72.788 248.674 1.00 33.20 O ATOM 1378 CB VAL A 155 29.574 72.643 251.977 1.00 33.07 C ATOM 1379 CG1 VAL A 155 30.343 72.622 253.292 1.00 32.44 C ATOM 1380 CG2 VAL A 155 29.150 74.061 251.625 1.00 32.77 C ATOM 1381 H VAL A 155 31.618 73.751 250.225 1.00 0.00 H ATOM 1382 N MET A 156 28.675 70.994 249.566 1.00 39.08 N ATOM 1383 CA MET A 156 27.778 70.649 248.450 1.00 41.66 C ATOM 1384 C MET A 156 28.191 71.212 247.089 1.00 44.83 C ATOM 1385 O MET A 156 27.959 72.379 246.770 1.00 47.24 O ATOM 1386 CB MET A 156 26.335 71.075 248.774 1.00 41.36 C ATOM 1387 CG MET A 156 26.054 72.569 248.708 1.00 46.59 C ATOM 1388 SD MET A 156 24.304 72.945 248.897 1.00 65.71 S ATOM 1389 CE MET A 156 23.553 71.599 247.981 1.00 44.64 C ATOM 1390 H MET A 156 28.590 70.422 250.430 1.00 0.00 H TER 1391 MET A 156 HETATM 1392 O HOH 1 40.389 64.944 256.299 1.00 34.50 O HETATM 1393 O HOH 2 40.910 59.488 241.888 1.00 31.76 O HETATM 1394 O HOH 3 55.707 79.637 253.142 1.00 33.29 O HETATM 1395 O HOH 4 26.130 73.182 238.816 1.00 31.71 O HETATM 1396 O HOH 5 33.131 66.363 255.447 1.00 36.94 O HETATM 1397 O HOH 6 31.902 76.007 252.889 1.00 33.27 O HETATM 1398 O HOH 7 46.455 82.520 237.821 1.00 23.35 O HETATM 1399 O HOH 8 58.992 63.704 246.745 1.00 24.91 O HETATM 1400 O HOH 9 54.534 75.679 253.342 1.00 30.65 O HETATM 1401 O HOH 10 44.395 63.427 253.649 1.00 31.16 O HETATM 1402 O HOH 11 63.969 83.802 230.385 1.00 22.04 O HETATM 1403 O HOH 12 58.826 78.351 251.378 1.00 20.97 O HETATM 1404 O HOH 13 48.426 80.090 251.236 1.00 27.38 O HETATM 1405 O HOH 14 61.210 71.248 227.644 1.00 23.22 O HETATM 1406 O HOH 15 42.060 70.481 252.799 1.00 22.25 O HETATM 1407 O HOH 16 34.517 64.230 250.113 1.00 34.78 O HETATM 1408 O HOH 17 66.508 71.225 244.235 1.00 19.40 O HETATM 1409 O HOH 18 68.750 84.648 233.253 1.00 27.45 O HETATM 1410 O HOH 19 52.736 63.328 250.525 1.00 23.03 O HETATM 1411 O HOH 20 73.689 70.064 237.832 1.00 22.57 O HETATM 1412 O HOH 21 55.656 62.871 251.503 1.00 29.74 O HETATM 1413 O HOH 22 62.410 66.919 234.301 1.00 19.54 O HETATM 1414 O HOH 23 56.919 76.903 229.192 1.00 21.23 O HETATM 1415 O HOH 24 60.689 75.554 228.971 1.00 23.11 O HETATM 1416 O HOH 25 53.896 60.242 228.394 1.00 20.09 O HETATM 1417 O HOH 26 51.509 68.042 254.733 1.00 30.65 O HETATM 1418 O HOH 27 41.545 69.584 259.978 1.00 27.42 O HETATM 1419 O HOH 28 53.803 81.669 243.368 1.00 19.09 O HETATM 1420 O HOH 29 46.758 81.829 235.369 1.00 31.24 O HETATM 1421 O HOH 30 56.258 81.355 246.533 1.00 19.29 O HETATM 1422 O HOH 31 54.928 60.079 241.907 1.00 17.00 O HETATM 1423 O HOH 32 62.940 80.968 237.189 1.00 21.34 O HETATM 1424 O HOH 33 60.010 85.923 249.317 1.00 28.35 O HETATM 1425 O HOH 34 42.504 79.943 245.207 1.00 35.15 O HETATM 1426 O HOH 35 72.213 78.587 227.694 1.00 22.16 O HETATM 1427 O HOH 36 49.775 54.832 232.293 1.00 29.31 O HETATM 1428 O HOH 37 52.577 65.843 227.339 1.00 19.82 O HETATM 1429 O HOH 38 72.311 78.544 235.575 1.00 26.64 O HETATM 1430 O HOH 39 69.045 71.456 243.096 1.00 20.15 O HETATM 1431 O HOH 40 54.901 72.528 227.246 1.00 21.46 O HETATM 1432 O HOH 41 58.431 70.479 248.590 1.00 17.61 O HETATM 1433 O HOH 42 61.638 79.491 232.476 1.00 28.29 O HETATM 1434 O HOH 43 47.209 61.444 233.513 1.00 14.73 O HETATM 1435 O HOH 44 39.851 80.723 252.669 1.00 34.62 O HETATM 1436 O HOH 45 67.578 62.137 244.018 1.00 19.65 O HETATM 1437 O HOH 46 70.877 64.436 243.697 1.00 26.39 O HETATM 1438 O HOH 47 73.792 72.269 245.064 1.00 37.70 O HETATM 1439 O HOH 48 41.145 65.710 231.968 1.00 29.63 O HETATM 1440 O HOH 49 66.732 60.480 239.519 1.00 17.97 O HETATM 1441 O HOH 50 57.515 71.821 227.405 1.00 21.20 O HETATM 1442 O HOH 51 44.720 80.529 247.822 1.00 26.45 O HETATM 1443 O HOH 52 45.550 59.546 232.001 1.00 19.97 O HETATM 1444 O HOH 53 43.310 59.486 235.958 1.00 19.56 O HETATM 1445 O HOH 54 51.125 77.405 252.166 1.00 26.61 O HETATM 1446 O HOH 55 42.863 66.314 229.741 1.00 24.68 O HETATM 1447 O HOH 56 58.742 85.532 236.831 1.00 25.21 O HETATM 1448 O HOH 57 39.526 62.963 234.586 1.00 32.94 O HETATM 1449 O HOH 58 64.759 86.998 234.098 1.00 27.05 O HETATM 1450 O HOH 59 53.460 56.635 230.238 1.00 26.08 O HETATM 1451 O HOH 60 53.463 80.430 235.473 1.00 25.30 O HETATM 1452 O HOH 61 51.657 80.202 254.037 1.00 39.16 O HETATM 1453 O HOH 62 45.658 64.625 255.567 1.00 33.36 O HETATM 1454 O HOH 63 59.880 71.981 253.176 1.00 29.13 O HETATM 1455 O HOH 64 48.647 74.813 224.921 1.00 32.50 O HETATM 1456 O HOH 65 70.882 71.182 245.100 1.00 35.15 O HETATM 1457 O HOH 66 73.002 65.019 233.213 1.00 39.16 O HETATM 1458 O HOH 67 55.799 58.835 231.778 1.00 21.21 O HETATM 1459 O HOH 68 47.304 67.513 257.397 1.00 37.82 O HETATM 1460 O HOH 69 61.193 84.415 246.446 1.00 31.06 O HETATM 1461 O HOH 70 54.957 61.979 246.189 1.00 25.92 O HETATM 1462 O HOH 71 62.486 70.370 252.834 1.00 34.01 O HETATM 1463 O HOH 72 38.389 77.520 244.264 1.00 27.93 O HETATM 1464 O HOH 73 46.083 70.076 226.794 1.00 25.84 O HETATM 1465 O HOH 74 43.217 82.311 245.952 1.00 35.95 O HETATM 1466 O HOH 75 58.825 63.811 231.078 1.00 27.32 O HETATM 1467 O HOH 76 50.071 60.475 245.098 1.00 23.34 O HETATM 1468 O HOH 77 36.143 76.707 256.970 1.00 27.35 O HETATM 1469 O HOH 78 48.254 71.480 224.488 1.00 32.15 O HETATM 1470 O HOH 79 41.202 78.408 235.600 1.00 36.54 O HETATM 1471 O HOH 80 65.550 71.632 251.324 1.00 34.70 O HETATM 1472 O HOH 81 47.974 57.505 241.393 1.00 16.29 O HETATM 1473 O HOH 82 47.341 80.359 253.718 1.00 32.92 O HETATM 1474 O HOH 83 58.717 67.877 227.436 1.00 21.50 O HETATM 1475 O HOH 84 47.416 78.620 256.199 1.00 38.71 O HETATM 1476 O HOH 85 37.815 64.480 251.916 1.00 40.87 O HETATM 1477 O HOH 86 36.612 77.080 241.884 1.00 27.86 O HETATM 1478 O HOH 87 42.976 81.096 238.789 1.00 30.33 O HETATM 1479 O HOH 88 43.683 68.313 227.380 1.00 27.26 O HETATM 1480 O HOH 89 43.143 60.290 242.880 1.00 25.63 O HETATM 1481 O HOH 90 65.718 80.541 252.755 1.00 34.89 O HETATM 1482 O HOH 91 63.418 80.345 234.494 1.00 17.99 O HETATM 1483 O HOH 92 72.065 61.791 234.349 1.00 31.88 O HETATM 1484 O HOH 93 61.545 83.898 235.633 1.00 23.23 O HETATM 1485 O HOH 94 63.475 82.065 249.641 1.00 31.65 O HETATM 1486 O HOH 95 44.901 79.505 245.130 1.00 33.23 O HETATM 1487 O HOH 96 33.998 77.512 254.167 1.00 29.19 O HETATM 1488 O HOH 97 42.306 78.646 243.308 1.00 23.16 O HETATM 1489 O HOH 98 72.258 67.370 229.770 1.00 36.78 O HETATM 1490 O HOH 99 73.760 84.470 230.539 1.00 32.41 O HETATM 1491 O HOH 100 66.332 77.280 253.342 1.00 37.12 O HETATM 1492 O HOH 101 48.590 84.477 246.456 1.00 32.91 O HETATM 1493 O HOH 102 58.149 74.676 228.117 1.00 26.83 O HETATM 1494 O HOH 103 78.486 68.192 232.101 1.00 33.96 O HETATM 1495 O HOH 104 59.868 63.454 250.646 1.00 36.76 O HETATM 1496 O HOH 105 60.661 65.895 253.471 1.00 35.41 O HETATM 1497 O HOH 106 55.512 71.846 255.392 1.00 25.26 O HETATM 1498 O HOH 107 69.717 68.690 229.551 1.00 29.67 O HETATM 1499 O HOH 108 63.353 64.110 248.386 1.00 33.91 O HETATM 1500 O HOH 109 44.176 58.092 245.493 1.00 37.68 O HETATM 1501 O HOH 110 65.695 63.981 246.548 1.00 23.81 O HETATM 1502 O HOH 111 52.806 61.923 244.927 1.00 27.99 O HETATM 1503 O HOH 112 70.733 65.337 232.874 1.00 33.53 O HETATM 1504 O HOH 113 71.442 61.136 237.775 1.00 29.62 O HETATM 1505 O HOH 114 53.880 54.130 231.891 1.00 28.36 O HETATM 1506 O HOH 115 53.349 63.421 254.175 1.00 38.55 O HETATM 1507 O HOH 116 50.489 63.696 255.276 1.00 35.59 O HETATM 1508 O HOH 117 36.725 69.077 232.538 1.00 40.56 O HETATM 1509 O HOH 118 62.318 86.135 234.217 1.00 25.60 O HETATM 1510 O HOH 119 60.904 63.745 231.899 1.00 24.66 O HETATM 1511 O HOH 120 53.218 59.682 243.582 1.00 25.68 O HETATM 1512 O HOH 121 61.136 81.743 233.650 1.00 30.47 O HETATM 1513 O HOH 122 59.412 61.069 245.853 1.00 29.17 O HETATM 1514 O HOH 123 65.769 68.371 229.108 1.00 29.33 O HETATM 1515 O HOH 124 75.566 79.870 229.719 1.00 30.72 O HETATM 1516 O HOH 125 56.560 60.240 245.525 1.00 31.07 O HETATM 1517 O HOH 126 67.885 85.551 230.267 1.00 31.76 O HETATM 1518 O HOH 127 40.904 60.553 235.349 1.00 29.90 O HETATM 1519 O HOH 128 76.076 82.214 231.267 1.00 33.83 O HETATM 1520 O HOH 129 64.678 69.980 253.039 1.00 41.91 O HETATM 1521 O HOH 130 59.945 64.290 248.473 1.00 30.41 O HETATM 1522 O HOH 131 43.820 68.810 260.593 1.00 34.83 O HETATM 1523 O HOH 132 61.572 85.600 231.394 1.00 26.09 O HETATM 1524 O HOH 133 38.907 70.565 232.487 1.00 39.30 O HETATM 1525 O HOH 134 65.555 87.259 231.712 1.00 34.61 O HETATM 1526 O HOH 135 64.095 64.930 250.891 1.00 36.15 O HETATM 1527 O HOH 136 51.138 85.609 246.701 1.00 34.59 O HETATM 1528 O HOH 137 39.911 68.783 230.405 1.00 41.97 O HETATM 1529 O HOH 138 43.680 57.671 243.360 1.00 28.02 O HETATM 1530 O HOH 139 39.791 65.706 258.153 1.00 35.88 O HETATM 1531 O HOH 140 71.209 86.788 232.637 1.00 38.85 O HETATM 1532 O HOH 141 70.615 85.221 231.202 1.00 35.00 O HETATM 1533 O HOH 142 58.888 84.030 235.214 1.00 29.62 O HETATM 1534 O HOH 143 39.911 63.657 232.299 1.00 32.34 O HETATM 1535 O HOH 144 67.763 75.069 250.259 1.00 36.72 O HETATM 1536 O HOH 145 51.051 80.415 235.474 1.00 28.45 O HETATM 1537 O HOH 146 63.667 65.471 232.416 1.00 21.69 O HETATM 1538 O HOH 147 71.893 88.208 244.983 1.00 39.41 O HETATM 1539 O HOH 148 55.225 66.621 226.194 1.00 31.68 O HETATM 1540 O HOH 149 53.317 61.393 248.280 1.00 31.46 O HETATM 1541 O HOH 150 65.203 66.821 230.663 1.00 30.21 O HETATM 1542 O HOH 151 57.809 69.910 225.712 1.00 28.69 O HETATM 1543 O HOH 152 43.343 58.763 233.149 1.00 21.13 O HETATM 1544 O HOH 153 48.478 77.525 257.796 1.00 35.31 O HETATM 1545 O HOH 154 61.392 62.585 249.062 1.00 40.82 O HETATM 1546 O HOH 155 48.142 56.745 253.263 1.00 54.43 O HETATM 1547 O HOH 156 54.061 71.171 225.021 1.00 33.56 O HETATM 1548 O HOH 157 62.147 63.343 251.599 1.00 39.26 O HETATM 1549 O HOH 158 60.832 88.600 234.758 1.00 31.98 O HETATM 1550 O HOH 159 57.340 76.317 253.413 1.00 34.48 O HETATM 1551 O HOH 160 55.769 85.573 236.337 1.00 32.10 O HETATM 1552 O HOH 161 49.677 78.643 256.145 1.00 37.44 O HETATM 1553 O HOH 162 65.826 63.118 252.520 1.00 46.14 O HETATM 1554 O HOH 163 73.965 58.291 234.030 1.00 39.14 O HETATM 1555 C1 MOL A 164 72.496 73.879 242.036 1.00 0.21 C HETATM 1556 C2 MOL A 164 72.226 72.417 241.749 1.00 0.14 C HETATM 1557 O2 MOL A 164 73.163 71.612 242.430 1.00 -0.38 O HETATM 1558 H3 MOL A 164 73.091 71.766 243.365 1.00 0.21 H HETATM 1559 C3 MOL A 164 72.310 72.132 240.270 1.00 0.11 C HETATM 1560 O3 MOL A 164 71.937 70.778 240.039 1.00 -0.39 O HETATM 1561 H5 MOL A 164 71.987 70.591 239.109 1.00 0.21 H HETATM 1562 C4 MOL A 164 71.404 73.091 239.540 1.00 0.11 C HETATM 1563 O4 MOL A 164 70.066 72.849 239.931 1.00 -0.39 O HETATM 1564 H7 MOL A 164 69.490 73.451 239.474 1.00 0.21 H HETATM 1565 C5 MOL A 164 71.793 74.511 239.894 1.00 0.11 C HETATM 1566 C6 MOL A 164 70.952 75.517 239.114 1.00 0.07 C HETATM 1567 O6 MOL A 164 69.702 75.744 239.725 1.00 -0.39 O HETATM 1568 H11 MOL A 164 69.221 74.926 239.772 1.00 0.21 H HETATM 1569 H9 MOL A 164 70.786 75.129 238.098 1.00 0.06 H HETATM 1570 H10 MOL A 164 71.499 76.470 239.058 1.00 0.06 H HETATM 1571 O5 MOL A 164 71.626 74.696 241.276 1.00 -0.34 O HETATM 1572 H8 MOL A 164 72.852 74.665 239.637 1.00 0.06 H HETATM 1573 H6 MOL A 164 71.504 72.942 238.455 1.00 0.06 H HETATM 1574 H4 MOL A 164 73.343 72.282 239.924 1.00 0.06 H HETATM 1575 H2 MOL A 164 71.214 72.169 242.102 1.00 0.07 H HETATM 1576 O1' MOL A 164 72.263 74.011 243.416 1.00 -0.28 O HETATM 1577 C1' MOL A 164 72.557 75.251 244.009 1.00 0.14 C HETATM 1578 C2' MOL A 164 71.877 75.653 245.160 1.00 0.23 C HETATM 1579 C3' MOL A 164 72.188 76.876 245.735 1.00 -0.03 C HETATM 1580 C4' MOL A 164 73.164 77.684 245.183 1.00 -0.06 C HETATM 1581 C5' MOL A 164 73.840 77.283 244.047 1.00 -0.07 C HETATM 1582 C6' MOL A 164 73.541 76.064 243.467 1.00 -0.02 C HETATM 1583 H15 MOL A 164 74.079 75.742 242.583 1.00 0.06 H HETATM 1584 H14 MOL A 164 74.601 77.921 243.612 1.00 0.06 H HETATM 1585 H13 MOL A 164 73.400 78.636 245.643 1.00 0.05 H HETATM 1586 H12 MOL A 164 71.661 77.201 246.625 1.00 0.07 H HETATM 1587 N1' MOL A 164 70.855 74.866 245.765 1.00 0.31 N HETATM 1588 O2' MOL A 164 70.523 75.078 246.924 1.00 0.17 O HETATM 1589 O3' MOL A 164 70.269 73.985 245.148 1.00 0.17 O HETATM 1590 H1 MOL A 164 73.538 74.137 241.796 1.00 0.10 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 28 27 361 CONECT 361 28 360 CONECT 1003 1004 1007 1008 1009 CONECT 1007 1003 CONECT 1008 1003 CONECT 1009 1003 CONECT 1555 1556 1571 1576 1590 CONECT 1556 1555 1557 1559 1575 CONECT 1557 1556 1558 CONECT 1558 1557 CONECT 1559 1556 1560 1562 1574 CONECT 1560 1559 1561 CONECT 1561 1560 CONECT 1562 1559 1563 1565 1573 CONECT 1563 1562 1564 CONECT 1564 1563 CONECT 1565 1562 1566 1571 1572 CONECT 1566 1565 1567 1569 1570 CONECT 1567 1566 1568 CONECT 1568 1567 CONECT 1569 1566 CONECT 1570 1566 CONECT 1571 1555 1565 CONECT 1572 1565 CONECT 1573 1562 CONECT 1574 1559 CONECT 1575 1556 CONECT 1576 1555 1577 CONECT 1577 1576 1578 1582 CONECT 1578 1577 1579 1587 CONECT 1579 1578 1580 1586 CONECT 1580 1579 1581 1585 CONECT 1581 1580 1582 1584 CONECT 1582 1577 1581 1583 CONECT 1583 1582 CONECT 1584 1581 CONECT 1585 1580 CONECT 1586 1579 CONECT 1587 1578 1588 1589 CONECT 1588 1587 CONECT 1589 1587 CONECT 1590 1555 MASTER 0 0 0 0 0 0 0 0 1588 2 46 13 END
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Structure:
Ligand 2D
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Protein
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Related entries of code: 6arm
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5lne
RCSB PDB
PDBbind
164aa, >5LNE_1|Chains... at 100%
6as8
RCSB PDB
PDBbind
166aa, >6AS8_1|Chains... at 100%
6aro
RCSB PDB
PDBbind
166aa, >6ARO_1|Chains... at 100%
6arn
RCSB PDB
PDBbind
166aa, >6ARN_1|Chains... at 100%
6aoy
RCSB PDB
PDBbind
166aa, >6AOY_1|Chains... at 100%
6aox
RCSB PDB
PDBbind
166aa, >6AOX_1|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6aoy
RCSB PDB
PDBbind
145
Entry Information
PDB ID
6arm
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
F9 pilus adhesin FmlH
Ligand Name
145
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=10.6uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Proc.Natl.Acad.Sci.USA Vol. 115: pp. E2819-E2828
Ligand Properties
Formula
C
1
2
H
1
5
NO
8
Molecular Weight
301.249
Exact Mass
301.080
No. of atoms
36
No. of bonds
37
Polar Surface Area
145.2
LOGP Value
-0.41 (
Computed with XLOGP3
)
-0.70 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 2
Canonical SMILES
OC[C@H]1O[C@@H](Oc2ccccc2N(=O)=O)[C@@H]([C@H]([C@H]1O)O)O
InChI String
InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q1RBS0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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