Browse entries in the PDBbind-CN Database
HEADER 5UE4_COMPLEX COMPND 5UE4_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 19 ASP ARG GLN LEU ALA GLU GLU TYR LEU TYR ARG TYR GLY SEQRES 2 B 19 TYR THR ARG VAL ALA GLU SEQRES 1 B 41 SER LEU GLY PRO ALA LEU LEU LEU LEU GLN LYS GLN LEU SEQRES 2 B 41 SER LEU PRO GLU THR GLY GLU LEU ASP SER ALA THR LEU SEQRES 3 B 41 LYS ALA MET ARG THR PRO ARG CYS GLY VAL PRO ASP LEU SEQRES 4 B 41 GLY ARG SEQRES 1 B 160 PHE GLU GLY ASP LEU LYS TRP HIS HIS HIS ASN ILE THR SEQRES 2 B 160 TYR TRP ILE GLN ASN TYR SER GLU ASP LEU PRO ARG ALA SEQRES 3 B 160 VAL ILE ASP ASP ALA PHE ALA ARG ALA PHE ALA LEU TRP SEQRES 4 B 160 SER ALA VAL THR PRO LEU THR PHE THR ARG VAL TYR SER SEQRES 5 B 160 ARG ASP ALA ASP ILE VAL ILE GLN PHE GLY VAL ALA GLU SEQRES 6 B 160 HIS GLY ASP GLY TYR PRO PHE ASP GLY LYS ASP GLY LEU SEQRES 7 B 160 LEU ALA HIS ALA PHE PRO PRO GLY PRO GLY ILE GLN GLY SEQRES 8 B 160 ASP ALA HIS PHE ASP ASP ASP GLU LEU TRP SER LEU GLY SEQRES 9 B 160 LYS GLY GLN GLY TYR SER LEU PHE LEU VAL ALA ALA HIS SEQRES 10 B 160 GLU PHE GLY HIS ALA LEU GLY LEU ASP HIS SER SER VAL SEQRES 11 B 160 PRO GLU ALA LEU MET TYR PRO MET TYR ARG PHE THR GLU SEQRES 12 B 160 GLY PRO PRO LEU HIS LYS ASP ASP VAL ASN GLY ILE ARG SEQRES 13 B 160 HIS LEU TYR GLY HET ZN A 1 1 HET ZN A 2 1 HET CA A 3 1 HET CA A 4 1 HET UNN A 366 40 ATOM 1 N ASP B 41 61.936 41.891 34.547 1.00 49.31 N ATOM 2 CA ASP B 41 62.670 42.894 35.313 1.00 52.19 C ATOM 3 C ASP B 41 62.791 44.216 34.559 1.00 53.84 C ATOM 4 O ASP B 41 62.412 45.269 35.081 1.00 50.61 O ATOM 5 CB ASP B 41 64.051 42.371 35.724 1.00 54.22 C ATOM 6 CG ASP B 41 63.986 41.421 36.915 1.00 55.12 C ATOM 7 OD1 ASP B 41 62.862 41.063 37.329 1.00 56.64 O ATOM 8 OD2 ASP B 41 65.055 41.028 37.434 1.00 56.21 O ATOM 9 HN3 ASP B 41 62.432 41.710 33.651 1.00 0.00 H ATOM 10 HN2 ASP B 41 60.977 42.241 34.349 1.00 0.00 H ATOM 11 HN1 ASP B 41 61.878 41.010 35.097 1.00 0.00 H ATOM 12 N ARG B 42 63.314 44.160 33.335 1.00 52.43 N ATOM 13 CA ARG B 42 63.423 45.353 32.494 1.00 53.63 C ATOM 14 C ARG B 42 62.035 45.915 32.190 1.00 51.98 C ATOM 15 O ARG B 42 61.822 47.131 32.206 1.00 50.02 O ATOM 16 CB ARG B 42 64.142 45.023 31.183 1.00 53.07 C ATOM 17 CG ARG B 42 64.321 46.214 30.248 1.00 57.46 C ATOM 18 CD ARG B 42 65.656 46.915 30.498 1.00 60.54 C ATOM 19 NE ARG B 42 65.750 48.205 29.813 1.00 62.57 N ATOM 20 CZ ARG B 42 66.774 49.046 29.938 1.00 63.00 C ATOM 21 NH1 ARG B 42 67.797 48.729 30.723 1.00 62.08 N ATOM 22 NH2 ARG B 42 66.776 50.201 29.280 1.00 59.69 N ATOM 23 HE ARG B 42 64.966 48.482 29.188 1.00 0.00 H ATOM 24 HH12 ARG B 42 68.599 49.384 30.823 1.00 0.00 H ATOM 25 HH11 ARG B 42 67.797 47.826 31.238 1.00 0.00 H ATOM 26 HH22 ARG B 42 67.578 50.855 29.380 1.00 0.00 H ATOM 27 HH21 ARG B 42 65.975 50.450 28.665 1.00 0.00 H ATOM 28 H ARG B 42 63.653 43.248 32.969 1.00 0.00 H ATOM 29 N GLN B 43 61.104 45.009 31.903 1.00 49.99 N ATOM 30 CA GLN B 43 59.717 45.358 31.636 1.00 51.69 C ATOM 31 C GLN B 43 59.132 46.055 32.868 1.00 49.11 C ATOM 32 O GLN B 43 58.423 47.062 32.767 1.00 46.67 O ATOM 33 CB GLN B 43 58.905 44.091 31.325 1.00 51.89 C ATOM 34 CG GLN B 43 59.718 42.906 30.771 1.00 58.73 C ATOM 35 CD GLN B 43 60.505 42.144 31.846 1.00 59.96 C ATOM 36 OE1 GLN B 43 60.122 42.119 33.026 1.00 57.83 O ATOM 37 NE2 GLN B 43 61.610 41.520 31.438 1.00 51.58 N ATOM 38 HE22 GLN B 43 61.895 41.567 30.439 1.00 0.00 H ATOM 39 HE21 GLN B 43 62.187 40.986 32.119 1.00 0.00 H ATOM 40 H GLN B 43 61.380 44.007 31.868 1.00 0.00 H ATOM 41 N LEU B 44 59.451 45.505 34.032 1.00 46.56 N ATOM 42 CA LEU B 44 58.957 46.032 35.291 1.00 46.85 C ATOM 43 C LEU B 44 59.414 47.471 35.514 1.00 45.40 C ATOM 44 O LEU B 44 58.594 48.359 35.763 1.00 43.44 O ATOM 45 CB LEU B 44 59.428 45.149 36.442 1.00 47.52 C ATOM 46 CG LEU B 44 59.094 45.657 37.838 1.00 47.82 C ATOM 47 CD1 LEU B 44 57.582 45.762 37.999 1.00 47.83 C ATOM 48 CD2 LEU B 44 59.690 44.733 38.880 1.00 47.37 C ATOM 49 H LEU B 44 60.073 44.672 34.043 1.00 0.00 H ATOM 50 N ALA B 45 60.721 47.702 35.429 1.00 41.28 N ATOM 51 CA ALA B 45 61.267 49.010 35.750 1.00 42.48 C ATOM 52 C ALA B 45 60.705 50.079 34.819 1.00 42.56 C ATOM 53 O ALA B 45 60.369 51.185 35.249 1.00 37.48 O ATOM 54 CB ALA B 45 62.789 48.984 35.689 1.00 42.33 C ATOM 55 H ALA B 45 61.360 46.938 35.129 1.00 0.00 H ATOM 56 N GLU B 46 60.609 49.755 33.534 1.00 42.40 N ATOM 57 CA GLU B 46 60.103 50.719 32.576 1.00 42.96 C ATOM 58 C GLU B 46 58.649 51.078 32.879 1.00 36.78 C ATOM 59 O GLU B 46 58.275 52.249 32.849 1.00 37.35 O ATOM 60 CB GLU B 46 60.277 50.204 31.142 1.00 45.06 C ATOM 61 CG GLU B 46 61.742 50.054 30.737 1.00 49.09 C ATOM 62 CD GLU B 46 61.934 49.437 29.353 1.00 54.28 C ATOM 63 OE1 GLU B 46 60.933 49.198 28.642 1.00 51.79 O ATOM 64 OE2 GLU B 46 63.100 49.186 28.978 1.00 60.13 O ATOM 65 H GLU B 46 60.897 48.808 33.215 1.00 0.00 H ATOM 66 N GLU B 47 57.833 50.073 33.176 1.00 39.54 N ATOM 67 CA GLU B 47 56.422 50.309 33.473 1.00 37.93 C ATOM 68 C GLU B 47 56.259 51.111 34.775 1.00 35.97 C ATOM 69 O GLU B 47 55.440 52.025 34.859 1.00 36.23 O ATOM 70 CB GLU B 47 55.669 48.981 33.568 1.00 43.06 C ATOM 71 CG GLU B 47 54.180 49.122 33.867 1.00 48.95 C ATOM 72 CD GLU B 47 53.440 47.791 33.827 1.00 57.08 C ATOM 73 OE1 GLU B 47 53.642 47.023 32.858 1.00 63.72 O ATOM 74 OE2 GLU B 47 52.660 47.511 34.765 1.00 57.62 O ATOM 75 H GLU B 47 58.205 49.102 33.198 1.00 0.00 H ATOM 76 N TYR B 48 57.055 50.766 35.781 1.00 34.75 N ATOM 77 CA TYR B 48 56.976 51.416 37.090 1.00 32.08 C ATOM 78 C TYR B 48 57.412 52.878 36.983 1.00 33.85 C ATOM 79 O TYR B 48 56.744 53.791 37.473 1.00 32.66 O ATOM 80 CB TYR B 48 57.866 50.662 38.083 1.00 31.05 C ATOM 81 CG TYR B 48 57.667 51.011 39.548 1.00 33.01 C ATOM 82 CD1 TYR B 48 58.204 52.173 40.089 1.00 31.77 C ATOM 83 CD2 TYR B 48 56.965 50.154 40.396 1.00 30.73 C ATOM 84 CE1 TYR B 48 58.034 52.483 41.435 1.00 31.75 C ATOM 85 CE2 TYR B 48 56.793 50.450 41.747 1.00 30.07 C ATOM 86 CZ TYR B 48 57.328 51.620 42.254 1.00 33.15 C ATOM 87 OH TYR B 48 57.173 51.930 43.586 1.00 30.55 O ATOM 88 HH TYR B 48 57.585 51.220 44.139 1.00 0.00 H ATOM 89 H TYR B 48 57.755 50.011 35.634 1.00 0.00 H ATOM 90 N LEU B 49 58.531 53.106 36.305 1.00 32.22 N ATOM 91 CA LEU B 49 59.057 54.450 36.179 1.00 30.82 C ATOM 92 C LEU B 49 58.103 55.347 35.406 1.00 34.62 C ATOM 93 O LEU B 49 57.974 56.532 35.721 1.00 35.22 O ATOM 94 CB LEU B 49 60.426 54.424 35.504 1.00 35.73 C ATOM 95 CG LEU B 49 61.572 53.854 36.340 1.00 38.15 C ATOM 96 CD1 LEU B 49 62.823 53.760 35.474 1.00 39.53 C ATOM 97 CD2 LEU B 49 61.827 54.723 37.571 1.00 37.48 C ATOM 98 H LEU B 49 59.035 52.312 35.860 1.00 0.00 H ATOM 99 N TYR B 50 57.431 54.794 34.400 1.00 32.95 N ATOM 100 CA TYR B 50 56.466 55.587 33.645 1.00 35.81 C ATOM 101 C TYR B 50 55.233 55.850 34.489 1.00 34.25 C ATOM 102 O TYR B 50 54.778 56.992 34.614 1.00 36.55 O ATOM 103 CB TYR B 50 56.028 54.885 32.354 1.00 35.17 C ATOM 104 CG TYR B 50 54.822 55.546 31.699 1.00 37.77 C ATOM 105 CD1 TYR B 50 54.956 56.735 30.993 1.00 40.54 C ATOM 106 CD2 TYR B 50 53.544 54.986 31.802 1.00 43.43 C ATOM 107 CE1 TYR B 50 53.852 57.355 30.396 1.00 41.75 C ATOM 108 CE2 TYR B 50 52.430 55.598 31.202 1.00 41.76 C ATOM 109 CZ TYR B 50 52.598 56.783 30.502 1.00 43.86 C ATOM 110 OH TYR B 50 51.517 57.400 29.906 1.00 43.92 O ATOM 111 HH TYR B 50 51.819 58.227 29.454 1.00 0.00 H ATOM 112 H TYR B 50 57.593 53.797 34.152 1.00 0.00 H ATOM 113 N ARG B 51 54.675 54.776 35.036 1.00 31.32 N ATOM 114 CA ARG B 51 53.410 54.853 35.754 1.00 35.09 C ATOM 115 C ARG B 51 53.447 55.889 36.864 1.00 30.86 C ATOM 116 O ARG B 51 52.495 56.653 37.046 1.00 32.05 O ATOM 117 CB ARG B 51 53.053 53.495 36.352 1.00 32.72 C ATOM 118 CG ARG B 51 51.834 53.540 37.237 1.00 35.19 C ATOM 119 CD ARG B 51 51.597 52.211 37.929 1.00 36.46 C ATOM 120 NE ARG B 51 51.118 51.187 37.007 1.00 41.28 N ATOM 121 CZ ARG B 51 49.883 51.138 36.520 1.00 40.77 C ATOM 122 NH1 ARG B 51 48.993 52.071 36.847 1.00 38.78 N ATOM 123 NH2 ARG B 51 49.540 50.158 35.694 1.00 41.33 N ATOM 124 HE ARG B 51 51.787 50.447 36.712 1.00 0.00 H ATOM 125 HH12 ARG B 51 48.028 52.027 36.462 1.00 0.00 H ATOM 126 HH11 ARG B 51 49.262 52.845 37.488 1.00 0.00 H ATOM 127 HH22 ARG B 51 48.574 50.115 35.310 1.00 0.00 H ATOM 128 HH21 ARG B 51 50.237 49.432 35.430 1.00 0.00 H ATOM 129 H ARG B 51 55.153 53.857 34.949 1.00 0.00 H ATOM 130 N TYR B 52 54.546 55.923 37.604 1.00 30.90 N ATOM 131 CA TYR B 52 54.560 56.721 38.822 1.00 33.12 C ATOM 132 C TYR B 52 55.200 58.086 38.638 1.00 34.14 C ATOM 133 O TYR B 52 55.330 58.840 39.600 1.00 34.13 O ATOM 134 CB TYR B 52 55.153 55.931 40.001 1.00 29.82 C ATOM 135 CG TYR B 52 54.300 54.734 40.356 1.00 28.02 C ATOM 136 CD1 TYR B 52 53.015 54.902 40.897 1.00 28.62 C ATOM 137 CD2 TYR B 52 54.753 53.445 40.132 1.00 27.88 C ATOM 138 CE1 TYR B 52 52.221 53.816 41.201 1.00 26.64 C ATOM 139 CE2 TYR B 52 53.971 52.352 40.428 1.00 28.98 C ATOM 140 CZ TYR B 52 52.708 52.543 40.979 1.00 27.73 C ATOM 141 OH TYR B 52 51.932 51.456 41.265 1.00 30.66 O ATOM 142 HH TYR B 52 52.401 50.880 41.919 1.00 0.00 H ATOM 143 H TYR B 52 55.389 55.386 37.318 1.00 0.00 H ATOM 144 N GLY B 53 55.594 58.399 37.399 1.00 34.33 N ATOM 145 CA GLY B 53 55.949 59.759 37.023 1.00 36.55 C ATOM 146 C GLY B 53 57.427 60.089 36.890 1.00 38.01 C ATOM 147 O GLY B 53 57.790 61.213 36.538 1.00 38.40 O ATOM 148 H GLY B 53 55.648 57.647 36.682 1.00 0.00 H ATOM 149 N TYR B 54 58.281 59.109 37.159 1.00 34.99 N ATOM 150 CA TYR B 54 59.717 59.319 37.145 1.00 34.15 C ATOM 151 C TYR B 54 60.271 59.601 35.739 1.00 38.10 C ATOM 152 O TYR B 54 61.145 60.448 35.562 1.00 34.74 O ATOM 153 CB TYR B 54 60.398 58.103 37.760 1.00 35.21 C ATOM 154 CG TYR B 54 60.013 57.907 39.208 1.00 35.06 C ATOM 155 CD1 TYR B 54 60.665 58.607 40.213 1.00 36.66 C ATOM 156 CD2 TYR B 54 58.987 57.034 39.570 1.00 33.07 C ATOM 157 CE1 TYR B 54 60.316 58.443 41.546 1.00 36.78 C ATOM 158 CE2 TYR B 54 58.625 56.868 40.908 1.00 36.68 C ATOM 159 CZ TYR B 54 59.303 57.572 41.888 1.00 36.35 C ATOM 160 OH TYR B 54 58.979 57.417 43.216 1.00 34.47 O ATOM 161 HH TYR B 54 58.033 57.674 43.356 1.00 0.00 H ATOM 162 H TYR B 54 57.911 58.164 37.386 1.00 0.00 H ATOM 163 N THR B 55 59.754 58.893 34.746 1.00 35.46 N ATOM 164 CA THR B 55 60.203 59.103 33.375 1.00 37.66 C ATOM 165 C THR B 55 59.813 60.503 32.883 1.00 42.42 C ATOM 166 O THR B 55 60.589 61.167 32.196 1.00 43.48 O ATOM 167 CB THR B 55 59.659 58.006 32.436 1.00 36.53 C ATOM 168 OG1 THR B 55 60.130 56.722 32.879 1.00 36.73 O ATOM 169 CG2 THR B 55 60.106 58.250 30.984 1.00 44.47 C ATOM 170 HG1 THR B 55 59.781 56.018 32.277 1.00 0.00 H ATOM 171 H THR B 55 59.022 58.182 34.946 1.00 0.00 H ATOM 172 N ARG B 56 58.622 60.963 33.251 1.00 39.89 N ATOM 173 CA ARG B 56 58.151 62.276 32.812 1.00 39.53 C ATOM 174 C ARG B 56 59.004 63.398 33.405 1.00 44.41 C ATOM 175 O ARG B 56 59.264 64.408 32.750 1.00 46.91 O ATOM 176 CB ARG B 56 56.668 62.477 33.155 1.00 43.45 C ATOM 177 CG ARG B 56 56.042 63.678 32.457 1.00 47.14 C ATOM 178 CD ARG B 56 54.519 63.685 32.543 1.00 50.82 C ATOM 179 NE ARG B 56 53.919 62.452 32.032 1.00 52.20 N ATOM 180 CZ ARG B 56 53.476 61.461 32.803 1.00 51.08 C ATOM 181 NH1 ARG B 56 53.563 61.557 34.129 1.00 46.84 N ATOM 182 NH2 ARG B 56 52.944 60.376 32.251 1.00 45.78 N ATOM 183 HE ARG B 56 53.833 62.343 31.001 1.00 0.00 H ATOM 184 HH12 ARG B 56 53.217 60.782 34.730 1.00 0.00 H ATOM 185 HH11 ARG B 56 53.977 62.407 34.563 1.00 0.00 H ATOM 186 HH22 ARG B 56 52.598 59.602 32.854 1.00 0.00 H ATOM 187 HH21 ARG B 56 52.873 60.300 31.216 1.00 0.00 H ATOM 188 H ARG B 56 58.015 60.380 33.861 1.00 0.00 H ATOM 189 N VAL B 57 59.444 63.218 34.646 1.00 41.55 N ATOM 190 CA VAL B 57 60.333 64.183 35.275 1.00 41.93 C ATOM 191 C VAL B 57 61.725 64.123 34.665 1.00 48.02 C ATOM 192 O VAL B 57 62.328 65.162 34.377 1.00 47.04 O ATOM 193 CB VAL B 57 60.433 63.956 36.786 1.00 44.92 C ATOM 194 CG1 VAL B 57 61.521 64.853 37.388 1.00 45.48 C ATOM 195 CG2 VAL B 57 59.089 64.217 37.424 1.00 36.82 C ATOM 196 H VAL B 57 59.148 62.374 35.176 1.00 0.00 H ATOM 197 N ALA B 58 62.234 62.906 34.474 1.00 44.91 N ATOM 198 CA ALA B 58 63.549 62.721 33.860 1.00 46.63 C ATOM 199 C ALA B 58 63.588 63.448 32.524 1.00 46.76 C ATOM 200 O ALA B 58 64.569 64.122 32.189 1.00 51.02 O ATOM 201 CB ALA B 58 63.848 61.238 33.675 1.00 45.10 C ATOM 202 H ALA B 58 61.686 62.072 34.767 1.00 0.00 H ATOM 203 N GLU B 59 62.507 63.315 31.766 1.00 44.87 N ATOM 204 CA GLU B 59 62.397 63.963 30.464 1.00 47.90 C ATOM 205 C GLU B 59 62.387 65.490 30.592 1.00 51.06 C ATOM 206 O GLU B 59 61.781 66.049 31.513 1.00 48.13 O ATOM 207 CB GLU B 59 61.140 63.477 29.740 1.00 45.17 C ATOM 208 CG GLU B 59 61.155 61.988 29.397 1.00 43.94 C ATOM 209 CD GLU B 59 59.822 61.504 28.863 1.00 43.73 C ATOM 210 OE1 GLU B 59 58.830 62.265 28.957 1.00 48.30 O ATOM 211 OE2 GLU B 59 59.761 60.365 28.347 1.00 47.22 O ATOM 212 H GLU B 59 61.717 62.733 32.110 1.00 0.00 H TER 213 GLU B 59 ATOM 214 N SER B 66 68.547 56.950 29.006 1.00 52.55 N ATOM 215 CA SER B 66 68.665 55.724 29.800 1.00 48.52 C ATOM 216 C SER B 66 67.753 55.764 31.022 1.00 48.92 C ATOM 217 O SER B 66 67.077 56.767 31.266 1.00 45.52 O ATOM 218 CB SER B 66 70.111 55.504 30.249 1.00 47.55 C ATOM 219 OG SER B 66 70.927 55.103 29.155 1.00 62.16 O ATOM 220 HG SER B 66 71.856 54.967 29.470 1.00 0.00 H ATOM 221 HN3 SER B 66 68.813 57.768 29.591 1.00 0.00 H ATOM 222 HN2 SER B 66 67.565 57.059 28.683 1.00 0.00 H ATOM 223 HN1 SER B 66 69.180 56.891 28.183 1.00 0.00 H ATOM 224 N LEU B 67 67.755 54.679 31.793 1.00 45.95 N ATOM 225 CA LEU B 67 66.922 54.594 32.991 1.00 47.40 C ATOM 226 C LEU B 67 67.590 55.227 34.211 1.00 47.13 C ATOM 227 O LEU B 67 66.930 55.490 35.229 1.00 43.81 O ATOM 228 CB LEU B 67 66.579 53.136 33.300 1.00 46.75 C ATOM 229 CG LEU B 67 65.805 52.369 32.227 1.00 48.06 C ATOM 230 CD1 LEU B 67 65.564 50.924 32.676 1.00 48.92 C ATOM 231 CD2 LEU B 67 64.496 53.063 31.895 1.00 49.05 C ATOM 232 H LEU B 67 68.362 53.874 31.537 1.00 0.00 H ATOM 233 N GLY B 68 68.894 55.472 34.101 1.00 46.05 N ATOM 234 CA GLY B 68 69.703 55.938 35.217 1.00 47.53 C ATOM 235 C GLY B 68 69.126 57.103 36.001 1.00 48.73 C ATOM 236 O GLY B 68 68.804 56.963 37.191 1.00 46.96 O ATOM 237 H GLY B 68 69.353 55.324 33.180 1.00 0.00 H ATOM 238 N PRO B 69 69.007 58.271 35.347 1.00 48.08 N ATOM 239 CA PRO B 69 68.478 59.479 35.993 1.00 46.78 C ATOM 240 C PRO B 69 67.121 59.244 36.667 1.00 46.08 C ATOM 241 O PRO B 69 66.945 59.642 37.814 1.00 45.56 O ATOM 242 CB PRO B 69 68.336 60.460 34.827 1.00 46.78 C ATOM 243 CG PRO B 69 69.396 60.032 33.862 1.00 47.40 C ATOM 244 CD PRO B 69 69.454 58.532 33.965 1.00 47.53 C ATOM 245 N ALA B 70 66.184 58.612 35.965 1.00 42.45 N ATOM 246 CA ALA B 70 64.877 58.313 36.535 1.00 42.33 C ATOM 247 C ALA B 70 64.986 57.396 37.759 1.00 43.31 C ATOM 248 O ALA B 70 64.291 57.591 38.763 1.00 40.41 O ATOM 249 CB ALA B 70 63.966 57.694 35.482 1.00 41.70 C ATOM 250 H ALA B 70 66.389 58.325 34.987 1.00 0.00 H ATOM 251 N LEU B 71 65.859 56.398 37.670 1.00 41.20 N ATOM 252 CA LEU B 71 66.078 55.474 38.772 1.00 42.74 C ATOM 253 C LEU B 71 66.627 56.206 39.985 1.00 45.37 C ATOM 254 O LEU B 71 66.276 55.891 41.123 1.00 40.40 O ATOM 255 CB LEU B 71 67.043 54.363 38.360 1.00 43.84 C ATOM 256 CG LEU B 71 66.440 53.199 37.575 1.00 44.28 C ATOM 257 CD1 LEU B 71 67.540 52.265 37.081 1.00 48.61 C ATOM 258 CD2 LEU B 71 65.437 52.442 38.426 1.00 44.87 C ATOM 259 H LEU B 71 66.399 56.274 36.790 1.00 0.00 H ATOM 260 N LEU B 72 67.505 57.177 39.744 1.00 43.29 N ATOM 261 CA LEU B 72 68.035 57.975 40.843 1.00 45.98 C ATOM 262 C LEU B 72 66.898 58.758 41.494 1.00 44.11 C ATOM 263 O LEU B 72 66.810 58.829 42.719 1.00 44.78 O ATOM 264 CB LEU B 72 69.143 58.911 40.357 1.00 46.23 C ATOM 265 CG LEU B 72 70.480 58.826 41.105 1.00 51.93 C ATOM 266 CD1 LEU B 72 70.570 59.861 42.216 1.00 54.38 C ATOM 267 CD2 LEU B 72 70.721 57.425 41.651 1.00 51.48 C ATOM 268 H LEU B 72 67.814 57.367 38.769 1.00 0.00 H ATOM 269 N LEU B 73 66.028 59.334 40.666 1.00 41.73 N ATOM 270 CA LEU B 73 64.845 60.035 41.150 1.00 42.58 C ATOM 271 C LEU B 73 64.013 59.126 42.049 1.00 41.31 C ATOM 272 O LEU B 73 63.520 59.550 43.100 1.00 38.04 O ATOM 273 CB LEU B 73 63.988 60.507 39.975 1.00 42.54 C ATOM 274 CG LEU B 73 64.563 61.604 39.082 1.00 47.51 C ATOM 275 CD1 LEU B 73 63.665 61.810 37.864 1.00 45.64 C ATOM 276 CD2 LEU B 73 64.727 62.896 39.865 1.00 46.16 C ATOM 277 H LEU B 73 66.198 59.282 39.641 1.00 0.00 H ATOM 278 N LEU B 74 63.857 57.876 41.621 1.00 37.23 N ATOM 279 CA LEU B 74 63.009 56.916 42.318 1.00 39.02 C ATOM 280 C LEU B 74 63.614 56.532 43.661 1.00 40.75 C ATOM 281 O LEU B 74 62.922 56.472 44.682 1.00 38.43 O ATOM 282 CB LEU B 74 62.797 55.672 41.448 1.00 37.44 C ATOM 283 CG LEU B 74 62.053 54.465 42.016 1.00 36.84 C ATOM 284 CD1 LEU B 74 61.540 53.572 40.893 1.00 36.27 C ATOM 285 CD2 LEU B 74 62.921 53.665 42.965 1.00 39.87 C ATOM 286 H LEU B 74 64.357 57.573 40.761 1.00 0.00 H ATOM 287 N GLN B 75 64.915 56.277 43.654 1.00 39.68 N ATOM 288 CA GLN B 75 65.600 55.822 44.853 1.00 41.50 C ATOM 289 C GLN B 75 65.574 56.854 45.971 1.00 39.84 C ATOM 290 O GLN B 75 65.418 56.499 47.141 1.00 40.98 O ATOM 291 CB GLN B 75 67.037 55.407 44.527 1.00 44.22 C ATOM 292 CG GLN B 75 67.129 54.009 43.950 1.00 44.62 C ATOM 293 CD GLN B 75 68.262 53.861 42.952 1.00 47.51 C ATOM 294 OE1 GLN B 75 69.008 54.808 42.695 1.00 46.90 O ATOM 295 NE2 GLN B 75 68.390 52.670 42.379 1.00 47.02 N ATOM 296 HE22 GLN B 75 67.736 51.900 42.628 1.00 0.00 H ATOM 297 HE21 GLN B 75 69.144 52.507 41.681 1.00 0.00 H ATOM 298 H GLN B 75 65.455 56.405 42.775 1.00 0.00 H ATOM 299 N LYS B 76 65.714 58.129 45.636 1.00 40.09 N ATOM 300 CA LYS B 76 65.631 59.126 46.697 1.00 43.27 C ATOM 301 C LYS B 76 64.180 59.389 47.090 1.00 41.72 C ATOM 302 O LYS B 76 63.894 59.701 48.247 1.00 43.70 O ATOM 303 CB LYS B 76 66.385 60.414 46.360 1.00 47.30 C ATOM 304 CG LYS B 76 65.754 61.291 45.314 1.00 47.20 C ATOM 305 CD LYS B 76 66.746 62.362 44.910 1.00 52.03 C ATOM 306 CE LYS B 76 68.079 61.723 44.497 1.00 55.02 C ATOM 307 NZ LYS B 76 69.111 62.725 44.104 1.00 58.05 N ATOM 308 HZ1 LYS B 76 68.763 63.280 43.296 1.00 0.00 H ATOM 309 HZ2 LYS B 76 69.300 63.359 44.906 1.00 0.00 H ATOM 310 HZ3 LYS B 76 69.987 62.232 43.836 1.00 0.00 H ATOM 311 H LYS B 76 65.878 58.409 44.648 1.00 0.00 H ATOM 312 N GLN B 77 63.268 59.229 46.134 1.00 40.40 N ATOM 313 CA GLN B 77 61.841 59.338 46.419 1.00 43.87 C ATOM 314 C GLN B 77 61.380 58.302 47.436 1.00 39.58 C ATOM 315 O GLN B 77 60.582 58.609 48.312 1.00 39.28 O ATOM 316 CB GLN B 77 61.009 59.188 45.142 1.00 43.02 C ATOM 317 CG GLN B 77 60.372 60.479 44.664 1.00 46.87 C ATOM 318 CD GLN B 77 59.696 61.256 45.782 1.00 49.97 C ATOM 319 OE1 GLN B 77 59.923 62.456 45.932 1.00 52.29 O ATOM 320 NE2 GLN B 77 58.861 60.576 46.573 1.00 48.52 N ATOM 321 HE22 GLN B 77 58.699 59.562 46.409 1.00 0.00 H ATOM 322 HE21 GLN B 77 58.373 61.061 47.353 1.00 0.00 H ATOM 323 H GLN B 77 63.579 59.022 45.163 1.00 0.00 H ATOM 324 N LEU B 78 61.866 57.072 47.305 1.00 35.78 N ATOM 325 CA LEU B 78 61.455 55.987 48.191 1.00 36.58 C ATOM 326 C LEU B 78 62.460 55.753 49.315 1.00 38.77 C ATOM 327 O LEU B 78 62.330 54.802 50.089 1.00 36.62 O ATOM 328 CB LEU B 78 61.266 54.691 47.404 1.00 37.42 C ATOM 329 CG LEU B 78 60.247 54.703 46.263 1.00 36.75 C ATOM 330 CD1 LEU B 78 60.147 53.323 45.657 1.00 38.41 C ATOM 331 CD2 LEU B 78 58.880 55.157 46.767 1.00 38.47 C ATOM 332 H LEU B 78 62.557 56.877 46.552 1.00 0.00 H ATOM 333 N SER B 79 63.460 56.623 49.400 1.00 39.36 N ATOM 334 CA SER B 79 64.536 56.461 50.375 1.00 40.41 C ATOM 335 C SER B 79 65.266 55.121 50.225 1.00 41.58 C ATOM 336 O SER B 79 65.526 54.420 51.207 1.00 42.93 O ATOM 337 CB SER B 79 64.008 56.653 51.799 1.00 39.16 C ATOM 338 OG SER B 79 63.672 58.013 51.997 1.00 35.76 O ATOM 339 HG SER B 79 62.974 58.277 51.347 1.00 0.00 H ATOM 340 H SER B 79 63.478 57.440 48.757 1.00 0.00 H ATOM 341 N LEU B 80 65.588 54.771 48.984 1.00 42.35 N ATOM 342 CA LEU B 80 66.410 53.597 48.713 1.00 45.15 C ATOM 343 C LEU B 80 67.855 54.049 48.554 1.00 43.11 C ATOM 344 O LEU B 80 68.110 55.238 48.387 1.00 41.87 O ATOM 345 CB LEU B 80 65.947 52.899 47.435 1.00 42.65 C ATOM 346 CG LEU B 80 64.480 52.500 47.357 1.00 41.68 C ATOM 347 CD1 LEU B 80 64.134 51.975 45.973 1.00 44.99 C ATOM 348 CD2 LEU B 80 64.146 51.470 48.434 1.00 44.58 C ATOM 349 H LEU B 80 65.246 55.347 48.188 1.00 0.00 H ATOM 350 N PRO B 81 68.808 53.104 48.631 1.00 48.33 N ATOM 351 CA PRO B 81 70.195 53.406 48.240 1.00 48.89 C ATOM 352 C PRO B 81 70.222 54.039 46.845 1.00 48.30 C ATOM 353 O PRO B 81 69.710 53.443 45.891 1.00 48.00 O ATOM 354 CB PRO B 81 70.852 52.026 48.201 1.00 46.95 C ATOM 355 CG PRO B 81 70.076 51.213 49.201 1.00 50.16 C ATOM 356 CD PRO B 81 68.655 51.725 49.137 1.00 47.19 C ATOM 357 N GLU B 82 70.811 55.227 46.733 1.00 48.71 N ATOM 358 CA GLU B 82 70.752 56.002 45.496 1.00 49.62 C ATOM 359 C GLU B 82 71.856 55.623 44.501 1.00 51.76 C ATOM 360 O GLU B 82 72.830 56.356 44.321 1.00 51.46 O ATOM 361 CB GLU B 82 70.782 57.497 45.821 1.00 51.74 C ATOM 362 CG GLU B 82 69.717 57.905 46.843 1.00 50.11 C ATOM 363 CD GLU B 82 69.679 59.402 47.109 1.00 55.76 C ATOM 364 OE1 GLU B 82 70.194 60.173 46.267 1.00 56.60 O ATOM 365 OE2 GLU B 82 69.124 59.804 48.162 1.00 58.23 O ATOM 366 H GLU B 82 71.327 55.614 47.548 1.00 0.00 H ATOM 367 N THR B 83 71.678 54.481 43.844 1.00 51.45 N ATOM 368 CA THR B 83 72.720 53.899 43.003 1.00 52.04 C ATOM 369 C THR B 83 72.617 54.317 41.537 1.00 53.78 C ATOM 370 O THR B 83 73.635 54.524 40.864 1.00 52.01 O ATOM 371 CB THR B 83 72.696 52.361 43.084 1.00 50.82 C ATOM 372 OG1 THR B 83 71.500 51.864 42.470 1.00 50.59 O ATOM 373 CG2 THR B 83 72.748 51.903 44.530 1.00 48.85 C ATOM 374 HG1 THR B 83 71.489 50.876 42.524 1.00 0.00 H ATOM 375 H THR B 83 70.767 53.986 43.932 1.00 0.00 H ATOM 376 N GLY B 84 71.391 54.442 41.043 1.00 51.35 N ATOM 377 CA GLY B 84 71.170 54.736 39.640 1.00 50.38 C ATOM 378 C GLY B 84 71.134 53.447 38.847 1.00 49.10 C ATOM 379 O GLY B 84 71.192 53.459 37.618 1.00 49.39 O ATOM 380 H GLY B 84 70.573 54.327 41.675 1.00 0.00 H ATOM 381 N GLU B 85 71.038 52.328 39.561 1.00 50.50 N ATOM 382 CA GLU B 85 70.988 51.015 38.928 1.00 52.68 C ATOM 383 C GLU B 85 69.717 50.243 39.266 1.00 51.73 C ATOM 384 O GLU B 85 69.208 50.321 40.382 1.00 50.61 O ATOM 385 CB GLU B 85 72.205 50.180 39.328 1.00 55.08 C ATOM 386 CG GLU B 85 73.506 50.618 38.673 1.00 57.47 C ATOM 387 CD GLU B 85 74.651 49.659 38.962 1.00 64.44 C ATOM 388 OE1 GLU B 85 74.439 48.694 39.729 1.00 64.06 O ATOM 389 OE2 GLU B 85 75.761 49.868 38.423 1.00 65.34 O ATOM 390 H GLU B 85 70.998 52.392 40.598 1.00 0.00 H ATOM 391 N LEU B 86 69.219 49.492 38.290 1.00 49.96 N ATOM 392 CA LEU B 86 68.119 48.565 38.513 1.00 51.11 C ATOM 393 C LEU B 86 68.615 47.448 39.434 1.00 53.54 C ATOM 394 O LEU B 86 68.623 46.272 39.064 1.00 52.64 O ATOM 395 CB LEU B 86 67.624 48.015 37.168 1.00 50.03 C ATOM 396 CG LEU B 86 66.357 47.162 37.046 1.00 50.58 C ATOM 397 CD1 LEU B 86 65.719 47.357 35.681 1.00 48.81 C ATOM 398 CD2 LEU B 86 66.657 45.690 37.261 1.00 59.14 C ATOM 399 H LEU B 86 69.628 49.569 37.337 1.00 0.00 H ATOM 400 N ASP B 87 69.040 47.830 40.638 1.00 51.42 N ATOM 401 CA ASP B 87 69.630 46.882 41.583 1.00 50.45 C ATOM 402 C ASP B 87 68.608 46.136 42.443 1.00 53.03 C ATOM 403 O ASP B 87 67.404 46.394 42.380 1.00 50.53 O ATOM 404 CB ASP B 87 70.662 47.577 42.475 1.00 52.25 C ATOM 405 CG ASP B 87 70.069 48.717 43.280 1.00 53.63 C ATOM 406 OD1 ASP B 87 68.865 48.649 43.613 1.00 52.44 O ATOM 407 OD2 ASP B 87 70.809 49.680 43.581 1.00 52.98 O ATOM 408 H ASP B 87 68.950 48.829 40.913 1.00 0.00 H ATOM 409 N SER B 88 69.110 45.215 43.258 1.00 50.53 N ATOM 410 CA SER B 88 68.260 44.294 44.000 1.00 49.93 C ATOM 411 C SER B 88 67.203 45.010 44.842 1.00 49.41 C ATOM 412 O SER B 88 66.012 44.696 44.762 1.00 48.89 O ATOM 413 CB SER B 88 69.122 43.390 44.883 1.00 52.57 C ATOM 414 OG SER B 88 68.365 42.305 45.388 1.00 54.31 O ATOM 415 HG SER B 88 68.944 41.736 45.955 1.00 0.00 H ATOM 416 H SER B 88 70.142 45.150 43.370 1.00 0.00 H ATOM 417 N ALA B 89 67.645 45.969 45.650 1.00 49.43 N ATOM 418 CA ALA B 89 66.747 46.695 46.541 1.00 49.69 C ATOM 419 C ALA B 89 65.706 47.447 45.725 1.00 46.30 C ATOM 420 O ALA B 89 64.531 47.512 46.095 1.00 47.36 O ATOM 421 CB ALA B 89 67.539 47.657 47.421 1.00 47.80 C ATOM 422 H ALA B 89 68.657 46.208 45.647 1.00 0.00 H ATOM 423 N THR B 90 66.150 48.012 44.610 1.00 47.10 N ATOM 424 CA THR B 90 65.268 48.751 43.717 1.00 46.43 C ATOM 425 C THR B 90 64.180 47.869 43.100 1.00 45.26 C ATOM 426 O THR B 90 63.019 48.273 43.018 1.00 39.20 O ATOM 427 CB THR B 90 66.062 49.450 42.614 1.00 47.86 C ATOM 428 OG1 THR B 90 66.971 50.389 43.208 1.00 49.95 O ATOM 429 CG2 THR B 90 65.121 50.173 41.659 1.00 43.03 C ATOM 430 HG1 THR B 90 67.592 49.909 43.811 1.00 0.00 H ATOM 431 H THR B 90 67.157 47.925 44.366 1.00 0.00 H ATOM 432 N LEU B 91 64.557 46.666 42.675 1.00 45.15 N ATOM 433 CA LEU B 91 63.602 45.695 42.147 1.00 44.19 C ATOM 434 C LEU B 91 62.622 45.195 43.206 1.00 42.55 C ATOM 435 O LEU B 91 61.432 45.037 42.937 1.00 41.55 O ATOM 436 CB LEU B 91 64.339 44.502 41.540 1.00 46.64 C ATOM 437 CG LEU B 91 64.993 44.764 40.187 1.00 51.16 C ATOM 438 CD1 LEU B 91 65.792 43.542 39.747 1.00 52.09 C ATOM 439 CD2 LEU B 91 63.934 45.134 39.156 1.00 49.61 C ATOM 440 H LEU B 91 65.564 46.409 42.720 1.00 0.00 H ATOM 441 N LYS B 92 63.125 44.920 44.405 1.00 42.66 N ATOM 442 CA LYS B 92 62.252 44.513 45.491 1.00 44.32 C ATOM 443 C LYS B 92 61.196 45.595 45.707 1.00 41.30 C ATOM 444 O LYS B 92 60.013 45.295 45.829 1.00 43.23 O ATOM 445 CB LYS B 92 63.044 44.299 46.778 1.00 47.00 C ATOM 446 CG LYS B 92 62.177 43.891 47.953 1.00 49.21 C ATOM 447 CD LYS B 92 62.918 44.042 49.269 1.00 53.06 C ATOM 448 CE LYS B 92 61.967 43.857 50.444 1.00 52.41 C ATOM 449 NZ LYS B 92 62.620 44.166 51.752 1.00 61.37 N ATOM 450 HZ1 LYS B 92 63.433 43.532 51.890 1.00 0.00 H ATOM 451 HZ2 LYS B 92 62.945 45.154 51.751 1.00 0.00 H ATOM 452 HZ3 LYS B 92 61.935 44.026 52.522 1.00 0.00 H ATOM 453 H LYS B 92 64.150 44.997 44.566 1.00 0.00 H ATOM 454 N ALA B 93 61.636 46.852 45.739 1.00 40.41 N ATOM 455 CA ALA B 93 60.735 47.992 45.877 1.00 39.35 C ATOM 456 C ALA B 93 59.636 47.961 44.817 1.00 37.70 C ATOM 457 O ALA B 93 58.449 47.993 45.140 1.00 34.40 O ATOM 458 CB ALA B 93 61.515 49.296 45.796 1.00 39.34 C ATOM 459 H ALA B 93 62.658 47.027 45.663 1.00 0.00 H ATOM 460 N MET B 94 60.041 47.882 43.553 1.00 37.03 N ATOM 461 CA MET B 94 59.103 47.877 42.433 1.00 35.94 C ATOM 462 C MET B 94 58.111 46.722 42.470 1.00 35.70 C ATOM 463 O MET B 94 57.008 46.847 41.934 1.00 36.37 O ATOM 464 CB MET B 94 59.854 47.866 41.101 1.00 34.17 C ATOM 465 CG MET B 94 60.633 49.136 40.805 1.00 34.31 C ATOM 466 SD MET B 94 61.734 48.904 39.384 1.00 39.21 S ATOM 467 CE MET B 94 62.311 50.577 39.154 1.00 34.05 C ATOM 468 H MET B 94 61.060 47.822 43.355 1.00 0.00 H ATOM 469 N ARG B 95 58.501 45.603 43.086 1.00 32.93 N ATOM 470 CA ARG B 95 57.622 44.437 43.210 1.00 36.61 C ATOM 471 C ARG B 95 56.657 44.547 44.388 1.00 36.46 C ATOM 472 O ARG B 95 55.739 43.738 44.512 1.00 35.58 O ATOM 473 CB ARG B 95 58.427 43.140 43.367 1.00 40.96 C ATOM 474 CG ARG B 95 59.158 42.696 42.119 1.00 44.40 C ATOM 475 CD ARG B 95 59.929 41.401 42.348 1.00 46.24 C ATOM 476 NE ARG B 95 60.934 41.223 41.303 1.00 52.61 N ATOM 477 CZ ARG B 95 62.244 41.163 41.523 1.00 53.23 C ATOM 478 NH1 ARG B 95 62.721 41.240 42.762 1.00 51.29 N ATOM 479 NH2 ARG B 95 63.075 41.015 40.501 1.00 54.67 N ATOM 480 HE ARG B 95 60.603 41.137 40.321 1.00 0.00 H ATOM 481 HH12 ARG B 95 63.747 41.193 42.928 1.00 0.00 H ATOM 482 HH11 ARG B 95 62.069 41.348 43.565 1.00 0.00 H ATOM 483 HH22 ARG B 95 64.101 40.967 40.667 1.00 0.00 H ATOM 484 HH21 ARG B 95 62.702 40.946 39.533 1.00 0.00 H ATOM 485 H ARG B 95 59.458 45.558 43.490 1.00 0.00 H ATOM 486 N THR B 96 56.874 45.530 45.258 1.00 32.85 N ATOM 487 CA THR B 96 56.043 45.672 46.454 1.00 33.24 C ATOM 488 C THR B 96 54.712 46.339 46.118 1.00 31.38 C ATOM 489 O THR B 96 54.683 47.381 45.452 1.00 30.72 O ATOM 490 CB THR B 96 56.765 46.476 47.540 1.00 34.12 C ATOM 491 OG1 THR B 96 58.083 45.940 47.728 1.00 36.12 O ATOM 492 CG2 THR B 96 55.996 46.425 48.856 1.00 34.36 C ATOM 493 HG1 THR B 96 58.587 46.001 46.878 1.00 0.00 H ATOM 494 H THR B 96 57.645 46.207 45.086 1.00 0.00 H ATOM 495 N PRO B 97 53.601 45.724 46.558 1.00 32.15 N ATOM 496 CA PRO B 97 52.267 46.309 46.379 1.00 31.41 C ATOM 497 C PRO B 97 52.231 47.728 46.927 1.00 29.63 C ATOM 498 O PRO B 97 52.855 48.014 47.950 1.00 28.90 O ATOM 499 CB PRO B 97 51.373 45.388 47.201 1.00 32.71 C ATOM 500 CG PRO B 97 52.071 44.058 47.118 1.00 35.39 C ATOM 501 CD PRO B 97 53.538 44.391 47.183 1.00 33.73 C ATOM 502 N ARG B 98 51.512 48.615 46.249 1.00 27.24 N ATOM 503 CA ARG B 98 51.606 50.032 46.577 1.00 26.67 C ATOM 504 C ARG B 98 50.397 50.828 46.115 1.00 28.38 C ATOM 505 O ARG B 98 49.482 50.289 45.491 1.00 27.19 O ATOM 506 CB ARG B 98 52.865 50.645 45.964 1.00 27.54 C ATOM 507 CG ARG B 98 52.886 50.675 44.417 1.00 25.92 C ATOM 508 CD ARG B 98 53.842 51.759 43.899 1.00 25.49 C ATOM 509 NE ARG B 98 53.256 53.090 44.037 1.00 25.73 N ATOM 510 CZ ARG B 98 53.949 54.221 44.108 1.00 24.70 C ATOM 511 NH1 ARG B 98 55.279 54.196 44.058 1.00 27.14 N ATOM 512 NH2 ARG B 98 53.306 55.383 44.237 1.00 25.36 N ATOM 513 HE ARG B 98 52.219 53.157 44.083 1.00 0.00 H ATOM 514 HH12 ARG B 98 55.818 55.084 44.114 1.00 0.00 H ATOM 515 HH11 ARG B 98 55.779 53.289 43.963 1.00 0.00 H ATOM 516 HH22 ARG B 98 53.844 56.271 44.293 1.00 0.00 H ATOM 517 HH21 ARG B 98 52.267 55.400 44.281 1.00 0.00 H ATOM 518 H ARG B 98 50.882 48.299 45.484 1.00 0.00 H ATOM 519 N CYS B 99 50.422 52.123 46.421 1.00 26.93 N ATOM 520 CA CYS B 99 49.352 53.027 46.046 1.00 27.72 C ATOM 521 C CYS B 99 49.479 53.356 44.568 1.00 24.62 C ATOM 522 O CYS B 99 50.585 53.539 44.074 1.00 28.75 O ATOM 523 CB CYS B 99 49.456 54.320 46.843 1.00 25.41 C ATOM 524 SG CYS B 99 48.211 55.550 46.410 1.00 25.01 S ATOM 525 H CYS B 99 51.237 52.499 46.947 1.00 0.00 H ATOM 526 N GLY B 100 48.339 53.463 43.891 1.00 27.22 N ATOM 527 CA GLY B 100 48.304 53.756 42.472 1.00 25.64 C ATOM 528 C GLY B 100 48.534 55.214 42.109 1.00 27.05 C ATOM 529 O GLY B 100 48.686 55.551 40.932 1.00 31.67 O ATOM 530 H GLY B 100 47.441 53.332 44.398 1.00 0.00 H ATOM 531 N VAL B 101 48.577 56.089 43.106 1.00 26.02 N ATOM 532 CA VAL B 101 48.826 57.507 42.849 1.00 27.28 C ATOM 533 C VAL B 101 50.288 57.742 42.464 1.00 26.28 C ATOM 534 O VAL B 101 51.189 57.207 43.094 1.00 25.77 O ATOM 535 CB VAL B 101 48.470 58.344 44.093 1.00 24.51 C ATOM 536 CG1 VAL B 101 48.967 59.807 43.951 1.00 25.04 C ATOM 537 CG2 VAL B 101 46.964 58.256 44.368 1.00 23.69 C ATOM 538 H VAL B 101 48.432 55.762 44.083 1.00 0.00 H ATOM 539 N PRO B 102 50.540 58.518 41.393 1.00 29.34 N ATOM 540 CA PRO B 102 51.944 58.758 41.028 1.00 31.66 C ATOM 541 C PRO B 102 52.701 59.575 42.085 1.00 31.58 C ATOM 542 O PRO B 102 52.081 60.314 42.854 1.00 32.71 O ATOM 543 CB PRO B 102 51.841 59.536 39.704 1.00 31.83 C ATOM 544 CG PRO B 102 50.509 59.145 39.129 1.00 31.00 C ATOM 545 CD PRO B 102 49.602 58.968 40.345 1.00 32.45 C ATOM 546 N ASP B 103 54.020 59.437 42.118 1.00 27.89 N ATOM 547 CA ASP B 103 54.850 60.128 43.103 1.00 32.51 C ATOM 548 C ASP B 103 55.296 61.503 42.591 1.00 38.00 C ATOM 549 O ASP B 103 55.555 62.416 43.381 1.00 33.99 O ATOM 550 CB ASP B 103 56.072 59.277 43.468 1.00 33.91 C ATOM 551 CG ASP B 103 55.703 57.867 43.907 1.00 33.04 C ATOM 552 OD1 ASP B 103 54.661 57.710 44.565 1.00 29.46 O ATOM 553 OD2 ASP B 103 56.455 56.912 43.601 1.00 30.00 O ATOM 554 H ASP B 103 54.478 58.817 41.420 1.00 0.00 H ATOM 555 N LEU B 104 55.387 61.638 41.267 1.00 37.41 N ATOM 556 CA LEU B 104 55.844 62.877 40.623 1.00 41.47 C ATOM 557 C LEU B 104 55.227 63.034 39.232 1.00 42.60 C ATOM 558 O LEU B 104 54.393 62.237 38.811 1.00 41.40 O ATOM 559 CB LEU B 104 57.369 62.880 40.437 1.00 41.65 C ATOM 560 CG LEU B 104 58.405 62.543 41.513 1.00 45.51 C ATOM 561 CD1 LEU B 104 58.318 61.086 41.924 1.00 44.82 C ATOM 562 CD2 LEU B 104 59.804 62.852 41.012 1.00 45.29 C ATOM 563 H LEU B 104 55.123 60.832 40.665 1.00 0.00 H ATOM 564 N GLY B 105 55.675 64.061 38.514 1.00 48.71 N ATOM 565 CA GLY B 105 55.360 64.216 37.103 1.00 47.58 C ATOM 566 C GLY B 105 53.884 64.199 36.748 1.00 49.65 C ATOM 567 O GLY B 105 53.507 63.705 35.681 1.00 50.25 O ATOM 568 H GLY B 105 56.270 64.777 38.978 1.00 0.00 H ATOM 569 N ARG B 106 53.045 64.742 37.629 1.00 47.20 N ATOM 570 CA ARG B 106 51.616 64.829 37.351 1.00 51.20 C ATOM 571 C ARG B 106 51.346 65.819 36.212 1.00 51.39 C ATOM 572 O ARG B 106 50.559 65.540 35.303 1.00 55.14 O ATOM 573 CB ARG B 106 50.827 65.220 38.615 1.00 46.16 C ATOM 574 CG ARG B 106 50.300 64.049 39.459 1.00 44.43 C ATOM 575 CD ARG B 106 51.361 63.475 40.405 1.00 44.30 C ATOM 576 NE ARG B 106 51.901 64.486 41.315 1.00 46.00 N ATOM 577 CZ ARG B 106 51.824 64.429 42.644 1.00 44.02 C ATOM 578 NH1 ARG B 106 51.233 63.395 43.235 1.00 42.84 N ATOM 579 NH2 ARG B 106 52.345 65.404 43.385 1.00 43.21 N ATOM 580 HE ARG B 106 52.379 65.308 40.894 1.00 0.00 H ATOM 581 HH12 ARG B 106 51.174 63.353 44.272 1.00 0.00 H ATOM 582 HH11 ARG B 106 50.829 62.628 42.660 1.00 0.00 H ATOM 583 HH22 ARG B 106 52.284 65.358 44.422 1.00 0.00 H ATOM 584 HH21 ARG B 106 52.813 66.212 42.927 1.00 0.00 H ATOM 585 H ARG B 106 53.415 65.110 38.529 1.00 0.00 H TER 586 ARG B 106 ATOM 587 N PHE B 110 43.996 68.852 37.428 1.00 42.49 N ATOM 588 CA PHE B 110 42.967 68.979 38.458 1.00 36.47 C ATOM 589 C PHE B 110 42.486 70.404 38.647 1.00 39.29 C ATOM 590 O PHE B 110 43.195 71.366 38.346 1.00 43.48 O ATOM 591 CB PHE B 110 43.453 68.415 39.796 1.00 34.73 C ATOM 592 CG PHE B 110 43.681 66.945 39.766 1.00 34.04 C ATOM 593 CD1 PHE B 110 42.628 66.077 39.525 1.00 32.59 C ATOM 594 CD2 PHE B 110 44.945 66.422 39.967 1.00 33.36 C ATOM 595 CE1 PHE B 110 42.830 64.705 39.488 1.00 33.73 C ATOM 596 CE2 PHE B 110 45.158 65.055 39.935 1.00 34.20 C ATOM 597 CZ PHE B 110 44.103 64.192 39.687 1.00 31.79 C ATOM 598 HN3 PHE B 110 44.820 69.431 37.689 1.00 0.00 H ATOM 599 HN2 PHE B 110 43.615 69.180 36.517 1.00 0.00 H ATOM 600 HN1 PHE B 110 44.283 67.856 37.347 1.00 0.00 H ATOM 601 N GLU B 111 41.266 70.517 39.153 1.00 38.84 N ATOM 602 CA GLU B 111 40.612 71.791 39.362 1.00 42.63 C ATOM 603 C GLU B 111 40.908 72.336 40.755 1.00 41.75 C ATOM 604 O GLU B 111 40.788 71.624 41.760 1.00 35.87 O ATOM 605 CB GLU B 111 39.109 71.614 39.182 1.00 44.66 C ATOM 606 CG GLU B 111 38.367 72.841 38.708 1.00 50.30 C ATOM 607 CD GLU B 111 37.047 72.480 38.053 1.00 55.61 C ATOM 608 OE1 GLU B 111 36.984 71.413 37.398 1.00 56.74 O ATOM 609 OE2 GLU B 111 36.073 73.253 38.199 1.00 59.41 O ATOM 610 H GLU B 111 40.755 69.649 39.412 1.00 0.00 H ATOM 611 N GLY B 112 41.307 73.603 40.799 1.00 38.10 N ATOM 612 CA GLY B 112 41.430 74.321 42.049 1.00 38.27 C ATOM 613 C GLY B 112 42.699 74.135 42.865 1.00 34.52 C ATOM 614 O GLY B 112 43.760 73.757 42.361 1.00 35.31 O ATOM 615 H GLY B 112 41.537 74.092 39.910 1.00 0.00 H ATOM 616 N ASP B 113 42.532 74.395 44.158 1.00 33.57 N ATOM 617 CA ASP B 113 43.576 74.497 45.170 1.00 36.86 C ATOM 618 C ASP B 113 44.155 73.161 45.668 1.00 33.24 C ATOM 619 O ASP B 113 45.235 73.125 46.268 1.00 33.98 O ATOM 620 CB ASP B 113 42.921 75.170 46.378 1.00 36.90 C ATOM 621 CG ASP B 113 43.800 76.177 47.013 1.00 42.09 C ATOM 622 OD1 ASP B 113 44.820 76.540 46.384 1.00 46.53 O ATOM 623 OD2 ASP B 113 43.462 76.614 48.128 1.00 44.85 O ATOM 624 H ASP B 113 41.554 74.541 44.481 1.00 0.00 H ATOM 625 N LEU B 114 43.401 72.086 45.468 1.00 30.76 N ATOM 626 CA LEU B 114 43.742 70.756 45.988 1.00 28.04 C ATOM 627 C LEU B 114 43.702 70.690 47.523 1.00 29.56 C ATOM 628 O LEU B 114 44.378 69.865 48.140 1.00 27.10 O ATOM 629 CB LEU B 114 45.077 70.263 45.435 1.00 30.82 C ATOM 630 CG LEU B 114 45.194 70.371 43.909 1.00 31.95 C ATOM 631 CD1 LEU B 114 46.359 69.528 43.413 1.00 34.61 C ATOM 632 CD2 LEU B 114 43.892 69.944 43.236 1.00 29.98 C ATOM 633 H LEU B 114 42.526 72.192 44.916 1.00 0.00 H ATOM 634 N LYS B 115 42.890 71.568 48.106 1.00 28.62 N ATOM 635 CA LYS B 115 42.583 71.582 49.536 1.00 33.23 C ATOM 636 C LYS B 115 41.067 71.722 49.667 1.00 30.92 C ATOM 637 O LYS B 115 40.418 72.293 48.782 1.00 30.38 O ATOM 638 CB LYS B 115 43.276 72.787 50.179 1.00 34.17 C ATOM 639 CG LYS B 115 43.458 72.723 51.674 1.00 37.91 C ATOM 640 CD LYS B 115 44.570 73.689 52.112 1.00 37.64 C ATOM 641 CE LYS B 115 44.073 75.124 52.291 1.00 42.92 C ATOM 642 NZ LYS B 115 43.798 75.418 53.732 1.00 36.95 N ATOM 643 HZ1 LYS B 115 43.070 74.765 54.085 1.00 0.00 H ATOM 644 HZ2 LYS B 115 44.672 75.295 54.283 1.00 0.00 H ATOM 645 HZ3 LYS B 115 43.462 76.398 53.827 1.00 0.00 H ATOM 646 H LYS B 115 42.445 72.291 47.506 1.00 0.00 H ATOM 647 N TRP B 116 40.487 71.193 50.746 1.00 26.00 N ATOM 648 CA TRP B 116 39.088 71.476 51.046 1.00 26.20 C ATOM 649 C TRP B 116 38.930 72.870 51.644 1.00 30.74 C ATOM 650 O TRP B 116 39.768 73.323 52.430 1.00 28.59 O ATOM 651 CB TRP B 116 38.495 70.434 52.006 1.00 24.27 C ATOM 652 CG TRP B 116 38.422 69.063 51.402 1.00 24.38 C ATOM 653 CD1 TRP B 116 39.113 67.951 51.806 1.00 26.01 C ATOM 654 CD2 TRP B 116 37.628 68.657 50.277 1.00 25.79 C ATOM 655 NE1 TRP B 116 38.792 66.875 51.003 1.00 29.38 N ATOM 656 CE2 TRP B 116 37.879 67.280 50.058 1.00 25.72 C ATOM 657 CE3 TRP B 116 36.743 69.323 49.423 1.00 26.78 C ATOM 658 CZ2 TRP B 116 37.271 66.557 49.027 1.00 26.86 C ATOM 659 CZ3 TRP B 116 36.133 68.603 48.400 1.00 30.55 C ATOM 660 CH2 TRP B 116 36.404 67.233 48.208 1.00 29.69 C ATOM 661 HE1 TRP B 116 39.178 65.914 51.097 1.00 0.00 H ATOM 662 H TRP B 116 41.036 70.575 51.377 1.00 0.00 H ATOM 663 N HIS B 117 37.847 73.541 51.274 1.00 30.54 N ATOM 664 CA HIS B 117 37.584 74.891 51.755 1.00 33.74 C ATOM 665 C HIS B 117 36.310 74.983 52.584 1.00 35.46 C ATOM 666 O HIS B 117 35.700 76.051 52.704 1.00 37.70 O ATOM 667 CB HIS B 117 37.578 75.871 50.586 1.00 34.06 C ATOM 668 CG HIS B 117 38.907 75.972 49.906 1.00 34.25 C ATOM 669 ND1 HIS B 117 39.986 76.606 50.484 1.00 37.84 N ATOM 670 CD2 HIS B 117 39.345 75.484 48.722 1.00 37.06 C ATOM 671 CE1 HIS B 117 41.028 76.519 49.676 1.00 39.79 C ATOM 672 NE2 HIS B 117 40.665 75.844 48.599 1.00 39.10 N ATOM 673 H HIS B 117 37.169 73.093 50.625 1.00 0.00 H ATOM 674 N HIS B 118 35.920 73.849 53.164 1.00 30.06 N ATOM 675 CA HIS B 118 34.851 73.801 54.144 1.00 31.18 C ATOM 676 C HIS B 118 35.188 72.708 55.156 1.00 27.47 C ATOM 677 O HIS B 118 36.018 71.844 54.884 1.00 29.10 O ATOM 678 CB HIS B 118 33.484 73.567 53.489 1.00 33.04 C ATOM 679 CG HIS B 118 33.358 72.249 52.793 1.00 33.36 C ATOM 680 ND1 HIS B 118 33.816 72.039 51.510 1.00 33.68 N ATOM 681 CD2 HIS B 118 32.810 71.077 53.194 1.00 30.00 C ATOM 682 CE1 HIS B 118 33.563 70.791 51.152 1.00 32.67 C ATOM 683 NE2 HIS B 118 32.949 70.187 52.154 1.00 30.61 N ATOM 684 H HIS B 118 36.400 72.964 52.904 1.00 0.00 H ATOM 685 N HIS B 119 34.558 72.752 56.316 1.00 29.98 N ATOM 686 CA HIS B 119 35.032 71.955 57.444 1.00 32.75 C ATOM 687 C HIS B 119 34.366 70.592 57.584 1.00 29.49 C ATOM 688 O HIS B 119 34.979 69.655 58.094 1.00 29.84 O ATOM 689 CB HIS B 119 34.897 72.741 58.748 1.00 37.95 C ATOM 690 CG HIS B 119 35.576 74.077 58.720 1.00 44.90 C ATOM 691 ND1 HIS B 119 36.938 74.227 58.885 1.00 45.86 N ATOM 692 CD2 HIS B 119 35.078 75.327 58.556 1.00 48.03 C ATOM 693 CE1 HIS B 119 37.249 75.510 58.822 1.00 42.25 C ATOM 694 NE2 HIS B 119 36.138 76.198 58.622 1.00 48.04 N ATOM 695 H HIS B 119 33.720 73.358 56.427 1.00 0.00 H ATOM 696 N ASN B 120 33.117 70.468 57.153 1.00 30.09 N ATOM 697 CA ASN B 120 32.453 69.171 57.263 1.00 27.94 C ATOM 698 C ASN B 120 32.488 68.423 55.949 1.00 29.36 C ATOM 699 O ASN B 120 31.702 68.703 55.038 1.00 28.53 O ATOM 700 CB ASN B 120 31.010 69.281 57.739 1.00 33.30 C ATOM 701 CG ASN B 120 30.378 67.908 57.979 1.00 37.22 C ATOM 702 OD1 ASN B 120 31.053 66.957 58.418 1.00 31.49 O ATOM 703 ND2 ASN B 120 29.088 67.790 57.668 1.00 40.53 N ATOM 704 HD22 ASN B 120 28.564 68.611 57.304 1.00 0.00 H ATOM 705 HD21 ASN B 120 28.605 66.877 57.789 1.00 0.00 H ATOM 706 H ASN B 120 32.618 71.283 56.743 1.00 0.00 H ATOM 707 N ILE B 121 33.382 67.449 55.883 1.00 25.00 N ATOM 708 CA ILE B 121 33.598 66.661 54.683 1.00 26.28 C ATOM 709 C ILE B 121 32.671 65.457 54.710 1.00 26.08 C ATOM 710 O ILE B 121 32.663 64.683 55.665 1.00 27.66 O ATOM 711 CB ILE B 121 35.061 66.191 54.610 1.00 25.37 C ATOM 712 CG1 ILE B 121 35.996 67.390 54.765 1.00 27.38 C ATOM 713 CG2 ILE B 121 35.330 65.478 53.296 1.00 23.70 C ATOM 714 CD1 ILE B 121 35.723 68.508 53.758 1.00 27.25 C ATOM 715 H ILE B 121 33.954 67.239 56.726 1.00 0.00 H ATOM 716 N THR B 122 31.871 65.302 53.666 1.00 24.39 N ATOM 717 CA THR B 122 30.927 64.208 53.643 1.00 26.67 C ATOM 718 C THR B 122 31.500 63.096 52.783 1.00 23.91 C ATOM 719 O THR B 122 32.234 63.353 51.837 1.00 24.39 O ATOM 720 CB THR B 122 29.579 64.671 53.071 1.00 24.94 C ATOM 721 OG1 THR B 122 29.819 65.289 51.803 1.00 25.71 O ATOM 722 CG2 THR B 122 28.891 65.691 54.020 1.00 26.63 C ATOM 723 HG1 THR B 122 30.241 64.634 51.192 1.00 0.00 H ATOM 724 H THR B 122 31.922 65.965 52.866 1.00 0.00 H ATOM 725 N TYR B 123 31.161 61.853 53.104 1.00 24.41 N ATOM 726 CA TYR B 123 31.612 60.733 52.285 1.00 24.84 C ATOM 727 C TYR B 123 30.540 59.676 52.066 1.00 23.59 C ATOM 728 O TYR B 123 29.719 59.417 52.942 1.00 24.46 O ATOM 729 CB TYR B 123 32.869 60.098 52.864 1.00 26.24 C ATOM 730 CG TYR B 123 32.697 59.373 54.180 1.00 24.57 C ATOM 731 CD1 TYR B 123 32.837 60.040 55.382 1.00 23.33 C ATOM 732 CD2 TYR B 123 32.445 58.001 54.214 1.00 22.84 C ATOM 733 CE1 TYR B 123 32.719 59.367 56.592 1.00 26.09 C ATOM 734 CE2 TYR B 123 32.325 57.324 55.410 1.00 24.83 C ATOM 735 CZ TYR B 123 32.467 58.008 56.596 1.00 27.02 C ATOM 736 OH TYR B 123 32.344 57.319 57.789 1.00 27.04 O ATOM 737 HH TYR B 123 32.471 57.945 58.545 1.00 0.00 H ATOM 738 H TYR B 123 30.572 61.677 53.943 1.00 0.00 H ATOM 739 N TRP B 124 30.559 59.077 50.881 1.00 24.66 N ATOM 740 CA TRP B 124 29.549 58.112 50.482 1.00 25.47 C ATOM 741 C TRP B 124 30.244 56.813 50.133 1.00 26.16 C ATOM 742 O TRP B 124 31.084 56.790 49.246 1.00 27.78 O ATOM 743 CB TRP B 124 28.806 58.616 49.250 1.00 25.92 C ATOM 744 CG TRP B 124 27.751 57.695 48.739 1.00 27.82 C ATOM 745 CD1 TRP B 124 26.980 56.836 49.471 1.00 29.99 C ATOM 746 CD2 TRP B 124 27.347 57.535 47.376 1.00 31.50 C ATOM 747 NE1 TRP B 124 26.109 56.160 48.647 1.00 30.98 N ATOM 748 CE2 TRP B 124 26.313 56.570 47.356 1.00 33.02 C ATOM 749 CE3 TRP B 124 27.749 58.121 46.174 1.00 32.55 C ATOM 750 CZ2 TRP B 124 25.684 56.170 46.175 1.00 32.97 C ATOM 751 CZ3 TRP B 124 27.122 57.725 44.998 1.00 33.11 C ATOM 752 CH2 TRP B 124 26.098 56.759 45.012 1.00 34.65 C ATOM 753 HE1 TRP B 124 25.410 55.454 48.954 1.00 0.00 H ATOM 754 H TRP B 124 31.324 59.307 50.215 1.00 0.00 H ATOM 755 N ILE B 125 29.903 55.744 50.844 1.00 29.09 N ATOM 756 CA ILE B 125 30.393 54.422 50.499 1.00 27.93 C ATOM 757 C ILE B 125 29.471 53.906 49.399 1.00 29.62 C ATOM 758 O ILE B 125 28.334 53.513 49.661 1.00 30.99 O ATOM 759 CB ILE B 125 30.376 53.482 51.709 1.00 33.09 C ATOM 760 CG1 ILE B 125 31.233 54.076 52.841 1.00 29.00 C ATOM 761 CG2 ILE B 125 30.875 52.101 51.296 1.00 28.44 C ATOM 762 CD1 ILE B 125 31.123 53.376 54.158 1.00 29.96 C ATOM 763 H ILE B 125 29.273 55.856 51.664 1.00 0.00 H ATOM 764 N GLN B 126 29.962 53.962 48.167 1.00 30.76 N ATOM 765 CA GLN B 126 29.150 53.703 46.982 1.00 32.08 C ATOM 766 C GLN B 126 28.804 52.217 46.839 1.00 35.38 C ATOM 767 O GLN B 126 27.697 51.858 46.426 1.00 38.46 O ATOM 768 CB GLN B 126 29.906 54.195 45.744 1.00 34.58 C ATOM 769 CG GLN B 126 29.034 54.687 44.617 1.00 39.37 C ATOM 770 CD GLN B 126 29.862 55.262 43.483 1.00 37.22 C ATOM 771 OE1 GLN B 126 30.913 54.726 43.129 1.00 40.78 O ATOM 772 NE2 GLN B 126 29.402 56.372 42.920 1.00 43.50 N ATOM 773 HE22 GLN B 126 28.509 56.791 43.250 1.00 0.00 H ATOM 774 HE21 GLN B 126 29.934 56.823 42.148 1.00 0.00 H ATOM 775 H GLN B 126 30.966 54.200 48.041 1.00 0.00 H ATOM 776 N ASN B 127 29.752 51.359 47.189 1.00 31.31 N ATOM 777 CA ASN B 127 29.554 49.913 47.137 1.00 33.44 C ATOM 778 C ASN B 127 30.481 49.190 48.119 1.00 35.81 C ATOM 779 O ASN B 127 31.241 49.834 48.856 1.00 32.83 O ATOM 780 CB ASN B 127 29.737 49.375 45.703 1.00 30.24 C ATOM 781 CG ASN B 127 31.153 49.532 45.183 1.00 33.28 C ATOM 782 OD1 ASN B 127 31.943 50.319 45.702 1.00 32.18 O ATOM 783 ND2 ASN B 127 31.477 48.784 44.129 1.00 30.49 N ATOM 784 HD22 ASN B 127 30.778 48.131 43.721 1.00 0.00 H ATOM 785 HD21 ASN B 127 32.428 48.853 43.715 1.00 0.00 H ATOM 786 H ASN B 127 30.669 51.729 47.512 1.00 0.00 H ATOM 787 N TYR B 128 30.433 47.858 48.114 1.00 32.96 N ATOM 788 CA TYR B 128 31.149 47.066 49.103 1.00 32.37 C ATOM 789 C TYR B 128 31.858 45.874 48.491 1.00 34.49 C ATOM 790 O TYR B 128 31.312 45.200 47.617 1.00 39.78 O ATOM 791 CB TYR B 128 30.174 46.543 50.154 1.00 31.51 C ATOM 792 CG TYR B 128 29.610 47.607 51.064 1.00 34.67 C ATOM 793 CD1 TYR B 128 28.492 48.354 50.693 1.00 33.27 C ATOM 794 CD2 TYR B 128 30.186 47.861 52.304 1.00 32.67 C ATOM 795 CE1 TYR B 128 27.982 49.327 51.527 1.00 34.74 C ATOM 796 CE2 TYR B 128 29.680 48.830 53.143 1.00 30.25 C ATOM 797 CZ TYR B 128 28.584 49.561 52.754 1.00 34.09 C ATOM 798 OH TYR B 128 28.080 50.522 53.606 1.00 35.82 O ATOM 799 HH TYR B 128 28.778 51.200 53.787 1.00 0.00 H ATOM 800 H TYR B 128 29.870 47.373 47.386 1.00 0.00 H ATOM 801 N SER B 129 33.068 45.605 48.959 1.00 31.80 N ATOM 802 CA SER B 129 33.725 44.351 48.637 1.00 30.52 C ATOM 803 C SER B 129 33.011 43.247 49.388 1.00 33.90 C ATOM 804 O SER B 129 32.442 43.493 50.444 1.00 35.17 O ATOM 805 CB SER B 129 35.183 44.362 49.071 1.00 31.10 C ATOM 806 OG SER B 129 35.666 43.032 49.167 1.00 31.33 O ATOM 807 HG SER B 129 35.590 42.590 48.284 1.00 0.00 H ATOM 808 H SER B 129 33.552 46.299 49.563 1.00 0.00 H ATOM 809 N GLU B 130 33.069 42.032 48.858 1.00 33.26 N ATOM 810 CA GLU B 130 32.467 40.882 49.524 1.00 37.19 C ATOM 811 C GLU B 130 33.405 40.234 50.537 1.00 34.10 C ATOM 812 O GLU B 130 33.022 39.290 51.237 1.00 35.62 O ATOM 813 CB GLU B 130 32.011 39.849 48.490 1.00 39.56 C ATOM 814 CG GLU B 130 30.888 40.357 47.599 1.00 43.95 C ATOM 815 CD GLU B 130 29.756 40.983 48.396 1.00 49.33 C ATOM 816 OE1 GLU B 130 29.242 40.319 49.331 1.00 51.57 O ATOM 817 OE2 GLU B 130 29.382 42.145 48.096 1.00 54.15 O ATOM 818 H GLU B 130 33.554 41.897 47.948 1.00 0.00 H ATOM 819 N ASP B 131 34.627 40.744 50.626 1.00 31.57 N ATOM 820 CA ASP B 131 35.653 40.116 51.454 1.00 32.26 C ATOM 821 C ASP B 131 35.417 40.303 52.948 1.00 34.13 C ATOM 822 O ASP B 131 36.002 39.592 53.775 1.00 33.27 O ATOM 823 CB ASP B 131 37.024 40.670 51.101 1.00 31.27 C ATOM 824 CG ASP B 131 37.408 40.403 49.663 1.00 35.89 C ATOM 825 OD1 ASP B 131 36.790 39.506 49.044 1.00 36.98 O ATOM 826 OD2 ASP B 131 38.328 41.092 49.161 1.00 33.22 O ATOM 827 H ASP B 131 34.859 41.608 50.096 1.00 0.00 H ATOM 828 N LEU B 132 34.581 41.276 53.286 1.00 33.11 N ATOM 829 CA LEU B 132 34.328 41.636 54.681 1.00 32.45 C ATOM 830 C LEU B 132 32.875 42.029 54.860 1.00 31.04 C ATOM 831 O LEU B 132 32.232 42.500 53.915 1.00 31.18 O ATOM 832 CB LEU B 132 35.224 42.811 55.108 1.00 31.85 C ATOM 833 CG LEU B 132 36.729 42.606 55.262 1.00 31.55 C ATOM 834 CD1 LEU B 132 37.480 43.931 55.186 1.00 32.28 C ATOM 835 CD2 LEU B 132 37.038 41.897 56.571 1.00 30.02 C ATOM 836 H LEU B 132 34.089 41.800 52.534 1.00 0.00 H ATOM 837 N PRO B 133 32.345 41.846 56.081 1.00 32.62 N ATOM 838 CA PRO B 133 30.979 42.281 56.365 1.00 31.85 C ATOM 839 C PRO B 133 30.881 43.790 56.150 1.00 31.08 C ATOM 840 O PRO B 133 31.843 44.509 56.452 1.00 28.20 O ATOM 841 CB PRO B 133 30.811 41.964 57.852 1.00 32.44 C ATOM 842 CG PRO B 133 31.849 40.931 58.157 1.00 32.86 C ATOM 843 CD PRO B 133 33.006 41.285 57.272 1.00 31.78 C ATOM 844 N ARG B 134 29.744 44.250 55.646 1.00 28.00 N ATOM 845 CA ARG B 134 29.525 45.671 55.414 1.00 31.67 C ATOM 846 C ARG B 134 29.796 46.534 56.644 1.00 30.94 C ATOM 847 O ARG B 134 30.352 47.622 56.525 1.00 30.92 O ATOM 848 CB ARG B 134 28.106 45.922 54.920 1.00 32.78 C ATOM 849 CG ARG B 134 27.834 45.357 53.544 1.00 33.96 C ATOM 850 CD ARG B 134 26.609 46.006 52.936 1.00 38.26 C ATOM 851 NE ARG B 134 26.461 45.649 51.530 1.00 44.89 N ATOM 852 CZ ARG B 134 25.616 46.247 50.693 1.00 47.33 C ATOM 853 NH1 ARG B 134 24.841 47.237 51.124 1.00 46.44 N ATOM 854 NH2 ARG B 134 25.549 45.854 49.426 1.00 49.83 N ATOM 855 HE ARG B 134 27.053 44.879 51.158 1.00 0.00 H ATOM 856 HH12 ARG B 134 24.181 47.704 50.469 1.00 0.00 H ATOM 857 HH11 ARG B 134 24.894 47.545 52.116 1.00 0.00 H ATOM 858 HH22 ARG B 134 24.889 46.320 48.771 1.00 0.00 H ATOM 859 HH21 ARG B 134 26.156 45.080 49.089 1.00 0.00 H ATOM 860 H ARG B 134 28.987 43.577 55.410 1.00 0.00 H ATOM 861 N ALA B 135 29.387 46.059 57.817 1.00 30.81 N ATOM 862 CA ALA B 135 29.596 46.820 59.046 1.00 31.47 C ATOM 863 C ALA B 135 31.081 46.989 59.343 1.00 30.44 C ATOM 864 O ALA B 135 31.509 48.023 59.872 1.00 31.29 O ATOM 865 CB ALA B 135 28.906 46.140 60.217 1.00 33.32 C ATOM 866 H ALA B 135 28.913 45.134 57.860 1.00 0.00 H ATOM 867 N VAL B 136 31.858 45.959 59.026 1.00 28.49 N ATOM 868 CA VAL B 136 33.293 45.976 59.269 1.00 29.16 C ATOM 869 C VAL B 136 33.933 46.984 58.319 1.00 26.55 C ATOM 870 O VAL B 136 34.840 47.735 58.690 1.00 25.58 O ATOM 871 CB VAL B 136 33.903 44.565 59.107 1.00 28.92 C ATOM 872 CG1 VAL B 136 35.411 44.609 59.229 1.00 29.66 C ATOM 873 CG2 VAL B 136 33.315 43.617 60.167 1.00 30.49 C ATOM 874 H VAL B 136 31.429 45.117 58.592 1.00 0.00 H ATOM 875 N ILE B 137 33.424 47.011 57.095 1.00 25.63 N ATOM 876 CA ILE B 137 33.891 47.953 56.088 1.00 25.20 C ATOM 877 C ILE B 137 33.563 49.391 56.502 1.00 26.04 C ATOM 878 O ILE B 137 34.443 50.270 56.496 1.00 24.94 O ATOM 879 CB ILE B 137 33.313 47.602 54.703 1.00 25.51 C ATOM 880 CG1 ILE B 137 33.951 46.287 54.217 1.00 28.79 C ATOM 881 CG2 ILE B 137 33.608 48.725 53.696 1.00 24.53 C ATOM 882 CD1 ILE B 137 33.408 45.759 52.873 1.00 27.99 C ATOM 883 H ILE B 137 32.669 46.340 56.847 1.00 0.00 H ATOM 884 N ASP B 138 32.314 49.619 56.887 1.00 25.74 N ATOM 885 CA ASP B 138 31.879 50.937 57.353 1.00 28.68 C ATOM 886 C ASP B 138 32.793 51.386 58.484 1.00 26.51 C ATOM 887 O ASP B 138 33.250 52.534 58.534 1.00 25.47 O ATOM 888 CB ASP B 138 30.435 50.897 57.875 1.00 28.68 C ATOM 889 CG ASP B 138 29.415 50.604 56.782 1.00 33.68 C ATOM 890 OD1 ASP B 138 29.757 50.751 55.583 1.00 35.64 O ATOM 891 OD2 ASP B 138 28.268 50.238 57.135 1.00 34.55 O ATOM 892 H ASP B 138 31.625 48.840 56.857 1.00 0.00 H ATOM 893 N ASP B 139 33.049 50.466 59.402 1.00 27.23 N ATOM 894 CA ASP B 139 33.843 50.787 60.571 1.00 26.91 C ATOM 895 C ASP B 139 35.293 51.040 60.200 1.00 24.04 C ATOM 896 O ASP B 139 35.943 51.885 60.802 1.00 23.73 O ATOM 897 CB ASP B 139 33.760 49.678 61.612 1.00 27.07 C ATOM 898 CG ASP B 139 34.666 49.937 62.798 1.00 28.87 C ATOM 899 OD1 ASP B 139 34.300 50.763 63.664 1.00 32.66 O ATOM 900 OD2 ASP B 139 35.752 49.328 62.847 1.00 30.48 O ATOM 901 H ASP B 139 32.676 49.503 59.282 1.00 0.00 H ATOM 902 N ALA B 140 35.818 50.307 59.222 1.00 24.61 N ATOM 903 CA ALA B 140 37.208 50.517 58.864 1.00 23.89 C ATOM 904 C ALA B 140 37.379 51.916 58.266 1.00 22.32 C ATOM 905 O ALA B 140 38.330 52.625 58.572 1.00 19.14 O ATOM 906 CB ALA B 140 37.720 49.429 57.910 1.00 23.48 C ATOM 907 H ALA B 140 35.243 49.598 58.724 1.00 0.00 H ATOM 908 N PHE B 141 36.443 52.313 57.414 1.00 22.71 N ATOM 909 CA PHE B 141 36.484 53.658 56.861 1.00 23.08 C ATOM 910 C PHE B 141 36.265 54.724 57.956 1.00 23.46 C ATOM 911 O PHE B 141 36.910 55.768 57.947 1.00 20.63 O ATOM 912 CB PHE B 141 35.445 53.830 55.739 1.00 22.88 C ATOM 913 CG PHE B 141 35.722 52.999 54.502 1.00 23.49 C ATOM 914 CD1 PHE B 141 37.012 52.743 54.090 1.00 22.30 C ATOM 915 CD2 PHE B 141 34.673 52.488 53.747 1.00 23.14 C ATOM 916 CE1 PHE B 141 37.251 51.979 52.954 1.00 26.68 C ATOM 917 CE2 PHE B 141 34.913 51.725 52.604 1.00 22.41 C ATOM 918 CZ PHE B 141 36.186 51.472 52.216 1.00 23.40 C ATOM 919 H PHE B 141 35.679 51.662 57.141 1.00 0.00 H ATOM 920 N ALA B 142 35.350 54.474 58.886 1.00 23.08 N ATOM 921 CA ALA B 142 35.108 55.426 59.974 1.00 21.72 C ATOM 922 C ALA B 142 36.391 55.677 60.778 1.00 23.51 C ATOM 923 O ALA B 142 36.738 56.816 61.088 1.00 20.73 O ATOM 924 CB ALA B 142 33.984 54.921 60.901 1.00 27.20 C ATOM 925 H ALA B 142 34.799 53.593 58.842 1.00 0.00 H ATOM 926 N ARG B 143 37.078 54.597 61.123 1.00 20.66 N ATOM 927 CA ARG B 143 38.315 54.687 61.886 1.00 21.79 C ATOM 928 C ARG B 143 39.393 55.420 61.101 1.00 21.83 C ATOM 929 O ARG B 143 40.160 56.210 61.663 1.00 21.66 O ATOM 930 CB ARG B 143 38.785 53.283 62.287 1.00 21.59 C ATOM 931 CG ARG B 143 37.870 52.669 63.377 1.00 25.88 C ATOM 932 CD ARG B 143 38.399 51.340 63.884 1.00 27.12 C ATOM 933 NE ARG B 143 38.377 50.282 62.869 1.00 25.22 N ATOM 934 CZ ARG B 143 39.456 49.684 62.379 1.00 25.32 C ATOM 935 NH1 ARG B 143 40.669 50.042 62.786 1.00 24.38 N ATOM 936 NH2 ARG B 143 39.323 48.724 61.469 1.00 27.87 N ATOM 937 HE ARG B 143 37.450 49.979 62.507 1.00 0.00 H ATOM 938 HH12 ARG B 143 41.509 49.568 62.397 1.00 0.00 H ATOM 939 HH11 ARG B 143 40.779 50.796 63.494 1.00 0.00 H ATOM 940 HH22 ARG B 143 40.166 48.253 61.083 1.00 0.00 H ATOM 941 HH21 ARG B 143 38.376 48.444 61.143 1.00 0.00 H ATOM 942 H ARG B 143 36.724 53.661 60.841 1.00 0.00 H ATOM 943 N ALA B 144 39.471 55.155 59.801 1.00 21.33 N ATOM 944 CA ALA B 144 40.479 55.822 58.987 1.00 22.17 C ATOM 945 C ALA B 144 40.247 57.331 58.976 1.00 21.25 C ATOM 946 O ALA B 144 41.200 58.100 59.030 1.00 22.15 O ATOM 947 CB ALA B 144 40.496 55.262 57.562 1.00 20.41 C ATOM 948 H ALA B 144 38.815 54.475 59.367 1.00 0.00 H ATOM 949 N PHE B 145 38.985 57.755 58.907 1.00 20.59 N ATOM 950 CA PHE B 145 38.680 59.194 58.941 1.00 22.00 C ATOM 951 C PHE B 145 38.952 59.771 60.322 1.00 23.11 C ATOM 952 O PHE B 145 39.377 60.926 60.462 1.00 22.66 O ATOM 953 CB PHE B 145 37.230 59.487 58.543 1.00 21.63 C ATOM 954 CG PHE B 145 37.006 59.486 57.056 1.00 20.86 C ATOM 955 CD1 PHE B 145 37.685 60.391 56.237 1.00 23.07 C ATOM 956 CD2 PHE B 145 36.116 58.597 56.477 1.00 23.07 C ATOM 957 CE1 PHE B 145 37.490 60.394 54.849 1.00 25.46 C ATOM 958 CE2 PHE B 145 35.906 58.602 55.095 1.00 23.12 C ATOM 959 CZ PHE B 145 36.603 59.499 54.285 1.00 23.82 C ATOM 960 H PHE B 145 38.211 57.064 58.829 1.00 0.00 H ATOM 961 N ALA B 146 38.706 58.964 61.343 1.00 23.41 N ATOM 962 CA ALA B 146 38.934 59.428 62.709 1.00 25.78 C ATOM 963 C ALA B 146 40.400 59.760 62.946 1.00 23.24 C ATOM 964 O ALA B 146 40.721 60.653 63.731 1.00 25.22 O ATOM 965 CB ALA B 146 38.446 58.404 63.717 1.00 25.48 C ATOM 966 H ALA B 146 38.351 58.001 61.172 1.00 0.00 H ATOM 967 N LEU B 147 41.294 59.030 62.291 1.00 22.84 N ATOM 968 CA LEU B 147 42.714 59.385 62.327 1.00 21.58 C ATOM 969 C LEU B 147 42.944 60.843 61.913 1.00 23.66 C ATOM 970 O LEU B 147 43.646 61.596 62.592 1.00 22.39 O ATOM 971 CB LEU B 147 43.531 58.499 61.392 1.00 25.08 C ATOM 972 CG LEU B 147 43.863 57.071 61.798 1.00 27.74 C ATOM 973 CD1 LEU B 147 44.613 56.425 60.648 1.00 23.61 C ATOM 974 CD2 LEU B 147 44.690 57.033 63.109 1.00 26.26 C ATOM 975 H LEU B 147 40.984 58.199 61.748 1.00 0.00 H ATOM 976 N TRP B 148 42.374 61.216 60.772 1.00 21.41 N ATOM 977 CA TRP B 148 42.576 62.540 60.205 1.00 21.33 C ATOM 978 C TRP B 148 41.768 63.603 60.946 1.00 21.53 C ATOM 979 O TRP B 148 42.193 64.758 61.052 1.00 22.79 O ATOM 980 CB TRP B 148 42.234 62.531 58.715 1.00 20.55 C ATOM 981 CG TRP B 148 43.182 61.665 57.930 1.00 21.90 C ATOM 982 CD1 TRP B 148 42.878 60.513 57.257 1.00 22.20 C ATOM 983 CD2 TRP B 148 44.590 61.858 57.774 1.00 23.68 C ATOM 984 NE1 TRP B 148 44.003 59.995 56.676 1.00 22.21 N ATOM 985 CE2 TRP B 148 45.071 60.800 56.975 1.00 22.26 C ATOM 986 CE3 TRP B 148 45.490 62.837 58.209 1.00 22.63 C ATOM 987 CZ2 TRP B 148 46.405 60.686 56.612 1.00 22.77 C ATOM 988 CZ3 TRP B 148 46.820 62.721 57.847 1.00 23.22 C ATOM 989 CH2 TRP B 148 47.265 61.652 57.057 1.00 24.32 C ATOM 990 HE1 TRP B 148 44.042 59.130 56.100 1.00 0.00 H ATOM 991 H TRP B 148 41.764 60.540 60.269 1.00 0.00 H ATOM 992 N SER B 149 40.614 63.207 61.470 1.00 20.51 N ATOM 993 CA SER B 149 39.758 64.122 62.212 1.00 22.22 C ATOM 994 C SER B 149 40.515 64.745 63.376 1.00 22.73 C ATOM 995 O SER B 149 40.387 65.937 63.660 1.00 24.76 O ATOM 996 CB SER B 149 38.531 63.361 62.762 1.00 23.74 C ATOM 997 OG SER B 149 37.621 64.256 63.359 1.00 33.17 O ATOM 998 HG SER B 149 36.843 63.751 63.705 1.00 0.00 H ATOM 999 H SER B 149 40.314 62.219 61.347 1.00 0.00 H ATOM 1000 N ALA B 150 41.271 63.926 64.089 1.00 21.23 N ATOM 1001 CA ALA B 150 41.882 64.395 65.338 1.00 20.47 C ATOM 1002 C ALA B 150 42.974 65.438 65.106 1.00 25.18 C ATOM 1003 O ALA B 150 43.294 66.212 66.009 1.00 22.67 O ATOM 1004 CB ALA B 150 42.442 63.208 66.139 1.00 21.22 C ATOM 1005 H ALA B 150 41.432 62.951 63.765 1.00 0.00 H ATOM 1006 N VAL B 151 43.552 65.445 63.902 1.00 21.17 N ATOM 1007 CA VAL B 151 44.733 66.266 63.620 1.00 22.24 C ATOM 1008 C VAL B 151 44.479 67.387 62.614 1.00 25.74 C ATOM 1009 O VAL B 151 45.416 68.058 62.178 1.00 24.90 O ATOM 1010 CB VAL B 151 45.940 65.402 63.140 1.00 24.96 C ATOM 1011 CG1 VAL B 151 46.434 64.507 64.269 1.00 22.23 C ATOM 1012 CG2 VAL B 151 45.583 64.572 61.878 1.00 19.20 C ATOM 1013 H VAL B 151 43.154 64.853 63.145 1.00 0.00 H ATOM 1014 N THR B 152 43.210 67.585 62.264 1.00 24.67 N ATOM 1015 CA THR B 152 42.804 68.640 61.347 1.00 24.94 C ATOM 1016 C THR B 152 41.580 69.332 61.915 1.00 26.67 C ATOM 1017 O THR B 152 40.970 68.844 62.865 1.00 26.06 O ATOM 1018 CB THR B 152 42.381 68.067 59.991 1.00 23.72 C ATOM 1019 OG1 THR B 152 41.215 67.259 60.175 1.00 23.86 O ATOM 1020 CG2 THR B 152 43.487 67.229 59.390 1.00 27.63 C ATOM 1021 HG1 THR B 152 41.422 66.521 60.802 1.00 0.00 H ATOM 1022 H THR B 152 42.479 66.961 62.662 1.00 0.00 H ATOM 1023 N PRO B 153 41.222 70.486 61.347 1.00 24.72 N ATOM 1024 CA PRO B 153 39.963 71.105 61.759 1.00 29.64 C ATOM 1025 C PRO B 153 38.793 70.594 60.922 1.00 28.37 C ATOM 1026 O PRO B 153 37.795 71.294 60.763 1.00 32.89 O ATOM 1027 CB PRO B 153 40.209 72.604 61.523 1.00 28.90 C ATOM 1028 CG PRO B 153 41.258 72.669 60.506 1.00 30.85 C ATOM 1029 CD PRO B 153 42.090 71.410 60.592 1.00 27.56 C ATOM 1030 N LEU B 154 38.906 69.374 60.412 1.00 24.08 N ATOM 1031 CA LEU B 154 37.837 68.825 59.601 1.00 24.61 C ATOM 1032 C LEU B 154 37.030 67.818 60.394 1.00 25.78 C ATOM 1033 O LEU B 154 37.539 67.195 61.325 1.00 26.78 O ATOM 1034 CB LEU B 154 38.416 68.128 58.371 1.00 24.39 C ATOM 1035 CG LEU B 154 39.262 69.040 57.485 1.00 22.86 C ATOM 1036 CD1 LEU B 154 39.975 68.217 56.419 1.00 23.57 C ATOM 1037 CD2 LEU B 154 38.378 70.127 56.853 1.00 24.99 C ATOM 1038 H LEU B 154 39.762 68.812 60.594 1.00 0.00 H ATOM 1039 N THR B 155 35.769 67.662 60.015 1.00 22.21 N ATOM 1040 CA THR B 155 34.954 66.576 60.523 1.00 24.66 C ATOM 1041 C THR B 155 34.492 65.787 59.310 1.00 28.16 C ATOM 1042 O THR B 155 34.424 66.322 58.192 1.00 28.92 O ATOM 1043 CB THR B 155 33.748 67.055 61.376 1.00 30.41 C ATOM 1044 OG1 THR B 155 32.814 67.766 60.553 1.00 31.35 O ATOM 1045 CG2 THR B 155 34.227 67.951 62.519 1.00 23.58 C ATOM 1046 HG1 THR B 155 32.487 67.168 59.834 1.00 0.00 H ATOM 1047 H THR B 155 35.355 68.334 59.338 1.00 0.00 H ATOM 1048 N PHE B 156 34.234 64.506 59.529 1.00 24.70 N ATOM 1049 CA PHE B 156 33.816 63.617 58.462 1.00 24.38 C ATOM 1050 C PHE B 156 32.491 63.001 58.798 1.00 28.81 C ATOM 1051 O PHE B 156 32.286 62.512 59.910 1.00 28.55 O ATOM 1052 CB PHE B 156 34.870 62.547 58.230 1.00 25.69 C ATOM 1053 CG PHE B 156 36.198 63.120 57.878 1.00 20.62 C ATOM 1054 CD1 PHE B 156 36.456 63.543 56.593 1.00 25.22 C ATOM 1055 CD2 PHE B 156 37.159 63.328 58.862 1.00 22.37 C ATOM 1056 CE1 PHE B 156 37.681 64.112 56.259 1.00 26.65 C ATOM 1057 CE2 PHE B 156 38.386 63.890 58.547 1.00 25.20 C ATOM 1058 CZ PHE B 156 38.648 64.295 57.241 1.00 26.34 C ATOM 1059 H PHE B 156 34.334 64.128 60.493 1.00 0.00 H ATOM 1060 N THR B 157 31.587 63.041 57.832 1.00 26.36 N ATOM 1061 CA THR B 157 30.223 62.612 58.070 1.00 26.52 C ATOM 1062 C THR B 157 29.837 61.671 56.972 1.00 26.60 C ATOM 1063 O THR B 157 29.877 62.041 55.803 1.00 24.37 O ATOM 1064 CB THR B 157 29.257 63.800 58.041 1.00 29.59 C ATOM 1065 OG1 THR B 157 29.518 64.658 59.160 1.00 32.35 O ATOM 1066 CG2 THR B 157 27.809 63.308 58.113 1.00 29.76 C ATOM 1067 HG1 THR B 157 29.391 64.150 60.000 1.00 0.00 H ATOM 1068 H THR B 157 31.859 63.385 56.889 1.00 0.00 H ATOM 1069 N ARG B 158 29.450 60.459 57.348 1.00 27.22 N ATOM 1070 CA ARG B 158 28.996 59.481 56.376 1.00 26.52 C ATOM 1071 C ARG B 158 27.633 59.908 55.852 1.00 25.74 C ATOM 1072 O ARG B 158 26.737 60.238 56.635 1.00 27.31 O ATOM 1073 CB ARG B 158 28.870 58.108 57.036 1.00 26.38 C ATOM 1074 CG ARG B 158 28.438 57.034 56.067 1.00 27.62 C ATOM 1075 CD ARG B 158 28.287 55.678 56.742 1.00 32.54 C ATOM 1076 NE ARG B 158 27.819 54.685 55.782 1.00 31.21 N ATOM 1077 CZ ARG B 158 27.514 53.433 56.097 1.00 35.23 C ATOM 1078 NH1 ARG B 158 27.629 53.020 57.353 1.00 33.18 N ATOM 1079 NH2 ARG B 158 27.088 52.599 55.157 1.00 35.15 N ATOM 1080 HE ARG B 158 27.718 54.976 54.789 1.00 0.00 H ATOM 1081 HH12 ARG B 158 27.390 52.039 57.602 1.00 0.00 H ATOM 1082 HH11 ARG B 158 27.958 53.678 58.089 1.00 0.00 H ATOM 1083 HH22 ARG B 158 26.849 51.617 55.403 1.00 0.00 H ATOM 1084 HH21 ARG B 158 26.994 52.927 54.175 1.00 0.00 H ATOM 1085 H ARG B 158 29.472 60.205 58.356 1.00 0.00 H ATOM 1086 N VAL B 159 27.464 59.904 54.539 1.00 24.31 N ATOM 1087 CA VAL B 159 26.154 60.223 53.970 1.00 26.96 C ATOM 1088 C VAL B 159 25.775 59.182 52.934 1.00 30.66 C ATOM 1089 O VAL B 159 26.583 58.317 52.588 1.00 28.45 O ATOM 1090 CB VAL B 159 26.121 61.617 53.330 1.00 25.62 C ATOM 1091 CG1 VAL B 159 26.463 62.666 54.375 1.00 28.06 C ATOM 1092 CG2 VAL B 159 27.082 61.680 52.143 1.00 28.29 C ATOM 1093 H VAL B 159 28.262 59.674 53.912 1.00 0.00 H ATOM 1094 N TYR B 160 24.554 59.275 52.425 1.00 28.02 N ATOM 1095 CA TYR B 160 24.027 58.214 51.583 1.00 30.66 C ATOM 1096 C TYR B 160 23.527 58.737 50.249 1.00 33.40 C ATOM 1097 O TYR B 160 22.697 58.106 49.601 1.00 40.88 O ATOM 1098 CB TYR B 160 22.932 57.453 52.345 1.00 32.14 C ATOM 1099 CG TYR B 160 23.473 56.823 53.610 1.00 33.43 C ATOM 1100 CD1 TYR B 160 23.614 57.567 54.770 1.00 29.63 C ATOM 1101 CD2 TYR B 160 23.881 55.487 53.632 1.00 35.11 C ATOM 1102 CE1 TYR B 160 24.131 57.007 55.921 1.00 30.00 C ATOM 1103 CE2 TYR B 160 24.392 54.917 54.789 1.00 32.02 C ATOM 1104 CZ TYR B 160 24.518 55.677 55.923 1.00 30.38 C ATOM 1105 OH TYR B 160 25.015 55.128 57.090 1.00 37.01 O ATOM 1106 HH TYR B 160 25.033 55.820 57.797 1.00 0.00 H ATOM 1107 H TYR B 160 23.971 60.111 52.629 1.00 0.00 H ATOM 1108 N SER B 161 24.063 59.882 49.837 1.00 32.93 N ATOM 1109 CA SER B 161 23.689 60.525 48.583 1.00 38.64 C ATOM 1110 C SER B 161 24.923 60.748 47.701 1.00 36.89 C ATOM 1111 O SER B 161 26.050 60.806 48.200 1.00 35.27 O ATOM 1112 CB SER B 161 23.033 61.876 48.869 1.00 35.35 C ATOM 1113 OG SER B 161 23.872 62.653 49.722 1.00 41.69 O ATOM 1114 HG SER B 161 24.745 62.801 49.279 1.00 0.00 H ATOM 1115 H SER B 161 24.780 60.339 50.435 1.00 0.00 H ATOM 1116 N ARG B 162 24.691 60.892 46.393 1.00 36.30 N ATOM 1117 CA ARG B 162 25.734 61.219 45.426 1.00 35.87 C ATOM 1118 C ARG B 162 26.310 62.574 45.792 1.00 40.14 C ATOM 1119 O ARG B 162 27.367 62.974 45.305 1.00 39.96 O ATOM 1120 CB ARG B 162 25.140 61.273 44.007 1.00 35.76 C ATOM 1121 CG ARG B 162 24.283 60.050 43.664 1.00 41.24 C ATOM 1122 CD ARG B 162 23.679 60.085 42.253 1.00 39.02 C ATOM 1123 NE ARG B 162 23.319 58.737 41.799 1.00 40.47 N ATOM 1124 CZ ARG B 162 22.147 58.143 42.029 1.00 44.25 C ATOM 1125 NH1 ARG B 162 21.194 58.772 42.715 1.00 50.25 N ATOM 1126 NH2 ARG B 162 21.922 56.910 41.581 1.00 42.13 N ATOM 1127 HE ARG B 162 24.030 58.205 41.258 1.00 0.00 H ATOM 1128 HH12 ARG B 162 20.283 58.302 42.890 1.00 0.00 H ATOM 1129 HH11 ARG B 162 21.361 59.733 43.076 1.00 0.00 H ATOM 1130 HH22 ARG B 162 21.007 56.450 41.762 1.00 0.00 H ATOM 1131 HH21 ARG B 162 22.661 56.407 41.050 1.00 0.00 H ATOM 1132 H ARG B 162 23.719 60.765 46.047 1.00 0.00 H ATOM 1133 N ASP B 163 25.573 63.281 46.642 1.00 39.62 N ATOM 1134 CA ASP B 163 25.988 64.560 47.195 1.00 44.56 C ATOM 1135 C ASP B 163 26.976 64.299 48.329 1.00 42.76 C ATOM 1136 O ASP B 163 26.621 64.418 49.507 1.00 43.11 O ATOM 1137 CB ASP B 163 24.763 65.307 47.743 1.00 43.42 C ATOM 1138 CG ASP B 163 25.084 66.720 48.195 1.00 52.91 C ATOM 1139 OD1 ASP B 163 25.937 67.370 47.552 1.00 56.47 O ATOM 1140 OD2 ASP B 163 24.477 67.184 49.191 1.00 59.33 O ATOM 1141 H ASP B 163 24.649 62.899 46.927 1.00 0.00 H ATOM 1142 N ALA B 164 28.199 63.915 47.971 1.00 37.39 N ATOM 1143 CA ALA B 164 29.259 63.696 48.955 1.00 31.96 C ATOM 1144 C ALA B 164 30.563 64.252 48.411 1.00 28.69 C ATOM 1145 O ALA B 164 30.819 64.160 47.199 1.00 31.56 O ATOM 1146 CB ALA B 164 29.411 62.207 49.263 1.00 29.21 C ATOM 1147 H ALA B 164 28.407 63.766 46.963 1.00 0.00 H ATOM 1148 N ASP B 165 31.390 64.817 49.291 1.00 25.30 N ATOM 1149 CA ASP B 165 32.712 65.305 48.887 1.00 25.67 C ATOM 1150 C ASP B 165 33.599 64.140 48.491 1.00 26.87 C ATOM 1151 O ASP B 165 34.297 64.193 47.482 1.00 25.88 O ATOM 1152 CB ASP B 165 33.394 66.069 50.026 1.00 25.48 C ATOM 1153 CG ASP B 165 32.629 67.298 50.436 1.00 28.85 C ATOM 1154 OD1 ASP B 165 32.137 68.013 49.535 1.00 31.00 O ATOM 1155 OD2 ASP B 165 32.501 67.536 51.658 1.00 27.77 O ATOM 1156 H ASP B 165 31.092 64.913 50.283 1.00 0.00 H ATOM 1157 N ILE B 166 33.564 63.083 49.293 1.00 22.49 N ATOM 1158 CA ILE B 166 34.422 61.926 49.068 1.00 25.44 C ATOM 1159 C ILE B 166 33.589 60.711 48.729 1.00 26.20 C ATOM 1160 O ILE B 166 32.864 60.183 49.574 1.00 26.31 O ATOM 1161 CB ILE B 166 35.297 61.599 50.300 1.00 27.41 C ATOM 1162 CG1 ILE B 166 36.274 62.745 50.565 1.00 25.31 C ATOM 1163 CG2 ILE B 166 36.068 60.269 50.073 1.00 27.04 C ATOM 1164 CD1 ILE B 166 37.043 62.609 51.885 1.00 28.27 C ATOM 1165 H ILE B 166 32.909 63.080 50.101 1.00 0.00 H ATOM 1166 N VAL B 167 33.701 60.257 47.485 1.00 26.46 N ATOM 1167 CA VAL B 167 32.982 59.069 47.080 1.00 25.22 C ATOM 1168 C VAL B 167 33.930 57.881 47.108 1.00 23.70 C ATOM 1169 O VAL B 167 35.019 57.933 46.558 1.00 25.51 O ATOM 1170 CB VAL B 167 32.379 59.243 45.684 1.00 27.25 C ATOM 1171 CG1 VAL B 167 31.792 57.919 45.199 1.00 30.16 C ATOM 1172 CG2 VAL B 167 31.326 60.320 45.737 1.00 28.67 C ATOM 1173 H VAL B 167 34.306 60.756 46.802 1.00 0.00 H ATOM 1174 N ILE B 168 33.503 56.818 47.771 1.00 25.21 N ATOM 1175 CA ILE B 168 34.341 55.640 47.965 1.00 26.04 C ATOM 1176 C ILE B 168 33.797 54.476 47.149 1.00 25.80 C ATOM 1177 O ILE B 168 32.606 54.196 47.201 1.00 26.73 O ATOM 1178 CB ILE B 168 34.319 55.235 49.440 1.00 26.51 C ATOM 1179 CG1 ILE B 168 34.989 56.315 50.290 1.00 27.72 C ATOM 1180 CG2 ILE B 168 34.990 53.882 49.637 1.00 27.50 C ATOM 1181 CD1 ILE B 168 34.769 56.103 51.796 1.00 25.74 C ATOM 1182 H ILE B 168 32.541 56.823 48.166 1.00 0.00 H ATOM 1183 N GLN B 169 34.670 53.800 46.409 1.00 27.65 N ATOM 1184 CA GLN B 169 34.241 52.756 45.483 1.00 27.73 C ATOM 1185 C GLN B 169 35.229 51.584 45.470 1.00 28.74 C ATOM 1186 O GLN B 169 36.439 51.791 45.490 1.00 29.94 O ATOM 1187 CB GLN B 169 34.117 53.355 44.070 1.00 29.29 C ATOM 1188 CG GLN B 169 34.005 52.333 42.920 1.00 32.71 C ATOM 1189 CD GLN B 169 34.305 52.935 41.536 1.00 37.46 C ATOM 1190 OE1 GLN B 169 34.768 54.073 41.420 1.00 35.75 O ATOM 1191 NE2 GLN B 169 34.051 52.155 40.481 1.00 40.48 N ATOM 1192 HE22 GLN B 169 33.661 51.201 40.621 1.00 0.00 H ATOM 1193 HE21 GLN B 169 34.244 52.502 39.520 1.00 0.00 H ATOM 1194 H GLN B 169 35.683 54.020 46.492 1.00 0.00 H ATOM 1195 N PHE B 170 34.714 50.359 45.447 1.00 25.77 N ATOM 1196 CA PHE B 170 35.539 49.189 45.175 1.00 24.67 C ATOM 1197 C PHE B 170 35.344 48.870 43.709 1.00 29.63 C ATOM 1198 O PHE B 170 34.222 48.915 43.220 1.00 29.57 O ATOM 1199 CB PHE B 170 35.081 47.990 45.989 1.00 27.27 C ATOM 1200 CG PHE B 170 35.333 48.118 47.463 1.00 27.19 C ATOM 1201 CD1 PHE B 170 34.391 48.715 48.295 1.00 27.33 C ATOM 1202 CD2 PHE B 170 36.499 47.619 48.021 1.00 26.80 C ATOM 1203 CE1 PHE B 170 34.621 48.823 49.670 1.00 29.14 C ATOM 1204 CE2 PHE B 170 36.733 47.721 49.391 1.00 25.67 C ATOM 1205 CZ PHE B 170 35.796 48.325 50.209 1.00 25.21 C ATOM 1206 H PHE B 170 33.698 50.232 45.627 1.00 0.00 H ATOM 1207 N GLY B 171 36.428 48.557 43.012 1.00 29.48 N ATOM 1208 CA GLY B 171 36.344 48.263 41.590 1.00 34.21 C ATOM 1209 C GLY B 171 37.482 47.391 41.126 1.00 31.50 C ATOM 1210 O GLY B 171 38.442 47.169 41.862 1.00 29.19 O ATOM 1211 H GLY B 171 37.351 48.521 43.489 1.00 0.00 H ATOM 1212 N VAL B 172 37.378 46.893 39.898 1.00 31.59 N ATOM 1213 CA VAL B 172 38.426 46.068 39.315 1.00 30.82 C ATOM 1214 C VAL B 172 38.722 46.574 37.900 1.00 34.24 C ATOM 1215 O VAL B 172 37.844 47.131 37.234 1.00 34.00 O ATOM 1216 CB VAL B 172 38.022 44.568 39.298 1.00 36.05 C ATOM 1217 CG1 VAL B 172 37.686 44.094 40.708 1.00 36.00 C ATOM 1218 CG2 VAL B 172 36.830 44.344 38.388 1.00 36.76 C ATOM 1219 H VAL B 172 36.525 47.098 39.339 1.00 0.00 H ATOM 1220 N ALA B 173 39.966 46.413 37.467 1.00 34.21 N ATOM 1221 CA ALA B 173 40.397 46.867 36.143 1.00 36.82 C ATOM 1222 C ALA B 173 39.888 48.266 35.809 1.00 37.33 C ATOM 1223 O ALA B 173 40.039 49.199 36.598 1.00 34.92 O ATOM 1224 CB ALA B 173 39.962 45.872 35.078 1.00 40.89 C ATOM 1225 H ALA B 173 40.658 45.949 38.089 1.00 0.00 H ATOM 1226 N GLU B 174 39.297 48.426 34.626 1.00 38.25 N ATOM 1227 CA GLU B 174 38.700 49.712 34.277 1.00 38.89 C ATOM 1228 C GLU B 174 37.387 49.866 35.027 1.00 38.85 C ATOM 1229 O GLU B 174 36.433 49.121 34.799 1.00 40.34 O ATOM 1230 CB GLU B 174 38.492 49.847 32.760 1.00 41.52 C ATOM 1231 CG GLU B 174 37.800 51.151 32.357 1.00 42.90 C ATOM 1232 CD GLU B 174 38.535 52.394 32.858 1.00 41.86 C ATOM 1233 OE1 GLU B 174 39.774 52.464 32.699 1.00 43.02 O ATOM 1234 OE2 GLU B 174 37.872 53.303 33.411 1.00 42.47 O ATOM 1235 H GLU B 174 39.261 47.635 33.951 1.00 0.00 H ATOM 1236 N HIS B 175 37.341 50.823 35.948 1.00 35.86 N ATOM 1237 CA HIS B 175 36.189 50.964 36.814 1.00 34.42 C ATOM 1238 C HIS B 175 35.656 52.377 36.724 1.00 34.72 C ATOM 1239 O HIS B 175 35.049 52.882 37.661 1.00 33.93 O ATOM 1240 CB HIS B 175 36.574 50.626 38.249 1.00 33.87 C ATOM 1241 CG HIS B 175 37.735 51.422 38.741 1.00 29.57 C ATOM 1242 ND1 HIS B 175 39.033 51.122 38.399 1.00 32.48 N ATOM 1243 CD2 HIS B 175 37.792 52.540 39.500 1.00 30.62 C ATOM 1244 CE1 HIS B 175 39.844 52.010 38.944 1.00 31.29 C ATOM 1245 NE2 HIS B 175 39.116 52.879 39.617 1.00 29.29 N ATOM 1246 H HIS B 175 38.142 51.479 36.048 1.00 0.00 H ATOM 1247 N GLY B 176 35.900 53.029 35.588 1.00 35.21 N ATOM 1248 CA GLY B 176 35.206 54.265 35.279 1.00 36.14 C ATOM 1249 C GLY B 176 35.917 55.597 35.451 1.00 38.84 C ATOM 1250 O GLY B 176 35.255 56.637 35.436 1.00 41.56 O ATOM 1251 H GLY B 176 36.596 52.648 34.915 1.00 0.00 H ATOM 1252 N ASP B 177 37.240 55.591 35.613 1.00 36.16 N ATOM 1253 CA ASP B 177 37.980 56.852 35.687 1.00 35.81 C ATOM 1254 C ASP B 177 39.216 56.921 34.797 1.00 35.19 C ATOM 1255 O ASP B 177 39.948 57.913 34.821 1.00 36.53 O ATOM 1256 CB ASP B 177 38.343 57.204 37.135 1.00 35.65 C ATOM 1257 CG ASP B 177 39.196 56.144 37.810 1.00 35.56 C ATOM 1258 OD1 ASP B 177 39.696 55.214 37.139 1.00 32.91 O ATOM 1259 OD2 ASP B 177 39.384 56.278 39.031 1.00 33.43 O ATOM 1260 H ASP B 177 37.749 54.687 35.687 1.00 0.00 H ATOM 1261 N GLY B 178 39.455 55.876 34.015 1.00 34.88 N ATOM 1262 CA GLY B 178 40.587 55.875 33.107 1.00 38.23 C ATOM 1263 C GLY B 178 41.920 55.624 33.789 1.00 39.46 C ATOM 1264 O GLY B 178 42.983 55.733 33.166 1.00 38.08 O ATOM 1265 H GLY B 178 38.825 55.050 34.053 1.00 0.00 H ATOM 1266 N TYR B 179 41.871 55.296 35.077 1.00 34.20 N ATOM 1267 CA TYR B 179 43.059 54.806 35.765 1.00 33.73 C ATOM 1268 C TYR B 179 42.772 53.400 36.260 1.00 34.22 C ATOM 1269 O TYR B 179 42.574 53.175 37.452 1.00 32.83 O ATOM 1270 CB TYR B 179 43.449 55.723 36.914 1.00 33.78 C ATOM 1271 CG TYR B 179 43.794 57.119 36.472 1.00 35.65 C ATOM 1272 CD1 TYR B 179 45.061 57.422 35.990 1.00 39.10 C ATOM 1273 CD2 TYR B 179 42.849 58.132 36.516 1.00 35.96 C ATOM 1274 CE1 TYR B 179 45.380 58.700 35.570 1.00 40.57 C ATOM 1275 CE2 TYR B 179 43.163 59.418 36.100 1.00 38.98 C ATOM 1276 CZ TYR B 179 44.425 59.694 35.629 1.00 37.79 C ATOM 1277 OH TYR B 179 44.739 60.976 35.213 1.00 40.58 O ATOM 1278 HH TYR B 179 44.141 61.236 34.468 1.00 0.00 H ATOM 1279 H TYR B 179 40.976 55.390 35.598 1.00 0.00 H ATOM 1280 N PRO B 180 42.731 52.447 35.330 1.00 35.31 N ATOM 1281 CA PRO B 180 42.352 51.069 35.638 1.00 34.40 C ATOM 1282 C PRO B 180 43.297 50.416 36.638 1.00 31.68 C ATOM 1283 O PRO B 180 44.499 50.693 36.622 1.00 32.15 O ATOM 1284 CB PRO B 180 42.461 50.366 34.276 1.00 35.39 C ATOM 1285 CG PRO B 180 43.409 51.211 33.491 1.00 34.81 C ATOM 1286 CD PRO B 180 43.121 52.613 33.918 1.00 37.52 C ATOM 1287 N PHE B 181 42.735 49.569 37.497 1.00 33.47 N ATOM 1288 CA PHE B 181 43.504 48.712 38.388 1.00 29.75 C ATOM 1289 C PHE B 181 44.020 47.533 37.574 1.00 36.89 C ATOM 1290 O PHE B 181 43.669 47.385 36.393 1.00 35.70 O ATOM 1291 CB PHE B 181 42.630 48.211 39.545 1.00 29.96 C ATOM 1292 CG PHE B 181 42.291 49.273 40.559 1.00 28.40 C ATOM 1293 CD1 PHE B 181 43.258 50.154 41.012 1.00 29.91 C ATOM 1294 CD2 PHE B 181 41.001 49.379 41.061 1.00 29.69 C ATOM 1295 CE1 PHE B 181 42.940 51.144 41.956 1.00 28.04 C ATOM 1296 CE2 PHE B 181 40.668 50.365 42.002 1.00 30.01 C ATOM 1297 CZ PHE B 181 41.641 51.242 42.453 1.00 28.72 C ATOM 1298 H PHE B 181 41.697 49.517 37.534 1.00 0.00 H ATOM 1299 N ASP B 182 44.815 46.684 38.221 1.00 31.34 N ATOM 1300 CA ASP B 182 45.719 45.778 37.525 1.00 35.76 C ATOM 1301 C ASP B 182 45.615 44.341 38.014 1.00 34.12 C ATOM 1302 O ASP B 182 46.586 43.588 37.930 1.00 39.44 O ATOM 1303 CB ASP B 182 47.160 46.253 37.716 1.00 36.75 C ATOM 1304 CG ASP B 182 47.553 46.320 39.182 1.00 34.97 C ATOM 1305 OD1 ASP B 182 46.630 46.266 40.015 1.00 32.06 O ATOM 1306 OD2 ASP B 182 48.755 46.445 39.502 1.00 35.33 O ATOM 1307 H ASP B 182 44.790 46.667 39.261 1.00 0.00 H ATOM 1308 N GLY B 183 44.450 43.954 38.513 1.00 34.16 N ATOM 1309 CA GLY B 183 44.280 42.615 39.052 1.00 33.04 C ATOM 1310 C GLY B 183 45.012 42.461 40.372 1.00 36.66 C ATOM 1311 O GLY B 183 45.324 43.441 41.019 1.00 33.01 O ATOM 1312 H GLY B 183 43.648 44.616 38.519 1.00 0.00 H ATOM 1313 N LYS B 184 45.308 41.229 40.763 1.00 35.49 N ATOM 1314 CA LYS B 184 45.881 40.959 42.079 1.00 36.43 C ATOM 1315 C LYS B 184 47.280 41.565 42.313 1.00 35.11 C ATOM 1316 O LYS B 184 48.141 41.531 41.438 1.00 36.46 O ATOM 1317 CB LYS B 184 45.871 39.443 42.321 1.00 39.15 C ATOM 1318 CG LYS B 184 46.770 38.957 43.438 1.00 44.20 C ATOM 1319 CD LYS B 184 46.976 37.445 43.338 1.00 43.98 C ATOM 1320 CE LYS B 184 48.025 36.963 44.325 1.00 47.54 C ATOM 1321 NZ LYS B 184 48.645 35.664 43.919 1.00 52.16 N ATOM 1322 HZ1 LYS B 184 47.907 34.934 43.855 1.00 0.00 H ATOM 1323 HZ2 LYS B 184 49.105 35.775 42.993 1.00 0.00 H ATOM 1324 HZ3 LYS B 184 49.353 35.383 44.627 1.00 0.00 H ATOM 1325 H LYS B 184 45.128 40.435 40.116 1.00 0.00 H ATOM 1326 N ASP B 185 47.490 42.131 43.499 1.00 33.07 N ATOM 1327 CA ASP B 185 48.765 42.763 43.870 1.00 36.11 C ATOM 1328 C ASP B 185 49.087 43.990 43.012 1.00 32.23 C ATOM 1329 O ASP B 185 48.219 44.495 42.332 1.00 34.24 O ATOM 1330 CB ASP B 185 49.900 41.739 43.853 1.00 37.49 C ATOM 1331 CG ASP B 185 49.672 40.629 44.858 1.00 41.36 C ATOM 1332 OD1 ASP B 185 48.891 40.858 45.812 1.00 38.82 O ATOM 1333 OD2 ASP B 185 50.256 39.535 44.698 1.00 43.53 O ATOM 1334 H ASP B 185 46.717 42.126 44.195 1.00 0.00 H ATOM 1335 N GLY B 186 50.315 44.490 43.056 1.00 31.98 N ATOM 1336 CA GLY B 186 50.626 45.710 42.322 1.00 32.49 C ATOM 1337 C GLY B 186 49.935 46.924 42.940 1.00 33.53 C ATOM 1338 O GLY B 186 50.140 47.211 44.128 1.00 31.09 O ATOM 1339 H GLY B 186 51.053 44.013 43.612 1.00 0.00 H ATOM 1340 N LEU B 187 49.132 47.640 42.149 1.00 28.03 N ATOM 1341 CA LEU B 187 48.334 48.756 42.680 1.00 29.96 C ATOM 1342 C LEU B 187 47.256 48.247 43.604 1.00 28.93 C ATOM 1343 O LEU B 187 46.512 47.372 43.219 1.00 27.65 O ATOM 1344 CB LEU B 187 47.608 49.495 41.554 1.00 32.29 C ATOM 1345 CG LEU B 187 48.406 50.406 40.645 1.00 33.81 C ATOM 1346 CD1 LEU B 187 49.325 49.579 39.786 1.00 34.94 C ATOM 1347 CD2 LEU B 187 47.442 51.214 39.792 1.00 38.37 C ATOM 1348 H LEU B 187 49.070 47.404 41.138 1.00 0.00 H ATOM 1349 N LEU B 188 47.108 48.827 44.796 1.00 25.76 N ATOM 1350 CA LEU B 188 46.064 48.376 45.715 1.00 25.22 C ATOM 1351 C LEU B 188 44.830 49.275 45.708 1.00 23.27 C ATOM 1352 O LEU B 188 43.714 48.815 45.960 1.00 26.68 O ATOM 1353 CB LEU B 188 46.607 48.317 47.149 1.00 25.25 C ATOM 1354 CG LEU B 188 47.801 47.371 47.311 1.00 27.91 C ATOM 1355 CD1 LEU B 188 48.307 47.402 48.754 1.00 28.11 C ATOM 1356 CD2 LEU B 188 47.403 45.965 46.900 1.00 27.21 C ATOM 1357 H LEU B 188 47.739 49.605 45.074 1.00 0.00 H ATOM 1358 N ALA B 189 45.052 50.553 45.423 1.00 22.71 N ATOM 1359 CA ALA B 189 44.036 51.582 45.567 1.00 24.41 C ATOM 1360 C ALA B 189 44.611 52.887 45.059 1.00 22.00 C ATOM 1361 O ALA B 189 45.806 52.982 44.798 1.00 24.32 O ATOM 1362 CB ALA B 189 43.651 51.739 47.047 1.00 23.10 C ATOM 1363 H ALA B 189 45.995 50.830 45.082 1.00 0.00 H ATOM 1364 N HIS B 190 43.761 53.894 44.935 1.00 22.21 N ATOM 1365 CA HIS B 190 44.219 55.237 44.626 1.00 22.73 C ATOM 1366 C HIS B 190 43.144 56.232 45.000 1.00 22.84 C ATOM 1367 O HIS B 190 42.071 55.851 45.435 1.00 25.96 O ATOM 1368 CB HIS B 190 44.656 55.363 43.159 1.00 24.35 C ATOM 1369 CG HIS B 190 43.579 55.063 42.160 1.00 25.22 C ATOM 1370 ND1 HIS B 190 43.866 54.605 40.889 1.00 28.41 N ATOM 1371 CD2 HIS B 190 42.233 55.184 42.219 1.00 27.61 C ATOM 1372 CE1 HIS B 190 42.747 54.443 40.215 1.00 25.48 C ATOM 1373 NE2 HIS B 190 41.740 54.787 41.000 1.00 28.62 N ATOM 1374 H HIS B 190 42.744 53.720 45.062 1.00 0.00 H ATOM 1375 N ALA B 191 43.442 57.516 44.862 1.00 24.98 N ATOM 1376 CA ALA B 191 42.512 58.545 45.273 1.00 23.64 C ATOM 1377 C ALA B 191 42.868 59.814 44.534 1.00 24.52 C ATOM 1378 O ALA B 191 43.916 59.881 43.896 1.00 26.06 O ATOM 1379 CB ALA B 191 42.576 58.761 46.808 1.00 24.80 C ATOM 1380 H ALA B 191 44.358 57.788 44.452 1.00 0.00 H ATOM 1381 N PHE B 192 42.004 60.815 44.642 1.00 23.30 N ATOM 1382 CA PHE B 192 42.186 62.075 43.930 1.00 25.52 C ATOM 1383 C PHE B 192 42.139 63.222 44.923 1.00 23.69 C ATOM 1384 O PHE B 192 41.427 63.138 45.917 1.00 25.67 O ATOM 1385 CB PHE B 192 41.088 62.225 42.887 1.00 24.77 C ATOM 1386 CG PHE B 192 41.094 61.122 41.879 1.00 27.16 C ATOM 1387 CD1 PHE B 192 41.902 61.203 40.759 1.00 29.36 C ATOM 1388 CD2 PHE B 192 40.357 59.973 42.091 1.00 28.94 C ATOM 1389 CE1 PHE B 192 41.933 60.173 39.832 1.00 30.32 C ATOM 1390 CE2 PHE B 192 40.383 58.932 41.174 1.00 30.72 C ATOM 1391 CZ PHE B 192 41.170 59.035 40.047 1.00 31.18 C ATOM 1392 H PHE B 192 41.171 60.698 45.253 1.00 0.00 H ATOM 1393 N PRO B 193 42.901 64.290 44.660 1.00 25.94 N ATOM 1394 CA PRO B 193 42.979 65.428 45.586 1.00 25.47 C ATOM 1395 C PRO B 193 41.666 66.197 45.671 1.00 27.90 C ATOM 1396 O PRO B 193 40.852 66.106 44.751 1.00 26.50 O ATOM 1397 CB PRO B 193 44.064 66.315 44.962 1.00 27.56 C ATOM 1398 CG PRO B 193 44.032 65.960 43.485 1.00 27.60 C ATOM 1399 CD PRO B 193 43.754 64.480 43.471 1.00 26.58 C ATOM 1400 N PRO B 194 41.463 66.949 46.766 1.00 25.64 N ATOM 1401 CA PRO B 194 40.203 67.666 46.991 1.00 26.29 C ATOM 1402 C PRO B 194 39.820 68.524 45.801 1.00 28.50 C ATOM 1403 O PRO B 194 40.686 69.069 45.113 1.00 27.29 O ATOM 1404 CB PRO B 194 40.516 68.564 48.193 1.00 26.37 C ATOM 1405 CG PRO B 194 41.578 67.828 48.939 1.00 26.39 C ATOM 1406 CD PRO B 194 42.415 67.133 47.881 1.00 24.60 C ATOM 1407 N GLY B 195 38.522 68.645 45.578 1.00 29.31 N ATOM 1408 CA GLY B 195 38.019 69.430 44.470 1.00 32.89 C ATOM 1409 C GLY B 195 36.671 68.891 44.056 1.00 31.22 C ATOM 1410 O GLY B 195 36.101 68.045 44.738 1.00 32.13 O ATOM 1411 H GLY B 195 37.849 68.167 46.211 1.00 0.00 H ATOM 1412 N PRO B 196 36.155 69.367 42.921 1.00 36.26 N ATOM 1413 CA PRO B 196 34.810 68.945 42.515 1.00 36.11 C ATOM 1414 C PRO B 196 34.823 67.617 41.761 1.00 35.06 C ATOM 1415 O PRO B 196 35.867 67.182 41.279 1.00 32.68 O ATOM 1416 CB PRO B 196 34.376 70.068 41.574 1.00 38.22 C ATOM 1417 CG PRO B 196 35.657 70.539 40.954 1.00 39.03 C ATOM 1418 CD PRO B 196 36.730 70.371 42.009 1.00 38.95 C ATOM 1419 N GLY B 197 33.656 66.986 41.671 1.00 40.10 N ATOM 1420 CA GLY B 197 33.483 65.797 40.856 1.00 41.27 C ATOM 1421 C GLY B 197 34.227 64.586 41.382 1.00 37.38 C ATOM 1422 O GLY B 197 33.996 64.140 42.502 1.00 37.05 O ATOM 1423 H GLY B 197 32.841 67.356 42.201 1.00 0.00 H ATOM 1424 N ILE B 198 35.118 64.048 40.567 1.00 29.55 N ATOM 1425 CA ILE B 198 35.867 62.862 40.951 1.00 33.46 C ATOM 1426 C ILE B 198 36.911 63.205 42.016 1.00 33.50 C ATOM 1427 O ILE B 198 37.384 62.331 42.751 1.00 30.28 O ATOM 1428 CB ILE B 198 36.547 62.216 39.736 1.00 35.39 C ATOM 1429 CG1 ILE B 198 36.852 60.742 40.018 1.00 38.54 C ATOM 1430 CG2 ILE B 198 37.803 62.982 39.336 1.00 36.08 C ATOM 1431 CD1 ILE B 198 37.306 59.986 38.796 1.00 36.82 C ATOM 1432 H ILE B 198 35.286 64.480 39.636 1.00 0.00 H ATOM 1433 N GLN B 199 37.263 64.483 42.104 1.00 28.79 N ATOM 1434 CA GLN B 199 38.311 64.890 43.026 1.00 28.40 C ATOM 1435 C GLN B 199 37.831 64.639 44.436 1.00 27.04 C ATOM 1436 O GLN B 199 36.676 64.833 44.716 1.00 26.60 O ATOM 1437 CB GLN B 199 38.684 66.351 42.808 1.00 29.66 C ATOM 1438 CG GLN B 199 39.556 66.498 41.583 1.00 27.62 C ATOM 1439 CD GLN B 199 39.891 67.935 41.264 1.00 37.32 C ATOM 1440 OE1 GLN B 199 39.744 68.368 40.116 1.00 35.06 O ATOM 1441 NE2 GLN B 199 40.358 68.685 42.272 1.00 31.45 N ATOM 1442 HE22 GLN B 199 40.463 68.273 43.221 1.00 0.00 H ATOM 1443 HE21 GLN B 199 40.615 69.679 42.105 1.00 0.00 H ATOM 1444 H GLN B 199 36.788 65.194 41.512 1.00 0.00 H ATOM 1445 N GLY B 200 38.721 64.190 45.313 1.00 28.39 N ATOM 1446 CA GLY B 200 38.301 63.807 46.645 1.00 25.39 C ATOM 1447 C GLY B 200 37.969 62.323 46.770 1.00 27.22 C ATOM 1448 O GLY B 200 37.938 61.798 47.873 1.00 26.19 O ATOM 1449 H GLY B 200 39.722 64.113 45.043 1.00 0.00 H ATOM 1450 N ASP B 201 37.727 61.639 45.653 1.00 26.53 N ATOM 1451 CA ASP B 201 37.258 60.246 45.706 1.00 25.98 C ATOM 1452 C ASP B 201 38.372 59.220 45.979 1.00 23.98 C ATOM 1453 O ASP B 201 39.541 59.461 45.689 1.00 23.80 O ATOM 1454 CB ASP B 201 36.529 59.877 44.406 1.00 28.12 C ATOM 1455 CG ASP B 201 35.267 60.681 44.203 1.00 31.71 C ATOM 1456 OD1 ASP B 201 34.911 61.451 45.121 1.00 29.96 O ATOM 1457 OD2 ASP B 201 34.613 60.530 43.140 1.00 32.97 O ATOM 1458 H ASP B 201 37.872 62.096 44.730 1.00 0.00 H ATOM 1459 N ALA B 202 37.984 58.065 46.518 1.00 22.94 N ATOM 1460 CA ALA B 202 38.928 57.024 46.889 1.00 24.45 C ATOM 1461 C ALA B 202 38.422 55.688 46.374 1.00 23.37 C ATOM 1462 O ALA B 202 37.267 55.339 46.622 1.00 24.01 O ATOM 1463 CB ALA B 202 39.078 56.974 48.417 1.00 21.27 C ATOM 1464 H ALA B 202 36.969 57.903 46.679 1.00 0.00 H ATOM 1465 N HIS B 203 39.287 54.946 45.682 1.00 25.96 N ATOM 1466 CA HIS B 203 38.922 53.672 45.065 1.00 26.43 C ATOM 1467 C HIS B 203 39.845 52.543 45.501 1.00 25.32 C ATOM 1468 O HIS B 203 41.060 52.702 45.531 1.00 24.93 O ATOM 1469 CB HIS B 203 38.989 53.789 43.545 1.00 28.13 C ATOM 1470 CG HIS B 203 38.157 54.904 42.994 1.00 26.30 C ATOM 1471 ND1 HIS B 203 38.320 55.398 41.718 1.00 34.90 N ATOM 1472 CD2 HIS B 203 37.146 55.614 43.548 1.00 29.73 C ATOM 1473 CE1 HIS B 203 37.444 56.365 41.509 1.00 30.62 C ATOM 1474 NE2 HIS B 203 36.723 56.518 42.603 1.00 32.34 N ATOM 1475 H HIS B 203 40.263 55.288 45.577 1.00 0.00 H ATOM 1476 N PHE B 204 39.256 51.389 45.780 1.00 24.62 N ATOM 1477 CA PHE B 204 40.015 50.229 46.219 1.00 25.50 C ATOM 1478 C PHE B 204 39.891 49.114 45.202 1.00 24.30 C ATOM 1479 O PHE B 204 38.799 48.857 44.693 1.00 28.60 O ATOM 1480 CB PHE B 204 39.503 49.805 47.597 1.00 25.84 C ATOM 1481 CG PHE B 204 39.567 50.927 48.592 1.00 25.62 C ATOM 1482 CD1 PHE B 204 38.562 51.869 48.643 1.00 24.05 C ATOM 1483 CD2 PHE B 204 40.685 51.096 49.394 1.00 24.74 C ATOM 1484 CE1 PHE B 204 38.633 52.944 49.523 1.00 25.01 C ATOM 1485 CE2 PHE B 204 40.762 52.161 50.275 1.00 24.13 C ATOM 1486 CZ PHE B 204 39.741 53.089 50.335 1.00 25.57 C ATOM 1487 H PHE B 204 38.224 51.311 45.682 1.00 0.00 H ATOM 1488 N ASP B 205 41.017 48.469 44.907 1.00 26.31 N ATOM 1489 CA ASP B 205 41.066 47.387 43.925 1.00 28.08 C ATOM 1490 C ASP B 205 40.463 46.127 44.536 1.00 28.84 C ATOM 1491 O ASP B 205 41.044 45.522 45.441 1.00 28.07 O ATOM 1492 CB ASP B 205 42.506 47.118 43.516 1.00 27.99 C ATOM 1493 CG ASP B 205 42.617 46.158 42.319 1.00 28.32 C ATOM 1494 OD1 ASP B 205 41.615 45.510 41.935 1.00 30.89 O ATOM 1495 OD2 ASP B 205 43.718 46.047 41.780 1.00 30.93 O ATOM 1496 H ASP B 205 41.894 48.745 45.393 1.00 0.00 H ATOM 1497 N ASP B 206 39.308 45.716 44.036 1.00 30.56 N ATOM 1498 CA ASP B 206 38.621 44.580 44.637 1.00 31.18 C ATOM 1499 C ASP B 206 39.149 43.228 44.152 1.00 32.99 C ATOM 1500 O ASP B 206 38.685 42.175 44.598 1.00 31.14 O ATOM 1501 CB ASP B 206 37.111 44.685 44.449 1.00 31.00 C ATOM 1502 CG ASP B 206 36.331 44.026 45.585 1.00 33.69 C ATOM 1503 OD1 ASP B 206 36.959 43.600 46.589 1.00 31.69 O ATOM 1504 OD2 ASP B 206 35.088 43.953 45.482 1.00 33.40 O ATOM 1505 H ASP B 206 38.892 46.203 43.216 1.00 0.00 H ATOM 1506 N ASP B 207 40.119 43.257 43.247 1.00 30.04 N ATOM 1507 CA ASP B 207 40.846 42.041 42.906 1.00 32.32 C ATOM 1508 C ASP B 207 41.809 41.679 44.035 1.00 32.05 C ATOM 1509 O ASP B 207 42.401 40.605 44.040 1.00 32.62 O ATOM 1510 CB ASP B 207 41.583 42.194 41.572 1.00 32.52 C ATOM 1511 CG ASP B 207 40.688 41.901 40.381 1.00 35.46 C ATOM 1512 OD1 ASP B 207 39.731 41.102 40.542 1.00 36.69 O ATOM 1513 OD2 ASP B 207 40.943 42.472 39.292 1.00 34.75 O ATOM 1514 H ASP B 207 40.362 44.153 42.778 1.00 0.00 H ATOM 1515 N GLU B 208 41.967 42.582 44.998 1.00 30.90 N ATOM 1516 CA GLU B 208 42.721 42.245 46.198 1.00 30.69 C ATOM 1517 C GLU B 208 41.785 41.634 47.225 1.00 32.39 C ATOM 1518 O GLU B 208 40.583 41.914 47.226 1.00 32.62 O ATOM 1519 CB GLU B 208 43.391 43.476 46.806 1.00 30.52 C ATOM 1520 CG GLU B 208 44.052 44.380 45.802 1.00 29.60 C ATOM 1521 CD GLU B 208 45.274 43.757 45.160 1.00 34.05 C ATOM 1522 OE1 GLU B 208 45.666 42.622 45.522 1.00 32.76 O ATOM 1523 OE2 GLU B 208 45.858 44.433 44.299 1.00 34.50 O ATOM 1524 H GLU B 208 41.552 43.530 44.894 1.00 0.00 H ATOM 1525 N LEU B 209 42.346 40.801 48.097 1.00 29.29 N ATOM 1526 CA LEU B 209 41.625 40.308 49.256 1.00 34.54 C ATOM 1527 C LEU B 209 41.711 41.361 50.352 1.00 30.37 C ATOM 1528 O LEU B 209 42.798 41.641 50.865 1.00 32.00 O ATOM 1529 CB LEU B 209 42.245 39.003 49.751 1.00 31.92 C ATOM 1530 CG LEU B 209 41.772 38.475 51.103 1.00 35.81 C ATOM 1531 CD1 LEU B 209 40.306 38.072 51.053 1.00 36.57 C ATOM 1532 CD2 LEU B 209 42.646 37.301 51.532 1.00 36.92 C ATOM 1533 H LEU B 209 43.328 40.495 47.944 1.00 0.00 H ATOM 1534 N TRP B 210 40.572 41.952 50.693 1.00 28.84 N ATOM 1535 CA TRP B 210 40.531 42.965 51.743 1.00 30.65 C ATOM 1536 C TRP B 210 40.228 42.341 53.094 1.00 27.18 C ATOM 1537 O TRP B 210 39.295 41.553 53.231 1.00 29.96 O ATOM 1538 CB TRP B 210 39.511 44.064 51.413 1.00 27.97 C ATOM 1539 CG TRP B 210 39.970 44.846 50.247 1.00 26.12 C ATOM 1540 CD1 TRP B 210 39.469 44.804 48.975 1.00 26.57 C ATOM 1541 CD2 TRP B 210 41.091 45.730 50.212 1.00 26.28 C ATOM 1542 NE1 TRP B 210 40.196 45.633 48.158 1.00 26.22 N ATOM 1543 CE2 TRP B 210 41.200 46.214 48.894 1.00 25.80 C ATOM 1544 CE3 TRP B 210 42.005 46.175 51.175 1.00 25.49 C ATOM 1545 CZ2 TRP B 210 42.191 47.115 48.510 1.00 24.36 C ATOM 1546 CZ3 TRP B 210 42.993 47.065 50.792 1.00 24.06 C ATOM 1547 CH2 TRP B 210 43.079 47.524 49.470 1.00 26.50 C ATOM 1548 HE1 TRP B 210 40.016 45.795 47.147 1.00 0.00 H ATOM 1549 H TRP B 210 39.693 41.688 50.203 1.00 0.00 H ATOM 1550 N SER B 211 41.026 42.693 54.091 1.00 28.64 N ATOM 1551 CA SER B 211 40.775 42.206 55.439 1.00 30.93 C ATOM 1552 C SER B 211 41.263 43.251 56.438 1.00 30.61 C ATOM 1553 O SER B 211 41.336 44.437 56.116 1.00 26.17 O ATOM 1554 CB SER B 211 41.484 40.869 55.652 1.00 33.42 C ATOM 1555 OG SER B 211 42.887 41.026 55.544 1.00 34.21 O ATOM 1556 HG SER B 211 43.328 40.151 55.685 1.00 0.00 H ATOM 1557 H SER B 211 41.835 43.320 53.909 1.00 0.00 H ATOM 1558 N LEU B 212 41.595 42.830 57.649 1.00 28.38 N ATOM 1559 CA LEU B 212 42.259 43.758 58.555 1.00 30.96 C ATOM 1560 C LEU B 212 43.774 43.542 58.551 1.00 37.91 C ATOM 1561 O LEU B 212 44.480 43.992 59.460 1.00 40.67 O ATOM 1562 CB LEU B 212 41.656 43.720 59.959 1.00 39.21 C ATOM 1563 CG LEU B 212 40.184 44.156 59.946 1.00 36.19 C ATOM 1564 CD1 LEU B 212 39.724 44.615 61.328 1.00 44.08 C ATOM 1565 CD2 LEU B 212 39.944 45.261 58.927 1.00 34.87 C ATOM 1566 H LEU B 212 41.386 41.856 57.947 1.00 0.00 H ATOM 1567 N GLY B 213 44.256 42.863 57.503 1.00 33.31 N ATOM 1568 CA GLY B 213 45.667 42.789 57.186 1.00 33.68 C ATOM 1569 C GLY B 213 46.513 41.897 58.079 1.00 42.33 C ATOM 1570 O GLY B 213 47.714 41.730 57.837 1.00 40.63 O ATOM 1571 H GLY B 213 43.584 42.364 56.886 1.00 0.00 H ATOM 1572 N LYS B 214 45.901 41.319 59.106 1.00 36.60 N ATOM 1573 CA LYS B 214 46.663 40.545 60.080 1.00 42.87 C ATOM 1574 C LYS B 214 47.180 39.195 59.544 1.00 45.07 C ATOM 1575 O LYS B 214 48.154 38.651 60.063 1.00 46.05 O ATOM 1576 CB LYS B 214 45.846 40.379 61.359 1.00 45.54 C ATOM 1577 CG LYS B 214 45.220 41.695 61.807 1.00 46.56 C ATOM 1578 CD LYS B 214 44.990 41.734 63.310 1.00 55.43 C ATOM 1579 CE LYS B 214 45.522 43.042 63.899 1.00 59.80 C ATOM 1580 NZ LYS B 214 46.993 43.217 63.647 1.00 50.68 N ATOM 1581 HZ1 LYS B 214 47.514 42.429 64.082 1.00 0.00 H ATOM 1582 HZ2 LYS B 214 47.169 43.227 62.622 1.00 0.00 H ATOM 1583 HZ3 LYS B 214 47.310 44.116 64.063 1.00 0.00 H ATOM 1584 H LYS B 214 44.872 41.419 59.217 1.00 0.00 H ATOM 1585 N GLY B 215 46.542 38.678 58.495 1.00 45.74 N ATOM 1586 CA GLY B 215 46.940 37.416 57.891 1.00 43.99 C ATOM 1587 C GLY B 215 47.379 37.557 56.444 1.00 44.62 C ATOM 1588 O GLY B 215 48.453 38.095 56.165 1.00 45.05 O ATOM 1589 H GLY B 215 45.733 39.194 58.095 1.00 0.00 H ATOM 1590 N GLN B 216 46.545 37.080 55.519 1.00 44.92 N ATOM 1591 CA GLN B 216 46.864 37.141 54.091 1.00 45.63 C ATOM 1592 C GLN B 216 46.224 38.321 53.344 1.00 45.81 C ATOM 1593 O GLN B 216 46.519 38.534 52.163 1.00 45.23 O ATOM 1594 CB GLN B 216 46.491 35.829 53.378 1.00 45.70 C ATOM 1595 CG GLN B 216 47.505 34.693 53.543 1.00 44.71 C ATOM 1596 CD GLN B 216 47.126 33.452 52.739 1.00 47.83 C ATOM 1597 OE1 GLN B 216 46.723 33.549 51.577 1.00 45.96 O ATOM 1598 NE2 GLN B 216 47.244 32.280 53.362 1.00 44.55 N ATOM 1599 HE22 GLN B 216 47.588 32.245 54.343 1.00 0.00 H ATOM 1600 HE21 GLN B 216 46.992 31.401 52.867 1.00 0.00 H ATOM 1601 H GLN B 216 45.645 36.654 55.819 1.00 0.00 H ATOM 1602 N GLY B 217 45.354 39.080 54.003 1.00 40.43 N ATOM 1603 CA GLY B 217 44.691 40.178 53.311 1.00 36.68 C ATOM 1604 C GLY B 217 45.424 41.507 53.417 1.00 32.91 C ATOM 1605 O GLY B 217 46.323 41.673 54.243 1.00 34.63 O ATOM 1606 H GLY B 217 45.148 38.892 55.005 1.00 0.00 H ATOM 1607 N TYR B 218 45.058 42.468 52.574 1.00 29.19 N ATOM 1608 CA TYR B 218 45.557 43.829 52.762 1.00 25.11 C ATOM 1609 C TYR B 218 44.616 44.530 53.739 1.00 25.56 C ATOM 1610 O TYR B 218 43.404 44.380 53.648 1.00 24.37 O ATOM 1611 CB TYR B 218 45.599 44.583 51.431 1.00 25.56 C ATOM 1612 CG TYR B 218 46.643 44.036 50.495 1.00 27.69 C ATOM 1613 CD1 TYR B 218 47.987 44.331 50.678 1.00 27.46 C ATOM 1614 CD2 TYR B 218 46.290 43.197 49.445 1.00 29.87 C ATOM 1615 CE1 TYR B 218 48.959 43.819 49.817 1.00 31.30 C ATOM 1616 CE2 TYR B 218 47.250 42.687 48.584 1.00 31.62 C ATOM 1617 CZ TYR B 218 48.573 42.994 48.777 1.00 33.58 C ATOM 1618 OH TYR B 218 49.517 42.469 47.927 1.00 32.24 O ATOM 1619 HH TYR B 218 49.328 42.766 47.002 1.00 0.00 H ATOM 1620 H TYR B 218 44.418 42.252 51.783 1.00 0.00 H ATOM 1621 N SER B 219 45.174 45.271 54.689 1.00 24.46 N ATOM 1622 CA SER B 219 44.337 45.986 55.648 1.00 23.31 C ATOM 1623 C SER B 219 43.555 47.104 54.966 1.00 23.16 C ATOM 1624 O SER B 219 44.142 48.089 54.520 1.00 21.08 O ATOM 1625 CB SER B 219 45.176 46.583 56.771 1.00 24.21 C ATOM 1626 OG SER B 219 44.365 47.450 57.554 1.00 24.48 O ATOM 1627 HG SER B 219 44.909 47.839 58.284 1.00 0.00 H ATOM 1628 H SER B 219 46.210 45.342 54.750 1.00 0.00 H ATOM 1629 N LEU B 220 42.235 46.957 54.889 1.00 23.98 N ATOM 1630 CA LEU B 220 41.400 48.032 54.357 1.00 24.16 C ATOM 1631 C LEU B 220 41.570 49.287 55.198 1.00 23.86 C ATOM 1632 O LEU B 220 41.561 50.401 54.679 1.00 23.72 O ATOM 1633 CB LEU B 220 39.935 47.618 54.338 1.00 24.11 C ATOM 1634 CG LEU B 220 38.936 48.592 53.722 1.00 23.72 C ATOM 1635 CD1 LEU B 220 39.358 48.918 52.296 1.00 24.46 C ATOM 1636 CD2 LEU B 220 37.530 48.010 53.759 1.00 25.60 C ATOM 1637 H LEU B 220 41.794 46.071 55.210 1.00 0.00 H ATOM 1638 N PHE B 221 41.722 49.111 56.506 1.00 21.79 N ATOM 1639 CA PHE B 221 41.846 50.257 57.396 1.00 24.68 C ATOM 1640 C PHE B 221 43.095 51.065 57.051 1.00 23.28 C ATOM 1641 O PHE B 221 43.034 52.284 56.922 1.00 20.51 O ATOM 1642 CB PHE B 221 41.882 49.794 58.857 1.00 21.86 C ATOM 1643 CG PHE B 221 42.363 50.840 59.824 1.00 21.56 C ATOM 1644 CD1 PHE B 221 41.641 52.010 60.029 1.00 21.77 C ATOM 1645 CD2 PHE B 221 43.523 50.633 60.567 1.00 24.22 C ATOM 1646 CE1 PHE B 221 42.075 52.971 60.944 1.00 19.98 C ATOM 1647 CE2 PHE B 221 43.958 51.580 61.479 1.00 24.94 C ATOM 1648 CZ PHE B 221 43.226 52.753 61.676 1.00 22.88 C ATOM 1649 H PHE B 221 41.753 48.148 56.897 1.00 0.00 H ATOM 1650 N LEU B 222 44.232 50.384 56.900 1.00 22.89 N ATOM 1651 CA LEU B 222 45.479 51.084 56.623 1.00 22.59 C ATOM 1652 C LEU B 222 45.477 51.709 55.223 1.00 21.36 C ATOM 1653 O LEU B 222 45.951 52.830 55.022 1.00 21.17 O ATOM 1654 CB LEU B 222 46.665 50.125 56.756 1.00 23.37 C ATOM 1655 CG LEU B 222 46.978 49.627 58.179 1.00 24.16 C ATOM 1656 CD1 LEU B 222 48.176 48.692 58.130 1.00 24.40 C ATOM 1657 CD2 LEU B 222 47.273 50.830 59.057 1.00 24.64 C ATOM 1658 H LEU B 222 44.228 49.347 56.981 1.00 0.00 H ATOM 1659 N VAL B 223 44.967 50.971 54.252 1.00 20.18 N ATOM 1660 CA VAL B 223 44.983 51.491 52.892 1.00 21.54 C ATOM 1661 C VAL B 223 44.021 52.666 52.805 1.00 21.74 C ATOM 1662 O VAL B 223 44.348 53.674 52.186 1.00 22.98 O ATOM 1663 CB VAL B 223 44.627 50.406 51.865 1.00 23.52 C ATOM 1664 CG1 VAL B 223 44.520 51.013 50.440 1.00 22.70 C ATOM 1665 CG2 VAL B 223 45.697 49.316 51.899 1.00 24.98 C ATOM 1666 H VAL B 223 44.561 50.035 54.456 1.00 0.00 H ATOM 1667 N ALA B 224 42.857 52.553 53.448 1.00 21.41 N ATOM 1668 CA ALA B 224 41.900 53.672 53.454 1.00 19.76 C ATOM 1669 C ALA B 224 42.499 54.882 54.150 1.00 22.46 C ATOM 1670 O ALA B 224 42.346 56.007 53.682 1.00 21.87 O ATOM 1671 CB ALA B 224 40.589 53.286 54.094 1.00 23.43 C ATOM 1672 H ALA B 224 42.625 51.671 53.947 1.00 0.00 H ATOM 1673 N ALA B 225 43.222 54.661 55.245 1.00 19.95 N ATOM 1674 CA ALA B 225 43.817 55.790 55.967 1.00 21.12 C ATOM 1675 C ALA B 225 44.763 56.562 55.047 1.00 18.73 C ATOM 1676 O ALA B 225 44.761 57.799 54.996 1.00 21.08 O ATOM 1677 CB ALA B 225 44.549 55.303 57.201 1.00 22.85 C ATOM 1678 H ALA B 225 43.365 53.690 55.588 1.00 0.00 H ATOM 1679 N HIS B 226 45.563 55.810 54.313 1.00 18.90 N ATOM 1680 CA HIS B 226 46.473 56.365 53.324 1.00 19.48 C ATOM 1681 C HIS B 226 45.748 57.119 52.207 1.00 20.96 C ATOM 1682 O HIS B 226 46.106 58.253 51.884 1.00 20.51 O ATOM 1683 CB HIS B 226 47.296 55.231 52.712 1.00 21.14 C ATOM 1684 CG HIS B 226 48.242 55.685 51.645 1.00 21.51 C ATOM 1685 ND1 HIS B 226 49.566 55.972 51.900 1.00 20.09 N ATOM 1686 CD2 HIS B 226 48.054 55.912 50.321 1.00 22.28 C ATOM 1687 CE1 HIS B 226 50.156 56.349 50.780 1.00 24.06 C ATOM 1688 NE2 HIS B 226 49.260 56.325 49.811 1.00 19.93 N ATOM 1689 H HIS B 226 45.541 54.779 54.448 1.00 0.00 H ATOM 1690 N GLU B 227 44.762 56.482 51.585 1.00 19.67 N ATOM 1691 CA GLU B 227 44.056 57.131 50.463 1.00 21.86 C ATOM 1692 C GLU B 227 43.263 58.365 50.899 1.00 21.38 C ATOM 1693 O GLU B 227 43.178 59.360 50.168 1.00 23.00 O ATOM 1694 CB GLU B 227 43.131 56.146 49.754 1.00 20.57 C ATOM 1695 CG GLU B 227 43.846 54.910 49.225 1.00 21.32 C ATOM 1696 CD GLU B 227 44.906 55.215 48.168 1.00 23.88 C ATOM 1697 OE1 GLU B 227 44.861 56.302 47.545 1.00 23.16 O ATOM 1698 OE2 GLU B 227 45.807 54.361 48.002 1.00 24.48 O ATOM 1699 H GLU B 227 44.488 55.526 51.889 1.00 0.00 H ATOM 1700 N PHE B 228 42.675 58.305 52.087 1.00 22.39 N ATOM 1701 CA PHE B 228 41.958 59.458 52.622 1.00 19.99 C ATOM 1702 C PHE B 228 42.902 60.646 52.809 1.00 22.36 C ATOM 1703 O PHE B 228 42.478 61.803 52.743 1.00 23.75 O ATOM 1704 CB PHE B 228 41.249 59.100 53.936 1.00 22.42 C ATOM 1705 CG PHE B 228 40.122 58.108 53.771 1.00 23.42 C ATOM 1706 CD1 PHE B 228 39.655 57.762 52.507 1.00 23.17 C ATOM 1707 CD2 PHE B 228 39.537 57.516 54.886 1.00 21.29 C ATOM 1708 CE1 PHE B 228 38.626 56.837 52.358 1.00 22.95 C ATOM 1709 CE2 PHE B 228 38.511 56.600 54.753 1.00 23.33 C ATOM 1710 CZ PHE B 228 38.050 56.252 53.491 1.00 22.91 C ATOM 1711 H PHE B 228 42.726 57.427 52.643 1.00 0.00 H ATOM 1712 N GLY B 229 44.180 60.356 53.034 1.00 24.36 N ATOM 1713 CA GLY B 229 45.198 61.395 53.156 1.00 22.82 C ATOM 1714 C GLY B 229 45.300 62.142 51.839 1.00 23.83 C ATOM 1715 O GLY B 229 45.369 63.367 51.806 1.00 21.29 O ATOM 1716 H GLY B 229 44.463 59.359 53.126 1.00 0.00 H ATOM 1717 N HIS B 230 45.276 61.392 50.743 1.00 22.43 N ATOM 1718 CA HIS B 230 45.269 61.994 49.405 1.00 22.44 C ATOM 1719 C HIS B 230 43.992 62.785 49.203 1.00 24.15 C ATOM 1720 O HIS B 230 44.009 63.889 48.659 1.00 24.37 O ATOM 1721 CB HIS B 230 45.297 60.911 48.330 1.00 21.72 C ATOM 1722 CG HIS B 230 46.616 60.235 48.159 1.00 23.32 C ATOM 1723 ND1 HIS B 230 47.814 60.918 48.126 1.00 24.27 N ATOM 1724 CD2 HIS B 230 46.925 58.928 48.006 1.00 21.75 C ATOM 1725 CE1 HIS B 230 48.801 60.060 47.947 1.00 23.61 C ATOM 1726 NE2 HIS B 230 48.288 58.846 47.862 1.00 20.98 N ATOM 1727 H HIS B 230 45.262 60.356 50.835 1.00 0.00 H ATOM 1728 N ALA B 231 42.877 62.201 49.625 1.00 22.53 N ATOM 1729 CA ALA B 231 41.573 62.834 49.453 1.00 21.83 C ATOM 1730 C ALA B 231 41.487 64.136 50.244 1.00 26.83 C ATOM 1731 O ALA B 231 40.543 64.913 50.070 1.00 27.22 O ATOM 1732 CB ALA B 231 40.446 61.888 49.861 1.00 25.61 C ATOM 1733 H ALA B 231 42.934 61.272 50.088 1.00 0.00 H ATOM 1734 N LEU B 232 42.452 64.356 51.139 1.00 21.15 N ATOM 1735 CA LEU B 232 42.527 65.605 51.886 1.00 23.29 C ATOM 1736 C LEU B 232 43.549 66.566 51.288 1.00 24.75 C ATOM 1737 O LEU B 232 43.628 67.721 51.704 1.00 26.95 O ATOM 1738 CB LEU B 232 42.887 65.345 53.351 1.00 26.41 C ATOM 1739 CG LEU B 232 41.820 64.557 54.112 1.00 23.35 C ATOM 1740 CD1 LEU B 232 42.203 64.430 55.600 1.00 24.66 C ATOM 1741 CD2 LEU B 232 40.424 65.169 53.964 1.00 26.48 C ATOM 1742 H LEU B 232 43.167 63.619 51.307 1.00 0.00 H ATOM 1743 N GLY B 233 44.332 66.072 50.336 1.00 25.61 N ATOM 1744 CA GLY B 233 45.331 66.891 49.654 1.00 25.54 C ATOM 1745 C GLY B 233 46.783 66.507 49.918 1.00 25.93 C ATOM 1746 O GLY B 233 47.697 67.231 49.530 1.00 24.57 O ATOM 1747 H GLY B 233 44.231 65.072 50.068 1.00 0.00 H ATOM 1748 N LEU B 234 47.016 65.374 50.578 1.00 25.59 N ATOM 1749 CA LEU B 234 48.390 64.954 50.849 1.00 27.58 C ATOM 1750 C LEU B 234 49.035 64.233 49.690 1.00 26.80 C ATOM 1751 O LEU B 234 48.378 63.533 48.909 1.00 28.38 O ATOM 1752 CB LEU B 234 48.488 64.070 52.093 1.00 26.61 C ATOM 1753 CG LEU B 234 48.170 64.758 53.416 1.00 27.25 C ATOM 1754 CD1 LEU B 234 48.262 63.741 54.551 1.00 27.39 C ATOM 1755 CD2 LEU B 234 49.114 65.915 53.647 1.00 25.04 C ATOM 1756 H LEU B 234 46.220 64.788 50.901 1.00 0.00 H ATOM 1757 N ASP B 235 50.343 64.420 49.600 1.00 26.21 N ATOM 1758 CA ASP B 235 51.174 63.761 48.619 1.00 31.19 C ATOM 1759 C ASP B 235 51.882 62.605 49.298 1.00 30.21 C ATOM 1760 O ASP B 235 51.829 62.472 50.531 1.00 27.36 O ATOM 1761 CB ASP B 235 52.220 64.754 48.119 1.00 33.73 C ATOM 1762 CG ASP B 235 52.484 64.609 46.659 1.00 41.62 C ATOM 1763 OD1 ASP B 235 52.321 63.479 46.152 1.00 43.46 O ATOM 1764 OD2 ASP B 235 52.847 65.620 46.016 1.00 48.48 O ATOM 1765 H ASP B 235 50.795 65.075 50.270 1.00 0.00 H ATOM 1766 N HIS B 236 52.584 61.794 48.517 1.00 27.31 N ATOM 1767 CA HIS B 236 53.382 60.725 49.105 1.00 27.32 C ATOM 1768 C HIS B 236 54.538 61.244 49.942 1.00 29.36 C ATOM 1769 O HIS B 236 55.040 62.351 49.723 1.00 30.00 O ATOM 1770 CB HIS B 236 53.877 59.762 48.032 1.00 26.81 C ATOM 1771 CG HIS B 236 52.812 58.832 47.564 1.00 28.88 C ATOM 1772 ND1 HIS B 236 52.718 58.386 46.264 1.00 26.26 N ATOM 1773 CD2 HIS B 236 51.771 58.283 48.229 1.00 23.20 C ATOM 1774 CE1 HIS B 236 51.666 57.596 46.146 1.00 24.75 C ATOM 1775 NE2 HIS B 236 51.076 57.512 47.329 1.00 26.02 N ATOM 1776 H HIS B 236 52.565 61.921 47.485 1.00 0.00 H ATOM 1777 N SER B 237 54.930 60.432 50.915 1.00 28.16 N ATOM 1778 CA SER B 237 56.055 60.711 51.790 1.00 29.77 C ATOM 1779 C SER B 237 57.222 59.836 51.349 1.00 27.53 C ATOM 1780 O SER B 237 57.015 58.728 50.845 1.00 29.15 O ATOM 1781 CB SER B 237 55.660 60.370 53.238 1.00 27.85 C ATOM 1782 OG SER B 237 56.768 60.446 54.119 1.00 28.69 O ATOM 1783 HG SER B 237 57.137 61.365 54.105 1.00 0.00 H ATOM 1784 H SER B 237 54.403 59.547 51.059 1.00 0.00 H ATOM 1785 N SER B 238 58.443 60.320 51.539 1.00 28.90 N ATOM 1786 CA SER B 238 59.627 59.511 51.262 1.00 32.12 C ATOM 1787 C SER B 238 60.098 58.774 52.525 1.00 34.36 C ATOM 1788 O SER B 238 61.090 58.046 52.504 1.00 33.09 O ATOM 1789 CB SER B 238 60.741 60.390 50.707 1.00 35.26 C ATOM 1790 OG SER B 238 61.018 61.447 51.602 1.00 40.89 O ATOM 1791 HG SER B 238 60.203 61.995 51.726 1.00 0.00 H ATOM 1792 H SER B 238 58.559 61.292 51.891 1.00 0.00 H ATOM 1793 N VAL B 239 59.375 58.970 53.624 1.00 29.20 N ATOM 1794 CA VAL B 239 59.664 58.277 54.881 1.00 31.05 C ATOM 1795 C VAL B 239 59.006 56.912 54.908 1.00 29.81 C ATOM 1796 O VAL B 239 57.785 56.811 55.003 1.00 28.87 O ATOM 1797 CB VAL B 239 59.162 59.101 56.071 1.00 32.01 C ATOM 1798 CG1 VAL B 239 59.459 58.393 57.402 1.00 30.14 C ATOM 1799 CG2 VAL B 239 59.783 60.484 56.023 1.00 31.16 C ATOM 1800 H VAL B 239 58.578 59.637 53.589 1.00 0.00 H ATOM 1801 N PRO B 240 59.814 55.846 54.843 1.00 31.57 N ATOM 1802 CA PRO B 240 59.292 54.480 54.725 1.00 32.83 C ATOM 1803 C PRO B 240 58.258 54.096 55.786 1.00 34.82 C ATOM 1804 O PRO B 240 57.369 53.307 55.478 1.00 33.64 O ATOM 1805 CB PRO B 240 60.549 53.614 54.840 1.00 36.49 C ATOM 1806 CG PRO B 240 61.630 54.490 54.277 1.00 36.53 C ATOM 1807 CD PRO B 240 61.284 55.889 54.716 1.00 36.62 C ATOM 1808 N GLU B 241 58.353 54.642 56.996 1.00 32.56 N ATOM 1809 CA GLU B 241 57.418 54.259 58.052 1.00 35.54 C ATOM 1810 C GLU B 241 56.141 55.098 58.051 1.00 32.45 C ATOM 1811 O GLU B 241 55.139 54.716 58.665 1.00 31.56 O ATOM 1812 CB GLU B 241 58.088 54.349 59.428 1.00 36.34 C ATOM 1813 CG GLU B 241 59.285 53.419 59.595 1.00 43.17 C ATOM 1814 CD GLU B 241 60.512 53.882 58.821 1.00 43.42 C ATOM 1815 OE1 GLU B 241 60.583 55.086 58.473 1.00 40.93 O ATOM 1816 OE2 GLU B 241 61.410 53.040 58.564 1.00 47.86 O ATOM 1817 H GLU B 241 59.095 55.344 57.191 1.00 0.00 H ATOM 1818 N ALA B 242 56.174 56.237 57.368 1.00 29.03 N ATOM 1819 CA ALA B 242 55.034 57.157 57.383 1.00 28.49 C ATOM 1820 C ALA B 242 53.825 56.530 56.703 1.00 25.46 C ATOM 1821 O ALA B 242 53.978 55.735 55.779 1.00 25.09 O ATOM 1822 CB ALA B 242 55.402 58.462 56.710 1.00 27.42 C ATOM 1823 H ALA B 242 57.021 56.479 56.815 1.00 0.00 H ATOM 1824 N LEU B 243 52.626 56.876 57.170 1.00 20.43 N ATOM 1825 CA LEU B 243 51.401 56.398 56.539 1.00 21.39 C ATOM 1826 C LEU B 243 51.362 56.720 55.036 1.00 23.94 C ATOM 1827 O LEU B 243 50.844 55.935 54.237 1.00 23.23 O ATOM 1828 CB LEU B 243 50.178 57.009 57.230 1.00 23.69 C ATOM 1829 CG LEU B 243 48.808 56.676 56.625 1.00 22.58 C ATOM 1830 CD1 LEU B 243 48.532 55.177 56.695 1.00 22.50 C ATOM 1831 CD2 LEU B 243 47.726 57.457 57.353 1.00 22.02 C ATOM 1832 H LEU B 243 52.562 57.499 58.000 1.00 0.00 H ATOM 1833 N MET B 244 51.878 57.884 54.665 1.00 21.88 N ATOM 1834 CA MET B 244 51.757 58.359 53.282 1.00 25.73 C ATOM 1835 C MET B 244 52.880 57.870 52.345 1.00 24.63 C ATOM 1836 O MET B 244 52.901 58.220 51.159 1.00 26.01 O ATOM 1837 CB MET B 244 51.643 59.885 53.238 1.00 24.95 C ATOM 1838 CG MET B 244 50.354 60.439 53.811 1.00 23.40 C ATOM 1839 SD MET B 244 48.874 59.593 53.230 1.00 23.38 S ATOM 1840 CE MET B 244 49.043 59.901 51.444 1.00 22.01 C ATOM 1841 H MET B 244 52.376 58.469 55.365 1.00 0.00 H ATOM 1842 N TYR B 245 53.799 57.062 52.871 1.00 24.03 N ATOM 1843 CA TYR B 245 54.719 56.289 52.022 1.00 26.34 C ATOM 1844 C TYR B 245 53.897 55.425 51.073 1.00 26.43 C ATOM 1845 O TYR B 245 52.918 54.807 51.478 1.00 21.72 O ATOM 1846 CB TYR B 245 55.597 55.406 52.897 1.00 29.08 C ATOM 1847 CG TYR B 245 56.846 54.873 52.219 1.00 29.24 C ATOM 1848 CD1 TYR B 245 57.877 55.724 51.854 1.00 28.19 C ATOM 1849 CD2 TYR B 245 57.005 53.516 51.998 1.00 30.04 C ATOM 1850 CE1 TYR B 245 59.029 55.237 51.253 1.00 33.68 C ATOM 1851 CE2 TYR B 245 58.153 53.018 51.404 1.00 31.66 C ATOM 1852 CZ TYR B 245 59.157 53.881 51.037 1.00 32.85 C ATOM 1853 OH TYR B 245 60.293 53.381 50.442 1.00 37.33 O ATOM 1854 HH TYR B 245 60.914 54.126 50.241 1.00 0.00 H ATOM 1855 H TYR B 245 53.868 56.976 53.905 1.00 0.00 H ATOM 1856 N PRO B 246 54.280 55.383 49.789 1.00 27.80 N ATOM 1857 CA PRO B 246 53.376 54.784 48.794 1.00 27.13 C ATOM 1858 C PRO B 246 53.280 53.262 48.862 1.00 27.73 C ATOM 1859 O PRO B 246 52.278 52.683 48.405 1.00 26.72 O ATOM 1860 CB PRO B 246 53.988 55.225 47.455 1.00 25.71 C ATOM 1861 CG PRO B 246 55.409 55.492 47.761 1.00 27.65 C ATOM 1862 CD PRO B 246 55.437 56.042 49.165 1.00 27.61 C ATOM 1863 N MET B 247 54.295 52.616 49.428 1.00 27.29 N ATOM 1864 CA MET B 247 54.290 51.159 49.527 1.00 26.52 C ATOM 1865 C MET B 247 53.408 50.662 50.660 1.00 29.48 C ATOM 1866 O MET B 247 53.351 51.274 51.728 1.00 29.50 O ATOM 1867 CB MET B 247 55.699 50.617 49.748 1.00 31.35 C ATOM 1868 CG MET B 247 56.688 50.904 48.628 1.00 32.32 C ATOM 1869 SD MET B 247 58.113 49.828 48.834 1.00 41.52 S ATOM 1870 CE MET B 247 58.044 49.440 50.577 1.00 40.03 C ATOM 1871 H MET B 247 55.101 53.154 49.804 1.00 0.00 H ATOM 1872 N TYR B 248 52.732 49.539 50.440 1.00 26.90 N ATOM 1873 CA TYR B 248 51.964 48.917 51.505 1.00 27.85 C ATOM 1874 C TYR B 248 52.884 48.262 52.523 1.00 30.39 C ATOM 1875 O TYR B 248 53.812 47.537 52.170 1.00 29.83 O ATOM 1876 CB TYR B 248 51.001 47.872 50.976 1.00 29.74 C ATOM 1877 CG TYR B 248 50.207 47.196 52.076 1.00 28.48 C ATOM 1878 CD1 TYR B 248 49.104 47.818 52.645 1.00 26.28 C ATOM 1879 CD2 TYR B 248 50.570 45.930 52.548 1.00 28.62 C ATOM 1880 CE1 TYR B 248 48.369 47.202 53.649 1.00 28.08 C ATOM 1881 CE2 TYR B 248 49.842 45.305 53.556 1.00 29.92 C ATOM 1882 CZ TYR B 248 48.751 45.953 54.105 1.00 27.46 C ATOM 1883 OH TYR B 248 48.021 45.342 55.090 1.00 25.27 O ATOM 1884 HH TYR B 248 47.649 44.492 54.744 1.00 0.00 H ATOM 1885 H TYR B 248 52.753 49.101 49.497 1.00 0.00 H ATOM 1886 N ARG B 249 52.603 48.520 53.795 1.00 31.77 N ATOM 1887 CA ARG B 249 53.380 47.958 54.879 1.00 32.30 C ATOM 1888 C ARG B 249 52.453 47.773 56.068 1.00 32.52 C ATOM 1889 O ARG B 249 52.034 48.739 56.689 1.00 35.70 O ATOM 1890 CB ARG B 249 54.522 48.900 55.252 1.00 37.72 C ATOM 1891 CG ARG B 249 55.256 48.501 56.520 1.00 42.34 C ATOM 1892 CD ARG B 249 56.148 49.632 57.027 1.00 46.24 C ATOM 1893 NE ARG B 249 55.405 50.646 57.782 1.00 47.06 N ATOM 1894 CZ ARG B 249 55.510 50.825 59.098 1.00 47.91 C ATOM 1895 NH1 ARG B 249 56.328 50.055 59.806 1.00 50.38 N ATOM 1896 NH2 ARG B 249 54.803 51.779 59.707 1.00 48.13 N ATOM 1897 HE ARG B 249 54.755 51.265 57.257 1.00 0.00 H ATOM 1898 HH12 ARG B 249 56.412 50.192 60.833 1.00 0.00 H ATOM 1899 HH11 ARG B 249 56.885 49.315 59.333 1.00 0.00 H ATOM 1900 HH22 ARG B 249 54.889 51.914 60.735 1.00 0.00 H ATOM 1901 HH21 ARG B 249 54.166 52.387 59.154 1.00 0.00 H ATOM 1902 H ARG B 249 51.802 49.144 54.019 1.00 0.00 H ATOM 1903 N PHE B 250 52.119 46.529 56.371 1.00 30.10 N ATOM 1904 CA PHE B 250 51.226 46.266 57.476 1.00 31.11 C ATOM 1905 C PHE B 250 51.876 46.649 58.795 1.00 31.11 C ATOM 1906 O PHE B 250 53.077 46.459 58.988 1.00 30.35 O ATOM 1907 CB PHE B 250 50.805 44.803 57.508 1.00 31.03 C ATOM 1908 CG PHE B 250 49.886 44.488 58.640 1.00 33.17 C ATOM 1909 CD1 PHE B 250 48.535 44.782 58.551 1.00 32.78 C ATOM 1910 CD2 PHE B 250 50.377 43.938 59.815 1.00 32.30 C ATOM 1911 CE1 PHE B 250 47.679 44.510 59.614 1.00 36.37 C ATOM 1912 CE2 PHE B 250 49.532 43.658 60.877 1.00 33.54 C ATOM 1913 CZ PHE B 250 48.183 43.948 60.779 1.00 36.92 C ATOM 1914 H PHE B 250 52.500 45.739 55.813 1.00 0.00 H ATOM 1915 N THR B 251 51.072 47.210 59.691 1.00 33.36 N ATOM 1916 CA THR B 251 51.515 47.483 61.048 1.00 34.34 C ATOM 1917 C THR B 251 50.323 47.389 61.977 1.00 32.36 C ATOM 1918 O THR B 251 49.179 47.561 61.546 1.00 28.64 O ATOM 1919 CB THR B 251 52.175 48.877 61.183 1.00 36.54 C ATOM 1920 OG1 THR B 251 52.548 49.091 62.554 1.00 34.81 O ATOM 1921 CG2 THR B 251 51.221 49.994 60.724 1.00 29.70 C ATOM 1922 HG1 THR B 251 52.971 49.982 62.645 1.00 0.00 H ATOM 1923 H THR B 251 50.101 47.460 59.415 1.00 0.00 H ATOM 1924 N GLU B 252 50.582 47.089 63.250 1.00 32.69 N ATOM 1925 CA GLU B 252 49.532 47.129 64.263 1.00 33.28 C ATOM 1926 C GLU B 252 49.681 48.366 65.119 1.00 31.33 C ATOM 1927 O GLU B 252 48.869 48.611 66.014 1.00 33.03 O ATOM 1928 CB GLU B 252 49.573 45.893 65.159 1.00 39.34 C ATOM 1929 CG GLU B 252 49.606 44.594 64.386 1.00 44.35 C ATOM 1930 CD GLU B 252 49.421 43.384 65.272 1.00 53.67 C ATOM 1931 OE1 GLU B 252 48.291 43.178 65.768 1.00 55.59 O ATOM 1932 OE2 GLU B 252 50.410 42.644 65.472 1.00 56.76 O ATOM 1933 H GLU B 252 51.549 46.822 63.526 1.00 0.00 H ATOM 1934 N GLY B 253 50.724 49.137 64.843 1.00 31.15 N ATOM 1935 CA GLY B 253 50.963 50.379 65.542 1.00 30.56 C ATOM 1936 C GLY B 253 50.051 51.484 65.052 1.00 30.14 C ATOM 1937 O GLY B 253 49.336 51.325 64.050 1.00 31.51 O ATOM 1938 H GLY B 253 51.390 48.839 64.102 1.00 0.00 H ATOM 1939 N PRO B 254 50.058 52.613 65.760 1.00 26.79 N ATOM 1940 CA PRO B 254 49.293 53.782 65.319 1.00 26.35 C ATOM 1941 C PRO B 254 49.771 54.199 63.928 1.00 24.25 C ATOM 1942 O PRO B 254 50.977 54.320 63.682 1.00 25.99 O ATOM 1943 CB PRO B 254 49.640 54.843 66.369 1.00 27.31 C ATOM 1944 CG PRO B 254 49.977 54.006 67.620 1.00 27.40 C ATOM 1945 CD PRO B 254 50.706 52.822 67.070 1.00 28.31 C ATOM 1946 N PRO B 255 48.828 54.371 63.002 1.00 22.73 N ATOM 1947 CA PRO B 255 49.266 54.549 61.609 1.00 23.83 C ATOM 1948 C PRO B 255 49.939 55.896 61.322 1.00 24.28 C ATOM 1949 O PRO B 255 50.806 55.955 60.452 1.00 24.03 O ATOM 1950 CB PRO B 255 47.960 54.405 60.810 1.00 20.08 C ATOM 1951 CG PRO B 255 47.029 53.605 61.728 1.00 24.36 C ATOM 1952 CD PRO B 255 47.391 54.063 63.117 1.00 22.95 C ATOM 1953 N LEU B 256 49.566 56.964 62.022 1.00 22.87 N ATOM 1954 CA LEU B 256 50.168 58.259 61.710 1.00 22.64 C ATOM 1955 C LEU B 256 51.577 58.403 62.258 1.00 25.39 C ATOM 1956 O LEU B 256 51.861 58.006 63.383 1.00 24.20 O ATOM 1957 CB LEU B 256 49.331 59.422 62.240 1.00 21.69 C ATOM 1958 CG LEU B 256 47.931 59.660 61.674 1.00 24.62 C ATOM 1959 CD1 LEU B 256 47.354 60.933 62.283 1.00 22.67 C ATOM 1960 CD2 LEU B 256 47.968 59.763 60.166 1.00 26.98 C ATOM 1961 H LEU B 256 48.858 56.879 62.779 1.00 0.00 H ATOM 1962 N HIS B 257 52.444 59.018 61.462 1.00 23.42 N ATOM 1963 CA HIS B 257 53.773 59.398 61.915 1.00 23.82 C ATOM 1964 C HIS B 257 53.955 60.906 61.846 1.00 24.60 C ATOM 1965 O HIS B 257 53.081 61.605 61.335 1.00 23.42 O ATOM 1966 CB HIS B 257 54.827 58.627 61.113 1.00 24.27 C ATOM 1967 CG HIS B 257 54.790 57.160 61.395 1.00 26.60 C ATOM 1968 ND1 HIS B 257 55.737 56.525 62.171 1.00 33.16 N ATOM 1969 CD2 HIS B 257 53.862 56.222 61.090 1.00 27.40 C ATOM 1970 CE1 HIS B 257 55.418 55.248 62.290 1.00 32.62 C ATOM 1971 NE2 HIS B 257 54.287 55.038 61.639 1.00 30.90 N ATOM 1972 H HIS B 257 52.164 59.235 60.484 1.00 0.00 H ATOM 1973 N LYS B 258 55.051 61.413 62.411 1.00 24.91 N ATOM 1974 CA LYS B 258 55.318 62.856 62.416 1.00 22.91 C ATOM 1975 C LYS B 258 55.171 63.468 61.027 1.00 23.85 C ATOM 1976 O LYS B 258 54.585 64.535 60.875 1.00 25.67 O ATOM 1977 CB LYS B 258 56.723 63.148 62.941 1.00 24.11 C ATOM 1978 CG LYS B 258 56.904 62.869 64.442 1.00 26.39 C ATOM 1979 CD LYS B 258 58.359 63.081 64.846 1.00 26.80 C ATOM 1980 CE LYS B 258 58.580 62.752 66.319 1.00 28.64 C ATOM 1981 NZ LYS B 258 58.006 63.833 67.164 1.00 27.30 N ATOM 1982 HZ1 LYS B 258 58.473 64.734 66.937 1.00 0.00 H ATOM 1983 HZ2 LYS B 258 56.986 63.913 66.977 1.00 0.00 H ATOM 1984 HZ3 LYS B 258 58.159 63.605 68.167 1.00 0.00 H ATOM 1985 H LYS B 258 55.734 60.770 62.860 1.00 0.00 H ATOM 1986 N ASP B 259 55.695 62.784 60.017 1.00 23.80 N ATOM 1987 CA ASP B 259 55.717 63.341 58.655 1.00 26.13 C ATOM 1988 C ASP B 259 54.311 63.536 58.092 1.00 24.16 C ATOM 1989 O ASP B 259 54.040 64.526 57.406 1.00 25.50 O ATOM 1990 CB ASP B 259 56.574 62.482 57.709 1.00 24.75 C ATOM 1991 CG ASP B 259 56.831 63.177 56.373 1.00 31.35 C ATOM 1992 OD1 ASP B 259 57.569 64.190 56.363 1.00 28.70 O ATOM 1993 OD2 ASP B 259 56.281 62.719 55.345 1.00 28.68 O ATOM 1994 H ASP B 259 56.096 61.840 60.191 1.00 0.00 H ATOM 1995 N ASP B 260 53.421 62.592 58.400 1.00 25.46 N ATOM 1996 CA ASP B 260 52.006 62.675 58.026 1.00 23.66 C ATOM 1997 C ASP B 260 51.304 63.850 58.710 1.00 23.77 C ATOM 1998 O ASP B 260 50.514 64.572 58.103 1.00 22.67 O ATOM 1999 CB ASP B 260 51.296 61.378 58.431 1.00 23.23 C ATOM 2000 CG ASP B 260 51.984 60.136 57.897 1.00 27.99 C ATOM 2001 OD1 ASP B 260 52.195 60.054 56.665 1.00 24.53 O ATOM 2002 OD2 ASP B 260 52.311 59.239 58.712 1.00 25.97 O ATOM 2003 H ASP B 260 53.746 61.758 58.930 1.00 0.00 H ATOM 2004 N VAL B 261 51.580 64.031 59.997 1.00 23.21 N ATOM 2005 CA VAL B 261 50.963 65.122 60.739 1.00 22.21 C ATOM 2006 C VAL B 261 51.525 66.465 60.231 1.00 23.28 C ATOM 2007 O VAL B 261 50.768 67.416 59.987 1.00 24.39 O ATOM 2008 CB VAL B 261 51.177 64.952 62.265 1.00 23.42 C ATOM 2009 CG1 VAL B 261 50.644 66.169 63.017 1.00 24.47 C ATOM 2010 CG2 VAL B 261 50.473 63.679 62.764 1.00 22.67 C ATOM 2011 H VAL B 261 52.242 63.389 60.478 1.00 0.00 H ATOM 2012 N ASN B 262 52.847 66.531 60.069 1.00 25.33 N ATOM 2013 CA ASN B 262 53.500 67.711 59.493 1.00 24.43 C ATOM 2014 C ASN B 262 52.825 68.087 58.173 1.00 25.57 C ATOM 2015 O ASN B 262 52.458 69.242 57.945 1.00 26.84 O ATOM 2016 CB ASN B 262 54.989 67.452 59.238 1.00 29.35 C ATOM 2017 CG ASN B 262 55.795 67.370 60.527 1.00 33.21 C ATOM 2018 OD1 ASN B 262 55.372 67.881 61.569 1.00 36.90 O ATOM 2019 ND2 ASN B 262 56.947 66.707 60.466 1.00 32.65 N ATOM 2020 HD22 ASN B 262 57.262 66.294 59.565 1.00 0.00 H ATOM 2021 HD21 ASN B 262 57.532 66.602 61.319 1.00 0.00 H ATOM 2022 H ASN B 262 53.432 65.722 60.360 1.00 0.00 H ATOM 2023 N GLY B 263 52.638 67.089 57.330 1.00 25.74 N ATOM 2024 CA GLY B 263 52.040 67.292 56.021 1.00 26.10 C ATOM 2025 C GLY B 263 50.625 67.833 56.118 1.00 25.11 C ATOM 2026 O GLY B 263 50.258 68.764 55.389 1.00 25.53 O ATOM 2027 H GLY B 263 52.927 66.130 57.610 1.00 0.00 H ATOM 2028 N ILE B 264 49.808 67.263 57.004 1.00 24.60 N ATOM 2029 CA ILE B 264 48.422 67.689 57.056 1.00 23.36 C ATOM 2030 C ILE B 264 48.322 69.077 57.677 1.00 25.15 C ATOM 2031 O ILE B 264 47.488 69.884 57.279 1.00 24.53 O ATOM 2032 CB ILE B 264 47.500 66.669 57.783 1.00 22.81 C ATOM 2033 CG1 ILE B 264 46.039 66.852 57.350 1.00 21.64 C ATOM 2034 CG2 ILE B 264 47.632 66.818 59.297 1.00 20.66 C ATOM 2035 CD1 ILE B 264 45.812 66.655 55.856 1.00 27.64 C ATOM 2036 H ILE B 264 50.158 66.525 57.647 1.00 0.00 H ATOM 2037 N ARG B 265 49.178 69.367 58.649 1.00 24.62 N ATOM 2038 CA ARG B 265 49.181 70.701 59.241 1.00 23.82 C ATOM 2039 C ARG B 265 49.637 71.757 58.236 1.00 27.45 C ATOM 2040 O ARG B 265 49.255 72.921 58.328 1.00 29.03 O ATOM 2041 CB ARG B 265 50.071 70.732 60.476 1.00 25.64 C ATOM 2042 CG ARG B 265 49.402 70.040 61.647 1.00 25.46 C ATOM 2043 CD ARG B 265 50.299 70.052 62.877 1.00 28.46 C ATOM 2044 NE ARG B 265 49.715 69.274 63.966 1.00 29.82 N ATOM 2045 CZ ARG B 265 50.375 68.961 65.076 1.00 31.90 C ATOM 2046 NH1 ARG B 265 51.631 69.361 65.220 1.00 33.91 N ATOM 2047 NH2 ARG B 265 49.797 68.232 66.028 1.00 29.67 N ATOM 2048 HE ARG B 265 48.732 68.948 63.868 1.00 0.00 H ATOM 2049 HH12 ARG B 265 52.157 69.122 66.085 1.00 0.00 H ATOM 2050 HH11 ARG B 265 52.090 69.914 64.468 1.00 0.00 H ATOM 2051 HH22 ARG B 265 50.324 67.993 66.892 1.00 0.00 H ATOM 2052 HH21 ARG B 265 48.818 67.901 65.907 1.00 0.00 H ATOM 2053 H ARG B 265 49.845 68.645 58.988 1.00 0.00 H ATOM 2054 N HIS B 266 50.467 71.354 57.289 1.00 27.29 N ATOM 2055 CA HIS B 266 50.913 72.293 56.266 1.00 29.39 C ATOM 2056 C HIS B 266 49.709 72.744 55.444 1.00 32.11 C ATOM 2057 O HIS B 266 49.659 73.878 54.960 1.00 34.38 O ATOM 2058 CB HIS B 266 51.971 71.666 55.364 1.00 29.40 C ATOM 2059 CG HIS B 266 52.419 72.573 54.264 1.00 36.67 C ATOM 2060 ND1 HIS B 266 52.044 72.391 52.949 1.00 41.24 N ATOM 2061 CD2 HIS B 266 53.182 73.691 54.290 1.00 36.55 C ATOM 2062 CE1 HIS B 266 52.576 73.348 52.207 1.00 43.14 C ATOM 2063 NE2 HIS B 266 53.274 74.147 52.996 1.00 46.76 N ATOM 2064 H HIS B 266 50.801 70.369 57.274 1.00 0.00 H ATOM 2065 N LEU B 267 48.726 71.862 55.302 1.00 28.63 N ATOM 2066 CA LEU B 267 47.530 72.194 54.532 1.00 27.83 C ATOM 2067 C LEU B 267 46.432 72.897 55.331 1.00 31.22 C ATOM 2068 O LEU B 267 45.804 73.832 54.827 1.00 30.37 O ATOM 2069 CB LEU B 267 46.954 70.946 53.850 1.00 28.37 C ATOM 2070 CG LEU B 267 47.825 70.343 52.748 1.00 30.59 C ATOM 2071 CD1 LEU B 267 47.202 69.070 52.190 1.00 32.37 C ATOM 2072 CD2 LEU B 267 48.040 71.360 51.636 1.00 34.48 C ATOM 2073 H LEU B 267 48.809 70.924 55.744 1.00 0.00 H ATOM 2074 N TYR B 268 46.187 72.448 56.566 1.00 26.48 N ATOM 2075 CA TYR B 268 45.017 72.896 57.321 1.00 26.40 C ATOM 2076 C TYR B 268 45.320 73.626 58.630 1.00 29.91 C ATOM 2077 O TYR B 268 44.413 74.169 59.256 1.00 29.67 O ATOM 2078 CB TYR B 268 44.058 71.718 57.578 1.00 26.14 C ATOM 2079 CG TYR B 268 43.535 71.123 56.294 1.00 24.87 C ATOM 2080 CD1 TYR B 268 42.562 71.786 55.555 1.00 28.15 C ATOM 2081 CD2 TYR B 268 44.030 69.926 55.803 1.00 24.28 C ATOM 2082 CE1 TYR B 268 42.083 71.266 54.373 1.00 26.97 C ATOM 2083 CE2 TYR B 268 43.551 69.395 54.603 1.00 25.15 C ATOM 2084 CZ TYR B 268 42.577 70.074 53.899 1.00 24.03 C ATOM 2085 OH TYR B 268 42.090 69.578 52.698 1.00 25.78 O ATOM 2086 HH TYR B 268 42.833 69.500 52.049 1.00 0.00 H ATOM 2087 H TYR B 268 46.842 71.766 56.999 1.00 0.00 H ATOM 2088 N GLY B 269 46.582 73.630 59.039 1.00 31.08 N ATOM 2089 CA GLY B 269 46.999 74.410 60.191 1.00 32.98 C ATOM 2090 C GLY B 269 47.458 73.591 61.379 1.00 31.49 C ATOM 2091 O GLY B 269 48.389 73.985 62.091 1.00 33.04 O ATOM 2092 H GLY B 269 47.286 73.064 58.525 1.00 0.00 H TER 2093 GLY B 269 HETATM 2094 ZN ZN A 1 49.193 57.041 47.792 1.00 24.05 ZN HETATM 2095 ZN ZN A 2 39.805 54.729 40.282 1.00 30.07 ZN HETATM 2096 CA CA A 3 45.961 45.421 42.185 1.00 31.40 CA HETATM 2097 CA CA A 4 34.406 63.980 45.021 1.00 39.30 CA HETATM 2098 O HOH 5 38.466 41.538 46.783 1.00 28.35 O HETATM 2099 O HOH 6 43.266 62.654 35.099 1.00 47.86 O HETATM 2100 O HOH 7 69.086 51.161 45.962 1.00 47.40 O HETATM 2101 O HOH 8 30.457 43.453 52.483 1.00 37.42 O HETATM 2102 O HOH 9 50.574 46.525 37.819 1.00 39.76 O HETATM 2103 O HOH 10 40.987 51.892 30.593 1.00 45.14 O HETATM 2104 O HOH 11 33.986 41.807 46.144 1.00 35.62 O HETATM 2105 O HOH 12 54.187 45.052 52.148 1.00 37.29 O HETATM 2106 O HOH 13 36.518 47.666 61.121 1.00 28.54 O HETATM 2107 O HOH 14 52.894 49.143 41.031 1.00 34.46 O HETATM 2108 O HOH 15 50.325 75.211 58.354 1.00 38.72 O HETATM 2109 O HOH 16 29.520 69.683 54.195 1.00 42.91 O HETATM 2110 O HOH 17 36.391 48.584 65.192 1.00 39.32 O HETATM 2111 O HOH 18 38.629 72.244 46.974 1.00 38.20 O HETATM 2112 O HOH 19 53.096 55.134 64.857 1.00 34.13 O HETATM 2113 O HOH 20 58.205 65.901 58.379 1.00 37.74 O HETATM 2114 O HOH 21 44.761 61.171 64.878 1.00 24.06 O HETATM 2115 O HOH 22 65.968 58.350 32.997 1.00 43.97 O HETATM 2116 O HOH 23 27.552 50.224 59.630 1.00 36.29 O HETATM 2117 O HOH 24 34.034 66.575 45.306 1.00 34.99 O HETATM 2118 O HOH 25 48.475 42.771 55.575 1.00 31.99 O HETATM 2119 O HOH 26 33.467 45.073 43.779 1.00 40.88 O HETATM 2120 O HOH 27 59.370 54.151 31.445 1.00 42.35 O HETATM 2121 O HOH 28 34.148 76.544 50.179 1.00 45.20 O HETATM 2122 O HOH 29 40.822 71.834 44.379 1.00 32.17 O HETATM 2123 O HOH 30 42.202 75.253 58.324 1.00 32.48 O HETATM 2124 O HOH 31 41.757 44.992 39.354 1.00 34.59 O HETATM 2125 O HOH 32 34.022 49.346 33.703 1.00 42.41 O HETATM 2126 O HOH 33 31.826 54.686 57.863 1.00 27.93 O HETATM 2127 O HOH 34 21.617 56.410 47.835 1.00 43.25 O HETATM 2128 O HOH 35 34.573 58.171 41.866 1.00 37.50 O HETATM 2129 O HOH 36 29.909 64.173 61.779 1.00 41.68 O HETATM 2130 O HOH 37 54.213 47.349 42.801 1.00 35.80 O HETATM 2131 O HOH 38 32.716 68.521 46.953 1.00 34.18 O HETATM 2132 O HOH 39 31.937 63.860 44.759 1.00 37.25 O HETATM 2133 O HOH 40 46.591 49.772 35.183 1.00 41.54 O HETATM 2134 O HOH 41 32.195 61.559 42.515 1.00 39.27 O HETATM 2135 O HOH 42 47.020 72.757 48.268 1.00 42.67 O HETATM 2136 O HOH 43 49.549 76.293 61.279 1.00 35.88 O HETATM 2137 O HOH 44 34.932 58.741 61.712 1.00 25.80 O HETATM 2138 O HOH 45 47.121 69.531 48.206 1.00 31.46 O HETATM 2139 O HOH 46 44.270 46.710 60.170 1.00 28.13 O HETATM 2140 O HOH 47 47.101 68.584 64.296 1.00 29.23 O HETATM 2141 O HOH 48 32.649 58.544 60.204 1.00 33.81 O HETATM 2142 O HOH 49 39.419 52.790 35.923 1.00 36.59 O HETATM 2143 O HOH 50 60.277 56.903 60.484 1.00 42.43 O HETATM 2144 O HOH 51 36.657 40.127 46.388 1.00 38.64 O HETATM 2145 O HOH 52 56.370 49.772 45.267 1.00 30.20 O HETATM 2146 O HOH 53 52.779 52.808 62.199 1.00 32.53 O HETATM 2147 O HOH 54 61.400 50.935 51.070 1.00 42.56 O HETATM 2148 O HOH 55 28.130 46.916 46.921 1.00 41.04 O HETATM 2149 O HOH 56 26.372 59.712 59.321 1.00 31.55 O HETATM 2150 O HOH 57 31.720 66.341 43.534 1.00 44.43 O HETATM 2151 O HOH 58 52.474 63.461 53.035 1.00 37.98 O HETATM 2152 O HOH 59 38.746 39.138 54.491 1.00 34.47 O HETATM 2153 O HOH 60 29.723 59.815 60.038 1.00 32.41 O HETATM 2154 O HOH 61 46.263 54.185 39.543 1.00 33.79 O HETATM 2155 O HOH 62 26.604 53.590 51.845 1.00 34.07 O HETATM 2156 O HOH 63 35.527 55.359 39.061 1.00 37.85 O HETATM 2157 O HOH 64 64.084 47.676 48.852 1.00 45.88 O HETATM 2158 O HOH 65 39.223 61.264 66.015 1.00 29.99 O HETATM 2159 O HOH 66 53.709 71.495 59.048 1.00 34.69 O HETATM 2160 O HOH 67 50.372 68.048 49.746 1.00 38.03 O HETATM 2161 O HOH 68 50.596 58.035 65.891 1.00 28.14 O HETATM 2162 O HOH 69 40.486 74.914 54.632 1.00 43.01 O HETATM 2163 O HOH 70 45.950 53.073 37.029 1.00 30.09 O HETATM 2164 O HOH 71 55.810 64.454 53.164 1.00 38.37 O HETATM 2165 O HOH 72 53.023 43.512 43.707 1.00 39.80 O HETATM 2166 O HOH 73 45.048 40.212 47.403 1.00 37.27 O HETATM 2167 O HOH 74 27.720 55.714 52.862 1.00 28.29 O HETATM 2168 O HOH 75 51.344 68.956 52.747 1.00 34.89 O HETATM 2169 O HOH 76 53.432 62.101 55.085 1.00 25.33 O HETATM 2170 O HOH 77 47.836 31.162 50.445 1.00 46.86 O HETATM 2171 O HOH 78 34.850 47.603 38.727 1.00 40.99 O HETATM 2172 O HOH 79 45.731 70.197 60.282 1.00 29.05 O HETATM 2173 O HOH 80 51.944 66.083 51.318 1.00 34.42 O HETATM 2174 O HOH 81 56.315 59.258 33.727 1.00 39.40 O HETATM 2175 O HOH 82 29.891 49.828 61.427 1.00 32.88 O HETATM 2176 O HOH 83 49.231 69.550 46.087 1.00 40.10 O HETATM 2177 O HOH 84 49.365 43.477 39.687 1.00 40.60 O HETATM 2178 O HOH 85 51.675 53.682 58.890 1.00 30.10 O HETATM 2179 O HOH 86 53.276 44.267 54.963 1.00 35.20 O HETATM 2180 O HOH 87 70.512 46.431 45.739 1.00 51.51 O HETATM 2181 O HOH 88 48.245 50.674 67.972 1.00 27.79 O HETATM 2182 O HOH 89 46.271 47.547 61.856 1.00 32.89 O HETATM 2183 O HOH 90 68.180 62.183 38.581 1.00 47.41 O HETATM 2184 O HOH 91 58.567 63.220 52.023 1.00 37.62 O HETATM 2185 O HOH 92 50.286 52.641 50.629 1.00 31.38 O HETATM 2186 O HOH 93 46.870 49.981 63.014 1.00 34.55 O HETATM 2187 O HOH 94 34.821 63.589 62.319 1.00 30.37 O HETATM 2188 O HOH 95 51.002 50.994 54.334 1.00 34.23 O HETATM 2189 O HOH 96 36.978 40.663 42.655 1.00 40.84 O HETATM 2190 O HOH 97 33.463 70.594 45.976 1.00 43.55 O HETATM 2191 O HOH 98 31.256 72.597 56.127 1.00 36.59 O HETATM 2192 O HOH 99 31.535 44.760 44.642 1.00 43.27 O HETATM 2193 O HOH 100 56.394 59.359 64.187 1.00 33.51 O HETATM 2194 O HOH 101 42.083 47.470 61.696 1.00 27.25 O HETATM 2195 O HOH 102 47.840 57.061 64.546 1.00 24.41 O HETATM 2196 O HOH 103 32.083 52.854 63.345 1.00 38.23 O HETATM 2197 O HOH 104 49.577 47.126 35.239 1.00 47.63 O HETATM 2198 O HOH 105 32.371 57.626 35.038 1.00 39.39 O HETATM 2199 O HOH 106 57.867 60.610 60.396 1.00 28.53 O HETATM 2200 O HOH 107 46.587 29.302 52.804 1.00 43.22 O HETATM 2201 O HOH 108 27.340 43.740 58.101 1.00 37.77 O HETATM 2202 O HOH 109 53.412 46.043 63.990 1.00 43.27 O HETATM 2203 O HOH 110 54.517 66.626 64.299 1.00 39.71 O HETATM 2204 O HOH 111 51.403 68.409 46.158 1.00 44.77 O HETATM 2205 O HOH 112 59.608 66.252 65.978 1.00 38.96 O HETATM 2206 O HOH 113 44.308 71.247 62.900 1.00 37.01 O HETATM 2207 O HOH 114 44.533 77.141 60.428 1.00 35.90 O HETATM 2208 O HOH 115 28.313 43.056 51.059 1.00 45.07 O HETATM 2209 O HOH 116 21.573 61.126 45.522 1.00 43.08 O HETATM 2210 O HOH 117 50.599 51.648 56.471 1.00 39.13 O HETATM 2211 O HOH 118 29.696 54.416 59.560 1.00 33.99 O HETATM 2212 O HOH 119 48.957 51.819 53.994 1.00 32.55 O HETATM 2213 O HOH 120 48.769 44.917 68.606 1.00 44.31 O HETATM 2214 O HOH 121 30.783 68.320 42.799 1.00 46.05 O HETATM 2215 O HOH 122 43.454 48.645 64.275 1.00 38.64 O HETATM 2216 O HOH 123 27.125 41.995 55.606 1.00 44.92 O HETATM 2217 O HOH 124 47.477 73.812 43.702 1.00 43.38 O HETATM 2218 O HOH 125 38.847 73.707 55.769 1.00 42.34 O HETATM 2219 O HOH 126 63.774 57.763 31.949 1.00 44.82 O HETATM 2220 O HOH 127 30.709 52.444 61.293 1.00 36.36 O HETATM 2221 O HOH 128 35.970 61.197 62.199 1.00 32.08 O HETATM 2222 O HOH 129 30.577 59.546 41.474 1.00 42.39 O HETATM 2223 O HOH 130 20.895 54.076 39.265 1.00 42.28 O HETATM 2224 O HOH 131 35.875 55.668 64.608 1.00 36.80 O HETATM 2225 O HOH 132 54.047 69.155 53.259 1.00 44.87 O HETATM 2226 O HOH 133 34.447 57.450 64.145 1.00 35.25 O HETATM 2227 O HOH 134 61.369 48.447 49.283 1.00 44.99 O HETATM 2228 O HOH 135 36.327 45.465 62.757 1.00 38.49 O HETATM 2229 O HOH 136 47.440 47.164 34.320 1.00 47.43 O HETATM 2230 O HOH 137 36.272 60.968 65.191 1.00 34.75 O HETATM 2231 O HOH 138 46.358 52.944 67.434 1.00 28.75 O HETATM 2232 O HOH 139 42.020 80.204 50.209 1.00 50.76 O HETATM 2233 O HOH 140 48.534 72.194 42.202 1.00 43.74 O HETATM 2234 O HOH 141 45.138 51.170 64.857 1.00 35.86 O HETATM 2235 O HOH 142 45.911 55.477 66.141 1.00 21.46 O HETATM 2236 O HOH 143 30.932 56.978 62.193 1.00 37.29 O HETATM 2237 O HOH 144 31.910 71.083 44.355 1.00 50.08 O HETATM 2238 O HOH 145 46.767 59.351 65.773 1.00 24.03 O HETATM 2239 C10 UNN A 146 46.473 63.426 45.351 1.00 -0.01 C HETATM 2240 C09 UNN A 146 47.099 63.963 44.249 1.00 -0.01 C HETATM 2241 C11 UNN A 146 47.863 65.195 44.125 1.00 0.03 C HETATM 2242 C13 UNN A 146 48.401 66.027 45.081 1.00 -0.02 C HETATM 2243 C14 UNN A 146 48.368 65.889 46.577 1.00 -0.03 C HETATM 2244 H2 UNN A 146 48.899 66.737 47.035 1.00 0.04 H HETATM 2245 H3 UNN A 146 48.858 64.948 46.869 1.00 0.04 H HETATM 2246 H4 UNN A 146 47.323 65.881 46.922 1.00 0.04 H HETATM 2247 N03 UNN A 146 49.052 67.132 44.529 1.00 -0.31 N HETATM 2248 C12 UNN A 146 48.999 67.134 43.194 1.00 0.21 C HETATM 2249 S UNN A 146 48.137 65.769 42.490 1.00 0.01 S HETATM 2250 N UNN A 146 49.578 68.154 42.406 1.00 -0.19 N HETATM 2251 C15 UNN A 146 49.436 68.302 41.087 1.00 0.21 C HETATM 2252 C UNN A 146 50.160 69.494 40.466 1.00 0.03 C HETATM 2253 H14 UNN A 146 49.971 69.514 39.383 1.00 0.05 H HETATM 2254 H15 UNN A 146 51.241 69.402 40.648 1.00 0.05 H HETATM 2255 H16 UNN A 146 49.789 70.425 40.919 1.00 0.05 H HETATM 2256 O UNN A 146 48.766 67.531 40.393 1.00 -0.38 O HETATM 2257 H13 UNN A 146 50.146 68.827 42.880 1.00 0.24 H HETATM 2258 N02 UNN A 146 46.919 63.189 43.093 1.00 -0.32 N HETATM 2259 C08 UNN A 146 46.194 62.101 43.302 1.00 0.19 C HETATM 2260 N01 UNN A 146 45.886 61.178 42.329 1.00 -0.24 N HETATM 2261 C07 UNN A 146 46.278 61.071 41.030 1.00 0.10 C HETATM 2262 C02 UNN A 146 45.811 59.970 40.271 1.00 0.12 C HETATM 2263 O01 UNN A 146 44.984 59.079 40.932 1.00 -0.33 O HETATM 2264 C01 UNN A 146 44.329 58.027 40.230 1.00 0.06 C HETATM 2265 H5 UNN A 146 43.724 57.437 40.934 1.00 0.06 H HETATM 2266 H6 UNN A 146 45.081 57.377 39.759 1.00 0.06 H HETATM 2267 H7 UNN A 146 43.676 58.454 39.455 1.00 0.06 H HETATM 2268 C03 UNN A 146 46.211 59.857 38.908 1.00 -0.04 C HETATM 2269 C04 UNN A 146 47.056 60.828 38.326 1.00 -0.08 C HETATM 2270 C05 UNN A 146 47.514 61.922 39.087 1.00 -0.08 C HETATM 2271 C06 UNN A 146 47.129 62.043 40.444 1.00 -0.05 C HETATM 2272 H11 UNN A 146 47.485 62.879 41.036 1.00 0.05 H HETATM 2273 H10 UNN A 146 48.158 62.668 38.635 1.00 0.05 H HETATM 2274 H9 UNN A 146 47.354 60.731 37.288 1.00 0.05 H HETATM 2275 H8 UNN A 146 45.864 59.020 38.313 1.00 0.05 H HETATM 2276 H12 UNN A 146 45.244 60.435 42.639 1.00 0.22 H HETATM 2277 S01 UNN A 146 45.647 61.947 44.961 1.00 0.00 S HETATM 2278 H1 UNN A 146 46.493 63.872 46.344 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 214 215 221 222 223 CONECT 221 214 CONECT 222 214 CONECT 223 214 CONECT 524 523 2094 CONECT 587 588 598 599 600 CONECT 598 587 CONECT 599 587 CONECT 600 587 CONECT 1151 1150 2097 CONECT 1245 1243 1244 2095 CONECT 1259 1257 2095 CONECT 1305 1304 2096 CONECT 1311 1310 2096 CONECT 1329 1328 2096 CONECT 1343 1342 2096 CONECT 1373 1371 1372 2095 CONECT 1422 1421 2097 CONECT 1436 1435 2097 CONECT 1456 1455 2097 CONECT 1471 1470 1473 2095 CONECT 1688 1686 1687 2094 CONECT 1726 1724 1725 2094 CONECT 1775 1773 1774 2094 CONECT 2094 524 1688 1726 1775 CONECT 2095 1245 1259 1373 1471 CONECT 2096 1305 1311 1329 1343 CONECT 2097 1151 1422 1436 1456 CONECT 2239 2240 2277 2278 CONECT 2240 2239 2241 2258 CONECT 2241 2240 2242 2249 CONECT 2242 2241 2243 2247 CONECT 2243 2242 2244 2245 2246 CONECT 2244 2243 CONECT 2245 2243 CONECT 2246 2243 CONECT 2247 2242 2248 CONECT 2248 2247 2249 2250 CONECT 2249 2241 2248 CONECT 2250 2248 2251 2257 CONECT 2251 2250 2252 2256 CONECT 2252 2251 2253 2254 2255 CONECT 2253 2252 CONECT 2254 2252 CONECT 2255 2252 CONECT 2256 2251 CONECT 2257 2250 CONECT 2258 2240 2259 CONECT 2259 2258 2260 2277 CONECT 2260 2259 2261 2276 CONECT 2261 2260 2262 2271 CONECT 2262 2261 2263 2268 CONECT 2263 2262 2264 CONECT 2264 2263 2265 2266 2267 CONECT 2265 2264 CONECT 2266 2264 CONECT 2267 2264 CONECT 2268 2262 2269 2275 CONECT 2269 2268 2270 2274 CONECT 2270 2269 2271 2273 CONECT 2271 2261 2270 2272 CONECT 2272 2271 CONECT 2273 2270 CONECT 2274 2269 CONECT 2275 2268 CONECT 2276 2260 CONECT 2277 2239 2259 CONECT 2278 2239 MASTER 0 0 0 0 0 0 0 0 2275 3 72 19 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5ue4
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Matrix metalloproteinase-9
Ligand Name
5XQ
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50=440nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Biol. Chem. Vol. 292: pp. 17963-17974
Ligand Properties
Formula
C
1
6
H
1
6
N
4
O
2
S
2
Molecular Weight
360.454
Exact Mass
360.071
No. of atoms
40
No. of bonds
42
Polar Surface Area
132.62
LOGP Value
3.44 (
Computed with XLOGP3
)
4.43 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
Canonical SMILES
COc1ccccc1Nc1scc(n1)c1sc(nc1C)NC(=O)C
InChI String
InChI=1S/C16H16N4O2S2/c1-9-14(24-16(17-9)18-10(2)21)12-8-23-15(20-12)19-11-6-4-5-7-13(11)22-3/h4-8H,1-3H3,(H,19,20)(H,17,18,21)
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):
P14780
Entrez Gene ID
NCBI Entrez Gene ID:
4318
ASD
Information of known allosteric effects of PDB entries
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