Browse entries in the PDBbind-CN Database
HEADER 5TCA_COMPLEX COMPND 5TCA_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 228 ILE LEU GLY GLY ARG GLU ALA GLU ALA HIS ALA ARG PRO SEQRES 2 A 228 TYR MET ALA SER VAL GLN LEU ASN GLY ALA HIS LEU CYS SEQRES 3 A 228 GLY GLY VAL LEU VAL ALA GLU GLN TRP VAL LEU SER ALA SEQRES 4 A 228 ALA HIS CYS LEU GLU ASP ALA ALA ASP GLY LYS VAL GLN SEQRES 5 A 228 VAL LEU LEU GLY ALA HIS SER LEU SER GLN PRO GLU PRO SEQRES 6 A 228 SER LYS ARG LEU TYR ASP VAL LEU ARG ALA VAL PRO HIS SEQRES 7 A 228 PRO ASP SER GLN PRO ASP THR ILE ASP HIS ASP LEU LEU SEQRES 8 A 228 LEU LEU GLN LEU SER GLU LYS ALA THR LEU GLY PRO ALA SEQRES 9 A 228 VAL ARG PRO LEU PRO TRP GLN ARG VAL ASP ARG ASP VAL SEQRES 10 A 228 ALA PRO GLY THR LEU CYS ASP VAL ALA GLY TRP GLY ILE SEQRES 11 A 228 VAL ASN HIS ALA GLY ARG ARG PRO ASP SER LEU GLN HIS SEQRES 12 A 228 VAL LEU LEU PRO VAL LEU ASP ARG ALA THR CYS ASN ARG SEQRES 13 A 228 ARG THR HIS HIS ASP GLY ALA ILE THR GLU ARG LEU MET SEQRES 14 A 228 CYS ALA GLU SER ASN ARG ARG ASP SER CYS LYS GLY ASP SEQRES 15 A 228 SER GLY GLY PRO LEU VAL CYS GLY GLY VAL LEU GLU GLY SEQRES 16 A 228 VAL VAL THR SER GLY SER ARG VAL CYS GLY ASN ARG LYS SEQRES 17 A 228 LYS PRO GLY ILE TYR THR ARG VAL ALA SER TYR ALA ALA SEQRES 18 A 228 TRP ILE ASP SER VAL LEU ALA HET J A 55 46 SSBOND 1 CYS A 41 CYS A 57 SSBOND 2 CYS A 169 CYS A 185 SSBOND 3 CYS A 138 CYS A 204 SSBOND 4 CYS A 194 CYS A 219 ATOM 1 N ILE A 16 31.751 21.146 66.424 1.00 41.27 N ATOM 2 CA ILE A 16 31.346 20.030 65.585 1.00 40.77 C ATOM 3 C ILE A 16 31.911 20.281 64.165 1.00 46.88 C ATOM 4 O ILE A 16 31.521 21.250 63.491 1.00 48.43 O ATOM 5 CB ILE A 16 29.787 19.868 65.613 1.00 43.28 C ATOM 6 CG1 ILE A 16 29.245 19.462 67.004 1.00 44.02 C ATOM 7 CG2 ILE A 16 29.276 18.946 64.535 1.00 43.64 C ATOM 8 CD1 ILE A 16 29.431 18.065 67.473 1.00 52.07 C ATOM 9 HN3 ILE A 16 31.368 22.030 66.032 1.00 0.00 H ATOM 10 HN2 ILE A 16 32.789 21.199 66.451 1.00 0.00 H ATOM 11 HN1 ILE A 16 31.385 21.005 67.387 1.00 0.00 H ATOM 12 N LEU A 17 32.849 19.419 63.730 1.00 41.56 N ATOM 13 CA LEU A 17 33.447 19.488 62.391 1.00 40.15 C ATOM 14 C LEU A 17 32.530 18.747 61.399 1.00 45.38 C ATOM 15 O LEU A 17 32.047 17.665 61.729 1.00 47.88 O ATOM 16 CB LEU A 17 34.872 18.860 62.393 1.00 39.45 C ATOM 17 CG LEU A 17 35.947 19.445 63.310 1.00 42.84 C ATOM 18 CD1 LEU A 17 37.302 18.959 62.906 1.00 41.74 C ATOM 19 CD2 LEU A 17 35.946 20.954 63.255 1.00 44.21 C ATOM 20 H LEU A 17 33.166 18.667 64.375 1.00 0.00 H ATOM 21 N GLY A 18 32.280 19.318 60.227 1.00 39.71 N ATOM 22 CA GLY A 18 31.431 18.681 59.224 1.00 40.56 C ATOM 23 C GLY A 18 29.955 18.500 59.574 1.00 47.30 C ATOM 24 O GLY A 18 29.282 17.591 59.069 1.00 47.31 O ATOM 25 H GLY A 18 32.701 20.246 60.017 1.00 0.00 H ATOM 26 N GLY A 19 29.443 19.375 60.422 1.00 44.90 N ATOM 27 CA GLY A 19 28.066 19.314 60.852 1.00 45.73 C ATOM 28 C GLY A 19 27.148 20.309 60.190 1.00 54.12 C ATOM 29 O GLY A 19 27.473 20.954 59.182 1.00 55.60 O ATOM 30 H GLY A 19 30.052 20.133 60.792 1.00 0.00 H ATOM 31 N ARG A 20 25.977 20.408 60.781 1.00 50.37 N ATOM 32 CA ARG A 20 24.867 21.209 60.339 1.00 49.00 C ATOM 33 C ARG A 20 24.395 22.034 61.523 1.00 48.93 C ATOM 34 O ARG A 20 24.597 21.623 62.654 1.00 47.65 O ATOM 35 CB ARG A 20 23.791 20.207 59.895 1.00 51.87 C ATOM 36 CG ARG A 20 22.854 20.689 58.809 1.00 75.25 C ATOM 37 CD ARG A 20 21.703 19.703 58.541 1.00 91.48 C ATOM 38 NE ARG A 20 20.737 19.595 59.646 1.00 96.98 N ATOM 39 CZ ARG A 20 19.781 20.486 59.912 1.00104.78 C ATOM 40 NH1 ARG A 20 19.662 21.588 59.174 1.00 89.20 N ATOM 41 NH2 ARG A 20 18.953 20.295 60.933 1.00 81.23 N ATOM 42 HE ARG A 20 20.805 18.762 60.265 1.00 0.00 H ATOM 43 HH12 ARG A 20 18.914 22.278 59.387 1.00 0.00 H ATOM 44 HH11 ARG A 20 20.317 21.758 58.384 1.00 0.00 H ATOM 45 HH22 ARG A 20 18.209 20.993 61.137 1.00 0.00 H ATOM 46 HH21 ARG A 20 19.049 19.448 61.529 1.00 0.00 H ATOM 47 H ARG A 20 25.841 19.854 61.651 1.00 0.00 H ATOM 48 N GLU A 21 23.788 23.199 61.291 1.00 43.83 N ATOM 49 CA GLU A 21 23.208 23.940 62.403 1.00 41.52 C ATOM 50 C GLU A 21 21.977 23.174 62.810 1.00 45.74 C ATOM 51 O GLU A 21 21.209 22.756 61.947 1.00 46.75 O ATOM 52 CB GLU A 21 22.876 25.385 62.019 1.00 42.06 C ATOM 53 CG GLU A 21 22.162 26.122 63.137 1.00 49.52 C ATOM 54 CD GLU A 21 21.675 27.521 62.823 1.00 68.75 C ATOM 55 OE1 GLU A 21 22.252 28.182 61.926 1.00 44.05 O ATOM 56 OE2 GLU A 21 20.758 27.986 63.538 1.00 65.27 O ATOM 57 H GLU A 21 23.729 23.575 60.323 1.00 0.00 H ATOM 58 N ALA A 22 21.831 22.905 64.090 1.00 42.45 N ATOM 59 CA ALA A 22 20.706 22.151 64.619 1.00 42.69 C ATOM 60 C ALA A 22 19.423 22.958 64.568 1.00 46.78 C ATOM 61 O ALA A 22 19.482 24.176 64.544 1.00 46.51 O ATOM 62 CB ALA A 22 21.002 21.739 66.056 1.00 43.69 C ATOM 63 H ALA A 22 22.554 23.248 64.754 1.00 0.00 H ATOM 64 N GLU A 23 18.267 22.276 64.520 1.00 44.84 N ATOM 65 CA GLU A 23 16.939 22.892 64.580 1.00 45.09 C ATOM 66 C GLU A 23 16.810 23.503 65.979 1.00 47.61 C ATOM 67 O GLU A 23 17.021 22.785 66.962 1.00 47.39 O ATOM 68 CB GLU A 23 15.841 21.830 64.311 1.00 46.63 C ATOM 69 CG GLU A 23 14.427 22.389 64.236 1.00 58.77 C ATOM 70 CD GLU A 23 13.290 21.428 64.528 1.00 88.16 C ATOM 71 OE1 GLU A 23 13.473 20.196 64.376 1.00 89.06 O ATOM 72 OE2 GLU A 23 12.200 21.918 64.903 1.00 83.60 O ATOM 73 H GLU A 23 18.318 21.241 64.434 1.00 0.00 H ATOM 74 N ALA A 24 16.548 24.824 66.070 1.00 42.46 N ATOM 75 CA ALA A 24 16.447 25.520 67.353 1.00 41.58 C ATOM 76 C ALA A 24 15.533 24.808 68.351 1.00 45.21 C ATOM 77 O ALA A 24 14.425 24.402 68.006 1.00 45.11 O ATOM 78 CB ALA A 24 15.979 26.939 67.144 1.00 42.05 C ATOM 79 H ALA A 24 16.413 25.368 65.194 1.00 0.00 H ATOM 80 N HIS A 25 16.059 24.589 69.566 1.00 42.17 N ATOM 81 CA HIS A 25 15.383 23.989 70.722 1.00 42.75 C ATOM 82 C HIS A 25 14.799 22.574 70.455 1.00 45.67 C ATOM 83 O HIS A 25 13.914 22.135 71.179 1.00 43.28 O ATOM 84 CB HIS A 25 14.303 24.952 71.258 1.00 44.00 C ATOM 85 CG HIS A 25 14.816 26.344 71.439 1.00 48.08 C ATOM 86 ND1 HIS A 25 14.709 27.280 70.427 1.00 50.19 N ATOM 87 CD2 HIS A 25 15.518 26.884 72.462 1.00 50.67 C ATOM 88 CE1 HIS A 25 15.307 28.372 70.876 1.00 49.91 C ATOM 89 NE2 HIS A 25 15.811 28.185 72.097 1.00 50.54 N ATOM 90 H HIS A 25 17.050 24.874 69.703 1.00 0.00 H ATOM 91 N ALA A 26 15.355 21.839 69.479 1.00 45.12 N ATOM 92 CA ALA A 26 14.940 20.460 69.155 1.00 45.39 C ATOM 93 C ALA A 26 15.611 19.454 70.101 1.00 50.32 C ATOM 94 O ALA A 26 15.195 18.303 70.189 1.00 49.87 O ATOM 95 CB ALA A 26 15.277 20.131 67.710 1.00 45.95 C ATOM 96 H ALA A 26 16.121 22.265 68.920 1.00 0.00 H ATOM 97 N ARG A 27 16.659 19.903 70.808 1.00 48.30 N ATOM 98 CA ARG A 27 17.412 19.127 71.809 1.00 46.85 C ATOM 99 C ARG A 27 17.303 19.867 73.136 1.00 45.92 C ATOM 100 O ARG A 27 18.245 20.559 73.509 1.00 45.80 O ATOM 101 CB ARG A 27 18.880 18.945 71.371 1.00 45.41 C ATOM 102 CG ARG A 27 19.003 18.035 70.159 1.00 54.24 C ATOM 103 CD ARG A 27 20.362 18.132 69.500 1.00 56.03 C ATOM 104 NE ARG A 27 20.385 17.456 68.205 1.00 55.01 N ATOM 105 CZ ARG A 27 19.836 17.945 67.096 1.00 61.31 C ATOM 106 NH1 ARG A 27 19.206 19.117 67.117 1.00 49.06 N ATOM 107 NH2 ARG A 27 19.910 17.267 65.958 1.00 30.84 N ATOM 108 HE ARG A 27 20.861 16.533 68.146 1.00 0.00 H ATOM 109 HH12 ARG A 27 18.779 19.494 66.247 1.00 0.00 H ATOM 110 HH11 ARG A 27 19.141 19.656 68.004 1.00 0.00 H ATOM 111 HH22 ARG A 27 19.479 17.653 65.094 1.00 0.00 H ATOM 112 HH21 ARG A 27 20.399 16.349 65.930 1.00 0.00 H ATOM 113 H ARG A 27 16.966 20.881 70.635 1.00 0.00 H ATOM 114 N PRO A 28 16.143 19.806 73.825 1.00 38.86 N ATOM 115 CA PRO A 28 15.957 20.615 75.049 1.00 38.99 C ATOM 116 C PRO A 28 16.874 20.253 76.242 1.00 45.16 C ATOM 117 O PRO A 28 16.907 20.980 77.254 1.00 43.47 O ATOM 118 CB PRO A 28 14.485 20.388 75.405 1.00 39.97 C ATOM 119 CG PRO A 28 14.119 19.155 74.738 1.00 44.16 C ATOM 120 CD PRO A 28 14.907 19.092 73.477 1.00 39.56 C ATOM 121 N TYR A 29 17.626 19.143 76.105 1.00 41.91 N ATOM 122 CA TYR A 29 18.538 18.628 77.116 1.00 40.84 C ATOM 123 C TYR A 29 19.908 19.286 77.042 1.00 44.88 C ATOM 124 O TYR A 29 20.688 19.200 77.993 1.00 44.72 O ATOM 125 CB TYR A 29 18.687 17.119 76.936 1.00 41.02 C ATOM 126 CG TYR A 29 19.026 16.679 75.526 1.00 41.15 C ATOM 127 CD1 TYR A 29 20.345 16.625 75.091 1.00 42.97 C ATOM 128 CD2 TYR A 29 18.032 16.245 74.648 1.00 41.47 C ATOM 129 CE1 TYR A 29 20.667 16.215 73.792 1.00 42.86 C ATOM 130 CE2 TYR A 29 18.344 15.816 73.350 1.00 41.84 C ATOM 131 CZ TYR A 29 19.668 15.802 72.926 1.00 44.04 C ATOM 132 OH TYR A 29 20.029 15.359 71.670 1.00 35.55 O ATOM 133 HH TYR A 29 19.752 14.415 71.562 1.00 0.00 H ATOM 134 H TYR A 29 17.549 18.616 75.212 1.00 0.00 H ATOM 135 N MET A 30 20.207 19.905 75.898 1.00 40.66 N ATOM 136 CA MET A 30 21.469 20.544 75.611 1.00 40.25 C ATOM 137 C MET A 30 21.715 21.718 76.545 1.00 46.97 C ATOM 138 O MET A 30 20.807 22.520 76.762 1.00 50.34 O ATOM 139 CB MET A 30 21.474 20.999 74.162 1.00 42.52 C ATOM 140 CG MET A 30 22.835 21.252 73.613 1.00 46.37 C ATOM 141 SD MET A 30 23.858 19.772 73.602 1.00 50.65 S ATOM 142 CE MET A 30 25.422 20.524 73.901 1.00 47.47 C ATOM 143 H MET A 30 19.476 19.929 75.158 1.00 0.00 H ATOM 144 N ALA A 31 22.925 21.776 77.144 1.00 41.07 N ATOM 145 CA ALA A 31 23.379 22.804 78.081 1.00 39.36 C ATOM 146 C ALA A 31 24.751 23.314 77.675 1.00 42.18 C ATOM 147 O ALA A 31 25.549 22.538 77.129 1.00 41.91 O ATOM 148 CB ALA A 31 23.439 22.232 79.490 1.00 39.92 C ATOM 149 H ALA A 31 23.598 21.017 76.917 1.00 0.00 H ATOM 150 N SER A 32 25.027 24.616 77.903 1.00 37.05 N ATOM 151 CA SER A 32 26.330 25.222 77.588 1.00 35.52 C ATOM 152 C SER A 32 27.003 25.611 78.907 1.00 39.87 C ATOM 153 O SER A 32 26.517 26.504 79.631 1.00 39.52 O ATOM 154 CB SER A 32 26.176 26.406 76.632 1.00 35.78 C ATOM 155 OG SER A 32 27.280 27.296 76.545 1.00 37.21 O ATOM 156 HG SER A 32 28.079 26.800 76.236 1.00 0.00 H ATOM 157 H SER A 32 24.287 25.216 78.319 1.00 0.00 H ATOM 158 N VAL A 33 28.065 24.851 79.263 1.00 34.92 N ATOM 159 CA VAL A 33 28.846 25.104 80.471 1.00 33.86 C ATOM 160 C VAL A 33 29.782 26.274 80.132 1.00 33.05 C ATOM 161 O VAL A 33 30.650 26.149 79.270 1.00 30.06 O ATOM 162 CB VAL A 33 29.580 23.855 81.055 1.00 37.40 C ATOM 163 CG1 VAL A 33 30.213 24.203 82.407 1.00 36.21 C ATOM 164 CG2 VAL A 33 28.618 22.662 81.208 1.00 37.25 C ATOM 165 H VAL A 33 28.336 24.055 78.652 1.00 0.00 H ATOM 166 N GLN A 34 29.543 27.426 80.772 1.00 29.39 N ATOM 167 CA GLN A 34 30.261 28.673 80.498 1.00 29.27 C ATOM 168 C GLN A 34 31.101 29.219 81.649 1.00 34.14 C ATOM 169 O GLN A 34 30.803 28.984 82.821 1.00 33.96 O ATOM 170 CB GLN A 34 29.261 29.741 80.104 1.00 29.98 C ATOM 171 CG GLN A 34 28.652 29.440 78.770 1.00 38.38 C ATOM 172 CD GLN A 34 27.476 30.289 78.465 1.00 46.84 C ATOM 173 OE1 GLN A 34 27.068 31.152 79.245 1.00 43.25 O ATOM 174 NE2 GLN A 34 26.926 30.055 77.300 1.00 31.88 N ATOM 175 HE22 GLN A 34 27.313 29.313 76.682 1.00 0.00 H ATOM 176 HE21 GLN A 34 26.102 30.611 76.993 1.00 0.00 H ATOM 177 H GLN A 34 28.806 27.436 81.505 1.00 0.00 H ATOM 178 N LEU A 35 32.159 29.942 81.287 1.00 30.11 N ATOM 179 CA LEU A 35 33.037 30.608 82.221 1.00 31.89 C ATOM 180 C LEU A 35 33.255 32.032 81.748 1.00 42.59 C ATOM 181 O LEU A 35 33.787 32.239 80.637 1.00 44.98 O ATOM 182 CB LEU A 35 34.382 29.873 82.358 1.00 31.57 C ATOM 183 CG LEU A 35 35.469 30.583 83.203 1.00 33.52 C ATOM 184 CD1 LEU A 35 35.126 30.613 84.703 1.00 30.61 C ATOM 185 CD2 LEU A 35 36.776 29.933 82.960 1.00 34.84 C ATOM 186 H LEU A 35 32.365 30.033 80.272 1.00 0.00 H ATOM 187 N ASN A 36 32.850 33.015 82.584 1.00 38.23 N ATOM 188 CA ASN A 36 32.945 34.462 82.305 1.00 37.33 C ATOM 189 C ASN A 36 32.220 34.811 80.992 1.00 41.38 C ATOM 190 O ASN A 36 32.732 35.566 80.155 1.00 38.92 O ATOM 191 CB ASN A 36 34.390 34.955 82.342 1.00 34.49 C ATOM 192 CG ASN A 36 34.915 35.050 83.758 1.00 56.22 C ATOM 193 OD1 ASN A 36 34.237 35.550 84.670 1.00 55.26 O ATOM 194 ND2 ASN A 36 36.119 34.540 83.992 1.00 44.26 N ATOM 195 HD22 ASN A 36 36.669 34.126 83.212 1.00 0.00 H ATOM 196 HD21 ASN A 36 36.512 34.554 84.955 1.00 0.00 H ATOM 197 H ASN A 36 32.439 32.729 83.496 1.00 0.00 H ATOM 198 N GLY A 37 31.001 34.241 80.873 1.00 39.83 N ATOM 199 CA GLY A 37 30.099 34.364 79.731 1.00 39.52 C ATOM 200 C GLY A 37 30.777 34.013 78.428 1.00 44.18 C ATOM 201 O GLY A 37 30.784 34.819 77.509 1.00 46.14 O ATOM 202 H GLY A 37 30.674 33.659 81.671 1.00 0.00 H ATOM 203 N ALA A 38 31.461 32.872 78.404 1.00 39.01 N ATOM 204 CA ALA A 38 32.178 32.290 77.279 1.00 37.38 C ATOM 205 C ALA A 38 32.063 30.775 77.394 1.00 42.45 C ATOM 206 O ALA A 38 32.311 30.198 78.476 1.00 41.93 O ATOM 207 CB ALA A 38 33.611 32.732 77.287 1.00 37.17 C ATOM 208 H ALA A 38 31.486 32.333 79.293 1.00 0.00 H ATOM 209 N HIS A 39 31.573 30.149 76.304 1.00 36.95 N ATOM 210 CA HIS A 39 31.340 28.719 76.242 1.00 34.55 C ATOM 211 C HIS A 39 32.672 27.960 76.393 1.00 37.39 C ATOM 212 O HIS A 39 33.716 28.368 75.866 1.00 37.08 O ATOM 213 CB HIS A 39 30.619 28.382 74.959 1.00 34.64 C ATOM 214 CG HIS A 39 30.505 26.924 74.691 1.00 38.35 C ATOM 215 ND1 HIS A 39 29.387 26.210 75.064 1.00 40.49 N ATOM 216 CD2 HIS A 39 31.375 26.088 74.075 1.00 40.15 C ATOM 217 CE1 HIS A 39 29.608 24.964 74.669 1.00 39.64 C ATOM 218 NE2 HIS A 39 30.791 24.842 74.075 1.00 39.97 N ATOM 219 H HIS A 39 31.351 30.722 75.465 1.00 0.00 H ATOM 220 N LEU A 40 32.629 26.893 77.183 1.00 31.51 N ATOM 221 CA LEU A 40 33.760 26.043 77.489 1.00 30.37 C ATOM 222 C LEU A 40 33.480 24.633 77.022 1.00 37.44 C ATOM 223 O LEU A 40 34.259 24.049 76.276 1.00 36.13 O ATOM 224 CB LEU A 40 33.934 26.055 79.022 1.00 29.34 C ATOM 225 CG LEU A 40 35.233 26.482 79.607 1.00 33.09 C ATOM 226 CD1 LEU A 40 35.518 27.926 79.283 1.00 35.30 C ATOM 227 CD2 LEU A 40 35.166 26.379 81.079 1.00 30.91 C ATOM 228 H LEU A 40 31.714 26.650 77.614 1.00 0.00 H ATOM 229 N CYS A 41 32.332 24.099 77.468 1.00 37.69 N ATOM 230 CA CYS A 41 31.881 22.745 77.256 1.00 39.04 C ATOM 231 C CYS A 41 30.416 22.673 77.067 1.00 43.72 C ATOM 232 O CYS A 41 29.690 23.533 77.558 1.00 45.68 O ATOM 233 CB CYS A 41 32.267 21.928 78.474 1.00 40.98 C ATOM 234 SG CYS A 41 34.019 21.552 78.569 1.00 46.29 S ATOM 235 H CYS A 41 31.707 24.721 78.020 1.00 0.00 H ATOM 236 N GLY A 42 29.980 21.574 76.476 1.00 38.22 N ATOM 237 CA GLY A 42 28.581 21.219 76.384 1.00 37.87 C ATOM 238 C GLY A 42 28.249 20.475 77.660 1.00 43.88 C ATOM 239 O GLY A 42 29.144 20.129 78.437 1.00 45.21 O ATOM 240 H GLY A 42 30.680 20.930 76.055 1.00 0.00 H ATOM 241 N GLY A 43 26.971 20.250 77.887 1.00 40.57 N ATOM 242 CA GLY A 43 26.464 19.528 79.046 1.00 40.39 C ATOM 243 C GLY A 43 25.111 18.957 78.698 1.00 46.42 C ATOM 244 O GLY A 43 24.547 19.297 77.656 1.00 48.67 O ATOM 245 H GLY A 43 26.282 20.610 77.196 1.00 0.00 H ATOM 246 N VAL A 44 24.571 18.089 79.541 1.00 41.85 N ATOM 247 CA VAL A 44 23.272 17.496 79.232 1.00 40.70 C ATOM 248 C VAL A 44 22.437 17.421 80.512 1.00 42.48 C ATOM 249 O VAL A 44 22.904 16.894 81.522 1.00 42.40 O ATOM 250 CB VAL A 44 23.382 16.131 78.463 1.00 44.44 C ATOM 251 CG1 VAL A 44 24.457 15.225 79.041 1.00 44.59 C ATOM 252 CG2 VAL A 44 22.041 15.405 78.359 1.00 44.12 C ATOM 253 H VAL A 44 25.069 17.831 80.417 1.00 0.00 H ATOM 254 N LEU A 45 21.216 18.016 80.465 1.00 37.17 N ATOM 255 CA LEU A 45 20.242 18.011 81.561 1.00 36.14 C ATOM 256 C LEU A 45 19.736 16.545 81.758 1.00 40.95 C ATOM 257 O LEU A 45 19.138 15.959 80.850 1.00 42.83 O ATOM 258 CB LEU A 45 19.087 18.995 81.263 1.00 35.07 C ATOM 259 CG LEU A 45 18.177 19.357 82.438 1.00 38.45 C ATOM 260 CD1 LEU A 45 18.877 20.287 83.415 1.00 38.28 C ATOM 261 CD2 LEU A 45 16.905 20.013 81.959 1.00 38.90 C ATOM 262 H LEU A 45 20.954 18.510 79.589 1.00 0.00 H ATOM 263 N VAL A 46 20.077 15.937 82.891 1.00 33.64 N ATOM 264 CA VAL A 46 19.754 14.547 83.172 1.00 32.22 C ATOM 265 C VAL A 46 18.664 14.468 84.240 1.00 38.37 C ATOM 266 O VAL A 46 17.998 13.436 84.375 1.00 39.59 O ATOM 267 CB VAL A 46 21.021 13.724 83.566 1.00 35.51 C ATOM 268 CG1 VAL A 46 21.885 13.418 82.347 1.00 35.06 C ATOM 269 CG2 VAL A 46 21.847 14.402 84.666 1.00 34.98 C ATOM 270 H VAL A 46 20.598 16.480 83.608 1.00 0.00 H ATOM 271 N ALA A 47 18.486 15.557 84.990 1.00 34.30 N ATOM 272 CA ALA A 47 17.493 15.726 86.044 1.00 34.02 C ATOM 273 C ALA A 47 17.101 17.201 86.108 1.00 43.08 C ATOM 274 O ALA A 47 17.814 18.032 85.536 1.00 43.88 O ATOM 275 CB ALA A 47 18.085 15.271 87.364 1.00 34.31 C ATOM 276 H ALA A 47 19.116 16.363 84.805 1.00 0.00 H ATOM 277 N GLU A 48 16.007 17.550 86.819 1.00 41.78 N ATOM 278 CA GLU A 48 15.558 18.946 86.969 1.00 41.35 C ATOM 279 C GLU A 48 16.658 19.853 87.517 1.00 46.10 C ATOM 280 O GLU A 48 16.684 21.026 87.154 1.00 49.36 O ATOM 281 CB GLU A 48 14.359 19.060 87.912 1.00 42.55 C ATOM 282 CG GLU A 48 13.010 18.728 87.315 1.00 56.31 C ATOM 283 CD GLU A 48 11.882 19.162 88.230 1.00 98.28 C ATOM 284 OE1 GLU A 48 11.252 20.205 87.938 1.00108.85 O ATOM 285 OE2 GLU A 48 11.679 18.509 89.280 1.00 97.62 O ATOM 286 H GLU A 48 15.456 16.799 87.282 1.00 0.00 H ATOM 287 N GLN A 49 17.557 19.340 88.383 1.00 38.44 N ATOM 288 CA GLN A 49 18.587 20.202 88.963 1.00 37.26 C ATOM 289 C GLN A 49 19.996 19.669 88.748 1.00 40.45 C ATOM 290 O GLN A 49 20.914 20.070 89.470 1.00 42.45 O ATOM 291 CB GLN A 49 18.316 20.341 90.461 1.00 38.20 C ATOM 292 CG GLN A 49 18.655 21.697 91.063 1.00 34.78 C ATOM 293 CD GLN A 49 18.446 21.672 92.545 1.00 45.06 C ATOM 294 OE1 GLN A 49 17.728 20.817 93.077 1.00 43.01 O ATOM 295 NE2 GLN A 49 19.076 22.602 93.252 1.00 32.99 N ATOM 296 HE22 GLN A 49 19.672 23.306 92.771 1.00 0.00 H ATOM 297 HE21 GLN A 49 18.974 22.627 94.287 1.00 0.00 H ATOM 298 H GLN A 49 17.518 18.332 88.638 1.00 0.00 H ATOM 299 N TRP A 50 20.190 18.811 87.742 1.00 33.70 N ATOM 300 CA TRP A 50 21.487 18.206 87.492 1.00 32.58 C ATOM 301 C TRP A 50 21.857 18.192 86.025 1.00 36.65 C ATOM 302 O TRP A 50 21.073 17.734 85.180 1.00 37.06 O ATOM 303 CB TRP A 50 21.518 16.773 88.042 1.00 31.45 C ATOM 304 CG TRP A 50 21.582 16.695 89.527 1.00 32.74 C ATOM 305 CD1 TRP A 50 20.542 16.548 90.390 1.00 35.54 C ATOM 306 CD2 TRP A 50 22.762 16.754 90.328 1.00 33.69 C ATOM 307 NE1 TRP A 50 20.996 16.519 91.686 1.00 35.48 N ATOM 308 CE2 TRP A 50 22.358 16.636 91.676 1.00 37.68 C ATOM 309 CE3 TRP A 50 24.133 16.927 90.041 1.00 35.17 C ATOM 310 CZ2 TRP A 50 23.267 16.659 92.724 1.00 36.79 C ATOM 311 CZ3 TRP A 50 25.030 16.927 91.091 1.00 36.08 C ATOM 312 CH2 TRP A 50 24.592 16.791 92.409 1.00 36.54 C ATOM 313 HE1 TRP A 50 20.402 16.424 92.534 1.00 0.00 H ATOM 314 H TRP A 50 19.391 18.570 87.121 1.00 0.00 H ATOM 315 N VAL A 51 23.088 18.658 85.729 1.00 33.03 N ATOM 316 CA VAL A 51 23.648 18.674 84.373 1.00 32.65 C ATOM 317 C VAL A 51 24.904 17.795 84.386 1.00 38.77 C ATOM 318 O VAL A 51 25.780 17.945 85.243 1.00 39.53 O ATOM 319 CB VAL A 51 23.902 20.108 83.844 1.00 35.90 C ATOM 320 CG1 VAL A 51 24.693 20.103 82.548 1.00 35.68 C ATOM 321 CG2 VAL A 51 22.589 20.850 83.626 1.00 35.75 C ATOM 322 H VAL A 51 23.673 19.027 86.506 1.00 0.00 H ATOM 323 N LEU A 52 24.933 16.817 83.483 1.00 35.58 N ATOM 324 CA LEU A 52 26.069 15.913 83.331 1.00 34.40 C ATOM 325 C LEU A 52 27.007 16.488 82.262 1.00 38.42 C ATOM 326 O LEU A 52 26.541 16.892 81.196 1.00 38.02 O ATOM 327 CB LEU A 52 25.572 14.494 82.953 1.00 32.93 C ATOM 328 CG LEU A 52 26.629 13.425 82.612 1.00 33.00 C ATOM 329 CD1 LEU A 52 27.535 13.095 83.816 1.00 30.32 C ATOM 330 CD2 LEU A 52 25.959 12.193 82.094 1.00 30.67 C ATOM 331 H LEU A 52 24.111 16.692 82.859 1.00 0.00 H ATOM 332 N SER A 53 28.314 16.541 82.570 1.00 35.57 N ATOM 333 CA SER A 53 29.359 17.057 81.674 1.00 36.15 C ATOM 334 C SER A 53 30.666 16.241 81.855 1.00 42.45 C ATOM 335 O SER A 53 30.639 15.197 82.497 1.00 44.13 O ATOM 336 CB SER A 53 29.584 18.557 81.917 1.00 37.91 C ATOM 337 OG SER A 53 30.447 19.183 80.974 1.00 37.72 O ATOM 338 HG SER A 53 30.063 19.092 80.066 1.00 0.00 H ATOM 339 H SER A 53 28.606 16.193 83.506 1.00 0.00 H ATOM 340 N ALA A 54 31.764 16.658 81.201 1.00 38.78 N ATOM 341 CA ALA A 54 33.107 16.066 81.258 1.00 38.25 C ATOM 342 C ALA A 54 33.903 16.650 82.445 1.00 42.80 C ATOM 343 O ALA A 54 33.728 17.812 82.803 1.00 41.81 O ATOM 344 CB ALA A 54 33.842 16.314 79.949 1.00 38.71 C ATOM 345 H ALA A 54 31.650 17.490 80.588 1.00 0.00 H ATOM 346 N ALA A 55 34.766 15.831 83.048 1.00 41.81 N ATOM 347 CA ALA A 55 35.545 16.122 84.255 1.00 42.67 C ATOM 348 C ALA A 55 36.422 17.389 84.190 1.00 48.57 C ATOM 349 O ALA A 55 36.331 18.221 85.095 1.00 49.14 O ATOM 350 CB ALA A 55 36.423 14.927 84.597 1.00 43.42 C ATOM 351 H ALA A 55 34.899 14.893 82.619 1.00 0.00 H ATOM 352 N HIS A 56 37.251 17.536 83.132 1.00 45.37 N ATOM 353 CA HIS A 56 38.277 18.577 82.970 1.00 44.85 C ATOM 354 C HIS A 56 37.765 19.845 82.275 1.00 49.22 C ATOM 355 O HIS A 56 38.567 20.621 81.768 1.00 50.06 O ATOM 356 CB HIS A 56 39.512 17.973 82.243 1.00 45.49 C ATOM 357 CG HIS A 56 39.809 16.591 82.748 1.00 49.19 C ATOM 358 ND1 HIS A 56 40.116 16.363 84.090 1.00 51.22 N ATOM 359 CD2 HIS A 56 39.655 15.398 82.131 1.00 50.93 C ATOM 360 CE1 HIS A 56 40.151 15.050 84.234 1.00 50.53 C ATOM 361 NE2 HIS A 56 39.885 14.425 83.085 1.00 50.87 N ATOM 362 H HIS A 56 37.154 16.847 82.359 1.00 0.00 H ATOM 363 N CYS A 57 36.470 20.137 82.380 1.00 45.61 N ATOM 364 CA CYS A 57 35.913 21.338 81.757 1.00 44.99 C ATOM 365 C CYS A 57 36.212 22.583 82.591 1.00 52.01 C ATOM 366 O CYS A 57 36.697 23.575 82.031 1.00 51.07 O ATOM 367 CB CYS A 57 34.422 21.171 81.501 1.00 44.04 C ATOM 368 SG CYS A 57 34.041 20.168 80.036 1.00 46.79 S ATOM 369 H CYS A 57 35.844 19.501 82.914 1.00 0.00 H ATOM 370 N LEU A 58 36.031 22.488 83.937 1.00 51.41 N ATOM 371 CA LEU A 58 36.295 23.563 84.925 1.00 51.41 C ATOM 372 C LEU A 58 37.820 23.777 85.234 1.00 59.77 C ATOM 373 O LEU A 58 38.165 24.570 86.106 1.00 57.94 O ATOM 374 CB LEU A 58 35.532 23.283 86.232 1.00 50.40 C ATOM 375 CG LEU A 58 34.012 23.254 86.149 1.00 53.51 C ATOM 376 CD1 LEU A 58 33.389 22.834 87.458 1.00 53.00 C ATOM 377 CD2 LEU A 58 33.462 24.566 85.695 1.00 53.70 C ATOM 378 H LEU A 58 35.676 21.582 84.305 1.00 0.00 H ATOM 379 N GLU A 59 38.718 23.078 84.515 1.00 62.01 N ATOM 380 CA GLU A 59 40.174 23.230 84.631 1.00 64.09 C ATOM 381 C GLU A 59 40.532 24.641 84.187 1.00 72.38 C ATOM 382 O GLU A 59 39.900 25.175 83.263 1.00 71.96 O ATOM 383 CB GLU A 59 40.886 22.180 83.753 1.00 65.77 C ATOM 384 CG GLU A 59 42.380 22.008 84.002 1.00 79.43 C ATOM 385 CD GLU A 59 42.992 20.693 83.532 1.00111.76 C ATOM 386 OE1 GLU A 59 44.175 20.443 83.864 1.00117.70 O ATOM 387 OE2 GLU A 59 42.294 19.905 82.850 1.00103.08 O ATOM 388 H GLU A 59 38.356 22.383 83.831 1.00 0.00 H ATOM 389 N ASP A 60 41.508 25.257 84.880 1.00 72.10 N ATOM 390 CA ASP A 60 42.005 26.626 84.662 1.00 73.03 C ATOM 391 C ASP A 60 40.889 27.700 84.866 1.00 79.02 C ATOM 392 O ASP A 60 41.153 28.885 84.606 1.00 79.32 O ATOM 393 CB ASP A 60 42.677 26.771 83.266 1.00 74.45 C ATOM 394 H ASP A 60 41.955 24.712 85.645 1.00 0.00 H ATOM 395 N ALA A 61 39.668 27.295 85.348 1.00 75.11 N ATOM 396 CA ALA A 61 38.547 28.216 85.582 1.00 75.02 C ATOM 397 C ALA A 61 38.873 29.165 86.717 1.00 80.66 C ATOM 398 O ALA A 61 38.878 30.381 86.513 1.00 80.24 O ATOM 399 CB ALA A 61 37.267 27.453 85.878 1.00 75.71 C ATOM 400 H ALA A 61 39.530 26.286 85.558 1.00 0.00 H ATOM 401 N ALA A 62 39.197 28.588 87.898 1.00 78.74 N ATOM 402 CA ALA A 62 39.623 29.245 89.138 1.00 78.53 C ATOM 403 C ALA A 62 38.793 30.482 89.441 1.00 80.52 C ATOM 404 O ALA A 62 37.592 30.365 89.707 1.00 78.49 O ATOM 405 CB ALA A 62 41.107 29.610 89.043 1.00 79.47 C ATOM 406 H ALA A 62 39.136 27.550 87.930 1.00 0.00 H ATOM 407 N ASP A 63 39.440 31.668 89.367 1.00 77.49 N ATOM 408 CA ASP A 63 38.826 32.978 89.541 1.00 77.36 C ATOM 409 C ASP A 63 37.995 33.267 88.261 1.00 76.96 C ATOM 410 O ASP A 63 38.545 33.563 87.180 1.00 75.71 O ATOM 411 CB ASP A 63 39.927 34.029 89.805 1.00 80.36 C ATOM 412 CG ASP A 63 39.473 35.461 89.996 1.00101.08 C ATOM 413 OD1 ASP A 63 38.281 35.672 90.335 1.00104.33 O ATOM 414 OD2 ASP A 63 40.318 36.379 89.831 1.00108.30 O ATOM 415 H ASP A 63 40.461 31.643 89.169 1.00 0.00 H ATOM 416 N GLY A 64 36.684 33.072 88.388 1.00 69.12 N ATOM 417 CA GLY A 64 35.768 33.264 87.273 1.00 66.49 C ATOM 418 C GLY A 64 34.374 32.753 87.548 1.00 63.23 C ATOM 419 O GLY A 64 34.186 31.807 88.330 1.00 60.97 O ATOM 420 H GLY A 64 36.304 32.774 89.309 1.00 0.00 H ATOM 421 N LYS A 65 33.393 33.371 86.862 1.00 55.48 N ATOM 422 CA LYS A 65 31.977 33.043 86.994 1.00 53.00 C ATOM 423 C LYS A 65 31.583 31.799 86.142 1.00 54.15 C ATOM 424 O LYS A 65 31.494 31.913 84.910 1.00 54.98 O ATOM 425 CB LYS A 65 31.112 34.272 86.632 1.00 52.24 C ATOM 426 CG LYS A 65 29.650 34.143 87.064 1.00 46.52 C ATOM 427 CD LYS A 65 29.220 35.001 88.253 1.00 48.81 C ATOM 428 CE LYS A 65 27.907 34.509 88.812 1.00 55.78 C ATOM 429 NZ LYS A 65 28.046 33.339 89.729 1.00 65.50 N ATOM 430 HZ1 LYS A 65 28.481 32.547 89.214 1.00 0.00 H ATOM 431 HZ2 LYS A 65 28.648 33.602 90.536 1.00 0.00 H ATOM 432 HZ3 LYS A 65 27.106 33.057 90.073 1.00 0.00 H ATOM 433 H LYS A 65 33.661 34.126 86.199 1.00 0.00 H ATOM 434 N VAL A 66 31.334 30.632 86.816 1.00 45.39 N ATOM 435 CA VAL A 66 30.893 29.400 86.152 1.00 43.34 C ATOM 436 C VAL A 66 29.396 29.364 86.199 1.00 46.34 C ATOM 437 O VAL A 66 28.807 29.540 87.271 1.00 48.08 O ATOM 438 CB VAL A 66 31.506 28.108 86.730 1.00 46.28 C ATOM 439 CG1 VAL A 66 30.769 26.856 86.247 1.00 44.88 C ATOM 440 CG2 VAL A 66 32.993 28.031 86.406 1.00 46.49 C ATOM 441 H VAL A 66 31.464 30.619 87.848 1.00 0.00 H ATOM 442 N GLN A 67 28.765 29.141 85.041 1.00 40.12 N ATOM 443 CA GLN A 67 27.316 29.114 84.923 1.00 38.23 C ATOM 444 C GLN A 67 26.902 28.173 83.857 1.00 37.10 C ATOM 445 O GLN A 67 27.681 27.929 82.955 1.00 37.33 O ATOM 446 CB GLN A 67 26.793 30.510 84.627 1.00 40.07 C ATOM 447 CG GLN A 67 27.044 31.500 85.755 1.00 47.09 C ATOM 448 CD GLN A 67 26.103 32.606 85.608 1.00 66.81 C ATOM 449 OE1 GLN A 67 26.133 33.349 84.620 1.00 70.05 O ATOM 450 NE2 GLN A 67 25.168 32.633 86.512 1.00 53.61 N ATOM 451 HE22 GLN A 67 25.206 31.978 87.319 1.00 0.00 H ATOM 452 HE21 GLN A 67 24.383 33.310 86.428 1.00 0.00 H ATOM 453 H GLN A 67 29.336 28.980 84.187 1.00 0.00 H ATOM 454 N VAL A 68 25.695 27.627 83.966 1.00 32.00 N ATOM 455 CA VAL A 68 25.149 26.625 83.055 1.00 32.92 C ATOM 456 C VAL A 68 23.979 27.271 82.294 1.00 39.58 C ATOM 457 O VAL A 68 22.972 27.690 82.913 1.00 40.00 O ATOM 458 CB VAL A 68 24.729 25.346 83.856 1.00 37.68 C ATOM 459 CG1 VAL A 68 24.027 24.305 82.983 1.00 37.70 C ATOM 460 CG2 VAL A 68 25.911 24.718 84.589 1.00 37.60 C ATOM 461 H VAL A 68 25.096 27.936 84.758 1.00 0.00 H ATOM 462 N LEU A 69 24.128 27.381 80.947 1.00 35.75 N ATOM 463 CA LEU A 69 23.093 28.017 80.141 1.00 34.79 C ATOM 464 C LEU A 69 22.127 26.983 79.588 1.00 38.52 C ATOM 465 O LEU A 69 22.506 26.101 78.797 1.00 39.52 O ATOM 466 CB LEU A 69 23.679 28.900 79.018 1.00 34.26 C ATOM 467 CG LEU A 69 22.700 29.374 77.892 1.00 37.26 C ATOM 468 CD1 LEU A 69 21.656 30.407 78.376 1.00 36.14 C ATOM 469 CD2 LEU A 69 23.452 29.837 76.671 1.00 36.61 C ATOM 470 H LEU A 69 24.985 27.009 80.489 1.00 0.00 H ATOM 471 N LEU A 70 20.849 27.163 79.952 1.00 33.34 N ATOM 472 CA LEU A 70 19.740 26.296 79.534 1.00 32.04 C ATOM 473 C LEU A 70 18.754 26.958 78.519 1.00 38.75 C ATOM 474 O LEU A 70 18.633 28.182 78.474 1.00 39.59 O ATOM 475 CB LEU A 70 18.994 25.826 80.795 1.00 30.11 C ATOM 476 CG LEU A 70 19.771 24.813 81.649 1.00 32.24 C ATOM 477 CD1 LEU A 70 18.923 24.255 82.727 1.00 31.72 C ATOM 478 CD2 LEU A 70 20.300 23.640 80.816 1.00 32.23 C ATOM 479 H LEU A 70 20.629 27.969 80.571 1.00 0.00 H ATOM 480 N GLY A 71 18.070 26.139 77.719 1.00 35.69 N ATOM 481 CA GLY A 71 17.093 26.640 76.748 1.00 35.76 C ATOM 482 C GLY A 71 17.655 27.483 75.612 1.00 38.60 C ATOM 483 O GLY A 71 16.917 28.266 75.013 1.00 35.65 O ATOM 484 H GLY A 71 18.235 25.114 77.786 1.00 0.00 H ATOM 485 N ALA A 72 18.952 27.302 75.288 1.00 36.69 N ATOM 486 CA ALA A 72 19.606 28.088 74.256 1.00 37.47 C ATOM 487 C ALA A 72 19.746 27.408 72.902 1.00 43.96 C ATOM 488 O ALA A 72 19.742 26.184 72.788 1.00 45.96 O ATOM 489 CB ALA A 72 20.980 28.472 74.726 1.00 38.48 C ATOM 490 H ALA A 72 19.501 26.577 75.793 1.00 0.00 H ATOM 491 N HIS A 73 19.898 28.242 71.879 1.00 39.46 N ATOM 492 CA HIS A 73 20.221 27.867 70.521 1.00 39.15 C ATOM 493 C HIS A 73 21.358 28.781 70.098 1.00 40.51 C ATOM 494 O HIS A 73 22.452 28.289 69.816 1.00 39.08 O ATOM 495 CB HIS A 73 19.023 27.923 69.573 1.00 40.33 C ATOM 496 CG HIS A 73 19.405 27.462 68.205 1.00 43.13 C ATOM 497 ND1 HIS A 73 19.711 26.146 67.963 1.00 44.88 N ATOM 498 CD2 HIS A 73 19.655 28.178 67.090 1.00 44.15 C ATOM 499 CE1 HIS A 73 20.085 26.093 66.699 1.00 44.05 C ATOM 500 NE2 HIS A 73 20.068 27.293 66.134 1.00 44.01 N ATOM 501 H HIS A 73 19.773 29.256 72.073 1.00 0.00 H ATOM 502 N SER A 74 21.118 30.111 70.120 1.00 36.32 N ATOM 503 CA SER A 74 22.178 31.101 69.901 1.00 35.87 C ATOM 504 C SER A 74 22.775 31.403 71.255 1.00 37.13 C ATOM 505 O SER A 74 22.034 31.613 72.238 1.00 34.84 O ATOM 506 CB SER A 74 21.656 32.380 69.250 1.00 38.90 C ATOM 507 OG SER A 74 22.602 33.431 69.357 1.00 36.47 O ATOM 508 HG SER A 74 23.442 33.165 68.905 1.00 0.00 H ATOM 509 H SER A 74 20.149 30.444 70.298 1.00 0.00 H ATOM 510 N LEU A 75 24.099 31.433 71.311 1.00 32.34 N ATOM 511 CA LEU A 75 24.759 31.726 72.554 1.00 33.54 C ATOM 512 C LEU A 75 24.626 33.198 72.940 1.00 37.89 C ATOM 513 O LEU A 75 24.540 33.492 74.135 1.00 37.02 O ATOM 514 CB LEU A 75 26.243 31.353 72.453 1.00 34.39 C ATOM 515 CG LEU A 75 26.607 29.849 72.422 1.00 39.23 C ATOM 516 CD1 LEU A 75 28.089 29.662 72.153 1.00 39.04 C ATOM 517 CD2 LEU A 75 26.254 29.133 73.740 1.00 39.65 C ATOM 518 H LEU A 75 24.660 31.245 70.456 1.00 0.00 H ATOM 519 N SER A 76 24.568 34.110 71.932 1.00 34.21 N ATOM 520 CA SER A 76 24.587 35.564 72.098 1.00 33.86 C ATOM 521 C SER A 76 23.265 36.267 72.033 1.00 40.17 C ATOM 522 O SER A 76 23.128 37.315 72.668 1.00 43.13 O ATOM 523 CB SER A 76 25.462 36.191 71.012 1.00 37.27 C ATOM 524 OG SER A 76 24.908 36.093 69.706 1.00 37.04 O ATOM 525 HG SER A 76 24.784 35.139 69.472 1.00 0.00 H ATOM 526 H SER A 76 24.505 33.743 70.961 1.00 0.00 H ATOM 527 N GLN A 77 22.351 35.797 71.170 1.00 35.36 N ATOM 528 CA GLN A 77 21.079 36.446 70.906 1.00 34.15 C ATOM 529 C GLN A 77 20.031 36.167 71.974 1.00 35.29 C ATOM 530 O GLN A 77 20.018 35.076 72.548 1.00 32.90 O ATOM 531 CB GLN A 77 20.566 36.010 69.537 1.00 35.90 C ATOM 532 CG GLN A 77 21.249 36.784 68.416 1.00 42.52 C ATOM 533 CD GLN A 77 21.344 36.000 67.144 1.00 52.98 C ATOM 534 OE1 GLN A 77 20.477 35.201 66.801 1.00 44.94 O ATOM 535 NE2 GLN A 77 22.409 36.227 66.404 1.00 53.77 N ATOM 536 HE22 GLN A 77 23.127 36.910 66.721 1.00 0.00 H ATOM 537 HE21 GLN A 77 22.533 35.724 65.502 1.00 0.00 H ATOM 538 H GLN A 77 22.566 34.916 70.660 1.00 0.00 H ATOM 539 N PRO A 78 19.108 37.133 72.228 1.00 32.58 N ATOM 540 CA PRO A 78 18.059 36.900 73.237 1.00 33.64 C ATOM 541 C PRO A 78 17.024 35.846 72.791 1.00 42.62 C ATOM 542 O PRO A 78 16.597 35.839 71.625 1.00 46.00 O ATOM 543 CB PRO A 78 17.420 38.282 73.406 1.00 33.67 C ATOM 544 CG PRO A 78 17.710 38.984 72.199 1.00 36.29 C ATOM 545 CD PRO A 78 18.968 38.469 71.627 1.00 32.53 C ATOM 546 N GLU A 79 16.660 34.950 73.709 1.00 36.22 N ATOM 547 CA GLU A 79 15.706 33.879 73.473 1.00 36.64 C ATOM 548 C GLU A 79 14.832 33.710 74.710 1.00 46.23 C ATOM 549 O GLU A 79 15.367 33.727 75.834 1.00 49.72 O ATOM 550 CB GLU A 79 16.416 32.556 73.140 1.00 37.53 C ATOM 551 CG GLU A 79 17.073 32.539 71.775 1.00 46.79 C ATOM 552 CD GLU A 79 18.063 31.422 71.519 1.00 68.17 C ATOM 553 OE1 GLU A 79 18.232 30.560 72.410 1.00 71.94 O ATOM 554 OE2 GLU A 79 18.661 31.398 70.419 1.00 52.04 O ATOM 555 H GLU A 79 17.086 35.022 74.655 1.00 0.00 H ATOM 556 N PRO A 80 13.496 33.530 74.550 1.00 40.62 N ATOM 557 CA PRO A 80 12.629 33.451 75.725 1.00 39.83 C ATOM 558 C PRO A 80 12.986 32.287 76.637 1.00 44.15 C ATOM 559 O PRO A 80 13.045 32.480 77.852 1.00 45.36 O ATOM 560 CB PRO A 80 11.246 33.311 75.107 1.00 41.18 C ATOM 561 CG PRO A 80 11.357 33.969 73.806 1.00 44.54 C ATOM 562 CD PRO A 80 12.687 33.510 73.320 1.00 40.84 C ATOM 563 N SER A 81 13.318 31.129 76.040 1.00 39.37 N ATOM 564 CA SER A 81 13.688 29.879 76.713 1.00 38.30 C ATOM 565 C SER A 81 15.031 29.967 77.470 1.00 39.66 C ATOM 566 O SER A 81 15.183 29.276 78.476 1.00 39.24 O ATOM 567 CB SER A 81 13.751 28.740 75.702 1.00 41.10 C ATOM 568 OG SER A 81 14.226 29.197 74.446 1.00 50.93 O ATOM 569 HG SER A 81 15.135 29.574 74.556 1.00 0.00 H ATOM 570 H SER A 81 13.312 31.118 75.000 1.00 0.00 H ATOM 571 N LYS A 82 15.980 30.820 77.005 1.00 33.60 N ATOM 572 CA LYS A 82 17.315 30.980 77.605 1.00 32.45 C ATOM 573 C LYS A 82 17.249 31.375 79.085 1.00 37.35 C ATOM 574 O LYS A 82 16.597 32.354 79.421 1.00 39.68 O ATOM 575 CB LYS A 82 18.157 32.007 76.825 1.00 32.95 C ATOM 576 CG LYS A 82 19.074 31.383 75.782 1.00 26.37 C ATOM 577 CD LYS A 82 19.697 32.406 74.843 1.00 33.55 C ATOM 578 CE LYS A 82 21.060 32.911 75.279 1.00 33.00 C ATOM 579 NZ LYS A 82 21.749 33.667 74.203 1.00 29.35 N ATOM 580 HZ1 LYS A 82 21.882 33.049 73.377 1.00 0.00 H ATOM 581 HZ2 LYS A 82 21.171 34.488 73.933 1.00 0.00 H ATOM 582 HZ3 LYS A 82 22.675 33.992 74.547 1.00 0.00 H ATOM 583 H LYS A 82 15.749 31.397 76.171 1.00 0.00 H ATOM 584 N ARG A 83 17.892 30.587 79.974 1.00 31.88 N ATOM 585 CA ARG A 83 17.993 30.829 81.434 1.00 30.24 C ATOM 586 C ARG A 83 19.401 30.424 81.980 1.00 37.09 C ATOM 587 O ARG A 83 19.985 29.435 81.523 1.00 38.62 O ATOM 588 CB ARG A 83 16.906 30.097 82.200 1.00 24.28 C ATOM 589 H ARG A 83 18.358 29.735 79.602 1.00 0.00 H ATOM 590 N LEU A 84 19.957 31.194 82.950 1.00 33.14 N ATOM 591 CA LEU A 84 21.295 30.936 83.514 1.00 32.22 C ATOM 592 C LEU A 84 21.249 30.474 84.928 1.00 36.89 C ATOM 593 O LEU A 84 20.521 31.053 85.762 1.00 37.56 O ATOM 594 CB LEU A 84 22.185 32.168 83.456 1.00 31.64 C ATOM 595 CG LEU A 84 22.812 32.427 82.128 1.00 34.86 C ATOM 596 CD1 LEU A 84 23.331 33.821 82.082 1.00 34.97 C ATOM 597 CD2 LEU A 84 23.882 31.402 81.829 1.00 34.66 C ATOM 598 H LEU A 84 19.414 32.004 83.312 1.00 0.00 H ATOM 599 N TYR A 85 22.059 29.443 85.222 1.00 32.04 N ATOM 600 CA TYR A 85 22.059 28.865 86.566 1.00 30.91 C ATOM 601 C TYR A 85 23.413 28.849 87.176 1.00 34.65 C ATOM 602 O TYR A 85 24.402 28.513 86.513 1.00 32.85 O ATOM 603 CB TYR A 85 21.501 27.428 86.546 1.00 30.35 C ATOM 604 CG TYR A 85 20.122 27.345 85.961 1.00 28.70 C ATOM 605 CD1 TYR A 85 19.933 27.316 84.591 1.00 30.39 C ATOM 606 CD2 TYR A 85 18.996 27.393 86.776 1.00 29.07 C ATOM 607 CE1 TYR A 85 18.660 27.382 84.038 1.00 33.08 C ATOM 608 CE2 TYR A 85 17.714 27.357 86.235 1.00 30.48 C ATOM 609 CZ TYR A 85 17.549 27.339 84.858 1.00 40.97 C ATOM 610 OH TYR A 85 16.300 27.303 84.274 1.00 46.45 O ATOM 611 HH TYR A 85 16.398 27.295 83.289 1.00 0.00 H ATOM 612 H TYR A 85 22.689 29.054 84.491 1.00 0.00 H ATOM 613 N ASP A 86 23.447 29.154 88.473 1.00 32.78 N ATOM 614 CA ASP A 86 24.685 29.094 89.252 1.00 33.51 C ATOM 615 C ASP A 86 24.950 27.624 89.626 1.00 37.07 C ATOM 616 O ASP A 86 24.014 26.827 89.702 1.00 36.24 O ATOM 617 CB ASP A 86 24.587 30.020 90.487 1.00 35.33 C ATOM 618 CG ASP A 86 24.870 31.493 90.183 1.00 52.92 C ATOM 619 OD1 ASP A 86 25.514 31.775 89.156 1.00 56.85 O ATOM 620 OD2 ASP A 86 24.484 32.354 90.992 1.00 60.49 O ATOM 621 H ASP A 86 22.567 29.443 88.946 1.00 0.00 H ATOM 622 N VAL A 87 26.202 27.241 89.763 1.00 34.27 N ATOM 623 CA VAL A 87 26.475 25.843 90.117 1.00 35.32 C ATOM 624 C VAL A 87 26.602 25.758 91.647 1.00 44.15 C ATOM 625 O VAL A 87 27.560 26.285 92.241 1.00 45.61 O ATOM 626 CB VAL A 87 27.705 25.219 89.387 1.00 37.14 C ATOM 627 CG1 VAL A 87 27.939 23.784 89.839 1.00 35.76 C ATOM 628 CG2 VAL A 87 27.536 25.285 87.875 1.00 36.62 C ATOM 629 H VAL A 87 26.982 27.915 89.623 1.00 0.00 H ATOM 630 N LEU A 88 25.630 25.100 92.274 1.00 40.04 N ATOM 631 CA LEU A 88 25.599 24.947 93.715 1.00 39.60 C ATOM 632 C LEU A 88 26.581 23.907 94.179 1.00 41.47 C ATOM 633 O LEU A 88 27.115 24.034 95.280 1.00 42.41 O ATOM 634 CB LEU A 88 24.176 24.571 94.145 1.00 40.23 C ATOM 635 CG LEU A 88 23.927 24.156 95.606 1.00 44.61 C ATOM 636 CD1 LEU A 88 24.204 25.292 96.567 1.00 43.60 C ATOM 637 CD2 LEU A 88 22.519 23.618 95.783 1.00 48.08 C ATOM 638 H LEU A 88 24.864 24.680 91.709 1.00 0.00 H ATOM 639 N ARG A 89 26.833 22.887 93.356 1.00 36.79 N ATOM 640 CA ARG A 89 27.691 21.757 93.727 1.00 36.17 C ATOM 641 C ARG A 89 28.313 21.134 92.482 1.00 37.35 C ATOM 642 O ARG A 89 27.594 20.916 91.506 1.00 37.38 O ATOM 643 CB ARG A 89 26.792 20.748 94.465 1.00 37.11 C ATOM 644 CG ARG A 89 27.489 19.707 95.246 1.00 53.69 C ATOM 645 CD ARG A 89 26.635 19.262 96.409 1.00 50.52 C ATOM 646 NE ARG A 89 25.665 18.223 96.062 1.00 36.87 N ATOM 647 CZ ARG A 89 25.891 16.913 96.110 1.00 48.48 C ATOM 648 NH1 ARG A 89 27.097 16.449 96.390 1.00 35.22 N ATOM 649 NH2 ARG A 89 24.918 16.058 95.834 1.00 36.05 N ATOM 650 HE ARG A 89 24.722 18.534 95.753 1.00 0.00 H ATOM 651 HH12 ARG A 89 27.264 15.423 96.425 1.00 0.00 H ATOM 652 HH11 ARG A 89 27.878 17.110 96.575 1.00 0.00 H ATOM 653 HH22 ARG A 89 25.099 15.035 95.873 1.00 0.00 H ATOM 654 HH21 ARG A 89 23.973 16.410 95.579 1.00 0.00 H ATOM 655 H ARG A 89 26.402 22.894 92.410 1.00 0.00 H ATOM 656 N ALA A 90 29.641 20.902 92.478 1.00 31.96 N ATOM 657 CA ALA A 90 30.310 20.283 91.306 1.00 31.03 C ATOM 658 C ALA A 90 30.933 18.973 91.743 1.00 37.28 C ATOM 659 O ALA A 90 31.944 18.966 92.445 1.00 35.68 O ATOM 660 CB ALA A 90 31.354 21.207 90.686 1.00 30.50 C ATOM 661 H ALA A 90 30.207 21.161 93.311 1.00 0.00 H ATOM 662 N VAL A 91 30.293 17.860 91.367 1.00 37.03 N ATOM 663 CA VAL A 91 30.708 16.515 91.777 1.00 38.09 C ATOM 664 C VAL A 91 31.448 15.810 90.651 1.00 47.90 C ATOM 665 O VAL A 91 30.800 15.214 89.781 1.00 48.56 O ATOM 666 CB VAL A 91 29.495 15.664 92.254 1.00 41.59 C ATOM 667 CG1 VAL A 91 29.961 14.355 92.857 1.00 40.40 C ATOM 668 CG2 VAL A 91 28.569 16.432 93.234 1.00 41.62 C ATOM 669 H VAL A 91 29.459 17.954 90.753 1.00 0.00 H ATOM 670 N PRO A 92 32.808 15.833 90.641 1.00 47.38 N ATOM 671 CA PRO A 92 33.535 15.077 89.593 1.00 46.93 C ATOM 672 C PRO A 92 33.629 13.616 89.995 1.00 49.91 C ATOM 673 O PRO A 92 33.495 13.289 91.182 1.00 48.64 O ATOM 674 CB PRO A 92 34.913 15.737 89.566 1.00 48.27 C ATOM 675 CG PRO A 92 35.097 16.250 90.959 1.00 52.98 C ATOM 676 CD PRO A 92 33.745 16.449 91.608 1.00 48.55 C ATOM 677 N HIS A 93 33.875 12.738 89.027 1.00 47.20 N ATOM 678 CA HIS A 93 34.049 11.325 89.349 1.00 46.02 C ATOM 679 C HIS A 93 35.292 11.176 90.238 1.00 50.23 C ATOM 680 O HIS A 93 36.322 11.800 89.957 1.00 49.14 O ATOM 681 CB HIS A 93 34.163 10.461 88.088 1.00 45.63 C ATOM 682 CG HIS A 93 34.068 9.002 88.392 1.00 48.47 C ATOM 683 ND1 HIS A 93 35.172 8.280 88.851 1.00 49.67 N ATOM 684 CD2 HIS A 93 32.993 8.181 88.353 1.00 49.77 C ATOM 685 CE1 HIS A 93 34.737 7.050 89.049 1.00 48.49 C ATOM 686 NE2 HIS A 93 33.434 6.937 88.753 1.00 49.06 N ATOM 687 H HIS A 93 33.943 13.058 88.040 1.00 0.00 H ATOM 688 N PRO A 94 35.191 10.389 91.331 1.00 47.59 N ATOM 689 CA PRO A 94 36.343 10.219 92.243 1.00 47.18 C ATOM 690 C PRO A 94 37.651 9.812 91.573 1.00 51.80 C ATOM 691 O PRO A 94 38.704 10.297 91.974 1.00 53.50 O ATOM 692 CB PRO A 94 35.891 9.101 93.177 1.00 48.76 C ATOM 693 CG PRO A 94 34.414 9.198 93.164 1.00 54.32 C ATOM 694 CD PRO A 94 34.010 9.636 91.800 1.00 49.53 C ATOM 695 N ASP A 95 37.589 8.947 90.560 1.00 46.43 N ATOM 696 CA ASP A 95 38.775 8.433 89.905 1.00 46.28 C ATOM 697 C ASP A 95 39.195 9.223 88.641 1.00 52.35 C ATOM 698 O ASP A 95 40.027 8.742 87.863 1.00 52.23 O ATOM 699 CB ASP A 95 38.530 6.954 89.578 1.00 48.04 C ATOM 700 CG ASP A 95 38.296 6.112 90.817 1.00 55.07 C ATOM 701 OD1 ASP A 95 39.089 6.225 91.751 1.00 52.31 O ATOM 702 OD2 ASP A 95 37.325 5.312 90.825 1.00 62.57 O ATOM 703 H ASP A 95 36.656 8.630 90.228 1.00 0.00 H ATOM 704 N SER A 96 38.700 10.457 88.465 1.00 50.77 N ATOM 705 CA SER A 96 39.065 11.234 87.271 1.00 51.40 C ATOM 706 C SER A 96 40.341 12.010 87.484 1.00 59.61 C ATOM 707 O SER A 96 40.532 12.622 88.537 1.00 61.39 O ATOM 708 CB SER A 96 37.939 12.164 86.819 1.00 52.34 C ATOM 709 OG SER A 96 37.645 13.203 87.730 1.00 55.94 O ATOM 710 HG SER A 96 37.369 12.812 88.597 1.00 0.00 H ATOM 711 H SER A 96 38.057 10.865 89.174 1.00 0.00 H ATOM 712 N GLN A 97 41.229 11.965 86.485 1.00 56.62 N ATOM 713 CA GLN A 97 42.511 12.661 86.534 1.00 56.36 C ATOM 714 C GLN A 97 42.830 13.274 85.189 1.00 62.51 C ATOM 715 O GLN A 97 42.446 12.687 84.175 1.00 62.69 O ATOM 716 CB GLN A 97 43.614 11.719 86.978 1.00 56.92 C ATOM 717 CG GLN A 97 43.593 11.592 88.474 1.00 56.38 C ATOM 718 CD GLN A 97 44.067 10.256 88.888 1.00 66.35 C ATOM 719 OE1 GLN A 97 45.267 9.955 88.788 1.00 64.17 O ATOM 720 NE2 GLN A 97 43.124 9.418 89.322 1.00 48.99 N ATOM 721 HE22 GLN A 97 42.135 9.734 89.382 1.00 0.00 H ATOM 722 HE21 GLN A 97 43.378 8.449 89.600 1.00 0.00 H ATOM 723 H GLN A 97 40.996 11.410 85.637 1.00 0.00 H ATOM 724 N PRO A 98 43.498 14.455 85.144 1.00 59.39 N ATOM 725 CA PRO A 98 43.759 15.104 83.848 1.00 59.04 C ATOM 726 C PRO A 98 44.702 14.339 82.928 1.00 63.08 C ATOM 727 O PRO A 98 44.702 14.621 81.735 1.00 63.64 O ATOM 728 CB PRO A 98 44.368 16.448 84.229 1.00 61.17 C ATOM 729 CG PRO A 98 44.031 16.640 85.670 1.00 66.45 C ATOM 730 CD PRO A 98 44.002 15.278 86.259 1.00 61.58 C ATOM 731 N ASP A 99 45.471 13.373 83.449 1.00 59.27 N ATOM 732 CA ASP A 99 46.421 12.569 82.662 1.00 59.08 C ATOM 733 C ASP A 99 45.733 11.442 81.889 1.00 60.28 C ATOM 734 O ASP A 99 46.284 10.977 80.887 1.00 61.53 O ATOM 735 CB ASP A 99 47.496 11.963 83.568 1.00 61.74 C ATOM 736 CG ASP A 99 47.999 12.937 84.592 1.00 82.80 C ATOM 737 OD1 ASP A 99 48.959 13.683 84.273 1.00 86.13 O ATOM 738 OD2 ASP A 99 47.374 13.020 85.692 1.00 89.44 O ATOM 739 H ASP A 99 45.392 13.180 84.468 1.00 0.00 H ATOM 740 N THR A 100 44.566 10.984 82.369 1.00 52.58 N ATOM 741 CA THR A 100 43.808 9.912 81.742 1.00 50.97 C ATOM 742 C THR A 100 42.520 10.428 81.138 1.00 52.12 C ATOM 743 O THR A 100 42.001 11.472 81.535 1.00 52.33 O ATOM 744 CB THR A 100 43.505 8.780 82.731 1.00 61.35 C ATOM 745 OG1 THR A 100 42.784 9.271 83.857 1.00 62.09 O ATOM 746 CG2 THR A 100 44.747 8.062 83.185 1.00 65.53 C ATOM 747 HG1 THR A 100 42.600 8.524 84.481 1.00 0.00 H ATOM 748 H THR A 100 44.184 11.418 83.234 1.00 0.00 H ATOM 749 N ILE A 101 41.994 9.678 80.179 1.00 45.63 N ATOM 750 CA ILE A 101 40.706 9.977 79.553 1.00 43.72 C ATOM 751 C ILE A 101 39.588 9.172 80.277 1.00 44.53 C ATOM 752 O ILE A 101 38.416 9.199 79.883 1.00 44.56 O ATOM 753 CB ILE A 101 40.749 9.724 78.016 1.00 45.26 C ATOM 754 CG1 ILE A 101 41.174 8.293 77.667 1.00 42.93 C ATOM 755 CG2 ILE A 101 41.627 10.777 77.338 1.00 47.51 C ATOM 756 CD1 ILE A 101 40.744 7.831 76.323 1.00 37.58 C ATOM 757 H ILE A 101 42.520 8.840 79.858 1.00 0.00 H ATOM 758 N ASP A 102 39.974 8.494 81.357 1.00 38.74 N ATOM 759 CA ASP A 102 39.103 7.635 82.139 1.00 38.58 C ATOM 760 C ASP A 102 38.315 8.390 83.192 1.00 42.60 C ATOM 761 O ASP A 102 38.824 9.326 83.831 1.00 42.19 O ATOM 762 CB ASP A 102 39.919 6.531 82.806 1.00 40.10 C ATOM 763 CG ASP A 102 40.628 5.653 81.802 1.00 53.06 C ATOM 764 OD1 ASP A 102 39.934 4.952 81.033 1.00 55.62 O ATOM 765 OD2 ASP A 102 41.876 5.670 81.776 1.00 55.28 O ATOM 766 H ASP A 102 40.965 8.586 81.660 1.00 0.00 H ATOM 767 N HIS A 103 37.051 7.949 83.370 1.00 37.40 N ATOM 768 CA HIS A 103 36.064 8.444 84.346 1.00 34.94 C ATOM 769 C HIS A 103 35.878 9.949 84.191 1.00 39.90 C ATOM 770 O HIS A 103 35.714 10.689 85.173 1.00 39.72 O ATOM 771 CB HIS A 103 36.459 8.042 85.768 1.00 33.72 C ATOM 772 CG HIS A 103 37.207 6.748 85.827 1.00 35.81 C ATOM 773 ND1 HIS A 103 36.587 5.536 85.557 1.00 36.84 N ATOM 774 CD2 HIS A 103 38.512 6.523 86.081 1.00 36.17 C ATOM 775 CE1 HIS A 103 37.531 4.622 85.654 1.00 35.46 C ATOM 776 NE2 HIS A 103 38.703 5.170 85.991 1.00 35.71 N ATOM 777 H HIS A 103 36.740 7.174 82.750 1.00 0.00 H ATOM 778 N ASP A 104 35.829 10.362 82.917 1.00 37.26 N ATOM 779 CA ASP A 104 35.704 11.729 82.459 1.00 38.85 C ATOM 780 C ASP A 104 34.268 12.230 82.584 1.00 45.24 C ATOM 781 O ASP A 104 33.647 12.633 81.581 1.00 46.46 O ATOM 782 CB ASP A 104 36.159 11.800 80.997 1.00 41.54 C ATOM 783 CG ASP A 104 36.705 13.123 80.531 1.00 47.21 C ATOM 784 OD1 ASP A 104 36.416 14.156 81.192 1.00 43.09 O ATOM 785 OD2 ASP A 104 37.446 13.125 79.523 1.00 56.35 O ATOM 786 H ASP A 104 35.887 9.626 82.184 1.00 0.00 H ATOM 787 N LEU A 105 33.751 12.223 83.824 1.00 40.19 N ATOM 788 CA LEU A 105 32.414 12.701 84.104 1.00 38.65 C ATOM 789 C LEU A 105 32.409 13.720 85.251 1.00 41.12 C ATOM 790 O LEU A 105 33.276 13.715 86.147 1.00 41.00 O ATOM 791 CB LEU A 105 31.474 11.545 84.410 1.00 38.64 C ATOM 792 CG LEU A 105 31.119 10.605 83.246 1.00 42.76 C ATOM 793 CD1 LEU A 105 30.139 9.575 83.716 1.00 42.37 C ATOM 794 CD2 LEU A 105 30.515 11.346 82.045 1.00 43.50 C ATOM 795 H LEU A 105 34.331 11.862 84.608 1.00 0.00 H ATOM 796 N LEU A 106 31.431 14.623 85.176 1.00 35.07 N ATOM 797 CA LEU A 106 31.227 15.689 86.129 1.00 33.89 C ATOM 798 C LEU A 106 29.740 15.938 86.270 1.00 39.21 C ATOM 799 O LEU A 106 29.038 16.105 85.264 1.00 40.15 O ATOM 800 CB LEU A 106 31.968 16.955 85.655 1.00 32.87 C ATOM 801 CG LEU A 106 31.748 18.257 86.448 1.00 33.80 C ATOM 802 CD1 LEU A 106 32.250 18.141 87.889 1.00 30.21 C ATOM 803 CD2 LEU A 106 32.372 19.431 85.713 1.00 36.20 C ATOM 804 H LEU A 106 30.770 14.555 84.376 1.00 0.00 H ATOM 805 N LEU A 107 29.260 15.948 87.519 1.00 35.65 N ATOM 806 CA LEU A 107 27.860 16.191 87.786 1.00 36.10 C ATOM 807 C LEU A 107 27.688 17.535 88.470 1.00 39.86 C ATOM 808 O LEU A 107 28.172 17.733 89.603 1.00 38.08 O ATOM 809 CB LEU A 107 27.248 15.050 88.610 1.00 36.46 C ATOM 810 CG LEU A 107 26.675 13.905 87.777 1.00 40.52 C ATOM 811 CD1 LEU A 107 26.302 12.771 88.679 1.00 39.46 C ATOM 812 CD2 LEU A 107 25.459 14.368 86.899 1.00 41.66 C ATOM 813 H LEU A 107 29.908 15.777 88.315 1.00 0.00 H ATOM 814 N LEU A 108 27.037 18.478 87.736 1.00 35.38 N ATOM 815 CA LEU A 108 26.803 19.845 88.193 1.00 33.00 C ATOM 816 C LEU A 108 25.392 20.009 88.710 1.00 35.89 C ATOM 817 O LEU A 108 24.435 19.796 87.968 1.00 34.93 O ATOM 818 CB LEU A 108 27.061 20.848 87.057 1.00 31.77 C ATOM 819 CG LEU A 108 28.419 20.821 86.391 1.00 34.20 C ATOM 820 CD1 LEU A 108 28.408 21.702 85.138 1.00 31.97 C ATOM 821 CD2 LEU A 108 29.510 21.273 87.374 1.00 41.16 C ATOM 822 H LEU A 108 26.686 18.209 86.795 1.00 0.00 H ATOM 823 N GLN A 109 25.266 20.371 89.986 1.00 33.27 N ATOM 824 CA GLN A 109 23.978 20.644 90.592 1.00 33.91 C ATOM 825 C GLN A 109 23.689 22.129 90.441 1.00 43.89 C ATOM 826 O GLN A 109 24.470 22.963 90.942 1.00 46.80 O ATOM 827 CB GLN A 109 23.925 20.227 92.060 1.00 34.39 C ATOM 828 CG GLN A 109 22.565 20.489 92.674 1.00 40.32 C ATOM 829 CD GLN A 109 22.434 20.063 94.087 1.00 52.01 C ATOM 830 OE1 GLN A 109 23.335 20.207 94.910 1.00 49.69 O ATOM 831 NE2 GLN A 109 21.274 19.563 94.412 1.00 46.95 N ATOM 832 HE22 GLN A 109 20.533 19.455 93.690 1.00 0.00 H ATOM 833 HE21 GLN A 109 21.090 19.272 95.393 1.00 0.00 H ATOM 834 H GLN A 109 26.123 20.461 90.568 1.00 0.00 H ATOM 835 N LEU A 110 22.562 22.468 89.794 1.00 39.61 N ATOM 836 CA LEU A 110 22.229 23.878 89.638 1.00 40.18 C ATOM 837 C LEU A 110 21.800 24.487 90.987 1.00 46.48 C ATOM 838 O LEU A 110 21.503 23.762 91.944 1.00 47.22 O ATOM 839 CB LEU A 110 21.148 24.048 88.574 1.00 40.47 C ATOM 840 CG LEU A 110 21.389 23.278 87.257 1.00 45.92 C ATOM 841 CD1 LEU A 110 20.208 23.396 86.311 1.00 46.44 C ATOM 842 CD2 LEU A 110 22.664 23.730 86.547 1.00 48.05 C ATOM 843 H LEU A 110 21.935 21.733 89.409 1.00 0.00 H ATOM 844 N SER A 111 21.847 25.814 91.084 1.00 43.65 N ATOM 845 CA SER A 111 21.458 26.589 92.272 1.00 43.47 C ATOM 846 C SER A 111 19.989 26.359 92.618 1.00 51.89 C ATOM 847 O SER A 111 19.643 26.358 93.795 1.00 54.09 O ATOM 848 CB SER A 111 21.689 28.073 92.023 1.00 45.22 C ATOM 849 OG SER A 111 21.045 28.532 90.841 1.00 47.00 O ATOM 850 HG SER A 111 21.224 29.498 90.723 1.00 0.00 H ATOM 851 H SER A 111 22.185 26.344 90.255 1.00 0.00 H ATOM 852 N GLU A 112 19.128 26.146 91.583 1.00 47.93 N ATOM 853 CA GLU A 112 17.707 25.860 91.691 1.00 46.47 C ATOM 854 C GLU A 112 17.282 24.942 90.540 1.00 49.06 C ATOM 855 O GLU A 112 18.032 24.814 89.570 1.00 46.77 O ATOM 856 CB GLU A 112 16.903 27.159 91.717 1.00 48.08 C ATOM 857 CG GLU A 112 17.017 28.016 90.469 1.00 67.32 C ATOM 858 CD GLU A 112 15.839 28.943 90.246 1.00107.42 C ATOM 859 OE1 GLU A 112 14.891 28.535 89.535 1.00112.35 O ATOM 860 OE2 GLU A 112 15.857 30.071 90.792 1.00107.07 O ATOM 861 H GLU A 112 19.526 26.193 90.623 1.00 0.00 H ATOM 862 N LYS A 113 16.092 24.276 90.661 1.00 47.60 N ATOM 863 CA LYS A 113 15.539 23.375 89.621 1.00 47.17 C ATOM 864 C LYS A 113 15.269 24.158 88.349 1.00 51.32 C ATOM 865 O LYS A 113 14.815 25.303 88.410 1.00 52.92 O ATOM 866 CB LYS A 113 14.247 22.671 90.072 1.00 49.40 C ATOM 867 CG LYS A 113 14.414 21.603 91.145 1.00 62.29 C ATOM 868 CD LYS A 113 13.117 20.792 91.335 1.00 70.46 C ATOM 869 CE LYS A 113 13.216 19.789 92.468 1.00 80.46 C ATOM 870 NZ LYS A 113 12.126 18.782 92.446 1.00 90.74 N ATOM 871 HZ1 LYS A 113 11.208 19.264 92.529 1.00 0.00 H ATOM 872 HZ2 LYS A 113 12.162 18.254 91.551 1.00 0.00 H ATOM 873 HZ3 LYS A 113 12.247 18.125 93.243 1.00 0.00 H ATOM 874 H LYS A 113 15.543 24.410 91.534 1.00 0.00 H ATOM 875 N ALA A 114 15.543 23.552 87.203 1.00 46.70 N ATOM 876 CA ALA A 114 15.328 24.154 85.890 1.00 46.95 C ATOM 877 C ALA A 114 13.827 24.365 85.586 1.00 52.62 C ATOM 878 O ALA A 114 13.006 23.478 85.862 1.00 53.21 O ATOM 879 CB ALA A 114 15.944 23.271 84.814 1.00 47.41 C ATOM 880 H ALA A 114 15.935 22.589 87.241 1.00 0.00 H ATOM 881 N THR A 115 13.471 25.535 85.016 1.00 48.63 N ATOM 882 CA THR A 115 12.093 25.791 84.600 1.00 47.86 C ATOM 883 C THR A 115 11.875 24.989 83.331 1.00 55.03 C ATOM 884 O THR A 115 12.445 25.302 82.279 1.00 55.29 O ATOM 885 CB THR A 115 11.830 27.278 84.445 1.00 39.71 C ATOM 886 OG1 THR A 115 12.134 27.914 85.685 1.00 36.02 O ATOM 887 CG2 THR A 115 10.409 27.575 84.002 1.00 28.86 C ATOM 888 HG1 THR A 115 11.969 28.887 85.605 1.00 0.00 H ATOM 889 H THR A 115 14.192 26.270 84.870 1.00 0.00 H ATOM 890 N LEU A 116 11.102 23.908 83.455 1.00 53.32 N ATOM 891 CA LEU A 116 10.879 22.995 82.335 1.00 53.04 C ATOM 892 C LEU A 116 9.843 23.522 81.356 1.00 54.02 C ATOM 893 O LEU A 116 8.877 24.183 81.731 1.00 54.88 O ATOM 894 CB LEU A 116 10.514 21.580 82.835 1.00 52.87 C ATOM 895 CG LEU A 116 11.571 20.912 83.735 1.00 56.65 C ATOM 896 CD1 LEU A 116 11.122 19.590 84.161 1.00 56.57 C ATOM 897 CD2 LEU A 116 12.935 20.798 83.033 1.00 59.89 C ATOM 898 H LEU A 116 10.648 23.711 84.369 1.00 0.00 H ATOM 899 N GLY A 117 10.083 23.225 80.103 1.00 47.82 N ATOM 900 CA GLY A 117 9.246 23.631 78.992 1.00 46.88 C ATOM 901 C GLY A 117 9.642 22.935 77.709 1.00 50.44 C ATOM 902 O GLY A 117 10.436 21.975 77.712 1.00 48.63 O ATOM 903 H GLY A 117 10.930 22.660 79.892 1.00 0.00 H ATOM 904 N PRO A 118 9.107 23.408 76.574 1.00 47.86 N ATOM 905 CA PRO A 118 9.415 22.746 75.289 1.00 48.47 C ATOM 906 C PRO A 118 10.899 22.820 74.878 1.00 53.38 C ATOM 907 O PRO A 118 11.371 21.992 74.078 1.00 51.93 O ATOM 908 CB PRO A 118 8.541 23.514 74.284 1.00 49.37 C ATOM 909 CG PRO A 118 7.535 24.187 75.086 1.00 53.05 C ATOM 910 CD PRO A 118 8.165 24.520 76.385 1.00 48.38 C ATOM 911 N ALA A 119 11.622 23.820 75.432 1.00 50.30 N ATOM 912 CA ALA A 119 13.008 24.102 75.104 1.00 49.67 C ATOM 913 C ALA A 119 13.972 23.664 76.181 1.00 52.41 C ATOM 914 O ALA A 119 15.179 23.671 75.934 1.00 51.43 O ATOM 915 CB ALA A 119 13.165 25.581 74.839 1.00 50.35 C ATOM 916 H ALA A 119 11.156 24.425 76.138 1.00 0.00 H ATOM 917 N VAL A 120 13.444 23.270 77.358 1.00 49.20 N ATOM 918 CA VAL A 120 14.209 22.788 78.518 1.00 49.17 C ATOM 919 C VAL A 120 13.540 21.506 79.038 1.00 55.35 C ATOM 920 O VAL A 120 12.482 21.562 79.671 1.00 54.32 O ATOM 921 CB VAL A 120 14.384 23.844 79.653 1.00 51.44 C ATOM 922 CG1 VAL A 120 15.201 23.270 80.816 1.00 51.04 C ATOM 923 CG2 VAL A 120 15.014 25.132 79.125 1.00 50.22 C ATOM 924 H VAL A 120 12.409 23.310 77.453 1.00 0.00 H ATOM 925 N ARG A 121 14.169 20.352 78.769 1.00 53.62 N ATOM 926 CA ARG A 121 13.648 19.045 79.191 1.00 53.65 C ATOM 927 C ARG A 121 14.803 18.056 79.429 1.00 54.61 C ATOM 928 O ARG A 121 15.680 17.920 78.557 1.00 53.55 O ATOM 929 CB ARG A 121 12.687 18.484 78.120 1.00 56.89 C ATOM 930 CG ARG A 121 11.694 17.426 78.607 1.00 70.47 C ATOM 931 CD ARG A 121 10.451 18.049 79.228 1.00 89.50 C ATOM 932 NE ARG A 121 9.594 18.713 78.235 1.00109.60 N ATOM 933 CZ ARG A 121 8.630 19.581 78.534 1.00128.79 C ATOM 934 NH1 ARG A 121 8.401 19.923 79.799 1.00115.97 N ATOM 935 NH2 ARG A 121 7.901 20.134 77.566 1.00113.92 N ATOM 936 HE ARG A 121 9.751 18.490 77.232 1.00 0.00 H ATOM 937 HH12 ARG A 121 7.646 20.602 80.026 1.00 0.00 H ATOM 938 HH11 ARG A 121 8.977 19.512 80.561 1.00 0.00 H ATOM 939 HH22 ARG A 121 7.149 20.812 77.804 1.00 0.00 H ATOM 940 HH21 ARG A 121 8.084 19.888 76.572 1.00 0.00 H ATOM 941 H ARG A 121 15.063 20.384 78.239 1.00 0.00 H ATOM 942 N PRO A 122 14.828 17.343 80.582 1.00 47.58 N ATOM 943 CA PRO A 122 15.921 16.387 80.816 1.00 46.21 C ATOM 944 C PRO A 122 15.873 15.213 79.853 1.00 49.74 C ATOM 945 O PRO A 122 14.784 14.824 79.410 1.00 51.73 O ATOM 946 CB PRO A 122 15.685 15.922 82.250 1.00 47.33 C ATOM 947 CG PRO A 122 14.782 16.939 82.842 1.00 51.55 C ATOM 948 CD PRO A 122 13.911 17.395 81.733 1.00 47.63 C ATOM 949 N LEU A 123 17.059 14.665 79.509 1.00 42.76 N ATOM 950 CA LEU A 123 17.189 13.522 78.604 1.00 40.81 C ATOM 951 C LEU A 123 17.333 12.210 79.375 1.00 48.74 C ATOM 952 O LEU A 123 18.195 12.128 80.255 1.00 49.37 O ATOM 953 CB LEU A 123 18.388 13.693 77.660 1.00 38.91 C ATOM 954 CG LEU A 123 18.630 12.643 76.586 1.00 40.60 C ATOM 955 CD1 LEU A 123 17.559 12.661 75.532 1.00 39.11 C ATOM 956 CD2 LEU A 123 19.924 12.897 75.898 1.00 43.42 C ATOM 957 H LEU A 123 17.926 15.077 79.909 1.00 0.00 H ATOM 958 N PRO A 124 16.515 11.162 79.059 1.00 45.43 N ATOM 959 CA PRO A 124 16.707 9.861 79.711 1.00 44.57 C ATOM 960 C PRO A 124 18.041 9.274 79.280 1.00 48.99 C ATOM 961 O PRO A 124 18.376 9.245 78.085 1.00 46.65 O ATOM 962 CB PRO A 124 15.533 9.035 79.209 1.00 45.98 C ATOM 963 CG PRO A 124 14.619 9.994 78.550 1.00 50.39 C ATOM 964 CD PRO A 124 15.443 11.091 78.052 1.00 46.12 C ATOM 965 N TRP A 125 18.837 8.878 80.265 1.00 47.60 N ATOM 966 CA TRP A 125 20.166 8.328 80.014 1.00 47.34 C ATOM 967 C TRP A 125 20.154 6.822 80.191 1.00 50.72 C ATOM 968 O TRP A 125 19.295 6.300 80.897 1.00 51.39 O ATOM 969 CB TRP A 125 21.205 9.012 80.911 1.00 46.09 C ATOM 970 CG TRP A 125 20.853 9.032 82.372 1.00 46.53 C ATOM 971 CD1 TRP A 125 20.067 9.934 83.032 1.00 48.93 C ATOM 972 CD2 TRP A 125 21.359 8.144 83.355 1.00 46.30 C ATOM 973 NE1 TRP A 125 20.042 9.646 84.372 1.00 47.96 N ATOM 974 CE2 TRP A 125 20.832 8.551 84.601 1.00 49.92 C ATOM 975 CE3 TRP A 125 22.220 7.040 83.303 1.00 47.70 C ATOM 976 CZ2 TRP A 125 21.100 7.860 85.778 1.00 49.69 C ATOM 977 CZ3 TRP A 125 22.489 6.364 84.470 1.00 49.93 C ATOM 978 CH2 TRP A 125 21.941 6.775 85.692 1.00 50.56 C ATOM 979 HE1 TRP A 125 19.511 10.172 85.095 1.00 0.00 H ATOM 980 H TRP A 125 18.504 8.962 81.247 1.00 0.00 H ATOM 981 N GLN A 126 21.080 6.126 79.516 1.00 47.67 N ATOM 982 CA GLN A 126 21.177 4.660 79.527 1.00 48.01 C ATOM 983 C GLN A 126 21.587 4.131 80.886 1.00 53.78 C ATOM 984 O GLN A 126 22.652 4.488 81.386 1.00 55.60 O ATOM 985 CB GLN A 126 22.141 4.160 78.449 1.00 48.83 C ATOM 986 CG GLN A 126 22.095 2.641 78.263 1.00 51.58 C ATOM 987 CD GLN A 126 20.716 2.107 78.048 1.00 56.02 C ATOM 988 OE1 GLN A 126 20.120 1.479 78.935 1.00 51.48 O ATOM 989 NE2 GLN A 126 20.159 2.432 76.892 1.00 39.28 N ATOM 990 HE22 GLN A 126 20.705 2.960 76.182 1.00 0.00 H ATOM 991 HE21 GLN A 126 19.175 2.159 76.694 1.00 0.00 H ATOM 992 H GLN A 126 21.772 6.657 78.950 1.00 0.00 H ATOM 993 N ARG A 127 20.706 3.314 81.496 1.00 48.46 N ATOM 994 CA ARG A 127 20.878 2.759 82.839 1.00 46.85 C ATOM 995 C ARG A 127 21.220 1.226 82.829 1.00 46.38 C ATOM 996 O ARG A 127 21.390 0.657 83.907 1.00 45.15 O ATOM 997 CB ARG A 127 19.602 3.037 83.655 1.00 47.44 C ATOM 998 CG ARG A 127 19.818 3.979 84.843 1.00 58.34 C ATOM 999 CD ARG A 127 18.617 4.856 85.184 1.00 68.48 C ATOM 1000 NE ARG A 127 18.202 5.681 84.039 1.00 81.74 N ATOM 1001 CZ ARG A 127 17.452 6.780 84.125 1.00 90.01 C ATOM 1002 NH1 ARG A 127 17.055 7.231 85.313 1.00 72.81 N ATOM 1003 NH2 ARG A 127 17.109 7.448 83.022 1.00 64.22 N ATOM 1004 HE ARG A 127 18.517 5.385 83.093 1.00 0.00 H ATOM 1005 HH12 ARG A 127 16.470 8.089 85.375 1.00 0.00 H ATOM 1006 HH11 ARG A 127 17.330 6.726 86.179 1.00 0.00 H ATOM 1007 HH22 ARG A 127 16.524 8.305 83.094 1.00 0.00 H ATOM 1008 HH21 ARG A 127 17.427 7.112 82.091 1.00 0.00 H ATOM 1009 H ARG A 127 19.842 3.060 80.975 1.00 0.00 H ATOM 1010 N VAL A 128 21.314 0.585 81.616 1.00 39.93 N ATOM 1011 CA VAL A 128 21.669 -0.819 81.335 1.00 38.12 C ATOM 1012 C VAL A 128 23.022 -0.857 80.613 1.00 43.21 C ATOM 1013 O VAL A 128 23.140 -0.388 79.460 1.00 42.45 O ATOM 1014 CB VAL A 128 20.571 -1.545 80.518 1.00 40.05 C ATOM 1015 CG1 VAL A 128 21.028 -2.940 80.092 1.00 39.68 C ATOM 1016 CG2 VAL A 128 19.283 -1.624 81.303 1.00 39.12 C ATOM 1017 H VAL A 128 21.106 1.171 80.782 1.00 0.00 H ATOM 1018 N ASP A 129 24.038 -1.419 81.294 1.00 42.12 N ATOM 1019 CA ASP A 129 25.403 -1.477 80.774 1.00 44.76 C ATOM 1020 C ASP A 129 25.555 -2.474 79.608 1.00 52.76 C ATOM 1021 O ASP A 129 26.011 -3.591 79.817 1.00 55.15 O ATOM 1022 CB ASP A 129 26.398 -1.790 81.904 1.00 47.54 C ATOM 1023 CG ASP A 129 27.868 -1.554 81.578 1.00 68.28 C ATOM 1024 OD1 ASP A 129 28.195 -1.355 80.375 1.00 71.51 O ATOM 1025 OD2 ASP A 129 28.693 -1.554 82.525 1.00 73.40 O ATOM 1026 H ASP A 129 23.844 -1.829 82.230 1.00 0.00 H ATOM 1027 N ARG A 130 25.199 -2.056 78.388 1.00 48.67 N ATOM 1028 CA ARG A 130 25.359 -2.863 77.180 1.00 48.80 C ATOM 1029 C ARG A 130 25.823 -1.947 76.048 1.00 52.48 C ATOM 1030 O ARG A 130 25.197 -0.908 75.804 1.00 53.53 O ATOM 1031 CB ARG A 130 24.060 -3.599 76.813 1.00 52.25 C ATOM 1032 CG ARG A 130 23.797 -4.931 77.534 1.00 60.16 C ATOM 1033 CD ARG A 130 22.862 -5.850 76.720 1.00 79.23 C ATOM 1034 NE ARG A 130 21.514 -5.291 76.497 1.00105.50 N ATOM 1035 CZ ARG A 130 20.480 -5.385 77.345 1.00127.08 C ATOM 1036 NH1 ARG A 130 20.615 -6.017 78.505 1.00108.85 N ATOM 1037 NH2 ARG A 130 19.309 -4.830 77.042 1.00114.56 N ATOM 1038 HE ARG A 130 21.353 -4.780 75.605 1.00 0.00 H ATOM 1039 HH12 ARG A 130 19.808 -6.085 79.157 1.00 0.00 H ATOM 1040 HH11 ARG A 130 21.528 -6.444 78.762 1.00 0.00 H ATOM 1041 HH22 ARG A 130 18.511 -4.906 77.704 1.00 0.00 H ATOM 1042 HH21 ARG A 130 19.192 -4.320 76.143 1.00 0.00 H ATOM 1043 H ARG A 130 24.786 -1.106 78.294 1.00 0.00 H ATOM 1044 N ASP A 131 26.934 -2.302 75.389 1.00 47.50 N ATOM 1045 CA ASP A 131 27.527 -1.493 74.311 1.00 46.42 C ATOM 1046 C ASP A 131 26.534 -1.183 73.184 1.00 49.86 C ATOM 1047 O ASP A 131 25.723 -2.034 72.814 1.00 49.48 O ATOM 1048 CB ASP A 131 28.754 -2.204 73.680 1.00 47.35 C ATOM 1049 CG ASP A 131 30.084 -2.095 74.375 1.00 49.88 C ATOM 1050 OD1 ASP A 131 30.162 -1.416 75.411 1.00 51.74 O ATOM 1051 OD2 ASP A 131 31.041 -2.686 73.885 1.00 51.04 O ATOM 1052 H ASP A 131 27.401 -3.193 75.652 1.00 0.00 H ATOM 1053 N VAL A 132 26.624 0.037 72.634 1.00 45.08 N ATOM 1054 CA VAL A 132 25.859 0.439 71.459 1.00 43.36 C ATOM 1055 C VAL A 132 26.501 -0.301 70.306 1.00 50.14 C ATOM 1056 O VAL A 132 27.741 -0.234 70.139 1.00 51.09 O ATOM 1057 CB VAL A 132 25.865 1.970 71.238 1.00 44.64 C ATOM 1058 CG1 VAL A 132 25.077 2.363 70.000 1.00 43.76 C ATOM 1059 CG2 VAL A 132 25.341 2.688 72.454 1.00 43.77 C ATOM 1060 H VAL A 132 27.270 0.729 73.066 1.00 0.00 H ATOM 1061 N ALA A 133 25.679 -1.047 69.556 1.00 46.42 N ATOM 1062 CA ALA A 133 26.131 -1.842 68.425 1.00 46.61 C ATOM 1063 C ALA A 133 26.908 -1.012 67.389 1.00 46.28 C ATOM 1064 O ALA A 133 26.379 0.024 66.955 1.00 46.83 O ATOM 1065 CB ALA A 133 24.932 -2.490 67.762 1.00 48.06 C ATOM 1066 H ALA A 133 24.667 -1.058 69.794 1.00 0.00 H ATOM 1067 N PRO A 134 28.158 -1.411 67.001 1.00 37.95 N ATOM 1068 CA PRO A 134 28.881 -0.653 65.962 1.00 37.95 C ATOM 1069 C PRO A 134 27.995 -0.411 64.730 1.00 46.97 C ATOM 1070 O PRO A 134 27.092 -1.209 64.440 1.00 49.21 O ATOM 1071 CB PRO A 134 30.085 -1.540 65.640 1.00 37.85 C ATOM 1072 CG PRO A 134 30.312 -2.278 66.862 1.00 40.69 C ATOM 1073 CD PRO A 134 28.962 -2.555 67.456 1.00 36.89 C ATOM 1074 N GLY A 135 28.187 0.729 64.085 1.00 42.88 N ATOM 1075 CA GLY A 135 27.393 1.102 62.932 1.00 42.80 C ATOM 1076 C GLY A 135 26.094 1.799 63.282 1.00 48.67 C ATOM 1077 O GLY A 135 25.403 2.261 62.366 1.00 51.65 O ATOM 1078 H GLY A 135 28.930 1.377 64.416 1.00 0.00 H ATOM 1079 N THR A 136 25.740 1.909 64.584 1.00 42.49 N ATOM 1080 CA THR A 136 24.531 2.633 64.982 1.00 42.55 C ATOM 1081 C THR A 136 24.794 4.122 64.788 1.00 50.39 C ATOM 1082 O THR A 136 25.874 4.606 65.141 1.00 50.71 O ATOM 1083 CB THR A 136 24.127 2.313 66.436 1.00 50.91 C ATOM 1084 OG1 THR A 136 23.792 0.931 66.590 1.00 53.08 O ATOM 1085 CG2 THR A 136 22.967 3.157 66.927 1.00 47.26 C ATOM 1086 HG1 THR A 136 24.575 0.374 66.350 1.00 0.00 H ATOM 1087 H THR A 136 26.337 1.472 65.314 1.00 0.00 H ATOM 1088 N LEU A 137 23.827 4.841 64.198 1.00 49.23 N ATOM 1089 CA LEU A 137 23.956 6.280 63.981 1.00 49.00 C ATOM 1090 C LEU A 137 23.555 7.017 65.224 1.00 52.96 C ATOM 1091 O LEU A 137 22.441 6.826 65.731 1.00 52.35 O ATOM 1092 CB LEU A 137 23.143 6.767 62.786 1.00 48.88 C ATOM 1093 CG LEU A 137 23.862 6.665 61.459 1.00 54.39 C ATOM 1094 CD1 LEU A 137 22.957 7.043 60.349 1.00 55.13 C ATOM 1095 CD2 LEU A 137 25.126 7.527 61.432 1.00 58.47 C ATOM 1096 H LEU A 137 22.960 4.360 63.886 1.00 0.00 H ATOM 1097 N CYS A 138 24.493 7.817 65.754 1.00 49.37 N ATOM 1098 CA CYS A 138 24.256 8.586 66.966 1.00 48.73 C ATOM 1099 C CYS A 138 24.443 10.042 66.681 1.00 52.00 C ATOM 1100 O CYS A 138 25.231 10.415 65.803 1.00 50.92 O ATOM 1101 CB CYS A 138 25.141 8.123 68.114 1.00 48.81 C ATOM 1102 SG CYS A 138 24.909 6.388 68.561 1.00 52.49 S ATOM 1103 H CYS A 138 25.418 7.890 65.284 1.00 0.00 H ATOM 1104 N ASP A 139 23.660 10.864 67.394 1.00 47.86 N ATOM 1105 CA ASP A 139 23.644 12.305 67.234 1.00 47.25 C ATOM 1106 C ASP A 139 24.490 12.982 68.314 1.00 51.81 C ATOM 1107 O ASP A 139 24.237 12.785 69.504 1.00 54.33 O ATOM 1108 CB ASP A 139 22.184 12.797 67.269 1.00 48.19 C ATOM 1109 CG ASP A 139 22.028 14.279 67.074 1.00 57.64 C ATOM 1110 OD1 ASP A 139 22.041 14.727 65.906 1.00 55.72 O ATOM 1111 OD2 ASP A 139 21.920 15.000 68.093 1.00 69.07 O ATOM 1112 H ASP A 139 23.027 10.443 68.104 1.00 0.00 H ATOM 1113 N VAL A 140 25.499 13.757 67.902 1.00 45.49 N ATOM 1114 CA VAL A 140 26.316 14.538 68.828 1.00 45.29 C ATOM 1115 C VAL A 140 26.124 16.022 68.485 1.00 51.27 C ATOM 1116 O VAL A 140 26.233 16.401 67.312 1.00 50.03 O ATOM 1117 CB VAL A 140 27.807 14.121 68.928 1.00 47.90 C ATOM 1118 CG1 VAL A 140 28.416 13.830 67.562 1.00 47.60 C ATOM 1119 CG2 VAL A 140 28.629 15.157 69.692 1.00 47.12 C ATOM 1120 H VAL A 140 25.710 13.806 66.885 1.00 0.00 H ATOM 1121 N ALA A 141 25.789 16.842 69.509 1.00 49.68 N ATOM 1122 CA ALA A 141 25.535 18.279 69.340 1.00 50.16 C ATOM 1123 C ALA A 141 26.395 19.111 70.272 1.00 55.08 C ATOM 1124 O ALA A 141 26.796 18.636 71.340 1.00 55.39 O ATOM 1125 CB ALA A 141 24.061 18.597 69.586 1.00 50.60 C ATOM 1126 H ALA A 141 25.707 16.434 70.462 1.00 0.00 H ATOM 1127 N GLY A 142 26.618 20.362 69.890 1.00 50.86 N ATOM 1128 CA GLY A 142 27.391 21.282 70.705 1.00 50.55 C ATOM 1129 C GLY A 142 27.818 22.537 69.985 1.00 52.71 C ATOM 1130 O GLY A 142 27.737 22.626 68.750 1.00 52.73 O ATOM 1131 H GLY A 142 26.229 20.692 68.984 1.00 0.00 H ATOM 1132 N TRP A 143 28.375 23.472 70.779 1.00 45.65 N ATOM 1133 CA TRP A 143 28.865 24.766 70.336 1.00 42.94 C ATOM 1134 C TRP A 143 30.408 24.773 70.195 1.00 45.04 C ATOM 1135 O TRP A 143 31.030 25.844 70.239 1.00 45.97 O ATOM 1136 CB TRP A 143 28.401 25.843 71.310 1.00 40.54 C ATOM 1137 CG TRP A 143 26.933 26.127 71.271 1.00 40.85 C ATOM 1138 CD1 TRP A 143 26.287 27.001 70.438 1.00 44.06 C ATOM 1139 CD2 TRP A 143 25.935 25.603 72.159 1.00 39.87 C ATOM 1140 NE1 TRP A 143 24.945 27.044 70.745 1.00 43.58 N ATOM 1141 CE2 TRP A 143 24.699 26.188 71.794 1.00 44.11 C ATOM 1142 CE3 TRP A 143 25.959 24.685 73.218 1.00 39.74 C ATOM 1143 CZ2 TRP A 143 23.504 25.879 72.456 1.00 41.86 C ATOM 1144 CZ3 TRP A 143 24.778 24.382 73.861 1.00 40.05 C ATOM 1145 CH2 TRP A 143 23.571 24.972 73.480 1.00 40.45 C ATOM 1146 HE1 TRP A 143 24.233 27.629 70.262 1.00 0.00 H ATOM 1147 H TRP A 143 28.461 23.249 71.791 1.00 0.00 H ATOM 1148 N GLY A 144 30.992 23.588 69.999 1.00 38.61 N ATOM 1149 CA GLY A 144 32.425 23.415 69.792 1.00 38.24 C ATOM 1150 C GLY A 144 32.866 23.923 68.432 1.00 42.10 C ATOM 1151 O GLY A 144 32.015 24.158 67.557 1.00 40.68 O ATOM 1152 H GLY A 144 30.390 22.740 69.994 1.00 0.00 H ATOM 1153 N ILE A 145 34.208 24.048 68.225 1.00 38.95 N ATOM 1154 CA ILE A 145 34.787 24.611 66.991 1.00 39.16 C ATOM 1155 C ILE A 145 34.267 23.869 65.748 1.00 44.45 C ATOM 1156 O ILE A 145 34.064 22.650 65.784 1.00 43.49 O ATOM 1157 CB ILE A 145 36.329 24.755 66.983 1.00 42.01 C ATOM 1158 CG1 ILE A 145 37.048 23.422 67.185 1.00 43.44 C ATOM 1159 CG2 ILE A 145 36.768 25.769 68.035 1.00 41.97 C ATOM 1160 CD1 ILE A 145 38.470 23.402 66.661 1.00 50.62 C ATOM 1161 H ILE A 145 34.855 23.731 68.975 1.00 0.00 H ATOM 1162 N VAL A 146 33.975 24.651 64.675 1.00 41.44 N ATOM 1163 CA VAL A 146 33.375 24.164 63.420 1.00 39.74 C ATOM 1164 C VAL A 146 34.396 23.984 62.296 1.00 45.32 C ATOM 1165 O VAL A 146 34.050 23.411 61.264 1.00 46.50 O ATOM 1166 CB VAL A 146 32.196 25.034 62.947 1.00 41.24 C ATOM 1167 CG1 VAL A 146 31.003 24.881 63.879 1.00 41.19 C ATOM 1168 CG2 VAL A 146 32.595 26.486 62.783 1.00 39.96 C ATOM 1169 H VAL A 146 34.191 25.666 64.745 1.00 0.00 H ATOM 1170 N ASN A 147 35.631 24.460 62.485 1.00 41.63 N ATOM 1171 CA ASN A 147 36.720 24.270 61.535 1.00 41.47 C ATOM 1172 C ASN A 147 38.073 24.249 62.271 1.00 46.07 C ATOM 1173 O ASN A 147 38.169 24.708 63.409 1.00 46.44 O ATOM 1174 CB ASN A 147 36.685 25.308 60.418 1.00 41.91 C ATOM 1175 CG ASN A 147 36.806 26.737 60.836 1.00 58.31 C ATOM 1176 OD1 ASN A 147 37.377 27.064 61.874 1.00 50.94 O ATOM 1177 ND2 ASN A 147 36.343 27.629 59.973 1.00 52.11 N ATOM 1178 HD22 ASN A 147 35.865 27.313 59.105 1.00 0.00 H ATOM 1179 HD21 ASN A 147 36.457 28.645 60.164 1.00 0.00 H ATOM 1180 H ASN A 147 35.825 24.994 63.356 1.00 0.00 H ATOM 1181 N HIS A 148 39.115 23.719 61.624 1.00 42.07 N ATOM 1182 CA HIS A 148 40.437 23.593 62.222 1.00 40.94 C ATOM 1183 C HIS A 148 41.046 24.925 62.602 1.00 45.18 C ATOM 1184 O HIS A 148 41.753 24.966 63.604 1.00 45.50 O ATOM 1185 CB HIS A 148 41.355 22.797 61.318 1.00 41.15 C ATOM 1186 CG HIS A 148 40.937 21.368 61.263 1.00 44.26 C ATOM 1187 ND1 HIS A 148 40.394 20.812 60.124 1.00 46.03 N ATOM 1188 CD2 HIS A 148 40.898 20.453 62.259 1.00 46.63 C ATOM 1189 CE1 HIS A 148 40.104 19.556 60.440 1.00 45.89 C ATOM 1190 NE2 HIS A 148 40.375 19.299 61.723 1.00 46.37 N ATOM 1191 H HIS A 148 38.976 23.381 60.650 1.00 0.00 H ATOM 1192 N ALA A 149 40.718 26.020 61.885 1.00 41.27 N ATOM 1193 CA ALA A 149 41.173 27.360 62.286 1.00 40.44 C ATOM 1194 C ALA A 149 40.690 27.668 63.710 1.00 42.04 C ATOM 1195 O ALA A 149 41.412 28.312 64.473 1.00 41.71 O ATOM 1196 CB ALA A 149 40.656 28.412 61.320 1.00 41.27 C ATOM 1197 H ALA A 149 40.132 25.914 61.032 1.00 0.00 H ATOM 1198 N GLY A 150 39.500 27.162 64.057 1.00 36.66 N ATOM 1199 CA GLY A 150 38.918 27.334 65.383 1.00 36.00 C ATOM 1200 C GLY A 150 37.693 28.218 65.496 1.00 39.66 C ATOM 1201 O GLY A 150 37.438 28.759 66.581 1.00 38.37 O ATOM 1202 H GLY A 150 38.966 26.621 63.348 1.00 0.00 H ATOM 1203 N ARG A 151 36.894 28.335 64.398 1.00 36.40 N ATOM 1204 CA ARG A 151 35.671 29.147 64.394 1.00 35.16 C ATOM 1205 C ARG A 151 34.694 28.647 65.468 1.00 37.70 C ATOM 1206 O ARG A 151 34.312 27.472 65.482 1.00 36.44 O ATOM 1207 CB ARG A 151 34.992 29.192 63.000 1.00 31.70 C ATOM 1208 CG ARG A 151 34.123 30.442 62.834 1.00 39.73 C ATOM 1209 CD ARG A 151 32.782 30.356 62.109 1.00 53.79 C ATOM 1210 NE ARG A 151 32.864 29.733 60.792 1.00 73.14 N ATOM 1211 CZ ARG A 151 31.901 28.985 60.267 1.00 98.78 C ATOM 1212 NH1 ARG A 151 30.771 28.774 60.940 1.00 90.13 N ATOM 1213 NH2 ARG A 151 32.063 28.427 59.073 1.00 88.89 N ATOM 1214 HE ARG A 151 33.727 29.884 60.232 1.00 0.00 H ATOM 1215 HH12 ARG A 151 30.020 28.187 60.524 1.00 0.00 H ATOM 1216 HH11 ARG A 151 30.640 29.196 61.881 1.00 0.00 H ATOM 1217 HH22 ARG A 151 31.306 27.842 58.665 1.00 0.00 H ATOM 1218 HH21 ARG A 151 32.947 28.575 58.545 1.00 0.00 H ATOM 1219 H ARG A 151 37.161 27.829 63.529 1.00 0.00 H ATOM 1220 N ARG A 152 34.374 29.532 66.408 1.00 34.07 N ATOM 1221 CA ARG A 152 33.414 29.261 67.469 1.00 34.42 C ATOM 1222 C ARG A 152 31.984 29.547 66.922 1.00 41.27 C ATOM 1223 O ARG A 152 31.681 30.700 66.586 1.00 41.63 O ATOM 1224 CB ARG A 152 33.706 30.143 68.709 1.00 32.58 C ATOM 1225 CG ARG A 152 34.836 29.725 69.616 1.00 38.67 C ATOM 1226 CD ARG A 152 35.152 30.841 70.616 1.00 35.36 C ATOM 1227 NE ARG A 152 35.865 30.373 71.807 1.00 37.77 N ATOM 1228 CZ ARG A 152 35.252 29.957 72.914 1.00 57.11 C ATOM 1229 NH1 ARG A 152 33.921 29.943 72.979 1.00 46.63 N ATOM 1230 NH2 ARG A 152 35.966 29.522 73.956 1.00 34.91 N ATOM 1231 HE ARG A 152 36.905 30.365 71.787 1.00 0.00 H ATOM 1232 HH12 ARG A 152 33.446 29.618 73.845 1.00 0.00 H ATOM 1233 HH11 ARG A 152 33.357 30.258 72.164 1.00 0.00 H ATOM 1234 HH22 ARG A 152 35.483 29.198 74.818 1.00 0.00 H ATOM 1235 HH21 ARG A 152 37.005 29.507 73.905 1.00 0.00 H ATOM 1236 H ARG A 152 34.833 30.465 66.384 1.00 0.00 H ATOM 1237 N PRO A 153 31.091 28.543 66.775 1.00 39.24 N ATOM 1238 CA PRO A 153 29.728 28.843 66.277 1.00 38.73 C ATOM 1239 C PRO A 153 28.848 29.501 67.329 1.00 40.42 C ATOM 1240 O PRO A 153 28.962 29.142 68.509 1.00 41.23 O ATOM 1241 CB PRO A 153 29.162 27.467 65.938 1.00 40.78 C ATOM 1242 CG PRO A 153 29.846 26.549 66.873 1.00 46.29 C ATOM 1243 CD PRO A 153 31.250 27.106 67.064 1.00 41.67 C ATOM 1244 N ASP A 154 27.979 30.443 66.908 1.00 33.46 N ATOM 1245 CA ASP A 154 27.040 31.111 67.787 1.00 32.77 C ATOM 1246 C ASP A 154 25.836 30.182 68.051 1.00 39.85 C ATOM 1247 O ASP A 154 25.348 30.104 69.188 1.00 39.83 O ATOM 1248 CB ASP A 154 26.593 32.477 67.196 1.00 33.62 C ATOM 1249 CG ASP A 154 25.389 33.130 67.895 1.00 40.49 C ATOM 1250 OD1 ASP A 154 25.551 33.617 69.033 1.00 38.67 O ATOM 1251 OD2 ASP A 154 24.279 33.110 67.317 1.00 48.86 O ATOM 1252 H ASP A 154 27.983 30.703 65.901 1.00 0.00 H ATOM 1253 N SER A 155 25.361 29.492 67.007 1.00 38.49 N ATOM 1254 CA SER A 155 24.213 28.601 67.137 1.00 40.57 C ATOM 1255 C SER A 155 24.643 27.156 67.284 1.00 46.28 C ATOM 1256 O SER A 155 25.736 26.784 66.825 1.00 46.85 O ATOM 1257 CB SER A 155 23.282 28.743 65.941 1.00 47.56 C ATOM 1258 OG SER A 155 24.024 28.544 64.750 1.00 65.40 O ATOM 1259 HG SER A 155 23.423 28.635 63.969 1.00 0.00 H ATOM 1260 H SER A 155 25.822 29.594 66.080 1.00 0.00 H ATOM 1261 N LEU A 156 23.770 26.337 67.922 1.00 41.80 N ATOM 1262 CA LEU A 156 24.000 24.913 68.144 1.00 40.36 C ATOM 1263 C LEU A 156 24.153 24.173 66.829 1.00 40.53 C ATOM 1264 O LEU A 156 23.356 24.362 65.916 1.00 39.39 O ATOM 1265 CB LEU A 156 22.859 24.297 68.968 1.00 40.56 C ATOM 1266 CG LEU A 156 23.067 22.860 69.451 1.00 45.54 C ATOM 1267 CD1 LEU A 156 24.100 22.782 70.541 1.00 46.73 C ATOM 1268 CD2 LEU A 156 21.820 22.308 69.991 1.00 45.25 C ATOM 1269 H LEU A 156 22.883 26.749 68.275 1.00 0.00 H ATOM 1270 N GLN A 157 25.214 23.372 66.748 1.00 35.87 N ATOM 1271 CA GLN A 157 25.579 22.503 65.636 1.00 34.79 C ATOM 1272 C GLN A 157 25.340 21.075 66.076 1.00 40.35 C ATOM 1273 O GLN A 157 25.196 20.812 67.266 1.00 39.41 O ATOM 1274 CB GLN A 157 27.052 22.704 65.228 1.00 35.45 C ATOM 1275 CG GLN A 157 27.458 24.135 64.904 1.00 39.91 C ATOM 1276 CD GLN A 157 26.648 24.731 63.791 1.00 59.00 C ATOM 1277 OE1 GLN A 157 26.791 24.375 62.622 1.00 56.58 O ATOM 1278 NE2 GLN A 157 25.782 25.663 64.132 1.00 58.04 N ATOM 1279 HE22 GLN A 157 25.684 25.942 65.129 1.00 0.00 H ATOM 1280 HE21 GLN A 157 25.196 26.120 63.404 1.00 0.00 H ATOM 1281 H GLN A 157 25.853 23.366 67.569 1.00 0.00 H ATOM 1282 N HIS A 158 25.290 20.153 65.132 1.00 39.72 N ATOM 1283 CA HIS A 158 25.109 18.730 65.391 1.00 40.38 C ATOM 1284 C HIS A 158 25.610 17.922 64.173 1.00 45.18 C ATOM 1285 O HIS A 158 25.741 18.460 63.065 1.00 42.95 O ATOM 1286 CB HIS A 158 23.631 18.405 65.724 1.00 41.15 C ATOM 1287 CG HIS A 158 22.778 18.170 64.524 1.00 44.51 C ATOM 1288 ND1 HIS A 158 22.299 16.913 64.226 1.00 46.46 N ATOM 1289 CD2 HIS A 158 22.413 19.024 63.538 1.00 46.09 C ATOM 1290 CE1 HIS A 158 21.614 17.048 63.097 1.00 45.81 C ATOM 1291 NE2 HIS A 158 21.664 18.297 62.639 1.00 45.95 N ATOM 1292 H HIS A 158 25.386 20.461 64.143 1.00 0.00 H ATOM 1293 N VAL A 159 25.882 16.633 64.386 1.00 43.65 N ATOM 1294 CA VAL A 159 26.358 15.725 63.347 1.00 44.15 C ATOM 1295 C VAL A 159 25.888 14.300 63.724 1.00 51.36 C ATOM 1296 O VAL A 159 25.728 13.993 64.910 1.00 51.48 O ATOM 1297 CB VAL A 159 27.910 15.864 63.128 1.00 47.71 C ATOM 1298 CG1 VAL A 159 28.733 15.370 64.311 1.00 47.72 C ATOM 1299 CG2 VAL A 159 28.371 15.217 61.844 1.00 47.60 C ATOM 1300 H VAL A 159 25.747 16.254 65.345 1.00 0.00 H ATOM 1301 N LEU A 160 25.587 13.474 62.713 1.00 49.44 N ATOM 1302 CA LEU A 160 25.183 12.069 62.885 1.00 48.63 C ATOM 1303 C LEU A 160 26.372 11.198 62.545 1.00 50.89 C ATOM 1304 O LEU A 160 26.871 11.233 61.411 1.00 50.01 O ATOM 1305 CB LEU A 160 23.962 11.704 62.025 1.00 48.11 C ATOM 1306 CG LEU A 160 22.772 11.173 62.773 1.00 51.80 C ATOM 1307 CD1 LEU A 160 22.001 12.282 63.450 1.00 51.43 C ATOM 1308 CD2 LEU A 160 21.898 10.404 61.852 1.00 55.32 C ATOM 1309 H LEU A 160 25.642 13.849 61.745 1.00 0.00 H ATOM 1310 N LEU A 161 26.878 10.487 63.550 1.00 45.82 N ATOM 1311 CA LEU A 161 28.064 9.657 63.371 1.00 43.66 C ATOM 1312 C LEU A 161 27.775 8.217 63.726 1.00 46.40 C ATOM 1313 O LEU A 161 27.056 7.956 64.706 1.00 45.51 O ATOM 1314 CB LEU A 161 29.249 10.174 64.220 1.00 42.61 C ATOM 1315 CG LEU A 161 29.607 11.636 64.108 1.00 45.62 C ATOM 1316 CD1 LEU A 161 30.554 12.032 65.210 1.00 46.24 C ATOM 1317 CD2 LEU A 161 30.216 11.934 62.776 1.00 45.19 C ATOM 1318 H LEU A 161 26.418 10.524 64.482 1.00 0.00 H ATOM 1319 N PRO A 162 28.330 7.266 62.936 1.00 41.80 N ATOM 1320 CA PRO A 162 28.163 5.851 63.286 1.00 41.32 C ATOM 1321 C PRO A 162 29.177 5.411 64.354 1.00 46.75 C ATOM 1322 O PRO A 162 30.355 5.807 64.330 1.00 46.81 O ATOM 1323 CB PRO A 162 28.411 5.146 61.972 1.00 42.67 C ATOM 1324 CG PRO A 162 29.353 6.051 61.214 1.00 46.00 C ATOM 1325 CD PRO A 162 29.211 7.434 61.758 1.00 42.00 C ATOM 1326 N VAL A 163 28.697 4.609 65.313 1.00 43.62 N ATOM 1327 CA VAL A 163 29.492 4.039 66.399 1.00 43.53 C ATOM 1328 C VAL A 163 30.554 3.102 65.805 1.00 48.53 C ATOM 1329 O VAL A 163 30.249 2.293 64.941 1.00 49.48 O ATOM 1330 CB VAL A 163 28.576 3.320 67.412 1.00 47.29 C ATOM 1331 CG1 VAL A 163 29.384 2.588 68.471 1.00 47.98 C ATOM 1332 CG2 VAL A 163 27.627 4.305 68.067 1.00 46.64 C ATOM 1333 H VAL A 163 27.684 4.375 65.283 1.00 0.00 H ATOM 1334 N LEU A 164 31.792 3.249 66.224 1.00 45.20 N ATOM 1335 CA LEU A 164 32.889 2.432 65.723 1.00 45.63 C ATOM 1336 C LEU A 164 33.196 1.262 66.671 1.00 49.44 C ATOM 1337 O LEU A 164 33.091 1.407 67.897 1.00 50.06 O ATOM 1338 CB LEU A 164 34.099 3.340 65.591 1.00 46.31 C ATOM 1339 CG LEU A 164 35.214 2.865 64.717 1.00 52.60 C ATOM 1340 CD1 LEU A 164 35.069 3.408 63.324 1.00 53.22 C ATOM 1341 CD2 LEU A 164 36.517 3.332 65.267 1.00 57.78 C ATOM 1342 H LEU A 164 31.995 3.976 66.940 1.00 0.00 H ATOM 1343 N ASP A 165 33.556 0.101 66.096 1.00 45.03 N ATOM 1344 CA ASP A 165 33.928 -1.133 66.798 1.00 44.64 C ATOM 1345 C ASP A 165 35.156 -0.851 67.686 1.00 45.25 C ATOM 1346 O ASP A 165 36.158 -0.321 67.191 1.00 44.37 O ATOM 1347 CB ASP A 165 34.193 -2.240 65.753 1.00 47.79 C ATOM 1348 CG ASP A 165 35.160 -3.347 66.147 1.00 71.62 C ATOM 1349 OD1 ASP A 165 34.897 -4.042 67.163 1.00 74.99 O ATOM 1350 OD2 ASP A 165 36.152 -3.552 65.416 1.00 80.33 O ATOM 1351 H ASP A 165 33.572 0.075 65.056 1.00 0.00 H ATOM 1352 N ARG A 166 35.065 -1.165 69.005 1.00 39.66 N ATOM 1353 CA ARG A 166 36.156 -0.847 69.946 1.00 38.36 C ATOM 1354 C ARG A 166 37.491 -1.428 69.497 1.00 43.03 C ATOM 1355 O ARG A 166 38.517 -0.771 69.650 1.00 42.60 O ATOM 1356 CB ARG A 166 35.833 -1.313 71.365 1.00 34.21 C ATOM 1357 CG ARG A 166 36.654 -0.607 72.424 1.00 35.33 C ATOM 1358 CD ARG A 166 36.344 -1.070 73.840 1.00 44.23 C ATOM 1359 NE ARG A 166 35.156 -0.417 74.393 1.00 45.38 N ATOM 1360 CZ ARG A 166 33.923 -0.913 74.325 1.00 55.59 C ATOM 1361 NH1 ARG A 166 33.706 -2.090 73.762 1.00 48.82 N ATOM 1362 NH2 ARG A 166 32.904 -0.248 74.852 1.00 42.16 N ATOM 1363 HE ARG A 166 35.285 0.497 74.872 1.00 0.00 H ATOM 1364 HH12 ARG A 166 32.740 -2.472 73.712 1.00 0.00 H ATOM 1365 HH11 ARG A 166 34.501 -2.633 73.369 1.00 0.00 H ATOM 1366 HH22 ARG A 166 31.942 -0.640 74.796 1.00 0.00 H ATOM 1367 HH21 ARG A 166 33.066 0.666 75.321 1.00 0.00 H ATOM 1368 H ARG A 166 34.209 -1.639 69.358 1.00 0.00 H ATOM 1369 N ALA A 167 37.475 -2.653 68.949 1.00 40.35 N ATOM 1370 CA ALA A 167 38.657 -3.355 68.496 1.00 40.16 C ATOM 1371 C ALA A 167 39.424 -2.528 67.469 1.00 47.57 C ATOM 1372 O ALA A 167 40.645 -2.423 67.578 1.00 49.34 O ATOM 1373 CB ALA A 167 38.261 -4.699 67.927 1.00 40.78 C ATOM 1374 H ALA A 167 36.556 -3.128 68.843 1.00 0.00 H ATOM 1375 N THR A 168 38.712 -1.897 66.513 1.00 45.21 N ATOM 1376 CA THR A 168 39.267 -1.039 65.455 1.00 45.17 C ATOM 1377 C THR A 168 39.826 0.245 66.044 1.00 50.28 C ATOM 1378 O THR A 168 40.850 0.752 65.618 1.00 50.13 O ATOM 1379 CB THR A 168 38.151 -0.686 64.467 1.00 44.74 C ATOM 1380 OG1 THR A 168 37.628 -1.881 63.912 1.00 40.26 O ATOM 1381 CG2 THR A 168 38.611 0.276 63.375 1.00 41.86 C ATOM 1382 HG1 THR A 168 37.265 -2.449 64.637 1.00 0.00 H ATOM 1383 H THR A 168 37.680 -2.029 66.525 1.00 0.00 H ATOM 1384 N CYS A 169 39.084 0.792 66.984 1.00 47.57 N ATOM 1385 CA CYS A 169 39.381 2.010 67.691 1.00 47.42 C ATOM 1386 C CYS A 169 40.667 1.893 68.519 1.00 40.29 C ATOM 1387 O CYS A 169 41.411 2.872 68.615 1.00 34.86 O ATOM 1388 CB CYS A 169 38.189 2.377 68.564 1.00 50.66 C ATOM 1389 SG CYS A 169 37.914 4.147 68.654 1.00 56.58 S ATOM 1390 H CYS A 169 38.204 0.300 67.239 1.00 0.00 H ATOM 1391 N ASN A 170 40.918 0.679 69.101 1.00 34.83 N ATOM 1392 CA ASN A 170 42.085 0.358 69.930 1.00 33.49 C ATOM 1393 C ASN A 170 43.361 -0.009 69.128 1.00 37.34 C ATOM 1394 O ASN A 170 44.430 -0.163 69.713 1.00 35.69 O ATOM 1395 CB ASN A 170 41.751 -0.747 70.889 1.00 25.86 C ATOM 1396 CG ASN A 170 41.037 -0.266 72.107 1.00 54.02 C ATOM 1397 OD1 ASN A 170 41.409 0.732 72.731 1.00 48.33 O ATOM 1398 ND2 ASN A 170 39.997 -0.988 72.487 1.00 52.39 N ATOM 1399 HD22 ASN A 170 39.714 -1.823 71.935 1.00 0.00 H ATOM 1400 HD21 ASN A 170 39.462 -0.721 73.338 1.00 0.00 H ATOM 1401 H ASN A 170 40.223 -0.079 68.942 1.00 0.00 H ATOM 1402 N ARG A 171 43.270 -0.092 67.807 1.00 35.11 N ATOM 1403 CA ARG A 171 44.433 -0.367 66.960 1.00 35.68 C ATOM 1404 C ARG A 171 45.555 0.621 67.256 1.00 39.88 C ATOM 1405 O ARG A 171 45.281 1.754 67.645 1.00 40.62 O ATOM 1406 CB ARG A 171 44.061 -0.277 65.477 1.00 36.27 C ATOM 1407 CG ARG A 171 43.121 -1.352 65.034 1.00 44.02 C ATOM 1408 CD ARG A 171 43.009 -1.295 63.541 1.00 56.53 C ATOM 1409 NE ARG A 171 41.805 -2.005 63.115 1.00 69.04 N ATOM 1410 CZ ARG A 171 41.293 -1.942 61.895 1.00 75.36 C ATOM 1411 NH1 ARG A 171 41.899 -1.231 60.949 1.00 46.64 N ATOM 1412 NH2 ARG A 171 40.162 -2.573 61.614 1.00 68.18 N ATOM 1413 HE ARG A 171 41.318 -2.599 63.816 1.00 0.00 H ATOM 1414 HH12 ARG A 171 41.493 -1.185 59.993 1.00 0.00 H ATOM 1415 HH11 ARG A 171 42.779 -0.721 61.165 1.00 0.00 H ATOM 1416 HH22 ARG A 171 39.762 -2.522 60.655 1.00 0.00 H ATOM 1417 HH21 ARG A 171 39.674 -3.119 62.352 1.00 0.00 H ATOM 1418 H ARG A 171 42.342 0.043 67.358 1.00 0.00 H ATOM 1419 N ARG A 172 46.805 0.202 67.072 1.00 34.24 N ATOM 1420 CA ARG A 172 47.970 1.041 67.332 1.00 32.27 C ATOM 1421 C ARG A 172 47.933 2.306 66.491 1.00 39.10 C ATOM 1422 O ARG A 172 48.359 3.365 66.968 1.00 40.27 O ATOM 1423 CB ARG A 172 49.241 0.247 67.048 1.00 28.10 C ATOM 1424 CG ARG A 172 50.413 0.672 67.846 1.00 29.61 C ATOM 1425 CD ARG A 172 51.533 -0.279 67.620 1.00 25.27 C ATOM 1426 NE ARG A 172 52.819 0.314 67.982 1.00 33.74 N ATOM 1427 CZ ARG A 172 53.899 -0.392 68.294 1.00 45.07 C ATOM 1428 NH1 ARG A 172 53.846 -1.713 68.336 1.00 33.11 N ATOM 1429 NH2 ARG A 172 55.032 0.218 68.591 1.00 32.43 N ATOM 1430 HE ARG A 172 52.892 1.351 67.996 1.00 0.00 H ATOM 1431 HH12 ARG A 172 54.696 -2.260 68.581 1.00 0.00 H ATOM 1432 HH11 ARG A 172 52.954 -2.205 68.124 1.00 0.00 H ATOM 1433 HH22 ARG A 172 55.875 -0.340 68.835 1.00 0.00 H ATOM 1434 HH21 ARG A 172 55.081 1.257 68.581 1.00 0.00 H ATOM 1435 H ARG A 172 46.958 -0.767 66.727 1.00 0.00 H ATOM 1436 N THR A 173 47.391 2.210 65.254 1.00 37.86 N ATOM 1437 CA THR A 173 47.266 3.349 64.322 1.00 38.23 C ATOM 1438 C THR A 173 46.203 4.298 64.814 1.00 44.51 C ATOM 1439 O THR A 173 46.233 5.477 64.488 1.00 45.01 O ATOM 1440 CB THR A 173 46.971 2.902 62.895 1.00 39.28 C ATOM 1441 OG1 THR A 173 45.903 1.965 62.901 1.00 50.63 O ATOM 1442 CG2 THR A 173 48.149 2.294 62.253 1.00 35.45 C ATOM 1443 HG1 THR A 173 45.096 2.389 63.287 1.00 0.00 H ATOM 1444 H THR A 173 47.043 1.281 64.942 1.00 0.00 H ATOM 1445 N HIS A 174 45.280 3.780 65.618 1.00 42.29 N ATOM 1446 CA HIS A 174 44.168 4.519 66.177 1.00 42.44 C ATOM 1447 C HIS A 174 44.480 4.923 67.634 1.00 43.16 C ATOM 1448 O HIS A 174 45.492 5.570 67.840 1.00 43.02 O ATOM 1449 CB HIS A 174 42.894 3.684 66.028 1.00 43.82 C ATOM 1450 CG HIS A 174 42.500 3.465 64.601 1.00 47.88 C ATOM 1451 ND1 HIS A 174 43.388 2.949 63.671 1.00 50.16 N ATOM 1452 CD2 HIS A 174 41.324 3.710 63.988 1.00 50.43 C ATOM 1453 CE1 HIS A 174 42.729 2.914 62.527 1.00 50.05 C ATOM 1454 NE2 HIS A 174 41.478 3.343 62.672 1.00 50.45 N ATOM 1455 H HIS A 174 45.363 2.773 65.863 1.00 0.00 H ATOM 1456 N HIS A 175 43.679 4.525 68.628 1.00 37.55 N ATOM 1457 CA HIS A 175 43.922 4.964 70.001 1.00 36.71 C ATOM 1458 C HIS A 175 44.772 3.999 70.857 1.00 39.89 C ATOM 1459 O HIS A 175 44.914 4.211 72.063 1.00 38.02 O ATOM 1460 CB HIS A 175 42.605 5.291 70.700 1.00 36.91 C ATOM 1461 CG HIS A 175 42.013 6.544 70.155 1.00 39.55 C ATOM 1462 ND1 HIS A 175 42.802 7.642 69.893 1.00 40.85 N ATOM 1463 CD2 HIS A 175 40.745 6.810 69.762 1.00 41.50 C ATOM 1464 CE1 HIS A 175 41.990 8.552 69.380 1.00 40.86 C ATOM 1465 NE2 HIS A 175 40.745 8.098 69.283 1.00 41.32 N ATOM 1466 H HIS A 175 42.876 3.897 68.422 1.00 0.00 H ATOM 1467 N ASP A 176 45.449 3.058 70.202 1.00 37.77 N ATOM 1468 CA ASP A 176 46.398 2.096 70.770 1.00 37.23 C ATOM 1469 C ASP A 176 46.027 1.603 72.188 1.00 41.92 C ATOM 1470 O ASP A 176 46.789 1.840 73.146 1.00 43.72 O ATOM 1471 CB ASP A 176 47.809 2.696 70.768 1.00 37.84 C ATOM 1472 CG ASP A 176 48.933 1.698 70.961 1.00 43.08 C ATOM 1473 OD1 ASP A 176 48.651 0.487 70.995 1.00 44.32 O ATOM 1474 OD2 ASP A 176 50.103 2.130 71.047 1.00 48.54 O ATOM 1475 H ASP A 176 45.287 2.999 69.176 1.00 0.00 H ATOM 1476 N GLY A 177 44.859 0.955 72.301 1.00 34.16 N ATOM 1477 CA GLY A 177 44.420 0.329 73.540 1.00 32.49 C ATOM 1478 C GLY A 177 43.799 1.202 74.594 1.00 36.46 C ATOM 1479 O GLY A 177 43.202 0.675 75.535 1.00 37.00 O ATOM 1480 H GLY A 177 44.240 0.897 71.468 1.00 0.00 H ATOM 1481 N ALA A 178 43.869 2.525 74.419 1.00 33.54 N ATOM 1482 CA ALA A 178 43.309 3.505 75.352 1.00 33.47 C ATOM 1483 C ALA A 178 41.788 3.354 75.564 1.00 39.17 C ATOM 1484 O ALA A 178 41.300 3.801 76.606 1.00 40.74 O ATOM 1485 CB ALA A 178 43.619 4.922 74.884 1.00 33.64 C ATOM 1486 H ALA A 178 44.351 2.880 73.568 1.00 0.00 H ATOM 1487 N ILE A 179 41.050 2.756 74.603 1.00 34.40 N ATOM 1488 CA ILE A 179 39.600 2.669 74.716 1.00 35.17 C ATOM 1489 C ILE A 179 39.214 1.443 75.564 1.00 42.55 C ATOM 1490 O ILE A 179 39.229 0.294 75.086 1.00 43.67 O ATOM 1491 CB ILE A 179 38.845 2.700 73.342 1.00 37.67 C ATOM 1492 CG1 ILE A 179 39.418 3.760 72.373 1.00 37.28 C ATOM 1493 CG2 ILE A 179 37.312 2.853 73.528 1.00 37.52 C ATOM 1494 CD1 ILE A 179 39.474 5.242 72.846 1.00 40.28 C ATOM 1495 H ILE A 179 41.524 2.352 73.770 1.00 0.00 H ATOM 1496 N THR A 180 38.804 1.730 76.816 1.00 37.33 N ATOM 1497 CA THR A 180 38.389 0.754 77.804 1.00 36.86 C ATOM 1498 C THR A 180 36.949 0.345 77.526 1.00 44.66 C ATOM 1499 O THR A 180 36.339 0.865 76.599 1.00 44.82 O ATOM 1500 CB THR A 180 38.588 1.324 79.215 1.00 40.95 C ATOM 1501 OG1 THR A 180 37.474 2.125 79.614 1.00 44.52 O ATOM 1502 CG2 THR A 180 39.885 2.094 79.361 1.00 37.10 C ATOM 1503 HG1 THR A 180 37.632 2.477 80.526 1.00 0.00 H ATOM 1504 H THR A 180 38.784 2.732 77.095 1.00 0.00 H ATOM 1505 N GLU A 181 36.401 -0.583 78.326 1.00 43.91 N ATOM 1506 CA GLU A 181 35.020 -1.046 78.211 1.00 44.66 C ATOM 1507 C GLU A 181 34.021 0.046 78.661 1.00 49.59 C ATOM 1508 O GLU A 181 32.808 -0.070 78.415 1.00 51.24 O ATOM 1509 CB GLU A 181 34.823 -2.291 79.078 1.00 46.30 C ATOM 1510 CG GLU A 181 35.637 -3.509 78.692 1.00 58.89 C ATOM 1511 CD GLU A 181 35.015 -4.807 79.189 1.00 96.30 C ATOM 1512 OE1 GLU A 181 34.561 -4.853 80.361 1.00 86.26 O ATOM 1513 OE2 GLU A 181 34.953 -5.771 78.389 1.00 97.39 O ATOM 1514 H GLU A 181 36.995 -0.997 79.072 1.00 0.00 H ATOM 1515 N ARG A 182 34.540 1.068 79.367 1.00 43.50 N ATOM 1516 CA ARG A 182 33.770 2.180 79.919 1.00 42.82 C ATOM 1517 C ARG A 182 33.720 3.363 78.922 1.00 46.35 C ATOM 1518 O ARG A 182 32.998 4.347 79.145 1.00 46.39 O ATOM 1519 CB ARG A 182 34.352 2.605 81.286 1.00 42.63 C ATOM 1520 CG ARG A 182 34.519 1.434 82.272 1.00 47.43 C ATOM 1521 CD ARG A 182 34.810 1.833 83.699 1.00 39.96 C ATOM 1522 NE ARG A 182 33.597 2.129 84.452 1.00 39.78 N ATOM 1523 CZ ARG A 182 33.611 2.563 85.706 1.00 67.23 C ATOM 1524 NH1 ARG A 182 34.765 2.753 86.338 1.00 59.83 N ATOM 1525 NH2 ARG A 182 32.474 2.812 86.340 1.00 60.24 N ATOM 1526 HE ARG A 182 32.678 1.994 83.985 1.00 0.00 H ATOM 1527 HH12 ARG A 182 34.770 3.093 87.321 1.00 0.00 H ATOM 1528 HH11 ARG A 182 35.663 2.561 85.850 1.00 0.00 H ATOM 1529 HH22 ARG A 182 32.490 3.152 87.323 1.00 0.00 H ATOM 1530 HH21 ARG A 182 31.566 2.667 85.855 1.00 0.00 H ATOM 1531 H ARG A 182 35.567 1.066 79.532 1.00 0.00 H ATOM 1532 N LEU A 183 34.462 3.243 77.813 1.00 41.38 N ATOM 1533 CA LEU A 183 34.499 4.245 76.748 1.00 40.55 C ATOM 1534 C LEU A 183 33.909 3.666 75.451 1.00 45.53 C ATOM 1535 O LEU A 183 33.783 2.443 75.316 1.00 46.08 O ATOM 1536 CB LEU A 183 35.948 4.717 76.504 1.00 39.79 C ATOM 1537 CG LEU A 183 36.596 5.593 77.543 1.00 41.13 C ATOM 1538 CD1 LEU A 183 38.068 5.527 77.417 1.00 39.15 C ATOM 1539 CD2 LEU A 183 36.152 7.024 77.375 1.00 43.53 C ATOM 1540 H LEU A 183 35.045 2.389 77.703 1.00 0.00 H ATOM 1541 N MET A 184 33.536 4.546 74.515 1.00 41.08 N ATOM 1542 CA MET A 184 33.000 4.163 73.213 1.00 40.51 C ATOM 1543 C MET A 184 33.538 5.103 72.115 1.00 48.64 C ATOM 1544 O MET A 184 33.992 6.223 72.389 1.00 48.92 O ATOM 1545 CB MET A 184 31.468 4.091 73.215 1.00 41.65 C ATOM 1546 CG MET A 184 30.772 5.426 73.314 1.00 43.63 C ATOM 1547 SD MET A 184 28.976 5.303 73.166 1.00 46.04 S ATOM 1548 CE MET A 184 28.821 5.020 71.438 1.00 41.90 C ATOM 1549 H MET A 184 33.633 5.559 74.727 1.00 0.00 H ATOM 1550 N CYS A 185 33.492 4.613 70.885 1.00 47.37 N ATOM 1551 CA CYS A 185 33.995 5.323 69.741 1.00 48.93 C ATOM 1552 C CYS A 185 32.954 5.541 68.710 1.00 53.79 C ATOM 1553 O CYS A 185 32.013 4.745 68.586 1.00 54.50 O ATOM 1554 CB CYS A 185 35.133 4.534 69.146 1.00 51.19 C ATOM 1555 SG CYS A 185 36.604 4.508 70.165 1.00 56.69 S ATOM 1556 H CYS A 185 33.073 3.672 70.741 1.00 0.00 H ATOM 1557 N ALA A 186 33.187 6.575 67.894 1.00 49.19 N ATOM 1558 CA ALA A 186 32.378 6.957 66.748 1.00 48.11 C ATOM 1559 C ALA A 186 33.326 7.362 65.637 1.00 51.05 C ATOM 1560 O ALA A 186 34.465 7.743 65.926 1.00 50.10 O ATOM 1561 CB ALA A 186 31.433 8.089 67.116 1.00 48.46 C ATOM 1562 H ALA A 186 34.023 7.159 68.098 1.00 0.00 H ATOM 1563 N GLU A 187 32.886 7.248 64.379 1.00 47.73 N ATOM 1564 CA GLU A 187 33.708 7.583 63.219 1.00 48.46 C ATOM 1565 C GLU A 187 34.078 9.066 63.217 1.00 53.81 C ATOM 1566 O GLU A 187 33.282 9.893 63.673 1.00 55.49 O ATOM 1567 CB GLU A 187 32.971 7.208 61.933 1.00 50.57 C ATOM 1568 CG GLU A 187 33.559 5.990 61.235 1.00 67.61 C ATOM 1569 CD GLU A 187 32.640 5.275 60.260 1.00 81.06 C ATOM 1570 OE1 GLU A 187 32.189 5.931 59.291 1.00 73.15 O ATOM 1571 OE2 GLU A 187 32.386 4.061 60.453 1.00 54.43 O ATOM 1572 H GLU A 187 31.917 6.906 64.220 1.00 0.00 H ATOM 1573 N SER A 188 35.288 9.408 62.740 1.00 48.72 N ATOM 1574 CA SER A 188 35.766 10.801 62.730 1.00 47.10 C ATOM 1575 C SER A 188 36.374 11.212 61.381 1.00 50.99 C ATOM 1576 O SER A 188 37.378 11.924 61.348 1.00 47.83 O ATOM 1577 CB SER A 188 36.806 10.971 63.819 1.00 48.03 C ATOM 1578 OG SER A 188 37.892 10.117 63.517 1.00 54.18 O ATOM 1579 HG SER A 188 38.271 10.366 62.637 1.00 0.00 H ATOM 1580 H SER A 188 35.908 8.662 62.365 1.00 0.00 H ATOM 1581 N ASN A 189 35.781 10.735 60.269 1.00 50.19 N ATOM 1582 CA ASN A 189 36.271 11.041 58.926 1.00 50.62 C ATOM 1583 C ASN A 189 35.675 12.383 58.469 1.00 55.68 C ATOM 1584 O ASN A 189 34.554 12.433 57.936 1.00 56.24 O ATOM 1585 CB ASN A 189 35.942 9.897 57.963 1.00 50.43 C ATOM 1586 CG ASN A 189 36.554 10.031 56.593 1.00 82.74 C ATOM 1587 OD1 ASN A 189 37.694 10.487 56.410 1.00 79.79 O ATOM 1588 ND2 ASN A 189 35.815 9.577 55.599 1.00 76.56 N ATOM 1589 HD22 ASN A 189 34.864 9.202 55.788 1.00 0.00 H ATOM 1590 HD21 ASN A 189 36.184 9.595 54.627 1.00 0.00 H ATOM 1591 H ASN A 189 34.944 10.127 60.370 1.00 0.00 H ATOM 1592 N ARG A 190 36.411 13.473 58.771 1.00 50.42 N ATOM 1593 CA ARG A 190 36.065 14.856 58.501 1.00 50.26 C ATOM 1594 C ARG A 190 34.932 15.290 59.444 1.00 54.82 C ATOM 1595 O ARG A 190 35.136 16.229 60.218 1.00 56.66 O ATOM 1596 CB ARG A 190 35.765 15.103 57.013 1.00 52.84 C ATOM 1597 CG ARG A 190 37.042 15.252 56.168 1.00 71.46 C ATOM 1598 CD ARG A 190 37.286 14.116 55.189 1.00 93.89 C ATOM 1599 NE ARG A 190 36.384 14.180 54.041 1.00113.11 N ATOM 1600 CZ ARG A 190 36.306 13.252 53.091 1.00133.63 C ATOM 1601 NH1 ARG A 190 37.078 12.172 53.141 1.00122.45 N ATOM 1602 NH2 ARG A 190 35.453 13.395 52.084 1.00122.36 N ATOM 1603 HE ARG A 190 35.760 15.008 53.961 1.00 0.00 H ATOM 1604 HH12 ARG A 190 37.012 11.450 52.395 1.00 0.00 H ATOM 1605 HH11 ARG A 190 37.749 12.048 53.926 1.00 0.00 H ATOM 1606 HH22 ARG A 190 35.396 12.667 51.344 1.00 0.00 H ATOM 1607 HH21 ARG A 190 34.842 14.235 52.035 1.00 0.00 H ATOM 1608 H ARG A 190 37.320 13.304 59.247 1.00 0.00 H ATOM 1609 N ARG A 191 33.772 14.614 59.414 1.00 49.94 N ATOM 1610 CA ARG A 191 32.657 14.849 60.352 1.00 49.41 C ATOM 1611 C ARG A 191 33.070 14.262 61.720 1.00 51.56 C ATOM 1612 O ARG A 191 33.335 13.057 61.812 1.00 52.39 O ATOM 1613 CB ARG A 191 31.337 14.202 59.856 1.00 50.53 C ATOM 1614 CG ARG A 191 30.811 14.720 58.540 1.00 63.32 C ATOM 1615 CD ARG A 191 29.686 13.863 57.995 1.00 75.98 C ATOM 1616 NE ARG A 191 29.529 14.140 56.565 1.00 92.89 N ATOM 1617 CZ ARG A 191 28.842 13.395 55.700 1.00104.69 C ATOM 1618 NH1 ARG A 191 28.196 12.308 56.111 1.00 93.38 N ATOM 1619 NH2 ARG A 191 28.791 13.734 54.416 1.00 83.38 N ATOM 1620 HE ARG A 191 29.994 14.992 56.193 1.00 0.00 H ATOM 1621 HH12 ARG A 191 27.662 11.732 55.430 1.00 0.00 H ATOM 1622 HH11 ARG A 191 28.225 12.034 57.114 1.00 0.00 H ATOM 1623 HH22 ARG A 191 28.253 13.149 53.745 1.00 0.00 H ATOM 1624 HH21 ARG A 191 29.289 14.584 54.082 1.00 0.00 H ATOM 1625 H ARG A 191 33.652 13.881 58.686 1.00 0.00 H ATOM 1626 N ASP A 192 33.156 15.095 62.765 1.00 45.66 N ATOM 1627 CA ASP A 192 33.594 14.657 64.101 1.00 44.70 C ATOM 1628 C ASP A 192 33.170 15.666 65.189 1.00 47.17 C ATOM 1629 O ASP A 192 32.597 16.712 64.866 1.00 47.58 O ATOM 1630 CB ASP A 192 35.148 14.544 64.064 1.00 46.51 C ATOM 1631 CG ASP A 192 35.854 13.899 65.241 1.00 54.04 C ATOM 1632 OD1 ASP A 192 35.181 13.152 66.010 1.00 59.65 O ATOM 1633 OD2 ASP A 192 37.095 14.058 65.343 1.00 47.04 O ATOM 1634 H ASP A 192 32.903 16.094 62.627 1.00 0.00 H ATOM 1635 N SER A 193 33.468 15.351 66.476 1.00 41.03 N ATOM 1636 CA SER A 193 33.313 16.228 67.642 1.00 39.01 C ATOM 1637 C SER A 193 34.692 16.884 67.887 1.00 42.79 C ATOM 1638 O SER A 193 35.710 16.349 67.415 1.00 43.30 O ATOM 1639 CB SER A 193 32.800 15.465 68.860 1.00 39.19 C ATOM 1640 OG SER A 193 33.680 14.438 69.276 1.00 46.84 O ATOM 1641 HG SER A 193 33.798 13.787 68.539 1.00 0.00 H ATOM 1642 H SER A 193 33.842 14.397 66.652 1.00 0.00 H ATOM 1643 N CYS A 194 34.739 18.056 68.542 1.00 37.25 N ATOM 1644 CA CYS A 194 36.020 18.713 68.725 1.00 36.60 C ATOM 1645 C CYS A 194 36.036 19.610 69.957 1.00 36.00 C ATOM 1646 O CYS A 194 35.115 19.542 70.772 1.00 34.69 O ATOM 1647 CB CYS A 194 36.413 19.482 67.467 1.00 38.06 C ATOM 1648 SG CYS A 194 38.202 19.739 67.322 1.00 42.87 S ATOM 1649 H CYS A 194 33.868 18.487 68.913 1.00 0.00 H ATOM 1650 N LYS A 195 37.126 20.395 70.121 1.00 29.83 N ATOM 1651 CA LYS A 195 37.338 21.363 71.190 1.00 29.04 C ATOM 1652 C LYS A 195 36.012 22.112 71.424 1.00 31.99 C ATOM 1653 O LYS A 195 35.421 22.622 70.456 1.00 31.59 O ATOM 1654 CB LYS A 195 38.467 22.324 70.744 1.00 30.91 C ATOM 1655 CG LYS A 195 39.274 22.943 71.864 1.00 39.46 C ATOM 1656 CD LYS A 195 39.909 24.269 71.440 1.00 44.36 C ATOM 1657 CE LYS A 195 41.209 24.263 70.658 1.00 41.39 C ATOM 1658 NZ LYS A 195 41.379 25.535 69.830 1.00 39.80 N ATOM 1659 HZ1 LYS A 195 40.592 25.616 69.155 1.00 0.00 H ATOM 1660 HZ2 LYS A 195 41.381 26.361 70.462 1.00 0.00 H ATOM 1661 HZ3 LYS A 195 42.279 25.492 69.311 1.00 0.00 H ATOM 1662 H LYS A 195 37.885 20.298 69.417 1.00 0.00 H ATOM 1663 N GLY A 196 35.523 22.086 72.661 1.00 26.75 N ATOM 1664 CA GLY A 196 34.278 22.753 73.038 1.00 26.51 C ATOM 1665 C GLY A 196 33.047 21.867 73.025 1.00 31.77 C ATOM 1666 O GLY A 196 32.006 22.218 73.608 1.00 30.99 O ATOM 1667 H GLY A 196 36.050 21.568 73.393 1.00 0.00 H ATOM 1668 N ASP A 197 33.140 20.722 72.325 1.00 30.34 N ATOM 1669 CA ASP A 197 32.025 19.770 72.240 1.00 30.45 C ATOM 1670 C ASP A 197 32.067 18.884 73.451 1.00 32.90 C ATOM 1671 O ASP A 197 31.081 18.225 73.739 1.00 32.81 O ATOM 1672 CB ASP A 197 32.038 18.957 70.931 1.00 32.70 C ATOM 1673 CG ASP A 197 31.734 19.801 69.706 1.00 48.04 C ATOM 1674 OD1 ASP A 197 30.780 20.603 69.762 1.00 51.07 O ATOM 1675 OD2 ASP A 197 32.438 19.645 68.684 1.00 51.45 O ATOM 1676 H ASP A 197 34.028 20.504 71.829 1.00 0.00 H ATOM 1677 N SER A 198 33.188 18.935 74.198 1.00 28.77 N ATOM 1678 CA SER A 198 33.447 18.228 75.445 1.00 29.33 C ATOM 1679 C SER A 198 32.272 18.300 76.410 1.00 35.77 C ATOM 1680 O SER A 198 31.624 19.325 76.517 1.00 34.87 O ATOM 1681 CB SER A 198 34.669 18.834 76.115 1.00 31.96 C ATOM 1682 OG SER A 198 35.717 18.859 75.167 1.00 39.96 O ATOM 1683 HG SER A 198 35.912 17.936 74.868 1.00 0.00 H ATOM 1684 H SER A 198 33.952 19.546 73.845 1.00 0.00 H ATOM 1685 N GLY A 199 31.977 17.210 77.089 1.00 35.60 N ATOM 1686 CA GLY A 199 30.867 17.210 78.033 1.00 36.76 C ATOM 1687 C GLY A 199 29.495 17.180 77.390 1.00 42.88 C ATOM 1688 O GLY A 199 28.487 17.062 78.092 1.00 42.46 O ATOM 1689 H GLY A 199 32.539 16.346 76.951 1.00 0.00 H ATOM 1690 N GLY A 200 29.466 17.302 76.061 1.00 40.70 N ATOM 1691 CA GLY A 200 28.262 17.245 75.242 1.00 40.71 C ATOM 1692 C GLY A 200 27.701 15.832 75.102 1.00 46.13 C ATOM 1693 O GLY A 200 28.407 14.840 75.321 1.00 42.85 O ATOM 1694 H GLY A 200 30.372 17.449 75.573 1.00 0.00 H ATOM 1695 N PRO A 201 26.413 15.712 74.698 1.00 45.77 N ATOM 1696 CA PRO A 201 25.786 14.393 74.578 1.00 44.76 C ATOM 1697 C PRO A 201 25.982 13.680 73.241 1.00 49.19 C ATOM 1698 O PRO A 201 26.082 14.310 72.197 1.00 49.78 O ATOM 1699 CB PRO A 201 24.317 14.720 74.747 1.00 46.31 C ATOM 1700 CG PRO A 201 24.167 16.061 74.166 1.00 51.37 C ATOM 1701 CD PRO A 201 25.443 16.788 74.404 1.00 47.92 C ATOM 1702 N LEU A 202 26.034 12.342 73.301 1.00 45.36 N ATOM 1703 CA LEU A 202 26.037 11.402 72.174 1.00 43.80 C ATOM 1704 C LEU A 202 24.743 10.624 72.377 1.00 47.50 C ATOM 1705 O LEU A 202 24.617 9.889 73.363 1.00 47.96 O ATOM 1706 CB LEU A 202 27.302 10.506 72.102 1.00 42.92 C ATOM 1707 CG LEU A 202 27.318 9.512 70.932 1.00 45.94 C ATOM 1708 CD1 LEU A 202 28.631 9.466 70.276 1.00 45.69 C ATOM 1709 CD2 LEU A 202 27.014 8.154 71.386 1.00 46.31 C ATOM 1710 H LEU A 202 26.077 11.923 74.252 1.00 0.00 H ATOM 1711 N VAL A 203 23.744 10.892 71.536 1.00 43.29 N ATOM 1712 CA VAL A 203 22.412 10.316 71.700 1.00 44.23 C ATOM 1713 C VAL A 203 22.112 9.300 70.606 1.00 48.84 C ATOM 1714 O VAL A 203 22.289 9.596 69.427 1.00 47.94 O ATOM 1715 CB VAL A 203 21.336 11.426 71.749 1.00 49.04 C ATOM 1716 CG1 VAL A 203 19.980 10.872 72.151 1.00 49.08 C ATOM 1717 CG2 VAL A 203 21.748 12.547 72.694 1.00 49.08 C ATOM 1718 H VAL A 203 23.919 11.533 70.736 1.00 0.00 H ATOM 1719 N CYS A 204 21.692 8.085 71.017 1.00 46.65 N ATOM 1720 CA CYS A 204 21.317 6.976 70.135 1.00 46.63 C ATOM 1721 C CYS A 204 19.932 6.520 70.536 1.00 49.71 C ATOM 1722 O CYS A 204 19.714 6.160 71.706 1.00 49.86 O ATOM 1723 CB CYS A 204 22.316 5.824 70.195 1.00 47.29 C ATOM 1724 SG CYS A 204 24.031 6.338 70.405 1.00 52.21 S ATOM 1725 H CYS A 204 21.629 7.923 72.042 1.00 0.00 H ATOM 1726 N GLY A 205 19.009 6.559 69.574 1.00 43.47 N ATOM 1727 CA GLY A 205 17.631 6.157 69.782 1.00 42.52 C ATOM 1728 C GLY A 205 16.953 6.952 70.873 1.00 47.65 C ATOM 1729 O GLY A 205 16.293 6.363 71.741 1.00 46.72 O ATOM 1730 H GLY A 205 19.291 6.893 68.630 1.00 0.00 H ATOM 1731 N GLY A 206 17.171 8.286 70.838 1.00 44.83 N ATOM 1732 CA GLY A 206 16.621 9.268 71.774 1.00 43.48 C ATOM 1733 C GLY A 206 17.044 9.090 73.223 1.00 45.10 C ATOM 1734 O GLY A 206 16.443 9.688 74.121 1.00 41.93 O ATOM 1735 H GLY A 206 17.784 8.646 70.079 1.00 0.00 H ATOM 1736 N VAL A 207 18.095 8.272 73.460 1.00 42.96 N ATOM 1737 CA VAL A 207 18.628 7.964 74.790 1.00 43.10 C ATOM 1738 C VAL A 207 20.089 8.403 74.838 1.00 48.04 C ATOM 1739 O VAL A 207 20.830 8.186 73.871 1.00 48.51 O ATOM 1740 CB VAL A 207 18.449 6.445 75.149 1.00 46.36 C ATOM 1741 CG1 VAL A 207 19.056 6.090 76.500 1.00 45.63 C ATOM 1742 CG2 VAL A 207 16.980 6.051 75.137 1.00 46.33 C ATOM 1743 H VAL A 207 18.558 7.830 72.640 1.00 0.00 H ATOM 1744 N LEU A 208 20.498 9.019 75.963 1.00 43.68 N ATOM 1745 CA LEU A 208 21.883 9.427 76.148 1.00 43.92 C ATOM 1746 C LEU A 208 22.747 8.180 76.309 1.00 46.59 C ATOM 1747 O LEU A 208 22.482 7.362 77.194 1.00 46.25 O ATOM 1748 CB LEU A 208 22.018 10.361 77.371 1.00 44.52 C ATOM 1749 CG LEU A 208 23.437 10.831 77.751 1.00 48.91 C ATOM 1750 CD1 LEU A 208 23.985 11.815 76.745 1.00 48.14 C ATOM 1751 CD2 LEU A 208 23.444 11.432 79.138 1.00 50.10 C ATOM 1752 H LEU A 208 19.808 9.208 76.718 1.00 0.00 H ATOM 1753 N GLU A 209 23.748 8.016 75.428 1.00 42.48 N ATOM 1754 CA GLU A 209 24.656 6.867 75.473 1.00 41.72 C ATOM 1755 C GLU A 209 26.063 7.283 75.899 1.00 43.85 C ATOM 1756 O GLU A 209 26.643 6.655 76.781 1.00 42.37 O ATOM 1757 CB GLU A 209 24.680 6.110 74.133 1.00 42.95 C ATOM 1758 CG GLU A 209 23.419 5.277 73.899 1.00 55.89 C ATOM 1759 CD GLU A 209 23.124 4.114 74.846 1.00 77.16 C ATOM 1760 OE1 GLU A 209 24.076 3.536 75.420 1.00 77.67 O ATOM 1761 OE2 GLU A 209 21.931 3.765 74.995 1.00 63.75 O ATOM 1762 H GLU A 209 23.883 8.732 74.686 1.00 0.00 H ATOM 1763 N GLY A 210 26.581 8.345 75.299 1.00 41.46 N ATOM 1764 CA GLY A 210 27.919 8.842 75.615 1.00 41.59 C ATOM 1765 C GLY A 210 28.022 10.315 75.971 1.00 43.01 C ATOM 1766 O GLY A 210 27.072 11.079 75.773 1.00 42.87 O ATOM 1767 H GLY A 210 26.017 8.841 74.580 1.00 0.00 H ATOM 1768 N VAL A 211 29.183 10.715 76.510 1.00 36.51 N ATOM 1769 CA VAL A 211 29.485 12.089 76.895 1.00 35.45 C ATOM 1770 C VAL A 211 30.849 12.402 76.293 1.00 40.58 C ATOM 1771 O VAL A 211 31.836 11.754 76.641 1.00 41.67 O ATOM 1772 CB VAL A 211 29.415 12.310 78.438 1.00 39.02 C ATOM 1773 CG1 VAL A 211 30.016 13.652 78.848 1.00 39.05 C ATOM 1774 CG2 VAL A 211 27.984 12.201 78.943 1.00 38.93 C ATOM 1775 H VAL A 211 29.919 9.996 76.664 1.00 0.00 H ATOM 1776 N VAL A 212 30.908 13.357 75.358 1.00 35.99 N ATOM 1777 CA VAL A 212 32.149 13.762 74.667 1.00 32.98 C ATOM 1778 C VAL A 212 33.256 14.000 75.708 1.00 35.58 C ATOM 1779 O VAL A 212 32.997 14.690 76.699 1.00 34.87 O ATOM 1780 CB VAL A 212 31.926 15.010 73.765 1.00 33.59 C ATOM 1781 CG1 VAL A 212 33.193 15.351 72.988 1.00 34.01 C ATOM 1782 CG2 VAL A 212 30.739 14.821 72.818 1.00 31.56 C ATOM 1783 H VAL A 212 30.026 13.844 75.102 1.00 0.00 H ATOM 1784 N THR A 213 34.431 13.339 75.552 1.00 31.87 N ATOM 1785 CA THR A 213 35.537 13.500 76.515 1.00 31.99 C ATOM 1786 C THR A 213 36.087 14.927 76.491 1.00 34.62 C ATOM 1787 O THR A 213 35.921 15.625 75.485 1.00 34.66 O ATOM 1788 CB THR A 213 36.694 12.516 76.288 1.00 46.87 C ATOM 1789 OG1 THR A 213 37.251 12.717 74.975 1.00 49.74 O ATOM 1790 CG2 THR A 213 36.327 11.052 76.577 1.00 43.99 C ATOM 1791 HG1 THR A 213 36.550 12.563 74.293 1.00 0.00 H ATOM 1792 H THR A 213 34.554 12.706 74.736 1.00 0.00 H ATOM 1793 N SER A 214 36.719 15.356 77.607 1.00 30.56 N ATOM 1794 CA SER A 214 37.337 16.672 77.736 1.00 31.25 C ATOM 1795 C SER A 214 38.875 16.612 77.561 1.00 34.80 C ATOM 1796 O SER A 214 39.565 17.605 77.814 1.00 34.74 O ATOM 1797 CB SER A 214 36.973 17.315 79.070 1.00 35.88 C ATOM 1798 OG SER A 214 37.323 16.460 80.139 1.00 46.73 O ATOM 1799 HG SER A 214 36.835 15.604 80.049 1.00 0.00 H ATOM 1800 H SER A 214 36.768 14.710 78.421 1.00 0.00 H ATOM 1801 N GLY A 215 39.383 15.460 77.132 1.00 31.21 N ATOM 1802 CA GLY A 215 40.803 15.248 76.910 1.00 31.56 C ATOM 1803 C GLY A 215 41.191 15.784 75.560 1.00 39.03 C ATOM 1804 O GLY A 215 40.531 15.457 74.578 1.00 42.63 O ATOM 1805 H GLY A 215 38.731 14.671 76.946 1.00 0.00 H ATOM 1806 N SER A 216 42.229 16.619 75.491 1.00 35.15 N ATOM 1807 CA SER A 216 42.754 17.139 74.234 1.00 36.03 C ATOM 1808 C SER A 216 42.980 15.984 73.261 1.00 42.17 C ATOM 1809 O SER A 216 43.449 14.907 73.660 1.00 42.14 O ATOM 1810 CB SER A 216 44.065 17.901 74.440 1.00 42.23 C ATOM 1811 OG SER A 216 45.217 17.066 74.444 1.00 59.63 O ATOM 1812 HG SER A 216 46.025 17.621 74.581 1.00 0.00 H ATOM 1813 H SER A 216 42.686 16.914 76.377 1.00 0.00 H ATOM 1814 N ARG A 217 42.653 16.215 71.988 1.00 39.06 N ATOM 1815 CA ARG A 217 42.799 15.230 70.933 1.00 38.15 C ATOM 1816 C ARG A 217 42.830 15.870 69.563 1.00 40.01 C ATOM 1817 O ARG A 217 42.520 17.054 69.430 1.00 38.75 O ATOM 1818 CB ARG A 217 41.662 14.204 71.004 1.00 40.15 C ATOM 1819 CG ARG A 217 40.286 14.795 70.846 1.00 45.25 C ATOM 1820 CD ARG A 217 39.266 13.696 70.809 1.00 46.43 C ATOM 1821 NE ARG A 217 39.333 12.921 69.567 1.00 48.49 N ATOM 1822 CZ ARG A 217 38.588 13.147 68.486 1.00 60.78 C ATOM 1823 NH1 ARG A 217 37.734 14.170 68.457 1.00 29.81 N ATOM 1824 NH2 ARG A 217 38.698 12.360 67.421 1.00 52.56 N ATOM 1825 HE ARG A 217 40.013 12.135 69.526 1.00 0.00 H ATOM 1826 HH12 ARG A 217 37.155 14.341 67.610 1.00 0.00 H ATOM 1827 HH11 ARG A 217 37.646 14.798 69.282 1.00 0.00 H ATOM 1828 HH22 ARG A 217 38.115 12.540 66.579 1.00 0.00 H ATOM 1829 HH21 ARG A 217 39.368 11.564 67.429 1.00 0.00 H ATOM 1830 H ARG A 217 42.273 17.151 71.739 1.00 0.00 H ATOM 1831 N VAL A 218 43.182 15.075 68.536 1.00 35.58 N ATOM 1832 CA VAL A 218 43.214 15.514 67.150 1.00 34.70 C ATOM 1833 C VAL A 218 41.786 15.338 66.552 1.00 43.67 C ATOM 1834 O VAL A 218 41.181 14.261 66.721 1.00 47.18 O ATOM 1835 CB VAL A 218 44.329 14.738 66.412 1.00 35.58 C ATOM 1836 CG1 VAL A 218 43.962 14.381 64.959 1.00 35.56 C ATOM 1837 CG2 VAL A 218 45.631 15.516 66.499 1.00 34.51 C ATOM 1838 H VAL A 218 43.446 14.091 68.745 1.00 0.00 H ATOM 1839 N CYS A 219 41.239 16.386 65.897 1.00 37.93 N ATOM 1840 CA CYS A 219 39.900 16.241 65.332 1.00 38.30 C ATOM 1841 C CYS A 219 39.916 16.029 63.825 1.00 43.04 C ATOM 1842 O CYS A 219 40.859 16.464 63.148 1.00 44.24 O ATOM 1843 CB CYS A 219 39.040 17.445 65.679 1.00 38.88 C ATOM 1844 SG CYS A 219 39.038 17.877 67.427 1.00 42.78 S ATOM 1845 H CYS A 219 41.762 17.279 65.797 1.00 0.00 H ATOM 1846 N GLY A 220 38.832 15.416 63.328 1.00 37.37 N ATOM 1847 CA GLY A 220 38.538 15.244 61.911 1.00 36.80 C ATOM 1848 C GLY A 220 39.384 14.293 61.107 1.00 42.61 C ATOM 1849 O GLY A 220 39.156 14.149 59.904 1.00 44.56 O ATOM 1850 H GLY A 220 38.146 15.032 64.009 1.00 0.00 H ATOM 1851 N ASN A 221 40.362 13.644 61.759 1.00 38.79 N ATOM 1852 CA ASN A 221 41.228 12.603 61.197 1.00 38.33 C ATOM 1853 C ASN A 221 40.539 11.238 61.445 1.00 45.75 C ATOM 1854 O ASN A 221 40.307 10.876 62.614 1.00 46.26 O ATOM 1855 CB ASN A 221 42.583 12.683 61.886 1.00 34.69 C ATOM 1856 CG ASN A 221 43.596 11.635 61.525 1.00 51.17 C ATOM 1857 OD1 ASN A 221 43.307 10.582 60.950 1.00 40.77 O ATOM 1858 ND2 ASN A 221 44.826 11.903 61.898 1.00 49.21 N ATOM 1859 HD22 ASN A 221 45.039 12.799 62.381 1.00 0.00 H ATOM 1860 HD21 ASN A 221 45.587 11.219 61.711 1.00 0.00 H ATOM 1861 H ASN A 221 40.520 13.903 62.754 1.00 0.00 H ATOM 1862 N ARG A 222 40.233 10.482 60.367 1.00 42.57 N ATOM 1863 CA ARG A 222 39.534 9.199 60.461 1.00 42.70 C ATOM 1864 C ARG A 222 40.266 8.112 61.292 1.00 48.46 C ATOM 1865 O ARG A 222 39.605 7.208 61.828 1.00 49.25 O ATOM 1866 CB ARG A 222 39.196 8.653 59.066 1.00 41.75 C ATOM 1867 CG ARG A 222 40.330 8.079 58.271 1.00 53.22 C ATOM 1868 CD ARG A 222 39.952 7.966 56.808 1.00 70.66 C ATOM 1869 NE ARG A 222 40.550 6.820 56.120 1.00 86.65 N ATOM 1870 CZ ARG A 222 41.799 6.756 55.644 1.00 98.34 C ATOM 1871 NH1 ARG A 222 42.626 7.793 55.769 1.00 71.45 N ATOM 1872 NH2 ARG A 222 42.224 5.660 55.032 1.00 92.47 N ATOM 1873 HE ARG A 222 39.950 5.980 55.990 1.00 0.00 H ATOM 1874 HH12 ARG A 222 43.595 7.733 55.396 1.00 0.00 H ATOM 1875 HH11 ARG A 222 42.303 8.662 56.240 1.00 0.00 H ATOM 1876 HH22 ARG A 222 43.195 5.614 54.663 1.00 0.00 H ATOM 1877 HH21 ARG A 222 41.586 4.846 54.920 1.00 0.00 H ATOM 1878 H ARG A 222 40.507 10.828 59.426 1.00 0.00 H ATOM 1879 N LYS A 223 41.603 8.198 61.399 1.00 44.20 N ATOM 1880 CA LYS A 223 42.408 7.205 62.120 1.00 43.45 C ATOM 1881 C LYS A 223 42.496 7.526 63.620 1.00 47.80 C ATOM 1882 O LYS A 223 43.062 6.749 64.386 1.00 48.42 O ATOM 1883 CB LYS A 223 43.804 7.053 61.483 1.00 44.85 C ATOM 1884 CG LYS A 223 43.699 6.678 59.999 1.00 55.80 C ATOM 1885 CD LYS A 223 44.873 5.906 59.470 1.00 64.02 C ATOM 1886 CE LYS A 223 44.475 5.051 58.293 1.00 71.66 C ATOM 1887 NZ LYS A 223 43.338 4.129 58.597 1.00 80.03 N ATOM 1888 HZ1 LYS A 223 43.608 3.492 59.373 1.00 0.00 H ATOM 1889 HZ2 LYS A 223 42.506 4.687 58.878 1.00 0.00 H ATOM 1890 HZ3 LYS A 223 43.111 3.569 57.750 1.00 0.00 H ATOM 1891 H LYS A 223 42.088 9.002 60.952 1.00 0.00 H ATOM 1892 N LYS A 224 41.895 8.631 64.050 1.00 43.18 N ATOM 1893 CA LYS A 224 41.875 9.000 65.461 1.00 41.98 C ATOM 1894 C LYS A 224 40.420 9.243 65.815 1.00 44.70 C ATOM 1895 O LYS A 224 39.967 10.395 65.777 1.00 46.40 O ATOM 1896 CB LYS A 224 42.789 10.224 65.715 1.00 43.47 C ATOM 1897 CG LYS A 224 44.274 10.032 65.355 1.00 26.72 C ATOM 1898 CD LYS A 224 44.874 8.827 66.047 1.00 30.85 C ATOM 1899 CE LYS A 224 46.361 8.806 65.978 1.00 38.67 C ATOM 1900 NZ LYS A 224 46.886 7.461 66.298 1.00 57.10 N ATOM 1901 HZ1 LYS A 224 46.592 7.195 67.259 1.00 0.00 H ATOM 1902 HZ2 LYS A 224 46.510 6.772 65.616 1.00 0.00 H ATOM 1903 HZ3 LYS A 224 47.924 7.473 66.243 1.00 0.00 H ATOM 1904 H LYS A 224 41.425 9.251 63.360 1.00 0.00 H ATOM 1905 N PRO A 225 39.638 8.158 66.047 1.00 38.23 N ATOM 1906 CA PRO A 225 38.182 8.321 66.249 1.00 37.69 C ATOM 1907 C PRO A 225 37.790 9.176 67.450 1.00 44.88 C ATOM 1908 O PRO A 225 38.600 9.435 68.343 1.00 46.82 O ATOM 1909 CB PRO A 225 37.686 6.883 66.416 1.00 38.45 C ATOM 1910 CG PRO A 225 38.734 6.045 65.764 1.00 41.84 C ATOM 1911 CD PRO A 225 40.014 6.730 66.054 1.00 38.07 C ATOM 1912 N GLY A 226 36.557 9.660 67.426 1.00 40.38 N ATOM 1913 CA GLY A 226 36.002 10.451 68.516 1.00 39.05 C ATOM 1914 C GLY A 226 35.807 9.546 69.718 1.00 39.76 C ATOM 1915 O GLY A 226 35.348 8.411 69.553 1.00 41.09 O ATOM 1916 H GLY A 226 35.961 9.467 66.596 1.00 0.00 H ATOM 1917 N ILE A 227 36.188 10.020 70.919 1.00 31.79 N ATOM 1918 CA ILE A 227 36.097 9.257 72.170 1.00 29.58 C ATOM 1919 C ILE A 227 34.951 9.821 73.006 1.00 37.73 C ATOM 1920 O ILE A 227 34.870 11.043 73.163 1.00 39.59 O ATOM 1921 CB ILE A 227 37.442 9.226 72.945 1.00 29.26 C ATOM 1922 CG1 ILE A 227 38.599 8.880 72.002 1.00 28.11 C ATOM 1923 CG2 ILE A 227 37.364 8.231 74.073 1.00 29.00 C ATOM 1924 CD1 ILE A 227 39.994 9.092 72.543 1.00 22.69 C ATOM 1925 H ILE A 227 36.570 10.986 70.963 1.00 0.00 H ATOM 1926 N TYR A 228 34.050 8.933 73.504 1.00 34.25 N ATOM 1927 CA TYR A 228 32.876 9.297 74.308 1.00 34.89 C ATOM 1928 C TYR A 228 32.762 8.362 75.534 1.00 39.57 C ATOM 1929 O TYR A 228 32.899 7.143 75.399 1.00 40.31 O ATOM 1930 CB TYR A 228 31.579 9.245 73.442 1.00 36.02 C ATOM 1931 CG TYR A 228 31.706 9.929 72.100 1.00 36.60 C ATOM 1932 CD1 TYR A 228 32.302 9.281 71.018 1.00 39.08 C ATOM 1933 CD2 TYR A 228 31.266 11.241 71.917 1.00 35.72 C ATOM 1934 CE1 TYR A 228 32.477 9.926 69.795 1.00 41.71 C ATOM 1935 CE2 TYR A 228 31.431 11.897 70.692 1.00 35.82 C ATOM 1936 CZ TYR A 228 32.041 11.234 69.634 1.00 46.38 C ATOM 1937 OH TYR A 228 32.251 11.838 68.413 1.00 48.13 O ATOM 1938 HH TYR A 228 32.826 12.635 68.535 1.00 0.00 H ATOM 1939 H TYR A 228 34.203 7.924 73.301 1.00 0.00 H ATOM 1940 N THR A 229 32.523 8.930 76.721 1.00 34.96 N ATOM 1941 CA THR A 229 32.363 8.172 77.955 1.00 35.28 C ATOM 1942 C THR A 229 30.968 7.532 77.966 1.00 41.30 C ATOM 1943 O THR A 229 29.974 8.231 77.800 1.00 41.88 O ATOM 1944 CB THR A 229 32.584 9.094 79.165 1.00 48.32 C ATOM 1945 OG1 THR A 229 33.891 9.664 79.126 1.00 53.60 O ATOM 1946 CG2 THR A 229 32.375 8.377 80.490 1.00 48.30 C ATOM 1947 HG1 THR A 229 34.016 10.254 79.911 1.00 0.00 H ATOM 1948 H THR A 229 32.447 9.966 76.766 1.00 0.00 H ATOM 1949 N ARG A 230 30.892 6.214 78.163 1.00 38.05 N ATOM 1950 CA ARG A 230 29.626 5.468 78.209 1.00 36.36 C ATOM 1951 C ARG A 230 28.916 5.774 79.519 1.00 41.17 C ATOM 1952 O ARG A 230 29.443 5.402 80.561 1.00 40.48 O ATOM 1953 CB ARG A 230 29.905 3.958 78.086 1.00 29.86 C ATOM 1954 CG ARG A 230 30.532 3.523 76.775 1.00 34.43 C ATOM 1955 CD ARG A 230 30.753 2.022 76.706 1.00 36.57 C ATOM 1956 NE ARG A 230 29.492 1.287 76.820 1.00 38.73 N ATOM 1957 CZ ARG A 230 29.137 0.554 77.871 1.00 57.91 C ATOM 1958 NH1 ARG A 230 29.955 0.427 78.909 1.00 51.47 N ATOM 1959 NH2 ARG A 230 27.954 -0.046 77.899 1.00 52.25 N ATOM 1960 HE ARG A 230 28.827 1.342 76.022 1.00 0.00 H ATOM 1961 HH12 ARG A 230 29.671 -0.148 79.728 1.00 0.00 H ATOM 1962 HH11 ARG A 230 30.880 0.902 78.903 1.00 0.00 H ATOM 1963 HH22 ARG A 230 27.681 -0.618 78.723 1.00 0.00 H ATOM 1964 HH21 ARG A 230 27.300 0.056 77.097 1.00 0.00 H ATOM 1965 H ARG A 230 31.778 5.685 78.291 1.00 0.00 H ATOM 1966 N VAL A 231 27.749 6.464 79.491 1.00 39.38 N ATOM 1967 CA VAL A 231 27.017 6.816 80.719 1.00 40.67 C ATOM 1968 C VAL A 231 26.552 5.565 81.457 1.00 47.65 C ATOM 1969 O VAL A 231 26.654 5.544 82.689 1.00 49.72 O ATOM 1970 CB VAL A 231 25.858 7.834 80.588 1.00 45.54 C ATOM 1971 CG1 VAL A 231 26.359 9.113 79.968 1.00 45.58 C ATOM 1972 CG2 VAL A 231 24.672 7.291 79.794 1.00 46.17 C ATOM 1973 H VAL A 231 27.358 6.754 78.572 1.00 0.00 H ATOM 1974 N ALA A 232 26.086 4.517 80.728 1.00 43.25 N ATOM 1975 CA ALA A 232 25.636 3.273 81.351 1.00 43.51 C ATOM 1976 C ALA A 232 26.725 2.656 82.223 1.00 47.36 C ATOM 1977 O ALA A 232 26.424 2.059 83.253 1.00 48.83 O ATOM 1978 CB ALA A 232 25.198 2.281 80.295 1.00 44.47 C ATOM 1979 H ALA A 232 26.048 4.603 79.692 1.00 0.00 H ATOM 1980 N SER A 233 27.990 2.851 81.835 1.00 41.57 N ATOM 1981 CA SER A 233 29.131 2.343 82.575 1.00 41.17 C ATOM 1982 C SER A 233 29.284 3.003 83.956 1.00 46.28 C ATOM 1983 O SER A 233 29.932 2.414 84.827 1.00 47.52 O ATOM 1984 CB SER A 233 30.397 2.553 81.767 1.00 43.11 C ATOM 1985 OG SER A 233 31.370 1.638 82.217 1.00 50.65 O ATOM 1986 HG SER A 233 31.036 0.715 82.090 1.00 0.00 H ATOM 1987 H SER A 233 28.164 3.391 80.964 1.00 0.00 H ATOM 1988 N TYR A 234 28.677 4.209 84.153 1.00 39.27 N ATOM 1989 CA TYR A 234 28.763 4.988 85.375 1.00 36.17 C ATOM 1990 C TYR A 234 27.389 5.213 86.007 1.00 44.78 C ATOM 1991 O TYR A 234 27.287 6.012 86.938 1.00 46.39 O ATOM 1992 CB TYR A 234 29.447 6.322 85.067 1.00 33.39 C ATOM 1993 CG TYR A 234 30.886 6.156 84.634 1.00 31.52 C ATOM 1994 CD1 TYR A 234 31.211 5.945 83.303 1.00 32.17 C ATOM 1995 CD2 TYR A 234 31.926 6.188 85.563 1.00 31.88 C ATOM 1996 CE1 TYR A 234 32.528 5.726 82.906 1.00 31.24 C ATOM 1997 CE2 TYR A 234 33.255 6.016 85.170 1.00 32.17 C ATOM 1998 CZ TYR A 234 33.549 5.772 83.841 1.00 34.51 C ATOM 1999 OH TYR A 234 34.844 5.568 83.439 1.00 26.66 O ATOM 2000 HH TYR A 234 34.864 5.410 82.462 1.00 0.00 H ATOM 2001 H TYR A 234 28.112 4.598 83.371 1.00 0.00 H ATOM 2002 N ALA A 235 26.347 4.470 85.537 1.00 41.40 N ATOM 2003 CA ALA A 235 24.951 4.533 85.980 1.00 41.06 C ATOM 2004 C ALA A 235 24.794 4.494 87.486 1.00 44.68 C ATOM 2005 O ALA A 235 24.060 5.315 88.022 1.00 45.51 O ATOM 2006 CB ALA A 235 24.157 3.396 85.367 1.00 41.92 C ATOM 2007 H ALA A 235 26.566 3.786 84.785 1.00 0.00 H ATOM 2008 N ALA A 236 25.495 3.576 88.165 1.00 40.18 N ATOM 2009 CA ALA A 236 25.421 3.438 89.608 1.00 40.96 C ATOM 2010 C ALA A 236 25.933 4.688 90.321 1.00 47.62 C ATOM 2011 O ALA A 236 25.303 5.115 91.295 1.00 48.62 O ATOM 2012 CB ALA A 236 26.207 2.228 90.046 1.00 41.76 C ATOM 2013 H ALA A 236 26.119 2.935 87.635 1.00 0.00 H ATOM 2014 N TRP A 237 27.063 5.276 89.832 1.00 42.91 N ATOM 2015 CA TRP A 237 27.652 6.488 90.407 1.00 41.76 C ATOM 2016 C TRP A 237 26.695 7.668 90.235 1.00 44.79 C ATOM 2017 O TRP A 237 26.442 8.377 91.199 1.00 45.22 O ATOM 2018 CB TRP A 237 29.023 6.793 89.773 1.00 39.93 C ATOM 2019 CG TRP A 237 29.613 8.094 90.219 1.00 41.04 C ATOM 2020 CD1 TRP A 237 30.128 8.376 91.446 1.00 44.13 C ATOM 2021 CD2 TRP A 237 29.661 9.320 89.473 1.00 41.16 C ATOM 2022 NE1 TRP A 237 30.541 9.688 91.500 1.00 43.75 N ATOM 2023 CE2 TRP A 237 30.278 10.287 90.297 1.00 44.83 C ATOM 2024 CE3 TRP A 237 29.269 9.691 88.168 1.00 42.42 C ATOM 2025 CZ2 TRP A 237 30.497 11.598 89.868 1.00 43.72 C ATOM 2026 CZ3 TRP A 237 29.506 10.985 87.734 1.00 43.57 C ATOM 2027 CH2 TRP A 237 30.097 11.927 88.581 1.00 44.25 C ATOM 2028 HE1 TRP A 237 30.981 10.150 92.321 1.00 0.00 H ATOM 2029 H TRP A 237 27.530 4.842 89.010 1.00 0.00 H ATOM 2030 N ILE A 238 26.171 7.871 89.006 1.00 39.36 N ATOM 2031 CA ILE A 238 25.236 8.946 88.659 1.00 37.13 C ATOM 2032 C ILE A 238 24.029 8.865 89.594 1.00 41.65 C ATOM 2033 O ILE A 238 23.697 9.865 90.226 1.00 42.98 O ATOM 2034 CB ILE A 238 24.813 8.927 87.163 1.00 38.14 C ATOM 2035 CG1 ILE A 238 26.022 9.106 86.238 1.00 36.98 C ATOM 2036 CG2 ILE A 238 23.743 9.984 86.895 1.00 37.28 C ATOM 2037 CD1 ILE A 238 25.749 8.855 84.774 1.00 47.53 C ATOM 2038 H ILE A 238 26.452 7.215 88.249 1.00 0.00 H ATOM 2039 N ASP A 239 23.426 7.677 89.728 1.00 37.15 N ATOM 2040 CA ASP A 239 22.290 7.448 90.599 1.00 38.61 C ATOM 2041 C ASP A 239 22.628 7.856 92.036 1.00 45.00 C ATOM 2042 O ASP A 239 21.851 8.578 92.656 1.00 44.70 O ATOM 2043 CB ASP A 239 21.904 5.976 90.543 1.00 41.86 C ATOM 2044 CG ASP A 239 21.004 5.532 91.669 1.00 60.03 C ATOM 2045 OD1 ASP A 239 19.782 5.847 91.607 1.00 61.45 O ATOM 2046 OD2 ASP A 239 21.516 4.825 92.616 1.00 61.34 O ATOM 2047 H ASP A 239 23.793 6.875 89.177 1.00 0.00 H ATOM 2048 N SER A 240 23.804 7.424 92.534 1.00 42.77 N ATOM 2049 CA SER A 240 24.310 7.718 93.864 1.00 43.38 C ATOM 2050 C SER A 240 24.340 9.225 94.123 1.00 51.36 C ATOM 2051 O SER A 240 23.854 9.659 95.168 1.00 53.80 O ATOM 2052 CB SER A 240 25.702 7.121 94.043 1.00 47.37 C ATOM 2053 OG SER A 240 26.656 8.084 94.471 1.00 58.81 O ATOM 2054 HG SER A 240 27.540 7.649 94.572 1.00 0.00 H ATOM 2055 H SER A 240 24.397 6.833 91.917 1.00 0.00 H ATOM 2056 N VAL A 241 24.890 10.016 93.174 1.00 47.72 N ATOM 2057 CA VAL A 241 25.037 11.475 93.279 1.00 47.41 C ATOM 2058 C VAL A 241 23.648 12.154 93.234 1.00 52.93 C ATOM 2059 O VAL A 241 23.310 12.900 94.158 1.00 54.59 O ATOM 2060 CB VAL A 241 26.013 12.043 92.208 1.00 50.43 C ATOM 2061 CG1 VAL A 241 26.218 13.543 92.390 1.00 50.55 C ATOM 2062 CG2 VAL A 241 27.358 11.313 92.231 1.00 49.77 C ATOM 2063 H VAL A 241 25.234 9.558 92.306 1.00 0.00 H ATOM 2064 N LEU A 242 22.850 11.863 92.199 1.00 48.15 N ATOM 2065 CA LEU A 242 21.519 12.429 92.012 1.00 47.97 C ATOM 2066 C LEU A 242 20.580 12.175 93.223 1.00 54.92 C ATOM 2067 O LEU A 242 19.783 13.052 93.555 1.00 55.99 O ATOM 2068 CB LEU A 242 20.910 11.865 90.725 1.00 47.01 C ATOM 2069 CG LEU A 242 21.040 12.758 89.504 1.00 50.38 C ATOM 2070 CD1 LEU A 242 22.428 12.751 88.954 1.00 51.40 C ATOM 2071 CD2 LEU A 242 20.140 12.332 88.441 1.00 50.36 C ATOM 2072 H LEU A 242 23.201 11.193 91.485 1.00 0.00 H ATOM 2073 N ALA A 243 20.706 11.007 93.890 1.00 51.47 N ATOM 2074 CA ALA A 243 19.907 10.647 95.063 1.00 53.83 C ATOM 2075 C ALA A 243 20.423 11.355 96.307 1.00 77.57 C ATOM 2076 O ALA A 243 19.596 11.961 97.005 1.00 82.63 O ATOM 2077 CB ALA A 243 19.930 9.140 95.276 1.00 54.31 C ATOM 2078 OXT ALA A 243 21.645 11.332 96.575 1.00 99.89 O ATOM 2079 H ALA A 243 21.412 10.323 93.550 1.00 0.00 H TER 2080 ALA A 243 HETATM 2081 O HOH 1 31.328 30.880 72.677 1.00 29.48 O HETATM 2082 O HOH 2 31.438 -1.474 82.072 1.00 31.16 O HETATM 2083 O HOH 3 16.357 11.868 82.336 1.00 37.79 O HETATM 2084 O HOH 4 36.682 5.136 81.333 1.00 28.05 O HETATM 2085 O HOH 5 34.081 26.719 57.693 1.00 35.27 O HETATM 2086 O HOH 6 28.938 32.578 82.268 1.00 35.87 O HETATM 2087 O HOH 7 46.645 18.753 76.465 1.00 32.88 O HETATM 2088 O HOH 8 19.031 9.096 67.939 1.00 26.98 O HETATM 2089 O HOH 9 17.858 13.803 70.185 1.00 27.41 O HETATM 2090 O HOH 10 42.346 14.368 90.551 1.00 45.37 O HETATM 2091 O HOH 11 39.649 15.744 87.510 1.00 31.47 O HETATM 2092 O HOH 12 40.429 -2.528 76.152 1.00 36.65 O HETATM 2093 O HOH 13 20.860 31.350 89.075 1.00 46.40 O HETATM 2094 O HOH 14 38.194 30.515 60.286 1.00 31.20 O HETATM 2095 O HOH 15 31.324 0.777 70.905 1.00 27.45 O HETATM 2096 O HOH 16 31.040 32.746 63.552 1.00 39.34 O HETATM 2097 O HOH 17 27.150 38.998 69.068 1.00 15.92 O HETATM 2098 O2 J A 55 38.893 23.734 75.477 1.00 -0.38 O HETATM 2099 C2 J A 55 37.693 23.673 75.759 1.00 0.24 C HETATM 2100 N1 J A 55 36.732 24.446 75.197 1.00 -0.22 N HETATM 2101 C1 J A 55 36.860 25.348 74.131 1.00 0.14 C HETATM 2102 N J A 55 35.728 25.515 73.435 1.00 -0.27 N HETATM 2103 C J A 55 35.790 26.315 72.379 1.00 0.07 C HETATM 2104 C17 J A 55 36.918 26.987 71.945 1.00 -0.04 C HETATM 2105 C16 J A 55 38.067 26.815 72.694 1.00 -0.06 C HETATM 2106 C15 J A 55 38.056 25.992 73.805 1.00 -0.01 C HETATM 2107 H2 J A 55 38.948 25.851 74.405 1.00 0.06 H HETATM 2108 H3 J A 55 38.979 27.327 72.409 1.00 0.07 H HETATM 2109 H4 J A 55 36.902 27.616 71.063 1.00 0.06 H HETATM 2110 BR J A 55 34.161 26.536 71.402 1.00 -0.02 BR HETATM 2111 H1 J A 55 35.817 24.363 75.592 1.00 0.23 H HETATM 2112 C3 J A 55 37.114 22.660 76.802 1.00 0.19 C HETATM 2113 N2 J A 55 37.870 21.365 76.684 1.00 -0.24 N HETATM 2114 C5 J A 55 38.467 20.970 77.972 1.00 0.05 C HETATM 2115 C4 J A 55 38.860 22.219 78.696 1.00 0.02 C HETATM 2116 S J A 55 37.403 23.270 78.489 1.00 -0.11 S HETATM 2117 H8 J A 55 39.749 22.679 78.240 1.00 0.04 H HETATM 2118 H9 J A 55 39.056 22.017 79.759 1.00 0.04 H HETATM 2119 H6 J A 55 39.354 20.344 77.797 1.00 0.05 H HETATM 2120 H7 J A 55 37.733 20.407 78.568 1.00 0.05 H HETATM 2121 C6 J A 55 38.040 20.693 75.518 1.00 0.21 C HETATM 2122 O1 J A 55 37.455 21.017 74.494 1.00 -0.39 O HETATM 2123 C7 J A 55 38.988 19.493 75.535 1.00 0.16 C HETATM 2124 N3 J A 55 39.017 18.895 74.222 1.00 -0.16 N HETATM 2125 C11 J A 55 39.855 19.190 73.205 1.00 0.17 C HETATM 2126 N6 J A 55 40.911 20.010 73.141 1.00 -0.28 N HETATM 2127 C12 J A 55 41.535 20.056 71.956 1.00 0.00 C HETATM 2128 C13 J A 55 41.139 19.328 70.847 1.00 -0.04 C HETATM 2129 C14 J A 55 40.043 18.482 70.948 1.00 -0.04 C HETATM 2130 C10 J A 55 39.360 18.383 72.160 1.00 0.05 C HETATM 2131 C8 J A 55 38.233 17.613 72.633 1.00 0.14 C HETATM 2132 N4 J A 55 38.074 17.973 73.904 1.00 -0.16 N HETATM 2133 C9 J A 55 37.451 16.630 71.905 1.00 0.21 C HETATM 2134 O J A 55 37.559 16.511 70.674 1.00 -0.39 O HETATM 2135 N5 J A 55 36.628 15.887 72.639 1.00 -0.30 N HETATM 2136 H15 J A 55 36.059 15.190 72.202 1.00 0.18 H HETATM 2137 H16 J A 55 36.578 16.025 73.628 1.00 0.18 H HETATM 2138 H14 J A 55 39.720 17.902 70.091 1.00 0.07 H HETATM 2139 H13 J A 55 41.678 19.418 69.911 1.00 0.06 H HETATM 2140 H12 J A 55 42.401 20.701 71.860 1.00 0.08 H HETATM 2141 H10 J A 55 38.633 18.754 76.269 1.00 0.09 H HETATM 2142 H11 J A 55 39.999 19.827 75.810 1.00 0.09 H HETATM 2143 H5 J A 55 36.039 22.505 76.625 1.00 0.09 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 234 233 368 CONECT 368 234 367 CONECT 1102 1101 1724 CONECT 1389 1388 1555 CONECT 1555 1389 1554 CONECT 1648 1647 1844 CONECT 1724 1102 1723 CONECT 1844 1648 1843 CONECT 2098 2099 CONECT 2099 2098 2100 2112 CONECT 2100 2099 2101 2111 CONECT 2101 2100 2102 2106 CONECT 2102 2101 2103 CONECT 2103 2102 2104 2110 CONECT 2104 2103 2105 2109 CONECT 2105 2104 2106 2108 CONECT 2106 2101 2105 2107 CONECT 2107 2106 CONECT 2108 2105 CONECT 2109 2104 CONECT 2110 2103 CONECT 2111 2100 CONECT 2112 2099 2113 2116 2143 CONECT 2113 2112 2114 2121 CONECT 2114 2113 2115 2119 2120 CONECT 2115 2114 2116 2117 2118 CONECT 2116 2112 2115 CONECT 2117 2115 CONECT 2118 2115 CONECT 2119 2114 CONECT 2120 2114 CONECT 2121 2113 2122 2123 CONECT 2122 2121 CONECT 2123 2121 2124 2141 2142 CONECT 2124 2123 2125 2132 CONECT 2125 2124 2126 2130 CONECT 2126 2125 2127 CONECT 2127 2126 2128 2140 CONECT 2128 2127 2129 2139 CONECT 2129 2128 2130 2138 CONECT 2130 2125 2129 2131 CONECT 2131 2130 2132 2133 CONECT 2132 2124 2131 CONECT 2133 2131 2134 2135 CONECT 2134 2133 CONECT 2135 2133 2136 2137 CONECT 2136 2135 CONECT 2137 2135 CONECT 2138 2129 CONECT 2139 2128 CONECT 2140 2127 CONECT 2141 2123 CONECT 2142 2123 CONECT 2143 2112 MASTER 0 0 0 0 0 0 0 0 2142 1 58 18 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5tca
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1bio
RCSB PDB
PDBbind
228aa, >1BIO_1|Chain... at 100%
5fbe
RCSB PDB
PDBbind
232aa, >5FBE_1|Chain... at 99%
5fbi
RCSB PDB
PDBbind
232aa, >5FBI_1|Chain... at 99%
5fck
RCSB PDB
PDBbind
232aa, >5FCK_1|Chain... at 99%
5mt0
RCSB PDB
PDBbind
232aa, >5MT0_1|Chain... at 99%
5mt4
RCSB PDB
PDBbind
232aa, >5MT4_1|Chain... at 99%
5nar
RCSB PDB
PDBbind
232aa, >5NAR_1|Chain... at 99%
5naw
RCSB PDB
PDBbind
232aa, >5NAW_1|Chain... at 99%
5nb6
RCSB PDB
PDBbind
232aa, >5NB6_1|Chain... at 99%
5nb7
RCSB PDB
PDBbind
230aa, >5NB7_1|Chain... at 100%
5nba
RCSB PDB
PDBbind
230aa, >5NBA_1|Chain... at 100%
5tcc
RCSB PDB
PDBbind
228aa, >5TCC_1|Chains... at 100%
6fty
RCSB PDB
PDBbind
232aa, >6FTY_1|Chain... at 99%
6ftz
RCSB PDB
PDBbind
232aa, >6FTZ_1|Chain... at 99%
6fug
RCSB PDB
PDBbind
232aa, >6FUG_1|Chains... at 99%
6fuh
RCSB PDB
PDBbind
232aa, >6FUH_1|Chain... at 99%
6fui
RCSB PDB
PDBbind
232aa, >6FUI_1|Chain... at 99%
6fuj
RCSB PDB
PDBbind
232aa, >6FUJ_1|Chains... at 99%
6fut
RCSB PDB
PDBbind
232aa, >6FUT_1|Chain... at 99%
6qmt
RCSB PDB
PDBbind
254aa, >6QMT_1|Chains... at 100%
6qmr
RCSB PDB
PDBbind
254aa, >6QMR_1|Chains... *
5nat
RCSB PDB
PDBbind
232aa, >5NAT_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5tca
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Complement factor D
Ligand Name
J55
EC.Number
E.C.3.4.21.46
Resolution
3.15(Å)
Affinity (Kd/Ki/IC50)
Kd=18.85nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) ACS Med Chem Lett Vol. 7: pp. 1092-1096
Ligand Properties
Formula
C
1
8
H
1
6
BrN
7
O
3
S
Molecular Weight
490.334
Exact Mass
489.022
No. of atoms
46
No. of bonds
49
Polar Surface Area
161.4
LOGP Value
1.42 (
Computed with XLOGP3
)
1.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 4
Canonical SMILES
O=C([C@@H]1SCCN1C(=O)Cn1nc(c2c1nccc2)C(=O)N)Nc1cccc(n1)Br
InChI String
InChI=1S/C18H16BrN7O3S/c19-11-4-1-5-12(22-11)23-17(29)18-25(7-8-30-18)13(27)9-26-16-10(3-2-6-21-16)14(24-26)15(20)28/h1-6,18H,7-9H2,(H2,20,28)(H,22,23,29)/t18-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00746
Entrez Gene ID
NCBI Entrez Gene ID:
1675
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓