Browse entries in the PDBbind-CN Database
HEADER 3P8O_COMPLEX COMPND 3P8O_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 182 ALA PRO ILE THR ALA TYR SER GLN GLN THR ARG GLY LEU SEQRES 2 A 182 LEU GLY CYS ILE ILE THR SER LEU THR GLY ARG ASP LYS SEQRES 3 A 182 ASN GLN VAL ASP GLY GLU VAL GLN VAL LEU SER THR ALA SEQRES 4 A 182 THR GLN SER PHE LEU ALA THR CYS VAL ASN GLY VAL CYS SEQRES 5 A 182 TRP THR VAL TYR HIS GLY ALA GLY SER LYS THR LEU ALA SEQRES 6 A 182 GLY PRO LYS GLY PRO ILE THR GLN MET TYR THR ASN VAL SEQRES 7 A 182 ASP GLN ASP LEU VAL GLY TRP PRO ALA PRO PRO GLY ALA SEQRES 8 A 182 ARG SER MET THR PRO CYS THR CYS GLY SER SER ASP LEU SEQRES 9 A 182 TYR LEU VAL THR ARG HIS ALA ASP VAL ILE PRO VAL ARG SEQRES 10 A 182 ARG ARG GLY ASP SER ARG GLY SER LEU LEU SER PRO ARG SEQRES 11 A 182 PRO VAL SER TYR LEU LYS GLY SER SER GLY GLY PRO LEU SEQRES 12 A 182 LEU CYS PRO SER GLY HIS VAL VAL GLY ILE PHE ARG ALA SEQRES 13 A 182 ALA VAL CYS THR ARG GLY VAL ALA LYS ALA VAL ASP PHE SEQRES 14 A 182 ILE PRO VAL GLU SER MET GLU THR THR MET ARG ALA SER HET NA A 1 1 HET L A 5T 105 SSBOND 1 CYS A 97 CYS A 145 ATOM 1 N ALA A 1 66.103 39.464 7.380 1.00 75.33 N ATOM 2 CA ALA A 1 65.503 39.967 6.106 1.00 75.78 C ATOM 3 C ALA A 1 66.592 40.550 5.189 1.00 75.67 C ATOM 4 O ALA A 1 67.441 41.340 5.633 1.00 76.65 O ATOM 5 CB ALA A 1 64.446 41.034 6.420 1.00 74.88 C ATOM 6 HA ALA A 1 65.029 39.134 5.586 1.00 0.00 H ATOM 7 HB1 ALA A 1 63.664 40.597 7.041 1.00 0.00 H ATOM 8 HB2 ALA A 1 64.914 41.862 6.952 1.00 0.00 H ATOM 9 HB3 ALA A 1 64.011 41.398 5.489 1.00 0.00 H ATOM 10 HN3 ALA A 1 66.575 40.249 7.873 1.00 0.00 H ATOM 11 HN2 ALA A 1 66.797 38.720 7.165 1.00 0.00 H ATOM 12 HN1 ALA A 1 65.352 39.075 7.985 1.00 0.00 H ATOM 13 N PRO A 2 66.585 40.166 3.894 1.00 73.99 N ATOM 14 CA PRO A 2 67.559 40.679 2.911 1.00 71.00 C ATOM 15 C PRO A 2 67.297 42.137 2.530 1.00 67.42 C ATOM 16 O PRO A 2 68.217 42.883 2.191 1.00 68.02 O ATOM 17 CB PRO A 2 67.391 39.740 1.709 1.00 73.21 C ATOM 18 CG PRO A 2 65.992 39.229 1.825 1.00 73.04 C ATOM 19 CD PRO A 2 65.691 39.149 3.306 1.00 74.00 C ATOM 20 HA PRO A 2 68.575 40.686 3.307 1.00 0.00 H ATOM 21 HD3 PRO A 2 64.646 39.386 3.505 1.00 0.00 H ATOM 22 HD2 PRO A 2 65.918 38.157 3.697 1.00 0.00 H ATOM 23 HG3 PRO A 2 65.911 38.242 1.369 1.00 0.00 H ATOM 24 HG2 PRO A 2 65.298 39.912 1.335 1.00 0.00 H ATOM 25 HB2 PRO A 2 67.527 40.283 0.774 1.00 0.00 H ATOM 26 HB3 PRO A 2 68.106 38.919 1.758 1.00 0.00 H ATOM 27 N ILE A 3 66.030 42.528 2.595 1.00 62.58 N ATOM 28 CA ILE A 3 65.578 43.815 2.083 1.00 57.19 C ATOM 29 C ILE A 3 65.592 44.881 3.174 1.00 53.53 C ATOM 30 O ILE A 3 65.211 44.618 4.307 1.00 54.39 O ATOM 31 CB ILE A 3 64.150 43.671 1.498 1.00 57.04 C ATOM 32 CG1 ILE A 3 64.196 42.751 0.270 1.00 57.19 C ATOM 33 CG2 ILE A 3 63.591 45.022 1.111 1.00 55.74 C ATOM 34 CD1 ILE A 3 62.928 41.964 0.044 1.00 55.68 C ATOM 35 HA ILE A 3 66.264 44.131 1.297 1.00 0.00 H ATOM 36 HB ILE A 3 63.499 43.238 2.257 1.00 0.00 H ATOM 37 HG12 ILE A 3 64.380 43.365 -0.612 1.00 0.00 H ATOM 38 HG13 ILE A 3 65.018 42.047 0.399 1.00 0.00 H ATOM 39 HD11 ILE A 3 62.734 41.334 0.912 1.00 0.00 H ATOM 40 HD12 ILE A 3 62.095 42.653 -0.100 1.00 0.00 H ATOM 41 HD13 ILE A 3 63.043 41.340 -0.842 1.00 0.00 H ATOM 42 HG21 ILE A 3 63.548 45.662 1.992 1.00 0.00 H ATOM 43 HG22 ILE A 3 64.235 45.479 0.360 1.00 0.00 H ATOM 44 HG23 ILE A 3 62.588 44.896 0.703 1.00 0.00 H ATOM 45 H ILE A 3 65.332 41.890 3.029 1.00 0.00 H ATOM 46 N THR A 4 66.055 46.078 2.838 1.00 48.94 N ATOM 47 CA THR A 4 66.020 47.193 3.776 1.00 47.82 C ATOM 48 C THR A 4 65.340 48.419 3.163 1.00 44.85 C ATOM 49 O THR A 4 65.098 48.469 1.959 1.00 43.43 O ATOM 50 CB THR A 4 67.448 47.583 4.239 1.00 48.17 C ATOM 51 OG1 THR A 4 68.281 47.824 3.100 1.00 47.23 O ATOM 52 CG2 THR A 4 68.052 46.459 5.077 1.00 48.90 C ATOM 53 HA THR A 4 65.442 46.860 4.638 1.00 0.00 H ATOM 54 HB THR A 4 67.385 48.489 4.842 1.00 0.00 H ATOM 55 HG1 THR A 4 69.190 48.072 3.404 1.00 0.00 H ATOM 56 HG23 THR A 4 67.419 46.274 5.945 1.00 0.00 H ATOM 57 HG21 THR A 4 68.118 45.553 4.474 1.00 0.00 H ATOM 58 HG22 THR A 4 69.049 46.750 5.408 1.00 0.00 H ATOM 59 H THR A 4 66.450 46.224 1.887 1.00 0.00 H ATOM 60 N ALA A 5 65.041 49.409 3.998 1.00 42.52 N ATOM 61 CA ALA A 5 64.294 50.580 3.548 1.00 40.73 C ATOM 62 C ALA A 5 64.510 51.805 4.456 1.00 38.80 C ATOM 63 O ALA A 5 64.734 51.677 5.655 1.00 35.54 O ATOM 64 CB ALA A 5 62.785 50.229 3.492 1.00 38.06 C ATOM 65 HA ALA A 5 64.663 50.848 2.558 1.00 0.00 H ATOM 66 HB1 ALA A 5 62.631 49.405 2.795 1.00 0.00 H ATOM 67 HB2 ALA A 5 62.444 49.936 4.485 1.00 0.00 H ATOM 68 HB3 ALA A 5 62.223 51.100 3.156 1.00 0.00 H ATOM 69 H ALA A 5 65.345 49.348 4.991 1.00 0.00 H ATOM 70 N TYR A 6 64.398 52.999 3.884 1.00 40.85 N ATOM 71 CA TYR A 6 64.327 54.211 4.691 1.00 41.44 C ATOM 72 C TYR A 6 63.340 55.174 4.055 1.00 41.74 C ATOM 73 O TYR A 6 63.030 55.051 2.860 1.00 41.39 O ATOM 74 CB TYR A 6 65.713 54.854 4.811 1.00 42.14 C ATOM 75 CG TYR A 6 66.339 55.249 3.490 1.00 43.49 C ATOM 76 CD1 TYR A 6 67.182 54.377 2.791 1.00 42.76 C ATOM 77 CD2 TYR A 6 66.106 56.510 2.952 1.00 42.45 C ATOM 78 CE1 TYR A 6 67.777 54.773 1.588 1.00 44.36 C ATOM 79 CE2 TYR A 6 66.684 56.907 1.772 1.00 43.45 C ATOM 80 CZ TYR A 6 67.516 56.048 1.094 1.00 44.85 C ATOM 81 OH TYR A 6 68.088 56.507 -0.067 1.00 47.65 O ATOM 82 HA TYR A 6 63.986 53.961 5.696 1.00 0.00 H ATOM 83 HB3 TYR A 6 66.377 54.143 5.304 1.00 0.00 H ATOM 84 HB2 TYR A 6 65.621 55.749 5.426 1.00 0.00 H ATOM 85 HD2 TYR A 6 65.448 57.200 3.480 1.00 0.00 H ATOM 86 HE2 TYR A 6 66.484 57.901 1.373 1.00 0.00 H ATOM 87 HE1 TYR A 6 68.435 54.094 1.046 1.00 0.00 H ATOM 88 HD1 TYR A 6 67.377 53.380 3.187 1.00 0.00 H ATOM 89 HH TYR A 6 68.660 55.798 -0.455 1.00 0.00 H ATOM 90 H TYR A 6 64.360 53.070 2.847 1.00 0.00 H ATOM 91 N SER A 7 62.816 56.107 4.851 1.00 40.56 N ATOM 92 CA SER A 7 61.882 57.082 4.318 1.00 40.62 C ATOM 93 C SER A 7 62.469 58.484 4.244 1.00 41.28 C ATOM 94 O SER A 7 63.430 58.817 4.950 1.00 41.68 O ATOM 95 CB SER A 7 60.587 57.117 5.147 1.00 39.40 C ATOM 96 OG SER A 7 60.856 57.360 6.511 1.00 44.03 O ATOM 97 HA SER A 7 61.660 56.759 3.301 1.00 0.00 H ATOM 98 HB2 SER A 7 60.078 56.158 5.051 1.00 0.00 H ATOM 99 HB3 SER A 7 59.943 57.909 4.766 1.00 0.00 H ATOM 100 HG SER A 7 60.005 57.377 7.016 1.00 0.00 H ATOM 101 H SER A 7 63.077 56.136 5.857 1.00 0.00 H ATOM 102 N GLN A 8 61.881 59.288 3.364 1.00 38.91 N ATOM 103 CA GLN A 8 62.157 60.715 3.251 1.00 38.73 C ATOM 104 C GLN A 8 60.827 61.467 3.130 1.00 39.22 C ATOM 105 O GLN A 8 60.055 61.211 2.204 1.00 36.20 O ATOM 106 CB GLN A 8 63.011 60.988 2.006 1.00 37.07 C ATOM 107 CG GLN A 8 64.404 60.435 2.140 1.00 37.42 C ATOM 108 CD GLN A 8 65.230 60.561 0.889 1.00 40.02 C ATOM 109 OE1 GLN A 8 66.462 60.616 0.958 1.00 42.06 O ATOM 110 NE2 GLN A 8 64.569 60.599 -0.268 1.00 40.58 N ATOM 111 HA GLN A 8 62.700 61.052 4.134 1.00 0.00 H ATOM 112 HB2 GLN A 8 62.531 60.527 1.143 1.00 0.00 H ATOM 113 HB3 GLN A 8 63.074 62.065 1.852 1.00 0.00 H ATOM 114 HG2 GLN A 8 64.911 60.971 2.942 1.00 0.00 H ATOM 115 HG3 GLN A 8 64.331 59.379 2.399 1.00 0.00 H ATOM 116 HE22 GLN A 8 63.530 60.550 -0.275 1.00 0.00 H ATOM 117 HE21 GLN A 8 65.092 60.678 -1.163 1.00 0.00 H ATOM 118 H GLN A 8 61.181 58.874 2.716 1.00 0.00 H ATOM 119 N GLN A 9 60.568 62.385 4.061 1.00 39.58 N ATOM 120 CA GLN A 9 59.381 63.236 3.973 1.00 42.53 C ATOM 121 C GLN A 9 59.562 64.339 2.945 1.00 42.46 C ATOM 122 O GLN A 9 60.682 64.738 2.650 1.00 40.56 O ATOM 123 CB GLN A 9 59.058 63.838 5.332 1.00 42.73 C ATOM 124 CG GLN A 9 58.587 62.803 6.310 1.00 46.30 C ATOM 125 CD GLN A 9 58.414 63.362 7.704 1.00 50.58 C ATOM 126 OE1 GLN A 9 57.691 64.362 7.911 1.00 53.52 O ATOM 127 NE2 GLN A 9 59.080 62.726 8.685 1.00 47.14 N ATOM 128 HA GLN A 9 58.549 62.610 3.652 1.00 0.00 H ATOM 129 HB2 GLN A 9 59.955 64.314 5.728 1.00 0.00 H ATOM 130 HB3 GLN A 9 58.276 64.587 5.208 1.00 0.00 H ATOM 131 HG2 GLN A 9 57.629 62.409 5.969 1.00 0.00 H ATOM 132 HG3 GLN A 9 59.318 61.996 6.345 1.00 0.00 H ATOM 133 HE22 GLN A 9 59.669 61.898 8.462 1.00 0.00 H ATOM 134 HE21 GLN A 9 59.006 63.062 9.666 1.00 0.00 H ATOM 135 H GLN A 9 61.220 62.498 4.863 1.00 0.00 H ATOM 136 N THR A 10 58.455 64.812 2.380 1.00 45.56 N ATOM 137 CA THR A 10 58.521 65.799 1.308 1.00 47.24 C ATOM 138 C THR A 10 57.699 67.044 1.618 1.00 49.28 C ATOM 139 O THR A 10 57.996 68.134 1.118 1.00 49.66 O ATOM 140 CB THR A 10 58.021 65.218 -0.031 1.00 48.72 C ATOM 141 OG1 THR A 10 56.671 64.737 0.115 1.00 49.39 O ATOM 142 CG2 THR A 10 58.924 64.082 -0.491 1.00 47.16 C ATOM 143 HA THR A 10 59.573 66.072 1.226 1.00 0.00 H ATOM 144 HB THR A 10 58.043 66.009 -0.781 1.00 0.00 H ATOM 145 HG1 THR A 10 56.359 64.366 -0.748 1.00 0.00 H ATOM 146 HG23 THR A 10 59.944 64.451 -0.600 1.00 0.00 H ATOM 147 HG21 THR A 10 58.903 63.281 0.248 1.00 0.00 H ATOM 148 HG22 THR A 10 58.569 63.703 -1.449 1.00 0.00 H ATOM 149 H THR A 10 57.528 64.473 2.707 1.00 0.00 H ATOM 150 N ARG A 11 56.664 66.874 2.436 1.00 51.09 N ATOM 151 CA ARG A 11 55.716 67.947 2.720 1.00 54.24 C ATOM 152 C ARG A 11 55.357 67.979 4.198 1.00 56.28 C ATOM 153 O ARG A 11 55.456 66.963 4.892 1.00 55.79 O ATOM 154 CB ARG A 11 54.419 67.750 1.927 1.00 54.08 C ATOM 155 CG ARG A 11 54.586 67.689 0.442 1.00 54.56 C ATOM 156 CD ARG A 11 53.249 67.858 -0.277 1.00 53.77 C ATOM 157 NE ARG A 11 53.461 68.355 -1.623 1.00 51.69 N ATOM 158 CZ ARG A 11 53.678 69.633 -1.903 1.00 54.03 C ATOM 159 NH1 ARG A 11 53.698 70.527 -0.924 1.00 57.28 N ATOM 160 NH2 ARG A 11 53.908 70.018 -3.149 1.00 51.72 N ATOM 161 HA ARG A 11 56.196 68.882 2.432 1.00 0.00 H ATOM 162 HB2 ARG A 11 53.961 66.816 2.254 1.00 0.00 H ATOM 163 HB3 ARG A 11 53.752 68.581 2.158 1.00 0.00 H ATOM 164 HG2 ARG A 11 55.261 68.485 0.128 1.00 0.00 H ATOM 165 HG3 ARG A 11 55.014 66.724 0.172 1.00 0.00 H ATOM 166 HD2 ARG A 11 52.630 68.566 0.275 1.00 0.00 H ATOM 167 HD3 ARG A 11 52.742 66.894 -0.325 1.00 0.00 H ATOM 168 HE ARG A 11 53.442 67.674 -2.409 1.00 0.00 H ATOM 169 HH12 ARG A 11 53.868 71.530 -1.139 1.00 0.00 H ATOM 170 HH11 ARG A 11 53.544 70.225 0.059 1.00 0.00 H ATOM 171 HH22 ARG A 11 54.077 71.022 -3.360 1.00 0.00 H ATOM 172 HH21 ARG A 11 53.919 69.316 -3.916 1.00 0.00 H ATOM 173 H ARG A 11 56.526 65.947 2.887 1.00 0.00 H ATOM 174 N GLY A 12 54.911 69.146 4.659 1.00 58.40 N ATOM 175 CA GLY A 12 54.369 69.268 5.997 1.00 62.21 C ATOM 176 C GLY A 12 52.853 69.290 5.971 1.00 64.68 C ATOM 177 O GLY A 12 52.247 69.063 4.925 1.00 64.90 O ATOM 178 HA3 GLY A 12 54.731 70.193 6.445 1.00 0.00 H ATOM 179 HA2 GLY A 12 54.703 68.420 6.596 1.00 0.00 H ATOM 180 H GLY A 12 54.953 69.986 4.047 1.00 0.00 H ATOM 181 N LEU A 13 52.239 69.564 7.118 1.00 67.29 N ATOM 182 CA LEU A 13 50.786 69.496 7.251 1.00 69.07 C ATOM 183 C LEU A 13 50.110 70.631 6.490 1.00 70.14 C ATOM 184 O LEU A 13 48.957 70.518 6.071 1.00 70.32 O ATOM 185 CB LEU A 13 50.398 69.561 8.729 1.00 70.32 C ATOM 186 CG LEU A 13 48.906 69.491 9.063 1.00 71.85 C ATOM 187 CD1 LEU A 13 48.722 68.827 10.434 1.00 72.07 C ATOM 188 CD2 LEU A 13 48.302 70.888 9.052 1.00 72.25 C ATOM 189 HA LEU A 13 50.449 68.551 6.825 1.00 0.00 H ATOM 190 HB2 LEU A 13 50.887 68.728 9.234 1.00 0.00 H ATOM 191 HB3 LEU A 13 50.780 70.501 9.128 1.00 0.00 H ATOM 192 HG LEU A 13 48.390 68.894 8.311 1.00 0.00 H ATOM 193 HD21 LEU A 13 48.807 71.507 9.794 1.00 0.00 H ATOM 194 HD22 LEU A 13 48.428 71.329 8.063 1.00 0.00 H ATOM 195 HD23 LEU A 13 47.240 70.825 9.291 1.00 0.00 H ATOM 196 HD11 LEU A 13 49.138 67.820 10.407 1.00 0.00 H ATOM 197 HD12 LEU A 13 49.239 69.414 11.193 1.00 0.00 H ATOM 198 HD13 LEU A 13 47.660 68.777 10.672 1.00 0.00 H ATOM 199 H LEU A 13 52.810 69.835 7.944 1.00 0.00 H ATOM 200 N LEU A 14 50.839 71.724 6.306 1.00 70.38 N ATOM 201 CA LEU A 14 50.274 72.919 5.702 1.00 70.33 C ATOM 202 C LEU A 14 50.346 72.827 4.186 1.00 69.31 C ATOM 203 O LEU A 14 49.333 72.943 3.503 1.00 70.21 O ATOM 204 CB LEU A 14 51.036 74.157 6.187 1.00 71.47 C ATOM 205 CG LEU A 14 50.189 75.363 6.606 1.00 72.22 C ATOM 206 CD1 LEU A 14 49.477 75.938 5.390 1.00 72.01 C ATOM 207 CD2 LEU A 14 49.185 74.931 7.671 1.00 71.68 C ATOM 208 HA LEU A 14 49.229 73.003 5.999 1.00 0.00 H ATOM 209 HB2 LEU A 14 51.637 73.860 7.046 1.00 0.00 H ATOM 210 HB3 LEU A 14 51.693 74.479 5.379 1.00 0.00 H ATOM 211 HG LEU A 14 50.830 76.138 7.025 1.00 0.00 H ATOM 212 HD21 LEU A 14 48.538 74.154 7.264 1.00 0.00 H ATOM 213 HD22 LEU A 14 49.721 74.543 8.537 1.00 0.00 H ATOM 214 HD23 LEU A 14 48.582 75.789 7.969 1.00 0.00 H ATOM 215 HD11 LEU A 14 50.216 76.253 4.653 1.00 0.00 H ATOM 216 HD12 LEU A 14 48.831 75.176 4.955 1.00 0.00 H ATOM 217 HD13 LEU A 14 48.876 76.795 5.694 1.00 0.00 H ATOM 218 H LEU A 14 51.836 71.726 6.600 1.00 0.00 H ATOM 219 N GLY A 15 51.549 72.611 3.664 1.00 68.48 N ATOM 220 CA GLY A 15 51.708 72.435 2.232 1.00 66.88 C ATOM 221 C GLY A 15 50.908 71.269 1.673 1.00 66.11 C ATOM 222 O GLY A 15 50.724 71.173 0.462 1.00 65.71 O ATOM 223 HA3 GLY A 15 52.763 72.263 2.020 1.00 0.00 H ATOM 224 HA2 GLY A 15 51.383 73.348 1.733 1.00 0.00 H ATOM 225 H GLY A 15 52.382 72.568 4.286 1.00 0.00 H ATOM 226 N CYS A 16 50.435 70.384 2.549 1.00 65.18 N ATOM 227 CA CYS A 16 49.630 69.232 2.142 1.00 64.53 C ATOM 228 C CYS A 16 48.172 69.627 1.951 1.00 64.12 C ATOM 229 O CYS A 16 47.542 69.251 0.966 1.00 64.28 O ATOM 230 CB CYS A 16 49.714 68.121 3.193 1.00 65.22 C ATOM 231 SG CYS A 16 48.484 66.789 2.985 1.00 62.35 S ATOM 232 HA CYS A 16 50.028 68.869 1.194 1.00 0.00 H ATOM 233 HB2 CYS A 16 49.568 68.570 4.176 1.00 0.00 H ATOM 234 HB3 CYS A 16 50.708 67.678 3.142 1.00 0.00 H ATOM 235 HG CYS A 16 48.653 65.849 3.982 1.00 0.00 H ATOM 236 H CYS A 16 50.646 70.517 3.559 1.00 0.00 H ATOM 237 N ILE A 17 47.641 70.384 2.906 1.00 63.96 N ATOM 238 CA ILE A 17 46.339 71.020 2.746 1.00 63.31 C ATOM 239 C ILE A 17 46.283 71.851 1.468 1.00 62.69 C ATOM 240 O ILE A 17 45.350 71.718 0.671 1.00 62.09 O ATOM 241 CB ILE A 17 46.012 71.923 3.945 1.00 64.24 C ATOM 242 CG1 ILE A 17 45.686 71.054 5.167 1.00 63.73 C ATOM 243 CG2 ILE A 17 44.861 72.862 3.587 1.00 64.48 C ATOM 244 CD1 ILE A 17 45.315 71.844 6.410 1.00 63.71 C ATOM 245 HA ILE A 17 45.600 70.221 2.686 1.00 0.00 H ATOM 246 HB ILE A 17 46.874 72.541 4.195 1.00 0.00 H ATOM 247 HG12 ILE A 17 44.849 70.404 4.912 1.00 0.00 H ATOM 248 HG13 ILE A 17 46.560 70.445 5.397 1.00 0.00 H ATOM 249 HD11 ILE A 17 46.146 72.491 6.689 1.00 0.00 H ATOM 250 HD12 ILE A 17 44.434 72.451 6.203 1.00 0.00 H ATOM 251 HD13 ILE A 17 45.100 71.155 7.226 1.00 0.00 H ATOM 252 HG21 ILE A 17 45.149 73.481 2.737 1.00 0.00 H ATOM 253 HG22 ILE A 17 43.981 72.274 3.328 1.00 0.00 H ATOM 254 HG23 ILE A 17 44.634 73.499 4.442 1.00 0.00 H ATOM 255 H ILE A 17 48.168 70.526 3.791 1.00 0.00 H ATOM 256 N ILE A 18 47.295 72.688 1.264 1.00 61.12 N ATOM 257 CA ILE A 18 47.389 73.483 0.049 1.00 59.69 C ATOM 258 C ILE A 18 47.356 72.602 -1.196 1.00 58.59 C ATOM 259 O ILE A 18 46.537 72.805 -2.091 1.00 58.54 O ATOM 260 CB ILE A 18 48.690 74.318 0.030 1.00 61.01 C ATOM 261 CG1 ILE A 18 48.651 75.361 1.149 1.00 60.89 C ATOM 262 CG2 ILE A 18 48.870 74.983 -1.337 1.00 60.02 C ATOM 263 CD1 ILE A 18 49.872 76.263 1.195 1.00 62.83 C ATOM 264 HA ILE A 18 46.527 74.150 0.041 1.00 0.00 H ATOM 265 HB ILE A 18 49.544 73.662 0.200 1.00 0.00 H ATOM 266 HG12 ILE A 18 47.769 75.985 1.006 1.00 0.00 H ATOM 267 HG13 ILE A 18 48.574 74.839 2.103 1.00 0.00 H ATOM 268 HD11 ILE A 18 50.764 75.657 1.350 1.00 0.00 H ATOM 269 HD12 ILE A 18 49.958 76.804 0.253 1.00 0.00 H ATOM 270 HD13 ILE A 18 49.767 76.973 2.015 1.00 0.00 H ATOM 271 HG21 ILE A 18 48.926 74.215 -2.109 1.00 0.00 H ATOM 272 HG22 ILE A 18 48.022 75.638 -1.536 1.00 0.00 H ATOM 273 HG23 ILE A 18 49.790 75.568 -1.337 1.00 0.00 H ATOM 274 H ILE A 18 48.036 72.777 1.989 1.00 0.00 H ATOM 275 N THR A 19 48.251 71.624 -1.255 1.00 58.18 N ATOM 276 CA THR A 19 48.376 70.784 -2.442 1.00 56.85 C ATOM 277 C THR A 19 47.095 69.988 -2.668 1.00 55.80 C ATOM 278 O THR A 19 46.688 69.748 -3.801 1.00 54.65 O ATOM 279 CB THR A 19 49.550 69.804 -2.296 1.00 55.92 C ATOM 280 OG1 THR A 19 50.743 70.537 -1.976 1.00 56.34 O ATOM 281 CG2 THR A 19 49.769 69.035 -3.590 1.00 53.60 C ATOM 282 HA THR A 19 48.557 71.439 -3.294 1.00 0.00 H ATOM 283 HB THR A 19 49.318 69.096 -1.500 1.00 0.00 H ATOM 284 HG1 THR A 19 50.611 71.026 -1.125 1.00 0.00 H ATOM 285 HG23 THR A 19 48.866 68.477 -3.837 1.00 0.00 H ATOM 286 HG21 THR A 19 49.996 69.736 -4.394 1.00 0.00 H ATOM 287 HG22 THR A 19 50.602 68.343 -3.464 1.00 0.00 H ATOM 288 H THR A 19 48.875 71.453 -0.441 1.00 0.00 H ATOM 289 N SER A 20 46.458 69.597 -1.575 1.00 55.56 N ATOM 290 CA SER A 20 45.195 68.883 -1.639 1.00 55.24 C ATOM 291 C SER A 20 44.142 69.691 -2.410 1.00 56.28 C ATOM 292 O SER A 20 43.379 69.137 -3.207 1.00 55.18 O ATOM 293 CB SER A 20 44.716 68.601 -0.219 1.00 53.60 C ATOM 294 OG SER A 20 43.417 68.050 -0.221 1.00 53.50 O ATOM 295 HA SER A 20 45.342 67.944 -2.172 1.00 0.00 H ATOM 296 HB2 SER A 20 44.707 69.533 0.346 1.00 0.00 H ATOM 297 HB3 SER A 20 45.401 67.898 0.255 1.00 0.00 H ATOM 298 HG SER A 20 43.132 67.877 0.711 1.00 0.00 H ATOM 299 H SER A 20 46.874 69.807 -0.645 1.00 0.00 H ATOM 300 N LEU A 21 44.125 71.006 -2.180 1.00 56.95 N ATOM 301 CA LEU A 21 43.105 71.896 -2.740 1.00 55.82 C ATOM 302 C LEU A 21 43.397 72.346 -4.165 1.00 55.01 C ATOM 303 O LEU A 21 42.472 72.585 -4.949 1.00 54.98 O ATOM 304 CB LEU A 21 42.930 73.118 -1.844 1.00 56.99 C ATOM 305 CG LEU A 21 42.305 72.822 -0.483 1.00 58.83 C ATOM 306 CD1 LEU A 21 41.958 74.126 0.236 1.00 59.68 C ATOM 307 CD2 LEU A 21 41.045 71.991 -0.703 1.00 60.29 C ATOM 308 HA LEU A 21 42.184 71.314 -2.780 1.00 0.00 H ATOM 309 HB2 LEU A 21 43.911 73.562 -1.679 1.00 0.00 H ATOM 310 HB3 LEU A 21 42.292 73.833 -2.364 1.00 0.00 H ATOM 311 HG LEU A 21 43.012 72.271 0.138 1.00 0.00 H ATOM 312 HD21 LEU A 21 40.345 72.552 -1.322 1.00 0.00 H ATOM 313 HD22 LEU A 21 41.309 71.059 -1.204 1.00 0.00 H ATOM 314 HD23 LEU A 21 40.584 71.770 0.260 1.00 0.00 H ATOM 315 HD11 LEU A 21 42.865 74.712 0.380 1.00 0.00 H ATOM 316 HD12 LEU A 21 41.249 74.694 -0.366 1.00 0.00 H ATOM 317 HD13 LEU A 21 41.513 73.898 1.205 1.00 0.00 H ATOM 318 H LEU A 21 44.867 71.416 -1.578 1.00 0.00 H ATOM 319 N THR A 22 44.674 72.452 -4.511 1.00 53.84 N ATOM 320 CA THR A 22 45.042 72.852 -5.866 1.00 52.55 C ATOM 321 C THR A 22 45.186 71.641 -6.782 1.00 52.36 C ATOM 322 O THR A 22 45.095 71.763 -8.009 1.00 51.12 O ATOM 323 CB THR A 22 46.376 73.633 -5.891 1.00 53.12 C ATOM 324 OG1 THR A 22 47.476 72.721 -5.753 1.00 52.00 O ATOM 325 CG2 THR A 22 46.415 74.658 -4.760 1.00 51.09 C ATOM 326 HA THR A 22 44.237 73.495 -6.222 1.00 0.00 H ATOM 327 HB THR A 22 46.455 74.157 -6.844 1.00 0.00 H ATOM 328 HG1 THR A 22 48.327 73.227 -5.770 1.00 0.00 H ATOM 329 HG23 THR A 22 45.579 75.348 -4.868 1.00 0.00 H ATOM 330 HG21 THR A 22 46.341 74.143 -3.802 1.00 0.00 H ATOM 331 HG22 THR A 22 47.353 75.212 -4.805 1.00 0.00 H ATOM 332 H THR A 22 45.417 72.249 -3.812 1.00 0.00 H ATOM 333 N GLY A 23 45.434 70.479 -6.180 1.00 51.53 N ATOM 334 CA GLY A 23 45.678 69.267 -6.950 1.00 52.22 C ATOM 335 C GLY A 23 46.961 69.272 -7.759 1.00 52.22 C ATOM 336 O GLY A 23 47.127 68.470 -8.675 1.00 50.85 O ATOM 337 HA3 GLY A 23 44.844 69.129 -7.638 1.00 0.00 H ATOM 338 HA2 GLY A 23 45.718 68.427 -6.256 1.00 0.00 H ATOM 339 H GLY A 23 45.454 70.436 -5.141 1.00 0.00 H ATOM 340 N ARG A 24 47.875 70.179 -7.432 1.00 55.71 N ATOM 341 CA ARG A 24 49.078 70.367 -8.243 1.00 58.99 C ATOM 342 C ARG A 24 50.328 70.266 -7.371 1.00 59.73 C ATOM 343 O ARG A 24 50.535 71.067 -6.456 1.00 60.36 O ATOM 344 CB ARG A 24 49.025 71.732 -8.935 1.00 62.11 C ATOM 345 CG ARG A 24 49.877 71.840 -10.200 1.00 66.52 C ATOM 346 CD ARG A 24 49.570 73.132 -10.952 1.00 70.03 C ATOM 347 NE ARG A 24 49.952 73.071 -12.365 1.00 73.01 N ATOM 348 CZ ARG A 24 49.098 72.895 -13.373 1.00 74.75 C ATOM 349 NH1 ARG A 24 47.797 72.757 -13.128 1.00 74.53 N ATOM 350 NH2 ARG A 24 49.545 72.863 -14.628 1.00 74.60 N ATOM 351 HA ARG A 24 49.121 69.584 -9.000 1.00 0.00 H ATOM 352 HB2 ARG A 24 47.989 71.936 -9.205 1.00 0.00 H ATOM 353 HB3 ARG A 24 49.370 72.486 -8.227 1.00 0.00 H ATOM 354 HG2 ARG A 24 50.931 71.829 -9.923 1.00 0.00 H ATOM 355 HG3 ARG A 24 49.664 70.990 -10.848 1.00 0.00 H ATOM 356 HD2 ARG A 24 50.115 73.949 -10.479 1.00 0.00 H ATOM 357 HD3 ARG A 24 48.499 73.326 -10.888 1.00 0.00 H ATOM 358 HE ARG A 24 50.961 73.172 -12.598 1.00 0.00 H ATOM 359 HH12 ARG A 24 47.131 72.620 -13.915 1.00 0.00 H ATOM 360 HH11 ARG A 24 47.446 72.786 -12.149 1.00 0.00 H ATOM 361 HH22 ARG A 24 48.878 72.726 -15.414 1.00 0.00 H ATOM 362 HH21 ARG A 24 50.561 72.975 -14.821 1.00 0.00 H ATOM 363 H ARG A 24 47.733 70.765 -6.585 1.00 0.00 H ATOM 364 N ASP A 25 51.162 69.271 -7.650 1.00 60.84 N ATOM 365 CA ASP A 25 52.332 69.003 -6.813 1.00 61.14 C ATOM 366 C ASP A 25 53.593 69.058 -7.664 1.00 61.93 C ATOM 367 O ASP A 25 53.787 68.240 -8.565 1.00 61.21 O ATOM 368 CB ASP A 25 52.193 67.633 -6.140 1.00 60.22 C ATOM 369 CG ASP A 25 53.361 67.303 -5.222 1.00 59.41 C ATOM 370 OD1 ASP A 25 53.511 66.123 -4.856 1.00 59.98 O ATOM 371 OD2 ASP A 25 54.126 68.215 -4.860 1.00 58.04 O ATOM 372 HA ASP A 25 52.402 69.762 -6.034 1.00 0.00 H ATOM 373 HB2 ASP A 25 51.275 67.626 -5.552 1.00 0.00 H ATOM 374 HB3 ASP A 25 52.133 66.869 -6.915 1.00 0.00 H ATOM 375 H ASP A 25 50.980 68.671 -8.479 1.00 0.00 H ATOM 376 N LYS A 26 54.437 70.045 -7.376 1.00 63.00 N ATOM 377 CA LYS A 26 55.640 70.286 -8.160 1.00 63.81 C ATOM 378 C LYS A 26 56.805 69.419 -7.694 1.00 63.14 C ATOM 379 O LYS A 26 57.764 69.198 -8.437 1.00 62.90 O ATOM 380 CB LYS A 26 56.025 71.764 -8.071 1.00 65.29 C ATOM 381 CG LYS A 26 55.001 72.699 -8.697 1.00 68.28 C ATOM 382 CD LYS A 26 54.714 72.304 -10.146 1.00 69.63 C ATOM 383 CE LYS A 26 54.476 73.538 -11.022 1.00 69.99 C ATOM 384 NZ LYS A 26 54.593 73.230 -12.481 1.00 70.70 N ATOM 385 HA LYS A 26 55.423 70.020 -9.194 1.00 0.00 H ATOM 386 HB2 LYS A 26 56.136 72.029 -7.019 1.00 0.00 H ATOM 387 HB3 LYS A 26 56.977 71.904 -8.582 1.00 0.00 H ATOM 388 HG2 LYS A 26 54.075 72.650 -8.124 1.00 0.00 H ATOM 389 HG3 LYS A 26 55.387 73.718 -8.675 1.00 0.00 H ATOM 390 HD2 LYS A 26 55.566 71.748 -10.538 1.00 0.00 H ATOM 391 HD3 LYS A 26 53.826 71.672 -10.173 1.00 0.00 H ATOM 392 HE2 LYS A 26 55.213 74.299 -10.764 1.00 0.00 H ATOM 393 HE3 LYS A 26 53.475 73.921 -10.824 1.00 0.00 H ATOM 394 HZ1 LYS A 26 55.548 72.871 -12.683 1.00 0.00 H ATOM 395 HZ2 LYS A 26 53.888 72.510 -12.740 1.00 0.00 H ATOM 396 HZ3 LYS A 26 54.424 74.096 -13.032 1.00 0.00 H ATOM 397 H LYS A 26 54.231 70.664 -6.566 1.00 0.00 H ATOM 398 N ASN A 27 56.720 68.938 -6.456 1.00 62.27 N ATOM 399 CA ASN A 27 57.790 68.137 -5.866 1.00 60.85 C ATOM 400 C ASN A 27 58.218 66.999 -6.783 1.00 60.01 C ATOM 401 O ASN A 27 57.378 66.313 -7.366 1.00 59.69 O ATOM 402 CB ASN A 27 57.340 67.576 -4.518 1.00 60.08 C ATOM 403 CG ASN A 27 57.192 68.652 -3.471 1.00 59.73 C ATOM 404 OD1 ASN A 27 56.708 68.401 -2.366 1.00 59.89 O ATOM 405 ND2 ASN A 27 57.611 69.866 -3.813 1.00 58.84 N ATOM 406 HA ASN A 27 58.651 68.790 -5.723 1.00 0.00 H ATOM 407 HB2 ASN A 27 56.379 67.079 -4.648 1.00 0.00 H ATOM 408 HB3 ASN A 27 58.079 66.852 -4.175 1.00 0.00 H ATOM 409 HD22 ASN A 27 58.013 70.030 -4.758 1.00 0.00 H ATOM 410 HD21 ASN A 27 57.537 70.652 -3.136 1.00 0.00 H ATOM 411 H ASN A 27 55.869 69.138 -5.893 1.00 0.00 H ATOM 412 N GLN A 28 59.531 66.818 -6.917 1.00 60.16 N ATOM 413 CA GLN A 28 60.097 65.703 -7.675 1.00 59.79 C ATOM 414 C GLN A 28 59.764 64.403 -6.948 1.00 57.92 C ATOM 415 O GLN A 28 59.748 64.357 -5.712 1.00 55.85 O ATOM 416 CB GLN A 28 61.625 65.862 -7.796 1.00 64.63 C ATOM 417 CG GLN A 28 62.263 65.062 -8.949 1.00 68.90 C ATOM 418 CD GLN A 28 63.797 65.179 -8.994 1.00 72.55 C ATOM 419 OE1 GLN A 28 64.369 66.262 -8.757 1.00 72.76 O ATOM 420 NE2 GLN A 28 64.468 64.061 -9.294 1.00 71.70 N ATOM 421 HA GLN A 28 59.674 65.688 -8.679 1.00 0.00 H ATOM 422 HB2 GLN A 28 61.846 66.918 -7.951 1.00 0.00 H ATOM 423 HB3 GLN A 28 62.077 65.531 -6.861 1.00 0.00 H ATOM 424 HG2 GLN A 28 61.999 64.011 -8.829 1.00 0.00 H ATOM 425 HG3 GLN A 28 61.860 65.431 -9.892 1.00 0.00 H ATOM 426 HE22 GLN A 28 63.951 63.179 -9.485 1.00 0.00 H ATOM 427 HE21 GLN A 28 65.507 64.074 -9.337 1.00 0.00 H ATOM 428 H GLN A 28 60.178 67.495 -6.465 1.00 0.00 H ATOM 429 N VAL A 29 59.475 63.358 -7.719 1.00 56.04 N ATOM 430 CA VAL A 29 59.044 62.085 -7.150 1.00 54.09 C ATOM 431 C VAL A 29 60.131 61.020 -7.277 1.00 53.70 C ATOM 432 O VAL A 29 60.779 60.907 -8.321 1.00 54.54 O ATOM 433 CB VAL A 29 57.748 61.566 -7.846 1.00 52.51 C ATOM 434 CG1 VAL A 29 57.340 60.221 -7.262 1.00 49.20 C ATOM 435 CG2 VAL A 29 56.621 62.583 -7.668 1.00 52.42 C ATOM 436 HA VAL A 29 58.842 62.266 -6.094 1.00 0.00 H ATOM 437 HB VAL A 29 57.944 61.437 -8.910 1.00 0.00 H ATOM 438 HG11 VAL A 29 58.143 59.500 -7.418 1.00 0.00 H ATOM 439 HG12 VAL A 29 57.152 60.332 -6.194 1.00 0.00 H ATOM 440 HG13 VAL A 29 56.434 59.871 -7.757 1.00 0.00 H ATOM 441 HG21 VAL A 29 56.427 62.726 -6.605 1.00 0.00 H ATOM 442 HG22 VAL A 29 56.916 63.532 -8.116 1.00 0.00 H ATOM 443 HG23 VAL A 29 55.719 62.214 -8.157 1.00 0.00 H ATOM 444 H VAL A 29 59.558 63.450 -8.752 1.00 0.00 H ATOM 445 N ASP A 30 60.313 60.243 -6.209 1.00 52.01 N ATOM 446 CA ASP A 30 61.263 59.136 -6.205 1.00 50.23 C ATOM 447 C ASP A 30 60.767 58.027 -5.295 1.00 47.11 C ATOM 448 O ASP A 30 59.827 58.220 -4.533 1.00 47.40 O ATOM 449 CB ASP A 30 62.637 59.609 -5.722 1.00 51.15 C ATOM 450 CG ASP A 30 63.766 58.755 -6.270 1.00 54.19 C ATOM 451 OD1 ASP A 30 63.594 58.209 -7.382 1.00 55.33 O ATOM 452 OD2 ASP A 30 64.813 58.622 -5.600 1.00 56.03 O ATOM 453 HA ASP A 30 61.353 58.759 -7.224 1.00 0.00 H ATOM 454 HB2 ASP A 30 62.787 60.639 -6.046 1.00 0.00 H ATOM 455 HB3 ASP A 30 62.660 59.565 -4.633 1.00 0.00 H ATOM 456 H ASP A 30 59.759 60.433 -5.350 1.00 0.00 H ATOM 457 N GLY A 31 61.399 56.864 -5.383 1.00 44.87 N ATOM 458 CA GLY A 31 61.086 55.791 -4.459 1.00 45.27 C ATOM 459 C GLY A 31 60.119 54.771 -5.023 1.00 44.08 C ATOM 460 O GLY A 31 59.372 55.058 -5.956 1.00 44.27 O ATOM 461 HA3 GLY A 31 60.645 56.226 -3.562 1.00 0.00 H ATOM 462 HA2 GLY A 31 62.012 55.280 -4.196 1.00 0.00 H ATOM 463 H GLY A 31 62.122 56.721 -6.117 1.00 0.00 H ATOM 464 N GLU A 32 60.137 53.571 -4.459 1.00 44.00 N ATOM 465 CA GLU A 32 59.240 52.519 -4.906 1.00 43.44 C ATOM 466 C GLU A 32 57.863 52.753 -4.292 1.00 43.05 C ATOM 467 O GLU A 32 56.833 52.349 -4.839 1.00 43.11 O ATOM 468 CB GLU A 32 59.776 51.146 -4.478 1.00 45.96 C ATOM 469 CG GLU A 32 60.984 50.624 -5.288 1.00 49.69 C ATOM 470 CD GLU A 32 62.299 51.347 -4.978 1.00 54.00 C ATOM 471 OE1 GLU A 32 62.420 51.979 -3.899 1.00 55.17 O ATOM 472 OE2 GLU A 32 63.217 51.287 -5.824 1.00 55.72 O ATOM 473 HA GLU A 32 59.170 52.538 -5.994 1.00 0.00 H ATOM 474 HB2 GLU A 32 60.076 51.213 -3.432 1.00 0.00 H ATOM 475 HB3 GLU A 32 58.966 50.423 -4.577 1.00 0.00 H ATOM 476 HG2 GLU A 32 61.114 49.565 -5.067 1.00 0.00 H ATOM 477 HG3 GLU A 32 60.766 50.748 -6.349 1.00 0.00 H ATOM 478 H GLU A 32 60.804 53.380 -3.684 1.00 0.00 H ATOM 479 N VAL A 33 57.850 53.415 -3.148 1.00 39.55 N ATOM 480 CA VAL A 33 56.639 53.505 -2.367 1.00 39.18 C ATOM 481 C VAL A 33 56.374 54.956 -2.038 1.00 38.00 C ATOM 482 O VAL A 33 57.251 55.652 -1.551 1.00 37.60 O ATOM 483 CB VAL A 33 56.783 52.694 -1.072 1.00 38.31 C ATOM 484 CG1 VAL A 33 55.488 52.684 -0.299 1.00 38.82 C ATOM 485 CG2 VAL A 33 57.228 51.287 -1.411 1.00 39.32 C ATOM 486 HA VAL A 33 55.806 53.098 -2.940 1.00 0.00 H ATOM 487 HB VAL A 33 57.536 53.160 -0.437 1.00 0.00 H ATOM 488 HG11 VAL A 33 55.210 53.707 -0.045 1.00 0.00 H ATOM 489 HG12 VAL A 33 54.705 52.235 -0.910 1.00 0.00 H ATOM 490 HG13 VAL A 33 55.616 52.103 0.614 1.00 0.00 H ATOM 491 HG21 VAL A 33 56.485 50.818 -2.056 1.00 0.00 H ATOM 492 HG22 VAL A 33 58.187 51.325 -1.927 1.00 0.00 H ATOM 493 HG23 VAL A 33 57.331 50.709 -0.493 1.00 0.00 H ATOM 494 H VAL A 33 58.719 53.875 -2.808 1.00 0.00 H ATOM 495 N GLN A 34 55.163 55.420 -2.313 1.00 37.61 N ATOM 496 CA GLN A 34 54.805 56.793 -1.968 1.00 36.93 C ATOM 497 C GLN A 34 53.983 56.837 -0.690 1.00 37.49 C ATOM 498 O GLN A 34 53.155 55.946 -0.437 1.00 36.84 O ATOM 499 CB GLN A 34 54.059 57.430 -3.134 1.00 36.30 C ATOM 500 CG GLN A 34 54.813 57.313 -4.461 1.00 33.65 C ATOM 501 CD GLN A 34 56.190 57.950 -4.385 1.00 37.09 C ATOM 502 OE1 GLN A 34 57.212 57.306 -4.699 1.00 34.92 O ATOM 503 NE2 GLN A 34 56.233 59.223 -3.960 1.00 36.09 N ATOM 504 HA GLN A 34 55.714 57.364 -1.782 1.00 0.00 H ATOM 505 HB2 GLN A 34 53.092 56.938 -3.239 1.00 0.00 H ATOM 506 HB3 GLN A 34 53.905 58.486 -2.913 1.00 0.00 H ATOM 507 HG2 GLN A 34 54.925 56.258 -4.712 1.00 0.00 H ATOM 508 HG3 GLN A 34 54.236 57.811 -5.240 1.00 0.00 H ATOM 509 HE22 GLN A 34 55.353 59.718 -3.710 1.00 0.00 H ATOM 510 HE21 GLN A 34 57.146 59.714 -3.881 1.00 0.00 H ATOM 511 H GLN A 34 54.465 54.804 -2.776 1.00 0.00 H ATOM 512 N VAL A 35 54.229 57.863 0.128 1.00 37.23 N ATOM 513 CA VAL A 35 53.478 58.050 1.376 1.00 37.23 C ATOM 514 C VAL A 35 52.414 59.105 1.112 1.00 38.47 C ATOM 515 O VAL A 35 52.724 60.216 0.687 1.00 39.50 O ATOM 516 CB VAL A 35 54.402 58.504 2.556 1.00 36.35 C ATOM 517 CG1 VAL A 35 53.612 58.560 3.847 1.00 34.17 C ATOM 518 CG2 VAL A 35 55.574 57.551 2.704 1.00 34.94 C ATOM 519 HA VAL A 35 53.032 57.101 1.675 1.00 0.00 H ATOM 520 HB VAL A 35 54.786 59.500 2.334 1.00 0.00 H ATOM 521 HG11 VAL A 35 52.793 59.272 3.740 1.00 0.00 H ATOM 522 HG12 VAL A 35 53.209 57.572 4.068 1.00 0.00 H ATOM 523 HG13 VAL A 35 54.267 58.877 4.659 1.00 0.00 H ATOM 524 HG21 VAL A 35 55.201 56.548 2.909 1.00 0.00 H ATOM 525 HG22 VAL A 35 56.153 57.543 1.781 1.00 0.00 H ATOM 526 HG23 VAL A 35 56.207 57.880 3.528 1.00 0.00 H ATOM 527 H VAL A 35 54.971 58.547 -0.125 1.00 0.00 H ATOM 528 N LEU A 36 51.157 58.750 1.354 1.00 39.02 N ATOM 529 CA LEU A 36 50.050 59.551 0.861 1.00 38.78 C ATOM 530 C LEU A 36 49.197 60.053 1.991 1.00 40.80 C ATOM 531 O LEU A 36 49.097 59.432 3.057 1.00 38.97 O ATOM 532 CB LEU A 36 49.177 58.736 -0.105 1.00 38.34 C ATOM 533 CG LEU A 36 49.871 58.164 -1.346 1.00 40.38 C ATOM 534 CD1 LEU A 36 48.913 57.204 -2.059 1.00 42.12 C ATOM 535 CD2 LEU A 36 50.316 59.267 -2.286 1.00 37.22 C ATOM 536 HA LEU A 36 50.477 60.404 0.333 1.00 0.00 H ATOM 537 HB2 LEU A 36 48.758 57.899 0.454 1.00 0.00 H ATOM 538 HB3 LEU A 36 48.370 59.384 -0.447 1.00 0.00 H ATOM 539 HG LEU A 36 50.764 57.624 -1.032 1.00 0.00 H ATOM 540 HD21 LEU A 36 49.447 59.841 -2.608 1.00 0.00 H ATOM 541 HD22 LEU A 36 51.016 59.923 -1.768 1.00 0.00 H ATOM 542 HD23 LEU A 36 50.804 58.827 -3.155 1.00 0.00 H ATOM 543 HD11 LEU A 36 48.643 56.393 -1.383 1.00 0.00 H ATOM 544 HD12 LEU A 36 48.014 57.744 -2.357 1.00 0.00 H ATOM 545 HD13 LEU A 36 49.402 56.794 -2.943 1.00 0.00 H ATOM 546 H LEU A 36 50.963 57.888 1.903 1.00 0.00 H ATOM 547 N SER A 37 48.577 61.200 1.758 1.00 42.87 N ATOM 548 CA SER A 37 47.707 61.761 2.765 1.00 45.29 C ATOM 549 C SER A 37 46.464 62.405 2.160 1.00 46.05 C ATOM 550 O SER A 37 46.517 63.036 1.098 1.00 44.94 O ATOM 551 CB SER A 37 48.489 62.774 3.606 1.00 45.94 C ATOM 552 OG SER A 37 47.664 63.327 4.621 1.00 50.93 O ATOM 553 HA SER A 37 47.359 60.948 3.402 1.00 0.00 H ATOM 554 HB2 SER A 37 48.847 63.575 2.960 1.00 0.00 H ATOM 555 HB3 SER A 37 49.340 62.274 4.069 1.00 0.00 H ATOM 556 HG SER A 37 46.892 63.785 4.204 1.00 0.00 H ATOM 557 H SER A 37 48.716 61.695 0.854 1.00 0.00 H ATOM 558 N THR A 38 45.342 62.211 2.846 1.00 47.80 N ATOM 559 CA THR A 38 44.162 63.040 2.643 1.00 51.60 C ATOM 560 C THR A 38 43.965 63.866 3.918 1.00 54.33 C ATOM 561 O THR A 38 44.863 63.943 4.771 1.00 53.88 O ATOM 562 CB THR A 38 42.891 62.182 2.385 1.00 48.70 C ATOM 563 OG1 THR A 38 42.615 61.371 3.532 1.00 50.56 O ATOM 564 CG2 THR A 38 43.080 61.308 1.166 1.00 45.87 C ATOM 565 HA THR A 38 44.309 63.672 1.767 1.00 0.00 H ATOM 566 HB THR A 38 42.048 62.849 2.204 1.00 0.00 H ATOM 567 HG1 THR A 38 43.385 60.774 3.705 1.00 0.00 H ATOM 568 HG23 THR A 38 43.289 61.935 0.300 1.00 0.00 H ATOM 569 HG21 THR A 38 43.915 60.628 1.334 1.00 0.00 H ATOM 570 HG22 THR A 38 42.171 60.733 0.989 1.00 0.00 H ATOM 571 H THR A 38 45.306 61.445 3.548 1.00 0.00 H ATOM 572 N ALA A 39 42.796 64.484 4.033 1.00 57.24 N ATOM 573 CA ALA A 39 42.426 65.237 5.221 1.00 59.81 C ATOM 574 C ALA A 39 42.441 64.343 6.458 1.00 60.40 C ATOM 575 O ALA A 39 42.977 64.719 7.502 1.00 61.65 O ATOM 576 CB ALA A 39 41.023 65.849 5.032 1.00 60.68 C ATOM 577 HA ALA A 39 43.155 66.035 5.367 1.00 0.00 H ATOM 578 HB1 ALA A 39 41.032 66.515 4.169 1.00 0.00 H ATOM 579 HB2 ALA A 39 40.299 65.051 4.869 1.00 0.00 H ATOM 580 HB3 ALA A 39 40.750 66.412 5.925 1.00 0.00 H ATOM 581 H ALA A 39 42.120 64.428 3.245 1.00 0.00 H ATOM 582 N THR A 40 41.867 63.150 6.334 1.00 60.40 N ATOM 583 CA THR A 40 41.547 62.359 7.513 1.00 59.38 C ATOM 584 C THR A 40 42.460 61.161 7.788 1.00 57.43 C ATOM 585 O THR A 40 42.372 60.563 8.857 1.00 56.52 O ATOM 586 CB THR A 40 40.096 61.862 7.442 1.00 60.50 C ATOM 587 OG1 THR A 40 39.968 60.900 6.387 1.00 60.81 O ATOM 588 CG2 THR A 40 39.162 63.033 7.169 1.00 60.68 C ATOM 589 HA THR A 40 41.705 63.048 8.342 1.00 0.00 H ATOM 590 HB THR A 40 39.831 61.400 8.393 1.00 0.00 H ATOM 591 HG1 THR A 40 39.032 60.582 6.344 1.00 0.00 H ATOM 592 HG23 THR A 40 39.257 63.766 7.970 1.00 0.00 H ATOM 593 HG21 THR A 40 39.429 63.495 6.218 1.00 0.00 H ATOM 594 HG22 THR A 40 38.134 62.673 7.124 1.00 0.00 H ATOM 595 H THR A 40 41.645 62.780 5.388 1.00 0.00 H ATOM 596 N GLN A 41 43.320 60.796 6.839 1.00 56.18 N ATOM 597 CA GLN A 41 44.203 59.647 7.053 1.00 54.49 C ATOM 598 C GLN A 41 45.413 59.551 6.130 1.00 51.66 C ATOM 599 O GLN A 41 45.478 60.197 5.081 1.00 49.81 O ATOM 600 CB GLN A 41 43.406 58.350 6.962 1.00 57.63 C ATOM 601 CG GLN A 41 42.746 58.114 5.622 1.00 59.63 C ATOM 602 CD GLN A 41 41.740 56.969 5.685 1.00 61.25 C ATOM 603 OE1 GLN A 41 42.000 55.929 6.302 1.00 59.22 O ATOM 604 NE2 GLN A 41 40.582 57.161 5.054 1.00 60.90 N ATOM 605 HA GLN A 41 44.611 59.806 8.051 1.00 0.00 H ATOM 606 HB2 GLN A 41 44.083 57.519 7.160 1.00 0.00 H ATOM 607 HB3 GLN A 41 42.629 58.373 7.726 1.00 0.00 H ATOM 608 HG2 GLN A 41 42.228 59.024 5.317 1.00 0.00 H ATOM 609 HG3 GLN A 41 43.514 57.871 4.887 1.00 0.00 H ATOM 610 HE22 GLN A 41 40.407 58.052 4.548 1.00 0.00 H ATOM 611 HE21 GLN A 41 39.853 56.419 5.068 1.00 0.00 H ATOM 612 H GLN A 41 43.365 61.327 5.946 1.00 0.00 H ATOM 613 N SER A 42 46.380 58.738 6.544 1.00 48.72 N ATOM 614 CA SER A 42 47.591 58.511 5.770 1.00 45.31 C ATOM 615 C SER A 42 47.662 57.018 5.393 1.00 42.75 C ATOM 616 O SER A 42 47.107 56.159 6.090 1.00 41.68 O ATOM 617 CB SER A 42 48.820 58.931 6.604 1.00 47.13 C ATOM 618 OG SER A 42 49.937 59.254 5.786 1.00 45.52 O ATOM 619 HA SER A 42 47.580 59.107 4.857 1.00 0.00 H ATOM 620 HB2 SER A 42 49.094 58.109 7.265 1.00 0.00 H ATOM 621 HB3 SER A 42 48.558 59.804 7.202 1.00 0.00 H ATOM 622 HG SER A 42 49.699 60.005 5.187 1.00 0.00 H ATOM 623 H SER A 42 46.267 58.247 7.454 1.00 0.00 H ATOM 624 N PHE A 43 48.333 56.724 4.284 1.00 38.18 N ATOM 625 CA PHE A 43 48.465 55.361 3.784 1.00 37.06 C ATOM 626 C PHE A 43 49.570 55.352 2.737 1.00 37.26 C ATOM 627 O PHE A 43 50.279 56.352 2.597 1.00 36.99 O ATOM 628 CB PHE A 43 47.127 54.863 3.202 1.00 35.30 C ATOM 629 CG PHE A 43 46.447 55.848 2.272 1.00 36.06 C ATOM 630 CD1 PHE A 43 45.734 56.933 2.776 1.00 34.22 C ATOM 631 CD2 PHE A 43 46.494 55.671 0.892 1.00 35.10 C ATOM 632 CE1 PHE A 43 45.083 57.815 1.915 1.00 35.20 C ATOM 633 CE2 PHE A 43 45.849 56.544 0.039 1.00 34.91 C ATOM 634 CZ PHE A 43 45.142 57.615 0.551 1.00 33.89 C ATOM 635 HA PHE A 43 48.726 54.681 4.595 1.00 0.00 H ATOM 636 HB2 PHE A 43 47.316 53.944 2.647 1.00 0.00 H ATOM 637 HB3 PHE A 43 46.451 54.653 4.031 1.00 0.00 H ATOM 638 HD2 PHE A 43 47.049 54.829 0.478 1.00 0.00 H ATOM 639 HE2 PHE A 43 45.897 56.388 -1.039 1.00 0.00 H ATOM 640 HZ PHE A 43 44.631 58.302 -0.123 1.00 0.00 H ATOM 641 HE1 PHE A 43 44.528 58.662 2.319 1.00 0.00 H ATOM 642 HD1 PHE A 43 45.685 57.094 3.853 1.00 0.00 H ATOM 643 H PHE A 43 48.782 57.497 3.752 1.00 0.00 H ATOM 644 N LEU A 44 49.737 54.225 2.040 1.00 36.02 N ATOM 645 CA LEU A 44 50.889 53.997 1.159 1.00 34.08 C ATOM 646 C LEU A 44 50.448 53.627 -0.254 1.00 34.44 C ATOM 647 O LEU A 44 49.342 53.132 -0.453 1.00 35.94 O ATOM 648 CB LEU A 44 51.758 52.873 1.718 1.00 32.06 C ATOM 649 CG LEU A 44 52.434 53.071 3.094 1.00 35.56 C ATOM 650 CD1 LEU A 44 53.392 51.894 3.372 1.00 26.62 C ATOM 651 CD2 LEU A 44 53.228 54.359 3.110 1.00 28.93 C ATOM 652 HA LEU A 44 51.458 54.926 1.114 1.00 0.00 H ATOM 653 HB2 LEU A 44 51.127 51.987 1.795 1.00 0.00 H ATOM 654 HB3 LEU A 44 52.552 52.690 0.994 1.00 0.00 H ATOM 655 HG LEU A 44 51.659 53.115 3.859 1.00 0.00 H ATOM 656 HD21 LEU A 44 53.997 54.320 2.338 1.00 0.00 H ATOM 657 HD22 LEU A 44 52.560 55.199 2.917 1.00 0.00 H ATOM 658 HD23 LEU A 44 53.697 54.483 4.086 1.00 0.00 H ATOM 659 HD11 LEU A 44 52.828 50.961 3.375 1.00 0.00 H ATOM 660 HD12 LEU A 44 54.155 51.857 2.594 1.00 0.00 H ATOM 661 HD13 LEU A 44 53.867 52.036 4.343 1.00 0.00 H ATOM 662 H LEU A 44 49.020 53.477 2.125 1.00 0.00 H ATOM 663 N ALA A 45 51.313 53.857 -1.235 1.00 35.39 N ATOM 664 CA ALA A 45 51.040 53.429 -2.603 1.00 36.99 C ATOM 665 C ALA A 45 52.289 52.794 -3.182 1.00 37.90 C ATOM 666 O ALA A 45 53.404 53.296 -2.991 1.00 40.17 O ATOM 667 CB ALA A 45 50.597 54.617 -3.477 1.00 35.06 C ATOM 668 HA ALA A 45 50.227 52.703 -2.590 1.00 0.00 H ATOM 669 HB1 ALA A 45 49.690 55.055 -3.060 1.00 0.00 H ATOM 670 HB2 ALA A 45 51.388 55.367 -3.497 1.00 0.00 H ATOM 671 HB3 ALA A 45 50.401 54.267 -4.491 1.00 0.00 H ATOM 672 H ALA A 45 52.203 54.352 -1.024 1.00 0.00 H ATOM 673 N THR A 46 52.102 51.679 -3.879 1.00 39.02 N ATOM 674 CA THR A 46 53.214 50.940 -4.449 1.00 40.35 C ATOM 675 C THR A 46 53.122 51.025 -5.961 1.00 42.47 C ATOM 676 O THR A 46 52.075 50.716 -6.537 1.00 42.53 O ATOM 677 CB THR A 46 53.149 49.455 -4.020 1.00 41.16 C ATOM 678 OG1 THR A 46 53.226 49.364 -2.586 1.00 39.42 O ATOM 679 CG2 THR A 46 54.271 48.668 -4.662 1.00 39.23 C ATOM 680 HA THR A 46 54.153 51.367 -4.096 1.00 0.00 H ATOM 681 HB THR A 46 52.203 49.029 -4.354 1.00 0.00 H ATOM 682 HG1 THR A 46 52.467 49.857 -2.184 1.00 0.00 H ATOM 683 HG23 THR A 46 54.196 48.749 -5.746 1.00 0.00 H ATOM 684 HG21 THR A 46 55.229 49.069 -4.332 1.00 0.00 H ATOM 685 HG22 THR A 46 54.193 47.621 -4.368 1.00 0.00 H ATOM 686 H THR A 46 51.134 51.326 -4.020 1.00 0.00 H ATOM 687 N CYS A 47 54.207 51.449 -6.601 1.00 44.41 N ATOM 688 CA CYS A 47 54.236 51.557 -8.057 1.00 49.26 C ATOM 689 C CYS A 47 54.642 50.234 -8.670 1.00 49.08 C ATOM 690 O CYS A 47 55.690 49.689 -8.342 1.00 49.90 O ATOM 691 CB CYS A 47 55.218 52.645 -8.506 1.00 51.65 C ATOM 692 SG CYS A 47 54.972 54.229 -7.704 1.00 62.78 S ATOM 693 HA CYS A 47 53.235 51.825 -8.394 1.00 0.00 H ATOM 694 HB2 CYS A 47 55.107 52.784 -9.581 1.00 0.00 H ATOM 695 HB3 CYS A 47 56.230 52.304 -8.288 1.00 0.00 H ATOM 696 HG CYS A 47 53.701 54.690 -7.979 1.00 0.00 H ATOM 697 H CYS A 47 55.052 51.709 -6.054 1.00 0.00 H ATOM 698 N VAL A 48 53.794 49.727 -9.557 1.00 49.93 N ATOM 699 CA VAL A 48 53.989 48.436 -10.215 1.00 51.04 C ATOM 700 C VAL A 48 53.554 48.576 -11.670 1.00 52.62 C ATOM 701 O VAL A 48 52.406 48.912 -11.960 1.00 53.10 O ATOM 702 CB VAL A 48 53.132 47.325 -9.542 1.00 50.15 C ATOM 703 CG1 VAL A 48 53.359 45.988 -10.240 1.00 48.45 C ATOM 704 CG2 VAL A 48 53.489 47.216 -8.070 1.00 49.61 C ATOM 705 HA VAL A 48 55.039 48.153 -10.138 1.00 0.00 H ATOM 706 HB VAL A 48 52.078 47.589 -9.631 1.00 0.00 H ATOM 707 HG11 VAL A 48 53.073 46.074 -11.288 1.00 0.00 H ATOM 708 HG12 VAL A 48 54.413 45.718 -10.170 1.00 0.00 H ATOM 709 HG13 VAL A 48 52.753 45.221 -9.758 1.00 0.00 H ATOM 710 HG21 VAL A 48 54.545 46.965 -7.971 1.00 0.00 H ATOM 711 HG22 VAL A 48 53.293 48.169 -7.578 1.00 0.00 H ATOM 712 HG23 VAL A 48 52.884 46.436 -7.608 1.00 0.00 H ATOM 713 H VAL A 48 52.945 50.278 -9.797 1.00 0.00 H ATOM 714 N ASN A 49 54.489 48.325 -12.575 1.00 55.54 N ATOM 715 CA ASN A 49 54.276 48.517 -14.004 1.00 57.24 C ATOM 716 C ASN A 49 53.641 49.867 -14.333 1.00 57.35 C ATOM 717 O ASN A 49 52.661 49.938 -15.079 1.00 57.44 O ATOM 718 CB ASN A 49 53.427 47.367 -14.562 1.00 57.83 C ATOM 719 CG ASN A 49 54.137 46.019 -14.463 1.00 59.64 C ATOM 720 OD1 ASN A 49 53.514 44.964 -14.595 1.00 59.48 O ATOM 721 ND2 ASN A 49 55.451 46.053 -14.226 1.00 59.28 N ATOM 722 HA ASN A 49 55.256 48.514 -14.482 1.00 0.00 H ATOM 723 HB2 ASN A 49 52.495 47.314 -13.999 1.00 0.00 H ATOM 724 HB3 ASN A 49 53.206 47.571 -15.610 1.00 0.00 H ATOM 725 HD22 ASN A 49 55.937 46.966 -14.121 1.00 0.00 H ATOM 726 HD21 ASN A 49 55.988 45.166 -14.146 1.00 0.00 H ATOM 727 H ASN A 49 55.414 47.976 -12.252 1.00 0.00 H ATOM 728 N GLY A 50 54.202 50.930 -13.764 1.00 56.38 N ATOM 729 CA GLY A 50 53.790 52.273 -14.135 1.00 55.13 C ATOM 730 C GLY A 50 52.474 52.769 -13.547 1.00 54.60 C ATOM 731 O GLY A 50 52.015 53.859 -13.909 1.00 55.00 O ATOM 732 HA3 GLY A 50 53.700 52.304 -15.221 1.00 0.00 H ATOM 733 HA2 GLY A 50 54.574 52.960 -13.817 1.00 0.00 H ATOM 734 H GLY A 50 54.943 50.799 -13.046 1.00 0.00 H ATOM 735 N VAL A 51 51.863 51.983 -12.656 1.00 52.33 N ATOM 736 CA VAL A 51 50.681 52.432 -11.917 1.00 49.62 C ATOM 737 C VAL A 51 51.006 52.535 -10.429 1.00 48.51 C ATOM 738 O VAL A 51 51.564 51.601 -9.855 1.00 48.35 O ATOM 739 CB VAL A 51 49.474 51.452 -12.098 1.00 49.34 C ATOM 740 CG1 VAL A 51 48.268 51.940 -11.299 1.00 46.64 C ATOM 741 CG2 VAL A 51 49.110 51.332 -13.571 1.00 48.34 C ATOM 742 HA VAL A 51 50.401 53.407 -12.316 1.00 0.00 H ATOM 743 HB VAL A 51 49.766 50.470 -11.726 1.00 0.00 H ATOM 744 HG11 VAL A 51 48.530 51.990 -10.242 1.00 0.00 H ATOM 745 HG12 VAL A 51 47.978 52.930 -11.650 1.00 0.00 H ATOM 746 HG13 VAL A 51 47.438 51.247 -11.436 1.00 0.00 H ATOM 747 HG21 VAL A 51 48.834 52.313 -13.957 1.00 0.00 H ATOM 748 HG22 VAL A 51 49.967 50.950 -14.126 1.00 0.00 H ATOM 749 HG23 VAL A 51 48.269 50.647 -13.682 1.00 0.00 H ATOM 750 H VAL A 51 52.236 51.028 -12.483 1.00 0.00 H ATOM 751 N CYS A 52 50.664 53.675 -9.823 1.00 46.88 N ATOM 752 CA CYS A 52 50.616 53.815 -8.369 1.00 46.49 C ATOM 753 C CYS A 52 49.357 53.172 -7.784 1.00 43.90 C ATOM 754 O CYS A 52 48.264 53.726 -7.898 1.00 42.27 O ATOM 755 CB CYS A 52 50.624 55.286 -7.962 1.00 47.24 C ATOM 756 SG CYS A 52 52.223 55.980 -7.675 1.00 58.03 S ATOM 757 HA CYS A 52 51.500 53.311 -7.979 1.00 0.00 H ATOM 758 HB2 CYS A 52 50.044 55.385 -7.045 1.00 0.00 H ATOM 759 HB3 CYS A 52 50.146 55.858 -8.757 1.00 0.00 H ATOM 760 HG CYS A 52 52.847 55.287 -6.658 1.00 0.00 H ATOM 761 H CYS A 52 50.422 54.498 -10.411 1.00 0.00 H ATOM 762 N TRP A 53 49.542 52.025 -7.134 1.00 40.32 N ATOM 763 CA TRP A 53 48.464 51.236 -6.544 1.00 37.98 C ATOM 764 C TRP A 53 48.278 51.512 -5.043 1.00 37.86 C ATOM 765 O TRP A 53 49.249 51.580 -4.291 1.00 37.80 O ATOM 766 CB TRP A 53 48.758 49.750 -6.726 1.00 36.17 C ATOM 767 CG TRP A 53 48.824 49.308 -8.145 1.00 38.59 C ATOM 768 CD1 TRP A 53 49.943 49.056 -8.878 1.00 37.19 C ATOM 769 CD2 TRP A 53 47.712 49.084 -9.015 1.00 38.48 C ATOM 770 NE1 TRP A 53 49.598 48.693 -10.154 1.00 40.95 N ATOM 771 CE2 TRP A 53 48.232 48.700 -10.267 1.00 40.32 C ATOM 772 CE3 TRP A 53 46.331 49.175 -8.855 1.00 39.74 C ATOM 773 CZ2 TRP A 53 47.414 48.404 -11.360 1.00 40.93 C ATOM 774 CZ3 TRP A 53 45.517 48.884 -9.931 1.00 42.18 C ATOM 775 CH2 TRP A 53 46.061 48.503 -11.171 1.00 41.32 C ATOM 776 HA TRP A 53 47.546 51.524 -7.057 1.00 0.00 H ATOM 777 HB2 TRP A 53 49.716 49.531 -6.255 1.00 0.00 H ATOM 778 HB3 TRP A 53 47.972 49.183 -6.228 1.00 0.00 H ATOM 779 HE1 TRP A 53 50.265 48.451 -10.914 1.00 0.00 H ATOM 780 HD1 TRP A 53 50.964 49.132 -8.505 1.00 0.00 H ATOM 781 HZ2 TRP A 53 47.834 48.107 -12.321 1.00 0.00 H ATOM 782 HH2 TRP A 53 45.390 48.281 -12.001 1.00 0.00 H ATOM 783 HZ3 TRP A 53 44.435 48.951 -9.818 1.00 0.00 H ATOM 784 HE3 TRP A 53 45.901 49.471 -7.898 1.00 0.00 H ATOM 785 H TRP A 53 50.515 51.669 -7.041 1.00 0.00 H ATOM 786 N THR A 54 47.033 51.652 -4.600 1.00 36.47 N ATOM 787 CA THR A 54 46.768 51.801 -3.174 1.00 37.18 C ATOM 788 C THR A 54 45.358 51.299 -2.864 1.00 36.61 C ATOM 789 O THR A 54 44.723 50.685 -3.717 1.00 37.81 O ATOM 790 CB THR A 54 46.928 53.277 -2.742 1.00 37.61 C ATOM 791 OG1 THR A 54 46.879 53.373 -1.316 1.00 34.87 O ATOM 792 CG2 THR A 54 45.820 54.125 -3.337 1.00 38.88 C ATOM 793 HA THR A 54 47.490 51.208 -2.613 1.00 0.00 H ATOM 794 HB THR A 54 47.890 53.641 -3.103 1.00 0.00 H ATOM 795 HG1 THR A 54 47.613 52.836 -0.925 1.00 0.00 H ATOM 796 HG23 THR A 54 45.854 54.054 -4.424 1.00 0.00 H ATOM 797 HG21 THR A 54 44.856 53.765 -2.978 1.00 0.00 H ATOM 798 HG22 THR A 54 45.957 55.163 -3.035 1.00 0.00 H ATOM 799 H THR A 54 46.242 51.655 -5.275 1.00 0.00 H ATOM 800 N VAL A 55 44.874 51.519 -1.649 1.00 34.92 N ATOM 801 CA VAL A 55 43.555 51.009 -1.291 1.00 34.32 C ATOM 802 C VAL A 55 42.431 52.038 -1.462 1.00 34.18 C ATOM 803 O VAL A 55 42.627 53.248 -1.224 1.00 32.02 O ATOM 804 CB VAL A 55 43.532 50.514 0.168 1.00 32.93 C ATOM 805 CG1 VAL A 55 44.358 49.266 0.297 1.00 30.91 C ATOM 806 CG2 VAL A 55 44.028 51.618 1.092 1.00 31.10 C ATOM 807 HA VAL A 55 43.372 50.188 -1.984 1.00 0.00 H ATOM 808 HB VAL A 55 42.511 50.267 0.459 1.00 0.00 H ATOM 809 HG11 VAL A 55 43.949 48.492 -0.353 1.00 0.00 H ATOM 810 HG12 VAL A 55 45.386 49.481 0.005 1.00 0.00 H ATOM 811 HG13 VAL A 55 44.336 48.923 1.331 1.00 0.00 H ATOM 812 HG21 VAL A 55 45.047 51.889 0.818 1.00 0.00 H ATOM 813 HG22 VAL A 55 43.380 52.489 0.995 1.00 0.00 H ATOM 814 HG23 VAL A 55 44.010 51.263 2.122 1.00 0.00 H ATOM 815 H VAL A 55 45.433 52.053 -0.954 1.00 0.00 H ATOM 816 N TYR A 56 41.253 51.547 -1.836 1.00 33.63 N ATOM 817 CA TYR A 56 40.073 52.401 -1.912 1.00 35.12 C ATOM 818 C TYR A 56 39.716 53.076 -0.593 1.00 34.92 C ATOM 819 O TYR A 56 39.311 54.236 -0.581 1.00 33.54 O ATOM 820 CB TYR A 56 38.842 51.617 -2.399 1.00 36.09 C ATOM 821 CG TYR A 56 37.736 52.551 -2.811 1.00 35.31 C ATOM 822 CD1 TYR A 56 37.736 53.135 -4.072 1.00 36.36 C ATOM 823 CD2 TYR A 56 36.723 52.896 -1.928 1.00 38.11 C ATOM 824 CE1 TYR A 56 36.761 54.034 -4.444 1.00 36.87 C ATOM 825 CE2 TYR A 56 35.727 53.803 -2.294 1.00 37.62 C ATOM 826 CZ TYR A 56 35.754 54.362 -3.556 1.00 39.42 C ATOM 827 OH TYR A 56 34.756 55.216 -3.968 1.00 38.85 O ATOM 828 HA TYR A 56 40.341 53.178 -2.628 1.00 0.00 H ATOM 829 HB3 TYR A 56 38.486 50.976 -1.593 1.00 0.00 H ATOM 830 HB2 TYR A 56 39.126 51.002 -3.253 1.00 0.00 H ATOM 831 HD2 TYR A 56 36.705 52.452 -0.933 1.00 0.00 H ATOM 832 HE2 TYR A 56 34.937 54.067 -1.591 1.00 0.00 H ATOM 833 HE1 TYR A 56 36.784 54.485 -5.436 1.00 0.00 H ATOM 834 HD1 TYR A 56 38.523 52.877 -4.781 1.00 0.00 H ATOM 835 HH TYR A 56 33.887 54.743 -3.941 1.00 0.00 H ATOM 836 H TYR A 56 41.172 50.539 -2.078 1.00 0.00 H ATOM 837 N HIS A 57 39.849 52.352 0.516 1.00 35.08 N ATOM 838 CA HIS A 57 39.369 52.884 1.792 1.00 37.03 C ATOM 839 C HIS A 57 40.266 53.995 2.298 1.00 35.77 C ATOM 840 O HIS A 57 39.909 54.704 3.228 1.00 38.14 O ATOM 841 CB HIS A 57 39.235 51.773 2.845 1.00 38.21 C ATOM 842 CG HIS A 57 40.539 51.229 3.342 1.00 41.59 C ATOM 843 ND1 HIS A 57 41.099 50.067 2.854 1.00 42.43 N ATOM 844 CD2 HIS A 57 41.367 51.660 4.325 1.00 42.57 C ATOM 845 CE1 HIS A 57 42.213 49.802 3.517 1.00 41.00 C ATOM 846 NE2 HIS A 57 42.397 50.752 4.416 1.00 42.34 N ATOM 847 HA HIS A 57 38.379 53.304 1.617 1.00 0.00 H ATOM 848 HB2 HIS A 57 38.686 52.175 3.697 1.00 0.00 H ATOM 849 HB3 HIS A 57 38.669 50.952 2.405 1.00 0.00 H ATOM 850 HD2 HIS A 57 41.241 52.558 4.930 1.00 0.00 H ATOM 851 HE1 HIS A 57 42.867 48.946 3.350 1.00 0.00 H ATOM 852 H HIS A 57 40.292 51.412 0.476 1.00 0.00 H ATOM 853 N GLY A 58 41.426 54.150 1.665 1.00 36.83 N ATOM 854 CA GLY A 58 42.268 55.312 1.904 1.00 36.27 C ATOM 855 C GLY A 58 42.058 56.441 0.888 1.00 35.58 C ATOM 856 O GLY A 58 41.818 57.580 1.268 1.00 35.86 O ATOM 857 HA3 GLY A 58 43.311 54.997 1.860 1.00 0.00 H ATOM 858 HA2 GLY A 58 42.048 55.698 2.899 1.00 0.00 H ATOM 859 H GLY A 58 41.737 53.426 0.986 1.00 0.00 H ATOM 860 N ALA A 59 42.146 56.131 -0.401 1.00 35.60 N ATOM 861 CA ALA A 59 42.099 57.146 -1.456 1.00 36.40 C ATOM 862 C ALA A 59 40.673 57.510 -1.925 1.00 38.03 C ATOM 863 O ALA A 59 40.483 58.549 -2.549 1.00 35.10 O ATOM 864 CB ALA A 59 42.917 56.678 -2.659 1.00 36.19 C ATOM 865 HA ALA A 59 42.520 58.050 -1.017 1.00 0.00 H ATOM 866 HB1 ALA A 59 43.952 56.521 -2.354 1.00 0.00 H ATOM 867 HB2 ALA A 59 42.502 55.744 -3.037 1.00 0.00 H ATOM 868 HB3 ALA A 59 42.878 57.437 -3.440 1.00 0.00 H ATOM 869 H ALA A 59 42.252 55.132 -0.670 1.00 0.00 H ATOM 870 N GLY A 60 39.695 56.645 -1.650 1.00 38.10 N ATOM 871 CA GLY A 60 38.367 56.810 -2.216 1.00 39.94 C ATOM 872 C GLY A 60 38.409 56.867 -3.734 1.00 40.02 C ATOM 873 O GLY A 60 39.148 56.122 -4.368 1.00 41.16 O ATOM 874 HA3 GLY A 60 37.934 57.736 -1.839 1.00 0.00 H ATOM 875 HA2 GLY A 60 37.745 55.969 -1.910 1.00 0.00 H ATOM 876 H GLY A 60 39.886 55.840 -1.020 1.00 0.00 H ATOM 877 N SER A 61 37.633 57.773 -4.316 1.00 40.53 N ATOM 878 CA SER A 61 37.654 58.003 -5.754 1.00 40.61 C ATOM 879 C SER A 61 38.521 59.211 -6.124 1.00 39.43 C ATOM 880 O SER A 61 38.498 59.669 -7.275 1.00 39.83 O ATOM 881 CB SER A 61 36.230 58.248 -6.245 1.00 43.90 C ATOM 882 OG SER A 61 35.665 59.334 -5.533 1.00 48.43 O ATOM 883 HA SER A 61 38.081 57.119 -6.228 1.00 0.00 H ATOM 884 HB2 SER A 61 35.630 57.353 -6.080 1.00 0.00 H ATOM 885 HB3 SER A 61 36.248 58.481 -7.310 1.00 0.00 H ATOM 886 HG SER A 61 35.649 59.121 -4.566 1.00 0.00 H ATOM 887 H SER A 61 36.989 58.337 -3.726 1.00 0.00 H ATOM 888 N LYS A 62 39.283 59.729 -5.162 1.00 37.77 N ATOM 889 CA LYS A 62 40.037 60.972 -5.360 1.00 37.16 C ATOM 890 C LYS A 62 41.097 60.970 -6.481 1.00 37.49 C ATOM 891 O LYS A 62 41.579 59.917 -6.900 1.00 35.48 O ATOM 892 CB LYS A 62 40.708 61.382 -4.046 1.00 39.81 C ATOM 893 CG LYS A 62 39.757 61.858 -2.975 1.00 39.98 C ATOM 894 CD LYS A 62 40.479 61.972 -1.649 1.00 42.42 C ATOM 895 CE LYS A 62 39.648 62.762 -0.634 1.00 44.42 C ATOM 896 NZ LYS A 62 38.529 61.934 -0.134 1.00 47.21 N ATOM 897 HA LYS A 62 39.283 61.688 -5.688 1.00 0.00 H ATOM 898 HB2 LYS A 62 41.252 60.521 -3.659 1.00 0.00 H ATOM 899 HB3 LYS A 62 41.410 62.188 -4.260 1.00 0.00 H ATOM 900 HG2 LYS A 62 39.359 62.834 -3.254 1.00 0.00 H ATOM 901 HG3 LYS A 62 38.937 61.146 -2.879 1.00 0.00 H ATOM 902 HD2 LYS A 62 40.664 60.972 -1.257 1.00 0.00 H ATOM 903 HD3 LYS A 62 41.430 62.481 -1.804 1.00 0.00 H ATOM 904 HE2 LYS A 62 39.249 63.656 -1.113 1.00 0.00 H ATOM 905 HE3 LYS A 62 40.283 63.053 0.203 1.00 0.00 H ATOM 906 HZ1 LYS A 62 37.921 61.658 -0.931 1.00 0.00 H ATOM 907 HZ2 LYS A 62 38.908 61.082 0.326 1.00 0.00 H ATOM 908 HZ3 LYS A 62 37.974 62.482 0.554 1.00 0.00 H ATOM 909 H LYS A 62 39.345 59.239 -4.247 1.00 0.00 H ATOM 910 N THR A 63 41.421 62.169 -6.973 1.00 37.41 N ATOM 911 CA THR A 63 42.583 62.397 -7.830 1.00 39.22 C ATOM 912 C THR A 63 43.876 62.383 -6.997 1.00 38.40 C ATOM 913 O THR A 63 43.878 62.659 -5.791 1.00 36.96 O ATOM 914 CB THR A 63 42.508 63.770 -8.528 1.00 39.77 C ATOM 915 OG1 THR A 63 42.242 64.785 -7.546 1.00 40.94 O ATOM 916 CG2 THR A 63 41.450 63.765 -9.593 1.00 40.62 C ATOM 917 HA THR A 63 42.586 61.599 -8.573 1.00 0.00 H ATOM 918 HB THR A 63 43.462 63.982 -9.011 1.00 0.00 H ATOM 919 HG1 THR A 63 42.970 64.792 -6.875 1.00 0.00 H ATOM 920 HG23 THR A 63 41.675 62.988 -10.323 1.00 0.00 H ATOM 921 HG21 THR A 63 40.479 63.568 -9.138 1.00 0.00 H ATOM 922 HG22 THR A 63 41.430 64.736 -10.088 1.00 0.00 H ATOM 923 H THR A 63 40.816 62.981 -6.734 1.00 0.00 H ATOM 924 N LEU A 64 44.981 62.092 -7.662 1.00 38.23 N ATOM 925 CA LEU A 64 46.288 62.283 -7.045 1.00 39.65 C ATOM 926 C LEU A 64 46.909 63.620 -7.467 1.00 39.71 C ATOM 927 O LEU A 64 47.056 63.901 -8.654 1.00 39.68 O ATOM 928 CB LEU A 64 47.207 61.143 -7.440 1.00 38.21 C ATOM 929 CG LEU A 64 48.627 61.229 -6.882 1.00 39.26 C ATOM 930 CD1 LEU A 64 48.640 60.953 -5.393 1.00 39.82 C ATOM 931 CD2 LEU A 64 49.486 60.257 -7.620 1.00 38.95 C ATOM 932 HA LEU A 64 46.159 62.295 -5.963 1.00 0.00 H ATOM 933 HB2 LEU A 64 46.762 60.213 -7.087 1.00 0.00 H ATOM 934 HB3 LEU A 64 47.272 61.124 -8.528 1.00 0.00 H ATOM 935 HG LEU A 64 49.018 62.237 -7.022 1.00 0.00 H ATOM 936 HD21 LEU A 64 49.093 59.250 -7.483 1.00 0.00 H ATOM 937 HD22 LEU A 64 49.487 60.507 -8.681 1.00 0.00 H ATOM 938 HD23 LEU A 64 50.504 60.307 -7.233 1.00 0.00 H ATOM 939 HD11 LEU A 64 48.017 61.688 -4.883 1.00 0.00 H ATOM 940 HD12 LEU A 64 48.250 59.952 -5.207 1.00 0.00 H ATOM 941 HD13 LEU A 64 49.662 61.021 -5.021 1.00 0.00 H ATOM 942 H LEU A 64 44.917 61.724 -8.633 1.00 0.00 H ATOM 943 N ALA A 65 47.279 64.439 -6.494 1.00 40.46 N ATOM 944 CA ALA A 65 47.946 65.688 -6.809 1.00 42.45 C ATOM 945 C ALA A 65 49.201 65.399 -7.638 1.00 45.18 C ATOM 946 O ALA A 65 50.034 64.571 -7.258 1.00 45.62 O ATOM 947 CB ALA A 65 48.312 66.430 -5.521 1.00 40.52 C ATOM 948 HA ALA A 65 47.275 66.321 -7.389 1.00 0.00 H ATOM 949 HB1 ALA A 65 47.405 66.642 -4.955 1.00 0.00 H ATOM 950 HB2 ALA A 65 48.979 65.809 -4.923 1.00 0.00 H ATOM 951 HB3 ALA A 65 48.812 67.366 -5.772 1.00 0.00 H ATOM 952 H ALA A 65 47.091 64.186 -5.503 1.00 0.00 H ATOM 953 N GLY A 66 49.321 66.085 -8.771 1.00 47.77 N ATOM 954 CA GLY A 66 50.412 65.837 -9.691 1.00 49.21 C ATOM 955 C GLY A 66 50.973 67.114 -10.300 1.00 52.57 C ATOM 956 O GLY A 66 50.429 68.207 -10.085 1.00 51.66 O ATOM 957 HA3 GLY A 66 50.050 65.197 -10.496 1.00 0.00 H ATOM 958 HA2 GLY A 66 51.211 65.327 -9.154 1.00 0.00 H ATOM 959 H GLY A 66 48.617 66.815 -9.001 1.00 0.00 H ATOM 960 N PRO A 67 52.066 67.005 -11.081 1.00 55.22 N ATOM 961 CA PRO A 67 52.829 68.135 -11.640 1.00 57.15 C ATOM 962 C PRO A 67 52.041 68.947 -12.672 1.00 58.91 C ATOM 963 O PRO A 67 52.195 70.170 -12.766 1.00 60.36 O ATOM 964 CB PRO A 67 54.056 67.466 -12.251 1.00 56.73 C ATOM 965 CG PRO A 67 53.564 66.098 -12.612 1.00 57.98 C ATOM 966 CD PRO A 67 52.597 65.707 -11.539 1.00 55.46 C ATOM 967 HA PRO A 67 53.078 68.874 -10.879 1.00 0.00 H ATOM 968 HD3 PRO A 67 51.802 65.077 -11.938 1.00 0.00 H ATOM 969 HD2 PRO A 67 53.102 65.182 -10.728 1.00 0.00 H ATOM 970 HG3 PRO A 67 54.395 65.394 -12.647 1.00 0.00 H ATOM 971 HG2 PRO A 67 53.066 66.119 -13.581 1.00 0.00 H ATOM 972 HB2 PRO A 67 54.394 68.005 -13.136 1.00 0.00 H ATOM 973 HB3 PRO A 67 54.870 67.410 -11.528 1.00 0.00 H ATOM 974 N LYS A 68 51.195 68.259 -13.436 1.00 59.33 N ATOM 975 CA LYS A 68 50.330 68.900 -14.423 1.00 59.92 C ATOM 976 C LYS A 68 48.904 69.041 -13.876 1.00 59.12 C ATOM 977 O LYS A 68 47.938 69.096 -14.639 1.00 59.18 O ATOM 978 CB LYS A 68 50.317 68.075 -15.724 1.00 61.94 C ATOM 979 CG LYS A 68 51.682 68.007 -16.436 1.00 64.62 C ATOM 980 CD LYS A 68 51.785 66.838 -17.406 1.00 65.46 C ATOM 981 CE LYS A 68 51.255 67.208 -18.787 1.00 68.31 C ATOM 982 NZ LYS A 68 51.546 66.162 -19.831 1.00 69.17 N ATOM 983 HA LYS A 68 50.720 69.895 -14.635 1.00 0.00 H ATOM 984 HB2 LYS A 68 50.005 67.059 -15.483 1.00 0.00 H ATOM 985 HB3 LYS A 68 49.596 68.523 -16.407 1.00 0.00 H ATOM 986 HG2 LYS A 68 51.833 68.934 -16.990 1.00 0.00 H ATOM 987 HG3 LYS A 68 52.463 67.905 -15.683 1.00 0.00 H ATOM 988 HD2 LYS A 68 52.830 66.543 -17.495 1.00 0.00 H ATOM 989 HD3 LYS A 68 51.205 66.002 -17.016 1.00 0.00 H ATOM 990 HE2 LYS A 68 51.717 68.145 -19.097 1.00 0.00 H ATOM 991 HE3 LYS A 68 50.175 67.341 -18.720 1.00 0.00 H ATOM 992 HZ1 LYS A 68 52.575 66.032 -19.912 1.00 0.00 H ATOM 993 HZ2 LYS A 68 51.102 65.263 -19.553 1.00 0.00 H ATOM 994 HZ3 LYS A 68 51.161 66.471 -20.746 1.00 0.00 H ATOM 995 H LYS A 68 51.148 67.226 -13.326 1.00 0.00 H ATOM 996 N GLY A 69 48.780 69.099 -12.552 1.00 56.93 N ATOM 997 CA GLY A 69 47.462 69.131 -11.940 1.00 55.60 C ATOM 998 C GLY A 69 47.009 67.747 -11.476 1.00 54.15 C ATOM 999 O GLY A 69 47.792 66.793 -11.479 1.00 53.83 O ATOM 1000 HA3 GLY A 69 46.745 69.510 -12.669 1.00 0.00 H ATOM 1001 HA2 GLY A 69 47.490 69.799 -11.079 1.00 0.00 H ATOM 1002 H GLY A 69 49.630 69.122 -11.953 1.00 0.00 H ATOM 1003 N PRO A 70 45.737 67.604 -11.070 1.00 52.76 N ATOM 1004 CA PRO A 70 45.253 66.345 -10.480 1.00 50.74 C ATOM 1005 C PRO A 70 45.219 65.184 -11.469 1.00 49.42 C ATOM 1006 O PRO A 70 44.778 65.334 -12.611 1.00 49.48 O ATOM 1007 CB PRO A 70 43.863 66.698 -9.946 1.00 50.70 C ATOM 1008 CG PRO A 70 43.435 67.877 -10.762 1.00 52.85 C ATOM 1009 CD PRO A 70 44.688 68.640 -11.116 1.00 51.84 C ATOM 1010 HA PRO A 70 45.923 65.983 -9.700 1.00 0.00 H ATOM 1011 HD3 PRO A 70 44.612 69.076 -12.112 1.00 0.00 H ATOM 1012 HD2 PRO A 70 44.885 69.428 -10.389 1.00 0.00 H ATOM 1013 HG3 PRO A 70 42.761 68.509 -10.184 1.00 0.00 H ATOM 1014 HG2 PRO A 70 42.930 67.543 -11.668 1.00 0.00 H ATOM 1015 HB2 PRO A 70 43.174 65.864 -10.083 1.00 0.00 H ATOM 1016 HB3 PRO A 70 43.911 66.958 -8.889 1.00 0.00 H ATOM 1017 N ILE A 71 45.713 64.031 -11.024 1.00 47.68 N ATOM 1018 CA ILE A 71 45.708 62.815 -11.835 1.00 44.09 C ATOM 1019 C ILE A 71 44.461 61.987 -11.525 1.00 42.70 C ATOM 1020 O ILE A 71 44.190 61.662 -10.365 1.00 41.52 O ATOM 1021 CB ILE A 71 46.983 61.964 -11.557 1.00 44.76 C ATOM 1022 CG1 ILE A 71 48.235 62.711 -12.028 1.00 43.91 C ATOM 1023 CG2 ILE A 71 46.878 60.628 -12.254 1.00 40.39 C ATOM 1024 CD1 ILE A 71 49.445 62.495 -11.121 1.00 46.74 C ATOM 1025 HA ILE A 71 45.701 63.102 -12.886 1.00 0.00 H ATOM 1026 HB ILE A 71 47.063 61.795 -10.483 1.00 0.00 H ATOM 1027 HG12 ILE A 71 48.488 62.365 -13.030 1.00 0.00 H ATOM 1028 HG13 ILE A 71 48.011 63.777 -12.058 1.00 0.00 H ATOM 1029 HD11 ILE A 71 49.211 62.846 -10.116 1.00 0.00 H ATOM 1030 HD12 ILE A 71 49.688 61.433 -11.089 1.00 0.00 H ATOM 1031 HD13 ILE A 71 50.296 63.052 -11.513 1.00 0.00 H ATOM 1032 HG21 ILE A 71 46.003 60.094 -11.883 1.00 0.00 H ATOM 1033 HG22 ILE A 71 46.780 60.787 -13.328 1.00 0.00 H ATOM 1034 HG23 ILE A 71 47.775 60.043 -12.052 1.00 0.00 H ATOM 1035 H ILE A 71 46.116 63.994 -10.066 1.00 0.00 H ATOM 1036 N THR A 72 43.704 61.660 -12.568 1.00 41.31 N ATOM 1037 CA THR A 72 42.478 60.879 -12.451 1.00 41.56 C ATOM 1038 C THR A 72 42.816 59.390 -12.307 1.00 41.78 C ATOM 1039 O THR A 72 43.761 58.893 -12.929 1.00 42.93 O ATOM 1040 CB THR A 72 41.570 61.100 -13.716 1.00 42.31 C ATOM 1041 OG1 THR A 72 41.171 62.474 -13.764 1.00 43.18 O ATOM 1042 CG2 THR A 72 40.296 60.229 -13.662 1.00 39.24 C ATOM 1043 HA THR A 72 41.936 61.209 -11.565 1.00 0.00 H ATOM 1044 HB THR A 72 42.146 60.821 -14.598 1.00 0.00 H ATOM 1045 HG1 THR A 72 41.975 63.048 -13.824 1.00 0.00 H ATOM 1046 HG23 THR A 72 40.578 59.177 -13.625 1.00 0.00 H ATOM 1047 HG21 THR A 72 39.721 60.484 -12.772 1.00 0.00 H ATOM 1048 HG22 THR A 72 39.693 60.414 -14.551 1.00 0.00 H ATOM 1049 H THR A 72 44.001 61.977 -13.513 1.00 0.00 H ATOM 1050 N GLN A 73 42.060 58.690 -11.472 1.00 40.96 N ATOM 1051 CA GLN A 73 42.258 57.256 -11.293 1.00 40.81 C ATOM 1052 C GLN A 73 42.089 56.510 -12.602 1.00 41.82 C ATOM 1053 O GLN A 73 41.202 56.817 -13.392 1.00 44.21 O ATOM 1054 CB GLN A 73 41.284 56.706 -10.246 1.00 36.18 C ATOM 1055 CG GLN A 73 41.680 57.047 -8.824 1.00 31.76 C ATOM 1056 CD GLN A 73 40.825 56.329 -7.800 1.00 33.49 C ATOM 1057 OE1 GLN A 73 40.177 55.312 -8.109 1.00 33.56 O ATOM 1058 NE2 GLN A 73 40.818 56.845 -6.570 1.00 31.64 N ATOM 1059 HA GLN A 73 43.279 57.103 -10.943 1.00 0.00 H ATOM 1060 HB2 GLN A 73 40.295 57.122 -10.440 1.00 0.00 H ATOM 1061 HB3 GLN A 73 41.246 55.621 -10.344 1.00 0.00 H ATOM 1062 HG2 GLN A 73 42.721 56.763 -8.672 1.00 0.00 H ATOM 1063 HG3 GLN A 73 41.573 58.122 -8.678 1.00 0.00 H ATOM 1064 HE22 GLN A 73 41.376 57.697 -6.360 1.00 0.00 H ATOM 1065 HE21 GLN A 73 40.254 56.395 -5.821 1.00 0.00 H ATOM 1066 H GLN A 73 41.312 59.173 -10.935 1.00 0.00 H ATOM 1067 N MET A 74 42.966 55.542 -12.831 1.00 45.34 N ATOM 1068 CA MET A 74 42.980 54.763 -14.057 1.00 48.59 C ATOM 1069 C MET A 74 42.302 53.417 -13.795 1.00 48.46 C ATOM 1070 O MET A 74 41.891 52.724 -14.724 1.00 49.68 O ATOM 1071 CB MET A 74 44.433 54.544 -14.497 1.00 54.37 C ATOM 1072 CG MET A 74 44.595 53.924 -15.874 1.00 61.80 C ATOM 1073 SD MET A 74 46.357 53.672 -16.340 1.00 74.20 S ATOM 1074 CE MET A 74 46.172 52.769 -17.917 1.00 70.86 C ATOM 1075 HA MET A 74 42.444 55.290 -14.846 1.00 0.00 H ATOM 1076 HB2 MET A 74 44.936 55.511 -14.499 1.00 0.00 H ATOM 1077 HB3 MET A 74 44.912 53.888 -13.771 1.00 0.00 H ATOM 1078 HG2 MET A 74 44.131 54.581 -16.609 1.00 0.00 H ATOM 1079 HG3 MET A 74 44.091 52.958 -15.883 1.00 0.00 H ATOM 1080 HE1 MET A 74 45.630 51.840 -17.741 1.00 0.00 H ATOM 1081 HE2 MET A 74 45.618 53.386 -18.624 1.00 0.00 H ATOM 1082 HE3 MET A 74 47.158 52.545 -18.324 1.00 0.00 H ATOM 1083 H MET A 74 43.675 55.331 -12.100 1.00 0.00 H ATOM 1084 N TYR A 75 42.192 53.052 -12.521 1.00 47.93 N ATOM 1085 CA TYR A 75 41.583 51.790 -12.133 1.00 48.12 C ATOM 1086 C TYR A 75 40.918 51.947 -10.785 1.00 46.28 C ATOM 1087 O TYR A 75 41.495 52.517 -9.859 1.00 45.19 O ATOM 1088 CB TYR A 75 42.643 50.693 -12.063 1.00 51.89 C ATOM 1089 CG TYR A 75 43.341 50.490 -13.394 1.00 59.64 C ATOM 1090 CD1 TYR A 75 42.659 49.939 -14.484 1.00 62.20 C ATOM 1091 CD2 TYR A 75 44.677 50.852 -13.568 1.00 61.68 C ATOM 1092 CE1 TYR A 75 43.293 49.753 -15.702 1.00 65.29 C ATOM 1093 CE2 TYR A 75 45.319 50.668 -14.784 1.00 64.35 C ATOM 1094 CZ TYR A 75 44.622 50.115 -15.841 1.00 65.42 C ATOM 1095 OH TYR A 75 45.257 49.891 -17.035 1.00 68.64 O ATOM 1096 HA TYR A 75 40.837 51.509 -12.877 1.00 0.00 H ATOM 1097 HB3 TYR A 75 42.164 49.759 -11.771 1.00 0.00 H ATOM 1098 HB2 TYR A 75 43.386 50.969 -11.314 1.00 0.00 H ATOM 1099 HD2 TYR A 75 45.226 51.287 -12.733 1.00 0.00 H ATOM 1100 HE2 TYR A 75 46.363 50.957 -14.904 1.00 0.00 H ATOM 1101 HE1 TYR A 75 42.749 49.325 -16.544 1.00 0.00 H ATOM 1102 HD1 TYR A 75 41.613 49.652 -14.374 1.00 0.00 H ATOM 1103 HH TYR A 75 44.618 49.494 -17.678 1.00 0.00 H ATOM 1104 H TYR A 75 42.552 53.688 -11.781 1.00 0.00 H ATOM 1105 N THR A 76 39.699 51.445 -10.672 1.00 43.01 N ATOM 1106 CA THR A 76 38.929 51.675 -9.470 1.00 42.38 C ATOM 1107 C THR A 76 38.076 50.449 -9.220 1.00 43.14 C ATOM 1108 O THR A 76 37.177 50.144 -10.001 1.00 44.68 O ATOM 1109 CB THR A 76 38.010 52.907 -9.639 1.00 39.82 C ATOM 1110 OG1 THR A 76 38.740 53.958 -10.277 1.00 38.75 O ATOM 1111 CG2 THR A 76 37.517 53.396 -8.292 1.00 38.99 C ATOM 1112 HA THR A 76 39.603 51.860 -8.634 1.00 0.00 H ATOM 1113 HB THR A 76 37.152 52.620 -10.247 1.00 0.00 H ATOM 1114 HG1 THR A 76 39.521 54.201 -9.720 1.00 0.00 H ATOM 1115 HG23 THR A 76 36.959 52.599 -7.800 1.00 0.00 H ATOM 1116 HG21 THR A 76 38.370 53.679 -7.675 1.00 0.00 H ATOM 1117 HG22 THR A 76 36.868 54.260 -8.436 1.00 0.00 H ATOM 1118 H THR A 76 39.294 50.884 -11.449 1.00 0.00 H ATOM 1119 N ASN A 77 38.369 49.741 -8.136 1.00 43.18 N ATOM 1120 CA ASN A 77 37.609 48.556 -7.777 1.00 42.65 C ATOM 1121 C ASN A 77 37.283 48.627 -6.307 1.00 42.13 C ATOM 1122 O ASN A 77 38.099 48.261 -5.461 1.00 43.74 O ATOM 1123 CB ASN A 77 38.415 47.288 -8.056 1.00 41.46 C ATOM 1124 CG ASN A 77 37.548 46.035 -8.052 1.00 43.70 C ATOM 1125 OD1 ASN A 77 37.752 45.133 -8.868 1.00 44.52 O ATOM 1126 ND2 ASN A 77 36.571 45.977 -7.139 1.00 40.17 N ATOM 1127 HA ASN A 77 36.697 48.520 -8.373 1.00 0.00 H ATOM 1128 HB2 ASN A 77 38.889 47.382 -9.033 1.00 0.00 H ATOM 1129 HB3 ASN A 77 39.183 47.185 -7.289 1.00 0.00 H ATOM 1130 HD22 ASN A 77 36.437 46.762 -6.471 1.00 0.00 H ATOM 1131 HD21 ASN A 77 35.946 45.147 -7.098 1.00 0.00 H ATOM 1132 H ASN A 77 39.160 50.041 -7.531 1.00 0.00 H ATOM 1133 N VAL A 78 36.084 49.098 -6.007 1.00 42.56 N ATOM 1134 CA VAL A 78 35.666 49.317 -4.634 1.00 43.38 C ATOM 1135 C VAL A 78 35.723 48.016 -3.837 1.00 45.57 C ATOM 1136 O VAL A 78 36.141 48.011 -2.681 1.00 46.62 O ATOM 1137 CB VAL A 78 34.233 49.867 -4.595 1.00 42.95 C ATOM 1138 CG1 VAL A 78 33.859 50.268 -3.168 1.00 43.21 C ATOM 1139 CG2 VAL A 78 34.120 51.049 -5.533 1.00 42.94 C ATOM 1140 HA VAL A 78 36.348 50.040 -4.187 1.00 0.00 H ATOM 1141 HB VAL A 78 33.539 49.092 -4.921 1.00 0.00 H ATOM 1142 HG11 VAL A 78 33.924 49.396 -2.518 1.00 0.00 H ATOM 1143 HG12 VAL A 78 34.546 51.037 -2.816 1.00 0.00 H ATOM 1144 HG13 VAL A 78 32.840 50.656 -3.156 1.00 0.00 H ATOM 1145 HG21 VAL A 78 34.817 51.827 -5.221 1.00 0.00 H ATOM 1146 HG22 VAL A 78 34.360 50.730 -6.547 1.00 0.00 H ATOM 1147 HG23 VAL A 78 33.102 51.438 -5.504 1.00 0.00 H ATOM 1148 H VAL A 78 35.421 49.318 -6.777 1.00 0.00 H ATOM 1149 N ASP A 79 35.316 46.912 -4.460 1.00 47.13 N ATOM 1150 CA ASP A 79 35.133 45.663 -3.734 1.00 49.72 C ATOM 1151 C ASP A 79 36.442 44.909 -3.545 1.00 47.72 C ATOM 1152 O ASP A 79 36.574 44.122 -2.621 1.00 49.71 O ATOM 1153 CB ASP A 79 34.100 44.785 -4.451 1.00 53.21 C ATOM 1154 CG ASP A 79 32.665 45.295 -4.252 1.00 55.09 C ATOM 1155 OD1 ASP A 79 32.413 45.981 -3.225 1.00 55.56 O ATOM 1156 OD2 ASP A 79 31.800 45.015 -5.118 1.00 56.05 O ATOM 1157 HA ASP A 79 34.764 45.911 -2.739 1.00 0.00 H ATOM 1158 HB2 ASP A 79 34.325 44.778 -5.517 1.00 0.00 H ATOM 1159 HB3 ASP A 79 34.169 43.770 -4.059 1.00 0.00 H ATOM 1160 H ASP A 79 35.126 46.942 -5.482 1.00 0.00 H ATOM 1161 N GLN A 80 37.411 45.161 -4.414 1.00 46.57 N ATOM 1162 CA GLN A 80 38.782 44.735 -4.159 1.00 45.88 C ATOM 1163 C GLN A 80 39.504 45.652 -3.168 1.00 43.58 C ATOM 1164 O GLN A 80 40.572 45.292 -2.663 1.00 42.88 O ATOM 1165 CB GLN A 80 39.579 44.712 -5.462 1.00 50.25 C ATOM 1166 CG GLN A 80 39.869 43.338 -6.020 1.00 57.25 C ATOM 1167 CD GLN A 80 40.580 43.434 -7.354 1.00 62.35 C ATOM 1168 OE1 GLN A 80 40.987 44.526 -7.766 1.00 62.61 O ATOM 1169 NE2 GLN A 80 40.736 42.293 -8.043 1.00 66.73 N ATOM 1170 HA GLN A 80 38.722 43.737 -3.725 1.00 0.00 H ATOM 1171 HB2 GLN A 80 39.015 45.267 -6.211 1.00 0.00 H ATOM 1172 HB3 GLN A 80 40.532 45.210 -5.283 1.00 0.00 H ATOM 1173 HG2 GLN A 80 40.500 42.793 -5.318 1.00 0.00 H ATOM 1174 HG3 GLN A 80 38.930 42.802 -6.154 1.00 0.00 H ATOM 1175 HE22 GLN A 80 40.376 41.398 -7.655 1.00 0.00 H ATOM 1176 HE21 GLN A 80 41.217 42.304 -8.965 1.00 0.00 H ATOM 1177 H GLN A 80 37.189 45.671 -5.293 1.00 0.00 H ATOM 1178 N ASP A 81 38.928 46.831 -2.912 1.00 39.22 N ATOM 1179 CA ASP A 81 39.592 47.888 -2.149 1.00 37.04 C ATOM 1180 C ASP A 81 40.873 48.336 -2.888 1.00 36.71 C ATOM 1181 O ASP A 81 41.887 48.591 -2.261 1.00 33.05 O ATOM 1182 CB ASP A 81 39.969 47.406 -0.744 1.00 34.22 C ATOM 1183 CG ASP A 81 40.117 48.549 0.244 1.00 37.41 C ATOM 1184 OD1 ASP A 81 39.817 49.702 -0.129 1.00 39.54 O ATOM 1185 OD2 ASP A 81 40.539 48.301 1.400 1.00 35.36 O ATOM 1186 HA ASP A 81 38.898 48.723 -2.056 1.00 0.00 H ATOM 1187 HB2 ASP A 81 39.191 46.732 -0.385 1.00 0.00 H ATOM 1188 HB3 ASP A 81 40.916 46.868 -0.801 1.00 0.00 H ATOM 1189 H ASP A 81 37.967 47.004 -3.270 1.00 0.00 H ATOM 1190 N LEU A 82 40.827 48.390 -4.218 1.00 34.81 N ATOM 1191 CA LEU A 82 41.997 48.735 -5.018 1.00 36.84 C ATOM 1192 C LEU A 82 41.763 49.916 -5.970 1.00 38.19 C ATOM 1193 O LEU A 82 40.762 49.947 -6.696 1.00 38.57 O ATOM 1194 CB LEU A 82 42.429 47.528 -5.851 1.00 36.84 C ATOM 1195 CG LEU A 82 43.728 47.675 -6.637 1.00 37.67 C ATOM 1196 CD1 LEU A 82 44.885 47.865 -5.655 1.00 37.69 C ATOM 1197 CD2 LEU A 82 43.957 46.435 -7.497 1.00 36.25 C ATOM 1198 HA LEU A 82 42.770 49.030 -4.309 1.00 0.00 H ATOM 1199 HB2 LEU A 82 42.545 46.682 -5.174 1.00 0.00 H ATOM 1200 HB3 LEU A 82 41.632 47.315 -6.564 1.00 0.00 H ATOM 1201 HG LEU A 82 43.667 48.543 -7.294 1.00 0.00 H ATOM 1202 HD21 LEU A 82 44.021 45.556 -6.855 1.00 0.00 H ATOM 1203 HD22 LEU A 82 43.126 46.318 -8.193 1.00 0.00 H ATOM 1204 HD23 LEU A 82 44.887 46.548 -8.055 1.00 0.00 H ATOM 1205 HD11 LEU A 82 44.711 48.761 -5.060 1.00 0.00 H ATOM 1206 HD12 LEU A 82 44.948 46.998 -4.998 1.00 0.00 H ATOM 1207 HD13 LEU A 82 45.817 47.971 -6.210 1.00 0.00 H ATOM 1208 H LEU A 82 39.930 48.180 -4.701 1.00 0.00 H ATOM 1209 N VAL A 83 42.685 50.873 -5.971 1.00 36.62 N ATOM 1210 CA VAL A 83 42.684 51.905 -6.983 1.00 37.75 C ATOM 1211 C VAL A 83 44.096 52.113 -7.502 1.00 37.27 C ATOM 1212 O VAL A 83 45.058 51.738 -6.852 1.00 37.94 O ATOM 1213 CB VAL A 83 42.120 53.251 -6.434 1.00 38.65 C ATOM 1214 CG1 VAL A 83 40.674 53.049 -5.935 1.00 36.39 C ATOM 1215 CG2 VAL A 83 43.003 53.763 -5.324 1.00 38.07 C ATOM 1216 HA VAL A 83 42.034 51.578 -7.795 1.00 0.00 H ATOM 1217 HB VAL A 83 42.109 53.991 -7.234 1.00 0.00 H ATOM 1218 HG11 VAL A 83 40.050 52.707 -6.761 1.00 0.00 H ATOM 1219 HG12 VAL A 83 40.666 52.304 -5.140 1.00 0.00 H ATOM 1220 HG13 VAL A 83 40.287 53.994 -5.553 1.00 0.00 H ATOM 1221 HG21 VAL A 83 43.033 53.030 -4.518 1.00 0.00 H ATOM 1222 HG22 VAL A 83 44.010 53.925 -5.708 1.00 0.00 H ATOM 1223 HG23 VAL A 83 42.601 54.703 -4.947 1.00 0.00 H ATOM 1224 H VAL A 83 43.418 50.880 -5.233 1.00 0.00 H ATOM 1225 N GLY A 84 44.204 52.664 -8.707 1.00 38.39 N ATOM 1226 CA GLY A 84 45.505 52.927 -9.290 1.00 38.22 C ATOM 1227 C GLY A 84 45.450 54.180 -10.138 1.00 39.91 C ATOM 1228 O GLY A 84 44.493 54.405 -10.899 1.00 40.28 O ATOM 1229 HA3 GLY A 84 45.799 52.082 -9.913 1.00 0.00 H ATOM 1230 HA2 GLY A 84 46.237 53.062 -8.494 1.00 0.00 H ATOM 1231 H GLY A 84 43.344 52.910 -9.238 1.00 0.00 H ATOM 1232 N TRP A 85 46.469 55.017 -9.985 1.00 39.49 N ATOM 1233 CA TRP A 85 46.667 56.183 -10.849 1.00 39.16 C ATOM 1234 C TRP A 85 47.884 55.877 -11.704 1.00 40.95 C ATOM 1235 O TRP A 85 48.765 55.141 -11.278 1.00 40.00 O ATOM 1236 CB TRP A 85 46.991 57.440 -10.024 1.00 38.30 C ATOM 1237 CG TRP A 85 45.983 57.829 -8.997 1.00 36.01 C ATOM 1238 CD1 TRP A 85 44.835 58.520 -9.206 1.00 35.43 C ATOM 1239 CD2 TRP A 85 46.058 57.594 -7.587 1.00 36.22 C ATOM 1240 NE1 TRP A 85 44.187 58.739 -8.014 1.00 35.87 N ATOM 1241 CE2 TRP A 85 44.918 58.178 -7.003 1.00 34.66 C ATOM 1242 CE3 TRP A 85 46.982 56.950 -6.760 1.00 36.49 C ATOM 1243 CZ2 TRP A 85 44.673 58.139 -5.628 1.00 37.07 C ATOM 1244 CZ3 TRP A 85 46.734 56.917 -5.393 1.00 37.40 C ATOM 1245 CH2 TRP A 85 45.591 57.505 -4.845 1.00 34.72 C ATOM 1246 HA TRP A 85 45.763 56.369 -11.429 1.00 0.00 H ATOM 1247 HB2 TRP A 85 47.938 57.268 -9.513 1.00 0.00 H ATOM 1248 HB3 TRP A 85 47.100 58.274 -10.717 1.00 0.00 H ATOM 1249 HE1 TRP A 85 43.287 59.248 -7.899 1.00 0.00 H ATOM 1250 HD1 TRP A 85 44.477 58.854 -10.180 1.00 0.00 H ATOM 1251 HZ2 TRP A 85 43.782 58.598 -5.198 1.00 0.00 H ATOM 1252 HH2 TRP A 85 45.430 57.456 -3.768 1.00 0.00 H ATOM 1253 HZ3 TRP A 85 47.447 56.422 -4.734 1.00 0.00 H ATOM 1254 HE3 TRP A 85 47.875 56.485 -7.177 1.00 0.00 H ATOM 1255 H TRP A 85 47.153 54.838 -9.222 1.00 0.00 H ATOM 1256 N PRO A 86 47.961 56.453 -12.912 1.00 43.61 N ATOM 1257 CA PRO A 86 49.223 56.395 -13.671 1.00 45.97 C ATOM 1258 C PRO A 86 50.368 56.981 -12.833 1.00 47.19 C ATOM 1259 O PRO A 86 50.239 58.063 -12.253 1.00 45.14 O ATOM 1260 CB PRO A 86 48.940 57.242 -14.913 1.00 45.83 C ATOM 1261 CG PRO A 86 47.447 57.220 -15.047 1.00 45.06 C ATOM 1262 CD PRO A 86 46.915 57.193 -13.630 1.00 43.56 C ATOM 1263 HA PRO A 86 49.530 55.382 -13.930 1.00 0.00 H ATOM 1264 HD3 PRO A 86 46.802 58.201 -13.232 1.00 0.00 H ATOM 1265 HD2 PRO A 86 45.958 56.674 -13.578 1.00 0.00 H ATOM 1266 HG3 PRO A 86 47.126 56.332 -15.592 1.00 0.00 H ATOM 1267 HG2 PRO A 86 47.098 58.111 -15.569 1.00 0.00 H ATOM 1268 HB2 PRO A 86 49.300 58.261 -14.775 1.00 0.00 H ATOM 1269 HB3 PRO A 86 49.413 56.807 -15.793 1.00 0.00 H ATOM 1270 N ALA A 87 51.479 56.254 -12.772 1.00 50.00 N ATOM 1271 CA ALA A 87 52.596 56.627 -11.907 1.00 53.61 C ATOM 1272 C ALA A 87 53.253 57.915 -12.379 1.00 56.03 C ATOM 1273 O ALA A 87 53.626 58.032 -13.544 1.00 56.61 O ATOM 1274 CB ALA A 87 53.621 55.501 -11.875 1.00 50.37 C ATOM 1275 HA ALA A 87 52.208 56.795 -10.902 1.00 0.00 H ATOM 1276 HB1 ALA A 87 53.152 54.596 -11.490 1.00 0.00 H ATOM 1277 HB2 ALA A 87 53.991 55.319 -12.884 1.00 0.00 H ATOM 1278 HB3 ALA A 87 54.451 55.785 -11.228 1.00 0.00 H ATOM 1279 H ALA A 87 51.555 55.397 -13.356 1.00 0.00 H ATOM 1280 N PRO A 88 53.412 58.896 -11.477 1.00 59.50 N ATOM 1281 CA PRO A 88 54.090 60.158 -11.803 1.00 62.49 C ATOM 1282 C PRO A 88 55.530 59.916 -12.269 1.00 64.70 C ATOM 1283 O PRO A 88 56.123 58.876 -11.971 1.00 65.24 O ATOM 1284 CB PRO A 88 54.043 60.949 -10.490 1.00 62.57 C ATOM 1285 CG PRO A 88 52.918 60.336 -9.717 1.00 61.78 C ATOM 1286 CD PRO A 88 52.935 58.873 -10.086 1.00 60.07 C ATOM 1287 HA PRO A 88 53.614 60.691 -12.626 1.00 0.00 H ATOM 1288 HD3 PRO A 88 53.617 58.314 -9.445 1.00 0.00 H ATOM 1289 HD2 PRO A 88 51.937 58.439 -10.019 1.00 0.00 H ATOM 1290 HG3 PRO A 88 51.968 60.790 -9.999 1.00 0.00 H ATOM 1291 HG2 PRO A 88 53.076 60.462 -8.646 1.00 0.00 H ATOM 1292 HB2 PRO A 88 54.983 60.849 -9.947 1.00 0.00 H ATOM 1293 HB3 PRO A 88 53.847 62.004 -10.683 1.00 0.00 H ATOM 1294 N PRO A 89 56.104 60.877 -13.014 1.00 66.71 N ATOM 1295 CA PRO A 89 57.464 60.745 -13.555 1.00 67.00 C ATOM 1296 C PRO A 89 58.490 60.650 -12.424 1.00 66.92 C ATOM 1297 O PRO A 89 58.598 61.566 -11.596 1.00 66.94 O ATOM 1298 CB PRO A 89 57.654 62.027 -14.375 1.00 66.97 C ATOM 1299 CG PRO A 89 56.271 62.522 -14.644 1.00 67.37 C ATOM 1300 CD PRO A 89 55.465 62.138 -13.439 1.00 67.32 C ATOM 1301 HA PRO A 89 57.601 59.844 -14.153 1.00 0.00 H ATOM 1302 HD3 PRO A 89 55.535 62.897 -12.660 1.00 0.00 H ATOM 1303 HD2 PRO A 89 54.418 61.981 -13.699 1.00 0.00 H ATOM 1304 HG3 PRO A 89 55.865 62.051 -15.540 1.00 0.00 H ATOM 1305 HG2 PRO A 89 56.272 63.604 -14.773 1.00 0.00 H ATOM 1306 HB2 PRO A 89 58.222 62.765 -13.808 1.00 0.00 H ATOM 1307 HB3 PRO A 89 58.173 61.811 -15.309 1.00 0.00 H ATOM 1308 N GLY A 90 59.243 59.552 -12.395 1.00 65.92 N ATOM 1309 CA GLY A 90 60.332 59.439 -11.436 1.00 65.72 C ATOM 1310 C GLY A 90 60.049 58.468 -10.303 1.00 66.12 C ATOM 1311 O GLY A 90 60.953 58.091 -9.557 1.00 66.78 O ATOM 1312 HA3 GLY A 90 60.517 60.424 -11.007 1.00 0.00 H ATOM 1313 HA2 GLY A 90 61.223 59.101 -11.965 1.00 0.00 H ATOM 1314 H GLY A 90 59.053 58.774 -13.059 1.00 0.00 H ATOM 1315 N ALA A 91 58.791 58.064 -10.166 1.00 64.68 N ATOM 1316 CA ALA A 91 58.461 56.965 -9.274 1.00 63.84 C ATOM 1317 C ALA A 91 59.173 55.726 -9.809 1.00 63.42 C ATOM 1318 O ALA A 91 59.287 55.551 -11.023 1.00 63.96 O ATOM 1319 CB ALA A 91 56.953 56.744 -9.252 1.00 63.13 C ATOM 1320 HA ALA A 91 58.779 57.181 -8.254 1.00 0.00 H ATOM 1321 HB1 ALA A 91 56.459 57.651 -8.902 1.00 0.00 H ATOM 1322 HB2 ALA A 91 56.607 56.506 -10.258 1.00 0.00 H ATOM 1323 HB3 ALA A 91 56.718 55.918 -8.580 1.00 0.00 H ATOM 1324 H ALA A 91 58.036 58.538 -10.701 1.00 0.00 H ATOM 1325 N ARG A 92 59.663 54.878 -8.911 1.00 62.56 N ATOM 1326 CA ARG A 92 60.371 53.670 -9.323 1.00 62.29 C ATOM 1327 C ARG A 92 59.415 52.493 -9.432 1.00 61.52 C ATOM 1328 O ARG A 92 58.895 51.999 -8.431 1.00 61.76 O ATOM 1329 CB ARG A 92 61.487 53.331 -8.329 1.00 64.07 C ATOM 1330 CG ARG A 92 62.588 54.385 -8.238 1.00 66.83 C ATOM 1331 CD ARG A 92 63.633 54.033 -7.186 1.00 68.06 C ATOM 1332 NE ARG A 92 64.470 55.188 -6.855 1.00 69.65 N ATOM 1333 CZ ARG A 92 65.596 55.130 -6.149 1.00 70.62 C ATOM 1334 NH1 ARG A 92 66.043 53.967 -5.685 1.00 70.82 N ATOM 1335 NH2 ARG A 92 66.274 56.242 -5.901 1.00 71.49 N ATOM 1336 HA ARG A 92 60.810 53.861 -10.302 1.00 0.00 H ATOM 1337 HB2 ARG A 92 61.041 53.216 -7.341 1.00 0.00 H ATOM 1338 HB3 ARG A 92 61.941 52.388 -8.633 1.00 0.00 H ATOM 1339 HG2 ARG A 92 63.079 54.466 -9.208 1.00 0.00 H ATOM 1340 HG3 ARG A 92 62.137 55.343 -7.979 1.00 0.00 H ATOM 1341 HD2 ARG A 92 64.267 53.234 -7.570 1.00 0.00 H ATOM 1342 HD3 ARG A 92 63.126 53.692 -6.283 1.00 0.00 H ATOM 1343 HE ARG A 92 64.162 56.121 -7.196 1.00 0.00 H ATOM 1344 HH12 ARG A 92 66.924 53.931 -5.134 1.00 0.00 H ATOM 1345 HH11 ARG A 92 65.511 53.093 -5.873 1.00 0.00 H ATOM 1346 HH22 ARG A 92 67.155 56.202 -5.350 1.00 0.00 H ATOM 1347 HH21 ARG A 92 65.925 57.154 -6.258 1.00 0.00 H ATOM 1348 H ARG A 92 59.540 55.078 -7.898 1.00 0.00 H ATOM 1349 N SER A 93 59.193 52.047 -10.659 1.00 60.42 N ATOM 1350 CA SER A 93 58.258 50.969 -10.930 1.00 59.29 C ATOM 1351 C SER A 93 58.819 49.651 -10.407 1.00 58.10 C ATOM 1352 O SER A 93 59.963 49.306 -10.674 1.00 57.19 O ATOM 1353 CB SER A 93 58.013 50.874 -12.439 1.00 59.54 C ATOM 1354 OG SER A 93 56.748 50.297 -12.713 1.00 62.08 O ATOM 1355 HA SER A 93 57.314 51.173 -10.425 1.00 0.00 H ATOM 1356 HB2 SER A 93 58.791 50.257 -12.889 1.00 0.00 H ATOM 1357 HB3 SER A 93 58.050 51.874 -12.870 1.00 0.00 H ATOM 1358 HG SER A 93 56.615 50.247 -13.693 1.00 0.00 H ATOM 1359 H SER A 93 59.704 52.482 -11.453 1.00 0.00 H ATOM 1360 N MET A 94 58.009 48.920 -9.655 1.00 57.79 N ATOM 1361 CA MET A 94 58.415 47.619 -9.144 1.00 57.43 C ATOM 1362 C MET A 94 58.029 46.502 -10.128 1.00 57.81 C ATOM 1363 O MET A 94 57.222 46.709 -11.039 1.00 58.47 O ATOM 1364 CB MET A 94 57.773 47.380 -7.770 1.00 55.94 C ATOM 1365 CG MET A 94 58.246 48.353 -6.693 1.00 56.17 C ATOM 1366 SD MET A 94 58.497 47.557 -5.081 1.00 55.44 S ATOM 1367 CE MET A 94 57.652 48.700 -4.032 1.00 56.23 C ATOM 1368 HA MET A 94 59.499 47.605 -9.034 1.00 0.00 H ATOM 1369 HB2 MET A 94 56.692 47.479 -7.873 1.00 0.00 H ATOM 1370 HB3 MET A 94 58.015 46.367 -7.449 1.00 0.00 H ATOM 1371 HG2 MET A 94 57.498 49.138 -6.581 1.00 0.00 H ATOM 1372 HG3 MET A 94 59.189 48.795 -7.013 1.00 0.00 H ATOM 1373 HE1 MET A 94 58.118 49.682 -4.117 1.00 0.00 H ATOM 1374 HE2 MET A 94 56.607 48.765 -4.335 1.00 0.00 H ATOM 1375 HE3 MET A 94 57.712 48.356 -2.999 1.00 0.00 H ATOM 1376 H MET A 94 57.062 49.284 -9.425 1.00 0.00 H ATOM 1377 N THR A 95 58.614 45.326 -9.944 1.00 58.21 N ATOM 1378 CA THR A 95 58.343 44.179 -10.808 1.00 60.03 C ATOM 1379 C THR A 95 57.582 43.101 -10.037 1.00 60.15 C ATOM 1380 O THR A 95 57.942 42.758 -8.908 1.00 59.74 O ATOM 1381 CB THR A 95 59.668 43.557 -11.337 1.00 60.90 C ATOM 1382 OG1 THR A 95 60.441 44.566 -11.994 1.00 61.48 O ATOM 1383 CG2 THR A 95 59.384 42.419 -12.312 1.00 61.70 C ATOM 1384 HA THR A 95 57.745 44.534 -11.647 1.00 0.00 H ATOM 1385 HB THR A 95 60.224 43.156 -10.489 1.00 0.00 H ATOM 1386 HG1 THR A 95 61.283 44.168 -12.330 1.00 0.00 H ATOM 1387 HG23 THR A 95 58.795 41.651 -11.810 1.00 0.00 H ATOM 1388 HG21 THR A 95 58.828 42.805 -13.167 1.00 0.00 H ATOM 1389 HG22 THR A 95 60.327 41.991 -12.653 1.00 0.00 H ATOM 1390 H THR A 95 59.288 45.217 -9.159 1.00 0.00 H ATOM 1391 N PRO A 96 56.518 42.551 -10.639 1.00 61.27 N ATOM 1392 CA PRO A 96 55.714 41.465 -10.060 1.00 62.51 C ATOM 1393 C PRO A 96 56.508 40.207 -9.721 1.00 64.50 C ATOM 1394 O PRO A 96 57.372 39.784 -10.481 1.00 65.10 O ATOM 1395 CB PRO A 96 54.661 41.182 -11.130 1.00 61.98 C ATOM 1396 CG PRO A 96 54.569 42.447 -11.908 1.00 61.76 C ATOM 1397 CD PRO A 96 55.960 43.024 -11.915 1.00 61.79 C ATOM 1398 HA PRO A 96 55.297 41.764 -9.098 1.00 0.00 H ATOM 1399 HD3 PRO A 96 56.537 42.647 -12.759 1.00 0.00 H ATOM 1400 HD2 PRO A 96 55.933 44.113 -11.952 1.00 0.00 H ATOM 1401 HG3 PRO A 96 53.873 43.137 -11.431 1.00 0.00 H ATOM 1402 HG2 PRO A 96 54.236 42.244 -12.926 1.00 0.00 H ATOM 1403 HB2 PRO A 96 54.974 40.358 -11.771 1.00 0.00 H ATOM 1404 HB3 PRO A 96 53.702 40.940 -10.672 1.00 0.00 H ATOM 1405 N CYS A 97 56.210 39.611 -8.572 1.00 67.30 N ATOM 1406 CA CYS A 97 56.776 38.315 -8.205 1.00 70.41 C ATOM 1407 C CYS A 97 55.844 37.167 -8.623 1.00 73.02 C ATOM 1408 O CYS A 97 54.621 37.248 -8.461 1.00 72.97 O ATOM 1409 CB CYS A 97 57.017 38.249 -6.686 1.00 68.78 C ATOM 1410 SG CYS A 97 57.699 36.663 -6.104 1.00 67.42 S ATOM 1411 HA CYS A 97 57.725 38.205 -8.730 1.00 0.00 H ATOM 1412 HB2 CYS A 97 56.066 38.418 -6.181 1.00 0.00 H ATOM 1413 HB3 CYS A 97 57.715 39.041 -6.416 1.00 0.00 H ATOM 1414 H CYS A 97 55.555 40.080 -7.915 1.00 0.00 H ATOM 1415 N THR A 98 56.436 36.094 -9.143 1.00 76.31 N ATOM 1416 CA THR A 98 55.680 34.921 -9.574 1.00 79.41 C ATOM 1417 C THR A 98 56.307 33.594 -9.127 1.00 81.34 C ATOM 1418 O THR A 98 55.706 32.531 -9.304 1.00 81.95 O ATOM 1419 CB THR A 98 55.511 34.915 -11.113 1.00 80.14 C ATOM 1420 OG1 THR A 98 56.753 35.274 -11.736 1.00 80.22 O ATOM 1421 CG2 THR A 98 54.430 35.904 -11.533 1.00 80.19 C ATOM 1422 HA THR A 98 54.707 34.999 -9.089 1.00 0.00 H ATOM 1423 HB THR A 98 55.217 33.914 -11.428 1.00 0.00 H ATOM 1424 HG1 THR A 98 56.641 35.269 -12.720 1.00 0.00 H ATOM 1425 HG23 THR A 98 53.487 35.632 -11.060 1.00 0.00 H ATOM 1426 HG21 THR A 98 54.717 36.908 -11.222 1.00 0.00 H ATOM 1427 HG22 THR A 98 54.316 35.877 -12.617 1.00 0.00 H ATOM 1428 H THR A 98 57.471 36.091 -9.246 1.00 0.00 H ATOM 1429 N CYS A 99 57.505 33.659 -8.545 1.00 83.01 N ATOM 1430 CA CYS A 99 58.226 32.451 -8.130 1.00 84.58 C ATOM 1431 C CYS A 99 57.557 31.796 -6.924 1.00 84.08 C ATOM 1432 O CYS A 99 57.831 30.638 -6.596 1.00 84.14 O ATOM 1433 CB CYS A 99 59.695 32.776 -7.807 1.00 85.95 C ATOM 1434 SG CYS A 99 60.025 33.500 -6.161 1.00 90.33 S ATOM 1435 HA CYS A 99 58.197 31.748 -8.962 1.00 0.00 H ATOM 1436 HB2 CYS A 99 60.051 33.482 -8.557 1.00 0.00 H ATOM 1437 HB3 CYS A 99 60.264 31.849 -7.882 1.00 0.00 H ATOM 1438 HG CYS A 99 59.338 34.690 -6.038 1.00 0.00 H ATOM 1439 H CYS A 99 57.939 34.590 -8.381 1.00 0.00 H ATOM 1440 N GLY A 100 56.669 32.542 -6.275 1.00 83.43 N ATOM 1441 CA GLY A 100 55.878 31.974 -5.200 1.00 82.39 C ATOM 1442 C GLY A 100 56.711 31.492 -4.026 1.00 80.94 C ATOM 1443 O GLY A 100 56.491 30.391 -3.512 1.00 81.11 O ATOM 1444 HA3 GLY A 100 55.315 31.128 -5.595 1.00 0.00 H ATOM 1445 HA2 GLY A 100 55.184 32.735 -4.842 1.00 0.00 H ATOM 1446 H GLY A 100 56.540 33.540 -6.540 1.00 0.00 H ATOM 1447 N SER A 101 57.672 32.306 -3.597 1.00 78.91 N ATOM 1448 CA SER A 101 58.444 31.981 -2.405 1.00 76.27 C ATOM 1449 C SER A 101 57.533 32.109 -1.193 1.00 73.60 C ATOM 1450 O SER A 101 56.577 32.882 -1.191 1.00 73.32 O ATOM 1451 CB SER A 101 59.644 32.922 -2.262 1.00 77.32 C ATOM 1452 OG SER A 101 60.547 32.449 -1.274 1.00 77.92 O ATOM 1453 HA SER A 101 58.825 30.963 -2.484 1.00 0.00 H ATOM 1454 HB2 SER A 101 59.289 33.912 -1.976 1.00 0.00 H ATOM 1455 HB3 SER A 101 60.163 32.986 -3.218 1.00 0.00 H ATOM 1456 HG SER A 101 61.312 33.074 -1.201 1.00 0.00 H ATOM 1457 H SER A 101 57.874 33.183 -4.118 1.00 0.00 H ATOM 1458 N SER A 102 57.839 31.337 -0.163 1.00 70.95 N ATOM 1459 CA SER A 102 56.921 31.138 0.939 1.00 67.68 C ATOM 1460 C SER A 102 57.035 32.276 1.964 1.00 65.32 C ATOM 1461 O SER A 102 56.049 32.659 2.581 1.00 64.79 O ATOM 1462 CB SER A 102 57.222 29.791 1.604 1.00 67.81 C ATOM 1463 OG SER A 102 56.240 29.456 2.563 1.00 69.39 O ATOM 1464 HA SER A 102 55.901 31.139 0.555 1.00 0.00 H ATOM 1465 HB2 SER A 102 58.193 29.848 2.096 1.00 0.00 H ATOM 1466 HB3 SER A 102 57.249 29.016 0.838 1.00 0.00 H ATOM 1467 HG SER A 102 56.464 28.583 2.972 1.00 0.00 H ATOM 1468 H SER A 102 58.763 30.861 -0.144 1.00 0.00 H ATOM 1469 N ASP A 103 58.239 32.804 2.155 1.00 61.50 N ATOM 1470 CA ASP A 103 58.444 33.861 3.139 1.00 58.56 C ATOM 1471 C ASP A 103 58.409 35.253 2.463 1.00 55.25 C ATOM 1472 O ASP A 103 59.133 35.510 1.505 1.00 54.37 O ATOM 1473 CB ASP A 103 59.777 33.626 3.897 1.00 59.02 C ATOM 1474 CG ASP A 103 59.736 32.380 4.864 1.00 61.48 C ATOM 1475 OD1 ASP A 103 60.726 31.595 4.862 1.00 62.97 O ATOM 1476 OD2 ASP A 103 58.746 32.188 5.626 1.00 55.26 O ATOM 1477 HA ASP A 103 57.632 33.834 3.866 1.00 0.00 H ATOM 1478 HB2 ASP A 103 60.569 33.469 3.164 1.00 0.00 H ATOM 1479 HB3 ASP A 103 60.001 34.515 4.487 1.00 0.00 H ATOM 1480 H ASP A 103 59.045 32.459 1.596 1.00 0.00 H ATOM 1481 N LEU A 104 57.540 36.136 2.949 1.00 50.81 N ATOM 1482 CA LEU A 104 57.372 37.458 2.347 1.00 47.88 C ATOM 1483 C LEU A 104 57.826 38.584 3.287 1.00 46.61 C ATOM 1484 O LEU A 104 58.131 38.343 4.456 1.00 46.99 O ATOM 1485 CB LEU A 104 55.903 37.677 1.959 1.00 44.63 C ATOM 1486 CG LEU A 104 55.289 36.563 1.097 1.00 44.64 C ATOM 1487 CD1 LEU A 104 53.786 36.723 1.028 1.00 41.36 C ATOM 1488 CD2 LEU A 104 55.896 36.605 -0.308 1.00 45.41 C ATOM 1489 HA LEU A 104 58.002 37.490 1.458 1.00 0.00 H ATOM 1490 HB2 LEU A 104 55.319 37.757 2.876 1.00 0.00 H ATOM 1491 HB3 LEU A 104 55.835 38.612 1.403 1.00 0.00 H ATOM 1492 HG LEU A 104 55.511 35.597 1.550 1.00 0.00 H ATOM 1493 HD21 LEU A 104 55.687 37.573 -0.764 1.00 0.00 H ATOM 1494 HD22 LEU A 104 56.974 36.459 -0.241 1.00 0.00 H ATOM 1495 HD23 LEU A 104 55.458 35.813 -0.916 1.00 0.00 H ATOM 1496 HD11 LEU A 104 53.369 36.667 2.034 1.00 0.00 H ATOM 1497 HD12 LEU A 104 53.545 37.690 0.587 1.00 0.00 H ATOM 1498 HD13 LEU A 104 53.365 35.927 0.414 1.00 0.00 H ATOM 1499 H LEU A 104 56.966 35.879 3.778 1.00 0.00 H ATOM 1500 N TYR A 105 57.873 39.814 2.777 1.00 44.42 N ATOM 1501 CA TYR A 105 58.276 40.952 3.595 1.00 42.53 C ATOM 1502 C TYR A 105 57.407 42.187 3.374 1.00 40.25 C ATOM 1503 O TYR A 105 57.346 42.750 2.275 1.00 39.48 O ATOM 1504 CB TYR A 105 59.759 41.274 3.352 1.00 44.33 C ATOM 1505 CG TYR A 105 60.669 40.082 3.617 1.00 48.78 C ATOM 1506 CD1 TYR A 105 60.844 39.086 2.652 1.00 49.59 C ATOM 1507 CD2 TYR A 105 61.326 39.935 4.836 1.00 48.25 C ATOM 1508 CE1 TYR A 105 61.645 37.972 2.897 1.00 50.69 C ATOM 1509 CE2 TYR A 105 62.128 38.829 5.090 1.00 50.59 C ATOM 1510 CZ TYR A 105 62.278 37.854 4.121 1.00 52.10 C ATOM 1511 OH TYR A 105 63.035 36.740 4.394 1.00 54.09 O ATOM 1512 HA TYR A 105 58.132 40.665 4.637 1.00 0.00 H ATOM 1513 HB3 TYR A 105 60.052 42.090 4.012 1.00 0.00 H ATOM 1514 HB2 TYR A 105 59.884 41.585 2.315 1.00 0.00 H ATOM 1515 HD2 TYR A 105 61.209 40.700 5.604 1.00 0.00 H ATOM 1516 HE2 TYR A 105 62.637 38.730 6.049 1.00 0.00 H ATOM 1517 HE1 TYR A 105 61.771 37.204 2.134 1.00 0.00 H ATOM 1518 HD1 TYR A 105 60.344 39.182 1.688 1.00 0.00 H ATOM 1519 HH TYR A 105 63.042 36.145 3.603 1.00 0.00 H ATOM 1520 H TYR A 105 57.618 39.965 1.780 1.00 0.00 H ATOM 1521 N LEU A 106 56.738 42.592 4.444 1.00 37.40 N ATOM 1522 CA LEU A 106 55.885 43.763 4.442 1.00 36.13 C ATOM 1523 C LEU A 106 56.690 45.017 4.764 1.00 35.89 C ATOM 1524 O LEU A 106 57.385 45.077 5.775 1.00 36.40 O ATOM 1525 CB LEU A 106 54.776 43.600 5.481 1.00 34.07 C ATOM 1526 CG LEU A 106 53.888 44.829 5.608 1.00 34.71 C ATOM 1527 CD1 LEU A 106 53.230 45.107 4.283 1.00 33.40 C ATOM 1528 CD2 LEU A 106 52.855 44.598 6.683 1.00 34.35 C ATOM 1529 HA LEU A 106 55.449 43.866 3.448 1.00 0.00 H ATOM 1530 HB2 LEU A 106 54.155 42.751 5.195 1.00 0.00 H ATOM 1531 HB3 LEU A 106 55.235 43.402 6.450 1.00 0.00 H ATOM 1532 HG LEU A 106 54.488 45.695 5.888 1.00 0.00 H ATOM 1533 HD21 LEU A 106 52.244 43.735 6.419 1.00 0.00 H ATOM 1534 HD22 LEU A 106 53.356 44.413 7.633 1.00 0.00 H ATOM 1535 HD23 LEU A 106 52.221 45.480 6.771 1.00 0.00 H ATOM 1536 HD11 LEU A 106 53.996 45.286 3.529 1.00 0.00 H ATOM 1537 HD12 LEU A 106 52.626 44.248 3.992 1.00 0.00 H ATOM 1538 HD13 LEU A 106 52.593 45.987 4.372 1.00 0.00 H ATOM 1539 H LEU A 106 56.829 42.045 5.324 1.00 0.00 H ATOM 1540 N VAL A 107 56.597 46.025 3.903 1.00 35.65 N ATOM 1541 CA VAL A 107 57.256 47.294 4.168 1.00 34.74 C ATOM 1542 C VAL A 107 56.205 48.237 4.787 1.00 35.55 C ATOM 1543 O VAL A 107 55.195 48.558 4.156 1.00 34.39 O ATOM 1544 CB VAL A 107 57.845 47.863 2.829 1.00 35.24 C ATOM 1545 CG1 VAL A 107 58.565 49.195 3.053 1.00 33.21 C ATOM 1546 CG2 VAL A 107 58.830 46.866 2.242 1.00 35.00 C ATOM 1547 HA VAL A 107 58.089 47.183 4.863 1.00 0.00 H ATOM 1548 HB VAL A 107 57.014 48.029 2.144 1.00 0.00 H ATOM 1549 HG11 VAL A 107 57.862 49.923 3.458 1.00 0.00 H ATOM 1550 HG12 VAL A 107 59.385 49.050 3.757 1.00 0.00 H ATOM 1551 HG13 VAL A 107 58.959 49.558 2.104 1.00 0.00 H ATOM 1552 HG21 VAL A 107 59.640 46.696 2.952 1.00 0.00 H ATOM 1553 HG22 VAL A 107 58.317 45.925 2.042 1.00 0.00 H ATOM 1554 HG23 VAL A 107 59.237 47.264 1.312 1.00 0.00 H ATOM 1555 H VAL A 107 56.046 45.905 3.029 1.00 0.00 H ATOM 1556 N THR A 108 56.428 48.669 6.023 1.00 34.81 N ATOM 1557 CA THR A 108 55.487 49.583 6.670 1.00 36.20 C ATOM 1558 C THR A 108 55.810 51.045 6.311 1.00 37.39 C ATOM 1559 O THR A 108 56.883 51.339 5.760 1.00 35.15 O ATOM 1560 CB THR A 108 55.521 49.429 8.217 1.00 37.54 C ATOM 1561 OG1 THR A 108 56.785 49.897 8.711 1.00 40.48 O ATOM 1562 CG2 THR A 108 55.351 47.978 8.619 1.00 37.72 C ATOM 1563 HA THR A 108 54.492 49.326 6.307 1.00 0.00 H ATOM 1564 HB THR A 108 54.703 50.013 8.639 1.00 0.00 H ATOM 1565 HG1 THR A 108 56.809 49.800 9.696 1.00 0.00 H ATOM 1566 HG23 THR A 108 54.394 47.610 8.250 1.00 0.00 H ATOM 1567 HG21 THR A 108 56.160 47.386 8.190 1.00 0.00 H ATOM 1568 HG22 THR A 108 55.378 47.898 9.706 1.00 0.00 H ATOM 1569 H THR A 108 57.278 48.355 6.534 1.00 0.00 H ATOM 1570 N ARG A 109 54.892 51.958 6.637 1.00 37.85 N ATOM 1571 CA ARG A 109 55.107 53.399 6.416 1.00 38.79 C ATOM 1572 C ARG A 109 56.297 53.943 7.219 1.00 39.48 C ATOM 1573 O ARG A 109 56.800 55.037 6.938 1.00 36.96 O ATOM 1574 CB ARG A 109 53.845 54.188 6.805 1.00 38.80 C ATOM 1575 CG ARG A 109 53.565 54.246 8.311 1.00 40.19 C ATOM 1576 CD ARG A 109 52.281 55.026 8.631 1.00 41.49 C ATOM 1577 NE ARG A 109 52.465 56.461 8.391 1.00 43.51 N ATOM 1578 CZ ARG A 109 51.980 57.124 7.346 1.00 43.46 C ATOM 1579 NH1 ARG A 109 51.260 56.497 6.419 1.00 42.64 N ATOM 1580 NH2 ARG A 109 52.221 58.422 7.224 1.00 44.23 N ATOM 1581 HA ARG A 109 55.326 53.526 5.356 1.00 0.00 H ATOM 1582 HB2 ARG A 109 53.957 55.209 6.441 1.00 0.00 H ATOM 1583 HB3 ARG A 109 52.989 53.721 6.318 1.00 0.00 H ATOM 1584 HG2 ARG A 109 53.462 53.229 8.689 1.00 0.00 H ATOM 1585 HG3 ARG A 109 54.405 54.733 8.806 1.00 0.00 H ATOM 1586 HD2 ARG A 109 52.020 54.870 9.678 1.00 0.00 H ATOM 1587 HD3 ARG A 109 51.473 54.659 7.998 1.00 0.00 H ATOM 1588 HE ARG A 109 53.016 57.000 9.090 1.00 0.00 H ATOM 1589 HH12 ARG A 109 50.886 57.026 5.606 1.00 0.00 H ATOM 1590 HH11 ARG A 109 51.072 55.478 6.508 1.00 0.00 H ATOM 1591 HH22 ARG A 109 51.844 58.946 6.409 1.00 0.00 H ATOM 1592 HH21 ARG A 109 52.787 58.916 7.944 1.00 0.00 H ATOM 1593 H ARG A 109 53.996 51.642 7.061 1.00 0.00 H ATOM 1594 N HIS A 110 56.729 53.185 8.227 1.00 39.50 N ATOM 1595 CA HIS A 110 57.845 53.601 9.069 1.00 40.69 C ATOM 1596 C HIS A 110 59.151 53.117 8.449 1.00 41.73 C ATOM 1597 O HIS A 110 60.217 53.213 9.073 1.00 42.49 O ATOM 1598 CB HIS A 110 57.738 52.997 10.480 1.00 42.75 C ATOM 1599 CG HIS A 110 56.374 53.091 11.094 1.00 45.16 C ATOM 1600 ND1 HIS A 110 55.835 54.283 11.531 1.00 46.94 N ATOM 1601 CD2 HIS A 110 55.459 52.135 11.380 1.00 45.50 C ATOM 1602 CE1 HIS A 110 54.646 54.054 12.063 1.00 46.60 C ATOM 1603 NE2 HIS A 110 54.396 52.758 11.985 1.00 46.40 N ATOM 1604 HA HIS A 110 57.821 54.688 9.142 1.00 0.00 H ATOM 1605 HB2 HIS A 110 58.014 51.944 10.422 1.00 0.00 H ATOM 1606 HB3 HIS A 110 58.441 53.520 11.129 1.00 0.00 H ATOM 1607 HD2 HIS A 110 55.550 51.069 11.169 1.00 0.00 H ATOM 1608 HE1 HIS A 110 53.984 54.806 12.493 1.00 0.00 H ATOM 1609 H HIS A 110 56.260 52.277 8.417 1.00 0.00 H ATOM 1610 N ALA A 111 59.062 52.578 7.232 1.00 40.66 N ATOM 1611 CA ALA A 111 60.232 52.039 6.527 1.00 40.55 C ATOM 1612 C ALA A 111 60.849 50.841 7.273 1.00 40.20 C ATOM 1613 O ALA A 111 62.052 50.607 7.192 1.00 37.18 O ATOM 1614 CB ALA A 111 61.288 53.149 6.333 1.00 38.75 C ATOM 1615 HA ALA A 111 59.898 51.681 5.553 1.00 0.00 H ATOM 1616 HB1 ALA A 111 60.857 53.960 5.746 1.00 0.00 H ATOM 1617 HB2 ALA A 111 61.598 53.528 7.307 1.00 0.00 H ATOM 1618 HB3 ALA A 111 62.152 52.739 5.809 1.00 0.00 H ATOM 1619 H ALA A 111 58.133 52.538 6.767 1.00 0.00 H ATOM 1620 N ASP A 112 60.020 50.109 8.016 1.00 42.61 N ATOM 1621 CA ASP A 112 60.417 48.834 8.605 1.00 44.69 C ATOM 1622 C ASP A 112 60.045 47.697 7.668 1.00 46.67 C ATOM 1623 O ASP A 112 59.102 47.808 6.890 1.00 48.00 O ATOM 1624 CB ASP A 112 59.722 48.622 9.952 1.00 46.93 C ATOM 1625 CG ASP A 112 60.215 49.590 11.026 1.00 49.29 C ATOM 1626 OD1 ASP A 112 59.474 49.832 11.997 1.00 51.20 O ATOM 1627 OD2 ASP A 112 61.347 50.108 10.894 1.00 51.00 O ATOM 1628 HA ASP A 112 61.496 48.849 8.761 1.00 0.00 H ATOM 1629 HB2 ASP A 112 58.650 48.765 9.818 1.00 0.00 H ATOM 1630 HB3 ASP A 112 59.912 47.602 10.287 1.00 0.00 H ATOM 1631 H ASP A 112 59.055 50.459 8.182 1.00 0.00 H ATOM 1632 N VAL A 113 60.810 46.613 7.739 1.00 47.44 N ATOM 1633 CA VAL A 113 60.621 45.476 6.862 1.00 46.75 C ATOM 1634 C VAL A 113 60.245 44.264 7.709 1.00 47.74 C ATOM 1635 O VAL A 113 61.054 43.769 8.488 1.00 48.00 O ATOM 1636 CB VAL A 113 61.910 45.188 6.062 1.00 47.00 C ATOM 1637 CG1 VAL A 113 61.739 43.938 5.205 1.00 46.90 C ATOM 1638 CG2 VAL A 113 62.240 46.388 5.171 1.00 46.64 C ATOM 1639 HA VAL A 113 59.825 45.693 6.150 1.00 0.00 H ATOM 1640 HB VAL A 113 62.728 45.019 6.762 1.00 0.00 H ATOM 1641 HG11 VAL A 113 61.523 43.085 5.848 1.00 0.00 H ATOM 1642 HG12 VAL A 113 60.915 44.087 4.508 1.00 0.00 H ATOM 1643 HG13 VAL A 113 62.658 43.752 4.649 1.00 0.00 H ATOM 1644 HG21 VAL A 113 61.416 46.563 4.480 1.00 0.00 H ATOM 1645 HG22 VAL A 113 62.389 47.271 5.793 1.00 0.00 H ATOM 1646 HG23 VAL A 113 63.150 46.181 4.608 1.00 0.00 H ATOM 1647 H VAL A 113 61.570 46.580 8.448 1.00 0.00 H ATOM 1648 N ILE A 114 59.013 43.793 7.554 1.00 46.22 N ATOM 1649 CA ILE A 114 58.460 42.816 8.471 1.00 45.78 C ATOM 1650 C ILE A 114 58.248 41.477 7.793 1.00 45.19 C ATOM 1651 O ILE A 114 57.547 41.378 6.781 1.00 44.12 O ATOM 1652 CB ILE A 114 57.113 43.290 9.045 1.00 48.30 C ATOM 1653 CG1 ILE A 114 57.309 44.590 9.816 1.00 48.77 C ATOM 1654 CG2 ILE A 114 56.544 42.247 9.993 1.00 48.55 C ATOM 1655 CD1 ILE A 114 56.056 45.009 10.533 1.00 51.81 C ATOM 1656 HA ILE A 114 59.184 42.703 9.278 1.00 0.00 H ATOM 1657 HB ILE A 114 56.423 43.445 8.216 1.00 0.00 H ATOM 1658 HG12 ILE A 114 58.104 44.450 10.548 1.00 0.00 H ATOM 1659 HG13 ILE A 114 57.595 45.376 9.117 1.00 0.00 H ATOM 1660 HD11 ILE A 114 55.256 45.158 9.807 1.00 0.00 H ATOM 1661 HD12 ILE A 114 55.766 44.232 11.240 1.00 0.00 H ATOM 1662 HD13 ILE A 114 56.240 45.940 11.070 1.00 0.00 H ATOM 1663 HG21 ILE A 114 56.391 41.312 9.453 1.00 0.00 H ATOM 1664 HG22 ILE A 114 57.243 42.084 10.814 1.00 0.00 H ATOM 1665 HG23 ILE A 114 55.592 42.599 10.389 1.00 0.00 H ATOM 1666 H ILE A 114 58.434 44.132 6.759 1.00 0.00 H ATOM 1667 N PRO A 115 58.864 40.421 8.350 1.00 45.36 N ATOM 1668 CA PRO A 115 58.738 39.036 7.874 1.00 43.32 C ATOM 1669 C PRO A 115 57.310 38.527 7.930 1.00 41.50 C ATOM 1670 O PRO A 115 56.668 38.549 8.981 1.00 41.62 O ATOM 1671 CB PRO A 115 59.651 38.246 8.811 1.00 44.20 C ATOM 1672 CG PRO A 115 60.642 39.264 9.303 1.00 45.68 C ATOM 1673 CD PRO A 115 59.879 40.549 9.416 1.00 44.05 C ATOM 1674 HA PRO A 115 59.016 38.939 6.825 1.00 0.00 H ATOM 1675 HD3 PRO A 115 59.410 40.643 10.396 1.00 0.00 H ATOM 1676 HD2 PRO A 115 60.527 41.408 9.241 1.00 0.00 H ATOM 1677 HG3 PRO A 115 61.463 39.370 8.594 1.00 0.00 H ATOM 1678 HG2 PRO A 115 61.039 38.970 10.275 1.00 0.00 H ATOM 1679 HB2 PRO A 115 59.083 37.826 9.641 1.00 0.00 H ATOM 1680 HB3 PRO A 115 60.155 37.443 8.274 1.00 0.00 H ATOM 1681 N VAL A 116 56.826 38.048 6.793 1.00 40.12 N ATOM 1682 CA VAL A 116 55.510 37.440 6.725 1.00 39.17 C ATOM 1683 C VAL A 116 55.629 36.044 6.109 1.00 39.99 C ATOM 1684 O VAL A 116 56.485 35.810 5.256 1.00 39.65 O ATOM 1685 CB VAL A 116 54.557 38.345 5.883 1.00 38.32 C ATOM 1686 CG1 VAL A 116 53.219 37.678 5.693 1.00 37.10 C ATOM 1687 CG2 VAL A 116 54.383 39.715 6.600 1.00 35.27 C ATOM 1688 HA VAL A 116 55.091 37.343 7.727 1.00 0.00 H ATOM 1689 HB VAL A 116 54.995 38.505 4.898 1.00 0.00 H ATOM 1690 HG11 VAL A 116 53.357 36.731 5.172 1.00 0.00 H ATOM 1691 HG12 VAL A 116 52.764 37.496 6.666 1.00 0.00 H ATOM 1692 HG13 VAL A 116 52.571 38.327 5.103 1.00 0.00 H ATOM 1693 HG21 VAL A 116 53.955 39.554 7.589 1.00 0.00 H ATOM 1694 HG22 VAL A 116 55.355 40.199 6.698 1.00 0.00 H ATOM 1695 HG23 VAL A 116 53.718 40.349 6.014 1.00 0.00 H ATOM 1696 H VAL A 116 57.403 38.109 5.930 1.00 0.00 H ATOM 1697 N ARG A 117 54.793 35.120 6.570 1.00 37.94 N ATOM 1698 CA ARG A 117 54.694 33.801 5.966 1.00 37.63 C ATOM 1699 C ARG A 117 53.407 33.740 5.163 1.00 38.45 C ATOM 1700 O ARG A 117 52.321 33.827 5.725 1.00 37.37 O ATOM 1701 CB ARG A 117 54.669 32.706 7.053 1.00 36.50 C ATOM 1702 CG ARG A 117 54.100 31.325 6.595 1.00 36.08 C ATOM 1703 CD ARG A 117 55.102 30.510 5.769 1.00 31.59 C ATOM 1704 NE ARG A 117 56.386 30.361 6.439 1.00 31.56 N ATOM 1705 CZ ARG A 117 56.728 29.334 7.221 1.00 33.18 C ATOM 1706 NH1 ARG A 117 55.880 28.338 7.437 1.00 32.50 N ATOM 1707 NH2 ARG A 117 57.926 29.318 7.812 1.00 34.27 N ATOM 1708 HA ARG A 117 55.558 33.630 5.324 1.00 0.00 H ATOM 1709 HB2 ARG A 117 55.691 32.552 7.400 1.00 0.00 H ATOM 1710 HB3 ARG A 117 54.057 33.066 7.880 1.00 0.00 H ATOM 1711 HG2 ARG A 117 53.829 30.749 7.480 1.00 0.00 H ATOM 1712 HG3 ARG A 117 53.210 31.499 5.990 1.00 0.00 H ATOM 1713 HD2 ARG A 117 55.261 31.014 4.816 1.00 0.00 H ATOM 1714 HD3 ARG A 117 54.684 29.519 5.590 1.00 0.00 H ATOM 1715 HE ARG A 117 57.091 31.112 6.298 1.00 0.00 H ATOM 1716 HH12 ARG A 117 56.156 27.543 8.048 1.00 0.00 H ATOM 1717 HH11 ARG A 117 54.938 28.352 6.996 1.00 0.00 H ATOM 1718 HH22 ARG A 117 58.195 28.519 8.421 1.00 0.00 H ATOM 1719 HH21 ARG A 117 58.590 30.104 7.663 1.00 0.00 H ATOM 1720 H ARG A 117 54.191 35.347 7.387 1.00 0.00 H ATOM 1721 N ARG A 118 53.527 33.591 3.851 1.00 40.36 N ATOM 1722 CA ARG A 118 52.357 33.398 3.005 1.00 44.60 C ATOM 1723 C ARG A 118 51.531 32.186 3.459 1.00 46.05 C ATOM 1724 O ARG A 118 52.070 31.091 3.618 1.00 47.71 O ATOM 1725 CB ARG A 118 52.797 33.214 1.551 1.00 46.87 C ATOM 1726 CG ARG A 118 51.659 32.824 0.621 1.00 51.49 C ATOM 1727 CD ARG A 118 51.156 33.993 -0.199 1.00 53.49 C ATOM 1728 NE ARG A 118 51.901 34.102 -1.446 1.00 57.21 N ATOM 1729 CZ ARG A 118 51.386 34.482 -2.613 1.00 58.23 C ATOM 1730 NH1 ARG A 118 50.098 34.802 -2.709 1.00 57.04 N ATOM 1731 NH2 ARG A 118 52.167 34.525 -3.692 1.00 57.12 N ATOM 1732 HA ARG A 118 51.727 34.284 3.089 1.00 0.00 H ATOM 1733 HB2 ARG A 118 53.226 34.152 1.198 1.00 0.00 H ATOM 1734 HB3 ARG A 118 53.556 32.432 1.516 1.00 0.00 H ATOM 1735 HG2 ARG A 118 52.012 32.047 -0.057 1.00 0.00 H ATOM 1736 HG3 ARG A 118 50.835 32.436 1.220 1.00 0.00 H ATOM 1737 HD2 ARG A 118 51.279 34.912 0.374 1.00 0.00 H ATOM 1738 HD3 ARG A 118 50.100 33.845 -0.424 1.00 0.00 H ATOM 1739 HE ARG A 118 52.913 33.865 -1.423 1.00 0.00 H ATOM 1740 HH12 ARG A 118 49.703 35.098 -3.624 1.00 0.00 H ATOM 1741 HH11 ARG A 118 49.487 34.756 -1.869 1.00 0.00 H ATOM 1742 HH22 ARG A 118 51.773 34.821 -4.608 1.00 0.00 H ATOM 1743 HH21 ARG A 118 53.171 34.263 -3.618 1.00 0.00 H ATOM 1744 H ARG A 118 54.473 33.612 3.419 1.00 0.00 H ATOM 1745 N ARG A 119 50.232 32.396 3.671 1.00 48.56 N ATOM 1746 CA ARG A 119 49.311 31.349 4.132 1.00 52.83 C ATOM 1747 C ARG A 119 48.305 31.004 3.039 1.00 53.94 C ATOM 1748 O ARG A 119 47.492 30.091 3.195 1.00 53.88 O ATOM 1749 CB ARG A 119 48.519 31.807 5.369 1.00 53.48 C ATOM 1750 CG ARG A 119 49.356 32.366 6.507 1.00 58.28 C ATOM 1751 CD ARG A 119 50.061 31.248 7.271 1.00 60.55 C ATOM 1752 NE ARG A 119 49.100 30.327 7.859 1.00 63.18 N ATOM 1753 CZ ARG A 119 48.653 30.408 9.107 1.00 64.90 C ATOM 1754 NH1 ARG A 119 49.086 31.376 9.909 1.00 63.45 N ATOM 1755 NH2 ARG A 119 47.761 29.525 9.546 1.00 66.05 N ATOM 1756 HA ARG A 119 49.918 30.479 4.383 1.00 0.00 H ATOM 1757 HB2 ARG A 119 47.820 32.581 5.053 1.00 0.00 H ATOM 1758 HB3 ARG A 119 47.963 30.950 5.749 1.00 0.00 H ATOM 1759 HG2 ARG A 119 50.104 33.045 6.099 1.00 0.00 H ATOM 1760 HG3 ARG A 119 48.707 32.912 7.192 1.00 0.00 H ATOM 1761 HD2 ARG A 119 50.666 31.686 8.065 1.00 0.00 H ATOM 1762 HD3 ARG A 119 50.706 30.699 6.585 1.00 0.00 H ATOM 1763 HE ARG A 119 48.740 29.555 7.263 1.00 0.00 H ATOM 1764 HH12 ARG A 119 48.735 31.438 10.886 1.00 0.00 H ATOM 1765 HH11 ARG A 119 49.776 32.071 9.559 1.00 0.00 H ATOM 1766 HH22 ARG A 119 47.408 29.584 10.522 1.00 0.00 H ATOM 1767 HH21 ARG A 119 47.416 28.775 8.913 1.00 0.00 H ATOM 1768 H ARG A 119 49.852 33.349 3.501 1.00 0.00 H ATOM 1769 N GLY A 120 48.348 31.756 1.945 1.00 54.99 N ATOM 1770 CA GLY A 120 47.385 31.568 0.876 1.00 55.13 C ATOM 1771 C GLY A 120 47.459 32.711 -0.109 1.00 55.38 C ATOM 1772 O GLY A 120 48.356 33.550 -0.024 1.00 54.87 O ATOM 1773 HA3 GLY A 120 46.382 31.524 1.300 1.00 0.00 H ATOM 1774 HA2 GLY A 120 47.601 30.633 0.358 1.00 0.00 H ATOM 1775 H GLY A 120 49.081 32.488 1.853 1.00 0.00 H ATOM 1776 N ASP A 121 46.524 32.760 -1.046 1.00 56.08 N ATOM 1777 CA ASP A 121 46.643 33.712 -2.137 1.00 57.74 C ATOM 1778 C ASP A 121 46.721 35.169 -1.674 1.00 56.97 C ATOM 1779 O ASP A 121 47.513 35.959 -2.206 1.00 55.81 O ATOM 1780 CB ASP A 121 45.484 33.524 -3.132 1.00 61.03 C ATOM 1781 CG ASP A 121 45.666 32.278 -4.004 1.00 65.21 C ATOM 1782 OD1 ASP A 121 46.838 31.932 -4.308 1.00 66.86 O ATOM 1783 OD2 ASP A 121 44.648 31.648 -4.374 1.00 67.38 O ATOM 1784 HA ASP A 121 47.592 33.501 -2.630 1.00 0.00 H ATOM 1785 HB2 ASP A 121 44.553 33.429 -2.573 1.00 0.00 H ATOM 1786 HB3 ASP A 121 45.430 34.400 -3.778 1.00 0.00 H ATOM 1787 H ASP A 121 45.707 32.119 -1.001 1.00 0.00 H ATOM 1788 N SER A 122 45.910 35.520 -0.683 1.00 55.14 N ATOM 1789 CA SER A 122 45.812 36.908 -0.252 1.00 54.92 C ATOM 1790 C SER A 122 45.950 37.041 1.268 1.00 52.76 C ATOM 1791 O SER A 122 45.536 38.037 1.857 1.00 51.86 O ATOM 1792 CB SER A 122 44.471 37.512 -0.708 1.00 56.15 C ATOM 1793 OG SER A 122 43.423 37.167 0.181 1.00 58.56 O ATOM 1794 HA SER A 122 46.635 37.454 -0.713 1.00 0.00 H ATOM 1795 HB2 SER A 122 44.232 37.136 -1.703 1.00 0.00 H ATOM 1796 HB3 SER A 122 44.564 38.597 -0.744 1.00 0.00 H ATOM 1797 HG SER A 122 43.633 37.510 1.086 1.00 0.00 H ATOM 1798 H SER A 122 45.337 34.794 -0.208 1.00 0.00 H ATOM 1799 N ARG A 123 46.524 36.022 1.895 1.00 50.70 N ATOM 1800 CA ARG A 123 46.667 35.984 3.339 1.00 48.15 C ATOM 1801 C ARG A 123 48.113 35.686 3.716 1.00 47.18 C ATOM 1802 O ARG A 123 48.804 34.906 3.051 1.00 42.85 O ATOM 1803 CB ARG A 123 45.735 34.926 3.915 1.00 50.57 C ATOM 1804 CG ARG A 123 45.665 34.885 5.437 1.00 56.82 C ATOM 1805 CD ARG A 123 45.187 36.223 6.007 1.00 59.11 C ATOM 1806 NE ARG A 123 43.749 36.420 5.841 1.00 59.98 N ATOM 1807 CZ ARG A 123 42.836 36.016 6.718 1.00 59.95 C ATOM 1808 NH1 ARG A 123 43.218 35.382 7.824 1.00 60.34 N ATOM 1809 NH2 ARG A 123 41.551 36.267 6.499 1.00 56.41 N ATOM 1810 HA ARG A 123 46.399 36.956 3.754 1.00 0.00 H ATOM 1811 HB2 ARG A 123 44.731 35.117 3.536 1.00 0.00 H ATOM 1812 HB3 ARG A 123 46.074 33.951 3.566 1.00 0.00 H ATOM 1813 HG2 ARG A 123 44.971 34.101 5.740 1.00 0.00 H ATOM 1814 HG3 ARG A 123 46.656 34.664 5.833 1.00 0.00 H ATOM 1815 HD2 ARG A 123 45.712 37.029 5.495 1.00 0.00 H ATOM 1816 HD3 ARG A 123 45.424 36.255 7.070 1.00 0.00 H ATOM 1817 HE ARG A 123 43.419 36.907 4.983 1.00 0.00 H ATOM 1818 HH12 ARG A 123 42.507 35.064 8.513 1.00 0.00 H ATOM 1819 HH11 ARG A 123 44.228 35.204 7.999 1.00 0.00 H ATOM 1820 HH22 ARG A 123 40.835 35.951 7.184 1.00 0.00 H ATOM 1821 HH21 ARG A 123 41.260 36.779 5.642 1.00 0.00 H ATOM 1822 H ARG A 123 46.883 35.224 1.333 1.00 0.00 H ATOM 1823 N GLY A 124 48.563 36.325 4.788 1.00 46.90 N ATOM 1824 CA GLY A 124 49.933 36.160 5.232 1.00 47.15 C ATOM 1825 C GLY A 124 49.995 36.224 6.750 1.00 47.41 C ATOM 1826 O GLY A 124 49.309 37.031 7.379 1.00 46.11 O ATOM 1827 HA3 GLY A 124 50.548 36.955 4.811 1.00 0.00 H ATOM 1828 HA2 GLY A 124 50.309 35.194 4.895 1.00 0.00 H ATOM 1829 H GLY A 124 47.924 36.953 5.317 1.00 0.00 H ATOM 1830 N SER A 125 50.808 35.364 7.348 1.00 46.58 N ATOM 1831 CA SER A 125 50.984 35.379 8.788 1.00 47.24 C ATOM 1832 C SER A 125 52.226 36.190 9.176 1.00 46.80 C ATOM 1833 O SER A 125 53.282 36.074 8.541 1.00 47.04 O ATOM 1834 CB SER A 125 51.126 33.951 9.306 1.00 48.57 C ATOM 1835 OG SER A 125 51.294 33.957 10.706 1.00 54.48 O ATOM 1836 HA SER A 125 50.108 35.847 9.236 1.00 0.00 H ATOM 1837 HB2 SER A 125 51.994 33.483 8.841 1.00 0.00 H ATOM 1838 HB3 SER A 125 50.230 33.385 9.053 1.00 0.00 H ATOM 1839 HG SER A 125 51.385 33.026 11.030 1.00 0.00 H ATOM 1840 H SER A 125 51.328 34.668 6.776 1.00 0.00 H ATOM 1841 N LEU A 126 52.098 37.002 10.221 1.00 45.82 N ATOM 1842 CA LEU A 126 53.255 37.657 10.826 1.00 47.52 C ATOM 1843 C LEU A 126 54.053 36.680 11.699 1.00 47.88 C ATOM 1844 O LEU A 126 53.559 36.200 12.716 1.00 47.93 O ATOM 1845 CB LEU A 126 52.803 38.848 11.682 1.00 46.34 C ATOM 1846 CG LEU A 126 52.065 39.966 10.922 1.00 44.39 C ATOM 1847 CD1 LEU A 126 51.459 40.960 11.908 1.00 44.30 C ATOM 1848 CD2 LEU A 126 52.997 40.651 9.982 1.00 42.53 C ATOM 1849 HA LEU A 126 53.897 38.008 10.018 1.00 0.00 H ATOM 1850 HB2 LEU A 126 52.136 38.471 12.457 1.00 0.00 H ATOM 1851 HB3 LEU A 126 53.688 39.284 12.146 1.00 0.00 H ATOM 1852 HG LEU A 126 51.256 39.525 10.340 1.00 0.00 H ATOM 1853 HD21 LEU A 126 53.823 41.086 10.544 1.00 0.00 H ATOM 1854 HD22 LEU A 126 53.385 39.927 9.265 1.00 0.00 H ATOM 1855 HD23 LEU A 126 52.462 41.439 9.452 1.00 0.00 H ATOM 1856 HD11 LEU A 126 50.753 40.442 12.557 1.00 0.00 H ATOM 1857 HD12 LEU A 126 52.252 41.401 12.511 1.00 0.00 H ATOM 1858 HD13 LEU A 126 50.940 41.745 11.358 1.00 0.00 H ATOM 1859 H LEU A 126 51.152 37.175 10.617 1.00 0.00 H ATOM 1860 N LEU A 127 55.284 36.381 11.296 1.00 49.29 N ATOM 1861 CA LEU A 127 56.139 35.494 12.076 1.00 50.51 C ATOM 1862 C LEU A 127 56.273 36.022 13.500 1.00 51.19 C ATOM 1863 O LEU A 127 56.464 35.255 14.440 1.00 51.80 O ATOM 1864 CB LEU A 127 57.517 35.386 11.427 1.00 50.93 C ATOM 1865 CG LEU A 127 57.507 34.692 10.060 1.00 53.32 C ATOM 1866 CD1 LEU A 127 58.938 34.617 9.546 1.00 54.55 C ATOM 1867 CD2 LEU A 127 56.901 33.304 10.170 1.00 51.62 C ATOM 1868 HA LEU A 127 55.686 34.503 12.105 1.00 0.00 H ATOM 1869 HB2 LEU A 127 57.916 36.392 11.299 1.00 0.00 H ATOM 1870 HB3 LEU A 127 58.168 34.821 12.094 1.00 0.00 H ATOM 1871 HG LEU A 127 56.896 35.262 9.360 1.00 0.00 H ATOM 1872 HD21 LEU A 127 57.489 32.706 10.866 1.00 0.00 H ATOM 1873 HD22 LEU A 127 55.877 33.384 10.534 1.00 0.00 H ATOM 1874 HD23 LEU A 127 56.904 32.829 9.189 1.00 0.00 H ATOM 1875 HD11 LEU A 127 59.341 35.625 9.449 1.00 0.00 H ATOM 1876 HD12 LEU A 127 59.546 34.047 10.249 1.00 0.00 H ATOM 1877 HD13 LEU A 127 58.948 34.125 8.573 1.00 0.00 H ATOM 1878 H LEU A 127 55.644 36.787 10.409 1.00 0.00 H ATOM 1879 N SER A 128 56.164 37.340 13.646 1.00 51.81 N ATOM 1880 CA SER A 128 56.196 37.989 14.950 1.00 52.04 C ATOM 1881 C SER A 128 55.047 38.996 15.054 1.00 51.01 C ATOM 1882 O SER A 128 54.949 39.928 14.254 1.00 51.05 O ATOM 1883 CB SER A 128 57.537 38.708 15.130 1.00 53.61 C ATOM 1884 OG SER A 128 57.833 38.877 16.501 1.00 57.03 O ATOM 1885 HA SER A 128 56.083 37.238 15.732 1.00 0.00 H ATOM 1886 HB2 SER A 128 57.486 39.686 14.651 1.00 0.00 H ATOM 1887 HB3 SER A 128 58.325 38.117 14.664 1.00 0.00 H ATOM 1888 HG SER A 128 58.702 39.343 16.595 1.00 0.00 H ATOM 1889 H SER A 128 56.052 37.930 12.797 1.00 0.00 H ATOM 1890 N PRO A 129 54.160 38.814 16.042 1.00 49.59 N ATOM 1891 CA PRO A 129 52.986 39.677 16.236 1.00 47.74 C ATOM 1892 C PRO A 129 53.333 41.152 16.457 1.00 46.82 C ATOM 1893 O PRO A 129 54.355 41.480 17.054 1.00 45.05 O ATOM 1894 CB PRO A 129 52.290 39.076 17.460 1.00 49.69 C ATOM 1895 CG PRO A 129 52.810 37.667 17.541 1.00 49.57 C ATOM 1896 CD PRO A 129 54.212 37.721 17.027 1.00 49.15 C ATOM 1897 HA PRO A 129 52.359 39.695 15.344 1.00 0.00 H ATOM 1898 HD3 PRO A 129 54.915 37.948 17.828 1.00 0.00 H ATOM 1899 HD2 PRO A 129 54.493 36.780 16.554 1.00 0.00 H ATOM 1900 HG3 PRO A 129 52.205 37.002 16.925 1.00 0.00 H ATOM 1901 HG2 PRO A 129 52.797 37.316 18.573 1.00 0.00 H ATOM 1902 HB2 PRO A 129 52.547 39.633 18.361 1.00 0.00 H ATOM 1903 HB3 PRO A 129 51.208 39.080 17.328 1.00 0.00 H ATOM 1904 N ARG A 130 52.475 42.042 15.966 1.00 46.27 N ATOM 1905 CA ARG A 130 52.686 43.480 16.138 1.00 45.59 C ATOM 1906 C ARG A 130 51.386 44.154 16.580 1.00 43.69 C ATOM 1907 O ARG A 130 50.297 43.663 16.303 1.00 42.97 O ATOM 1908 CB ARG A 130 53.194 44.110 14.830 1.00 46.52 C ATOM 1909 CG ARG A 130 54.714 44.363 14.761 1.00 52.42 C ATOM 1910 CD ARG A 130 55.475 43.132 14.300 1.00 55.08 C ATOM 1911 NE ARG A 130 56.911 43.347 14.082 1.00 57.30 N ATOM 1912 CZ ARG A 130 57.701 42.462 13.465 1.00 57.77 C ATOM 1913 NH1 ARG A 130 57.177 41.332 13.015 1.00 58.19 N ATOM 1914 NH2 ARG A 130 59.003 42.687 13.303 1.00 53.06 N ATOM 1915 HA ARG A 130 53.441 43.630 16.910 1.00 0.00 H ATOM 1916 HB2 ARG A 130 52.927 43.443 14.010 1.00 0.00 H ATOM 1917 HB3 ARG A 130 52.688 45.066 14.699 1.00 0.00 H ATOM 1918 HG2 ARG A 130 54.904 45.177 14.062 1.00 0.00 H ATOM 1919 HG3 ARG A 130 55.069 44.646 15.752 1.00 0.00 H ATOM 1920 HD2 ARG A 130 55.036 42.792 13.362 1.00 0.00 H ATOM 1921 HD3 ARG A 130 55.358 42.356 15.057 1.00 0.00 H ATOM 1922 HE ARG A 130 57.335 44.232 14.425 1.00 0.00 H ATOM 1923 HH12 ARG A 130 57.780 40.635 12.533 1.00 0.00 H ATOM 1924 HH11 ARG A 130 56.163 41.142 13.143 1.00 0.00 H ATOM 1925 HH22 ARG A 130 59.596 41.983 12.820 1.00 0.00 H ATOM 1926 HH21 ARG A 130 59.427 43.567 13.660 1.00 0.00 H ATOM 1927 H ARG A 130 51.636 41.709 15.449 1.00 0.00 H ATOM 1928 N PRO A 131 51.490 45.286 17.291 1.00 42.76 N ATOM 1929 CA PRO A 131 50.301 46.120 17.522 1.00 41.51 C ATOM 1930 C PRO A 131 49.620 46.520 16.202 1.00 41.82 C ATOM 1931 O PRO A 131 50.290 46.850 15.214 1.00 40.84 O ATOM 1932 CB PRO A 131 50.854 47.339 18.263 1.00 40.98 C ATOM 1933 CG PRO A 131 52.137 46.869 18.877 1.00 41.29 C ATOM 1934 CD PRO A 131 52.701 45.850 17.919 1.00 41.14 C ATOM 1935 HA PRO A 131 49.528 45.599 18.087 1.00 0.00 H ATOM 1936 HD3 PRO A 131 53.345 46.322 17.177 1.00 0.00 H ATOM 1937 HD2 PRO A 131 53.263 45.081 18.449 1.00 0.00 H ATOM 1938 HG3 PRO A 131 51.949 46.413 19.849 1.00 0.00 H ATOM 1939 HG2 PRO A 131 52.829 47.703 18.996 1.00 0.00 H ATOM 1940 HB2 PRO A 131 51.039 48.159 17.569 1.00 0.00 H ATOM 1941 HB3 PRO A 131 50.157 47.668 19.034 1.00 0.00 H ATOM 1942 N VAL A 132 48.292 46.479 16.196 1.00 40.38 N ATOM 1943 CA VAL A 132 47.507 47.003 15.088 1.00 42.75 C ATOM 1944 C VAL A 132 47.876 48.468 14.802 1.00 43.03 C ATOM 1945 O VAL A 132 48.051 48.864 13.651 1.00 42.43 O ATOM 1946 CB VAL A 132 46.006 46.931 15.411 1.00 44.19 C ATOM 1947 CG1 VAL A 132 45.198 47.630 14.324 1.00 47.77 C ATOM 1948 CG2 VAL A 132 45.582 45.476 15.532 1.00 45.75 C ATOM 1949 HA VAL A 132 47.727 46.394 14.211 1.00 0.00 H ATOM 1950 HB VAL A 132 45.818 47.438 16.358 1.00 0.00 H ATOM 1951 HG11 VAL A 132 45.500 48.676 14.264 1.00 0.00 H ATOM 1952 HG12 VAL A 132 45.381 47.142 13.367 1.00 0.00 H ATOM 1953 HG13 VAL A 132 44.137 47.571 14.567 1.00 0.00 H ATOM 1954 HG21 VAL A 132 45.776 44.963 14.590 1.00 0.00 H ATOM 1955 HG22 VAL A 132 46.149 44.999 16.331 1.00 0.00 H ATOM 1956 HG23 VAL A 132 44.517 45.427 15.761 1.00 0.00 H ATOM 1957 H VAL A 132 47.798 46.059 17.009 1.00 0.00 H ATOM 1958 N SER A 133 47.994 49.268 15.857 1.00 42.42 N ATOM 1959 CA SER A 133 48.289 50.681 15.715 1.00 44.27 C ATOM 1960 C SER A 133 49.605 50.891 14.975 1.00 44.44 C ATOM 1961 O SER A 133 49.751 51.840 14.218 1.00 46.03 O ATOM 1962 CB SER A 133 48.349 51.347 17.094 1.00 45.30 C ATOM 1963 OG SER A 133 49.314 50.729 17.931 1.00 50.86 O ATOM 1964 HA SER A 133 47.491 51.140 15.131 1.00 0.00 H ATOM 1965 HB2 SER A 133 47.370 51.271 17.567 1.00 0.00 H ATOM 1966 HB3 SER A 133 48.610 52.398 16.969 1.00 0.00 H ATOM 1967 HG SER A 133 49.080 49.775 18.054 1.00 0.00 H ATOM 1968 H SER A 133 47.871 48.870 16.810 1.00 0.00 H ATOM 1969 N TYR A 134 50.562 49.998 15.190 1.00 44.03 N ATOM 1970 CA TYR A 134 51.821 50.053 14.464 1.00 40.66 C ATOM 1971 C TYR A 134 51.651 49.831 12.944 1.00 40.19 C ATOM 1972 O TYR A 134 52.393 50.399 12.155 1.00 39.87 O ATOM 1973 CB TYR A 134 52.788 49.014 15.047 1.00 43.66 C ATOM 1974 CG TYR A 134 54.032 48.803 14.213 1.00 45.29 C ATOM 1975 CD1 TYR A 134 55.106 49.683 14.290 1.00 45.81 C ATOM 1976 CD2 TYR A 134 54.108 47.742 13.321 1.00 45.99 C ATOM 1977 CE1 TYR A 134 56.223 49.509 13.491 1.00 48.86 C ATOM 1978 CE2 TYR A 134 55.207 47.556 12.521 1.00 48.23 C ATOM 1979 CZ TYR A 134 56.262 48.442 12.605 1.00 49.61 C ATOM 1980 OH TYR A 134 57.351 48.278 11.772 1.00 53.66 O ATOM 1981 HA TYR A 134 52.225 51.058 14.586 1.00 0.00 H ATOM 1982 HB3 TYR A 134 52.263 48.062 15.128 1.00 0.00 H ATOM 1983 HB2 TYR A 134 53.092 49.346 16.040 1.00 0.00 H ATOM 1984 HD2 TYR A 134 53.276 47.041 13.255 1.00 0.00 H ATOM 1985 HE2 TYR A 134 55.247 46.717 11.826 1.00 0.00 H ATOM 1986 HE1 TYR A 134 57.062 50.202 13.557 1.00 0.00 H ATOM 1987 HD1 TYR A 134 55.068 50.520 14.988 1.00 0.00 H ATOM 1988 HH TYR A 134 58.015 48.989 11.955 1.00 0.00 H ATOM 1989 H TYR A 134 50.409 49.245 15.891 1.00 0.00 H ATOM 1990 N LEU A 135 50.696 48.997 12.528 1.00 38.59 N ATOM 1991 CA LEU A 135 50.473 48.733 11.098 1.00 36.79 C ATOM 1992 C LEU A 135 49.562 49.779 10.462 1.00 36.84 C ATOM 1993 O LEU A 135 49.553 49.956 9.241 1.00 35.09 O ATOM 1994 CB LEU A 135 49.857 47.349 10.903 1.00 34.76 C ATOM 1995 CG LEU A 135 50.739 46.167 11.328 1.00 36.31 C ATOM 1996 CD1 LEU A 135 50.020 44.828 11.073 1.00 35.09 C ATOM 1997 CD2 LEU A 135 52.027 46.221 10.562 1.00 32.91 C ATOM 1998 HA LEU A 135 51.446 48.780 10.608 1.00 0.00 H ATOM 1999 HB2 LEU A 135 48.935 47.306 11.484 1.00 0.00 H ATOM 2000 HB3 LEU A 135 49.624 47.231 9.845 1.00 0.00 H ATOM 2001 HG LEU A 135 50.943 46.237 12.396 1.00 0.00 H ATOM 2002 HD21 LEU A 135 51.816 46.159 9.494 1.00 0.00 H ATOM 2003 HD22 LEU A 135 52.538 47.159 10.779 1.00 0.00 H ATOM 2004 HD23 LEU A 135 52.660 45.384 10.858 1.00 0.00 H ATOM 2005 HD11 LEU A 135 49.093 44.800 11.646 1.00 0.00 H ATOM 2006 HD12 LEU A 135 49.794 44.735 10.011 1.00 0.00 H ATOM 2007 HD13 LEU A 135 50.665 44.006 11.382 1.00 0.00 H ATOM 2008 H LEU A 135 50.095 48.522 13.232 1.00 0.00 H ATOM 2009 N LYS A 136 48.802 50.475 11.305 1.00 37.86 N ATOM 2010 CA LYS A 136 47.786 51.419 10.843 1.00 37.86 C ATOM 2011 C LYS A 136 48.496 52.512 10.033 1.00 36.85 C ATOM 2012 O LYS A 136 49.535 53.033 10.443 1.00 34.73 O ATOM 2013 CB LYS A 136 47.050 52.009 12.069 1.00 41.06 C ATOM 2014 CG LYS A 136 45.769 52.804 11.802 1.00 43.68 C ATOM 2015 CD LYS A 136 44.770 52.082 10.879 1.00 46.39 C ATOM 2016 CE LYS A 136 43.732 51.279 11.670 1.00 51.18 C ATOM 2017 NZ LYS A 136 42.653 50.751 10.765 1.00 52.62 N ATOM 2018 HA LYS A 136 47.044 50.932 10.211 1.00 0.00 H ATOM 2019 HB2 LYS A 136 46.790 51.179 12.726 1.00 0.00 H ATOM 2020 HB3 LYS A 136 47.747 52.672 12.582 1.00 0.00 H ATOM 2021 HG2 LYS A 136 45.278 52.996 12.756 1.00 0.00 H ATOM 2022 HG3 LYS A 136 46.043 53.752 11.338 1.00 0.00 H ATOM 2023 HD2 LYS A 136 44.252 52.824 10.272 1.00 0.00 H ATOM 2024 HD3 LYS A 136 45.320 51.402 10.229 1.00 0.00 H ATOM 2025 HE2 LYS A 136 43.281 51.924 12.424 1.00 0.00 H ATOM 2026 HE3 LYS A 136 44.228 50.441 12.160 1.00 0.00 H ATOM 2027 HZ1 LYS A 136 42.174 51.547 10.298 1.00 0.00 H ATOM 2028 HZ2 LYS A 136 43.078 50.131 10.046 1.00 0.00 H ATOM 2029 HZ3 LYS A 136 41.964 50.211 11.327 1.00 0.00 H ATOM 2030 H LYS A 136 48.936 50.342 12.328 1.00 0.00 H ATOM 2031 N GLY A 137 47.947 52.829 8.866 1.00 34.99 N ATOM 2032 CA GLY A 137 48.600 53.772 7.976 1.00 34.55 C ATOM 2033 C GLY A 137 49.550 53.146 6.958 1.00 35.80 C ATOM 2034 O GLY A 137 50.169 53.872 6.176 1.00 36.50 O ATOM 2035 HA3 GLY A 137 49.171 54.473 8.585 1.00 0.00 H ATOM 2036 HA2 GLY A 137 47.827 54.313 7.430 1.00 0.00 H ATOM 2037 H GLY A 137 47.042 52.398 8.588 1.00 0.00 H ATOM 2038 N SER A 138 49.664 51.818 6.955 1.00 34.06 N ATOM 2039 CA SER A 138 50.527 51.113 6.011 1.00 34.70 C ATOM 2040 C SER A 138 49.761 50.349 4.912 1.00 34.17 C ATOM 2041 O SER A 138 50.366 49.674 4.079 1.00 35.25 O ATOM 2042 CB SER A 138 51.440 50.135 6.765 1.00 33.44 C ATOM 2043 OG SER A 138 52.417 50.837 7.517 1.00 36.37 O ATOM 2044 HA SER A 138 51.112 51.883 5.508 1.00 0.00 H ATOM 2045 HB2 SER A 138 51.940 49.486 6.046 1.00 0.00 H ATOM 2046 HB3 SER A 138 50.836 49.530 7.440 1.00 0.00 H ATOM 2047 HG SER A 138 51.966 51.425 8.174 1.00 0.00 H ATOM 2048 H SER A 138 49.120 51.265 7.648 1.00 0.00 H ATOM 2049 N SER A 139 48.437 50.444 4.908 1.00 35.34 N ATOM 2050 CA SER A 139 47.648 49.941 3.793 1.00 35.61 C ATOM 2051 C SER A 139 48.183 50.545 2.498 1.00 34.81 C ATOM 2052 O SER A 139 48.514 51.726 2.447 1.00 35.90 O ATOM 2053 CB SER A 139 46.172 50.324 3.967 1.00 36.75 C ATOM 2054 OG SER A 139 45.994 51.726 3.876 1.00 40.00 O ATOM 2055 HA SER A 139 47.724 48.854 3.759 1.00 0.00 H ATOM 2056 HB2 SER A 139 45.829 49.984 4.944 1.00 0.00 H ATOM 2057 HB3 SER A 139 45.584 49.839 3.188 1.00 0.00 H ATOM 2058 HG SER A 139 46.523 52.171 4.585 1.00 0.00 H ATOM 2059 H SER A 139 47.955 50.886 5.716 1.00 0.00 H ATOM 2060 N GLY A 140 48.271 49.727 1.456 1.00 35.13 N ATOM 2061 CA GLY A 140 48.914 50.155 0.231 1.00 34.63 C ATOM 2062 C GLY A 140 50.376 49.754 0.155 1.00 35.04 C ATOM 2063 O GLY A 140 50.945 49.699 -0.934 1.00 34.92 O ATOM 2064 HA3 GLY A 140 48.848 51.241 0.165 1.00 0.00 H ATOM 2065 HA2 GLY A 140 48.387 49.708 -0.612 1.00 0.00 H ATOM 2066 H GLY A 140 47.874 48.768 1.520 1.00 0.00 H ATOM 2067 N GLY A 141 50.993 49.479 1.302 1.00 34.22 N ATOM 2068 CA GLY A 141 52.396 49.083 1.307 1.00 33.11 C ATOM 2069 C GLY A 141 52.609 47.694 0.694 1.00 34.34 C ATOM 2070 O GLY A 141 51.728 46.833 0.753 1.00 32.30 O ATOM 2071 HA3 GLY A 141 52.754 49.071 2.337 1.00 0.00 H ATOM 2072 HA2 GLY A 141 52.969 49.812 0.733 1.00 0.00 H ATOM 2073 H GLY A 141 50.471 49.547 2.199 1.00 0.00 H ATOM 2074 N PRO A 142 53.780 47.456 0.081 1.00 34.27 N ATOM 2075 CA PRO A 142 54.093 46.234 -0.668 1.00 35.70 C ATOM 2076 C PRO A 142 54.474 45.035 0.221 1.00 37.32 C ATOM 2077 O PRO A 142 55.242 45.178 1.182 1.00 37.20 O ATOM 2078 CB PRO A 142 55.269 46.652 -1.555 1.00 35.59 C ATOM 2079 CG PRO A 142 55.994 47.658 -0.717 1.00 33.77 C ATOM 2080 CD PRO A 142 54.898 48.420 0.040 1.00 32.90 C ATOM 2081 HA PRO A 142 53.223 45.878 -1.220 1.00 0.00 H ATOM 2082 HD3 PRO A 142 55.227 48.680 1.046 1.00 0.00 H ATOM 2083 HD2 PRO A 142 54.613 49.327 -0.494 1.00 0.00 H ATOM 2084 HG3 PRO A 142 56.567 48.338 -1.347 1.00 0.00 H ATOM 2085 HG2 PRO A 142 56.666 47.160 -0.018 1.00 0.00 H ATOM 2086 HB2 PRO A 142 55.909 45.799 -1.783 1.00 0.00 H ATOM 2087 HB3 PRO A 142 54.917 47.099 -2.485 1.00 0.00 H ATOM 2088 N LEU A 143 53.954 43.859 -0.123 1.00 38.41 N ATOM 2089 CA LEU A 143 54.554 42.609 0.308 1.00 40.05 C ATOM 2090 C LEU A 143 55.526 42.139 -0.763 1.00 42.89 C ATOM 2091 O LEU A 143 55.146 41.993 -1.924 1.00 42.21 O ATOM 2092 CB LEU A 143 53.492 41.540 0.526 1.00 41.30 C ATOM 2093 CG LEU A 143 52.773 41.634 1.864 1.00 44.24 C ATOM 2094 CD1 LEU A 143 51.654 42.670 1.773 1.00 44.60 C ATOM 2095 CD2 LEU A 143 52.242 40.277 2.242 1.00 46.33 C ATOM 2096 HA LEU A 143 55.073 42.774 1.252 1.00 0.00 H ATOM 2097 HB2 LEU A 143 52.750 41.629 -0.267 1.00 0.00 H ATOM 2098 HB3 LEU A 143 53.973 40.564 0.464 1.00 0.00 H ATOM 2099 HG LEU A 143 53.466 41.956 2.641 1.00 0.00 H ATOM 2100 HD21 LEU A 143 51.545 39.935 1.477 1.00 0.00 H ATOM 2101 HD22 LEU A 143 53.071 39.573 2.322 1.00 0.00 H ATOM 2102 HD23 LEU A 143 51.727 40.344 3.200 1.00 0.00 H ATOM 2103 HD11 LEU A 143 52.079 43.641 1.521 1.00 0.00 H ATOM 2104 HD12 LEU A 143 50.945 42.371 1.001 1.00 0.00 H ATOM 2105 HD13 LEU A 143 51.141 42.735 2.733 1.00 0.00 H ATOM 2106 H LEU A 143 53.099 43.835 -0.714 1.00 0.00 H ATOM 2107 N LEU A 144 56.772 41.895 -0.363 1.00 42.73 N ATOM 2108 CA LEU A 144 57.824 41.529 -1.296 1.00 44.83 C ATOM 2109 C LEU A 144 58.249 40.068 -1.150 1.00 45.39 C ATOM 2110 O LEU A 144 58.350 39.550 -0.037 1.00 45.75 O ATOM 2111 CB LEU A 144 59.044 42.425 -1.072 1.00 43.59 C ATOM 2112 CG LEU A 144 58.738 43.925 -1.006 1.00 45.07 C ATOM 2113 CD1 LEU A 144 60.009 44.668 -0.614 1.00 42.06 C ATOM 2114 CD2 LEU A 144 58.215 44.419 -2.359 1.00 40.42 C ATOM 2115 HA LEU A 144 57.425 41.664 -2.301 1.00 0.00 H ATOM 2116 HB2 LEU A 144 59.511 42.133 -0.132 1.00 0.00 H ATOM 2117 HB3 LEU A 144 59.743 42.257 -1.891 1.00 0.00 H ATOM 2118 HG LEU A 144 57.966 44.113 -0.260 1.00 0.00 H ATOM 2119 HD21 LEU A 144 58.969 44.242 -3.125 1.00 0.00 H ATOM 2120 HD22 LEU A 144 57.303 43.879 -2.614 1.00 0.00 H ATOM 2121 HD23 LEU A 144 58.002 45.486 -2.297 1.00 0.00 H ATOM 2122 HD11 LEU A 144 60.348 44.316 0.360 1.00 0.00 H ATOM 2123 HD12 LEU A 144 60.782 44.480 -1.359 1.00 0.00 H ATOM 2124 HD13 LEU A 144 59.803 45.737 -0.564 1.00 0.00 H ATOM 2125 H LEU A 144 57.000 41.969 0.649 1.00 0.00 H ATOM 2126 N CYS A 145 58.500 39.409 -2.277 1.00 48.55 N ATOM 2127 CA CYS A 145 59.339 38.208 -2.292 1.00 52.85 C ATOM 2128 C CYS A 145 60.776 38.601 -1.935 1.00 52.34 C ATOM 2129 O CYS A 145 61.165 39.772 -2.047 1.00 49.82 O ATOM 2130 CB CYS A 145 59.304 37.547 -3.677 1.00 56.76 C ATOM 2131 SG CYS A 145 57.701 36.780 -4.071 1.00 66.59 S ATOM 2132 HA CYS A 145 58.960 37.493 -1.562 1.00 0.00 H ATOM 2133 HB2 CYS A 145 60.074 36.776 -3.712 1.00 0.00 H ATOM 2134 HB3 CYS A 145 59.518 38.307 -4.428 1.00 0.00 H ATOM 2135 H CYS A 145 58.091 39.754 -3.169 1.00 0.00 H ATOM 2136 N PRO A 146 61.587 37.628 -1.507 1.00 53.87 N ATOM 2137 CA PRO A 146 62.936 37.976 -1.035 1.00 54.62 C ATOM 2138 C PRO A 146 63.807 38.628 -2.119 1.00 54.92 C ATOM 2139 O PRO A 146 64.734 39.377 -1.814 1.00 54.76 O ATOM 2140 CB PRO A 146 63.504 36.646 -0.519 1.00 54.73 C ATOM 2141 CG PRO A 146 62.664 35.585 -1.152 1.00 55.82 C ATOM 2142 CD PRO A 146 61.307 36.183 -1.420 1.00 55.27 C ATOM 2143 HA PRO A 146 62.914 38.740 -0.257 1.00 0.00 H ATOM 2144 HD3 PRO A 146 60.892 35.808 -2.356 1.00 0.00 H ATOM 2145 HD2 PRO A 146 60.616 35.967 -0.605 1.00 0.00 H ATOM 2146 HG3 PRO A 146 62.569 34.733 -0.478 1.00 0.00 H ATOM 2147 HG2 PRO A 146 63.119 35.258 -2.087 1.00 0.00 H ATOM 2148 HB2 PRO A 146 64.547 36.535 -0.816 1.00 0.00 H ATOM 2149 HB3 PRO A 146 63.429 36.595 0.567 1.00 0.00 H ATOM 2150 N SER A 147 63.480 38.375 -3.382 1.00 55.41 N ATOM 2151 CA SER A 147 64.188 39.012 -4.495 1.00 56.47 C ATOM 2152 C SER A 147 63.900 40.519 -4.625 1.00 57.40 C ATOM 2153 O SER A 147 64.519 41.207 -5.440 1.00 57.29 O ATOM 2154 CB SER A 147 63.835 38.309 -5.811 1.00 55.42 C ATOM 2155 OG SER A 147 62.433 38.294 -6.033 1.00 59.29 O ATOM 2156 HA SER A 147 65.252 38.911 -4.279 1.00 0.00 H ATOM 2157 HB2 SER A 147 64.199 37.282 -5.773 1.00 0.00 H ATOM 2158 HB3 SER A 147 64.319 38.834 -6.634 1.00 0.00 H ATOM 2159 HG SER A 147 62.240 37.834 -6.888 1.00 0.00 H ATOM 2160 H SER A 147 62.705 37.711 -3.584 1.00 0.00 H ATOM 2161 N GLY A 148 62.950 41.022 -3.837 1.00 57.98 N ATOM 2162 CA GLY A 148 62.546 42.418 -3.946 1.00 55.98 C ATOM 2163 C GLY A 148 61.387 42.669 -4.908 1.00 55.93 C ATOM 2164 O GLY A 148 61.025 43.811 -5.171 1.00 56.13 O ATOM 2165 HA3 GLY A 148 63.405 42.995 -4.289 1.00 0.00 H ATOM 2166 HA2 GLY A 148 62.249 42.765 -2.956 1.00 0.00 H ATOM 2167 H GLY A 148 62.490 40.409 -3.134 1.00 0.00 H ATOM 2168 N HIS A 149 60.798 41.611 -5.446 1.00 54.51 N ATOM 2169 CA HIS A 149 59.636 41.766 -6.309 1.00 53.86 C ATOM 2170 C HIS A 149 58.359 41.828 -5.478 1.00 51.04 C ATOM 2171 O HIS A 149 58.334 41.352 -4.339 1.00 49.96 O ATOM 2172 CB HIS A 149 59.580 40.611 -7.305 1.00 55.38 C ATOM 2173 CG HIS A 149 60.730 40.598 -8.263 1.00 57.75 C ATOM 2174 ND1 HIS A 149 60.989 39.542 -9.110 1.00 60.15 N ATOM 2175 CD2 HIS A 149 61.690 41.521 -8.507 1.00 59.87 C ATOM 2176 CE1 HIS A 149 62.060 39.814 -9.835 1.00 60.48 C ATOM 2177 NE2 HIS A 149 62.504 41.009 -9.489 1.00 62.04 N ATOM 2178 HA HIS A 149 59.722 42.702 -6.861 1.00 0.00 H ATOM 2179 HB2 HIS A 149 59.582 39.674 -6.749 1.00 0.00 H ATOM 2180 HB3 HIS A 149 58.655 40.691 -7.876 1.00 0.00 H ATOM 2181 HD2 HIS A 149 61.797 42.489 -8.017 1.00 0.00 H ATOM 2182 HE1 HIS A 149 62.502 39.163 -10.590 1.00 0.00 H ATOM 2183 H HIS A 149 61.170 40.660 -5.250 1.00 0.00 H ATOM 2184 N VAL A 150 57.313 42.422 -6.050 1.00 48.31 N ATOM 2185 CA VAL A 150 56.065 42.673 -5.335 1.00 46.88 C ATOM 2186 C VAL A 150 55.080 41.523 -5.535 1.00 45.25 C ATOM 2187 O VAL A 150 54.866 41.068 -6.658 1.00 44.71 O ATOM 2188 CB VAL A 150 55.377 43.983 -5.828 1.00 45.95 C ATOM 2189 CG1 VAL A 150 54.111 44.255 -5.007 1.00 46.00 C ATOM 2190 CG2 VAL A 150 56.324 45.145 -5.721 1.00 46.95 C ATOM 2191 HA VAL A 150 56.325 42.769 -4.281 1.00 0.00 H ATOM 2192 HB VAL A 150 55.099 43.858 -6.874 1.00 0.00 H ATOM 2193 HG11 VAL A 150 53.418 43.421 -5.123 1.00 0.00 H ATOM 2194 HG12 VAL A 150 54.378 44.364 -3.956 1.00 0.00 H ATOM 2195 HG13 VAL A 150 53.640 45.172 -5.361 1.00 0.00 H ATOM 2196 HG21 VAL A 150 56.626 45.272 -4.681 1.00 0.00 H ATOM 2197 HG22 VAL A 150 57.204 44.953 -6.335 1.00 0.00 H ATOM 2198 HG23 VAL A 150 55.827 46.050 -6.069 1.00 0.00 H ATOM 2199 H VAL A 150 57.388 42.718 -7.044 1.00 0.00 H ATOM 2200 N VAL A 151 54.469 41.067 -4.448 1.00 43.46 N ATOM 2201 CA VAL A 151 53.495 39.981 -4.522 1.00 43.94 C ATOM 2202 C VAL A 151 52.090 40.553 -4.343 1.00 42.68 C ATOM 2203 O VAL A 151 51.113 39.971 -4.807 1.00 41.46 O ATOM 2204 CB VAL A 151 53.745 38.913 -3.399 1.00 44.48 C ATOM 2205 CG1 VAL A 151 53.199 37.577 -3.838 1.00 48.79 C ATOM 2206 CG2 VAL A 151 55.238 38.775 -3.109 1.00 48.77 C ATOM 2207 HA VAL A 151 53.598 39.499 -5.494 1.00 0.00 H ATOM 2208 HB VAL A 151 53.238 39.241 -2.492 1.00 0.00 H ATOM 2209 HG11 VAL A 151 52.128 37.666 -4.021 1.00 0.00 H ATOM 2210 HG12 VAL A 151 53.701 37.264 -4.754 1.00 0.00 H ATOM 2211 HG13 VAL A 151 53.375 36.839 -3.055 1.00 0.00 H ATOM 2212 HG21 VAL A 151 55.756 38.462 -4.016 1.00 0.00 H ATOM 2213 HG22 VAL A 151 55.633 39.735 -2.777 1.00 0.00 H ATOM 2214 HG23 VAL A 151 55.388 38.030 -2.328 1.00 0.00 H ATOM 2215 H VAL A 151 54.688 41.492 -3.525 1.00 0.00 H ATOM 2216 N GLY A 152 52.004 41.699 -3.663 1.00 41.08 N ATOM 2217 CA GLY A 152 50.715 42.251 -3.286 1.00 39.02 C ATOM 2218 C GLY A 152 50.839 43.570 -2.537 1.00 38.01 C ATOM 2219 O GLY A 152 51.945 44.035 -2.262 1.00 37.51 O ATOM 2220 HA3 GLY A 152 50.201 41.533 -2.647 1.00 0.00 H ATOM 2221 HA2 GLY A 152 50.128 42.416 -4.189 1.00 0.00 H ATOM 2222 H GLY A 152 52.874 42.204 -3.399 1.00 0.00 H ATOM 2223 N ILE A 153 49.723 44.199 -2.195 1.00 35.93 N ATOM 2224 CA ILE A 153 49.820 45.359 -1.320 1.00 33.62 C ATOM 2225 C ILE A 153 48.988 45.141 -0.081 1.00 31.53 C ATOM 2226 O ILE A 153 48.025 44.393 -0.108 1.00 31.61 O ATOM 2227 CB ILE A 153 49.373 46.639 -2.038 1.00 34.97 C ATOM 2228 CG1 ILE A 153 47.968 46.456 -2.608 1.00 33.25 C ATOM 2229 CG2 ILE A 153 50.370 46.985 -3.152 1.00 31.01 C ATOM 2230 CD1 ILE A 153 47.339 47.739 -3.089 1.00 35.54 C ATOM 2231 HA ILE A 153 50.865 45.482 -1.036 1.00 0.00 H ATOM 2232 HB ILE A 153 49.349 47.463 -1.325 1.00 0.00 H ATOM 2233 HG12 ILE A 153 48.024 45.764 -3.448 1.00 0.00 H ATOM 2234 HG13 ILE A 153 47.333 46.031 -1.830 1.00 0.00 H ATOM 2235 HD11 ILE A 153 47.264 48.440 -2.257 1.00 0.00 H ATOM 2236 HD12 ILE A 153 47.956 48.172 -3.876 1.00 0.00 H ATOM 2237 HD13 ILE A 153 46.343 47.530 -3.480 1.00 0.00 H ATOM 2238 HG21 ILE A 153 51.358 47.140 -2.718 1.00 0.00 H ATOM 2239 HG22 ILE A 153 50.411 46.165 -3.869 1.00 0.00 H ATOM 2240 HG23 ILE A 153 50.047 47.895 -3.658 1.00 0.00 H ATOM 2241 H ILE A 153 48.800 43.871 -2.544 1.00 0.00 H ATOM 2242 N PHE A 154 49.370 45.777 1.016 1.00 32.71 N ATOM 2243 CA PHE A 154 48.747 45.526 2.320 1.00 32.19 C ATOM 2244 C PHE A 154 47.321 46.107 2.310 1.00 33.30 C ATOM 2245 O PHE A 154 47.130 47.282 1.970 1.00 31.10 O ATOM 2246 CB PHE A 154 49.611 46.198 3.403 1.00 34.20 C ATOM 2247 CG PHE A 154 49.141 45.963 4.818 1.00 32.60 C ATOM 2248 CD1 PHE A 154 48.339 44.889 5.132 1.00 32.25 C ATOM 2249 CD2 PHE A 154 49.506 46.837 5.830 1.00 34.04 C ATOM 2250 CE1 PHE A 154 47.900 44.684 6.430 1.00 34.70 C ATOM 2251 CE2 PHE A 154 49.076 46.640 7.132 1.00 34.43 C ATOM 2252 CZ PHE A 154 48.264 45.553 7.431 1.00 34.34 C ATOM 2253 HA PHE A 154 48.682 44.458 2.528 1.00 0.00 H ATOM 2254 HB2 PHE A 154 50.627 45.814 3.314 1.00 0.00 H ATOM 2255 HB3 PHE A 154 49.612 47.272 3.219 1.00 0.00 H ATOM 2256 HD2 PHE A 154 50.141 47.692 5.598 1.00 0.00 H ATOM 2257 HE2 PHE A 154 49.373 47.334 7.918 1.00 0.00 H ATOM 2258 HZ PHE A 154 47.918 45.390 8.452 1.00 0.00 H ATOM 2259 HE1 PHE A 154 47.263 43.830 6.659 1.00 0.00 H ATOM 2260 HD1 PHE A 154 48.045 44.190 4.349 1.00 0.00 H ATOM 2261 H PHE A 154 50.136 46.477 0.951 1.00 0.00 H ATOM 2262 N ARG A 155 46.318 45.305 2.680 1.00 32.89 N ATOM 2263 CA ARG A 155 44.918 45.779 2.632 1.00 34.10 C ATOM 2264 C ARG A 155 44.251 45.900 4.004 1.00 36.13 C ATOM 2265 O ARG A 155 43.639 46.926 4.318 1.00 37.01 O ATOM 2266 CB ARG A 155 44.074 44.863 1.730 1.00 35.27 C ATOM 2267 CG ARG A 155 42.569 45.188 1.668 1.00 35.23 C ATOM 2268 CD ARG A 155 41.913 44.513 0.463 1.00 36.56 C ATOM 2269 NE ARG A 155 41.926 43.055 0.592 1.00 38.31 N ATOM 2270 CZ ARG A 155 41.639 42.195 -0.392 1.00 37.44 C ATOM 2271 NH1 ARG A 155 41.306 42.613 -1.603 1.00 31.67 N ATOM 2272 NH2 ARG A 155 41.695 40.896 -0.165 1.00 36.48 N ATOM 2273 HA ARG A 155 44.964 46.787 2.220 1.00 0.00 H ATOM 2274 HB2 ARG A 155 44.473 44.929 0.718 1.00 0.00 H ATOM 2275 HB3 ARG A 155 44.181 43.842 2.095 1.00 0.00 H ATOM 2276 HG2 ARG A 155 42.089 44.834 2.580 1.00 0.00 H ATOM 2277 HG3 ARG A 155 42.440 46.267 1.587 1.00 0.00 H ATOM 2278 HD2 ARG A 155 42.456 44.794 -0.440 1.00 0.00 H ATOM 2279 HD3 ARG A 155 40.880 44.853 0.385 1.00 0.00 H ATOM 2280 HE ARG A 155 42.178 42.657 1.519 1.00 0.00 H ATOM 2281 HH12 ARG A 155 41.088 41.923 -2.350 1.00 0.00 H ATOM 2282 HH11 ARG A 155 41.263 43.632 -1.808 1.00 0.00 H ATOM 2283 HH22 ARG A 155 41.473 40.225 -0.928 1.00 0.00 H ATOM 2284 HH21 ARG A 155 41.962 40.544 0.776 1.00 0.00 H ATOM 2285 H ARG A 155 46.524 44.339 3.005 1.00 0.00 H ATOM 2286 N ALA A 156 44.354 44.843 4.807 1.00 35.22 N ATOM 2287 CA ALA A 156 43.698 44.785 6.110 1.00 35.01 C ATOM 2288 C ALA A 156 44.521 43.903 7.046 1.00 35.71 C ATOM 2289 O ALA A 156 45.341 43.111 6.581 1.00 35.23 O ATOM 2290 CB ALA A 156 42.286 44.206 5.965 1.00 30.73 C ATOM 2291 HA ALA A 156 43.624 45.792 6.521 1.00 0.00 H ATOM 2292 HB1 ALA A 156 41.702 44.840 5.298 1.00 0.00 H ATOM 2293 HB2 ALA A 156 42.348 43.200 5.550 1.00 0.00 H ATOM 2294 HB3 ALA A 156 41.808 44.168 6.944 1.00 0.00 H ATOM 2295 H ALA A 156 44.922 44.030 4.495 1.00 0.00 H ATOM 2296 N ALA A 157 44.294 44.047 8.351 1.00 34.76 N ATOM 2297 CA ALA A 157 45.007 43.274 9.366 1.00 38.21 C ATOM 2298 C ALA A 157 44.069 42.293 10.053 1.00 39.71 C ATOM 2299 O ALA A 157 42.925 42.623 10.356 1.00 41.55 O ATOM 2300 CB ALA A 157 45.636 44.220 10.410 1.00 38.08 C ATOM 2301 HA ALA A 157 45.798 42.709 8.873 1.00 0.00 H ATOM 2302 HB1 ALA A 157 46.337 44.892 9.914 1.00 0.00 H ATOM 2303 HB2 ALA A 157 44.850 44.803 10.891 1.00 0.00 H ATOM 2304 HB3 ALA A 157 46.164 43.631 11.160 1.00 0.00 H ATOM 2305 H ALA A 157 43.580 44.738 8.660 1.00 0.00 H ATOM 2306 N VAL A 158 44.543 41.074 10.278 1.00 42.42 N ATOM 2307 CA VAL A 158 43.821 40.108 11.116 1.00 42.58 C ATOM 2308 C VAL A 158 44.297 40.296 12.554 1.00 44.03 C ATOM 2309 O VAL A 158 45.486 40.140 12.850 1.00 43.32 O ATOM 2310 CB VAL A 158 44.125 38.650 10.668 1.00 41.02 C ATOM 2311 CG1 VAL A 158 43.369 37.657 11.554 1.00 39.88 C ATOM 2312 CG2 VAL A 158 43.741 38.459 9.220 1.00 42.44 C ATOM 2313 HA VAL A 158 42.748 40.276 11.026 1.00 0.00 H ATOM 2314 HB VAL A 158 45.194 38.466 10.772 1.00 0.00 H ATOM 2315 HG11 VAL A 158 43.682 37.785 12.590 1.00 0.00 H ATOM 2316 HG12 VAL A 158 42.298 37.841 11.471 1.00 0.00 H ATOM 2317 HG13 VAL A 158 43.591 36.640 11.229 1.00 0.00 H ATOM 2318 HG21 VAL A 158 42.676 38.655 9.099 1.00 0.00 H ATOM 2319 HG22 VAL A 158 44.312 39.150 8.600 1.00 0.00 H ATOM 2320 HG23 VAL A 158 43.959 37.434 8.920 1.00 0.00 H ATOM 2321 H VAL A 158 45.449 40.796 9.850 1.00 0.00 H ATOM 2322 N CYS A 159 43.385 40.651 13.449 1.00 46.28 N ATOM 2323 CA CYS A 159 43.807 41.103 14.770 1.00 49.57 C ATOM 2324 C CYS A 159 42.803 40.801 15.876 1.00 50.30 C ATOM 2325 O CYS A 159 41.629 40.516 15.620 1.00 51.20 O ATOM 2326 CB CYS A 159 44.083 42.611 14.723 1.00 52.16 C ATOM 2327 SG CYS A 159 42.624 43.614 14.436 1.00 58.61 S ATOM 2328 HA CYS A 159 44.710 40.545 15.017 1.00 0.00 H ATOM 2329 HB2 CYS A 159 44.795 42.804 13.920 1.00 0.00 H ATOM 2330 HB3 CYS A 159 44.522 42.909 15.675 1.00 0.00 H ATOM 2331 HG CYS A 159 42.059 43.266 13.226 1.00 0.00 H ATOM 2332 H CYS A 159 42.374 40.607 13.210 1.00 0.00 H ATOM 2333 N THR A 160 43.277 40.883 17.113 1.00 51.16 N ATOM 2334 CA THR A 160 42.475 40.521 18.281 1.00 51.97 C ATOM 2335 C THR A 160 43.003 41.294 19.479 1.00 51.52 C ATOM 2336 O THR A 160 44.178 41.168 19.838 1.00 51.68 O ATOM 2337 CB THR A 160 42.584 39.004 18.598 1.00 52.49 C ATOM 2338 OG1 THR A 160 42.364 38.233 17.403 1.00 56.51 O ATOM 2339 CG2 THR A 160 41.556 38.610 19.629 1.00 51.30 C ATOM 2340 HA THR A 160 41.432 40.759 18.072 1.00 0.00 H ATOM 2341 HB THR A 160 43.583 38.806 18.986 1.00 0.00 H ATOM 2342 HG1 THR A 160 41.461 38.428 17.048 1.00 0.00 H ATOM 2343 HG23 THR A 160 41.715 39.189 20.539 1.00 0.00 H ATOM 2344 HG21 THR A 160 40.558 38.809 19.239 1.00 0.00 H ATOM 2345 HG22 THR A 160 41.655 37.548 19.851 1.00 0.00 H ATOM 2346 H THR A 160 44.252 41.216 17.256 1.00 0.00 H ATOM 2347 N ARG A 161 42.136 42.091 20.095 1.00 51.27 N ATOM 2348 CA ARG A 161 42.531 42.955 21.203 1.00 51.15 C ATOM 2349 C ARG A 161 43.732 43.832 20.833 1.00 49.15 C ATOM 2350 O ARG A 161 44.664 44.005 21.626 1.00 47.82 O ATOM 2351 CB ARG A 161 42.837 42.107 22.439 1.00 55.42 C ATOM 2352 CG ARG A 161 41.583 41.580 23.137 1.00 60.87 C ATOM 2353 CD ARG A 161 41.042 40.333 22.462 1.00 65.91 C ATOM 2354 NE ARG A 161 40.117 39.591 23.324 1.00 70.21 N ATOM 2355 CZ ARG A 161 39.863 38.287 23.216 1.00 72.07 C ATOM 2356 NH1 ARG A 161 40.467 37.558 22.281 1.00 71.31 N ATOM 2357 NH2 ARG A 161 38.998 37.713 24.042 1.00 74.70 N ATOM 2358 HA ARG A 161 41.700 43.624 21.428 1.00 0.00 H ATOM 2359 HB2 ARG A 161 43.446 41.256 22.133 1.00 0.00 H ATOM 2360 HB3 ARG A 161 43.397 42.717 23.148 1.00 0.00 H ATOM 2361 HG2 ARG A 161 41.829 41.342 24.172 1.00 0.00 H ATOM 2362 HG3 ARG A 161 40.816 42.354 23.116 1.00 0.00 H ATOM 2363 HD2 ARG A 161 41.878 39.683 22.203 1.00 0.00 H ATOM 2364 HD3 ARG A 161 40.516 40.626 21.553 1.00 0.00 H ATOM 2365 HE ARG A 161 39.624 40.119 24.072 1.00 0.00 H ATOM 2366 HH12 ARG A 161 40.264 36.541 22.203 1.00 0.00 H ATOM 2367 HH11 ARG A 161 41.142 38.005 21.629 1.00 0.00 H ATOM 2368 HH22 ARG A 161 38.798 36.696 23.960 1.00 0.00 H ATOM 2369 HH21 ARG A 161 38.520 38.280 24.771 1.00 0.00 H ATOM 2370 H ARG A 161 41.146 42.099 19.778 1.00 0.00 H ATOM 2371 N GLY A 162 43.691 44.378 19.618 1.00 45.22 N ATOM 2372 CA GLY A 162 44.703 45.322 19.183 1.00 43.41 C ATOM 2373 C GLY A 162 46.046 44.716 18.813 1.00 41.73 C ATOM 2374 O GLY A 162 47.021 45.434 18.669 1.00 41.65 O ATOM 2375 HA3 GLY A 162 44.867 46.035 19.991 1.00 0.00 H ATOM 2376 HA2 GLY A 162 44.319 45.847 18.309 1.00 0.00 H ATOM 2377 H GLY A 162 42.919 44.123 18.970 1.00 0.00 H ATOM 2378 N VAL A 163 46.094 43.399 18.663 1.00 40.99 N ATOM 2379 CA VAL A 163 47.315 42.706 18.293 1.00 41.21 C ATOM 2380 C VAL A 163 47.077 42.003 16.952 1.00 41.82 C ATOM 2381 O VAL A 163 46.106 41.276 16.792 1.00 40.43 O ATOM 2382 CB VAL A 163 47.706 41.650 19.391 1.00 41.00 C ATOM 2383 CG1 VAL A 163 48.949 40.872 18.989 1.00 37.85 C ATOM 2384 CG2 VAL A 163 47.946 42.357 20.717 1.00 39.10 C ATOM 2385 HA VAL A 163 48.134 43.421 18.208 1.00 0.00 H ATOM 2386 HB VAL A 163 46.883 40.943 19.494 1.00 0.00 H ATOM 2387 HG11 VAL A 163 48.760 40.347 18.053 1.00 0.00 H ATOM 2388 HG12 VAL A 163 49.782 41.563 18.858 1.00 0.00 H ATOM 2389 HG13 VAL A 163 49.193 40.151 19.769 1.00 0.00 H ATOM 2390 HG21 VAL A 163 48.756 43.077 20.602 1.00 0.00 H ATOM 2391 HG22 VAL A 163 47.037 42.876 21.020 1.00 0.00 H ATOM 2392 HG23 VAL A 163 48.217 41.622 21.475 1.00 0.00 H ATOM 2393 H VAL A 163 45.228 42.844 18.816 1.00 0.00 H ATOM 2394 N ALA A 164 47.957 42.232 15.984 1.00 42.19 N ATOM 2395 CA ALA A 164 47.775 41.664 14.650 1.00 44.28 C ATOM 2396 C ALA A 164 48.684 40.467 14.462 1.00 44.26 C ATOM 2397 O ALA A 164 49.888 40.565 14.686 1.00 45.56 O ATOM 2398 CB ALA A 164 48.074 42.733 13.569 1.00 43.20 C ATOM 2399 HA ALA A 164 46.740 41.339 14.547 1.00 0.00 H ATOM 2400 HB1 ALA A 164 47.394 43.575 13.695 1.00 0.00 H ATOM 2401 HB2 ALA A 164 49.103 43.076 13.674 1.00 0.00 H ATOM 2402 HB3 ALA A 164 47.935 42.297 12.580 1.00 0.00 H ATOM 2403 H ALA A 164 48.789 42.825 16.179 1.00 0.00 H ATOM 2404 N LYS A 165 48.117 39.343 14.034 1.00 45.11 N ATOM 2405 CA LYS A 165 48.907 38.139 13.841 1.00 46.92 C ATOM 2406 C LYS A 165 49.041 37.788 12.357 1.00 46.09 C ATOM 2407 O LYS A 165 49.881 36.971 11.976 1.00 45.64 O ATOM 2408 CB LYS A 165 48.281 36.966 14.621 1.00 49.42 C ATOM 2409 CG LYS A 165 46.833 36.640 14.248 1.00 54.60 C ATOM 2410 CD LYS A 165 45.943 36.482 15.480 1.00 57.76 C ATOM 2411 CE LYS A 165 44.489 36.224 15.085 1.00 60.72 C ATOM 2412 NZ LYS A 165 44.318 34.858 14.479 1.00 60.70 N ATOM 2413 HA LYS A 165 49.910 38.327 14.225 1.00 0.00 H ATOM 2414 HB2 LYS A 165 48.886 36.078 14.439 1.00 0.00 H ATOM 2415 HB3 LYS A 165 48.310 37.212 15.683 1.00 0.00 H ATOM 2416 HG2 LYS A 165 46.439 37.447 13.631 1.00 0.00 H ATOM 2417 HG3 LYS A 165 46.817 35.709 13.681 1.00 0.00 H ATOM 2418 HD2 LYS A 165 46.304 35.643 16.074 1.00 0.00 H ATOM 2419 HD3 LYS A 165 45.993 37.394 16.074 1.00 0.00 H ATOM 2420 HE2 LYS A 165 44.180 36.976 14.359 1.00 0.00 H ATOM 2421 HE3 LYS A 165 43.861 36.299 15.973 1.00 0.00 H ATOM 2422 HZ1 LYS A 165 44.910 34.781 13.628 1.00 0.00 H ATOM 2423 HZ2 LYS A 165 44.606 34.135 15.169 1.00 0.00 H ATOM 2424 HZ3 LYS A 165 43.320 34.716 14.223 1.00 0.00 H ATOM 2425 H LYS A 165 47.096 39.325 13.835 1.00 0.00 H ATOM 2426 N ALA A 166 48.225 38.429 11.523 1.00 44.89 N ATOM 2427 CA ALA A 166 48.205 38.158 10.088 1.00 43.29 C ATOM 2428 C ALA A 166 47.799 39.409 9.279 1.00 42.97 C ATOM 2429 O ALA A 166 47.125 40.314 9.800 1.00 42.28 O ATOM 2430 CB ALA A 166 47.236 37.010 9.802 1.00 39.17 C ATOM 2431 HA ALA A 166 49.212 37.879 9.778 1.00 0.00 H ATOM 2432 HB1 ALA A 166 47.563 36.118 10.337 1.00 0.00 H ATOM 2433 HB2 ALA A 166 46.236 37.289 10.135 1.00 0.00 H ATOM 2434 HB3 ALA A 166 47.221 36.807 8.731 1.00 0.00 H ATOM 2435 H ALA A 166 47.579 39.148 11.907 1.00 0.00 H ATOM 2436 N VAL A 167 48.209 39.442 8.009 1.00 41.41 N ATOM 2437 CA VAL A 167 47.812 40.501 7.073 1.00 41.55 C ATOM 2438 C VAL A 167 47.012 39.960 5.889 1.00 42.11 C ATOM 2439 O VAL A 167 47.337 38.909 5.340 1.00 43.01 O ATOM 2440 CB VAL A 167 49.052 41.262 6.508 1.00 42.04 C ATOM 2441 CG1 VAL A 167 49.893 41.827 7.658 1.00 42.51 C ATOM 2442 CG2 VAL A 167 49.896 40.337 5.648 1.00 37.38 C ATOM 2443 HA VAL A 167 47.186 41.181 7.651 1.00 0.00 H ATOM 2444 HB VAL A 167 48.701 42.087 5.889 1.00 0.00 H ATOM 2445 HG11 VAL A 167 49.287 42.517 8.245 1.00 0.00 H ATOM 2446 HG12 VAL A 167 50.234 41.009 8.293 1.00 0.00 H ATOM 2447 HG13 VAL A 167 50.755 42.355 7.251 1.00 0.00 H ATOM 2448 HG21 VAL A 167 50.240 39.496 6.250 1.00 0.00 H ATOM 2449 HG22 VAL A 167 49.296 39.969 4.816 1.00 0.00 H ATOM 2450 HG23 VAL A 167 50.756 40.885 5.263 1.00 0.00 H ATOM 2451 H VAL A 167 48.836 38.686 7.668 1.00 0.00 H ATOM 2452 N ASP A 168 45.971 40.689 5.496 1.00 41.81 N ATOM 2453 CA ASP A 168 45.254 40.427 4.251 1.00 40.60 C ATOM 2454 C ASP A 168 45.786 41.396 3.181 1.00 40.45 C ATOM 2455 O ASP A 168 45.902 42.601 3.422 1.00 40.73 O ATOM 2456 CB ASP A 168 43.753 40.626 4.491 1.00 43.24 C ATOM 2457 CG ASP A 168 42.938 40.640 3.210 1.00 46.95 C ATOM 2458 OD1 ASP A 168 42.423 41.721 2.843 1.00 51.19 O ATOM 2459 OD2 ASP A 168 42.792 39.579 2.571 1.00 51.20 O ATOM 2460 HA ASP A 168 45.409 39.404 3.909 1.00 0.00 H ATOM 2461 HB2 ASP A 168 43.392 39.814 5.122 1.00 0.00 H ATOM 2462 HB3 ASP A 168 43.607 41.576 5.005 1.00 0.00 H ATOM 2463 H ASP A 168 45.656 41.476 6.099 1.00 0.00 H ATOM 2464 N PHE A 169 46.143 40.878 2.010 1.00 38.93 N ATOM 2465 CA PHE A 169 46.677 41.734 0.952 1.00 37.60 C ATOM 2466 C PHE A 169 45.998 41.476 -0.394 1.00 38.81 C ATOM 2467 O PHE A 169 45.361 40.441 -0.600 1.00 38.95 O ATOM 2468 CB PHE A 169 48.196 41.569 0.821 1.00 36.88 C ATOM 2469 CG PHE A 169 48.640 40.196 0.371 1.00 37.90 C ATOM 2470 CD1 PHE A 169 48.980 39.226 1.304 1.00 38.27 C ATOM 2471 CD2 PHE A 169 48.733 39.882 -0.976 1.00 37.32 C ATOM 2472 CE1 PHE A 169 49.406 37.963 0.904 1.00 39.49 C ATOM 2473 CE2 PHE A 169 49.155 38.625 -1.386 1.00 40.22 C ATOM 2474 CZ PHE A 169 49.492 37.660 -0.439 1.00 39.13 C ATOM 2475 HA PHE A 169 46.461 42.763 1.241 1.00 0.00 H ATOM 2476 HB2 PHE A 169 48.557 42.299 0.096 1.00 0.00 H ATOM 2477 HB3 PHE A 169 48.646 41.771 1.793 1.00 0.00 H ATOM 2478 HD2 PHE A 169 48.471 40.632 -1.723 1.00 0.00 H ATOM 2479 HE2 PHE A 169 49.223 38.393 -2.449 1.00 0.00 H ATOM 2480 HZ PHE A 169 49.822 36.671 -0.758 1.00 0.00 H ATOM 2481 HE1 PHE A 169 49.671 37.214 1.651 1.00 0.00 H ATOM 2482 HD1 PHE A 169 48.912 39.457 2.367 1.00 0.00 H ATOM 2483 H PHE A 169 46.042 39.856 1.845 1.00 0.00 H ATOM 2484 N ILE A 170 46.133 42.438 -1.297 1.00 39.11 N ATOM 2485 CA ILE A 170 45.702 42.298 -2.680 1.00 40.68 C ATOM 2486 C ILE A 170 46.850 41.760 -3.535 1.00 42.79 C ATOM 2487 O ILE A 170 47.815 42.468 -3.817 1.00 40.93 O ATOM 2488 CB ILE A 170 45.273 43.674 -3.257 1.00 39.84 C ATOM 2489 CG1 ILE A 170 44.158 44.267 -2.388 1.00 37.23 C ATOM 2490 CG2 ILE A 170 44.827 43.517 -4.709 1.00 39.07 C ATOM 2491 CD1 ILE A 170 44.210 45.757 -2.258 1.00 39.73 C ATOM 2492 HA ILE A 170 44.859 41.608 -2.701 1.00 0.00 H ATOM 2493 HB ILE A 170 46.120 44.360 -3.243 1.00 0.00 H ATOM 2494 HG12 ILE A 170 43.199 43.995 -2.829 1.00 0.00 H ATOM 2495 HG13 ILE A 170 44.234 43.833 -1.391 1.00 0.00 H ATOM 2496 HD11 ILE A 170 45.158 46.048 -1.806 1.00 0.00 H ATOM 2497 HD12 ILE A 170 44.122 46.210 -3.246 1.00 0.00 H ATOM 2498 HD13 ILE A 170 43.387 46.094 -1.628 1.00 0.00 H ATOM 2499 HG21 ILE A 170 45.653 43.122 -5.301 1.00 0.00 H ATOM 2500 HG22 ILE A 170 43.983 42.829 -4.756 1.00 0.00 H ATOM 2501 HG23 ILE A 170 44.528 44.488 -5.103 1.00 0.00 H ATOM 2502 H ILE A 170 46.568 43.336 -1.003 1.00 0.00 H ATOM 2503 N PRO A 171 46.746 40.500 -3.971 1.00 45.72 N ATOM 2504 CA PRO A 171 47.812 39.888 -4.773 1.00 48.23 C ATOM 2505 C PRO A 171 47.981 40.617 -6.106 1.00 51.35 C ATOM 2506 O PRO A 171 47.014 41.094 -6.701 1.00 49.81 O ATOM 2507 CB PRO A 171 47.349 38.434 -4.954 1.00 47.10 C ATOM 2508 CG PRO A 171 45.865 38.483 -4.783 1.00 48.22 C ATOM 2509 CD PRO A 171 45.579 39.609 -3.805 1.00 47.43 C ATOM 2510 HA PRO A 171 48.792 39.944 -4.299 1.00 0.00 H ATOM 2511 HD3 PRO A 171 44.653 40.124 -4.061 1.00 0.00 H ATOM 2512 HD2 PRO A 171 45.515 39.234 -2.784 1.00 0.00 H ATOM 2513 HG3 PRO A 171 45.500 37.536 -4.384 1.00 0.00 H ATOM 2514 HG2 PRO A 171 45.382 38.683 -5.739 1.00 0.00 H ATOM 2515 HB2 PRO A 171 47.610 38.068 -5.947 1.00 0.00 H ATOM 2516 HB3 PRO A 171 47.802 37.790 -4.200 1.00 0.00 H ATOM 2517 N VAL A 172 49.220 40.699 -6.569 1.00 54.74 N ATOM 2518 CA VAL A 172 49.533 41.379 -7.820 1.00 58.78 C ATOM 2519 C VAL A 172 48.683 40.840 -8.988 1.00 61.74 C ATOM 2520 O VAL A 172 48.611 41.461 -10.048 1.00 62.08 O ATOM 2521 CB VAL A 172 51.032 41.214 -8.147 1.00 59.11 C ATOM 2522 CG1 VAL A 172 51.308 39.792 -8.598 1.00 59.80 C ATOM 2523 CG2 VAL A 172 51.459 42.220 -9.193 1.00 61.40 C ATOM 2524 HA VAL A 172 49.298 42.436 -7.693 1.00 0.00 H ATOM 2525 HB VAL A 172 51.619 41.405 -7.249 1.00 0.00 H ATOM 2526 HG11 VAL A 172 51.035 39.100 -7.801 1.00 0.00 H ATOM 2527 HG12 VAL A 172 50.719 39.574 -9.489 1.00 0.00 H ATOM 2528 HG13 VAL A 172 52.368 39.684 -8.827 1.00 0.00 H ATOM 2529 HG21 VAL A 172 50.878 42.066 -10.102 1.00 0.00 H ATOM 2530 HG22 VAL A 172 51.287 43.228 -8.817 1.00 0.00 H ATOM 2531 HG23 VAL A 172 52.519 42.088 -9.411 1.00 0.00 H ATOM 2532 H VAL A 172 49.992 40.265 -6.024 1.00 0.00 H ATOM 2533 N GLU A 173 48.037 39.694 -8.788 1.00 64.64 N ATOM 2534 CA GLU A 173 47.112 39.134 -9.779 1.00 68.21 C ATOM 2535 C GLU A 173 45.836 39.965 -9.960 1.00 68.89 C ATOM 2536 O GLU A 173 45.443 40.276 -11.085 1.00 68.86 O ATOM 2537 CB GLU A 173 46.726 37.698 -9.393 1.00 69.69 C ATOM 2538 CG GLU A 173 47.732 36.630 -9.835 1.00 71.53 C ATOM 2539 CD GLU A 173 48.794 36.318 -8.781 1.00 73.28 C ATOM 2540 OE1 GLU A 173 48.755 36.900 -7.670 1.00 73.34 O ATOM 2541 OE2 GLU A 173 49.674 35.481 -9.071 1.00 73.89 O ATOM 2542 HA GLU A 173 47.644 39.147 -10.730 1.00 0.00 H ATOM 2543 HB2 GLU A 173 46.632 37.650 -8.308 1.00 0.00 H ATOM 2544 HB3 GLU A 173 45.763 37.469 -9.850 1.00 0.00 H ATOM 2545 HG2 GLU A 173 47.186 35.713 -10.057 1.00 0.00 H ATOM 2546 HG3 GLU A 173 48.234 36.981 -10.737 1.00 0.00 H ATOM 2547 H GLU A 173 48.193 39.178 -7.899 1.00 0.00 H ATOM 2548 N SER A 174 45.197 40.316 -8.847 1.00 70.83 N ATOM 2549 CA SER A 174 43.998 41.153 -8.857 1.00 71.69 C ATOM 2550 C SER A 174 44.207 42.490 -9.567 1.00 72.09 C ATOM 2551 O SER A 174 43.257 43.101 -10.054 1.00 72.57 O ATOM 2552 CB SER A 174 43.531 41.424 -7.424 1.00 71.20 C ATOM 2553 OG SER A 174 42.868 40.297 -6.882 1.00 70.91 O ATOM 2554 HA SER A 174 43.242 40.597 -9.411 1.00 0.00 H ATOM 2555 HB2 SER A 174 42.847 42.273 -7.427 1.00 0.00 H ATOM 2556 HB3 SER A 174 44.397 41.659 -6.806 1.00 0.00 H ATOM 2557 HG SER A 174 42.578 40.499 -5.957 1.00 0.00 H ATOM 2558 H SER A 174 45.565 39.982 -7.933 1.00 0.00 H ATOM 2559 N MET A 175 45.449 42.947 -9.616 1.00 72.55 N ATOM 2560 CA MET A 175 45.753 44.201 -10.278 1.00 74.13 C ATOM 2561 C MET A 175 45.680 44.011 -11.789 1.00 76.45 C ATOM 2562 O MET A 175 45.560 44.977 -12.545 1.00 76.89 O ATOM 2563 CB MET A 175 47.143 44.686 -9.852 1.00 72.19 C ATOM 2564 CG MET A 175 47.253 44.875 -8.349 1.00 69.52 C ATOM 2565 SD MET A 175 48.827 45.511 -7.836 1.00 69.92 S ATOM 2566 CE MET A 175 48.767 45.167 -6.077 1.00 68.51 C ATOM 2567 HA MET A 175 45.023 44.957 -9.990 1.00 0.00 H ATOM 2568 HB2 MET A 175 47.883 43.951 -10.168 1.00 0.00 H ATOM 2569 HB3 MET A 175 47.347 45.638 -10.341 1.00 0.00 H ATOM 2570 HG2 MET A 175 47.095 43.911 -7.866 1.00 0.00 H ATOM 2571 HG3 MET A 175 46.477 45.571 -8.030 1.00 0.00 H ATOM 2572 HE1 MET A 175 47.918 45.689 -5.635 1.00 0.00 H ATOM 2573 HE2 MET A 175 48.656 44.094 -5.922 1.00 0.00 H ATOM 2574 HE3 MET A 175 49.690 45.510 -5.609 1.00 0.00 H ATOM 2575 H MET A 175 46.216 42.400 -9.174 1.00 0.00 H ATOM 2576 N GLU A 176 45.733 42.752 -12.219 1.00 79.30 N ATOM 2577 CA GLU A 176 45.528 42.398 -13.623 1.00 81.89 C ATOM 2578 C GLU A 176 44.040 42.348 -13.952 1.00 82.45 C ATOM 2579 O GLU A 176 43.618 42.758 -15.036 1.00 82.53 O ATOM 2580 CB GLU A 176 46.142 41.031 -13.922 1.00 83.25 C ATOM 2581 CG GLU A 176 47.631 40.946 -13.694 1.00 85.76 C ATOM 2582 CD GLU A 176 48.172 39.550 -13.967 1.00 87.71 C ATOM 2583 OE1 GLU A 176 47.367 38.587 -13.990 1.00 88.04 O ATOM 2584 OE2 GLU A 176 49.403 39.416 -14.161 1.00 88.19 O ATOM 2585 HA GLU A 176 46.011 43.161 -14.234 1.00 0.00 H ATOM 2586 HB2 GLU A 176 45.657 40.293 -13.282 1.00 0.00 H ATOM 2587 HB3 GLU A 176 45.944 40.790 -14.966 1.00 0.00 H ATOM 2588 HG2 GLU A 176 48.130 41.653 -14.357 1.00 0.00 H ATOM 2589 HG3 GLU A 176 47.844 41.210 -12.658 1.00 0.00 H ATOM 2590 H GLU A 176 45.927 41.995 -11.533 1.00 0.00 H ATOM 2591 N THR A 177 43.257 41.841 -13.002 1.00 83.22 N ATOM 2592 CA THR A 177 41.825 41.636 -13.183 1.00 84.01 C ATOM 2593 C THR A 177 41.075 42.969 -13.285 1.00 84.89 C ATOM 2594 O THR A 177 40.049 43.060 -13.962 1.00 85.59 O ATOM 2595 CB THR A 177 41.233 40.828 -12.005 1.00 84.08 C ATOM 2596 OG1 THR A 177 42.062 39.688 -11.747 1.00 83.45 O ATOM 2597 CG2 THR A 177 39.821 40.347 -12.339 1.00 83.66 C ATOM 2598 HA THR A 177 41.700 41.082 -14.113 1.00 0.00 H ATOM 2599 HB THR A 177 41.192 41.473 -11.127 1.00 0.00 H ATOM 2600 HG1 THR A 177 42.975 39.991 -11.515 1.00 0.00 H ATOM 2601 HG23 THR A 177 39.183 41.208 -12.537 1.00 0.00 H ATOM 2602 HG21 THR A 177 39.855 39.708 -13.221 1.00 0.00 H ATOM 2603 HG22 THR A 177 39.422 39.783 -11.496 1.00 0.00 H ATOM 2604 H THR A 177 43.686 41.580 -12.091 1.00 0.00 H ATOM 2605 N THR A 178 41.588 43.996 -12.609 1.00 85.56 N ATOM 2606 CA THR A 178 41.031 45.345 -12.725 1.00 85.73 C ATOM 2607 C THR A 178 41.446 45.997 -14.048 1.00 87.06 C ATOM 2608 O THR A 178 40.679 46.762 -14.645 1.00 87.52 O ATOM 2609 CB THR A 178 41.482 46.247 -11.536 1.00 84.48 C ATOM 2610 OG1 THR A 178 40.880 45.776 -10.325 1.00 82.54 O ATOM 2611 CG2 THR A 178 41.075 47.698 -11.765 1.00 82.63 C ATOM 2612 HA THR A 178 39.945 45.250 -12.700 1.00 0.00 H ATOM 2613 HB THR A 178 42.568 46.198 -11.461 1.00 0.00 H ATOM 2614 HG1 THR A 178 41.164 44.842 -10.158 1.00 0.00 H ATOM 2615 HG23 THR A 178 41.531 48.061 -12.686 1.00 0.00 H ATOM 2616 HG21 THR A 178 39.990 47.761 -11.846 1.00 0.00 H ATOM 2617 HG22 THR A 178 41.414 48.306 -10.926 1.00 0.00 H ATOM 2618 H THR A 178 42.404 43.836 -11.984 1.00 0.00 H ATOM 2619 N MET A 179 42.651 45.675 -14.513 1.00 87.47 N ATOM 2620 CA MET A 179 43.172 46.247 -15.754 1.00 88.06 C ATOM 2621 C MET A 179 42.453 45.711 -16.994 1.00 89.47 C ATOM 2622 O MET A 179 42.248 46.442 -17.970 1.00 89.22 O ATOM 2623 CB MET A 179 44.673 45.972 -15.870 1.00 86.09 C ATOM 2624 CG MET A 179 45.514 46.752 -14.876 1.00 84.17 C ATOM 2625 SD MET A 179 47.273 46.426 -15.041 1.00 80.24 S ATOM 2626 CE MET A 179 47.850 47.986 -15.696 1.00 81.12 C ATOM 2627 HA MET A 179 42.992 47.321 -15.710 1.00 0.00 H ATOM 2628 HB2 MET A 179 44.842 44.908 -15.704 1.00 0.00 H ATOM 2629 HB3 MET A 179 44.995 46.237 -16.877 1.00 0.00 H ATOM 2630 HG2 MET A 179 45.203 46.480 -13.867 1.00 0.00 H ATOM 2631 HG3 MET A 179 45.341 47.817 -15.033 1.00 0.00 H ATOM 2632 HE1 MET A 179 47.353 48.186 -16.645 1.00 0.00 H ATOM 2633 HE2 MET A 179 47.619 48.783 -14.989 1.00 0.00 H ATOM 2634 HE3 MET A 179 48.928 47.937 -15.851 1.00 0.00 H ATOM 2635 H MET A 179 43.236 45.000 -13.981 1.00 0.00 H ATOM 2636 N ARG A 180 42.074 44.434 -16.945 1.00 91.10 N ATOM 2637 CA ARG A 180 41.354 43.785 -18.045 1.00 92.61 C ATOM 2638 C ARG A 180 39.934 44.334 -18.199 1.00 93.37 C ATOM 2639 O ARG A 180 39.454 44.538 -19.320 1.00 93.64 O ATOM 2640 CB ARG A 180 41.311 42.276 -17.821 1.00 92.15 C ATOM 2641 HA ARG A 180 41.893 44.002 -18.967 1.00 0.00 H ATOM 2642 HB2 ARG A 180 42.328 41.887 -17.778 1.00 0.00 H ATOM 2643 HB3 ARG A 180 40.800 42.064 -16.882 1.00 0.00 H ATOM 2644 H ARG A 180 42.297 43.878 -16.095 1.00 0.00 H ATOM 2645 N ALA A 181 39.271 44.573 -17.068 1.00 94.26 N ATOM 2646 CA ALA A 181 37.963 45.226 -17.059 1.00 94.99 C ATOM 2647 C ALA A 181 38.121 46.747 -17.168 1.00 95.65 C ATOM 2648 O ALA A 181 37.358 47.511 -16.569 1.00 95.53 O ATOM 2649 CB ALA A 181 37.202 44.865 -15.781 1.00 94.66 C ATOM 2650 HA ALA A 181 37.394 44.874 -17.920 1.00 0.00 H ATOM 2651 HB1 ALA A 181 37.063 43.785 -15.735 1.00 0.00 H ATOM 2652 HB2 ALA A 181 37.773 45.196 -14.914 1.00 0.00 H ATOM 2653 HB3 ALA A 181 36.230 45.358 -15.787 1.00 0.00 H ATOM 2654 H ALA A 181 39.697 44.286 -16.164 1.00 0.00 H ATOM 2655 N SER A 182 39.131 47.175 -17.925 1.00 96.38 N ATOM 2656 CA SER A 182 39.252 48.567 -18.352 1.00 96.64 C ATOM 2657 C SER A 182 39.396 48.643 -19.877 1.00 96.93 C ATOM 2658 O SER A 182 39.645 47.586 -20.502 1.00 96.85 O ATOM 2659 CB SER A 182 40.458 49.218 -17.677 1.00 96.38 C ATOM 2660 HA SER A 182 38.350 49.104 -18.059 1.00 0.00 H ATOM 2661 HB2 SER A 182 40.329 49.184 -16.595 1.00 0.00 H ATOM 2662 HB3 SER A 182 41.363 48.678 -17.954 1.00 0.00 H ATOM 2663 H SER A 182 39.859 46.494 -18.222 1.00 0.00 H TER 2664 SER A 182 HETATM 2665 NA NA A 1 64.316 50.937 7.448 1.00 46.69 NA HETATM 2666 O HOH 2 51.823 51.975 9.867 1.00 30.42 O HETATM 2667 O HOH 3 47.453 48.566 18.529 1.00 33.26 O HETATM 2668 O HOH 4 63.476 64.641 3.989 1.00 36.28 O HETATM 2669 O HOH 5 63.561 46.744 9.118 1.00 35.42 O HETATM 2670 O HOH 6 52.966 27.992 7.404 1.00 37.06 O HETATM 2671 O HOH 7 58.322 61.103 -3.786 1.00 40.54 O HETATM 2672 O HOH 8 51.619 28.563 4.883 1.00 40.25 O HETATM 2673 O HOH 9 66.799 51.723 8.084 1.00 40.00 O HETATM 2674 O HOH 10 65.231 48.631 7.034 1.00 43.27 O HETATM 2675 O HOH 11 36.043 59.977 -2.535 1.00 41.17 O HETATM 2676 O HOH 12 57.280 38.977 11.745 1.00 41.57 O HETATM 2677 O HOH 13 42.311 64.623 -13.935 1.00 42.65 O HETATM 2678 O HOH 14 33.669 46.521 -7.075 1.00 42.61 O HETATM 2679 O HOH 15 54.914 71.616 1.044 1.00 40.01 O HETATM 2680 O HOH 16 40.028 56.471 -15.693 1.00 44.30 O HETATM 2681 O HOH 17 32.955 54.990 -6.038 1.00 42.14 O HETATM 2682 O HOH 18 38.299 50.789 -13.193 1.00 44.76 O HETATM 2683 O HOH 19 44.079 58.124 -15.756 1.00 45.22 O HETATM 2684 O HOH 20 40.941 41.279 12.031 1.00 48.74 O HETATM 2685 O HOH 21 51.003 64.644 -4.692 1.00 47.90 O HETATM 2686 O HOH 22 46.495 53.158 5.820 1.00 52.66 O HETATM 2687 O HOH 23 42.025 69.007 -5.807 1.00 52.47 O HETATM 2688 O HOH 24 61.010 44.931 -8.124 1.00 56.17 O HETATM 2689 O HOH 25 43.753 33.948 0.887 1.00 55.63 O HETATM 2690 O HOH 26 52.250 72.651 -3.810 1.00 57.74 O HETATM 2691 O HOH 27 43.895 54.272 7.782 1.00 58.46 O HETATM 2692 O HOH 28 65.228 44.443 7.255 1.00 57.53 O HETATM 2693 O HOH 29 35.579 46.451 -0.369 1.00 57.15 O HETATM 2694 O HOH 30 52.193 51.818 17.492 1.00 62.75 O HETATM 2695 O HOH 31 60.730 36.698 -8.376 1.00 60.62 O HETATM 2696 O HOH 32 55.919 65.341 -2.589 1.00 50.27 O HETATM 2697 C25 L A 5 39.391 43.649 9.159 1.00 0.32 C HETATM 2698 O26 L A 5 38.425 44.198 8.631 1.00 -0.38 O HETATM 2699 O27 L A 5 39.641 42.307 9.143 1.00 -0.26 O HETATM 2700 C28 L A 5 40.203 41.823 7.924 1.00 0.09 C HETATM 2701 C29 L A 5 39.186 41.417 6.879 1.00 -0.02 C HETATM 2702 C30 L A 5 40.013 40.570 5.924 1.00 -0.05 C HETATM 2703 C31 L A 5 41.151 40.021 6.764 1.00 -0.05 C HETATM 2704 C32 L A 5 40.866 40.488 8.176 1.00 -0.02 C HETATM 2705 H8 L A 5 40.190 39.796 8.699 1.00 0.03 H HETATM 2706 H9 L A 5 41.794 40.603 8.756 1.00 0.03 H HETATM 2707 H6 L A 5 42.115 40.419 6.414 1.00 0.03 H HETATM 2708 H7 L A 5 41.169 38.922 6.718 1.00 0.03 H HETATM 2709 H4 L A 5 40.404 41.186 5.101 1.00 0.03 H HETATM 2710 H5 L A 5 39.407 39.750 5.512 1.00 0.03 H HETATM 2711 H2 L A 5 38.768 42.297 6.369 1.00 0.03 H HETATM 2712 H3 L A 5 38.370 40.830 7.326 1.00 0.03 H HETATM 2713 H1 L A 5 40.906 42.569 7.525 1.00 0.06 H HETATM 2714 N24 L A 5 40.356 44.298 9.841 1.00 -0.24 N HETATM 2715 C19 L A 5 40.331 45.744 10.027 1.00 0.14 C HETATM 2716 C20 L A 5 40.698 46.238 11.489 1.00 0.00 C HETATM 2717 C21 L A 5 40.329 47.738 11.641 1.00 -0.06 C HETATM 2718 H12 L A 5 40.585 48.078 12.656 1.00 0.02 H HETATM 2719 H13 L A 5 39.250 47.869 11.471 1.00 0.02 H HETATM 2720 H14 L A 5 40.891 48.330 10.904 1.00 0.02 H HETATM 2721 C22 L A 5 42.191 46.046 11.871 1.00 -0.06 C HETATM 2722 H15 L A 5 42.463 44.985 11.767 1.00 0.02 H HETATM 2723 H16 L A 5 42.347 46.363 12.913 1.00 0.02 H HETATM 2724 H17 L A 5 42.821 46.653 11.204 1.00 0.02 H HETATM 2725 C23 L A 5 39.847 45.459 12.529 1.00 -0.06 C HETATM 2726 H18 L A 5 38.780 45.573 12.289 1.00 0.02 H HETATM 2727 H19 L A 5 40.041 45.859 13.535 1.00 0.02 H HETATM 2728 H20 L A 5 40.117 44.393 12.500 1.00 0.02 H HETATM 2729 C17 L A 5 41.152 46.401 8.875 1.00 0.21 C HETATM 2730 O18 L A 5 42.365 46.178 8.741 1.00 -0.39 O HETATM 2731 N16 L A 5 40.512 47.268 7.969 1.00 -0.25 N HETATM 2732 C12 L A 5 41.269 47.912 6.878 1.00 0.14 C HETATM 2733 C10 L A 5 42.412 48.825 7.393 1.00 0.20 C HETATM 2734 O11 L A 5 42.269 49.559 8.366 1.00 -0.39 O HETATM 2735 N9 L A 5 43.590 48.682 6.684 1.00 -0.27 N HETATM 2736 C4 L A 5 44.901 49.028 7.235 1.00 0.11 C HETATM 2737 C6 L A 5 45.482 48.050 8.287 1.00 0.02 C HETATM 2738 C5 L A 5 46.075 48.090 6.911 1.00 -0.00 C HETATM 2739 H45 L A 5 47.082 48.507 6.762 1.00 0.03 H HETATM 2740 H46 L A 5 45.924 47.242 6.226 1.00 0.03 H HETATM 2741 C7 L A 5 46.269 48.451 9.451 1.00 -0.08 C HETATM 2742 C8 L A 5 45.840 48.380 10.721 1.00 -0.12 C HETATM 2743 H48 L A 5 46.490 48.700 11.534 1.00 0.03 H HETATM 2744 H49 L A 5 44.842 48.003 10.938 1.00 0.03 H HETATM 2745 H47 L A 5 47.273 48.834 9.276 1.00 0.07 H HETATM 2746 H44 L A 5 44.868 47.186 8.580 1.00 0.05 H HETATM 2747 C2 L A 5 45.237 50.536 7.194 1.00 0.08 C HETATM 2748 O1 L A 5 44.361 51.329 6.700 1.00 -0.55 O HETATM 2749 O3 L A 5 46.348 50.947 7.617 1.00 -0.55 O HETATM 2750 H43 L A 5 43.544 48.325 5.751 1.00 0.18 H HETATM 2751 C13 L A 5 40.210 48.775 6.153 1.00 0.02 C HETATM 2752 C14 L A 5 38.890 48.051 6.426 1.00 0.11 C HETATM 2753 C15 L A 5 39.092 47.652 7.888 1.00 0.07 C HETATM 2754 H25 L A 5 38.444 46.804 8.153 1.00 0.06 H HETATM 2755 H26 L A 5 38.879 48.500 8.556 1.00 0.06 H HETATM 2756 O33 L A 5 38.864 46.810 5.631 1.00 -0.30 O HETATM 2757 C34 L A 5 38.313 46.800 4.322 1.00 0.12 C HETATM 2758 C35 L A 5 37.645 48.029 3.809 1.00 -0.01 C HETATM 2759 C36 L A 5 37.100 48.038 2.544 1.00 0.02 C HETATM 2760 N37 L A 5 37.179 46.868 1.775 1.00 -0.33 N HETATM 2761 C38 L A 5 37.781 45.665 2.158 1.00 0.02 C HETATM 2762 C39 L A 5 38.374 45.656 3.545 1.00 0.03 C HETATM 2763 C40 L A 5 39.040 44.384 4.034 1.00 -0.05 C HETATM 2764 C41 L A 5 39.018 43.221 3.060 1.00 -0.03 C HETATM 2765 C42 L A 5 38.456 43.287 1.814 1.00 0.09 C HETATM 2766 C43 L A 5 37.823 44.550 1.375 1.00 -0.02 C HETATM 2767 H30 L A 5 37.374 44.590 0.389 1.00 0.05 H HETATM 2768 O45 L A 5 38.388 42.252 0.838 1.00 -0.32 O HETATM 2769 C46 L A 5 38.955 40.957 1.123 1.00 0.06 C HETATM 2770 H31 L A 5 38.808 40.294 0.258 1.00 0.06 H HETATM 2771 H32 L A 5 38.459 40.525 2.005 1.00 0.06 H HETATM 2772 H33 L A 5 40.031 41.064 1.324 1.00 0.06 H HETATM 2773 H29 L A 5 39.472 42.286 3.368 1.00 0.06 H HETATM 2774 H28 L A 5 39.500 44.311 5.013 1.00 0.06 H HETATM 2775 C47 L A 5 36.446 49.195 2.007 1.00 0.02 C HETATM 2776 C48 L A 5 35.945 49.303 0.721 1.00 0.02 C HETATM 2777 S49 L A 5 35.232 50.832 0.520 1.00 0.03 S HETATM 2778 C50 L A 5 35.651 51.247 2.133 1.00 0.21 C HETATM 2779 N51 L A 5 36.272 50.309 2.806 1.00 -0.31 N HETATM 2780 N52 L A 5 35.347 52.457 2.726 1.00 -0.19 N HETATM 2781 C53 L A 5 34.413 53.372 2.269 1.00 0.22 C HETATM 2782 O54 L A 5 33.742 53.186 1.243 1.00 -0.38 O HETATM 2783 C55 L A 5 34.298 54.633 3.171 1.00 0.05 C HETATM 2784 C56 L A 5 32.867 54.831 3.703 1.00 -0.04 C HETATM 2785 H37 L A 5 32.832 55.731 4.334 1.00 0.03 H HETATM 2786 H38 L A 5 32.572 53.954 4.298 1.00 0.03 H HETATM 2787 H39 L A 5 32.174 54.949 2.857 1.00 0.03 H HETATM 2788 C57 L A 5 34.780 55.889 2.427 1.00 -0.04 C HETATM 2789 H40 L A 5 35.803 55.726 2.056 1.00 0.03 H HETATM 2790 H41 L A 5 34.772 56.748 3.114 1.00 0.03 H HETATM 2791 H42 L A 5 34.110 56.092 1.578 1.00 0.03 H HETATM 2792 H36 L A 5 34.958 54.482 4.038 1.00 0.05 H HETATM 2793 H35 L A 5 35.846 52.694 3.560 1.00 0.24 H HETATM 2794 H34 L A 5 35.999 48.529 -0.043 1.00 0.07 H HETATM 2795 H27 L A 5 37.588 48.915 4.431 1.00 0.05 H HETATM 2796 H24 L A 5 38.001 48.675 6.253 1.00 0.07 H HETATM 2797 H22 L A 5 40.415 48.820 5.073 1.00 0.03 H HETATM 2798 H23 L A 5 40.189 49.795 6.565 1.00 0.03 H HETATM 2799 H21 L A 5 41.689 47.151 6.203 1.00 0.08 H HETATM 2800 H11 L A 5 39.287 46.056 9.876 1.00 0.08 H HETATM 2801 H10 L A 5 41.112 43.772 10.231 1.00 0.19 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 63 62 2665 CONECT 1410 1409 2131 CONECT 1613 1612 2665 CONECT 2131 1410 2130 CONECT 2665 63 1613 CONECT 2697 2698 2699 2714 CONECT 2698 2697 CONECT 2699 2697 2700 CONECT 2700 2699 2701 2704 2713 CONECT 2701 2700 2702 2711 2712 CONECT 2702 2701 2703 2709 2710 CONECT 2703 2702 2704 2707 2708 CONECT 2704 2700 2703 2705 2706 CONECT 2705 2704 CONECT 2706 2704 CONECT 2707 2703 CONECT 2708 2703 CONECT 2709 2702 CONECT 2710 2702 CONECT 2711 2701 CONECT 2712 2701 CONECT 2713 2700 CONECT 2714 2697 2715 2801 CONECT 2715 2714 2716 2729 2800 CONECT 2716 2715 2717 2721 2725 CONECT 2717 2716 2718 2719 2720 CONECT 2718 2717 CONECT 2719 2717 CONECT 2720 2717 CONECT 2721 2716 2722 2723 2724 CONECT 2722 2721 CONECT 2723 2721 CONECT 2724 2721 CONECT 2725 2716 2726 2727 2728 CONECT 2726 2725 CONECT 2727 2725 CONECT 2728 2725 CONECT 2729 2715 2730 2731 CONECT 2730 2729 CONECT 2731 2729 2732 2753 CONECT 2732 2731 2733 2751 2799 CONECT 2733 2732 2734 2735 CONECT 2734 2733 CONECT 2735 2733 2736 2750 CONECT 2736 2735 2737 2738 2747 CONECT 2737 2736 2738 2741 2746 CONECT 2738 2736 2737 2739 2740 CONECT 2739 2738 CONECT 2740 2738 CONECT 2741 2737 2742 2745 CONECT 2742 2741 2743 2744 CONECT 2743 2742 CONECT 2744 2742 CONECT 2745 2741 CONECT 2746 2737 CONECT 2747 2736 2748 2749 CONECT 2748 2747 CONECT 2749 2747 CONECT 2750 2735 CONECT 2751 2732 2752 2797 2798 CONECT 2752 2751 2753 2756 2796 CONECT 2753 2731 2752 2754 2755 CONECT 2754 2753 CONECT 2755 2753 CONECT 2756 2752 2757 CONECT 2757 2756 2758 2762 CONECT 2758 2757 2759 2795 CONECT 2759 2758 2760 2775 CONECT 2760 2759 2761 CONECT 2761 2760 2762 2766 CONECT 2762 2757 2761 2763 CONECT 2763 2762 2764 2774 CONECT 2764 2763 2765 2773 CONECT 2765 2764 2766 2768 CONECT 2766 2761 2765 2767 CONECT 2767 2766 CONECT 2768 2765 2769 CONECT 2769 2768 2770 2771 2772 CONECT 2770 2769 CONECT 2771 2769 CONECT 2772 2769 CONECT 2773 2764 CONECT 2774 2763 CONECT 2775 2759 2776 2779 CONECT 2776 2775 2777 2794 CONECT 2777 2776 2778 CONECT 2778 2777 2779 2780 CONECT 2779 2775 2778 CONECT 2780 2778 2781 2793 CONECT 2781 2780 2782 2783 CONECT 2782 2781 CONECT 2783 2781 2784 2788 2792 CONECT 2784 2783 2785 2786 2787 CONECT 2785 2784 CONECT 2786 2784 CONECT 2787 2784 CONECT 2788 2783 2789 2790 2791 CONECT 2789 2788 CONECT 2790 2788 CONECT 2791 2788 CONECT 2792 2783 CONECT 2793 2780 CONECT 2794 2776 CONECT 2795 2758 CONECT 2796 2752 CONECT 2797 2751 CONECT 2798 2751 CONECT 2799 2732 CONECT 2800 2715 CONECT 2801 2714 MASTER 0 0 0 0 0 0 0 0 2800 1 114 14 END
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Related entries of code: 3p8o
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1dxp
RCSB PDB
PDBbind
16aa, >1DXP_2|Chains... at 100%
3oyp
RCSB PDB
PDBbind
16aa, >3OYP_2|Chains... at 100%
3p8n
RCSB PDB
PDBbind
17aa, >3P8N_2|Chains... at 100%
4i31
RCSB PDB
PDBbind
17aa, >4I31_2|Chains... at 100%
4i32
RCSB PDB
PDBbind
17aa, >4I32_2|Chains... at 100%
4i33
RCSB PDB
PDBbind
17aa, >4I33_2|Chains... at 100%
4ktc
RCSB PDB
PDBbind
16aa, >4KTC_2|Chains... at 100%
4u01
RCSB PDB
PDBbind
16aa, >4U01_2|Chains... at 100%
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
3p8o
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
NS3-NS4A protease
Ligand Name
L5T
EC.Number
E.C.3.4.21.98;3.6.1.15;3.6.4.13
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Ki=1.89nM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) J.Biol.Chem. Vol. 286: pp. 11434-11443
Ligand Properties
Formula
C
4
0
H
5
0
N
6
O
9
S
Molecular Weight
790.925
Exact Mass
790.336
No. of atoms
106
No. of bonds
111
Polar Surface Area
226.62
LOGP Value
6.63 (
Computed with XLOGP3
)
6.33 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 18
No. of Nitrogen and Oxygen Atoms: 15
No. of Rings: 6
Canonical SMILES
COc1ccc2c(c1)nc(cc2O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)NC(=O)OC1CCCC1)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)O)c1csc(n1)NC(=O)C(C)C
InChI String
InChI=1S/C40H50N6O9S/c1-8-22-18-40(22,36(50)51)45-34(48)30-16-25(19-46(30)35(49)32(39(4,5)6)43-38(52)55-23-11-9-10-12-23)54-31-17-28(41-27-15-24(53-7)13-14-26(27)31)29-20-56-37(42-29)44-33(47)21(2)3/h8,13-15,17,20-23,25,30,32H,1,9-12,16,18-19H2,2-7H3,(H,43,52)(H,45,48)(H,50,51)(H,42,44,47)/t22-,25-,30+,32-,40-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P26662
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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