Browse entries in the PDBbind-CN Database
HEADER 6SGE_COMPLEX COMPND 6SGE_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 178 ALA ILE ARG LYS LYS LEU VAL VAL VAL GLY ASP GLY ALA SEQRES 2 A 178 CYS GLY LYS THR CYS LEU LEU ILE VAL PHE SER LYS ASP SEQRES 3 A 178 GLU PHE PRO GLU VAL TYR VAL PRO THR VAL PHE GLU ASN SEQRES 4 A 178 TYR VAL ALA ASP ILE GLU VAL ASP GLY LYS GLN VAL GLU SEQRES 5 A 178 LEU ALA LEU TRP ASP THR ALA GLY LEU GLU ASP TYR ASP SEQRES 6 A 178 ARG LEU ARG PRO LEU SER TYR PRO ASP THR ASP VAL ILE SEQRES 7 A 178 LEU MET CYS PHE SER VAL ASP SER PRO ASP SER LEU GLU SEQRES 8 A 178 ASN ILE PRO GLU LYS TRP VAL PRO GLU VAL LYS HIS PHE SEQRES 9 A 178 CYS PRO ASN VAL PRO ILE ILE LEU VAL ALA ASN LYS LYS SEQRES 10 A 178 ASP LEU ARG SER ASP GLU HIS VAL ARG THR GLU LEU ALA SEQRES 11 A 178 ARG MET LYS GLN GLU PRO VAL ARG THR ASP ASP GLY ARG SEQRES 12 A 178 ALA MET ALA VAL ARG ILE GLN ALA TYR ASP TYR LEU GLU SEQRES 13 A 178 CYS SER ALA LYS THR LYS GLU GLY VAL ARG GLU VAL PHE SEQRES 14 A 178 GLU THR ALA THR ARG ALA ALA LEU GLN SEQRES 1 B 126 ALA VAL GLN LEU GLN ALA SER GLY GLY GLY PHE VAL GLN SEQRES 2 B 126 PRO GLY GLY SER LEU ARG LEU SER CYS ALA ALA SER GLY SEQRES 3 B 126 TYR GLY SER THR ILE GLU THR MET GLY TRP PHE ARG GLN SEQRES 4 B 126 ALA PRO GLY LYS GLU ARG GLU PHE VAL SER ALA ILE SER SEQRES 5 B 126 ARG ALA PRO GLY PRO SER GLN TYR TYR ALA ASP SER VAL SEQRES 6 B 126 LYS GLY ARG PHE THR ILE SER ARG ASP ASN SER LYS ASN SEQRES 7 B 126 THR VAL TYR LEU GLN MET ASN SER LEU ARG ALA GLU ASP SEQRES 8 B 126 THR ALA THR TYR TYR CYS ALA PRO ILE ASN ASN ARG THR SEQRES 9 B 126 MET GLN ASP SER MET PHE LEU TRP ASN TYR TRP GLY GLN SEQRES 10 B 126 GLY THR GLN VAL THR VAL SER SER ALA HET MG A 1 1 HET MG A 2 1 HET GTP A 643 45 SSBOND 1 CYS B 22 CYS B 97 ATOM 1 N ALA A 3 43.797 5.676 104.818 1.00 62.82 N ATOM 2 CA ALA A 3 44.894 6.140 103.984 1.00 61.02 C ATOM 3 C ALA A 3 44.696 7.614 103.627 1.00 60.31 C ATOM 4 O ALA A 3 43.590 8.155 103.700 1.00 67.74 O ATOM 5 CB ALA A 3 45.012 5.293 102.732 1.00 59.52 C ATOM 6 HN3 ALA A 3 42.901 5.785 104.302 1.00 0.00 H ATOM 7 HN2 ALA A 3 43.766 6.238 105.692 1.00 0.00 H ATOM 8 HN1 ALA A 3 43.943 4.674 105.054 1.00 0.00 H ATOM 9 N ILE A 4 45.800 8.242 103.270 1.00 50.55 N ATOM 10 CA ILE A 4 45.873 9.661 102.977 1.00 42.60 C ATOM 11 C ILE A 4 45.504 9.819 101.516 1.00 36.71 C ATOM 12 O ILE A 4 46.007 9.058 100.685 1.00 35.23 O ATOM 13 CB ILE A 4 47.299 10.192 103.232 1.00 41.85 C ATOM 14 CG1 ILE A 4 47.791 9.838 104.636 1.00 47.63 C ATOM 15 CG2 ILE A 4 47.387 11.674 102.932 1.00 40.24 C ATOM 16 CD1 ILE A 4 49.157 9.125 104.620 1.00 49.93 C ATOM 17 H ILE A 4 46.674 7.684 103.194 1.00 0.00 H ATOM 18 N ARG A 5 44.644 10.795 101.191 1.00 36.15 N ATOM 19 CA ARG A 5 44.265 11.088 99.805 1.00 35.25 C ATOM 20 C ARG A 5 45.008 12.326 99.312 1.00 31.79 C ATOM 21 O ARG A 5 45.048 13.343 100.020 1.00 33.44 O ATOM 22 CB ARG A 5 42.762 11.338 99.636 1.00 40.18 C ATOM 23 CG ARG A 5 41.897 10.097 99.642 1.00 46.37 C ATOM 24 CD ARG A 5 40.431 10.498 99.681 1.00 52.83 C ATOM 25 NE ARG A 5 39.538 9.417 99.285 1.00 58.97 N ATOM 26 CZ ARG A 5 38.209 9.512 99.292 1.00 64.73 C ATOM 27 NH1 ARG A 5 37.630 10.644 99.668 1.00 69.89 N ATOM 28 NH2 ARG A 5 37.462 8.482 98.919 1.00 64.34 N ATOM 29 HE ARG A 5 39.963 8.518 98.979 1.00 0.00 H ATOM 30 HH12 ARG A 5 36.593 10.721 99.674 1.00 0.00 H ATOM 31 HH11 ARG A 5 38.213 11.455 99.957 1.00 0.00 H ATOM 32 HH22 ARG A 5 36.425 8.562 98.926 1.00 0.00 H ATOM 33 HH21 ARG A 5 37.913 7.594 98.619 1.00 0.00 H ATOM 34 H ARG A 5 44.229 11.368 101.953 1.00 0.00 H ATOM 35 N LYS A 6 45.578 12.247 98.106 1.00 27.29 N ATOM 36 CA LYS A 6 46.220 13.406 97.497 1.00 24.63 C ATOM 37 C LYS A 6 45.861 13.477 96.022 1.00 23.78 C ATOM 38 O LYS A 6 45.677 12.450 95.361 1.00 24.46 O ATOM 39 CB LYS A 6 47.769 13.380 97.605 1.00 24.74 C ATOM 40 CG LYS A 6 48.305 13.469 99.040 1.00 27.17 C ATOM 41 CD LYS A 6 48.128 14.845 99.652 1.00 29.30 C ATOM 42 CE LYS A 6 48.555 14.864 101.142 1.00 35.01 C ATOM 43 NZ LYS A 6 48.359 16.220 101.713 1.00 38.80 N ATOM 44 HZ1 LYS A 6 48.936 16.904 101.184 1.00 0.00 H ATOM 45 HZ2 LYS A 6 47.355 16.483 101.642 1.00 0.00 H ATOM 46 HZ3 LYS A 6 48.649 16.219 102.712 1.00 0.00 H ATOM 47 H LYS A 6 45.563 11.343 97.593 1.00 0.00 H ATOM 48 N LYS A 7 45.830 14.701 95.515 1.00 21.85 N ATOM 49 CA LYS A 7 45.427 14.971 94.137 1.00 20.91 C ATOM 50 C LYS A 7 46.626 15.412 93.302 1.00 19.84 C ATOM 51 O LYS A 7 47.290 16.404 93.624 1.00 21.01 O ATOM 52 CB LYS A 7 44.339 16.039 94.109 1.00 22.11 C ATOM 53 CG LYS A 7 44.034 16.567 92.719 1.00 21.09 C ATOM 54 CD LYS A 7 42.776 17.423 92.723 1.00 23.07 C ATOM 55 CE LYS A 7 42.575 17.928 91.297 1.00 22.95 C ATOM 56 NZ LYS A 7 41.215 18.568 91.157 1.00 24.53 N ATOM 57 HZ1 LYS A 7 40.479 17.867 91.377 1.00 0.00 H ATOM 58 HZ2 LYS A 7 41.141 19.369 91.816 1.00 0.00 H ATOM 59 HZ3 LYS A 7 41.092 18.907 90.182 1.00 0.00 H ATOM 60 H LYS A 7 46.103 15.500 96.122 1.00 0.00 H ATOM 61 N LEU A 8 46.876 14.689 92.233 1.00 18.81 N ATOM 62 CA LEU A 8 47.912 14.956 91.242 1.00 17.96 C ATOM 63 C LEU A 8 47.245 15.343 89.930 1.00 17.84 C ATOM 64 O LEU A 8 46.286 14.697 89.506 1.00 18.01 O ATOM 65 CB LEU A 8 48.775 13.706 91.052 1.00 18.05 C ATOM 66 CG LEU A 8 49.891 13.779 89.989 1.00 17.81 C ATOM 67 CD1 LEU A 8 50.971 12.758 90.413 1.00 18.04 C ATOM 68 CD2 LEU A 8 49.357 13.472 88.630 1.00 18.16 C ATOM 69 H LEU A 8 46.281 13.850 92.080 1.00 0.00 H ATOM 70 N VAL A 9 47.745 16.382 89.295 1.00 16.55 N ATOM 71 CA VAL A 9 47.282 16.841 87.990 1.00 16.60 C ATOM 72 C VAL A 9 48.461 16.906 87.043 1.00 16.06 C ATOM 73 O VAL A 9 49.540 17.410 87.418 1.00 16.51 O ATOM 74 CB VAL A 9 46.590 18.210 88.063 1.00 18.26 C ATOM 75 CG1 VAL A 9 46.151 18.675 86.648 1.00 19.51 C ATOM 76 CG2 VAL A 9 45.356 18.135 88.913 1.00 19.50 C ATOM 77 H VAL A 9 48.517 16.908 89.752 1.00 0.00 H ATOM 78 N VAL A 10 48.295 16.309 85.866 1.00 15.36 N ATOM 79 CA VAL A 10 49.340 16.293 84.846 1.00 15.44 C ATOM 80 C VAL A 10 48.985 17.283 83.754 1.00 14.94 C ATOM 81 O VAL A 10 47.820 17.381 83.330 1.00 15.93 O ATOM 82 CB VAL A 10 49.538 14.894 84.235 1.00 14.94 C ATOM 83 CG1 VAL A 10 48.329 14.363 83.484 1.00 17.94 C ATOM 84 CG2 VAL A 10 50.807 14.860 83.435 1.00 13.76 C ATOM 85 H VAL A 10 47.390 15.837 85.665 1.00 0.00 H ATOM 86 N VAL A 11 49.962 18.053 83.307 1.00 15.19 N ATOM 87 CA VAL A 11 49.803 19.022 82.237 1.00 15.12 C ATOM 88 C VAL A 11 51.002 18.915 81.302 1.00 14.95 C ATOM 89 O VAL A 11 52.038 18.343 81.639 1.00 15.35 O ATOM 90 CB VAL A 11 49.667 20.462 82.724 1.00 16.63 C ATOM 91 CG1 VAL A 11 48.560 20.599 83.745 1.00 18.20 C ATOM 92 CG2 VAL A 11 50.996 21.028 83.336 1.00 17.62 C ATOM 93 H VAL A 11 50.900 17.959 83.747 1.00 0.00 H ATOM 94 N GLY A 12 50.863 19.507 80.125 1.00 15.47 N ATOM 95 CA GLY A 12 51.886 19.436 79.106 1.00 15.99 C ATOM 96 C GLY A 12 51.274 19.357 77.725 1.00 15.34 C ATOM 97 O GLY A 12 50.075 19.051 77.559 1.00 15.14 O ATOM 98 H GLY A 12 49.991 20.039 79.928 1.00 0.00 H ATOM 99 N ASP A 13 52.113 19.582 76.724 1.00 14.56 N ATOM 100 CA ASP A 13 51.690 19.635 75.336 1.00 14.73 C ATOM 101 C ASP A 13 50.947 18.392 74.895 1.00 14.55 C ATOM 102 O ASP A 13 51.130 17.272 75.357 1.00 14.76 O ATOM 103 CB ASP A 13 52.871 19.809 74.395 1.00 15.25 C ATOM 104 CG ASP A 13 53.367 21.188 74.316 1.00 16.81 C ATOM 105 OD1 ASP A 13 52.936 22.101 75.067 1.00 17.87 O ATOM 106 OD2 ASP A 13 54.260 21.453 73.494 1.00 18.71 O ATOM 107 H ASP A 13 53.119 19.727 76.942 1.00 0.00 H ATOM 108 N GLY A 14 50.042 18.602 73.939 1.00 16.02 N ATOM 109 CA GLY A 14 49.412 17.459 73.349 1.00 17.11 C ATOM 110 C GLY A 14 50.390 16.439 72.840 1.00 15.43 C ATOM 111 O GLY A 14 51.416 16.784 72.242 1.00 16.11 O ATOM 112 H GLY A 14 49.801 19.566 73.631 1.00 0.00 H ATOM 113 N ALA A 15 50.078 15.163 73.054 1.00 14.57 N ATOM 114 CA ALA A 15 50.808 14.007 72.551 1.00 16.02 C ATOM 115 C ALA A 15 52.184 13.813 73.195 1.00 15.85 C ATOM 116 O ALA A 15 52.961 13.015 72.693 1.00 16.01 O ATOM 117 CB ALA A 15 50.947 14.041 71.032 1.00 16.91 C ATOM 118 H ALA A 15 49.236 14.974 73.634 1.00 0.00 H ATOM 119 N CYS A 16 52.426 14.453 74.328 1.00 15.24 N ATOM 120 CA CYS A 16 53.742 14.350 74.973 1.00 15.02 C ATOM 121 C CYS A 16 53.815 13.210 75.958 1.00 15.51 C ATOM 122 O CYS A 16 54.846 13.054 76.597 1.00 16.72 O ATOM 123 CB CYS A 16 54.155 15.674 75.661 1.00 15.85 C ATOM 124 SG CYS A 16 53.435 16.001 77.236 1.00 16.87 S ATOM 125 H CYS A 16 51.680 15.032 74.764 1.00 0.00 H ATOM 126 N GLY A 17 52.802 12.388 76.057 1.00 13.68 N ATOM 127 CA GLY A 17 52.821 11.151 76.786 1.00 13.71 C ATOM 128 C GLY A 17 52.157 11.139 78.148 1.00 14.80 C ATOM 129 O GLY A 17 52.477 10.237 78.962 1.00 15.76 O ATOM 130 H GLY A 17 51.919 12.649 75.573 1.00 0.00 H ATOM 131 N LYS A 18 51.401 12.156 78.495 1.00 13.32 N ATOM 132 CA LYS A 18 50.747 12.235 79.780 1.00 14.44 C ATOM 133 C LYS A 18 49.901 11.016 80.087 1.00 16.62 C ATOM 134 O LYS A 18 50.015 10.411 81.157 1.00 16.41 O ATOM 135 CB LYS A 18 49.933 13.517 79.836 1.00 13.56 C ATOM 136 CG LYS A 18 50.733 14.749 79.612 1.00 15.81 C ATOM 137 CD LYS A 18 49.922 16.022 79.773 1.00 15.59 C ATOM 138 CE LYS A 18 48.849 16.183 78.709 1.00 15.00 C ATOM 139 NZ LYS A 18 49.349 16.220 77.320 1.00 15.03 N ATOM 140 HZ1 LYS A 18 50.002 17.022 77.209 1.00 0.00 H ATOM 141 HZ2 LYS A 18 49.848 15.333 77.109 1.00 0.00 H ATOM 142 HZ3 LYS A 18 48.547 16.332 76.667 1.00 0.00 H ATOM 143 H LYS A 18 51.268 12.934 77.818 1.00 0.00 H ATOM 144 N THR A 19 48.982 10.685 79.197 1.00 15.01 N ATOM 145 CA THR A 19 48.063 9.591 79.472 1.00 16.00 C ATOM 146 C THR A 19 48.830 8.276 79.589 1.00 16.07 C ATOM 147 O THR A 19 48.560 7.482 80.494 1.00 17.08 O ATOM 148 CB THR A 19 46.986 9.534 78.389 1.00 16.16 C ATOM 149 OG1 THR A 19 46.195 10.722 78.449 1.00 18.27 O ATOM 150 CG2 THR A 19 46.098 8.280 78.522 1.00 18.17 C ATOM 151 HG1 THR A 19 46.775 11.511 78.300 1.00 0.00 H ATOM 152 H THR A 19 48.916 11.207 78.300 1.00 0.00 H ATOM 153 N CYS A 20 49.812 8.037 78.722 1.00 16.79 N ATOM 154 CA CYS A 20 50.534 6.774 78.804 1.00 16.05 C ATOM 155 C CYS A 20 51.277 6.670 80.143 1.00 16.22 C ATOM 156 O CYS A 20 51.337 5.581 80.734 1.00 16.84 O ATOM 157 CB CYS A 20 51.515 6.648 77.649 1.00 16.74 C ATOM 158 SG CYS A 20 50.613 6.264 76.087 1.00 17.40 S ATOM 159 H CYS A 20 50.060 8.741 77.998 1.00 0.00 H ATOM 160 N LEU A 21 51.810 7.800 80.626 1.00 16.18 N ATOM 161 CA LEU A 21 52.491 7.792 81.921 1.00 15.95 C ATOM 162 C LEU A 21 51.529 7.444 83.044 1.00 17.43 C ATOM 163 O LEU A 21 51.819 6.595 83.902 1.00 17.33 O ATOM 164 CB LEU A 21 53.093 9.171 82.170 1.00 17.36 C ATOM 165 CG LEU A 21 53.804 9.338 83.504 1.00 18.53 C ATOM 166 CD1 LEU A 21 54.941 8.332 83.693 1.00 19.93 C ATOM 167 CD2 LEU A 21 54.302 10.811 83.629 1.00 19.79 C ATOM 168 H LEU A 21 51.740 8.683 80.081 1.00 0.00 H ATOM 169 N LEU A 22 50.373 8.075 83.037 1.00 16.93 N ATOM 170 CA LEU A 22 49.419 7.834 84.121 1.00 17.10 C ATOM 171 C LEU A 22 48.872 6.418 84.084 1.00 18.48 C ATOM 172 O LEU A 22 48.666 5.789 85.134 1.00 20.76 O ATOM 173 CB LEU A 22 48.276 8.855 84.051 1.00 18.33 C ATOM 174 CG LEU A 22 48.556 10.171 84.806 1.00 20.82 C ATOM 175 CD1 LEU A 22 49.796 10.999 84.498 1.00 22.53 C ATOM 176 CD2 LEU A 22 47.215 11.022 84.652 1.00 21.53 C ATOM 177 H LEU A 22 50.140 8.737 82.270 1.00 0.00 H ATOM 178 N ILE A 23 48.533 5.922 82.895 1.00 18.10 N ATOM 179 CA ILE A 23 47.987 4.594 82.747 1.00 18.70 C ATOM 180 C ILE A 23 49.007 3.501 83.027 1.00 19.12 C ATOM 181 O ILE A 23 48.658 2.455 83.578 1.00 20.14 O ATOM 182 CB ILE A 23 47.365 4.420 81.334 1.00 22.69 C ATOM 183 CG1 ILE A 23 46.163 5.343 81.212 1.00 27.09 C ATOM 184 CG2 ILE A 23 46.984 2.989 81.107 1.00 25.78 C ATOM 185 CD1 ILE A 23 45.117 5.051 82.251 1.00 31.74 C ATOM 186 H ILE A 23 48.666 6.510 82.047 1.00 0.00 H ATOM 187 N VAL A 24 50.269 3.688 82.621 1.00 19.35 N ATOM 188 CA VAL A 24 51.272 2.684 82.978 1.00 21.21 C ATOM 189 C VAL A 24 51.395 2.630 84.490 1.00 21.35 C ATOM 190 O VAL A 24 51.420 1.556 85.091 1.00 23.03 O ATOM 191 CB VAL A 24 52.613 2.972 82.283 1.00 21.40 C ATOM 192 CG1 VAL A 24 53.746 2.142 82.908 1.00 23.48 C ATOM 193 CG2 VAL A 24 52.501 2.652 80.784 1.00 23.05 C ATOM 194 H VAL A 24 50.530 4.527 82.065 1.00 0.00 H ATOM 195 N PHE A 25 51.431 3.787 85.116 1.00 19.99 N ATOM 196 CA PHE A 25 51.570 3.800 86.589 1.00 21.19 C ATOM 197 C PHE A 25 50.261 3.295 87.322 1.00 22.80 C ATOM 198 O PHE A 25 50.314 2.423 88.214 1.00 24.14 O ATOM 199 CB PHE A 25 51.925 5.181 87.196 1.00 21.46 C ATOM 200 CG PHE A 25 51.856 5.196 88.723 1.00 23.72 C ATOM 201 CD1 PHE A 25 52.823 4.532 89.479 1.00 25.94 C ATOM 202 CD2 PHE A 25 50.816 5.829 89.408 1.00 26.10 C ATOM 203 CE1 PHE A 25 52.761 4.529 90.855 1.00 27.81 C ATOM 204 CE2 PHE A 25 50.762 5.822 90.782 1.00 29.02 C ATOM 205 CZ PHE A 25 51.734 5.173 91.503 1.00 28.58 C ATOM 206 H PHE A 25 51.363 4.678 84.584 1.00 0.00 H ATOM 207 N SER A 26 49.078 3.834 86.955 1.00 21.40 N ATOM 208 CA SER A 26 47.791 3.487 87.683 1.00 23.48 C ATOM 209 C SER A 26 47.236 2.020 87.425 1.00 24.68 C ATOM 210 O SER A 26 46.665 1.404 88.354 1.00 27.42 O ATOM 211 CB SER A 26 46.621 4.480 87.422 1.00 25.79 C ATOM 212 OG SER A 26 46.255 4.439 86.064 1.00 27.42 O ATOM 213 HG SER A 26 47.032 4.694 85.506 1.00 0.00 H ATOM 214 H SER A 26 49.048 4.501 86.157 1.00 0.00 H ATOM 215 N LYS A 27 47.357 1.519 86.174 1.00 25.65 N ATOM 216 CA LYS A 27 46.890 0.172 85.712 1.00 29.99 C ATOM 217 C LYS A 27 48.007 -0.744 85.133 1.00 28.85 C ATOM 218 O LYS A 27 47.684 -1.746 84.482 1.00 32.26 O ATOM 219 CB LYS A 27 45.795 0.345 84.626 1.00 35.73 C ATOM 220 CG LYS A 27 44.672 1.271 85.059 1.00 44.56 C ATOM 221 CD LYS A 27 43.581 1.413 84.003 1.00 51.04 C ATOM 222 CE LYS A 27 42.475 2.358 84.458 1.00 51.91 C ATOM 223 NZ LYS A 27 41.392 2.514 83.449 1.00 49.11 N ATOM 224 HZ1 LYS A 27 41.793 2.896 82.569 1.00 0.00 H ATOM 225 HZ2 LYS A 27 40.959 1.587 83.261 1.00 0.00 H ATOM 226 HZ3 LYS A 27 40.670 3.167 83.815 1.00 0.00 H ATOM 227 H LYS A 27 47.818 2.126 85.466 1.00 0.00 H ATOM 228 N ASP A 28 49.306 -0.423 85.271 1.00 30.54 N ATOM 229 CA ASP A 28 50.377 -1.227 84.652 1.00 32.60 C ATOM 230 C ASP A 28 50.186 -1.647 83.152 1.00 34.71 C ATOM 231 O ASP A 28 50.646 -2.736 82.815 1.00 37.10 O ATOM 232 CB ASP A 28 50.647 -2.458 85.524 1.00 35.50 C ATOM 233 CG ASP A 28 51.007 -2.058 86.985 1.00 35.78 C ATOM 234 OD1 ASP A 28 51.845 -1.139 87.121 1.00 33.24 O ATOM 235 OD2 ASP A 28 50.484 -2.606 87.990 1.00 38.82 O ATOM 236 H ASP A 28 49.563 0.416 85.830 1.00 0.00 H ATOM 237 N GLU A 29 49.538 -0.811 82.307 1.00 36.56 N ATOM 238 CA GLU A 29 49.254 -1.061 80.862 1.00 40.99 C ATOM 239 C GLU A 29 49.618 0.146 79.996 1.00 36.11 C ATOM 240 O GLU A 29 49.483 1.288 80.416 1.00 34.20 O ATOM 241 CB GLU A 29 47.758 -1.449 80.645 1.00 48.13 C ATOM 242 CG GLU A 29 47.391 -2.842 81.172 1.00 58.71 C ATOM 243 CD GLU A 29 45.875 -3.100 81.232 1.00 65.19 C ATOM 244 OE1 GLU A 29 45.432 -4.226 81.576 1.00 70.21 O ATOM 245 OE2 GLU A 29 45.117 -2.152 80.946 1.00 64.99 O ATOM 246 H GLU A 29 49.206 0.092 82.702 1.00 0.00 H ATOM 247 N PHE A 30 50.091 -0.141 78.822 1.00 34.46 N ATOM 248 CA PHE A 30 50.448 0.947 77.894 1.00 30.34 C ATOM 249 C PHE A 30 49.470 1.022 76.740 1.00 30.28 C ATOM 250 O PHE A 30 49.393 0.088 75.947 1.00 31.60 O ATOM 251 CB PHE A 30 51.857 0.740 77.348 1.00 33.10 C ATOM 252 CG PHE A 30 52.357 1.874 76.476 1.00 35.07 C ATOM 253 CD1 PHE A 30 52.152 1.885 75.102 1.00 43.78 C ATOM 254 CD2 PHE A 30 53.077 2.906 77.029 1.00 28.09 C ATOM 255 CE1 PHE A 30 52.634 2.941 74.322 1.00 43.39 C ATOM 256 CE2 PHE A 30 53.582 3.911 76.264 1.00 28.38 C ATOM 257 CZ PHE A 30 53.373 3.945 74.916 1.00 36.16 C ATOM 258 H PHE A 30 50.217 -1.133 78.538 1.00 0.00 H ATOM 259 N PRO A 31 48.785 2.135 76.591 1.00 33.79 N ATOM 260 CA PRO A 31 47.766 2.263 75.540 1.00 36.64 C ATOM 261 C PRO A 31 48.363 2.126 74.148 1.00 39.31 C ATOM 262 O PRO A 31 49.357 2.774 73.812 1.00 38.04 O ATOM 263 CB PRO A 31 47.205 3.666 75.773 1.00 35.43 C ATOM 264 CG PRO A 31 47.516 3.972 77.171 1.00 34.12 C ATOM 265 CD PRO A 31 48.796 3.295 77.499 1.00 33.68 C ATOM 266 N GLU A 32 47.712 1.303 73.317 1.00 42.60 N ATOM 267 CA GLU A 32 48.237 1.032 71.979 1.00 45.39 C ATOM 268 C GLU A 32 47.950 2.160 70.990 1.00 43.15 C ATOM 269 O GLU A 32 48.805 2.486 70.158 1.00 45.46 O ATOM 270 CB GLU A 32 47.671 -0.273 71.441 1.00 50.36 C ATOM 271 CG GLU A 32 48.275 -0.684 70.111 1.00 56.14 C ATOM 272 CD GLU A 32 47.824 -2.059 69.676 1.00 65.46 C ATOM 273 OE1 GLU A 32 46.597 -2.260 69.526 1.00 68.34 O ATOM 274 OE2 GLU A 32 48.692 -2.941 69.490 1.00 70.66 O ATOM 275 H GLU A 32 46.826 0.853 73.625 1.00 0.00 H ATOM 276 N VAL A 33 46.766 2.759 71.030 1.00 38.66 N ATOM 277 CA VAL A 33 46.365 3.734 70.017 1.00 35.26 C ATOM 278 C VAL A 33 46.204 5.097 70.683 1.00 30.39 C ATOM 279 O VAL A 33 45.528 5.209 71.718 1.00 30.60 O ATOM 280 CB VAL A 33 45.077 3.304 69.298 1.00 37.01 C ATOM 281 CG1 VAL A 33 44.635 4.413 68.361 1.00 36.35 C ATOM 282 CG2 VAL A 33 45.269 1.980 68.555 1.00 40.84 C ATOM 283 H VAL A 33 46.107 2.529 71.801 1.00 0.00 H ATOM 284 N TYR A 34 46.806 6.139 70.067 1.00 26.74 N ATOM 285 CA TYR A 34 46.756 7.513 70.575 1.00 23.23 C ATOM 286 C TYR A 34 45.354 8.060 70.417 1.00 23.63 C ATOM 287 O TYR A 34 44.887 8.211 69.294 1.00 24.78 O ATOM 288 CB TYR A 34 47.744 8.409 69.834 1.00 21.90 C ATOM 289 CG TYR A 34 47.609 9.867 70.183 1.00 19.06 C ATOM 290 CD1 TYR A 34 47.426 10.266 71.515 1.00 17.62 C ATOM 291 CD2 TYR A 34 47.697 10.848 69.224 1.00 20.07 C ATOM 292 CE1 TYR A 34 47.309 11.603 71.869 1.00 17.18 C ATOM 293 CE2 TYR A 34 47.540 12.171 69.530 1.00 20.94 C ATOM 294 CZ TYR A 34 47.381 12.569 70.855 1.00 19.96 C ATOM 295 OH TYR A 34 47.231 13.935 71.102 1.00 20.49 O ATOM 296 HH TYR A 34 47.128 14.084 72.075 1.00 0.00 H ATOM 297 H TYR A 34 47.331 5.956 69.188 1.00 0.00 H ATOM 298 N VAL A 35 44.695 8.318 71.541 1.00 22.93 N ATOM 299 CA VAL A 35 43.428 9.003 71.595 1.00 22.24 C ATOM 300 C VAL A 35 43.625 10.214 72.486 1.00 19.17 C ATOM 301 O VAL A 35 43.917 10.061 73.678 1.00 18.94 O ATOM 302 CB VAL A 35 42.292 8.116 72.123 1.00 25.13 C ATOM 303 CG1 VAL A 35 41.015 8.928 72.139 1.00 25.04 C ATOM 304 CG2 VAL A 35 42.113 6.915 71.233 1.00 26.93 C ATOM 305 H VAL A 35 45.120 8.006 72.438 1.00 0.00 H ATOM 306 N PRO A 36 43.530 11.427 71.935 1.00 18.39 N ATOM 307 CA PRO A 36 43.612 12.635 72.748 1.00 17.17 C ATOM 308 C PRO A 36 42.636 12.602 73.904 1.00 17.85 C ATOM 309 O PRO A 36 41.496 12.207 73.775 1.00 19.40 O ATOM 310 CB PRO A 36 43.298 13.766 71.762 1.00 18.85 C ATOM 311 CG PRO A 36 43.682 13.186 70.413 1.00 20.35 C ATOM 312 CD PRO A 36 43.339 11.733 70.498 1.00 20.66 C ATOM 313 N THR A 37 43.161 13.006 75.068 1.00 15.97 N ATOM 314 CA THR A 37 42.369 13.177 76.274 1.00 17.04 C ATOM 315 C THR A 37 41.430 14.370 76.124 1.00 17.51 C ATOM 316 O THR A 37 41.759 15.358 75.451 1.00 17.59 O ATOM 317 CB THR A 37 43.333 13.349 77.426 1.00 17.76 C ATOM 318 OG1 THR A 37 44.144 12.158 77.419 1.00 18.94 O ATOM 319 CG2 THR A 37 42.643 13.528 78.765 1.00 16.53 C ATOM 320 HG1 THR A 37 44.804 12.205 78.156 1.00 0.00 H ATOM 321 H THR A 37 44.181 13.206 75.110 1.00 0.00 H ATOM 322 N VAL A 38 40.264 14.279 76.772 1.00 17.96 N ATOM 323 CA VAL A 38 39.408 15.428 76.976 1.00 19.16 C ATOM 324 C VAL A 38 39.643 15.814 78.425 1.00 19.03 C ATOM 325 O VAL A 38 40.430 16.728 78.703 1.00 17.65 O ATOM 326 CB VAL A 38 37.973 15.073 76.635 1.00 20.29 C ATOM 327 CG1 VAL A 38 37.061 16.269 76.831 1.00 21.48 C ATOM 328 CG2 VAL A 38 37.877 14.568 75.156 1.00 20.92 C ATOM 329 H VAL A 38 39.963 13.354 77.141 1.00 0.00 H ATOM 330 N PHE A 39 39.064 15.065 79.349 1.00 18.07 N ATOM 331 CA PHE A 39 39.509 15.071 80.758 1.00 17.50 C ATOM 332 C PHE A 39 38.951 13.821 81.423 1.00 18.49 C ATOM 333 O PHE A 39 37.903 13.311 81.026 1.00 20.00 O ATOM 334 CB PHE A 39 39.106 16.338 81.553 1.00 17.81 C ATOM 335 CG PHE A 39 37.643 16.617 81.622 1.00 19.35 C ATOM 336 CD1 PHE A 39 36.814 15.947 82.507 1.00 21.86 C ATOM 337 CD2 PHE A 39 37.154 17.574 80.818 1.00 20.68 C ATOM 338 CE1 PHE A 39 35.434 16.221 82.511 1.00 25.25 C ATOM 339 CE2 PHE A 39 35.757 17.859 80.828 1.00 22.87 C ATOM 340 CZ PHE A 39 34.960 17.195 81.726 1.00 24.81 C ATOM 341 H PHE A 39 38.270 14.452 79.075 1.00 0.00 H ATOM 342 N GLU A 40 39.664 13.299 82.424 1.00 18.16 N ATOM 343 CA GLU A 40 39.280 12.130 83.195 1.00 18.85 C ATOM 344 C GLU A 40 40.331 11.949 84.259 1.00 19.43 C ATOM 345 O GLU A 40 41.348 12.636 84.242 1.00 17.80 O ATOM 346 CB GLU A 40 39.144 10.867 82.351 1.00 20.57 C ATOM 347 CG GLU A 40 40.398 10.480 81.605 1.00 19.34 C ATOM 348 CD GLU A 40 40.162 9.365 80.641 1.00 21.18 C ATOM 349 OE1 GLU A 40 39.732 8.260 81.090 1.00 22.53 O ATOM 350 OE2 GLU A 40 40.266 9.610 79.404 1.00 21.27 O ATOM 351 H GLU A 40 40.561 13.764 82.670 1.00 0.00 H ATOM 352 N ASN A 41 40.050 11.071 85.207 1.00 18.90 N ATOM 353 CA ASN A 41 41.058 10.822 86.223 1.00 19.45 C ATOM 354 C ASN A 41 41.053 9.355 86.592 1.00 21.78 C ATOM 355 O ASN A 41 40.206 8.561 86.167 1.00 23.02 O ATOM 356 CB ASN A 41 40.857 11.759 87.422 1.00 20.40 C ATOM 357 CG ASN A 41 39.533 11.557 88.124 1.00 20.76 C ATOM 358 OD1 ASN A 41 39.103 10.448 88.335 1.00 22.33 O ATOM 359 ND2 ASN A 41 38.910 12.660 88.507 1.00 21.84 N ATOM 360 HD22 ASN A 41 39.325 13.591 88.299 1.00 0.00 H ATOM 361 HD21 ASN A 41 38.005 12.596 89.016 1.00 0.00 H ATOM 362 H ASN A 41 39.136 10.574 85.225 1.00 0.00 H ATOM 363 N TYR A 42 42.120 9.029 87.309 1.00 20.70 N ATOM 364 CA TYR A 42 42.395 7.684 87.791 1.00 22.09 C ATOM 365 C TYR A 42 42.707 7.643 89.296 1.00 23.88 C ATOM 366 O TYR A 42 43.016 8.660 89.901 1.00 24.81 O ATOM 367 CB TYR A 42 43.598 7.097 87.006 1.00 22.55 C ATOM 368 CG TYR A 42 43.450 7.185 85.465 1.00 24.24 C ATOM 369 CD1 TYR A 42 42.779 6.193 84.751 1.00 28.18 C ATOM 370 CD2 TYR A 42 43.976 8.259 84.737 1.00 25.23 C ATOM 371 CE1 TYR A 42 42.640 6.247 83.387 1.00 28.97 C ATOM 372 CE2 TYR A 42 43.850 8.342 83.367 1.00 27.66 C ATOM 373 CZ TYR A 42 43.171 7.335 82.669 1.00 30.42 C ATOM 374 OH TYR A 42 43.033 7.396 81.274 1.00 36.15 O ATOM 375 HH TYR A 42 42.529 6.605 80.959 1.00 0.00 H ATOM 376 H TYR A 42 42.801 9.780 87.541 1.00 0.00 H ATOM 377 N VAL A 43 42.625 6.450 89.861 1.00 25.55 N ATOM 378 CA VAL A 43 43.020 6.228 91.254 1.00 28.93 C ATOM 379 C VAL A 43 44.187 5.260 91.261 1.00 29.16 C ATOM 380 O VAL A 43 44.170 4.253 90.545 1.00 31.63 O ATOM 381 CB VAL A 43 41.856 5.673 92.094 1.00 34.24 C ATOM 382 CG1 VAL A 43 42.255 5.499 93.564 1.00 38.62 C ATOM 383 CG2 VAL A 43 40.646 6.593 91.969 1.00 35.46 C ATOM 384 H VAL A 43 42.271 5.648 89.301 1.00 0.00 H ATOM 385 N ALA A 44 45.189 5.546 92.079 1.00 27.01 N ATOM 386 CA ALA A 44 46.267 4.591 92.304 1.00 28.21 C ATOM 387 C ALA A 44 46.610 4.599 93.782 1.00 29.07 C ATOM 388 O ALA A 44 46.538 5.640 94.432 1.00 30.26 O ATOM 389 CB ALA A 44 47.512 4.905 91.447 1.00 27.07 C ATOM 390 H ALA A 44 45.207 6.464 92.567 1.00 0.00 H ATOM 391 N ASP A 45 46.906 3.442 94.322 1.00 30.99 N ATOM 392 CA ASP A 45 47.443 3.353 95.672 1.00 34.52 C ATOM 393 C ASP A 45 48.959 3.324 95.583 1.00 33.72 C ATOM 394 O ASP A 45 49.531 2.671 94.710 1.00 35.44 O ATOM 395 CB ASP A 45 46.927 2.111 96.389 1.00 41.23 C ATOM 396 CG ASP A 45 45.424 2.098 96.490 1.00 47.87 C ATOM 397 OD1 ASP A 45 44.842 3.132 96.881 1.00 49.56 O ATOM 398 OD2 ASP A 45 44.829 1.052 96.171 1.00 52.04 O ATOM 399 H ASP A 45 46.754 2.570 93.775 1.00 0.00 H ATOM 400 N ILE A 46 49.619 4.070 96.446 1.00 32.75 N ATOM 401 CA ILE A 46 51.065 4.012 96.461 1.00 31.78 C ATOM 402 C ILE A 46 51.540 4.025 97.908 1.00 32.91 C ATOM 403 O ILE A 46 50.932 4.663 98.776 1.00 33.54 O ATOM 404 CB ILE A 46 51.662 5.170 95.639 1.00 30.63 C ATOM 405 CG1 ILE A 46 53.158 4.973 95.429 1.00 31.65 C ATOM 406 CG2 ILE A 46 51.407 6.521 96.323 1.00 30.95 C ATOM 407 CD1 ILE A 46 53.763 6.085 94.586 1.00 31.27 C ATOM 408 H ILE A 46 49.109 4.691 97.106 1.00 0.00 H ATOM 409 N GLU A 47 52.615 3.293 98.170 1.00 35.03 N ATOM 410 CA GLU A 47 53.307 3.368 99.440 1.00 37.55 C ATOM 411 C GLU A 47 54.671 4.002 99.191 1.00 36.36 C ATOM 412 O GLU A 47 55.452 3.518 98.363 1.00 36.80 O ATOM 413 CB GLU A 47 53.449 1.996 100.085 1.00 41.73 C ATOM 414 CG GLU A 47 54.104 2.053 101.443 1.00 47.29 C ATOM 415 CD GLU A 47 54.204 0.701 102.104 1.00 53.27 C ATOM 416 OE1 GLU A 47 53.258 -0.104 101.966 1.00 53.82 O ATOM 417 OE2 GLU A 47 55.232 0.448 102.769 1.00 57.53 O ATOM 418 H GLU A 47 52.972 2.644 97.440 1.00 0.00 H ATOM 419 N VAL A 48 54.925 5.105 99.870 1.00 35.52 N ATOM 420 CA VAL A 48 56.176 5.832 99.753 1.00 39.29 C ATOM 421 C VAL A 48 56.675 6.110 101.153 1.00 42.02 C ATOM 422 O VAL A 48 55.912 6.590 102.001 1.00 42.18 O ATOM 423 CB VAL A 48 55.987 7.149 98.972 1.00 43.31 C ATOM 424 CG1 VAL A 48 57.317 7.672 98.510 1.00 53.84 C ATOM 425 CG2 VAL A 48 55.017 6.949 97.782 1.00 37.95 C ATOM 426 H VAL A 48 54.197 5.469 100.517 1.00 0.00 H ATOM 427 N ASP A 49 57.955 5.800 101.396 1.00 39.18 N ATOM 428 CA ASP A 49 58.589 6.038 102.687 1.00 43.33 C ATOM 429 C ASP A 49 57.733 5.505 103.830 1.00 46.53 C ATOM 430 O ASP A 49 57.578 6.147 104.869 1.00 48.13 O ATOM 431 CB ASP A 49 58.883 7.522 102.890 1.00 42.61 C ATOM 432 CG ASP A 49 59.698 8.094 101.781 1.00 40.14 C ATOM 433 OD1 ASP A 49 60.421 7.310 101.143 1.00 40.71 O ATOM 434 OD2 ASP A 49 59.598 9.320 101.514 1.00 38.30 O ATOM 435 H ASP A 49 58.519 5.373 100.634 1.00 0.00 H ATOM 436 N GLY A 50 57.134 4.337 103.612 1.00 47.71 N ATOM 437 CA GLY A 50 56.344 3.689 104.628 1.00 50.27 C ATOM 438 C GLY A 50 54.922 4.175 104.765 1.00 49.92 C ATOM 439 O GLY A 50 54.185 3.629 105.589 1.00 50.43 O ATOM 440 H GLY A 50 57.239 3.880 102.684 1.00 0.00 H ATOM 441 N LYS A 51 54.498 5.166 103.983 1.00 49.18 N ATOM 442 CA LYS A 51 53.165 5.740 104.124 1.00 49.22 C ATOM 443 C LYS A 51 52.272 5.313 102.969 1.00 45.57 C ATOM 444 O LYS A 51 52.724 5.220 101.826 1.00 44.18 O ATOM 445 CB LYS A 51 53.215 7.268 104.175 1.00 49.75 C ATOM 446 CG LYS A 51 54.227 7.841 105.158 1.00 52.01 C ATOM 447 CD LYS A 51 54.234 9.367 105.118 1.00 52.23 C ATOM 448 CE LYS A 51 55.605 9.953 105.425 1.00 54.59 C ATOM 449 NZ LYS A 51 55.690 11.392 105.036 1.00 54.24 N ATOM 450 HZ1 LYS A 51 55.515 11.485 104.015 1.00 0.00 H ATOM 451 HZ2 LYS A 51 54.976 11.935 105.562 1.00 0.00 H ATOM 452 HZ3 LYS A 51 56.638 11.755 105.261 1.00 0.00 H ATOM 453 H LYS A 51 55.135 5.541 103.252 1.00 0.00 H ATOM 454 N GLN A 52 51.004 5.072 103.281 1.00 43.46 N ATOM 455 CA GLN A 52 50.012 4.646 102.306 1.00 42.66 C ATOM 456 C GLN A 52 49.232 5.864 101.838 1.00 39.10 C ATOM 457 O GLN A 52 48.646 6.580 102.658 1.00 40.33 O ATOM 458 CB GLN A 52 49.071 3.613 102.931 1.00 50.24 C ATOM 459 CG GLN A 52 48.309 2.785 101.922 1.00 56.42 C ATOM 460 CD GLN A 52 49.222 1.916 101.076 1.00 59.45 C ATOM 461 OE1 GLN A 52 50.131 1.254 101.597 1.00 65.84 O ATOM 462 NE2 GLN A 52 48.991 1.917 99.761 1.00 53.92 N ATOM 463 HE22 GLN A 52 48.216 2.489 99.370 1.00 0.00 H ATOM 464 HE21 GLN A 52 49.586 1.346 99.128 1.00 0.00 H ATOM 465 H GLN A 52 50.706 5.194 104.270 1.00 0.00 H ATOM 466 N VAL A 53 49.188 6.076 100.516 1.00 36.14 N ATOM 467 CA VAL A 53 48.555 7.236 99.929 1.00 34.62 C ATOM 468 C VAL A 53 47.674 6.734 98.801 1.00 33.33 C ATOM 469 O VAL A 53 48.097 5.870 98.018 1.00 33.37 O ATOM 470 CB VAL A 53 49.581 8.262 99.391 1.00 33.23 C ATOM 471 CG1 VAL A 53 48.864 9.401 98.651 1.00 32.84 C ATOM 472 CG2 VAL A 53 50.458 8.760 100.546 1.00 34.52 C ATOM 473 H VAL A 53 49.628 5.376 99.885 1.00 0.00 H ATOM 474 N GLU A 54 46.433 7.222 98.762 1.00 32.93 N ATOM 475 CA GLU A 54 45.563 7.055 97.607 1.00 33.20 C ATOM 476 C GLU A 54 45.754 8.271 96.718 1.00 29.28 C ATOM 477 O GLU A 54 45.343 9.388 97.071 1.00 29.65 O ATOM 478 CB GLU A 54 44.113 6.907 98.039 1.00 38.12 C ATOM 479 CG GLU A 54 43.148 6.584 96.915 1.00 43.09 C ATOM 480 CD GLU A 54 41.696 6.713 97.344 1.00 51.16 C ATOM 481 OE1 GLU A 54 40.997 7.626 96.852 1.00 53.08 O ATOM 482 OE2 GLU A 54 41.255 5.890 98.162 1.00 56.11 O ATOM 483 H GLU A 54 46.074 7.741 99.588 1.00 0.00 H ATOM 484 N LEU A 55 46.362 8.061 95.551 1.00 27.05 N ATOM 485 CA LEU A 55 46.656 9.123 94.631 1.00 26.92 C ATOM 486 C LEU A 55 45.479 9.195 93.680 1.00 26.61 C ATOM 487 O LEU A 55 45.000 8.156 93.227 1.00 30.87 O ATOM 488 CB LEU A 55 47.896 8.843 93.802 1.00 29.44 C ATOM 489 CG LEU A 55 49.224 9.331 94.359 1.00 32.99 C ATOM 490 CD1 LEU A 55 50.250 8.981 93.275 1.00 31.38 C ATOM 491 CD2 LEU A 55 49.125 10.831 94.608 1.00 35.32 C ATOM 492 H LEU A 55 46.634 7.090 95.297 1.00 0.00 H ATOM 493 N ALA A 56 44.971 10.376 93.463 1.00 23.37 N ATOM 494 CA ALA A 56 44.070 10.587 92.319 1.00 21.94 C ATOM 495 C ALA A 56 44.865 11.276 91.227 1.00 20.62 C ATOM 496 O ALA A 56 45.548 12.277 91.469 1.00 22.66 O ATOM 497 CB ALA A 56 42.849 11.419 92.710 1.00 23.49 C ATOM 498 H ALA A 56 45.202 11.167 94.097 1.00 0.00 H ATOM 499 N LEU A 57 44.787 10.742 90.018 1.00 18.77 N ATOM 500 CA LEU A 57 45.632 11.165 88.921 1.00 17.87 C ATOM 501 C LEU A 57 44.722 11.809 87.878 1.00 16.71 C ATOM 502 O LEU A 57 43.984 11.111 87.162 1.00 19.28 O ATOM 503 CB LEU A 57 46.393 9.993 88.314 1.00 19.55 C ATOM 504 CG LEU A 57 47.099 9.005 89.224 1.00 20.78 C ATOM 505 CD1 LEU A 57 47.770 7.936 88.370 1.00 22.62 C ATOM 506 CD2 LEU A 57 48.174 9.779 90.020 1.00 20.16 C ATOM 507 H LEU A 57 44.091 9.988 89.849 1.00 0.00 H ATOM 508 N TRP A 58 44.803 13.112 87.761 1.00 16.34 N ATOM 509 CA TRP A 58 43.877 13.862 86.903 1.00 15.95 C ATOM 510 C TRP A 58 44.575 14.152 85.590 1.00 16.68 C ATOM 511 O TRP A 58 45.582 14.865 85.515 1.00 16.37 O ATOM 512 CB TRP A 58 43.421 15.136 87.593 1.00 17.28 C ATOM 513 CG TRP A 58 42.551 14.962 88.779 1.00 17.76 C ATOM 514 CD1 TRP A 58 42.820 14.245 89.932 1.00 18.91 C ATOM 515 CD2 TRP A 58 41.246 15.507 88.958 1.00 19.43 C ATOM 516 NE1 TRP A 58 41.767 14.344 90.811 1.00 19.94 N ATOM 517 CE2 TRP A 58 40.785 15.103 90.227 1.00 20.20 C ATOM 518 CE3 TRP A 58 40.428 16.323 88.177 1.00 18.16 C ATOM 519 CZ2 TRP A 58 39.548 15.477 90.718 1.00 21.81 C ATOM 520 CZ3 TRP A 58 39.228 16.684 88.675 1.00 20.34 C ATOM 521 CH2 TRP A 58 38.773 16.242 89.902 1.00 22.17 C ATOM 522 HE1 TRP A 58 41.723 13.916 91.758 1.00 0.00 H ATOM 523 H TRP A 58 45.539 13.626 88.287 1.00 0.00 H ATOM 524 N ASP A 59 44.007 13.614 84.532 1.00 16.00 N ATOM 525 CA ASP A 59 44.569 13.689 83.195 1.00 15.21 C ATOM 526 C ASP A 59 43.911 14.832 82.465 1.00 15.45 C ATOM 527 O ASP A 59 42.691 14.991 82.542 1.00 16.92 O ATOM 528 CB ASP A 59 44.316 12.356 82.491 1.00 16.01 C ATOM 529 CG ASP A 59 45.291 12.077 81.355 1.00 16.70 C ATOM 530 OD1 ASP A 59 46.124 12.939 81.091 1.00 17.38 O ATOM 531 OD2 ASP A 59 45.176 10.989 80.739 1.00 18.29 O ATOM 532 H ASP A 59 43.107 13.108 84.660 1.00 0.00 H ATOM 533 N THR A 60 44.696 15.593 81.739 1.00 15.28 N ATOM 534 CA THR A 60 44.234 16.764 81.014 1.00 14.94 C ATOM 535 C THR A 60 44.580 16.677 79.548 1.00 15.34 C ATOM 536 O THR A 60 45.547 16.038 79.158 1.00 15.28 O ATOM 537 CB THR A 60 44.824 18.077 81.560 1.00 16.50 C ATOM 538 OG1 THR A 60 46.251 18.153 81.334 1.00 16.71 O ATOM 539 CG2 THR A 60 44.531 18.180 83.025 1.00 17.48 C ATOM 540 HG1 THR A 60 46.697 17.396 81.790 1.00 0.00 H ATOM 541 H THR A 60 45.704 15.344 81.679 1.00 0.00 H ATOM 542 N ALA A 61 43.843 17.431 78.750 1.00 15.76 N ATOM 543 CA ALA A 61 44.087 17.541 77.334 1.00 16.55 C ATOM 544 C ALA A 61 45.154 18.587 77.116 1.00 17.16 C ATOM 545 O ALA A 61 44.958 19.744 77.514 1.00 17.94 O ATOM 546 CB ALA A 61 42.810 17.987 76.627 1.00 18.08 C ATOM 547 H ALA A 61 43.053 17.968 79.162 1.00 0.00 H ATOM 548 N GLY A 62 46.205 18.220 76.393 1.00 17.35 N ATOM 549 CA GLY A 62 47.196 19.207 76.026 1.00 18.65 C ATOM 550 C GLY A 62 46.896 19.998 74.791 1.00 21.60 C ATOM 551 O GLY A 62 47.522 21.043 74.581 1.00 23.47 O ATOM 552 H GLY A 62 46.315 17.230 76.093 1.00 0.00 H ATOM 553 N LEU A 63 45.995 19.527 73.948 1.00 21.75 N ATOM 554 CA LEU A 63 45.692 20.263 72.740 1.00 25.35 C ATOM 555 C LEU A 63 45.057 21.608 73.073 1.00 27.39 C ATOM 556 O LEU A 63 44.215 21.727 73.965 1.00 25.28 O ATOM 557 CB LEU A 63 44.792 19.430 71.856 1.00 27.76 C ATOM 558 CG LEU A 63 45.430 18.224 71.154 1.00 28.04 C ATOM 559 CD1 LEU A 63 44.270 17.458 70.487 1.00 30.49 C ATOM 560 CD2 LEU A 63 46.468 18.635 70.152 1.00 28.75 C ATOM 561 H LEU A 63 45.506 18.632 74.151 1.00 0.00 H ATOM 562 N GLU A 64 45.528 22.641 72.387 1.00 31.47 N ATOM 563 CA GLU A 64 44.983 23.975 72.597 1.00 33.96 C ATOM 564 C GLU A 64 43.486 24.023 72.363 1.00 32.75 C ATOM 565 O GLU A 64 42.787 24.809 73.016 1.00 33.26 O ATOM 566 CB GLU A 64 45.730 24.947 71.680 1.00 37.68 C ATOM 567 CG GLU A 64 45.083 26.284 71.556 1.00 44.02 C ATOM 568 CD GLU A 64 45.984 27.285 70.859 1.00 48.84 C ATOM 569 OE1 GLU A 64 47.216 27.051 70.811 1.00 48.38 O ATOM 570 OE2 GLU A 64 45.454 28.308 70.392 1.00 52.65 O ATOM 571 H GLU A 64 46.291 22.497 71.695 1.00 0.00 H ATOM 572 N ASP A 65 42.965 23.158 71.488 1.00 30.38 N ATOM 573 CA ASP A 65 41.525 23.105 71.238 1.00 32.42 C ATOM 574 C ASP A 65 40.727 22.821 72.514 1.00 28.48 C ATOM 575 O ASP A 65 39.518 23.123 72.566 1.00 30.49 O ATOM 576 CB ASP A 65 41.220 22.006 70.204 1.00 36.41 C ATOM 577 CG ASP A 65 41.505 22.407 68.735 1.00 42.58 C ATOM 578 OD1 ASP A 65 41.545 23.608 68.368 1.00 44.98 O ATOM 579 OD2 ASP A 65 41.665 21.469 67.918 1.00 44.54 O ATOM 580 H ASP A 65 43.596 22.510 70.975 1.00 0.00 H ATOM 581 N TYR A 66 41.351 22.213 73.530 1.00 25.68 N ATOM 582 CA TYR A 66 40.663 21.932 74.784 1.00 24.30 C ATOM 583 C TYR A 66 41.211 22.773 75.925 1.00 23.34 C ATOM 584 O TYR A 66 40.991 22.448 77.100 1.00 23.74 O ATOM 585 CB TYR A 66 40.733 20.450 75.137 1.00 24.12 C ATOM 586 CG TYR A 66 39.939 19.484 74.254 1.00 26.28 C ATOM 587 CD1 TYR A 66 38.596 19.655 74.005 1.00 29.45 C ATOM 588 CD2 TYR A 66 40.558 18.354 73.749 1.00 29.12 C ATOM 589 CE1 TYR A 66 37.898 18.744 73.235 1.00 31.24 C ATOM 590 CE2 TYR A 66 39.878 17.443 72.989 1.00 31.71 C ATOM 591 CZ TYR A 66 38.563 17.644 72.736 1.00 33.44 C ATOM 592 OH TYR A 66 37.879 16.712 71.972 1.00 37.68 O ATOM 593 HH TYR A 66 36.935 16.995 71.875 1.00 0.00 H ATOM 594 H TYR A 66 42.347 21.935 73.423 1.00 0.00 H ATOM 595 N ASP A 67 41.875 23.888 75.602 1.00 24.48 N ATOM 596 CA ASP A 67 42.350 24.799 76.644 1.00 23.93 C ATOM 597 C ASP A 67 41.277 25.156 77.673 1.00 24.44 C ATOM 598 O ASP A 67 41.543 25.156 78.875 1.00 25.31 O ATOM 599 CB ASP A 67 42.876 26.098 76.033 1.00 25.98 C ATOM 600 CG ASP A 67 44.372 26.051 75.682 1.00 26.98 C ATOM 601 OD1 ASP A 67 45.082 25.089 76.036 1.00 24.89 O ATOM 602 OD2 ASP A 67 44.784 27.041 75.017 1.00 31.75 O ATOM 603 H ASP A 67 42.055 24.109 74.602 1.00 0.00 H ATOM 604 N ARG A 68 40.061 25.451 77.247 1.00 24.62 N ATOM 605 CA ARG A 68 39.028 25.944 78.159 1.00 26.50 C ATOM 606 C ARG A 68 38.676 24.909 79.217 1.00 26.60 C ATOM 607 O ARG A 68 38.055 25.255 80.226 1.00 28.51 O ATOM 608 CB ARG A 68 37.764 26.317 77.377 1.00 29.62 C ATOM 609 CG ARG A 68 37.201 25.145 76.592 1.00 32.72 C ATOM 610 CD ARG A 68 35.828 25.476 75.988 1.00 38.04 C ATOM 611 NE ARG A 68 35.096 24.270 75.598 1.00 40.85 N ATOM 612 CZ ARG A 68 35.500 23.453 74.631 1.00 41.50 C ATOM 613 NH1 ARG A 68 36.604 23.746 73.965 1.00 40.19 N ATOM 614 NH2 ARG A 68 34.790 22.366 74.315 1.00 42.67 N ATOM 615 HE ARG A 68 34.216 24.041 76.103 1.00 0.00 H ATOM 616 HH12 ARG A 68 36.935 23.118 73.205 1.00 0.00 H ATOM 617 HH11 ARG A 68 37.141 24.605 74.201 1.00 0.00 H ATOM 618 HH22 ARG A 68 35.116 21.734 73.556 1.00 0.00 H ATOM 619 HH21 ARG A 68 33.911 22.152 74.828 1.00 0.00 H ATOM 620 H ARG A 68 39.833 25.330 76.240 1.00 0.00 H ATOM 621 N LEU A 69 38.977 23.642 78.972 1.00 23.65 N ATOM 622 CA LEU A 69 38.629 22.580 79.894 1.00 23.17 C ATOM 623 C LEU A 69 39.643 22.390 80.987 1.00 21.55 C ATOM 624 O LEU A 69 39.345 21.825 82.045 1.00 21.32 O ATOM 625 CB LEU A 69 38.479 21.278 79.104 1.00 22.51 C ATOM 626 CG LEU A 69 37.334 21.317 78.085 1.00 23.79 C ATOM 627 CD1 LEU A 69 37.284 19.886 77.477 1.00 23.75 C ATOM 628 CD2 LEU A 69 35.979 21.760 78.615 1.00 24.96 C ATOM 629 H LEU A 69 39.478 23.403 78.092 1.00 0.00 H ATOM 630 N ARG A 70 40.881 22.814 80.746 1.00 19.19 N ATOM 631 CA ARG A 70 41.949 22.448 81.668 1.00 18.92 C ATOM 632 C ARG A 70 41.713 22.995 83.073 1.00 18.83 C ATOM 633 O ARG A 70 41.945 22.248 84.046 1.00 18.43 O ATOM 634 CB ARG A 70 43.318 22.853 81.122 1.00 18.82 C ATOM 635 CG ARG A 70 44.420 21.890 81.612 1.00 17.73 C ATOM 636 CD ARG A 70 45.783 22.126 80.938 1.00 16.50 C ATOM 637 NE ARG A 70 45.672 21.996 79.505 1.00 17.55 N ATOM 638 CZ ARG A 70 45.527 22.970 78.626 1.00 17.98 C ATOM 639 NH1 ARG A 70 45.500 24.257 78.965 1.00 20.12 N ATOM 640 NH2 ARG A 70 45.377 22.648 77.349 1.00 19.38 N ATOM 641 HE ARG A 70 45.710 21.029 79.123 1.00 0.00 H ATOM 642 HH12 ARG A 70 45.383 24.985 78.232 1.00 0.00 H ATOM 643 HH11 ARG A 70 45.596 24.534 79.963 1.00 0.00 H ATOM 644 HH22 ARG A 70 45.261 23.395 76.635 1.00 0.00 H ATOM 645 HH21 ARG A 70 45.376 21.649 77.061 1.00 0.00 H ATOM 646 H ARG A 70 41.084 23.399 79.910 1.00 0.00 H ATOM 647 N PRO A 71 41.216 24.223 83.259 1.00 20.94 N ATOM 648 CA PRO A 71 41.029 24.715 84.636 1.00 22.37 C ATOM 649 C PRO A 71 39.987 23.929 85.436 1.00 22.32 C ATOM 650 O PRO A 71 39.938 24.066 86.678 1.00 22.28 O ATOM 651 CB PRO A 71 40.618 26.175 84.427 1.00 25.31 C ATOM 652 CG PRO A 71 41.259 26.540 83.091 1.00 25.41 C ATOM 653 CD PRO A 71 41.058 25.286 82.252 1.00 22.41 C ATOM 654 N LEU A 72 39.176 23.100 84.779 1.00 20.88 N ATOM 655 CA LEU A 72 38.277 22.207 85.513 1.00 21.41 C ATOM 656 C LEU A 72 39.034 21.242 86.423 1.00 20.86 C ATOM 657 O LEU A 72 38.505 20.810 87.437 1.00 21.06 O ATOM 658 CB LEU A 72 37.368 21.427 84.538 1.00 21.30 C ATOM 659 CG LEU A 72 36.462 22.271 83.659 1.00 21.95 C ATOM 660 CD1 LEU A 72 35.862 21.357 82.612 1.00 20.48 C ATOM 661 CD2 LEU A 72 35.393 22.866 84.516 1.00 23.64 C ATOM 662 H LEU A 72 39.182 23.087 83.739 1.00 0.00 H ATOM 663 N SER A 73 40.269 20.908 86.073 1.00 19.48 N ATOM 664 CA SER A 73 41.036 19.922 86.834 1.00 18.83 C ATOM 665 C SER A 73 41.839 20.525 87.976 1.00 19.34 C ATOM 666 O SER A 73 42.214 19.778 88.863 1.00 20.48 O ATOM 667 CB SER A 73 42.006 19.203 85.900 1.00 18.55 C ATOM 668 OG SER A 73 41.344 18.376 84.957 1.00 18.54 O ATOM 669 HG SER A 73 40.740 18.929 84.401 1.00 0.00 H ATOM 670 H SER A 73 40.701 21.357 85.240 1.00 0.00 H ATOM 671 N TYR A 74 42.103 21.841 87.973 1.00 18.89 N ATOM 672 CA TYR A 74 43.139 22.368 88.878 1.00 20.28 C ATOM 673 C TYR A 74 42.721 22.566 90.327 1.00 21.90 C ATOM 674 O TYR A 74 43.607 22.550 91.189 1.00 22.44 O ATOM 675 CB TYR A 74 43.617 23.724 88.367 1.00 19.98 C ATOM 676 CG TYR A 74 44.429 23.709 87.112 1.00 19.15 C ATOM 677 CD1 TYR A 74 45.417 22.759 86.917 1.00 20.30 C ATOM 678 CD2 TYR A 74 44.250 24.683 86.126 1.00 20.38 C ATOM 679 CE1 TYR A 74 46.188 22.778 85.789 1.00 20.44 C ATOM 680 CE2 TYR A 74 45.033 24.684 84.973 1.00 19.31 C ATOM 681 CZ TYR A 74 45.978 23.716 84.807 1.00 20.69 C ATOM 682 OH TYR A 74 46.785 23.685 83.690 1.00 21.14 O ATOM 683 HH TYR A 74 46.222 23.595 82.880 1.00 0.00 H ATOM 684 H TYR A 74 41.583 22.481 87.339 1.00 0.00 H ATOM 685 N PRO A 75 41.461 22.749 90.689 1.00 21.44 N ATOM 686 CA PRO A 75 41.148 23.047 92.099 1.00 22.57 C ATOM 687 C PRO A 75 41.606 21.954 93.039 1.00 22.42 C ATOM 688 O PRO A 75 41.520 20.764 92.742 1.00 22.26 O ATOM 689 CB PRO A 75 39.620 23.182 92.112 1.00 25.00 C ATOM 690 CG PRO A 75 39.309 23.689 90.737 1.00 24.19 C ATOM 691 CD PRO A 75 40.272 22.941 89.832 1.00 21.17 C ATOM 692 N ASP A 76 42.193 22.393 94.158 1.00 23.31 N ATOM 693 CA ASP A 76 42.586 21.507 95.250 1.00 25.76 C ATOM 694 C ASP A 76 43.660 20.504 94.878 1.00 25.38 C ATOM 695 O ASP A 76 43.720 19.414 95.467 1.00 25.73 O ATOM 696 CB ASP A 76 41.374 20.790 95.810 1.00 28.07 C ATOM 697 CG ASP A 76 40.329 21.761 96.262 1.00 32.64 C ATOM 698 OD1 ASP A 76 40.644 22.522 97.209 1.00 35.48 O ATOM 699 OD2 ASP A 76 39.245 21.790 95.668 1.00 33.14 O ATOM 700 H ASP A 76 42.378 23.412 94.255 1.00 0.00 H ATOM 701 N THR A 77 44.561 20.899 93.975 1.00 23.69 N ATOM 702 CA THR A 77 45.644 20.040 93.545 1.00 21.82 C ATOM 703 C THR A 77 46.730 20.069 94.599 1.00 21.97 C ATOM 704 O THR A 77 47.065 21.126 95.133 1.00 23.37 O ATOM 705 CB THR A 77 46.176 20.508 92.205 1.00 21.18 C ATOM 706 OG1 THR A 77 45.109 20.397 91.240 1.00 20.23 O ATOM 707 CG2 THR A 77 47.338 19.647 91.736 1.00 21.84 C ATOM 708 HG1 THR A 77 44.349 20.964 91.524 1.00 0.00 H ATOM 709 H THR A 77 44.482 21.853 93.568 1.00 0.00 H ATOM 710 N ASP A 78 47.279 18.895 94.882 1.00 19.74 N ATOM 711 CA ASP A 78 48.398 18.778 95.826 1.00 20.72 C ATOM 712 C ASP A 78 49.764 18.741 95.153 1.00 19.97 C ATOM 713 O ASP A 78 50.772 19.061 95.808 1.00 21.23 O ATOM 714 CB ASP A 78 48.216 17.526 96.670 1.00 22.52 C ATOM 715 CG ASP A 78 46.967 17.601 97.505 1.00 25.59 C ATOM 716 OD1 ASP A 78 46.881 18.575 98.283 1.00 28.32 O ATOM 717 OD2 ASP A 78 46.099 16.717 97.352 1.00 24.88 O ATOM 718 H ASP A 78 46.908 18.038 94.425 1.00 0.00 H ATOM 719 N VAL A 79 49.857 18.272 93.916 1.00 19.69 N ATOM 720 CA VAL A 79 51.107 18.215 93.151 1.00 19.12 C ATOM 721 C VAL A 79 50.777 18.223 91.663 1.00 18.56 C ATOM 722 O VAL A 79 49.780 17.641 91.223 1.00 17.14 O ATOM 723 CB VAL A 79 51.945 16.965 93.559 1.00 19.71 C ATOM 724 CG1 VAL A 79 51.190 15.667 93.328 1.00 20.20 C ATOM 725 CG2 VAL A 79 53.302 16.956 92.849 1.00 18.62 C ATOM 726 H VAL A 79 48.990 17.923 93.460 1.00 0.00 H ATOM 727 N ILE A 80 51.660 18.849 90.896 1.00 17.44 N ATOM 728 CA ILE A 80 51.573 18.973 89.455 1.00 17.44 C ATOM 729 C ILE A 80 52.687 18.173 88.839 1.00 16.86 C ATOM 730 O ILE A 80 53.844 18.315 89.263 1.00 16.69 O ATOM 731 CB ILE A 80 51.673 20.449 89.027 1.00 19.00 C ATOM 732 CG1 ILE A 80 50.390 21.216 89.371 1.00 22.09 C ATOM 733 CG2 ILE A 80 52.000 20.532 87.577 1.00 20.61 C ATOM 734 CD1 ILE A 80 49.256 20.995 88.372 1.00 21.70 C ATOM 735 H ILE A 80 52.479 19.285 91.366 1.00 0.00 H ATOM 736 N LEU A 81 52.368 17.283 87.914 1.00 16.55 N ATOM 737 CA LEU A 81 53.361 16.746 86.993 1.00 16.38 C ATOM 738 C LEU A 81 53.321 17.616 85.756 1.00 16.94 C ATOM 739 O LEU A 81 52.275 17.679 85.085 1.00 16.04 O ATOM 740 CB LEU A 81 53.077 15.309 86.587 1.00 17.58 C ATOM 741 CG LEU A 81 53.107 14.244 87.632 1.00 19.13 C ATOM 742 CD1 LEU A 81 52.905 12.892 86.924 1.00 18.93 C ATOM 743 CD2 LEU A 81 54.426 14.284 88.383 1.00 21.04 C ATOM 744 H LEU A 81 51.383 16.958 87.842 1.00 0.00 H ATOM 745 N MET A 82 54.391 18.233 85.400 1.00 15.55 N ATOM 746 CA MET A 82 54.468 19.116 84.244 1.00 15.02 C ATOM 747 C MET A 82 55.375 18.441 83.224 1.00 14.68 C ATOM 748 O MET A 82 56.570 18.251 83.476 1.00 15.04 O ATOM 749 CB MET A 82 54.934 20.485 84.671 1.00 15.29 C ATOM 750 CG MET A 82 55.011 21.464 83.554 1.00 16.66 C ATOM 751 SD MET A 82 55.533 23.101 84.016 1.00 17.67 S ATOM 752 CE MET A 82 54.152 23.635 85.056 1.00 19.33 C ATOM 753 H MET A 82 55.250 18.094 85.969 1.00 0.00 H ATOM 754 N CYS A 83 54.799 17.986 82.138 1.00 15.14 N ATOM 755 CA CYS A 83 55.467 17.064 81.249 1.00 14.50 C ATOM 756 C CYS A 83 55.813 17.724 79.913 1.00 14.42 C ATOM 757 O CYS A 83 55.137 18.640 79.430 1.00 15.37 O ATOM 758 CB CYS A 83 54.593 15.828 80.924 1.00 14.98 C ATOM 759 SG CYS A 83 54.287 14.726 82.263 1.00 16.85 S ATOM 760 H CYS A 83 53.833 18.298 81.910 1.00 0.00 H ATOM 761 N PHE A 84 56.928 17.265 79.341 1.00 13.70 N ATOM 762 CA PHE A 84 57.328 17.493 77.974 1.00 13.45 C ATOM 763 C PHE A 84 57.832 16.158 77.474 1.00 14.92 C ATOM 764 O PHE A 84 57.977 15.221 78.264 1.00 15.35 O ATOM 765 CB PHE A 84 58.371 18.613 77.838 1.00 15.57 C ATOM 766 CG PHE A 84 59.702 18.289 78.442 1.00 16.90 C ATOM 767 CD1 PHE A 84 59.917 18.479 79.783 1.00 17.26 C ATOM 768 CD2 PHE A 84 60.684 17.753 77.669 1.00 15.46 C ATOM 769 CE1 PHE A 84 61.178 18.190 80.383 1.00 18.02 C ATOM 770 CE2 PHE A 84 61.950 17.429 78.244 1.00 17.76 C ATOM 771 CZ PHE A 84 62.163 17.645 79.607 1.00 17.45 C ATOM 772 H PHE A 84 57.564 16.693 79.933 1.00 0.00 H ATOM 773 N SER A 85 58.134 16.040 76.181 1.00 15.39 N ATOM 774 CA SER A 85 58.675 14.780 75.718 1.00 16.25 C ATOM 775 C SER A 85 59.921 15.011 74.876 1.00 16.17 C ATOM 776 O SER A 85 60.090 16.041 74.225 1.00 15.78 O ATOM 777 CB SER A 85 57.601 13.925 75.001 1.00 17.67 C ATOM 778 OG SER A 85 57.048 14.611 73.899 1.00 17.82 O ATOM 779 HG SER A 85 57.765 14.824 73.251 1.00 0.00 H ATOM 780 H SER A 85 57.985 16.832 75.523 1.00 0.00 H ATOM 781 N VAL A 86 60.803 14.013 74.909 1.00 15.85 N ATOM 782 CA VAL A 86 62.112 14.232 74.323 1.00 16.93 C ATOM 783 C VAL A 86 62.080 14.234 72.811 1.00 17.71 C ATOM 784 O VAL A 86 63.067 14.671 72.175 1.00 19.43 O ATOM 785 CB VAL A 86 63.168 13.198 74.837 1.00 19.12 C ATOM 786 CG1 VAL A 86 63.192 13.169 76.339 1.00 19.84 C ATOM 787 CG2 VAL A 86 62.894 11.847 74.247 1.00 21.07 C ATOM 788 H VAL A 86 60.559 13.100 75.344 1.00 0.00 H ATOM 789 N ASP A 87 60.994 13.740 72.196 1.00 17.27 N ATOM 790 CA ASP A 87 60.796 13.812 70.765 1.00 19.83 C ATOM 791 C ASP A 87 60.294 15.175 70.333 1.00 19.69 C ATOM 792 O ASP A 87 60.157 15.385 69.125 1.00 20.42 O ATOM 793 CB ASP A 87 59.823 12.735 70.258 1.00 19.47 C ATOM 794 CG ASP A 87 58.502 12.732 70.995 1.00 18.68 C ATOM 795 OD1 ASP A 87 58.380 13.291 72.135 1.00 17.56 O ATOM 796 OD2 ASP A 87 57.551 12.064 70.411 1.00 18.52 O ATOM 797 H ASP A 87 60.261 13.284 72.776 1.00 0.00 H ATOM 798 N SER A 88 60.093 16.111 71.271 1.00 18.04 N ATOM 799 CA SER A 88 59.555 17.426 70.933 1.00 18.75 C ATOM 800 C SER A 88 60.287 18.555 71.642 1.00 18.68 C ATOM 801 O SER A 88 59.895 18.978 72.727 1.00 17.09 O ATOM 802 CB SER A 88 58.055 17.486 71.261 1.00 19.17 C ATOM 803 OG SER A 88 57.538 18.755 70.870 1.00 19.44 O ATOM 804 HG SER A 88 57.670 18.878 69.897 1.00 0.00 H ATOM 805 H SER A 88 60.325 15.896 72.262 1.00 0.00 H ATOM 806 N PRO A 89 61.287 19.128 71.006 1.00 20.43 N ATOM 807 CA PRO A 89 61.929 20.328 71.573 1.00 22.24 C ATOM 808 C PRO A 89 60.941 21.434 71.857 1.00 21.14 C ATOM 809 O PRO A 89 61.019 22.108 72.894 1.00 20.88 O ATOM 810 CB PRO A 89 62.969 20.696 70.498 1.00 25.83 C ATOM 811 CG PRO A 89 63.233 19.371 69.802 1.00 25.79 C ATOM 812 CD PRO A 89 61.985 18.585 69.822 1.00 24.58 C ATOM 813 N ASP A 90 59.901 21.556 71.024 1.00 19.45 N ATOM 814 CA ASP A 90 58.907 22.585 71.304 1.00 20.32 C ATOM 815 C ASP A 90 58.179 22.342 72.615 1.00 17.53 C ATOM 816 O ASP A 90 57.804 23.307 73.299 1.00 19.06 O ATOM 817 CB ASP A 90 57.855 22.674 70.173 1.00 23.31 C ATOM 818 CG ASP A 90 58.403 23.260 68.890 1.00 31.82 C ATOM 819 OD1 ASP A 90 59.549 23.751 68.867 1.00 35.50 O ATOM 820 OD2 ASP A 90 57.674 23.224 67.881 1.00 35.76 O ATOM 821 H ASP A 90 59.804 20.932 70.197 1.00 0.00 H ATOM 822 N SER A 91 57.972 21.074 73.000 1.00 15.95 N ATOM 823 CA SER A 91 57.258 20.769 74.225 1.00 16.51 C ATOM 824 C SER A 91 58.050 21.263 75.425 1.00 16.16 C ATOM 825 O SER A 91 57.456 21.634 76.433 1.00 16.51 O ATOM 826 CB SER A 91 56.889 19.290 74.338 1.00 17.55 C ATOM 827 OG SER A 91 58.020 18.479 74.647 1.00 16.32 O ATOM 828 HG SER A 91 58.699 18.575 73.933 1.00 0.00 H ATOM 829 H SER A 91 58.330 20.296 72.410 1.00 0.00 H ATOM 830 N LEU A 92 59.369 21.252 75.348 1.00 17.20 N ATOM 831 CA LEU A 92 60.164 21.849 76.434 1.00 18.10 C ATOM 832 C LEU A 92 60.070 23.373 76.421 1.00 18.73 C ATOM 833 O LEU A 92 59.946 24.002 77.481 1.00 19.52 O ATOM 834 CB LEU A 92 61.609 21.403 76.299 1.00 18.56 C ATOM 835 CG LEU A 92 62.575 21.957 77.358 1.00 19.07 C ATOM 836 CD1 LEU A 92 62.043 21.557 78.706 1.00 18.29 C ATOM 837 CD2 LEU A 92 64.034 21.492 77.128 1.00 20.05 C ATOM 838 H LEU A 92 59.842 20.825 74.526 1.00 0.00 H ATOM 839 N GLU A 93 60.146 23.983 75.245 1.00 18.89 N ATOM 840 CA GLU A 93 60.013 25.428 75.170 1.00 21.63 C ATOM 841 C GLU A 93 58.678 25.893 75.700 1.00 20.73 C ATOM 842 O GLU A 93 58.570 27.013 76.210 1.00 22.20 O ATOM 843 CB GLU A 93 60.194 25.946 73.734 1.00 27.35 C ATOM 844 CG GLU A 93 60.348 27.477 73.634 1.00 34.74 C ATOM 845 CD GLU A 93 61.297 28.105 74.676 1.00 40.30 C ATOM 846 OE1 GLU A 93 62.405 27.562 74.959 1.00 42.19 O ATOM 847 OE2 GLU A 93 60.896 29.165 75.222 1.00 42.09 O ATOM 848 H GLU A 93 60.300 23.428 74.379 1.00 0.00 H ATOM 849 N ASN A 94 57.644 25.074 75.561 1.00 18.90 N ATOM 850 CA ASN A 94 56.353 25.524 76.040 1.00 20.20 C ATOM 851 C ASN A 94 56.215 25.436 77.545 1.00 19.32 C ATOM 852 O ASN A 94 55.233 25.936 78.094 1.00 20.01 O ATOM 853 CB ASN A 94 55.262 24.720 75.337 1.00 20.09 C ATOM 854 CG ASN A 94 55.053 25.154 73.905 1.00 24.14 C ATOM 855 OD1 ASN A 94 55.176 26.329 73.570 1.00 26.52 O ATOM 856 ND2 ASN A 94 54.663 24.203 73.046 1.00 25.07 N ATOM 857 HD22 ASN A 94 54.570 23.218 73.367 1.00 0.00 H ATOM 858 HD21 ASN A 94 54.453 24.449 72.058 1.00 0.00 H ATOM 859 H ASN A 94 57.757 24.138 75.122 1.00 0.00 H ATOM 860 N ILE A 95 57.169 24.821 78.244 1.00 19.15 N ATOM 861 CA ILE A 95 57.106 24.730 79.696 1.00 17.47 C ATOM 862 C ILE A 95 57.070 26.155 80.256 1.00 18.70 C ATOM 863 O ILE A 95 56.117 26.508 80.981 1.00 19.11 O ATOM 864 CB ILE A 95 58.270 23.882 80.238 1.00 17.25 C ATOM 865 CG1 ILE A 95 58.063 22.403 79.897 1.00 16.73 C ATOM 866 CG2 ILE A 95 58.443 24.091 81.741 1.00 17.04 C ATOM 867 CD1 ILE A 95 56.890 21.736 80.577 1.00 16.30 C ATOM 868 H ILE A 95 57.975 24.397 77.742 1.00 0.00 H ATOM 869 N PRO A 96 58.037 27.018 79.990 1.00 19.17 N ATOM 870 CA PRO A 96 57.972 28.345 80.583 1.00 20.37 C ATOM 871 C PRO A 96 56.992 29.252 79.894 1.00 21.43 C ATOM 872 O PRO A 96 56.542 30.223 80.502 1.00 23.78 O ATOM 873 CB PRO A 96 59.425 28.865 80.455 1.00 21.79 C ATOM 874 CG PRO A 96 59.976 28.143 79.282 1.00 20.72 C ATOM 875 CD PRO A 96 59.347 26.770 79.319 1.00 18.90 C ATOM 876 N GLU A 97 56.666 28.993 78.620 1.00 21.45 N ATOM 877 CA GLU A 97 55.839 29.933 77.854 1.00 24.52 C ATOM 878 C GLU A 97 54.356 29.751 78.156 1.00 22.79 C ATOM 879 O GLU A 97 53.611 30.738 78.176 1.00 24.89 O ATOM 880 CB GLU A 97 56.093 29.741 76.369 1.00 29.60 C ATOM 881 CG GLU A 97 57.448 30.235 75.913 1.00 38.81 C ATOM 882 CD GLU A 97 57.722 31.693 76.300 1.00 48.21 C ATOM 883 OE1 GLU A 97 56.919 32.572 75.903 1.00 51.36 O ATOM 884 OE2 GLU A 97 58.750 31.935 77.009 1.00 51.00 O ATOM 885 H GLU A 97 57.002 28.118 78.170 1.00 0.00 H ATOM 886 N LYS A 98 53.928 28.512 78.361 1.00 21.04 N ATOM 887 CA LYS A 98 52.516 28.204 78.589 1.00 21.38 C ATOM 888 C LYS A 98 52.254 27.532 79.923 1.00 19.73 C ATOM 889 O LYS A 98 51.370 27.987 80.677 1.00 21.15 O ATOM 890 CB LYS A 98 52.002 27.282 77.467 1.00 21.33 C ATOM 891 CG LYS A 98 50.514 26.909 77.626 1.00 23.04 C ATOM 892 CD LYS A 98 49.934 26.223 76.385 1.00 25.10 C ATOM 893 CE LYS A 98 48.478 25.894 76.688 1.00 26.08 C ATOM 894 NZ LYS A 98 47.640 25.757 75.483 1.00 28.12 N ATOM 895 HZ1 LYS A 98 47.653 26.650 74.950 1.00 0.00 H ATOM 896 HZ2 LYS A 98 48.014 24.991 74.887 1.00 0.00 H ATOM 897 HZ3 LYS A 98 46.664 25.534 75.764 1.00 0.00 H ATOM 898 H LYS A 98 54.619 27.734 78.360 1.00 0.00 H ATOM 899 N TRP A 99 52.965 26.456 80.241 1.00 17.84 N ATOM 900 CA TRP A 99 52.552 25.596 81.342 1.00 17.25 C ATOM 901 C TRP A 99 52.823 26.253 82.678 1.00 18.65 C ATOM 902 O TRP A 99 51.962 26.223 83.568 1.00 19.61 O ATOM 903 CB TRP A 99 53.181 24.190 81.258 1.00 16.37 C ATOM 904 CG TRP A 99 52.713 23.575 79.956 1.00 16.22 C ATOM 905 CD1 TRP A 99 53.466 23.321 78.882 1.00 15.99 C ATOM 906 CD2 TRP A 99 51.353 23.307 79.583 1.00 17.41 C ATOM 907 NE1 TRP A 99 52.666 22.898 77.819 1.00 16.84 N ATOM 908 CE2 TRP A 99 51.374 22.866 78.257 1.00 17.17 C ATOM 909 CE3 TRP A 99 50.120 23.407 80.253 1.00 17.78 C ATOM 910 CZ2 TRP A 99 50.202 22.528 77.557 1.00 16.96 C ATOM 911 CZ3 TRP A 99 48.981 23.062 79.551 1.00 17.41 C ATOM 912 CH2 TRP A 99 49.040 22.614 78.244 1.00 17.33 C ATOM 913 HE1 TRP A 99 52.996 22.651 76.864 1.00 0.00 H ATOM 914 H TRP A 99 53.823 26.226 79.700 1.00 0.00 H ATOM 915 N VAL A 100 54.014 26.829 82.866 1.00 19.95 N ATOM 916 CA VAL A 100 54.326 27.469 84.127 1.00 21.04 C ATOM 917 C VAL A 100 53.351 28.609 84.430 1.00 20.92 C ATOM 918 O VAL A 100 52.798 28.642 85.529 1.00 21.54 O ATOM 919 CB VAL A 100 55.770 27.887 84.175 1.00 21.40 C ATOM 920 CG1 VAL A 100 56.026 28.850 85.329 1.00 23.98 C ATOM 921 CG2 VAL A 100 56.635 26.640 84.304 1.00 20.58 C ATOM 922 H VAL A 100 54.720 26.818 82.103 1.00 0.00 H ATOM 923 N PRO A 101 53.114 29.560 83.516 1.00 21.26 N ATOM 924 CA PRO A 101 52.190 30.639 83.855 1.00 23.14 C ATOM 925 C PRO A 101 50.795 30.140 84.188 1.00 22.05 C ATOM 926 O PRO A 101 50.157 30.703 85.086 1.00 22.59 O ATOM 927 CB PRO A 101 52.185 31.519 82.597 1.00 25.16 C ATOM 928 CG PRO A 101 53.408 31.163 81.832 1.00 24.69 C ATOM 929 CD PRO A 101 53.882 29.823 82.290 1.00 22.07 C ATOM 930 N GLU A 102 50.321 29.101 83.499 1.00 21.26 N ATOM 931 CA GLU A 102 48.971 28.604 83.757 1.00 21.86 C ATOM 932 C GLU A 102 48.880 27.943 85.124 1.00 21.84 C ATOM 933 O GLU A 102 47.950 28.217 85.899 1.00 21.48 O ATOM 934 CB GLU A 102 48.576 27.610 82.684 1.00 21.06 C ATOM 935 CG GLU A 102 47.175 27.061 82.896 1.00 21.62 C ATOM 936 CD GLU A 102 46.578 26.491 81.631 1.00 22.03 C ATOM 937 OE1 GLU A 102 46.431 27.209 80.654 1.00 25.25 O ATOM 938 OE2 GLU A 102 46.207 25.319 81.663 1.00 22.10 O ATOM 939 H GLU A 102 50.913 28.644 82.777 1.00 0.00 H ATOM 940 N VAL A 103 49.861 27.107 85.455 1.00 21.82 N ATOM 941 CA VAL A 103 49.796 26.403 86.742 1.00 22.56 C ATOM 942 C VAL A 103 50.069 27.370 87.894 1.00 22.72 C ATOM 943 O VAL A 103 49.453 27.253 88.967 1.00 22.33 O ATOM 944 CB VAL A 103 50.752 25.199 86.706 1.00 25.31 C ATOM 945 CG1 VAL A 103 50.967 24.606 88.098 1.00 31.02 C ATOM 946 CG2 VAL A 103 50.246 24.131 85.704 1.00 22.78 C ATOM 947 H VAL A 103 50.663 26.954 84.811 1.00 0.00 H ATOM 948 N LYS A 104 50.928 28.373 87.691 1.00 22.78 N ATOM 949 CA LYS A 104 51.104 29.374 88.731 1.00 26.95 C ATOM 950 C LYS A 104 49.808 30.115 89.022 1.00 26.73 C ATOM 951 O LYS A 104 49.519 30.466 90.172 1.00 29.68 O ATOM 952 CB LYS A 104 52.213 30.366 88.339 1.00 33.80 C ATOM 953 CG LYS A 104 53.610 29.748 88.243 1.00 40.99 C ATOM 954 CD LYS A 104 54.712 30.627 88.844 1.00 48.16 C ATOM 955 CE LYS A 104 55.482 31.412 87.810 1.00 49.80 C ATOM 956 NZ LYS A 104 56.947 31.465 87.996 1.00 48.91 N ATOM 957 HZ1 LYS A 104 57.163 31.905 88.913 1.00 0.00 H ATOM 958 HZ2 LYS A 104 57.333 30.500 87.973 1.00 0.00 H ATOM 959 HZ3 LYS A 104 57.372 32.028 87.232 1.00 0.00 H ATOM 960 H LYS A 104 51.463 28.437 86.802 1.00 0.00 H ATOM 961 N HIS A 105 49.023 30.392 87.979 1.00 23.24 N ATOM 962 CA HIS A 105 47.782 31.130 88.141 1.00 24.10 C ATOM 963 C HIS A 105 46.750 30.307 88.907 1.00 24.40 C ATOM 964 O HIS A 105 46.128 30.805 89.850 1.00 26.57 O ATOM 965 CB HIS A 105 47.219 31.531 86.769 1.00 26.08 C ATOM 966 CG HIS A 105 45.915 32.243 86.850 1.00 32.13 C ATOM 967 ND1 HIS A 105 45.777 33.483 87.439 1.00 35.64 N ATOM 968 CD2 HIS A 105 44.676 31.866 86.465 1.00 33.55 C ATOM 969 CE1 HIS A 105 44.506 33.850 87.387 1.00 37.56 C ATOM 970 NE2 HIS A 105 43.817 32.877 86.815 1.00 35.20 N ATOM 971 H HIS A 105 49.305 30.073 87.030 1.00 0.00 H ATOM 972 N PHE A 106 46.557 29.058 88.504 1.00 23.47 N ATOM 973 CA PHE A 106 45.456 28.264 89.017 1.00 24.74 C ATOM 974 C PHE A 106 45.844 27.393 90.195 1.00 26.08 C ATOM 975 O PHE A 106 44.948 26.957 90.938 1.00 27.36 O ATOM 976 CB PHE A 106 44.899 27.354 87.935 1.00 22.28 C ATOM 977 CG PHE A 106 44.131 28.067 86.902 1.00 22.80 C ATOM 978 CD1 PHE A 106 42.928 28.647 87.226 1.00 24.11 C ATOM 979 CD2 PHE A 106 44.586 28.132 85.613 1.00 22.07 C ATOM 980 CE1 PHE A 106 42.175 29.278 86.262 1.00 25.28 C ATOM 981 CE2 PHE A 106 43.852 28.785 84.652 1.00 22.63 C ATOM 982 CZ PHE A 106 42.651 29.345 84.970 1.00 24.84 C ATOM 983 H PHE A 106 47.207 28.640 87.808 1.00 0.00 H ATOM 984 N CYS A 107 47.145 27.170 90.385 1.00 24.10 N ATOM 985 CA CYS A 107 47.676 26.281 91.428 1.00 25.35 C ATOM 986 C CYS A 107 48.829 26.972 92.128 1.00 25.92 C ATOM 987 O CYS A 107 49.939 26.418 92.230 1.00 24.83 O ATOM 988 CB CYS A 107 48.155 24.949 90.868 1.00 24.15 C ATOM 989 SG CYS A 107 46.898 24.088 89.933 1.00 23.47 S ATOM 990 H CYS A 107 47.822 27.652 89.760 1.00 0.00 H ATOM 991 N PRO A 108 48.609 28.178 92.637 1.00 27.65 N ATOM 992 CA PRO A 108 49.685 28.860 93.344 1.00 30.59 C ATOM 993 C PRO A 108 50.218 27.994 94.481 1.00 32.20 C ATOM 994 O PRO A 108 49.465 27.335 95.206 1.00 33.45 O ATOM 995 CB PRO A 108 49.024 30.150 93.856 1.00 32.96 C ATOM 996 CG PRO A 108 47.529 29.839 93.875 1.00 32.63 C ATOM 997 CD PRO A 108 47.303 28.876 92.747 1.00 29.44 C ATOM 998 N ASN A 109 51.535 27.956 94.581 1.00 32.92 N ATOM 999 CA ASN A 109 52.250 27.292 95.667 1.00 35.53 C ATOM 1000 C ASN A 109 52.148 25.771 95.646 1.00 32.11 C ATOM 1001 O ASN A 109 52.564 25.123 96.609 1.00 34.03 O ATOM 1002 CB ASN A 109 51.763 27.791 97.023 1.00 40.29 C ATOM 1003 CG ASN A 109 51.949 29.281 97.189 1.00 44.40 C ATOM 1004 OD1 ASN A 109 53.017 29.813 96.905 1.00 42.86 O ATOM 1005 ND2 ASN A 109 50.897 29.963 97.619 1.00 48.85 N ATOM 1006 HD22 ASN A 109 50.013 29.466 97.847 1.00 0.00 H ATOM 1007 HD21 ASN A 109 50.956 30.996 97.728 1.00 0.00 H ATOM 1008 H ASN A 109 52.095 28.427 93.842 1.00 0.00 H ATOM 1009 N VAL A 110 51.622 25.183 94.583 1.00 26.20 N ATOM 1010 CA VAL A 110 51.572 23.735 94.447 1.00 23.43 C ATOM 1011 C VAL A 110 52.886 23.261 93.843 1.00 22.62 C ATOM 1012 O VAL A 110 53.314 23.805 92.821 1.00 23.25 O ATOM 1013 CB VAL A 110 50.391 23.340 93.559 1.00 23.13 C ATOM 1014 CG1 VAL A 110 50.401 21.865 93.258 1.00 21.39 C ATOM 1015 CG2 VAL A 110 49.079 23.766 94.227 1.00 25.33 C ATOM 1016 H VAL A 110 51.232 25.774 93.821 1.00 0.00 H ATOM 1017 N PRO A 111 53.593 22.296 94.445 1.00 21.90 N ATOM 1018 CA PRO A 111 54.870 21.867 93.870 1.00 21.25 C ATOM 1019 C PRO A 111 54.708 21.281 92.480 1.00 19.59 C ATOM 1020 O PRO A 111 53.718 20.616 92.172 1.00 19.07 O ATOM 1021 CB PRO A 111 55.396 20.814 94.867 1.00 23.62 C ATOM 1022 CG PRO A 111 54.193 20.410 95.710 1.00 25.78 C ATOM 1023 CD PRO A 111 53.181 21.527 95.630 1.00 24.26 C ATOM 1024 N ILE A 112 55.714 21.514 91.632 1.00 17.99 N ATOM 1025 CA ILE A 112 55.724 21.069 90.236 1.00 17.99 C ATOM 1026 C ILE A 112 56.875 20.091 90.069 1.00 16.78 C ATOM 1027 O ILE A 112 58.002 20.411 90.469 1.00 16.58 O ATOM 1028 CB ILE A 112 55.931 22.264 89.296 1.00 20.50 C ATOM 1029 CG1 ILE A 112 54.745 23.214 89.386 1.00 22.54 C ATOM 1030 CG2 ILE A 112 56.181 21.795 87.853 1.00 20.05 C ATOM 1031 CD1 ILE A 112 54.994 24.573 88.810 1.00 24.59 C ATOM 1032 H ILE A 112 56.538 22.042 91.983 1.00 0.00 H ATOM 1033 N ILE A 113 56.611 18.886 89.599 1.00 16.18 N ATOM 1034 CA ILE A 113 57.646 17.967 89.162 1.00 15.64 C ATOM 1035 C ILE A 113 57.769 18.149 87.660 1.00 15.77 C ATOM 1036 O ILE A 113 56.785 17.944 86.948 1.00 14.92 O ATOM 1037 CB ILE A 113 57.327 16.486 89.478 1.00 18.20 C ATOM 1038 CG1 ILE A 113 56.775 16.254 90.878 1.00 21.65 C ATOM 1039 CG2 ILE A 113 58.455 15.574 89.134 1.00 19.43 C ATOM 1040 CD1 ILE A 113 57.578 16.763 91.906 1.00 23.64 C ATOM 1041 H ILE A 113 55.618 18.582 89.539 1.00 0.00 H ATOM 1042 N LEU A 114 58.924 18.536 87.146 1.00 15.79 N ATOM 1043 CA LEU A 114 59.168 18.625 85.713 1.00 14.70 C ATOM 1044 C LEU A 114 59.632 17.260 85.228 1.00 14.81 C ATOM 1045 O LEU A 114 60.572 16.677 85.773 1.00 15.53 O ATOM 1046 CB LEU A 114 60.169 19.730 85.401 1.00 16.39 C ATOM 1047 CG LEU A 114 60.394 19.918 83.909 1.00 16.98 C ATOM 1048 CD1 LEU A 114 59.163 20.468 83.158 1.00 17.38 C ATOM 1049 CD2 LEU A 114 61.658 20.817 83.653 1.00 19.13 C ATOM 1050 H LEU A 114 59.695 18.789 87.796 1.00 0.00 H ATOM 1051 N VAL A 115 58.921 16.695 84.267 1.00 14.13 N ATOM 1052 CA VAL A 115 59.097 15.315 83.839 1.00 15.04 C ATOM 1053 C VAL A 115 59.374 15.301 82.339 1.00 15.76 C ATOM 1054 O VAL A 115 58.529 15.774 81.526 1.00 14.53 O ATOM 1055 CB VAL A 115 57.827 14.488 84.148 1.00 16.18 C ATOM 1056 CG1 VAL A 115 58.012 13.064 83.648 1.00 17.09 C ATOM 1057 CG2 VAL A 115 57.649 14.449 85.687 1.00 17.87 C ATOM 1058 H VAL A 115 58.196 17.268 83.791 1.00 0.00 H ATOM 1059 N ALA A 116 60.454 14.658 81.936 1.00 15.14 N ATOM 1060 CA ALA A 116 60.728 14.344 80.540 1.00 15.16 C ATOM 1061 C ALA A 116 60.158 12.973 80.234 1.00 14.61 C ATOM 1062 O ALA A 116 60.547 11.965 80.845 1.00 16.00 O ATOM 1063 CB ALA A 116 62.228 14.335 80.272 1.00 15.90 C ATOM 1064 H ALA A 116 61.146 14.360 82.653 1.00 0.00 H ATOM 1065 N ASN A 117 59.202 12.911 79.315 1.00 14.33 N ATOM 1066 CA ASN A 117 58.613 11.652 78.873 1.00 14.35 C ATOM 1067 C ASN A 117 59.290 11.108 77.626 1.00 14.54 C ATOM 1068 O ASN A 117 59.999 11.808 76.894 1.00 14.55 O ATOM 1069 CB ASN A 117 57.101 11.812 78.537 1.00 15.06 C ATOM 1070 CG ASN A 117 56.243 12.084 79.744 1.00 17.03 C ATOM 1071 OD1 ASN A 117 56.616 11.750 80.873 1.00 18.74 O ATOM 1072 ND2 ASN A 117 55.032 12.613 79.506 1.00 16.26 N ATOM 1073 HD22 ASN A 117 54.762 12.879 78.538 1.00 0.00 H ATOM 1074 HD21 ASN A 117 54.364 12.756 80.290 1.00 0.00 H ATOM 1075 H ASN A 117 58.859 13.797 78.893 1.00 0.00 H ATOM 1076 N LYS A 118 59.016 9.828 77.372 1.00 15.55 N ATOM 1077 CA LYS A 118 59.432 9.123 76.171 1.00 17.07 C ATOM 1078 C LYS A 118 60.950 9.028 76.067 1.00 17.48 C ATOM 1079 O LYS A 118 61.496 9.086 74.967 1.00 17.99 O ATOM 1080 CB LYS A 118 58.879 9.767 74.901 1.00 18.35 C ATOM 1081 CG LYS A 118 57.408 10.102 74.868 1.00 17.62 C ATOM 1082 CD LYS A 118 56.916 10.392 73.422 1.00 18.42 C ATOM 1083 CE LYS A 118 55.672 11.191 73.470 1.00 19.32 C ATOM 1084 NZ LYS A 118 55.225 11.385 72.045 1.00 18.30 N ATOM 1085 HZ1 LYS A 118 55.967 11.886 71.516 1.00 0.00 H ATOM 1086 HZ2 LYS A 118 55.052 10.457 71.608 1.00 0.00 H ATOM 1087 HZ3 LYS A 118 54.349 11.945 72.031 1.00 0.00 H ATOM 1088 H LYS A 118 58.468 9.299 78.080 1.00 0.00 H ATOM 1089 N LYS A 119 61.643 8.831 77.195 1.00 15.97 N ATOM 1090 CA LYS A 119 63.092 8.927 77.126 1.00 18.44 C ATOM 1091 C LYS A 119 63.707 7.833 76.254 1.00 19.78 C ATOM 1092 O LYS A 119 64.852 8.001 75.775 1.00 21.52 O ATOM 1093 CB LYS A 119 63.666 8.936 78.539 1.00 21.78 C ATOM 1094 CG LYS A 119 63.711 7.661 79.283 1.00 22.91 C ATOM 1095 CD LYS A 119 64.384 7.901 80.683 1.00 24.78 C ATOM 1096 CE LYS A 119 65.867 8.139 80.538 1.00 28.27 C ATOM 1097 NZ LYS A 119 66.612 7.803 81.797 1.00 32.28 N ATOM 1098 HZ1 LYS A 119 66.260 8.396 82.575 1.00 0.00 H ATOM 1099 HZ2 LYS A 119 66.463 6.800 82.029 1.00 0.00 H ATOM 1100 HZ3 LYS A 119 67.627 7.980 81.656 1.00 0.00 H ATOM 1101 H LYS A 119 61.161 8.616 78.091 1.00 0.00 H ATOM 1102 N ASP A 120 62.974 6.745 75.994 1.00 19.47 N ATOM 1103 CA ASP A 120 63.420 5.697 75.098 1.00 20.67 C ATOM 1104 C ASP A 120 63.681 6.221 73.696 1.00 21.29 C ATOM 1105 O ASP A 120 64.429 5.598 72.928 1.00 22.42 O ATOM 1106 CB ASP A 120 62.352 4.573 75.052 1.00 20.82 C ATOM 1107 CG ASP A 120 60.998 5.062 74.598 1.00 19.66 C ATOM 1108 OD1 ASP A 120 60.352 5.791 75.394 1.00 19.04 O ATOM 1109 OD2 ASP A 120 60.642 4.747 73.440 1.00 20.28 O ATOM 1110 H ASP A 120 62.046 6.647 76.454 1.00 0.00 H ATOM 1111 N LEU A 121 63.047 7.323 73.331 1.00 19.66 N ATOM 1112 CA LEU A 121 63.178 7.779 71.963 1.00 20.25 C ATOM 1113 C LEU A 121 64.506 8.470 71.709 1.00 21.58 C ATOM 1114 O LEU A 121 64.808 8.776 70.560 1.00 22.21 O ATOM 1115 CB LEU A 121 62.013 8.703 71.625 1.00 20.34 C ATOM 1116 CG LEU A 121 60.657 8.011 71.571 1.00 19.55 C ATOM 1117 CD1 LEU A 121 59.574 9.015 71.133 1.00 20.30 C ATOM 1118 CD2 LEU A 121 60.704 6.815 70.585 1.00 19.84 C ATOM 1119 H LEU A 121 62.466 7.851 74.013 1.00 0.00 H ATOM 1120 N ARG A 122 65.309 8.742 72.761 1.00 19.36 N ATOM 1121 CA ARG A 122 66.647 9.273 72.510 1.00 21.80 C ATOM 1122 C ARG A 122 67.441 8.334 71.657 1.00 24.57 C ATOM 1123 O ARG A 122 68.364 8.765 70.957 1.00 28.64 O ATOM 1124 CB ARG A 122 67.359 9.573 73.828 1.00 21.76 C ATOM 1125 CG ARG A 122 66.830 10.792 74.492 1.00 21.08 C ATOM 1126 CD ARG A 122 67.554 11.076 75.765 1.00 22.63 C ATOM 1127 NE ARG A 122 67.065 12.304 76.377 1.00 20.98 N ATOM 1128 CZ ARG A 122 66.870 12.444 77.696 1.00 19.50 C ATOM 1129 NH1 ARG A 122 67.096 11.427 78.521 1.00 21.10 N ATOM 1130 NH2 ARG A 122 66.442 13.591 78.157 1.00 18.63 N ATOM 1131 HE ARG A 122 66.856 13.114 75.759 1.00 0.00 H ATOM 1132 HH12 ARG A 122 66.943 11.543 79.543 1.00 0.00 H ATOM 1133 HH11 ARG A 122 67.426 10.516 78.145 1.00 0.00 H ATOM 1134 HH22 ARG A 122 66.286 13.716 79.178 1.00 0.00 H ATOM 1135 HH21 ARG A 122 66.258 14.378 77.503 1.00 0.00 H ATOM 1136 H ARG A 122 64.980 8.576 73.734 1.00 0.00 H ATOM 1137 N SER A 123 67.198 7.026 71.764 1.00 24.66 N ATOM 1138 CA SER A 123 67.948 6.032 71.002 1.00 28.85 C ATOM 1139 C SER A 123 67.168 5.486 69.814 1.00 28.43 C ATOM 1140 O SER A 123 67.603 4.508 69.183 1.00 31.45 O ATOM 1141 CB SER A 123 68.386 4.887 71.925 1.00 32.82 C ATOM 1142 OG SER A 123 67.263 4.156 72.385 1.00 32.94 O ATOM 1143 HG SER A 123 66.661 4.760 72.888 1.00 0.00 H ATOM 1144 H SER A 123 66.450 6.704 72.411 1.00 0.00 H ATOM 1145 N ASP A 124 66.050 6.109 69.457 1.00 24.79 N ATOM 1146 CA ASP A 124 65.279 5.609 68.341 1.00 25.81 C ATOM 1147 C ASP A 124 65.813 6.208 67.050 1.00 25.70 C ATOM 1148 O ASP A 124 65.774 7.422 66.880 1.00 25.05 O ATOM 1149 CB ASP A 124 63.813 5.970 68.533 1.00 26.10 C ATOM 1150 CG ASP A 124 62.928 5.444 67.429 1.00 31.90 C ATOM 1151 OD1 ASP A 124 62.841 6.092 66.371 1.00 31.19 O ATOM 1152 OD2 ASP A 124 62.334 4.379 67.662 1.00 36.71 O ATOM 1153 H ASP A 124 65.732 6.951 69.977 1.00 0.00 H ATOM 1154 N GLU A 125 66.284 5.346 66.142 1.00 27.68 N ATOM 1155 CA GLU A 125 66.936 5.832 64.936 1.00 31.39 C ATOM 1156 C GLU A 125 65.983 6.637 64.066 1.00 28.59 C ATOM 1157 O GLU A 125 66.398 7.570 63.377 1.00 29.55 O ATOM 1158 CB GLU A 125 67.496 4.676 64.111 1.00 43.12 C ATOM 1159 CG GLU A 125 68.635 5.124 63.150 1.00 59.62 C ATOM 1160 CD GLU A 125 69.400 6.391 63.622 1.00 72.61 C ATOM 1161 OE1 GLU A 125 69.996 6.388 64.744 1.00 76.83 O ATOM 1162 OE2 GLU A 125 69.378 7.394 62.864 1.00 77.73 O ATOM 1163 H GLU A 125 66.183 4.323 66.299 1.00 0.00 H ATOM 1164 N HIS A 126 64.716 6.221 63.987 1.00 28.09 N ATOM 1165 CA HIS A 126 63.746 6.944 63.167 1.00 27.75 C ATOM 1166 C HIS A 126 63.492 8.340 63.725 1.00 25.69 C ATOM 1167 O HIS A 126 63.503 9.325 62.982 1.00 24.83 O ATOM 1168 CB HIS A 126 62.449 6.130 63.092 1.00 26.91 C ATOM 1169 CG HIS A 126 61.336 6.779 62.307 1.00 26.93 C ATOM 1170 ND1 HIS A 126 61.498 7.298 61.041 1.00 28.48 N ATOM 1171 CD2 HIS A 126 60.015 6.946 62.609 1.00 26.13 C ATOM 1172 CE1 HIS A 126 60.328 7.771 60.609 1.00 28.20 C ATOM 1173 NE2 HIS A 126 59.422 7.563 61.537 1.00 26.93 N ATOM 1174 H HIS A 126 64.417 5.375 64.514 1.00 0.00 H ATOM 1175 N VAL A 127 63.313 8.453 65.046 1.00 23.47 N ATOM 1176 CA VAL A 127 63.189 9.774 65.649 1.00 23.30 C ATOM 1177 C VAL A 127 64.398 10.636 65.357 1.00 24.87 C ATOM 1178 O VAL A 127 64.282 11.822 65.003 1.00 24.42 O ATOM 1179 CB VAL A 127 62.971 9.652 67.162 1.00 22.48 C ATOM 1180 CG1 VAL A 127 63.044 11.025 67.796 1.00 22.78 C ATOM 1181 CG2 VAL A 127 61.582 9.032 67.379 1.00 22.13 C ATOM 1182 H VAL A 127 63.263 7.601 65.641 1.00 0.00 H ATOM 1183 N ARG A 128 65.590 10.083 65.632 1.00 24.93 N ATOM 1184 CA ARG A 128 66.813 10.843 65.444 1.00 27.73 C ATOM 1185 C ARG A 128 66.945 11.262 63.988 1.00 27.55 C ATOM 1186 O ARG A 128 67.314 12.401 63.698 1.00 28.90 O ATOM 1187 CB ARG A 128 68.031 10.038 65.894 1.00 29.75 C ATOM 1188 CG ARG A 128 68.026 9.701 67.360 1.00 29.33 C ATOM 1189 CD ARG A 128 69.294 8.897 67.697 1.00 36.61 C ATOM 1190 NE ARG A 128 70.523 9.671 67.817 1.00 45.46 N ATOM 1191 CZ ARG A 128 71.633 9.488 67.096 1.00 54.53 C ATOM 1192 NH1 ARG A 128 71.672 8.598 66.104 1.00 60.98 N ATOM 1193 NH2 ARG A 128 72.708 10.229 67.344 1.00 55.74 N ATOM 1194 HE ARG A 128 70.537 10.432 68.526 1.00 0.00 H ATOM 1195 HH12 ARG A 128 72.545 8.470 65.554 1.00 0.00 H ATOM 1196 HH11 ARG A 128 70.829 8.032 65.880 1.00 0.00 H ATOM 1197 HH22 ARG A 128 73.575 10.091 66.786 1.00 0.00 H ATOM 1198 HH21 ARG A 128 72.683 10.947 68.096 1.00 0.00 H ATOM 1199 H ARG A 128 65.638 9.105 65.982 1.00 0.00 H ATOM 1200 N THR A 129 66.641 10.346 63.044 1.00 27.55 N ATOM 1201 CA THR A 129 66.838 10.642 61.639 1.00 30.05 C ATOM 1202 C THR A 129 65.889 11.733 61.182 1.00 28.47 C ATOM 1203 O THR A 129 66.282 12.639 60.431 1.00 31.21 O ATOM 1204 CB THR A 129 66.644 9.380 60.781 1.00 31.77 C ATOM 1205 OG1 THR A 129 67.710 8.453 61.030 1.00 32.86 O ATOM 1206 CG2 THR A 129 66.562 9.729 59.290 1.00 33.68 C ATOM 1207 HG1 THR A 129 67.710 8.201 61.987 1.00 0.00 H ATOM 1208 H THR A 129 66.262 9.420 63.327 1.00 0.00 H ATOM 1209 N GLU A 130 64.629 11.675 61.649 1.00 27.50 N ATOM 1210 CA GLU A 130 63.690 12.640 61.112 1.00 26.27 C ATOM 1211 C GLU A 130 63.846 13.996 61.800 1.00 26.00 C ATOM 1212 O GLU A 130 63.782 15.043 61.144 1.00 26.92 O ATOM 1213 CB GLU A 130 62.237 12.139 61.225 1.00 24.78 C ATOM 1214 CG GLU A 130 61.882 10.935 60.337 1.00 26.25 C ATOM 1215 CD GLU A 130 62.294 11.118 58.945 1.00 29.70 C ATOM 1216 OE1 GLU A 130 62.103 12.237 58.382 1.00 28.95 O ATOM 1217 OE2 GLU A 130 62.860 10.143 58.365 1.00 34.11 O ATOM 1218 H GLU A 130 64.343 10.972 62.360 1.00 0.00 H ATOM 1219 N LEU A 131 64.081 14.016 63.105 1.00 25.57 N ATOM 1220 CA LEU A 131 64.367 15.294 63.725 1.00 26.40 C ATOM 1221 C LEU A 131 65.616 15.936 63.136 1.00 27.03 C ATOM 1222 O LEU A 131 65.640 17.156 62.941 1.00 27.83 O ATOM 1223 CB LEU A 131 64.524 15.088 65.234 1.00 24.93 C ATOM 1224 CG LEU A 131 63.283 14.826 66.110 1.00 22.96 C ATOM 1225 CD1 LEU A 131 63.678 14.726 67.611 1.00 23.08 C ATOM 1226 CD2 LEU A 131 62.280 15.946 65.866 1.00 24.33 C ATOM 1227 H LEU A 131 64.061 13.141 63.666 1.00 0.00 H ATOM 1228 N ALA A 132 66.667 15.127 62.860 1.00 28.27 N ATOM 1229 CA ALA A 132 67.872 15.644 62.220 1.00 30.52 C ATOM 1230 C ALA A 132 67.584 16.200 60.846 1.00 32.39 C ATOM 1231 O ALA A 132 68.197 17.193 60.427 1.00 34.97 O ATOM 1232 CB ALA A 132 68.942 14.545 62.084 1.00 31.81 C ATOM 1233 H ALA A 132 66.614 14.119 63.109 1.00 0.00 H ATOM 1234 N ARG A 133 66.630 15.585 60.139 1.00 32.63 N ATOM 1235 CA ARG A 133 66.288 16.106 58.829 1.00 35.56 C ATOM 1236 C ARG A 133 65.744 17.515 58.944 1.00 35.60 C ATOM 1237 O ARG A 133 65.885 18.314 58.008 1.00 36.82 O ATOM 1238 CB ARG A 133 65.268 15.177 58.159 1.00 34.52 C ATOM 1239 CG ARG A 133 65.309 15.175 56.647 1.00 37.30 C ATOM 1240 CD ARG A 133 64.179 14.339 56.104 1.00 36.76 C ATOM 1241 NE ARG A 133 64.150 12.937 56.545 1.00 35.29 N ATOM 1242 CZ ARG A 133 64.919 11.980 56.008 1.00 37.97 C ATOM 1243 NH1 ARG A 133 65.816 12.288 55.071 1.00 39.20 N ATOM 1244 NH2 ARG A 133 64.776 10.721 56.395 1.00 37.79 N ATOM 1245 HE ARG A 133 63.500 12.675 57.313 1.00 0.00 H ATOM 1246 HH12 ARG A 133 66.411 11.543 54.656 1.00 0.00 H ATOM 1247 HH11 ARG A 133 65.920 13.273 54.755 1.00 0.00 H ATOM 1248 HH22 ARG A 133 65.373 9.978 55.978 1.00 0.00 H ATOM 1249 HH21 ARG A 133 64.067 10.476 57.115 1.00 0.00 H ATOM 1250 H ARG A 133 66.143 14.749 60.521 1.00 0.00 H ATOM 1251 N MET A 134 65.165 17.844 60.100 1.00 33.32 N ATOM 1252 CA MET A 134 64.610 19.159 60.378 1.00 33.07 C ATOM 1253 C MET A 134 65.504 19.957 61.293 1.00 31.69 C ATOM 1254 O MET A 134 65.036 20.898 61.941 1.00 31.06 O ATOM 1255 CB MET A 134 63.195 19.060 60.963 1.00 33.54 C ATOM 1256 CG MET A 134 62.369 18.343 59.983 1.00 34.05 C ATOM 1257 SD MET A 134 60.618 18.189 60.328 1.00 32.92 S ATOM 1258 CE MET A 134 60.585 16.881 61.423 1.00 31.40 C ATOM 1259 H MET A 134 65.107 17.120 60.844 1.00 0.00 H ATOM 1260 N LYS A 135 66.808 19.564 61.383 1.00 32.69 N ATOM 1261 CA LYS A 135 67.840 20.277 62.166 1.00 36.64 C ATOM 1262 C LYS A 135 67.521 20.324 63.667 1.00 33.44 C ATOM 1263 O LYS A 135 67.875 21.264 64.397 1.00 34.49 O ATOM 1264 CB LYS A 135 68.092 21.689 61.606 1.00 47.00 C ATOM 1265 CG LYS A 135 68.597 21.757 60.152 1.00 60.90 C ATOM 1266 CD LYS A 135 68.954 23.193 59.681 1.00 76.47 C ATOM 1267 CE LYS A 135 69.433 23.218 58.213 1.00 92.12 C ATOM 1268 NZ LYS A 135 69.786 24.581 57.704 1.00103.74 N ATOM 1269 HZ1 LYS A 135 68.951 25.199 57.763 1.00 0.00 H ATOM 1270 HZ2 LYS A 135 70.554 24.978 58.282 1.00 0.00 H ATOM 1271 HZ3 LYS A 135 70.097 24.510 56.714 1.00 0.00 H ATOM 1272 H LYS A 135 67.094 18.707 60.867 1.00 0.00 H ATOM 1273 N GLN A 136 66.903 19.258 64.170 1.00 28.99 N ATOM 1274 CA GLN A 136 66.602 19.112 65.577 1.00 27.43 C ATOM 1275 C GLN A 136 67.171 17.795 66.089 1.00 24.48 C ATOM 1276 O GLN A 136 67.724 16.979 65.338 1.00 27.53 O ATOM 1277 CB GLN A 136 65.078 19.147 65.822 1.00 27.56 C ATOM 1278 CG GLN A 136 64.483 20.511 65.508 1.00 32.41 C ATOM 1279 CD GLN A 136 62.980 20.462 65.523 1.00 36.74 C ATOM 1280 OE1 GLN A 136 62.384 19.803 64.689 1.00 41.16 O ATOM 1281 NE2 GLN A 136 62.375 21.113 66.492 1.00 36.67 N ATOM 1282 HE22 GLN A 136 62.933 21.661 67.178 1.00 0.00 H ATOM 1283 HE21 GLN A 136 61.339 21.080 66.573 1.00 0.00 H ATOM 1284 H GLN A 136 66.624 18.495 63.521 1.00 0.00 H ATOM 1285 N GLU A 137 67.017 17.593 67.382 1.00 24.22 N ATOM 1286 CA GLU A 137 67.442 16.352 68.000 1.00 23.77 C ATOM 1287 C GLU A 137 66.640 16.119 69.252 1.00 21.32 C ATOM 1288 O GLU A 137 66.050 17.052 69.813 1.00 21.56 O ATOM 1289 CB GLU A 137 68.952 16.373 68.348 1.00 25.19 C ATOM 1290 CG GLU A 137 69.317 17.382 69.448 1.00 27.14 C ATOM 1291 CD GLU A 137 70.824 17.390 69.814 1.00 29.06 C ATOM 1292 OE1 GLU A 137 71.586 16.664 69.196 1.00 30.46 O ATOM 1293 OE2 GLU A 137 71.197 18.149 70.739 1.00 30.15 O ATOM 1294 H GLU A 137 66.584 18.335 67.968 1.00 0.00 H ATOM 1295 N PRO A 138 66.641 14.903 69.764 1.00 20.28 N ATOM 1296 CA PRO A 138 65.949 14.650 71.024 1.00 20.05 C ATOM 1297 C PRO A 138 66.454 15.539 72.159 1.00 19.85 C ATOM 1298 O PRO A 138 67.642 15.892 72.234 1.00 21.43 O ATOM 1299 CB PRO A 138 66.224 13.174 71.281 1.00 22.31 C ATOM 1300 CG PRO A 138 66.459 12.615 69.906 1.00 23.08 C ATOM 1301 CD PRO A 138 67.145 13.691 69.118 1.00 22.37 C ATOM 1302 N VAL A 139 65.510 15.938 73.015 1.00 19.48 N ATOM 1303 CA VAL A 139 65.844 16.816 74.121 1.00 20.50 C ATOM 1304 C VAL A 139 66.838 16.129 75.053 1.00 19.68 C ATOM 1305 O VAL A 139 66.590 15.020 75.537 1.00 20.16 O ATOM 1306 CB VAL A 139 64.566 17.193 74.886 1.00 19.33 C ATOM 1307 CG1 VAL A 139 64.937 18.082 76.044 1.00 20.31 C ATOM 1308 CG2 VAL A 139 63.502 17.834 73.977 1.00 20.23 C ATOM 1309 H VAL A 139 64.529 15.617 72.888 1.00 0.00 H ATOM 1310 N ARG A 140 67.906 16.832 75.424 1.00 20.17 N ATOM 1311 CA ARG A 140 68.943 16.257 76.274 1.00 19.42 C ATOM 1312 C ARG A 140 68.662 16.531 77.742 1.00 19.55 C ATOM 1313 O ARG A 140 68.034 17.520 78.100 1.00 20.69 O ATOM 1314 CB ARG A 140 70.303 16.825 75.876 1.00 21.38 C ATOM 1315 CG ARG A 140 70.785 16.377 74.508 1.00 22.10 C ATOM 1316 CD ARG A 140 72.098 17.088 74.118 1.00 24.87 C ATOM 1317 NE ARG A 140 72.450 16.622 72.773 1.00 25.26 N ATOM 1318 CZ ARG A 140 73.026 15.446 72.518 1.00 26.49 C ATOM 1319 NH1 ARG A 140 73.392 14.623 73.509 1.00 27.24 N ATOM 1320 NH2 ARG A 140 73.284 15.092 71.267 1.00 27.86 N ATOM 1321 HE ARG A 140 72.238 17.246 71.969 1.00 0.00 H ATOM 1322 HH12 ARG A 140 73.840 13.711 73.289 1.00 0.00 H ATOM 1323 HH11 ARG A 140 73.229 14.896 74.499 1.00 0.00 H ATOM 1324 HH22 ARG A 140 73.733 14.175 71.068 1.00 0.00 H ATOM 1325 HH21 ARG A 140 73.037 15.731 70.484 1.00 0.00 H ATOM 1326 H ARG A 140 68.003 17.815 75.100 1.00 0.00 H ATOM 1327 N THR A 141 69.113 15.588 78.599 1.00 19.47 N ATOM 1328 CA THR A 141 68.954 15.734 80.049 1.00 18.53 C ATOM 1329 C THR A 141 69.410 17.086 80.544 1.00 18.48 C ATOM 1330 O THR A 141 68.741 17.691 81.395 1.00 17.89 O ATOM 1331 CB THR A 141 69.735 14.628 80.735 1.00 21.97 C ATOM 1332 OG1 THR A 141 69.232 13.373 80.265 1.00 21.32 O ATOM 1333 CG2 THR A 141 69.655 14.711 82.285 1.00 22.59 C ATOM 1334 HG1 THR A 141 68.270 13.301 80.487 1.00 0.00 H ATOM 1335 H THR A 141 69.583 14.741 78.222 1.00 0.00 H ATOM 1336 N ASP A 142 70.556 17.572 80.064 1.00 18.55 N ATOM 1337 CA ASP A 142 71.057 18.843 80.561 1.00 21.01 C ATOM 1338 C ASP A 142 70.045 19.965 80.349 1.00 20.33 C ATOM 1339 O ASP A 142 69.944 20.874 81.184 1.00 20.58 O ATOM 1340 CB ASP A 142 72.366 19.239 79.867 1.00 23.09 C ATOM 1341 CG ASP A 142 73.577 18.440 80.319 1.00 28.61 C ATOM 1342 OD1 ASP A 142 73.544 17.818 81.409 1.00 30.63 O ATOM 1343 OD2 ASP A 142 74.579 18.499 79.550 1.00 30.06 O ATOM 1344 H ASP A 142 71.086 17.046 79.340 1.00 0.00 H ATOM 1345 N ASP A 143 69.344 19.955 79.230 1.00 21.49 N ATOM 1346 CA ASP A 143 68.406 21.038 79.000 1.00 21.87 C ATOM 1347 C ASP A 143 67.124 20.869 79.797 1.00 19.11 C ATOM 1348 O ASP A 143 66.535 21.871 80.187 1.00 19.71 O ATOM 1349 CB ASP A 143 68.133 21.158 77.500 1.00 25.73 C ATOM 1350 CG ASP A 143 69.443 21.526 76.754 1.00 31.57 C ATOM 1351 OD1 ASP A 143 70.118 22.514 77.159 1.00 34.83 O ATOM 1352 OD2 ASP A 143 69.848 20.802 75.858 1.00 34.05 O ATOM 1353 H ASP A 143 69.461 19.192 78.533 1.00 0.00 H ATOM 1354 N GLY A 144 66.703 19.648 80.067 1.00 17.29 N ATOM 1355 CA GLY A 144 65.596 19.457 80.992 1.00 15.49 C ATOM 1356 C GLY A 144 65.955 19.952 82.382 1.00 17.18 C ATOM 1357 O GLY A 144 65.175 20.650 83.033 1.00 17.62 O ATOM 1358 H GLY A 144 67.160 18.827 79.621 1.00 0.00 H ATOM 1359 N ARG A 145 67.151 19.567 82.860 1.00 17.75 N ATOM 1360 CA ARG A 145 67.564 19.983 84.185 1.00 17.88 C ATOM 1361 C ARG A 145 67.650 21.508 84.253 1.00 18.25 C ATOM 1362 O ARG A 145 67.271 22.122 85.264 1.00 19.02 O ATOM 1363 CB ARG A 145 68.934 19.386 84.528 1.00 19.52 C ATOM 1364 CG ARG A 145 68.873 17.926 84.855 1.00 20.75 C ATOM 1365 CD ARG A 145 70.251 17.402 85.212 1.00 23.15 C ATOM 1366 NE ARG A 145 70.153 16.007 85.601 1.00 24.17 N ATOM 1367 CZ ARG A 145 71.113 15.332 86.206 1.00 30.33 C ATOM 1368 NH1 ARG A 145 72.259 15.932 86.469 1.00 32.93 N ATOM 1369 NH2 ARG A 145 70.923 14.060 86.535 1.00 32.24 N ATOM 1370 HE ARG A 145 69.267 15.505 85.389 1.00 0.00 H ATOM 1371 HH12 ARG A 145 73.022 15.410 86.945 1.00 0.00 H ATOM 1372 HH11 ARG A 145 72.399 16.927 86.200 1.00 0.00 H ATOM 1373 HH22 ARG A 145 71.679 13.528 87.012 1.00 0.00 H ATOM 1374 HH21 ARG A 145 70.018 13.596 86.316 1.00 0.00 H ATOM 1375 H ARG A 145 67.778 18.973 82.281 1.00 0.00 H ATOM 1376 N ALA A 146 68.169 22.148 83.196 1.00 17.35 N ATOM 1377 CA ALA A 146 68.308 23.591 83.220 1.00 19.39 C ATOM 1378 C ALA A 146 66.948 24.261 83.338 1.00 19.63 C ATOM 1379 O ALA A 146 66.813 25.315 83.958 1.00 19.74 O ATOM 1380 CB ALA A 146 69.025 24.107 81.978 1.00 20.40 C ATOM 1381 H ALA A 146 68.472 21.610 82.359 1.00 0.00 H ATOM 1382 N MET A 147 65.951 23.690 82.658 1.00 19.00 N ATOM 1383 CA MET A 147 64.602 24.223 82.736 1.00 18.08 C ATOM 1384 C MET A 147 64.028 24.028 84.128 1.00 17.42 C ATOM 1385 O MET A 147 63.385 24.927 84.658 1.00 16.41 O ATOM 1386 CB MET A 147 63.723 23.534 81.690 1.00 17.66 C ATOM 1387 CG MET A 147 62.372 24.198 81.552 1.00 18.31 C ATOM 1388 SD MET A 147 62.442 25.887 80.999 1.00 20.19 S ATOM 1389 CE MET A 147 62.760 25.709 79.244 1.00 21.12 C ATOM 1390 H MET A 147 66.142 22.856 82.067 1.00 0.00 H ATOM 1391 N ALA A 148 64.306 22.881 84.745 1.00 18.06 N ATOM 1392 CA ALA A 148 63.846 22.652 86.108 1.00 18.42 C ATOM 1393 C ALA A 148 64.442 23.692 87.062 1.00 19.32 C ATOM 1394 O ALA A 148 63.767 24.170 87.982 1.00 19.36 O ATOM 1395 CB ALA A 148 64.216 21.244 86.556 1.00 18.86 C ATOM 1396 H ALA A 148 64.853 22.147 84.252 1.00 0.00 H ATOM 1397 N VAL A 149 65.702 24.064 86.874 1.00 20.11 N ATOM 1398 CA VAL A 149 66.258 25.141 87.678 1.00 20.80 C ATOM 1399 C VAL A 149 65.584 26.469 87.377 1.00 21.02 C ATOM 1400 O VAL A 149 65.240 27.245 88.284 1.00 22.13 O ATOM 1401 CB VAL A 149 67.766 25.232 87.411 1.00 22.09 C ATOM 1402 CG1 VAL A 149 68.403 26.444 88.133 1.00 24.01 C ATOM 1403 CG2 VAL A 149 68.416 23.963 87.893 1.00 24.12 C ATOM 1404 H VAL A 149 66.287 23.589 86.157 1.00 0.00 H ATOM 1405 N ARG A 150 65.464 26.801 86.097 1.00 21.24 N ATOM 1406 CA ARG A 150 64.815 28.046 85.701 1.00 22.24 C ATOM 1407 C ARG A 150 63.429 28.201 86.332 1.00 21.55 C ATOM 1408 O ARG A 150 63.071 29.286 86.795 1.00 21.58 O ATOM 1409 CB ARG A 150 64.738 28.123 84.178 1.00 23.92 C ATOM 1410 CG ARG A 150 63.978 29.316 83.658 1.00 25.17 C ATOM 1411 CD ARG A 150 63.988 29.383 82.136 1.00 25.75 C ATOM 1412 NE ARG A 150 63.023 30.419 81.717 1.00 27.49 N ATOM 1413 CZ ARG A 150 62.633 30.669 80.472 1.00 31.86 C ATOM 1414 NH1 ARG A 150 63.131 29.956 79.481 1.00 32.11 N ATOM 1415 NH2 ARG A 150 61.758 31.638 80.252 1.00 35.68 N ATOM 1416 HE ARG A 150 62.610 31.009 82.467 1.00 0.00 H ATOM 1417 HH12 ARG A 150 62.832 30.145 78.503 1.00 0.00 H ATOM 1418 HH11 ARG A 150 63.823 29.205 79.677 1.00 0.00 H ATOM 1419 HH22 ARG A 150 61.444 31.845 79.282 1.00 0.00 H ATOM 1420 HH21 ARG A 150 61.385 32.192 81.049 1.00 0.00 H ATOM 1421 H ARG A 150 65.838 26.164 85.365 1.00 0.00 H ATOM 1422 N ILE A 151 62.631 27.143 86.328 1.00 19.92 N ATOM 1423 CA ILE A 151 61.275 27.274 86.840 1.00 20.45 C ATOM 1424 C ILE A 151 61.152 26.872 88.301 1.00 21.55 C ATOM 1425 O ILE A 151 60.049 26.904 88.865 1.00 22.33 O ATOM 1426 CB ILE A 151 60.268 26.461 86.000 1.00 19.38 C ATOM 1427 CG1 ILE A 151 60.401 24.939 86.189 1.00 19.17 C ATOM 1428 CG2 ILE A 151 60.462 26.821 84.543 1.00 20.72 C ATOM 1429 CD1 ILE A 151 59.242 24.091 85.555 1.00 18.89 C ATOM 1430 H ILE A 151 62.970 26.230 85.963 1.00 0.00 H ATOM 1431 N GLN A 152 62.273 26.568 88.931 1.00 21.17 N ATOM 1432 CA GLN A 152 62.352 26.219 90.357 1.00 20.49 C ATOM 1433 C GLN A 152 61.387 25.085 90.690 1.00 20.67 C ATOM 1434 O GLN A 152 60.642 25.115 91.685 1.00 21.31 O ATOM 1435 CB GLN A 152 62.166 27.462 91.236 1.00 22.21 C ATOM 1436 CG GLN A 152 63.255 28.468 90.953 1.00 24.08 C ATOM 1437 CD GLN A 152 63.304 29.680 91.859 1.00 27.91 C ATOM 1438 OE1 GLN A 152 62.527 29.815 92.791 1.00 29.75 O ATOM 1439 NE2 GLN A 152 64.256 30.575 91.598 1.00 30.64 N ATOM 1440 HE22 GLN A 152 64.901 30.429 90.796 1.00 0.00 H ATOM 1441 HE21 GLN A 152 64.354 31.420 92.197 1.00 0.00 H ATOM 1442 H GLN A 152 63.157 26.576 88.383 1.00 0.00 H ATOM 1443 N ALA A 153 61.406 24.081 89.819 1.00 19.03 N ATOM 1444 CA ALA A 153 60.653 22.864 90.048 1.00 18.67 C ATOM 1445 C ALA A 153 61.092 22.175 91.320 1.00 19.86 C ATOM 1446 O ALA A 153 62.265 22.213 91.711 1.00 19.73 O ATOM 1447 CB ALA A 153 60.816 21.929 88.854 1.00 18.32 C ATOM 1448 H ALA A 153 61.975 24.171 88.953 1.00 0.00 H ATOM 1449 N TYR A 154 60.129 21.548 91.970 1.00 19.87 N ATOM 1450 CA TYR A 154 60.413 20.705 93.138 1.00 19.12 C ATOM 1451 C TYR A 154 61.415 19.622 92.799 1.00 18.88 C ATOM 1452 O TYR A 154 62.288 19.282 93.603 1.00 19.94 O ATOM 1453 CB TYR A 154 59.093 20.072 93.624 1.00 20.74 C ATOM 1454 CG TYR A 154 59.264 19.079 94.767 1.00 21.98 C ATOM 1455 CD1 TYR A 154 59.534 17.738 94.516 1.00 21.85 C ATOM 1456 CD2 TYR A 154 59.148 19.481 96.069 1.00 24.94 C ATOM 1457 CE1 TYR A 154 59.678 16.829 95.536 1.00 23.92 C ATOM 1458 CE2 TYR A 154 59.308 18.566 97.116 1.00 25.08 C ATOM 1459 CZ TYR A 154 59.522 17.248 96.833 1.00 25.10 C ATOM 1460 OH TYR A 154 59.667 16.320 97.875 1.00 28.56 O ATOM 1461 HH TYR A 154 60.443 16.573 98.436 1.00 0.00 H ATOM 1462 H TYR A 154 59.146 21.654 91.647 1.00 0.00 H ATOM 1463 N ASP A 155 61.300 19.037 91.619 1.00 18.43 N ATOM 1464 CA ASP A 155 62.269 18.070 91.137 1.00 19.18 C ATOM 1465 C ASP A 155 62.153 17.938 89.632 1.00 17.52 C ATOM 1466 O ASP A 155 61.236 18.483 89.007 1.00 17.30 O ATOM 1467 CB ASP A 155 62.088 16.733 91.856 1.00 20.44 C ATOM 1468 CG ASP A 155 63.373 16.015 92.086 1.00 24.42 C ATOM 1469 OD1 ASP A 155 64.393 16.330 91.421 1.00 24.76 O ATOM 1470 OD2 ASP A 155 63.414 15.140 92.991 1.00 27.05 O ATOM 1471 H ASP A 155 60.488 19.278 91.016 1.00 0.00 H ATOM 1472 N TYR A 156 63.146 17.263 89.056 1.00 17.09 N ATOM 1473 CA TYR A 156 63.291 16.965 87.640 1.00 16.99 C ATOM 1474 C TYR A 156 63.514 15.468 87.480 1.00 17.33 C ATOM 1475 O TYR A 156 64.452 14.932 88.074 1.00 17.32 O ATOM 1476 CB TYR A 156 64.429 17.705 86.979 1.00 16.90 C ATOM 1477 CG TYR A 156 64.602 17.303 85.556 1.00 17.87 C ATOM 1478 CD1 TYR A 156 63.670 17.715 84.608 1.00 17.49 C ATOM 1479 CD2 TYR A 156 65.618 16.463 85.131 1.00 17.72 C ATOM 1480 CE1 TYR A 156 63.749 17.347 83.311 1.00 17.99 C ATOM 1481 CE2 TYR A 156 65.722 16.094 83.787 1.00 17.61 C ATOM 1482 CZ TYR A 156 64.754 16.528 82.873 1.00 18.20 C ATOM 1483 OH TYR A 156 64.831 16.164 81.562 1.00 17.91 O ATOM 1484 HH TYR A 156 64.796 15.177 81.492 1.00 0.00 H ATOM 1485 H TYR A 156 63.896 16.912 89.685 1.00 0.00 H ATOM 1486 N LEU A 157 62.701 14.803 86.668 1.00 17.26 N ATOM 1487 CA LEU A 157 62.791 13.377 86.456 1.00 16.32 C ATOM 1488 C LEU A 157 62.542 13.059 85.009 1.00 17.08 C ATOM 1489 O LEU A 157 61.847 13.788 84.311 1.00 17.48 O ATOM 1490 CB LEU A 157 61.783 12.641 87.340 1.00 18.50 C ATOM 1491 CG LEU A 157 62.168 12.661 88.825 1.00 20.06 C ATOM 1492 CD1 LEU A 157 60.978 12.156 89.675 1.00 23.37 C ATOM 1493 CD2 LEU A 157 63.407 11.884 89.156 1.00 19.62 C ATOM 1494 H LEU A 157 61.965 15.334 86.161 1.00 0.00 H ATOM 1495 N GLU A 158 63.090 11.945 84.573 1.00 16.97 N ATOM 1496 CA GLU A 158 62.953 11.463 83.215 1.00 15.69 C ATOM 1497 C GLU A 158 62.395 10.047 83.249 1.00 16.89 C ATOM 1498 O GLU A 158 62.645 9.286 84.163 1.00 18.43 O ATOM 1499 CB GLU A 158 64.269 11.475 82.435 1.00 15.46 C ATOM 1500 CG GLU A 158 65.011 12.800 82.521 1.00 16.68 C ATOM 1501 CD GLU A 158 66.108 12.923 81.512 1.00 19.59 C ATOM 1502 OE1 GLU A 158 66.781 11.904 81.270 1.00 22.40 O ATOM 1503 OE2 GLU A 158 66.266 14.039 80.947 1.00 21.53 O ATOM 1504 H GLU A 158 63.652 11.380 85.241 1.00 0.00 H ATOM 1505 N CYS A 159 61.539 9.732 82.281 1.00 15.59 N ATOM 1506 CA CYS A 159 60.915 8.411 82.275 1.00 16.57 C ATOM 1507 C CYS A 159 60.548 7.970 80.874 1.00 16.13 C ATOM 1508 O CYS A 159 60.584 8.750 79.908 1.00 16.19 O ATOM 1509 CB CYS A 159 59.665 8.360 83.170 1.00 16.47 C ATOM 1510 SG CYS A 159 58.284 9.367 82.539 1.00 16.83 S ATOM 1511 H CYS A 159 61.316 10.421 81.534 1.00 0.00 H ATOM 1512 N SER A 160 60.259 6.670 80.787 1.00 16.43 N ATOM 1513 CA SER A 160 59.639 6.085 79.601 1.00 16.72 C ATOM 1514 C SER A 160 58.450 5.261 80.023 1.00 16.50 C ATOM 1515 O SER A 160 58.606 4.184 80.596 1.00 17.44 O ATOM 1516 CB SER A 160 60.631 5.211 78.831 1.00 17.80 C ATOM 1517 OG SER A 160 59.962 4.478 77.822 1.00 18.30 O ATOM 1518 HG SER A 160 59.528 5.106 77.192 1.00 0.00 H ATOM 1519 H SER A 160 60.483 6.051 81.592 1.00 0.00 H ATOM 1520 N ALA A 161 57.240 5.694 79.643 1.00 16.48 N ATOM 1521 CA ALA A 161 56.086 4.834 79.874 1.00 16.81 C ATOM 1522 C ALA A 161 56.185 3.531 79.096 1.00 17.05 C ATOM 1523 O ALA A 161 55.681 2.493 79.539 1.00 18.30 O ATOM 1524 CB ALA A 161 54.808 5.582 79.473 1.00 18.72 C ATOM 1525 H ALA A 161 57.127 6.625 79.193 1.00 0.00 H ATOM 1526 N LYS A 162 56.830 3.567 77.927 1.00 17.72 N ATOM 1527 CA LYS A 162 56.901 2.412 77.042 1.00 19.47 C ATOM 1528 C LYS A 162 57.747 1.308 77.662 1.00 19.16 C ATOM 1529 O LYS A 162 57.382 0.133 77.599 1.00 21.13 O ATOM 1530 CB LYS A 162 57.479 2.854 75.707 1.00 22.25 C ATOM 1531 CG LYS A 162 57.542 1.735 74.658 1.00 28.71 C ATOM 1532 CD LYS A 162 57.824 2.321 73.269 1.00 34.28 C ATOM 1533 CE LYS A 162 57.965 1.218 72.216 1.00 41.82 C ATOM 1534 NZ LYS A 162 59.090 0.293 72.568 1.00 46.06 N ATOM 1535 HZ1 LYS A 162 59.979 0.831 72.614 1.00 0.00 H ATOM 1536 HZ2 LYS A 162 58.901 -0.145 73.492 1.00 0.00 H ATOM 1537 HZ3 LYS A 162 59.169 -0.447 71.842 1.00 0.00 H ATOM 1538 H LYS A 162 57.298 4.450 77.639 1.00 0.00 H ATOM 1539 N THR A 163 58.916 1.663 78.231 1.00 18.65 N ATOM 1540 CA THR A 163 59.773 0.645 78.820 1.00 19.04 C ATOM 1541 C THR A 163 59.564 0.505 80.312 1.00 18.50 C ATOM 1542 O THR A 163 60.043 -0.483 80.905 1.00 19.47 O ATOM 1543 CB THR A 163 61.260 0.961 78.613 1.00 19.67 C ATOM 1544 OG1 THR A 163 61.571 2.095 79.410 1.00 20.15 O ATOM 1545 CG2 THR A 163 61.606 1.217 77.147 1.00 20.26 C ATOM 1546 HG1 THR A 163 62.528 2.324 79.297 1.00 0.00 H ATOM 1547 H THR A 163 59.205 2.662 78.249 1.00 0.00 H ATOM 1548 N LYS A 164 58.880 1.466 80.921 1.00 17.92 N ATOM 1549 CA LYS A 164 58.547 1.601 82.334 1.00 18.12 C ATOM 1550 C LYS A 164 59.700 2.261 83.086 1.00 17.78 C ATOM 1551 O LYS A 164 59.516 2.629 84.237 1.00 18.29 O ATOM 1552 CB LYS A 164 58.190 0.285 83.036 1.00 20.36 C ATOM 1553 CG LYS A 164 57.129 -0.502 82.231 1.00 26.10 C ATOM 1554 CD LYS A 164 56.462 -1.568 83.019 1.00 31.55 C ATOM 1555 CE LYS A 164 55.040 -1.836 82.424 1.00 31.48 C ATOM 1556 NZ LYS A 164 55.126 -2.219 80.962 1.00 30.52 N ATOM 1557 HZ1 LYS A 164 55.571 -1.446 80.428 1.00 0.00 H ATOM 1558 HZ2 LYS A 164 55.697 -3.083 80.864 1.00 0.00 H ATOM 1559 HZ3 LYS A 164 54.169 -2.391 80.593 1.00 0.00 H ATOM 1560 H LYS A 164 58.534 2.229 80.305 1.00 0.00 H ATOM 1561 N GLU A 165 60.834 2.507 82.438 1.00 17.24 N ATOM 1562 CA GLU A 165 61.960 3.136 83.147 1.00 17.42 C ATOM 1563 C GLU A 165 61.521 4.464 83.794 1.00 17.72 C ATOM 1564 O GLU A 165 60.945 5.333 83.130 1.00 16.73 O ATOM 1565 CB GLU A 165 63.073 3.380 82.153 1.00 19.81 C ATOM 1566 CG GLU A 165 64.342 3.896 82.848 1.00 22.42 C ATOM 1567 CD GLU A 165 65.447 4.273 81.902 1.00 27.28 C ATOM 1568 OE1 GLU A 165 65.255 4.372 80.675 1.00 28.69 O ATOM 1569 OE2 GLU A 165 66.551 4.503 82.443 1.00 30.21 O ATOM 1570 H GLU A 165 60.925 2.256 81.433 1.00 0.00 H ATOM 1571 N GLY A 166 61.804 4.615 85.094 1.00 19.10 N ATOM 1572 CA GLY A 166 61.577 5.906 85.734 1.00 16.07 C ATOM 1573 C GLY A 166 60.146 6.219 86.138 1.00 16.83 C ATOM 1574 O GLY A 166 59.902 7.258 86.780 1.00 17.38 O ATOM 1575 H GLY A 166 62.183 3.817 85.644 1.00 0.00 H ATOM 1576 N VAL A 167 59.171 5.383 85.755 1.00 17.33 N ATOM 1577 CA VAL A 167 57.777 5.729 85.979 1.00 16.39 C ATOM 1578 C VAL A 167 57.443 5.724 87.461 1.00 17.34 C ATOM 1579 O VAL A 167 56.855 6.685 87.983 1.00 17.14 O ATOM 1580 CB VAL A 167 56.852 4.772 85.193 1.00 17.79 C ATOM 1581 CG1 VAL A 167 55.408 4.994 85.638 1.00 17.44 C ATOM 1582 CG2 VAL A 167 57.062 5.029 83.734 1.00 17.59 C ATOM 1583 H VAL A 167 59.413 4.482 85.295 1.00 0.00 H ATOM 1584 N ARG A 168 57.793 4.642 88.166 1.00 18.92 N ATOM 1585 CA ARG A 168 57.498 4.585 89.590 1.00 20.67 C ATOM 1586 C ARG A 168 58.119 5.776 90.306 1.00 19.44 C ATOM 1587 O ARG A 168 57.472 6.412 91.130 1.00 18.86 O ATOM 1588 CB ARG A 168 58.008 3.269 90.199 1.00 23.22 C ATOM 1589 CG ARG A 168 57.842 3.109 91.730 1.00 25.68 C ATOM 1590 CD ARG A 168 58.027 1.640 92.202 1.00 27.68 C ATOM 1591 NE ARG A 168 57.251 0.727 91.364 1.00 29.30 N ATOM 1592 CZ ARG A 168 55.925 0.654 91.378 1.00 32.75 C ATOM 1593 NH1 ARG A 168 55.226 1.411 92.214 1.00 32.84 N ATOM 1594 NH2 ARG A 168 55.291 -0.179 90.568 1.00 35.60 N ATOM 1595 HE ARG A 168 57.768 0.097 90.718 1.00 0.00 H ATOM 1596 HH12 ARG A 168 54.188 1.353 92.224 1.00 0.00 H ATOM 1597 HH11 ARG A 168 55.716 2.063 92.859 1.00 0.00 H ATOM 1598 HH22 ARG A 168 54.252 -0.231 90.584 1.00 0.00 H ATOM 1599 HH21 ARG A 168 55.831 -0.782 89.915 1.00 0.00 H ATOM 1600 H ARG A 168 58.273 3.846 87.699 1.00 0.00 H ATOM 1601 N GLU A 169 59.356 6.119 89.959 1.00 19.12 N ATOM 1602 CA GLU A 169 60.034 7.211 90.635 1.00 18.66 C ATOM 1603 C GLU A 169 59.327 8.554 90.458 1.00 18.31 C ATOM 1604 O GLU A 169 59.285 9.365 91.393 1.00 17.65 O ATOM 1605 CB GLU A 169 61.452 7.279 90.087 1.00 18.09 C ATOM 1606 CG GLU A 169 62.336 6.087 90.480 1.00 20.25 C ATOM 1607 CD GLU A 169 62.338 4.937 89.500 1.00 24.31 C ATOM 1608 OE1 GLU A 169 61.388 4.714 88.732 1.00 24.17 O ATOM 1609 OE2 GLU A 169 63.325 4.159 89.562 1.00 27.63 O ATOM 1610 H GLU A 169 59.841 5.602 89.198 1.00 0.00 H ATOM 1611 N VAL A 170 58.717 8.794 89.295 1.00 15.88 N ATOM 1612 CA VAL A 170 57.981 10.020 89.090 1.00 15.88 C ATOM 1613 C VAL A 170 56.870 10.109 90.131 1.00 16.73 C ATOM 1614 O VAL A 170 56.656 11.149 90.762 1.00 17.62 O ATOM 1615 CB VAL A 170 57.374 10.047 87.667 1.00 16.30 C ATOM 1616 CG1 VAL A 170 56.327 11.099 87.608 1.00 16.70 C ATOM 1617 CG2 VAL A 170 58.459 10.264 86.623 1.00 16.13 C ATOM 1618 H VAL A 170 58.772 8.092 88.530 1.00 0.00 H ATOM 1619 N PHE A 171 56.112 9.013 90.295 1.00 16.83 N ATOM 1620 CA PHE A 171 54.978 9.057 91.216 1.00 17.12 C ATOM 1621 C PHE A 171 55.393 8.998 92.666 1.00 18.64 C ATOM 1622 O PHE A 171 54.732 9.616 93.516 1.00 19.65 O ATOM 1623 CB PHE A 171 53.969 7.963 90.835 1.00 17.55 C ATOM 1624 CG PHE A 171 53.307 8.299 89.560 1.00 17.03 C ATOM 1625 CD1 PHE A 171 52.248 9.173 89.557 1.00 18.10 C ATOM 1626 CD2 PHE A 171 53.804 7.841 88.382 1.00 17.28 C ATOM 1627 CE1 PHE A 171 51.687 9.559 88.341 1.00 17.17 C ATOM 1628 CE2 PHE A 171 53.226 8.218 87.143 1.00 18.15 C ATOM 1629 CZ PHE A 171 52.177 9.077 87.161 1.00 17.27 C ATOM 1630 H PHE A 171 56.330 8.141 89.772 1.00 0.00 H ATOM 1631 N GLU A 172 56.519 8.350 92.976 1.00 19.03 N ATOM 1632 CA GLU A 172 57.015 8.402 94.340 1.00 19.45 C ATOM 1633 C GLU A 172 57.443 9.806 94.711 1.00 17.96 C ATOM 1634 O GLU A 172 57.145 10.273 95.815 1.00 19.02 O ATOM 1635 CB GLU A 172 58.203 7.450 94.527 1.00 20.90 C ATOM 1636 CG GLU A 172 57.797 6.015 94.546 1.00 24.06 C ATOM 1637 CD GLU A 172 58.976 5.072 94.661 1.00 29.54 C ATOM 1638 OE1 GLU A 172 60.125 5.503 94.412 1.00 30.07 O ATOM 1639 OE2 GLU A 172 58.714 3.903 94.975 1.00 32.97 O ATOM 1640 H GLU A 172 57.035 7.814 92.249 1.00 0.00 H ATOM 1641 N THR A 173 58.135 10.478 93.801 1.00 18.02 N ATOM 1642 CA THR A 173 58.584 11.840 94.044 1.00 18.44 C ATOM 1643 C THR A 173 57.390 12.774 94.116 1.00 17.89 C ATOM 1644 O THR A 173 57.324 13.636 94.966 1.00 20.48 O ATOM 1645 CB THR A 173 59.560 12.257 92.956 1.00 19.60 C ATOM 1646 OG1 THR A 173 60.764 11.487 93.086 1.00 22.95 O ATOM 1647 CG2 THR A 173 59.887 13.712 93.084 1.00 20.72 C ATOM 1648 HG1 THR A 173 60.551 10.525 92.992 1.00 0.00 H ATOM 1649 H THR A 173 58.361 10.022 92.894 1.00 0.00 H ATOM 1650 N ALA A 174 56.418 12.601 93.219 1.00 17.21 N ATOM 1651 CA ALA A 174 55.245 13.445 93.315 1.00 17.38 C ATOM 1652 C ALA A 174 54.507 13.252 94.611 1.00 17.54 C ATOM 1653 O ALA A 174 53.976 14.208 95.187 1.00 19.64 O ATOM 1654 CB ALA A 174 54.278 13.141 92.179 1.00 17.76 C ATOM 1655 H ALA A 174 56.500 11.881 92.473 1.00 0.00 H ATOM 1656 N THR A 175 54.411 12.019 95.083 1.00 17.52 N ATOM 1657 CA THR A 175 53.726 11.783 96.342 1.00 18.51 C ATOM 1658 C THR A 175 54.445 12.457 97.498 1.00 20.45 C ATOM 1659 O THR A 175 53.806 13.028 98.381 1.00 21.50 O ATOM 1660 CB THR A 175 53.573 10.294 96.594 1.00 20.69 C ATOM 1661 OG1 THR A 175 52.847 9.691 95.515 1.00 21.14 O ATOM 1662 CG2 THR A 175 52.810 10.050 97.878 1.00 23.20 C ATOM 1663 HG1 THR A 175 53.340 9.831 94.668 1.00 0.00 H ATOM 1664 H THR A 175 54.824 11.224 94.555 1.00 0.00 H ATOM 1665 N ARG A 176 55.786 12.368 97.523 1.00 19.99 N ATOM 1666 CA ARG A 176 56.538 13.084 98.545 1.00 22.23 C ATOM 1667 C ARG A 176 56.266 14.578 98.505 1.00 22.57 C ATOM 1668 O ARG A 176 56.144 15.222 99.563 1.00 24.80 O ATOM 1669 CB ARG A 176 58.047 12.832 98.366 1.00 22.52 C ATOM 1670 CG ARG A 176 58.457 11.453 98.697 1.00 24.97 C ATOM 1671 CD ARG A 176 59.969 11.262 98.635 1.00 26.81 C ATOM 1672 NE ARG A 176 60.250 9.855 98.857 1.00 29.14 N ATOM 1673 CZ ARG A 176 60.673 9.042 97.896 1.00 28.58 C ATOM 1674 NH1 ARG A 176 60.894 9.506 96.698 1.00 27.25 N ATOM 1675 NH2 ARG A 176 60.894 7.781 98.183 1.00 31.93 N ATOM 1676 HE ARG A 176 60.114 9.466 99.812 1.00 0.00 H ATOM 1677 HH12 ARG A 176 61.225 8.868 95.946 1.00 0.00 H ATOM 1678 HH11 ARG A 176 60.739 10.514 96.494 1.00 0.00 H ATOM 1679 HH22 ARG A 176 61.226 7.130 97.443 1.00 0.00 H ATOM 1680 HH21 ARG A 176 60.738 7.433 99.150 1.00 0.00 H ATOM 1681 H ARG A 176 56.284 11.791 96.816 1.00 0.00 H ATOM 1682 N ALA A 177 56.189 15.155 97.296 1.00 20.72 N ATOM 1683 CA ALA A 177 55.947 16.598 97.187 1.00 21.02 C ATOM 1684 C ALA A 177 54.585 16.935 97.777 1.00 23.30 C ATOM 1685 O ALA A 177 54.449 17.886 98.555 1.00 25.23 O ATOM 1686 CB ALA A 177 56.085 17.051 95.737 1.00 20.32 C ATOM 1687 H ALA A 177 56.301 14.580 96.437 1.00 0.00 H ATOM 1688 N ALA A 178 53.591 16.107 97.471 1.00 24.00 N ATOM 1689 CA ALA A 178 52.243 16.323 97.972 1.00 27.01 C ATOM 1690 C ALA A 178 52.158 16.190 99.482 1.00 29.19 C ATOM 1691 O ALA A 178 51.328 16.854 100.120 1.00 31.27 O ATOM 1692 CB ALA A 178 51.320 15.324 97.297 1.00 28.32 C ATOM 1693 H ALA A 178 53.782 15.287 96.860 1.00 0.00 H ATOM 1694 N LEU A 179 52.985 15.337 100.072 1.00 28.63 N ATOM 1695 CA LEU A 179 52.993 15.125 101.507 1.00 31.95 C ATOM 1696 C LEU A 179 53.806 16.161 102.280 1.00 35.06 C ATOM 1697 O LEU A 179 53.689 16.213 103.518 1.00 37.17 O ATOM 1698 CB LEU A 179 53.541 13.730 101.791 1.00 31.05 C ATOM 1699 CG LEU A 179 52.725 12.516 101.396 1.00 31.58 C ATOM 1700 CD1 LEU A 179 53.503 11.247 101.549 1.00 31.30 C ATOM 1701 CD2 LEU A 179 51.452 12.446 102.215 1.00 34.63 C ATOM 1702 H LEU A 179 53.653 14.800 99.483 1.00 0.00 H ATOM 1703 N GLN A 180 54.591 17.003 101.612 1.00 35.47 N ATOM 1704 CA GLN A 180 55.501 17.916 102.311 1.00 39.95 C ATOM 1705 C GLN A 180 54.766 19.010 103.088 1.00 43.85 C ATOM 1706 O GLN A 180 53.876 19.682 102.559 1.00 45.21 O ATOM 1707 CB GLN A 180 56.493 18.546 101.299 1.00 39.33 C ATOM 1708 H GLN A 180 54.558 17.014 100.573 1.00 0.00 H TER 1709 GLN A 180 ATOM 1710 N ALA B 1 47.899 1.508 60.538 1.00 58.55 N ATOM 1711 CA ALA B 1 49.186 0.756 60.484 1.00 55.94 C ATOM 1712 C ALA B 1 49.843 0.755 59.101 1.00 50.50 C ATOM 1713 O ALA B 1 51.013 0.398 58.973 1.00 52.19 O ATOM 1714 CB ALA B 1 48.973 -0.680 60.965 1.00 56.55 C ATOM 1715 HN3 ALA B 1 47.222 1.082 59.874 1.00 0.00 H ATOM 1716 HN2 ALA B 1 48.067 2.500 60.275 1.00 0.00 H ATOM 1717 HN1 ALA B 1 47.514 1.465 61.503 1.00 0.00 H ATOM 1718 N VAL B 2 49.111 1.146 58.054 1.00 42.71 N ATOM 1719 CA VAL B 2 49.792 1.519 56.821 1.00 37.67 C ATOM 1720 C VAL B 2 50.474 2.863 57.054 1.00 37.40 C ATOM 1721 O VAL B 2 49.878 3.780 57.638 1.00 36.84 O ATOM 1722 CB VAL B 2 48.815 1.572 55.635 1.00 36.97 C ATOM 1723 CG1 VAL B 2 49.511 2.226 54.439 1.00 35.02 C ATOM 1724 CG2 VAL B 2 48.345 0.186 55.325 1.00 38.34 C ATOM 1725 H VAL B 2 48.074 1.183 58.118 1.00 0.00 H ATOM 1726 N GLN B 3 51.744 2.975 56.643 1.00 38.60 N ATOM 1727 CA GLN B 3 52.510 4.205 56.831 1.00 38.74 C ATOM 1728 C GLN B 3 53.121 4.682 55.514 1.00 34.05 C ATOM 1729 O GLN B 3 53.697 3.893 54.753 1.00 33.54 O ATOM 1730 CB GLN B 3 53.608 4.004 57.884 1.00 41.97 C ATOM 1731 CG GLN B 3 54.327 5.275 58.269 1.00 41.66 C ATOM 1732 CD GLN B 3 55.419 5.014 59.274 1.00 44.18 C ATOM 1733 OE1 GLN B 3 56.521 4.591 58.913 1.00 40.49 O ATOM 1734 NE2 GLN B 3 55.104 5.217 60.542 1.00 50.60 N ATOM 1735 HE22 GLN B 3 54.160 5.575 60.792 1.00 0.00 H ATOM 1736 HE21 GLN B 3 55.800 5.019 61.289 1.00 0.00 H ATOM 1737 H GLN B 3 52.198 2.163 56.177 1.00 0.00 H ATOM 1738 N LEU B 4 53.012 5.986 55.276 1.00 32.16 N ATOM 1739 CA LEU B 4 53.409 6.630 54.043 1.00 31.00 C ATOM 1740 C LEU B 4 54.810 7.224 54.162 1.00 30.83 C ATOM 1741 O LEU B 4 55.154 7.836 55.181 1.00 31.52 O ATOM 1742 CB LEU B 4 52.401 7.723 53.683 1.00 31.47 C ATOM 1743 CG LEU B 4 50.960 7.264 53.425 1.00 32.15 C ATOM 1744 CD1 LEU B 4 50.085 8.408 52.918 1.00 31.64 C ATOM 1745 CD2 LEU B 4 50.987 6.096 52.460 1.00 32.41 C ATOM 1746 H LEU B 4 52.614 6.584 56.028 1.00 0.00 H ATOM 1747 N GLN B 5 55.624 6.923 53.152 1.00 32.18 N ATOM 1748 CA GLN B 5 57.041 7.296 53.125 1.00 33.86 C ATOM 1749 C GLN B 5 57.348 8.305 51.964 1.00 32.18 C ATOM 1750 O GLN B 5 57.051 7.943 50.827 1.00 32.79 O ATOM 1751 CB GLN B 5 57.920 6.025 52.990 1.00 38.40 C ATOM 1752 CG GLN B 5 57.383 4.828 53.770 1.00 42.98 C ATOM 1753 CD GLN B 5 57.505 5.004 55.296 1.00 44.41 C ATOM 1754 OE1 GLN B 5 58.353 5.765 55.748 1.00 43.40 O ATOM 1755 NE2 GLN B 5 56.689 4.289 56.085 1.00 45.06 N ATOM 1756 HE22 GLN B 5 55.982 3.654 55.662 1.00 0.00 H ATOM 1757 HE21 GLN B 5 56.763 4.370 57.119 1.00 0.00 H ATOM 1758 H GLN B 5 55.235 6.398 52.343 1.00 0.00 H ATOM 1759 N ALA B 6 57.999 9.465 52.225 1.00 30.96 N ATOM 1760 CA ALA B 6 58.284 10.520 51.203 1.00 29.89 C ATOM 1761 C ALA B 6 59.734 10.349 50.626 1.00 32.48 C ATOM 1762 O ALA B 6 60.609 9.964 51.400 1.00 32.53 O ATOM 1763 CB ALA B 6 58.122 11.948 51.750 1.00 29.56 C ATOM 1764 H ALA B 6 58.321 9.633 53.199 1.00 0.00 H ATOM 1765 N SER B 7 59.960 10.567 49.308 1.00 34.68 N ATOM 1766 CA SER B 7 61.314 10.541 48.655 1.00 39.04 C ATOM 1767 C SER B 7 61.420 11.542 47.449 1.00 38.46 C ATOM 1768 O SER B 7 60.426 12.200 47.157 1.00 35.82 O ATOM 1769 CB SER B 7 61.670 9.109 48.240 1.00 42.85 C ATOM 1770 OG SER B 7 60.670 8.546 47.425 1.00 50.69 O ATOM 1771 HG SER B 7 59.814 8.526 47.922 1.00 0.00 H ATOM 1772 H SER B 7 59.137 10.767 48.704 1.00 0.00 H ATOM 1773 N GLY B 8 62.570 11.645 46.772 1.00 38.93 N ATOM 1774 CA GLY B 8 62.762 12.557 45.650 1.00 38.09 C ATOM 1775 C GLY B 8 63.128 14.043 45.923 1.00 37.90 C ATOM 1776 O GLY B 8 63.215 14.850 44.981 1.00 39.22 O ATOM 1777 H GLY B 8 63.368 11.044 47.061 1.00 0.00 H ATOM 1778 N GLY B 9 63.405 14.431 47.179 1.00 36.19 N ATOM 1779 CA GLY B 9 63.804 15.788 47.508 1.00 36.14 C ATOM 1780 C GLY B 9 65.242 16.053 47.084 1.00 39.05 C ATOM 1781 O GLY B 9 66.008 15.137 46.801 1.00 41.82 O ATOM 1782 H GLY B 9 63.331 13.732 47.946 1.00 0.00 H ATOM 1783 N GLY B 10 65.633 17.312 47.080 1.00 38.98 N ATOM 1784 CA GLY B 10 66.991 17.648 46.690 1.00 41.83 C ATOM 1785 C GLY B 10 67.215 19.143 46.751 1.00 42.75 C ATOM 1786 O GLY B 10 66.385 19.891 47.255 1.00 41.23 O ATOM 1787 H GLY B 10 64.970 18.064 47.356 1.00 0.00 H ATOM 1788 N PHE B 11 68.365 19.564 46.248 1.00 45.46 N ATOM 1789 CA PHE B 11 68.674 20.974 46.091 1.00 46.78 C ATOM 1790 C PHE B 11 68.282 21.399 44.687 1.00 46.88 C ATOM 1791 O PHE B 11 68.693 20.763 43.707 1.00 49.11 O ATOM 1792 CB PHE B 11 70.175 21.239 46.305 1.00 50.76 C ATOM 1793 CG PHE B 11 70.645 20.923 47.684 1.00 53.13 C ATOM 1794 CD1 PHE B 11 70.640 21.885 48.682 1.00 54.74 C ATOM 1795 CD2 PHE B 11 71.072 19.639 47.996 1.00 54.41 C ATOM 1796 CE1 PHE B 11 71.061 21.567 49.981 1.00 56.67 C ATOM 1797 CE2 PHE B 11 71.506 19.318 49.279 1.00 55.72 C ATOM 1798 CZ PHE B 11 71.494 20.281 50.274 1.00 56.94 C ATOM 1799 H PHE B 11 69.072 18.860 45.955 1.00 0.00 H ATOM 1800 N VAL B 12 67.581 22.526 44.588 1.00 46.58 N ATOM 1801 CA VAL B 12 67.110 23.063 43.314 1.00 48.72 C ATOM 1802 C VAL B 12 67.354 24.562 43.275 1.00 48.54 C ATOM 1803 O VAL B 12 67.394 25.234 44.306 1.00 49.38 O ATOM 1804 CB VAL B 12 65.604 22.776 43.122 1.00 50.85 C ATOM 1805 CG1 VAL B 12 65.183 23.030 41.692 1.00 53.39 C ATOM 1806 CG2 VAL B 12 65.260 21.362 43.571 1.00 50.82 C ATOM 1807 H VAL B 12 67.358 23.049 45.459 1.00 0.00 H ATOM 1808 N GLN B 13 67.483 25.098 42.058 1.00 49.57 N ATOM 1809 CA GLN B 13 67.542 26.546 41.899 1.00 52.70 C ATOM 1810 C GLN B 13 66.132 27.122 41.788 1.00 50.04 C ATOM 1811 O GLN B 13 65.210 26.424 41.364 1.00 47.42 O ATOM 1812 CB GLN B 13 68.339 26.912 40.651 1.00 60.19 C ATOM 1813 CG GLN B 13 69.725 27.495 40.934 1.00 70.41 C ATOM 1814 CD GLN B 13 70.237 28.373 39.800 1.00 81.16 C ATOM 1815 OE1 GLN B 13 69.456 28.978 39.076 1.00 86.12 O ATOM 1816 NE2 GLN B 13 71.555 28.441 39.641 1.00 84.92 N ATOM 1817 HE22 GLN B 13 72.184 27.911 40.278 1.00 0.00 H ATOM 1818 HE21 GLN B 13 71.958 29.024 38.880 1.00 0.00 H ATOM 1819 H GLN B 13 67.541 24.481 41.223 1.00 0.00 H ATOM 1820 N PRO B 14 65.918 28.373 42.203 1.00 53.18 N ATOM 1821 CA PRO B 14 64.604 29.001 41.985 1.00 51.83 C ATOM 1822 C PRO B 14 64.155 28.793 40.544 1.00 50.81 C ATOM 1823 O PRO B 14 64.939 28.954 39.600 1.00 52.87 O ATOM 1824 CB PRO B 14 64.849 30.485 42.299 1.00 56.28 C ATOM 1825 CG PRO B 14 66.075 30.524 43.152 1.00 59.72 C ATOM 1826 CD PRO B 14 66.869 29.257 42.908 1.00 58.64 C ATOM 1827 N GLY B 15 62.893 28.394 40.376 1.00 48.75 N ATOM 1828 CA GLY B 15 62.329 28.122 39.071 1.00 48.24 C ATOM 1829 C GLY B 15 62.452 26.696 38.578 1.00 47.29 C ATOM 1830 O GLY B 15 61.842 26.355 37.563 1.00 46.66 O ATOM 1831 H GLY B 15 62.291 28.274 41.215 1.00 0.00 H ATOM 1832 N GLY B 16 63.242 25.857 39.231 1.00 48.92 N ATOM 1833 CA GLY B 16 63.374 24.481 38.815 1.00 49.83 C ATOM 1834 C GLY B 16 62.220 23.619 39.285 1.00 48.65 C ATOM 1835 O GLY B 16 61.248 24.093 39.867 1.00 46.88 O ATOM 1836 H GLY B 16 63.776 26.195 40.057 1.00 0.00 H ATOM 1837 N SER B 17 62.340 22.318 38.997 1.00 49.89 N ATOM 1838 CA SER B 17 61.275 21.350 39.236 1.00 48.56 C ATOM 1839 C SER B 17 61.818 20.133 39.980 1.00 45.46 C ATOM 1840 O SER B 17 63.017 19.822 39.955 1.00 47.10 O ATOM 1841 CB SER B 17 60.611 20.876 37.927 1.00 52.10 C ATOM 1842 OG SER B 17 61.269 19.709 37.450 1.00 56.07 O ATOM 1843 HG SER B 17 60.839 19.409 36.610 1.00 0.00 H ATOM 1844 H SER B 17 63.233 21.981 38.584 1.00 0.00 H ATOM 1845 N LEU B 18 60.905 19.450 40.659 1.00 43.94 N ATOM 1846 CA LEU B 18 61.227 18.226 41.366 1.00 42.52 C ATOM 1847 C LEU B 18 59.962 17.403 41.505 1.00 38.94 C ATOM 1848 O LEU B 18 58.880 17.959 41.703 1.00 37.40 O ATOM 1849 CB LEU B 18 61.784 18.518 42.762 1.00 44.30 C ATOM 1850 CG LEU B 18 63.271 18.534 43.024 1.00 50.12 C ATOM 1851 CD1 LEU B 18 63.370 18.897 44.526 1.00 51.18 C ATOM 1852 CD2 LEU B 18 63.921 17.234 42.665 1.00 51.65 C ATOM 1853 H LEU B 18 59.927 19.804 40.685 1.00 0.00 H ATOM 1854 N ARG B 19 60.111 16.083 41.443 1.00 37.99 N ATOM 1855 CA ARG B 19 58.982 15.177 41.651 1.00 34.75 C ATOM 1856 C ARG B 19 59.197 14.353 42.913 1.00 33.19 C ATOM 1857 O ARG B 19 60.163 13.576 42.999 1.00 35.42 O ATOM 1858 CB ARG B 19 58.779 14.240 40.470 1.00 37.96 C ATOM 1859 CG ARG B 19 57.485 13.446 40.535 1.00 39.57 C ATOM 1860 CD ARG B 19 57.237 13.052 39.115 1.00 47.43 C ATOM 1861 NE ARG B 19 56.515 11.810 38.871 1.00 54.32 N ATOM 1862 CZ ARG B 19 57.051 10.597 38.948 1.00 61.07 C ATOM 1863 NH1 ARG B 19 58.310 10.445 39.335 1.00 60.22 N ATOM 1864 NH2 ARG B 19 56.316 9.530 38.651 1.00 67.16 N ATOM 1865 HE ARG B 19 55.508 11.878 38.619 1.00 0.00 H ATOM 1866 HH12 ARG B 19 58.725 9.493 39.394 1.00 0.00 H ATOM 1867 HH11 ARG B 19 58.883 11.278 39.580 1.00 0.00 H ATOM 1868 HH22 ARG B 19 56.732 8.579 38.710 1.00 0.00 H ATOM 1869 HH21 ARG B 19 55.325 9.646 38.359 1.00 0.00 H ATOM 1870 H ARG B 19 61.051 15.686 41.242 1.00 0.00 H ATOM 1871 N LEU B 20 58.320 14.540 43.892 1.00 30.31 N ATOM 1872 CA LEU B 20 58.379 13.756 45.114 1.00 29.98 C ATOM 1873 C LEU B 20 57.495 12.535 44.997 1.00 30.65 C ATOM 1874 O LEU B 20 56.511 12.521 44.251 1.00 29.63 O ATOM 1875 CB LEU B 20 57.966 14.580 46.333 1.00 28.88 C ATOM 1876 CG LEU B 20 58.654 15.923 46.571 1.00 29.42 C ATOM 1877 CD1 LEU B 20 58.155 16.479 47.925 1.00 28.25 C ATOM 1878 CD2 LEU B 20 60.191 15.814 46.498 1.00 32.56 C ATOM 1879 H LEU B 20 57.578 15.260 43.782 1.00 0.00 H ATOM 1880 N SER B 21 57.868 11.488 45.703 1.00 31.47 N ATOM 1881 CA SER B 21 57.091 10.261 45.692 1.00 30.38 C ATOM 1882 C SER B 21 56.690 9.896 47.096 1.00 29.07 C ATOM 1883 O SER B 21 57.475 10.071 48.016 1.00 29.80 O ATOM 1884 CB SER B 21 57.890 9.092 45.083 1.00 33.60 C ATOM 1885 OG SER B 21 58.230 9.300 43.735 1.00 37.41 O ATOM 1886 HG SER B 21 58.739 8.520 43.400 1.00 0.00 H ATOM 1887 H SER B 21 58.733 11.541 46.278 1.00 0.00 H ATOM 1888 N CYS B 22 55.491 9.373 47.248 1.00 28.32 N ATOM 1889 CA CYS B 22 54.964 8.916 48.532 1.00 29.40 C ATOM 1890 C CYS B 22 54.575 7.454 48.363 1.00 32.41 C ATOM 1891 O CYS B 22 53.613 7.160 47.640 1.00 32.19 O ATOM 1892 CB CYS B 22 53.755 9.743 48.977 1.00 27.97 C ATOM 1893 SG CYS B 22 53.169 9.189 50.539 1.00 27.87 S ATOM 1894 H CYS B 22 54.886 9.280 46.408 1.00 0.00 H ATOM 1895 N ALA B 23 55.313 6.549 49.004 1.00 34.47 N ATOM 1896 CA ALA B 23 55.035 5.119 48.927 1.00 37.70 C ATOM 1897 C ALA B 23 54.446 4.605 50.238 1.00 38.77 C ATOM 1898 O ALA B 23 54.757 5.114 51.324 1.00 39.87 O ATOM 1899 CB ALA B 23 56.305 4.325 48.597 1.00 41.05 C ATOM 1900 H ALA B 23 56.116 6.873 49.580 1.00 0.00 H ATOM 1901 N ALA B 24 53.635 3.556 50.133 1.00 37.45 N ATOM 1902 CA ALA B 24 52.994 2.926 51.274 1.00 36.44 C ATOM 1903 C ALA B 24 53.739 1.678 51.733 1.00 40.68 C ATOM 1904 O ALA B 24 54.287 0.918 50.925 1.00 44.09 O ATOM 1905 CB ALA B 24 51.542 2.555 50.947 1.00 34.10 C ATOM 1906 H ALA B 24 53.451 3.167 49.186 1.00 0.00 H ATOM 1907 N SER B 25 53.764 1.478 53.052 1.00 39.94 N ATOM 1908 CA SER B 25 54.359 0.283 53.628 1.00 40.57 C ATOM 1909 C SER B 25 53.586 -0.112 54.874 1.00 39.02 C ATOM 1910 O SER B 25 52.922 0.711 55.513 1.00 36.34 O ATOM 1911 CB SER B 25 55.841 0.508 53.950 1.00 43.04 C ATOM 1912 OG SER B 25 55.971 1.452 55.003 1.00 43.31 O ATOM 1913 HG SER B 25 55.510 1.110 55.810 1.00 0.00 H ATOM 1914 H SER B 25 53.348 2.193 53.682 1.00 0.00 H ATOM 1915 N GLY B 26 53.680 -1.396 55.196 1.00 43.03 N ATOM 1916 CA GLY B 26 53.026 -1.969 56.342 1.00 44.74 C ATOM 1917 C GLY B 26 51.683 -2.545 55.951 1.00 43.56 C ATOM 1918 O GLY B 26 51.272 -2.545 54.789 1.00 43.46 O ATOM 1919 H GLY B 26 54.254 -2.018 54.591 1.00 0.00 H ATOM 1920 N TYR B 27 50.991 -3.039 56.964 1.00 42.60 N ATOM 1921 CA TYR B 27 49.744 -3.761 56.790 1.00 43.02 C ATOM 1922 C TYR B 27 48.638 -2.978 57.476 1.00 41.35 C ATOM 1923 O TYR B 27 48.810 -2.475 58.586 1.00 41.77 O ATOM 1924 CB TYR B 27 49.843 -5.189 57.372 1.00 47.21 C ATOM 1925 CG TYR B 27 48.511 -5.914 57.334 1.00 48.19 C ATOM 1926 CD1 TYR B 27 47.550 -5.654 58.298 1.00 47.59 C ATOM 1927 CD2 TYR B 27 48.210 -6.832 56.334 1.00 50.13 C ATOM 1928 CE1 TYR B 27 46.323 -6.267 58.277 1.00 48.70 C ATOM 1929 CE2 TYR B 27 46.966 -7.479 56.303 1.00 51.30 C ATOM 1930 CZ TYR B 27 46.027 -7.190 57.292 1.00 50.61 C ATOM 1931 OH TYR B 27 44.770 -7.776 57.332 1.00 51.96 O ATOM 1932 HH TYR B 27 44.279 -7.557 56.501 1.00 0.00 H ATOM 1933 H TYR B 27 51.357 -2.904 57.928 1.00 0.00 H ATOM 1934 N GLY B 28 47.488 -2.916 56.838 1.00 39.56 N ATOM 1935 CA GLY B 28 46.324 -2.317 57.458 1.00 38.45 C ATOM 1936 C GLY B 28 45.391 -1.791 56.390 1.00 36.96 C ATOM 1937 O GLY B 28 45.611 -1.993 55.207 1.00 36.21 O ATOM 1938 H GLY B 28 47.414 -3.303 55.875 1.00 0.00 H ATOM 1939 N SER B 29 44.343 -1.108 56.832 1.00 38.39 N ATOM 1940 CA SER B 29 43.353 -0.612 55.879 1.00 40.13 C ATOM 1941 C SER B 29 43.996 0.404 54.934 1.00 37.99 C ATOM 1942 O SER B 29 44.831 1.221 55.337 1.00 35.47 O ATOM 1943 CB SER B 29 42.165 -0.003 56.628 1.00 43.99 C ATOM 1944 OG SER B 29 42.626 0.783 57.703 1.00 47.38 O ATOM 1945 HG SER B 29 43.148 0.216 58.324 1.00 0.00 H ATOM 1946 H SER B 29 44.227 -0.927 57.850 1.00 0.00 H ATOM 1947 N THR B 30 43.611 0.334 53.659 1.00 39.12 N ATOM 1948 CA THR B 30 44.148 1.227 52.643 1.00 39.32 C ATOM 1949 C THR B 30 43.915 2.687 53.031 1.00 34.67 C ATOM 1950 O THR B 30 42.872 3.042 53.593 1.00 35.30 O ATOM 1951 CB THR B 30 43.464 0.966 51.304 1.00 44.72 C ATOM 1952 OG1 THR B 30 42.074 1.331 51.427 1.00 50.81 O ATOM 1953 CG2 THR B 30 43.559 -0.488 50.917 1.00 45.16 C ATOM 1954 HG1 THR B 30 42.005 2.290 51.663 1.00 0.00 H ATOM 1955 H THR B 30 42.907 -0.379 53.383 1.00 0.00 H ATOM 1956 N ILE B 31 44.866 3.539 52.673 1.00 30.42 N ATOM 1957 CA ILE B 31 44.723 4.977 52.843 1.00 27.80 C ATOM 1958 C ILE B 31 44.068 5.538 51.583 1.00 25.94 C ATOM 1959 O ILE B 31 44.689 5.583 50.518 1.00 26.04 O ATOM 1960 CB ILE B 31 46.072 5.649 53.102 1.00 28.85 C ATOM 1961 CG1 ILE B 31 46.639 5.163 54.425 1.00 31.57 C ATOM 1962 CG2 ILE B 31 45.914 7.178 53.133 1.00 27.97 C ATOM 1963 CD1 ILE B 31 48.013 5.669 54.646 1.00 32.30 C ATOM 1964 H ILE B 31 45.743 3.167 52.257 1.00 0.00 H ATOM 1965 N GLU B 32 42.819 5.990 51.698 1.00 25.14 N ATOM 1966 CA GLU B 32 42.103 6.490 50.535 1.00 25.78 C ATOM 1967 C GLU B 32 42.395 7.958 50.237 1.00 23.41 C ATOM 1968 O GLU B 32 42.278 8.389 49.069 1.00 24.38 O ATOM 1969 CB GLU B 32 40.598 6.284 50.742 1.00 27.31 C ATOM 1970 CG GLU B 32 40.164 4.812 50.744 1.00 31.36 C ATOM 1971 CD GLU B 32 40.346 4.117 49.412 1.00 36.83 C ATOM 1972 OE1 GLU B 32 40.503 4.795 48.363 1.00 37.80 O ATOM 1973 OE2 GLU B 32 40.286 2.865 49.411 1.00 41.37 O ATOM 1974 H GLU B 32 42.353 5.985 52.628 1.00 0.00 H ATOM 1975 N THR B 33 42.710 8.730 51.265 1.00 21.52 N ATOM 1976 CA THR B 33 42.911 10.163 51.174 1.00 19.90 C ATOM 1977 C THR B 33 44.235 10.453 51.846 1.00 18.72 C ATOM 1978 O THR B 33 44.379 10.200 53.044 1.00 21.70 O ATOM 1979 CB THR B 33 41.779 10.928 51.845 1.00 21.18 C ATOM 1980 OG1 THR B 33 40.543 10.483 51.254 1.00 21.86 O ATOM 1981 CG2 THR B 33 41.949 12.413 51.556 1.00 21.77 C ATOM 1982 HG1 THR B 33 40.558 10.669 50.282 1.00 0.00 H ATOM 1983 H THR B 33 42.820 8.281 52.196 1.00 0.00 H ATOM 1984 N MET B 34 45.168 10.933 51.070 1.00 23.98 N ATOM 1985 CA MET B 34 46.481 11.241 51.630 1.00 24.03 C ATOM 1986 C MET B 34 46.832 12.666 51.293 1.00 22.49 C ATOM 1987 O MET B 34 46.358 13.250 50.331 1.00 23.50 O ATOM 1988 CB MET B 34 47.519 10.283 51.074 1.00 25.97 C ATOM 1989 CG MET B 34 47.732 10.421 49.585 1.00 28.52 C ATOM 1990 SD MET B 34 48.763 11.850 49.224 1.00 29.77 S ATOM 1991 CE MET B 34 50.405 11.300 49.788 1.00 30.35 C ATOM 1992 H MET B 34 44.978 11.095 50.060 1.00 0.00 H ATOM 1993 N GLY B 35 47.753 13.225 52.092 1.00 21.51 N ATOM 1994 CA GLY B 35 48.206 14.569 51.864 1.00 20.76 C ATOM 1995 C GLY B 35 49.720 14.662 51.973 1.00 20.64 C ATOM 1996 O GLY B 35 50.387 13.817 52.580 1.00 22.70 O ATOM 1997 H GLY B 35 48.144 12.679 52.886 1.00 0.00 H ATOM 1998 N TRP B 36 50.220 15.690 51.323 1.00 19.92 N ATOM 1999 CA TRP B 36 51.551 16.223 51.464 1.00 21.05 C ATOM 2000 C TRP B 36 51.537 17.381 52.440 1.00 20.98 C ATOM 2001 O TRP B 36 50.684 18.247 52.377 1.00 20.48 O ATOM 2002 CB TRP B 36 52.063 16.674 50.105 1.00 21.31 C ATOM 2003 CG TRP B 36 52.421 15.545 49.234 1.00 22.69 C ATOM 2004 CD1 TRP B 36 51.624 15.015 48.228 1.00 23.36 C ATOM 2005 CD2 TRP B 36 53.636 14.795 49.209 1.00 22.82 C ATOM 2006 NE1 TRP B 36 52.258 13.973 47.637 1.00 24.27 N ATOM 2007 CE2 TRP B 36 53.512 13.824 48.181 1.00 24.30 C ATOM 2008 CE3 TRP B 36 54.827 14.845 49.948 1.00 24.01 C ATOM 2009 CZ2 TRP B 36 54.530 12.907 47.894 1.00 27.32 C ATOM 2010 CZ3 TRP B 36 55.847 13.933 49.657 1.00 26.97 C ATOM 2011 CH2 TRP B 36 55.681 12.973 48.627 1.00 27.89 C ATOM 2012 HE1 TRP B 36 51.857 13.376 46.886 1.00 0.00 H ATOM 2013 H TRP B 36 49.594 16.164 50.641 1.00 0.00 H ATOM 2014 N PHE B 37 52.507 17.373 53.357 1.00 21.28 N ATOM 2015 CA PHE B 37 52.738 18.357 54.408 1.00 21.22 C ATOM 2016 C PHE B 37 54.192 18.764 54.301 1.00 21.78 C ATOM 2017 O PHE B 37 55.056 17.966 53.883 1.00 24.81 O ATOM 2018 CB PHE B 37 52.479 17.763 55.808 1.00 22.76 C ATOM 2019 CG PHE B 37 51.016 17.381 55.999 1.00 22.68 C ATOM 2020 CD1 PHE B 37 50.589 16.165 55.535 1.00 22.65 C ATOM 2021 CD2 PHE B 37 50.136 18.268 56.579 1.00 23.74 C ATOM 2022 CE1 PHE B 37 49.239 15.831 55.634 1.00 23.52 C ATOM 2023 CE2 PHE B 37 48.794 17.941 56.668 1.00 25.01 C ATOM 2024 CZ PHE B 37 48.379 16.707 56.228 1.00 24.84 C ATOM 2025 H PHE B 37 53.173 16.575 53.317 1.00 0.00 H ATOM 2026 N ARG B 38 54.483 19.985 54.716 1.00 21.68 N ATOM 2027 CA ARG B 38 55.890 20.387 54.766 1.00 22.43 C ATOM 2028 C ARG B 38 56.168 21.214 56.007 1.00 22.95 C ATOM 2029 O ARG B 38 55.300 21.857 56.576 1.00 22.93 O ATOM 2030 CB ARG B 38 56.282 21.164 53.505 1.00 22.96 C ATOM 2031 CG ARG B 38 55.646 22.544 53.397 1.00 23.24 C ATOM 2032 CD ARG B 38 55.955 23.132 52.041 1.00 24.51 C ATOM 2033 NE ARG B 38 55.298 24.432 51.853 1.00 26.84 N ATOM 2034 CZ ARG B 38 55.282 25.103 50.707 1.00 28.83 C ATOM 2035 NH1 ARG B 38 55.834 24.583 49.624 1.00 29.95 N ATOM 2036 NH2 ARG B 38 54.717 26.300 50.649 1.00 30.65 N ATOM 2037 HE ARG B 38 54.814 24.855 52.671 1.00 0.00 H ATOM 2038 HH12 ARG B 38 55.820 25.111 48.728 1.00 0.00 H ATOM 2039 HH11 ARG B 38 56.283 23.646 49.668 1.00 0.00 H ATOM 2040 HH22 ARG B 38 54.704 26.826 49.752 1.00 0.00 H ATOM 2041 HH21 ARG B 38 54.286 26.714 51.501 1.00 0.00 H ATOM 2042 H ARG B 38 53.730 20.644 55.000 1.00 0.00 H ATOM 2043 N GLN B 39 57.428 21.173 56.416 1.00 23.94 N ATOM 2044 CA GLN B 39 57.883 21.791 57.667 1.00 25.00 C ATOM 2045 C GLN B 39 59.202 22.506 57.441 1.00 27.42 C ATOM 2046 O GLN B 39 60.203 21.875 57.101 1.00 27.70 O ATOM 2047 CB GLN B 39 58.009 20.743 58.777 1.00 25.81 C ATOM 2048 CG GLN B 39 58.433 21.328 60.102 1.00 28.34 C ATOM 2049 CD GLN B 39 57.374 22.134 60.784 1.00 29.50 C ATOM 2050 OE1 GLN B 39 56.345 21.588 61.208 1.00 30.59 O ATOM 2051 NE2 GLN B 39 57.594 23.446 60.880 1.00 30.15 N ATOM 2052 HE22 GLN B 39 58.475 23.854 60.508 1.00 0.00 H ATOM 2053 HE21 GLN B 39 56.884 24.061 61.327 1.00 0.00 H ATOM 2054 H GLN B 39 58.126 20.680 55.823 1.00 0.00 H ATOM 2055 N ALA B 40 59.223 23.809 57.706 1.00 32.97 N ATOM 2056 CA ALA B 40 60.431 24.624 57.624 1.00 38.90 C ATOM 2057 C ALA B 40 60.758 25.196 58.999 1.00 38.64 C ATOM 2058 O ALA B 40 59.848 25.378 59.815 1.00 36.53 O ATOM 2059 CB ALA B 40 60.247 25.767 56.618 1.00 43.02 C ATOM 2060 H ALA B 40 58.334 24.270 57.986 1.00 0.00 H ATOM 2061 N PRO B 41 62.033 25.467 59.292 1.00 41.02 N ATOM 2062 CA PRO B 41 62.385 25.989 60.623 1.00 42.52 C ATOM 2063 C PRO B 41 61.609 27.257 60.936 1.00 44.61 C ATOM 2064 O PRO B 41 61.500 28.157 60.108 1.00 44.86 O ATOM 2065 CB PRO B 41 63.889 26.264 60.522 1.00 44.37 C ATOM 2066 CG PRO B 41 64.390 25.366 59.442 1.00 45.33 C ATOM 2067 CD PRO B 41 63.232 25.227 58.455 1.00 42.84 C ATOM 2068 N GLY B 42 61.062 27.314 62.140 1.00 49.08 N ATOM 2069 CA GLY B 42 60.388 28.504 62.623 1.00 54.02 C ATOM 2070 C GLY B 42 58.910 28.604 62.307 1.00 56.09 C ATOM 2071 O GLY B 42 58.134 29.082 63.136 1.00 60.62 O ATOM 2072 H GLY B 42 61.117 26.480 62.759 1.00 0.00 H ATOM 2073 N LYS B 43 58.497 28.121 61.138 1.00 51.84 N ATOM 2074 CA LYS B 43 57.114 28.247 60.690 1.00 48.70 C ATOM 2075 C LYS B 43 56.284 27.048 61.161 1.00 42.35 C ATOM 2076 O LYS B 43 56.810 26.025 61.582 1.00 39.88 O ATOM 2077 CB LYS B 43 57.067 28.384 59.163 1.00 52.34 C ATOM 2078 CG LYS B 43 58.212 29.206 58.535 1.00 57.28 C ATOM 2079 CD LYS B 43 57.955 29.568 57.055 1.00 59.58 C ATOM 2080 CE LYS B 43 59.259 29.663 56.247 1.00 59.20 C ATOM 2081 NZ LYS B 43 59.097 30.071 54.809 1.00 58.74 N ATOM 2082 HZ1 LYS B 43 58.496 29.378 54.319 1.00 0.00 H ATOM 2083 HZ2 LYS B 43 58.653 31.010 54.764 1.00 0.00 H ATOM 2084 HZ3 LYS B 43 60.031 30.106 54.352 1.00 0.00 H ATOM 2085 H LYS B 43 59.183 27.638 60.523 1.00 0.00 H ATOM 2086 N GLU B 44 54.960 27.196 61.132 1.00 41.89 N ATOM 2087 CA GLU B 44 54.094 26.069 61.468 1.00 40.42 C ATOM 2088 C GLU B 44 54.116 25.032 60.333 1.00 35.94 C ATOM 2089 O GLU B 44 54.525 25.320 59.200 1.00 36.34 O ATOM 2090 CB GLU B 44 52.653 26.540 61.740 1.00 44.97 C ATOM 2091 CG GLU B 44 52.471 27.357 63.036 1.00 51.83 C ATOM 2092 CD GLU B 44 52.931 26.610 64.279 1.00 58.93 C ATOM 2093 OE1 GLU B 44 52.266 25.618 64.651 1.00 62.77 O ATOM 2094 OE2 GLU B 44 53.953 27.009 64.880 1.00 61.75 O ATOM 2095 H GLU B 44 54.544 28.113 60.871 1.00 0.00 H ATOM 2096 N ARG B 45 53.757 23.794 60.671 1.00 32.90 N ATOM 2097 CA ARG B 45 53.607 22.756 59.662 1.00 30.29 C ATOM 2098 C ARG B 45 52.527 23.174 58.665 1.00 29.82 C ATOM 2099 O ARG B 45 51.462 23.665 59.046 1.00 33.05 O ATOM 2100 CB ARG B 45 53.236 21.412 60.289 1.00 30.79 C ATOM 2101 CG ARG B 45 53.227 20.288 59.285 1.00 29.91 C ATOM 2102 CD ARG B 45 52.539 19.106 59.841 1.00 34.44 C ATOM 2103 NE ARG B 45 51.132 19.427 59.725 1.00 37.33 N ATOM 2104 CZ ARG B 45 50.162 18.853 60.401 1.00 38.71 C ATOM 2105 NH1 ARG B 45 50.468 17.919 61.294 1.00 42.29 N ATOM 2106 NH2 ARG B 45 48.915 19.226 60.181 1.00 36.55 N ATOM 2107 HE ARG B 45 50.867 20.173 59.051 1.00 0.00 H ATOM 2108 HH12 ARG B 45 49.714 17.453 61.839 1.00 0.00 H ATOM 2109 HH11 ARG B 45 51.461 17.653 61.449 1.00 0.00 H ATOM 2110 HH22 ARG B 45 48.138 18.780 60.709 1.00 0.00 H ATOM 2111 HH21 ARG B 45 48.710 19.966 59.480 1.00 0.00 H ATOM 2112 H ARG B 45 53.581 23.566 61.670 1.00 0.00 H ATOM 2113 N GLU B 46 52.787 22.937 57.390 1.00 28.67 N ATOM 2114 CA GLU B 46 51.910 23.453 56.343 1.00 27.43 C ATOM 2115 C GLU B 46 51.364 22.323 55.502 1.00 25.98 C ATOM 2116 O GLU B 46 52.125 21.536 54.928 1.00 25.29 O ATOM 2117 CB GLU B 46 52.685 24.455 55.489 1.00 29.95 C ATOM 2118 CG GLU B 46 51.812 25.215 54.503 1.00 29.67 C ATOM 2119 CD GLU B 46 52.555 26.219 53.649 1.00 33.32 C ATOM 2120 OE1 GLU B 46 53.791 26.189 53.615 1.00 33.63 O ATOM 2121 OE2 GLU B 46 51.842 27.010 52.973 1.00 34.90 O ATOM 2122 H GLU B 46 53.624 22.378 57.131 1.00 0.00 H ATOM 2123 N PHE B 47 50.024 22.315 55.357 1.00 23.53 N ATOM 2124 CA PHE B 47 49.370 21.454 54.396 1.00 21.46 C ATOM 2125 C PHE B 47 49.634 21.943 52.978 1.00 21.08 C ATOM 2126 O PHE B 47 49.593 23.145 52.704 1.00 22.36 O ATOM 2127 CB PHE B 47 47.866 21.443 54.651 1.00 21.07 C ATOM 2128 CG PHE B 47 47.122 20.796 53.551 1.00 20.39 C ATOM 2129 CD1 PHE B 47 47.146 19.435 53.496 1.00 20.75 C ATOM 2130 CD2 PHE B 47 46.501 21.513 52.519 1.00 21.18 C ATOM 2131 CE1 PHE B 47 46.510 18.747 52.458 1.00 19.90 C ATOM 2132 CE2 PHE B 47 45.876 20.825 51.442 1.00 20.59 C ATOM 2133 CZ PHE B 47 45.885 19.451 51.413 1.00 19.83 C ATOM 2134 H PHE B 47 49.446 22.943 55.951 1.00 0.00 H ATOM 2135 N VAL B 48 50.013 21.017 52.072 1.00 21.35 N ATOM 2136 CA VAL B 48 50.427 21.363 50.710 1.00 21.76 C ATOM 2137 C VAL B 48 49.376 20.901 49.711 1.00 22.32 C ATOM 2138 O VAL B 48 48.861 21.697 48.916 1.00 21.52 O ATOM 2139 CB VAL B 48 51.822 20.761 50.390 1.00 23.20 C ATOM 2140 CG1 VAL B 48 52.230 20.995 48.921 1.00 23.44 C ATOM 2141 CG2 VAL B 48 52.880 21.332 51.336 1.00 25.25 C ATOM 2142 H VAL B 48 50.011 20.016 52.353 1.00 0.00 H ATOM 2143 N SER B 49 49.035 19.625 49.739 1.00 20.54 N ATOM 2144 CA SER B 49 48.150 19.099 48.705 1.00 20.32 C ATOM 2145 C SER B 49 47.620 17.759 49.153 1.00 18.98 C ATOM 2146 O SER B 49 48.229 17.066 49.981 1.00 18.58 O ATOM 2147 CB SER B 49 48.936 18.956 47.393 1.00 20.45 C ATOM 2148 OG SER B 49 48.084 18.429 46.368 1.00 20.94 O ATOM 2149 HG SER B 49 47.321 19.044 46.227 1.00 0.00 H ATOM 2150 H SER B 49 49.394 19.002 50.490 1.00 0.00 H ATOM 2151 N ALA B 50 46.469 17.380 48.590 1.00 18.64 N ATOM 2152 CA ALA B 50 45.938 16.069 48.911 1.00 17.93 C ATOM 2153 C ALA B 50 45.173 15.500 47.717 1.00 18.68 C ATOM 2154 O ALA B 50 44.795 16.225 46.800 1.00 19.33 O ATOM 2155 CB ALA B 50 44.997 16.083 50.130 1.00 16.39 C ATOM 2156 H ALA B 50 45.965 18.012 47.936 1.00 0.00 H ATOM 2157 N ILE B 51 44.971 14.176 47.778 1.00 19.46 N ATOM 2158 CA ILE B 51 44.256 13.410 46.739 1.00 18.31 C ATOM 2159 C ILE B 51 43.436 12.342 47.440 1.00 19.79 C ATOM 2160 O ILE B 51 43.853 11.788 48.458 1.00 20.05 O ATOM 2161 CB ILE B 51 45.243 12.837 45.710 1.00 18.80 C ATOM 2162 CG1 ILE B 51 44.493 12.195 44.529 1.00 20.81 C ATOM 2163 CG2 ILE B 51 46.250 11.807 46.360 1.00 19.85 C ATOM 2164 CD1 ILE B 51 45.290 12.025 43.333 1.00 24.01 C ATOM 2165 H ILE B 51 45.338 13.660 48.603 1.00 0.00 H ATOM 2166 N SER B 52 42.249 12.060 46.918 1.00 19.36 N ATOM 2167 CA SER B 52 41.348 11.140 47.562 1.00 18.67 C ATOM 2168 C SER B 52 40.939 10.137 46.502 1.00 19.50 C ATOM 2169 O SER B 52 41.732 9.776 45.621 1.00 22.04 O ATOM 2170 CB SER B 52 40.220 11.943 48.179 1.00 17.52 C ATOM 2171 OG SER B 52 39.348 11.150 48.918 1.00 17.84 O ATOM 2172 HG SER B 52 39.846 10.708 49.651 1.00 0.00 H ATOM 2173 H SER B 52 41.964 12.513 46.026 1.00 0.00 H ATOM 2174 N ARG B 53 39.662 9.754 46.518 1.00 20.06 N ATOM 2175 CA ARG B 53 39.228 8.646 45.671 1.00 20.82 C ATOM 2176 C ARG B 53 38.973 9.043 44.218 1.00 21.99 C ATOM 2177 O ARG B 53 39.050 8.194 43.314 1.00 24.61 O ATOM 2178 CB ARG B 53 37.945 8.035 46.245 1.00 21.98 C ATOM 2179 CG ARG B 53 38.087 7.415 47.643 1.00 22.35 C ATOM 2180 CD ARG B 53 36.791 6.888 48.165 1.00 23.12 C ATOM 2181 NE ARG B 53 36.841 6.446 49.567 1.00 23.34 N ATOM 2182 CZ ARG B 53 36.886 7.248 50.615 1.00 22.30 C ATOM 2183 NH1 ARG B 53 36.850 8.559 50.446 1.00 20.24 N ATOM 2184 NH2 ARG B 53 36.929 6.738 51.853 1.00 22.51 N ATOM 2185 HE ARG B 53 36.841 5.422 49.747 1.00 0.00 H ATOM 2186 HH12 ARG B 53 36.885 9.191 51.271 1.00 0.00 H ATOM 2187 HH11 ARG B 53 36.786 8.958 49.488 1.00 0.00 H ATOM 2188 HH22 ARG B 53 36.964 7.373 52.676 1.00 0.00 H ATOM 2189 HH21 ARG B 53 36.927 5.707 51.991 1.00 0.00 H ATOM 2190 H ARG B 53 38.978 10.242 47.131 1.00 0.00 H ATOM 2191 N ALA B 54 38.668 10.321 43.998 1.00 21.01 N ATOM 2192 CA ALA B 54 38.269 10.783 42.664 1.00 23.16 C ATOM 2193 C ALA B 54 39.491 11.162 41.855 1.00 25.54 C ATOM 2194 O ALA B 54 40.275 12.015 42.293 1.00 25.34 O ATOM 2195 CB ALA B 54 37.352 11.977 42.771 1.00 22.57 C ATOM 2196 H ALA B 54 38.713 11.001 44.783 1.00 0.00 H ATOM 2197 N PRO B 55 39.696 10.568 40.695 1.00 29.89 N ATOM 2198 CA PRO B 55 40.838 10.950 39.867 1.00 33.09 C ATOM 2199 C PRO B 55 40.512 12.229 39.118 1.00 34.10 C ATOM 2200 O PRO B 55 39.407 12.762 39.192 1.00 35.25 O ATOM 2201 CB PRO B 55 41.003 9.753 38.938 1.00 36.68 C ATOM 2202 CG PRO B 55 39.609 9.256 38.756 1.00 37.28 C ATOM 2203 CD PRO B 55 38.863 9.537 40.051 1.00 34.07 C ATOM 2204 N GLY B 56 41.509 12.751 38.440 1.00 32.82 N ATOM 2205 CA GLY B 56 41.254 13.859 37.545 1.00 31.75 C ATOM 2206 C GLY B 56 41.973 15.088 38.045 1.00 28.89 C ATOM 2207 O GLY B 56 42.657 15.055 39.060 1.00 28.45 O ATOM 2208 H GLY B 56 42.472 12.372 38.546 1.00 0.00 H ATOM 2209 N PRO B 57 41.810 16.209 37.342 1.00 29.94 N ATOM 2210 CA PRO B 57 42.626 17.385 37.664 1.00 27.85 C ATOM 2211 C PRO B 57 42.166 18.123 38.896 1.00 26.22 C ATOM 2212 O PRO B 57 42.971 18.851 39.473 1.00 27.02 O ATOM 2213 CB PRO B 57 42.469 18.276 36.420 1.00 30.28 C ATOM 2214 CG PRO B 57 41.193 17.892 35.857 1.00 32.65 C ATOM 2215 CD PRO B 57 41.076 16.394 36.093 1.00 32.63 C ATOM 2216 N SER B 58 40.917 17.977 39.321 1.00 24.95 N ATOM 2217 CA SER B 58 40.448 18.699 40.514 1.00 22.23 C ATOM 2218 C SER B 58 40.926 17.952 41.750 1.00 20.71 C ATOM 2219 O SER B 58 40.522 16.813 42.003 1.00 21.60 O ATOM 2220 CB SER B 58 38.920 18.871 40.477 1.00 24.50 C ATOM 2221 OG SER B 58 38.537 19.666 41.602 1.00 23.99 O ATOM 2222 HG SER B 58 37.555 19.790 41.598 1.00 0.00 H ATOM 2223 H SER B 58 40.266 17.349 38.808 1.00 0.00 H ATOM 2224 N GLN B 59 41.829 18.567 42.519 1.00 20.61 N ATOM 2225 CA GLN B 59 42.335 17.939 43.726 1.00 18.26 C ATOM 2226 C GLN B 59 42.366 19.008 44.821 1.00 18.65 C ATOM 2227 O GLN B 59 41.836 20.116 44.683 1.00 19.27 O ATOM 2228 CB GLN B 59 43.721 17.290 43.493 1.00 19.39 C ATOM 2229 CG GLN B 59 43.686 16.243 42.398 1.00 21.22 C ATOM 2230 CD GLN B 59 42.805 15.069 42.811 1.00 21.29 C ATOM 2231 OE1 GLN B 59 42.502 14.926 44.001 1.00 21.40 O ATOM 2232 NE2 GLN B 59 42.418 14.212 41.859 1.00 22.67 N ATOM 2233 HE22 GLN B 59 42.697 14.373 40.870 1.00 0.00 H ATOM 2234 HE21 GLN B 59 41.838 13.385 42.108 1.00 0.00 H ATOM 2235 H GLN B 59 42.175 19.510 42.249 1.00 0.00 H ATOM 2236 N TYR B 60 43.055 18.711 45.901 1.00 18.42 N ATOM 2237 CA TYR B 60 43.122 19.613 47.042 1.00 19.03 C ATOM 2238 C TYR B 60 44.487 20.293 47.030 1.00 18.70 C ATOM 2239 O TYR B 60 45.529 19.616 47.023 1.00 19.83 O ATOM 2240 CB TYR B 60 42.951 18.870 48.362 1.00 17.70 C ATOM 2241 CG TYR B 60 41.688 18.072 48.498 1.00 16.48 C ATOM 2242 CD1 TYR B 60 41.614 16.806 47.984 1.00 17.34 C ATOM 2243 CD2 TYR B 60 40.576 18.587 49.129 1.00 16.28 C ATOM 2244 CE1 TYR B 60 40.495 16.048 48.128 1.00 17.34 C ATOM 2245 CE2 TYR B 60 39.429 17.819 49.270 1.00 16.25 C ATOM 2246 CZ TYR B 60 39.422 16.551 48.792 1.00 16.47 C ATOM 2247 OH TYR B 60 38.292 15.768 48.929 1.00 17.37 O ATOM 2248 HH TYR B 60 38.458 14.878 48.528 1.00 0.00 H ATOM 2249 H TYR B 60 43.566 17.806 45.941 1.00 0.00 H ATOM 2250 N TYR B 61 44.490 21.622 46.946 1.00 19.04 N ATOM 2251 CA TYR B 61 45.751 22.339 46.911 1.00 19.99 C ATOM 2252 C TYR B 61 45.718 23.567 47.803 1.00 19.80 C ATOM 2253 O TYR B 61 44.813 24.404 47.714 1.00 20.10 O ATOM 2254 CB TYR B 61 46.073 22.814 45.491 1.00 21.82 C ATOM 2255 CG TYR B 61 46.354 21.734 44.514 1.00 22.18 C ATOM 2256 CD1 TYR B 61 47.542 21.025 44.520 1.00 22.85 C ATOM 2257 CD2 TYR B 61 45.392 21.392 43.588 1.00 23.24 C ATOM 2258 CE1 TYR B 61 47.779 20.041 43.612 1.00 22.83 C ATOM 2259 CE2 TYR B 61 45.618 20.400 42.685 1.00 24.39 C ATOM 2260 CZ TYR B 61 46.829 19.742 42.670 1.00 23.25 C ATOM 2261 OH TYR B 61 47.088 18.737 41.775 1.00 24.53 O ATOM 2262 HH TYR B 61 47.011 19.090 40.853 1.00 0.00 H ATOM 2263 H TYR B 61 43.592 22.144 46.906 1.00 0.00 H ATOM 2264 N ALA B 62 46.765 23.732 48.619 1.00 20.27 N ATOM 2265 CA ALA B 62 46.950 25.007 49.282 1.00 21.29 C ATOM 2266 C ALA B 62 47.106 26.120 48.256 1.00 21.92 C ATOM 2267 O ALA B 62 47.751 25.952 47.227 1.00 23.28 O ATOM 2268 CB ALA B 62 48.235 24.978 50.153 1.00 22.32 C ATOM 2269 H ALA B 62 47.438 22.955 48.776 1.00 0.00 H ATOM 2270 N ASP B 63 46.582 27.293 48.577 1.00 23.77 N ATOM 2271 CA ASP B 63 46.728 28.419 47.673 1.00 27.87 C ATOM 2272 C ASP B 63 48.195 28.684 47.346 1.00 31.85 C ATOM 2273 O ASP B 63 48.495 29.126 46.235 1.00 34.68 O ATOM 2274 CB ASP B 63 46.073 29.659 48.277 1.00 31.39 C ATOM 2275 CG ASP B 63 44.549 29.586 48.266 1.00 35.25 C ATOM 2276 OD1 ASP B 63 43.978 28.628 47.691 1.00 35.15 O ATOM 2277 OD2 ASP B 63 43.922 30.478 48.854 1.00 38.32 O ATOM 2278 H ASP B 63 46.068 27.407 49.474 1.00 0.00 H ATOM 2279 N SER B 64 49.105 28.377 48.285 1.00 32.75 N ATOM 2280 CA SER B 64 50.541 28.654 48.136 1.00 34.80 C ATOM 2281 C SER B 64 51.172 27.896 46.986 1.00 33.76 C ATOM 2282 O SER B 64 52.256 28.274 46.518 1.00 35.36 O ATOM 2283 CB SER B 64 51.314 28.272 49.402 1.00 34.82 C ATOM 2284 OG SER B 64 51.023 26.918 49.804 1.00 35.18 O ATOM 2285 HG SER B 64 51.536 26.701 50.623 1.00 0.00 H ATOM 2286 H SER B 64 48.778 27.921 49.160 1.00 0.00 H ATOM 2287 N VAL B 65 50.542 26.824 46.527 1.00 30.28 N ATOM 2288 CA VAL B 65 51.149 25.956 45.527 1.00 29.78 C ATOM 2289 C VAL B 65 50.257 25.740 44.335 1.00 29.64 C ATOM 2290 O VAL B 65 50.695 25.105 43.364 1.00 30.27 O ATOM 2291 CB VAL B 65 51.570 24.599 46.138 1.00 29.10 C ATOM 2292 CG1 VAL B 65 52.443 24.834 47.370 1.00 29.19 C ATOM 2293 CG2 VAL B 65 50.360 23.738 46.485 1.00 28.35 C ATOM 2294 H VAL B 65 49.594 26.598 46.889 1.00 0.00 H ATOM 2295 N LYS B 66 49.035 26.255 44.381 1.00 29.08 N ATOM 2296 CA LYS B 66 48.109 26.093 43.266 1.00 30.94 C ATOM 2297 C LYS B 66 48.747 26.507 41.962 1.00 32.29 C ATOM 2298 O LYS B 66 49.321 27.588 41.859 1.00 34.84 O ATOM 2299 CB LYS B 66 46.859 26.942 43.476 1.00 34.14 C ATOM 2300 CG LYS B 66 45.808 26.273 44.290 1.00 35.29 C ATOM 2301 CD LYS B 66 44.507 27.063 44.216 1.00 38.01 C ATOM 2302 CE LYS B 66 43.520 26.610 45.299 1.00 36.88 C ATOM 2303 NZ LYS B 66 42.289 27.498 45.409 1.00 37.10 N ATOM 2304 HZ1 LYS B 66 42.583 28.468 45.641 1.00 0.00 H ATOM 2305 HZ2 LYS B 66 41.780 27.496 44.502 1.00 0.00 H ATOM 2306 HZ3 LYS B 66 41.667 27.134 46.159 1.00 0.00 H ATOM 2307 H LYS B 66 48.733 26.782 45.225 1.00 0.00 H ATOM 2308 N GLY B 67 48.577 25.669 40.941 1.00 32.32 N ATOM 2309 CA GLY B 67 49.090 25.927 39.624 1.00 34.05 C ATOM 2310 C GLY B 67 50.548 25.575 39.430 1.00 35.01 C ATOM 2311 O GLY B 67 50.986 25.418 38.289 1.00 37.68 O ATOM 2312 H GLY B 67 48.049 24.788 41.104 1.00 0.00 H ATOM 2313 N ARG B 68 51.311 25.454 40.509 1.00 34.03 N ATOM 2314 CA ARG B 68 52.699 25.049 40.402 1.00 33.36 C ATOM 2315 C ARG B 68 52.917 23.589 40.773 1.00 31.15 C ATOM 2316 O ARG B 68 53.861 22.953 40.254 1.00 31.60 O ATOM 2317 CB ARG B 68 53.581 25.922 41.309 1.00 33.42 C ATOM 2318 CG ARG B 68 53.416 27.441 41.107 1.00 34.60 C ATOM 2319 CD ARG B 68 54.435 28.251 41.949 1.00 35.95 C ATOM 2320 NE ARG B 68 54.176 28.128 43.379 1.00 35.11 N ATOM 2321 CZ ARG B 68 55.060 27.657 44.262 1.00 35.58 C ATOM 2322 NH1 ARG B 68 56.280 27.304 43.874 1.00 35.96 N ATOM 2323 NH2 ARG B 68 54.711 27.573 45.534 1.00 34.88 N ATOM 2324 HE ARG B 68 53.245 28.426 43.733 1.00 0.00 H ATOM 2325 HH12 ARG B 68 56.961 26.938 44.569 1.00 0.00 H ATOM 2326 HH11 ARG B 68 56.554 27.393 42.875 1.00 0.00 H ATOM 2327 HH22 ARG B 68 55.387 27.209 46.236 1.00 0.00 H ATOM 2328 HH21 ARG B 68 53.761 27.871 45.833 1.00 0.00 H ATOM 2329 H ARG B 68 50.907 25.653 41.446 1.00 0.00 H ATOM 2330 N PHE B 69 52.129 23.074 41.701 1.00 29.31 N ATOM 2331 CA PHE B 69 52.274 21.718 42.204 1.00 28.80 C ATOM 2332 C PHE B 69 51.112 20.910 41.649 1.00 28.48 C ATOM 2333 O PHE B 69 49.992 21.405 41.551 1.00 29.04 O ATOM 2334 CB PHE B 69 52.260 21.679 43.750 1.00 27.87 C ATOM 2335 CG PHE B 69 53.478 22.255 44.406 1.00 29.61 C ATOM 2336 CD1 PHE B 69 54.337 23.093 43.746 1.00 32.08 C ATOM 2337 CD2 PHE B 69 53.734 21.939 45.732 1.00 29.79 C ATOM 2338 CE1 PHE B 69 55.502 23.607 44.378 1.00 33.34 C ATOM 2339 CE2 PHE B 69 54.865 22.441 46.384 1.00 32.07 C ATOM 2340 CZ PHE B 69 55.740 23.291 45.709 1.00 33.46 C ATOM 2341 H PHE B 69 51.369 23.668 42.090 1.00 0.00 H ATOM 2342 N THR B 70 51.385 19.671 41.271 1.00 29.59 N ATOM 2343 CA THR B 70 50.354 18.760 40.785 1.00 28.24 C ATOM 2344 C THR B 70 50.502 17.439 41.519 1.00 27.40 C ATOM 2345 O THR B 70 51.597 16.849 41.539 1.00 29.36 O ATOM 2346 CB THR B 70 50.493 18.533 39.281 1.00 32.80 C ATOM 2347 OG1 THR B 70 50.510 19.787 38.603 1.00 34.90 O ATOM 2348 CG2 THR B 70 49.348 17.706 38.788 1.00 33.58 C ATOM 2349 HG1 THR B 70 51.276 20.325 38.926 1.00 0.00 H ATOM 2350 H THR B 70 52.368 19.335 41.322 1.00 0.00 H ATOM 2351 N ILE B 71 49.406 17.052 42.145 1.00 25.92 N ATOM 2352 CA ILE B 71 49.380 15.823 42.902 1.00 24.35 C ATOM 2353 C ILE B 71 48.674 14.769 41.995 1.00 24.89 C ATOM 2354 O ILE B 71 47.679 15.139 41.373 1.00 27.03 O ATOM 2355 CB ILE B 71 48.658 15.929 44.287 1.00 22.63 C ATOM 2356 CG1 ILE B 71 48.933 14.684 45.153 1.00 23.99 C ATOM 2357 CG2 ILE B 71 47.160 16.135 44.087 1.00 22.20 C ATOM 2358 CD1 ILE B 71 48.401 14.778 46.569 1.00 22.98 C ATOM 2359 H ILE B 71 48.550 17.640 42.092 1.00 0.00 H ATOM 2360 N SER B 72 49.218 13.540 41.850 1.00 25.49 N ATOM 2361 CA SER B 72 48.608 12.419 41.046 1.00 27.34 C ATOM 2362 C SER B 72 48.915 11.005 41.659 1.00 30.53 C ATOM 2363 O SER B 72 49.755 10.995 42.530 1.00 30.99 O ATOM 2364 CB SER B 72 49.137 12.475 39.606 1.00 29.38 C ATOM 2365 OG SER B 72 50.548 12.375 39.597 1.00 32.13 O ATOM 2366 HG SER B 72 50.934 13.126 40.113 1.00 0.00 H ATOM 2367 H SER B 72 50.123 13.354 42.328 1.00 0.00 H ATOM 2368 N ARG B 73 48.283 9.901 41.206 1.00 32.14 N ATOM 2369 CA ARG B 73 48.510 8.507 41.695 1.00 34.31 C ATOM 2370 C ARG B 73 49.222 7.725 40.539 1.00 36.73 C ATOM 2371 O ARG B 73 48.924 8.022 39.382 1.00 39.41 O ATOM 2372 CB ARG B 73 47.187 7.783 42.042 1.00 35.08 C ATOM 2373 CG ARG B 73 46.397 8.418 43.179 1.00 32.40 C ATOM 2374 CD ARG B 73 45.096 7.675 43.473 1.00 32.06 C ATOM 2375 NE ARG B 73 44.390 8.222 44.625 1.00 29.50 N ATOM 2376 CZ ARG B 73 44.885 8.143 45.899 1.00 29.49 C ATOM 2377 NH1 ARG B 73 46.130 7.497 46.096 1.00 31.39 N ATOM 2378 NH2 ARG B 73 44.162 8.681 46.988 1.00 28.02 N ATOM 2379 HE ARG B 73 43.474 8.691 44.473 1.00 0.00 H ATOM 2380 HH12 ARG B 73 46.531 7.422 47.053 1.00 0.00 H ATOM 2381 HH11 ARG B 73 46.643 7.098 45.284 1.00 0.00 H ATOM 2382 HH22 ARG B 73 44.548 8.615 47.952 1.00 0.00 H ATOM 2383 HH21 ARG B 73 43.244 9.143 46.826 1.00 0.00 H ATOM 2384 H ARG B 73 47.578 10.032 40.453 1.00 0.00 H ATOM 2385 N ASP B 74 50.119 6.749 40.820 1.00 42.96 N ATOM 2386 CA ASP B 74 50.777 5.929 39.738 1.00 50.90 C ATOM 2387 C ASP B 74 49.783 4.995 38.930 1.00 67.46 C ATOM 2388 O ASP B 74 50.191 4.425 37.907 1.00 77.57 O ATOM 2389 CB ASP B 74 51.996 5.037 40.231 1.00 49.21 C ATOM 2390 CG ASP B 74 52.926 4.543 39.022 1.00 57.52 C ATOM 2391 OD1 ASP B 74 52.558 3.573 38.322 1.00 63.54 O ATOM 2392 OD2 ASP B 74 53.984 5.158 38.713 1.00 59.39 O ATOM 2393 H ASP B 74 50.362 6.559 41.813 1.00 0.00 H ATOM 2394 N ASN B 75 48.530 4.779 39.375 1.00 72.84 N ATOM 2395 CA ASN B 75 47.580 3.889 38.686 1.00 80.29 C ATOM 2396 C ASN B 75 47.956 2.373 38.695 1.00 84.67 C ATOM 2397 O ASN B 75 47.116 1.576 38.284 1.00 88.04 O ATOM 2398 CB ASN B 75 47.019 4.506 37.374 1.00 83.06 C ATOM 2399 CG ASN B 75 45.841 3.704 36.805 1.00 87.75 C ATOM 2400 OD1 ASN B 75 45.348 2.795 37.467 1.00 89.80 O ATOM 2401 ND2 ASN B 75 45.368 4.052 35.601 1.00 90.58 N ATOM 2402 HD22 ASN B 75 45.814 4.828 35.072 1.00 0.00 H ATOM 2403 HD21 ASN B 75 44.555 3.546 35.196 1.00 0.00 H ATOM 2404 H ASN B 75 48.220 5.262 40.243 1.00 0.00 H ATOM 2405 N SER B 76 49.159 1.974 39.191 1.00 83.48 N ATOM 2406 CA SER B 76 49.688 0.540 39.205 1.00 85.59 C ATOM 2407 C SER B 76 50.575 0.091 40.498 1.00 80.08 C ATOM 2408 O SER B 76 50.484 -1.067 40.958 1.00 85.70 O ATOM 2409 CB SER B 76 50.680 0.469 37.978 1.00 88.54 C ATOM 2410 OG SER B 76 50.102 0.602 36.679 1.00 90.08 O ATOM 2411 HG SER B 76 50.815 0.542 35.994 1.00 0.00 H ATOM 2412 H SER B 76 49.772 2.710 39.596 1.00 0.00 H ATOM 2413 N LYS B 77 51.281 1.100 41.038 1.00 69.48 N ATOM 2414 CA LYS B 77 52.274 0.975 42.143 1.00 66.70 C ATOM 2415 C LYS B 77 51.903 1.452 43.571 1.00 64.40 C ATOM 2416 O LYS B 77 52.783 1.587 44.414 1.00 62.30 O ATOM 2417 CB LYS B 77 53.613 1.672 41.749 1.00 65.89 C ATOM 2418 CG LYS B 77 54.084 1.396 40.324 1.00 74.96 C ATOM 2419 CD LYS B 77 55.435 2.047 40.005 1.00 76.88 C ATOM 2420 CE LYS B 77 55.988 2.819 41.199 1.00 71.78 C ATOM 2421 NZ LYS B 77 57.329 3.422 40.955 1.00 78.28 N ATOM 2422 HZ1 LYS B 77 58.011 2.669 40.730 1.00 0.00 H ATOM 2423 HZ2 LYS B 77 57.269 4.087 40.157 1.00 0.00 H ATOM 2424 HZ3 LYS B 77 57.640 3.929 41.808 1.00 0.00 H ATOM 2425 H LYS B 77 51.120 2.052 40.651 1.00 0.00 H ATOM 2426 N ASN B 78 50.638 1.714 43.839 1.00 66.70 N ATOM 2427 CA ASN B 78 50.178 2.148 45.178 1.00 65.41 C ATOM 2428 C ASN B 78 51.107 3.301 45.697 1.00 53.12 C ATOM 2429 O ASN B 78 51.474 3.239 46.869 1.00 51.47 O ATOM 2430 CB ASN B 78 50.057 1.030 46.238 1.00 76.76 C ATOM 2431 CG ASN B 78 49.490 1.541 47.573 1.00 79.69 C ATOM 2432 OD1 ASN B 78 49.113 2.709 47.680 1.00 77.22 O ATOM 2433 ND2 ASN B 78 49.409 0.664 48.587 1.00 84.21 N ATOM 2434 HD22 ASN B 78 49.738 -0.314 48.456 1.00 0.00 H ATOM 2435 HD21 ASN B 78 49.017 0.963 49.503 1.00 0.00 H ATOM 2436 H ASN B 78 49.935 1.612 43.079 1.00 0.00 H ATOM 2437 N THR B 79 51.483 4.276 44.822 1.00 44.58 N ATOM 2438 CA THR B 79 52.396 5.439 45.096 1.00 37.38 C ATOM 2439 C THR B 79 51.743 6.812 44.649 1.00 33.67 C ATOM 2440 O THR B 79 51.172 6.785 43.557 1.00 36.92 O ATOM 2441 CB THR B 79 53.709 5.295 44.245 1.00 39.50 C ATOM 2442 OG1 THR B 79 54.391 4.060 44.552 1.00 41.98 O ATOM 2443 CG2 THR B 79 54.645 6.511 44.435 1.00 37.96 C ATOM 2444 HG1 THR B 79 53.795 3.296 44.349 1.00 0.00 H ATOM 2445 H THR B 79 51.096 4.208 43.859 1.00 0.00 H ATOM 2446 N VAL B 80 51.829 7.915 45.438 1.00 29.78 N ATOM 2447 CA VAL B 80 51.300 9.267 45.119 1.00 28.70 C ATOM 2448 C VAL B 80 52.555 10.137 44.778 1.00 28.38 C ATOM 2449 O VAL B 80 53.503 10.044 45.550 1.00 27.83 O ATOM 2450 CB VAL B 80 50.541 9.937 46.310 1.00 28.75 C ATOM 2451 CG1 VAL B 80 50.165 11.381 45.985 1.00 29.01 C ATOM 2452 CG2 VAL B 80 49.322 9.113 46.737 1.00 30.64 C ATOM 2453 H VAL B 80 52.311 7.802 46.353 1.00 0.00 H ATOM 2454 N TYR B 81 52.557 10.941 43.685 1.00 29.77 N ATOM 2455 CA TYR B 81 53.667 11.826 43.232 1.00 30.50 C ATOM 2456 C TYR B 81 53.240 13.311 43.479 1.00 29.65 C ATOM 2457 O TYR B 81 52.042 13.562 43.347 1.00 29.35 O ATOM 2458 CB TYR B 81 53.992 11.657 41.711 1.00 32.67 C ATOM 2459 CG TYR B 81 54.391 10.214 41.342 1.00 35.08 C ATOM 2460 CD1 TYR B 81 53.537 9.375 40.629 1.00 38.02 C ATOM 2461 CD2 TYR B 81 55.610 9.693 41.760 1.00 35.03 C ATOM 2462 CE1 TYR B 81 53.888 8.088 40.314 1.00 41.60 C ATOM 2463 CE2 TYR B 81 55.985 8.407 41.465 1.00 38.17 C ATOM 2464 CZ TYR B 81 55.127 7.580 40.733 1.00 41.22 C ATOM 2465 OH TYR B 81 55.495 6.267 40.423 1.00 44.52 O ATOM 2466 HH TYR B 81 54.770 5.836 39.905 1.00 0.00 H ATOM 2467 H TYR B 81 51.695 10.939 43.103 1.00 0.00 H ATOM 2468 N LEU B 82 54.161 14.219 43.875 1.00 30.07 N ATOM 2469 CA LEU B 82 53.928 15.681 43.991 1.00 28.04 C ATOM 2470 C LEU B 82 54.863 16.335 42.966 1.00 28.72 C ATOM 2471 O LEU B 82 56.053 16.486 43.214 1.00 29.59 O ATOM 2472 CB LEU B 82 54.178 16.219 45.423 1.00 26.76 C ATOM 2473 CG LEU B 82 53.827 17.707 45.652 1.00 27.94 C ATOM 2474 CD1 LEU B 82 52.337 17.967 45.397 1.00 27.42 C ATOM 2475 CD2 LEU B 82 54.240 18.201 47.035 1.00 28.28 C ATOM 2476 H LEU B 82 55.108 13.865 44.118 1.00 0.00 H ATOM 2477 N GLN B 83 54.332 16.634 41.793 1.00 29.29 N ATOM 2478 CA GLN B 83 55.151 17.297 40.776 1.00 32.10 C ATOM 2479 C GLN B 83 55.252 18.768 41.153 1.00 34.62 C ATOM 2480 O GLN B 83 54.232 19.456 41.262 1.00 35.75 O ATOM 2481 CB GLN B 83 54.532 17.129 39.399 1.00 33.04 C ATOM 2482 CG GLN B 83 55.314 17.820 38.311 1.00 36.56 C ATOM 2483 CD GLN B 83 56.721 17.263 38.154 1.00 40.13 C ATOM 2484 OE1 GLN B 83 56.913 16.056 38.030 1.00 40.38 O ATOM 2485 NE2 GLN B 83 57.699 18.150 38.131 1.00 43.18 N ATOM 2486 HE22 GLN B 83 57.486 19.162 38.240 1.00 0.00 H ATOM 2487 HE21 GLN B 83 58.682 17.837 38.004 1.00 0.00 H ATOM 2488 H GLN B 83 53.339 16.400 41.594 1.00 0.00 H ATOM 2489 N MET B 84 56.454 19.235 41.460 1.00 34.94 N ATOM 2490 CA MET B 84 56.654 20.590 41.983 1.00 34.39 C ATOM 2491 C MET B 84 57.376 21.414 40.927 1.00 37.93 C ATOM 2492 O MET B 84 58.570 21.196 40.676 1.00 39.28 O ATOM 2493 CB MET B 84 57.468 20.591 43.275 1.00 33.75 C ATOM 2494 CG MET B 84 56.923 19.714 44.370 1.00 32.63 C ATOM 2495 SD MET B 84 57.645 20.025 46.000 1.00 37.41 S ATOM 2496 CE MET B 84 59.295 19.591 45.804 1.00 40.43 C ATOM 2497 H MET B 84 57.282 18.620 41.326 1.00 0.00 H ATOM 2498 N ASN B 85 56.650 22.335 40.288 1.00 37.61 N ATOM 2499 CA ASN B 85 57.243 23.217 39.301 1.00 41.67 C ATOM 2500 C ASN B 85 57.360 24.649 39.814 1.00 41.96 C ATOM 2501 O ASN B 85 56.821 25.017 40.859 1.00 40.53 O ATOM 2502 CB ASN B 85 56.431 23.186 38.003 1.00 44.64 C ATOM 2503 CG ASN B 85 56.335 21.799 37.414 1.00 46.59 C ATOM 2504 OD1 ASN B 85 57.267 20.995 37.504 1.00 48.87 O ATOM 2505 ND2 ASN B 85 55.193 21.497 36.838 1.00 47.32 N ATOM 2506 HD22 ASN B 85 54.434 22.206 36.784 1.00 0.00 H ATOM 2507 HD21 ASN B 85 55.048 20.549 36.436 1.00 0.00 H ATOM 2508 H ASN B 85 55.636 22.422 40.503 1.00 0.00 H ATOM 2509 N SER B 86 58.100 25.455 39.050 1.00 44.40 N ATOM 2510 CA SER B 86 58.366 26.848 39.392 1.00 46.64 C ATOM 2511 C SER B 86 58.670 27.000 40.871 1.00 44.18 C ATOM 2512 O SER B 86 58.067 27.807 41.580 1.00 43.85 O ATOM 2513 CB SER B 86 57.203 27.749 38.998 1.00 49.74 C ATOM 2514 OG SER B 86 56.734 27.436 37.706 1.00 52.20 O ATOM 2515 HG SER B 86 55.980 28.035 37.476 1.00 0.00 H ATOM 2516 H SER B 86 58.505 25.073 38.172 1.00 0.00 H ATOM 2517 N LEU B 87 59.615 26.194 41.346 1.00 43.05 N ATOM 2518 CA LEU B 87 59.923 26.179 42.761 1.00 41.71 C ATOM 2519 C LEU B 87 60.520 27.515 43.181 1.00 43.16 C ATOM 2520 O LEU B 87 61.182 28.199 42.398 1.00 46.61 O ATOM 2521 CB LEU B 87 60.875 25.020 43.064 1.00 42.11 C ATOM 2522 CG LEU B 87 60.129 23.683 43.245 1.00 39.22 C ATOM 2523 CD1 LEU B 87 61.092 22.495 43.122 1.00 39.28 C ATOM 2524 CD2 LEU B 87 59.397 23.617 44.586 1.00 36.03 C ATOM 2525 H LEU B 87 60.136 25.570 40.697 1.00 0.00 H ATOM 2526 N ARG B 88 60.244 27.896 44.420 1.00 41.87 N ATOM 2527 CA ARG B 88 60.674 29.167 44.977 1.00 48.27 C ATOM 2528 C ARG B 88 61.302 28.911 46.335 1.00 47.76 C ATOM 2529 O ARG B 88 61.145 27.836 46.924 1.00 41.81 O ATOM 2530 CB ARG B 88 59.509 30.158 45.142 1.00 54.42 C ATOM 2531 CG ARG B 88 58.561 30.261 43.956 1.00 58.83 C ATOM 2532 CD ARG B 88 57.175 30.713 44.397 1.00 59.03 C ATOM 2533 NE ARG B 88 56.356 31.144 43.270 1.00 60.17 N ATOM 2534 CZ ARG B 88 55.060 31.430 43.352 1.00 59.72 C ATOM 2535 NH1 ARG B 88 54.427 31.327 44.511 1.00 56.88 N ATOM 2536 NH2 ARG B 88 54.394 31.815 42.270 1.00 63.29 N ATOM 2537 HE ARG B 88 56.816 31.234 42.341 1.00 0.00 H ATOM 2538 HH12 ARG B 88 53.413 31.551 44.572 1.00 0.00 H ATOM 2539 HH11 ARG B 88 54.944 31.022 45.360 1.00 0.00 H ATOM 2540 HH22 ARG B 88 53.380 32.038 42.335 1.00 0.00 H ATOM 2541 HH21 ARG B 88 54.886 31.893 41.357 1.00 0.00 H ATOM 2542 H ARG B 88 59.692 27.253 45.023 1.00 0.00 H ATOM 2543 N ALA B 89 62.032 29.918 46.831 1.00 54.64 N ATOM 2544 CA ALA B 89 62.703 29.781 48.122 1.00 55.30 C ATOM 2545 C ALA B 89 61.713 29.405 49.214 1.00 51.03 C ATOM 2546 O ALA B 89 62.036 28.622 50.118 1.00 49.95 O ATOM 2547 CB ALA B 89 63.420 31.083 48.478 1.00 60.16 C ATOM 2548 H ALA B 89 62.122 30.804 46.294 1.00 0.00 H ATOM 2549 N GLU B 90 60.500 29.959 49.146 1.00 49.16 N ATOM 2550 CA GLU B 90 59.473 29.676 50.140 1.00 46.77 C ATOM 2551 C GLU B 90 59.104 28.201 50.189 1.00 40.31 C ATOM 2552 O GLU B 90 58.446 27.766 51.140 1.00 39.39 O ATOM 2553 CB GLU B 90 58.195 30.467 49.843 1.00 52.65 C ATOM 2554 CG GLU B 90 58.380 31.939 49.549 1.00 61.90 C ATOM 2555 CD GLU B 90 58.724 32.195 48.097 1.00 66.75 C ATOM 2556 OE1 GLU B 90 59.933 32.173 47.777 1.00 65.52 O ATOM 2557 OE2 GLU B 90 57.796 32.399 47.281 1.00 71.45 O ATOM 2558 H GLU B 90 60.283 30.609 48.364 1.00 0.00 H ATOM 2559 N ASP B 91 59.463 27.433 49.162 1.00 36.57 N ATOM 2560 CA ASP B 91 59.131 26.017 49.135 1.00 32.60 C ATOM 2561 C ASP B 91 60.138 25.171 49.894 1.00 31.22 C ATOM 2562 O ASP B 91 59.918 23.966 50.055 1.00 28.93 O ATOM 2563 CB ASP B 91 59.023 25.525 47.689 1.00 32.92 C ATOM 2564 CG ASP B 91 57.940 26.237 46.911 1.00 34.57 C ATOM 2565 OD1 ASP B 91 56.810 26.328 47.435 1.00 33.79 O ATOM 2566 OD2 ASP B 91 58.215 26.720 45.784 1.00 36.72 O ATOM 2567 H ASP B 91 59.988 27.852 48.368 1.00 0.00 H ATOM 2568 N THR B 92 61.245 25.765 50.343 1.00 33.54 N ATOM 2569 CA THR B 92 62.249 25.019 51.086 1.00 32.71 C ATOM 2570 C THR B 92 61.646 24.503 52.375 1.00 29.55 C ATOM 2571 O THR B 92 61.104 25.285 53.155 1.00 30.33 O ATOM 2572 CB THR B 92 63.430 25.934 51.381 1.00 34.41 C ATOM 2573 OG1 THR B 92 64.119 26.258 50.167 1.00 35.72 O ATOM 2574 CG2 THR B 92 64.382 25.263 52.352 1.00 34.64 C ATOM 2575 HG1 THR B 92 63.498 26.718 49.549 1.00 0.00 H ATOM 2576 H THR B 92 61.393 26.778 50.159 1.00 0.00 H ATOM 2577 N ALA B 93 61.694 23.187 52.588 1.00 27.04 N ATOM 2578 CA ALA B 93 61.052 22.580 53.764 1.00 24.56 C ATOM 2579 C ALA B 93 61.358 21.088 53.714 1.00 24.21 C ATOM 2580 O ALA B 93 61.828 20.572 52.702 1.00 26.55 O ATOM 2581 CB ALA B 93 59.520 22.801 53.798 1.00 23.56 C ATOM 2582 H ALA B 93 62.195 22.578 51.910 1.00 0.00 H ATOM 2583 N THR B 94 61.073 20.395 54.812 1.00 23.68 N ATOM 2584 CA THR B 94 61.075 18.939 54.840 1.00 24.14 C ATOM 2585 C THR B 94 59.665 18.485 54.543 1.00 23.85 C ATOM 2586 O THR B 94 58.742 18.853 55.273 1.00 25.35 O ATOM 2587 CB THR B 94 61.508 18.403 56.203 1.00 26.80 C ATOM 2588 OG1 THR B 94 62.669 19.113 56.669 1.00 29.32 O ATOM 2589 CG2 THR B 94 61.848 16.920 56.112 1.00 27.95 C ATOM 2590 HG1 THR B 94 63.409 18.993 56.023 1.00 0.00 H ATOM 2591 H THR B 94 60.840 20.912 55.684 1.00 0.00 H ATOM 2592 N TYR B 95 59.511 17.657 53.514 1.00 23.41 N ATOM 2593 CA TYR B 95 58.203 17.238 53.021 1.00 23.35 C ATOM 2594 C TYR B 95 57.889 15.831 53.496 1.00 23.65 C ATOM 2595 O TYR B 95 58.762 14.952 53.484 1.00 25.22 O ATOM 2596 CB TYR B 95 58.134 17.294 51.494 1.00 23.72 C ATOM 2597 CG TYR B 95 58.017 18.685 50.931 1.00 24.27 C ATOM 2598 CD1 TYR B 95 59.103 19.559 51.008 1.00 25.60 C ATOM 2599 CD2 TYR B 95 56.886 19.113 50.277 1.00 25.20 C ATOM 2600 CE1 TYR B 95 59.023 20.813 50.472 1.00 26.70 C ATOM 2601 CE2 TYR B 95 56.807 20.370 49.762 1.00 26.28 C ATOM 2602 CZ TYR B 95 57.880 21.218 49.865 1.00 27.74 C ATOM 2603 OH TYR B 95 57.844 22.482 49.356 1.00 29.49 O ATOM 2604 HH TYR B 95 58.709 22.932 49.530 1.00 0.00 H ATOM 2605 H TYR B 95 60.361 17.292 53.039 1.00 0.00 H ATOM 2606 N TYR B 96 56.641 15.641 53.926 1.00 21.40 N ATOM 2607 CA TYR B 96 56.138 14.380 54.458 1.00 21.38 C ATOM 2608 C TYR B 96 54.814 14.106 53.771 1.00 21.37 C ATOM 2609 O TYR B 96 54.127 15.021 53.357 1.00 22.03 O ATOM 2610 CB TYR B 96 55.877 14.400 55.952 1.00 20.66 C ATOM 2611 CG TYR B 96 57.150 14.451 56.787 1.00 21.45 C ATOM 2612 CD1 TYR B 96 57.740 15.658 57.055 1.00 22.78 C ATOM 2613 CD2 TYR B 96 57.778 13.288 57.237 1.00 22.96 C ATOM 2614 CE1 TYR B 96 58.947 15.727 57.757 1.00 22.19 C ATOM 2615 CE2 TYR B 96 58.992 13.337 57.966 1.00 24.25 C ATOM 2616 CZ TYR B 96 59.575 14.553 58.231 1.00 23.71 C ATOM 2617 OH TYR B 96 60.762 14.584 58.921 1.00 26.61 O ATOM 2618 HH TYR B 96 61.450 14.082 58.415 1.00 0.00 H ATOM 2619 H TYR B 96 55.983 16.445 53.879 1.00 0.00 H ATOM 2620 N CYS B 97 54.463 12.846 53.685 1.00 21.64 N ATOM 2621 CA CYS B 97 53.102 12.478 53.295 1.00 21.73 C ATOM 2622 C CYS B 97 52.482 11.686 54.437 1.00 22.24 C ATOM 2623 O CYS B 97 53.174 11.081 55.259 1.00 23.37 O ATOM 2624 CB CYS B 97 53.117 11.703 52.011 1.00 23.22 C ATOM 2625 SG CYS B 97 54.190 10.294 51.924 1.00 25.32 S ATOM 2626 H CYS B 97 55.158 12.102 53.896 1.00 0.00 H ATOM 2627 N ALA B 98 51.147 11.732 54.497 1.00 19.89 N ATOM 2628 CA ALA B 98 50.401 11.104 55.588 1.00 19.50 C ATOM 2629 C ALA B 98 48.930 11.020 55.185 1.00 20.71 C ATOM 2630 O ALA B 98 48.444 11.843 54.369 1.00 20.76 O ATOM 2631 CB ALA B 98 50.475 11.904 56.888 1.00 20.13 C ATOM 2632 H ALA B 98 50.624 12.228 53.747 1.00 0.00 H ATOM 2633 N PRO B 99 48.194 10.128 55.832 1.00 22.00 N ATOM 2634 CA PRO B 99 46.740 10.105 55.662 1.00 23.36 C ATOM 2635 C PRO B 99 46.142 11.423 56.094 1.00 22.71 C ATOM 2636 O PRO B 99 46.622 12.101 56.978 1.00 21.57 O ATOM 2637 CB PRO B 99 46.268 8.973 56.589 1.00 25.33 C ATOM 2638 CG PRO B 99 47.382 8.810 57.591 1.00 26.64 C ATOM 2639 CD PRO B 99 48.649 9.200 56.886 1.00 25.26 C ATOM 2640 N ILE B 100 44.997 11.765 55.509 1.00 18.35 N ATOM 2641 CA ILE B 100 44.238 12.907 55.979 1.00 19.97 C ATOM 2642 C ILE B 100 43.251 12.405 57.021 1.00 20.81 C ATOM 2643 O ILE B 100 42.295 11.687 56.710 1.00 22.20 O ATOM 2644 CB ILE B 100 43.498 13.623 54.844 1.00 19.30 C ATOM 2645 CG1 ILE B 100 44.484 14.207 53.839 1.00 20.23 C ATOM 2646 CG2 ILE B 100 42.586 14.749 55.412 1.00 19.02 C ATOM 2647 CD1 ILE B 100 45.498 15.141 54.364 1.00 20.88 C ATOM 2648 H ILE B 100 44.643 11.207 54.706 1.00 0.00 H ATOM 2649 N ASN B 101 43.470 12.774 58.274 1.00 19.97 N ATOM 2650 CA ASN B 101 42.566 12.390 59.328 1.00 21.00 C ATOM 2651 C ASN B 101 42.688 13.413 60.446 1.00 21.78 C ATOM 2652 O ASN B 101 43.476 14.347 60.357 1.00 21.59 O ATOM 2653 CB ASN B 101 42.829 10.957 59.815 1.00 21.14 C ATOM 2654 CG ASN B 101 44.236 10.784 60.394 1.00 22.72 C ATOM 2655 OD1 ASN B 101 44.778 11.661 61.080 1.00 23.77 O ATOM 2656 ND2 ASN B 101 44.836 9.618 60.111 1.00 24.90 N ATOM 2657 HD22 ASN B 101 44.345 8.908 59.531 1.00 0.00 H ATOM 2658 HD21 ASN B 101 45.792 9.424 60.472 1.00 0.00 H ATOM 2659 H ASN B 101 44.306 13.349 58.500 1.00 0.00 H ATOM 2660 N ASN B 102 41.839 13.276 61.448 1.00 21.90 N ATOM 2661 CA ASN B 102 41.863 14.253 62.556 1.00 26.53 C ATOM 2662 C ASN B 102 43.313 14.318 63.204 1.00 26.01 C ATOM 2663 O ASN B 102 43.831 15.405 63.499 1.00 26.65 O ATOM 2664 CB ASN B 102 40.778 13.993 63.663 1.00 38.57 C ATOM 2665 CG ASN B 102 39.307 14.200 63.130 1.00 55.53 C ATOM 2666 OD1 ASN B 102 38.959 15.318 62.726 1.00 67.64 O ATOM 2667 ND2 ASN B 102 38.475 13.137 63.090 1.00 57.58 N ATOM 2668 HD22 ASN B 102 38.797 12.211 63.437 1.00 0.00 H ATOM 2669 HD21 ASN B 102 37.512 13.244 62.712 1.00 0.00 H ATOM 2670 H ASN B 102 41.160 12.488 61.457 1.00 0.00 H ATOM 2671 N ARG B 103 43.935 13.172 63.423 1.00 24.91 N ATOM 2672 CA ARG B 103 45.278 13.202 64.061 1.00 26.77 C ATOM 2673 C ARG B 103 46.260 14.047 63.165 1.00 26.52 C ATOM 2674 O ARG B 103 46.901 15.005 63.623 1.00 30.34 O ATOM 2675 CB ARG B 103 45.926 11.822 64.284 1.00 30.15 C ATOM 2676 CG ARG B 103 47.370 11.924 64.776 1.00 38.16 C ATOM 2677 CD ARG B 103 48.055 10.570 64.862 1.00 47.11 C ATOM 2678 NE ARG B 103 47.774 9.790 63.657 1.00 50.79 N ATOM 2679 CZ ARG B 103 48.428 9.973 62.463 1.00 55.27 C ATOM 2680 NH1 ARG B 103 49.442 10.956 62.399 1.00 61.95 N ATOM 2681 NH2 ARG B 103 48.103 9.182 61.330 1.00 50.93 N ATOM 2682 HE ARG B 103 47.039 9.056 63.707 1.00 0.00 H ATOM 2683 HH12 ARG B 103 49.955 11.117 61.509 1.00 0.00 H ATOM 2684 HH11 ARG B 103 49.675 11.518 63.242 1.00 0.00 H ATOM 2685 HH22 ARG B 103 48.605 9.330 60.431 1.00 0.00 H ATOM 2686 HH21 ARG B 103 47.363 8.455 61.399 1.00 0.00 H ATOM 2687 H ARG B 103 43.494 12.269 63.155 1.00 0.00 H ATOM 2688 N THR B 104 46.424 13.676 61.882 1.00 24.53 N ATOM 2689 CA THR B 104 47.358 14.463 60.998 1.00 24.69 C ATOM 2690 C THR B 104 47.065 16.031 60.893 1.00 25.72 C ATOM 2691 O THR B 104 48.012 16.816 60.680 1.00 26.54 O ATOM 2692 CB THR B 104 47.505 13.925 59.529 1.00 23.48 C ATOM 2693 OG1 THR B 104 46.317 14.223 58.793 1.00 21.50 O ATOM 2694 CG2 THR B 104 47.769 12.394 59.528 1.00 23.54 C ATOM 2695 HG1 THR B 104 46.410 13.884 57.868 1.00 0.00 H ATOM 2696 H THR B 104 45.911 12.854 61.504 1.00 0.00 H ATOM 2697 N MET B 105 45.787 16.473 61.008 1.00 26.45 N ATOM 2698 CA MET B 105 45.404 17.934 60.934 1.00 30.72 C ATOM 2699 C MET B 105 45.571 18.616 62.331 1.00 34.49 C ATOM 2700 O MET B 105 45.668 19.845 62.440 1.00 36.71 O ATOM 2701 CB MET B 105 43.953 18.208 60.413 1.00 31.83 C ATOM 2702 CG MET B 105 43.604 17.582 59.066 1.00 31.57 C ATOM 2703 SD MET B 105 44.908 17.628 57.827 1.00 32.71 S ATOM 2704 CE MET B 105 44.639 19.222 57.066 1.00 32.60 C ATOM 2705 H MET B 105 45.033 15.772 61.154 1.00 0.00 H ATOM 2706 N GLN B 106 45.558 17.825 63.407 1.00 39.08 N ATOM 2707 CA GLN B 106 45.680 18.416 64.795 1.00 40.05 C ATOM 2708 C GLN B 106 46.999 19.175 64.962 1.00 39.17 C ATOM 2709 O GLN B 106 48.023 18.807 64.389 1.00 38.07 O ATOM 2710 CB GLN B 106 45.409 17.443 66.002 1.00 39.05 C ATOM 2711 CG GLN B 106 46.639 16.768 66.607 1.00 36.44 C ATOM 2712 CD GLN B 106 46.279 15.683 67.668 1.00 37.83 C ATOM 2713 OE1 GLN B 106 45.280 14.986 67.505 1.00 40.36 O ATOM 2714 NE2 GLN B 106 47.085 15.534 68.727 1.00 37.15 N ATOM 2715 HE22 GLN B 106 47.922 16.142 68.833 1.00 0.00 H ATOM 2716 HE21 GLN B 106 46.874 14.811 69.444 1.00 0.00 H ATOM 2717 H GLN B 106 45.463 16.796 63.290 1.00 0.00 H ATOM 2718 N ASP B 107 46.973 20.211 65.793 1.00 39.99 N ATOM 2719 CA ASP B 107 48.167 21.103 65.986 1.00 37.14 C ATOM 2720 C ASP B 107 49.028 20.538 67.102 1.00 34.54 C ATOM 2721 O ASP B 107 48.898 20.953 68.248 1.00 38.53 O ATOM 2722 CB ASP B 107 47.774 22.584 66.317 1.00 40.89 C ATOM 2723 CG ASP B 107 48.987 23.522 66.451 1.00 42.82 C ATOM 2724 OD1 ASP B 107 50.081 23.113 66.029 1.00 42.72 O ATOM 2725 OD2 ASP B 107 48.852 24.670 66.936 1.00 46.64 O ATOM 2726 H ASP B 107 46.102 20.410 66.325 1.00 0.00 H ATOM 2727 N SER B 108 49.892 19.582 66.776 1.00 28.13 N ATOM 2728 CA SER B 108 50.754 18.990 67.790 1.00 26.52 C ATOM 2729 C SER B 108 51.926 18.313 67.125 1.00 24.15 C ATOM 2730 O SER B 108 52.004 18.185 65.916 1.00 25.05 O ATOM 2731 CB SER B 108 49.998 18.000 68.697 1.00 30.97 C ATOM 2732 OG SER B 108 49.294 17.013 67.968 1.00 33.32 O ATOM 2733 HG SER B 108 49.932 16.493 67.418 1.00 0.00 H ATOM 2734 H SER B 108 49.953 19.255 65.791 1.00 0.00 H ATOM 2735 N MET B 109 52.877 17.925 67.977 1.00 21.59 N ATOM 2736 CA MET B 109 54.144 17.384 67.536 1.00 20.97 C ATOM 2737 C MET B 109 53.975 16.237 66.561 1.00 20.97 C ATOM 2738 O MET B 109 53.014 15.457 66.604 1.00 21.49 O ATOM 2739 CB MET B 109 54.943 16.880 68.755 1.00 20.50 C ATOM 2740 CG MET B 109 54.293 15.675 69.462 1.00 20.21 C ATOM 2741 SD MET B 109 55.304 15.086 70.819 1.00 20.24 S ATOM 2742 CE MET B 109 54.937 16.339 71.977 1.00 19.99 C ATOM 2743 H MET B 109 52.700 18.015 68.998 1.00 0.00 H ATOM 2744 N PHE B 110 54.961 16.082 65.682 1.00 21.50 N ATOM 2745 CA PHE B 110 55.078 14.839 64.958 1.00 20.85 C ATOM 2746 C PHE B 110 55.295 13.669 65.913 1.00 19.83 C ATOM 2747 O PHE B 110 56.245 13.623 66.689 1.00 19.37 O ATOM 2748 CB PHE B 110 56.273 14.863 63.985 1.00 20.76 C ATOM 2749 CG PHE B 110 56.102 15.655 62.752 1.00 22.26 C ATOM 2750 CD1 PHE B 110 56.436 17.002 62.699 1.00 24.33 C ATOM 2751 CD2 PHE B 110 55.701 15.073 61.556 1.00 23.69 C ATOM 2752 CE1 PHE B 110 56.357 17.743 61.554 1.00 25.73 C ATOM 2753 CE2 PHE B 110 55.632 15.797 60.414 1.00 26.00 C ATOM 2754 CZ PHE B 110 55.925 17.149 60.404 1.00 26.77 C ATOM 2755 H PHE B 110 55.642 16.850 65.518 1.00 0.00 H ATOM 2756 N LEU B 111 54.423 12.678 65.824 1.00 20.01 N ATOM 2757 CA LEU B 111 54.606 11.377 66.450 1.00 17.76 C ATOM 2758 C LEU B 111 55.275 10.439 65.434 1.00 18.47 C ATOM 2759 O LEU B 111 54.654 10.071 64.424 1.00 18.41 O ATOM 2760 CB LEU B 111 53.275 10.822 66.921 1.00 19.51 C ATOM 2761 CG LEU B 111 52.619 11.600 68.043 1.00 19.00 C ATOM 2762 CD1 LEU B 111 51.247 11.005 68.295 1.00 21.40 C ATOM 2763 CD2 LEU B 111 53.484 11.519 69.303 1.00 19.39 C ATOM 2764 H LEU B 111 53.555 12.838 65.274 1.00 0.00 H ATOM 2765 N TRP B 112 56.532 10.060 65.695 1.00 20.42 N ATOM 2766 CA TRP B 112 57.277 9.301 64.701 1.00 21.44 C ATOM 2767 C TRP B 112 56.799 7.860 64.603 1.00 22.26 C ATOM 2768 O TRP B 112 57.202 7.186 63.651 1.00 25.28 O ATOM 2769 CB TRP B 112 58.812 9.421 65.030 1.00 21.58 C ATOM 2770 CG TRP B 112 59.126 10.922 64.883 1.00 20.04 C ATOM 2771 CD1 TRP B 112 59.520 11.809 65.878 1.00 21.57 C ATOM 2772 CD2 TRP B 112 59.076 11.674 63.692 1.00 20.56 C ATOM 2773 NE1 TRP B 112 59.588 13.080 65.333 1.00 19.76 N ATOM 2774 CE2 TRP B 112 59.359 13.011 63.992 1.00 19.75 C ATOM 2775 CE3 TRP B 112 58.726 11.343 62.358 1.00 21.86 C ATOM 2776 CZ2 TRP B 112 59.343 14.009 62.998 1.00 20.36 C ATOM 2777 CZ3 TRP B 112 58.704 12.311 61.413 1.00 22.32 C ATOM 2778 CH2 TRP B 112 59.005 13.636 61.721 1.00 20.51 C ATOM 2779 HE1 TRP B 112 59.784 13.952 65.865 1.00 0.00 H ATOM 2780 H TRP B 112 56.974 10.307 66.603 1.00 0.00 H ATOM 2781 N ASN B 113 55.962 7.392 65.531 1.00 22.55 N ATOM 2782 CA ASN B 113 55.323 6.086 65.385 1.00 24.89 C ATOM 2783 C ASN B 113 54.215 6.148 64.330 1.00 25.93 C ATOM 2784 O ASN B 113 53.682 5.110 63.931 1.00 29.02 O ATOM 2785 CB ASN B 113 54.765 5.541 66.727 1.00 27.43 C ATOM 2786 CG ASN B 113 54.095 6.597 67.611 1.00 31.15 C ATOM 2787 OD1 ASN B 113 54.561 7.727 67.768 1.00 34.63 O ATOM 2788 ND2 ASN B 113 53.009 6.188 68.255 1.00 31.87 N ATOM 2789 HD22 ASN B 113 52.643 5.227 68.099 1.00 0.00 H ATOM 2790 HD21 ASN B 113 52.524 6.828 68.916 1.00 0.00 H ATOM 2791 H ASN B 113 55.761 7.967 66.374 1.00 0.00 H ATOM 2792 N TYR B 114 53.851 7.344 63.920 1.00 23.96 N ATOM 2793 CA TYR B 114 52.798 7.549 62.935 1.00 24.01 C ATOM 2794 C TYR B 114 53.256 8.188 61.631 1.00 25.34 C ATOM 2795 O TYR B 114 52.542 8.069 60.619 1.00 28.98 O ATOM 2796 CB TYR B 114 51.715 8.442 63.538 1.00 23.68 C ATOM 2797 CG TYR B 114 50.762 7.785 64.482 1.00 27.66 C ATOM 2798 CD1 TYR B 114 49.705 7.043 64.013 1.00 32.02 C ATOM 2799 CD2 TYR B 114 50.896 7.934 65.868 1.00 28.73 C ATOM 2800 CE1 TYR B 114 48.793 6.478 64.864 1.00 34.97 C ATOM 2801 CE2 TYR B 114 49.974 7.349 66.734 1.00 32.06 C ATOM 2802 CZ TYR B 114 48.957 6.597 66.227 1.00 35.35 C ATOM 2803 OH TYR B 114 48.007 6.009 67.051 1.00 37.67 O ATOM 2804 HH TYR B 114 47.357 5.508 66.498 1.00 0.00 H ATOM 2805 H TYR B 114 54.334 8.176 64.315 1.00 0.00 H ATOM 2806 N TRP B 115 54.330 8.958 61.642 1.00 23.89 N ATOM 2807 CA TRP B 115 54.869 9.554 60.432 1.00 23.98 C ATOM 2808 C TRP B 115 56.068 8.752 59.964 1.00 25.59 C ATOM 2809 O TRP B 115 56.924 8.371 60.784 1.00 25.22 O ATOM 2810 CB TRP B 115 55.308 11.002 60.644 1.00 22.28 C ATOM 2811 CG TRP B 115 54.168 11.963 60.938 1.00 21.01 C ATOM 2812 CD1 TRP B 115 53.543 12.144 62.125 1.00 20.76 C ATOM 2813 CD2 TRP B 115 53.539 12.853 59.999 1.00 22.72 C ATOM 2814 NE1 TRP B 115 52.545 13.088 61.986 1.00 22.57 N ATOM 2815 CE2 TRP B 115 52.516 13.533 60.691 1.00 22.93 C ATOM 2816 CE3 TRP B 115 53.749 13.145 58.662 1.00 23.94 C ATOM 2817 CZ2 TRP B 115 51.727 14.514 60.081 1.00 23.91 C ATOM 2818 CZ3 TRP B 115 52.985 14.064 58.072 1.00 26.67 C ATOM 2819 CH2 TRP B 115 51.954 14.736 58.768 1.00 27.02 C ATOM 2820 HE1 TRP B 115 51.913 13.411 62.747 1.00 0.00 H ATOM 2821 H TRP B 115 54.806 9.144 62.548 1.00 0.00 H ATOM 2822 N GLY B 116 56.158 8.539 58.673 1.00 26.30 N ATOM 2823 CA GLY B 116 57.312 7.894 58.065 1.00 27.73 C ATOM 2824 C GLY B 116 58.401 8.850 57.645 1.00 27.00 C ATOM 2825 O GLY B 116 58.623 9.894 58.265 1.00 25.35 O ATOM 2826 H GLY B 116 55.374 8.843 58.060 1.00 0.00 H ATOM 2827 N GLN B 117 59.133 8.451 56.616 1.00 29.77 N ATOM 2828 CA GLN B 117 60.305 9.190 56.180 1.00 31.73 C ATOM 2829 C GLN B 117 59.914 10.477 55.495 1.00 31.05 C ATOM 2830 O GLN B 117 58.992 10.482 54.661 1.00 32.30 O ATOM 2831 CB GLN B 117 61.133 8.352 55.220 1.00 41.50 C ATOM 2832 CG GLN B 117 61.545 7.037 55.858 1.00 51.18 C ATOM 2833 CD GLN B 117 62.626 6.373 55.091 1.00 63.74 C ATOM 2834 OE1 GLN B 117 62.679 6.482 53.859 1.00 75.56 O ATOM 2835 NE2 GLN B 117 63.532 5.692 55.803 1.00 61.69 N ATOM 2836 HE22 GLN B 117 63.441 5.631 56.837 1.00 0.00 H ATOM 2837 HE21 GLN B 117 64.326 5.224 55.322 1.00 0.00 H ATOM 2838 H GLN B 117 58.862 7.586 56.107 1.00 0.00 H ATOM 2839 N GLY B 118 60.611 11.562 55.852 1.00 28.96 N ATOM 2840 CA GLY B 118 60.502 12.824 55.159 1.00 29.56 C ATOM 2841 C GLY B 118 61.575 12.974 54.104 1.00 32.54 C ATOM 2842 O GLY B 118 62.446 12.122 53.966 1.00 33.86 O ATOM 2843 H GLY B 118 61.259 11.493 56.663 1.00 0.00 H ATOM 2844 N THR B 119 61.435 14.022 53.283 1.00 25.13 N ATOM 2845 CA THR B 119 62.424 14.327 52.263 1.00 26.03 C ATOM 2846 C THR B 119 62.656 15.821 52.169 1.00 27.28 C ATOM 2847 O THR B 119 61.711 16.607 52.105 1.00 28.82 O ATOM 2848 CB THR B 119 62.049 13.753 50.887 1.00 28.75 C ATOM 2849 OG1 THR B 119 63.178 13.764 49.999 1.00 31.45 O ATOM 2850 CG2 THR B 119 60.835 14.506 50.253 1.00 28.20 C ATOM 2851 HG1 THR B 119 63.905 13.215 50.385 1.00 0.00 H ATOM 2852 H THR B 119 60.598 14.633 53.377 1.00 0.00 H ATOM 2853 N GLN B 120 63.931 16.219 52.214 1.00 27.86 N ATOM 2854 CA GLN B 120 64.280 17.630 52.248 1.00 27.71 C ATOM 2855 C GLN B 120 64.278 18.224 50.851 1.00 29.60 C ATOM 2856 O GLN B 120 64.876 17.676 49.921 1.00 32.00 O ATOM 2857 CB GLN B 120 65.679 17.836 52.873 1.00 29.48 C ATOM 2858 CG GLN B 120 66.069 19.290 52.959 1.00 32.71 C ATOM 2859 CD GLN B 120 65.266 20.081 53.984 1.00 34.22 C ATOM 2860 OE1 GLN B 120 64.819 19.531 54.979 1.00 33.69 O ATOM 2861 NE2 GLN B 120 65.054 21.375 53.717 1.00 35.81 N ATOM 2862 HE22 GLN B 120 65.455 21.801 52.857 1.00 0.00 H ATOM 2863 HE21 GLN B 120 64.489 21.955 54.370 1.00 0.00 H ATOM 2864 H GLN B 120 64.688 15.506 52.225 1.00 0.00 H ATOM 2865 N VAL B 121 63.648 19.381 50.719 1.00 28.29 N ATOM 2866 CA VAL B 121 63.681 20.167 49.496 1.00 30.00 C ATOM 2867 C VAL B 121 64.277 21.511 49.854 1.00 31.53 C ATOM 2868 O VAL B 121 63.767 22.197 50.743 1.00 31.16 O ATOM 2869 CB VAL B 121 62.262 20.360 48.929 1.00 31.52 C ATOM 2870 CG1 VAL B 121 62.282 21.398 47.824 1.00 34.68 C ATOM 2871 CG2 VAL B 121 61.678 19.042 48.487 1.00 31.00 C ATOM 2872 H VAL B 121 63.104 19.745 51.528 1.00 0.00 H ATOM 2873 N THR B 122 65.421 21.857 49.248 1.00 35.02 N ATOM 2874 CA THR B 122 66.027 23.152 49.496 1.00 38.91 C ATOM 2875 C THR B 122 66.102 23.896 48.169 1.00 41.00 C ATOM 2876 O THR B 122 66.711 23.399 47.211 1.00 42.77 O ATOM 2877 CB THR B 122 67.415 22.986 50.133 1.00 42.39 C ATOM 2878 OG1 THR B 122 67.288 22.353 51.424 1.00 38.91 O ATOM 2879 CG2 THR B 122 68.092 24.333 50.321 1.00 49.35 C ATOM 2880 HG1 THR B 122 68.185 22.249 51.829 1.00 0.00 H ATOM 2881 H THR B 122 65.879 21.191 48.594 1.00 0.00 H ATOM 2882 N VAL B 123 65.513 25.093 48.125 1.00 42.42 N ATOM 2883 CA VAL B 123 65.562 25.973 46.962 1.00 47.98 C ATOM 2884 C VAL B 123 66.546 27.103 47.252 1.00 58.37 C ATOM 2885 O VAL B 123 66.503 27.703 48.335 1.00 61.52 O ATOM 2886 CB VAL B 123 64.162 26.520 46.627 1.00 46.17 C ATOM 2887 CG1 VAL B 123 64.239 27.456 45.425 1.00 50.35 C ATOM 2888 CG2 VAL B 123 63.189 25.377 46.372 1.00 41.94 C ATOM 2889 H VAL B 123 64.991 25.416 48.965 1.00 0.00 H ATOM 2890 N SER B 124 67.429 27.405 46.290 1.00 65.11 N ATOM 2891 CA SER B 124 68.537 28.314 46.566 1.00 71.43 C ATOM 2892 C SER B 124 69.059 28.993 45.310 1.00 78.14 C ATOM 2893 O SER B 124 69.126 28.379 44.239 1.00 78.53 O ATOM 2894 CB SER B 124 69.688 27.546 47.223 1.00 70.29 C ATOM 2895 OG SER B 124 70.424 26.831 46.229 1.00 70.89 O ATOM 2896 HG SER B 124 71.166 26.337 46.661 1.00 0.00 H ATOM 2897 H SER B 124 67.324 26.990 45.342 1.00 0.00 H ATOM 2898 N SER B 125 69.541 30.236 45.477 1.00 82.94 N ATOM 2899 CA SER B 125 70.130 30.974 44.359 1.00 86.77 C ATOM 2900 C SER B 125 71.231 30.174 43.659 1.00 83.66 C ATOM 2901 O SER B 125 71.341 30.205 42.427 1.00 81.98 O ATOM 2902 CB SER B 125 70.687 32.316 44.836 1.00 92.13 C ATOM 2903 OG SER B 125 69.850 32.912 45.807 1.00 91.99 O ATOM 2904 HG SER B 125 70.240 33.776 46.092 1.00 0.00 H ATOM 2905 H SER B 125 69.495 30.681 46.416 1.00 0.00 H ATOM 2906 N ALA B 126 72.063 29.462 44.425 1.00 81.89 N ATOM 2907 CA ALA B 126 73.140 28.652 43.845 1.00 78.99 C ATOM 2908 C ALA B 126 72.566 27.557 42.949 1.00 77.38 C ATOM 2909 O ALA B 126 71.976 26.590 43.441 1.00 73.44 O ATOM 2910 CB ALA B 126 74.007 28.030 44.947 1.00 73.09 C ATOM 2911 H ALA B 126 71.944 29.483 45.458 1.00 0.00 H TER 2912 ALA B 126 HETATM 2913 MG MG A 1 46.183 12.180 76.982 1.00 15.02 MG HETATM 2914 MG MG A 2 41.342 15.658 84.766 1.00 24.28 MG HETATM 2915 O HOH 3 51.460 -3.271 89.842 1.00 50.09 O HETATM 2916 O HOH 4 51.126 2.320 93.111 1.00 49.54 O HETATM 2917 O HOH 5 38.387 20.253 94.197 1.00 35.63 O HETATM 2918 O HOH 6 59.978 16.319 100.208 1.00 45.02 O HETATM 2919 O HOH 7 58.929 30.493 87.087 1.00 39.76 O HETATM 2920 O HOH 8 64.555 12.989 93.131 1.00101.27 O HETATM 2921 O HOH 9 65.147 28.603 79.234 1.00 36.59 O HETATM 2922 O HOH 10 46.066 -0.910 88.882 1.00 58.59 O HETATM 2923 O HOH 11 37.571 23.613 95.564 1.00 45.25 O HETATM 2924 O HOH 12 61.120 31.053 77.138 1.00 50.47 O HETATM 2925 O HOH 13 53.208 19.934 99.397 1.00 39.49 O HETATM 2926 O HOH 14 47.051 26.535 95.006 1.00 46.51 O HETATM 2927 O HOH 15 40.487 19.325 82.737 1.00 19.42 O HETATM 2928 O HOH 16 60.409 20.079 63.054 1.00 43.59 O HETATM 2929 O HOH 17 72.180 22.743 78.698 1.00 34.58 O HETATM 2930 O HOH 18 46.446 13.593 78.610 1.00 15.33 O HETATM 2931 O HOH 19 76.602 19.652 80.706 1.00 26.58 O HETATM 2932 O HOH 20 68.164 11.089 83.317 1.00 40.86 O HETATM 2933 O HOH 21 42.606 10.097 77.895 1.00 19.66 O HETATM 2934 O HOH 22 44.907 24.032 92.908 1.00 34.50 O HETATM 2935 O HOH 23 63.026 15.266 95.576 1.00 36.50 O HETATM 2936 O HOH 24 46.589 32.665 91.646 1.00 78.95 O HETATM 2937 O HOH 25 62.558 9.591 92.754 1.00 37.50 O HETATM 2938 O HOH 26 69.598 18.018 58.357 1.00 36.46 O HETATM 2939 O HOH 27 63.550 7.727 59.449 1.00 28.50 O HETATM 2940 O HOH 28 54.462 33.220 78.410 1.00 43.88 O HETATM 2941 O HOH 29 39.769 12.292 71.785 1.00 27.74 O HETATM 2942 O HOH 30 52.537 24.214 99.088 1.00 47.21 O HETATM 2943 O HOH 31 49.345 5.129 72.617 1.00 27.05 O HETATM 2944 O HOH 32 61.553 3.051 71.628 1.00 29.16 O HETATM 2945 O HOH 33 43.248 7.579 67.314 1.00 42.24 O HETATM 2946 O HOH 34 57.203 19.358 68.312 1.00 21.51 O HETATM 2947 O HOH 35 61.009 1.842 88.073 1.00 26.34 O HETATM 2948 O HOH 36 48.670 23.411 74.241 1.00 35.75 O HETATM 2949 O HOH 37 48.941 19.191 99.839 1.00 45.55 O HETATM 2950 O HOH 38 57.462 31.265 82.763 1.00 30.07 O HETATM 2951 O HOH 39 57.485 1.931 98.993 1.00 51.36 O HETATM 2952 O HOH 40 43.334 28.769 73.611 1.00 39.93 O HETATM 2953 O HOH 41 57.418 10.187 68.532 1.00 21.88 O HETATM 2954 O HOH 42 53.130 29.222 92.869 1.00 41.88 O HETATM 2955 O HOH 43 68.279 19.414 74.218 1.00 27.63 O HETATM 2956 O HOH 44 50.720 33.110 86.077 1.00 42.57 O HETATM 2957 O HOH 45 68.743 27.148 84.205 1.00 23.59 O HETATM 2958 O HOH 46 54.840 20.065 71.282 1.00 18.46 O HETATM 2959 O HOH 47 51.082 -2.601 78.469 1.00 46.64 O HETATM 2960 O HOH 48 61.808 10.504 102.464 1.00 34.35 O HETATM 2961 O HOH 49 54.966 20.218 77.262 1.00 15.79 O HETATM 2962 O HOH 50 58.109 28.709 88.417 1.00 40.21 O HETATM 2963 O HOH 51 52.153 25.583 90.954 1.00 26.87 O HETATM 2964 O HOH 52 41.514 18.740 80.124 1.00 15.64 O HETATM 2965 O HOH 53 63.718 3.664 78.582 1.00 33.11 O HETATM 2966 O HOH 54 61.805 7.613 94.573 1.00 31.33 O HETATM 2967 O HOH 55 47.971 7.105 73.850 1.00 29.27 O HETATM 2968 O HOH 56 67.050 5.131 78.800 1.00 42.51 O HETATM 2969 O HOH 57 68.480 12.729 58.857 1.00 34.52 O HETATM 2970 O HOH 58 53.500 1.438 96.409 1.00 46.67 O HETATM 2971 O HOH 59 69.107 8.403 80.929 1.00 44.20 O HETATM 2972 O HOH 60 48.727 27.037 73.060 1.00 37.87 O HETATM 2973 O HOH 61 39.133 7.726 77.817 1.00 39.90 O HETATM 2974 O HOH 62 69.872 14.496 71.568 1.00 24.55 O HETATM 2975 O HOH 63 54.779 -0.057 79.302 1.00 23.40 O HETATM 2976 O HOH 64 45.979 10.737 75.502 1.00 15.94 O HETATM 2977 O HOH 65 52.381 18.841 70.745 1.00 19.65 O HETATM 2978 O HOH 66 50.810 20.406 98.173 1.00 32.95 O HETATM 2979 O HOH 67 55.485 25.431 93.047 1.00 34.59 O HETATM 2980 O HOH 68 51.415 1.875 70.644 1.00 43.99 O HETATM 2981 O HOH 69 52.439 0.855 88.896 1.00 30.40 O HETATM 2982 O HOH 70 43.494 31.371 90.290 1.00 51.44 O HETATM 2983 O HOH 71 66.670 19.268 71.284 1.00 25.76 O HETATM 2984 O HOH 72 58.695 2.234 86.813 1.00 19.93 O HETATM 2985 O HOH 73 47.745 19.624 79.579 1.00 14.84 O HETATM 2986 O HOH 74 72.491 20.424 75.266 1.00 33.55 O HETATM 2987 O HOH 75 68.244 14.072 65.653 1.00 21.45 O HETATM 2988 O HOH 76 67.031 6.675 76.768 1.00 49.76 O HETATM 2989 O HOH 77 58.497 15.303 66.942 1.00 19.79 O HETATM 2990 O HOH 78 50.004 5.077 69.764 1.00 31.21 O HETATM 2991 O HOH 79 42.137 25.074 94.753 1.00 33.75 O HETATM 2992 O HOH 80 51.284 23.772 73.642 1.00 29.69 O HETATM 2993 O HOH 81 39.506 10.836 75.086 1.00 27.99 O HETATM 2994 O HOH 82 36.863 11.676 79.071 1.00 30.92 O HETATM 2995 O HOH 83 42.910 8.467 75.689 1.00 23.17 O HETATM 2996 O HOH 84 62.908 18.562 96.194 1.00 39.21 O HETATM 2997 O HOH 85 42.506 20.791 78.708 1.00 18.56 O HETATM 2998 O HOH 86 66.650 24.408 79.098 1.00 23.35 O HETATM 2999 O HOH 87 36.421 22.181 88.632 1.00 20.53 O HETATM 3000 O HOH 88 69.474 24.850 78.497 1.00 27.07 O HETATM 3001 O HOH 89 58.062 25.810 90.455 1.00 45.75 O HETATM 3002 O HOH 90 63.580 23.005 73.451 1.00 31.56 O HETATM 3003 O HOH 91 64.438 3.183 71.568 1.00 35.20 O HETATM 3004 O HOH 92 54.949 -0.838 76.691 1.00 34.91 O HETATM 3005 O HOH 93 70.203 17.675 64.307 1.00 32.56 O HETATM 3006 O HOH 94 57.818 14.747 101.724 1.00 40.56 O HETATM 3007 O HOH 95 69.218 19.706 71.908 1.00 33.36 O HETATM 3008 O HOH 96 71.832 21.630 83.075 1.00 22.12 O HETATM 3009 O HOH 97 60.318 3.465 69.342 1.00 42.31 O HETATM 3010 O HOH 98 66.163 16.750 93.524 1.00 33.84 O HETATM 3011 O HOH 99 61.382 30.657 88.530 1.00 41.77 O HETATM 3012 O HOH 100 45.355 6.514 74.171 1.00 35.88 O HETATM 3013 O HOH 101 41.072 32.634 86.401 1.00 47.43 O HETATM 3014 O HOH 102 56.171 2.771 94.788 1.00 37.31 O HETATM 3015 O HOH 103 49.656 30.024 79.834 1.00 26.24 O HETATM 3016 O HOH 104 60.657 -2.899 79.645 1.00 19.44 O HETATM 3017 O HOH 105 62.015 9.083 86.880 1.00 20.72 O HETATM 3018 O HOH 106 67.856 18.158 56.026 1.00 34.08 O HETATM 3019 O HOH 107 59.740 20.484 68.440 1.00 23.96 O HETATM 3020 O HOH 108 65.887 29.838 89.129 1.00 29.40 O HETATM 3021 O HOH 109 39.347 11.760 77.851 1.00 19.79 O HETATM 3022 O HOH 110 54.879 8.886 78.429 1.00 16.75 O HETATM 3023 O HOH 111 48.052 34.816 88.408 1.00 45.73 O HETATM 3024 O HOH 112 44.527 20.106 98.180 1.00 39.26 O HETATM 3025 O HOH 113 49.499 1.732 90.814 1.00 43.99 O HETATM 3026 O HOH 114 59.161 27.065 93.068 1.00 59.72 O HETATM 3027 O HOH 115 69.576 11.300 70.805 1.00 50.18 O HETATM 3028 O HOH 116 61.147 14.122 96.925 1.00 35.16 O HETATM 3029 O HOH 117 73.530 18.430 86.166 1.00 29.05 O HETATM 3030 O HOH 118 68.015 1.720 69.098 1.00 75.01 O HETATM 3031 O HOH 119 74.330 19.195 76.827 1.00 33.58 O HETATM 3032 O HOH 120 40.878 26.244 88.206 1.00 32.26 O HETATM 3033 O HOH 121 59.331 4.334 99.416 1.00 53.12 O HETATM 3034 O HOH 122 57.339 8.612 79.297 1.00 16.79 O HETATM 3035 O HOH 123 73.478 19.579 83.624 1.00 23.03 O HETATM 3036 O HOH 124 54.081 4.368 71.002 1.00 44.84 O HETATM 3037 O HOH 125 64.632 7.269 83.991 1.00 22.61 O HETATM 3038 O HOH 126 63.928 3.555 86.714 1.00 30.76 O HETATM 3039 O HOH 127 49.841 15.733 104.129 1.00 50.62 O HETATM 3040 O HOH 128 50.947 -1.756 74.357 1.00 50.07 O HETATM 3041 O HOH 129 68.696 9.053 78.135 1.00 28.86 O HETATM 3042 O HOH 130 60.478 1.639 95.338 1.00 70.09 O HETATM 3043 O HOH 131 41.505 4.335 88.224 1.00 29.05 O HETATM 3044 O HOH 132 41.003 13.910 93.575 1.00 24.68 O HETATM 3045 O HOH 133 72.499 15.955 78.617 1.00 25.13 O HETATM 3046 O HOH 134 50.653 23.404 98.014 1.00 53.32 O HETATM 3047 O HOH 135 68.168 13.909 85.068 1.00 22.59 O HETATM 3048 O HOH 136 59.461 21.907 65.942 1.00 38.76 O HETATM 3049 O HOH 137 50.076 20.948 72.154 1.00 29.40 O HETATM 3050 O HOH 138 65.241 10.728 86.186 1.00 18.69 O HETATM 3051 O HOH 139 66.007 2.446 66.624 1.00 45.80 O HETATM 3052 O HOH 140 61.748 12.193 95.817 1.00 36.01 O HETATM 3053 O HOH 141 44.557 21.955 69.307 1.00 33.55 O HETATM 3054 O HOH 142 57.063 5.369 69.681 1.00 22.93 O HETATM 3055 O HOH 143 73.047 14.303 76.430 1.00 31.90 O HETATM 3056 O HOH 144 55.559 21.210 67.387 1.00 38.23 O HETATM 3057 O HOH 145 42.099 26.256 90.528 1.00 32.45 O HETATM 3058 O HOH 146 39.371 25.948 74.406 1.00 34.89 O HETATM 3059 O HOH 147 38.210 28.157 80.832 1.00 37.39 O HETATM 3060 O HOH 148 42.732 10.655 96.402 1.00 55.65 O HETATM 3061 O HOH 149 57.613 23.732 92.273 1.00 22.77 O HETATM 3062 O HOH 150 45.512 30.009 81.253 1.00 33.59 O HETATM 3063 O HOH 151 59.706 2.985 104.395 1.00 55.58 O HETATM 3064 O HOH 152 63.500 24.805 75.546 1.00 31.57 O HETATM 3065 O HOH 153 66.667 20.329 68.663 1.00 28.35 O HETATM 3066 O HOH 154 57.634 2.186 101.486 1.00 54.52 O HETATM 3067 O HOH 155 55.636 8.747 70.493 1.00 18.94 O HETATM 3068 O HOH 156 54.075 24.602 70.020 1.00 37.59 O HETATM 3069 O HOH 157 44.168 1.525 72.229 1.00 48.56 O HETATM 3070 O HOH 158 66.785 9.866 53.325 1.00 63.87 O HETATM 3071 O HOH 159 70.464 13.265 76.969 1.00 24.41 O HETATM 3072 O HOH 160 59.671 6.026 66.156 1.00 24.52 O HETATM 3073 O HOH 161 70.273 12.672 66.767 1.00 32.38 O HETATM 3074 O HOH 162 44.325 16.638 74.053 1.00 20.95 O HETATM 3075 O HOH 163 46.173 3.844 99.708 1.00 82.53 O HETATM 3076 O HOH 164 34.859 24.973 80.153 1.00 48.73 O HETATM 3077 O HOH 165 50.457 -5.807 88.242 1.00 40.52 O HETATM 3078 O HOH 166 32.914 23.971 78.014 1.00 45.47 O HETATM 3079 O HOH 167 66.829 9.472 84.634 1.00 37.85 O HETATM 3080 O HOH 168 37.574 19.282 97.030 1.00 42.51 O HETATM 3081 O HOH 169 75.254 15.423 78.327 1.00 41.54 O HETATM 3082 O HOH 170 48.959 -5.567 83.718 1.00 49.63 O HETATM 3083 O HOH 171 70.870 22.714 85.260 1.00 30.48 O HETATM 3084 O HOH 172 69.627 20.436 67.278 1.00 46.88 O HETATM 3085 O HOH 173 59.193 23.735 94.563 1.00 35.45 O HETATM 3086 O HOH 174 71.740 12.218 64.576 1.00 35.65 O HETATM 3087 O HOH 175 55.466 32.421 84.775 1.00 39.18 O HETATM 3088 O HOH 176 66.433 1.016 83.871 1.00 35.83 O HETATM 3089 O HOH 177 69.978 12.699 73.995 1.00 31.11 O HETATM 3090 O HOH 178 68.351 27.926 81.665 1.00 28.94 O HETATM 3091 O HOH 179 68.124 29.544 85.899 1.00 37.62 O HETATM 3092 O HOH 180 65.232 5.944 86.289 1.00 25.54 O HETATM 3093 O HOH 181 31.627 21.835 76.520 1.00 40.30 O HETATM 3094 O HOH 182 36.891 26.262 84.322 1.00 43.61 O HETATM 3095 O HOH 183 65.474 22.560 68.437 1.00 46.64 O HETATM 3096 O HOH 184 51.296 26.252 72.791 1.00 50.71 O HETATM 3097 O HOH 185 73.016 23.360 81.268 1.00 27.91 O HETATM 3098 O HOH 186 66.030 26.968 80.443 1.00 34.96 O HETATM 3099 O HOH 187 71.440 11.453 83.568 1.00 46.26 O HETATM 3100 O HOH 188 54.261 21.673 69.443 1.00 52.99 O HETATM 3101 O HOH 189 72.487 19.700 88.063 1.00 60.99 O HETATM 3102 O HOH 190 70.483 11.389 60.327 1.00 35.06 O HETATM 3103 O HOH 191 75.911 20.681 83.244 1.00 32.66 O HETATM 3104 O HOH 192 58.246 19.648 64.502 1.00 33.86 O HETATM 3105 O HOH 193 44.379 5.141 78.014 1.00 45.63 O HETATM 3106 O HOH 194 51.917 -0.205 72.177 1.00 49.32 O HETATM 3107 O HOH 195 64.370 8.572 88.015 1.00 25.31 O HETATM 3108 O HOH 196 40.230 8.128 75.384 1.00 25.67 O HETATM 3109 O HOH 197 71.083 26.028 84.772 1.00 31.38 O HETATM 3110 O HOH 198 43.769 6.059 75.740 1.00 38.77 O HETATM 3111 O HOH 199 40.698 26.895 92.683 1.00 31.94 O HETATM 3112 O HOH 200 39.858 11.328 69.169 1.00 39.87 O HETATM 3113 O HOH 201 68.311 16.091 54.283 1.00 43.71 O HETATM 3114 O HOH 202 65.903 24.902 76.586 1.00 30.09 O HETATM 3115 O HOH 203 71.376 21.561 87.521 1.00 59.57 O HETATM 3116 O HOH 204 65.788 20.896 73.392 1.00 29.29 O HETATM 3117 O HOH 205 41.554 4.709 74.465 1.00 92.77 O HETATM 3118 O HOH 206 54.271 -0.186 73.809 1.00 43.32 O HETATM 3119 O HOH 207 70.554 26.641 80.220 1.00 62.47 O HETATM 3120 O HOH 208 68.254 30.538 81.028 1.00 48.76 O HETATM 3121 O HOH 209 72.454 25.964 82.210 1.00 28.65 O HETATM 3122 O HOH 210 39.211 6.083 74.018 1.00 63.40 O HETATM 3123 O HOH 211 60.105 11.281 43.053 1.00 45.32 O HETATM 3124 O HOH 212 45.029 31.911 50.474 1.00 40.74 O HETATM 3125 O HOH 213 42.651 32.185 47.642 1.00110.36 O HETATM 3126 O HOH 214 58.910 7.371 48.776 1.00 31.32 O HETATM 3127 O HOH 215 46.583 -1.947 52.885 1.00 47.49 O HETATM 3128 O HOH 216 50.055 -4.265 53.378 1.00 63.61 O HETATM 3129 O HOH 217 58.263 25.737 52.672 1.00 36.86 O HETATM 3130 O HOH 218 43.300 26.420 48.796 1.00 36.73 O HETATM 3131 O HOH 219 49.332 27.451 53.236 1.00 31.67 O HETATM 3132 O HOH 220 41.844 6.558 47.051 1.00 23.95 O HETATM 3133 O HOH 221 53.559 0.704 59.233 1.00 38.08 O HETATM 3134 O HOH 222 45.605 18.522 39.674 1.00 25.80 O HETATM 3135 O HOH 223 61.630 27.674 53.979 1.00 50.74 O HETATM 3136 O HOH 224 52.906 20.744 38.509 1.00 40.10 O HETATM 3137 O HOH 225 53.043 29.250 52.472 1.00 45.69 O HETATM 3138 O HOH 226 48.189 25.046 53.790 1.00 28.14 O HETATM 3139 O HOH 227 40.665 13.257 44.830 1.00 18.00 O HETATM 3140 O HOH 228 38.683 2.165 51.379 1.00 58.81 O HETATM 3141 O HOH 229 69.327 21.347 52.763 1.00 44.17 O HETATM 3142 O HOH 230 66.280 12.838 48.072 1.00 49.96 O HETATM 3143 O HOH 231 41.236 27.675 42.975 1.00 33.24 O HETATM 3144 O HOH 232 38.859 15.062 40.892 1.00 25.71 O HETATM 3145 O HOH 233 50.549 14.694 67.630 1.00 21.76 O HETATM 3146 O HOH 234 38.084 5.733 42.984 1.00 41.19 O HETATM 3147 O HOH 235 40.272 2.582 53.994 1.00 53.74 O HETATM 3148 O HOH 236 51.948 14.653 39.807 1.00 30.13 O HETATM 3149 O HOH 237 39.532 9.082 53.308 1.00 24.78 O HETATM 3150 O HOH 238 53.864 9.242 57.093 1.00 22.63 O HETATM 3151 O HOH 239 49.995 7.584 59.883 1.00 32.94 O HETATM 3152 O HOH 240 56.614 24.931 57.538 1.00 31.02 O HETATM 3153 O HOH 241 45.977 15.321 39.277 1.00 34.95 O HETATM 3154 O HOH 242 51.189 6.269 48.452 1.00 42.75 O HETATM 3155 O HOH 243 52.842 17.053 62.271 1.00 25.49 O HETATM 3156 O HOH 244 71.265 25.117 48.163 1.00 49.06 O HETATM 3157 O HOH 245 47.756 22.263 70.342 1.00 33.25 O HETATM 3158 O HOH 246 45.967 7.470 49.019 1.00 33.26 O HETATM 3159 O HOH 247 46.168 1.486 57.705 1.00 33.57 O HETATM 3160 O HOH 248 56.317 10.820 55.115 1.00 23.34 O HETATM 3161 O HOH 249 60.384 30.394 40.958 1.00 47.98 O HETATM 3162 O HOH 250 62.411 7.687 51.403 1.00 40.48 O HETATM 3163 O HOH 251 49.532 21.795 58.432 1.00 48.32 O HETATM 3164 O HOH 252 59.107 7.081 42.352 1.00 47.26 O HETATM 3165 O HOH 253 42.412 10.861 63.520 1.00 34.92 O HETATM 3166 O HOH 254 53.332 19.503 63.865 1.00 57.56 O HETATM 3167 O HOH 255 41.420 29.381 49.385 1.00 44.88 O HETATM 3168 O HOH 256 51.396 28.863 43.211 1.00 71.75 O HETATM 3169 O HOH 257 41.521 25.640 47.347 1.00 31.20 O HETATM 3170 O HOH 258 62.902 21.713 57.827 1.00 35.63 O HETATM 3171 O HOH 259 57.258 4.633 62.502 1.00 34.33 O HETATM 3172 O HOH 260 51.456 15.771 64.291 1.00 26.83 O HETATM 3173 O HOH 261 49.325 16.423 63.648 1.00 35.32 O HETATM 3174 O HOH 262 48.104 5.918 44.870 1.00 36.69 O HETATM 3175 O HOH 263 47.656 22.929 41.208 1.00 29.96 O HETATM 3176 O HOH 264 39.301 21.329 44.708 1.00 23.68 O HETATM 3177 O HOH 265 64.868 21.778 37.883 1.00 44.80 O HETATM 3178 O HOH 266 43.104 4.074 56.220 1.00 48.46 O HETATM 3179 O HOH 267 42.524 15.676 67.451 1.00 57.20 O HETATM 3180 O HOH 268 44.451 20.569 67.084 1.00 35.62 O HETATM 3181 O HOH 269 36.713 3.910 52.238 1.00 39.35 O HETATM 3182 O HOH 270 39.679 11.385 61.163 1.00 26.20 O HETATM 3183 O HOH 271 57.302 1.851 59.310 1.00 46.96 O HETATM 3184 O HOH 272 50.971 10.464 60.011 1.00 27.75 O HETATM 3185 O HOH 273 55.684 20.670 63.861 1.00 41.24 O HETATM 3186 O HOH 274 51.280 -0.827 52.471 1.00 37.49 O HETATM 3187 O HOH 275 55.005 28.472 48.763 1.00 50.08 O HETATM 3188 O HOH 276 41.614 7.261 42.353 1.00 38.62 O HETATM 3189 O HOH 277 55.545 0.604 57.737 1.00 38.15 O HETATM 3190 O HOH 278 48.176 21.506 38.595 1.00 51.63 O HETATM 3191 O HOH 279 64.449 11.435 51.985 1.00 46.65 O HETATM 3192 O HOH 280 38.780 16.217 38.457 1.00 29.20 O HETATM 3193 O HOH 281 36.502 3.565 49.652 1.00 43.50 O HETATM 3194 O HOH 282 42.692 9.686 42.782 1.00 31.11 O HETATM 3195 O HOH 283 41.652 6.988 54.174 1.00 39.57 O HETATM 3196 O HOH 284 44.575 -0.035 59.709 1.00 46.06 O HETATM 3197 O HOH 285 48.389 24.395 56.595 1.00 28.76 O HETATM 3198 O HOH 286 43.485 7.530 58.570 1.00 32.20 O HETATM 3199 O HOH 287 65.061 10.901 48.118 1.00 40.74 O HETATM 3200 O HOH 288 47.475 -4.399 54.309 1.00 35.74 O HETATM 3201 O HOH 289 48.316 28.812 51.077 1.00 30.65 O HETATM 3202 O HOH 290 56.405 25.913 54.994 1.00 37.31 O HETATM 3203 O HOH 291 59.929 5.060 58.166 1.00 50.22 O HETATM 3204 O HOH 292 42.443 21.320 41.570 1.00 28.59 O HETATM 3205 O HOH 293 66.184 14.470 53.069 1.00 34.21 O HETATM 3206 O HOH 294 47.204 2.356 51.245 1.00 37.08 O HETATM 3207 O HOH 295 43.285 -5.274 56.668 1.00 45.24 O HETATM 3208 O HOH 296 51.486 7.595 57.295 1.00 26.61 O HETATM 3209 O HOH 297 57.502 17.589 66.207 1.00 19.32 O HETATM 3210 O HOH 298 51.973 -2.547 59.762 1.00 48.10 O HETATM 3211 O HOH 299 45.529 27.519 51.408 1.00 31.24 O HETATM 3212 O HOH 300 59.240 4.751 60.265 1.00 48.14 O HETATM 3213 O HOH 301 45.988 10.818 39.418 1.00 38.86 O HETATM 3214 O HOH 302 44.643 12.710 39.050 1.00 39.80 O HETATM 3215 O HOH 303 51.227 12.765 64.792 1.00 16.83 O HETATM 3216 O HOH 304 63.822 23.392 55.767 1.00108.97 O HETATM 3217 O HOH 305 42.070 23.103 43.744 1.00 24.74 O HETATM 3218 O HOH 306 42.830 20.858 63.329 1.00 44.38 O HETATM 3219 O HOH 307 59.103 1.645 55.172 1.00 72.63 O HETATM 3220 O HOH 308 50.072 26.377 58.136 1.00 44.01 O HETATM 3221 O HOH 309 52.952 -2.009 50.572 1.00 49.72 O HETATM 3222 O HOH 310 58.181 7.406 67.944 1.00 24.41 O HETATM 3223 O HOH 311 36.626 6.409 55.156 1.00 46.73 O HETATM 3224 O HOH 312 62.563 32.421 44.678 1.00 45.43 O HETATM 3225 O HOH 313 42.166 5.734 44.408 1.00 36.30 O HETATM 3226 O HOH 314 53.128 21.259 66.853 1.00 44.92 O HETATM 3227 O HOH 315 46.945 21.393 58.390 1.00 31.24 O HETATM 3228 O HOH 316 40.096 8.915 57.393 1.00 40.38 O HETATM 3229 O HOH 317 49.118 31.007 50.758 1.00 49.13 O HETATM 3230 O HOH 318 53.075 2.308 61.472 1.00 49.37 O HETATM 3231 O HOH 319 42.097 7.154 60.754 1.00 48.49 O HETATM 3232 O HOH 320 43.890 -3.822 52.413 1.00 39.29 O HETATM 3233 O HOH 321 60.920 22.729 62.478 1.00 47.90 O HETATM 3234 O HOH 322 56.487 -1.971 57.776 1.00 50.43 O HETATM 3235 O HOH 323 46.286 19.941 37.787 1.00 48.18 O HETATM 3236 O HOH 324 58.411 3.833 65.239 1.00 38.57 O HETATM 3237 O HOH 325 53.756 -5.754 56.365 1.00 46.82 O HETATM 3238 O HOH 326 70.977 32.913 49.563 1.00 49.03 O HETATM 3239 O HOH 327 42.100 25.190 42.206 1.00 38.01 O HETATM 3240 O HOH 328 50.855 -3.576 50.821 1.00 54.82 O HETATM 3241 O HOH 329 44.184 9.842 40.554 1.00 46.31 O HETATM 3242 O HOH 330 61.291 32.412 42.532 1.00 52.90 O HETATM 3243 O HOH 331 52.170 15.584 37.222 1.00 38.95 O HETATM 3244 O HOH 332 40.164 4.031 43.937 1.00 49.68 O HETATM 3245 O HOH 333 45.699 25.417 52.627 1.00 31.62 O HETATM 3246 O HOH 334 36.449 4.795 44.703 1.00 44.15 O HETATM 3247 O HOH 335 36.116 17.248 38.605 1.00 32.94 O HETATM 3248 O HOH 336 44.835 22.899 40.485 1.00 79.12 O HETATM 3249 O HOH 337 73.801 32.919 48.852 1.00 40.35 O HETATM 3250 O HOH 338 37.887 18.734 34.511 1.00 55.88 O HETATM 3251 PG GTP A 339 46.857 14.480 74.945 1.00 0.19 P HETATM 3252 O1G GTP A 339 45.861 13.696 75.760 1.00 -0.61 O HETATM 3253 O2G GTP A 339 47.266 15.806 75.639 1.00 -0.61 O HETATM 3254 O3G GTP A 339 46.391 14.768 73.282 1.00 -0.61 O HETATM 3255 O3B GTP A 339 48.214 13.521 74.632 1.00 -0.15 O HETATM 3256 PB GTP A 339 49.086 12.765 75.835 1.00 0.36 P HETATM 3257 O1B GTP A 339 50.115 13.741 76.377 1.00 -0.57 O HETATM 3258 O2B GTP A 339 48.180 12.099 76.843 1.00 -0.57 O HETATM 3259 O3A GTP A 339 49.834 11.712 74.930 1.00 -0.12 O HETATM 3260 PA GTP A 339 49.701 10.090 75.076 1.00 0.33 P HETATM 3261 O1A GTP A 339 50.097 9.618 76.442 1.00 -0.57 O HETATM 3262 O2A GTP A 339 48.306 9.688 74.573 1.00 -0.57 O HETATM 3263 O5' GTP A 339 50.785 9.635 74.017 1.00 -0.24 O HETATM 3264 C5' GTP A 339 50.918 10.210 72.744 1.00 0.11 C HETATM 3265 C4' GTP A 339 51.641 9.316 71.797 1.00 0.12 C HETATM 3266 O4' GTP A 339 52.998 9.178 72.283 1.00 -0.33 O HETATM 3267 C1' GTP A 339 53.378 7.753 72.578 1.00 0.22 C HETATM 3268 C2' GTP A 339 51.917 7.167 72.615 1.00 0.14 C HETATM 3269 C3' GTP A 339 51.138 7.780 71.744 1.00 0.12 C HETATM 3270 O3' GTP A 339 51.236 7.465 70.323 1.00 -0.39 O HETATM 3271 H5 GTP A 339 50.958 6.568 70.179 1.00 0.21 H HETATM 3272 H4 GTP A 339 50.092 7.668 72.064 1.00 0.06 H HETATM 3273 O2' GTP A 339 51.966 5.713 72.329 1.00 -0.38 O HETATM 3274 H7 GTP A 339 51.090 5.350 72.387 1.00 0.21 H HETATM 3275 H6 GTP A 339 51.501 7.318 73.622 1.00 0.07 H HETATM 3276 N9 GTP A 339 53.989 7.630 73.802 1.00 -0.10 N HETATM 3277 C8 GTP A 339 53.562 7.892 75.004 1.00 0.19 C HETATM 3278 N7 GTP A 339 54.486 7.615 75.937 1.00 -0.19 N HETATM 3279 C5 GTP A 339 55.507 7.130 75.242 1.00 0.26 C HETATM 3280 C6 GTP A 339 56.832 6.610 75.696 1.00 0.26 C HETATM 3281 O6 GTP A 339 57.211 6.545 76.811 1.00 -0.36 O HETATM 3282 N1 GTP A 339 57.635 6.211 74.674 1.00 -0.25 N HETATM 3283 C2 GTP A 339 57.323 6.206 73.300 1.00 0.20 C HETATM 3284 N2 GTP A 339 58.217 5.750 72.376 1.00 -0.33 N HETATM 3285 H11 GTP A 339 57.971 5.754 71.376 1.00 0.18 H HETATM 3286 H12 GTP A 339 59.138 5.402 72.679 1.00 0.18 H HETATM 3287 N3 GTP A 339 56.079 6.673 72.826 1.00 -0.19 N HETATM 3288 C4 GTP A 339 55.244 7.105 73.898 1.00 0.33 C HETATM 3289 H13 GTP A 339 55.809 6.699 71.832 1.00 0.25 H HETATM 3290 H10 GTP A 339 58.547 5.886 74.925 1.00 0.18 H HETATM 3291 H9 GTP A 339 52.572 8.289 75.226 1.00 0.18 H HETATM 3292 H8 GTP A 339 54.005 7.304 71.793 1.00 0.10 H HETATM 3293 H3 GTP A 339 51.609 9.758 70.790 1.00 0.07 H HETATM 3294 H1 GTP A 339 51.476 11.153 72.838 1.00 0.06 H HETATM 3295 H2 GTP A 339 49.915 10.416 72.341 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 149 148 151 2913 CONECT 318 317 320 2913 CONECT 527 526 2914 CONECT 668 667 669 2914 CONECT 1710 1711 1715 1716 1717 CONECT 1715 1710 CONECT 1716 1710 CONECT 1717 1710 CONECT 1893 1892 2625 CONECT 2625 1893 2624 CONECT 2913 149 318 CONECT 2914 527 668 CONECT 3251 3252 3253 3254 3255 CONECT 3252 3251 CONECT 3253 3251 CONECT 3254 3251 CONECT 3255 3251 3256 CONECT 3256 3255 3257 3258 3259 CONECT 3257 3256 CONECT 3258 3256 CONECT 3259 3256 3260 CONECT 3260 3259 3261 3262 3263 CONECT 3261 3260 CONECT 3262 3260 CONECT 3263 3260 3264 CONECT 3264 3263 3265 3294 3295 CONECT 3265 3264 3266 3269 3293 CONECT 3266 3265 3267 CONECT 3267 3266 3268 3276 3292 CONECT 3268 3267 3269 3273 3275 CONECT 3269 3265 3268 3270 3272 CONECT 3270 3269 3271 CONECT 3271 3270 CONECT 3272 3269 CONECT 3273 3268 3274 CONECT 3274 3273 CONECT 3275 3268 CONECT 3276 3267 3277 3288 CONECT 3277 3276 3278 3291 CONECT 3278 3277 3279 CONECT 3279 3278 3280 3288 CONECT 3280 3279 3281 3282 CONECT 3281 3280 CONECT 3282 3280 3283 3290 CONECT 3283 3282 3284 3287 CONECT 3284 3283 3285 3286 CONECT 3285 3284 CONECT 3286 3284 CONECT 3287 3283 3288 3289 CONECT 3288 3276 3279 3287 CONECT 3289 3287 CONECT 3290 3282 CONECT 3291 3277 CONECT 3292 3267 CONECT 3293 3265 CONECT 3294 3264 CONECT 3295 3264 MASTER 0 0 0 0 0 0 0 0 3293 2 61 24 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6sge
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
PDB Code
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RCSB PDB
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GTP
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2xtn
RCSB PDB
PDBbind
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RCSB PDB
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PDBbind
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3ffu
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RCSB PDB
PDBbind
GTP
4kax
RCSB PDB
PDBbind
GTP
4kva
RCSB PDB
PDBbind
GTP
4ncn
RCSB PDB
PDBbind
GTP
5efc
RCSB PDB
PDBbind
GTP
5ey0
RCSB PDB
PDBbind
GTP
5gof
RCSB PDB
PDBbind
GTP
6j72
RCSB PDB
PDBbind
GTP
6iae
RCSB PDB
PDBbind
GTP
6ia7
RCSB PDB
PDBbind
GTP
6ak5
RCSB PDB
PDBbind
GTP
Entry Information
PDB ID
6sge
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
RHOB
Ligand Name
GTP
EC.Number
E.C.-.-.-.-
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=30.8nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Cell Chem Biol Vol. 26: pp. 1544-
Ligand Properties
Formula
C
1
0
H
2
0
N
5
O
1
4
P
3
Molecular Weight
527.212
Exact Mass
527.022
No. of atoms
52
No. of bonds
54
Polar Surface Area
350.6
LOGP Value
-5.61 (
Computed with XLOGP3
)
-3.65 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 11
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 19
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(OP(O)(O)O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1[nH]c(N)[nH+]c2=O
InChI String
InChI=1S/C10H22N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17,19-25,30-32H,1H2,(H3,11,13,14,18)/p+1/t3-,5-,6-,9-/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):
P62745
Entrez Gene ID
NCBI Entrez Gene ID:
388
ASD
Information of known allosteric effects of PDB entries
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